A0A087XV59_POEFO Loading...

Myotubularin related protein 6

AlphaFold DB , UniProt , Accession A0A087XV59, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 658 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	51.8	Low	77.7	Confident	193 Å²	193	96.3 Å²	96.3	95%	0.951	46%	0.457	S	S	*	.				0	-20.3	0	-80.1	-153.9	-77.2	0	0	113.8	H3 I4	M1-H3 PolarHBondContact O-N 3.5Å; M1-I4 PolarHBondContact O-N 3.16Å; M1-I4 VanDerWaalsContact O-N 3.11Å
2	E	55.5	Low	78.8	Confident	185 Å²	185	88.3 Å²	88.3	86%	0.864	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-2.4	-176.3	-56.6	-176	151.8	0	0	117.2
3	H	67.8	Low	79.9	Confident	71 Å²	71	86.5 Å²	86.5	33%	0.329	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-1.9	-176.4	-58.9	-11.7	0	0	0	113	M1 S99 R102	M1-H3 PolarHBondContact O-N 3.5Å; H3-S99 WeakPolarHBondContact O-CB 3.37Å; H3-S99 PolarHBondContact O-OG 3.24Å; H3-R102 HydrophobicContact CB-CG 4.32Å; H3-R102 PolarHBondContact CD2-NE 3.46Å; H3-R102 VanDerWaalsContact CE1-CZ 3.49Å; H3-R102 PolarHBondContact CE1-NE 3.02Å; H3-R102 VanDerWaalsContact CE1-NE 3.29Å; H3-R102 PolarHBondContact CE1-NH2 3.48Å; H3-R102 VanDerWaalsContact CG-NE 3.26Å; H3-R102 PolarHBondContact ND1-NE 3.34Å; H3-R102 PolarHBondContact NE2-NE 3.04Å; H3-R102 PolarHBondContact NE2-NH2 2.95Å; H3-R102 VanDerWaalsContact NE2-NH2 3.15Å
4	I	76.4	Confident	80.6	Confident	28 Å²	28	82 Å²	82	14%	0.144	39%	0.386	C	S	.	.			trans	-99.1	108.7	179.6	-62.7	166.8	0	0	0	107.6	M1 P7 L29 T30 L103	M1-I4 PolarHBondContact O-N 3.16Å; M1-I4 VanDerWaalsContact O-N 3.11Å; I4-P7 HydrophobicContact CG2-CB 3.84Å; I4-L29 HydrophobicContact CG1-CD2 4.37Å; I4-L29 HydrophobicContact CG1-CG 4.24Å; I4-L29 HydrophobicContact CG2-CB 4.31Å; I4-L29 HydrophobicContact CG2-CD2 4.13Å; I4-L29 HydrophobicContact CG2-CG 4.16Å; I4-T30 VanDerWaalsContact CD1-C 3.46Å; I4-L103 HydrophobicContact CG1-CD1 4.18Å
5	R	76.4	Confident	81.1	Confident	155 Å²	155	79.3 Å²	79.3	59%	0.585	38%	0.377	S	S	*	.	S	Bend	trans	-78.6	-39.9	179.1	-67.7	-175.1	-179.9	178.5	1.5	112.8	D95 S99	R5-D95 HydrophobicContact CB-CB 3.89Å; R5-D95 WeakPolarHBondContact CD-OD1 3.32Å; R5-D95 IonicContact CZ-OD1 3.79Å; R5-D95 IonicContact NE-OD1 2.98Å; R5-D95 IonicContact NH1-OD1 3.36Å; R5-D95 PolarHBondContact NH1-OD1 3.35Å; R5-S99 PolarHBondContact N-OG 3.43Å; R5-S99 VanDerWaalsContact N-OG 3.1Å
6	T	80.4	Confident	81.1	Confident	26 Å²	26	77.6 Å²	77.6	16%	0.16	37%	0.371	C	S	.	.			trans	-132.1	96.5	-177.3	-51.4	0	0	0	0	108.8	K8 V9 D95	T6-K8 VanDerWaalsContact C-N 3.32Å; T6-K8 WeakPolarHBondContact CG2-O 3.38Å; T6-K8 PolarHBondContact O-N 3.23Å; T6-V9 HydrophobicContact CG2-CG2 3.48Å; T6-V9 VanDerWaalsContact CG2-CG2 3.48Å; T6-D95 WeakPolarHBondContact OG1-CB 3.35Å
7	P	85.1	Confident	80.7	Confident	79 Å²	79	74.1 Å²	74.1	51%	0.513	35%	0.353	S	S	.	.	S	Bend	trans	-77.1	-16	-172.8	30.1	-35.7	0	0	0	113.9	I4 Y28 L29	I4-P7 HydrophobicContact CG2-CB 3.84Å; P7-Y28 WeakPolarHBondContact O-CA 3.49Å; P7-L29 PolarHBondContact O-N 2.94Å
8	K	92.2	Very high	80.3	Confident	92 Å²	92	73.4 Å²	73.4	40%	0.4	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	128.5	179	-174.9	-170.4	-170.7	-163.8	0	109.3	T6 E10 T26 L27 Y28	T6-K8 VanDerWaalsContact C-N 3.32Å; T6-K8 WeakPolarHBondContact CG2-O 3.38Å; T6-K8 PolarHBondContact O-N 3.23Å; K8-E10 HydrophobicContact CD-CG 4.41Å; K8-E10 VanDerWaalsContact CE-OE1 3.25Å; K8-E10 WeakPolarHBondContact CE-OE1 3.31Å; K8-E10 IonicContact NZ-OE1 2.63Å; K8-E10 PolarHBondContact NZ-OE1 3.15Å; K8-T26 HydrophobicContact CD-CG2 4.21Å; K8-T26 HydrophobicContact CG-CG2 3.59Å; K8-L27 CarbonylContact C-O 3.49Å; K8-L27 WeakPolarHBondContact CA-O 3.5Å; K8-Y28 HydrophobicContact CB-CD1 4.17Å; K8-Y28 HydrophobicContact CB-CE1 4.32Å; K8-Y28 HydrophobicContact CD-CE1 3.84Å; K8-Y28 HydrophobicContact CG-CD1 3.92Å; K8-Y28 HydrophobicContact CG-CE1 3.65Å
9	V	90.2	Very high	79.8	Confident	8 Å²	8	71.4 Å²	71.4	5%	0.048	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	118.9	170.7	-176.5	0	0	0	0	108.7	T6 V12 T26 L27 V87 D92 I96	T6-V9 HydrophobicContact CG2-CG2 3.48Å; T6-V9 VanDerWaalsContact CG2-CG2 3.48Å; V9-V12 HydrophobicContact CB-CG2 4.01Å; V9-V12 HydrophobicContact CG1-CG2 3.65Å; V9-T26 WeakPolarHBondContact O-CA 3.38Å; V9-L27 PolarHBondContact N-O 3.18Å; V9-L27 PolarHBondContact O-N 2.92Å; V9-V87 HydrophobicContact CG1-CG1 3.93Å; V9-D92 HydrophobicContact CG1-CB 4.08Å; V9-D92 HydrophobicContact CG2-CB 4.19Å; V9-I96 HydrophobicContact CB-CD1 4.12Å; V9-I96 HydrophobicContact CG1-CD1 4.46Å; V9-I96 HydrophobicContact CG2-CD1 3.63Å; V9-I96 HydrophobicContact CG2-CG1 4.05Å
10	E	90.4	Very high	79.4	Confident	110 Å²	110	76.8 Å²	76.8	51%	0.514	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	162.8	179.9	-64.3	178.5	179.6	0	0	111.4	K8 V12 T26	K8-E10 HydrophobicContact CD-CG 4.41Å; K8-E10 VanDerWaalsContact CE-OE1 3.25Å; K8-E10 WeakPolarHBondContact CE-OE1 3.31Å; K8-E10 IonicContact NZ-OE1 2.63Å; K8-E10 PolarHBondContact NZ-OE1 3.15Å; E10-V12 PolarHBondContact O-N 3.28Å; E10-T26 HydrophobicContact CG-CG2 4.11Å
11	Q	88.1	Confident	79.5	Confident	112 Å²	112	80.6 Å²	80.6	52%	0.523	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57	29.7	177.4	-45.4	-174.3	-1.5	0	0	114.3	G25	Q11-G25 PolarHBondContact N-O 3.38Å; Q11-G25 VanDerWaalsContact N-O 3.11Å
12	V	91.7	Very high	81.1	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137	170.3	178.8	0	0	0	0	108.4	V9 E10 G25 L27 F36 F85 V87	V9-V12 HydrophobicContact CB-CG2 4.01Å; V9-V12 HydrophobicContact CG1-CG2 3.65Å; E10-V12 PolarHBondContact O-N 3.28Å; V12-G25 PolarHBondContact N-O 2.97Å; V12-G25 PolarHBondContact O-N 3.39Å; V12-L27 HydrophobicContact CB-CB 4.22Å; V12-L27 HydrophobicContact CG1-CB 4.4Å; V12-L27 HydrophobicContact CG1-CD2 4.46Å; V12-L27 HydrophobicContact CG2-CB 3.81Å; V12-F36 HydrophobicContact CB-CE2 4.38Å; V12-F36 HydrophobicContact CG1-CE2 4.44Å; V12-F85 HydrophobicContact CG1-CB 3.93Å; V12-F85 HydrophobicContact CG1-CD1 3.71Å; V12-F85 HydrophobicContact CG1-CG 4.06Å; V12-V87 HydrophobicContact CG1-CG2 4.22Å; V12-V87 HydrophobicContact CG2-CG2 4.21Å
13	R	92.3	Very high	82.7	Confident	65 Å²	65	67.3 Å²	67.3	25%	0.245	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	118.1	177.9	-52.8	-162.5	-80.2	158.5	-7.6	110.1	T23 N24 S69 F85 V86	R13-T23 CarbonylContact C-O 3.54Å; R13-T23 WeakPolarHBondContact CA-O 3.34Å; R13-N24 WeakPolarHBondContact CD-OD1 3.39Å; R13-N24 VanDerWaalsContact CG-OD1 3.29Å; R13-N24 WeakPolarHBondContact CG-OD1 3.4Å; R13-S69 PolarHBondContact NH2-O 2.82Å; R13-S69 PolarHBondContact NH2-OG 3.47Å; R13-F85 CarbonylContact O-C 3.36Å; R13-F85 WeakPolarHBondContact O-CA 3.45Å; R13-V86 HydrophobicContact CB-CB 4.34Å; R13-V86 PolarHBondContact N-O 3.22Å; R13-V86 PolarHBondContact O-N 2.96Å
14	L	90.5	Very high	83.8	Confident	24 Å²	24	68.2 Å²	68.2	13%	0.126	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	124	165.5	173.6	69.2	0	0	0	108.3	S22 T23 F36 I51 V83 F85	L14-S22 CarbonylContact O-C 3.47Å; L14-S22 WeakPolarHBondContact O-CA 3.42Å; L14-T23 PolarHBondContact N-O 3.4Å; L14-T23 PolarHBondContact O-N 3.02Å; L14-F36 HydrophobicContact CB-CD1 4.47Å; L14-F36 HydrophobicContact CB-CE1 3.85Å; L14-F36 HydrophobicContact CB-CE2 4.2Å; L14-F36 HydrophobicContact CB-CZ 3.68Å; L14-F36 HydrophobicContact CD2-CD1 4.26Å; L14-F36 HydrophobicContact CD2-CE1 3.96Å; L14-I51 HydrophobicContact CD1-CD1 4.42Å; L14-I51 HydrophobicContact CD2-CD1 3.45Å; L14-I51 VanDerWaalsContact CD2-CD1 3.45Å; L14-V83 HydrophobicContact CD1-CG1 3.53Å; L14-F85 HydrophobicContact CB-CD1 4.31Å; L14-F85 HydrophobicContact CB-CE1 4.19Å; L14-F85 HydrophobicContact CD1-CD1 4.21Å; L14-F85 HydrophobicContact CD1-CE1 3.84Å; L14-F85 HydrophobicContact CD1-CZ 4.49Å
15	V	87.9	Confident	84.6	Confident	42 Å²	42	66.9 Å²	66.9	26%	0.255	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.4	-179.8	-177.3	0	0	0	0	109.3	H84 V86	V15-H84 HydrophobicContact CB-CB 4.18Å; V15-H84 PolarHBondContact N-O 3.37Å; V15-V86 HydrophobicContact CG2-CG2 3.83Å
16	D	81.4	Confident	85.4	Confident	51 Å²	51	60.3 Å²	60.3	27%	0.273	31%	0.311	S	S	.	.			trans	-67.6	144.1	172.4	-175.4	-103.1	0	0	0	110.3	F18 S19 K21 S512	D16-F18 PolarHBondContact OD1-N 3.32Å; D16-S19 WeakPolarHBondContact CB-OG 3.31Å; D16-S19 VanDerWaalsContact CG-OG 3.25Å; D16-S19 VanDerWaalsContact O-O 3.14Å; D16-S19 WeakPolarHBondContact OD1-CB 3.47Å; D16-S19 PolarHBondContact OD1-N 3Å; D16-S19 PolarHBondContact OD1-OG 3.49Å; D16-K21 HydrophobicContact CB-CB 4.48Å; D16-K21 PolarHBondContact N-O 2.73Å; D16-S512 PolarHBondContact OD1-OG 2.81Å; D16-S512 PolarHBondContact OD2-OG 3.21Å
17	R	73.6	Confident	86.1	Confident	19 Å²	19	59.2 Å²	59.2	7%	0.072	30%	0.304	C	S	.	.	S	Bend	trans	-78.7	-29.9	-170.1	-177.9	171.8	155.5	-113.2	-21.5	113.8	V293 I294 A296 D510	R17-V293 PolarHBondContact NH1-O 3.31Å; R17-V293 PolarHBondContact NH2-O 3.29Å; R17-I294 VanDerWaalsContact CZ-CA 3.4Å; R17-I294 PolarHBondContact NE-O 3.43Å; R17-I294 PolarHBondContact NH2-O 3.02Å; R17-A296 PolarHBondContact NH2-O 3.02Å; R17-D510 IonicContact NH1-OD1 2.8Å; R17-D510 IonicContact NH1-OD2 3.51Å; R17-D510 PolarHBondContact NH1-OD2 3.35Å
18	F	72.7	Confident	86.5	Confident	61 Å²	61	59.5 Å²	59.5	27%	0.268	30%	0.295	S	S	.	.	S	Bend	trans	-117.1	-3.1	-175.1	-59	-76.4	0	0	0	114	D16 D510 M513	D16-F18 PolarHBondContact OD1-N 3.32Å; F18-D510 HydrophobicContact CD2-CB 4.41Å; F18-D510 HydrophobicContact CE2-CB 3.87Å; F18-M513 HydrophobicContact CD2-CG 4.42Å; F18-M513 HydrophobicContact CE1-CE 3.81Å; F18-M513 HydrophobicContact CE2-CE 4.25Å; F18-M513 HydrophobicContact CE2-CG 4.33Å; F18-M513 HydrophobicContact CZ-CE 3.61Å; F18-M513 HydrophobicContact CZ-SD 4.42Å
19	S	71.3	Confident	86.4	Confident	35 Å²	35	55.4 Å²	55.4	25%	0.245	28%	0.278	C	S	.	.	S	Bend	trans	-130.4	149.9	173.2	67.4	0	0	0	0	110.4	D16 K21	D16-S19 WeakPolarHBondContact CB-OG 3.31Å; D16-S19 VanDerWaalsContact CG-OG 3.25Å; D16-S19 VanDerWaalsContact O-O 3.14Å; D16-S19 WeakPolarHBondContact OD1-CB 3.47Å; D16-S19 PolarHBondContact OD1-N 3Å; D16-S19 PolarHBondContact OD1-OG 3.49Å; S19-K21 PolarHBondContact O-N 3.48Å
20	N	71.6	Confident	86.3	Confident	179 Å²	179	57.4 Å²	57.4	96%	0.957	29%	0.29	S	S	*	.	S	Bend	trans	-73	21.8	176.8	-63.8	-24.3	0	0	0	112.9
21	K	81.6	Confident	85.9	Confident	157 Å²	157	55 Å²	55	68%	0.683	29%	0.289	S	S	*	.			trans	-82.5	134.6	176.5	-65.6	-173	177	-172	0	109.2	D16 S19	D16-K21 HydrophobicContact CB-CB 4.48Å; D16-K21 PolarHBondContact N-O 2.73Å; S19-K21 PolarHBondContact O-N 3.48Å
22	S	85.8	Confident	85.6	Confident	57 Å²	57	51.6 Å²	51.6	40%	0.399	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135	170.3	64.1	0	0	0	0	110.4	L14	L14-S22 CarbonylContact O-C 3.47Å; L14-S22 WeakPolarHBondContact O-CA 3.42Å
23	T	89.5	Confident	85.5	Confident	43 Å²	43	52.6 Å²	52.6	26%	0.264	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.4	178.5	-65.6	0	0	0	0	109.2	R13 L14 F36 E38	R13-T23 CarbonylContact C-O 3.54Å; R13-T23 WeakPolarHBondContact CA-O 3.34Å; L14-T23 PolarHBondContact N-O 3.4Å; L14-T23 PolarHBondContact O-N 3.02Å; T23-F36 HydrophobicContact CG2-CE1 4.21Å; T23-F36 HydrophobicContact CG2-CZ 4.31Å; T23-E38 HydrophobicContact CG2-CB 3.96Å; T23-E38 HydrophobicContact CG2-CG 3.49Å; T23-E38 VanDerWaalsContact CG2-CG 3.49Å; T23-E38 WeakPolarHBondContact CG2-OE1 3.35Å
24	N	91.3	Very high	85.5	Confident	90 Å²	90	49.6 Å²	49.6	48%	0.481	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	143.5	174.4	-66.2	-14.2	0	0	0	109.9	R13 S39	R13-N24 WeakPolarHBondContact CD-OD1 3.39Å; R13-N24 VanDerWaalsContact CG-OD1 3.29Å; R13-N24 WeakPolarHBondContact CG-OD1 3.4Å; N24-S39 PolarHBondContact O-N 3.38Å
25	G	92.4	Very high	85.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	-170.9	178.4	0	0	0	0	0	113.6	Q11 V12 V37	Q11-G25 PolarHBondContact N-O 3.38Å; Q11-G25 VanDerWaalsContact N-O 3.11Å; V12-G25 PolarHBondContact N-O 2.97Å; V12-G25 PolarHBondContact O-N 3.39Å; G25-V37 CarbonylContact C-O 3.42Å; G25-V37 WeakPolarHBondContact CA-O 3.4Å
26	T	93.4	Very high	85.9	Confident	17 Å²	17	47.6 Å²	47.6	10%	0.104	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	131.3	174.8	-57.2	0	0	0	0	109.6	K8 V9 E10 Y28 F36 V37	K8-T26 HydrophobicContact CD-CG2 4.21Å; K8-T26 HydrophobicContact CG-CG2 3.59Å; V9-T26 WeakPolarHBondContact O-CA 3.38Å; E10-T26 HydrophobicContact CG-CG2 4.11Å; T26-Y28 HydrophobicContact CG2-CD1 4.48Å; T26-Y28 HydrophobicContact CG2-CD2 4.07Å; T26-Y28 HydrophobicContact CG2-CE1 3.99Å; T26-Y28 HydrophobicContact CG2-CE2 3.51Å; T26-Y28 VanDerWaalsContact CG2-CZ 3.47Å; T26-F36 WeakPolarHBondContact O-CA 3.4Å; T26-V37 PolarHBondContact N-O 3.32Å; T26-V37 PolarHBondContact O-N 3.04Å
27	L	94.3	Very high	86.5	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	120.1	174.6	-168.1	68.1	0	0	0	109.4	K8 V9 V12 L34 F36 F85 I96	K8-L27 CarbonylContact C-O 3.49Å; K8-L27 WeakPolarHBondContact CA-O 3.5Å; V9-L27 PolarHBondContact N-O 3.18Å; V9-L27 PolarHBondContact O-N 2.92Å; V12-L27 HydrophobicContact CB-CB 4.22Å; V12-L27 HydrophobicContact CG1-CB 4.4Å; V12-L27 HydrophobicContact CG1-CD2 4.46Å; V12-L27 HydrophobicContact CG2-CB 3.81Å; L27-L34 HydrophobicContact CD1-CD1 3.77Å; L27-L34 HydrophobicContact CD1-CD2 4.26Å; L27-L34 HydrophobicContact CD1-CG 3.86Å; L27-L34 HydrophobicContact CD2-CD1 4.1Å; L27-L34 HydrophobicContact CG-CD1 3.83Å; L27-L34 HydrophobicContact CG-CG 4.48Å; L27-F36 HydrophobicContact CD1-CB 3.85Å; L27-F36 HydrophobicContact CD1-CD2 4.33Å; L27-F85 HydrophobicContact CD1-CD2 4.47Å; L27-F85 HydrophobicContact CD1-CE1 4.15Å; L27-F85 HydrophobicContact CD1-CE2 3.88Å; L27-F85 HydrophobicContact CD1-CZ 3.69Å; L27-F85 HydrophobicContact CD2-CD2 4.43Å; L27-I96 HydrophobicContact CD2-CD1 3.9Å
28	Y	93.3	Very high	87.2	Confident	84 Å²	84	49 Å²	49	33%	0.329	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	134.3	175.6	-60.1	-89.3	0	0	0	109.8	P7 K8 T26 I35 V37	P7-Y28 WeakPolarHBondContact O-CA 3.49Å; K8-Y28 HydrophobicContact CB-CD1 4.17Å; K8-Y28 HydrophobicContact CB-CE1 4.32Å; K8-Y28 HydrophobicContact CD-CE1 3.84Å; K8-Y28 HydrophobicContact CG-CD1 3.92Å; K8-Y28 HydrophobicContact CG-CE1 3.65Å; T26-Y28 HydrophobicContact CG2-CD1 4.48Å; T26-Y28 HydrophobicContact CG2-CD2 4.07Å; T26-Y28 HydrophobicContact CG2-CE1 3.99Å; T26-Y28 HydrophobicContact CG2-CE2 3.51Å; T26-Y28 VanDerWaalsContact CG2-CZ 3.47Å; Y28-I35 PolarHBondContact N-O 2.82Å; Y28-I35 PolarHBondContact O-N 3.02Å; Y28-V37 HydrophobicContact CD2-CG2 4.02Å; Y28-V37 HydrophobicContact CE2-CB 4.18Å; Y28-V37 HydrophobicContact CE2-CG2 3.8Å
29	L	90.8	Very high	87.8	Confident	7 Å²	7	49.4 Å²	49.4	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	114.4	175.1	-177.1	59.3	0	0	0	109.3	I4 P7 L34 H55 L100 L103	I4-L29 HydrophobicContact CG1-CD2 4.37Å; I4-L29 HydrophobicContact CG1-CG 4.24Å; I4-L29 HydrophobicContact CG2-CB 4.31Å; I4-L29 HydrophobicContact CG2-CD2 4.13Å; I4-L29 HydrophobicContact CG2-CG 4.16Å; P7-L29 PolarHBondContact O-N 2.94Å; L29-L34 HydrophobicContact CB-CD1 4.48Å; L29-L34 HydrophobicContact CD1-CD1 3.98Å; L29-H55 WeakPolarHBondContact CD1-CE1 3.48Å; L29-L100 HydrophobicContact CD1-CD2 3.82Å; L29-L103 HydrophobicContact CD1-CD1 4.17Å; L29-L103 HydrophobicContact CD2-CD1 4.48Å; L29-L103 HydrophobicContact CG-CD1 4.47Å
30	T	88.4	Confident	87.5	Confident	49 Å²	49	50 Å²	50	30%	0.301	29%	0.288	S	S	.	.			trans	-106.8	179.6	176.2	74.3	0	0	0	0	110.5	I4 T32 H33 I35 H55	I4-T30 VanDerWaalsContact CD1-C 3.46Å; T30-T32 VanDerWaalsContact C-N 3.27Å; T30-T32 PolarHBondContact O-N 3.4Å; T30-T32 PolarHBondContact OG1-N 2.85Å; T30-H33 PolarHBondContact N-O 3.02Å; T30-H33 WeakPolarHBondContact OG1-CA 3.38Å; T30-H33 PolarHBondContact OG1-N 3.31Å; T30-H33 PolarHBondContact OG1-O 3.29Å; T30-I35 HydrophobicContact CG2-CD1 4.17Å; T30-H55 PolarHBondContact O-NE2 3.37Å
31	A	81.3	Confident	86.5	Confident	60 Å²	60	46 Å²	46	50%	0.496	27%	0.273	S	S	.	.	S	Bend	trans	-69.1	-21.9	177.1	0	0	0	0	0	114	H55	A31-H55 PolarHBondContact O-CD2 3.03Å
32	T	82.5	Confident	84.9	Confident	40 Å²	40	46.3 Å²	46.3	25%	0.245	28%	0.283	C	S	.	.	S	Bend	trans	-122.4	-29.2	-173.6	49.4	0	0	0	0	113.7	T30 L54 H55 Y113	T30-T32 VanDerWaalsContact C-N 3.27Å; T30-T32 PolarHBondContact O-N 3.4Å; T30-T32 PolarHBondContact OG1-N 2.85Å; T32-L54 WeakPolarHBondContact O-CA 3.5Å; T32-H55 VanDerWaalsContact C-CD2 3.43Å; T32-H55 PolarHBondContact O-N 3.45Å; T32-Y113 HydrophobicContact CG2-CD2 3.77Å; T32-Y113 HydrophobicContact CG2-CE2 4.13Å
33	H	89.5	Confident	82.8	Confident	22 Å²	22	50.7 Å²	50.7	10%	0.102	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	145.2	-175.5	-59.6	76.3	0	0	0	112.7	T30 I35 W52 I53 L54 H55 Y113	T30-H33 PolarHBondContact N-O 3.02Å; T30-H33 WeakPolarHBondContact OG1-CA 3.38Å; T30-H33 PolarHBondContact OG1-N 3.31Å; T30-H33 PolarHBondContact OG1-O 3.29Å; H33-I35 HydrophobicContact CB-CD1 4.22Å; H33-I35 HydrophobicContact CB-CG1 3.83Å; H33-W52 AromaticContact CD2-CE3 3.84Å; H33-I53 CarbonylContact C-O 3.52Å; H33-I53 VanDerWaalsContact CA-O 3.31Å; H33-I53 WeakPolarHBondContact CA-O 3.48Å; H33-L54 WeakPolarHBondContact NE2-CD1 3.36Å; H33-H55 PolarHBondContact O-CE1 2.9Å; H33-Y113 AromaticContact CE1-CZ 3.92Å
34	L	92.9	Very high	80.6	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	125	155.3	-175.7	72.1	0	0	0	107.8	L27 L29 I53 H55 I75 F85	L27-L34 HydrophobicContact CD1-CD1 3.77Å; L27-L34 HydrophobicContact CD1-CD2 4.26Å; L27-L34 HydrophobicContact CD1-CG 3.86Å; L27-L34 HydrophobicContact CD2-CD1 4.1Å; L27-L34 HydrophobicContact CG-CD1 3.83Å; L27-L34 HydrophobicContact CG-CG 4.48Å; L29-L34 HydrophobicContact CB-CD1 4.48Å; L29-L34 HydrophobicContact CD1-CD1 3.98Å; L34-I53 HydrophobicContact CB-CB 4.44Å; L34-I53 HydrophobicContact CD2-CD1 4.48Å; L34-I53 PolarHBondContact N-O 2.97Å; L34-I53 PolarHBondContact O-N 3.4Å; L34-H55 PolarHBondContact N-CE1 3.21Å; L34-H55 VanDerWaalsContact N-CE1 3.31Å; L34-I75 HydrophobicContact CD2-CD1 3.27Å; L34-F85 HydrophobicContact CD2-CE2 4.04Å
35	I	93.9	Very high	78.2	Confident	21 Å²	21	54.9 Å²	54.9	11%	0.108	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121.1	-175.3	-52.2	170.9	0	0	0	108.7	Y28 T30 H33 V37 I51 W52	Y28-I35 PolarHBondContact N-O 2.82Å; Y28-I35 PolarHBondContact O-N 3.02Å; T30-I35 HydrophobicContact CG2-CD1 4.17Å; H33-I35 HydrophobicContact CB-CD1 4.22Å; H33-I35 HydrophobicContact CB-CG1 3.83Å; I35-V37 HydrophobicContact CG2-CG2 4.12Å; I35-I51 CarbonylContact C-O 3.49Å; I35-I51 VanDerWaalsContact CA-O 3.32Å; I35-I51 WeakPolarHBondContact CA-O 3.39Å; I35-W52 HydrophobicContact CD1-CD2 4.07Å; I35-W52 HydrophobicContact CD1-CE3 3.79Å; I35-W52 HydrophobicContact CD1-CH2 3.82Å; I35-W52 HydrophobicContact CD1-CZ2 4.09Å; I35-W52 HydrophobicContact CD1-CZ3 3.66Å; I35-W52 HydrophobicContact CG1-CD2 4Å; I35-W52 HydrophobicContact CG1-CE3 4Å; I35-W52 HydrophobicContact CG1-CG 4.42Å; I35-W52 HydrophobicContact CG1-CZ3 4.39Å; I35-W52 HydrophobicContact CG2-CD2 4.22Å; I35-W52 HydrophobicContact CG2-CG 4.32Å; I35-W52 HydrophobicContact CG2-CZ2 4.46Å
36	F	93.5	Very high	76.2	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.009	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.5	170.4	173.6	-91.7	0	0	0	109.4	V12 L14 T23 T26 L27 E50 I51 F85	V12-F36 HydrophobicContact CB-CE2 4.38Å; V12-F36 HydrophobicContact CG1-CE2 4.44Å; L14-F36 HydrophobicContact CB-CD1 4.47Å; L14-F36 HydrophobicContact CB-CE1 3.85Å; L14-F36 HydrophobicContact CB-CE2 4.2Å; L14-F36 HydrophobicContact CB-CZ 3.68Å; L14-F36 HydrophobicContact CD2-CD1 4.26Å; L14-F36 HydrophobicContact CD2-CE1 3.96Å; T23-F36 HydrophobicContact CG2-CE1 4.21Å; T23-F36 HydrophobicContact CG2-CZ 4.31Å; T26-F36 WeakPolarHBondContact O-CA 3.4Å; L27-F36 HydrophobicContact CD1-CB 3.85Å; L27-F36 HydrophobicContact CD1-CD2 4.33Å; F36-E50 CarbonylContact O-C 3.57Å; F36-E50 WeakPolarHBondContact O-CA 3.4Å; F36-I51 HydrophobicContact CB-CB 4.19Å; F36-I51 PolarHBondContact N-O 3.36Å; F36-I51 PolarHBondContact O-N 2.74Å; F36-F85 HydrophobicContact CB-CE1 3.88Å; F36-F85 HydrophobicContact CB-CZ 3.84Å; F36-F85 HydrophobicContact CD1-CE1 4.49Å; F36-F85 HydrophobicContact CD2-CD1 4.24Å; F36-F85 AromaticContact CD2-CE1 3.54Å; F36-F85 HydrophobicContact CD2-CE1 3.54Å; F36-F85 HydrophobicContact CD2-CZ 4.32Å; F36-F85 HydrophobicContact CE2-CE1 4.16Å; F36-F85 AromaticContact CG-CE1 3.72Å; F36-F85 HydrophobicContact CG-CE1 3.72Å; F36-F85 HydrophobicContact CG-CZ 4.21Å
37	V	92.2	Very high	74.4	Confident	36 Å²	36	62.7 Å²	62.7	22%	0.218	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.6	177.5	-177.3	0	0	0	0	108.1	G25 T26 Y28 I35 E50	G25-V37 CarbonylContact C-O 3.42Å; G25-V37 WeakPolarHBondContact CA-O 3.4Å; T26-V37 PolarHBondContact N-O 3.32Å; T26-V37 PolarHBondContact O-N 3.04Å; Y28-V37 HydrophobicContact CD2-CG2 4.02Å; Y28-V37 HydrophobicContact CE2-CB 4.18Å; Y28-V37 HydrophobicContact CE2-CG2 3.8Å; I35-V37 HydrophobicContact CG2-CG2 4.12Å; V37-E50 HydrophobicContact CG1-CG 4.35Å; V37-E50 HydrophobicContact CG2-CG 4.22Å
38	E	89.9	Confident	72.9	Confident	64 Å²	64	63.9 Å²	63.9	30%	0.299	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	135.8	174.2	174.2	167.5	-136.2	0	0	111.6	T23 G40 Q49	T23-E38 HydrophobicContact CG2-CB 3.96Å; T23-E38 HydrophobicContact CG2-CG 3.49Å; T23-E38 VanDerWaalsContact CG2-CG 3.49Å; T23-E38 WeakPolarHBondContact CG2-OE1 3.35Å; E38-G40 PolarHBondContact O-N 2.8Å; E38-Q49 HydrophobicContact CB-CB 4.39Å; E38-Q49 WeakPolarHBondContact CB-O 3.5Å; E38-Q49 PolarHBondContact N-O 2.97Å; E38-Q49 VanDerWaalsContact N-O 3.14Å; E38-Q49 WeakPolarHBondContact OE2-CB 3.32Å; E38-Q49 PolarHBondContact OE2-N 2.76Å
39	S	83.5	Confident	72.1	Confident	69 Å²	69	63 Å²	63	48%	0.483	42%	0.416	S	S	.	.			trans	-76	101.9	169.9	-70.1	0	0	0	0	108.8	N24	N24-S39 PolarHBondContact O-N 3.38Å
40	G	66.1	Low	71.9	Confident	49 Å²	49	67.5 Å²	67.5	51%	0.505	44%	0.437	S	S	.	.			trans	-55.9	143.3	177.5	0	0	0	0	0	112.4	E38	E38-G40 PolarHBondContact O-N 2.8Å
41	S	50.8	Low	71.9	Confident	93 Å²	93	65.7 Å²	65.7	65%	0.65	43%	0.426	S	S	*	.			trans	-71.1	140.4	162	63	0	0	0	0	108.5	N43	S41-N43 PolarHBondContact O-N 3.41Å
42	N	46.7	Very low	72.3	Confident	164 Å²	164	68.5 Å²	68.5	88%	0.877	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	11.8	-166.4	-72.6	-13.5	0	0	0	116.3
43	N	42.9	Very low	72.7	Confident	150 Å²	150	66.8 Å²	66.8	80%	0.802	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	3.6	-164.3	-85.3	11	0	0	0	117.1	S41	S41-N43 PolarHBondContact O-N 3.41Å
44	T	42.4	Very low	72.8	Confident	98 Å²	98	66.8 Å²	66.8	60%	0.601	41%	0.413	S	S	*	.			trans	-141.9	133.8	173.6	48.5	0	0	0	0	112.9	S46	T44-S46 PolarHBondContact O-N 2.87Å; T44-S46 PolarHBondContact OG1-OG 2.82Å
45	A	42.6	Very low	72.5	Confident	122 Å²	122	66.9 Å²	66.9	100%	1.008	41%	0.414	S	S	*	.			trans	-71	23.8	-179	0	0	0	0	0	115.2
46	S	48.5	Very low	72.1	Confident	80 Å²	80	66.8 Å²	66.8	56%	0.559	41%	0.413	S	S	*	.	S	Bend	trans	-80.5	118.1	168.9	53.3	0	0	0	0	109.2	T44 G48	T44-S46 PolarHBondContact O-N 2.87Å; T44-S46 PolarHBondContact OG1-OG 2.82Å; S46-G48 PolarHBondContact O-N 3.01Å
47	A	55.9	Low	71.9	Confident	102 Å²	102	67 Å²	67	84%	0.843	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-52.3	125.1	171.2	0	0	0	0	0	110
48	G	64	Low	71.8	Confident	28 Å²	28	65.3 Å²	65.3	29%	0.289	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-59.3	150.3	-177.3	0	0	0	0	0	111.6	S46 E50	S46-G48 PolarHBondContact O-N 3.01Å; G48-E50 PolarHBondContact O-N 2.77Å; G48-E50 VanDerWaalsContact O-N 3.11Å
49	Q	74.9	Confident	71.8	Confident	64 Å²	64	64.8 Å²	64.8	30%	0.299	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-66.3	117.9	-174.5	-169.7	-174.8	-68.9	0	0	111.7	E38	E38-Q49 HydrophobicContact CB-CB 4.39Å; E38-Q49 WeakPolarHBondContact CB-O 3.5Å; E38-Q49 PolarHBondContact N-O 2.97Å; E38-Q49 VanDerWaalsContact N-O 3.14Å; E38-Q49 WeakPolarHBondContact OE2-CB 3.32Å; E38-Q49 PolarHBondContact OE2-N 2.76Å
50	E	87.8	Confident	72.1	Confident	103 Å²	103	63.1 Å²	63.1	48%	0.481	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	144.7	170.2	-59.5	-166	167.1	0	0	112.1	F36 V37 G48 W52	F36-E50 CarbonylContact O-C 3.57Å; F36-E50 WeakPolarHBondContact O-CA 3.4Å; V37-E50 HydrophobicContact CG1-CG 4.35Å; V37-E50 HydrophobicContact CG2-CG 4.22Å; G48-E50 PolarHBondContact O-N 2.77Å; G48-E50 VanDerWaalsContact O-N 3.11Å; E50-W52 PolarHBondContact OE2-NE1 3.13Å
51	I	87.8	Confident	73.4	Confident	10 Å²	10	61.4 Å²	61.4	5%	0.051	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	112.5	174	-74.8	179.5	0	0	0	108	L14 I35 F36 I53	L14-I51 HydrophobicContact CD1-CD1 4.42Å; L14-I51 HydrophobicContact CD2-CD1 3.45Å; L14-I51 VanDerWaalsContact CD2-CD1 3.45Å; I35-I51 CarbonylContact C-O 3.49Å; I35-I51 VanDerWaalsContact CA-O 3.32Å; I35-I51 WeakPolarHBondContact CA-O 3.39Å; F36-I51 HydrophobicContact CB-CB 4.19Å; F36-I51 PolarHBondContact N-O 3.36Å; F36-I51 PolarHBondContact O-N 2.74Å; I51-I53 HydrophobicContact CG2-CD1 4.13Å; I51-I53 HydrophobicContact CG2-CG1 3.99Å
52	W	90.5	Very high	75.3	Confident	120 Å²	120	61.1 Å²	61.1	46%	0.455	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.5	174.2	-64.1	59.1	0	0	0	108.6	H33 I35 E50 R81	H33-W52 AromaticContact CD2-CE3 3.84Å; I35-W52 HydrophobicContact CD1-CD2 4.07Å; I35-W52 HydrophobicContact CD1-CE3 3.79Å; I35-W52 HydrophobicContact CD1-CH2 3.82Å; I35-W52 HydrophobicContact CD1-CZ2 4.09Å; I35-W52 HydrophobicContact CD1-CZ3 3.66Å; I35-W52 HydrophobicContact CG1-CD2 4Å; I35-W52 HydrophobicContact CG1-CE3 4Å; I35-W52 HydrophobicContact CG1-CG 4.42Å; I35-W52 HydrophobicContact CG1-CZ3 4.39Å; I35-W52 HydrophobicContact CG2-CD2 4.22Å; I35-W52 HydrophobicContact CG2-CG 4.32Å; I35-W52 HydrophobicContact CG2-CZ2 4.46Å; E50-W52 PolarHBondContact OE2-NE1 3.13Å; W52-R81 PolarHBondContact O-NH1 2.87Å
53	I	91.4	Very high	77.6	Confident	4 Å²	4	56 Å²	56	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	120	176.1	-51.7	174.7	0	0	0	106.7	H33 L34 I51 I58 V83	H33-I53 CarbonylContact C-O 3.52Å; H33-I53 VanDerWaalsContact CA-O 3.31Å; H33-I53 WeakPolarHBondContact CA-O 3.48Å; L34-I53 HydrophobicContact CB-CB 4.44Å; L34-I53 HydrophobicContact CD2-CD1 4.48Å; L34-I53 PolarHBondContact N-O 2.97Å; L34-I53 PolarHBondContact O-N 3.4Å; I51-I53 HydrophobicContact CG2-CD1 4.13Å; I51-I53 HydrophobicContact CG2-CG1 3.99Å; I53-I58 HydrophobicContact CG2-CD1 4.1Å; I53-I58 HydrophobicContact CG2-CG1 3.67Å; I53-V83 HydrophobicContact CD1-CB 4.34Å; I53-V83 HydrophobicContact CD1-CG2 3.78Å
54	L	89.6	Confident	79.9	Confident	21 Å²	21	53.3 Å²	53.3	11%	0.11	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	144.8	173.1	-76.1	71.6	0	0	0	109.3	T32 H33 H56 H57 Y113	T32-L54 WeakPolarHBondContact O-CA 3.5Å; H33-L54 WeakPolarHBondContact NE2-CD1 3.36Å; L54-H56 VanDerWaalsContact C-N 3.27Å; L54-H56 PolarHBondContact O-N 3.42Å; L54-H57 HydrophobicContact CB-CB 4.45Å; L54-H57 WeakPolarHBondContact O-CB 3.36Å; L54-H57 PolarHBondContact O-N 3.44Å; L54-Y113 HydrophobicContact CD2-CD1 3.58Å; L54-Y113 HydrophobicContact CD2-CE1 3.83Å
55	H	88.1	Confident	82.1	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.019	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-60.6	-38.3	177.4	-62.6	-30.8	0	0	0	111.8	L29 T30 A31 T32 H33 L34 H57 I58 L104	L29-H55 WeakPolarHBondContact CD1-CE1 3.48Å; T30-H55 PolarHBondContact O-NE2 3.37Å; A31-H55 PolarHBondContact O-CD2 3.03Å; T32-H55 VanDerWaalsContact C-CD2 3.43Å; T32-H55 PolarHBondContact O-N 3.45Å; H33-H55 PolarHBondContact O-CE1 2.9Å; L34-H55 PolarHBondContact N-CE1 3.21Å; L34-H55 VanDerWaalsContact N-CE1 3.31Å; H55-H57 PolarHBondContact O-N 2.85Å; H55-I58 PolarHBondContact O-N 2.96Å; H55-L104 HydrophobicContact CB-CD2 4.23Å; H55-L104 WeakPolarHBondContact O-CD2 3.32Å
56	H	84.6	Confident	84.5	Confident	20 Å²	20	53 Å²	53	9%	0.093	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-66.3	-17	174.3	-53.7	-64	0	0	0	114.1	L54 R78 L112 Y113 C438	L54-H56 VanDerWaalsContact C-N 3.27Å; L54-H56 PolarHBondContact O-N 3.42Å; H56-R78 PolarHBondContact O-NH1 2.89Å; H56-L112 VanDerWaalsContact CE1-CD2 3.49Å; H56-L112 WeakPolarHBondContact CE1-CD2 3.21Å; H56-Y113 PolarHBondContact NE2-N 3.07Å; H56-C438 HydrophobicContact CB-CB 4.07Å
57	H	89.2	Confident	86.5	Confident	7 Å²	7	52.2 Å²	52.2	3%	0.032	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-77.1	-25.3	169.2	-74.1	149.3	0	0	0	112.6	L54 H55 A59 C77 R78 E433 S437	L54-H57 HydrophobicContact CB-CB 4.45Å; L54-H57 WeakPolarHBondContact O-CB 3.36Å; L54-H57 PolarHBondContact O-N 3.44Å; H55-H57 PolarHBondContact O-N 2.85Å; H57-A59 PolarHBondContact O-N 3.16Å; H57-C77 HydrophobicContact CB-CB 4.46Å; H57-C77 CarbonylContact O-C 3.57Å; H57-C77 WeakPolarHBondContact O-CA 3.33Å; H57-C77 VanDerWaalsContact O-CB 3.27Å; H57-C77 WeakPolarHBondContact O-CB 3.25Å; H57-R78 PolarHBondContact O-N 3.33Å; H57-E433 VanDerWaalsContact CE1-CD 3.48Å; H57-E433 IonicContact CE1-OE1 3.47Å; H57-E433 PolarHBondContact CE1-OE1 2.63Å; H57-E433 IonicContact ND1-OE1 2.68Å; H57-E433 PolarHBondContact NE2-O 3.48Å; H57-E433 IonicContact NE2-OE1 3.89Å; H57-E433 IonicContact NE2-OE2 2.79Å; H57-S437 WeakPolarHBondContact NE2-CA 3.46Å; H57-S437 PolarHBondContact NE2-N 3.06Å
58	I	91.4	Very high	88	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.9	-176.3	-58.5	171.7	0	0	0	109.7	I53 H55 S60 I75 R78 L100 L104	I53-I58 HydrophobicContact CG2-CD1 4.1Å; I53-I58 HydrophobicContact CG2-CG1 3.67Å; H55-I58 PolarHBondContact O-N 2.96Å; I58-S60 WeakPolarHBondContact CG2-O 3.43Å; I58-I75 HydrophobicContact CB-CG2 4.25Å; I58-I75 HydrophobicContact CD1-CG2 3.84Å; I58-I75 HydrophobicContact CG1-CG2 3.67Å; I58-I75 HydrophobicContact CG2-CG2 3.71Å; I58-R78 PolarHBondContact O-NH1 3.36Å; I58-L100 HydrophobicContact CD1-CD2 4.13Å; I58-L104 HydrophobicContact CB-CD1 4.29Å; I58-L104 HydrophobicContact CB-CD2 3.56Å; I58-L104 HydrophobicContact CD1-CD2 4.25Å; I58-L104 HydrophobicContact CG1-CD2 4.4Å; I58-L104 HydrophobicContact CG2-CD1 3.61Å; I58-L104 HydrophobicContact CG2-CD2 3.87Å; I58-L104 HydrophobicContact CG2-CG 4.39Å
59	A	88.6	Confident	89	Confident	52 Å²	52	56.4 Å²	56.4	43%	0.43	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-39.7	176.1	0	0	0	0	0	111.8	H57 Q76 R78	H57-A59 PolarHBondContact O-N 3.16Å; A59-Q76 PolarHBondContact N-O 3.11Å; A59-R78 HydrophobicContact CB-CG 3.75Å
60	S	89.5	Confident	89.8	Confident	34 Å²	34	53.7 Å²	53.7	24%	0.238	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	152.4	178.4	73	0	0	0	0	111.7	I58 Q76	I58-S60 WeakPolarHBondContact CG2-O 3.43Å; S60-Q76 PolarHBondContact N-O 3.2Å; S60-Q76 VanDerWaalsContact N-O 3.09Å; S60-Q76 PolarHBondContact O-N 3.18Å; S60-Q76 WeakPolarHBondContact OG-CB 3.39Å; S60-Q76 WeakPolarHBondContact OG-CG 3.22Å; S60-Q76 PolarHBondContact OG-OE1 2.86Å
61	V	93.2	Very high	90.1	Very high	13 Å²	13	48.8 Å²	48.8	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.6	170.7	60.7	0	0	0	0	108.8	L73 V74 I75 Y97 L100 L101 L104	V61-L73 HydrophobicContact CG2-CD1 3.62Å; V61-L73 HydrophobicContact CG2-CG 4.15Å; V61-V74 CarbonylContact C-O 3.58Å; V61-V74 WeakPolarHBondContact CA-O 3.48Å; V61-I75 HydrophobicContact CG2-CG1 4.11Å; V61-Y97 HydrophobicContact CG1-CD2 4.17Å; V61-Y97 HydrophobicContact CG1-CE2 4.12Å; V61-Y97 HydrophobicContact CG2-CD2 3.98Å; V61-Y97 HydrophobicContact CG2-CE2 4.46Å; V61-Y97 WeakPolarHBondContact O-CE2 3.45Å; V61-L100 HydrophobicContact CG1-CB 4.43Å; V61-L100 HydrophobicContact CG2-CD1 4.09Å; V61-L101 HydrophobicContact CG1-CD2 3.77Å; V61-L101 HydrophobicContact CG1-CG 4.18Å; V61-L104 HydrophobicContact CB-CD1 4.44Å; V61-L104 HydrophobicContact CG1-CD1 3.87Å
62	E	92.5	Very high	90.4	Very high	87 Å²	87	49 Å²	49	41%	0.407	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117.1	-177.5	-65.4	178.2	-175.1	0	0	109.8	L73 V74	E62-L73 WeakPolarHBondContact O-CA 3.37Å; E62-V74 HydrophobicContact CB-CB 4.34Å; E62-V74 PolarHBondContact N-O 2.93Å; E62-V74 PolarHBondContact O-N 3.43Å
63	K	93.4	Very high	90.6	Very high	57 Å²	57	43.3 Å²	43.3	25%	0.248	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	118.3	168.2	175.4	178.3	167.4	177.8	0	108.7	C71 L73 E90 Y97	K63-C71 VanDerWaalsContact CE-SG 3.55Å; K63-L73 HydrophobicContact CB-CD1 4.29Å; K63-E90 IonicContact NZ-OE1 2.73Å; K63-E90 PolarHBondContact NZ-OE1 2.9Å; K63-Y97 HydrophobicContact CB-CD2 3.73Å; K63-Y97 HydrophobicContact CB-CE2 4Å; K63-Y97 HydrophobicContact CB-CG 4.01Å
64	Q	91.1	Very high	90.6	Very high	93 Å²	93	43.4 Å²	43.4	44%	0.435	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-92.2	163.8	177.6	-59.8	-175.4	-15.2	0	0	111.5	C71 P72	Q64-C71 PolarHBondContact O-SG 2.94Å; Q64-C71 VanDerWaalsContact O-SG 3.35Å; Q64-P72 HydrophobicContact CB-CB 4Å; Q64-P72 HydrophobicContact CB-CG 4.01Å; Q64-P72 HydrophobicContact CG-CB 4.42Å; Q64-P72 PolarHBondContact N-O 3.47Å
65	S	90.3	Very high	90.8	Very high	105 Å²	105	42.4 Å²	42.4	73%	0.734	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-53.9	145.5	177.5	-58.4	0	0	0	0	112.5	T67 P72	S65-T67 PolarHBondContact O-N 3.4Å; S65-P72 VanDerWaalsContact O-CD 3.28Å; S65-P72 WeakPolarHBondContact O-CD 3.39Å
66	L	91.4	Very high	90.9	Very high	109 Å²	109	45.9 Å²	45.9	57%	0.571	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-59.4	129.4	176.3	-179.9	61.3	0	0	0	110.7	C71 E90	L66-C71 HydrophobicContact CD1-CB 4.15Å; L66-E90 HydrophobicContact CD1-CB 4.3Å; L66-E90 HydrophobicContact CD2-CB 4.37Å
67	T	91.3	Very high	91.3	Very high	63 Å²	63	45.3 Å²	45.3	39%	0.387	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-110.3	168.8	175	73.9	0	0	0	0	110.5	S65 S69 G70 P72	S65-T67 PolarHBondContact O-N 3.4Å; T67-S69 PolarHBondContact O-N 2.88Å; T67-S69 WeakPolarHBondContact OG1-CB 3.34Å; T67-S69 PolarHBondContact OG1-N 2.89Å; T67-S69 VanDerWaalsContact OG1-N 3.11Å; T67-G70 PolarHBondContact N-O 3.39Å; T67-G70 PolarHBondContact O-N 2.9Å; T67-G70 PolarHBondContact OG1-N 3.38Å; T67-G70 PolarHBondContact OG1-O 3.34Å; T67-P72 HydrophobicContact CG2-CG 4.05Å
68	T	88.2	Confident	91.3	Very high	160 Å²	160	46.8 Å²	46.8	98%	0.982	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-18.7	168.9	53.5	0	0	0	0	113.5
69	S	84.9	Confident	91.1	Very high	58 Å²	58	47 Å²	47	41%	0.406	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-2.1	178.4	-98.6	0	0	0	0	114.3	R13 T67 V86	R13-S69 PolarHBondContact NH2-O 2.82Å; R13-S69 PolarHBondContact NH2-OG 3.47Å; T67-S69 PolarHBondContact O-N 2.88Å; T67-S69 WeakPolarHBondContact OG1-CB 3.34Å; T67-S69 PolarHBondContact OG1-N 2.89Å; T67-S69 VanDerWaalsContact OG1-N 3.11Å; S69-V86 WeakPolarHBondContact O-CG1 3.37Å
70	G	91.4	Very high	91.2	Very high	7 Å²	7	45.4 Å²	45.4	7%	0.072	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	109.9	-173	-170.2	0	0	0	0	0	112.6	T67	T67-G70 PolarHBondContact N-O 3.39Å; T67-G70 PolarHBondContact O-N 2.9Å; T67-G70 PolarHBondContact OG1-N 3.38Å; T67-G70 PolarHBondContact OG1-O 3.34Å
71	C	93.6	Very high	91.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116.6	-178.1	-174.2	0	0	0	0	110.3	K63 Q64 L66 V87 C93	K63-C71 VanDerWaalsContact CE-SG 3.55Å; Q64-C71 PolarHBondContact O-SG 2.94Å; Q64-C71 VanDerWaalsContact O-SG 3.35Å; L66-C71 HydrophobicContact CD1-CB 4.15Å; C71-V87 PolarHBondContact N-O 3.14Å; C71-V87 PolarHBondContact O-N 3.14Å; C71-C93 HydrophobicContact CB-CB 3.86Å; C71-C93 PolarHBondContact SG-SG 2.92Å
72	P	93.7	Very high	90.9	Very high	16 Å²	16	46.6 Å²	46.6	10%	0.104	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	137.7	177.5	-9	25.3	0	0	0	111.5	Q64 S65 T67 F85 V86	Q64-P72 HydrophobicContact CB-CB 4Å; Q64-P72 HydrophobicContact CB-CG 4.01Å; Q64-P72 HydrophobicContact CG-CB 4.42Å; Q64-P72 PolarHBondContact N-O 3.47Å; S65-P72 VanDerWaalsContact O-CD 3.28Å; S65-P72 WeakPolarHBondContact O-CD 3.39Å; T67-P72 HydrophobicContact CG2-CG 4.05Å; P72-F85 CarbonylContact C-O 3.58Å; P72-F85 WeakPolarHBondContact CA-O 3.27Å; P72-V86 HydrophobicContact CB-CG2 4.5Å
73	L	94.2	Very high	90.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	114.2	174.5	-173.8	72.9	0	0	0	107.8	V61 E62 K63 I75 F85 I96 Y97	V61-L73 HydrophobicContact CG2-CD1 3.62Å; V61-L73 HydrophobicContact CG2-CG 4.15Å; E62-L73 WeakPolarHBondContact O-CA 3.37Å; K63-L73 HydrophobicContact CB-CD1 4.29Å; L73-I75 HydrophobicContact CD2-CD1 4.39Å; L73-I75 HydrophobicContact CG-CG1 4.48Å; L73-F85 HydrophobicContact CB-CB 4.39Å; L73-F85 PolarHBondContact N-O 2.77Å; L73-F85 PolarHBondContact O-N 3.34Å; L73-I96 HydrophobicContact CD2-CG2 3.71Å; L73-Y97 HydrophobicContact CD1-CD2 4.09Å
74	V	92.6	Very high	90.7	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	129.3	178.4	-172.6	0	0	0	0	108.7	V61 E62 Q76 V82 H84	V61-V74 CarbonylContact C-O 3.58Å; V61-V74 WeakPolarHBondContact CA-O 3.48Å; E62-V74 HydrophobicContact CB-CB 4.34Å; E62-V74 PolarHBondContact N-O 2.93Å; E62-V74 PolarHBondContact O-N 3.43Å; V74-Q76 HydrophobicContact CG1-CG 4.47Å; V74-V82 HydrophobicContact CG1-CG1 3.92Å; V74-H84 WeakPolarHBondContact CG2-ND1 3.13Å
75	I	93.1	Very high	90.8	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.7	178.9	-61.5	-178.9	0	0	0	107.4	L34 I58 V61 L73 V82 V83 F85 L100	L34-I75 HydrophobicContact CD2-CD1 3.27Å; I58-I75 HydrophobicContact CB-CG2 4.25Å; I58-I75 HydrophobicContact CD1-CG2 3.84Å; I58-I75 HydrophobicContact CG1-CG2 3.67Å; I58-I75 HydrophobicContact CG2-CG2 3.71Å; V61-I75 HydrophobicContact CG2-CG1 4.11Å; L73-I75 HydrophobicContact CD2-CD1 4.39Å; L73-I75 HydrophobicContact CG-CG1 4.48Å; I75-V82 WeakPolarHBondContact O-CA 3.43Å; I75-V83 PolarHBondContact N-O 3.39Å; I75-V83 PolarHBondContact O-N 3.11Å; I75-F85 HydrophobicContact CD1-CD2 4.09Å; I75-F85 HydrophobicContact CD1-CE2 4.1Å; I75-L100 HydrophobicContact CD1-CD1 4.03Å
76	Q	91.3	Very high	91	Very high	77 Å²	77	32.8 Å²	32.8	36%	0.36	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	136	174.7	-48.5	176.8	-7.5	0	0	109.3	A59 S60 V74 V82	A59-Q76 PolarHBondContact N-O 3.11Å; S60-Q76 PolarHBondContact N-O 3.2Å; S60-Q76 VanDerWaalsContact N-O 3.09Å; S60-Q76 PolarHBondContact O-N 3.18Å; S60-Q76 WeakPolarHBondContact OG-CB 3.39Å; S60-Q76 WeakPolarHBondContact OG-CG 3.22Å; S60-Q76 PolarHBondContact OG-OE1 2.86Å; V74-Q76 HydrophobicContact CG1-CG 4.47Å; Q76-V82 HydrophobicContact CB-CG2 4.03Å; Q76-V82 HydrophobicContact CG-CG1 4.43Å; Q76-V82 HydrophobicContact CG-CG2 3.9Å
77	C	91.5	Very high	91.2	Very high	8 Å²	8	27.6 Å²	27.6	5%	0.054	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	150.4	-174.9	-54.6	0	0	0	0	111.9	H57 N79 F80 R81	H57-C77 HydrophobicContact CB-CB 4.46Å; H57-C77 CarbonylContact O-C 3.57Å; H57-C77 WeakPolarHBondContact O-CA 3.33Å; H57-C77 VanDerWaalsContact O-CB 3.27Å; H57-C77 WeakPolarHBondContact O-CB 3.25Å; C77-N79 WeakPolarHBondContact CB-OD1 3.44Å; C77-N79 PolarHBondContact O-N 3.21Å; C77-F80 WeakPolarHBondContact O-CA 3.08Å; C77-F80 PolarHBondContact O-N 3.31Å; C77-R81 HydrophobicContact CB-CB 3.92Å; C77-R81 VanDerWaalsContact CB-O 3.31Å; C77-R81 WeakPolarHBondContact CB-O 3.25Å; C77-R81 PolarHBondContact N-O 2.89Å; C77-R81 PolarHBondContact SG-O 2.86Å
78	R	89.3	Confident	91.2	Very high	38 Å²	38	29.2 Å²	29.2	14%	0.143	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.5	175.5	-62.1	-177.2	174.9	80.2	9.7	112.3	H56 H57 I58 A59 F80 C389 D390 H436	H56-R78 PolarHBondContact O-NH1 2.89Å; H57-R78 PolarHBondContact O-N 3.33Å; I58-R78 PolarHBondContact O-NH1 3.36Å; A59-R78 HydrophobicContact CB-CG 3.75Å; R78-F80 PolarHBondContact O-N 3.13Å; R78-C389 WeakPolarHBondContact CD-O 3.45Å; R78-C389 PolarHBondContact NE-O 3Å; R78-D390 IonicContact CZ-OD2 3.52Å; R78-D390 PolarHBondContact NE-O 3.36Å; R78-D390 IonicContact NE-OD2 3.57Å; R78-D390 PolarHBondContact NH2-O 3.37Å; R78-D390 IonicContact NH2-OD2 3.61Å; R78-D390 PolarHBondContact NH2-OD2 2.85Å; R78-H436 HydrophobicContact CB-CB 3.9Å
79	N	88.2	Confident	91.3	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.027	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	20.9	171	68.1	-1.9	0	0	0	114	C77 R81 E433 F509	C77-N79 WeakPolarHBondContact CB-OD1 3.44Å; C77-N79 PolarHBondContact O-N 3.21Å; N79-R81 PolarHBondContact O-N 2.91Å; N79-R81 VanDerWaalsContact O-N 3.1Å; N79-R81 WeakPolarHBondContact OD1-CB 3.4Å; N79-R81 PolarHBondContact OD1-N 2.76Å; N79-E433 WeakPolarHBondContact CB-OE2 3.39Å; N79-E433 VanDerWaalsContact ND2-CD 3.33Å; N79-E433 PolarHBondContact ND2-OE1 3.13Å; N79-E433 VanDerWaalsContact ND2-OE1 3.14Å; N79-E433 PolarHBondContact ND2-OE2 3.12Å; N79-F509 WeakPolarHBondContact O-CE2 3.36Å
80	F	89.9	Confident	91.6	Very high	17 Å²	17	31.2 Å²	31.2	8%	0.075	14%	0.143	C	C	.	.	S	Bend	trans	66.7	5.5	177.9	-42.7	-49.7	0	0	0	115.6	C77 R78 V82 L286 L290 I294 T404 H432 M505 Y506	C77-F80 WeakPolarHBondContact O-CA 3.08Å; C77-F80 PolarHBondContact O-N 3.31Å; R78-F80 PolarHBondContact O-N 3.13Å; F80-V82 PolarHBondContact O-N 2.97Å; F80-L286 HydrophobicContact CE1-CD1 4.25Å; F80-L286 HydrophobicContact CE1-CD2 4.08Å; F80-L286 HydrophobicContact CZ-CD1 4.44Å; F80-L286 HydrophobicContact CZ-CD2 4.36Å; F80-L290 HydrophobicContact CB-CD2 4.45Å; F80-L290 HydrophobicContact CD1-CD1 3.86Å; F80-L290 HydrophobicContact CD1-CD2 3.53Å; F80-L290 HydrophobicContact CD1-CG 4.37Å; F80-L290 HydrophobicContact CE1-CD1 4.04Å; F80-L290 HydrophobicContact CE1-CD2 4.05Å; F80-L290 HydrophobicContact CG-CD2 4.06Å; F80-I294 HydrophobicContact CB-CD1 3.89Å; F80-I294 WeakPolarHBondContact O-CD1 3.49Å; F80-T404 HydrophobicContact CE2-CG2 4.36Å; F80-T404 HydrophobicContact CZ-CG2 4.16Å; F80-H432 AromaticContact CE2-CE1 3.4Å; F80-H432 VanDerWaalsContact CE2-CE1 3.4Å; F80-H432 WeakPolarHBondContact CE2-CE1 3.4Å; F80-H432 AromaticContact CE2-NE2 3.8Å; F80-H432 AromaticContact CZ-CE1 3.77Å; F80-H432 AromaticContact CZ-NE2 3.9Å; F80-M505 HydrophobicContact CD2-CG 3.84Å; F80-M505 HydrophobicContact CD2-SD 3.98Å; F80-M505 HydrophobicContact CE2-CG 3.64Å; F80-M505 HydrophobicContact CE2-SD 3.7Å; F80-Y506 HydrophobicContact CD1-CD1 4.48Å; F80-Y506 AromaticContact CD2-CD1 3.68Å; F80-Y506 HydrophobicContact CD2-CD1 3.68Å; F80-Y506 AromaticContact CD2-CE1 3.88Å; F80-Y506 HydrophobicContact CD2-CE1 3.88Å; F80-Y506 HydrophobicContact CE1-CE1 4.34Å; F80-Y506 AromaticContact CE2-CD1 3.89Å; F80-Y506 HydrophobicContact CE2-CD1 3.89Å; F80-Y506 AromaticContact CE2-CE1 3.57Å; F80-Y506 HydrophobicContact CE2-CE1 3.57Å; F80-Y506 HydrophobicContact CG-CD1 4.01Å; F80-Y506 HydrophobicContact CG-CE1 4.38Å; F80-Y506 HydrophobicContact CZ-CD1 4.41Å; F80-Y506 AromaticContact CZ-CE1 3.84Å; F80-Y506 HydrophobicContact CZ-CE1 3.84Å
81	R	88.3	Confident	91.6	Very high	43 Å²	43	39.6 Å²	39.6	16%	0.162	17%	0.172	C	C	.	.			trans	-70	129.2	170.5	-167.5	176.9	-170.2	174.6	5.4	110.9	W52 C77 N79 V83 F509	W52-R81 PolarHBondContact O-NH1 2.87Å; C77-R81 HydrophobicContact CB-CB 3.92Å; C77-R81 VanDerWaalsContact CB-O 3.31Å; C77-R81 WeakPolarHBondContact CB-O 3.25Å; C77-R81 PolarHBondContact N-O 2.89Å; C77-R81 PolarHBondContact SG-O 2.86Å; N79-R81 PolarHBondContact O-N 2.91Å; N79-R81 VanDerWaalsContact O-N 3.1Å; N79-R81 WeakPolarHBondContact OD1-CB 3.4Å; N79-R81 PolarHBondContact OD1-N 2.76Å; R81-V83 HydrophobicContact CG-CG2 3.94Å; R81-F509 HydrophobicContact CB-CD1 4.4Å; R81-F509 HydrophobicContact CB-CD2 3.47Å; R81-F509 VanDerWaalsContact CB-CD2 3.47Å; R81-F509 HydrophobicContact CB-CE1 4.49Å; R81-F509 HydrophobicContact CB-CE2 3.62Å; R81-F509 HydrophobicContact CB-CG 3.91Å; R81-F509 HydrophobicContact CB-CZ 4.13Å; R81-F509 HydrophobicContact CG-CB 4.03Å; R81-F509 HydrophobicContact CG-CD1 3.91Å; R81-F509 HydrophobicContact CG-CD2 3.73Å; R81-F509 HydrophobicContact CG-CE1 4.33Å; R81-F509 HydrophobicContact CG-CE2 4.18Å; R81-F509 HydrophobicContact CG-CG 3.58Å; R81-F509 HydrophobicContact CG-CZ 4.46Å
82	V	88.9	Confident	91.6	Very high	29 Å²	29	41 Å²	41	18%	0.176	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.6	166.4	177.2	0	0	0	0	110.3	V74 I75 Q76 F80 I294	V74-V82 HydrophobicContact CG1-CG1 3.92Å; I75-V82 WeakPolarHBondContact O-CA 3.43Å; Q76-V82 HydrophobicContact CB-CG2 4.03Å; Q76-V82 HydrophobicContact CG-CG1 4.43Å; Q76-V82 HydrophobicContact CG-CG2 3.9Å; F80-V82 PolarHBondContact O-N 2.97Å; V82-I294 HydrophobicContact CB-CG2 3.96Å; V82-I294 HydrophobicContact CG2-CG2 3.25Å
83	V	90.5	Very high	91.5	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.036	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	124.6	-176.9	-173.4	0	0	0	0	108.8	L14 I53 I75 R81 F85	L14-V83 HydrophobicContact CD1-CG1 3.53Å; I53-V83 HydrophobicContact CD1-CB 4.34Å; I53-V83 HydrophobicContact CD1-CG2 3.78Å; I75-V83 PolarHBondContact N-O 3.39Å; I75-V83 PolarHBondContact O-N 3.11Å; R81-V83 HydrophobicContact CG-CG2 3.94Å; V83-F85 HydrophobicContact CB-CE2 4.41Å; V83-F85 HydrophobicContact CG1-CD1 4.44Å; V83-F85 HydrophobicContact CG1-CD2 4.02Å; V83-F85 HydrophobicContact CG1-CE1 3.96Å; V83-F85 HydrophobicContact CG1-CE2 3.5Å; V83-F85 HydrophobicContact CG1-CG 4.47Å; V83-F85 HydrophobicContact CG1-CZ 3.47Å; V83-F85 VanDerWaalsContact CG1-CZ 3.47Å
84	H	91.3	Very high	91.5	Very high	28 Å²	28	44 Å²	44	13%	0.13	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	108.3	177.7	-61.8	-76.2	0	0	0	109.3	V15 V74	V15-H84 HydrophobicContact CB-CB 4.18Å; V15-H84 PolarHBondContact N-O 3.37Å; V74-H84 WeakPolarHBondContact CG2-ND1 3.13Å
85	F	93.8	Very high	91.5	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.009	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.8	169.4	-66.7	-60.5	0	0	0	110.5	V12 R13 L14 L27 L34 F36 P72 L73 I75 V83	V12-F85 HydrophobicContact CG1-CB 3.93Å; V12-F85 HydrophobicContact CG1-CD1 3.71Å; V12-F85 HydrophobicContact CG1-CG 4.06Å; R13-F85 CarbonylContact O-C 3.36Å; R13-F85 WeakPolarHBondContact O-CA 3.45Å; L14-F85 HydrophobicContact CB-CD1 4.31Å; L14-F85 HydrophobicContact CB-CE1 4.19Å; L14-F85 HydrophobicContact CD1-CD1 4.21Å; L14-F85 HydrophobicContact CD1-CE1 3.84Å; L14-F85 HydrophobicContact CD1-CZ 4.49Å; L27-F85 HydrophobicContact CD1-CD2 4.47Å; L27-F85 HydrophobicContact CD1-CE1 4.15Å; L27-F85 HydrophobicContact CD1-CE2 3.88Å; L27-F85 HydrophobicContact CD1-CZ 3.69Å; L27-F85 HydrophobicContact CD2-CD2 4.43Å; L34-F85 HydrophobicContact CD2-CE2 4.04Å; F36-F85 HydrophobicContact CB-CE1 3.88Å; F36-F85 HydrophobicContact CB-CZ 3.84Å; F36-F85 HydrophobicContact CD1-CE1 4.49Å; F36-F85 HydrophobicContact CD2-CD1 4.24Å; F36-F85 AromaticContact CD2-CE1 3.54Å; F36-F85 HydrophobicContact CD2-CE1 3.54Å; F36-F85 HydrophobicContact CD2-CZ 4.32Å; F36-F85 HydrophobicContact CE2-CE1 4.16Å; F36-F85 AromaticContact CG-CE1 3.72Å; F36-F85 HydrophobicContact CG-CE1 3.72Å; F36-F85 HydrophobicContact CG-CZ 4.21Å; P72-F85 CarbonylContact C-O 3.58Å; P72-F85 WeakPolarHBondContact CA-O 3.27Å; L73-F85 HydrophobicContact CB-CB 4.39Å; L73-F85 PolarHBondContact N-O 2.77Å; L73-F85 PolarHBondContact O-N 3.34Å; I75-F85 HydrophobicContact CD1-CD2 4.09Å; I75-F85 HydrophobicContact CD1-CE2 4.1Å; V83-F85 HydrophobicContact CB-CE2 4.41Å; V83-F85 HydrophobicContact CG1-CD1 4.44Å; V83-F85 HydrophobicContact CG1-CD2 4.02Å; V83-F85 HydrophobicContact CG1-CE1 3.96Å; V83-F85 HydrophobicContact CG1-CE2 3.5Å; V83-F85 HydrophobicContact CG1-CG 4.47Å; V83-F85 HydrophobicContact CG1-CZ 3.47Å; V83-F85 VanDerWaalsContact CG1-CZ 3.47Å
86	V	94.4	Very high	91.5	Very high	17 Å²	17	44.7 Å²	44.7	10%	0.103	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	111.5	165.2	-175.6	0	0	0	0	107.5	R13 V15 S69 P72	R13-V86 HydrophobicContact CB-CB 4.34Å; R13-V86 PolarHBondContact N-O 3.22Å; R13-V86 PolarHBondContact O-N 2.96Å; V15-V86 HydrophobicContact CG2-CG2 3.83Å; S69-V86 WeakPolarHBondContact O-CG1 3.37Å; P72-V86 HydrophobicContact CB-CG2 4.5Å
87	V	93.9	Very high	91.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.5	179.8	-179.7	0	0	0	0	107.9	V9 V12 C71 R89 D92 C93 I96	V9-V87 HydrophobicContact CG1-CG1 3.93Å; V12-V87 HydrophobicContact CG1-CG2 4.22Å; V12-V87 HydrophobicContact CG2-CG2 4.21Å; C71-V87 PolarHBondContact N-O 3.14Å; C71-V87 PolarHBondContact O-N 3.14Å; V87-R89 PolarHBondContact O-N 2.8Å; V87-D92 HydrophobicContact CG1-CB 4.04Å; V87-C93 HydrophobicContact CB-CB 3.85Å; V87-C93 HydrophobicContact CG1-CB 4.02Å; V87-C93 HydrophobicContact CG2-CB 4.34Å; V87-I96 HydrophobicContact CG2-CD1 4.05Å
88	Q	91.3	Very high	91.6	Very high	97 Å²	97	45.1 Å²	45.1	45%	0.453	20%	0.198	S	C	.	.	S	Bend	trans	-60.9	-44	-173.2	-65.7	-173.3	10.9	0	0	113.1
89	R	90.8	Very high	91.7	Very high	168 Å²	168	43.3 Å²	43.3	63%	0.634	19%	0.191	S	C	*	.			trans	-97.3	129.3	-177.3	-56.7	-169.7	-170.4	132.1	-5	111.2	V87 R91 D92 C93	V87-R89 PolarHBondContact O-N 2.8Å; R89-R91 VanDerWaalsContact C-N 3.3Å; R89-R91 PolarHBondContact O-N 2.9Å; R89-D92 HydrophobicContact CB-CB 4.15Å; R89-D92 WeakPolarHBondContact CB-OD2 3.5Å; R89-D92 WeakPolarHBondContact CD-OD2 3.43Å; R89-D92 IonicContact NH1-OD2 2.73Å; R89-D92 PolarHBondContact NH1-OD2 2.96Å; R89-D92 PolarHBondContact O-N 2.96Å; R89-C93 PolarHBondContact O-N 3.27Å
90	E	91.3	Very high	91.8	Very high	92 Å²	92	43.1 Å²	43.1	43%	0.43	19%	0.19	S	C	.	.	H	α-helix	trans	-63.8	-34.4	-179.8	-172.3	-82.2	150.4	0	0	112.5	K63 L66 H94	K63-E90 IonicContact NZ-OE1 2.73Å; K63-E90 PolarHBondContact NZ-OE1 2.9Å; L66-E90 HydrophobicContact CD1-CB 4.3Å; L66-E90 HydrophobicContact CD2-CB 4.37Å; E90-H94 WeakPolarHBondContact O-CB 3.35Å; E90-H94 PolarHBondContact O-N 3.04Å
91	R	92.2	Very high	91.7	Very high	183 Å²	183	45.5 Å²	45.5	69%	0.691	20%	0.203	S	C	*	.	H	α-helix	trans	-60	-55.9	170.1	179	-179.9	176.2	174.4	-1	112.3	R89 C93 H94 D95	R89-R91 VanDerWaalsContact C-N 3.3Å; R89-R91 PolarHBondContact O-N 2.9Å; R91-C93 PolarHBondContact O-N 3.06Å; R91-H94 WeakPolarHBondContact O-CA 3.49Å; R91-H94 WeakPolarHBondContact O-CB 3.38Å; R91-H94 PolarHBondContact O-N 3.26Å; R91-D95 IonicContact NE-OD2 2.63Å; R91-D95 PolarHBondContact O-N 2.99Å
92	D	92.4	Very high	91.4	Very high	28 Å²	28	50.9 Å²	50.9	15%	0.15	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-38.5	-177.5	-57.2	-10.6	0	0	0	110.3	V9 V87 R89 D95 I96	V9-D92 HydrophobicContact CG1-CB 4.08Å; V9-D92 HydrophobicContact CG2-CB 4.19Å; V87-D92 HydrophobicContact CG1-CB 4.04Å; R89-D92 HydrophobicContact CB-CB 4.15Å; R89-D92 WeakPolarHBondContact CB-OD2 3.5Å; R89-D92 WeakPolarHBondContact CD-OD2 3.43Å; R89-D92 IonicContact NH1-OD2 2.73Å; R89-D92 PolarHBondContact NH1-OD2 2.96Å; R89-D92 PolarHBondContact O-N 2.96Å; D92-D95 PolarHBondContact O-N 3.42Å; D92-I96 WeakPolarHBondContact O-CD1 3.44Å; D92-I96 VanDerWaalsContact O-CG1 3.31Å; D92-I96 WeakPolarHBondContact O-CG1 3.49Å; D92-I96 PolarHBondContact O-N 3.46Å
93	C	92.8	Very high	91.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-42.8	172.3	-165.6	0	0	0	0	112.9	C71 V87 R89 R91 Y97	C71-C93 HydrophobicContact CB-CB 3.86Å; C71-C93 PolarHBondContact SG-SG 2.92Å; V87-C93 HydrophobicContact CB-CB 3.85Å; V87-C93 HydrophobicContact CG1-CB 4.02Å; V87-C93 HydrophobicContact CG2-CB 4.34Å; R89-C93 PolarHBondContact O-N 3.27Å; R91-C93 PolarHBondContact O-N 3.06Å; C93-Y97 VanDerWaalsContact O-CB 3.23Å; C93-Y97 WeakPolarHBondContact O-CB 3.44Å; C93-Y97 PolarHBondContact O-N 3.33Å
94	H	93.3	Very high	90.7	Very high	79 Å²	79	52.2 Å²	52.2	37%	0.366	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-42.9	175.9	-172.6	49.8	0	0	0	112	E90 R91 Y97 S98	E90-H94 WeakPolarHBondContact O-CB 3.35Å; E90-H94 PolarHBondContact O-N 3.04Å; R91-H94 WeakPolarHBondContact O-CA 3.49Å; R91-H94 WeakPolarHBondContact O-CB 3.38Å; R91-H94 PolarHBondContact O-N 3.26Å; H94-Y97 PolarHBondContact O-N 3.48Å; H94-S98 PolarHBondContact CE1-OG 3.26Å; H94-S98 WeakPolarHBondContact O-CB 3.48Å; H94-S98 PolarHBondContact O-N 3.29Å; H94-S98 PolarHBondContact O-OG 3.15Å
95	D	92.8	Very high	90.1	Very high	20 Å²	20	57.7 Å²	57.7	11%	0.107	25%	0.249	C	C	.	.	H	α-helix	trans	-68.6	-37.2	179.9	-77	-35.5	0	0	0	112	R5 T6 R91 D92 S99	R5-D95 HydrophobicContact CB-CB 3.89Å; R5-D95 WeakPolarHBondContact CD-OD1 3.32Å; R5-D95 IonicContact CZ-OD1 3.79Å; R5-D95 IonicContact NE-OD1 2.98Å; R5-D95 IonicContact NH1-OD1 3.36Å; R5-D95 PolarHBondContact NH1-OD1 3.35Å; T6-D95 WeakPolarHBondContact OG1-CB 3.35Å; R91-D95 IonicContact NE-OD2 2.63Å; R91-D95 PolarHBondContact O-N 2.99Å; D92-D95 PolarHBondContact O-N 3.42Å; D95-S99 VanDerWaalsContact O-CB 3.27Å; D95-S99 WeakPolarHBondContact O-CB 3.37Å; D95-S99 PolarHBondContact O-N 2.73Å; D95-S99 PolarHBondContact O-OG 3.07Å
96	I	92.4	Very high	89.6	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-53.3	168	-67.5	158.6	0	0	0	110.3	V9 L27 L73 V87 D92 S98 S99 L100	V9-I96 HydrophobicContact CB-CD1 4.12Å; V9-I96 HydrophobicContact CG1-CD1 4.46Å; V9-I96 HydrophobicContact CG2-CD1 3.63Å; V9-I96 HydrophobicContact CG2-CG1 4.05Å; L27-I96 HydrophobicContact CD2-CD1 3.9Å; L73-I96 HydrophobicContact CD2-CG2 3.71Å; V87-I96 HydrophobicContact CG2-CD1 4.05Å; D92-I96 WeakPolarHBondContact O-CD1 3.44Å; D92-I96 VanDerWaalsContact O-CG1 3.31Å; D92-I96 WeakPolarHBondContact O-CG1 3.49Å; D92-I96 PolarHBondContact O-N 3.46Å; I96-S98 PolarHBondContact O-N 3Å; I96-S99 PolarHBondContact O-N 3.22Å; I96-S99 VanDerWaalsContact O-N 3.17Å; I96-L100 HydrophobicContact CG2-CD1 3.78Å; I96-L100 HydrophobicContact CG2-CG 4.25Å; I96-L100 WeakPolarHBondContact O-CG 3.27Å; I96-L100 PolarHBondContact O-N 2.91Å
97	Y	93.3	Very high	89.2	Confident	64 Å²	64	61.5 Å²	61.5	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-56.2	-48.1	-177.6	173.4	-101	0	0	0	112.2	V61 K63 L73 C93 H94 L100 L101	V61-Y97 HydrophobicContact CG1-CD2 4.17Å; V61-Y97 HydrophobicContact CG1-CE2 4.12Å; V61-Y97 HydrophobicContact CG2-CD2 3.98Å; V61-Y97 HydrophobicContact CG2-CE2 4.46Å; V61-Y97 WeakPolarHBondContact O-CE2 3.45Å; K63-Y97 HydrophobicContact CB-CD2 3.73Å; K63-Y97 HydrophobicContact CB-CE2 4Å; K63-Y97 HydrophobicContact CB-CG 4.01Å; L73-Y97 HydrophobicContact CD1-CD2 4.09Å; C93-Y97 VanDerWaalsContact O-CB 3.23Å; C93-Y97 WeakPolarHBondContact O-CB 3.44Å; C93-Y97 PolarHBondContact O-N 3.33Å; H94-Y97 PolarHBondContact O-N 3.48Å; Y97-L100 PolarHBondContact O-N 3.24Å; Y97-L101 HydrophobicContact CD1-CD1 4.06Å; Y97-L101 HydrophobicContact CE1-CD1 3.43Å; Y97-L101 VanDerWaalsContact CE1-CD1 3.43Å; Y97-L101 HydrophobicContact CE1-CG 4.26Å; Y97-L101 HydrophobicContact CE2-CD1 4.21Å; Y97-L101 HydrophobicContact CE2-CG 4.29Å; Y97-L101 WeakPolarHBondContact O-CG 3.47Å; Y97-L101 PolarHBondContact O-N 2.84Å
98	S	91.6	Very high	89	Confident	29 Å²	29	66.7 Å²	66.7	20%	0.203	30%	0.296	C	S	.	.	H	α-helix	trans	-67.1	-35.2	177.7	-65.9	0	0	0	0	113.1	H94 I96 R102	H94-S98 PolarHBondContact CE1-OG 3.26Å; H94-S98 WeakPolarHBondContact O-CB 3.48Å; H94-S98 PolarHBondContact O-N 3.29Å; H94-S98 PolarHBondContact O-OG 3.15Å; I96-S98 PolarHBondContact O-N 3Å; S98-R102 PolarHBondContact O-N 3.31Å
99	S	91.2	Very high	88.9	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-68.3	-44.8	175.5	-56.1	0	0	0	0	110.7	H3 R5 D95 I96 R102 L103	H3-S99 WeakPolarHBondContact O-CB 3.37Å; H3-S99 PolarHBondContact O-OG 3.24Å; R5-S99 PolarHBondContact N-OG 3.43Å; R5-S99 VanDerWaalsContact N-OG 3.1Å; D95-S99 VanDerWaalsContact O-CB 3.27Å; D95-S99 WeakPolarHBondContact O-CB 3.37Å; D95-S99 PolarHBondContact O-N 2.73Å; D95-S99 PolarHBondContact O-OG 3.07Å; I96-S99 PolarHBondContact O-N 3.22Å; I96-S99 VanDerWaalsContact O-N 3.17Å; S99-R102 PolarHBondContact O-N 2.7Å; S99-L103 VanDerWaalsContact O-CG 3.31Å; S99-L103 WeakPolarHBondContact O-CG 3.3Å; S99-L103 PolarHBondContact O-N 3.26Å; S99-L103 VanDerWaalsContact O-N 3.13Å
100	L	90.7	Very high	89	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-55.1	174.9	-74.1	174.3	0	0	0	110.9	L29 I58 V61 I75 I96 Y97 R102 L103 L104	L29-L100 HydrophobicContact CD1-CD2 3.82Å; I58-L100 HydrophobicContact CD1-CD2 4.13Å; V61-L100 HydrophobicContact CG1-CB 4.43Å; V61-L100 HydrophobicContact CG2-CD1 4.09Å; I75-L100 HydrophobicContact CD1-CD1 4.03Å; I96-L100 HydrophobicContact CG2-CD1 3.78Å; I96-L100 HydrophobicContact CG2-CG 4.25Å; I96-L100 WeakPolarHBondContact O-CG 3.27Å; I96-L100 PolarHBondContact O-N 2.91Å; Y97-L100 PolarHBondContact O-N 3.24Å; L100-R102 CarbonylContact O-C 3.47Å; L100-R102 PolarHBondContact O-N 3.43Å; L100-L103 CarbonylContact O-C 3.54Å; L100-L103 WeakPolarHBondContact O-CA 3.41Å; L100-L103 PolarHBondContact O-N 3.31Å; L100-L104 VanDerWaalsContact O-CG 3.23Å; L100-L104 WeakPolarHBondContact O-CG 3.24Å; L100-L104 PolarHBondContact O-N 3.28Å
101	L	88.1	Confident	88.8	Confident	67 Å²	67	59.8 Å²	59.8	35%	0.351	27%	0.27	S	S	.	.	H	α-helix	trans	-50	-31.5	-179.5	-79.9	-176.6	0	0	0	114.4	V61 Y97	V61-L101 HydrophobicContact CG1-CD2 3.77Å; V61-L101 HydrophobicContact CG1-CG 4.18Å; Y97-L101 HydrophobicContact CD1-CD1 4.06Å; Y97-L101 HydrophobicContact CE1-CD1 3.43Å; Y97-L101 VanDerWaalsContact CE1-CD1 3.43Å; Y97-L101 HydrophobicContact CE1-CG 4.26Å; Y97-L101 HydrophobicContact CE2-CD1 4.21Å; Y97-L101 HydrophobicContact CE2-CG 4.29Å; Y97-L101 WeakPolarHBondContact O-CG 3.47Å; Y97-L101 PolarHBondContact O-N 2.84Å
102	R	82.7	Confident	88.8	Confident	156 Å²	156	51.1 Å²	51.1	59%	0.589	24%	0.238	S	C	*	.	H	α-helix	trans	-80.2	-37.9	175.2	-173.4	164.8	178.1	128.9	2.7	113.3	H3 S98 S99 L100 L104	H3-R102 HydrophobicContact CB-CG 4.32Å; H3-R102 PolarHBondContact CD2-NE 3.46Å; H3-R102 VanDerWaalsContact CE1-CZ 3.49Å; H3-R102 PolarHBondContact CE1-NE 3.02Å; H3-R102 VanDerWaalsContact CE1-NE 3.29Å; H3-R102 PolarHBondContact CE1-NH2 3.48Å; H3-R102 VanDerWaalsContact CG-NE 3.26Å; H3-R102 PolarHBondContact ND1-NE 3.34Å; H3-R102 PolarHBondContact NE2-NE 3.04Å; H3-R102 PolarHBondContact NE2-NH2 2.95Å; H3-R102 VanDerWaalsContact NE2-NH2 3.15Å; S98-R102 PolarHBondContact O-N 3.31Å; S99-R102 PolarHBondContact O-N 2.7Å; L100-R102 CarbonylContact O-C 3.47Å; L100-R102 PolarHBondContact O-N 3.43Å; R102-L104 VanDerWaalsContact C-N 3.29Å
103	L	82.1	Confident	88.6	Confident	36 Å²	36	51.5 Å²	51.5	19%	0.188	24%	0.237	C	C	.	.	H	α-helix	trans	-73.3	-19	176.3	-66.4	166.6	0	0	0	113.2	I4 L29 S99 L100	I4-L103 HydrophobicContact CG1-CD1 4.18Å; L29-L103 HydrophobicContact CD1-CD1 4.17Å; L29-L103 HydrophobicContact CD2-CD1 4.48Å; L29-L103 HydrophobicContact CG-CD1 4.47Å; S99-L103 VanDerWaalsContact O-CG 3.31Å; S99-L103 WeakPolarHBondContact O-CG 3.3Å; S99-L103 PolarHBondContact O-N 3.26Å; S99-L103 VanDerWaalsContact O-N 3.13Å; L100-L103 CarbonylContact O-C 3.54Å; L100-L103 WeakPolarHBondContact O-CA 3.41Å; L100-L103 PolarHBondContact O-N 3.31Å
104	L	83.3	Confident	88.7	Confident	27 Å²	27	51.6 Å²	51.6	14%	0.141	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-5.3	179.4	-63.7	-177.7	0	0	0	114.9	H55 I58 V61 L100 R102 P106	H55-L104 HydrophobicContact CB-CD2 4.23Å; H55-L104 WeakPolarHBondContact O-CD2 3.32Å; I58-L104 HydrophobicContact CB-CD1 4.29Å; I58-L104 HydrophobicContact CB-CD2 3.56Å; I58-L104 HydrophobicContact CD1-CD2 4.25Å; I58-L104 HydrophobicContact CG1-CD2 4.4Å; I58-L104 HydrophobicContact CG2-CD1 3.61Å; I58-L104 HydrophobicContact CG2-CD2 3.87Å; I58-L104 HydrophobicContact CG2-CG 4.39Å; V61-L104 HydrophobicContact CB-CD1 4.44Å; V61-L104 HydrophobicContact CG1-CD1 3.87Å; L100-L104 VanDerWaalsContact O-CG 3.23Å; L100-L104 WeakPolarHBondContact O-CG 3.24Å; L100-L104 PolarHBondContact O-N 3.28Å; R102-L104 VanDerWaalsContact C-N 3.29Å; L104-P106 WeakPolarHBondContact O-CD 3.4Å
105	R	78.7	Confident	88.7	Confident	144 Å²	144	49.8 Å²	49.8	54%	0.543	23%	0.229	S	C	.	.			trans	-120.9	69.6	-179.3	-63.9	-169.3	-176.2	-146.8	3.9	111.7	V107 D393	R105-V107 PolarHBondContact O-N 2.83Å; R105-D393 IonicContact NH1-OD1 3.95Å; R105-D393 PolarHBondContact NH1-OD1 2.73Å; R105-D393 IonicContact NH1-OD2 3.28Å; R105-D393 PolarHBondContact NH1-OD2 3.49Å
106	P	83.3	Confident	88.6	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.071	25%	0.25	C	C	.	.			trans	-61.8	131.6	168.2	28.5	-33.9	0	0	0	109.4	L104 E111 L112 Q391 L392 D393	L104-P106 WeakPolarHBondContact O-CD 3.4Å; P106-E111 WeakPolarHBondContact CA-OE2 3.29Å; P106-E111 HydrophobicContact CB-CB 4.01Å; P106-L112 HydrophobicContact CB-CD2 3.88Å; P106-L112 HydrophobicContact CG-CD2 3.68Å; P106-Q391 VanDerWaalsContact CG-O 3.28Å; P106-Q391 WeakPolarHBondContact CG-O 3.39Å; P106-L392 HydrophobicContact CB-CD2 4Å; P106-L392 HydrophobicContact CG-CD2 4.12Å; P106-L392 WeakPolarHBondContact O-CA 3.35Å; P106-L392 WeakPolarHBondContact O-CD2 3.25Å; P106-D393 PolarHBondContact O-N 3.48Å
107	V	84.8	Confident	88.5	Confident	88 Å²	88	54.4 Å²	54.4	53%	0.533	26%	0.257	S	S	.	.			trans	-96.9	-29.6	178	-178.5	0	0	0	0	110.4	R105 E111	R105-V107 PolarHBondContact O-N 2.83Å; V107-E111 PolarHBondContact N-OE2 2.89Å
108	H	89.4	Confident	88.2	Confident	109 Å²	109	56.8 Å²	56.8	51%	0.505	27%	0.274	S	S	.	.	S	Bend	trans	-118.8	148	-178.2	-60.2	-63.7	0	0	0	111.4	E110 E111	H108-E110 HydrophobicContact CB-CB 4.49Å; H108-E110 PolarHBondContact O-N 3.39Å; H108-E111 HydrophobicContact CB-CG 4.35Å; H108-E111 IonicContact CD2-OE1 3.83Å; H108-E111 WeakPolarHBondContact O-CB 3.41Å; H108-E111 PolarHBondContact O-N 2.78Å; H108-E111 VanDerWaalsContact O-N 3.11Å
109	Y	90.8	Very high	88.1	Confident	22 Å²	22	57.5 Å²	57.5	9%	0.086	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-61	-34.3	178.2	-77.7	-80	0	0	0	111.7	E111 L112 F115 A386 L392 L454	Y109-E111 PolarHBondContact O-N 2.96Å; Y109-E111 VanDerWaalsContact O-N 3.1Å; Y109-L112 HydrophobicContact CD1-CD1 3.73Å; Y109-L112 HydrophobicContact CE1-CD1 4.4Å; Y109-L112 VanDerWaalsContact O-CB 3.22Å; Y109-L112 WeakPolarHBondContact O-CB 3.42Å; Y109-L112 VanDerWaalsContact O-CG 3.29Å; Y109-L112 WeakPolarHBondContact O-CG 3.19Å; Y109-L112 PolarHBondContact O-N 3.46Å; Y109-F115 WeakPolarHBondContact O-CD2 3.44Å; Y109-F115 WeakPolarHBondContact O-CE2 3.36Å; Y109-A386 HydrophobicContact CE1-CB 4.28Å; Y109-A386 WeakPolarHBondContact OH-CB 3.45Å; Y109-L392 HydrophobicContact CD1-CD1 4.29Å; Y109-L392 HydrophobicContact CD2-CD1 3.84Å; Y109-L392 HydrophobicContact CE1-CD1 3.96Å; Y109-L392 HydrophobicContact CE1-CG 4.44Å; Y109-L392 HydrophobicContact CE2-CD1 3.47Å; Y109-L392 VanDerWaalsContact CE2-CD1 3.47Å; Y109-L392 HydrophobicContact CG-CD1 4.23Å; Y109-L454 HydrophobicContact CD1-CD1 4.01Å; Y109-L454 HydrophobicContact CD2-CD1 3.69Å; Y109-L454 HydrophobicContact CD2-CD2 3.97Å; Y109-L454 HydrophobicContact CD2-CG 4.46Å; Y109-L454 HydrophobicContact CE1-CD1 4.4Å; Y109-L454 HydrophobicContact CE2-CD1 4.11Å; Y109-L454 HydrophobicContact CG-CD1 3.65Å; Y109-L454 HydrophobicContact CG-CD2 4.14Å
110	E	90.9	Very high	88	Confident	90 Å²	90	66.5 Å²	66.5	42%	0.421	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-52.2	-26.4	173.8	-76.3	58.6	-141.1	0	0	114.6	H108 L112 R459	H108-E110 HydrophobicContact CB-CB 4.49Å; H108-E110 PolarHBondContact O-N 3.39Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-R459 IonicContact OE1-CZ 3.96Å; E110-R459 IonicContact OE1-NH1 3.03Å; E110-R459 PolarHBondContact OE1-NH1 2.75Å; E110-R459 IonicContact OE1-NH2 3.92Å; E110-R459 PolarHBondContact OE1-NH2 2.85Å
111	E	88.7	Confident	87.9	Confident	100 Å²	100	70 Å²	70	47%	0.467	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-83.1	-10.9	-179.9	-62.3	167.7	-174.8	0	0	112.1	P106 V107 H108 Y109	P106-E111 WeakPolarHBondContact CA-OE2 3.29Å; P106-E111 HydrophobicContact CB-CB 4.01Å; V107-E111 PolarHBondContact N-OE2 2.89Å; H108-E111 HydrophobicContact CB-CG 4.35Å; H108-E111 IonicContact CD2-OE1 3.83Å; H108-E111 WeakPolarHBondContact O-CB 3.41Å; H108-E111 PolarHBondContact O-N 2.78Å; H108-E111 VanDerWaalsContact O-N 3.11Å; Y109-E111 PolarHBondContact O-N 2.96Å; Y109-E111 VanDerWaalsContact O-N 3.1Å
112	L	90.6	Very high	88	Confident	0 Å²	0	71 Å²	71	0%	0	34%	0.339	C	S	.	.	S	Bend	trans	-75	145.3	178.7	-56.9	-178.9	0	0	0	111.9	H56 P106 Y109 E110 A114 F115 Q391 L392 C438 L444	H56-L112 VanDerWaalsContact CE1-CD2 3.49Å; H56-L112 WeakPolarHBondContact CE1-CD2 3.21Å; P106-L112 HydrophobicContact CB-CD2 3.88Å; P106-L112 HydrophobicContact CG-CD2 3.68Å; Y109-L112 HydrophobicContact CD1-CD1 3.73Å; Y109-L112 HydrophobicContact CE1-CD1 4.4Å; Y109-L112 VanDerWaalsContact O-CB 3.22Å; Y109-L112 WeakPolarHBondContact O-CB 3.42Å; Y109-L112 VanDerWaalsContact O-CG 3.29Å; Y109-L112 WeakPolarHBondContact O-CG 3.19Å; Y109-L112 PolarHBondContact O-N 3.46Å; E110-L112 VanDerWaalsContact C-N 3.31Å; L112-A114 PolarHBondContact O-N 3.26Å; L112-F115 HydrophobicContact CB-CD2 4.41Å; L112-F115 PolarHBondContact O-N 3.06Å; L112-F115 VanDerWaalsContact O-N 3.09Å; L112-Q391 WeakPolarHBondContact CD2-O 3.18Å; L112-L392 HydrophobicContact CD2-CD2 4.29Å; L112-C438 HydrophobicContact CB-CB 4.35Å; L112-L444 HydrophobicContact CD1-CD1 4.21Å; L112-L444 HydrophobicContact CD1-CD2 3.74Å
113	Y	90.3	Very high	88.3	Confident	37 Å²	37	68.7 Å²	68.7	15%	0.145	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-52.2	-35.6	-175.6	-177.7	-145	0	0	0	113.9	T32 H33 L54 H56 F115 S116 Y117 C438 Q439	T32-Y113 HydrophobicContact CG2-CD2 3.77Å; T32-Y113 HydrophobicContact CG2-CE2 4.13Å; H33-Y113 AromaticContact CE1-CZ 3.92Å; L54-Y113 HydrophobicContact CD2-CD1 3.58Å; L54-Y113 HydrophobicContact CD2-CE1 3.83Å; H56-Y113 PolarHBondContact NE2-N 3.07Å; Y113-F115 PolarHBondContact O-N 3.41Å; Y113-F115 VanDerWaalsContact O-N 3.07Å; Y113-S116 CarbonylContact O-C 3.49Å; Y113-S116 PolarHBondContact O-N 2.72Å; Y113-S116 PolarHBondContact O-OG 3.46Å; Y113-S116 VanDerWaalsContact O-OG 3.11Å; Y113-Y117 HydrophobicContact CE1-CD2 4.25Å; Y113-Y117 HydrophobicContact CE2-CD2 4.23Å; Y113-Y117 AromaticContact CZ-CD2 3.76Å; Y113-Y117 WeakPolarHBondContact O-CB 3.33Å; Y113-Y117 PolarHBondContact O-N 2.9Å; Y113-C438 CarbonylContact C-O 3.42Å; Y113-Q439 HydrophobicContact CD1-CB 3.81Å; Y113-Q439 HydrophobicContact CD1-CG 3.96Å; Y113-Q439 HydrophobicContact CE1-CB 4.06Å; Y113-Q439 HydrophobicContact CE1-CG 3.72Å
114	A	93.6	Very high	88.7	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.008	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-54.6	-28.9	179.3	0	0	0	0	0	115.1	L112 C438 Q439 L444 T460	L112-A114 PolarHBondContact O-N 3.26Å; A114-C438 WeakPolarHBondContact CA-O 3.47Å; A114-C438 VanDerWaalsContact CB-O 3.3Å; A114-C438 WeakPolarHBondContact CB-O 3.47Å; A114-C438 PolarHBondContact N-O 3.37Å; A114-Q439 WeakPolarHBondContact CA-O 3.41Å; A114-L444 HydrophobicContact CB-CD1 3.75Å; A114-T460 HydrophobicContact CB-CG2 3.91Å
115	F	92.8	Very high	89.1	Confident	41 Å²	41	75.3 Å²	75.3	18%	0.18	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-85.3	-11.8	178	-67	-89.1	0	0	0	113.5	Y109 L112 Y113 L444 L456 R459 T460	Y109-F115 WeakPolarHBondContact O-CD2 3.44Å; Y109-F115 WeakPolarHBondContact O-CE2 3.36Å; L112-F115 HydrophobicContact CB-CD2 4.41Å; L112-F115 PolarHBondContact O-N 3.06Å; L112-F115 VanDerWaalsContact O-N 3.09Å; Y113-F115 PolarHBondContact O-N 3.41Å; Y113-F115 VanDerWaalsContact O-N 3.07Å; F115-L444 HydrophobicContact CE2-CD1 4.01Å; F115-L456 HydrophobicContact CE1-CD2 4Å; F115-L456 HydrophobicContact CE2-CD2 4.15Å; F115-L456 HydrophobicContact CZ-CD2 3.39Å; F115-R459 HydrophobicContact CD1-CB 3.96Å; F115-R459 HydrophobicContact CE1-CB 3.97Å; F115-T460 HydrophobicContact CD1-CG2 3.84Å; F115-T460 HydrophobicContact CD2-CG2 4.23Å; F115-T460 HydrophobicContact CE1-CG2 3.85Å; F115-T460 HydrophobicContact CE2-CG2 4.24Å; F115-T460 HydrophobicContact CG-CG2 4.06Å; F115-T460 HydrophobicContact CZ-CG2 4.07Å
116	S	90.8	Very high	89.8	Confident	78 Å²	78	70.5 Å²	70.5	55%	0.545	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-8.8	174.5	57.6	0	0	0	0	113.3	Y113 N118	Y113-S116 CarbonylContact O-C 3.49Å; Y113-S116 PolarHBondContact O-N 2.72Å; Y113-S116 PolarHBondContact O-OG 3.46Å; Y113-S116 VanDerWaalsContact O-OG 3.11Å; S116-N118 PolarHBondContact O-N 2.91Å
117	Y	91.2	Very high	90.3	Very high	42 Å²	42	74.9 Å²	74.9	17%	0.165	37%	0.369	C	S	.	.			trans	-71.5	118.6	176.9	176.9	-118.9	0	0	0	110.7	Y113 P119 Q439 Y440 H461	Y113-Y117 HydrophobicContact CE1-CD2 4.25Å; Y113-Y117 HydrophobicContact CE2-CD2 4.23Å; Y113-Y117 AromaticContact CZ-CD2 3.76Å; Y113-Y117 WeakPolarHBondContact O-CB 3.33Å; Y113-Y117 PolarHBondContact O-N 2.9Å; Y117-P119 HydrophobicContact CE1-CB 4.13Å; Y117-P119 HydrophobicContact CE1-CG 3.98Å; Y117-Q439 HydrophobicContact CD1-CG 3.97Å; Y117-Q439 WeakPolarHBondContact CD1-O 3.28Å; Y117-Q439 HydrophobicContact CD2-CG 4.07Å; Y117-Q439 HydrophobicContact CE1-CG 4.13Å; Y117-Q439 HydrophobicContact CE2-CG 4.24Å; Y117-Q439 VanDerWaalsContact CE2-NE2 3.27Å; Y117-Q439 HydrophobicContact CG-CG 3.94Å; Y117-Q439 VanDerWaalsContact CZ-NE2 3.26Å; Y117-Q439 PolarHBondContact OH-NE2 3.17Å; Y117-Y440 HydrophobicContact CD1-CE1 4.45Å; Y117-Y440 HydrophobicContact CE1-CD1 4.32Å; Y117-Y440 AromaticContact CE1-CE1 3.71Å; Y117-Y440 HydrophobicContact CE1-CE1 3.71Å; Y117-H461 HydrophobicContact CD1-CB 4.38Å; Y117-H461 HydrophobicContact CE1-CB 4.41Å
118	N	87.4	Confident	90.6	Very high	114 Å²	114	75.4 Å²	75.4	61%	0.61	37%	0.366	S	S	*	.			trans	-126.5	99.8	179.1	-173.9	-19.8	0	0	0	110.3	S116 K120	S116-N118 PolarHBondContact O-N 2.91Å; N118-K120 PolarHBondContact O-N 2.75Å; N118-K120 WeakPolarHBondContact OD1-CA 3.42Å; N118-K120 PolarHBondContact OD1-N 2.83Å
119	P	89.6	Confident	90.8	Very high	43 Å²	43	70.6 Å²	70.6	28%	0.279	35%	0.345	S	S	.	.			trans	-76.1	10.2	175.8	30.8	-33.6	0	0	0	114	Y117 Q121 H461	Y117-P119 HydrophobicContact CE1-CB 4.13Å; Y117-P119 HydrophobicContact CE1-CG 3.98Å; P119-Q121 HydrophobicContact CB-CG 4.31Å; P119-Q121 HydrophobicContact CG-CB 4.21Å; P119-Q121 HydrophobicContact CG-CG 3.93Å; P119-Q121 PolarHBondContact O-N 3.47Å; P119-H461 WeakPolarHBondContact CD-NE2 3.21Å; P119-H461 WeakPolarHBondContact CG-ND1 3.45Å
120	K	89.3	Confident	91	Very high	190 Å²	190	70.9 Å²	70.9	83%	0.826	35%	0.347	S	S	*	.	S	Bend	trans	61.2	24.5	-172.3	-49.8	178.7	-176.4	175.4	0	114.4	N118	N118-K120 PolarHBondContact O-N 2.75Å; N118-K120 WeakPolarHBondContact OD1-CA 3.42Å; N118-K120 PolarHBondContact OD1-N 2.83Å
121	Q	87.1	Confident	91.2	Very high	73 Å²	73	72.4 Å²	72.4	34%	0.341	35%	0.354	S	S	.	.			trans	-76.6	148.5	169	-71.2	173.9	-21.3	0	0	110.1	P119 Q125 H461	P119-Q121 HydrophobicContact CB-CG 4.31Å; P119-Q121 HydrophobicContact CG-CB 4.21Å; P119-Q121 HydrophobicContact CG-CG 3.93Å; P119-Q121 PolarHBondContact O-N 3.47Å; Q121-Q125 HydrophobicContact CB-CB 4.13Å; Q121-Q125 HydrophobicContact CG-CB 4.41Å; Q121-H461 PolarHBondContact OE1-CE1 3.23Å; Q121-H461 PolarHBondContact OE1-ND1 3.22Å
122	N	90.3	Very high	91.5	Very high	88 Å²	88	69.9 Å²	69.9	47%	0.471	34%	0.343	S	S	.	.			trans	-80.3	169.5	169.4	65.9	27	0	0	0	111.2	Q124 Q125 R126	N122-Q124 VanDerWaalsContact C-N 3.29Å; N122-Q124 PolarHBondContact O-N 3.36Å; N122-Q124 WeakPolarHBondContact OD1-CB 3.47Å; N122-Q124 PolarHBondContact OD1-N 2.94Å; N122-Q125 VanDerWaalsContact N-OE1 3.09Å; N122-Q125 PolarHBondContact O-N 2.92Å; N122-Q125 WeakPolarHBondContact OD1-CB 3.5Å; N122-Q125 WeakPolarHBondContact OD1-CG 3.3Å; N122-Q125 PolarHBondContact OD1-N 2.83Å; N122-Q125 PolarHBondContact OD1-OE1 3.19Å; N122-R126 PolarHBondContact O-N 2.99Å; N122-R126 VanDerWaalsContact O-N 3.13Å
123	D	89.6	Confident	91.7	Very high	108 Å²	108	70.8 Å²	70.8	58%	0.578	35%	0.348	S	S	*	.	H	α-helix	trans	-60.4	-38	-177.3	-62.9	-55.3	0	0	0	112.7	R126 E127	D123-R126 WeakPolarHBondContact O-CB 3.41Å; D123-R126 PolarHBondContact O-N 3.26Å; D123-R126 IonicContact OD1-CZ 2.63Å; D123-R126 IonicContact OD1-NH1 3.88Å; D123-R126 PolarHBondContact OD1-NH1 3.4Å; D123-R126 IonicContact OD1-NH2 2.73Å; D123-R126 PolarHBondContact OD1-NH2 2.96Å; D123-E127 PolarHBondContact O-N 3.4Å
124	Q	91.1	Very high	92	Very high	113 Å²	113	73.7 Å²	73.7	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-49.5	176.9	-178.6	72.4	40	0	0	111.7	N122 R126 E127 E128	N122-Q124 VanDerWaalsContact C-N 3.29Å; N122-Q124 PolarHBondContact O-N 3.36Å; N122-Q124 WeakPolarHBondContact OD1-CB 3.47Å; N122-Q124 PolarHBondContact OD1-N 2.94Å; Q124-R126 VanDerWaalsContact C-N 3.32Å; Q124-R126 PolarHBondContact O-N 3.19Å; Q124-E127 PolarHBondContact O-N 2.82Å; Q124-E128 WeakPolarHBondContact CG-OE1 3.42Å; Q124-E128 PolarHBondContact NE2-OE1 2.87Å; Q124-E128 WeakPolarHBondContact O-CG 3.12Å; Q124-E128 PolarHBondContact O-N 2.86Å
125	Q	91.1	Very high	92.1	Very high	89 Å²	89	75.6 Å²	75.6	42%	0.416	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-35.6	177.5	-74.3	168.6	-28	0	0	112.4	Q121 N122 G129	Q121-Q125 HydrophobicContact CB-CB 4.13Å; Q121-Q125 HydrophobicContact CG-CB 4.41Å; N122-Q125 VanDerWaalsContact N-OE1 3.09Å; N122-Q125 PolarHBondContact O-N 2.92Å; N122-Q125 WeakPolarHBondContact OD1-CB 3.5Å; N122-Q125 WeakPolarHBondContact OD1-CG 3.3Å; N122-Q125 PolarHBondContact OD1-N 2.83Å; N122-Q125 PolarHBondContact OD1-OE1 3.19Å; Q125-G129 PolarHBondContact O-N 3.13Å
126	R	93.4	Very high	92.2	Very high	43 Å²	43	74.8 Å²	74.8	16%	0.162	38%	0.379	C	S	.	.	H	α-helix	trans	-64.5	-45.5	174.4	-175.1	179.9	66.9	-113.5	-6.7	110.4	N122 D123 Q124 G129 W130 E458 T460	N122-R126 PolarHBondContact O-N 2.99Å; N122-R126 VanDerWaalsContact O-N 3.13Å; D123-R126 WeakPolarHBondContact O-CB 3.41Å; D123-R126 PolarHBondContact O-N 3.26Å; D123-R126 IonicContact OD1-CZ 2.63Å; D123-R126 IonicContact OD1-NH1 3.88Å; D123-R126 PolarHBondContact OD1-NH1 3.4Å; D123-R126 IonicContact OD1-NH2 2.73Å; D123-R126 PolarHBondContact OD1-NH2 2.96Å; Q124-R126 VanDerWaalsContact C-N 3.32Å; Q124-R126 PolarHBondContact O-N 3.19Å; R126-G129 PolarHBondContact O-N 3.3Å; R126-W130 PolarHBondContact O-N 2.97Å; R126-E458 PolarHBondContact NE-O 2.83Å; R126-E458 PolarHBondContact NH2-O 2.68Å; R126-T460 WeakPolarHBondContact CD-O 3.48Å
127	E	93.3	Very high	92.5	Very high	103 Å²	103	73.2 Å²	73.2	48%	0.481	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-48.8	177.6	-178.3	169.5	-167	0	0	112	D123 Q124 G129 W130 Q131	D123-E127 PolarHBondContact O-N 3.4Å; Q124-E127 PolarHBondContact O-N 2.82Å; E127-G129 PolarHBondContact O-N 3.04Å; E127-W130 CarbonylContact O-C 3.48Å; E127-W130 WeakPolarHBondContact O-CA 3.35Å; E127-W130 PolarHBondContact O-N 3.32Å; E127-Q131 HydrophobicContact CG-CG 4.19Å; E127-Q131 WeakPolarHBondContact O-CG 3.44Å; E127-Q131 PolarHBondContact O-N 2.83Å; E127-Q131 PolarHBondContact OE1-NE2 2.8Å
128	E	92.8	Very high	92.8	Very high	99 Å²	99	71.4 Å²	71.4	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-54.8	-39.1	174.6	-73.9	167.4	-168.6	0	0	112	Q124 W130 Q131 L132	Q124-E128 WeakPolarHBondContact CG-OE1 3.42Å; Q124-E128 PolarHBondContact NE2-OE1 2.87Å; Q124-E128 WeakPolarHBondContact O-CG 3.12Å; Q124-E128 PolarHBondContact O-N 2.86Å; E128-W130 VanDerWaalsContact C-N 3.29Å; E128-W130 PolarHBondContact O-N 2.79Å; E128-Q131 PolarHBondContact O-N 3.18Å; E128-L132 PolarHBondContact O-N 2.98Å
129	G	93.2	Very high	93.2	Very high	8 Å²	8	66.5 Å²	66.5	8%	0.082	34%	0.337	C	S	.	.	H	α-helix	trans	-64.5	-27.2	175.2	0	0	0	0	0	114.9	Q125 R126 E127 S462	Q125-G129 PolarHBondContact O-N 3.13Å; R126-G129 PolarHBondContact O-N 3.3Å; E127-G129 PolarHBondContact O-N 3.04Å; G129-S462 WeakPolarHBondContact O-CB 3.36Å; G129-S462 PolarHBondContact O-OG 2.96Å
130	W	95	Very high	93.6	Very high	29 Å²	29	71 Å²	71	11%	0.11	35%	0.354	C	S	.	.	H	α-helix	trans	-86.8	-30.4	172.6	-73.5	112.6	0	0	0	112.9	R126 E127 E128 L132 N442 R457 T460	R126-W130 PolarHBondContact O-N 2.97Å; E127-W130 CarbonylContact O-C 3.48Å; E127-W130 WeakPolarHBondContact O-CA 3.35Å; E127-W130 PolarHBondContact O-N 3.32Å; E128-W130 VanDerWaalsContact C-N 3.29Å; E128-W130 PolarHBondContact O-N 2.79Å; W130-L132 VanDerWaalsContact C-N 3.31Å; W130-N442 VanDerWaalsContact CZ3-ND2 3.27Å; W130-N442 WeakPolarHBondContact CZ3-ND2 3.3Å; W130-R457 HydrophobicContact CB-CG 4.31Å; W130-R457 VanDerWaalsContact CD1-O 3.27Å; W130-R457 HydrophobicContact CD2-CB 4.43Å; W130-R457 HydrophobicContact CD2-CG 3.99Å; W130-R457 HydrophobicContact CE3-CG 4.24Å; W130-R457 HydrophobicContact CG-CB 4.16Å; W130-R457 HydrophobicContact CG-CG 4.02Å; W130-R457 PolarHBondContact NE1-O 3.32Å; W130-T460 PolarHBondContact NE1-O 3.12Å
131	Q	95	Very high	94	Very high	122 Å²	122	65.8 Å²	65.8	57%	0.57	33%	0.329	S	S	*	.	H	α-helix	trans	-78.3	-10.3	176.9	-66.7	-176	6.6	0	0	113.8	E127 E128 I133	E127-Q131 HydrophobicContact CG-CG 4.19Å; E127-Q131 WeakPolarHBondContact O-CG 3.44Å; E127-Q131 PolarHBondContact O-N 2.83Å; E127-Q131 PolarHBondContact OE1-NE2 2.8Å; E128-Q131 PolarHBondContact O-N 3.18Å; Q131-I133 PolarHBondContact O-N 3.03Å
132	L	94.1	Very high	94.4	Very high	46 Å²	46	62.5 Å²	62.5	24%	0.241	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-30.4	178.1	179.4	67	0	0	0	114.3	E128 W130 K368 W464 M468	E128-L132 PolarHBondContact O-N 2.98Å; W130-L132 VanDerWaalsContact C-N 3.31Å; L132-K368 WeakPolarHBondContact O-CE 3.41Å; L132-K368 PolarHBondContact O-NZ 2.92Å; L132-W464 HydrophobicContact CD2-CB 3.7Å; L132-M468 HydrophobicContact CD2-CB 4.44Å; L132-M468 HydrophobicContact CD2-CG 3.76Å
133	I	96.1	Very high	94.7	Very high	19 Å²	19	59.7 Å²	59.7	10%	0.097	31%	0.306	C	S	.	.			trans	-120.2	113.6	179.2	-67.1	171.5	0	0	0	109.1	Q131 L135 M371 V372 E375 W464	Q131-I133 PolarHBondContact O-N 3.03Å; I133-L135 HydrophobicContact CG2-CD2 4.13Å; I133-M371 HydrophobicContact CD1-CB 3.6Å; I133-V372 HydrophobicContact CB-CG2 4.49Å; I133-V372 HydrophobicContact CD1-CG2 4.28Å; I133-V372 HydrophobicContact CG1-CG2 3.95Å; I133-V372 HydrophobicContact CG2-CG2 3.95Å; I133-E375 HydrophobicContact CD1-CG 3.8Å; I133-E375 HydrophobicContact CG2-CB 4.03Å; I133-E375 HydrophobicContact CG2-CG 4.14Å; I133-W464 HydrophobicContact CD1-CB 4.48Å; I133-W464 VanDerWaalsContact CD1-CD1 3.5Å; I133-W464 HydrophobicContact CD1-CG 3.94Å
134	D	95.3	Very high	95	Very high	99 Å²	99	54.7 Å²	54.7	53%	0.529	28%	0.279	S	S	.	.			trans	-104.2	127.1	165.3	176.6	26.8	0	0	0	109.5	G136 A137 E138	D134-G136 PolarHBondContact OD1-N 3.22Å; D134-A137 HydrophobicContact CB-CB 4.12Å; D134-A137 WeakPolarHBondContact OD2-CB 3.37Å; D134-A137 PolarHBondContact OD2-N 3.48Å; D134-E138 PolarHBondContact O-N 3.28Å
135	L	95.2	Very high	95.3	Very high	40 Å²	40	53 Å²	53	21%	0.209	28%	0.278	C	S	.	.	H	α-helix	trans	-81.4	-22.9	175.9	-62.9	-177.3	0	0	0	111.9	I133 E138 F139 E375 K376	I133-L135 HydrophobicContact CG2-CD2 4.13Å; L135-E138 PolarHBondContact O-N 2.82Å; L135-F139 WeakPolarHBondContact O-CD2 3.49Å; L135-F139 PolarHBondContact O-N 3.01Å; L135-E375 HydrophobicContact CD2-CB 4.27Å; L135-K376 HydrophobicContact CD2-CB 4Å
136	G	95.5	Very high	95.5	Very high	24 Å²	24	50.9 Å²	50.9	25%	0.247	27%	0.27	C	S	.	.	H	α-helix	trans	-60.7	-58	171.5	0	0	0	0	0	110.6	D134 E138 F139 E140	D134-G136 PolarHBondContact OD1-N 3.22Å; G136-E138 PolarHBondContact O-N 2.91Å; G136-E138 VanDerWaalsContact O-N 3.11Å; G136-F139 PolarHBondContact O-N 3.29Å; G136-E140 PolarHBondContact O-N 2.82Å
137	A	96.6	Very high	95.6	Very high	45 Å²	45	55.9 Å²	55.9	37%	0.372	30%	0.3	S	S	.	.	H	α-helix	trans	-53.8	-28.9	173.8	0	0	0	0	0	114.3	D134 R141	D134-A137 HydrophobicContact CB-CB 4.12Å; D134-A137 WeakPolarHBondContact OD2-CB 3.37Å; D134-A137 PolarHBondContact OD2-N 3.48Å; A137-R141 WeakPolarHBondContact O-CB 3.37Å; A137-R141 PolarHBondContact O-N 3.01Å
138	E	97.6	Very high	95.7	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.019	29%	0.288	C	S	.	.	H	α-helix	trans	-71.5	-39.6	175.2	172.1	53.3	-159.7	0	0	112.9	D134 L135 G136 R141 M142 Y363 Y364 V372 K376	D134-E138 PolarHBondContact O-N 3.28Å; L135-E138 PolarHBondContact O-N 2.82Å; G136-E138 PolarHBondContact O-N 2.91Å; G136-E138 VanDerWaalsContact O-N 3.11Å; E138-R141 PolarHBondContact O-N 2.86Å; E138-R141 IonicContact OE1-CZ 3.18Å; E138-R141 IonicContact OE1-NE 3.01Å; E138-R141 IonicContact OE1-NH2 3.46Å; E138-R141 PolarHBondContact OE1-NH2 3.38Å; E138-R141 IonicContact OE2-CZ 3.58Å; E138-R141 IonicContact OE2-NE 3.9Å; E138-R141 PolarHBondContact OE2-NE 3.11Å; E138-R141 IonicContact OE2-NH2 3.57Å; E138-M142 HydrophobicContact CG-CE 4.16Å; E138-M142 PolarHBondContact O-N 2.81Å; E138-M142 VanDerWaalsContact O-N 3.1Å; E138-Y363 WeakPolarHBondContact OE2-CE1 3.35Å; E138-Y364 WeakPolarHBondContact OE1-CE1 3.31Å; E138-Y364 PolarHBondContact OE1-OH 2.95Å; E138-V372 HydrophobicContact CB-CG1 3.89Å; E138-V372 HydrophobicContact CG-CG1 3.6Å; E138-K376 HydrophobicContact CG-CD 4.1Å
139	F	97.3	Very high	95.9	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.053	27%	0.267	C	S	.	.	H	α-helix	trans	-69	-38	171.8	-78.9	-82.7	0	0	0	111.4	L135 G136 R141 M142 G143 V144 Y169 L194 K376	L135-F139 WeakPolarHBondContact O-CD2 3.49Å; L135-F139 PolarHBondContact O-N 3.01Å; G136-F139 PolarHBondContact O-N 3.29Å; F139-R141 PolarHBondContact O-N 3.29Å; F139-M142 HydrophobicContact CB-CE 4.47Å; F139-M142 HydrophobicContact CD1-CE 3.53Å; F139-M142 HydrophobicContact CE1-CE 3.8Å; F139-M142 HydrophobicContact CG-CE 3.93Å; F139-M142 HydrophobicContact CZ-CE 4.41Å; F139-M142 CarbonylContact O-C 3.46Å; F139-M142 WeakPolarHBondContact O-CA 3.48Å; F139-M142 WeakPolarHBondContact O-CB 3.31Å; F139-M142 PolarHBondContact O-N 3.1Å; F139-M142 VanDerWaalsContact O-N 3.11Å; F139-G143 PolarHBondContact O-N 2.94Å; F139-G143 VanDerWaalsContact O-N 3.1Å; F139-V144 CarbonylContact C-O 3.6Å; F139-V144 HydrophobicContact CB-CB 4.48Å; F139-V144 HydrophobicContact CD1-CB 4.47Å; F139-V144 HydrophobicContact CD1-CG1 4.41Å; F139-V144 PolarHBondContact O-N 3.18Å; F139-Y169 HydrophobicContact CB-CD2 4.36Å; F139-Y169 HydrophobicContact CB-CE1 4.23Å; F139-Y169 HydrophobicContact CB-CE2 3.75Å; F139-Y169 HydrophobicContact CD1-CD1 4.48Å; F139-Y169 AromaticContact CD1-CD2 3.49Å; F139-Y169 HydrophobicContact CD1-CD2 3.49Å; F139-Y169 VanDerWaalsContact CD1-CD2 3.49Å; F139-Y169 AromaticContact CD1-CE2 3.75Å; F139-Y169 HydrophobicContact CD1-CE2 3.75Å; F139-Y169 AromaticContact CD1-CG 3.89Å; F139-Y169 HydrophobicContact CD1-CG 3.89Å; F139-Y169 AromaticContact CD2-CD2 3.68Å; F139-Y169 HydrophobicContact CD2-CD2 3.68Å; F139-Y169 AromaticContact CD2-CE2 3.25Å; F139-Y169 HydrophobicContact CD2-CE2 3.25Å; F139-Y169 AromaticContact CE1-CD2 3.54Å; F139-Y169 HydrophobicContact CE1-CD2 3.54Å; F139-Y169 HydrophobicContact CE1-CE2 4.14Å; F139-Y169 HydrophobicContact CE1-CG 4.05Å; F139-Y169 AromaticContact CE2-CD2 3.73Å; F139-Y169 HydrophobicContact CE2-CD2 3.73Å; F139-Y169 AromaticContact CE2-CE2 3.69Å; F139-Y169 HydrophobicContact CE2-CE2 3.69Å; F139-Y169 AromaticContact CG-CD2 3.58Å; F139-Y169 HydrophobicContact CG-CD2 3.58Å; F139-Y169 HydrophobicContact CG-CE1 4.44Å; F139-Y169 AromaticContact CG-CE2 3.28Å; F139-Y169 HydrophobicContact CG-CE2 3.28Å; F139-Y169 HydrophobicContact CG-CG 4.28Å; F139-Y169 AromaticContact CG-CZ 3.75Å; F139-Y169 AromaticContact CZ-CD2 3.66Å; F139-Y169 HydrophobicContact CZ-CD2 3.66Å; F139-Y169 HydrophobicContact CZ-CE2 4.12Å; F139-L194 HydrophobicContact CD1-CD2 4.37Å; F139-L194 HydrophobicContact CE1-CD2 4.19Å; F139-L194 HydrophobicContact CE1-CG 4.43Å; F139-K376 HydrophobicContact CE2-CD 4.25Å; F139-K376 HydrophobicContact CZ-CD 4.28Å
140	E	97.1	Very high	96.1	Very high	138 Å²	138	51.5 Å²	51.5	65%	0.645	28%	0.277	S	S	*	.	H	α-helix	trans	-61.5	-41.4	173.3	-67.8	-178.7	174	0	0	112	G136 M142 G143 V144	G136-E140 PolarHBondContact O-N 2.82Å; E140-M142 VanDerWaalsContact C-N 3.3Å; E140-M142 PolarHBondContact O-N 3.44Å; E140-G143 WeakPolarHBondContact O-CA 3.29Å; E140-G143 PolarHBondContact O-N 3.24Å; E140-V144 PolarHBondContact N-O 2.84Å
141	R	97.5	Very high	96.2	Very high	80 Å²	80	53.8 Å²	53.8	30%	0.302	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-40.5	171.9	-173.7	-160.9	67.5	84.6	-0.3	111.7	A137 E138 F139 G143 Q199 D361 Y363 Y364	A137-R141 WeakPolarHBondContact O-CB 3.37Å; A137-R141 PolarHBondContact O-N 3.01Å; E138-R141 PolarHBondContact O-N 2.86Å; E138-R141 IonicContact OE1-CZ 3.18Å; E138-R141 IonicContact OE1-NE 3.01Å; E138-R141 IonicContact OE1-NH2 3.46Å; E138-R141 PolarHBondContact OE1-NH2 3.38Å; E138-R141 IonicContact OE2-CZ 3.58Å; E138-R141 IonicContact OE2-NE 3.9Å; E138-R141 PolarHBondContact OE2-NE 3.11Å; E138-R141 IonicContact OE2-NH2 3.57Å; F139-R141 PolarHBondContact O-N 3.29Å; R141-G143 PolarHBondContact O-N 3.28Å; R141-Q199 PolarHBondContact O-NE2 2.93Å; R141-Q199 VanDerWaalsContact O-NE2 3.15Å; R141-D361 IonicContact CZ-OD2 3.63Å; R141-D361 VanDerWaalsContact CZ-OD2 3.28Å; R141-D361 IonicContact NH1-OD1 3.54Å; R141-D361 PolarHBondContact NH1-OD1 2.8Å; R141-D361 IonicContact NH1-OD2 2.73Å; R141-D361 PolarHBondContact NH1-OD2 3.32Å; R141-D361 IonicContact NH2-OD2 2.72Å; R141-D361 PolarHBondContact NH2-OD2 3.28Å; R141-Y363 VanDerWaalsContact CZ-CD1 3.4Å; R141-Y363 VanDerWaalsContact NE-CD1 3.33Å; R141-Y364 PolarHBondContact NH2-OH 3.38Å
142	M	95.9	Very high	96.2	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.015	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-3.1	171.8	-70.5	-173.7	-71.9	0	0	113.4	E138 F139 E140 Y196 Q199 K376	E138-M142 HydrophobicContact CG-CE 4.16Å; E138-M142 PolarHBondContact O-N 2.81Å; E138-M142 VanDerWaalsContact O-N 3.1Å; F139-M142 HydrophobicContact CB-CE 4.47Å; F139-M142 HydrophobicContact CD1-CE 3.53Å; F139-M142 HydrophobicContact CE1-CE 3.8Å; F139-M142 HydrophobicContact CG-CE 3.93Å; F139-M142 HydrophobicContact CZ-CE 4.41Å; F139-M142 CarbonylContact O-C 3.46Å; F139-M142 WeakPolarHBondContact O-CA 3.48Å; F139-M142 WeakPolarHBondContact O-CB 3.31Å; F139-M142 PolarHBondContact O-N 3.1Å; F139-M142 VanDerWaalsContact O-N 3.11Å; E140-M142 VanDerWaalsContact C-N 3.3Å; E140-M142 PolarHBondContact O-N 3.44Å; M142-Y196 HydrophobicContact CG-CD2 4.46Å; M142-Y196 HydrophobicContact CG-CE2 4.48Å; M142-Y196 HydrophobicContact SD-CD2 3.45Å; M142-Y196 WeakPolarHBondContact SD-CD2 3.46Å; M142-Y196 HydrophobicContact SD-CE2 4.02Å; M142-Y196 HydrophobicContact SD-CG 4.28Å; M142-Q199 WeakPolarHBondContact O-CG 3.22Å; M142-Q199 PolarHBondContact O-NE2 2.9Å; M142-K376 HydrophobicContact CE-CD 4.4Å
143	G	96.4	Very high	96.2	Very high	30 Å²	30	49.9 Å²	49.9	31%	0.309	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	38.8	178.8	0	0	0	0	0	112.1	F139 E140 R141 N146	F139-G143 PolarHBondContact O-N 2.94Å; F139-G143 VanDerWaalsContact O-N 3.1Å; E140-G143 WeakPolarHBondContact O-CA 3.29Å; E140-G143 PolarHBondContact O-N 3.24Å; R141-G143 PolarHBondContact O-N 3.28Å; G143-N146 WeakPolarHBondContact O-CB 3.16Å; G143-N146 PolarHBondContact O-ND2 3.11Å
144	V	96.6	Very high	96.2	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	28%	0.275	C	S	.	.			trans	-131.6	131.6	179.7	179.2	0	0	0	0	108.1	F139 E140 W149 Y169 L194 F197	F139-V144 CarbonylContact C-O 3.6Å; F139-V144 HydrophobicContact CB-CB 4.48Å; F139-V144 HydrophobicContact CD1-CB 4.47Å; F139-V144 HydrophobicContact CD1-CG1 4.41Å; F139-V144 PolarHBondContact O-N 3.18Å; E140-V144 PolarHBondContact N-O 2.84Å; V144-W149 HydrophobicContact CG1-CB 3.88Å; V144-Y169 HydrophobicContact CG1-CD1 3.44Å; V144-Y169 VanDerWaalsContact CG1-CD1 3.44Å; V144-Y169 HydrophobicContact CG1-CE1 3.93Å; V144-Y169 HydrophobicContact CG1-CG 4.06Å; V144-L194 HydrophobicContact CB-CD2 4.47Å; V144-L194 HydrophobicContact CG1-CD2 3.93Å; V144-L194 HydrophobicContact CG2-CD2 3.98Å; V144-F197 HydrophobicContact CG2-CB 3.91Å; V144-F197 HydrophobicContact CG2-CD1 3.94Å; V144-F197 HydrophobicContact CG2-CG 4.05Å
145	P	96.5	Very high	96.3	Very high	78 Å²	78	45.5 Å²	45.5	51%	0.506	25%	0.25	S	C	.	.	S	Bend	cis	-70.9	157.4	6.7	31.2	-36.1	0	0	0	114.2	W149	P145-W149 CarbonylContact C-O 3.56Å; P145-W149 WeakPolarHBondContact CA-O 3.43Å; P145-W149 WeakPolarHBondContact CB-O 3.36Å
146	N	95.7	Very high	96.3	Very high	45 Å²	45	52 Å²	52	24%	0.241	27%	0.272	C	S	.	.	S	Bend	trans	-155.2	-175.6	179.9	62	43.8	0	0	0	110.7	G143 Q148 W149 I172 F197	G143-N146 WeakPolarHBondContact O-CB 3.16Å; G143-N146 PolarHBondContact O-ND2 3.11Å; N146-Q148 PolarHBondContact O-N 3.09Å; N146-Q148 PolarHBondContact OD1-N 2.91Å; N146-W149 PolarHBondContact N-O 2.98Å; N146-W149 PolarHBondContact O-N 3.07Å; N146-W149 VanDerWaalsContact O-O 3.05Å; N146-W149 PolarHBondContact OD1-N 3.41Å; N146-I172 WeakPolarHBondContact O-CD1 3.39Å; N146-F197 WeakPolarHBondContact ND2-CE1 3.45Å
147	D	94.3	Very high	96.3	Very high	147 Å²	147	55.3 Å²	55.3	79%	0.786	28%	0.284	S	S	*	.	S	Bend	trans	-57.3	-10.6	-178.5	-55.5	-29.5	0	0	0	115.9
148	Q	95.9	Very high	96.4	Very high	53 Å²	53	53.8 Å²	53.8	25%	0.248	27%	0.269	C	S	.	.	S	Bend	trans	-116.7	-28.8	179.1	-56.7	-54.8	-48.3	0	0	113.5	N146 P171 I172 A232 H234	N146-Q148 PolarHBondContact O-N 3.09Å; N146-Q148 PolarHBondContact OD1-N 2.91Å; Q148-P171 CarbonylContact O-C 3.56Å; Q148-P171 WeakPolarHBondContact O-CA 3.37Å; Q148-I172 PolarHBondContact O-N 3.05Å; Q148-A232 HydrophobicContact CB-CB 4.18Å; Q148-H234 PolarHBondContact NE2-CE1 2.77Å
149	W	97.9	Very high	96.2	Very high	1 Å²	1	61.6 Å²	61.6	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.3	-172	-65.8	88.6	0	0	0	112.1	V144 P145 N146 V170 P171 L194 F197 A204 C206 I229 A232	V144-W149 HydrophobicContact CG1-CB 3.88Å; P145-W149 CarbonylContact C-O 3.56Å; P145-W149 WeakPolarHBondContact CA-O 3.43Å; P145-W149 WeakPolarHBondContact CB-O 3.36Å; N146-W149 PolarHBondContact N-O 2.98Å; N146-W149 PolarHBondContact O-N 3.07Å; N146-W149 VanDerWaalsContact O-O 3.05Å; N146-W149 PolarHBondContact OD1-N 3.41Å; W149-V170 WeakPolarHBondContact CA-O 3.33Å; W149-P171 HydrophobicContact CE3-CG 4.34Å; W149-P171 HydrophobicContact CH2-CG 3.85Å; W149-P171 HydrophobicContact CZ2-CG 4.44Å; W149-P171 HydrophobicContact CZ3-CG 3.81Å; W149-L194 HydrophobicContact CD2-CD1 4.23Å; W149-L194 HydrophobicContact CD2-CD2 4.12Å; W149-L194 HydrophobicContact CE3-CB 3.85Å; W149-L194 HydrophobicContact CE3-CD1 4.12Å; W149-L194 HydrophobicContact CE3-CD2 4.01Å; W149-L194 HydrophobicContact CE3-CG 4.22Å; W149-L194 HydrophobicContact CG-CD2 4.36Å; W149-L194 HydrophobicContact CH2-CD1 4.12Å; W149-L194 HydrophobicContact CZ2-CD1 4.23Å; W149-L194 HydrophobicContact CZ3-CB 3.78Å; W149-L194 HydrophobicContact CZ3-CD1 4.05Å; W149-L194 HydrophobicContact CZ3-CG 4.38Å; W149-F197 AromaticContact CD1-CE2 3.84Å; W149-F197 AromaticContact NE1-CD2 3.86Å; W149-F197 AromaticContact NE1-CE2 3.63Å; W149-A204 HydrophobicContact CH2-CB 3.99Å; W149-A204 HydrophobicContact CZ2-CB 3.33Å; W149-C206 VanDerWaalsContact CH2-SG 3.51Å; W149-I229 HydrophobicContact CH2-CG1 4.12Å; W149-I229 HydrophobicContact CH2-CG2 4.32Å; W149-A232 HydrophobicContact CZ2-CB 3.98Å
150	Q	97.2	Very high	96.2	Very high	65 Å²	65	62.3 Å²	62.3	30%	0.304	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.8	178.5	62.2	-173.7	-6.8	0	0	112	Y169 V170 P171 I172	Q150-Y169 WeakPolarHBondContact O-CA 3.18Å; Q150-V170 HydrophobicContact CG-CG2 3.97Å; Q150-V170 PolarHBondContact N-O 3.41Å; Q150-V170 PolarHBondContact O-N 3.37Å; Q150-P171 PolarHBondContact NE2-O 2.84Å; Q150-I172 HydrophobicContact CB-CG1 3.77Å; Q150-I172 HydrophobicContact CG-CG1 4Å; Q150-I172 PolarHBondContact NE2-O 2.82Å
151	H	97.1	Very high	96.2	Very high	76 Å²	76	55.8 Å²	55.8	35%	0.352	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	147.6	160.5	174.9	-86.7	0	0	0	110	D167 L168 Y169	H151-D167 IonicContact CD2-OD1 3.68Å; H151-D167 IonicContact CE1-OD1 3.92Å; H151-D167 IonicContact NE2-OD1 3.44Å; H151-D167 PolarHBondContact NE2-OD1 3.03Å; H151-L168 CarbonylContact C-O 3.45Å; H151-L168 WeakPolarHBondContact CA-O 3.36Å; H151-Y169 HydrophobicContact CB-CD1 4.16Å; H151-Y169 HydrophobicContact CB-CE1 3.73Å
152	T	95.4	Very high	96.2	Very high	8 Å²	8	57.4 Å²	57.4	5%	0.049	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	131.2	171.2	-172.2	0	0	0	0	112.1	V154 L168 V170 I179	T152-V154 HydrophobicContact CG2-CG1 3.96Å; T152-V154 PolarHBondContact O-N 2.82Å; T152-V154 PolarHBondContact OG1-N 3.41Å; T152-L168 HydrophobicContact CG2-CB 3.9Å; T152-L168 PolarHBondContact N-O 2.95Å; T152-V170 HydrophobicContact CG2-CG1 3.95Å; T152-V170 HydrophobicContact CG2-CG2 3.8Å; T152-I179 HydrophobicContact CG2-CD1 4.49Å
153	D	93.4	Very high	96.3	Very high	78 Å²	78	58.4 Å²	58.4	42%	0.417	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-76.9	-1.2	175.9	66.4	-13.9	0	0	0	113.7	N155 R156 K176	D153-N155 PolarHBondContact O-N 3.38Å; D153-R156 VanDerWaalsContact O-CB 3.22Å; D153-R156 WeakPolarHBondContact O-CB 3.37Å; D153-R156 PolarHBondContact O-N 3.13Å; D153-K176 VanDerWaalsContact OD1-CE 3.25Å; D153-K176 WeakPolarHBondContact OD1-CE 3.42Å; D153-K176 IonicContact OD1-NZ 3.07Å; D153-K176 PolarHBondContact OD1-NZ 3.14Å; D153-K176 IonicContact OD2-NZ 3.5Å; D153-K176 PolarHBondContact OD2-NZ 2.81Å
154	V	95.6	Very high	96.4	Very high	26 Å²	26	57 Å²	57	16%	0.158	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-61.6	-24.2	-166.2	83	0	0	0	0	113.4	T152 V160 I179 V180 F191	T152-V154 HydrophobicContact CG2-CG1 3.96Å; T152-V154 PolarHBondContact O-N 2.82Å; T152-V154 PolarHBondContact OG1-N 3.41Å; V154-V160 HydrophobicContact CG2-CG2 3.95Å; V154-V160 WeakPolarHBondContact O-CG2 3.47Å; V154-I179 HydrophobicContact CG1-CG2 3.91Å; V154-V180 HydrophobicContact CG2-CG2 4.24Å; V154-F191 HydrophobicContact CG1-CZ 4.18Å
155	N	97.1	Very high	96.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-110.2	14.8	178.4	-153	49.4	0	0	0	114	D153 D157 Y158 V160 C161 Y164 P165 R166 L168	D153-N155 PolarHBondContact O-N 3.38Å; N155-D157 PolarHBondContact O-N 3.08Å; N155-D157 VanDerWaalsContact O-N 3.11Å; N155-Y158 WeakPolarHBondContact O-CA 3.46Å; N155-Y158 PolarHBondContact O-N 2.97Å; N155-Y158 WeakPolarHBondContact OD1-CA 3.47Å; N155-V160 PolarHBondContact OD1-N 3.44Å; N155-C161 PolarHBondContact ND2-O 3.28Å; N155-C161 PolarHBondContact OD1-N 3.02Å; N155-C161 PolarHBondContact OD1-O 3.4Å; N155-Y164 PolarHBondContact ND2-O 3.29Å; N155-P165 PolarHBondContact ND2-O 2.85Å; N155-R166 CarbonylContact C-O 3.58Å; N155-L168 HydrophobicContact CB-CD1 3.62Å; N155-L168 HydrophobicContact CB-CG 4.49Å
156	R	96.1	Very high	96.4	Very high	177 Å²	177	58.3 Å²	58.3	67%	0.668	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-37.3	-179.9	-179.8	178.5	179.4	175.6	1.9	113.9	D153 R166	D153-R156 VanDerWaalsContact O-CB 3.22Å; D153-R156 WeakPolarHBondContact O-CB 3.37Å; D153-R156 PolarHBondContact O-N 3.13Å; R156-R166 WeakPolarHBondContact O-CD 3.41Å; R156-R166 WeakPolarHBondContact O-CG 3.33Å
157	D	95.9	Very high	96.4	Very high	94 Å²	94	60.4 Å²	60.4	50%	0.503	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	15.9	178.3	-54.9	-25.1	0	0	0	112.5	N155 K159	N155-D157 PolarHBondContact O-N 3.08Å; N155-D157 VanDerWaalsContact O-N 3.11Å; D157-K159 HydrophobicContact CB-CD 3.82Å; D157-K159 HydrophobicContact CB-CG 3.96Å; D157-K159 PolarHBondContact O-N 3.3Å; D157-K159 WeakPolarHBondContact OD2-CE 3.49Å; D157-K159 IonicContact OD2-NZ 2.64Å; D157-K159 PolarHBondContact OD2-NZ 3.03Å
158	Y	97.1	Very high	96.6	Very high	13 Å²	13	53.5 Å²	53.5	5%	0.051	25%	0.25	C	S	.	.	S	Bend	trans	58.3	11.8	-176.1	-57.4	-77	0	0	0	116.6	N155 V160 C161 E162 Y164 R166 Q448 R449 E452	N155-Y158 WeakPolarHBondContact O-CA 3.46Å; N155-Y158 PolarHBondContact O-N 2.97Å; N155-Y158 WeakPolarHBondContact OD1-CA 3.47Å; Y158-V160 VanDerWaalsContact C-N 3.33Å; Y158-V160 PolarHBondContact O-N 3.31Å; Y158-C161 CarbonylContact O-C 3.57Å; Y158-E162 PolarHBondContact O-N 2.83Å; Y158-Y164 VanDerWaalsContact CD1-O 3.31Å; Y158-Y164 WeakPolarHBondContact CD1-O 3.42Å; Y158-Y164 VanDerWaalsContact CE1-O 3.26Å; Y158-Y164 WeakPolarHBondContact CE1-O 3.29Å; Y158-R166 HydrophobicContact CD1-CG 4.44Å; Y158-R166 HydrophobicContact CD2-CG 4.41Å; Y158-R166 HydrophobicContact CE1-CG 3.7Å; Y158-R166 HydrophobicContact CE2-CG 3.67Å; Y158-R166 WeakPolarHBondContact OH-CG 3.46Å; Y158-Q448 HydrophobicContact CE1-CB 4.22Å; Y158-Q448 VanDerWaalsContact OH-CG 3.27Å; Y158-Q448 WeakPolarHBondContact OH-CG 3.48Å; Y158-Q448 PolarHBondContact OH-OE1 2.94Å; Y158-R449 HydrophobicContact CD1-CB 3.87Å; Y158-R449 HydrophobicContact CD2-CB 3.64Å; Y158-R449 HydrophobicContact CD2-CG 3.64Å; Y158-R449 HydrophobicContact CE1-CB 3.85Å; Y158-R449 HydrophobicContact CE2-CB 3.63Å; Y158-R449 HydrophobicContact CE2-CG 3.91Å; Y158-R449 HydrophobicContact CG-CB 3.74Å; Y158-R449 HydrophobicContact CG-CG 4Å; Y158-R449 PolarHBondContact OH-N 2.98Å; Y158-E452 VanDerWaalsContact CE2-OE2 3.25Å; Y158-E452 WeakPolarHBondContact CE2-OE2 3.37Å; Y158-E452 PolarHBondContact OH-OE1 2.62Å; Y158-E452 VanDerWaalsContact OH-OE1 3.14Å; Y158-E452 PolarHBondContact OH-OE2 3.47Å
159	K	94.9	Very high	96.7	Very high	167 Å²	167	51.8 Å²	51.8	73%	0.726	24%	0.242	S	C	*	.	S	Bend	trans	-67.8	-24.6	-174.3	-71.7	167.7	-176.8	158.5	0	114.6	D157	D157-K159 HydrophobicContact CB-CD 3.82Å; D157-K159 HydrophobicContact CB-CG 3.96Å; D157-K159 PolarHBondContact O-N 3.3Å; D157-K159 WeakPolarHBondContact OD2-CE 3.49Å; D157-K159 IonicContact OD2-NZ 2.64Å; D157-K159 PolarHBondContact OD2-NZ 3.03Å
160	V	96.3	Very high	96.7	Very high	27 Å²	27	51.8 Å²	51.8	16%	0.164	24%	0.241	C	C	.	.	S	Bend	trans	-91.7	-38.3	-179.6	175.8	0	0	0	0	111.1	V154 N155 Y158 V180 F191	V154-V160 HydrophobicContact CG2-CG2 3.95Å; V154-V160 WeakPolarHBondContact O-CG2 3.47Å; N155-V160 PolarHBondContact OD1-N 3.44Å; Y158-V160 VanDerWaalsContact C-N 3.33Å; Y158-V160 PolarHBondContact O-N 3.31Å; V160-V180 HydrophobicContact CG2-CG2 4.23Å; V160-F191 HydrophobicContact CG1-CD1 3.94Å; V160-F191 HydrophobicContact CG1-CE1 3.63Å
161	C	97.8	Very high	96.7	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.014	23%	0.227	C	C	.	.			trans	-150.8	112.7	172.5	-175.5	0	0	0	0	111.3	N155 Y158 T163 Y164 K188 G189 R190	N155-C161 PolarHBondContact ND2-O 3.28Å; N155-C161 PolarHBondContact OD1-N 3.02Å; N155-C161 PolarHBondContact OD1-O 3.4Å; Y158-C161 CarbonylContact O-C 3.57Å; C161-T163 PolarHBondContact O-N 2.91Å; C161-T163 VanDerWaalsContact O-N 3.09Å; C161-T163 PolarHBondContact SG-OG1 3.32Å; C161-T163 VanDerWaalsContact SG-OG1 3.39Å; C161-Y164 HydrophobicContact CB-CD2 4.17Å; C161-Y164 HydrophobicContact CB-CG 4.18Å; C161-Y164 PolarHBondContact O-N 2.93Å; C161-K188 PolarHBondContact SG-O 3.23Å; C161-G189 WeakPolarHBondContact CB-O 3.17Å; C161-R190 WeakPolarHBondContact SG-CG 3.22Å
162	E	97.4	Very high	96.7	Very high	114 Å²	114	48.7 Å²	48.7	53%	0.533	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.2	-179.3	-56.5	-176.3	127.5	0	0	114.3	Y158 R449	Y158-E162 PolarHBondContact O-N 2.83Å; E162-R449 IonicContact OE1-CZ 3.16Å; E162-R449 IonicContact OE1-NH1 3.76Å; E162-R449 PolarHBondContact OE1-NH1 2.79Å
163	T	97.8	Very high	96.7	Very high	24 Å²	24	52.6 Å²	52.6	15%	0.147	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	4.4	-174.9	61.2	0	0	0	0	113.6	C161 R190 W346 F381 N447	C161-T163 PolarHBondContact O-N 2.91Å; C161-T163 VanDerWaalsContact O-N 3.09Å; C161-T163 PolarHBondContact SG-OG1 3.32Å; C161-T163 VanDerWaalsContact SG-OG1 3.39Å; T163-R190 VanDerWaalsContact CB-NH1 3.33Å; T163-R190 PolarHBondContact O-NH1 3.06Å; T163-R190 WeakPolarHBondContact OG1-CD 3.42Å; T163-R190 PolarHBondContact OG1-NH1 3.38Å; T163-W346 HydrophobicContact CG2-CZ3 4.44Å; T163-F381 CarbonylContact O-C 3.57Å; T163-N447 HydrophobicContact CG2-CB 4.49Å
164	Y	98.3	Very high	96.9	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	23%	0.233	C	C	.	.	S	Bend	trans	-101.4	160.9	170.4	-89.1	1.6	0	0	0	110.7	N155 Y158 C161 L168 R190 F191 V193 R207 F381	N155-Y164 PolarHBondContact ND2-O 3.29Å; Y158-Y164 VanDerWaalsContact CD1-O 3.31Å; Y158-Y164 WeakPolarHBondContact CD1-O 3.42Å; Y158-Y164 VanDerWaalsContact CE1-O 3.26Å; Y158-Y164 WeakPolarHBondContact CE1-O 3.29Å; C161-Y164 HydrophobicContact CB-CD2 4.17Å; C161-Y164 HydrophobicContact CB-CG 4.18Å; C161-Y164 PolarHBondContact O-N 2.93Å; Y164-L168 HydrophobicContact CD2-CD1 3.92Å; Y164-L168 HydrophobicContact CD2-CD2 4.07Å; Y164-L168 HydrophobicContact CG-CD2 4.38Å; Y164-R190 HydrophobicContact CD1-CG 4.14Å; Y164-R190 HydrophobicContact CE1-CB 3.92Å; Y164-R190 HydrophobicContact CE1-CG 3.88Å; Y164-R190 VanDerWaalsContact CE1-CZ 3.47Å; Y164-R190 HydrophobicContact CE2-CB 4.39Å; Y164-F191 HydrophobicContact CD2-CD1 4.49Å; Y164-F191 HydrophobicContact CD2-CE1 4.28Å; Y164-F191 HydrophobicContact CE2-CD1 4.36Å; Y164-F191 HydrophobicContact CE2-CE1 4.49Å; Y164-F191 VanDerWaalsContact CE2-O 3.3Å; Y164-F191 WeakPolarHBondContact CE2-O 3.42Å; Y164-F191 PolarHBondContact OH-O 2.87Å; Y164-V193 HydrophobicContact CD2-CG1 4.4Å; Y164-V193 HydrophobicContact CD2-CG2 4.3Å; Y164-V193 HydrophobicContact CE2-CB 4.37Å; Y164-V193 HydrophobicContact CE2-CG1 3.89Å; Y164-V193 HydrophobicContact CE2-CG2 3.52Å; Y164-R207 PolarHBondContact OH-O 3.31Å; Y164-F381 AromaticContact CD1-CD1 3.84Å; Y164-F381 HydrophobicContact CD1-CD1 3.84Å; Y164-F381 HydrophobicContact CD1-CE1 4.34Å; Y164-F381 AromaticContact CE1-CD1 3.89Å; Y164-F381 HydrophobicContact CE1-CD1 3.89Å; Y164-F381 HydrophobicContact CE1-CE1 4.31Å; Y164-F381 HydrophobicContact CG-CD1 4.46Å
165	P	97.3	Very high	96.9	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.052	25%	0.245	C	C	.	.			trans	-66.8	167	174.2	28.9	-35.4	0	0	0	112.5	N155 L168 S380 F381 Q448	N155-P165 PolarHBondContact ND2-O 2.85Å; P165-L168 HydrophobicContact CG-CD2 3.71Å; P165-S380 WeakPolarHBondContact CD-O 3.49Å; P165-F381 HydrophobicContact CG-CD1 4.24Å; P165-F381 HydrophobicContact CG-CE1 4.08Å; P165-F381 HydrophobicContact CG-CZ 4.49Å; P165-Q448 VanDerWaalsContact CB-OE1 3.25Å
166	R	96.4	Very high	96.8	Very high	98 Å²	98	55.4 Å²	55.4	37%	0.37	27%	0.267	S	S	.	.	S	Bend	trans	-62.9	-48.2	174.7	-64.2	-161.9	-101.4	-175.1	0.7	111.9	N155 R156 Y158 E452	N155-R166 CarbonylContact C-O 3.58Å; R156-R166 WeakPolarHBondContact O-CD 3.41Å; R156-R166 WeakPolarHBondContact O-CG 3.33Å; Y158-R166 HydrophobicContact CD1-CG 4.44Å; Y158-R166 HydrophobicContact CD2-CG 4.41Å; Y158-R166 HydrophobicContact CE1-CG 3.7Å; Y158-R166 HydrophobicContact CE2-CG 3.67Å; Y158-R166 WeakPolarHBondContact OH-CG 3.46Å; R166-E452 IonicContact CZ-OE1 3.57Å; R166-E452 IonicContact CZ-OE2 2.92Å; R166-E452 IonicContact NE-OE1 2.69Å; R166-E452 PolarHBondContact NE-OE1 3.2Å; R166-E452 IonicContact NE-OE2 2.75Å; R166-E452 PolarHBondContact NE-OE2 2.96Å; R166-E452 IonicContact NH1-OE2 3.48Å; R166-E452 IonicContact NH2-OE1 2.8Å; R166-E452 PolarHBondContact NH2-OE1 3.03Å; R166-E452 IonicContact NH2-OE2 3.58Å; R166-E452 PolarHBondContact NH2-OE2 2.89Å; R166-E452 VanDerWaalsContact NH2-OE2 3.16Å
167	D	95.3	Very high	96.9	Very high	90 Å²	90	51.5 Å²	51.5	48%	0.481	26%	0.264	S	S	.	.	S	Bend	trans	-91.7	122.2	-178.3	-57.3	-74.2	0	0	0	110.3	H151	H151-D167 IonicContact CD2-OD1 3.68Å; H151-D167 IonicContact CE1-OD1 3.92Å; H151-D167 IonicContact NE2-OD1 3.44Å; H151-D167 PolarHBondContact NE2-OD1 3.03Å
168	L	97.7	Very high	97	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	153.2	-177.7	-69.4	172.5	0	0	0	110.3	H151 T152 N155 Y164 P165 F191 V193 F381	H151-L168 CarbonylContact C-O 3.45Å; H151-L168 WeakPolarHBondContact CA-O 3.36Å; T152-L168 HydrophobicContact CG2-CB 3.9Å; T152-L168 PolarHBondContact N-O 2.95Å; N155-L168 HydrophobicContact CB-CD1 3.62Å; N155-L168 HydrophobicContact CB-CG 4.49Å; Y164-L168 HydrophobicContact CD2-CD1 3.92Å; Y164-L168 HydrophobicContact CD2-CD2 4.07Å; Y164-L168 HydrophobicContact CG-CD2 4.38Å; P165-L168 HydrophobicContact CG-CD2 3.71Å; L168-F191 HydrophobicContact CD1-CE1 4.01Å; L168-F191 HydrophobicContact CD1-CZ 3.62Å; L168-V193 HydrophobicContact CB-CG1 4.45Å; L168-V193 HydrophobicContact CD1-CG1 4.34Å; L168-V193 HydrophobicContact CD2-CB 4.34Å; L168-V193 HydrophobicContact CD2-CG1 4.12Å; L168-V193 HydrophobicContact CD2-CG2 4.3Å; L168-F381 HydrophobicContact CD2-CE1 3.94Å; L168-F381 HydrophobicContact CD2-CZ 4.46Å
169	Y	98.2	Very high	97	Very high	17 Å²	17	48 Å²	48	7%	0.067	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.3	-179.5	-67.9	-90.4	0	0	0	110.8	F139 V144 Q150 H151 L194	F139-Y169 HydrophobicContact CB-CD2 4.36Å; F139-Y169 HydrophobicContact CB-CE1 4.23Å; F139-Y169 HydrophobicContact CB-CE2 3.75Å; F139-Y169 HydrophobicContact CD1-CD1 4.48Å; F139-Y169 AromaticContact CD1-CD2 3.49Å; F139-Y169 HydrophobicContact CD1-CD2 3.49Å; F139-Y169 VanDerWaalsContact CD1-CD2 3.49Å; F139-Y169 AromaticContact CD1-CE2 3.75Å; F139-Y169 HydrophobicContact CD1-CE2 3.75Å; F139-Y169 AromaticContact CD1-CG 3.89Å; F139-Y169 HydrophobicContact CD1-CG 3.89Å; F139-Y169 AromaticContact CD2-CD2 3.68Å; F139-Y169 HydrophobicContact CD2-CD2 3.68Å; F139-Y169 AromaticContact CD2-CE2 3.25Å; F139-Y169 HydrophobicContact CD2-CE2 3.25Å; F139-Y169 AromaticContact CE1-CD2 3.54Å; F139-Y169 HydrophobicContact CE1-CD2 3.54Å; F139-Y169 HydrophobicContact CE1-CE2 4.14Å; F139-Y169 HydrophobicContact CE1-CG 4.05Å; F139-Y169 AromaticContact CE2-CD2 3.73Å; F139-Y169 HydrophobicContact CE2-CD2 3.73Å; F139-Y169 AromaticContact CE2-CE2 3.69Å; F139-Y169 HydrophobicContact CE2-CE2 3.69Å; F139-Y169 AromaticContact CG-CD2 3.58Å; F139-Y169 HydrophobicContact CG-CD2 3.58Å; F139-Y169 HydrophobicContact CG-CE1 4.44Å; F139-Y169 AromaticContact CG-CE2 3.28Å; F139-Y169 HydrophobicContact CG-CE2 3.28Å; F139-Y169 HydrophobicContact CG-CG 4.28Å; F139-Y169 AromaticContact CG-CZ 3.75Å; F139-Y169 AromaticContact CZ-CD2 3.66Å; F139-Y169 HydrophobicContact CZ-CD2 3.66Å; F139-Y169 HydrophobicContact CZ-CE2 4.12Å; V144-Y169 HydrophobicContact CG1-CD1 3.44Å; V144-Y169 VanDerWaalsContact CG1-CD1 3.44Å; V144-Y169 HydrophobicContact CG1-CE1 3.93Å; V144-Y169 HydrophobicContact CG1-CG 4.06Å; Q150-Y169 WeakPolarHBondContact O-CA 3.18Å; H151-Y169 HydrophobicContact CB-CD1 4.16Å; H151-Y169 HydrophobicContact CB-CE1 3.73Å; Y169-L194 WeakPolarHBondContact O-CB 3.45Å; Y169-L194 PolarHBondContact O-N 3.39Å
170	V	98.3	Very high	97.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	161	-170.6	-66.2	0	0	0	0	110.3	W149 Q150 T152 I179 F191 V193 M225	W149-V170 WeakPolarHBondContact CA-O 3.33Å; Q150-V170 HydrophobicContact CG-CG2 3.97Å; Q150-V170 PolarHBondContact N-O 3.41Å; Q150-V170 PolarHBondContact O-N 3.37Å; T152-V170 HydrophobicContact CG2-CG1 3.95Å; T152-V170 HydrophobicContact CG2-CG2 3.8Å; V170-I179 HydrophobicContact CB-CD1 4.5Å; V170-I179 HydrophobicContact CG1-CD1 4.28Å; V170-I179 HydrophobicContact CG2-CD1 4.02Å; V170-F191 HydrophobicContact CG1-CE2 3.99Å; V170-V193 HydrophobicContact CG1-CG1 4.36Å; V170-M225 HydrophobicContact CB-CE 4.11Å; V170-M225 HydrophobicContact CG1-CE 3.85Å
171	P	97.9	Very high	97.2	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	145.9	174	-22.9	34.4	0	0	0	111.7	Q148 W149 Q150 T173 A174 A228 I229 A232	Q148-P171 CarbonylContact O-C 3.56Å; Q148-P171 WeakPolarHBondContact O-CA 3.37Å; W149-P171 HydrophobicContact CE3-CG 4.34Å; W149-P171 HydrophobicContact CH2-CG 3.85Å; W149-P171 HydrophobicContact CZ2-CG 4.44Å; W149-P171 HydrophobicContact CZ3-CG 3.81Å; Q150-P171 PolarHBondContact NE2-O 2.84Å; P171-T173 PolarHBondContact O-N 3.43Å; P171-A174 HydrophobicContact CB-CB 4.4Å; P171-A174 WeakPolarHBondContact O-CB 3.38Å; P171-A174 PolarHBondContact O-N 3Å; P171-A228 HydrophobicContact CB-CB 3.92Å; P171-A228 HydrophobicContact CG-CB 4.03Å; P171-I229 HydrophobicContact CG-CB 4.46Å; P171-I229 HydrophobicContact CG-CG1 3.73Å; P171-A232 HydrophobicContact CB-CB 4.33Å
172	I	96.9	Very high	97.2	Very high	76 Å²	76	41.7 Å²	41.7	39%	0.39	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.6	176.9	-78.5	166.8	0	0	0	112.3	N146 Q148 Q150 A174	N146-I172 WeakPolarHBondContact O-CD1 3.39Å; Q148-I172 PolarHBondContact O-N 3.05Å; Q150-I172 HydrophobicContact CB-CG1 3.77Å; Q150-I172 HydrophobicContact CG-CG1 4Å; Q150-I172 PolarHBondContact NE2-O 2.82Å; I172-A174 PolarHBondContact O-N 3.24Å
173	T	96	Very high	97.2	Very high	89 Å²	89	36.7 Å²	36.7	55%	0.546	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.1	178.8	53.5	0	0	0	0	113.9	P171 S175 A228	P171-T173 PolarHBondContact O-N 3.43Å; T173-S175 PolarHBondContact O-N 3.05Å; T173-A228 WeakPolarHBondContact OG1-CB 3.47Å
174	A	96.6	Very high	97.2	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.008	23%	0.228	C	C	.	.			trans	-85.6	103.4	175.7	0	0	0	0	0	111	P171 I172 I179 M225 A228	P171-A174 HydrophobicContact CB-CB 4.4Å; P171-A174 WeakPolarHBondContact O-CB 3.38Å; P171-A174 PolarHBondContact O-N 3Å; I172-A174 PolarHBondContact O-N 3.24Å; A174-I179 HydrophobicContact CB-CG1 4.44Å; A174-M225 HydrophobicContact CB-CE 4.23Å; A174-M225 HydrophobicContact CB-SD 3.53Å; A174-M225 VanDerWaalsContact CB-SD 3.53Å; A174-A228 HydrophobicContact CB-CB 4.3Å
175	S	95.9	Very high	97.2	Very high	58 Å²	58	44.1 Å²	44.1	41%	0.406	23%	0.232	S	C	.	.			trans	-76	158.6	177.5	67.5	0	0	0	0	112.5	T173 P177 I178 I179	T173-S175 PolarHBondContact O-N 3.05Å; S175-P177 VanDerWaalsContact C-N 3.32Å; S175-I178 WeakPolarHBondContact O-CB 3.48Å; S175-I178 PolarHBondContact O-N 3.45Å; S175-I178 WeakPolarHBondContact OG-CG1 3.42Å; S175-I179 PolarHBondContact O-N 2.79Å; S175-I179 VanDerWaalsContact O-N 3.13Å
176	K	95.3	Very high	97.2	Very high	104 Å²	104	43.8 Å²	43.8	45%	0.452	23%	0.23	S	C	.	.	H	α-helix	trans	-52.8	-40	179.3	-58	-166.3	-172.2	-166.3	0	113.6	D153 I179 V180	D153-K176 VanDerWaalsContact OD1-CE 3.25Å; D153-K176 WeakPolarHBondContact OD1-CE 3.42Å; D153-K176 IonicContact OD1-NZ 3.07Å; D153-K176 PolarHBondContact OD1-NZ 3.14Å; D153-K176 IonicContact OD2-NZ 3.5Å; D153-K176 PolarHBondContact OD2-NZ 2.81Å; K176-I179 PolarHBondContact O-N 3.46Å; K176-V180 WeakPolarHBondContact O-CG2 3.45Å; K176-V180 PolarHBondContact O-N 2.75Å
177	P	97.1	Very high	97.2	Very high	96 Å²	96	39.5 Å²	39.5	62%	0.623	22%	0.215	S	C	*	.	H	α-helix	trans	-61.2	-40.2	172.9	-26.3	36.4	0	0	0	114.5	S175 I179 V180 G181	S175-P177 VanDerWaalsContact C-N 3.32Å; P177-I179 VanDerWaalsContact C-N 3.33Å; P177-I179 PolarHBondContact O-N 2.89Å; P177-V180 PolarHBondContact O-N 2.88Å; P177-G181 PolarHBondContact O-N 2.79Å
178	I	97.7	Very high	97.3	Very high	33 Å²	33	42.2 Å²	42.2	17%	0.169	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-45.5	176.3	-70.5	172.3	0	0	0	109.9	S175 G181 S182 E221 M225	S175-I178 WeakPolarHBondContact O-CB 3.48Å; S175-I178 PolarHBondContact O-N 3.45Å; S175-I178 WeakPolarHBondContact OG-CG1 3.42Å; I178-G181 PolarHBondContact O-N 2.75Å; I178-S182 WeakPolarHBondContact O-CB 3.46Å; I178-S182 PolarHBondContact O-N 3.01Å; I178-E221 WeakPolarHBondContact CG2-O 3.41Å; I178-M225 HydrophobicContact CG2-CB 3.98Å; I178-M225 HydrophobicContact CG2-SD 4.13Å
179	I	97.5	Very high	97.3	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-45.7	179.7	-61	164.7	0	0	0	111.4	T152 V154 V170 A174 S175 K176 P177 G181 S182 S183 F191	T152-I179 HydrophobicContact CG2-CD1 4.49Å; V154-I179 HydrophobicContact CG1-CG2 3.91Å; V170-I179 HydrophobicContact CB-CD1 4.5Å; V170-I179 HydrophobicContact CG1-CD1 4.28Å; V170-I179 HydrophobicContact CG2-CD1 4.02Å; A174-I179 HydrophobicContact CB-CG1 4.44Å; S175-I179 PolarHBondContact O-N 2.79Å; S175-I179 VanDerWaalsContact O-N 3.13Å; K176-I179 PolarHBondContact O-N 3.46Å; P177-I179 VanDerWaalsContact C-N 3.33Å; P177-I179 PolarHBondContact O-N 2.89Å; I179-G181 VanDerWaalsContact C-N 3.34Å; I179-G181 PolarHBondContact O-N 3.5Å; I179-S182 PolarHBondContact O-N 3.11Å; I179-S183 PolarHBondContact O-N 3.49Å; I179-F191 HydrophobicContact CG2-CD1 4.22Å; I179-F191 HydrophobicContact CG2-CD2 3.8Å; I179-F191 HydrophobicContact CG2-CE1 3.84Å; I179-F191 HydrophobicContact CG2-CE2 3.35Å; I179-F191 HydrophobicContact CG2-CG 4.22Å; I179-F191 HydrophobicContact CG2-CZ 3.38Å
180	V	97.5	Very high	97.3	Very high	49 Å²	49	41.9 Å²	41.9	30%	0.297	22%	0.224	S	C	.	.	H	α-helix	trans	-70.9	-27.2	179.4	173.7	0	0	0	0	112.7	V154 V160 K176 P177 S183 K184	V154-V180 HydrophobicContact CG2-CG2 4.24Å; V160-V180 HydrophobicContact CG2-CG2 4.23Å; K176-V180 WeakPolarHBondContact O-CG2 3.45Å; K176-V180 PolarHBondContact O-N 2.75Å; P177-V180 PolarHBondContact O-N 2.88Å; V180-S183 PolarHBondContact O-OG 3.06Å; V180-K184 WeakPolarHBondContact O-CD 3.43Å; V180-K184 WeakPolarHBondContact O-CG 3.35Å
181	G	97.8	Very high	97.3	Very high	13 Å²	13	41.9 Å²	41.9	13%	0.134	22%	0.224	C	C	.	.	H	α-helix	trans	-72.2	-49.3	171	0	0	0	0	0	112.1	P177 I178 I179 S183 K184 F185	P177-G181 PolarHBondContact O-N 2.79Å; I178-G181 PolarHBondContact O-N 2.75Å; I179-G181 VanDerWaalsContact C-N 3.34Å; I179-G181 PolarHBondContact O-N 3.5Å; G181-S183 PolarHBondContact O-N 3.32Å; G181-K184 PolarHBondContact O-N 2.98Å; G181-F185 PolarHBondContact O-N 2.97Å
182	S	98	Very high	97.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.4	-43.3	175.8	174.5	0	0	0	0	111.9	I178 I179 K184 F185 R186 P192 D222	I178-S182 WeakPolarHBondContact O-CB 3.46Å; I178-S182 PolarHBondContact O-N 3.01Å; I179-S182 PolarHBondContact O-N 3.11Å; S182-K184 VanDerWaalsContact C-N 3.34Å; S182-K184 PolarHBondContact O-N 3.38Å; S182-F185 CarbonylContact O-C 3.25Å; S182-F185 PolarHBondContact O-N 2.66Å; S182-R186 WeakPolarHBondContact O-CB 3.3Å; S182-R186 WeakPolarHBondContact O-CG 3.43Å; S182-R186 PolarHBondContact O-N 3.43Å; S182-R186 VanDerWaalsContact O-N 3.09Å; S182-P192 VanDerWaalsContact OG-CD 3.28Å; S182-P192 WeakPolarHBondContact OG-CD 3.23Å; S182-D222 PolarHBondContact OG-OD1 3.13Å
183	S	97.9	Very high	97.4	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.07	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-40.7	178.9	75.7	0	0	0	0	112.9	I179 V180 G181 F185 R186 G189	I179-S183 PolarHBondContact O-N 3.49Å; V180-S183 PolarHBondContact O-OG 3.06Å; G181-S183 PolarHBondContact O-N 3.32Å; S183-F185 PolarHBondContact O-N 3.1Å; S183-R186 PolarHBondContact O-N 3.29Å; S183-R186 VanDerWaalsContact O-N 3.14Å; S183-R186 VanDerWaalsContact O-O 3.09Å; S183-G189 WeakPolarHBondContact O-CA 3.29Å
184	K	97.6	Very high	97.5	Very high	160 Å²	160	34 Å²	34	70%	0.696	18%	0.18	S	C	*	.	H	α-helix	trans	-63.7	-27.6	175.8	-69.9	170.1	-175.8	177.2	0	113.1	V180 G181 S182	V180-K184 WeakPolarHBondContact O-CD 3.43Å; V180-K184 WeakPolarHBondContact O-CG 3.35Å; G181-K184 PolarHBondContact O-N 2.98Å; S182-K184 VanDerWaalsContact C-N 3.34Å; S182-K184 PolarHBondContact O-N 3.38Å
185	F	97.5	Very high	97.6	Very high	20 Å²	20	34 Å²	34	9%	0.088	18%	0.18	C	C	.	.	H	α-helix	trans	-90.2	-5.8	177.6	-171.1	-113.8	0	0	0	113.8	G181 S182 S183 P211 L212 A217 C219 D222 Y266	G181-F185 PolarHBondContact O-N 2.97Å; S182-F185 CarbonylContact O-C 3.25Å; S182-F185 PolarHBondContact O-N 2.66Å; S183-F185 PolarHBondContact O-N 3.1Å; F185-P211 HydrophobicContact CD1-CB 3.96Å; F185-P211 HydrophobicContact CE1-CB 3.45Å; F185-P211 VanDerWaalsContact CE1-CB 3.45Å; F185-P211 HydrophobicContact CZ-CB 4.09Å; F185-P211 CarbonylContact O-C 3.6Å; F185-P211 WeakPolarHBondContact O-CA 3.43Å; F185-L212 HydrophobicContact CD2-CB 4.3Å; F185-L212 HydrophobicContact CE2-CB 4.49Å; F185-L212 WeakPolarHBondContact CE2-O 3Å; F185-L212 WeakPolarHBondContact O-CB 3.43Å; F185-L212 WeakPolarHBondContact O-CG 3.39Å; F185-L212 PolarHBondContact O-N 2.93Å; F185-A217 HydrophobicContact CE2-CB 4.31Å; F185-C219 HydrophobicContact CB-CB 3.67Å; F185-C219 HydrophobicContact CD1-CB 3.49Å; F185-C219 VanDerWaalsContact CD1-CB 3.49Å; F185-C219 HydrophobicContact CD2-CB 3.63Å; F185-C219 HydrophobicContact CE1-CB 3.93Å; F185-C219 HydrophobicContact CE2-CB 4.08Å; F185-C219 HydrophobicContact CG-CB 3.3Å; F185-C219 HydrophobicContact CZ-CB 4.2Å; F185-D222 HydrophobicContact CD1-CB 3.77Å; F185-D222 HydrophobicContact CE1-CB 4.48Å; F185-Y266 WeakPolarHBondContact CE1-OH 3.49Å
186	R	97.9	Very high	97.7	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.008	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-108.7	137.5	-177.2	-69.2	-84.4	176	-177.3	-6.4	110.3	S182 S183 K188 G189 C208 S209 D222 E261	S182-R186 WeakPolarHBondContact O-CB 3.3Å; S182-R186 WeakPolarHBondContact O-CG 3.43Å; S182-R186 PolarHBondContact O-N 3.43Å; S182-R186 VanDerWaalsContact O-N 3.09Å; S183-R186 PolarHBondContact O-N 3.29Å; S183-R186 VanDerWaalsContact O-N 3.14Å; S183-R186 VanDerWaalsContact O-O 3.09Å; R186-K188 PolarHBondContact O-N 2.88Å; R186-G189 PolarHBondContact O-N 3.26Å; R186-C208 PolarHBondContact NH1-SG 2.78Å; R186-S209 WeakPolarHBondContact CD-O 3.04Å; R186-S209 PolarHBondContact NH1-O 3.44Å; R186-D222 IonicContact CZ-OD1 3.28Å; R186-D222 IonicContact CZ-OD2 2.79Å; R186-D222 IonicContact NE-OD1 2.75Å; R186-D222 PolarHBondContact NE-OD1 2.88Å; R186-D222 IonicContact NE-OD2 3.08Å; R186-D222 PolarHBondContact NE-OD2 3.12Å; R186-D222 IonicContact NH2-OD1 3.46Å; R186-D222 IonicContact NH2-OD2 2.81Å; R186-D222 PolarHBondContact NH2-OD2 3.05Å; R186-E261 IonicContact CZ-OE1 3.58Å; R186-E261 IonicContact NH1-OE1 3.37Å; R186-E261 PolarHBondContact NH1-OE1 2.77Å; R186-E261 IonicContact NH2-OE1 2.81Å; R186-E261 PolarHBondContact NH2-OE1 3.13Å
187	S	97.1	Very high	97.8	Very high	7 Å²	7	27 Å²	27	5%	0.049	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-52.1	128.3	-179.2	-167.8	0	0	0	0	111.2	G189 R190 S209 Q210 D344	S187-G189 PolarHBondContact O-N 2.91Å; S187-G189 VanDerWaalsContact O-N 3.15Å; S187-R190 PolarHBondContact O-N 2.96Å; S187-S209 PolarHBondContact N-OG 3.12Å; S187-S209 WeakPolarHBondContact O-CB 2.98Å; S187-S209 PolarHBondContact O-OG 2.93Å; S187-Q210 PolarHBondContact N-O 3.39Å; S187-Q210 VanDerWaalsContact N-O 3.08Å; S187-D344 PolarHBondContact OG-OD1 2.67Å
188	K	96.5	Very high	97.8	Very high	148 Å²	148	23.3 Å²	23.3	64%	0.643	12%	0.115	S	C	*	.	G	3₁₀ helix	trans	57.3	23.8	-178.8	-57.7	-67.3	-171.4	172.2	0	114.8	C161 R186 R190 W346	C161-K188 PolarHBondContact SG-O 3.23Å; R186-K188 PolarHBondContact O-N 2.88Å; K188-R190 HydrophobicContact CB-CG 4.45Å; K188-R190 PolarHBondContact O-N 3.23Å; K188-W346 HydrophobicContact CB-CZ3 4.47Å; K188-W346 HydrophobicContact CG-CH2 4.19Å; K188-W346 HydrophobicContact CG-CZ3 4.19Å
189	G	97.3	Very high	97.6	Very high	12 Å²	12	26 Å²	26	12%	0.124	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	76.5	3.7	179.8	0	0	0	0	0	114.5	C161 S183 R186 S187 F191	C161-G189 WeakPolarHBondContact CB-O 3.17Å; S183-G189 WeakPolarHBondContact O-CA 3.29Å; R186-G189 PolarHBondContact O-N 3.26Å; S187-G189 PolarHBondContact O-N 2.91Å; S187-G189 VanDerWaalsContact O-N 3.15Å; G189-F191 VanDerWaalsContact C-N 3.33Å; G189-F191 WeakPolarHBondContact O-CD1 3.31Å; G189-F191 PolarHBondContact O-N 2.81Å
190	R	98.4	Very high	97.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.154	C	C	.	.			trans	-81.8	79	-171.7	-66.1	171.8	72	81.7	0.7	110.4	C161 T163 Y164 S187 K188 C208 S209 D344 G345 F381	C161-R190 WeakPolarHBondContact SG-CG 3.22Å; T163-R190 VanDerWaalsContact CB-NH1 3.33Å; T163-R190 PolarHBondContact O-NH1 3.06Å; T163-R190 WeakPolarHBondContact OG1-CD 3.42Å; T163-R190 PolarHBondContact OG1-NH1 3.38Å; Y164-R190 HydrophobicContact CD1-CG 4.14Å; Y164-R190 HydrophobicContact CE1-CB 3.92Å; Y164-R190 HydrophobicContact CE1-CG 3.88Å; Y164-R190 VanDerWaalsContact CE1-CZ 3.47Å; Y164-R190 HydrophobicContact CE2-CB 4.39Å; S187-R190 PolarHBondContact O-N 2.96Å; K188-R190 HydrophobicContact CB-CG 4.45Å; K188-R190 PolarHBondContact O-N 3.23Å; R190-C208 WeakPolarHBondContact O-CB 3.23Å; R190-S209 PolarHBondContact O-N 3.41Å; R190-S209 PolarHBondContact O-OG 2.98Å; R190-S209 VanDerWaalsContact O-OG 3.09Å; R190-D344 WeakPolarHBondContact CD-O 3.49Å; R190-D344 PolarHBondContact NE-O 3.27Å; R190-G345 PolarHBondContact NH2-O 3.17Å; R190-F381 PolarHBondContact NH1-O 2.9Å; R190-F381 VanDerWaalsContact NH1-O 3.13Å; R190-F381 PolarHBondContact NH2-O 3.11Å
191	F	98.4	Very high	97.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.155	C	C	.	.			trans	-74.5	162.8	-178.5	67	-90.5	0	0	0	113.1	V154 V160 Y164 L168 V170 I179 G189 V193 M225	V154-F191 HydrophobicContact CG1-CZ 4.18Å; V160-F191 HydrophobicContact CG1-CD1 3.94Å; V160-F191 HydrophobicContact CG1-CE1 3.63Å; Y164-F191 HydrophobicContact CD2-CD1 4.49Å; Y164-F191 HydrophobicContact CD2-CE1 4.28Å; Y164-F191 HydrophobicContact CE2-CD1 4.36Å; Y164-F191 HydrophobicContact CE2-CE1 4.49Å; Y164-F191 VanDerWaalsContact CE2-O 3.3Å; Y164-F191 WeakPolarHBondContact CE2-O 3.42Å; Y164-F191 PolarHBondContact OH-O 2.87Å; L168-F191 HydrophobicContact CD1-CE1 4.01Å; L168-F191 HydrophobicContact CD1-CZ 3.62Å; V170-F191 HydrophobicContact CG1-CE2 3.99Å; I179-F191 HydrophobicContact CG2-CD1 4.22Å; I179-F191 HydrophobicContact CG2-CD2 3.8Å; I179-F191 HydrophobicContact CG2-CE1 3.84Å; I179-F191 HydrophobicContact CG2-CE2 3.35Å; I179-F191 HydrophobicContact CG2-CG 4.22Å; I179-F191 HydrophobicContact CG2-CZ 3.38Å; G189-F191 VanDerWaalsContact C-N 3.33Å; G189-F191 WeakPolarHBondContact O-CD1 3.31Å; G189-F191 PolarHBondContact O-N 2.81Å; F191-V193 HydrophobicContact CD2-CG1 3.59Å; F191-V193 HydrophobicContact CE2-CG1 3.18Å; F191-V193 HydrophobicContact CG-CG1 4.41Å; F191-V193 HydrophobicContact CZ-CG1 3.71Å; F191-V193 PolarHBondContact O-N 2.88Å; F191-M225 HydrophobicContact CD2-CE 4.36Å
192	P	98.5	Very high	97	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.17	C	C	.	.			trans	-57.2	117.9	176.7	-27	37.7	0	0	0	113.7	S182 C208 M225 L226 I229 L339	S182-P192 VanDerWaalsContact OG-CD 3.28Å; S182-P192 WeakPolarHBondContact OG-CD 3.23Å; P192-C208 HydrophobicContact CG-CB 4.15Å; P192-M225 HydrophobicContact CB-CE 4.49Å; P192-M225 HydrophobicContact CB-CG 4.13Å; P192-M225 HydrophobicContact CG-CG 4.19Å; P192-M225 WeakPolarHBondContact O-CE 3.44Å; P192-L226 HydrophobicContact CG-CD1 3.79Å; P192-I229 HydrophobicContact CB-CD1 3.59Å; P192-L339 HydrophobicContact CB-CD1 3.85Å; P192-L339 HydrophobicContact CB-CD2 4.48Å; P192-L339 HydrophobicContact CG-CD1 4.28Å; P192-L339 HydrophobicContact CG-CD2 4.18Å
193	V	98.5	Very high	97	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.4	177.6	-67.1	0	0	0	0	111.4	Y164 L168 V170 F191 C206 R207 F381	Y164-V193 HydrophobicContact CD2-CG1 4.4Å; Y164-V193 HydrophobicContact CD2-CG2 4.3Å; Y164-V193 HydrophobicContact CE2-CB 4.37Å; Y164-V193 HydrophobicContact CE2-CG1 3.89Å; Y164-V193 HydrophobicContact CE2-CG2 3.52Å; L168-V193 HydrophobicContact CB-CG1 4.45Å; L168-V193 HydrophobicContact CD1-CG1 4.34Å; L168-V193 HydrophobicContact CD2-CB 4.34Å; L168-V193 HydrophobicContact CD2-CG1 4.12Å; L168-V193 HydrophobicContact CD2-CG2 4.3Å; V170-V193 HydrophobicContact CG1-CG1 4.36Å; F191-V193 HydrophobicContact CD2-CG1 3.59Å; F191-V193 HydrophobicContact CE2-CG1 3.18Å; F191-V193 HydrophobicContact CG-CG1 4.41Å; F191-V193 HydrophobicContact CZ-CG1 3.71Å; F191-V193 PolarHBondContact O-N 2.88Å; V193-C206 CarbonylContact O-C 3.35Å; V193-C206 WeakPolarHBondContact O-CA 3.46Å; V193-C206 WeakPolarHBondContact O-CB 3.27Å; V193-R207 HydrophobicContact CG2-CG 4.05Å; V193-R207 PolarHBondContact N-O 3.08Å; V193-R207 VanDerWaalsContact N-O 3.09Å; V193-R207 PolarHBondContact O-N 2.87Å; V193-F381 HydrophobicContact CG2-CE1 3.65Å; V193-F381 HydrophobicContact CG2-CZ 4.09Å
194	L	98.6	Very high	97	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	136.3	177.4	-172.8	71.1	0	0	0	111.2	F139 V144 W149 Y169 Y196 F197 A204	F139-L194 HydrophobicContact CD1-CD2 4.37Å; F139-L194 HydrophobicContact CE1-CD2 4.19Å; F139-L194 HydrophobicContact CE1-CG 4.43Å; V144-L194 HydrophobicContact CB-CD2 4.47Å; V144-L194 HydrophobicContact CG1-CD2 3.93Å; V144-L194 HydrophobicContact CG2-CD2 3.98Å; W149-L194 HydrophobicContact CD2-CD1 4.23Å; W149-L194 HydrophobicContact CD2-CD2 4.12Å; W149-L194 HydrophobicContact CE3-CB 3.85Å; W149-L194 HydrophobicContact CE3-CD1 4.12Å; W149-L194 HydrophobicContact CE3-CD2 4.01Å; W149-L194 HydrophobicContact CE3-CG 4.22Å; W149-L194 HydrophobicContact CG-CD2 4.36Å; W149-L194 HydrophobicContact CH2-CD1 4.12Å; W149-L194 HydrophobicContact CZ2-CD1 4.23Å; W149-L194 HydrophobicContact CZ3-CB 3.78Å; W149-L194 HydrophobicContact CZ3-CD1 4.05Å; W149-L194 HydrophobicContact CZ3-CG 4.38Å; Y169-L194 WeakPolarHBondContact O-CB 3.45Å; Y169-L194 PolarHBondContact O-N 3.39Å; L194-Y196 WeakPolarHBondContact CD1-O 3.39Å; L194-F197 HydrophobicContact CD1-CB 4.31Å; L194-F197 HydrophobicContact CD2-CB 4.32Å; L194-A204 HydrophobicContact CD1-CB 3.73Å
195	T	97.8	Very high	97	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-26.1	171.9	-152.7	0	0	0	0	112.4	V205 R207 C353 K376 D377	T195-V205 HydrophobicContact CG2-CB 4.09Å; T195-V205 HydrophobicContact CG2-CG1 3.75Å; T195-V205 PolarHBondContact N-O 3.06Å; T195-R207 WeakPolarHBondContact OG1-CD 3.36Å; T195-C353 HydrophobicContact CG2-CB 3.85Å; T195-K376 PolarHBondContact O-NZ 2.98Å; T195-D377 PolarHBondContact OG1-OD1 2.88Å; T195-D377 PolarHBondContact OG1-OD2 3.32Å
196	Y	98.4	Very high	97.1	Very high	10 Å²	10	28.2 Å²	28.2	4%	0.039	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	142.2	175.5	179.9	-105.9	0	0	0	110.8	M142 L194 Y198 V205 M360 D361 Y364	M142-Y196 HydrophobicContact CG-CD2 4.46Å; M142-Y196 HydrophobicContact CG-CE2 4.48Å; M142-Y196 HydrophobicContact SD-CD2 3.45Å; M142-Y196 WeakPolarHBondContact SD-CD2 3.46Å; M142-Y196 HydrophobicContact SD-CE2 4.02Å; M142-Y196 HydrophobicContact SD-CG 4.28Å; L194-Y196 WeakPolarHBondContact CD1-O 3.39Å; Y196-Y198 AromaticContact CE1-CD2 3.98Å; Y196-Y198 HydrophobicContact CE1-CD2 3.98Å; Y196-V205 HydrophobicContact CD1-CG2 4.25Å; Y196-V205 PolarHBondContact N-O 3.13Å; Y196-V205 PolarHBondContact O-N 3.29Å; Y196-M360 HydrophobicContact CD1-CE 3.75Å; Y196-M360 HydrophobicContact CE1-CB 4.03Å; Y196-M360 HydrophobicContact CE1-CE 3.82Å; Y196-M360 HydrophobicContact CE1-SD 4.21Å; Y196-D361 HydrophobicContact CE2-CB 4.02Å; Y196-D361 WeakPolarHBondContact CE2-OD2 3.34Å; Y196-Y364 AromaticContact CD2-CE2 3.8Å; Y196-Y364 HydrophobicContact CD2-CE2 3.8Å; Y196-Y364 AromaticContact CE2-CE2 3.78Å; Y196-Y364 HydrophobicContact CE2-CE2 3.78Å
197	F	98.2	Very high	97.1	Very high	6 Å²	6	28.2 Å²	28.2	3%	0.026	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	115.1	178.3	-176.6	-113.3	0	0	0	111	V144 N146 W149 L194 Q199 K202 A204	V144-F197 HydrophobicContact CG2-CB 3.91Å; V144-F197 HydrophobicContact CG2-CD1 3.94Å; V144-F197 HydrophobicContact CG2-CG 4.05Å; N146-F197 WeakPolarHBondContact ND2-CE1 3.45Å; W149-F197 AromaticContact CD1-CE2 3.84Å; W149-F197 AromaticContact NE1-CD2 3.86Å; W149-F197 AromaticContact NE1-CE2 3.63Å; L194-F197 HydrophobicContact CD1-CB 4.31Å; L194-F197 HydrophobicContact CD2-CB 4.32Å; F197-Q199 HydrophobicContact CD1-CG 4.31Å; F197-Q199 PolarHBondContact O-N 3.04Å; F197-K202 HydrophobicContact CE1-CD 4.26Å; F197-K202 HydrophobicContact CZ-CB 4.13Å; F197-K202 HydrophobicContact CZ-CD 3.93Å; F197-A204 HydrophobicContact CD2-CB 4.22Å
198	Y	97	Very high	97.2	Very high	18 Å²	18	27.9 Å²	27.9	7%	0.071	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	96.1	-178.6	-167.2	-110.8	0	0	0	110.4	Y196 E200 K201 K202 A203 V331 T332 M360	Y196-Y198 AromaticContact CE1-CD2 3.98Å; Y196-Y198 HydrophobicContact CE1-CD2 3.98Å; Y198-E200 VanDerWaalsContact C-N 3.27Å; Y198-E200 HydrophobicContact CD1-CB 4.22Å; Y198-E200 HydrophobicContact CE1-CB 3.65Å; Y198-E200 WeakPolarHBondContact CE1-OE2 3.47Å; Y198-E200 PolarHBondContact O-N 3.45Å; Y198-E200 PolarHBondContact OH-OE2 3.11Å; Y198-K201 HydrophobicContact CD1-CB 3.99Å; Y198-K201 HydrophobicContact CD1-CG 3.86Å; Y198-K201 HydrophobicContact CE1-CB 4.44Å; Y198-K201 HydrophobicContact CE1-CG 3.82Å; Y198-K201 PolarHBondContact O-N 3.12Å; Y198-K202 WeakPolarHBondContact O-CA 3.27Å; Y198-K202 PolarHBondContact O-N 3.31Å; Y198-A203 PolarHBondContact N-O 3.29Å; Y198-A203 PolarHBondContact O-N 3.34Å; Y198-V331 HydrophobicContact CD1-CG1 4.16Å; Y198-V331 HydrophobicContact CG-CG1 3.91Å; Y198-T332 HydrophobicContact CE1-CG2 4.21Å; Y198-T332 HydrophobicContact CE2-CG2 4.35Å; Y198-M360 HydrophobicContact CD2-CB 4.3Å; Y198-M360 HydrophobicContact CD2-SD 4.44Å; Y198-M360 HydrophobicContact CE2-CB 4.35Å
199	Q	93.6	Very high	97.3	Very high	90 Å²	90	20.8 Å²	20.8	42%	0.421	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-32.6	-170.4	-68.9	-174.5	5.9	0	0	114.9	R141 M142 F197 K202	R141-Q199 PolarHBondContact O-NE2 2.93Å; R141-Q199 VanDerWaalsContact O-NE2 3.15Å; M142-Q199 WeakPolarHBondContact O-CG 3.22Å; M142-Q199 PolarHBondContact O-NE2 2.9Å; F197-Q199 HydrophobicContact CD1-CG 4.31Å; F197-Q199 PolarHBondContact O-N 3.04Å; Q199-K202 VanDerWaalsContact O-CD 3.29Å; Q199-K202 WeakPolarHBondContact O-CD 3.48Å; Q199-K202 WeakPolarHBondContact O-CE 3.23Å; Q199-K202 PolarHBondContact O-NZ 2.79Å
200	E	91.9	Very high	97.3	Very high	122 Å²	122	20.2 Å²	20.2	57%	0.57	9%	0.091	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-43.9	-175	-167.7	-149.4	141.7	0	0	111.7	Y198	Y198-E200 VanDerWaalsContact C-N 3.27Å; Y198-E200 HydrophobicContact CD1-CB 4.22Å; Y198-E200 HydrophobicContact CE1-CB 3.65Å; Y198-E200 WeakPolarHBondContact CE1-OE2 3.47Å; Y198-E200 PolarHBondContact O-N 3.45Å; Y198-E200 PolarHBondContact OH-OE2 3.11Å
201	K	93.8	Very high	97.2	Very high	70 Å²	70	20.2 Å²	20.2	30%	0.304	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-2.1	177.9	-54.3	-62.8	-178.6	-164.4	0	113.8	Y198 A203 N235 T332	Y198-K201 HydrophobicContact CD1-CB 3.99Å; Y198-K201 HydrophobicContact CD1-CG 3.86Å; Y198-K201 HydrophobicContact CE1-CB 4.44Å; Y198-K201 HydrophobicContact CE1-CG 3.82Å; Y198-K201 PolarHBondContact O-N 3.12Å; K201-A203 HydrophobicContact CB-CB 4.2Å; K201-A203 PolarHBondContact O-N 3.11Å; K201-N235 PolarHBondContact O-ND2 2.71Å; K201-T332 VanDerWaalsContact CE-O 3.3Å; K201-T332 WeakPolarHBondContact CE-O 3.11Å
202	K	95.1	Very high	97	Very high	106 Å²	106	23.2 Å²	23.2	46%	0.461	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	29.3	-171.1	-51.3	-59.9	175.9	-155.6	0	113.1	F197 Y198 Q199	F197-K202 HydrophobicContact CE1-CD 4.26Å; F197-K202 HydrophobicContact CZ-CB 4.13Å; F197-K202 HydrophobicContact CZ-CD 3.93Å; Y198-K202 WeakPolarHBondContact O-CA 3.27Å; Y198-K202 PolarHBondContact O-N 3.31Å; Q199-K202 VanDerWaalsContact O-CD 3.29Å; Q199-K202 WeakPolarHBondContact O-CD 3.48Å; Q199-K202 WeakPolarHBondContact O-CE 3.23Å; Q199-K202 PolarHBondContact O-NZ 2.79Å
203	A	97	Very high	96.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	140.6	-179	0	0	0	0	0	110.4	Y198 K201 V331	Y198-A203 PolarHBondContact N-O 3.29Å; Y198-A203 PolarHBondContact O-N 3.34Å; K201-A203 HydrophobicContact CB-CB 4.2Å; K201-A203 PolarHBondContact O-N 3.11Å; A203-V331 HydrophobicContact CB-CG1 3.91Å
204	A	98.1	Very high	96	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.008	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.3	-175.2	0	0	0	0	0	111.8	W149 L194 F197 S337 V338	W149-A204 HydrophobicContact CH2-CB 3.99Å; W149-A204 HydrophobicContact CZ2-CB 3.33Å; L194-A204 HydrophobicContact CD1-CB 3.73Å; F197-A204 HydrophobicContact CD2-CB 4.22Å; A204-S337 PolarHBondContact N-OG 3.1Å; A204-S337 VanDerWaalsContact N-OG 3.13Å; A204-S337 CarbonylContact O-C 3.56Å; A204-S337 VanDerWaalsContact O-CA 3.25Å; A204-S337 WeakPolarHBondContact O-CA 3.29Å; A204-S337 WeakPolarHBondContact O-CB 3.47Å; A204-V338 PolarHBondContact O-N 2.77Å
205	V	98.6	Very high	95.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118.9	161.4	-172.8	0	0	0	0	108	T195 Y196 L327 V331 V338 V340 M360	T195-V205 HydrophobicContact CG2-CB 4.09Å; T195-V205 HydrophobicContact CG2-CG1 3.75Å; T195-V205 PolarHBondContact N-O 3.06Å; Y196-V205 HydrophobicContact CD1-CG2 4.25Å; Y196-V205 PolarHBondContact N-O 3.13Å; Y196-V205 PolarHBondContact O-N 3.29Å; V205-L327 HydrophobicContact CG1-CD1 3.99Å; V205-L327 HydrophobicContact CG1-CD2 4.17Å; V205-L327 HydrophobicContact CG2-CD1 4Å; V205-V331 HydrophobicContact CG2-CG2 3.85Å; V205-V338 WeakPolarHBondContact CA-O 3.46Å; V205-V340 HydrophobicContact CG1-CG2 4.19Å; V205-M360 HydrophobicContact CG2-CE 3.95Å
206	C	98.7	Very high	94.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	155.1	174.2	-63	0	0	0	0	110.2	W149 V193 I229 V338 L339 V340	W149-C206 VanDerWaalsContact CH2-SG 3.51Å; V193-C206 CarbonylContact O-C 3.35Å; V193-C206 WeakPolarHBondContact O-CA 3.46Å; V193-C206 WeakPolarHBondContact O-CB 3.27Å; C206-I229 HydrophobicContact CB-CD1 4.32Å; C206-V338 PolarHBondContact N-O 3.1Å; C206-L339 HydrophobicContact CB-CD1 3.6Å; C206-V340 PolarHBondContact O-N 3.34Å
207	R	98.7	Very high	94	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.2	175.5	64.1	-171	-66	170.8	-4.9	111.6	Y164 V193 T195 V340 G345 T349 D377 F381	Y164-R207 PolarHBondContact OH-O 3.31Å; V193-R207 HydrophobicContact CG2-CG 4.05Å; V193-R207 PolarHBondContact N-O 3.08Å; V193-R207 VanDerWaalsContact N-O 3.09Å; V193-R207 PolarHBondContact O-N 2.87Å; T195-R207 WeakPolarHBondContact OG1-CD 3.36Å; R207-V340 VanDerWaalsContact CA-O 3.32Å; R207-V340 WeakPolarHBondContact CA-O 3.46Å; R207-G345 PolarHBondContact NH2-O 3.38Å; R207-T349 HydrophobicContact CB-CG2 3.8Å; R207-D377 PolarHBondContact NH1-O 2.65Å; R207-D377 IonicContact NH1-OD2 3.62Å; R207-D377 PolarHBondContact NH2-O 3.01Å; R207-F381 HydrophobicContact CG-CE1 4.44Å
208	C	98.6	Very high	93.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	-175.6	170.6	64.2	0	0	0	0	112	R186 R190 P192 L339 V340 H341 G345	R186-C208 PolarHBondContact NH1-SG 2.78Å; R190-C208 WeakPolarHBondContact O-CB 3.23Å; P192-C208 HydrophobicContact CG-CB 4.15Å; C208-L339 HydrophobicContact CB-CD1 4.25Å; C208-V340 PolarHBondContact N-O 3.32Å; C208-V340 VanDerWaalsContact N-O 3.1Å; C208-H341 WeakPolarHBondContact O-CA 3.45Å; C208-H341 WeakPolarHBondContact O-CB 3.37Å; C208-H341 VanDerWaalsContact SG-CB 3.59Å; C208-G345 VanDerWaalsContact O-CA 3.27Å; C208-G345 WeakPolarHBondContact O-CA 3.33Å
209	S	98.1	Very high	93.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-93.6	172.8	161.6	67.4	0	0	0	0	112.2	R186 S187 R190	R186-S209 WeakPolarHBondContact CD-O 3.04Å; R186-S209 PolarHBondContact NH1-O 3.44Å; S187-S209 PolarHBondContact N-OG 3.12Å; S187-S209 WeakPolarHBondContact O-CB 2.98Å; S187-S209 PolarHBondContact O-OG 2.93Å; R190-S209 PolarHBondContact O-N 3.41Å; R190-S209 PolarHBondContact O-OG 2.98Å; R190-S209 VanDerWaalsContact O-OG 3.09Å
210	Q	96.8	Very high	93.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-59.7	149.9	172.5	72.8	-162.9	-56.7	0	0	113	S187 N253 K258 G259 C342 S343	S187-Q210 PolarHBondContact N-O 3.39Å; S187-Q210 VanDerWaalsContact N-O 3.08Å; Q210-N253 PolarHBondContact OE1-OD1 2.93Å; Q210-K258 HydrophobicContact CG-CB 4.16Å; Q210-K258 VanDerWaalsContact OE1-CB 3.27Å; Q210-G259 WeakPolarHBondContact CB-O 3.45Å; Q210-C342 WeakPolarHBondContact CB-O 3.47Å; Q210-C342 PolarHBondContact N-O 2.67Å; Q210-S343 WeakPolarHBondContact CG-O 3.43Å; Q210-S343 PolarHBondContact N-O 3.09Å; Q210-S343 VanDerWaalsContact N-O 3.11Å; Q210-S343 VanDerWaalsContact NE2-C 3.33Å; Q210-S343 PolarHBondContact NE2-O 3.38Å
211	P	96.6	Very high	94.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-70.5	154.3	168.4	31.2	-34.4	0	0	0	111.7	F185 S213 K258 G259 E261	F185-P211 HydrophobicContact CD1-CB 3.96Å; F185-P211 HydrophobicContact CE1-CB 3.45Å; F185-P211 VanDerWaalsContact CE1-CB 3.45Å; F185-P211 HydrophobicContact CZ-CB 4.09Å; F185-P211 CarbonylContact O-C 3.6Å; F185-P211 WeakPolarHBondContact O-CA 3.43Å; P211-S213 PolarHBondContact O-N 2.94Å; P211-K258 CarbonylContact O-C 3.06Å; P211-G259 PolarHBondContact O-N 3.22Å; P211-G259 VanDerWaalsContact O-N 3.14Å; P211-E261 WeakPolarHBondContact CD-OE2 3.35Å; P211-E261 HydrophobicContact CG-CG 4.37Å
212	L	94.4	Very high	94.3	Very high	62 Å²	62	40.1 Å²	40.1	33%	0.325	21%	0.208	S	C	.	.			trans	-88.7	47.1	172.9	-59.2	179.4	0	0	0	110.6	F185 K258	F185-L212 HydrophobicContact CD2-CB 4.3Å; F185-L212 HydrophobicContact CE2-CB 4.49Å; F185-L212 WeakPolarHBondContact CE2-O 3Å; F185-L212 WeakPolarHBondContact O-CB 3.43Å; F185-L212 WeakPolarHBondContact O-CG 3.39Å; F185-L212 PolarHBondContact O-N 2.93Å; L212-K258 HydrophobicContact CD2-CG 3.9Å
213	S	88.7	Confident	94.3	Very high	13 Å²	13	36.1 Å²	36.1	9%	0.091	19%	0.191	C	C	.	.			trans	-74.1	-23.9	-172.9	54.6	0	0	0	0	114.2	P211 F215 S216 A217 Y260	P211-S213 PolarHBondContact O-N 2.94Å; S213-F215 PolarHBondContact O-N 2.84Å; S213-S216 PolarHBondContact O-N 3.13Å; S213-A217 WeakPolarHBondContact O-CA 3.34Å; S213-A217 VanDerWaalsContact O-CB 3.32Å; S213-A217 WeakPolarHBondContact O-CB 3.36Å; S213-A217 PolarHBondContact O-N 3.42Å; S213-Y260 PolarHBondContact OG-N 2.85Å; S213-Y260 PolarHBondContact OG-O 3.4Å; S213-Y260 VanDerWaalsContact OG-O 3.08Å
214	G	87.5	Confident	94.3	Very high	8 Å²	8	38.3 Å²	38.3	8%	0.082	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	-133	-173.9	0	0	0	0	0	111.8	R254 G257 K258	G214-R254 WeakPolarHBondContact O-CG 3.37Å; G214-R254 PolarHBondContact O-NE 2.63Å; G214-G257 PolarHBondContact N-O 3.47Å; G214-K258 WeakPolarHBondContact CA-O 3.41Å; G214-K258 PolarHBondContact N-O 3.47Å
215	F	79.8	Confident	94.3	Very high	149 Å²	149	38.2 Å²	38.2	65%	0.654	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-41.4	174.4	-67.6	-78.7	0	0	0	113	S213 R254 A255	S213-F215 PolarHBondContact O-N 2.84Å; F215-R254 PolarHBondContact O-NH2 3.39Å; F215-A255 HydrophobicContact CZ-CB 4.36Å
216	S	84.1	Confident	94.1	Very high	109 Å²	109	38.5 Å²	38.5	76%	0.762	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-150.5	5.9	-168	56.7	0	0	0	0	115.7	S213	S213-S216 PolarHBondContact O-N 3.13Å
217	A	89.5	Confident	94	Very high	49 Å²	49	42.1 Å²	42.1	41%	0.405	22%	0.224	S	C	.	.			trans	-69.5	140.4	178.8	0	0	0	0	0	111.2	F185 S213	F185-A217 HydrophobicContact CE2-CB 4.31Å; S213-A217 WeakPolarHBondContact O-CA 3.34Å; S213-A217 VanDerWaalsContact O-CB 3.32Å; S213-A217 WeakPolarHBondContact O-CB 3.36Å; S213-A217 PolarHBondContact O-N 3.42Å
218	R	93.4	Very high	93.8	Very high	138 Å²	138	42.3 Å²	42.3	52%	0.521	23%	0.226	S	C	.	.			trans	-133.6	145.2	-171.8	-166.9	-178.4	172.7	175.4	-0.4	109.4	E223	R218-E223 WeakPolarHBondContact CD-OE1 3.44Å; R218-E223 WeakPolarHBondContact CG-OE1 3.39Å; R218-E223 IonicContact CZ-OE1 3.65Å; R218-E223 IonicContact CZ-OE2 3.26Å; R218-E223 VanDerWaalsContact CZ-OE2 3.26Å; R218-E223 VanDerWaalsContact NE-CD 3.27Å; R218-E223 IonicContact NE-OE1 2.75Å; R218-E223 PolarHBondContact NE-OE1 2.93Å; R218-E223 IonicContact NE-OE2 3Å; R218-E223 PolarHBondContact NE-OE2 2.86Å; R218-E223 IonicContact NH2-OE1 3.74Å; R218-E223 IonicContact NH2-OE2 2.68Å; R218-E223 PolarHBondContact NH2-OE2 3.11Å
219	C	95.3	Very high	93.8	Very high	12 Å²	12	42.4 Å²	42.4	8%	0.081	23%	0.226	C	C	.	.			trans	-134	113	178.1	179.5	0	0	0	0	109.5	F185 E221 D222 E223	F185-C219 HydrophobicContact CB-CB 3.67Å; F185-C219 HydrophobicContact CD1-CB 3.49Å; F185-C219 VanDerWaalsContact CD1-CB 3.49Å; F185-C219 HydrophobicContact CD2-CB 3.63Å; F185-C219 HydrophobicContact CE1-CB 3.93Å; F185-C219 HydrophobicContact CE2-CB 4.08Å; F185-C219 HydrophobicContact CG-CB 3.3Å; F185-C219 HydrophobicContact CZ-CB 4.2Å; C219-E221 VanDerWaalsContact C-N 3.26Å; C219-E221 PolarHBondContact O-N 3.17Å; C219-E221 PolarHBondContact SG-OE2 3.05Å; C219-E221 VanDerWaalsContact SG-OE2 3.41Å; C219-D222 HydrophobicContact CB-CB 3.87Å; C219-D222 PolarHBondContact O-N 3.16Å; C219-D222 PolarHBondContact SG-N 3.3Å; C219-D222 VanDerWaalsContact SG-N 3.41Å; C219-E223 PolarHBondContact O-N 2.89Å; C219-E223 VanDerWaalsContact O-N 3.08Å
220	L	96.2	Very high	93.6	Very high	110 Å²	110	42.8 Å²	42.8	58%	0.576	23%	0.229	S	C	*	.	H	α-helix	trans	-67.8	-31.1	-177	-62.6	176.9	0	0	0	111.4	S224	L220-S224 VanDerWaalsContact O-CB 3.26Å; L220-S224 WeakPolarHBondContact O-CB 3.2Å; L220-S224 PolarHBondContact O-N 2.91Å; L220-S224 PolarHBondContact O-OG 3.46Å
221	E	97.4	Very high	93.5	Very high	84 Å²	84	48.2 Å²	48.2	39%	0.393	25%	0.252	S	S	.	.	H	α-helix	trans	-70.1	-39.7	176.2	-62.4	83.4	174.3	0	0	111.6	I178 C219 S224 M225	I178-E221 WeakPolarHBondContact CG2-O 3.41Å; C219-E221 VanDerWaalsContact C-N 3.26Å; C219-E221 PolarHBondContact O-N 3.17Å; C219-E221 PolarHBondContact SG-OE2 3.05Å; C219-E221 VanDerWaalsContact SG-OE2 3.41Å; E221-S224 PolarHBondContact O-N 2.85Å; E221-M225 WeakPolarHBondContact O-CB 3.27Å; E221-M225 PolarHBondContact O-N 3.41Å
222	D	97.2	Very high	93.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-70.1	-39.7	176.3	-166.3	78.1	0	0	0	112	S182 F185 R186 C219 M225 L226 Y266	S182-D222 PolarHBondContact OG-OD1 3.13Å; F185-D222 HydrophobicContact CD1-CB 3.77Å; F185-D222 HydrophobicContact CE1-CB 4.48Å; R186-D222 IonicContact CZ-OD1 3.28Å; R186-D222 IonicContact CZ-OD2 2.79Å; R186-D222 IonicContact NE-OD1 2.75Å; R186-D222 PolarHBondContact NE-OD1 2.88Å; R186-D222 IonicContact NE-OD2 3.08Å; R186-D222 PolarHBondContact NE-OD2 3.12Å; R186-D222 IonicContact NH2-OD1 3.46Å; R186-D222 IonicContact NH2-OD2 2.81Å; R186-D222 PolarHBondContact NH2-OD2 3.05Å; C219-D222 HydrophobicContact CB-CB 3.87Å; C219-D222 PolarHBondContact O-N 3.16Å; C219-D222 PolarHBondContact SG-N 3.3Å; C219-D222 VanDerWaalsContact SG-N 3.41Å; D222-M225 WeakPolarHBondContact O-CB 3.39Å; D222-M225 PolarHBondContact O-N 2.99Å; D222-L226 WeakPolarHBondContact O-CD1 3.06Å; D222-L226 PolarHBondContact O-N 2.92Å; D222-Y266 PolarHBondContact OD2-OH 3.36Å
223	E	96.2	Very high	93.4	Very high	22 Å²	22	45.5 Å²	45.5	10%	0.103	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-42.7	170.8	-74.3	165.1	-158.3	0	0	112	R218 C219 M225 L226 Q227 Y266	R218-E223 WeakPolarHBondContact CD-OE1 3.44Å; R218-E223 WeakPolarHBondContact CG-OE1 3.39Å; R218-E223 IonicContact CZ-OE1 3.65Å; R218-E223 IonicContact CZ-OE2 3.26Å; R218-E223 VanDerWaalsContact CZ-OE2 3.26Å; R218-E223 VanDerWaalsContact NE-CD 3.27Å; R218-E223 IonicContact NE-OE1 2.75Å; R218-E223 PolarHBondContact NE-OE1 2.93Å; R218-E223 IonicContact NE-OE2 3Å; R218-E223 PolarHBondContact NE-OE2 2.86Å; R218-E223 IonicContact NH2-OE1 3.74Å; R218-E223 IonicContact NH2-OE2 2.68Å; R218-E223 PolarHBondContact NH2-OE2 3.11Å; C219-E223 PolarHBondContact O-N 2.89Å; C219-E223 VanDerWaalsContact O-N 3.08Å; E223-M225 VanDerWaalsContact C-N 3.27Å; E223-M225 PolarHBondContact O-N 3.24Å; E223-L226 PolarHBondContact O-N 2.91Å; E223-Q227 WeakPolarHBondContact O-CB 3.38Å; E223-Q227 PolarHBondContact O-N 3.41Å; E223-Y266 HydrophobicContact CB-CD1 4.46Å; E223-Y266 HydrophobicContact CB-CE1 4.31Å; E223-Y266 HydrophobicContact CG-CD1 3.76Å; E223-Y266 HydrophobicContact CG-CE1 3.56Å; E223-Y266 HydrophobicContact CG-CE2 4.34Å; E223-Y266 HydrophobicContact CG-CG 4.27Å
224	S	96.6	Very high	93.5	Very high	46 Å²	46	52 Å²	52	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-35.1	174.2	-61	0	0	0	0	111.8	L220 E221 Q227 A228	L220-S224 VanDerWaalsContact O-CB 3.26Å; L220-S224 WeakPolarHBondContact O-CB 3.2Å; L220-S224 PolarHBondContact O-N 2.91Å; L220-S224 PolarHBondContact O-OG 3.46Å; E221-S224 PolarHBondContact O-N 2.85Å; S224-Q227 PolarHBondContact O-N 3.16Å; S224-A228 WeakPolarHBondContact O-CB 3.41Å; S224-A228 PolarHBondContact O-N 2.81Å
225	M	97.3	Very high	93.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-46.6	175.8	-170.6	61.5	180	0	0	111.6	V170 A174 I178 F191 P192 E221 D222 E223 Q227 A228 I229	V170-M225 HydrophobicContact CB-CE 4.11Å; V170-M225 HydrophobicContact CG1-CE 3.85Å; A174-M225 HydrophobicContact CB-CE 4.23Å; A174-M225 HydrophobicContact CB-SD 3.53Å; A174-M225 VanDerWaalsContact CB-SD 3.53Å; I178-M225 HydrophobicContact CG2-CB 3.98Å; I178-M225 HydrophobicContact CG2-SD 4.13Å; F191-M225 HydrophobicContact CD2-CE 4.36Å; P192-M225 HydrophobicContact CB-CE 4.49Å; P192-M225 HydrophobicContact CB-CG 4.13Å; P192-M225 HydrophobicContact CG-CG 4.19Å; P192-M225 WeakPolarHBondContact O-CE 3.44Å; E221-M225 WeakPolarHBondContact O-CB 3.27Å; E221-M225 PolarHBondContact O-N 3.41Å; D222-M225 WeakPolarHBondContact O-CB 3.39Å; D222-M225 PolarHBondContact O-N 2.99Å; E223-M225 VanDerWaalsContact C-N 3.27Å; E223-M225 PolarHBondContact O-N 3.24Å; M225-Q227 VanDerWaalsContact C-N 3.32Å; M225-Q227 PolarHBondContact O-N 3.31Å; M225-A228 WeakPolarHBondContact O-CB 3.48Å; M225-A228 PolarHBondContact O-N 2.98Å; M225-I229 WeakPolarHBondContact O-CG1 3.44Å; M225-I229 PolarHBondContact O-N 3.22Å
226	L	95.9	Very high	94.1	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.031	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-35.5	174.8	-88.3	71.9	0	0	0	111.6	P192 D222 E223 A228 I229 S230 V241 E261 Y266 I269 L339	P192-L226 HydrophobicContact CG-CD1 3.79Å; D222-L226 WeakPolarHBondContact O-CD1 3.06Å; D222-L226 PolarHBondContact O-N 2.92Å; E223-L226 PolarHBondContact O-N 2.91Å; L226-A228 VanDerWaalsContact C-N 3.33Å; L226-I229 PolarHBondContact O-N 2.64Å; L226-S230 PolarHBondContact O-N 2.87Å; L226-V241 HydrophobicContact CD2-CG2 4.09Å; L226-E261 HydrophobicContact CD2-CG 4.31Å; L226-Y266 HydrophobicContact CB-CD1 4.33Å; L226-Y266 HydrophobicContact CD1-CE1 4.41Å; L226-Y266 HydrophobicContact CD2-CD1 3.72Å; L226-Y266 HydrophobicContact CD2-CE1 3.87Å; L226-I269 HydrophobicContact CD2-CG2 4.07Å; L226-L339 HydrophobicContact CD1-CD2 3.9Å; L226-L339 HydrophobicContact CD2-CD2 3.87Å; L226-L339 HydrophobicContact CG-CD2 3.91Å
227	Q	95.1	Very high	94.2	Very high	76 Å²	76	56 Å²	56	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-34.8	173.1	-159	-166.1	55.2	0	0	112.1	E223 S224 M225 S230 K231	E223-Q227 WeakPolarHBondContact O-CB 3.38Å; E223-Q227 PolarHBondContact O-N 3.41Å; S224-Q227 PolarHBondContact O-N 3.16Å; M225-Q227 VanDerWaalsContact C-N 3.32Å; M225-Q227 PolarHBondContact O-N 3.31Å; Q227-S230 PolarHBondContact O-N 3Å; Q227-K231 HydrophobicContact CG-CD 4.34Å; Q227-K231 WeakPolarHBondContact O-CB 3.38Å; Q227-K231 VanDerWaalsContact O-CG 3.3Å; Q227-K231 WeakPolarHBondContact O-CG 3.24Å; Q227-K231 PolarHBondContact O-N 3.5Å
228	A	96.3	Very high	94.3	Very high	5 Å²	5	55.8 Å²	55.8	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-65.8	-42.2	174	0	0	0	0	0	111.6	P171 T173 A174 S224 M225 L226 S230 K231 A232	P171-A228 HydrophobicContact CB-CB 3.92Å; P171-A228 HydrophobicContact CG-CB 4.03Å; T173-A228 WeakPolarHBondContact OG1-CB 3.47Å; A174-A228 HydrophobicContact CB-CB 4.3Å; S224-A228 WeakPolarHBondContact O-CB 3.41Å; S224-A228 PolarHBondContact O-N 2.81Å; M225-A228 WeakPolarHBondContact O-CB 3.48Å; M225-A228 PolarHBondContact O-N 2.98Å; L226-A228 VanDerWaalsContact C-N 3.33Å; A228-S230 VanDerWaalsContact C-N 3.34Å; A228-S230 PolarHBondContact O-N 2.92Å; A228-K231 PolarHBondContact O-N 3.35Å; A228-A232 WeakPolarHBondContact O-CB 3.32Å; A228-A232 PolarHBondContact O-N 2.75Å
229	I	96.6	Very high	94.4	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-40	173.2	-63.7	168.9	0	0	0	111.1	W149 P171 P192 C206 M225 L226 A232 V239	W149-I229 HydrophobicContact CH2-CG1 4.12Å; W149-I229 HydrophobicContact CH2-CG2 4.32Å; P171-I229 HydrophobicContact CG-CB 4.46Å; P171-I229 HydrophobicContact CG-CG1 3.73Å; P192-I229 HydrophobicContact CB-CD1 3.59Å; C206-I229 HydrophobicContact CB-CD1 4.32Å; M225-I229 WeakPolarHBondContact O-CG1 3.44Å; M225-I229 PolarHBondContact O-N 3.22Å; L226-I229 PolarHBondContact O-N 2.64Å; I229-A232 PolarHBondContact O-N 2.99Å; I229-V239 HydrophobicContact CG2-CG1 4.48Å; I229-V239 HydrophobicContact CG2-CG2 4.16Å
230	S	94.9	Very high	94.5	Very high	9 Å²	9	50.1 Å²	50.1	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-45.9	174.5	177.3	0	0	0	0	111.9	L226 Q227 A228 A232 N233	L226-S230 PolarHBondContact O-N 2.87Å; Q227-S230 PolarHBondContact O-N 3Å; A228-S230 VanDerWaalsContact C-N 3.34Å; A228-S230 PolarHBondContact O-N 2.92Å; S230-A232 VanDerWaalsContact C-N 3.31Å; S230-A232 PolarHBondContact O-N 3.48Å; S230-N233 PolarHBondContact O-N 3.3Å
231	K	94.1	Very high	94.6	Very high	113 Å²	113	44.9 Å²	44.9	49%	0.491	21%	0.209	S	C	.	.	H	α-helix	trans	-66.7	-30.5	179.2	-75.1	166.5	174.2	170.2	0	113	Q227 A228 N233	Q227-K231 HydrophobicContact CG-CD 4.34Å; Q227-K231 WeakPolarHBondContact O-CB 3.38Å; Q227-K231 VanDerWaalsContact O-CG 3.3Å; Q227-K231 WeakPolarHBondContact O-CG 3.24Å; Q227-K231 PolarHBondContact O-N 3.5Å; A228-K231 PolarHBondContact O-N 3.35Å; K231-N233 PolarHBondContact O-N 3.11Å
232	A	95.3	Very high	94.6	Very high	3 Å²	3	41 Å²	41	3%	0.025	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-8.7	177.6	0	0	0	0	0	114.5	Q148 W149 P171 A228 I229 S230	Q148-A232 HydrophobicContact CB-CB 4.18Å; W149-A232 HydrophobicContact CZ2-CB 3.98Å; P171-A232 HydrophobicContact CB-CB 4.33Å; A228-A232 WeakPolarHBondContact O-CB 3.32Å; A228-A232 PolarHBondContact O-N 2.75Å; I229-A232 PolarHBondContact O-N 2.99Å; S230-A232 VanDerWaalsContact C-N 3.31Å; S230-A232 PolarHBondContact O-N 3.48Å
233	N	95.2	Very high	94.6	Very high	3 Å²	3	41 Å²	41	2%	0.016	19%	0.191	C	C	.	.			trans	-122	97.4	174.5	178.1	-5.8	0	0	0	110	S230 K231 N235 S236 G335 S337	S230-N233 PolarHBondContact O-N 3.3Å; K231-N233 PolarHBondContact O-N 3.11Å; N233-N235 PolarHBondContact O-N 3.3Å; N233-N235 WeakPolarHBondContact OD1-CB 3.31Å; N233-N235 PolarHBondContact OD1-N 3.05Å; N233-S236 PolarHBondContact O-N 3.41Å; N233-S236 PolarHBondContact OD1-N 3.32Å; N233-G335 PolarHBondContact ND2-O 2.94Å; N233-S337 VanDerWaalsContact CB-OG 3.32Å; N233-S337 WeakPolarHBondContact CB-OG 3.02Å; N233-S337 PolarHBondContact ND2-N 3.4Å; N233-S337 PolarHBondContact ND2-OG 3.35Å; N233-S337 VanDerWaalsContact ND2-OG 3.09Å
234	H	89.6	Confident	94.6	Very high	150 Å²	150	40 Å²	40	69%	0.694	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-14.8	179.2	-58	138.5	0	0	0	114.5	Q148	Q148-H234 PolarHBondContact NE2-CE1 2.77Å
235	N	89.6	Confident	94.6	Very high	110 Å²	110	37.9 Å²	37.9	59%	0.588	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-18.4	-176.4	-63.4	-31.1	0	0	0	113	K201 N233	K201-N235 PolarHBondContact O-ND2 2.71Å; N233-N235 PolarHBondContact O-N 3.3Å; N233-N235 WeakPolarHBondContact OD1-CB 3.31Å; N233-N235 PolarHBondContact OD1-N 3.05Å
236	S	90.7	Very high	94.4	Very high	12 Å²	12	38.8 Å²	38.8	8%	0.084	18%	0.177	C	C	.	.			trans	-125.9	140.5	175.7	-179.8	0	0	0	0	111.9	N233 F238	N233-S236 PolarHBondContact O-N 3.41Å; N233-S236 PolarHBondContact OD1-N 3.32Å; S236-F238 VanDerWaalsContact C-N 3.33Å; S236-F238 PolarHBondContact OG-N 2.95Å; S236-F238 VanDerWaalsContact OG-N 3.17Å; S236-F238 PolarHBondContact OG-O 2.74Å
237	R	86	Confident	94.3	Very high	227 Å²	227	44.6 Å²	44.6	86%	0.857	20%	0.202	S	C	*	.	S	Bend	trans	-86	-5	173.8	-65.8	-174.2	178.6	-177.2	-0.1	113.8
238	F	92.3	Very high	94	Very high	44 Å²	44	47.4 Å²	47.4	19%	0.193	22%	0.219	C	C	.	.			trans	-138.6	158.1	-176	61.4	-93.6	0	0	0	112	S236 Y240 N268 R270 A336	S236-F238 VanDerWaalsContact C-N 3.33Å; S236-F238 PolarHBondContact OG-N 2.95Å; S236-F238 VanDerWaalsContact OG-N 3.17Å; S236-F238 PolarHBondContact OG-O 2.74Å; F238-Y240 HydrophobicContact CD2-CE2 4.42Å; F238-Y240 AromaticContact CE2-CD2 4Å; F238-Y240 HydrophobicContact CE2-CD2 4Å; F238-Y240 AromaticContact CE2-CE2 3.54Å; F238-Y240 HydrophobicContact CE2-CE2 3.54Å; F238-Y240 AromaticContact CE2-CZ 3.81Å; F238-Y240 HydrophobicContact CZ-CE2 4.38Å; F238-N268 CarbonylContact C-O 3.44Å; F238-N268 WeakPolarHBondContact CA-O 3.32Å; F238-N268 WeakPolarHBondContact CB-O 3.44Å; F238-R270 HydrophobicContact CD2-CG 3.92Å; F238-R270 HydrophobicContact CE2-CG 4.44Å; F238-R270 HydrophobicContact CG-CG 4.26Å; F238-R270 VanDerWaalsContact CZ-NH1 3.3Å; F238-A336 HydrophobicContact CE2-CB 3.84Å; F238-A336 HydrophobicContact CZ-CB 4.38Å
239	V	95.5	Very high	93.8	Very high	2 Å²	2	49 Å²	49	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.5	173.3	174.7	0	0	0	0	108.6	I229 N268 I269 R270 S337 L339	I229-V239 HydrophobicContact CG2-CG1 4.48Å; I229-V239 HydrophobicContact CG2-CG2 4.16Å; V239-N268 PolarHBondContact N-O 3.46Å; V239-I269 CarbonylContact O-C 3.47Å; V239-I269 VanDerWaalsContact O-CA 3.23Å; V239-I269 WeakPolarHBondContact O-CA 3.36Å; V239-R270 PolarHBondContact O-N 2.9Å; V239-S337 WeakPolarHBondContact CA-O 3.47Å; V239-L339 HydrophobicContact CG1-CB 4.27Å
240	Y	97.3	Very high	93.3	Very high	30 Å²	30	49 Å²	49	12%	0.118	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	129.9	168.4	-81.3	-70.9	0	0	0	109.8	F238 R270 A330 E334 A336 S337 V338 L339	F238-Y240 HydrophobicContact CD2-CE2 4.42Å; F238-Y240 AromaticContact CE2-CD2 4Å; F238-Y240 HydrophobicContact CE2-CD2 4Å; F238-Y240 AromaticContact CE2-CE2 3.54Å; F238-Y240 HydrophobicContact CE2-CE2 3.54Å; F238-Y240 AromaticContact CE2-CZ 3.81Å; F238-Y240 HydrophobicContact CZ-CE2 4.38Å; Y240-R270 WeakPolarHBondContact CA-O 3.28Å; Y240-R270 HydrophobicContact CD1-CB 3.55Å; Y240-R270 HydrophobicContact CE1-CB 3.54Å; Y240-R270 HydrophobicContact CE1-CG 4.21Å; Y240-R270 HydrophobicContact CG-CB 4.47Å; Y240-R270 PolarHBondContact OH-NH1 3.21Å; Y240-A330 HydrophobicContact CD2-CB 3.67Å; Y240-A330 HydrophobicContact CE2-CB 3.93Å; Y240-A330 HydrophobicContact CG-CB 4.47Å; Y240-E334 WeakPolarHBondContact CE2-OE2 3.45Å; Y240-E334 VanDerWaalsContact OH-CD 3.27Å; Y240-E334 PolarHBondContact OH-OE1 3.35Å; Y240-E334 PolarHBondContact OH-OE2 3.38Å; Y240-A336 HydrophobicContact CD2-CB 3.82Å; Y240-A336 HydrophobicContact CE2-CB 3.99Å; Y240-S337 PolarHBondContact N-O 3.15Å; Y240-V338 CarbonylContact O-C 3.54Å; Y240-V338 WeakPolarHBondContact O-CA 3.46Å; Y240-L339 PolarHBondContact O-N 3.26Å
241	V	97.8	Very high	93	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	112	168.8	177.5	0	0	0	0	107.4	L226 E261 I269 R270 F271 Q272 L339 H341	L226-V241 HydrophobicContact CD2-CG2 4.09Å; V241-E261 HydrophobicContact CG1-CG 4.38Å; V241-I269 HydrophobicContact CB-CD1 4.31Å; V241-I269 HydrophobicContact CG2-CB 3.84Å; V241-I269 HydrophobicContact CG2-CD1 3.9Å; V241-I269 HydrophobicContact CG2-CG1 4.45Å; V241-I269 HydrophobicContact CG2-CG2 3.75Å; V241-R270 PolarHBondContact N-O 3.35Å; V241-F271 HydrophobicContact CB-CD2 3.9Å; V241-F271 HydrophobicContact CB-CE2 4.3Å; V241-F271 HydrophobicContact CG1-CD2 3.66Å; V241-F271 HydrophobicContact CG1-CE2 3.55Å; V241-Q272 PolarHBondContact O-N 2.8Å; V241-L339 HydrophobicContact CG2-CB 4.5Å; V241-H341 WeakPolarHBondContact CG1-NE2 3.12Å
242	M	97.6	Very high	92.7	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.015	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	95.7	-171.2	-173.1	-169	-178.8	0	0	109.3	V274 A323 C326 L327 V338 L339 V340 H341 V352	M242-V274 HydrophobicContact CE-CB 4.32Å; M242-V274 HydrophobicContact CE-CG1 3.63Å; M242-V274 HydrophobicContact CE-CG2 3.88Å; M242-V274 HydrophobicContact CG-CG1 4.4Å; M242-A323 HydrophobicContact CE-CB 3.67Å; M242-A323 WeakPolarHBondContact CE-O 3.44Å; M242-C326 HydrophobicContact CE-CB 4.46Å; M242-L327 HydrophobicContact CE-CB 4.38Å; M242-L327 HydrophobicContact SD-CB 4Å; M242-V338 HydrophobicContact CB-CG1 4Å; M242-V338 HydrophobicContact SD-CG1 4.5Å; M242-L339 PolarHBondContact N-O 3.38Å; M242-V340 HydrophobicContact SD-CG1 4.44Å; M242-V340 HydrophobicContact SD-CG2 4.12Å; M242-H341 PolarHBondContact O-N 3.42Å; M242-V352 HydrophobicContact CE-CG1 3.81Å; M242-V352 HydrophobicContact SD-CG1 3.98Å
243	D	97.4	Very high	92.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	115.5	173.9	-173	-18.9	0	0	0	109.3	R245 F271 Q272 F273 V274 H341	D243-R245 PolarHBondContact O-N 3.01Å; D243-R245 VanDerWaalsContact O-N 3.07Å; D243-R245 VanDerWaalsContact OD1-CB 3.22Å; D243-R245 WeakPolarHBondContact OD1-CB 3.43Å; D243-R245 WeakPolarHBondContact OD1-CG 3.42Å; D243-R245 IonicContact OD1-CZ 3.74Å; D243-R245 PolarHBondContact OD1-N 3.39Å; D243-R245 IonicContact OD1-NE 3.66Å; D243-R245 PolarHBondContact OD1-NE 3.45Å; D243-R245 IonicContact OD1-NH2 2.88Å; D243-R245 IonicContact OD2-CZ 3.26Å; D243-R245 IonicContact OD2-NE 3.49Å; D243-R245 PolarHBondContact OD2-NE 3.29Å; D243-R245 IonicContact OD2-NH2 2.66Å; D243-R245 PolarHBondContact OD2-NH2 3.05Å; D243-F271 HydrophobicContact CB-CE1 3.92Å; D243-F271 HydrophobicContact CB-CE2 4.44Å; D243-F271 HydrophobicContact CB-CZ 3.48Å; D243-F271 VanDerWaalsContact CB-CZ 3.48Å; D243-Q272 PolarHBondContact N-O 3.3Å; D243-F273 HydrophobicContact CB-CD1 3.9Å; D243-F273 HydrophobicContact CB-CE1 4.02Å; D243-F273 WeakPolarHBondContact O-CA 3.16Å; D243-V274 PolarHBondContact O-N 2.83Å; D243-H341 WeakPolarHBondContact CA-O 3.17Å; D243-H341 IonicContact OD2-CE1 3.82Å
244	T	96.1	Very high	91.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.261	C	S	.	.			trans	-70.3	-4.6	-177.1	80.9	0	0	0	0	113.8	I276 V340 H341 C342 R348 V352	T244-I276 WeakPolarHBondContact O-CA 3.21Å; T244-I276 WeakPolarHBondContact O-CB 3.48Å; T244-I276 PolarHBondContact O-N 3.2Å; T244-V340 HydrophobicContact CG2-CG1 3.89Å; T244-H341 WeakPolarHBondContact CG2-O 3.22Å; T244-H341 PolarHBondContact N-O 3.37Å; T244-C342 WeakPolarHBondContact OG1-CB 3.49Å; T244-R348 HydrophobicContact CG2-CB 4.25Å; T244-R348 WeakPolarHBondContact OG1-CB 3.26Å; T244-R348 WeakPolarHBondContact OG1-CD 3.44Å; T244-V352 HydrophobicContact CG2-CB 4.44Å; T244-V352 HydrophobicContact CG2-CG2 3.98Å
245	R	96.2	Very high	91.6	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	25%	0.254	C	S	.	.	S	Bend	trans	-82.3	158.2	-176.6	-62.4	175.9	-67.5	-174	-0.7	112.4	D243 A250 G259 G275 C342	D243-R245 PolarHBondContact O-N 3.01Å; D243-R245 VanDerWaalsContact O-N 3.07Å; D243-R245 VanDerWaalsContact OD1-CB 3.22Å; D243-R245 WeakPolarHBondContact OD1-CB 3.43Å; D243-R245 WeakPolarHBondContact OD1-CG 3.42Å; D243-R245 IonicContact OD1-CZ 3.74Å; D243-R245 PolarHBondContact OD1-N 3.39Å; D243-R245 IonicContact OD1-NE 3.66Å; D243-R245 PolarHBondContact OD1-NE 3.45Å; D243-R245 IonicContact OD1-NH2 2.88Å; D243-R245 IonicContact OD2-CZ 3.26Å; D243-R245 IonicContact OD2-NE 3.49Å; D243-R245 PolarHBondContact OD2-NE 3.29Å; D243-R245 IonicContact OD2-NH2 2.66Å; D243-R245 PolarHBondContact OD2-NH2 3.05Å; R245-A250 HydrophobicContact CB-CB 4.48Å; R245-G259 PolarHBondContact NH2-O 3.16Å; R245-G275 PolarHBondContact O-N 3.22Å; R245-C342 HydrophobicContact CG-CB 4.49Å
246	P	94.1	Very high	91.3	Very high	20 Å²	20	48.3 Å²	48.3	13%	0.13	26%	0.256	C	S	.	.			trans	-61.7	141.6	156.3	-19.4	30.7	0	0	0	110.6	L248 N249 A250 I276 E277	P246-L248 PolarHBondContact O-N 3.33Å; P246-L248 VanDerWaalsContact O-N 3.16Å; P246-N249 HydrophobicContact CB-CB 4.47Å; P246-N249 WeakPolarHBondContact O-CB 3.5Å; P246-N249 PolarHBondContact O-N 3.23Å; P246-A250 PolarHBondContact O-N 3Å; P246-A250 VanDerWaalsContact O-N 3.07Å; P246-I276 WeakPolarHBondContact CD-O 3.33Å; P246-E277 HydrophobicContact CG-CG 4.46Å; P246-E277 WeakPolarHBondContact CG-OE1 3.25Å
247	K	92.6	Very high	90.7	Very high	128 Å²	128	49.7 Å²	49.7	56%	0.557	27%	0.272	S	S	*	.	H	α-helix	trans	-51.5	-40.2	-179.8	-176.5	173	-178.4	176	0	113	A250 L251 F273	K247-A250 PolarHBondContact O-N 3.46Å; K247-L251 HydrophobicContact CG-CD1 4.22Å; K247-L251 WeakPolarHBondContact O-CG 3.2Å; K247-L251 PolarHBondContact O-N 3.4Å; K247-F273 HydrophobicContact CB-CD2 3.92Å; K247-F273 HydrophobicContact CB-CE2 4.12Å; K247-F273 HydrophobicContact CB-CG 4.14Å; K247-F273 HydrophobicContact CD-CD2 4.28Å; K247-F273 HydrophobicContact CD-CE2 4.19Å; K247-F273 HydrophobicContact CG-CD2 4.01Å; K247-F273 HydrophobicContact CG-CE2 3.77Å; K247-F273 HydrophobicContact CG-CZ 4.24Å
248	L	89.9	Confident	90.8	Very high	134 Å²	134	41.5 Å²	41.5	70%	0.702	24%	0.242	S	C	*	.	H	α-helix	trans	-63.2	-43.3	177.5	-174.6	62.3	0	0	0	112.3	P246 A250 L251 A252	P246-L248 PolarHBondContact O-N 3.33Å; P246-L248 VanDerWaalsContact O-N 3.16Å; L248-A250 VanDerWaalsContact C-N 3.31Å; L248-A250 PolarHBondContact O-N 2.91Å; L248-L251 PolarHBondContact O-N 3.33Å; L248-A252 PolarHBondContact O-N 3.24Å
249	N	90.2	Very high	90.6	Very high	40 Å²	40	39.4 Å²	39.4	21%	0.214	23%	0.233	C	C	.	.	H	α-helix	trans	-67.5	-33.2	178	-67.9	-12.8	0	0	0	111.5	P246 N253 E277	P246-N249 HydrophobicContact CB-CB 4.47Å; P246-N249 WeakPolarHBondContact O-CB 3.5Å; P246-N249 PolarHBondContact O-N 3.23Å; N249-N253 PolarHBondContact O-N 3.45Å; N249-N253 VanDerWaalsContact O-N 3.15Å; N249-N253 PolarHBondContact O-ND2 2.73Å; N249-E277 PolarHBondContact ND2-OE2 3.44Å
250	A	87.8	Confident	90.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68.9	-42.1	172.9	0	0	0	0	0	112.3	R245 P246 K247 L248 N253 R254 Y260 F273	R245-A250 HydrophobicContact CB-CB 4.48Å; P246-A250 PolarHBondContact O-N 3Å; P246-A250 VanDerWaalsContact O-N 3.07Å; K247-A250 PolarHBondContact O-N 3.46Å; L248-A250 VanDerWaalsContact C-N 3.31Å; L248-A250 PolarHBondContact O-N 2.91Å; A250-N253 PolarHBondContact O-N 3.41Å; A250-R254 PolarHBondContact O-N 3.34Å; A250-Y260 HydrophobicContact CB-CD1 4.15Å; A250-F273 HydrophobicContact CB-CD1 4.31Å; A250-F273 HydrophobicContact CB-CE1 3.38Å; A250-F273 HydrophobicContact CB-CZ 3.96Å
251	L	88.3	Confident	90.1	Very high	73 Å²	73	39.8 Å²	39.8	38%	0.382	23%	0.234	S	C	.	.	H	α-helix	trans	-62.2	-40.6	173.8	-71.9	167.4	0	0	0	112.3	K247 L248 N253 R254 A255 Y260	K247-L251 HydrophobicContact CG-CD1 4.22Å; K247-L251 WeakPolarHBondContact O-CG 3.2Å; K247-L251 PolarHBondContact O-N 3.4Å; L248-L251 PolarHBondContact O-N 3.33Å; L251-N253 PolarHBondContact O-N 2.8Å; L251-R254 WeakPolarHBondContact O-CB 3.42Å; L251-R254 PolarHBondContact O-N 3.36Å; L251-R254 VanDerWaalsContact O-N 3.13Å; L251-A255 PolarHBondContact O-N 3.43Å; L251-Y260 HydrophobicContact CD2-CE1 4.17Å
252	A	87.6	Confident	89.6	Confident	61 Å²	61	42.2 Å²	42.2	50%	0.504	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-40.2	174.4	0	0	0	0	0	112.4	L248 R254 A255 A256	L248-A252 PolarHBondContact O-N 3.24Å; A252-R254 VanDerWaalsContact C-N 3.32Å; A252-A255 PolarHBondContact O-N 3.48Å; A252-A256 PolarHBondContact O-N 2.98Å
253	N	85.6	Confident	89	Confident	36 Å²	36	47.1 Å²	47.1	19%	0.193	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-36.2	172.2	-83.1	-97.4	0	0	0	111.8	Q210 N249 A250 L251 A255 A256 K258	Q210-N253 PolarHBondContact OE1-OD1 2.93Å; N249-N253 PolarHBondContact O-N 3.45Å; N249-N253 VanDerWaalsContact O-N 3.15Å; N249-N253 PolarHBondContact O-ND2 2.73Å; A250-N253 PolarHBondContact O-N 3.41Å; L251-N253 PolarHBondContact O-N 2.8Å; N253-A255 PolarHBondContact O-N 2.92Å; N253-A256 CarbonylContact O-C 3.54Å; N253-A256 PolarHBondContact O-N 2.89Å; N253-A256 VanDerWaalsContact O-N 3.09Å; N253-K258 HydrophobicContact CB-CB 4.26Å; N253-K258 CarbonylContact O-C 3.57Å; N253-K258 WeakPolarHBondContact O-CA 3.42Å; N253-K258 WeakPolarHBondContact O-CB 3.45Å; N253-K258 PolarHBondContact O-N 3.41Å; N253-K258 VanDerWaalsContact O-N 3.08Å
254	R	86.8	Confident	88.5	Confident	61 Å²	61	53.7 Å²	53.7	23%	0.23	31%	0.305	C	S	.	.	H	α-helix	trans	-60.7	-43.2	176.3	-164.8	179.4	175.4	-178	-5	112.3	G214 F215 A250 L251 A252 A256 G257 K258 Y260	G214-R254 WeakPolarHBondContact O-CG 3.37Å; G214-R254 PolarHBondContact O-NE 2.63Å; F215-R254 PolarHBondContact O-NH2 3.39Å; A250-R254 PolarHBondContact O-N 3.34Å; L251-R254 WeakPolarHBondContact O-CB 3.42Å; L251-R254 PolarHBondContact O-N 3.36Å; L251-R254 VanDerWaalsContact O-N 3.13Å; A252-R254 VanDerWaalsContact C-N 3.32Å; R254-A256 PolarHBondContact O-N 2.9Å; R254-G257 PolarHBondContact O-N 3.1Å; R254-G257 VanDerWaalsContact O-N 3.16Å; R254-K258 WeakPolarHBondContact CA-O 3.24Å; R254-Y260 PolarHBondContact NH1-OH 3.36Å
255	A	83.9	Confident	88.1	Confident	66 Å²	66	55.9 Å²	55.9	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-62.3	-27.7	174.3	0	0	0	0	0	113.2	F215 L251 A252 N253 G257	F215-A255 HydrophobicContact CZ-CB 4.36Å; L251-A255 PolarHBondContact O-N 3.43Å; A252-A255 PolarHBondContact O-N 3.48Å; N253-A255 PolarHBondContact O-N 2.92Å; A255-G257 VanDerWaalsContact C-N 3.28Å; A255-G257 PolarHBondContact O-N 3.12Å
256	A	83.2	Confident	87.8	Confident	77 Å²	77	56.5 Å²	56.5	64%	0.636	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	19.4	176.1	0	0	0	0	0	114.2	A252 N253 R254 K258	A252-A256 PolarHBondContact O-N 2.98Å; N253-A256 CarbonylContact O-C 3.54Å; N253-A256 PolarHBondContact O-N 2.89Å; N253-A256 VanDerWaalsContact O-N 3.09Å; R254-A256 PolarHBondContact O-N 2.9Å; A256-K258 VanDerWaalsContact C-N 3.27Å; A256-K258 PolarHBondContact O-N 3.1Å
257	G	79.8	Confident	87.2	Confident	40 Å²	40	60.2 Å²	60.2	41%	0.412	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	2.5	178.2	0	0	0	0	0	115.3	G214 R254 A255	G214-G257 PolarHBondContact N-O 3.47Å; R254-G257 PolarHBondContact O-N 3.1Å; R254-G257 VanDerWaalsContact O-N 3.16Å; A255-G257 VanDerWaalsContact C-N 3.28Å; A255-G257 PolarHBondContact O-N 3.12Å
258	K	86.9	Confident	86.9	Confident	56 Å²	56	56.8 Å²	56.8	24%	0.243	33%	0.334	C	S	.	.			trans	-95.6	-149.5	169.7	-62.2	166.6	151.5	-163.5	0	108.4	Q210 P211 L212 G214 N253 R254 A256 D344	Q210-K258 HydrophobicContact CG-CB 4.16Å; Q210-K258 VanDerWaalsContact OE1-CB 3.27Å; P211-K258 CarbonylContact O-C 3.06Å; L212-K258 HydrophobicContact CD2-CG 3.9Å; G214-K258 WeakPolarHBondContact CA-O 3.41Å; G214-K258 PolarHBondContact N-O 3.47Å; N253-K258 HydrophobicContact CB-CB 4.26Å; N253-K258 CarbonylContact O-C 3.57Å; N253-K258 WeakPolarHBondContact O-CA 3.42Å; N253-K258 WeakPolarHBondContact O-CB 3.45Å; N253-K258 PolarHBondContact O-N 3.41Å; N253-K258 VanDerWaalsContact O-N 3.08Å; R254-K258 WeakPolarHBondContact CA-O 3.24Å; A256-K258 VanDerWaalsContact C-N 3.27Å; A256-K258 PolarHBondContact O-N 3.1Å; K258-D344 IonicContact NZ-OD1 2.66Å
259	G	88.4	Confident	87.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	31%	0.306	C	S	.	.			trans	153.9	-139.7	170.3	0	0	0	0	0	113.9	Q210 P211 R245	Q210-G259 WeakPolarHBondContact CB-O 3.45Å; P211-G259 PolarHBondContact O-N 3.22Å; P211-G259 VanDerWaalsContact O-N 3.14Å; R245-G259 PolarHBondContact NH2-O 3.16Å
260	Y	90.9	Very high	87.3	Confident	38 Å²	38	54.9 Å²	54.9	15%	0.149	32%	0.316	C	S	.	.			trans	-152.4	166	178.8	58.9	-88.9	0	0	0	108.6	S213 A250 L251 R254 F271 F273	S213-Y260 PolarHBondContact OG-N 2.85Å; S213-Y260 PolarHBondContact OG-O 3.4Å; S213-Y260 VanDerWaalsContact OG-O 3.08Å; A250-Y260 HydrophobicContact CB-CD1 4.15Å; L251-Y260 HydrophobicContact CD2-CE1 4.17Å; R254-Y260 PolarHBondContact NH1-OH 3.36Å; Y260-F271 HydrophobicContact CD2-CE1 4.4Å; Y260-F271 HydrophobicContact CD2-CE2 4.11Å; Y260-F271 AromaticContact CD2-CZ 3.99Å; Y260-F271 HydrophobicContact CD2-CZ 3.99Å; Y260-F271 HydrophobicContact CG-CE2 4.38Å; Y260-F271 HydrophobicContact CG-CZ 4.05Å; Y260-F273 HydrophobicContact CD1-CZ 4.26Å; Y260-F273 HydrophobicContact CD2-CZ 4.38Å; Y260-F273 HydrophobicContact CE1-CZ 4.4Å; Y260-F273 HydrophobicContact CG-CZ 4.27Å
261	E	91.7	Very high	87.5	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	32%	0.323	C	S	.	.			trans	-66.6	129.6	-176.8	-71.1	81.7	160.6	0	0	110.9	R186 P211 L226 V241 Y266 I269 F271 H341	R186-E261 IonicContact CZ-OE1 3.58Å; R186-E261 IonicContact NH1-OE1 3.37Å; R186-E261 PolarHBondContact NH1-OE1 2.77Å; R186-E261 IonicContact NH2-OE1 2.81Å; R186-E261 PolarHBondContact NH2-OE1 3.13Å; P211-E261 WeakPolarHBondContact CD-OE2 3.35Å; P211-E261 HydrophobicContact CG-CG 4.37Å; L226-E261 HydrophobicContact CD2-CG 4.31Å; V241-E261 HydrophobicContact CG1-CG 4.38Å; E261-Y266 HydrophobicContact CB-CD2 3.76Å; E261-Y266 HydrophobicContact CB-CE2 3.86Å; E261-Y266 HydrophobicContact CB-CG 4.23Å; E261-Y266 HydrophobicContact CG-CD1 4.4Å; E261-Y266 HydrophobicContact CG-CD2 4.1Å; E261-Y266 HydrophobicContact CG-CE1 4.13Å; E261-Y266 HydrophobicContact CG-CE2 3.83Å; E261-Y266 HydrophobicContact CG-CG 4.38Å; E261-I269 HydrophobicContact CB-CD1 3.61Å; E261-I269 HydrophobicContact CG-CD1 4.48Å; E261-F271 HydrophobicContact CB-CD2 4.27Å; E261-F271 HydrophobicContact CB-CE2 4.32Å; E261-H341 IonicContact OE1-NE2 3.63Å; E261-H341 IonicContact OE2-CE1 3.27Å; E261-H341 IonicContact OE2-NE2 2.77Å; E261-H341 PolarHBondContact OE2-NE2 2.87Å
262	N	87.2	Confident	87.8	Confident	52 Å²	52	56.5 Å²	56.5	28%	0.278	32%	0.321	S	S	.	.			trans	-90.7	123.7	176.2	-170.3	32	0	0	0	110.7	D264 N265 Y266	N262-D264 PolarHBondContact ND2-OD2 3.16Å; N262-D264 PolarHBondContact O-N 2.78Å; N262-D264 VanDerWaalsContact O-N 3.14Å; N262-D264 PolarHBondContact OD1-OD2 3.43Å; N262-N265 PolarHBondContact O-N 3.22Å; N262-Y266 WeakPolarHBondContact O-CD2 3.35Å; N262-Y266 PolarHBondContact O-N 3.44Å
263	E	84.8	Confident	88.1	Confident	105 Å²	105	56.2 Å²	56.2	49%	0.491	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.1	-175.8	-61.1	-173.9	140	0	0	112.6	N265 Y266 I269 F271	E263-N265 VanDerWaalsContact C-N 3.31Å; E263-N265 PolarHBondContact O-N 3.34Å; E263-Y266 CarbonylContact O-C 3.52Å; E263-I269 HydrophobicContact CG-CD1 4.41Å; E263-I269 HydrophobicContact CG-CG1 4.29Å; E263-F271 HydrophobicContact CG-CB 4.18Å; E263-F271 VanDerWaalsContact OE1-CB 3.3Å; E263-F271 WeakPolarHBondContact OE1-CB 3.4Å; E263-F271 PolarHBondContact OE1-N 3.06Å
264	D	85.8	Confident	88.2	Confident	138 Å²	138	56 Å²	56	74%	0.738	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-32.9	173.8	-50.3	-51.9	0	0	0	113.6	N262	N262-D264 PolarHBondContact ND2-OD2 3.16Å; N262-D264 PolarHBondContact O-N 2.78Å; N262-D264 VanDerWaalsContact O-N 3.14Å; N262-D264 PolarHBondContact OD1-OD2 3.43Å
265	N	88.4	Confident	88.5	Confident	46 Å²	46	54.7 Å²	54.7	25%	0.246	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-37.6	-179	-69.7	-19.4	0	0	0	111.1	N262 E263 S267	N262-N265 PolarHBondContact O-N 3.22Å; E263-N265 VanDerWaalsContact C-N 3.31Å; E263-N265 PolarHBondContact O-N 3.34Å; N265-S267 PolarHBondContact O-N 2.9Å
266	Y	90.1	Very high	89.1	Confident	15 Å²	15	51.6 Å²	51.6	6%	0.059	29%	0.288	C	S	.	.	S	Bend	trans	-100.2	73.5	-177.3	-67	-93.4	0	0	0	110.1	F185 D222 E223 L226 E261 N262 E263 N268 I269	F185-Y266 WeakPolarHBondContact CE1-OH 3.49Å; D222-Y266 PolarHBondContact OD2-OH 3.36Å; E223-Y266 HydrophobicContact CB-CD1 4.46Å; E223-Y266 HydrophobicContact CB-CE1 4.31Å; E223-Y266 HydrophobicContact CG-CD1 3.76Å; E223-Y266 HydrophobicContact CG-CE1 3.56Å; E223-Y266 HydrophobicContact CG-CE2 4.34Å; E223-Y266 HydrophobicContact CG-CG 4.27Å; L226-Y266 HydrophobicContact CB-CD1 4.33Å; L226-Y266 HydrophobicContact CD1-CE1 4.41Å; L226-Y266 HydrophobicContact CD2-CD1 3.72Å; L226-Y266 HydrophobicContact CD2-CE1 3.87Å; E261-Y266 HydrophobicContact CB-CD2 3.76Å; E261-Y266 HydrophobicContact CB-CE2 3.86Å; E261-Y266 HydrophobicContact CB-CG 4.23Å; E261-Y266 HydrophobicContact CG-CD1 4.4Å; E261-Y266 HydrophobicContact CG-CD2 4.1Å; E261-Y266 HydrophobicContact CG-CE1 4.13Å; E261-Y266 HydrophobicContact CG-CE2 3.83Å; E261-Y266 HydrophobicContact CG-CG 4.38Å; N262-Y266 WeakPolarHBondContact O-CD2 3.35Å; N262-Y266 PolarHBondContact O-N 3.44Å; E263-Y266 CarbonylContact O-C 3.52Å; Y266-N268 PolarHBondContact O-N 3.19Å; Y266-I269 HydrophobicContact CG-CD1 4.34Å; Y266-I269 WeakPolarHBondContact O-CG1 3.47Å; Y266-I269 PolarHBondContact O-N 2.9Å
267	S	80.9	Confident	89.8	Confident	98 Å²	98	50.6 Å²	50.6	69%	0.685	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-14.2	-169.8	63.7	0	0	0	0	117.5	N265	N265-S267 PolarHBondContact O-N 2.9Å
268	N	87.8	Confident	90.6	Very high	56 Å²	56	51 Å²	51	30%	0.299	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	20.7	-172.5	-63.5	23	0	0	0	112.7	F238 V239 Y266	F238-N268 CarbonylContact C-O 3.44Å; F238-N268 WeakPolarHBondContact CA-O 3.32Å; F238-N268 WeakPolarHBondContact CB-O 3.44Å; V239-N268 PolarHBondContact N-O 3.46Å; Y266-N268 PolarHBondContact O-N 3.19Å
269	I	93.4	Very high	91.1	Very high	22 Å²	22	49.2 Å²	49.2	11%	0.113	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	158.6	177.8	75.5	172.7	0	0	0	113	L226 V239 V241 E261 E263 Y266 F271	L226-I269 HydrophobicContact CD2-CG2 4.07Å; V239-I269 CarbonylContact O-C 3.47Å; V239-I269 VanDerWaalsContact O-CA 3.23Å; V239-I269 WeakPolarHBondContact O-CA 3.36Å; V241-I269 HydrophobicContact CB-CD1 4.31Å; V241-I269 HydrophobicContact CG2-CB 3.84Å; V241-I269 HydrophobicContact CG2-CD1 3.9Å; V241-I269 HydrophobicContact CG2-CG1 4.45Å; V241-I269 HydrophobicContact CG2-CG2 3.75Å; E261-I269 HydrophobicContact CB-CD1 3.61Å; E261-I269 HydrophobicContact CG-CD1 4.48Å; E263-I269 HydrophobicContact CG-CD1 4.41Å; E263-I269 HydrophobicContact CG-CG1 4.29Å; Y266-I269 HydrophobicContact CG-CD1 4.34Å; Y266-I269 WeakPolarHBondContact O-CG1 3.47Å; Y266-I269 PolarHBondContact O-N 2.9Å; I269-F271 HydrophobicContact CD1-CD2 4.32Å
270	R	93.8	Very high	91.5	Very high	112 Å²	112	53.3 Å²	53.3	42%	0.423	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	116.9	159.7	-71	-176.3	177.7	177.9	-0.1	108	F238 V239 Y240 V241 E334	F238-R270 HydrophobicContact CD2-CG 3.92Å; F238-R270 HydrophobicContact CE2-CG 4.44Å; F238-R270 HydrophobicContact CG-CG 4.26Å; F238-R270 VanDerWaalsContact CZ-NH1 3.3Å; V239-R270 PolarHBondContact O-N 2.9Å; Y240-R270 WeakPolarHBondContact CA-O 3.28Å; Y240-R270 HydrophobicContact CD1-CB 3.55Å; Y240-R270 HydrophobicContact CE1-CB 3.54Å; Y240-R270 HydrophobicContact CE1-CG 4.21Å; Y240-R270 HydrophobicContact CG-CB 4.47Å; Y240-R270 PolarHBondContact OH-NH1 3.21Å; V241-R270 PolarHBondContact N-O 3.35Å; R270-E334 IonicContact NH1-OE2 3.9Å
271	F	92.6	Very high	91.8	Very high	36 Å²	36	53.9 Å²	53.9	16%	0.158	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	136.7	-175.1	-162.9	-79	0	0	0	112.5	V241 D243 Y260 E261 E263 I269 F273	V241-F271 HydrophobicContact CB-CD2 3.9Å; V241-F271 HydrophobicContact CB-CE2 4.3Å; V241-F271 HydrophobicContact CG1-CD2 3.66Å; V241-F271 HydrophobicContact CG1-CE2 3.55Å; D243-F271 HydrophobicContact CB-CE1 3.92Å; D243-F271 HydrophobicContact CB-CE2 4.44Å; D243-F271 HydrophobicContact CB-CZ 3.48Å; D243-F271 VanDerWaalsContact CB-CZ 3.48Å; Y260-F271 HydrophobicContact CD2-CE1 4.4Å; Y260-F271 HydrophobicContact CD2-CE2 4.11Å; Y260-F271 AromaticContact CD2-CZ 3.99Å; Y260-F271 HydrophobicContact CD2-CZ 3.99Å; Y260-F271 HydrophobicContact CG-CE2 4.38Å; Y260-F271 HydrophobicContact CG-CZ 4.05Å; E261-F271 HydrophobicContact CB-CD2 4.27Å; E261-F271 HydrophobicContact CB-CE2 4.32Å; E263-F271 HydrophobicContact CG-CB 4.18Å; E263-F271 VanDerWaalsContact OE1-CB 3.3Å; E263-F271 WeakPolarHBondContact OE1-CB 3.4Å; E263-F271 PolarHBondContact OE1-N 3.06Å; I269-F271 HydrophobicContact CD1-CD2 4.32Å; F271-F273 HydrophobicContact CD1-CD2 4.29Å; F271-F273 HydrophobicContact CD1-CE2 4.03Å; F271-F273 HydrophobicContact CD1-CZ 4.24Å; F271-F273 AromaticContact CE1-CD1 3.87Å; F271-F273 HydrophobicContact CE1-CD1 3.87Å; F271-F273 AromaticContact CE1-CD2 3.9Å; F271-F273 HydrophobicContact CE1-CD2 3.9Å; F271-F273 AromaticContact CE1-CE1 3.51Å; F271-F273 HydrophobicContact CE1-CE1 3.51Å; F271-F273 AromaticContact CE1-CE2 3.56Å; F271-F273 HydrophobicContact CE1-CE2 3.56Å; F271-F273 HydrophobicContact CE1-CG 4.05Å; F271-F273 AromaticContact CE1-CZ 3.36Å; F271-F273 HydrophobicContact CE1-CZ 3.36Å; F271-F273 AromaticContact CZ-CE1 3.93Å; F271-F273 HydrophobicContact CZ-CE1 3.93Å; F271-F273 AromaticContact CZ-CZ 3.98Å; F271-F273 HydrophobicContact CZ-CZ 3.98Å
272	Q	93.6	Very high	92.1	Very high	71 Å²	71	53.9 Å²	53.9	33%	0.332	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	133.1	177	-167.6	-178.9	16.5	0	0	112.5	V241 D243 C326	V241-Q272 PolarHBondContact O-N 2.8Å; D243-Q272 PolarHBondContact N-O 3.3Å; Q272-C326 PolarHBondContact NE2-SG 3.22Å; Q272-C326 PolarHBondContact OE1-SG 3.04Å
273	F	93.9	Very high	92.6	Very high	54 Å²	54	54.8 Å²	54.8	24%	0.237	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134	166.4	-66.6	-72.8	0	0	0	110.2	D243 K247 A250 Y260 F271	D243-F273 HydrophobicContact CB-CD1 3.9Å; D243-F273 HydrophobicContact CB-CE1 4.02Å; D243-F273 WeakPolarHBondContact O-CA 3.16Å; K247-F273 HydrophobicContact CB-CD2 3.92Å; K247-F273 HydrophobicContact CB-CE2 4.12Å; K247-F273 HydrophobicContact CB-CG 4.14Å; K247-F273 HydrophobicContact CD-CD2 4.28Å; K247-F273 HydrophobicContact CD-CE2 4.19Å; K247-F273 HydrophobicContact CG-CD2 4.01Å; K247-F273 HydrophobicContact CG-CE2 3.77Å; K247-F273 HydrophobicContact CG-CZ 4.24Å; A250-F273 HydrophobicContact CB-CD1 4.31Å; A250-F273 HydrophobicContact CB-CE1 3.38Å; A250-F273 HydrophobicContact CB-CZ 3.96Å; Y260-F273 HydrophobicContact CD1-CZ 4.26Å; Y260-F273 HydrophobicContact CD2-CZ 4.38Å; Y260-F273 HydrophobicContact CE1-CZ 4.4Å; Y260-F273 HydrophobicContact CG-CZ 4.27Å; F271-F273 HydrophobicContact CD1-CD2 4.29Å; F271-F273 HydrophobicContact CD1-CE2 4.03Å; F271-F273 HydrophobicContact CD1-CZ 4.24Å; F271-F273 AromaticContact CE1-CD1 3.87Å; F271-F273 HydrophobicContact CE1-CD1 3.87Å; F271-F273 AromaticContact CE1-CD2 3.9Å; F271-F273 HydrophobicContact CE1-CD2 3.9Å; F271-F273 AromaticContact CE1-CE1 3.51Å; F271-F273 HydrophobicContact CE1-CE1 3.51Å; F271-F273 AromaticContact CE1-CE2 3.56Å; F271-F273 HydrophobicContact CE1-CE2 3.56Å; F271-F273 HydrophobicContact CE1-CG 4.05Å; F271-F273 AromaticContact CE1-CZ 3.36Å; F271-F273 HydrophobicContact CE1-CZ 3.36Å; F271-F273 AromaticContact CZ-CE1 3.93Å; F271-F273 HydrophobicContact CZ-CE1 3.93Å; F271-F273 AromaticContact CZ-CZ 3.98Å; F271-F273 HydrophobicContact CZ-CZ 3.98Å
274	V	88.8	Confident	93.2	Very high	33 Å²	33	52.3 Å²	52.3	20%	0.2	28%	0.276	C	S	.	.			trans	-111.4	-5.9	175.2	-65.3	0	0	0	0	115.6	M242 D243 I276 A323	M242-V274 HydrophobicContact CE-CB 4.32Å; M242-V274 HydrophobicContact CE-CG1 3.63Å; M242-V274 HydrophobicContact CE-CG2 3.88Å; M242-V274 HydrophobicContact CG-CG1 4.4Å; D243-V274 PolarHBondContact O-N 2.83Å; V274-I276 HydrophobicContact CG2-CG1 4.41Å; V274-A323 HydrophobicContact CB-CB 4.09Å; V274-A323 HydrophobicContact CG1-CB 4.45Å; V274-A323 HydrophobicContact CG2-CB 3.76Å
275	G	92.5	Very high	93.8	Very high	32 Å²	32	46 Å²	46	33%	0.33	24%	0.242	S	C	.	.			trans	81.3	24.9	163	0	0	0	0	0	117.9	R245 E277	R245-G275 PolarHBondContact O-N 3.22Å; G275-E277 PolarHBondContact O-N 3.44Å
276	I	96.8	Very high	94.1	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-81.2	118.3	175.9	-48.3	173.6	0	0	0	110.4	T244 P246 V274 M282 V320 A323 R348 V352	T244-I276 WeakPolarHBondContact O-CA 3.21Å; T244-I276 WeakPolarHBondContact O-CB 3.48Å; T244-I276 PolarHBondContact O-N 3.2Å; P246-I276 WeakPolarHBondContact CD-O 3.33Å; V274-I276 HydrophobicContact CG2-CG1 4.41Å; I276-M282 HydrophobicContact CG2-CE 3.61Å; I276-V320 HydrophobicContact CD1-CB 4.49Å; I276-V320 HydrophobicContact CD1-CG2 4.11Å; I276-V320 HydrophobicContact CG2-CG2 3.91Å; I276-A323 HydrophobicContact CD1-CB 3.81Å; I276-R348 HydrophobicContact CB-CG 4.17Å; I276-R348 HydrophobicContact CG2-CG 3.74Å; I276-R348 VanDerWaalsContact O-CD 3.22Å; I276-R348 WeakPolarHBondContact O-CD 3.45Å; I276-R348 PolarHBondContact O-NH1 2.91Å; I276-V352 HydrophobicContact CD1-CG2 3.75Å
277	E	96.9	Very high	94.3	Very high	56 Å²	56	49 Å²	49	26%	0.262	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-62.9	169.3	-175.8	-72.1	-62.1	167.3	0	0	115.1	P246 N249 G275 V281 M282 R348	P246-E277 HydrophobicContact CG-CG 4.46Å; P246-E277 WeakPolarHBondContact CG-OE1 3.25Å; N249-E277 PolarHBondContact ND2-OE2 3.44Å; G275-E277 PolarHBondContact O-N 3.44Å; E277-V281 HydrophobicContact CB-CB 3.81Å; E277-V281 HydrophobicContact CB-CG1 3.79Å; E277-V281 HydrophobicContact CB-CG2 4.1Å; E277-V281 HydrophobicContact CG-CG1 4.11Å; E277-M282 HydrophobicContact CB-CE 3.96Å; E277-R348 WeakPolarHBondContact O-CD 3.17Å; E277-R348 PolarHBondContact O-NH1 2.97Å
278	N	96.7	Very high	95	Very high	50 Å²	50	49 Å²	49	27%	0.267	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-80	170	-176.2	72.6	55.9	0	0	0	113.9	H280 V281 M282	N278-H280 PolarHBondContact O-N 2.85Å; N278-H280 VanDerWaalsContact O-N 3.15Å; N278-H280 WeakPolarHBondContact OD1-CB 3.22Å; N278-H280 PolarHBondContact OD1-N 3.35Å; N278-V281 PolarHBondContact O-N 3.43Å; N278-V281 VanDerWaalsContact O-N 3.11Å; N278-V281 PolarHBondContact OD1-N 2.73Å; N278-M282 PolarHBondContact O-N 2.99Å; N278-M282 VanDerWaalsContact O-N 3.15Å
279	I	97.4	Very high	95.3	Very high	17 Å²	17	46.3 Å²	46.3	9%	0.087	23%	0.229	C	C	.	.	H	α-helix	trans	-57.4	-30.4	-175.7	68.7	172.1	0	0	0	113.9	R283 D347 S400 I402	I279-R283 PolarHBondContact O-N 3.05Å; I279-D347 HydrophobicContact CG2-CB 4.5Å; I279-S400 WeakPolarHBondContact CA-OG 3.26Å; I279-S400 WeakPolarHBondContact O-CB 2.91Å; I279-S400 PolarHBondContact O-OG 2.99Å; I279-I402 HydrophobicContact CG2-CD1 4.08Å; I279-I402 HydrophobicContact CG2-CG1 4.23Å
280	H	97.1	Very high	95.2	Very high	86 Å²	86	47.2 Å²	47.2	40%	0.398	23%	0.234	S	C	.	.	H	α-helix	trans	-76.4	-35.8	-179.5	-46.1	-50	0	0	0	111.5	N278 R283 S284 K397	N278-H280 PolarHBondContact O-N 2.85Å; N278-H280 VanDerWaalsContact O-N 3.15Å; N278-H280 WeakPolarHBondContact OD1-CB 3.22Å; N278-H280 PolarHBondContact OD1-N 3.35Å; H280-R283 PolarHBondContact O-N 2.64Å; H280-S284 WeakPolarHBondContact O-CB 3.46Å; H280-S284 PolarHBondContact O-N 3.16Å; H280-K397 PolarHBondContact CE1-O 2.95Å; H280-K397 PolarHBondContact ND1-O 3.31Å; H280-K397 VanDerWaalsContact ND1-O 3.08Å
281	V	97.9	Very high	94.9	Very high	50 Å²	50	46.8 Å²	46.8	30%	0.303	24%	0.237	S	C	.	.	H	α-helix	trans	-64.1	-45	172	-179.3	0	0	0	0	109.8	E277 N278 R283 S284 S285	E277-V281 HydrophobicContact CB-CB 3.81Å; E277-V281 HydrophobicContact CB-CG1 3.79Å; E277-V281 HydrophobicContact CB-CG2 4.1Å; E277-V281 HydrophobicContact CG-CG1 4.11Å; N278-V281 PolarHBondContact O-N 3.43Å; N278-V281 VanDerWaalsContact O-N 3.11Å; N278-V281 PolarHBondContact OD1-N 2.73Å; V281-R283 PolarHBondContact O-N 3.15Å; V281-S284 PolarHBondContact O-N 2.65Å; V281-S285 WeakPolarHBondContact O-CB 3.32Å; V281-S285 PolarHBondContact O-N 2.7Å
282	M	98.1	Very high	94.7	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-38.4	178.2	-56.2	-43.6	-174.2	0	0	112.6	I276 E277 N278 L286 H316 I402 Q405	I276-M282 HydrophobicContact CG2-CE 3.61Å; E277-M282 HydrophobicContact CB-CE 3.96Å; N278-M282 PolarHBondContact O-N 2.99Å; N278-M282 VanDerWaalsContact O-N 3.15Å; M282-L286 PolarHBondContact O-N 2.86Å; M282-H316 HydrophobicContact CE-CB 4.05Å; M282-H316 HydrophobicContact SD-CB 3.78Å; M282-H316 VanDerWaalsContact SD-CG 3.56Å; M282-I402 HydrophobicContact CB-CD1 4.23Å; M282-I402 HydrophobicContact CG-CD1 4.13Å; M282-Q405 PolarHBondContact SD-NE2 2.9Å
283	R	96.9	Very high	94.1	Very high	72 Å²	72	43 Å²	43	27%	0.272	22%	0.221	S	C	.	.	H	α-helix	trans	-62.2	-48.7	171.8	178.6	177.2	61.1	-120.7	7.9	111.6	I279 H280 V281 S285 L286 Q287 P396 K397 V399	I279-R283 PolarHBondContact O-N 3.05Å; H280-R283 PolarHBondContact O-N 2.64Å; V281-R283 PolarHBondContact O-N 3.15Å; R283-S285 VanDerWaalsContact C-N 3.31Å; R283-S285 PolarHBondContact O-N 2.89Å; R283-L286 PolarHBondContact O-N 3.46Å; R283-Q287 WeakPolarHBondContact O-CB 3.2Å; R283-Q287 PolarHBondContact O-N 3.14Å; R283-P396 PolarHBondContact NH1-O 3.41Å; R283-P396 VanDerWaalsContact NH1-O 3.13Å; R283-K397 VanDerWaalsContact NH1-C 3.29Å; R283-K397 PolarHBondContact NH1-O 3.33Å; R283-V399 WeakPolarHBondContact CD-O 3.34Å; R283-V399 PolarHBondContact NH1-O 2.83Å
284	S	97.8	Very high	93.3	Very high	53 Å²	53	41.4 Å²	41.4	37%	0.371	22%	0.215	S	C	.	.	H	α-helix	trans	-63.8	-37	179.7	-178.3	0	0	0	0	112.2	H280 V281 Q287 K288	H280-S284 WeakPolarHBondContact O-CB 3.46Å; H280-S284 PolarHBondContact O-N 3.16Å; V281-S284 PolarHBondContact O-N 2.65Å; S284-Q287 PolarHBondContact O-N 3.11Å; S284-K288 WeakPolarHBondContact O-CG 3.27Å; S284-K288 PolarHBondContact O-N 3.04Å
285	S	98.2	Very high	92.3	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.028	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-48.2	175.2	-179.6	0	0	0	0	111.9	V281 R283 K288 L289 S311 W313 H316	V281-S285 WeakPolarHBondContact O-CB 3.32Å; V281-S285 PolarHBondContact O-N 2.7Å; R283-S285 VanDerWaalsContact C-N 3.31Å; R283-S285 PolarHBondContact O-N 2.89Å; S285-K288 PolarHBondContact O-N 3.47Å; S285-L289 PolarHBondContact O-N 2.92Å; S285-S311 WeakPolarHBondContact CA-O 3.23Å; S285-S311 VanDerWaalsContact CB-O 3.28Å; S285-S311 WeakPolarHBondContact CB-O 3.19Å; S285-S311 PolarHBondContact OG-O 3.37Å; S285-W313 VanDerWaalsContact OG-CA 3.29Å; S285-W313 WeakPolarHBondContact OG-CA 3.47Å; S285-W313 PolarHBondContact OG-N 2.93Å; S285-H316 PolarHBondContact OG-CD2 2.96Å
286	L	96.1	Very high	91.3	Very high	19 Å²	19	42.4 Å²	42.4	10%	0.099	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-43.6	174	179.5	60.7	0	0	0	111.5	F80 M282 R283 K288 L289 L290 W313 P401 Y506	F80-L286 HydrophobicContact CE1-CD1 4.25Å; F80-L286 HydrophobicContact CE1-CD2 4.08Å; F80-L286 HydrophobicContact CZ-CD1 4.44Å; F80-L286 HydrophobicContact CZ-CD2 4.36Å; M282-L286 PolarHBondContact O-N 2.86Å; R283-L286 PolarHBondContact O-N 3.46Å; L286-K288 VanDerWaalsContact C-N 3.33Å; L286-K288 PolarHBondContact O-N 2.85Å; L286-L289 HydrophobicContact CD1-CD2 4.18Å; L286-L289 WeakPolarHBondContact O-CA 3.45Å; L286-L289 WeakPolarHBondContact O-CB 3.43Å; L286-L289 PolarHBondContact O-N 3.41Å; L286-L290 HydrophobicContact CD1-CD1 4.1Å; L286-L290 HydrophobicContact CD1-CD2 3.97Å; L286-L290 HydrophobicContact CD1-CG 3.86Å; L286-L290 HydrophobicContact CD2-CD1 4.44Å; L286-L290 HydrophobicContact CG-CD1 3.92Å; L286-L290 HydrophobicContact CG-CG 4.1Å; L286-L290 VanDerWaalsContact O-CG 3.32Å; L286-L290 WeakPolarHBondContact O-CG 3.33Å; L286-L290 PolarHBondContact O-N 3Å; L286-W313 HydrophobicContact CB-CE3 4.13Å; L286-W313 HydrophobicContact CB-CH2 4.26Å; L286-W313 HydrophobicContact CB-CZ3 3.69Å; L286-W313 HydrophobicContact CD1-CH2 4.34Å; L286-W313 HydrophobicContact CD1-CZ3 4.42Å; L286-P401 HydrophobicContact CB-CG 3.93Å; L286-P401 HydrophobicContact CD2-CB 3.49Å; L286-P401 VanDerWaalsContact CD2-CB 3.49Å; L286-P401 HydrophobicContact CD2-CG 3.62Å; L286-P401 HydrophobicContact CG-CG 4.41Å; L286-Y506 HydrophobicContact CD1-CE1 3.8Å
287	Q	94.1	Very high	89.8	Confident	106 Å²	106	49.9 Å²	49.9	50%	0.495	26%	0.257	S	S	.	.	H	α-helix	trans	-55.8	-48.4	178.3	-177.9	-177.9	-17.2	0	0	111.4	R283 S284 L289 L290 E291	R283-Q287 WeakPolarHBondContact O-CB 3.2Å; R283-Q287 PolarHBondContact O-N 3.14Å; S284-Q287 PolarHBondContact O-N 3.11Å; Q287-L289 VanDerWaalsContact C-N 3.32Å; Q287-L289 PolarHBondContact O-N 3.32Å; Q287-L290 PolarHBondContact O-N 3.07Å; Q287-E291 WeakPolarHBondContact CG-OE1 3.46Å; Q287-E291 PolarHBondContact NE2-OE1 2.9Å; Q287-E291 WeakPolarHBondContact O-CG 3.36Å; Q287-E291 PolarHBondContact O-N 3.26Å
288	K	95	Very high	88.4	Confident	98 Å²	98	52.6 Å²	52.6	43%	0.426	28%	0.283	S	S	.	.	H	α-helix	trans	-60.2	-39.6	175.1	-71.1	174.8	178.2	-173.6	0	112.7	S284 S285 L286 E291 V292	S284-K288 WeakPolarHBondContact O-CG 3.27Å; S284-K288 PolarHBondContact O-N 3.04Å; S285-K288 PolarHBondContact O-N 3.47Å; L286-K288 VanDerWaalsContact C-N 3.33Å; L286-K288 PolarHBondContact O-N 2.85Å; K288-E291 PolarHBondContact O-N 3.45Å; K288-V292 WeakPolarHBondContact O-CG2 3.45Å; K288-V292 PolarHBondContact O-N 2.74Å
289	L	94	Very high	87.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-47	175.5	-177.5	68.1	0	0	0	111	S285 L286 Q287 V292 V293 L308 W313 F501 Y506	S285-L289 PolarHBondContact O-N 2.92Å; L286-L289 HydrophobicContact CD1-CD2 4.18Å; L286-L289 WeakPolarHBondContact O-CA 3.45Å; L286-L289 WeakPolarHBondContact O-CB 3.43Å; L286-L289 PolarHBondContact O-N 3.41Å; Q287-L289 VanDerWaalsContact C-N 3.32Å; Q287-L289 PolarHBondContact O-N 3.32Å; L289-V292 PolarHBondContact O-N 2.82Å; L289-V293 HydrophobicContact CD1-CG2 4.1Å; L289-V293 HydrophobicContact CG-CG2 4.33Å; L289-V293 VanDerWaalsContact O-CB 3.29Å; L289-V293 WeakPolarHBondContact O-CB 3.4Å; L289-V293 VanDerWaalsContact O-CG2 3.3Å; L289-V293 WeakPolarHBondContact O-CG2 3.48Å; L289-V293 PolarHBondContact O-N 3.44Å; L289-L308 HydrophobicContact CD1-CD1 3.36Å; L289-W313 HydrophobicContact CD2-CB 4.15Å; L289-W313 HydrophobicContact CD2-CD2 4.14Å; L289-W313 HydrophobicContact CD2-CG 3.73Å; L289-F501 HydrophobicContact CD1-CD2 4.37Å; L289-F501 HydrophobicContact CD1-CE2 3.95Å; L289-F501 HydrophobicContact CD2-CE2 4.34Å; L289-F501 HydrophobicContact CG-CE2 4.45Å; L289-Y506 HydrophobicContact CD2-CD1 4.27Å; L289-Y506 HydrophobicContact CD2-CD2 4.3Å; L289-Y506 HydrophobicContact CD2-CE1 3.89Å; L289-Y506 HydrophobicContact CD2-CE2 3.92Å; L289-Y506 HydrophobicContact CD2-CG 4.47Å
290	L	90.5	Very high	86.8	Confident	41 Å²	41	56.4 Å²	56.4	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-69.8	-32.2	178.4	-56.5	177.4	0	0	0	111.7	F80 L286 Q287 V292 I294 G295 Y506	F80-L290 HydrophobicContact CB-CD2 4.45Å; F80-L290 HydrophobicContact CD1-CD1 3.86Å; F80-L290 HydrophobicContact CD1-CD2 3.53Å; F80-L290 HydrophobicContact CD1-CG 4.37Å; F80-L290 HydrophobicContact CE1-CD1 4.04Å; F80-L290 HydrophobicContact CE1-CD2 4.05Å; F80-L290 HydrophobicContact CG-CD2 4.06Å; L286-L290 HydrophobicContact CD1-CD1 4.1Å; L286-L290 HydrophobicContact CD1-CD2 3.97Å; L286-L290 HydrophobicContact CD1-CG 3.86Å; L286-L290 HydrophobicContact CD2-CD1 4.44Å; L286-L290 HydrophobicContact CG-CD1 3.92Å; L286-L290 HydrophobicContact CG-CG 4.1Å; L286-L290 VanDerWaalsContact O-CG 3.32Å; L286-L290 WeakPolarHBondContact O-CG 3.33Å; L286-L290 PolarHBondContact O-N 3Å; Q287-L290 PolarHBondContact O-N 3.07Å; L290-V292 VanDerWaalsContact C-N 3.3Å; L290-V292 PolarHBondContact O-N 3.2Å; L290-I294 HydrophobicContact CB-CD1 4.21Å; L290-I294 HydrophobicContact CB-CG1 4.39Å; L290-I294 HydrophobicContact CD2-CD1 3.52Å; L290-I294 HydrophobicContact CD2-CG1 4.23Å; L290-I294 HydrophobicContact CG-CD1 4.33Å; L290-I294 CarbonylContact O-C 3.55Å; L290-I294 WeakPolarHBondContact O-CA 3.42Å; L290-I294 WeakPolarHBondContact O-CB 3.49Å; L290-I294 PolarHBondContact O-N 3.01Å; L290-G295 PolarHBondContact O-N 3.24Å; L290-Y506 HydrophobicContact CD2-CD1 3.89Å; L290-Y506 HydrophobicContact CD2-CE1 4.26Å
291	E	89.1	Confident	86.2	Confident	103 Å²	103	58.8 Å²	58.8	48%	0.481	32%	0.319	S	S	.	.	I	π-helix	trans	-61.1	-39.1	173	-76.4	166.1	-173.7	0	0	111.9	Q287 K288 G295 A296	Q287-E291 WeakPolarHBondContact CG-OE1 3.46Å; Q287-E291 PolarHBondContact NE2-OE1 2.9Å; Q287-E291 WeakPolarHBondContact O-CG 3.36Å; Q287-E291 PolarHBondContact O-N 3.26Å; K288-E291 PolarHBondContact O-N 3.45Å; E291-G295 WeakPolarHBondContact O-CA 3.1Å; E291-G295 PolarHBondContact O-N 2.86Å; E291-A296 PolarHBondContact O-N 3.36Å
292	V	86.6	Confident	85.8	Confident	25 Å²	25	60.4 Å²	60.4	15%	0.152	33%	0.332	C	S	.	.	I	π-helix	trans	-75.4	-51.7	176.3	177	0	0	0	0	111.3	K288 L289 L290 L299 Y304	K288-V292 WeakPolarHBondContact O-CG2 3.45Å; K288-V292 PolarHBondContact O-N 2.74Å; L289-V292 PolarHBondContact O-N 2.82Å; L290-V292 VanDerWaalsContact C-N 3.3Å; L290-V292 PolarHBondContact O-N 3.2Å; V292-L299 HydrophobicContact CG1-CD1 3.86Å; V292-L299 WeakPolarHBondContact O-CD1 3.28Å; V292-Y304 HydrophobicContact CG1-CD2 4.02Å; V292-Y304 HydrophobicContact CG1-CE2 4.46Å
293	V	81.3	Confident	85.3	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.012	35%	0.353	C	S	.	.	I	π-helix	trans	-73.4	-34.1	-174.2	170.5	0	0	0	0	112.4	R17 L289 Y304 F501 H507	R17-V293 PolarHBondContact NH1-O 3.31Å; R17-V293 PolarHBondContact NH2-O 3.29Å; L289-V293 HydrophobicContact CD1-CG2 4.1Å; L289-V293 HydrophobicContact CG-CG2 4.33Å; L289-V293 VanDerWaalsContact O-CB 3.29Å; L289-V293 WeakPolarHBondContact O-CB 3.4Å; L289-V293 VanDerWaalsContact O-CG2 3.3Å; L289-V293 WeakPolarHBondContact O-CG2 3.48Å; L289-V293 PolarHBondContact O-N 3.44Å; V293-Y304 HydrophobicContact CG2-CE2 4.07Å; V293-F501 HydrophobicContact CG1-CZ 4.32Å; V293-F501 HydrophobicContact CG2-CE2 4.01Å; V293-F501 HydrophobicContact CG2-CZ 3.71Å; V293-H507 WeakPolarHBondContact CG1-CE1 3.4Å
294	I	76.9	Confident	84.8	Confident	21 Å²	21	62.9 Å²	62.9	11%	0.108	35%	0.348	C	S	.	.	I	π-helix	trans	-118.6	-34.2	-168.6	-49.1	-171.7	0	0	0	113	R17 F80 V82 L290	R17-I294 VanDerWaalsContact CZ-CA 3.4Å; R17-I294 PolarHBondContact NE-O 3.43Å; R17-I294 PolarHBondContact NH2-O 3.02Å; F80-I294 HydrophobicContact CB-CD1 3.89Å; F80-I294 WeakPolarHBondContact O-CD1 3.49Å; V82-I294 HydrophobicContact CB-CG2 3.96Å; V82-I294 HydrophobicContact CG2-CG2 3.25Å; L290-I294 HydrophobicContact CB-CD1 4.21Å; L290-I294 HydrophobicContact CB-CG1 4.39Å; L290-I294 HydrophobicContact CD2-CD1 3.52Å; L290-I294 HydrophobicContact CD2-CG1 4.23Å; L290-I294 HydrophobicContact CG-CD1 4.33Å; L290-I294 CarbonylContact O-C 3.55Å; L290-I294 WeakPolarHBondContact O-CA 3.42Å; L290-I294 WeakPolarHBondContact O-CB 3.49Å; L290-I294 PolarHBondContact O-N 3.01Å
295	G	69.3	Low	84.4	Confident	58 Å²	58	65 Å²	65	60%	0.598	35%	0.354	S	S	*	.	I	π-helix	trans	-70.8	-42.1	-179.1	0	0	0	0	0	113.8	L290 E291	L290-G295 PolarHBondContact O-N 3.24Å; E291-G295 WeakPolarHBondContact O-CA 3.1Å; E291-G295 PolarHBondContact O-N 2.86Å
296	A	70	Confident	84.1	Confident	28 Å²	28	68.6 Å²	68.6	23%	0.231	38%	0.376	C	S	.	.			trans	-85.2	141.4	-173	0	0	0	0	0	113.7	R17 E291 L299	R17-A296 PolarHBondContact NH2-O 3.02Å; E291-A296 PolarHBondContact O-N 3.36Å; A296-L299 HydrophobicContact CB-CD1 3.61Å; A296-L299 HydrophobicContact CB-CD2 4.13Å; A296-L299 HydrophobicContact CB-CG 3.52Å
297	R	65.8	Low	83.9	Confident	158 Å²	158	68.3 Å²	68.3	60%	0.596	38%	0.377	S	S	*	.	S	Bend	trans	-95.2	-22.3	175	-72.9	-176.3	172.6	167.5	-1.8	114.1
298	S	68.6	Low	83.8	Confident	113 Å²	113	64.3 Å²	64.3	79%	0.79	36%	0.359	S	S	*	.	S	Bend	trans	-151.2	81.7	-175.2	57.7	0	0	0	0	110.6
299	L	75.3	Confident	83.8	Confident	72 Å²	72	67 Å²	67	38%	0.377	37%	0.373	S	S	.	.			trans	-92.4	145.7	170.6	-77.3	163.5	0	0	0	110.3	V292 A296 D303 Y304	V292-L299 HydrophobicContact CG1-CD1 3.86Å; V292-L299 WeakPolarHBondContact O-CD1 3.28Å; A296-L299 HydrophobicContact CB-CD1 3.61Å; A296-L299 HydrophobicContact CB-CD2 4.13Å; A296-L299 HydrophobicContact CB-CG 3.52Å; L299-D303 HydrophobicContact CD2-CB 3.59Å; L299-Y304 HydrophobicContact CD1-CD2 4.16Å
300	T	83.8	Confident	83.8	Confident	75 Å²	75	72.2 Å²	72.2	46%	0.46	40%	0.401	S	S	.	.			trans	-73.6	160.8	158.8	77.1	0	0	0	0	109.6	S302 D303 Y304	T300-S302 PolarHBondContact O-N 3.39Å; T300-S302 PolarHBondContact OG1-N 2.91Å; T300-D303 WeakPolarHBondContact CB-OD2 3.24Å; T300-D303 WeakPolarHBondContact CG2-OD2 3.34Å; T300-D303 PolarHBondContact N-OD2 2.85Å; T300-D303 PolarHBondContact O-N 3.14Å; T300-D303 PolarHBondContact OG1-N 3.34Å; T300-D303 PolarHBondContact OG1-OD2 2.78Å; T300-Y304 WeakPolarHBondContact O-CB 3.47Å; T300-Y304 PolarHBondContact O-N 3.09Å
301	M	84.8	Confident	84.1	Confident	136 Å²	136	70.5 Å²	70.5	67%	0.67	39%	0.393	S	S	*	.	H	α-helix	trans	-60.1	-35.5	175.1	-174.1	59.1	65.6	0	0	111.7	Y304 L305	M301-Y304 PolarHBondContact O-N 2.79Å; M301-Y304 HydrophobicContact SD-CD1 4.47Å; M301-L305 HydrophobicContact CG-CD1 4.12Å; M301-L305 HydrophobicContact CG-CG 4.5Å; M301-L305 VanDerWaalsContact O-CG 3.3Å; M301-L305 WeakPolarHBondContact O-CG 3.18Å; M301-L305 PolarHBondContact O-N 2.84Å; M301-L305 HydrophobicContact SD-CD1 4.45Å; M301-L305 HydrophobicContact SD-CG 4.33Å
302	S	88.6	Confident	84.5	Confident	83 Å²	83	66.4 Å²	66.4	58%	0.58	38%	0.378	S	S	*	.	H	α-helix	trans	-62.9	-49.5	176.7	-53.6	0	0	0	0	111.5	T300 Y304 L305 V306	T300-S302 PolarHBondContact O-N 3.39Å; T300-S302 PolarHBondContact OG1-N 2.91Å; S302-Y304 VanDerWaalsContact C-N 3.3Å; S302-Y304 PolarHBondContact O-N 2.97Å; S302-L305 PolarHBondContact O-N 2.84Å; S302-V306 WeakPolarHBondContact O-CB 3.47Å; S302-V306 WeakPolarHBondContact O-CG2 3.32Å; S302-V306 PolarHBondContact O-N 3.42Å
303	D	88.4	Confident	85	Confident	83 Å²	83	65.2 Å²	65.2	44%	0.444	37%	0.371	S	S	.	.	H	α-helix	trans	-64.7	-36.6	179.7	-53.8	-47	0	0	0	111.7	L299 T300 G307	L299-D303 HydrophobicContact CD2-CB 3.59Å; T300-D303 WeakPolarHBondContact CB-OD2 3.24Å; T300-D303 WeakPolarHBondContact CG2-OD2 3.34Å; T300-D303 PolarHBondContact N-OD2 2.85Å; T300-D303 PolarHBondContact O-N 3.14Å; T300-D303 PolarHBondContact OG1-N 3.34Å; T300-D303 PolarHBondContact OG1-OD2 2.78Å; D303-G307 PolarHBondContact O-N 2.71Å
304	Y	87.4	Confident	85.7	Confident	43 Å²	43	67 Å²	67	17%	0.169	38%	0.38	C	S	.	.	H	α-helix	trans	-62.8	-46.9	174.9	179.1	-89.8	0	0	0	112	V292 V293 L299 T300 M301 S302 G307 L308 F501	V292-Y304 HydrophobicContact CG1-CD2 4.02Å; V292-Y304 HydrophobicContact CG1-CE2 4.46Å; V293-Y304 HydrophobicContact CG2-CE2 4.07Å; L299-Y304 HydrophobicContact CD1-CD2 4.16Å; T300-Y304 WeakPolarHBondContact O-CB 3.47Å; T300-Y304 PolarHBondContact O-N 3.09Å; M301-Y304 PolarHBondContact O-N 2.79Å; M301-Y304 HydrophobicContact SD-CD1 4.47Å; S302-Y304 VanDerWaalsContact C-N 3.3Å; S302-Y304 PolarHBondContact O-N 2.97Å; Y304-G307 PolarHBondContact O-N 2.87Å; Y304-L308 HydrophobicContact CE1-CD2 4.35Å; Y304-L308 VanDerWaalsContact O-CB 3.28Å; Y304-L308 WeakPolarHBondContact O-CB 3.41Å; Y304-L308 PolarHBondContact O-N 3.1Å; Y304-F501 WeakPolarHBondContact OH-CD1 3.48Å; Y304-F501 WeakPolarHBondContact OH-CE1 3.39Å; Y304-F501 WeakPolarHBondContact OH-CZ 3.19Å
305	L	89.3	Confident	86.7	Confident	96 Å²	96	75.5 Å²	75.5	50%	0.503	41%	0.411	S	S	.	.	H	α-helix	trans	-67.6	-44.1	179.6	-69.4	172.6	0	0	0	111.9	M301 S302 G307 L308 E309	M301-L305 HydrophobicContact CG-CD1 4.12Å; M301-L305 HydrophobicContact CG-CG 4.5Å; M301-L305 VanDerWaalsContact O-CG 3.3Å; M301-L305 WeakPolarHBondContact O-CG 3.18Å; M301-L305 PolarHBondContact O-N 2.84Å; M301-L305 HydrophobicContact SD-CD1 4.45Å; M301-L305 HydrophobicContact SD-CG 4.33Å; S302-L305 PolarHBondContact O-N 2.84Å; L305-G307 VanDerWaalsContact C-N 3.34Å; L305-G307 PolarHBondContact O-N 3.26Å; L305-L308 PolarHBondContact O-N 3.41Å; L305-E309 PolarHBondContact O-N 3.11Å
306	V	92.1	Very high	88.1	Confident	81 Å²	81	74 Å²	74	49%	0.491	39%	0.388	S	S	.	.	H	α-helix	trans	-63.4	-40.6	175.3	170.2	0	0	0	0	111	S302 E309 N310	S302-V306 WeakPolarHBondContact O-CB 3.47Å; S302-V306 WeakPolarHBondContact O-CG2 3.32Å; S302-V306 PolarHBondContact O-N 3.42Å; V306-E309 PolarHBondContact O-N 3.1Å; V306-N310 VanDerWaalsContact CG1-ND2 3.34Å; V306-N310 WeakPolarHBondContact CG1-ND2 3.45Å; V306-N310 VanDerWaalsContact O-CB 3.24Å; V306-N310 WeakPolarHBondContact O-CB 3.34Å; V306-N310 VanDerWaalsContact O-CG 3.22Å; V306-N310 PolarHBondContact O-N 3.15Å; V306-N310 PolarHBondContact O-ND2 3.48Å; V306-N310 VanDerWaalsContact O-ND2 3.13Å
307	G	91.9	Very high	89.4	Confident	12 Å²	12	72.7 Å²	72.7	12%	0.124	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-43.9	174.4	0	0	0	0	0	112.9	D303 Y304 L305 N310 S311	D303-G307 PolarHBondContact O-N 2.71Å; Y304-G307 PolarHBondContact O-N 2.87Å; L305-G307 VanDerWaalsContact C-N 3.34Å; L305-G307 PolarHBondContact O-N 3.26Å; G307-N310 PolarHBondContact O-N 3.47Å; G307-S311 PolarHBondContact O-N 2.93Å
308	L	91.4	Very high	90.9	Very high	22 Å²	22	67.4 Å²	67.4	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-43.7	175.4	176.8	61.7	0	0	0	111.5	L289 Y304 L305 S311 L314 F501	L289-L308 HydrophobicContact CD1-CD1 3.36Å; Y304-L308 HydrophobicContact CE1-CD2 4.35Å; Y304-L308 VanDerWaalsContact O-CB 3.28Å; Y304-L308 WeakPolarHBondContact O-CB 3.41Å; Y304-L308 PolarHBondContact O-N 3.1Å; L305-L308 PolarHBondContact O-N 3.41Å; L308-S311 WeakPolarHBondContact O-CB 3.43Å; L308-S311 PolarHBondContact O-N 2.53Å; L308-S311 PolarHBondContact O-OG 2.79Å; L308-L314 HydrophobicContact CD1-CD1 4.49Å; L308-L314 HydrophobicContact CD2-CD1 4.4Å; L308-F501 HydrophobicContact CD1-CD2 3.79Å; L308-F501 HydrophobicContact CD1-CE2 4.36Å; L308-F501 HydrophobicContact CD1-CG 4.43Å; L308-F501 HydrophobicContact CD2-CB 4.11Å; L308-F501 HydrophobicContact CD2-CG 4.41Å
309	E	93.6	Very high	92.3	Very high	154 Å²	154	63 Å²	63	72%	0.72	33%	0.329	S	S	*	.	H	α-helix	trans	-64.8	-47.8	175	-176.1	170.6	-159.8	0	0	111.9	L305 V306 S311 G312	L305-E309 PolarHBondContact O-N 3.11Å; V306-E309 PolarHBondContact O-N 3.1Å; E309-S311 PolarHBondContact O-N 3.49Å; E309-G312 PolarHBondContact O-N 3.47Å
310	N	95.7	Very high	93.4	Very high	110 Å²	110	59.5 Å²	59.5	59%	0.588	31%	0.311	S	S	*	.	H	α-helix	trans	-65.3	-18.8	179.2	-76.5	-32.3	0	0	0	114.2	V306 G307 G312	V306-N310 VanDerWaalsContact CG1-ND2 3.34Å; V306-N310 WeakPolarHBondContact CG1-ND2 3.45Å; V306-N310 VanDerWaalsContact O-CB 3.24Å; V306-N310 WeakPolarHBondContact O-CB 3.34Å; V306-N310 VanDerWaalsContact O-CG 3.22Å; V306-N310 PolarHBondContact O-N 3.15Å; V306-N310 PolarHBondContact O-ND2 3.48Å; V306-N310 VanDerWaalsContact O-ND2 3.13Å; G307-N310 PolarHBondContact O-N 3.47Å; N310-G312 PolarHBondContact O-N 2.88Å
311	S	96.5	Very high	94.1	Very high	5 Å²	5	56.1 Å²	56.1	4%	0.035	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.7	168.5	81.2	0	0	0	0	112.2	S285 G307 L308 E309 W313	S285-S311 WeakPolarHBondContact CA-O 3.23Å; S285-S311 VanDerWaalsContact CB-O 3.28Å; S285-S311 WeakPolarHBondContact CB-O 3.19Å; S285-S311 PolarHBondContact OG-O 3.37Å; G307-S311 PolarHBondContact O-N 2.93Å; L308-S311 WeakPolarHBondContact O-CB 3.43Å; L308-S311 PolarHBondContact O-N 2.53Å; L308-S311 PolarHBondContact O-OG 2.79Å; E309-S311 PolarHBondContact O-N 3.49Å; S311-W313 PolarHBondContact O-N 3.37Å; S311-W313 WeakPolarHBondContact OG-CB 3.37Å; S311-W313 PolarHBondContact OG-N 3.4Å; S311-W313 VanDerWaalsContact OG-N 3.1Å
312	G	96.9	Very high	94.7	Very high	18 Å²	18	52.1 Å²	52.1	19%	0.186	27%	0.272	C	S	.	.			trans	69.2	1.6	-172.3	0	0	0	0	0	114.7	E309 N310 L314 R315 H316	E309-G312 PolarHBondContact O-N 3.47Å; N310-G312 PolarHBondContact O-N 2.88Å; G312-L314 PolarHBondContact O-N 2.81Å; G312-R315 WeakPolarHBondContact O-CB 3.48Å; G312-R315 PolarHBondContact O-N 2.81Å; G312-R315 VanDerWaalsContact O-N 3.1Å; G312-H316 PolarHBondContact O-CD2 3.18Å; G312-H316 PolarHBondContact O-N 3.46Å
313	W	97.7	Very high	95.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-54.2	-167.7	-177.4	-105.1	0	0	0	113.1	S285 L286 L289 S311 R315 H316 I317 P401 Q405 E408 Y506	S285-W313 VanDerWaalsContact OG-CA 3.29Å; S285-W313 WeakPolarHBondContact OG-CA 3.47Å; S285-W313 PolarHBondContact OG-N 2.93Å; L286-W313 HydrophobicContact CB-CE3 4.13Å; L286-W313 HydrophobicContact CB-CH2 4.26Å; L286-W313 HydrophobicContact CB-CZ3 3.69Å; L286-W313 HydrophobicContact CD1-CH2 4.34Å; L286-W313 HydrophobicContact CD1-CZ3 4.42Å; L289-W313 HydrophobicContact CD2-CB 4.15Å; L289-W313 HydrophobicContact CD2-CD2 4.14Å; L289-W313 HydrophobicContact CD2-CG 3.73Å; S311-W313 PolarHBondContact O-N 3.37Å; S311-W313 WeakPolarHBondContact OG-CB 3.37Å; S311-W313 PolarHBondContact OG-N 3.4Å; S311-W313 VanDerWaalsContact OG-N 3.1Å; W313-R315 PolarHBondContact O-N 2.91Å; W313-H316 WeakPolarHBondContact O-CA 3.44Å; W313-H316 WeakPolarHBondContact O-CB 3.47Å; W313-H316 PolarHBondContact O-N 3.16Å; W313-I317 HydrophobicContact CZ2-CD1 4.15Å; W313-I317 PolarHBondContact O-N 2.97Å; W313-P401 HydrophobicContact CH2-CB 4.08Å; W313-P401 HydrophobicContact CH2-CG 3.77Å; W313-P401 HydrophobicContact CZ3-CG 3.83Å; W313-Q405 HydrophobicContact CH2-CG 3.27Å; W313-Q405 HydrophobicContact CZ2-CG 3.71Å; W313-Q405 HydrophobicContact CZ3-CG 3.86Å; W313-E408 VanDerWaalsContact NE1-CD 3.33Å; W313-E408 PolarHBondContact NE1-OE1 2.89Å; W313-E408 PolarHBondContact NE1-OE2 3.23Å; W313-Y506 VanDerWaalsContact CE2-OH 3.29Å; W313-Y506 WeakPolarHBondContact CZ2-OH 3.39Å; W313-Y506 PolarHBondContact NE1-OH 3.25Å
314	L	96.5	Very high	95.7	Very high	38 Å²	38	44.3 Å²	44.3	20%	0.199	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-28.6	178.3	-65.3	177.5	0	0	0	112.7	L308 G312 I317 K318	L308-L314 HydrophobicContact CD1-CD1 4.49Å; L308-L314 HydrophobicContact CD2-CD1 4.4Å; G312-L314 PolarHBondContact O-N 2.81Å; L314-I317 PolarHBondContact O-N 3.35Å; L314-K318 VanDerWaalsContact O-CB 3.31Å; L314-K318 WeakPolarHBondContact O-CB 3.49Å; L314-K318 PolarHBondContact O-N 3.39Å
315	R	96.9	Very high	96.2	Very high	200 Å²	200	43.1 Å²	43.1	76%	0.755	22%	0.22	S	C	*	.	H	α-helix	trans	-68.1	-35.9	173	178.8	-179.5	175.4	173	-0.5	111.6	G312 W313 A319	G312-R315 WeakPolarHBondContact O-CB 3.48Å; G312-R315 PolarHBondContact O-N 2.81Å; G312-R315 VanDerWaalsContact O-N 3.1Å; W313-R315 PolarHBondContact O-N 2.91Å; R315-A319 WeakPolarHBondContact O-CB 3.43Å; R315-A319 PolarHBondContact O-N 2.9Å
316	H	98.1	Very high	96.6	Very high	27 Å²	27	40.3 Å²	40.3	13%	0.125	21%	0.208	C	C	.	.	H	α-helix	trans	-72	-42.6	173.6	-63.9	-53.6	0	0	0	112.1	M282 S285 G312 W313 K318 A319 V320	M282-H316 HydrophobicContact CE-CB 4.05Å; M282-H316 HydrophobicContact SD-CB 3.78Å; M282-H316 VanDerWaalsContact SD-CG 3.56Å; S285-H316 PolarHBondContact OG-CD2 2.96Å; G312-H316 PolarHBondContact O-CD2 3.18Å; G312-H316 PolarHBondContact O-N 3.46Å; W313-H316 WeakPolarHBondContact O-CA 3.44Å; W313-H316 WeakPolarHBondContact O-CB 3.47Å; W313-H316 PolarHBondContact O-N 3.16Å; H316-K318 VanDerWaalsContact C-N 3.32Å; H316-K318 PolarHBondContact O-N 2.83Å; H316-A319 PolarHBondContact O-N 3.26Å; H316-V320 WeakPolarHBondContact O-CG2 3.37Å; H316-V320 PolarHBondContact O-N 3.44Å
317	I	98.4	Very high	96.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.8	-46.3	172	-59.6	-55.9	0	0	0	110.5	W313 L314 A319 V320 V321 Q405 E408 Q412 F499	W313-I317 HydrophobicContact CZ2-CD1 4.15Å; W313-I317 PolarHBondContact O-N 2.97Å; L314-I317 PolarHBondContact O-N 3.35Å; I317-A319 PolarHBondContact O-N 3.09Å; I317-V320 PolarHBondContact O-N 3.04Å; I317-V321 WeakPolarHBondContact O-CG2 3.38Å; I317-V321 PolarHBondContact O-N 2.91Å; I317-V321 VanDerWaalsContact O-N 3.08Å; I317-Q405 HydrophobicContact CD1-CB 3.93Å; I317-Q405 HydrophobicContact CD1-CG 3.88Å; I317-E408 HydrophobicContact CD1-CB 4.06Å; I317-E408 HydrophobicContact CD1-CG 4.22Å; I317-E408 HydrophobicContact CG1-CG 4.3Å; I317-E408 HydrophobicContact CG2-CG 4.48Å; I317-Q412 HydrophobicContact CG2-CG 3.88Å; I317-F499 HydrophobicContact CG2-CD1 3.96Å; I317-F499 HydrophobicContact CG2-CE1 4.08Å
318	K	97.6	Very high	97.2	Very high	47 Å²	47	36.1 Å²	36.1	20%	0.204	18%	0.181	C	C	.	.	H	α-helix	trans	-56.3	-49.1	174.3	-173.3	-148	-177.1	-46.4	0	112.1	L314 H316 V320 V321 D322 T494 F499	L314-K318 VanDerWaalsContact O-CB 3.31Å; L314-K318 WeakPolarHBondContact O-CB 3.49Å; L314-K318 PolarHBondContact O-N 3.39Å; H316-K318 VanDerWaalsContact C-N 3.32Å; H316-K318 PolarHBondContact O-N 2.83Å; K318-V320 VanDerWaalsContact C-N 3.29Å; K318-V320 PolarHBondContact O-N 3.47Å; K318-V321 PolarHBondContact O-N 3.46Å; K318-V321 VanDerWaalsContact O-N 3.14Å; K318-D322 IonicContact NZ-OD1 2.97Å; K318-D322 PolarHBondContact NZ-OD1 3.2Å; K318-D322 IonicContact NZ-OD2 3.82Å; K318-D322 PolarHBondContact NZ-OD2 2.9Å; K318-D322 PolarHBondContact O-N 3.21Å; K318-T494 WeakPolarHBondContact CE-O 3.38Å; K318-T494 PolarHBondContact NZ-O 3.05Å; K318-T494 PolarHBondContact NZ-OG1 3.49Å; K318-F499 HydrophobicContact CB-CD1 4.4Å; K318-F499 HydrophobicContact CB-CD2 4.21Å; K318-F499 HydrophobicContact CB-CE1 4.14Å; K318-F499 HydrophobicContact CB-CE2 3.93Å; K318-F499 HydrophobicContact CB-CG 4.46Å; K318-F499 HydrophobicContact CB-CZ 3.9Å; K318-F499 HydrophobicContact CG-CD2 4.13Å; K318-F499 HydrophobicContact CG-CE2 3.57Å; K318-F499 HydrophobicContact CG-CZ 3.84Å
319	A	97.8	Very high	97.4	Very high	20 Å²	20	39.9 Å²	39.9	17%	0.165	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-34	-179	0	0	0	0	0	113.2	R315 H316 I317 A323	R315-A319 WeakPolarHBondContact O-CB 3.43Å; R315-A319 PolarHBondContact O-N 2.9Å; H316-A319 PolarHBondContact O-N 3.26Å; I317-A319 PolarHBondContact O-N 3.09Å; A319-A323 WeakPolarHBondContact O-CB 3.49Å; A319-A323 PolarHBondContact O-N 3.12Å; A319-A323 VanDerWaalsContact O-N 3.17Å
320	V	98.5	Very high	97.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-68.6	-41.4	174.1	175.6	0	0	0	0	111.1	I276 H316 I317 K318 A323 A324 Q351 L355	I276-V320 HydrophobicContact CD1-CB 4.49Å; I276-V320 HydrophobicContact CD1-CG2 4.11Å; I276-V320 HydrophobicContact CG2-CG2 3.91Å; H316-V320 WeakPolarHBondContact O-CG2 3.37Å; H316-V320 PolarHBondContact O-N 3.44Å; I317-V320 PolarHBondContact O-N 3.04Å; K318-V320 VanDerWaalsContact C-N 3.29Å; K318-V320 PolarHBondContact O-N 3.47Å; V320-A323 PolarHBondContact O-N 3.11Å; V320-A324 PolarHBondContact O-N 3.16Å; V320-A324 VanDerWaalsContact O-N 3.12Å; V320-Q351 HydrophobicContact CG1-CB 3.92Å; V320-L355 HydrophobicContact CG1-CD1 3.53Å
321	V	98.5	Very high	97.7	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.024	14%	0.137	C	C	.	.	H	α-helix	trans	-69.4	-41.6	175.7	177.9	0	0	0	0	111.8	I317 K318 A323 A324 V325 C409 P492 T494 F499	I317-V321 WeakPolarHBondContact O-CG2 3.38Å; I317-V321 PolarHBondContact O-N 2.91Å; I317-V321 VanDerWaalsContact O-N 3.08Å; K318-V321 PolarHBondContact O-N 3.46Å; K318-V321 VanDerWaalsContact O-N 3.14Å; V321-A323 VanDerWaalsContact C-N 3.25Å; V321-A323 PolarHBondContact O-N 3.47Å; V321-A324 PolarHBondContact O-N 3.3Å; V321-A324 VanDerWaalsContact O-N 3.13Å; V321-V325 HydrophobicContact CG1-CG2 4.29Å; V321-V325 WeakPolarHBondContact O-CG2 3.43Å; V321-V325 PolarHBondContact O-N 2.92Å; V321-C409 HydrophobicContact CG2-CB 3.96Å; V321-P492 HydrophobicContact CG1-CB 4.46Å; V321-P492 HydrophobicContact CG1-CG 4.1Å; V321-T494 HydrophobicContact CG1-CG2 4.01Å; V321-F499 HydrophobicContact CB-CE1 4.22Å; V321-F499 HydrophobicContact CB-CZ 4.11Å; V321-F499 HydrophobicContact CG1-CZ 4.3Å; V321-F499 HydrophobicContact CG2-CE1 4.02Å; V321-F499 HydrophobicContact CG2-CZ 4.39Å
322	D	97.9	Very high	97.7	Very high	52 Å²	52	28.2 Å²	28.2	28%	0.278	14%	0.14	S	C	.	.	H	α-helix	trans	-53.6	-44.5	173.7	-75.9	-40.5	0	0	0	111.2	K318 V325 C326 T494	K318-D322 IonicContact NZ-OD1 2.97Å; K318-D322 PolarHBondContact NZ-OD1 3.2Å; K318-D322 IonicContact NZ-OD2 3.82Å; K318-D322 PolarHBondContact NZ-OD2 2.9Å; K318-D322 PolarHBondContact O-N 3.21Å; D322-V325 PolarHBondContact O-N 3.39Å; D322-C326 WeakPolarHBondContact O-CB 3.36Å; D322-C326 PolarHBondContact O-N 2.96Å; D322-T494 WeakPolarHBondContact OD1-CB 3.4Å; D322-T494 WeakPolarHBondContact OD1-CG2 3.48Å; D322-T494 PolarHBondContact OD1-OG1 3.46Å
323	A	98.2	Very high	97.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-47.6	176.2	0	0	0	0	0	112.1	M242 V274 I276 A319 V320 V321 V325 C326 L327 V352	M242-A323 HydrophobicContact CE-CB 3.67Å; M242-A323 WeakPolarHBondContact CE-O 3.44Å; V274-A323 HydrophobicContact CB-CB 4.09Å; V274-A323 HydrophobicContact CG1-CB 4.45Å; V274-A323 HydrophobicContact CG2-CB 3.76Å; I276-A323 HydrophobicContact CD1-CB 3.81Å; A319-A323 WeakPolarHBondContact O-CB 3.49Å; A319-A323 PolarHBondContact O-N 3.12Å; A319-A323 VanDerWaalsContact O-N 3.17Å; V320-A323 PolarHBondContact O-N 3.11Å; V321-A323 VanDerWaalsContact C-N 3.25Å; V321-A323 PolarHBondContact O-N 3.47Å; A323-V325 VanDerWaalsContact C-N 3.31Å; A323-V325 PolarHBondContact O-N 2.93Å; A323-C326 PolarHBondContact O-N 3.31Å; A323-C326 VanDerWaalsContact O-N 3.16Å; A323-L327 PolarHBondContact O-N 3.36Å; A323-V352 HydrophobicContact CB-CG1 4.47Å; A323-V352 HydrophobicContact CB-CG2 3.71Å
324	A	98.4	Very high	97.5	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-37.8	177.2	0	0	0	0	0	112.7	V320 V321 T328 L355 L359	V320-A324 PolarHBondContact O-N 3.16Å; V320-A324 VanDerWaalsContact O-N 3.12Å; V321-A324 PolarHBondContact O-N 3.3Å; V321-A324 VanDerWaalsContact O-N 3.13Å; A324-T328 WeakPolarHBondContact O-CB 3.44Å; A324-T328 PolarHBondContact O-N 2.72Å; A324-T328 PolarHBondContact O-OG1 3.36Å; A324-L355 HydrophobicContact CB-CB 3.51Å; A324-L355 HydrophobicContact CB-CD1 4.46Å; A324-L359 HydrophobicContact CB-CD1 4.05Å
325	V	98	Very high	97.5	Very high	18 Å²	18	35.3 Å²	35.3	11%	0.109	18%	0.176	C	C	.	.	H	α-helix	trans	-65.3	-41.6	173.4	171.3	0	0	0	0	111.5	V321 D322 A323 T328 K329 L359 P492 T494	V321-V325 HydrophobicContact CG1-CG2 4.29Å; V321-V325 WeakPolarHBondContact O-CG2 3.43Å; V321-V325 PolarHBondContact O-N 2.92Å; D322-V325 PolarHBondContact O-N 3.39Å; A323-V325 VanDerWaalsContact C-N 3.31Å; A323-V325 PolarHBondContact O-N 2.93Å; V325-T328 PolarHBondContact O-N 2.75Å; V325-K329 HydrophobicContact CG1-CD 4.08Å; V325-K329 WeakPolarHBondContact O-CG 3.16Å; V325-K329 PolarHBondContact O-N 3.04Å; V325-L359 HydrophobicContact CG2-CD1 4.22Å; V325-P492 HydrophobicContact CG2-CG 3.52Å; V325-T494 HydrophobicContact CG2-CG2 4.08Å
326	C	97.6	Very high	97.5	Very high	37 Å²	37	25.8 Å²	25.8	25%	0.25	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-45	177.5	-160	0	0	0	0	111.9	M242 Q272 D322 A323 T328 K329 A330	M242-C326 HydrophobicContact CE-CB 4.46Å; Q272-C326 PolarHBondContact NE2-SG 3.22Å; Q272-C326 PolarHBondContact OE1-SG 3.04Å; D322-C326 WeakPolarHBondContact O-CB 3.36Å; D322-C326 PolarHBondContact O-N 2.96Å; A323-C326 PolarHBondContact O-N 3.31Å; A323-C326 VanDerWaalsContact O-N 3.16Å; C326-T328 VanDerWaalsContact C-N 3.34Å; C326-T328 PolarHBondContact O-N 2.87Å; C326-K329 PolarHBondContact O-N 2.99Å; C326-A330 PolarHBondContact O-N 3.47Å; C326-A330 VanDerWaalsContact O-N 3.09Å
327	L	98.3	Very high	97.5	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-56.2	-49.4	172.2	169.2	61.7	0	0	0	111	V205 M242 A323 K329 A330 V331 V338 V340 V352	V205-L327 HydrophobicContact CG1-CD1 3.99Å; V205-L327 HydrophobicContact CG1-CD2 4.17Å; V205-L327 HydrophobicContact CG2-CD1 4Å; M242-L327 HydrophobicContact CE-CB 4.38Å; M242-L327 HydrophobicContact SD-CB 4Å; A323-L327 PolarHBondContact O-N 3.36Å; L327-K329 PolarHBondContact O-N 2.72Å; L327-A330 PolarHBondContact O-N 3.41Å; L327-V331 HydrophobicContact CD1-CG2 4.21Å; L327-V331 WeakPolarHBondContact O-CG2 3.34Å; L327-V331 PolarHBondContact O-N 2.92Å; L327-V338 HydrophobicContact CD1-CB 3.59Å; L327-V338 HydrophobicContact CD1-CG1 3.63Å; L327-V338 HydrophobicContact CD1-CG2 3.84Å; L327-V340 HydrophobicContact CD1-CG2 3.99Å; L327-V340 HydrophobicContact CD2-CG2 4.19Å; L327-V352 HydrophobicContact CB-CG1 4.34Å; L327-V352 HydrophobicContact CD2-CG1 3.87Å; L327-V352 WeakPolarHBondContact CD2-O 3.38Å
328	T	98	Very high	97.5	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-57.9	-50.6	-179.2	-60.7	0	0	0	0	110.9	A324 V325 C326 A330 V331 T332 L359 M360 V489	A324-T328 WeakPolarHBondContact O-CB 3.44Å; A324-T328 PolarHBondContact O-N 2.72Å; A324-T328 PolarHBondContact O-OG1 3.36Å; V325-T328 PolarHBondContact O-N 2.75Å; C326-T328 VanDerWaalsContact C-N 3.34Å; C326-T328 PolarHBondContact O-N 2.87Å; T328-A330 PolarHBondContact O-N 2.91Å; T328-V331 PolarHBondContact O-N 2.86Å; T328-V331 VanDerWaalsContact O-N 3.14Å; T328-T332 HydrophobicContact CG2-CG2 4.22Å; T328-T332 WeakPolarHBondContact O-CG2 3.29Å; T328-T332 PolarHBondContact O-N 3.27Å; T328-T332 PolarHBondContact O-OG1 3.07Å; T328-L359 HydrophobicContact CG2-CB 4.23Å; T328-M360 HydrophobicContact CG2-CG 3.77Å; T328-V489 HydrophobicContact CG2-CG1 3.64Å
329	K	97.1	Very high	97.5	Very high	100 Å²	100	22.4 Å²	22.4	44%	0.435	13%	0.125	S	C	.	.	H	α-helix	trans	-62.4	-40	-179.3	-73	178.9	176.4	-176.3	0	113.1	V325 C326 L327 V331 V333 E334	V325-K329 HydrophobicContact CG1-CD 4.08Å; V325-K329 WeakPolarHBondContact O-CG 3.16Å; V325-K329 PolarHBondContact O-N 3.04Å; C326-K329 PolarHBondContact O-N 2.99Å; L327-K329 PolarHBondContact O-N 2.72Å; K329-V331 VanDerWaalsContact C-N 3.27Å; K329-V331 PolarHBondContact O-N 2.85Å; K329-V333 HydrophobicContact CB-CG2 4.44Å; K329-V333 HydrophobicContact CG-CG2 4.45Å; K329-V333 WeakPolarHBondContact O-CA 3.16Å; K329-V333 VanDerWaalsContact O-CB 3.29Å; K329-V333 WeakPolarHBondContact O-CB 3.37Å; K329-V333 PolarHBondContact O-N 2.78Å; K329-E334 PolarHBondContact O-N 3.02Å
330	A	97.1	Very high	97.6	Very high	9 Å²	9	21.4 Å²	21.4	7%	0.074	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-37.2	175.4	0	0	0	0	0	112.4	Y240 C326 L327 T328 E334 G335 A336 V338	Y240-A330 HydrophobicContact CD2-CB 3.67Å; Y240-A330 HydrophobicContact CE2-CB 3.93Å; Y240-A330 HydrophobicContact CG-CB 4.47Å; C326-A330 PolarHBondContact O-N 3.47Å; C326-A330 VanDerWaalsContact O-N 3.09Å; L327-A330 PolarHBondContact O-N 3.41Å; T328-A330 PolarHBondContact O-N 2.91Å; A330-E334 WeakPolarHBondContact O-CB 3.11Å; A330-G335 PolarHBondContact O-N 2.73Å; A330-A336 PolarHBondContact O-N 3.08Å; A330-V338 HydrophobicContact CB-CG2 3.74Å
331	V	97.7	Very high	97.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-80.4	-46.1	179.8	176.9	0	0	0	0	112.4	Y198 A203 V205 L327 T328 K329 G335 V338 M360	Y198-V331 HydrophobicContact CD1-CG1 4.16Å; Y198-V331 HydrophobicContact CG-CG1 3.91Å; A203-V331 HydrophobicContact CB-CG1 3.91Å; V205-V331 HydrophobicContact CG2-CG2 3.85Å; L327-V331 HydrophobicContact CD1-CG2 4.21Å; L327-V331 WeakPolarHBondContact O-CG2 3.34Å; L327-V331 PolarHBondContact O-N 2.92Å; T328-V331 PolarHBondContact O-N 2.86Å; T328-V331 VanDerWaalsContact O-N 3.14Å; K329-V331 VanDerWaalsContact C-N 3.27Å; K329-V331 PolarHBondContact O-N 2.85Å; V331-G335 VanDerWaalsContact O-CA 3.3Å; V331-G335 WeakPolarHBondContact O-CA 3.16Å; V331-G335 PolarHBondContact O-N 3.34Å; V331-V338 HydrophobicContact CG2-CG2 3.77Å; V331-M360 HydrophobicContact CB-SD 3.67Å; V331-M360 HydrophobicContact CG1-CE 4.41Å; V331-M360 HydrophobicContact CG1-SD 3.5Å; V331-M360 VanDerWaalsContact CG1-SD 3.5Å; V331-M360 HydrophobicContact CG2-CE 4.5Å; V331-M360 HydrophobicContact CG2-SD 4.27Å
332	T	96.6	Very high	97.3	Very high	16 Å²	16	21.3 Å²	21.3	10%	0.098	12%	0.117	C	C	.	.	H	α-helix	trans	-89.1	-39	-170	62.5	0	0	0	0	113.5	Y198 K201 T328 M360 V489	Y198-T332 HydrophobicContact CE1-CG2 4.21Å; Y198-T332 HydrophobicContact CE2-CG2 4.35Å; K201-T332 VanDerWaalsContact CE-O 3.3Å; K201-T332 WeakPolarHBondContact CE-O 3.11Å; T328-T332 HydrophobicContact CG2-CG2 4.22Å; T328-T332 WeakPolarHBondContact O-CG2 3.29Å; T328-T332 PolarHBondContact O-N 3.27Å; T328-T332 PolarHBondContact O-OG1 3.07Å; T332-M360 HydrophobicContact CG2-CG 3.77Å; T332-M360 HydrophobicContact CG2-SD 3.83Å; T332-V489 HydrophobicContact CG2-CG1 4.11Å; T332-V489 HydrophobicContact CG2-CG2 3.79Å
333	V	95.1	Very high	97.1	Very high	103 Å²	103	19.6 Å²	19.6	62%	0.624	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-51.2	-177.5	-174.6	0	0	0	0	110.9	K329	K329-V333 HydrophobicContact CB-CG2 4.44Å; K329-V333 HydrophobicContact CG-CG2 4.45Å; K329-V333 WeakPolarHBondContact O-CA 3.16Å; K329-V333 VanDerWaalsContact O-CB 3.29Å; K329-V333 WeakPolarHBondContact O-CB 3.37Å; K329-V333 PolarHBondContact O-N 2.78Å
334	E	94.8	Very high	96.9	Very high	94 Å²	94	21.2 Å²	21.2	44%	0.439	12%	0.118	S	C	.	.	S	Bend	trans	-83.4	-16.2	-179.7	-67.6	-175.7	-124.2	0	0	113.5	Y240 R270 K329 A330 A336	Y240-E334 WeakPolarHBondContact CE2-OE2 3.45Å; Y240-E334 VanDerWaalsContact OH-CD 3.27Å; Y240-E334 PolarHBondContact OH-OE1 3.35Å; Y240-E334 PolarHBondContact OH-OE2 3.38Å; R270-E334 IonicContact NH1-OE2 3.9Å; K329-E334 PolarHBondContact O-N 3.02Å; A330-E334 WeakPolarHBondContact O-CB 3.11Å; E334-A336 HydrophobicContact CB-CB 4.4Å; E334-A336 PolarHBondContact O-N 2.75Å
335	G	96.1	Very high	96.8	Very high	7 Å²	7	21.2 Å²	21.2	7%	0.072	12%	0.118	C	C	.	.			trans	67.1	17.1	-176.6	0	0	0	0	0	113.8	N233 A330 V331	N233-G335 PolarHBondContact ND2-O 2.94Å; A330-G335 PolarHBondContact O-N 2.73Å; V331-G335 VanDerWaalsContact O-CA 3.3Å; V331-G335 WeakPolarHBondContact O-CA 3.16Å; V331-G335 PolarHBondContact O-N 3.34Å
336	A	96.9	Very high	96.7	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.			trans	-89	143.3	-175.6	0	0	0	0	0	111.7	F238 Y240 A330 E334	F238-A336 HydrophobicContact CE2-CB 3.84Å; F238-A336 HydrophobicContact CZ-CB 4.38Å; Y240-A336 HydrophobicContact CD2-CB 3.82Å; Y240-A336 HydrophobicContact CE2-CB 3.99Å; A330-A336 PolarHBondContact O-N 3.08Å; E334-A336 HydrophobicContact CB-CB 4.4Å; E334-A336 PolarHBondContact O-N 2.75Å
337	S	98.1	Very high	96.8	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.007	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	146.8	168.7	-61.3	0	0	0	0	110.1	A204 N233 V239 Y240	A204-S337 PolarHBondContact N-OG 3.1Å; A204-S337 VanDerWaalsContact N-OG 3.13Å; A204-S337 CarbonylContact O-C 3.56Å; A204-S337 VanDerWaalsContact O-CA 3.25Å; A204-S337 WeakPolarHBondContact O-CA 3.29Å; A204-S337 WeakPolarHBondContact O-CB 3.47Å; N233-S337 VanDerWaalsContact CB-OG 3.32Å; N233-S337 WeakPolarHBondContact CB-OG 3.02Å; N233-S337 PolarHBondContact ND2-N 3.4Å; N233-S337 PolarHBondContact ND2-OG 3.35Å; N233-S337 VanDerWaalsContact ND2-OG 3.09Å; V239-S337 WeakPolarHBondContact CA-O 3.47Å; Y240-S337 PolarHBondContact N-O 3.15Å
338	V	98.5	Very high	96.8	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.012	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.5	-175.2	-169.9	0	0	0	0	110.4	A204 V205 C206 Y240 M242 L327 A330 V331 V340	A204-V338 PolarHBondContact O-N 2.77Å; V205-V338 WeakPolarHBondContact CA-O 3.46Å; C206-V338 PolarHBondContact N-O 3.1Å; Y240-V338 CarbonylContact O-C 3.54Å; Y240-V338 WeakPolarHBondContact O-CA 3.46Å; M242-V338 HydrophobicContact CB-CG1 4Å; M242-V338 HydrophobicContact SD-CG1 4.5Å; L327-V338 HydrophobicContact CD1-CB 3.59Å; L327-V338 HydrophobicContact CD1-CG1 3.63Å; L327-V338 HydrophobicContact CD1-CG2 3.84Å; A330-V338 HydrophobicContact CB-CG2 3.74Å; V331-V338 HydrophobicContact CG2-CG2 3.77Å; V338-V340 HydrophobicContact CG1-CG2 4.1Å
339	L	98.6	Very high	96.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	109.9	169.6	-178.5	63.7	0	0	0	109.2	P192 C206 C208 L226 V239 Y240 V241 M242	P192-L339 HydrophobicContact CB-CD1 3.85Å; P192-L339 HydrophobicContact CB-CD2 4.48Å; P192-L339 HydrophobicContact CG-CD1 4.28Å; P192-L339 HydrophobicContact CG-CD2 4.18Å; C206-L339 HydrophobicContact CB-CD1 3.6Å; C208-L339 HydrophobicContact CB-CD1 4.25Å; L226-L339 HydrophobicContact CD1-CD2 3.9Å; L226-L339 HydrophobicContact CD2-CD2 3.87Å; L226-L339 HydrophobicContact CG-CD2 3.91Å; V239-L339 HydrophobicContact CG1-CB 4.27Å; Y240-L339 PolarHBondContact O-N 3.26Å; V241-L339 HydrophobicContact CG2-CB 4.5Å; M242-L339 PolarHBondContact N-O 3.38Å
340	V	98.6	Very high	96.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	128.4	178.6	-171.1	0	0	0	0	109.8	V205 C206 R207 C208 M242 T244 L327 V338 T349 V352	V205-V340 HydrophobicContact CG1-CG2 4.19Å; C206-V340 PolarHBondContact O-N 3.34Å; R207-V340 VanDerWaalsContact CA-O 3.32Å; R207-V340 WeakPolarHBondContact CA-O 3.46Å; C208-V340 PolarHBondContact N-O 3.32Å; C208-V340 VanDerWaalsContact N-O 3.1Å; M242-V340 HydrophobicContact SD-CG1 4.44Å; M242-V340 HydrophobicContact SD-CG2 4.12Å; T244-V340 HydrophobicContact CG2-CG1 3.89Å; L327-V340 HydrophobicContact CD1-CG2 3.99Å; L327-V340 HydrophobicContact CD2-CG2 4.19Å; V338-V340 HydrophobicContact CG1-CG2 4.1Å; V340-T349 HydrophobicContact CB-CG2 4.36Å; V340-T349 HydrophobicContact CG1-CG2 4.13Å; V340-T349 WeakPolarHBondContact O-CG2 3.09Å; V340-V352 HydrophobicContact CG1-CB 4.16Å; V340-V352 HydrophobicContact CG1-CG1 3.89Å; V340-V352 HydrophobicContact CG2-CG1 4.45Å
341	H	98.1	Very high	96.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	170.8	171.2	71	92.5	0	0	0	111.9	C208 V241 M242 D243 T244 E261	C208-H341 WeakPolarHBondContact O-CA 3.45Å; C208-H341 WeakPolarHBondContact O-CB 3.37Å; C208-H341 VanDerWaalsContact SG-CB 3.59Å; V241-H341 WeakPolarHBondContact CG1-NE2 3.12Å; M242-H341 PolarHBondContact O-N 3.42Å; D243-H341 WeakPolarHBondContact CA-O 3.17Å; D243-H341 IonicContact OD2-CE1 3.82Å; T244-H341 WeakPolarHBondContact CG2-O 3.22Å; T244-H341 PolarHBondContact N-O 3.37Å; E261-H341 IonicContact OE1-NE2 3.63Å; E261-H341 IonicContact OE2-CE1 3.27Å; E261-H341 IonicContact OE2-NE2 2.77Å; E261-H341 PolarHBondContact OE2-NE2 2.87Å
342	C	93.8	Very high	97	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.014	9%	0.085	C	C	.	.			trans	-138.3	-138.9	171.3	65.7	0	0	0	0	107.6	Q210 T244 R245 G345 R348 T349	Q210-C342 WeakPolarHBondContact CB-O 3.47Å; Q210-C342 PolarHBondContact N-O 2.67Å; T244-C342 WeakPolarHBondContact OG1-CB 3.49Å; R245-C342 HydrophobicContact CG-CB 4.49Å; C342-G345 PolarHBondContact SG-N 3.09Å; C342-R348 HydrophobicContact CB-CB 4.36Å; C342-T349 PolarHBondContact N-OG1 3.47Å; C342-T349 PolarHBondContact SG-OG1 3.31Å
343	S	93.7	Very high	97.1	Very high	16 Å²	16	14.7 Å²	14.7	11%	0.112	8%	0.08	C	C	.	.	S	Bend	trans	-63.8	-65.7	167.4	-59.1	0	0	0	0	111.7	Q210	Q210-S343 WeakPolarHBondContact CG-O 3.43Å; Q210-S343 PolarHBondContact N-O 3.09Å; Q210-S343 VanDerWaalsContact N-O 3.11Å; Q210-S343 VanDerWaalsContact NE2-C 3.33Å; Q210-S343 PolarHBondContact NE2-O 3.38Å
344	D	94.7	Very high	97.2	Very high	34 Å²	34	9.8 Å²	9.8	18%	0.182	5%	0.05	C	C	.	.	S	Bend	trans	-118.6	-0.4	-169.9	-54.7	-68.7	0	0	0	113.4	S187 R190 K258 W346	S187-D344 PolarHBondContact OG-OD1 2.67Å; R190-D344 WeakPolarHBondContact CD-O 3.49Å; R190-D344 PolarHBondContact NE-O 3.27Å; K258-D344 IonicContact NZ-OD1 2.66Å; D344-W346 HydrophobicContact CB-CD2 4.06Å; D344-W346 HydrophobicContact CB-CE3 4.22Å; D344-W346 HydrophobicContact CB-CH2 3.78Å; D344-W346 HydrophobicContact CB-CZ2 3.58Å; D344-W346 HydrophobicContact CB-CZ3 4.1Å; D344-W346 PolarHBondContact O-N 3.49Å
345	G	95.4	Very high	97.4	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.01	3%	0.03	C	C	.	.	S	Bend	trans	78.7	13.9	166.3	0	0	0	0	0	116.7	R190 R207 C208 C342	R190-G345 PolarHBondContact NH2-O 3.17Å; R207-G345 PolarHBondContact NH2-O 3.38Å; C208-G345 VanDerWaalsContact O-CA 3.27Å; C208-G345 WeakPolarHBondContact O-CA 3.33Å; C342-G345 PolarHBondContact SG-N 3.09Å
346	W	96.8	Very high	97.5	Very high	22 Å²	22	5.1 Å²	5.1	8%	0.083	3%	0.026	C	C	.	.	S	Bend	trans	-121.5	-13.7	179.9	57.3	57.2	0	0	0	115.4	T163 K188 D344 G382 H383 K384	T163-W346 HydrophobicContact CG2-CZ3 4.44Å; K188-W346 HydrophobicContact CB-CZ3 4.47Å; K188-W346 HydrophobicContact CG-CH2 4.19Å; K188-W346 HydrophobicContact CG-CZ3 4.19Å; D344-W346 HydrophobicContact CB-CD2 4.06Å; D344-W346 HydrophobicContact CB-CE3 4.22Å; D344-W346 HydrophobicContact CB-CH2 3.78Å; D344-W346 HydrophobicContact CB-CZ2 3.58Å; D344-W346 HydrophobicContact CB-CZ3 4.1Å; D344-W346 PolarHBondContact O-N 3.49Å; W346-G382 WeakPolarHBondContact CB-O 3.44Å; W346-H383 PolarHBondContact O-ND1 3.46Å; W346-K384 HydrophobicContact CD2-CD 4.28Å; W346-K384 HydrophobicContact CD2-CG 4.31Å; W346-K384 HydrophobicContact CH2-CD 4.29Å; W346-K384 HydrophobicContact CZ2-CD 3.69Å
347	D	98.1	Very high	97.6	Very high	12 Å²	12	5.1 Å²	5.1	6%	0.064	3%	0.026	C	C	.	.	S	Bend	trans	-97.8	-97.1	178.5	-68.8	-50.9	0	0	0	110.4	I279 T349 A350 Q351 H383 R388 I402	I279-D347 HydrophobicContact CG2-CB 4.5Å; D347-T349 PolarHBondContact O-N 2.86Å; D347-T349 VanDerWaalsContact O-N 3.15Å; D347-A350 WeakPolarHBondContact O-CA 3.46Å; D347-A350 WeakPolarHBondContact O-CB 3.32Å; D347-A350 PolarHBondContact O-N 3.26Å; D347-Q351 PolarHBondContact O-N 2.73Å; D347-H383 IonicContact OD1-CE1 3.68Å; D347-H383 PolarHBondContact OD1-CE1 3.01Å; D347-H383 VanDerWaalsContact OD1-CE1 3.26Å; D347-H383 IonicContact OD1-ND1 3.36Å; D347-R388 IonicContact OD1-CZ 2.7Å; D347-R388 IonicContact OD1-NE 3.81Å; D347-R388 PolarHBondContact OD1-NE 2.88Å; D347-R388 IonicContact OD1-NH2 3.65Å; D347-R388 IonicContact OD2-CZ 3.17Å; D347-R388 IonicContact OD2-NE 2.71Å; D347-R388 IonicContact OD2-NH2 3Å; D347-R388 PolarHBondContact OD2-NH2 3.11Å; D347-I402 HydrophobicContact CB-CG1 4.49Å; D347-I402 HydrophobicContact CB-CG2 4.03Å
348	R	98.2	Very high	97.6	Very high	14 Å²	14	5 Å²	5	5%	0.053	3%	0.026	C	C	.	.	H	α-helix	trans	-55.7	-32.8	179.4	-64.9	164.8	-74.1	-160.5	-5.6	114.1	T244 I276 E277 C342 A350 Q351 V352	T244-R348 HydrophobicContact CG2-CB 4.25Å; T244-R348 WeakPolarHBondContact OG1-CB 3.26Å; T244-R348 WeakPolarHBondContact OG1-CD 3.44Å; I276-R348 HydrophobicContact CB-CG 4.17Å; I276-R348 HydrophobicContact CG2-CG 3.74Å; I276-R348 VanDerWaalsContact O-CD 3.22Å; I276-R348 WeakPolarHBondContact O-CD 3.45Å; I276-R348 PolarHBondContact O-NH1 2.91Å; E277-R348 WeakPolarHBondContact O-CD 3.17Å; E277-R348 PolarHBondContact O-NH1 2.97Å; C342-R348 HydrophobicContact CB-CB 4.36Å; R348-A350 VanDerWaalsContact C-N 3.34Å; R348-Q351 WeakPolarHBondContact O-CB 3.41Å; R348-Q351 PolarHBondContact O-N 3.01Å; R348-V352 WeakPolarHBondContact O-CG2 3.38Å; R348-V352 PolarHBondContact O-N 3.44Å
349	T	98.5	Very high	97.6	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-64	-38.8	173.9	-54.4	0	0	0	0	111.5	R207 V340 C342 D347 C353	R207-T349 HydrophobicContact CB-CG2 3.8Å; V340-T349 HydrophobicContact CB-CG2 4.36Å; V340-T349 HydrophobicContact CG1-CG2 4.13Å; V340-T349 WeakPolarHBondContact O-CG2 3.09Å; C342-T349 PolarHBondContact N-OG1 3.47Å; C342-T349 PolarHBondContact SG-OG1 3.31Å; D347-T349 PolarHBondContact O-N 2.86Å; D347-T349 VanDerWaalsContact O-N 3.15Å; T349-C353 WeakPolarHBondContact O-CB 3.33Å; T349-C353 PolarHBondContact O-N 3.19Å; T349-C353 PolarHBondContact O-SG 3.21Å
350	A	98.5	Very high	97.6	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-67.2	-43	174.1	0	0	0	0	0	111.2	D347 R348 V352 A354 W378	D347-A350 WeakPolarHBondContact O-CA 3.46Å; D347-A350 WeakPolarHBondContact O-CB 3.32Å; D347-A350 PolarHBondContact O-N 3.26Å; R348-A350 VanDerWaalsContact C-N 3.34Å; A350-V352 PolarHBondContact O-N 3.3Å; A350-A354 WeakPolarHBondContact O-CB 3.2Å; A350-A354 PolarHBondContact O-N 2.88Å; A350-W378 HydrophobicContact CB-CD2 3.91Å; A350-W378 HydrophobicContact CB-CE3 3.97Å; A350-W378 HydrophobicContact CB-CH2 4.22Å; A350-W378 HydrophobicContact CB-CZ2 4.11Å; A350-W378 HydrophobicContact CB-CZ3 4.14Å
351	Q	98.7	Very high	97.5	Very high	1 Å²	1	5.9 Å²	5.9	1%	0.005	3%	0.03	C	C	.	.	H	α-helix	trans	-54.7	-53.7	173.9	-65.5	175.4	-39.8	0	0	111.8	V320 D347 R348 L355 W378 I402 Q405 F406	V320-Q351 HydrophobicContact CG1-CB 3.92Å; D347-Q351 PolarHBondContact O-N 2.73Å; R348-Q351 WeakPolarHBondContact O-CB 3.41Å; R348-Q351 PolarHBondContact O-N 3.01Å; Q351-L355 VanDerWaalsContact O-CB 3.3Å; Q351-L355 WeakPolarHBondContact O-CB 3.47Å; Q351-L355 WeakPolarHBondContact O-CD1 3.11Å; Q351-L355 VanDerWaalsContact O-CG 3.26Å; Q351-L355 WeakPolarHBondContact O-CG 3.5Å; Q351-L355 PolarHBondContact O-N 3.39Å; Q351-W378 HydrophobicContact CB-CH2 4.49Å; Q351-W378 HydrophobicContact CB-CZ2 4.49Å; Q351-W378 HydrophobicContact CG-CH2 3.58Å; Q351-W378 HydrophobicContact CG-CZ2 4.01Å; Q351-I402 HydrophobicContact CG-CG2 4.04Å; Q351-I402 PolarHBondContact NE2-O 2.79Å; Q351-Q405 VanDerWaalsContact NE2-OE1 3.12Å; Q351-F406 HydrophobicContact CG-CB 4.46Å
352	V	98.7	Very high	97.5	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-70.4	-44	-175.1	173.3	0	0	0	0	112	M242 T244 I276 A323 L327 V340 R348 A350 G356	M242-V352 HydrophobicContact CE-CG1 3.81Å; M242-V352 HydrophobicContact SD-CG1 3.98Å; T244-V352 HydrophobicContact CG2-CB 4.44Å; T244-V352 HydrophobicContact CG2-CG2 3.98Å; I276-V352 HydrophobicContact CD1-CG2 3.75Å; A323-V352 HydrophobicContact CB-CG1 4.47Å; A323-V352 HydrophobicContact CB-CG2 3.71Å; L327-V352 HydrophobicContact CB-CG1 4.34Å; L327-V352 HydrophobicContact CD2-CG1 3.87Å; L327-V352 WeakPolarHBondContact CD2-O 3.38Å; V340-V352 HydrophobicContact CG1-CB 4.16Å; V340-V352 HydrophobicContact CG1-CG1 3.89Å; V340-V352 HydrophobicContact CG2-CG1 4.45Å; R348-V352 WeakPolarHBondContact O-CG2 3.38Å; R348-V352 PolarHBondContact O-N 3.44Å; A350-V352 PolarHBondContact O-N 3.3Å; V352-G356 PolarHBondContact O-N 3.24Å
353	C	98.7	Very high	97.7	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-64	-44.9	177.3	-68.8	0	0	0	0	112	T195 T349 S357 D377	T195-C353 HydrophobicContact CG2-CB 3.85Å; T349-C353 WeakPolarHBondContact O-CB 3.33Å; T349-C353 PolarHBondContact O-N 3.19Å; T349-C353 PolarHBondContact O-SG 3.21Å; C353-S357 VanDerWaalsContact O-CB 3.3Å; C353-S357 WeakPolarHBondContact O-CB 3.49Å; C353-S357 PolarHBondContact O-N 3.34Å; C353-S357 PolarHBondContact O-OG 3.41Å; C353-D377 WeakPolarHBondContact CB-OD2 3.5Å
354	A	98.8	Very high	97.9	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-67.1	-45.1	-179.6	0	0	0	0	0	111.8	A350 S357 L358 L373 D377 F406	A350-A354 WeakPolarHBondContact O-CB 3.2Å; A350-A354 PolarHBondContact O-N 2.88Å; A354-S357 PolarHBondContact O-N 2.82Å; A354-L358 WeakPolarHBondContact O-CB 3.26Å; A354-L358 PolarHBondContact O-N 2.98Å; A354-L373 HydrophobicContact CB-CD1 4.23Å; A354-L373 HydrophobicContact CB-CD2 4.26Å; A354-L373 HydrophobicContact CB-CG 4.19Å; A354-D377 HydrophobicContact CB-CB 3.96Å; A354-D377 PolarHBondContact N-OD2 3.41Å; A354-F406 HydrophobicContact CB-CD2 4.31Å; A354-F406 HydrophobicContact CB-CE2 3.59Å; A354-F406 HydrophobicContact CB-CZ 4.02Å
355	L	98.8	Very high	98.1	Very high	2 Å²	2	8.3 Å²	8.3	1%	0.01	4%	0.04	C	C	.	.	H	α-helix	trans	-68	-41.6	178.3	-70.8	168	0	0	0	112.5	V320 A324 Q351 S357 L358 L359 F406 C409 V410 L413	V320-L355 HydrophobicContact CG1-CD1 3.53Å; A324-L355 HydrophobicContact CB-CB 3.51Å; A324-L355 HydrophobicContact CB-CD1 4.46Å; Q351-L355 VanDerWaalsContact O-CB 3.3Å; Q351-L355 WeakPolarHBondContact O-CB 3.47Å; Q351-L355 WeakPolarHBondContact O-CD1 3.11Å; Q351-L355 VanDerWaalsContact O-CG 3.26Å; Q351-L355 WeakPolarHBondContact O-CG 3.5Å; Q351-L355 PolarHBondContact O-N 3.39Å; L355-S357 VanDerWaalsContact C-N 3.32Å; L355-S357 PolarHBondContact O-N 2.85Å; L355-L358 HydrophobicContact CD2-CD2 4.44Å; L355-L358 WeakPolarHBondContact O-CB 3.25Å; L355-L358 PolarHBondContact O-N 2.85Å; L355-L359 VanDerWaalsContact O-CG 3.31Å; L355-L359 WeakPolarHBondContact O-CG 3.24Å; L355-L359 PolarHBondContact O-N 3.04Å; L355-F406 HydrophobicContact CD1-CD2 4.36Å; L355-F406 HydrophobicContact CD2-CD2 3.93Å; L355-F406 HydrophobicContact CD2-CE2 3.85Å; L355-F406 HydrophobicContact CG-CD2 3.81Å; L355-F406 HydrophobicContact CG-CE2 3.91Å; L355-C409 HydrophobicContact CD1-CB 3.58Å; L355-C409 HydrophobicContact CD2-CB 3.82Å; L355-C409 HydrophobicContact CG-CB 4.36Å; L355-V410 HydrophobicContact CD2-CG2 3.84Å; L355-L413 HydrophobicContact CD2-CD1 4.3Å
356	G	98.4	Very high	98.2	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-60.4	-43.4	174.6	0	0	0	0	0	111.7	V352 L358 L359 M360	V352-G356 PolarHBondContact O-N 3.24Å; G356-L358 VanDerWaalsContact C-N 3.35Å; G356-L358 PolarHBondContact O-N 3.26Å; G356-L359 PolarHBondContact O-N 2.78Å; G356-M360 VanDerWaalsContact O-CE 3.24Å; G356-M360 WeakPolarHBondContact O-CE 3.47Å; G356-M360 WeakPolarHBondContact O-CG 3.12Å; G356-M360 PolarHBondContact O-N 2.95Å; G356-M360 VanDerWaalsContact O-N 3.08Å
357	S	98.1	Very high	98.3	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-60.3	-43.4	174.2	-56.3	0	0	0	0	111.8	C353 A354 L355 L359 M360 D361	C353-S357 VanDerWaalsContact O-CB 3.3Å; C353-S357 WeakPolarHBondContact O-CB 3.49Å; C353-S357 PolarHBondContact O-N 3.34Å; C353-S357 PolarHBondContact O-OG 3.41Å; A354-S357 PolarHBondContact O-N 2.82Å; L355-S357 VanDerWaalsContact C-N 3.32Å; L355-S357 PolarHBondContact O-N 2.85Å; S357-L359 VanDerWaalsContact C-N 3.34Å; S357-L359 PolarHBondContact O-N 2.88Å; S357-M360 PolarHBondContact O-N 2.89Å; S357-D361 WeakPolarHBondContact O-CB 3.4Å; S357-D361 PolarHBondContact O-N 3.26Å
358	L	98.5	Very high	98.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-65.4	-33	177.9	-172	67.4	0	0	0	113.6	A354 L355 G356 Y364 R365 F370 L373 V410 L413 F421	A354-L358 WeakPolarHBondContact O-CB 3.26Å; A354-L358 PolarHBondContact O-N 2.98Å; L355-L358 HydrophobicContact CD2-CD2 4.44Å; L355-L358 WeakPolarHBondContact O-CB 3.25Å; L355-L358 PolarHBondContact O-N 2.85Å; G356-L358 VanDerWaalsContact C-N 3.35Å; G356-L358 PolarHBondContact O-N 3.26Å; L358-Y364 VanDerWaalsContact CD1-C 3.47Å; L358-Y364 WeakPolarHBondContact CD1-O 3.21Å; L358-R365 HydrophobicContact CD1-CG 3.79Å; L358-R365 HydrophobicContact CG-CG 4.4Å; L358-F370 HydrophobicContact CD1-CD2 4.22Å; L358-F370 HydrophobicContact CD2-CE2 4.24Å; L358-L373 HydrophobicContact CB-CD2 4.11Å; L358-L373 HydrophobicContact CD1-CD2 4.22Å; L358-V410 HydrophobicContact CD2-CB 4.46Å; L358-V410 HydrophobicContact CD2-CG1 4.12Å; L358-V410 HydrophobicContact CD2-CG2 3.68Å; L358-L413 HydrophobicContact CD2-CD1 4.2Å; L358-F421 HydrophobicContact CD1-CE1 4.08Å; L358-F421 HydrophobicContact CD2-CE1 4.07Å; L358-F421 HydrophobicContact CG-CE1 4.06Å
359	L	98.6	Very high	98.3	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-72.7	-30.5	173.8	-69.2	176.3	0	0	0	112.2	A324 V325 T328 L355 G356 S357 L413 V489 L490 P492	A324-L359 HydrophobicContact CB-CD1 4.05Å; V325-L359 HydrophobicContact CG2-CD1 4.22Å; T328-L359 HydrophobicContact CG2-CB 4.23Å; L355-L359 VanDerWaalsContact O-CG 3.31Å; L355-L359 WeakPolarHBondContact O-CG 3.24Å; L355-L359 PolarHBondContact O-N 3.04Å; G356-L359 PolarHBondContact O-N 2.78Å; S357-L359 VanDerWaalsContact C-N 3.34Å; S357-L359 PolarHBondContact O-N 2.88Å; L359-L413 HydrophobicContact CD2-CD1 3.78Å; L359-L413 HydrophobicContact CD2-CD2 3.87Å; L359-L413 HydrophobicContact CD2-CG 4.49Å; L359-L413 HydrophobicContact CG-CD1 4.45Å; L359-V489 CarbonylContact O-C 3.51Å; L359-V489 VanDerWaalsContact O-CA 3.29Å; L359-V489 WeakPolarHBondContact O-CA 3.42Å; L359-L490 HydrophobicContact CD2-CB 3.83Å; L359-L490 PolarHBondContact O-N 3.38Å; L359-P492 HydrophobicContact CD1-CG 4.32Å; L359-P492 HydrophobicContact CD2-CG 3.94Å
360	M	97.8	Very high	98.3	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.01	6%	0.056	C	C	.	.	H	α-helix	trans	-93.4	-25.3	-176.2	-69.9	-175.1	-73.2	0	0	115.3	Y196 Y198 V205 T328 V331 T332 G356 S357 P488	Y196-M360 HydrophobicContact CD1-CE 3.75Å; Y196-M360 HydrophobicContact CE1-CB 4.03Å; Y196-M360 HydrophobicContact CE1-CE 3.82Å; Y196-M360 HydrophobicContact CE1-SD 4.21Å; Y198-M360 HydrophobicContact CD2-CB 4.3Å; Y198-M360 HydrophobicContact CD2-SD 4.44Å; Y198-M360 HydrophobicContact CE2-CB 4.35Å; V205-M360 HydrophobicContact CG2-CE 3.95Å; T328-M360 HydrophobicContact CG2-CG 3.77Å; V331-M360 HydrophobicContact CB-SD 3.67Å; V331-M360 HydrophobicContact CG1-CE 4.41Å; V331-M360 HydrophobicContact CG1-SD 3.5Å; V331-M360 VanDerWaalsContact CG1-SD 3.5Å; V331-M360 HydrophobicContact CG2-CE 4.5Å; V331-M360 HydrophobicContact CG2-SD 4.27Å; T332-M360 HydrophobicContact CG2-CG 3.77Å; T332-M360 HydrophobicContact CG2-SD 3.83Å; G356-M360 VanDerWaalsContact O-CE 3.24Å; G356-M360 WeakPolarHBondContact O-CE 3.47Å; G356-M360 WeakPolarHBondContact O-CG 3.12Å; G356-M360 PolarHBondContact O-N 2.95Å; G356-M360 VanDerWaalsContact O-N 3.08Å; S357-M360 PolarHBondContact O-N 2.89Å; M360-P488 CarbonylContact C-O 3.46Å
361	D	97.6	Very high	98.3	Very high	16 Å²	16	11.4 Å²	11.4	9%	0.086	6%	0.056	C	C	.	.			trans	-119.5	116.7	-172.8	-159.1	-32.5	0	0	0	112.3	R141 Y196 S357 Y363 Y364	R141-D361 IonicContact CZ-OD2 3.63Å; R141-D361 VanDerWaalsContact CZ-OD2 3.28Å; R141-D361 IonicContact NH1-OD1 3.54Å; R141-D361 PolarHBondContact NH1-OD1 2.8Å; R141-D361 IonicContact NH1-OD2 2.73Å; R141-D361 PolarHBondContact NH1-OD2 3.32Å; R141-D361 IonicContact NH2-OD2 2.72Å; R141-D361 PolarHBondContact NH2-OD2 3.28Å; Y196-D361 HydrophobicContact CE2-CB 4.02Å; Y196-D361 WeakPolarHBondContact CE2-OD2 3.34Å; S357-D361 WeakPolarHBondContact O-CB 3.4Å; S357-D361 PolarHBondContact O-N 3.26Å; D361-Y363 PolarHBondContact O-N 3.41Å; D361-Y363 WeakPolarHBondContact OD1-CB 3.22Å; D361-Y363 PolarHBondContact OD1-N 3.36Å; D361-Y364 HydrophobicContact CB-CD2 3.61Å; D361-Y364 HydrophobicContact CB-CE2 3.9Å; D361-Y364 HydrophobicContact CB-CG 4.44Å; D361-Y364 PolarHBondContact O-N 3.23Å
362	P	97.3	Very high	98.3	Very high	39 Å²	39	11.5 Å²	11.5	25%	0.253	6%	0.056	S	C	.	.	S	Bend	trans	-52	-31.9	168.4	-29.3	37.2	0	0	0	114.8	Y364 R365 P488	P362-Y364 PolarHBondContact O-N 3.36Å; P362-R365 WeakPolarHBondContact O-CB 3.45Å; P362-R365 PolarHBondContact O-N 2.82Å; P362-R365 VanDerWaalsContact O-N 3.16Å; P362-P488 HydrophobicContact CG-CB 4.24Å
363	Y	97.9	Very high	98.3	Very high	64 Å²	64	11.5 Å²	11.5	25%	0.251	6%	0.056	S	C	.	.	G	3₁₀ helix	trans	-60.8	-47	-177	174.7	-109.4	0	0	0	111.9	E138 R141 D361 R365 T366 G369 V372	E138-Y363 WeakPolarHBondContact OE2-CE1 3.35Å; R141-Y363 VanDerWaalsContact CZ-CD1 3.4Å; R141-Y363 VanDerWaalsContact NE-CD1 3.33Å; D361-Y363 PolarHBondContact O-N 3.41Å; D361-Y363 WeakPolarHBondContact OD1-CB 3.22Å; D361-Y363 PolarHBondContact OD1-N 3.36Å; Y363-R365 PolarHBondContact O-N 2.87Å; Y363-R365 VanDerWaalsContact O-N 3.1Å; Y363-T366 WeakPolarHBondContact O-CB 3.13Å; Y363-T366 WeakPolarHBondContact O-CG2 3.3Å; Y363-T366 PolarHBondContact O-N 2.82Å; Y363-T366 PolarHBondContact O-OG1 2.84Å; Y363-G369 WeakPolarHBondContact O-CA 3.42Å; Y363-V372 HydrophobicContact CE1-CB 4.34Å; Y363-V372 HydrophobicContact CE1-CG1 4.31Å
364	Y	98.4	Very high	98.3	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-67.6	-12.1	-179.4	-58.2	-46.6	0	0	0	113.7	E138 R141 Y196 L358 D361 P362 T366 G369 F370 L373 K376	E138-Y364 WeakPolarHBondContact OE1-CE1 3.31Å; E138-Y364 PolarHBondContact OE1-OH 2.95Å; R141-Y364 PolarHBondContact NH2-OH 3.38Å; Y196-Y364 AromaticContact CD2-CE2 3.8Å; Y196-Y364 HydrophobicContact CD2-CE2 3.8Å; Y196-Y364 AromaticContact CE2-CE2 3.78Å; Y196-Y364 HydrophobicContact CE2-CE2 3.78Å; L358-Y364 VanDerWaalsContact CD1-C 3.47Å; L358-Y364 WeakPolarHBondContact CD1-O 3.21Å; D361-Y364 HydrophobicContact CB-CD2 3.61Å; D361-Y364 HydrophobicContact CB-CE2 3.9Å; D361-Y364 HydrophobicContact CB-CG 4.44Å; D361-Y364 PolarHBondContact O-N 3.23Å; P362-Y364 PolarHBondContact O-N 3.36Å; Y364-T366 VanDerWaalsContact C-N 3.32Å; Y364-G369 WeakPolarHBondContact CD1-O 3.32Å; Y364-F370 WeakPolarHBondContact O-CA 3.29Å; Y364-F370 PolarHBondContact O-N 3.3Å; Y364-L373 HydrophobicContact CD1-CB 3.88Å; Y364-L373 HydrophobicContact CD1-CD1 4.2Å; Y364-L373 HydrophobicContact CD2-CD1 4.11Å; Y364-L373 HydrophobicContact CE1-CB 4.42Å; Y364-L373 HydrophobicContact CE1-CD1 4.31Å; Y364-L373 HydrophobicContact CE2-CD1 4.22Å; Y364-L373 HydrophobicContact CG-CB 4.2Å; Y364-L373 HydrophobicContact CG-CD1 4.1Å; Y364-L373 HydrophobicContact CG-CD2 4.36Å; Y364-L373 HydrophobicContact CG-CG 4.45Å; Y364-K376 VanDerWaalsContact OH-CE 3.23Å; Y364-K376 WeakPolarHBondContact OH-CE 3.43Å; Y364-K376 PolarHBondContact OH-NZ 3.17Å
365	R	98.4	Very high	98.3	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-85.1	-4.4	173.8	-54	-172.5	-104.7	143	-15.9	113	L358 P362 Y363 A420 F421 E422 Y423 S484 H487 P488	L358-R365 HydrophobicContact CD1-CG 3.79Å; L358-R365 HydrophobicContact CG-CG 4.4Å; P362-R365 WeakPolarHBondContact O-CB 3.45Å; P362-R365 PolarHBondContact O-N 2.82Å; P362-R365 VanDerWaalsContact O-N 3.16Å; Y363-R365 PolarHBondContact O-N 2.87Å; Y363-R365 VanDerWaalsContact O-N 3.1Å; R365-A420 WeakPolarHBondContact CB-O 3.3Å; R365-F421 HydrophobicContact CB-CD1 3.74Å; R365-F421 HydrophobicContact CB-CE1 4.07Å; R365-F421 HydrophobicContact CB-CG 4.47Å; R365-F421 HydrophobicContact CG-CD1 3.89Å; R365-F421 HydrophobicContact CG-CE1 3.67Å; R365-F421 HydrophobicContact CG-CZ 4.41Å; R365-F421 WeakPolarHBondContact O-CA 3.42Å; R365-E422 PolarHBondContact O-N 3.44Å; R365-Y423 WeakPolarHBondContact O-CE1 3.35Å; R365-S484 PolarHBondContact NH1-OG 3.17Å; R365-H487 PolarHBondContact NH2-O 3.13Å; R365-P488 VanDerWaalsContact NH2-C 3.29Å; R365-P488 PolarHBondContact NH2-O 3.47Å
366	T	97.9	Very high	98.2	Very high	28 Å²	28	12.8 Å²	12.8	17%	0.172	6%	0.062	C	C	.	.	S	Bend	trans	-82.2	158.9	167.2	70.3	0	0	0	0	111.1	Y363 Y364 K368 G369 F370 E422	Y363-T366 WeakPolarHBondContact O-CB 3.13Å; Y363-T366 WeakPolarHBondContact O-CG2 3.3Å; Y363-T366 PolarHBondContact O-N 2.82Å; Y363-T366 PolarHBondContact O-OG1 2.84Å; Y364-T366 VanDerWaalsContact C-N 3.32Å; T366-K368 PolarHBondContact O-N 3.45Å; T366-G369 PolarHBondContact O-N 2.95Å; T366-G369 PolarHBondContact OG1-N 2.69Å; T366-F370 WeakPolarHBondContact O-CB 3.26Å; T366-F370 PolarHBondContact O-N 2.92Å; T366-E422 WeakPolarHBondContact CA-OE2 3.4Å; T366-E422 WeakPolarHBondContact CB-OE2 3.37Å
367	I	97.8	Very high	98.2	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-56.8	-51.7	176	-76.3	169.3	0	0	0	110.3	F370 M371 E422 Y423 F427 M468 K471 L475	I367-F370 PolarHBondContact O-N 2.99Å; I367-M371 HydrophobicContact CG2-CE 3.73Å; I367-M371 WeakPolarHBondContact O-CG 3.24Å; I367-M371 PolarHBondContact O-N 3.07Å; I367-E422 HydrophobicContact CD1-CG 4.29Å; I367-E422 HydrophobicContact CG1-CB 4.46Å; I367-E422 HydrophobicContact CG1-CG 4.31Å; I367-E422 PolarHBondContact N-OE2 3.47Å; I367-Y423 HydrophobicContact CG1-CD1 4.35Å; I367-F427 HydrophobicContact CG2-CE2 4.1Å; I367-F427 HydrophobicContact CG2-CZ 3.93Å; I367-M468 HydrophobicContact CG2-SD 3.87Å; I367-K471 HydrophobicContact CD1-CD 4.46Å; I367-K471 HydrophobicContact CD1-CG 3.87Å; I367-L475 HydrophobicContact CD1-CD2 3.79Å; I367-L475 HydrophobicContact CD1-CG 4.45Å
368	K	97.8	Very high	98.3	Very high	87 Å²	87	12.8 Å²	12.8	38%	0.378	6%	0.062	S	C	.	.	H	α-helix	trans	-65.1	-44.6	179.6	-176.5	170.2	-176.6	171	0	111.4	L132 T366 F370 M371 V372	L132-K368 WeakPolarHBondContact O-CE 3.41Å; L132-K368 PolarHBondContact O-NZ 2.92Å; T366-K368 PolarHBondContact O-N 3.45Å; K368-F370 VanDerWaalsContact C-N 3.31Å; K368-F370 PolarHBondContact O-N 3.42Å; K368-M371 WeakPolarHBondContact O-CB 3.46Å; K368-M371 PolarHBondContact O-N 3.01Å; K368-V372 HydrophobicContact CG-CG2 4.47Å; K368-V372 WeakPolarHBondContact O-CG2 3.35Å; K368-V372 PolarHBondContact O-N 2.83Å
369	G	98.3	Very high	98.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.3	-34.8	179.7	0	0	0	0	0	113.2	Y363 Y364 T366 V372 L373	Y363-G369 WeakPolarHBondContact O-CA 3.42Å; Y364-G369 WeakPolarHBondContact CD1-O 3.32Å; T366-G369 PolarHBondContact O-N 2.95Å; T366-G369 PolarHBondContact OG1-N 2.69Å; G369-V372 PolarHBondContact O-N 3.2Å; G369-L373 WeakPolarHBondContact O-CB 3.34Å; G369-L373 PolarHBondContact O-N 3.49Å
370	F	98.8	Very high	98.2	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67.5	-37.3	175.1	-165.6	-108.7	0	0	0	112.5	L358 Y364 T366 I367 K368 L373 I374 F406 L407 V410 Y423 F427 L428 I431	L358-F370 HydrophobicContact CD1-CD2 4.22Å; L358-F370 HydrophobicContact CD2-CE2 4.24Å; Y364-F370 WeakPolarHBondContact O-CA 3.29Å; Y364-F370 PolarHBondContact O-N 3.3Å; T366-F370 WeakPolarHBondContact O-CB 3.26Å; T366-F370 PolarHBondContact O-N 2.92Å; I367-F370 PolarHBondContact O-N 2.99Å; K368-F370 VanDerWaalsContact C-N 3.31Å; K368-F370 PolarHBondContact O-N 3.42Å; F370-L373 HydrophobicContact CD2-CD2 4.29Å; F370-L373 HydrophobicContact CE2-CD2 4.42Å; F370-L373 WeakPolarHBondContact O-CB 3.49Å; F370-L373 PolarHBondContact O-N 3.28Å; F370-I374 HydrophobicContact CD1-CD1 3.74Å; F370-I374 HydrophobicContact CE1-CD1 3.55Å; F370-I374 HydrophobicContact CE1-CG1 4.39Å; F370-I374 HydrophobicContact CZ-CD1 4.24Å; F370-I374 WeakPolarHBondContact O-CG1 3.37Å; F370-I374 PolarHBondContact O-N 2.93Å; F370-F406 HydrophobicContact CE2-CE1 4.16Å; F370-F406 AromaticContact CE2-CZ 3.83Å; F370-F406 HydrophobicContact CE2-CZ 3.83Å; F370-F406 AromaticContact CZ-CE1 3.75Å; F370-F406 HydrophobicContact CZ-CE1 3.75Å; F370-F406 AromaticContact CZ-CZ 3.92Å; F370-F406 HydrophobicContact CZ-CZ 3.92Å; F370-L407 HydrophobicContact CE1-CD2 4.18Å; F370-L407 HydrophobicContact CZ-CD2 4.16Å; F370-V410 HydrophobicContact CE2-CG1 3.99Å; F370-V410 HydrophobicContact CE2-CG2 3.84Å; F370-V410 HydrophobicContact CZ-CB 4.42Å; F370-V410 HydrophobicContact CZ-CG1 4.09Å; F370-V410 HydrophobicContact CZ-CG2 3.95Å; F370-Y423 HydrophobicContact CB-CD1 4.28Å; F370-Y423 HydrophobicContact CB-CE1 3.66Å; F370-Y423 HydrophobicContact CD2-CE1 4.09Å; F370-Y423 AromaticContact CD2-CZ 3.79Å; F370-Y423 WeakPolarHBondContact CD2-OH 3.46Å; F370-Y423 AromaticContact CG-CE1 3.86Å; F370-Y423 HydrophobicContact CG-CE1 3.86Å; F370-Y423 AromaticContact CG-CZ 3.9Å; F370-F427 HydrophobicContact CB-CE1 4.27Å; F370-F427 HydrophobicContact CD1-CD1 4.37Å; F370-F427 AromaticContact CD1-CE1 3.72Å; F370-F427 HydrophobicContact CD1-CE1 3.72Å; F370-F427 HydrophobicContact CG-CE1 4.39Å; F370-L428 HydrophobicContact CE1-CD2 3.77Å; F370-L428 HydrophobicContact CZ-CD2 3.98Å; F370-I431 HydrophobicContact CD1-CD1 3.98Å; F370-I431 HydrophobicContact CE1-CD1 3.89Å
371	M	98.6	Very high	98.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-62.7	-44.2	171.7	-57.4	173.2	177	0	0	111.1	I133 I367 K368 L373 I374 E375 F427 W464 L467 M468	I133-M371 HydrophobicContact CD1-CB 3.6Å; I367-M371 HydrophobicContact CG2-CE 3.73Å; I367-M371 WeakPolarHBondContact O-CG 3.24Å; I367-M371 PolarHBondContact O-N 3.07Å; K368-M371 WeakPolarHBondContact O-CB 3.46Å; K368-M371 PolarHBondContact O-N 3.01Å; M371-L373 VanDerWaalsContact C-N 3.33Å; M371-L373 PolarHBondContact O-N 3.36Å; M371-I374 PolarHBondContact O-N 2.87Å; M371-E375 PolarHBondContact O-N 2.91Å; M371-F427 HydrophobicContact CE-CE2 3.69Å; M371-F427 HydrophobicContact CE-CZ 3.68Å; M371-F427 HydrophobicContact CG-CZ 4.13Å; M371-W464 HydrophobicContact CB-CD2 3.86Å; M371-W464 HydrophobicContact CB-CE3 3.91Å; M371-W464 HydrophobicContact CB-CG 4.29Å; M371-W464 HydrophobicContact CB-CZ3 4.27Å; M371-W464 HydrophobicContact CE-CE3 4.1Å; M371-W464 HydrophobicContact CG-CD2 3.86Å; M371-W464 HydrophobicContact CG-CE3 3.43Å; M371-W464 VanDerWaalsContact CG-CE3 3.43Å; M371-W464 HydrophobicContact CG-CG 4.42Å; M371-W464 HydrophobicContact CG-CZ3 3.82Å; M371-W464 HydrophobicContact SD-CB 3.82Å; M371-W464 HydrophobicContact SD-CD2 4.08Å; M371-W464 HydrophobicContact SD-CE3 3.79Å; M371-W464 HydrophobicContact SD-CG 4.13Å; M371-L467 HydrophobicContact CE-CB 3.61Å; M371-L467 HydrophobicContact CE-CD1 4.44Å; M371-M468 HydrophobicContact CE-CG 4Å; M371-M468 HydrophobicContact CE-SD 4.02Å; M371-M468 HydrophobicContact SD-CG 4.1Å; M371-M468 HydrophobicContact SD-SD 4.27Å
372	V	98.6	Very high	98.2	Very high	3 Å²	3	12.7 Å²	12.7	2%	0.018	6%	0.062	C	C	.	.	H	α-helix	trans	-61.4	-39.8	175.1	174	0	0	0	0	111.6	I133 E138 Y363 K368 G369 I374 E375 K376	I133-V372 HydrophobicContact CB-CG2 4.49Å; I133-V372 HydrophobicContact CD1-CG2 4.28Å; I133-V372 HydrophobicContact CG1-CG2 3.95Å; I133-V372 HydrophobicContact CG2-CG2 3.95Å; E138-V372 HydrophobicContact CB-CG1 3.89Å; E138-V372 HydrophobicContact CG-CG1 3.6Å; Y363-V372 HydrophobicContact CE1-CB 4.34Å; Y363-V372 HydrophobicContact CE1-CG1 4.31Å; K368-V372 HydrophobicContact CG-CG2 4.47Å; K368-V372 WeakPolarHBondContact O-CG2 3.35Å; K368-V372 PolarHBondContact O-N 2.83Å; G369-V372 PolarHBondContact O-N 3.2Å; V372-I374 VanDerWaalsContact C-N 3.34Å; V372-I374 PolarHBondContact O-N 3.4Å; V372-E375 PolarHBondContact O-N 3.19Å; V372-K376 VanDerWaalsContact O-CB 3.24Å; V372-K376 WeakPolarHBondContact O-CB 3.4Å; V372-K376 PolarHBondContact O-N 3.4Å
373	L	98.8	Very high	98.3	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.9	-40.6	175.6	-176.2	65.5	0	0	0	111.8	A354 L358 Y364 G369 F370 M371 D377 F406	A354-L373 HydrophobicContact CB-CD1 4.23Å; A354-L373 HydrophobicContact CB-CD2 4.26Å; A354-L373 HydrophobicContact CB-CG 4.19Å; L358-L373 HydrophobicContact CB-CD2 4.11Å; L358-L373 HydrophobicContact CD1-CD2 4.22Å; Y364-L373 HydrophobicContact CD1-CB 3.88Å; Y364-L373 HydrophobicContact CD1-CD1 4.2Å; Y364-L373 HydrophobicContact CD2-CD1 4.11Å; Y364-L373 HydrophobicContact CE1-CB 4.42Å; Y364-L373 HydrophobicContact CE1-CD1 4.31Å; Y364-L373 HydrophobicContact CE2-CD1 4.22Å; Y364-L373 HydrophobicContact CG-CB 4.2Å; Y364-L373 HydrophobicContact CG-CD1 4.1Å; Y364-L373 HydrophobicContact CG-CD2 4.36Å; Y364-L373 HydrophobicContact CG-CG 4.45Å; G369-L373 WeakPolarHBondContact O-CB 3.34Å; G369-L373 PolarHBondContact O-N 3.49Å; F370-L373 HydrophobicContact CD2-CD2 4.29Å; F370-L373 HydrophobicContact CE2-CD2 4.42Å; F370-L373 WeakPolarHBondContact O-CB 3.49Å; F370-L373 PolarHBondContact O-N 3.28Å; M371-L373 VanDerWaalsContact C-N 3.33Å; M371-L373 PolarHBondContact O-N 3.36Å; L373-D377 WeakPolarHBondContact O-CB 3.31Å; L373-D377 PolarHBondContact O-N 3.08Å; L373-F406 HydrophobicContact CD2-CZ 4.34Å
374	I	98.8	Very high	98.3	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-68.6	-48.3	176.1	-67.5	165.3	0	0	0	110.8	F370 M371 V372 K376 W378 I379 F403 F406 I431 F443 W464	F370-I374 HydrophobicContact CD1-CD1 3.74Å; F370-I374 HydrophobicContact CE1-CD1 3.55Å; F370-I374 HydrophobicContact CE1-CG1 4.39Å; F370-I374 HydrophobicContact CZ-CD1 4.24Å; F370-I374 WeakPolarHBondContact O-CG1 3.37Å; F370-I374 PolarHBondContact O-N 2.93Å; M371-I374 PolarHBondContact O-N 2.87Å; V372-I374 VanDerWaalsContact C-N 3.34Å; V372-I374 PolarHBondContact O-N 3.4Å; I374-K376 VanDerWaalsContact C-N 3.29Å; I374-K376 PolarHBondContact O-N 3.34Å; I374-W378 WeakPolarHBondContact O-CB 3.4Å; I374-W378 PolarHBondContact O-N 3.29Å; I374-W378 VanDerWaalsContact O-N 3.14Å; I374-I379 HydrophobicContact CG2-CD1 3.96Å; I374-I379 HydrophobicContact CG2-CG1 4.27Å; I374-I379 PolarHBondContact O-N 3.16Å; I374-F403 HydrophobicContact CD1-CZ 3.95Å; I374-F403 HydrophobicContact CG1-CE2 4.27Å; I374-F403 HydrophobicContact CG1-CZ 4.07Å; I374-F403 HydrophobicContact CG2-CE2 4.31Å; I374-F403 HydrophobicContact CG2-CZ 4.05Å; I374-F406 HydrophobicContact CG1-CE1 4.33Å; I374-I431 HydrophobicContact CD1-CD1 4.11Å; I374-I431 HydrophobicContact CD1-CG2 4.37Å; I374-F443 HydrophobicContact CG2-CE1 3.73Å; I374-F443 HydrophobicContact CG2-CZ 4.08Å; I374-W464 HydrophobicContact CB-CH2 4.31Å; I374-W464 HydrophobicContact CB-CZ2 4.25Å; I374-W464 HydrophobicContact CD1-CH2 3.97Å; I374-W464 HydrophobicContact CG2-CH2 4.09Å; I374-W464 HydrophobicContact CG2-CZ2 3.93Å
375	E	98.4	Very high	98.3	Very high	28 Å²	28	9.4 Å²	9.4	13%	0.131	5%	0.045	C	C	.	.	I	π-helix	trans	-58.7	-40	177	-78.5	-66.6	167.5	0	0	112.2	I133 L135 M371 V372 I379 S380 N442 W464	I133-E375 HydrophobicContact CD1-CG 3.8Å; I133-E375 HydrophobicContact CG2-CB 4.03Å; I133-E375 HydrophobicContact CG2-CG 4.14Å; L135-E375 HydrophobicContact CD2-CB 4.27Å; M371-E375 PolarHBondContact O-N 2.91Å; V372-E375 PolarHBondContact O-N 3.19Å; E375-I379 VanDerWaalsContact CD-CD1 3.46Å; E375-I379 HydrophobicContact CG-CD1 4.24Å; E375-I379 WeakPolarHBondContact OE1-CD1 3.3Å; E375-I379 WeakPolarHBondContact OE2-CG2 3.49Å; E375-S380 VanDerWaalsContact O-CB 3.32Å; E375-S380 WeakPolarHBondContact O-CB 3.28Å; E375-S380 PolarHBondContact O-N 2.88Å; E375-S380 PolarHBondContact O-OG 3.03Å; E375-N442 PolarHBondContact OE1-ND2 3.25Å; E375-W464 HydrophobicContact CG-CZ2 4.49Å; E375-W464 PolarHBondContact OE1-NE1 3.19Å
376	K	98.2	Very high	98.1	Very high	1 Å²	1	9.7 Å²	9.7	0%	0.004	5%	0.047	C	C	.	.	I	π-helix	trans	-71.4	-70.6	176.1	-171.3	167.9	56.7	71.7	0	111.9	L135 E138 F139 M142 T195 Y364 V372 I374 W378 S380 F381	L135-K376 HydrophobicContact CD2-CB 4Å; E138-K376 HydrophobicContact CG-CD 4.1Å; F139-K376 HydrophobicContact CE2-CD 4.25Å; F139-K376 HydrophobicContact CZ-CD 4.28Å; M142-K376 HydrophobicContact CE-CD 4.4Å; T195-K376 PolarHBondContact O-NZ 2.98Å; Y364-K376 VanDerWaalsContact OH-CE 3.23Å; Y364-K376 WeakPolarHBondContact OH-CE 3.43Å; Y364-K376 PolarHBondContact OH-NZ 3.17Å; V372-K376 VanDerWaalsContact O-CB 3.24Å; V372-K376 WeakPolarHBondContact O-CB 3.4Å; V372-K376 PolarHBondContact O-N 3.4Å; I374-K376 VanDerWaalsContact C-N 3.29Å; I374-K376 PolarHBondContact O-N 3.34Å; K376-W378 VanDerWaalsContact C-N 3.34Å; K376-W378 PolarHBondContact O-N 3.2Å; K376-S380 PolarHBondContact O-OG 3Å; K376-F381 HydrophobicContact CG-CE2 4.44Å; K376-F381 VanDerWaalsContact O-CD2 3.26Å; K376-F381 WeakPolarHBondContact O-CD2 3.5Å; K376-F381 PolarHBondContact O-N 3.38Å
377	D	98.4	Very high	98	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.052	C	C	.	.	I	π-helix	trans	-78.1	-18	-162.7	-84.5	45.2	0	0	0	114.2	T195 R207 C353 A354 L373	T195-D377 PolarHBondContact OG1-OD1 2.88Å; T195-D377 PolarHBondContact OG1-OD2 3.32Å; R207-D377 PolarHBondContact NH1-O 2.65Å; R207-D377 IonicContact NH1-OD2 3.62Å; R207-D377 PolarHBondContact NH2-O 3.01Å; C353-D377 WeakPolarHBondContact CB-OD2 3.5Å; A354-D377 HydrophobicContact CB-CB 3.96Å; A354-D377 PolarHBondContact N-OD2 3.41Å; L373-D377 WeakPolarHBondContact O-CB 3.31Å; L373-D377 PolarHBondContact O-N 3.08Å
378	W	98.7	Very high	98	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.053	C	C	.	.	I	π-helix	trans	-114.6	-56.4	-177.4	-62.8	81.2	0	0	0	112.8	A350 Q351 I374 K376 G382 H383 F385 I402 F403 F406	A350-W378 HydrophobicContact CB-CD2 3.91Å; A350-W378 HydrophobicContact CB-CE3 3.97Å; A350-W378 HydrophobicContact CB-CH2 4.22Å; A350-W378 HydrophobicContact CB-CZ2 4.11Å; A350-W378 HydrophobicContact CB-CZ3 4.14Å; Q351-W378 HydrophobicContact CB-CH2 4.49Å; Q351-W378 HydrophobicContact CB-CZ2 4.49Å; Q351-W378 HydrophobicContact CG-CH2 3.58Å; Q351-W378 HydrophobicContact CG-CZ2 4.01Å; I374-W378 WeakPolarHBondContact O-CB 3.4Å; I374-W378 PolarHBondContact O-N 3.29Å; I374-W378 VanDerWaalsContact O-N 3.14Å; K376-W378 VanDerWaalsContact C-N 3.34Å; K376-W378 PolarHBondContact O-N 3.2Å; W378-G382 PolarHBondContact O-N 3.28Å; W378-H383 HydrophobicContact CB-CB 4.32Å; W378-H383 HydrophobicContact CE3-CB 3.86Å; W378-H383 AromaticContact CE3-CD2 3.75Å; W378-H383 AromaticContact CE3-CG 3.51Å; W378-H383 AromaticContact CE3-ND1 3.79Å; W378-H383 AromaticContact CZ3-CE1 3.77Å; W378-H383 AromaticContact CZ3-CG 3.89Å; W378-H383 AromaticContact CZ3-ND1 3.73Å; W378-H383 AromaticContact CZ3-NE2 3.94Å; W378-H383 VanDerWaalsContact O-CB 3.24Å; W378-H383 WeakPolarHBondContact O-CB 3.25Å; W378-H383 PolarHBondContact O-N 2.99Å; W378-F385 HydrophobicContact CB-CE2 3.95Å; W378-F385 HydrophobicContact CB-CZ 3.94Å; W378-F385 HydrophobicContact CE3-CZ 4.33Å; W378-I402 HydrophobicContact CH2-CG2 4.15Å; W378-I402 HydrophobicContact CZ3-CG2 4.06Å; W378-F403 AromaticContact CD2-CD2 3.58Å; W378-F403 HydrophobicContact CD2-CD2 3.58Å; W378-F403 AromaticContact CD2-CE2 3.81Å; W378-F403 HydrophobicContact CD2-CE2 3.81Å; W378-F403 AromaticContact CE2-CD2 3.85Å; W378-F403 HydrophobicContact CE3-CB 4.48Å; W378-F403 AromaticContact CE3-CD2 3.5Å; W378-F403 HydrophobicContact CE3-CD2 3.5Å; W378-F403 HydrophobicContact CE3-CE2 4.2Å; W378-F403 HydrophobicContact CE3-CG 4.43Å; W378-F403 HydrophobicContact CG-CD2 4.19Å; W378-F403 AromaticContact CG-CE2 3.97Å; W378-F403 HydrophobicContact CG-CE2 3.97Å; W378-F403 AromaticContact CH2-CD2 3.97Å; W378-F403 HydrophobicContact CH2-CD2 3.97Å; W378-F403 HydrophobicContact CZ2-CD2 4.07Å; W378-F403 HydrophobicContact CZ3-CB 4.09Å; W378-F403 AromaticContact CZ3-CD2 3.7Å; W378-F403 HydrophobicContact CZ3-CD2 3.7Å; W378-F403 HydrophobicContact CZ3-CG 4.4Å; W378-F406 AromaticContact CE2-CD1 3.96Å; W378-F406 AromaticContact CE2-CG 3.93Å; W378-F406 HydrophobicContact CH2-CB 3.68Å; W378-F406 HydrophobicContact CH2-CG 4.16Å; W378-F406 HydrophobicContact CZ2-CB 3.38Å; W378-F406 AromaticContact CZ2-CD1 3.82Å; W378-F406 HydrophobicContact CZ2-CD1 3.82Å; W378-F406 AromaticContact CZ2-CD2 3.76Å; W378-F406 HydrophobicContact CZ2-CD2 3.76Å; W378-F406 HydrophobicContact CZ2-CE2 4.5Å; W378-F406 AromaticContact CZ2-CG 3.36Å; W378-F406 HydrophobicContact CZ2-CG 3.36Å; W378-F406 AromaticContact NE1-CD1 3.94Å; W378-F406 AromaticContact NE1-CE1 3.83Å; W378-F406 AromaticContact NE1-CZ 3.93Å
379	I	98.4	Very high	97.8	Very high	7 Å²	7	7.6 Å²	7.6	4%	0.036	4%	0.039	C	C	.	.	I	π-helix	trans	-73.6	-60.3	-172.1	-61.4	172.5	0	0	0	109.8	I374 E375 G382 F385 N442 F443 R451 W464	I374-I379 HydrophobicContact CG2-CD1 3.96Å; I374-I379 HydrophobicContact CG2-CG1 4.27Å; I374-I379 PolarHBondContact O-N 3.16Å; E375-I379 VanDerWaalsContact CD-CD1 3.46Å; E375-I379 HydrophobicContact CG-CD1 4.24Å; E375-I379 WeakPolarHBondContact OE1-CD1 3.3Å; E375-I379 WeakPolarHBondContact OE2-CG2 3.49Å; I379-G382 PolarHBondContact O-N 3.02Å; I379-F385 HydrophobicContact CG1-CE2 3.95Å; I379-N442 HydrophobicContact CD1-CB 4.09Å; I379-N442 WeakPolarHBondContact CD1-O 3.45Å; I379-F443 HydrophobicContact CD1-CD1 4.24Å; I379-F443 HydrophobicContact CD1-CE1 4.09Å; I379-F443 HydrophobicContact CG1-CD1 4.46Å; I379-F443 HydrophobicContact CG1-CE1 4.48Å; I379-R451 VanDerWaalsContact CG2-NH1 3.32Å; I379-R451 PolarHBondContact O-NH1 3.24Å; I379-W464 HydrophobicContact CD1-CZ2 4.39Å
380	S	97.3	Very high	97.5	Very high	5 Å²	5	10 Å²	10	4%	0.035	5%	0.052	C	C	.	.	I	π-helix	trans	-67.6	-42	-175.3	83.8	0	0	0	0	112.6	P165 E375 K376 G382	P165-S380 WeakPolarHBondContact CD-O 3.49Å; E375-S380 VanDerWaalsContact O-CB 3.32Å; E375-S380 WeakPolarHBondContact O-CB 3.28Å; E375-S380 PolarHBondContact O-N 2.88Å; E375-S380 PolarHBondContact O-OG 3.03Å; K376-S380 PolarHBondContact O-OG 3Å; S380-G382 PolarHBondContact O-N 3.45Å; S380-G382 VanDerWaalsContact O-N 3.09Å
381	F	98.3	Very high	97.1	Very high	4 Å²	4	10.4 Å²	10.4	2%	0.018	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	6.8	173.9	-83	-60.4	0	0	0	115.6	T163 Y164 P165 L168 R190 V193 R207 K376	T163-F381 CarbonylContact O-C 3.57Å; Y164-F381 AromaticContact CD1-CD1 3.84Å; Y164-F381 HydrophobicContact CD1-CD1 3.84Å; Y164-F381 HydrophobicContact CD1-CE1 4.34Å; Y164-F381 AromaticContact CE1-CD1 3.89Å; Y164-F381 HydrophobicContact CE1-CD1 3.89Å; Y164-F381 HydrophobicContact CE1-CE1 4.31Å; Y164-F381 HydrophobicContact CG-CD1 4.46Å; P165-F381 HydrophobicContact CG-CD1 4.24Å; P165-F381 HydrophobicContact CG-CE1 4.08Å; P165-F381 HydrophobicContact CG-CZ 4.49Å; L168-F381 HydrophobicContact CD2-CE1 3.94Å; L168-F381 HydrophobicContact CD2-CZ 4.46Å; R190-F381 PolarHBondContact NH1-O 2.9Å; R190-F381 VanDerWaalsContact NH1-O 3.13Å; R190-F381 PolarHBondContact NH2-O 3.11Å; V193-F381 HydrophobicContact CG2-CE1 3.65Å; V193-F381 HydrophobicContact CG2-CZ 4.09Å; R207-F381 HydrophobicContact CG-CE1 4.44Å; K376-F381 HydrophobicContact CG-CE2 4.44Å; K376-F381 VanDerWaalsContact O-CD2 3.26Å; K376-F381 WeakPolarHBondContact O-CD2 3.5Å; K376-F381 PolarHBondContact O-N 3.38Å
382	G	98	Very high	96.7	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	46.7	164.4	0	0	0	0	0	115	W346 W378 I379 S380 N446	W346-G382 WeakPolarHBondContact CB-O 3.44Å; W378-G382 PolarHBondContact O-N 3.28Å; I379-G382 PolarHBondContact O-N 3.02Å; S380-G382 PolarHBondContact O-N 3.45Å; S380-G382 VanDerWaalsContact O-N 3.09Å; G382-N446 CarbonylContact C-O 3.56Å; G382-N446 WeakPolarHBondContact CA-O 3.34Å
383	H	98.6	Very high	96	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.087	C	C	.	.			trans	-63.3	132.5	158.6	-172.7	68.9	0	0	0	109.6	W346 D347 W378 F385	W346-H383 PolarHBondContact O-ND1 3.46Å; D347-H383 IonicContact OD1-CE1 3.68Å; D347-H383 PolarHBondContact OD1-CE1 3.01Å; D347-H383 VanDerWaalsContact OD1-CE1 3.26Å; D347-H383 IonicContact OD1-ND1 3.36Å; W378-H383 HydrophobicContact CB-CB 4.32Å; W378-H383 HydrophobicContact CE3-CB 3.86Å; W378-H383 AromaticContact CE3-CD2 3.75Å; W378-H383 AromaticContact CE3-CG 3.51Å; W378-H383 AromaticContact CE3-ND1 3.79Å; W378-H383 AromaticContact CZ3-CE1 3.77Å; W378-H383 AromaticContact CZ3-CG 3.89Å; W378-H383 AromaticContact CZ3-ND1 3.73Å; W378-H383 AromaticContact CZ3-NE2 3.94Å; W378-H383 VanDerWaalsContact O-CB 3.24Å; W378-H383 WeakPolarHBondContact O-CB 3.25Å; W378-H383 PolarHBondContact O-N 2.99Å; H383-F385 HydrophobicContact CB-CD2 4.16Å; H383-F385 HydrophobicContact CB-CE2 3.92Å; H383-F385 AromaticContact CD2-CD1 3.88Å; H383-F385 AromaticContact CD2-CD2 3.86Å; H383-F385 AromaticContact CD2-CE1 3.87Å; H383-F385 AromaticContact CD2-CE2 3.86Å; H383-F385 AromaticContact CD2-CG 3.87Å; H383-F385 AromaticContact CD2-CZ 3.85Å; H383-F385 WeakPolarHBondContact O-CD2 3.33Å; H383-F385 PolarHBondContact O-N 3.41Å
384	K	97.8	Very high	95.4	Very high	34 Å²	34	18.7 Å²	18.7	15%	0.148	11%	0.108	C	C	.	.			trans	-78.3	60.8	-173.2	-63.9	-175.2	67.3	-160.2	0	112.3	W346 A386 D387 R388 E398 N446	W346-K384 HydrophobicContact CD2-CD 4.28Å; W346-K384 HydrophobicContact CD2-CG 4.31Å; W346-K384 HydrophobicContact CH2-CD 4.29Å; W346-K384 HydrophobicContact CZ2-CD 3.69Å; K384-A386 VanDerWaalsContact C-N 3.31Å; K384-A386 PolarHBondContact O-N 3.17Å; K384-D387 HydrophobicContact CB-CB 4.3Å; K384-D387 WeakPolarHBondContact CE-OD2 3.28Å; K384-D387 IonicContact NZ-OD2 3.59Å; K384-D387 PolarHBondContact NZ-OD2 3.44Å; K384-D387 PolarHBondContact O-N 3.46Å; K384-R388 HydrophobicContact CB-CG 4.22Å; K384-R388 VanDerWaalsContact O-CB 3.25Å; K384-R388 WeakPolarHBondContact O-CB 3.3Å; K384-R388 WeakPolarHBondContact O-CG 3.33Å; K384-R388 PolarHBondContact O-N 2.83Å; K384-E398 IonicContact NZ-OE2 3.04Å; K384-E398 PolarHBondContact NZ-OE2 2.94Å; K384-N446 WeakPolarHBondContact CA-OD1 3.29Å; K384-N446 HydrophobicContact CB-CB 4.36Å; K384-N446 WeakPolarHBondContact CB-OD1 3.42Å; K384-N446 HydrophobicContact CG-CB 4.34Å; K384-N446 PolarHBondContact O-OD1 2.86Å
385	F	97.8	Very high	95	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-55.7	-41.7	-174.7	-78.8	-79.1	0	0	0	113.3	W378 I379 H383 D387 R388 C389 F403 V435 F443	W378-F385 HydrophobicContact CB-CE2 3.95Å; W378-F385 HydrophobicContact CB-CZ 3.94Å; W378-F385 HydrophobicContact CE3-CZ 4.33Å; I379-F385 HydrophobicContact CG1-CE2 3.95Å; H383-F385 HydrophobicContact CB-CD2 4.16Å; H383-F385 HydrophobicContact CB-CE2 3.92Å; H383-F385 AromaticContact CD2-CD1 3.88Å; H383-F385 AromaticContact CD2-CD2 3.86Å; H383-F385 AromaticContact CD2-CE1 3.87Å; H383-F385 AromaticContact CD2-CE2 3.86Å; H383-F385 AromaticContact CD2-CG 3.87Å; H383-F385 AromaticContact CD2-CZ 3.85Å; H383-F385 WeakPolarHBondContact O-CD2 3.33Å; H383-F385 PolarHBondContact O-N 3.41Å; F385-D387 PolarHBondContact O-N 2.99Å; F385-R388 PolarHBondContact O-N 2.58Å; F385-C389 WeakPolarHBondContact O-CB 3.41Å; F385-C389 PolarHBondContact O-N 3.3Å; F385-F403 HydrophobicContact CE1-CB 4.02Å; F385-F403 AromaticContact CE1-CD1 3.94Å; F385-F403 HydrophobicContact CE1-CD1 3.94Å; F385-F403 HydrophobicContact CE1-CD2 4.06Å; F385-F403 HydrophobicContact CE1-CE1 4.39Å; F385-F403 AromaticContact CE1-CG 3.74Å; F385-F403 HydrophobicContact CE1-CG 3.74Å; F385-F403 HydrophobicContact CZ-CD2 4.03Å; F385-F403 HydrophobicContact CZ-CE2 4.22Å; F385-F403 HydrophobicContact CZ-CG 4.2Å; F385-V435 HydrophobicContact CD1-CG1 4.38Å; F385-F443 WeakPolarHBondContact CB-O 3.48Å; F385-F443 HydrophobicContact CD1-CB 4.31Å; F385-F443 AromaticContact CD1-CD1 3.88Å; F385-F443 HydrophobicContact CD1-CD1 3.88Å; F385-F443 HydrophobicContact CD1-CG 4.47Å; F385-F443 HydrophobicContact CD2-CD1 4.27Å; F385-F443 AromaticContact CE1-CD1 3.5Å; F385-F443 HydrophobicContact CE1-CD1 3.5Å; F385-F443 AromaticContact CE1-CE1 3.93Å; F385-F443 HydrophobicContact CE1-CE1 3.93Å; F385-F443 HydrophobicContact CE1-CG 4.43Å; F385-F443 AromaticContact CE2-CD1 3.93Å; F385-F443 HydrophobicContact CE2-CD1 3.93Å; F385-F443 HydrophobicContact CE2-CE1 4.42Å; F385-F443 HydrophobicContact CG-CB 4.39Å; F385-F443 HydrophobicContact CG-CD1 4.25Å; F385-F443 AromaticContact CZ-CD1 3.53Å; F385-F443 HydrophobicContact CZ-CD1 3.53Å; F385-F443 AromaticContact CZ-CE1 3.76Å; F385-F443 HydrophobicContact CZ-CE1 3.76Å
386	A	95.8	Very high	94.7	Very high	5 Å²	5	25.8 Å²	25.8	4%	0.041	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-45.1	179.4	0	0	0	0	0	112.9	Y109 K384 D390 Q391 N446	Y109-A386 HydrophobicContact CE1-CB 4.28Å; Y109-A386 WeakPolarHBondContact OH-CB 3.45Å; K384-A386 VanDerWaalsContact C-N 3.31Å; K384-A386 PolarHBondContact O-N 3.17Å; A386-D390 PolarHBondContact O-N 3.32Å; A386-Q391 VanDerWaalsContact CA-OE1 3.31Å; A386-Q391 HydrophobicContact CB-CB 4.19Å; A386-Q391 PolarHBondContact O-N 2.83Å; A386-N446 WeakPolarHBondContact CB-OD1 3.36Å; A386-N446 PolarHBondContact N-OD1 3.23Å
387	D	95.9	Very high	94.5	Very high	52 Å²	52	32 Å²	32	28%	0.278	18%	0.179	S	C	.	.	H	α-helix	trans	-76.9	-33.2	-179.9	-65	18.7	0	0	0	112.4	K384 F385 E398 V399 N446	K384-D387 HydrophobicContact CB-CB 4.3Å; K384-D387 WeakPolarHBondContact CE-OD2 3.28Å; K384-D387 IonicContact NZ-OD2 3.59Å; K384-D387 PolarHBondContact NZ-OD2 3.44Å; K384-D387 PolarHBondContact O-N 3.46Å; F385-D387 PolarHBondContact O-N 2.99Å; D387-E398 HydrophobicContact CB-CB 4.06Å; D387-E398 CarbonylContact O-C 3.56Å; D387-V399 WeakPolarHBondContact O-CA 3.37Å; D387-V399 PolarHBondContact O-N 2.77Å; D387-N446 PolarHBondContact N-OD1 3.44Å; D387-N446 PolarHBondContact OD1-ND2 2.99Å; D387-N446 PolarHBondContact OD1-OD1 2.95Å
388	R	97.1	Very high	94.3	Very high	8 Å²	8	34.4 Å²	34.4	3%	0.03	19%	0.19	C	C	.	.	H	α-helix	trans	-79	-34.4	-177	-68	-76.3	175.8	-83.8	-2.6	112.5	D347 K384 F385 E398 S400	D347-R388 IonicContact OD1-CZ 2.7Å; D347-R388 IonicContact OD1-NE 3.81Å; D347-R388 PolarHBondContact OD1-NE 2.88Å; D347-R388 IonicContact OD1-NH2 3.65Å; D347-R388 IonicContact OD2-CZ 3.17Å; D347-R388 IonicContact OD2-NE 2.71Å; D347-R388 IonicContact OD2-NH2 3Å; D347-R388 PolarHBondContact OD2-NH2 3.11Å; K384-R388 HydrophobicContact CB-CG 4.22Å; K384-R388 VanDerWaalsContact O-CB 3.25Å; K384-R388 WeakPolarHBondContact O-CB 3.3Å; K384-R388 WeakPolarHBondContact O-CG 3.33Å; K384-R388 PolarHBondContact O-N 2.83Å; F385-R388 PolarHBondContact O-N 2.58Å; R388-E398 WeakPolarHBondContact CD-O 3.45Å; R388-E398 IonicContact CZ-OE2 2.9Å; R388-E398 PolarHBondContact NH1-O 2.63Å; R388-E398 IonicContact NH1-OE2 3.22Å; R388-E398 PolarHBondContact NH1-OE2 2.86Å; R388-E398 IonicContact NH2-OE2 3.51Å; R388-E398 PolarHBondContact NH2-OE2 3.22Å; R388-S400 PolarHBondContact O-N 2.66Å
389	C	94.1	Very high	94.2	Very high	12 Å²	12	36.1 Å²	36.1	8%	0.081	20%	0.201	C	C	.	.	H	α-helix	trans	-101.6	3.2	-177.3	-59.4	0	0	0	0	113.8	R78 F385 Q391 V435	R78-C389 WeakPolarHBondContact CD-O 3.45Å; R78-C389 PolarHBondContact NE-O 3Å; F385-C389 WeakPolarHBondContact O-CB 3.41Å; F385-C389 PolarHBondContact O-N 3.3Å; C389-Q391 HydrophobicContact CB-CG 4.5Å; C389-V435 HydrophobicContact CB-CG1 4.46Å; C389-V435 VanDerWaalsContact SG-CG1 3.52Å
390	D	92.2	Very high	94.2	Very high	51 Å²	51	36 Å²	36	27%	0.273	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	54.1	174.8	-164.9	55.2	0	0	0	112.4	R78 A386 V399	R78-D390 IonicContact CZ-OD2 3.52Å; R78-D390 PolarHBondContact NE-O 3.36Å; R78-D390 IonicContact NE-OD2 3.57Å; R78-D390 PolarHBondContact NH2-O 3.37Å; R78-D390 IonicContact NH2-OD2 3.61Å; R78-D390 PolarHBondContact NH2-OD2 2.85Å; A386-D390 PolarHBondContact O-N 3.32Å; D390-V399 HydrophobicContact CB-CG1 4.14Å; D390-V399 HydrophobicContact CB-CG2 3.75Å
391	Q	90.3	Very high	94.2	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.037	20%	0.204	C	C	.	.			trans	-80.8	-25.7	-175.9	-69.3	179.9	-7.3	0	0	113.9	P106 L112 A386 C389 F443	P106-Q391 VanDerWaalsContact CG-O 3.28Å; P106-Q391 WeakPolarHBondContact CG-O 3.39Å; L112-Q391 WeakPolarHBondContact CD2-O 3.18Å; A386-Q391 VanDerWaalsContact CA-OE1 3.31Å; A386-Q391 HydrophobicContact CB-CB 4.19Å; A386-Q391 PolarHBondContact O-N 2.83Å; C389-Q391 HydrophobicContact CB-CG 4.5Å; Q391-F443 PolarHBondContact NE2-O 2.96Å
392	L	89.3	Confident	94.2	Very high	36 Å²	36	36.4 Å²	36.4	19%	0.188	20%	0.203	C	C	.	.	S	Bend	trans	-136.8	168.3	-179.7	-61.7	177.9	0	0	0	109.4	P106 Y109 L112 G394	P106-L392 HydrophobicContact CB-CD2 4Å; P106-L392 HydrophobicContact CG-CD2 4.12Å; P106-L392 WeakPolarHBondContact O-CA 3.35Å; P106-L392 WeakPolarHBondContact O-CD2 3.25Å; Y109-L392 HydrophobicContact CD1-CD1 4.29Å; Y109-L392 HydrophobicContact CD2-CD1 3.84Å; Y109-L392 HydrophobicContact CE1-CD1 3.96Å; Y109-L392 HydrophobicContact CE1-CG 4.44Å; Y109-L392 HydrophobicContact CE2-CD1 3.47Å; Y109-L392 VanDerWaalsContact CE2-CD1 3.47Å; Y109-L392 HydrophobicContact CG-CD1 4.23Å; L112-L392 HydrophobicContact CD2-CD2 4.29Å; L392-G394 VanDerWaalsContact C-N 3.25Å; L392-G394 PolarHBondContact O-N 3.37Å
393	D	84.3	Confident	94.2	Very high	97 Å²	97	36.7 Å²	36.7	52%	0.519	21%	0.205	S	C	.	.	S	Bend	trans	-67.8	76.2	176.7	-156.8	14.3	0	0	0	111.8	R105 P106	R105-D393 IonicContact NH1-OD1 3.95Å; R105-D393 PolarHBondContact NH1-OD1 2.73Å; R105-D393 IonicContact NH1-OD2 3.28Å; R105-D393 PolarHBondContact NH1-OD2 3.49Å; P106-D393 PolarHBondContact O-N 3.48Å
394	G	86.5	Confident	94.2	Very high	44 Å²	44	37 Å²	37	45%	0.454	21%	0.206	S	C	.	.			trans	-104.6	-165.5	-176.5	0	0	0	0	0	114.4	L392 P396	L392-G394 VanDerWaalsContact C-N 3.25Å; L392-G394 PolarHBondContact O-N 3.37Å; G394-P396 VanDerWaalsContact O-CD 3.26Å; G394-P396 WeakPolarHBondContact O-CD 3.34Å
395	D	90.6	Very high	94.2	Very high	87 Å²	87	35.3 Å²	35.3	47%	0.465	20%	0.199	S	C	.	.			trans	-77.3	114.5	173.9	-175.5	-5.9	0	0	0	110.3	K397 E398	D395-K397 PolarHBondContact O-N 2.99Å; D395-K397 VanDerWaalsContact OD1-CB 3.25Å; D395-K397 WeakPolarHBondContact OD1-CB 3.34Å; D395-K397 WeakPolarHBondContact OD1-CG 3.31Å; D395-K397 PolarHBondContact OD1-N 2.89Å; D395-E398 PolarHBondContact O-N 3.05Å
396	P	90.4	Very high	94.2	Very high	90 Å²	90	35.3 Å²	35.3	58%	0.584	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-12.9	177.6	26.5	-36.1	0	0	0	113.3	R283 G394 E398	R283-P396 PolarHBondContact NH1-O 3.41Å; R283-P396 VanDerWaalsContact NH1-O 3.13Å; G394-P396 VanDerWaalsContact O-CD 3.26Å; G394-P396 WeakPolarHBondContact O-CD 3.34Å; P396-E398 VanDerWaalsContact C-N 3.34Å
397	K	94.3	Very high	94.4	Very high	132 Å²	132	35.1 Å²	35.1	57%	0.574	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-23	172.6	-63.2	171.6	-176.2	168.4	0	113.4	H280 R283 D395	H280-K397 PolarHBondContact CE1-O 2.95Å; H280-K397 PolarHBondContact ND1-O 3.31Å; H280-K397 VanDerWaalsContact ND1-O 3.08Å; R283-K397 VanDerWaalsContact NH1-C 3.29Å; R283-K397 PolarHBondContact NH1-O 3.33Å; D395-K397 PolarHBondContact O-N 2.99Å; D395-K397 VanDerWaalsContact OD1-CB 3.25Å; D395-K397 WeakPolarHBondContact OD1-CB 3.34Å; D395-K397 WeakPolarHBondContact OD1-CG 3.31Å; D395-K397 PolarHBondContact OD1-N 2.89Å
398	E	95.6	Very high	94.5	Very high	49 Å²	49	32.6 Å²	32.6	23%	0.229	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-19.3	176	-76	-71.5	110.2	0	0	113.4	K384 D387 R388 D395 P396 S400	K384-E398 IonicContact NZ-OE2 3.04Å; K384-E398 PolarHBondContact NZ-OE2 2.94Å; D387-E398 HydrophobicContact CB-CB 4.06Å; D387-E398 CarbonylContact O-C 3.56Å; R388-E398 WeakPolarHBondContact CD-O 3.45Å; R388-E398 IonicContact CZ-OE2 2.9Å; R388-E398 PolarHBondContact NH1-O 2.63Å; R388-E398 IonicContact NH1-OE2 3.22Å; R388-E398 PolarHBondContact NH1-OE2 2.86Å; R388-E398 IonicContact NH2-OE2 3.51Å; R388-E398 PolarHBondContact NH2-OE2 3.22Å; D395-E398 PolarHBondContact O-N 3.05Å; P396-E398 VanDerWaalsContact C-N 3.34Å; E398-S400 PolarHBondContact O-N 3.09Å
399	V	95.7	Very high	94.6	Very high	37 Å²	37	32.2 Å²	32.2	22%	0.224	18%	0.183	C	C	.	.			trans	-64.6	127.1	179.4	-178.4	0	0	0	0	110.7	R283 D387 D390	R283-V399 WeakPolarHBondContact CD-O 3.34Å; R283-V399 PolarHBondContact NH1-O 2.83Å; D387-V399 WeakPolarHBondContact O-CA 3.37Å; D387-V399 PolarHBondContact O-N 2.77Å; D390-V399 HydrophobicContact CB-CG1 4.14Å; D390-V399 HydrophobicContact CB-CG2 3.75Å
400	S	97.6	Very high	94.8	Very high	5 Å²	5	31.7 Å²	31.7	4%	0.035	18%	0.179	C	C	.	.			trans	-166.7	139.3	-176.1	-169.3	0	0	0	0	112.9	I279 R388 E398 I402	I279-S400 WeakPolarHBondContact CA-OG 3.26Å; I279-S400 WeakPolarHBondContact O-CB 2.91Å; I279-S400 PolarHBondContact O-OG 2.99Å; R388-S400 PolarHBondContact O-N 2.66Å; E398-S400 PolarHBondContact O-N 3.09Å; S400-I402 PolarHBondContact O-N 2.88Å; S400-I402 WeakPolarHBondContact OG-CD1 3.1Å
401	P	97.3	Very high	95.1	Very high	15 Å²	15	30 Å²	30	10%	0.097	17%	0.169	C	C	.	.			trans	-80.5	43	-170.1	36.5	-41.2	0	0	0	114.3	L286 W313 F403 T404 Q405	L286-P401 HydrophobicContact CB-CG 3.93Å; L286-P401 HydrophobicContact CD2-CB 3.49Å; L286-P401 VanDerWaalsContact CD2-CB 3.49Å; L286-P401 HydrophobicContact CD2-CG 3.62Å; L286-P401 HydrophobicContact CG-CG 4.41Å; W313-P401 HydrophobicContact CH2-CB 4.08Å; W313-P401 HydrophobicContact CH2-CG 3.77Å; W313-P401 HydrophobicContact CZ3-CG 3.83Å; P401-F403 PolarHBondContact O-N 3.13Å; P401-T404 PolarHBondContact O-N 2.63Å; P401-Q405 WeakPolarHBondContact O-CG 3.34Å; P401-Q405 PolarHBondContact O-N 2.93Å
402	I	98.5	Very high	95.4	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-39	-171.7	-57.1	-55.9	0	0	0	112.3	I279 M282 D347 Q351 W378 S400 F406	I279-I402 HydrophobicContact CG2-CD1 4.08Å; I279-I402 HydrophobicContact CG2-CG1 4.23Å; M282-I402 HydrophobicContact CB-CD1 4.23Å; M282-I402 HydrophobicContact CG-CD1 4.13Å; D347-I402 HydrophobicContact CB-CG1 4.49Å; D347-I402 HydrophobicContact CB-CG2 4.03Å; Q351-I402 HydrophobicContact CG-CG2 4.04Å; Q351-I402 PolarHBondContact NE2-O 2.79Å; W378-I402 HydrophobicContact CH2-CG2 4.15Å; W378-I402 HydrophobicContact CZ3-CG2 4.06Å; S400-I402 PolarHBondContact O-N 2.88Å; S400-I402 WeakPolarHBondContact OG-CD1 3.1Å; I402-F406 PolarHBondContact O-N 3.23Å
403	F	98.6	Very high	95.8	Very high	5 Å²	5	28.2 Å²	28.2	2%	0.022	16%	0.16	C	C	.	.	H	α-helix	trans	-76.3	-35.6	175.3	-167.7	-113.8	0	0	0	112.6	I374 W378 F385 P401 Q405 F406 L407 I431 V435 F443	I374-F403 HydrophobicContact CD1-CZ 3.95Å; I374-F403 HydrophobicContact CG1-CE2 4.27Å; I374-F403 HydrophobicContact CG1-CZ 4.07Å; I374-F403 HydrophobicContact CG2-CE2 4.31Å; I374-F403 HydrophobicContact CG2-CZ 4.05Å; W378-F403 AromaticContact CD2-CD2 3.58Å; W378-F403 HydrophobicContact CD2-CD2 3.58Å; W378-F403 AromaticContact CD2-CE2 3.81Å; W378-F403 HydrophobicContact CD2-CE2 3.81Å; W378-F403 AromaticContact CE2-CD2 3.85Å; W378-F403 HydrophobicContact CE3-CB 4.48Å; W378-F403 AromaticContact CE3-CD2 3.5Å; W378-F403 HydrophobicContact CE3-CD2 3.5Å; W378-F403 HydrophobicContact CE3-CE2 4.2Å; W378-F403 HydrophobicContact CE3-CG 4.43Å; W378-F403 HydrophobicContact CG-CD2 4.19Å; W378-F403 AromaticContact CG-CE2 3.97Å; W378-F403 HydrophobicContact CG-CE2 3.97Å; W378-F403 AromaticContact CH2-CD2 3.97Å; W378-F403 HydrophobicContact CH2-CD2 3.97Å; W378-F403 HydrophobicContact CZ2-CD2 4.07Å; W378-F403 HydrophobicContact CZ3-CB 4.09Å; W378-F403 AromaticContact CZ3-CD2 3.7Å; W378-F403 HydrophobicContact CZ3-CD2 3.7Å; W378-F403 HydrophobicContact CZ3-CG 4.4Å; F385-F403 HydrophobicContact CE1-CB 4.02Å; F385-F403 AromaticContact CE1-CD1 3.94Å; F385-F403 HydrophobicContact CE1-CD1 3.94Å; F385-F403 HydrophobicContact CE1-CD2 4.06Å; F385-F403 HydrophobicContact CE1-CE1 4.39Å; F385-F403 AromaticContact CE1-CG 3.74Å; F385-F403 HydrophobicContact CE1-CG 3.74Å; F385-F403 HydrophobicContact CZ-CD2 4.03Å; F385-F403 HydrophobicContact CZ-CE2 4.22Å; F385-F403 HydrophobicContact CZ-CG 4.2Å; P401-F403 PolarHBondContact O-N 3.13Å; F403-Q405 VanDerWaalsContact C-N 3.32Å; F403-Q405 PolarHBondContact O-N 3.39Å; F403-F406 AromaticContact CD2-CD1 3.86Å; F403-F406 HydrophobicContact CD2-CD1 3.86Å; F403-F406 AromaticContact CE2-CD1 3.58Å; F403-F406 HydrophobicContact CE2-CD1 3.58Å; F403-F406 AromaticContact CE2-CE1 3.93Å; F403-F406 HydrophobicContact CE2-CE1 3.93Å; F403-F406 HydrophobicContact CZ-CD1 4.29Å; F403-F406 HydrophobicContact CZ-CE1 4.48Å; F403-F406 WeakPolarHBondContact O-CB 3.47Å; F403-F406 PolarHBondContact O-N 2.73Å; F403-F406 VanDerWaalsContact O-N 3.09Å; F403-L407 HydrophobicContact CD1-CD1 4.05Å; F403-L407 HydrophobicContact CD1-CG 4.29Å; F403-L407 HydrophobicContact CE1-CD1 3.85Å; F403-L407 HydrophobicContact CE1-CD2 4.18Å; F403-L407 HydrophobicContact CE1-CG 4.06Å; F403-L407 HydrophobicContact CZ-CD2 4.16Å; F403-L407 HydrophobicContact CZ-CG 4.43Å; F403-L407 PolarHBondContact O-N 2.99Å; F403-I431 HydrophobicContact CE1-CG2 3.81Å; F403-I431 HydrophobicContact CZ-CG2 4.17Å; F403-V435 HydrophobicContact CD1-CG1 4.45Å; F403-V435 HydrophobicContact CD1-CG2 3.68Å; F403-V435 HydrophobicContact CE1-CG2 3.55Å; F403-F443 HydrophobicContact CE1-CE1 4.11Å; F403-F443 HydrophobicContact CE1-CZ 4.18Å; F403-F443 HydrophobicContact CZ-CE1 4.1Å; F403-F443 HydrophobicContact CZ-CZ 4.3Å
404	T	98.1	Very high	96.4	Very high	7 Å²	7	24.5 Å²	24.5	4%	0.043	14%	0.141	C	C	.	.	H	α-helix	trans	-58.7	-43.9	171.5	-50.3	0	0	0	0	111.3	F80 P401 F406 L407 E408 H432	F80-T404 HydrophobicContact CE2-CG2 4.36Å; F80-T404 HydrophobicContact CZ-CG2 4.16Å; P401-T404 PolarHBondContact O-N 2.63Å; T404-F406 VanDerWaalsContact C-N 3.3Å; T404-F406 PolarHBondContact O-N 2.73Å; T404-L407 PolarHBondContact O-N 2.84Å; T404-E408 PolarHBondContact O-N 2.96Å; T404-H432 WeakPolarHBondContact CG2-NE2 3.35Å; T404-H432 PolarHBondContact OG1-CD2 2.94Å; T404-H432 PolarHBondContact OG1-NE2 3.48Å
405	Q	98.5	Very high	96.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.8	-39.9	173.2	-74.7	-175.4	-30.8	0	0	112.5	M282 W313 I317 Q351 P401 F403 E408 C409	M282-Q405 PolarHBondContact SD-NE2 2.9Å; W313-Q405 HydrophobicContact CH2-CG 3.27Å; W313-Q405 HydrophobicContact CZ2-CG 3.71Å; W313-Q405 HydrophobicContact CZ3-CG 3.86Å; I317-Q405 HydrophobicContact CD1-CB 3.93Å; I317-Q405 HydrophobicContact CD1-CG 3.88Å; Q351-Q405 VanDerWaalsContact NE2-OE1 3.12Å; P401-Q405 WeakPolarHBondContact O-CG 3.34Å; P401-Q405 PolarHBondContact O-N 2.93Å; F403-Q405 VanDerWaalsContact C-N 3.32Å; F403-Q405 PolarHBondContact O-N 3.39Å; Q405-E408 PolarHBondContact O-N 2.78Å; Q405-C409 PolarHBondContact O-N 2.8Å; Q405-C409 PolarHBondContact O-SG 3.39Å
406	F	98.8	Very high	96.9	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.3	-48.6	175.4	165.2	-106.3	0	0	0	111.8	Q351 A354 L355 F370 L373 I374 W378 I402 F403 T404 E408 C409 V410	Q351-F406 HydrophobicContact CG-CB 4.46Å; A354-F406 HydrophobicContact CB-CD2 4.31Å; A354-F406 HydrophobicContact CB-CE2 3.59Å; A354-F406 HydrophobicContact CB-CZ 4.02Å; L355-F406 HydrophobicContact CD1-CD2 4.36Å; L355-F406 HydrophobicContact CD2-CD2 3.93Å; L355-F406 HydrophobicContact CD2-CE2 3.85Å; L355-F406 HydrophobicContact CG-CD2 3.81Å; L355-F406 HydrophobicContact CG-CE2 3.91Å; F370-F406 HydrophobicContact CE2-CE1 4.16Å; F370-F406 AromaticContact CE2-CZ 3.83Å; F370-F406 HydrophobicContact CE2-CZ 3.83Å; F370-F406 AromaticContact CZ-CE1 3.75Å; F370-F406 HydrophobicContact CZ-CE1 3.75Å; F370-F406 AromaticContact CZ-CZ 3.92Å; F370-F406 HydrophobicContact CZ-CZ 3.92Å; L373-F406 HydrophobicContact CD2-CZ 4.34Å; I374-F406 HydrophobicContact CG1-CE1 4.33Å; W378-F406 AromaticContact CE2-CD1 3.96Å; W378-F406 AromaticContact CE2-CG 3.93Å; W378-F406 HydrophobicContact CH2-CB 3.68Å; W378-F406 HydrophobicContact CH2-CG 4.16Å; W378-F406 HydrophobicContact CZ2-CB 3.38Å; W378-F406 AromaticContact CZ2-CD1 3.82Å; W378-F406 HydrophobicContact CZ2-CD1 3.82Å; W378-F406 AromaticContact CZ2-CD2 3.76Å; W378-F406 HydrophobicContact CZ2-CD2 3.76Å; W378-F406 HydrophobicContact CZ2-CE2 4.5Å; W378-F406 AromaticContact CZ2-CG 3.36Å; W378-F406 HydrophobicContact CZ2-CG 3.36Å; W378-F406 AromaticContact NE1-CD1 3.94Å; W378-F406 AromaticContact NE1-CE1 3.83Å; W378-F406 AromaticContact NE1-CZ 3.93Å; I402-F406 PolarHBondContact O-N 3.23Å; F403-F406 AromaticContact CD2-CD1 3.86Å; F403-F406 HydrophobicContact CD2-CD1 3.86Å; F403-F406 AromaticContact CE2-CD1 3.58Å; F403-F406 HydrophobicContact CE2-CD1 3.58Å; F403-F406 AromaticContact CE2-CE1 3.93Å; F403-F406 HydrophobicContact CE2-CE1 3.93Å; F403-F406 HydrophobicContact CZ-CD1 4.29Å; F403-F406 HydrophobicContact CZ-CE1 4.48Å; F403-F406 WeakPolarHBondContact O-CB 3.47Å; F403-F406 PolarHBondContact O-N 2.73Å; F403-F406 VanDerWaalsContact O-N 3.09Å; T404-F406 VanDerWaalsContact C-N 3.3Å; T404-F406 PolarHBondContact O-N 2.73Å; F406-E408 VanDerWaalsContact C-N 3.26Å; F406-E408 PolarHBondContact O-N 2.87Å; F406-C409 WeakPolarHBondContact O-CB 3.48Å; F406-C409 PolarHBondContact O-N 2.99Å; F406-V410 HydrophobicContact CD2-CG2 4.35Å; F406-V410 HydrophobicContact CE1-CG2 4.41Å; F406-V410 HydrophobicContact CE2-CG2 3.94Å; F406-V410 HydrophobicContact CZ-CG2 3.98Å; F406-V410 WeakPolarHBondContact O-CG2 3.44Å; F406-V410 PolarHBondContact O-N 2.92Å
407	L	98.7	Very high	97.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.3	-37.2	176.5	-64.2	178.1	0	0	0	111.7	F370 F403 T404 V410 Y411 L428 I431 H432 W502	F370-L407 HydrophobicContact CE1-CD2 4.18Å; F370-L407 HydrophobicContact CZ-CD2 4.16Å; F403-L407 HydrophobicContact CD1-CD1 4.05Å; F403-L407 HydrophobicContact CD1-CG 4.29Å; F403-L407 HydrophobicContact CE1-CD1 3.85Å; F403-L407 HydrophobicContact CE1-CD2 4.18Å; F403-L407 HydrophobicContact CE1-CG 4.06Å; F403-L407 HydrophobicContact CZ-CD2 4.16Å; F403-L407 HydrophobicContact CZ-CG 4.43Å; F403-L407 PolarHBondContact O-N 2.99Å; T404-L407 PolarHBondContact O-N 2.84Å; L407-V410 PolarHBondContact O-N 3.42Å; L407-Y411 PolarHBondContact O-N 2.9Å; L407-L428 HydrophobicContact CD2-CD2 4.31Å; L407-I431 HydrophobicContact CD1-CG2 4.1Å; L407-I431 HydrophobicContact CD2-CG2 4.17Å; L407-H432 HydrophobicContact CD1-CB 3.82Å; L407-W502 HydrophobicContact CB-CH2 4.35Å; L407-W502 HydrophobicContact CB-CZ3 4.2Å
408	E	98.4	Very high	97.1	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-69.7	-39.9	175.2	-172.3	165.2	167.9	0	0	112.5	W313 I317 T404 Q405 F406 V410 Y411 Q412 W502 Y506	W313-E408 VanDerWaalsContact NE1-CD 3.33Å; W313-E408 PolarHBondContact NE1-OE1 2.89Å; W313-E408 PolarHBondContact NE1-OE2 3.23Å; I317-E408 HydrophobicContact CD1-CB 4.06Å; I317-E408 HydrophobicContact CD1-CG 4.22Å; I317-E408 HydrophobicContact CG1-CG 4.3Å; I317-E408 HydrophobicContact CG2-CG 4.48Å; T404-E408 PolarHBondContact O-N 2.96Å; Q405-E408 PolarHBondContact O-N 2.78Å; F406-E408 VanDerWaalsContact C-N 3.26Å; F406-E408 PolarHBondContact O-N 2.87Å; E408-V410 VanDerWaalsContact C-N 3.26Å; E408-V410 PolarHBondContact O-N 3.13Å; E408-Y411 WeakPolarHBondContact O-CB 3.22Å; E408-Y411 PolarHBondContact O-N 3.2Å; E408-Y411 VanDerWaalsContact O-N 3.12Å; E408-Q412 WeakPolarHBondContact O-CG 3.14Å; E408-Q412 PolarHBondContact O-N 3.39Å; E408-W502 HydrophobicContact CB-CE3 3.69Å; E408-W502 HydrophobicContact CB-CZ3 3.96Å; E408-W502 HydrophobicContact CG-CB 4.33Å; E408-W502 HydrophobicContact CG-CE3 3.8Å; E408-Y506 PolarHBondContact OE2-OH 2.88Å
409	C	98.7	Very high	97	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-56.3	-42.7	170.2	-69	0	0	0	0	111.2	V321 L355 Q405 F406 Q412 L413	V321-C409 HydrophobicContact CG2-CB 3.96Å; L355-C409 HydrophobicContact CD1-CB 3.58Å; L355-C409 HydrophobicContact CD2-CB 3.82Å; L355-C409 HydrophobicContact CG-CB 4.36Å; Q405-C409 PolarHBondContact O-N 2.8Å; Q405-C409 PolarHBondContact O-SG 3.39Å; F406-C409 WeakPolarHBondContact O-CB 3.48Å; F406-C409 PolarHBondContact O-N 2.99Å; C409-Q412 PolarHBondContact O-N 2.78Å; C409-L413 WeakPolarHBondContact O-CG 3.46Å; C409-L413 PolarHBondContact O-N 2.8Å; C409-L413 VanDerWaalsContact O-N 3.16Å
410	V	98.8	Very high	97.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.2	-41	175.4	179	0	0	0	0	111.2	L355 L358 F370 F406 L407 E408 Q412 L413 T414 Y423 L428	L355-V410 HydrophobicContact CD2-CG2 3.84Å; L358-V410 HydrophobicContact CD2-CB 4.46Å; L358-V410 HydrophobicContact CD2-CG1 4.12Å; L358-V410 HydrophobicContact CD2-CG2 3.68Å; F370-V410 HydrophobicContact CE2-CG1 3.99Å; F370-V410 HydrophobicContact CE2-CG2 3.84Å; F370-V410 HydrophobicContact CZ-CB 4.42Å; F370-V410 HydrophobicContact CZ-CG1 4.09Å; F370-V410 HydrophobicContact CZ-CG2 3.95Å; F406-V410 HydrophobicContact CD2-CG2 4.35Å; F406-V410 HydrophobicContact CE1-CG2 4.41Å; F406-V410 HydrophobicContact CE2-CG2 3.94Å; F406-V410 HydrophobicContact CZ-CG2 3.98Å; F406-V410 WeakPolarHBondContact O-CG2 3.44Å; F406-V410 PolarHBondContact O-N 2.92Å; L407-V410 PolarHBondContact O-N 3.42Å; E408-V410 VanDerWaalsContact C-N 3.26Å; E408-V410 PolarHBondContact O-N 3.13Å; V410-Q412 PolarHBondContact O-N 3.45Å; V410-L413 WeakPolarHBondContact O-CB 3.38Å; V410-L413 PolarHBondContact O-N 2.91Å; V410-L413 VanDerWaalsContact O-N 3.11Å; V410-T414 PolarHBondContact O-N 2.81Å; V410-Y423 HydrophobicContact CG1-CE2 3.87Å; V410-L428 HydrophobicContact CB-CD1 4.39Å; V410-L428 HydrophobicContact CG1-CD1 4.03Å; V410-L428 HydrophobicContact CG1-CD2 3.94Å
411	Y	97.9	Very high	97.1	Very high	17 Å²	17	17.1 Å²	17.1	7%	0.067	9%	0.088	C	C	.	.	H	α-helix	trans	-57.3	-45.9	172.5	165.4	-101.6	0	0	0	112.2	L407 E408 L413 T414 E415 E425 W502	L407-Y411 PolarHBondContact O-N 2.9Å; E408-Y411 WeakPolarHBondContact O-CB 3.22Å; E408-Y411 PolarHBondContact O-N 3.2Å; E408-Y411 VanDerWaalsContact O-N 3.12Å; Y411-L413 PolarHBondContact O-N 3.15Å; Y411-T414 WeakPolarHBondContact CA-OG1 3.38Å; Y411-T414 PolarHBondContact O-N 2.78Å; Y411-T414 PolarHBondContact O-OG1 3.13Å; Y411-E415 HydrophobicContact CD2-CG 4.33Å; Y411-E415 HydrophobicContact CE1-CG 4.14Å; Y411-E415 HydrophobicContact CE2-CG 3.77Å; Y411-E415 PolarHBondContact O-N 3.2Å; Y411-E425 HydrophobicContact CD2-CG 4.17Å; Y411-E425 HydrophobicContact CE2-CG 4.27Å; Y411-W502 HydrophobicContact CD1-CB 3.81Å; Y411-W502 AromaticContact CD1-CD1 3.85Å; Y411-W502 AromaticContact CD1-CD2 3.81Å; Y411-W502 HydrophobicContact CD1-CD2 3.81Å; Y411-W502 HydrophobicContact CD1-CE3 4.35Å; Y411-W502 AromaticContact CD1-CG 3.58Å; Y411-W502 HydrophobicContact CD1-CG 3.58Å; Y411-W502 AromaticContact CD2-CD1 3.81Å; Y411-W502 HydrophobicContact CD2-CD2 4.18Å; Y411-W502 AromaticContact CD2-CE2 3.72Å; Y411-W502 HydrophobicContact CD2-CG 4.24Å; Y411-W502 HydrophobicContact CD2-CZ2 4.19Å; Y411-W502 AromaticContact CD2-NE1 3.5Å; Y411-W502 HydrophobicContact CE1-CB 3.68Å; Y411-W502 AromaticContact CE1-CD1 3.64Å; Y411-W502 HydrophobicContact CE1-CD2 4.35Å; Y411-W502 AromaticContact CE1-CG 3.64Å; Y411-W502 HydrophobicContact CE1-CG 3.64Å; Y411-W502 AromaticContact CE2-CD1 3.59Å; Y411-W502 HydrophobicContact CE2-CG 4.29Å; Y411-W502 AromaticContact CE2-NE1 3.6Å; Y411-W502 AromaticContact CG-CD1 3.93Å; Y411-W502 AromaticContact CG-CD2 3.72Å; Y411-W502 HydrophobicContact CG-CD2 3.72Å; Y411-W502 AromaticContact CG-CE2 3.69Å; Y411-W502 HydrophobicContact CG-CE3 4.25Å; Y411-W502 AromaticContact CG-CG 3.89Å; Y411-W502 HydrophobicContact CG-CG 3.89Å; Y411-W502 HydrophobicContact CG-CZ2 4.18Å; Y411-W502 AromaticContact CG-NE1 3.84Å; Y411-W502 AromaticContact CZ-CD1 3.5Å
412	Q	97.4	Very high	97.1	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.009	9%	0.09	C	C	.	.	H	α-helix	trans	-57.9	-37.6	175	-56.1	-58	-34	0	0	111.9	I317 E408 C409 V410 E415 Q416 F499 K500	I317-Q412 HydrophobicContact CG2-CG 3.88Å; E408-Q412 WeakPolarHBondContact O-CG 3.14Å; E408-Q412 PolarHBondContact O-N 3.39Å; C409-Q412 PolarHBondContact O-N 2.78Å; V410-Q412 PolarHBondContact O-N 3.45Å; Q412-E415 PolarHBondContact O-N 2.84Å; Q412-Q416 WeakPolarHBondContact O-CG 3.36Å; Q412-Q416 PolarHBondContact O-N 2.89Å; Q412-Q416 VanDerWaalsContact O-N 3.07Å; Q412-F499 HydrophobicContact CB-CD1 4.49Å; Q412-F499 HydrophobicContact CB-CE1 4.5Å; Q412-F499 HydrophobicContact CG-CD1 3.83Å; Q412-F499 HydrophobicContact CG-CE1 4.16Å; Q412-K500 PolarHBondContact NE2-O 2.95Å
413	L	97.8	Very high	97	Very high	4 Å²	4	17.8 Å²	17.8	2%	0.021	9%	0.09	C	C	.	.	H	α-helix	trans	-68.8	-38.8	175.1	-60.3	178.3	0	0	0	112.2	L355 L358 L359 C409 V410 Y411 E415 Q416 F417 F421 P492	L355-L413 HydrophobicContact CD2-CD1 4.3Å; L358-L413 HydrophobicContact CD2-CD1 4.2Å; L359-L413 HydrophobicContact CD2-CD1 3.78Å; L359-L413 HydrophobicContact CD2-CD2 3.87Å; L359-L413 HydrophobicContact CD2-CG 4.49Å; L359-L413 HydrophobicContact CG-CD1 4.45Å; C409-L413 WeakPolarHBondContact O-CG 3.46Å; C409-L413 PolarHBondContact O-N 2.8Å; C409-L413 VanDerWaalsContact O-N 3.16Å; V410-L413 WeakPolarHBondContact O-CB 3.38Å; V410-L413 PolarHBondContact O-N 2.91Å; V410-L413 VanDerWaalsContact O-N 3.11Å; Y411-L413 PolarHBondContact O-N 3.15Å; L413-E415 VanDerWaalsContact C-N 3.29Å; L413-E415 PolarHBondContact O-N 2.9Å; L413-Q416 PolarHBondContact O-N 3.18Å; L413-F417 WeakPolarHBondContact O-CD2 3.47Å; L413-F417 PolarHBondContact O-N 2.7Å; L413-F421 HydrophobicContact CB-CE2 3.92Å; L413-F421 HydrophobicContact CB-CZ 3.69Å; L413-F421 HydrophobicContact CD1-CZ 4.43Å; L413-P492 HydrophobicContact CD2-CB 3.61Å; L413-P492 HydrophobicContact CD2-CG 3.69Å
414	T	95.9	Very high	96.7	Very high	19 Å²	19	18 Å²	18	12%	0.117	9%	0.092	C	C	.	.	H	α-helix	trans	-64.5	-33.8	174.7	61.3	0	0	0	0	112.5	V410 Y411 F417 P418 F421 Y423	V410-T414 PolarHBondContact O-N 2.81Å; Y411-T414 WeakPolarHBondContact CA-OG1 3.38Å; Y411-T414 PolarHBondContact O-N 2.78Å; Y411-T414 PolarHBondContact O-OG1 3.13Å; T414-F417 CarbonylContact O-C 3.57Å; T414-P418 WeakPolarHBondContact O-CA 3.47Å; T414-F421 HydrophobicContact CG2-CB 4.17Å; T414-F421 HydrophobicContact CG2-CD1 4.4Å; T414-F421 HydrophobicContact CG2-CD2 3.74Å; T414-F421 HydrophobicContact CG2-CE2 4.22Å; T414-F421 HydrophobicContact CG2-CG 3.84Å; T414-Y423 HydrophobicContact CG2-CE2 4.23Å
415	E	93.8	Very high	96.4	Very high	72 Å²	72	19 Å²	19	34%	0.336	10%	0.096	S	C	.	.	H	α-helix	trans	-71	-36.8	175.4	-77.5	-72	115.4	0	0	112.8	Y411 Q412 L413 K500	Y411-E415 HydrophobicContact CD2-CG 4.33Å; Y411-E415 HydrophobicContact CE1-CG 4.14Å; Y411-E415 HydrophobicContact CE2-CG 3.77Å; Y411-E415 PolarHBondContact O-N 3.2Å; Q412-E415 PolarHBondContact O-N 2.84Å; L413-E415 VanDerWaalsContact C-N 3.29Å; L413-E415 PolarHBondContact O-N 2.9Å; E415-K500 WeakPolarHBondContact OE2-CD 3.41Å; E415-K500 WeakPolarHBondContact OE2-CE 3.47Å; E415-K500 IonicContact OE2-NZ 2.64Å; E415-K500 PolarHBondContact OE2-NZ 2.93Å
416	Q	94.8	Very high	96.1	Very high	48 Å²	48	23.9 Å²	23.9	22%	0.224	11%	0.114	C	C	.	.	H	α-helix	trans	-79	-30.2	176.1	-68.2	-167.8	32.3	0	0	112.9	Q412 L413 S493	Q412-Q416 WeakPolarHBondContact O-CG 3.36Å; Q412-Q416 PolarHBondContact O-N 2.89Å; Q412-Q416 VanDerWaalsContact O-N 3.07Å; L413-Q416 PolarHBondContact O-N 3.18Å; Q416-S493 PolarHBondContact NE2-O 3.35Å; Q416-S493 PolarHBondContact OE1-O 2.92Å
417	F	95.6	Very high	95.9	Very high	29 Å²	29	23.9 Å²	23.9	13%	0.127	11%	0.114	C	C	.	.			trans	-127.2	68.7	-178.1	-54.3	-74.9	0	0	0	113.2	L413 T414 Q419 A420 F421 L490 P492	L413-F417 WeakPolarHBondContact O-CD2 3.47Å; L413-F417 PolarHBondContact O-N 2.7Å; T414-F417 CarbonylContact O-C 3.57Å; F417-Q419 PolarHBondContact O-N 3.35Å; F417-A420 HydrophobicContact CB-CB 3.69Å; F417-A420 PolarHBondContact O-N 3.23Å; F417-F421 HydrophobicContact CB-CE2 4.29Å; F417-L490 HydrophobicContact CB-CD1 4.48Å; F417-L490 HydrophobicContact CD1-CD2 4.1Å; F417-L490 HydrophobicContact CD2-CB 4.39Å; F417-L490 HydrophobicContact CD2-CD1 3.96Å; F417-L490 HydrophobicContact CD2-CD2 4.45Å; F417-L490 HydrophobicContact CE1-CD2 4.36Å; F417-L490 HydrophobicContact CE2-CB 4.06Å; F417-L490 HydrophobicContact CE2-CD1 4.45Å; F417-L490 HydrophobicContact CG-CD1 4.23Å; F417-L490 HydrophobicContact CG-CD2 4.14Å; F417-L490 HydrophobicContact CZ-CB 4.28Å; F417-P492 HydrophobicContact CE2-CB 3.94Å; F417-P492 HydrophobicContact CZ-CB 4.44Å
418	P	93.2	Very high	95.9	Very high	68 Å²	68	23.9 Å²	23.9	44%	0.442	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-12.8	-172.8	-25.9	35.9	0	0	0	116.1	T414 N476	T414-P418 WeakPolarHBondContact O-CA 3.47Å; P418-N476 PolarHBondContact O-ND2 2.86Å
419	Q	93.6	Very high	95.7	Very high	70 Å²	70	24.2 Å²	24.2	33%	0.327	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-7.5	-179.4	-63.2	176.3	81.4	0	0	113.5	F417 F478 K480 Y483	F417-Q419 PolarHBondContact O-N 3.35Å; Q419-F478 WeakPolarHBondContact CA-O 3.39Å; Q419-F478 HydrophobicContact CG-CB 4.45Å; Q419-F478 WeakPolarHBondContact CG-O 3.46Å; Q419-K480 PolarHBondContact O-N 3.49Å; Q419-K480 VanDerWaalsContact OE1-CE 3.24Å; Q419-Y483 HydrophobicContact CB-CD1 4.24Å; Q419-Y483 HydrophobicContact CB-CD2 4.42Å; Q419-Y483 HydrophobicContact CB-CG 4.05Å
420	A	96.3	Very high	95.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-89.3	-19	-168.7	0	0	0	0	0	115.3	R365 F417 Y483 S484 L490	R365-A420 WeakPolarHBondContact CB-O 3.3Å; F417-A420 HydrophobicContact CB-CB 3.69Å; F417-A420 PolarHBondContact O-N 3.23Å; A420-Y483 HydrophobicContact CB-CD1 4.03Å; A420-Y483 HydrophobicContact CB-CE1 3.89Å; A420-S484 PolarHBondContact O-OG 3.09Å; A420-L490 HydrophobicContact CB-CD1 4.07Å; A420-L490 HydrophobicContact CB-CD2 4.18Å
421	F	97.6	Very high	95.5	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.009	12%	0.122	C	C	.	.			trans	-115.2	132.4	-173	-62.9	-86.7	0	0	0	111.1	L358 R365 L413 T414 F417 Y423 N476 Y479 L490	L358-F421 HydrophobicContact CD1-CE1 4.08Å; L358-F421 HydrophobicContact CD2-CE1 4.07Å; L358-F421 HydrophobicContact CG-CE1 4.06Å; R365-F421 HydrophobicContact CB-CD1 3.74Å; R365-F421 HydrophobicContact CB-CE1 4.07Å; R365-F421 HydrophobicContact CB-CG 4.47Å; R365-F421 HydrophobicContact CG-CD1 3.89Å; R365-F421 HydrophobicContact CG-CE1 3.67Å; R365-F421 HydrophobicContact CG-CZ 4.41Å; R365-F421 WeakPolarHBondContact O-CA 3.42Å; L413-F421 HydrophobicContact CB-CE2 3.92Å; L413-F421 HydrophobicContact CB-CZ 3.69Å; L413-F421 HydrophobicContact CD1-CZ 4.43Å; T414-F421 HydrophobicContact CG2-CB 4.17Å; T414-F421 HydrophobicContact CG2-CD1 4.4Å; T414-F421 HydrophobicContact CG2-CD2 3.74Å; T414-F421 HydrophobicContact CG2-CE2 4.22Å; T414-F421 HydrophobicContact CG2-CG 3.84Å; F417-F421 HydrophobicContact CB-CE2 4.29Å; F421-Y423 VanDerWaalsContact C-N 3.3Å; F421-Y423 HydrophobicContact CB-CE2 4.33Å; F421-Y423 HydrophobicContact CD1-CE1 4.12Å; F421-Y423 AromaticContact CD1-CE2 3.98Å; F421-Y423 HydrophobicContact CD1-CE2 3.98Å; F421-Y423 AromaticContact CD1-CZ 3.54Å; F421-Y423 VanDerWaalsContact CD1-OH 3.24Å; F421-Y423 WeakPolarHBondContact CD1-OH 3.48Å; F421-Y423 HydrophobicContact CG-CE2 4.42Å; F421-N476 WeakPolarHBondContact O-CB 3.47Å; F421-N476 PolarHBondContact O-ND2 2.95Å; F421-Y479 WeakPolarHBondContact O-CB 3.34Å; F421-Y479 WeakPolarHBondContact O-CD2 3.5Å; F421-L490 HydrophobicContact CE2-CD1 4.11Å; F421-L490 HydrophobicContact CZ-CD1 3.97Å
422	E	97.4	Very high	95.4	Very high	29 Å²	29	24.8 Å²	24.8	14%	0.136	12%	0.119	C	C	.	.	S	Bend	trans	-69.6	-30.5	177.7	-170.6	-170.8	-166.4	0	0	111.5	R365 T366 I367 K471 L475 N476 Y479	R365-E422 PolarHBondContact O-N 3.44Å; T366-E422 WeakPolarHBondContact CA-OE2 3.4Å; T366-E422 WeakPolarHBondContact CB-OE2 3.37Å; I367-E422 HydrophobicContact CD1-CG 4.29Å; I367-E422 HydrophobicContact CG1-CB 4.46Å; I367-E422 HydrophobicContact CG1-CG 4.31Å; I367-E422 PolarHBondContact N-OE2 3.47Å; E422-K471 WeakPolarHBondContact OE1-CE 3.37Å; E422-K471 IonicContact OE1-NZ 3.17Å; E422-K471 PolarHBondContact OE1-NZ 3.25Å; E422-K471 IonicContact OE2-NZ 2.7Å; E422-L475 HydrophobicContact CG-CD2 3.66Å; E422-L475 WeakPolarHBondContact O-CA 3.5Å; E422-N476 WeakPolarHBondContact O-CB 3.47Å; E422-N476 PolarHBondContact O-N 2.78Å; E422-Y479 HydrophobicContact CB-CD1 3.94Å; E422-Y479 HydrophobicContact CB-CD2 4.35Å; E422-Y479 HydrophobicContact CB-CE1 3.93Å; E422-Y479 HydrophobicContact CB-CE2 4.33Å; E422-Y479 HydrophobicContact CB-CG 4.15Å; E422-Y479 HydrophobicContact CG-CD1 3.92Å; E422-Y479 HydrophobicContact CG-CE1 4.01Å
423	Y	96.8	Very high	95.2	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-91.9	150	178.5	49.9	-93.1	0	0	0	113	R365 I367 F370 V410 T414 F421 F427 L428 Y474	R365-Y423 WeakPolarHBondContact O-CE1 3.35Å; I367-Y423 HydrophobicContact CG1-CD1 4.35Å; F370-Y423 HydrophobicContact CB-CD1 4.28Å; F370-Y423 HydrophobicContact CB-CE1 3.66Å; F370-Y423 HydrophobicContact CD2-CE1 4.09Å; F370-Y423 AromaticContact CD2-CZ 3.79Å; F370-Y423 WeakPolarHBondContact CD2-OH 3.46Å; F370-Y423 AromaticContact CG-CE1 3.86Å; F370-Y423 HydrophobicContact CG-CE1 3.86Å; F370-Y423 AromaticContact CG-CZ 3.9Å; V410-Y423 HydrophobicContact CG1-CE2 3.87Å; T414-Y423 HydrophobicContact CG2-CE2 4.23Å; F421-Y423 VanDerWaalsContact C-N 3.3Å; F421-Y423 HydrophobicContact CB-CE2 4.33Å; F421-Y423 HydrophobicContact CD1-CE1 4.12Å; F421-Y423 AromaticContact CD1-CE2 3.98Å; F421-Y423 HydrophobicContact CD1-CE2 3.98Å; F421-Y423 AromaticContact CD1-CZ 3.54Å; F421-Y423 VanDerWaalsContact CD1-OH 3.24Å; F421-Y423 WeakPolarHBondContact CD1-OH 3.48Å; F421-Y423 HydrophobicContact CG-CE2 4.42Å; Y423-F427 VanDerWaalsContact CB-CD1 3.41Å; Y423-F427 HydrophobicContact CD1-CD1 4.06Å; Y423-F427 HydrophobicContact CD1-CE1 4.13Å; Y423-F427 AromaticContact CD2-CD1 3.93Å; Y423-F427 HydrophobicContact CD2-CD1 3.93Å; Y423-F427 AromaticContact CG-CD1 3.54Å; Y423-F427 HydrophobicContact CG-CD1 3.54Å; Y423-F427 HydrophobicContact CG-CE1 4.09Å; Y423-F427 HydrophobicContact CG-CG 4.4Å; Y423-L428 HydrophobicContact CD2-CD2 4.15Å; Y423-L428 HydrophobicContact CD2-CG 4.44Å; Y423-L428 HydrophobicContact CE2-CD2 3.89Å; Y423-L428 HydrophobicContact CE2-CG 4.46Å; Y423-Y474 CarbonylContact C-O 3.54Å; Y423-Y474 WeakPolarHBondContact CA-O 3.11Å
424	S	92.2	Very high	95.1	Very high	9 Å²	9	27 Å²	27	6%	0.063	13%	0.13	C	C	.	.			trans	-92.5	170.8	171.2	63.8	0	0	0	0	112.1	W426 F427 Y474	S424-W426 PolarHBondContact O-N 3.05Å; S424-W426 VanDerWaalsContact O-N 3.12Å; S424-F427 WeakPolarHBondContact O-CB 3.38Å; S424-F427 PolarHBondContact O-N 3.35Å; S424-F427 VanDerWaalsContact O-N 3.1Å; S424-Y474 WeakPolarHBondContact CB-O 3.33Å; S424-Y474 PolarHBondContact N-O 3.32Å; S424-Y474 PolarHBondContact OG-O 2.84Å
425	E	92.6	Very high	95	Very high	30 Å²	30	26.1 Å²	26.1	14%	0.14	13%	0.125	C	C	.	.	H	α-helix	trans	-48.1	-35.8	171.6	-177.8	-175.7	-154.4	0	0	113.5	Y411 F427 L428 L429 W502 N504	Y411-E425 HydrophobicContact CD2-CG 4.17Å; Y411-E425 HydrophobicContact CE2-CG 4.27Å; E425-F427 VanDerWaalsContact C-N 3.26Å; E425-F427 PolarHBondContact O-N 3.43Å; E425-L428 PolarHBondContact O-N 2.98Å; E425-L428 VanDerWaalsContact O-N 3.13Å; E425-L429 HydrophobicContact CG-CD1 4.17Å; E425-L429 HydrophobicContact CG-CG 4.48Å; E425-L429 PolarHBondContact O-N 3.23Å; E425-L429 VanDerWaalsContact O-N 3.12Å; E425-W502 HydrophobicContact CG-CZ2 4.2Å; E425-W502 PolarHBondContact OE1-NE1 2.91Å; E425-N504 VanDerWaalsContact OE1-CB 3.29Å; E425-N504 WeakPolarHBondContact OE1-CB 3.44Å; E425-N504 PolarHBondContact OE1-ND2 3.09Å; E425-N504 PolarHBondContact OE2-ND2 3.39Å
426	W	91.1	Very high	94.9	Very high	101 Å²	101	23.5 Å²	23.5	38%	0.383	11%	0.112	S	C	.	.	H	α-helix	trans	-60.8	-34.9	-178.6	-173	-124.6	0	0	0	112.7	S424 L429 Q430 Y474	S424-W426 PolarHBondContact O-N 3.05Å; S424-W426 VanDerWaalsContact O-N 3.12Å; W426-L429 HydrophobicContact CE3-CB 4.38Å; W426-L429 HydrophobicContact CE3-CD1 4.1Å; W426-L429 HydrophobicContact CZ3-CD1 4.48Å; W426-L429 PolarHBondContact O-N 2.88Å; W426-Q430 HydrophobicContact CD2-CG 4.47Å; W426-Q430 HydrophobicContact CZ2-CG 4.44Å; W426-Q430 WeakPolarHBondContact O-CG 3.47Å; W426-Q430 PolarHBondContact O-N 2.83Å; W426-Y474 AromaticContact CD1-CD1 3.59Å; W426-Y474 AromaticContact CD1-CE1 3.51Å; W426-Y474 HydrophobicContact CG-CD1 4.38Å; W426-Y474 HydrophobicContact CG-CE1 4.46Å; W426-Y474 AromaticContact NE1-CE1 3.74Å
427	F	96.3	Very high	94.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.1	-44.2	175.6	-173.6	-124.5	0	0	0	112	I367 F370 M371 Y423 S424 E425 L429 Q430 I431 L467 Y474	I367-F427 HydrophobicContact CG2-CE2 4.1Å; I367-F427 HydrophobicContact CG2-CZ 3.93Å; F370-F427 HydrophobicContact CB-CE1 4.27Å; F370-F427 HydrophobicContact CD1-CD1 4.37Å; F370-F427 AromaticContact CD1-CE1 3.72Å; F370-F427 HydrophobicContact CD1-CE1 3.72Å; F370-F427 HydrophobicContact CG-CE1 4.39Å; M371-F427 HydrophobicContact CE-CE2 3.69Å; M371-F427 HydrophobicContact CE-CZ 3.68Å; M371-F427 HydrophobicContact CG-CZ 4.13Å; Y423-F427 VanDerWaalsContact CB-CD1 3.41Å; Y423-F427 HydrophobicContact CD1-CD1 4.06Å; Y423-F427 HydrophobicContact CD1-CE1 4.13Å; Y423-F427 AromaticContact CD2-CD1 3.93Å; Y423-F427 HydrophobicContact CD2-CD1 3.93Å; Y423-F427 AromaticContact CG-CD1 3.54Å; Y423-F427 HydrophobicContact CG-CD1 3.54Å; Y423-F427 HydrophobicContact CG-CE1 4.09Å; Y423-F427 HydrophobicContact CG-CG 4.4Å; S424-F427 WeakPolarHBondContact O-CB 3.38Å; S424-F427 PolarHBondContact O-N 3.35Å; S424-F427 VanDerWaalsContact O-N 3.1Å; E425-F427 VanDerWaalsContact C-N 3.26Å; E425-F427 PolarHBondContact O-N 3.43Å; F427-L429 VanDerWaalsContact C-N 3.34Å; F427-L429 PolarHBondContact O-N 2.83Å; F427-Q430 PolarHBondContact O-N 3.02Å; F427-I431 HydrophobicContact CD1-CD1 3.98Å; F427-I431 HydrophobicContact CD2-CD1 4.49Å; F427-I431 HydrophobicContact CE1-CD1 3.72Å; F427-I431 HydrophobicContact CE2-CD1 4.23Å; F427-I431 HydrophobicContact CG-CD1 4.37Å; F427-I431 HydrophobicContact CZ-CD1 3.85Å; F427-I431 WeakPolarHBondContact O-CG1 3.3Å; F427-I431 PolarHBondContact O-N 3.2Å; F427-L467 HydrophobicContact CD2-CD1 4.46Å; F427-L467 HydrophobicContact CE2-CB 4.23Å; F427-L467 HydrophobicContact CE2-CD1 3.89Å; F427-Y474 HydrophobicContact CB-CD1 4.23Å; F427-Y474 HydrophobicContact CB-CG 4.28Å; F427-Y474 HydrophobicContact CD2-CD1 4.22Å; F427-Y474 HydrophobicContact CD2-CD2 4.06Å; F427-Y474 AromaticContact CD2-CG 3.78Å; F427-Y474 HydrophobicContact CD2-CG 3.78Å; F427-Y474 HydrophobicContact CG-CG 4.46Å
428	L	97.2	Very high	94.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66	-38.9	179.5	-54.7	177.7	0	0	0	111.2	F370 L407 V410 Y423 E425 I431 H432 W502	F370-L428 HydrophobicContact CE1-CD2 3.77Å; F370-L428 HydrophobicContact CZ-CD2 3.98Å; L407-L428 HydrophobicContact CD2-CD2 4.31Å; V410-L428 HydrophobicContact CB-CD1 4.39Å; V410-L428 HydrophobicContact CG1-CD1 4.03Å; V410-L428 HydrophobicContact CG1-CD2 3.94Å; Y423-L428 HydrophobicContact CD2-CD2 4.15Å; Y423-L428 HydrophobicContact CD2-CG 4.44Å; Y423-L428 HydrophobicContact CE2-CD2 3.89Å; Y423-L428 HydrophobicContact CE2-CG 4.46Å; E425-L428 PolarHBondContact O-N 2.98Å; E425-L428 VanDerWaalsContact O-N 3.13Å; L428-I431 PolarHBondContact O-N 3.37Å; L428-H432 PolarHBondContact O-N 3.37Å; L428-W502 HydrophobicContact CB-CH2 3.8Å; L428-W502 HydrophobicContact CB-CZ2 4.08Å; L428-W502 HydrophobicContact CD1-CH2 4.33Å; L428-W502 HydrophobicContact CD1-CZ2 4.49Å
429	L	94.3	Very high	94.6	Very high	7 Å²	7	18.3 Å²	18.3	4%	0.037	8%	0.083	C	C	.	.	H	α-helix	trans	-65.4	-41.3	175	-66.1	172.2	0	0	0	112	E425 W426 F427 H432 E433 W502 N504 M505	E425-L429 HydrophobicContact CG-CD1 4.17Å; E425-L429 HydrophobicContact CG-CG 4.48Å; E425-L429 PolarHBondContact O-N 3.23Å; E425-L429 VanDerWaalsContact O-N 3.12Å; W426-L429 HydrophobicContact CE3-CB 4.38Å; W426-L429 HydrophobicContact CE3-CD1 4.1Å; W426-L429 HydrophobicContact CZ3-CD1 4.48Å; W426-L429 PolarHBondContact O-N 2.88Å; F427-L429 VanDerWaalsContact C-N 3.34Å; F427-L429 PolarHBondContact O-N 2.83Å; L429-H432 PolarHBondContact O-N 3.48Å; L429-E433 WeakPolarHBondContact O-CB 3.1Å; L429-E433 PolarHBondContact O-N 3.33Å; L429-W502 HydrophobicContact CD2-CH2 4.43Å; L429-W502 HydrophobicContact CD2-CZ2 3.79Å; L429-W502 HydrophobicContact CG-CZ2 4.1Å; L429-N504 HydrophobicContact CD1-CB 4.2Å; L429-M505 HydrophobicContact CD2-CB 4.05Å; L429-M505 HydrophobicContact CD2-CE 3.78Å; L429-M505 HydrophobicContact CD2-SD 3.92Å
430	Q	95.2	Very high	94.7	Very high	26 Å²	26	15.6 Å²	15.6	12%	0.121	7%	0.07	C	C	.	.	H	α-helix	trans	-66.5	-37.6	175.2	-68.7	-53.6	-82	0	0	112.8	W426 F427 E433 H434 L467 Y474	W426-Q430 HydrophobicContact CD2-CG 4.47Å; W426-Q430 HydrophobicContact CZ2-CG 4.44Å; W426-Q430 WeakPolarHBondContact O-CG 3.47Å; W426-Q430 PolarHBondContact O-N 2.83Å; F427-Q430 PolarHBondContact O-N 3.02Å; Q430-E433 PolarHBondContact O-N 2.78Å; Q430-H434 PolarHBondContact O-CD2 3.17Å; Q430-H434 VanDerWaalsContact O-CD2 3.24Å; Q430-H434 PolarHBondContact O-N 3.4Å; Q430-L467 HydrophobicContact CB-CD2 4.1Å; Q430-Y474 HydrophobicContact CB-CE1 4.32Å; Q430-Y474 HydrophobicContact CG-CE1 3.64Å
431	I	97.8	Very high	94.8	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.6	-47.5	172.8	-69.3	169.5	0	0	0	109.9	F370 I374 F403 L407 F427 L428 E433 H434 V435 F443 W464 L467	F370-I431 HydrophobicContact CD1-CD1 3.98Å; F370-I431 HydrophobicContact CE1-CD1 3.89Å; I374-I431 HydrophobicContact CD1-CD1 4.11Å; I374-I431 HydrophobicContact CD1-CG2 4.37Å; F403-I431 HydrophobicContact CE1-CG2 3.81Å; F403-I431 HydrophobicContact CZ-CG2 4.17Å; L407-I431 HydrophobicContact CD1-CG2 4.1Å; L407-I431 HydrophobicContact CD2-CG2 4.17Å; F427-I431 HydrophobicContact CD1-CD1 3.98Å; F427-I431 HydrophobicContact CD2-CD1 4.49Å; F427-I431 HydrophobicContact CE1-CD1 3.72Å; F427-I431 HydrophobicContact CE2-CD1 4.23Å; F427-I431 HydrophobicContact CG-CD1 4.37Å; F427-I431 HydrophobicContact CZ-CD1 3.85Å; F427-I431 WeakPolarHBondContact O-CG1 3.3Å; F427-I431 PolarHBondContact O-N 3.2Å; L428-I431 PolarHBondContact O-N 3.37Å; I431-E433 PolarHBondContact O-N 3.14Å; I431-H434 PolarHBondContact O-N 3.39Å; I431-V435 HydrophobicContact CG2-CG2 4.42Å; I431-V435 VanDerWaalsContact O-CG2 3.24Å; I431-V435 WeakPolarHBondContact O-CG2 3.36Å; I431-V435 PolarHBondContact O-N 3.08Å; I431-F443 HydrophobicContact CG2-CE2 4.46Å; I431-F443 HydrophobicContact CG2-CZ 4.11Å; I431-W464 HydrophobicContact CD1-CZ3 4.34Å; I431-W464 HydrophobicContact CG1-CZ3 4.26Å; I431-L467 HydrophobicContact CG1-CD1 3.92Å
432	H	96.3	Very high	94.7	Very high	3 Å²	3	15.6 Å²	15.6	1%	0.014	7%	0.07	C	C	.	.	H	α-helix	trans	-59.7	-44.3	177.7	-173	-97.4	0	0	0	112.8	F80 T404 L407 L428 L429 H434 V435 H436 M505	F80-H432 AromaticContact CE2-CE1 3.4Å; F80-H432 VanDerWaalsContact CE2-CE1 3.4Å; F80-H432 WeakPolarHBondContact CE2-CE1 3.4Å; F80-H432 AromaticContact CE2-NE2 3.8Å; F80-H432 AromaticContact CZ-CE1 3.77Å; F80-H432 AromaticContact CZ-NE2 3.9Å; T404-H432 WeakPolarHBondContact CG2-NE2 3.35Å; T404-H432 PolarHBondContact OG1-CD2 2.94Å; T404-H432 PolarHBondContact OG1-NE2 3.48Å; L407-H432 HydrophobicContact CD1-CB 3.82Å; L428-H432 PolarHBondContact O-N 3.37Å; L429-H432 PolarHBondContact O-N 3.48Å; H432-H434 VanDerWaalsContact C-N 3.3Å; H432-H434 PolarHBondContact O-N 2.95Å; H432-V435 PolarHBondContact O-N 3.35Å; H432-H436 AromaticContact CE1-CD2 3.94Å; H432-H436 AromaticContact NE2-NE2 3.81Å; H432-H436 PolarHBondContact O-CD2 2.72Å; H432-M505 HydrophobicContact CB-CE 3.76Å; H432-M505 HydrophobicContact CB-SD 4.37Å; H432-M505 PolarHBondContact ND1-SD 3Å; H432-M505 VanDerWaalsContact ND1-SD 3.41Å
433	E	93.2	Very high	94.7	Very high	36 Å²	36	14.5 Å²	14.5	17%	0.168	7%	0.065	C	C	.	.	H	α-helix	trans	-57.5	-44.5	176	-175.1	70.4	170.9	0	0	111.5	H57 N79 L429 Q430 I431 H436 S437	H57-E433 VanDerWaalsContact CE1-CD 3.48Å; H57-E433 IonicContact CE1-OE1 3.47Å; H57-E433 PolarHBondContact CE1-OE1 2.63Å; H57-E433 IonicContact ND1-OE1 2.68Å; H57-E433 PolarHBondContact NE2-O 3.48Å; H57-E433 IonicContact NE2-OE1 3.89Å; H57-E433 IonicContact NE2-OE2 2.79Å; N79-E433 WeakPolarHBondContact CB-OE2 3.39Å; N79-E433 VanDerWaalsContact ND2-CD 3.33Å; N79-E433 PolarHBondContact ND2-OE1 3.13Å; N79-E433 VanDerWaalsContact ND2-OE1 3.14Å; N79-E433 PolarHBondContact ND2-OE2 3.12Å; L429-E433 WeakPolarHBondContact O-CB 3.1Å; L429-E433 PolarHBondContact O-N 3.33Å; Q430-E433 PolarHBondContact O-N 2.78Å; I431-E433 PolarHBondContact O-N 3.14Å; E433-H436 PolarHBondContact O-N 3.29Å; E433-S437 WeakPolarHBondContact O-CB 3.48Å; E433-S437 PolarHBondContact O-N 3.5Å
434	H	95.5	Very high	94.7	Very high	16 Å²	16	14.5 Å²	14.5	7%	0.074	7%	0.065	C	C	.	.	H	α-helix	trans	-78.7	-27.4	-175.2	-75.1	-54.7	0	0	0	114.7	Q430 I431 H432 H436 S437 Q439 Y440 L463 Y466	Q430-H434 PolarHBondContact O-CD2 3.17Å; Q430-H434 VanDerWaalsContact O-CD2 3.24Å; Q430-H434 PolarHBondContact O-N 3.4Å; I431-H434 PolarHBondContact O-N 3.39Å; H432-H434 VanDerWaalsContact C-N 3.3Å; H432-H434 PolarHBondContact O-N 2.95Å; H434-H436 PolarHBondContact O-N 3.16Å; H434-S437 VanDerWaalsContact CA-OG 3.29Å; H434-S437 WeakPolarHBondContact CA-OG 3.29Å; H434-S437 PolarHBondContact ND1-OG 3.47Å; H434-S437 PolarHBondContact O-N 3.31Å; H434-S437 PolarHBondContact O-OG 2.98Å; H434-Q439 PolarHBondContact CE1-OE1 3.14Å; H434-Q439 VanDerWaalsContact CE1-OE1 3.32Å; H434-Y440 HydrophobicContact CB-CD2 4.36Å; H434-Y440 AromaticContact CE1-CE2 3.65Å; H434-Y440 AromaticContact CG-CE2 3.99Å; H434-Y440 AromaticContact ND1-CD2 3.79Å; H434-Y440 AromaticContact ND1-CE2 3.62Å; H434-Y440 AromaticContact NE2-CE2 3.99Å; H434-L463 HydrophobicContact CB-CD1 3.76Å; H434-L463 HydrophobicContact CB-CD2 3.86Å; H434-L463 HydrophobicContact CB-CG 4.46Å; H434-L463 VanDerWaalsContact CD2-CD1 3.46Å; H434-L463 WeakPolarHBondContact CD2-CD1 3.32Å; H434-Y466 AromaticContact NE2-CE1 3.76Å
435	V	94.9	Very high	94.9	Very high	2 Å²	2	14 Å²	14	1%	0.012	6%	0.062	C	C	.	.	H	α-helix	trans	-54	-38.6	168	168.3	0	0	0	0	111.7	F385 C389 F403 I431 H432 F443	F385-V435 HydrophobicContact CD1-CG1 4.38Å; C389-V435 HydrophobicContact CB-CG1 4.46Å; C389-V435 VanDerWaalsContact SG-CG1 3.52Å; F403-V435 HydrophobicContact CD1-CG1 4.45Å; F403-V435 HydrophobicContact CD1-CG2 3.68Å; F403-V435 HydrophobicContact CE1-CG2 3.55Å; I431-V435 HydrophobicContact CG2-CG2 4.42Å; I431-V435 VanDerWaalsContact O-CG2 3.24Å; I431-V435 WeakPolarHBondContact O-CG2 3.36Å; I431-V435 PolarHBondContact O-N 3.08Å; H432-V435 PolarHBondContact O-N 3.35Å; V435-F443 HydrophobicContact CB-CD2 4.22Å; V435-F443 HydrophobicContact CB-CG 4.45Å; V435-F443 HydrophobicContact CG2-CD1 4.02Å; V435-F443 HydrophobicContact CG2-CD2 3.56Å; V435-F443 HydrophobicContact CG2-CE1 3.96Å; V435-F443 HydrophobicContact CG2-CE2 3.47Å; V435-F443 VanDerWaalsContact CG2-CE2 3.47Å; V435-F443 HydrophobicContact CG2-CG 3.83Å; V435-F443 HydrophobicContact CG2-CZ 3.69Å
436	H	91.6	Very high	95.1	Very high	17 Å²	17	13.6 Å²	13.6	8%	0.079	6%	0.06	C	C	.	.	H	α-helix	trans	-94.5	-22.1	179.5	-65.3	-64.4	0	0	0	114	R78 H432 E433 H434 C438	R78-H436 HydrophobicContact CB-CB 3.9Å; H432-H436 AromaticContact CE1-CD2 3.94Å; H432-H436 AromaticContact NE2-NE2 3.81Å; H432-H436 PolarHBondContact O-CD2 2.72Å; E433-H436 PolarHBondContact O-N 3.29Å; H434-H436 PolarHBondContact O-N 3.16Å; H436-C438 PolarHBondContact O-N 3.43Å
437	S	90.7	Very high	95.4	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-61.8	-28.4	-178.3	71.5	0	0	0	0	114.5	H57 E433 H434 Q439	H57-S437 WeakPolarHBondContact NE2-CA 3.46Å; H57-S437 PolarHBondContact NE2-N 3.06Å; E433-S437 WeakPolarHBondContact O-CB 3.48Å; E433-S437 PolarHBondContact O-N 3.5Å; H434-S437 VanDerWaalsContact CA-OG 3.29Å; H434-S437 WeakPolarHBondContact CA-OG 3.29Å; H434-S437 PolarHBondContact ND1-OG 3.47Å; H434-S437 PolarHBondContact O-N 3.31Å; H434-S437 PolarHBondContact O-OG 2.98Å; S437-Q439 PolarHBondContact O-N 3.21Å; S437-Q439 VanDerWaalsContact O-N 3.13Å; S437-Q439 WeakPolarHBondContact OG-CB 3.28Å; S437-Q439 PolarHBondContact OG-N 3.41Å; S437-Q439 VanDerWaalsContact OG-N 3.08Å
438	C	92.8	Very high	95.4	Very high	6 Å²	6	11.5 Å²	11.5	4%	0.041	6%	0.056	C	C	.	.			trans	49.7	28.7	-166.2	-56.4	0	0	0	0	113.6	H56 L112 Y113 A114 H436 L444	H56-C438 HydrophobicContact CB-CB 4.07Å; L112-C438 HydrophobicContact CB-CB 4.35Å; Y113-C438 CarbonylContact C-O 3.42Å; A114-C438 WeakPolarHBondContact CA-O 3.47Å; A114-C438 VanDerWaalsContact CB-O 3.3Å; A114-C438 WeakPolarHBondContact CB-O 3.47Å; A114-C438 PolarHBondContact N-O 3.37Å; H436-C438 PolarHBondContact O-N 3.43Å; C438-L444 HydrophobicContact CB-CD2 4.12Å
439	Q	93.7	Very high	95.4	Very high	30 Å²	30	15 Å²	15	14%	0.14	7%	0.069	C	C	.	.			trans	-82.7	-26.4	178.9	-179.1	177.3	-3.8	0	0	113.2	Y113 A114 Y117 H434 S437	Y113-Q439 HydrophobicContact CD1-CB 3.81Å; Y113-Q439 HydrophobicContact CD1-CG 3.96Å; Y113-Q439 HydrophobicContact CE1-CB 4.06Å; Y113-Q439 HydrophobicContact CE1-CG 3.72Å; A114-Q439 WeakPolarHBondContact CA-O 3.41Å; Y117-Q439 HydrophobicContact CD1-CG 3.97Å; Y117-Q439 WeakPolarHBondContact CD1-O 3.28Å; Y117-Q439 HydrophobicContact CD2-CG 4.07Å; Y117-Q439 HydrophobicContact CE1-CG 4.13Å; Y117-Q439 HydrophobicContact CE2-CG 4.24Å; Y117-Q439 VanDerWaalsContact CE2-NE2 3.27Å; Y117-Q439 HydrophobicContact CG-CG 3.94Å; Y117-Q439 VanDerWaalsContact CZ-NE2 3.26Å; Y117-Q439 PolarHBondContact OH-NE2 3.17Å; H434-Q439 PolarHBondContact CE1-OE1 3.14Å; H434-Q439 VanDerWaalsContact CE1-OE1 3.32Å; S437-Q439 PolarHBondContact O-N 3.21Å; S437-Q439 VanDerWaalsContact O-N 3.13Å; S437-Q439 WeakPolarHBondContact OG-CB 3.28Å; S437-Q439 PolarHBondContact OG-N 3.41Å; S437-Q439 VanDerWaalsContact OG-N 3.08Å
440	Y	96.3	Very high	95.5	Very high	12 Å²	12	16.8 Å²	16.8	5%	0.047	8%	0.077	C	C	.	.	S	Bend	trans	-124.6	153.4	-177.8	-61.1	-76.1	0	0	0	110.5	Y117 H434 N442 H461 L463 Y466	Y117-Y440 HydrophobicContact CD1-CE1 4.45Å; Y117-Y440 HydrophobicContact CE1-CD1 4.32Å; Y117-Y440 AromaticContact CE1-CE1 3.71Å; Y117-Y440 HydrophobicContact CE1-CE1 3.71Å; H434-Y440 HydrophobicContact CB-CD2 4.36Å; H434-Y440 AromaticContact CE1-CE2 3.65Å; H434-Y440 AromaticContact CG-CE2 3.99Å; H434-Y440 AromaticContact ND1-CD2 3.79Å; H434-Y440 AromaticContact ND1-CE2 3.62Å; H434-Y440 AromaticContact NE2-CE2 3.99Å; Y440-N442 PolarHBondContact O-N 2.96Å; Y440-H461 WeakPolarHBondContact CA-O 3.32Å; Y440-H461 WeakPolarHBondContact CB-O 3.43Å; Y440-H461 HydrophobicContact CD1-CB 4.15Å; Y440-H461 HydrophobicContact CE1-CB 4.46Å; Y440-L463 HydrophobicContact CD1-CB 4.46Å; Y440-L463 HydrophobicContact CD2-CB 3.94Å; Y440-L463 HydrophobicContact CD2-CD1 3.56Å; Y440-L463 HydrophobicContact CD2-CG 4.32Å; Y440-L463 HydrophobicContact CE2-CD1 3.63Å; Y440-L463 HydrophobicContact CG-CB 3.84Å; Y440-L463 HydrophobicContact CG-CD1 4.31Å; Y440-Y466 HydrophobicContact CE2-CD1 4.19Å; Y440-Y466 AromaticContact CZ-CD1 3.96Å; Y440-Y466 AromaticContact CZ-CG 3.96Å; Y440-Y466 WeakPolarHBondContact OH-CB 3.39Å; Y440-Y466 VanDerWaalsContact OH-CD1 3.3Å; Y440-Y466 WeakPolarHBondContact OH-CD1 3.39Å
441	G	96.6	Very high	95.6	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	-73.7	-22.3	-172.5	0	0	0	0	0	115.9	F443 L444 L456 T460 H461	G441-F443 VanDerWaalsContact C-N 3.3Å; G441-F443 PolarHBondContact O-N 3.42Å; G441-F443 VanDerWaalsContact O-N 3.16Å; G441-L444 WeakPolarHBondContact O-CB 3.33Å; G441-L444 PolarHBondContact O-N 3.22Å; G441-L456 WeakPolarHBondContact O-CD1 3.08Å; G441-T460 VanDerWaalsContact CA-OG1 3.3Å; G441-T460 WeakPolarHBondContact CA-OG1 3.41Å; G441-H461 PolarHBondContact N-O 3.09Å
442	N	97.2	Very high	95.5	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.016	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-39.7	-163.9	-58.5	78.8	0	0	0	113.7	W130 E375 I379 Y440 S462 L463 W464	W130-N442 VanDerWaalsContact CZ3-ND2 3.27Å; W130-N442 WeakPolarHBondContact CZ3-ND2 3.3Å; E375-N442 PolarHBondContact OE1-ND2 3.25Å; I379-N442 HydrophobicContact CD1-CB 4.09Å; I379-N442 WeakPolarHBondContact CD1-O 3.45Å; Y440-N442 PolarHBondContact O-N 2.96Å; N442-S462 WeakPolarHBondContact OD1-CA 3.12Å; N442-L463 PolarHBondContact OD1-N 3.24Å; N442-W464 VanDerWaalsContact ND2-CD1 3.3Å; N442-W464 PolarHBondContact ND2-NE1 2.64Å; N442-W464 VanDerWaalsContact ND2-NE1 3.11Å
443	F	97.4	Very high	95.5	Very high	5 Å²	5	24.8 Å²	24.8	2%	0.022	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	3.3	-178.5	-60.8	-62.8	0	0	0	113.7	I374 I379 F385 Q391 F403 I431 V435 G441 L463 W464	I374-F443 HydrophobicContact CG2-CE1 3.73Å; I374-F443 HydrophobicContact CG2-CZ 4.08Å; I379-F443 HydrophobicContact CD1-CD1 4.24Å; I379-F443 HydrophobicContact CD1-CE1 4.09Å; I379-F443 HydrophobicContact CG1-CD1 4.46Å; I379-F443 HydrophobicContact CG1-CE1 4.48Å; F385-F443 WeakPolarHBondContact CB-O 3.48Å; F385-F443 HydrophobicContact CD1-CB 4.31Å; F385-F443 AromaticContact CD1-CD1 3.88Å; F385-F443 HydrophobicContact CD1-CD1 3.88Å; F385-F443 HydrophobicContact CD1-CG 4.47Å; F385-F443 HydrophobicContact CD2-CD1 4.27Å; F385-F443 AromaticContact CE1-CD1 3.5Å; F385-F443 HydrophobicContact CE1-CD1 3.5Å; F385-F443 AromaticContact CE1-CE1 3.93Å; F385-F443 HydrophobicContact CE1-CE1 3.93Å; F385-F443 HydrophobicContact CE1-CG 4.43Å; F385-F443 AromaticContact CE2-CD1 3.93Å; F385-F443 HydrophobicContact CE2-CD1 3.93Å; F385-F443 HydrophobicContact CE2-CE1 4.42Å; F385-F443 HydrophobicContact CG-CB 4.39Å; F385-F443 HydrophobicContact CG-CD1 4.25Å; F385-F443 AromaticContact CZ-CD1 3.53Å; F385-F443 HydrophobicContact CZ-CD1 3.53Å; F385-F443 AromaticContact CZ-CE1 3.76Å; F385-F443 HydrophobicContact CZ-CE1 3.76Å; Q391-F443 PolarHBondContact NE2-O 2.96Å; F403-F443 HydrophobicContact CE1-CE1 4.11Å; F403-F443 HydrophobicContact CE1-CZ 4.18Å; F403-F443 HydrophobicContact CZ-CE1 4.1Å; F403-F443 HydrophobicContact CZ-CZ 4.3Å; I431-F443 HydrophobicContact CG2-CE2 4.46Å; I431-F443 HydrophobicContact CG2-CZ 4.11Å; V435-F443 HydrophobicContact CB-CD2 4.22Å; V435-F443 HydrophobicContact CB-CG 4.45Å; V435-F443 HydrophobicContact CG2-CD1 4.02Å; V435-F443 HydrophobicContact CG2-CD2 3.56Å; V435-F443 HydrophobicContact CG2-CE1 3.96Å; V435-F443 HydrophobicContact CG2-CE2 3.47Å; V435-F443 VanDerWaalsContact CG2-CE2 3.47Å; V435-F443 HydrophobicContact CG2-CG 3.83Å; V435-F443 HydrophobicContact CG2-CZ 3.69Å; G441-F443 VanDerWaalsContact C-N 3.3Å; G441-F443 PolarHBondContact O-N 3.42Å; G441-F443 VanDerWaalsContact O-N 3.16Å; F443-L463 HydrophobicContact CD2-CD2 4.36Å; F443-L463 HydrophobicContact CE2-CD2 3.6Å; F443-L463 HydrophobicContact CZ-CD2 4.48Å; F443-W464 HydrophobicContact CE2-CH2 4.44Å; F443-W464 AromaticContact CZ-CH2 3.89Å; F443-W464 HydrophobicContact CZ-CH2 3.89Å; F443-W464 HydrophobicContact CZ-CZ2 4.23Å
444	L	96.6	Very high	95.7	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	11%	0.111	C	C	.	.			trans	-77.9	143.4	178.8	-58.5	-172.7	0	0	0	111.3	L112 A114 F115 C438 G441 R451 L456	L112-L444 HydrophobicContact CD1-CD1 4.21Å; L112-L444 HydrophobicContact CD1-CD2 3.74Å; A114-L444 HydrophobicContact CB-CD1 3.75Å; F115-L444 HydrophobicContact CE2-CD1 4.01Å; C438-L444 HydrophobicContact CB-CD2 4.12Å; G441-L444 WeakPolarHBondContact O-CB 3.33Å; G441-L444 PolarHBondContact O-N 3.22Å; L444-R451 WeakPolarHBondContact O-CD 3.21Å; L444-R451 WeakPolarHBondContact O-CG 3.24Å; L444-R451 PolarHBondContact O-NE 3.46Å; L444-L456 HydrophobicContact CB-CD1 3.92Å; L444-L456 HydrophobicContact CD1-CD2 4.37Å
445	G	95.9	Very high	95.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	74	172.8	177.8	0	0	0	0	0	114.5	R451	G445-R451 PolarHBondContact O-NH2 3.1Å
446	N	97.2	Very high	95.8	Very high	20 Å²	20	28.6 Å²	28.6	11%	0.107	13%	0.132	C	C	.	.	S	Bend	trans	-103.5	-14.7	-167.3	-73.5	-41.3	0	0	0	115.3	G382 K384 A386 D387	G382-N446 CarbonylContact C-O 3.56Å; G382-N446 WeakPolarHBondContact CA-O 3.34Å; K384-N446 WeakPolarHBondContact CA-OD1 3.29Å; K384-N446 HydrophobicContact CB-CB 4.36Å; K384-N446 WeakPolarHBondContact CB-OD1 3.42Å; K384-N446 HydrophobicContact CG-CB 4.34Å; K384-N446 PolarHBondContact O-OD1 2.86Å; A386-N446 WeakPolarHBondContact CB-OD1 3.36Å; A386-N446 PolarHBondContact N-OD1 3.23Å; D387-N446 PolarHBondContact N-OD1 3.44Å; D387-N446 PolarHBondContact OD1-ND2 2.99Å; D387-N446 PolarHBondContact OD1-OD1 2.95Å
447	N	96.7	Very high	95.9	Very high	26 Å²	26	34.4 Å²	34.4	14%	0.139	15%	0.153	C	C	.	.	S	Bend	trans	-159.9	166.1	-178.8	57.6	64.9	0	0	0	111.5	T163 R449 Q450 R451	T163-N447 HydrophobicContact CG2-CB 4.49Å; N447-R449 PolarHBondContact O-N 3.42Å; N447-R449 WeakPolarHBondContact OD1-CB 2.99Å; N447-R449 PolarHBondContact OD1-N 2.88Å; N447-Q450 PolarHBondContact O-N 3.47Å; N447-Q450 WeakPolarHBondContact OD1-CB 3.31Å; N447-Q450 PolarHBondContact OD1-N 3.04Å; N447-R451 VanDerWaalsContact C-NH1 3.33Å; N447-R451 WeakPolarHBondContact O-CG 2.99Å; N447-R451 PolarHBondContact O-N 3.07Å
448	Q	96.4	Very high	96.1	Very high	31 Å²	31	39.6 Å²	39.6	15%	0.145	18%	0.177	C	C	.	.	H	α-helix	trans	-58.7	-44.1	-177.8	-165.8	-173.4	23.7	0	0	112.3	Y158 P165 Q450 R451 E452	Y158-Q448 HydrophobicContact CE1-CB 4.22Å; Y158-Q448 VanDerWaalsContact OH-CG 3.27Å; Y158-Q448 WeakPolarHBondContact OH-CG 3.48Å; Y158-Q448 PolarHBondContact OH-OE1 2.94Å; P165-Q448 VanDerWaalsContact CB-OE1 3.25Å; Q448-Q450 PolarHBondContact O-N 3.42Å; Q448-R451 WeakPolarHBondContact O-CB 3.34Å; Q448-R451 PolarHBondContact O-N 3.1Å; Q448-R451 VanDerWaalsContact O-N 3.07Å; Q448-E452 WeakPolarHBondContact O-CG 3.43Å; Q448-E452 PolarHBondContact O-N 2.9Å; Q448-E452 VanDerWaalsContact O-N 3.11Å
449	R	97	Very high	96.2	Very high	75 Å²	75	43.8 Å²	43.8	28%	0.283	19%	0.192	S	C	.	.	H	α-helix	trans	-54.1	-49.8	178.7	179.1	179.8	164.6	-166.2	-14.8	112.4	Y158 E162 N447 R451 E452 E453	Y158-R449 HydrophobicContact CD1-CB 3.87Å; Y158-R449 HydrophobicContact CD2-CB 3.64Å; Y158-R449 HydrophobicContact CD2-CG 3.64Å; Y158-R449 HydrophobicContact CE1-CB 3.85Å; Y158-R449 HydrophobicContact CE2-CB 3.63Å; Y158-R449 HydrophobicContact CE2-CG 3.91Å; Y158-R449 HydrophobicContact CG-CB 3.74Å; Y158-R449 HydrophobicContact CG-CG 4Å; Y158-R449 PolarHBondContact OH-N 2.98Å; E162-R449 IonicContact OE1-CZ 3.16Å; E162-R449 IonicContact OE1-NH1 3.76Å; E162-R449 PolarHBondContact OE1-NH1 2.79Å; N447-R449 PolarHBondContact O-N 3.42Å; N447-R449 WeakPolarHBondContact OD1-CB 2.99Å; N447-R449 PolarHBondContact OD1-N 2.88Å; R449-R451 VanDerWaalsContact C-N 3.28Å; R449-R451 PolarHBondContact O-N 2.64Å; R449-E452 PolarHBondContact O-N 2.92Å; R449-E452 VanDerWaalsContact O-N 3.15Å; R449-E453 HydrophobicContact CG-CG 4.38Å; R449-E453 IonicContact CZ-OE1 2.73Å; R449-E453 IonicContact NE-OE1 2.86Å; R449-E453 PolarHBondContact NE-OE1 2.86Å; R449-E453 IonicContact NH2-OE1 3.41Å; R449-E453 PolarHBondContact NH2-OE1 2.94Å; R449-E453 VanDerWaalsContact NH2-OE1 3.08Å; R449-E453 WeakPolarHBondContact O-CG 3.38Å; R449-E453 PolarHBondContact O-N 3.37Å
450	Q	96.3	Very high	96.3	Very high	44 Å²	44	42.4 Å²	42.4	21%	0.206	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-36	179.1	-175.6	174.6	35.8	0	0	112.1	N447 Q448 E452 E453 L454	N447-Q450 PolarHBondContact O-N 3.47Å; N447-Q450 WeakPolarHBondContact OD1-CB 3.31Å; N447-Q450 PolarHBondContact OD1-N 3.04Å; Q448-Q450 PolarHBondContact O-N 3.42Å; Q450-E452 VanDerWaalsContact C-N 3.29Å; Q450-E452 PolarHBondContact O-N 2.88Å; Q450-E453 PolarHBondContact O-N 3.5Å; Q450-L454 HydrophobicContact CG-CD1 4.02Å; Q450-L454 HydrophobicContact CG-CG 4.46Å; Q450-L454 VanDerWaalsContact O-CB 3.32Å; Q450-L454 WeakPolarHBondContact O-CB 3.36Å; Q450-L454 VanDerWaalsContact O-CG 3.22Å; Q450-L454 WeakPolarHBondContact O-CG 3.3Å; Q450-L454 PolarHBondContact O-N 3.45Å
451	R	97.1	Very high	96.3	Very high	21 Å²	21	42.4 Å²	42.4	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-68.5	-29.5	177.7	-64.4	-177.6	-170	104	7.1	112.7	I379 L444 G445 N447 Q448 R449 Q455 L456	I379-R451 VanDerWaalsContact CG2-NH1 3.32Å; I379-R451 PolarHBondContact O-NH1 3.24Å; L444-R451 WeakPolarHBondContact O-CD 3.21Å; L444-R451 WeakPolarHBondContact O-CG 3.24Å; L444-R451 PolarHBondContact O-NE 3.46Å; G445-R451 PolarHBondContact O-NH2 3.1Å; N447-R451 VanDerWaalsContact C-NH1 3.33Å; N447-R451 WeakPolarHBondContact O-CG 2.99Å; N447-R451 PolarHBondContact O-N 3.07Å; Q448-R451 WeakPolarHBondContact O-CB 3.34Å; Q448-R451 PolarHBondContact O-N 3.1Å; Q448-R451 VanDerWaalsContact O-N 3.07Å; R449-R451 VanDerWaalsContact C-N 3.28Å; R449-R451 PolarHBondContact O-N 2.64Å; R451-Q455 PolarHBondContact O-N 3.29Å; R451-L456 HydrophobicContact CB-CD1 3.74Å; R451-L456 HydrophobicContact CB-CG 4.3Å; R451-L456 HydrophobicContact CG-CD1 3.64Å; R451-L456 PolarHBondContact O-N 2.92Å; R451-L456 VanDerWaalsContact O-N 3.12Å
452	E	96.3	Very high	96.3	Very high	54 Å²	54	42.7 Å²	42.7	25%	0.252	19%	0.188	S	C	.	.	H	α-helix	trans	-79.8	-41.8	174.9	-65.8	172.6	171.7	0	0	111.5	Y158 R166 Q448 R449 Q450 L454 Q455	Y158-E452 VanDerWaalsContact CE2-OE2 3.25Å; Y158-E452 WeakPolarHBondContact CE2-OE2 3.37Å; Y158-E452 PolarHBondContact OH-OE1 2.62Å; Y158-E452 VanDerWaalsContact OH-OE1 3.14Å; Y158-E452 PolarHBondContact OH-OE2 3.47Å; R166-E452 IonicContact CZ-OE1 3.57Å; R166-E452 IonicContact CZ-OE2 2.92Å; R166-E452 IonicContact NE-OE1 2.69Å; R166-E452 PolarHBondContact NE-OE1 3.2Å; R166-E452 IonicContact NE-OE2 2.75Å; R166-E452 PolarHBondContact NE-OE2 2.96Å; R166-E452 IonicContact NH1-OE2 3.48Å; R166-E452 IonicContact NH2-OE1 2.8Å; R166-E452 PolarHBondContact NH2-OE1 3.03Å; R166-E452 IonicContact NH2-OE2 3.58Å; R166-E452 PolarHBondContact NH2-OE2 2.89Å; R166-E452 VanDerWaalsContact NH2-OE2 3.16Å; Q448-E452 WeakPolarHBondContact O-CG 3.43Å; Q448-E452 PolarHBondContact O-N 2.9Å; Q448-E452 VanDerWaalsContact O-N 3.11Å; R449-E452 PolarHBondContact O-N 2.92Å; R449-E452 VanDerWaalsContact O-N 3.15Å; Q450-E452 VanDerWaalsContact C-N 3.29Å; Q450-E452 PolarHBondContact O-N 2.88Å; E452-L454 VanDerWaalsContact C-N 3.26Å; E452-L454 PolarHBondContact O-N 3.46Å; E452-Q455 PolarHBondContact O-N 3.35Å
453	E	96.4	Very high	96.3	Very high	121 Å²	121	42.6 Å²	42.6	57%	0.565	19%	0.188	S	C	*	.	H	α-helix	trans	-60	-35.3	171.7	-71.5	172.3	170.3	0	0	111.8	R449 Q450 Q455	R449-E453 HydrophobicContact CG-CG 4.38Å; R449-E453 IonicContact CZ-OE1 2.73Å; R449-E453 IonicContact NE-OE1 2.86Å; R449-E453 PolarHBondContact NE-OE1 2.86Å; R449-E453 IonicContact NH2-OE1 3.41Å; R449-E453 PolarHBondContact NH2-OE1 2.94Å; R449-E453 VanDerWaalsContact NH2-OE1 3.08Å; R449-E453 WeakPolarHBondContact O-CG 3.38Å; R449-E453 PolarHBondContact O-N 3.37Å; Q450-E453 PolarHBondContact O-N 3.5Å; E453-Q455 VanDerWaalsContact C-N 3.33Å
454	L	96.4	Very high	96.3	Very high	24 Å²	24	42.5 Å²	42.5	13%	0.126	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-8.4	174.3	-72.1	171.7	0	0	0	114.6	Y109 Q450 E452 L456 R459	Y109-L454 HydrophobicContact CD1-CD1 4.01Å; Y109-L454 HydrophobicContact CD2-CD1 3.69Å; Y109-L454 HydrophobicContact CD2-CD2 3.97Å; Y109-L454 HydrophobicContact CD2-CG 4.46Å; Y109-L454 HydrophobicContact CE1-CD1 4.4Å; Y109-L454 HydrophobicContact CE2-CD1 4.11Å; Y109-L454 HydrophobicContact CG-CD1 3.65Å; Y109-L454 HydrophobicContact CG-CD2 4.14Å; Q450-L454 HydrophobicContact CG-CD1 4.02Å; Q450-L454 HydrophobicContact CG-CG 4.46Å; Q450-L454 VanDerWaalsContact O-CB 3.32Å; Q450-L454 WeakPolarHBondContact O-CB 3.36Å; Q450-L454 VanDerWaalsContact O-CG 3.22Å; Q450-L454 WeakPolarHBondContact O-CG 3.3Å; Q450-L454 PolarHBondContact O-N 3.45Å; E452-L454 VanDerWaalsContact C-N 3.26Å; E452-L454 PolarHBondContact O-N 3.46Å; L454-L456 HydrophobicContact CB-CD2 3.91Å; L454-L456 HydrophobicContact CB-CG 4.01Å; L454-L456 HydrophobicContact CD1-CD2 4.46Å; L454-L456 PolarHBondContact O-N 3.21Å; L454-R459 WeakPolarHBondContact O-CD 3.37Å; L454-R459 PolarHBondContact O-NH1 3.5Å; L454-R459 VanDerWaalsContact O-NH1 3.11Å
455	Q	96.8	Very high	96.2	Very high	105 Å²	105	43.6 Å²	43.6	49%	0.491	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	47.1	-176.6	-57.4	-178.2	-54.3	0	0	113.1	R451 E452 E453 R457 E458 R459	R451-Q455 PolarHBondContact O-N 3.29Å; E452-Q455 PolarHBondContact O-N 3.35Å; E453-Q455 VanDerWaalsContact C-N 3.33Å; Q455-R457 VanDerWaalsContact C-N 3.28Å; Q455-R457 PolarHBondContact O-N 3.41Å; Q455-E458 VanDerWaalsContact CA-OE2 3.23Å; Q455-E458 WeakPolarHBondContact CA-OE2 3.37Å; Q455-E458 HydrophobicContact CB-CB 4.39Å; Q455-E458 WeakPolarHBondContact CB-OE2 3.36Å; Q455-E458 PolarHBondContact O-N 3.26Å; Q455-E458 VanDerWaalsContact O-OE2 3.14Å; Q455-R459 HydrophobicContact CB-CG 4.19Å; Q455-R459 VanDerWaalsContact O-CB 3.28Å; Q455-R459 WeakPolarHBondContact O-CB 3.25Å; Q455-R459 WeakPolarHBondContact O-CG 3Å; Q455-R459 PolarHBondContact O-N 3.48Å
456	L	96.3	Very high	96.2	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-29.4	-173.9	-65.6	-173.9	0	0	0	113.6	F115 G441 L444 R451 L454 E458 T460	F115-L456 HydrophobicContact CE1-CD2 4Å; F115-L456 HydrophobicContact CE2-CD2 4.15Å; F115-L456 HydrophobicContact CZ-CD2 3.39Å; G441-L456 WeakPolarHBondContact O-CD1 3.08Å; L444-L456 HydrophobicContact CB-CD1 3.92Å; L444-L456 HydrophobicContact CD1-CD2 4.37Å; R451-L456 HydrophobicContact CB-CD1 3.74Å; R451-L456 HydrophobicContact CB-CG 4.3Å; R451-L456 HydrophobicContact CG-CD1 3.64Å; R451-L456 PolarHBondContact O-N 2.92Å; R451-L456 VanDerWaalsContact O-N 3.12Å; L454-L456 HydrophobicContact CB-CD2 3.91Å; L454-L456 HydrophobicContact CB-CG 4.01Å; L454-L456 HydrophobicContact CD1-CD2 4.46Å; L454-L456 PolarHBondContact O-N 3.21Å; L456-E458 VanDerWaalsContact C-N 3.33Å; L456-T460 HydrophobicContact CD2-CG2 4.02Å; L456-T460 WeakPolarHBondContact O-CB 3.27Å; L456-T460 PolarHBondContact O-N 3Å; L456-T460 PolarHBondContact O-OG1 3.21Å
457	R	94.4	Very high	96.1	Very high	140 Å²	140	46 Å²	46	53%	0.528	20%	0.204	S	C	.	.	H	α-helix	trans	-68.9	-36.3	179.4	-68.3	-178.2	171.3	-168.6	-5.8	111.6	W130 Q455	W130-R457 HydrophobicContact CB-CG 4.31Å; W130-R457 VanDerWaalsContact CD1-O 3.27Å; W130-R457 HydrophobicContact CD2-CB 4.43Å; W130-R457 HydrophobicContact CD2-CG 3.99Å; W130-R457 HydrophobicContact CE3-CG 4.24Å; W130-R457 HydrophobicContact CG-CB 4.16Å; W130-R457 HydrophobicContact CG-CG 4.02Å; W130-R457 PolarHBondContact NE1-O 3.32Å; Q455-R457 VanDerWaalsContact C-N 3.28Å; Q455-R457 PolarHBondContact O-N 3.41Å
458	E	93.6	Very high	96.1	Very high	108 Å²	108	47.4 Å²	47.4	51%	0.505	21%	0.211	S	C	.	.	H	α-helix	trans	-83	-34.8	-179.1	-57.2	83.1	171.7	0	0	111.7	R126 Q455 L456	R126-E458 PolarHBondContact NE-O 2.83Å; R126-E458 PolarHBondContact NH2-O 2.68Å; Q455-E458 VanDerWaalsContact CA-OE2 3.23Å; Q455-E458 WeakPolarHBondContact CA-OE2 3.37Å; Q455-E458 HydrophobicContact CB-CB 4.39Å; Q455-E458 WeakPolarHBondContact CB-OE2 3.36Å; Q455-E458 PolarHBondContact O-N 3.26Å; Q455-E458 VanDerWaalsContact O-OE2 3.14Å; L456-E458 VanDerWaalsContact C-N 3.33Å
459	R	95.1	Very high	95.9	Very high	95 Å²	95	49.9 Å²	49.9	36%	0.358	23%	0.232	S	C	.	.	H	α-helix	trans	-104.8	-10.8	-169.5	-61.4	172.9	68.2	-155.8	5	115.4	E110 F115 L454 Q455	E110-R459 IonicContact OE1-CZ 3.96Å; E110-R459 IonicContact OE1-NH1 3.03Å; E110-R459 PolarHBondContact OE1-NH1 2.75Å; E110-R459 IonicContact OE1-NH2 3.92Å; E110-R459 PolarHBondContact OE1-NH2 2.85Å; F115-R459 HydrophobicContact CD1-CB 3.96Å; F115-R459 HydrophobicContact CE1-CB 3.97Å; L454-R459 WeakPolarHBondContact O-CD 3.37Å; L454-R459 PolarHBondContact O-NH1 3.5Å; L454-R459 VanDerWaalsContact O-NH1 3.11Å; Q455-R459 HydrophobicContact CB-CG 4.19Å; Q455-R459 VanDerWaalsContact O-CB 3.28Å; Q455-R459 WeakPolarHBondContact O-CB 3.25Å; Q455-R459 WeakPolarHBondContact O-CG 3Å; Q455-R459 PolarHBondContact O-N 3.48Å
460	T	96.3	Very high	95.6	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-140.6	165	-176.7	74.1	0	0	0	0	112	A114 F115 R126 W130 G441 L456	A114-T460 HydrophobicContact CB-CG2 3.91Å; F115-T460 HydrophobicContact CD1-CG2 3.84Å; F115-T460 HydrophobicContact CD2-CG2 4.23Å; F115-T460 HydrophobicContact CE1-CG2 3.85Å; F115-T460 HydrophobicContact CE2-CG2 4.24Å; F115-T460 HydrophobicContact CG-CG2 4.06Å; F115-T460 HydrophobicContact CZ-CG2 4.07Å; R126-T460 WeakPolarHBondContact CD-O 3.48Å; W130-T460 PolarHBondContact NE1-O 3.12Å; G441-T460 VanDerWaalsContact CA-OG1 3.3Å; G441-T460 WeakPolarHBondContact CA-OG1 3.41Å; L456-T460 HydrophobicContact CD2-CG2 4.02Å; L456-T460 WeakPolarHBondContact O-CB 3.27Å; L456-T460 PolarHBondContact O-N 3Å; L456-T460 PolarHBondContact O-OG1 3.21Å
461	H	96.3	Very high	95.5	Very high	13 Å²	13	50.8 Å²	50.8	6%	0.06	24%	0.239	C	C	.	.			trans	-95.8	151.4	-179.6	-66.8	-96.1	0	0	0	112.4	Y117 P119 Q121 Y440 G441	Y117-H461 HydrophobicContact CD1-CB 4.38Å; Y117-H461 HydrophobicContact CE1-CB 4.41Å; P119-H461 WeakPolarHBondContact CD-NE2 3.21Å; P119-H461 WeakPolarHBondContact CG-ND1 3.45Å; Q121-H461 PolarHBondContact OE1-CE1 3.23Å; Q121-H461 PolarHBondContact OE1-ND1 3.22Å; Y440-H461 WeakPolarHBondContact CA-O 3.32Å; Y440-H461 WeakPolarHBondContact CB-O 3.43Å; Y440-H461 HydrophobicContact CD1-CB 4.15Å; Y440-H461 HydrophobicContact CE1-CB 4.46Å; G441-H461 PolarHBondContact N-O 3.09Å
462	S	96.9	Very high	95.1	Very high	6 Å²	6	57 Å²	57	4%	0.042	27%	0.268	C	S	.	.			trans	-84.7	128.2	177.5	176.8	0	0	0	0	111.7	G129 N442 W464 A465	G129-S462 WeakPolarHBondContact O-CB 3.36Å; G129-S462 PolarHBondContact O-OG 2.96Å; N442-S462 WeakPolarHBondContact OD1-CA 3.12Å; S462-W464 PolarHBondContact O-N 2.92Å; S462-W464 PolarHBondContact OG-N 3.28Å; S462-A465 PolarHBondContact O-N 3.09Å
463	L	97.2	Very high	94.7	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.3	-37	173.2	173.1	62.1	0	0	0	111.7	H434 Y440 N442 F443 A465 Y466 L467	H434-L463 HydrophobicContact CB-CD1 3.76Å; H434-L463 HydrophobicContact CB-CD2 3.86Å; H434-L463 HydrophobicContact CB-CG 4.46Å; H434-L463 VanDerWaalsContact CD2-CD1 3.46Å; H434-L463 WeakPolarHBondContact CD2-CD1 3.32Å; Y440-L463 HydrophobicContact CD1-CB 4.46Å; Y440-L463 HydrophobicContact CD2-CB 3.94Å; Y440-L463 HydrophobicContact CD2-CD1 3.56Å; Y440-L463 HydrophobicContact CD2-CG 4.32Å; Y440-L463 HydrophobicContact CE2-CD1 3.63Å; Y440-L463 HydrophobicContact CG-CB 3.84Å; Y440-L463 HydrophobicContact CG-CD1 4.31Å; N442-L463 PolarHBondContact OD1-N 3.24Å; F443-L463 HydrophobicContact CD2-CD2 4.36Å; F443-L463 HydrophobicContact CE2-CD2 3.6Å; F443-L463 HydrophobicContact CZ-CD2 4.48Å; L463-A465 VanDerWaalsContact C-N 3.29Å; L463-A465 PolarHBondContact O-N 3.08Å; L463-Y466 HydrophobicContact CD1-CD1 4.27Å; L463-Y466 PolarHBondContact O-N 3.43Å; L463-L467 HydrophobicContact CD1-CD1 3.88Å; L463-L467 HydrophobicContact CD1-CD2 4.28Å; L463-L467 HydrophobicContact CD1-CG 3.76Å; L463-L467 HydrophobicContact CD2-CD1 4.06Å; L463-L467 HydrophobicContact CG-CD1 3.74Å; L463-L467 HydrophobicContact CG-CG 4.02Å; L463-L467 PolarHBondContact O-N 2.85Å
464	W	97.3	Very high	94.5	Very high	3 Å²	3	53.1 Å²	53.1	1%	0.011	25%	0.253	C	S	.	.	H	α-helix	trans	-66.6	-32.2	-174.2	-50.6	134	0	0	0	112.4	L132 I133 M371 I374 E375 I379 I431 N442 F443 S462 L467 M468	L132-W464 HydrophobicContact CD2-CB 3.7Å; I133-W464 HydrophobicContact CD1-CB 4.48Å; I133-W464 VanDerWaalsContact CD1-CD1 3.5Å; I133-W464 HydrophobicContact CD1-CG 3.94Å; M371-W464 HydrophobicContact CB-CD2 3.86Å; M371-W464 HydrophobicContact CB-CE3 3.91Å; M371-W464 HydrophobicContact CB-CG 4.29Å; M371-W464 HydrophobicContact CB-CZ3 4.27Å; M371-W464 HydrophobicContact CE-CE3 4.1Å; M371-W464 HydrophobicContact CG-CD2 3.86Å; M371-W464 HydrophobicContact CG-CE3 3.43Å; M371-W464 VanDerWaalsContact CG-CE3 3.43Å; M371-W464 HydrophobicContact CG-CG 4.42Å; M371-W464 HydrophobicContact CG-CZ3 3.82Å; M371-W464 HydrophobicContact SD-CB 3.82Å; M371-W464 HydrophobicContact SD-CD2 4.08Å; M371-W464 HydrophobicContact SD-CE3 3.79Å; M371-W464 HydrophobicContact SD-CG 4.13Å; I374-W464 HydrophobicContact CB-CH2 4.31Å; I374-W464 HydrophobicContact CB-CZ2 4.25Å; I374-W464 HydrophobicContact CD1-CH2 3.97Å; I374-W464 HydrophobicContact CG2-CH2 4.09Å; I374-W464 HydrophobicContact CG2-CZ2 3.93Å; E375-W464 HydrophobicContact CG-CZ2 4.49Å; E375-W464 PolarHBondContact OE1-NE1 3.19Å; I379-W464 HydrophobicContact CD1-CZ2 4.39Å; I431-W464 HydrophobicContact CD1-CZ3 4.34Å; I431-W464 HydrophobicContact CG1-CZ3 4.26Å; N442-W464 VanDerWaalsContact ND2-CD1 3.3Å; N442-W464 PolarHBondContact ND2-NE1 2.64Å; N442-W464 VanDerWaalsContact ND2-NE1 3.11Å; F443-W464 HydrophobicContact CE2-CH2 4.44Å; F443-W464 AromaticContact CZ-CH2 3.89Å; F443-W464 HydrophobicContact CZ-CH2 3.89Å; F443-W464 HydrophobicContact CZ-CZ2 4.23Å; S462-W464 PolarHBondContact O-N 2.92Å; S462-W464 PolarHBondContact OG-N 3.28Å; W464-L467 HydrophobicContact CE3-CD1 4.02Å; W464-L467 HydrophobicContact CZ3-CD1 3.99Å; W464-M468 VanDerWaalsContact O-CB 3.27Å; W464-M468 WeakPolarHBondContact O-CB 3.4Å; W464-M468 VanDerWaalsContact O-CG 3.24Å; W464-M468 WeakPolarHBondContact O-CG 3.25Å; W464-M468 PolarHBondContact O-N 3.44Å
465	A	95.2	Very high	94.4	Very high	25 Å²	25	54.5 Å²	54.5	21%	0.207	26%	0.26	C	S	.	.	H	α-helix	trans	-61.4	-46.2	173.4	0	0	0	0	0	111.6	S462 L463 M468 S469	S462-A465 PolarHBondContact O-N 3.09Å; L463-A465 VanDerWaalsContact C-N 3.29Å; L463-A465 PolarHBondContact O-N 3.08Å; A465-M468 PolarHBondContact O-N 2.79Å; A465-S469 PolarHBondContact O-N 2.98Å
466	Y	94.9	Very high	94.1	Very high	69 Å²	69	50.5 Å²	50.5	27%	0.271	24%	0.242	S	C	.	.	H	α-helix	trans	-66.3	-45.7	177	169.8	-108.6	0	0	0	112.6	H434 Y440 L463 M468 S469 E470	H434-Y466 AromaticContact NE2-CE1 3.76Å; Y440-Y466 HydrophobicContact CE2-CD1 4.19Å; Y440-Y466 AromaticContact CZ-CD1 3.96Å; Y440-Y466 AromaticContact CZ-CG 3.96Å; Y440-Y466 WeakPolarHBondContact OH-CB 3.39Å; Y440-Y466 VanDerWaalsContact OH-CD1 3.3Å; Y440-Y466 WeakPolarHBondContact OH-CD1 3.39Å; L463-Y466 HydrophobicContact CD1-CD1 4.27Å; L463-Y466 PolarHBondContact O-N 3.43Å; Y466-M468 PolarHBondContact O-N 3.48Å; Y466-S469 PolarHBondContact O-N 3.18Å; Y466-S469 PolarHBondContact O-OG 3.1Å; Y466-E470 HydrophobicContact CE2-CG 4.15Å; Y466-E470 PolarHBondContact O-N 2.85Å; Y466-E470 VanDerWaalsContact O-N 3.14Å
467	L	95.5	Very high	93.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.4	-25	177.9	-66.2	-177.6	0	0	0	112.8	M371 F427 Q430 I431 L463 W464 K471 Y474	M371-L467 HydrophobicContact CE-CB 3.61Å; M371-L467 HydrophobicContact CE-CD1 4.44Å; F427-L467 HydrophobicContact CD2-CD1 4.46Å; F427-L467 HydrophobicContact CE2-CB 4.23Å; F427-L467 HydrophobicContact CE2-CD1 3.89Å; Q430-L467 HydrophobicContact CB-CD2 4.1Å; I431-L467 HydrophobicContact CG1-CD1 3.92Å; L463-L467 HydrophobicContact CD1-CD1 3.88Å; L463-L467 HydrophobicContact CD1-CD2 4.28Å; L463-L467 HydrophobicContact CD1-CG 3.76Å; L463-L467 HydrophobicContact CD2-CD1 4.06Å; L463-L467 HydrophobicContact CG-CD1 3.74Å; L463-L467 HydrophobicContact CG-CG 4.02Å; L463-L467 PolarHBondContact O-N 2.85Å; W464-L467 HydrophobicContact CE3-CD1 4.02Å; W464-L467 HydrophobicContact CZ3-CD1 3.99Å; L467-K471 PolarHBondContact O-N 3.26Å; L467-Y474 HydrophobicContact CB-CE2 4.22Å; L467-Y474 HydrophobicContact CD2-CE1 4.47Å; L467-Y474 HydrophobicContact CD2-CE2 3.7Å; L467-Y474 WeakPolarHBondContact CD2-OH 3.34Å; L467-Y474 WeakPolarHBondContact O-CD2 3.45Å; L467-Y474 WeakPolarHBondContact O-CE2 3.39Å
468	M	95.3	Very high	93.5	Very high	56 Å²	56	48.8 Å²	48.8	28%	0.276	24%	0.241	S	C	.	.	H	α-helix	trans	-81	-32.2	172.9	-75.2	-60.3	-64	0	0	113.6	L132 I367 M371 W464 A465 Y466 E470 K471	L132-M468 HydrophobicContact CD2-CB 4.44Å; L132-M468 HydrophobicContact CD2-CG 3.76Å; I367-M468 HydrophobicContact CG2-SD 3.87Å; M371-M468 HydrophobicContact CE-CG 4Å; M371-M468 HydrophobicContact CE-SD 4.02Å; M371-M468 HydrophobicContact SD-CG 4.1Å; M371-M468 HydrophobicContact SD-SD 4.27Å; W464-M468 VanDerWaalsContact O-CB 3.27Å; W464-M468 WeakPolarHBondContact O-CB 3.4Å; W464-M468 VanDerWaalsContact O-CG 3.24Å; W464-M468 WeakPolarHBondContact O-CG 3.25Å; W464-M468 PolarHBondContact O-N 3.44Å; A465-M468 PolarHBondContact O-N 2.79Å; Y466-M468 PolarHBondContact O-N 3.48Å; M468-E470 VanDerWaalsContact C-N 3.32Å; M468-K471 HydrophobicContact CE-CD 4.2Å; M468-K471 WeakPolarHBondContact O-CB 3.43Å; M468-K471 PolarHBondContact O-N 3.04Å
469	S	92.9	Very high	93.5	Very high	84 Å²	84	46.3 Å²	46.3	59%	0.587	23%	0.228	S	C	*	.	H	α-helix	trans	-65.3	-39.8	172.2	63.5	0	0	0	0	111	A465 Y466 K471	A465-S469 PolarHBondContact O-N 2.98Å; Y466-S469 PolarHBondContact O-N 3.18Å; Y466-S469 PolarHBondContact O-OG 3.1Å; S469-K471 VanDerWaalsContact C-N 3.3Å; S469-K471 PolarHBondContact O-N 2.94Å
470	E	91.7	Very high	93.4	Very high	78 Å²	78	46.7 Å²	46.7	36%	0.364	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	17.7	177.8	-64.2	-53.8	129	0	0	114	Y466 M468 Q472 N473 Y474	Y466-E470 HydrophobicContact CE2-CG 4.15Å; Y466-E470 PolarHBondContact O-N 2.85Å; Y466-E470 VanDerWaalsContact O-N 3.14Å; M468-E470 VanDerWaalsContact C-N 3.32Å; E470-Q472 PolarHBondContact O-N 3.45Å; E470-N473 WeakPolarHBondContact O-CB 3.22Å; E470-N473 PolarHBondContact O-N 3.19Å; E470-N473 PolarHBondContact OE2-ND2 3.27Å; E470-Y474 HydrophobicContact CB-CE2 3.7Å; E470-Y474 WeakPolarHBondContact O-CD2 3.44Å; E470-Y474 WeakPolarHBondContact O-CE2 3.4Å
471	K	93	Very high	93.2	Very high	60 Å²	60	50 Å²	50	26%	0.261	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-46.7	-39.7	-171.7	-177.9	177.9	179.7	-175.5	0	114	I367 E422 L467 M468 S469 N473 Y474 L475	I367-K471 HydrophobicContact CD1-CD 4.46Å; I367-K471 HydrophobicContact CD1-CG 3.87Å; E422-K471 WeakPolarHBondContact OE1-CE 3.37Å; E422-K471 IonicContact OE1-NZ 3.17Å; E422-K471 PolarHBondContact OE1-NZ 3.25Å; E422-K471 IonicContact OE2-NZ 2.7Å; L467-K471 PolarHBondContact O-N 3.26Å; M468-K471 HydrophobicContact CE-CD 4.2Å; M468-K471 WeakPolarHBondContact O-CB 3.43Å; M468-K471 PolarHBondContact O-N 3.04Å; S469-K471 VanDerWaalsContact C-N 3.3Å; S469-K471 PolarHBondContact O-N 2.94Å; K471-N473 PolarHBondContact O-N 3.33Å; K471-Y474 PolarHBondContact O-N 3.15Å; K471-L475 PolarHBondContact O-N 3.02Å
472	Q	89.9	Confident	93	Very high	151 Å²	151	52.9 Å²	52.9	71%	0.706	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-61.7	-30.9	-176.3	-57.1	-67.4	33.5	0	0	113.1	E470 Y474	E470-Q472 PolarHBondContact O-N 3.45Å; Q472-Y474 PolarHBondContact O-N 3.09Å
473	N	88.2	Confident	92.8	Very high	89 Å²	89	55.2 Å²	55.2	48%	0.476	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-71	-17.4	177.8	-61.6	-36.8	0	0	0	112.8	E470 K471	E470-N473 WeakPolarHBondContact O-CB 3.22Å; E470-N473 PolarHBondContact O-N 3.19Å; E470-N473 PolarHBondContact OE2-ND2 3.27Å; K471-N473 PolarHBondContact O-N 3.33Å
474	Y	92.3	Very high	92.4	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.016	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-16.5	-173.8	-56.4	-46.7	0	0	0	113.4	Y423 S424 W426 F427 Q430 L467 E470 K471 Q472	Y423-Y474 CarbonylContact C-O 3.54Å; Y423-Y474 WeakPolarHBondContact CA-O 3.11Å; S424-Y474 WeakPolarHBondContact CB-O 3.33Å; S424-Y474 PolarHBondContact N-O 3.32Å; S424-Y474 PolarHBondContact OG-O 2.84Å; W426-Y474 AromaticContact CD1-CD1 3.59Å; W426-Y474 AromaticContact CD1-CE1 3.51Å; W426-Y474 HydrophobicContact CG-CD1 4.38Å; W426-Y474 HydrophobicContact CG-CE1 4.46Å; W426-Y474 AromaticContact NE1-CE1 3.74Å; F427-Y474 HydrophobicContact CB-CD1 4.23Å; F427-Y474 HydrophobicContact CB-CG 4.28Å; F427-Y474 HydrophobicContact CD2-CD1 4.22Å; F427-Y474 HydrophobicContact CD2-CD2 4.06Å; F427-Y474 AromaticContact CD2-CG 3.78Å; F427-Y474 HydrophobicContact CD2-CG 3.78Å; F427-Y474 HydrophobicContact CG-CG 4.46Å; Q430-Y474 HydrophobicContact CB-CE1 4.32Å; Q430-Y474 HydrophobicContact CG-CE1 3.64Å; L467-Y474 HydrophobicContact CB-CE2 4.22Å; L467-Y474 HydrophobicContact CD2-CE1 4.47Å; L467-Y474 HydrophobicContact CD2-CE2 3.7Å; L467-Y474 WeakPolarHBondContact CD2-OH 3.34Å; L467-Y474 WeakPolarHBondContact O-CD2 3.45Å; L467-Y474 WeakPolarHBondContact O-CE2 3.39Å; E470-Y474 HydrophobicContact CB-CE2 3.7Å; E470-Y474 WeakPolarHBondContact O-CD2 3.44Å; E470-Y474 WeakPolarHBondContact O-CE2 3.4Å; K471-Y474 PolarHBondContact O-N 3.15Å; Q472-Y474 PolarHBondContact O-N 3.09Å
475	L	92.3	Very high	92	Very high	54 Å²	54	62.1 Å²	62.1	28%	0.283	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-61.7	136.1	-176.6	-75.5	179.5	0	0	0	113.3	I367 E422 K471 P477	I367-L475 HydrophobicContact CD1-CD2 3.79Å; I367-L475 HydrophobicContact CD1-CG 4.45Å; E422-L475 HydrophobicContact CG-CD2 3.66Å; E422-L475 WeakPolarHBondContact O-CA 3.5Å; K471-L475 PolarHBondContact O-N 3.02Å; L475-P477 WeakPolarHBondContact O-CD 3.39Å
476	N	92.1	Very high	91.9	Very high	21 Å²	21	64.2 Å²	64.2	11%	0.112	33%	0.334	C	S	.	.			trans	-82.9	114.9	167.3	174.3	11.7	0	0	0	110.2	P418 F421 E422 F478 Y479	P418-N476 PolarHBondContact O-ND2 2.86Å; F421-N476 WeakPolarHBondContact O-CB 3.47Å; F421-N476 PolarHBondContact O-ND2 2.95Å; E422-N476 WeakPolarHBondContact O-CB 3.47Å; E422-N476 PolarHBondContact O-N 2.78Å; N476-F478 PolarHBondContact O-N 2.87Å; N476-F478 VanDerWaalsContact O-N 3.12Å; N476-F478 WeakPolarHBondContact OD1-CB 3.49Å; N476-F478 WeakPolarHBondContact OD1-CD2 3.34Å; N476-F478 PolarHBondContact OD1-N 2.81Å; N476-Y479 WeakPolarHBondContact O-CB 3.49Å; N476-Y479 PolarHBondContact O-N 3.31Å; N476-Y479 VanDerWaalsContact O-N 3.13Å
477	P	87.8	Confident	91.8	Very high	27 Å²	27	65 Å²	65	18%	0.175	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.3	-179	-21.4	34.8	0	0	0	115.2	L475 L520 L524 K527	L475-P477 WeakPolarHBondContact O-CD 3.39Å; P477-L520 VanDerWaalsContact CD-CD1 3.5Å; P477-L520 HydrophobicContact CG-CD1 4.08Å; P477-L524 HydrophobicContact CB-CD2 4.49Å; P477-L524 HydrophobicContact CG-CD2 3.31Å; P477-L524 HydrophobicContact CG-CG 3.74Å; P477-K527 HydrophobicContact CB-CD 3.94Å; P477-K527 PolarHBondContact O-NZ 3.07Å
478	F	89.9	Confident	91.6	Very high	82 Å²	82	67.6 Å²	67.6	36%	0.36	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-7.1	178.9	-56.2	-73.1	0	0	0	113.1	Q419 N476 K480 L520 T523	Q419-F478 WeakPolarHBondContact CA-O 3.39Å; Q419-F478 HydrophobicContact CG-CB 4.45Å; Q419-F478 WeakPolarHBondContact CG-O 3.46Å; N476-F478 PolarHBondContact O-N 2.87Å; N476-F478 VanDerWaalsContact O-N 3.12Å; N476-F478 WeakPolarHBondContact OD1-CB 3.49Å; N476-F478 WeakPolarHBondContact OD1-CD2 3.34Å; N476-F478 PolarHBondContact OD1-N 2.81Å; F478-K480 PolarHBondContact O-N 2.82Å; F478-L520 HydrophobicContact CE2-CD1 4.24Å; F478-T523 HydrophobicContact CE1-CG2 3.88Å; F478-T523 HydrophobicContact CE2-CG2 4.38Å; F478-T523 HydrophobicContact CZ-CG2 3.5Å
479	Y	93.9	Very high	91.7	Very high	56 Å²	56	66.4 Å²	66.4	22%	0.22	35%	0.352	C	S	.	.			trans	-56.2	132.5	177.5	177.5	-121.8	0	0	0	111.3	F421 E422 N476 P481	F421-Y479 WeakPolarHBondContact O-CB 3.34Å; F421-Y479 WeakPolarHBondContact O-CD2 3.5Å; E422-Y479 HydrophobicContact CB-CD1 3.94Å; E422-Y479 HydrophobicContact CB-CD2 4.35Å; E422-Y479 HydrophobicContact CB-CE1 3.93Å; E422-Y479 HydrophobicContact CB-CE2 4.33Å; E422-Y479 HydrophobicContact CB-CG 4.15Å; E422-Y479 HydrophobicContact CG-CD1 3.92Å; E422-Y479 HydrophobicContact CG-CE1 4.01Å; N476-Y479 WeakPolarHBondContact O-CB 3.49Å; N476-Y479 PolarHBondContact O-N 3.31Å; N476-Y479 VanDerWaalsContact O-N 3.13Å; Y479-P481 HydrophobicContact CD1-CG 4.48Å; Y479-P481 HydrophobicContact CE1-CG 3.81Å
480	K	92.4	Very high	91.9	Very high	102 Å²	102	62.6 Å²	62.6	44%	0.443	33%	0.325	S	S	.	.			trans	-131.8	113.9	174.3	-68.7	-179.5	-169.5	161.8	0	109.6	Q419 F478 S482 Y483 S484	Q419-K480 PolarHBondContact O-N 3.49Å; Q419-K480 VanDerWaalsContact OE1-CE 3.24Å; F478-K480 PolarHBondContact O-N 2.82Å; K480-S482 PolarHBondContact O-N 2.93Å; K480-Y483 WeakPolarHBondContact O-CB 3.43Å; K480-Y483 PolarHBondContact O-N 3.15Å; K480-S484 PolarHBondContact O-N 3.11Å
481	P	92.1	Very high	92.2	Very high	70 Å²	70	64.9 Å²	64.9	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-51.2	-44.1	172.7	-28.6	35.6	0	0	0	112.4	Y479 Y483 S484 E485	Y479-P481 HydrophobicContact CD1-CG 4.48Å; Y479-P481 HydrophobicContact CE1-CG 3.81Å; P481-Y483 VanDerWaalsContact C-N 3.27Å; P481-Y483 PolarHBondContact O-N 3.4Å; P481-S484 CarbonylContact O-C 3.52Å; P481-S484 WeakPolarHBondContact O-CA 3.39Å; P481-S484 WeakPolarHBondContact O-CB 3.28Å; P481-S484 PolarHBondContact O-N 2.95Å; P481-E485 WeakPolarHBondContact O-CG 3.18Å; P481-E485 PolarHBondContact O-N 3.29Å
482	S	92.8	Very high	92.3	Very high	74 Å²	74	62.4 Å²	62.4	52%	0.517	33%	0.326	S	S	.	.	H	α-helix	trans	-62.6	-25.7	177.6	56.8	0	0	0	0	114.8	K480 A486	K480-S482 PolarHBondContact O-N 2.93Å; S482-A486 WeakPolarHBondContact O-CB 3.43Å; S482-A486 PolarHBondContact O-N 3.33Å; S482-A486 VanDerWaalsContact O-N 3.08Å
483	Y	91.1	Very high	92.6	Very high	55 Å²	55	57.1 Å²	57.1	22%	0.216	31%	0.306	C	S	.	.	H	α-helix	trans	-69.1	-41.4	171.2	180	-90	0	0	0	110.7	Q419 A420 K480 P481 A486 H487 L490	Q419-Y483 HydrophobicContact CB-CD1 4.24Å; Q419-Y483 HydrophobicContact CB-CD2 4.42Å; Q419-Y483 HydrophobicContact CB-CG 4.05Å; A420-Y483 HydrophobicContact CB-CD1 4.03Å; A420-Y483 HydrophobicContact CB-CE1 3.89Å; K480-Y483 WeakPolarHBondContact O-CB 3.43Å; K480-Y483 PolarHBondContact O-N 3.15Å; P481-Y483 VanDerWaalsContact C-N 3.27Å; P481-Y483 PolarHBondContact O-N 3.4Å; Y483-A486 PolarHBondContact O-N 3.28Å; Y483-H487 AromaticContact CD2-CE1 3.92Å; Y483-H487 AromaticContact CD2-ND1 3.63Å; Y483-H487 HydrophobicContact CE1-CB 4.23Å; Y483-H487 AromaticContact CE2-CE1 3.62Å; Y483-H487 AromaticContact CE2-ND1 3.47Å; Y483-H487 WeakPolarHBondContact CE2-ND1 3.41Å; Y483-H487 AromaticContact CZ-CG 3.97Å; Y483-H487 AromaticContact CZ-ND1 3.73Å; Y483-H487 WeakPolarHBondContact O-CB 3.36Å; Y483-H487 PolarHBondContact O-N 2.69Å; Y483-H487 PolarHBondContact O-ND1 2.98Å; Y483-L490 HydrophobicContact CE1-CD2 4.45Å
484	S	89.1	Confident	92.9	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-74	-26.8	178.6	-60.4	0	0	0	0	113.4	R365 A420 K480 P481 H487 P488	R365-S484 PolarHBondContact NH1-OG 3.17Å; A420-S484 PolarHBondContact O-OG 3.09Å; K480-S484 PolarHBondContact O-N 3.11Å; P481-S484 CarbonylContact O-C 3.52Å; P481-S484 WeakPolarHBondContact O-CA 3.39Å; P481-S484 WeakPolarHBondContact O-CB 3.28Å; P481-S484 PolarHBondContact O-N 2.95Å; S484-H487 CarbonylContact O-C 3.47Å; S484-H487 VanDerWaalsContact O-C 3.25Å; S484-P488 WeakPolarHBondContact O-CA 3.48Å
485	E	90	Very high	93	Very high	145 Å²	145	58.1 Å²	58.1	68%	0.678	31%	0.312	S	S	*	.	H	α-helix	trans	-70.3	-42.5	169.2	-69.8	164.4	-172	0	0	111.7	P481	P481-E485 WeakPolarHBondContact O-CG 3.18Å; P481-E485 PolarHBondContact O-N 3.29Å
486	A	92.5	Very high	92.9	Very high	69 Å²	69	59.9 Å²	59.9	57%	0.57	33%	0.327	S	S	*	.	H	α-helix	trans	-73.3	-27.8	176.2	0	0	0	0	0	113.3	S482 Y483 P488	S482-A486 WeakPolarHBondContact O-CB 3.43Å; S482-A486 PolarHBondContact O-N 3.33Å; S482-A486 VanDerWaalsContact O-N 3.08Å; Y483-A486 PolarHBondContact O-N 3.28Å; A486-P488 VanDerWaalsContact C-CD 3.47Å; A486-P488 WeakPolarHBondContact O-CD 3.39Å
487	H	92	Very high	92.8	Very high	84 Å²	84	67.1 Å²	67.1	39%	0.389	35%	0.354	S	S	.	.			trans	-125.7	72.8	178.5	-49.4	83.5	0	0	0	109.4	R365 Y483 S484 V489	R365-H487 PolarHBondContact NH2-O 3.13Å; Y483-H487 AromaticContact CD2-CE1 3.92Å; Y483-H487 AromaticContact CD2-ND1 3.63Å; Y483-H487 HydrophobicContact CE1-CB 4.23Å; Y483-H487 AromaticContact CE2-CE1 3.62Å; Y483-H487 AromaticContact CE2-ND1 3.47Å; Y483-H487 WeakPolarHBondContact CE2-ND1 3.41Å; Y483-H487 AromaticContact CZ-CG 3.97Å; Y483-H487 AromaticContact CZ-ND1 3.73Å; Y483-H487 WeakPolarHBondContact O-CB 3.36Å; Y483-H487 PolarHBondContact O-N 2.69Å; Y483-H487 PolarHBondContact O-ND1 2.98Å; S484-H487 CarbonylContact O-C 3.47Å; S484-H487 VanDerWaalsContact O-C 3.25Å; H487-V489 VanDerWaalsContact C-N 3.29Å; H487-V489 PolarHBondContact O-N 2.89Å
488	P	92.3	Very high	93	Very high	55 Å²	55	69.2 Å²	69.2	36%	0.357	36%	0.361	S	S	.	.	S	Bend	trans	-68.7	-30.7	-178.6	27.6	-34.2	0	0	0	111.9	M360 P362 R365 S484 A486	M360-P488 CarbonylContact C-O 3.46Å; P362-P488 HydrophobicContact CG-CB 4.24Å; R365-P488 VanDerWaalsContact NH2-C 3.29Å; R365-P488 PolarHBondContact NH2-O 3.47Å; S484-P488 WeakPolarHBondContact O-CA 3.48Å; A486-P488 VanDerWaalsContact C-CD 3.47Å; A486-P488 WeakPolarHBondContact O-CD 3.39Å
489	V	97.3	Very high	93.2	Very high	32 Å²	32	66 Å²	66	19%	0.194	35%	0.347	C	S	.	.	S	Bend	trans	-106.5	131.5	171.8	-174.4	0	0	0	0	109.3	T328 T332 L359 H487	T328-V489 HydrophobicContact CG2-CG1 3.64Å; T332-V489 HydrophobicContact CG2-CG1 4.11Å; T332-V489 HydrophobicContact CG2-CG2 3.79Å; L359-V489 CarbonylContact O-C 3.51Å; L359-V489 VanDerWaalsContact O-CA 3.29Å; L359-V489 WeakPolarHBondContact O-CA 3.42Å; H487-V489 VanDerWaalsContact C-N 3.29Å; H487-V489 PolarHBondContact O-N 2.89Å
490	L	97.6	Very high	93.1	Very high	3 Å²	3	68.2 Å²	68.2	2%	0.016	36%	0.358	C	S	.	.			trans	-97.5	132.6	174.7	-62.3	-177.1	0	0	0	110.9	L359 F417 A420 F421 Y483 P492	L359-L490 HydrophobicContact CD2-CB 3.83Å; L359-L490 PolarHBondContact O-N 3.38Å; F417-L490 HydrophobicContact CB-CD1 4.48Å; F417-L490 HydrophobicContact CD1-CD2 4.1Å; F417-L490 HydrophobicContact CD2-CB 4.39Å; F417-L490 HydrophobicContact CD2-CD1 3.96Å; F417-L490 HydrophobicContact CD2-CD2 4.45Å; F417-L490 HydrophobicContact CE1-CD2 4.36Å; F417-L490 HydrophobicContact CE2-CB 4.06Å; F417-L490 HydrophobicContact CE2-CD1 4.45Å; F417-L490 HydrophobicContact CG-CD1 4.23Å; F417-L490 HydrophobicContact CG-CD2 4.14Å; F417-L490 HydrophobicContact CZ-CB 4.28Å; A420-L490 HydrophobicContact CB-CD1 4.07Å; A420-L490 HydrophobicContact CB-CD2 4.18Å; F421-L490 HydrophobicContact CE2-CD1 4.11Å; F421-L490 HydrophobicContact CZ-CD1 3.97Å; Y483-L490 HydrophobicContact CE1-CD2 4.45Å; L490-P492 VanDerWaalsContact O-CD 3.25Å; L490-P492 WeakPolarHBondContact O-CD 3.37Å
491	E	96.5	Very high	93.1	Very high	126 Å²	126	65 Å²	65	59%	0.589	34%	0.344	S	S	*	.			trans	-114.1	79.7	177.7	-61.8	-159.7	146.1	0	0	111
492	P	96.6	Very high	93.1	Very high	9 Å²	9	61.6 Å²	61.6	6%	0.058	32%	0.322	C	S	.	.			trans	-63.2	140.1	178.9	25.3	-34	0	0	0	110.8	V321 V325 L359 L413 F417 L490	V321-P492 HydrophobicContact CG1-CB 4.46Å; V321-P492 HydrophobicContact CG1-CG 4.1Å; V325-P492 HydrophobicContact CG2-CG 3.52Å; L359-P492 HydrophobicContact CD1-CG 4.32Å; L359-P492 HydrophobicContact CD2-CG 3.94Å; L413-P492 HydrophobicContact CD2-CB 3.61Å; L413-P492 HydrophobicContact CD2-CG 3.69Å; F417-P492 HydrophobicContact CE2-CB 3.94Å; F417-P492 HydrophobicContact CZ-CB 4.44Å; L490-P492 VanDerWaalsContact O-CD 3.25Å; L490-P492 WeakPolarHBondContact O-CD 3.37Å
493	S	95.8	Very high	92.9	Very high	40 Å²	40	62.7 Å²	62.7	28%	0.28	32%	0.315	S	S	.	.			trans	-78.9	125.9	170.6	169.3	0	0	0	0	109.2	Q416 H498	Q416-S493 PolarHBondContact NE2-O 3.35Å; Q416-S493 PolarHBondContact OE1-O 2.92Å; S493-H498 VanDerWaalsContact CB-ND1 3.28Å; S493-H498 WeakPolarHBondContact CB-ND1 3.43Å; S493-H498 PolarHBondContact OG-CE1 3.42Å; S493-H498 PolarHBondContact OG-ND1 3.28Å
494	T	93.8	Very high	92.7	Very high	32 Å²	32	63 Å²	63	20%	0.196	32%	0.32	C	S	.	.			trans	-99.2	19.3	-177	72.8	0	0	0	0	113.6	K318 V321 D322 V325	K318-T494 WeakPolarHBondContact CE-O 3.38Å; K318-T494 PolarHBondContact NZ-O 3.05Å; K318-T494 PolarHBondContact NZ-OG1 3.49Å; V321-T494 HydrophobicContact CG1-CG2 4.01Å; D322-T494 WeakPolarHBondContact OD1-CB 3.4Å; D322-T494 WeakPolarHBondContact OD1-CG2 3.48Å; D322-T494 PolarHBondContact OD1-OG1 3.46Å; V325-T494 HydrophobicContact CG2-CG2 4.08Å
495	L	94.6	Very high	92.7	Very high	82 Å²	82	62.9 Å²	62.9	43%	0.429	32%	0.319	S	S	.	.			trans	-65.8	137	173.9	-62.9	176	0	0	0	110.2	Y497 H498	L495-Y497 VanDerWaalsContact C-N 3.26Å; L495-Y497 HydrophobicContact CB-CD1 4.18Å; L495-Y497 HydrophobicContact CB-CE1 3.75Å; L495-Y497 HydrophobicContact CD1-CE1 3.97Å; L495-Y497 WeakPolarHBondContact CD1-OH 3.34Å; L495-Y497 HydrophobicContact CG-CE1 4.4Å; L495-Y497 PolarHBondContact O-N 3.33Å; L495-Y497 VanDerWaalsContact O-N 3.11Å; L495-H498 PolarHBondContact O-N 3.19Å
496	P	90.8	Very high	92.7	Very high	90 Å²	90	56 Å²	56	58%	0.584	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-54.8	-37.1	-170.1	-29.2	35.8	0	0	0	114.9	H498 F499	P496-H498 PolarHBondContact O-N 3.35Å; P496-F499 PolarHBondContact O-N 3.13Å; P496-F499 VanDerWaalsContact O-N 3.16Å
497	Y	90.2	Very high	92.2	Very high	174 Å²	174	53.3 Å²	53.3	68%	0.682	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-73.3	-5.7	-178.4	61.2	-97.2	0	0	0	114.6	L495	L495-Y497 VanDerWaalsContact C-N 3.26Å; L495-Y497 HydrophobicContact CB-CD1 4.18Å; L495-Y497 HydrophobicContact CB-CE1 3.75Å; L495-Y497 HydrophobicContact CD1-CE1 3.97Å; L495-Y497 WeakPolarHBondContact CD1-OH 3.34Å; L495-Y497 HydrophobicContact CG-CE1 4.4Å; L495-Y497 PolarHBondContact O-N 3.33Å; L495-Y497 VanDerWaalsContact O-N 3.11Å
498	H	92.3	Very high	91.6	Very high	70 Å²	70	51.5 Å²	51.5	32%	0.324	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-88.8	-11.2	170.1	-72.3	176.1	0	0	0	113.6	S493 L495 P496	S493-H498 VanDerWaalsContact CB-ND1 3.28Å; S493-H498 WeakPolarHBondContact CB-ND1 3.43Å; S493-H498 PolarHBondContact OG-CE1 3.42Å; S493-H498 PolarHBondContact OG-ND1 3.28Å; L495-H498 PolarHBondContact O-N 3.19Å; P496-H498 PolarHBondContact O-N 3.35Å
499	F	94.2	Very high	90.9	Very high	15 Å²	15	51.5 Å²	51.5	7%	0.066	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-85.5	116.6	174.8	-71.4	-94.4	0	0	0	109.8	I317 K318 V321 Q412 P496	I317-F499 HydrophobicContact CG2-CD1 3.96Å; I317-F499 HydrophobicContact CG2-CE1 4.08Å; K318-F499 HydrophobicContact CB-CD1 4.4Å; K318-F499 HydrophobicContact CB-CD2 4.21Å; K318-F499 HydrophobicContact CB-CE1 4.14Å; K318-F499 HydrophobicContact CB-CE2 3.93Å; K318-F499 HydrophobicContact CB-CG 4.46Å; K318-F499 HydrophobicContact CB-CZ 3.9Å; K318-F499 HydrophobicContact CG-CD2 4.13Å; K318-F499 HydrophobicContact CG-CE2 3.57Å; K318-F499 HydrophobicContact CG-CZ 3.84Å; V321-F499 HydrophobicContact CB-CE1 4.22Å; V321-F499 HydrophobicContact CB-CZ 4.11Å; V321-F499 HydrophobicContact CG1-CZ 4.3Å; V321-F499 HydrophobicContact CG2-CE1 4.02Å; V321-F499 HydrophobicContact CG2-CZ 4.39Å; Q412-F499 HydrophobicContact CB-CD1 4.49Å; Q412-F499 HydrophobicContact CB-CE1 4.5Å; Q412-F499 HydrophobicContact CG-CD1 3.83Å; Q412-F499 HydrophobicContact CG-CE1 4.16Å; P496-F499 PolarHBondContact O-N 3.13Å; P496-F499 VanDerWaalsContact O-N 3.16Å
500	K	91.6	Very high	89.8	Confident	102 Å²	102	51 Å²	51	44%	0.443	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-99.6	139.5	-179.5	-61.3	-179.4	-168.9	171.8	0	110.1	Q412 E415 W502	Q412-K500 PolarHBondContact NE2-O 2.95Å; E415-K500 WeakPolarHBondContact OE2-CD 3.41Å; E415-K500 WeakPolarHBondContact OE2-CE 3.47Å; E415-K500 IonicContact OE2-NZ 2.64Å; E415-K500 PolarHBondContact OE2-NZ 2.93Å; K500-W502 PolarHBondContact O-N 3.42Å
501	F	92.1	Very high	88.2	Confident	34 Å²	34	56.6 Å²	56.6	15%	0.149	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-63.8	125.9	169.3	169.6	-104.1	0	0	0	110.9	L289 V293 Y304 L308 R503 Y506 H507	L289-F501 HydrophobicContact CD1-CD2 4.37Å; L289-F501 HydrophobicContact CD1-CE2 3.95Å; L289-F501 HydrophobicContact CD2-CE2 4.34Å; L289-F501 HydrophobicContact CG-CE2 4.45Å; V293-F501 HydrophobicContact CG1-CZ 4.32Å; V293-F501 HydrophobicContact CG2-CE2 4.01Å; V293-F501 HydrophobicContact CG2-CZ 3.71Å; Y304-F501 WeakPolarHBondContact OH-CD1 3.48Å; Y304-F501 WeakPolarHBondContact OH-CE1 3.39Å; Y304-F501 WeakPolarHBondContact OH-CZ 3.19Å; L308-F501 HydrophobicContact CD1-CD2 3.79Å; L308-F501 HydrophobicContact CD1-CE2 4.36Å; L308-F501 HydrophobicContact CD1-CG 4.43Å; L308-F501 HydrophobicContact CD2-CB 4.11Å; L308-F501 HydrophobicContact CD2-CG 4.41Å; F501-R503 VanDerWaalsContact C-N 3.31Å; F501-R503 HydrophobicContact CD1-CB 4.34Å; F501-R503 HydrophobicContact CE1-CB 4.31Å; F501-R503 PolarHBondContact O-N 3.14Å; F501-Y506 HydrophobicContact CD2-CD2 4.22Å; F501-Y506 AromaticContact CE2-CD2 3.43Å; F501-Y506 HydrophobicContact CE2-CD2 3.43Å; F501-Y506 VanDerWaalsContact CE2-CD2 3.43Å; F501-Y506 HydrophobicContact CE2-CE2 4.18Å; F501-Y506 AromaticContact CE2-CG 3.99Å; F501-Y506 HydrophobicContact CE2-CG 3.99Å; F501-Y506 AromaticContact CZ-CD2 3.77Å; F501-Y506 HydrophobicContact CZ-CD2 3.77Å; F501-Y506 HydrophobicContact CZ-CG 4.03Å; F501-H507 AromaticContact CE1-CE1 3.51Å; F501-H507 AromaticContact CE1-ND1 3.53Å; F501-H507 AromaticContact CZ-CE1 3.71Å; F501-H507 AromaticContact CZ-ND1 3.77Å
502	W	92.9	Very high	86.6	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.255	C	S	.	.			trans	-75.6	77.8	-175.9	-168.1	6.9	0	0	0	112.5	L407 E408 Y411 E425 L428 L429 K500 N504 M505 Y506	L407-W502 HydrophobicContact CB-CH2 4.35Å; L407-W502 HydrophobicContact CB-CZ3 4.2Å; E408-W502 HydrophobicContact CB-CE3 3.69Å; E408-W502 HydrophobicContact CB-CZ3 3.96Å; E408-W502 HydrophobicContact CG-CB 4.33Å; E408-W502 HydrophobicContact CG-CE3 3.8Å; Y411-W502 HydrophobicContact CD1-CB 3.81Å; Y411-W502 AromaticContact CD1-CD1 3.85Å; Y411-W502 AromaticContact CD1-CD2 3.81Å; Y411-W502 HydrophobicContact CD1-CD2 3.81Å; Y411-W502 HydrophobicContact CD1-CE3 4.35Å; Y411-W502 AromaticContact CD1-CG 3.58Å; Y411-W502 HydrophobicContact CD1-CG 3.58Å; Y411-W502 AromaticContact CD2-CD1 3.81Å; Y411-W502 HydrophobicContact CD2-CD2 4.18Å; Y411-W502 AromaticContact CD2-CE2 3.72Å; Y411-W502 HydrophobicContact CD2-CG 4.24Å; Y411-W502 HydrophobicContact CD2-CZ2 4.19Å; Y411-W502 AromaticContact CD2-NE1 3.5Å; Y411-W502 HydrophobicContact CE1-CB 3.68Å; Y411-W502 AromaticContact CE1-CD1 3.64Å; Y411-W502 HydrophobicContact CE1-CD2 4.35Å; Y411-W502 AromaticContact CE1-CG 3.64Å; Y411-W502 HydrophobicContact CE1-CG 3.64Å; Y411-W502 AromaticContact CE2-CD1 3.59Å; Y411-W502 HydrophobicContact CE2-CG 4.29Å; Y411-W502 AromaticContact CE2-NE1 3.6Å; Y411-W502 AromaticContact CG-CD1 3.93Å; Y411-W502 AromaticContact CG-CD2 3.72Å; Y411-W502 HydrophobicContact CG-CD2 3.72Å; Y411-W502 AromaticContact CG-CE2 3.69Å; Y411-W502 HydrophobicContact CG-CE3 4.25Å; Y411-W502 AromaticContact CG-CG 3.89Å; Y411-W502 HydrophobicContact CG-CG 3.89Å; Y411-W502 HydrophobicContact CG-CZ2 4.18Å; Y411-W502 AromaticContact CG-NE1 3.84Å; Y411-W502 AromaticContact CZ-CD1 3.5Å; E425-W502 HydrophobicContact CG-CZ2 4.2Å; E425-W502 PolarHBondContact OE1-NE1 2.91Å; L428-W502 HydrophobicContact CB-CH2 3.8Å; L428-W502 HydrophobicContact CB-CZ2 4.08Å; L428-W502 HydrophobicContact CD1-CH2 4.33Å; L428-W502 HydrophobicContact CD1-CZ2 4.49Å; L429-W502 HydrophobicContact CD2-CH2 4.43Å; L429-W502 HydrophobicContact CD2-CZ2 3.79Å; L429-W502 HydrophobicContact CG-CZ2 4.1Å; K500-W502 PolarHBondContact O-N 3.42Å; W502-N504 VanDerWaalsContact C-N 3.31Å; W502-N504 PolarHBondContact O-N 2.66Å; W502-M505 HydrophobicContact CB-CB 4.25Å; W502-M505 HydrophobicContact CD2-CB 3.54Å; W502-M505 HydrophobicContact CD2-CE 4.39Å; W502-M505 HydrophobicContact CD2-CG 4.38Å; W502-M505 HydrophobicContact CE3-CB 3.84Å; W502-M505 HydrophobicContact CE3-CE 3.81Å; W502-M505 HydrophobicContact CE3-CG 4.18Å; W502-M505 HydrophobicContact CG-CB 3.7Å; W502-M505 HydrophobicContact CH2-CE 3.43Å; W502-M505 VanDerWaalsContact CH2-CE 3.43Å; W502-M505 HydrophobicContact CZ2-CE 4.02Å; W502-M505 HydrophobicContact CZ3-CE 3.29Å; W502-M505 PolarHBondContact O-N 3.03Å; W502-M505 VanDerWaalsContact O-N 3.16Å; W502-Y506 HydrophobicContact CB-CD2 4.43Å; W502-Y506 HydrophobicContact CB-CE2 4.29Å; W502-Y506 WeakPolarHBondContact O-CD2 3.3Å; W502-Y506 PolarHBondContact O-N 3.46Å
503	R	87.6	Confident	84.9	Confident	97 Å²	97	55.5 Å²	55.5	37%	0.366	27%	0.267	S	S	.	.	H	α-helix	trans	-54.8	-41.3	-173.8	-175.5	178.9	175.1	-157.1	-6.6	113.5	F501 M505 H507 H514	F501-R503 VanDerWaalsContact C-N 3.31Å; F501-R503 HydrophobicContact CD1-CB 4.34Å; F501-R503 HydrophobicContact CE1-CB 4.31Å; F501-R503 PolarHBondContact O-N 3.14Å; R503-M505 VanDerWaalsContact C-N 3.31Å; R503-M505 PolarHBondContact O-N 3.15Å; R503-H507 HydrophobicContact CG-CB 4.32Å; R503-H507 WeakPolarHBondContact O-CA 3.23Å; R503-H507 WeakPolarHBondContact O-CB 3.19Å; R503-H507 PolarHBondContact O-N 3.08Å; R503-H514 PolarHBondContact NH2-O 3.29Å
504	N	87.2	Confident	82.7	Confident	61 Å²	61	61.4 Å²	61.4	33%	0.326	29%	0.289	S	S	.	.	H	α-helix	trans	-74.3	-19.3	-175.4	-62.2	-38.4	0	0	0	113.8	E425 L429 W502 Q508	E425-N504 VanDerWaalsContact OE1-CB 3.29Å; E425-N504 WeakPolarHBondContact OE1-CB 3.44Å; E425-N504 PolarHBondContact OE1-ND2 3.09Å; E425-N504 PolarHBondContact OE2-ND2 3.39Å; L429-N504 HydrophobicContact CD1-CB 4.2Å; W502-N504 VanDerWaalsContact C-N 3.31Å; W502-N504 PolarHBondContact O-N 2.66Å; N504-Q508 WeakPolarHBondContact O-CA 3.22Å; N504-Q508 WeakPolarHBondContact O-CB 3.44Å
505	M	89.6	Confident	80.6	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-73.9	-58.3	169.2	178.2	65.2	79.7	0	0	110	F80 L429 H432 W502 R503	F80-M505 HydrophobicContact CD2-CG 3.84Å; F80-M505 HydrophobicContact CD2-SD 3.98Å; F80-M505 HydrophobicContact CE2-CG 3.64Å; F80-M505 HydrophobicContact CE2-SD 3.7Å; L429-M505 HydrophobicContact CD2-CB 4.05Å; L429-M505 HydrophobicContact CD2-CE 3.78Å; L429-M505 HydrophobicContact CD2-SD 3.92Å; H432-M505 HydrophobicContact CB-CE 3.76Å; H432-M505 HydrophobicContact CB-SD 4.37Å; H432-M505 PolarHBondContact ND1-SD 3Å; H432-M505 VanDerWaalsContact ND1-SD 3.41Å; W502-M505 HydrophobicContact CB-CB 4.25Å; W502-M505 HydrophobicContact CD2-CB 3.54Å; W502-M505 HydrophobicContact CD2-CE 4.39Å; W502-M505 HydrophobicContact CD2-CG 4.38Å; W502-M505 HydrophobicContact CE3-CB 3.84Å; W502-M505 HydrophobicContact CE3-CE 3.81Å; W502-M505 HydrophobicContact CE3-CG 4.18Å; W502-M505 HydrophobicContact CG-CB 3.7Å; W502-M505 HydrophobicContact CH2-CE 3.43Å; W502-M505 VanDerWaalsContact CH2-CE 3.43Å; W502-M505 HydrophobicContact CZ2-CE 4.02Å; W502-M505 HydrophobicContact CZ3-CE 3.29Å; W502-M505 PolarHBondContact O-N 3.03Å; W502-M505 VanDerWaalsContact O-N 3.16Å; R503-M505 VanDerWaalsContact C-N 3.31Å; R503-M505 PolarHBondContact O-N 3.15Å
506	Y	89.6	Confident	78.8	Confident	1 Å²	1	65.1 Å²	65.1	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-82.7	-17.3	-168.9	-60.9	-68.1	0	0	0	115.2	F80 L286 L289 L290 W313 E408 F501 W502	F80-Y506 HydrophobicContact CD1-CD1 4.48Å; F80-Y506 AromaticContact CD2-CD1 3.68Å; F80-Y506 HydrophobicContact CD2-CD1 3.68Å; F80-Y506 AromaticContact CD2-CE1 3.88Å; F80-Y506 HydrophobicContact CD2-CE1 3.88Å; F80-Y506 HydrophobicContact CE1-CE1 4.34Å; F80-Y506 AromaticContact CE2-CD1 3.89Å; F80-Y506 HydrophobicContact CE2-CD1 3.89Å; F80-Y506 AromaticContact CE2-CE1 3.57Å; F80-Y506 HydrophobicContact CE2-CE1 3.57Å; F80-Y506 HydrophobicContact CG-CD1 4.01Å; F80-Y506 HydrophobicContact CG-CE1 4.38Å; F80-Y506 HydrophobicContact CZ-CD1 4.41Å; F80-Y506 AromaticContact CZ-CE1 3.84Å; F80-Y506 HydrophobicContact CZ-CE1 3.84Å; L286-Y506 HydrophobicContact CD1-CE1 3.8Å; L289-Y506 HydrophobicContact CD2-CD1 4.27Å; L289-Y506 HydrophobicContact CD2-CD2 4.3Å; L289-Y506 HydrophobicContact CD2-CE1 3.89Å; L289-Y506 HydrophobicContact CD2-CE2 3.92Å; L289-Y506 HydrophobicContact CD2-CG 4.47Å; L290-Y506 HydrophobicContact CD2-CD1 3.89Å; L290-Y506 HydrophobicContact CD2-CE1 4.26Å; W313-Y506 VanDerWaalsContact CE2-OH 3.29Å; W313-Y506 WeakPolarHBondContact CZ2-OH 3.39Å; W313-Y506 PolarHBondContact NE1-OH 3.25Å; E408-Y506 PolarHBondContact OE2-OH 2.88Å; F501-Y506 HydrophobicContact CD2-CD2 4.22Å; F501-Y506 AromaticContact CE2-CD2 3.43Å; F501-Y506 HydrophobicContact CE2-CD2 3.43Å; F501-Y506 VanDerWaalsContact CE2-CD2 3.43Å; F501-Y506 HydrophobicContact CE2-CE2 4.18Å; F501-Y506 AromaticContact CE2-CG 3.99Å; F501-Y506 HydrophobicContact CE2-CG 3.99Å; F501-Y506 AromaticContact CZ-CD2 3.77Å; F501-Y506 HydrophobicContact CZ-CD2 3.77Å; F501-Y506 HydrophobicContact CZ-CG 4.03Å; W502-Y506 HydrophobicContact CB-CD2 4.43Å; W502-Y506 HydrophobicContact CB-CE2 4.29Å; W502-Y506 WeakPolarHBondContact O-CD2 3.3Å; W502-Y506 PolarHBondContact O-N 3.46Å
507	H	81.9	Confident	76.8	Confident	12 Å²	12	68.5 Å²	68.5	6%	0.056	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	21.5	177.4	-62	89.6	0	0	0	112.7	V293 F501 R503 F509 D510 M513 R516	V293-H507 WeakPolarHBondContact CG1-CE1 3.4Å; F501-H507 AromaticContact CE1-CE1 3.51Å; F501-H507 AromaticContact CE1-ND1 3.53Å; F501-H507 AromaticContact CZ-CE1 3.71Å; F501-H507 AromaticContact CZ-ND1 3.77Å; R503-H507 HydrophobicContact CG-CB 4.32Å; R503-H507 WeakPolarHBondContact O-CA 3.23Å; R503-H507 WeakPolarHBondContact O-CB 3.19Å; R503-H507 PolarHBondContact O-N 3.08Å; H507-F509 PolarHBondContact O-N 2.85Å; H507-D510 HydrophobicContact CB-CB 4.33Å; H507-D510 IonicContact CD2-OD2 2.8Å; H507-D510 PolarHBondContact CD2-OD2 2.99Å; H507-D510 IonicContact CG-OD2 3.51Å; H507-D510 PolarHBondContact O-N 2.97Å; H507-D510 VanDerWaalsContact O-N 3.13Å; H507-M513 PolarHBondContact CD2-SD 3.05Å; H507-R516 PolarHBondContact O-NH2 2.85Å
508	Q	79.7	Confident	75.1	Confident	45 Å²	45	62.1 Å²	62.1	21%	0.21	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-38.6	-175	-165.2	174.5	-36.8	0	0	113.1	N504 R516	N504-Q508 WeakPolarHBondContact O-CA 3.22Å; N504-Q508 WeakPolarHBondContact O-CB 3.44Å; Q508-R516 PolarHBondContact O-NH1 3.42Å; Q508-R516 PolarHBondContact O-NH2 2.72Å
509	F	77.8	Confident	73.6	Confident	56 Å²	56	65.3 Å²	65.3	25%	0.246	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-14.6	-172.9	-55.7	-78.6	0	0	0	113.8	N79 R81 H507 R511	N79-F509 WeakPolarHBondContact O-CE2 3.36Å; R81-F509 HydrophobicContact CB-CD1 4.4Å; R81-F509 HydrophobicContact CB-CD2 3.47Å; R81-F509 VanDerWaalsContact CB-CD2 3.47Å; R81-F509 HydrophobicContact CB-CE1 4.49Å; R81-F509 HydrophobicContact CB-CE2 3.62Å; R81-F509 HydrophobicContact CB-CG 3.91Å; R81-F509 HydrophobicContact CB-CZ 4.13Å; R81-F509 HydrophobicContact CG-CB 4.03Å; R81-F509 HydrophobicContact CG-CD1 3.91Å; R81-F509 HydrophobicContact CG-CD2 3.73Å; R81-F509 HydrophobicContact CG-CE1 4.33Å; R81-F509 HydrophobicContact CG-CE2 4.18Å; R81-F509 HydrophobicContact CG-CG 3.58Å; R81-F509 HydrophobicContact CG-CZ 4.46Å; H507-F509 PolarHBondContact O-N 2.85Å; F509-R511 PolarHBondContact O-N 3.48Å; F509-R511 VanDerWaalsContact O-N 3.12Å
510	D	74.1	Confident	72.2	Confident	22 Å²	22	66.3 Å²	66.3	12%	0.118	32%	0.319	C	S	.	.			trans	-80.7	94.3	-175.2	-64.4	-39.5	0	0	0	111.4	R17 F18 H507 R516	R17-D510 IonicContact NH1-OD1 2.8Å; R17-D510 IonicContact NH1-OD2 3.51Å; R17-D510 PolarHBondContact NH1-OD2 3.35Å; F18-D510 HydrophobicContact CD2-CB 4.41Å; F18-D510 HydrophobicContact CE2-CB 3.87Å; H507-D510 HydrophobicContact CB-CB 4.33Å; H507-D510 IonicContact CD2-OD2 2.8Å; H507-D510 PolarHBondContact CD2-OD2 2.99Å; H507-D510 IonicContact CG-OD2 3.51Å; H507-D510 PolarHBondContact O-N 2.97Å; H507-D510 VanDerWaalsContact O-N 3.13Å; D510-R516 PolarHBondContact O-NE 3.2Å; D510-R516 PolarHBondContact O-NH2 2.73Å
511	R	64	Low	70.8	Confident	119 Å²	119	67.7 Å²	67.7	45%	0.449	33%	0.325	S	S	.	.			trans	-79.6	-20.5	-173.3	-66.3	-177.2	179.6	-173.9	3.5	113.8	F509	F509-R511 PolarHBondContact O-N 3.48Å; F509-R511 VanDerWaalsContact O-N 3.12Å
512	S	62.1	Low	69.5	Low	52 Å²	52	69.4 Å²	69.4	36%	0.364	34%	0.338	S	S	.	.	S	Bend	trans	-87.1	-15.4	-173.3	30.6	0	0	0	0	114.6	D16	D16-S512 PolarHBondContact OD1-OG 2.81Å; D16-S512 PolarHBondContact OD2-OG 3.21Å
513	M	60.4	Low	68.3	Low	61 Å²	61	71.3 Å²	71.3	30%	0.3	35%	0.35	S	S	.	.	S	Bend	trans	-74.9	139.9	170.1	-77.7	-169.7	163.2	0	0	112.1	F18 H507	F18-M513 HydrophobicContact CD2-CG 4.42Å; F18-M513 HydrophobicContact CE1-CE 3.81Å; F18-M513 HydrophobicContact CE2-CE 4.25Å; F18-M513 HydrophobicContact CE2-CG 4.33Å; F18-M513 HydrophobicContact CZ-CE 3.61Å; F18-M513 HydrophobicContact CZ-SD 4.42Å; H507-M513 PolarHBondContact CD2-SD 3.05Å
514	H	51.5	Low	67.5	Low	164 Å²	164	70.4 Å²	70.4	76%	0.759	35%	0.352	S	S	*	.	S	Bend	trans	-25.1	142.3	-175.4	-85	-72.1	0	0	0	117.7	R503 R516	R503-H514 PolarHBondContact NH2-O 3.29Å; H514-R516 PolarHBondContact O-N 3.2Å
515	P	48.5	Very low	66.8	Low	95 Å²	95	70.8 Å²	70.8	62%	0.617	36%	0.357	S	S	*	.			trans	-46.9	128.3	-158.7	15.6	-31.5	0	0	0	114.6	Q517	P515-Q517 PolarHBondContact O-N 2.73Å
516	R	56.2	Low	66.2	Low	96 Å²	96	75.8 Å²	75.8	36%	0.362	38%	0.383	S	S	.	.			trans	-73.5	56.4	-175.6	-61.2	167.8	166.5	-144	-13.6	112.5	H507 Q508 D510 H514 S518	H507-R516 PolarHBondContact O-NH2 2.85Å; Q508-R516 PolarHBondContact O-NH1 3.42Å; Q508-R516 PolarHBondContact O-NH2 2.72Å; D510-R516 PolarHBondContact O-NE 3.2Å; D510-R516 PolarHBondContact O-NH2 2.73Å; H514-R516 PolarHBondContact O-N 3.2Å; R516-S518 VanDerWaalsContact C-N 3.25Å; R516-S518 PolarHBondContact O-N 3.42Å
517	Q	49	Very low	65.5	Low	162 Å²	162	81.3 Å²	81.3	76%	0.757	41%	0.407	S	S	*	.			trans	-75.4	79.7	174.8	-68.9	-173.4	-9	0	0	110.1	P515 I519	P515-Q517 PolarHBondContact O-N 2.73Å; Q517-I519 PolarHBondContact O-N 3.27Å
518	S	56.1	Low	65.3	Low	40 Å²	40	83.8 Å²	83.8	28%	0.28	42%	0.418	S	S	.	.			trans	-63	114.3	163.2	170	0	0	0	0	108	R516 L520 K521 T522	R516-S518 VanDerWaalsContact C-N 3.25Å; R516-S518 PolarHBondContact O-N 3.42Å; S518-L520 PolarHBondContact O-N 2.95Å; S518-K521 PolarHBondContact O-N 3.29Å; S518-K521 PolarHBondContact OG-N 3.11Å; S518-T522 PolarHBondContact O-N 3.49Å; S518-T522 PolarHBondContact O-OG1 2.93Å
519	I	60.8	Low	65.3	Low	136 Å²	136	85.7 Å²	85.7	70%	0.697	43%	0.43	S	S	*	.	H	α-helix	trans	-55.3	-41.3	177	-61.9	173.2	0	0	0	109.4	Q517 K521 T522 T523	Q517-I519 PolarHBondContact O-N 3.27Å; I519-K521 PolarHBondContact O-N 2.92Å; I519-T522 PolarHBondContact O-N 3.38Å; I519-T523 PolarHBondContact O-N 3.35Å; I519-T523 PolarHBondContact O-OG1 3.28Å
520	L	63.2	Low	65.5	Low	36 Å²	36	85.8 Å²	85.8	19%	0.188	44%	0.438	C	S	.	.	H	α-helix	trans	-56.9	-47.5	173.4	175.4	64.6	0	0	0	112.5	P477 F478 S518 T523 L524	P477-L520 VanDerWaalsContact CD-CD1 3.5Å; P477-L520 HydrophobicContact CG-CD1 4.08Å; F478-L520 HydrophobicContact CE2-CD1 4.24Å; S518-L520 PolarHBondContact O-N 2.95Å; L520-T523 PolarHBondContact O-N 3.41Å; L520-L524 HydrophobicContact CD1-CD1 4.23Å; L520-L524 HydrophobicContact CD1-CG 4.34Å; L520-L524 HydrophobicContact CG-CD1 4.07Å; L520-L524 WeakPolarHBondContact O-CB 3.34Å; L520-L524 WeakPolarHBondContact O-CG 3.49Å; L520-L524 PolarHBondContact O-N 2.86Å
521	K	62.4	Low	65.8	Low	132 Å²	132	92.2 Å²	92.2	57%	0.574	46%	0.46	S	S	*	.	H	α-helix	trans	-62.4	-44.7	177.8	-172.6	174.8	-178.7	176.3	0	111.2	S518 I519 T523 L524 T525	S518-K521 PolarHBondContact O-N 3.29Å; S518-K521 PolarHBondContact OG-N 3.11Å; I519-K521 PolarHBondContact O-N 2.92Å; K521-T523 VanDerWaalsContact C-N 3.34Å; K521-T523 PolarHBondContact O-N 3.32Å; K521-L524 WeakPolarHBondContact O-CB 3.39Å; K521-L524 PolarHBondContact O-N 2.89Å; K521-T525 PolarHBondContact O-N 2.95Å; K521-T525 PolarHBondContact O-OG1 2.87Å
522	T	64.3	Low	66.8	Low	70 Å²	70	91.4 Å²	91.4	43%	0.429	46%	0.462	S	S	.	.	H	α-helix	trans	-60.2	-44	175.6	-54.2	0	0	0	0	111.2	S518 I519 T525 L526	S518-T522 PolarHBondContact O-N 3.49Å; S518-T522 PolarHBondContact O-OG1 2.93Å; I519-T522 PolarHBondContact O-N 3.38Å; T522-T525 PolarHBondContact O-N 2.96Å; T522-L526 HydrophobicContact CG2-CD1 4.06Å; T522-L526 WeakPolarHBondContact O-CB 3.35Å; T522-L526 VanDerWaalsContact O-CG 3.27Å; T522-L526 WeakPolarHBondContact O-CG 3.42Å; T522-L526 PolarHBondContact O-N 2.86Å
523	T	68.6	Low	67.8	Low	39 Å²	39	91.3 Å²	91.3	24%	0.239	46%	0.464	C	S	.	.	H	α-helix	trans	-68.7	-36.9	177.8	-52	0	0	0	0	112.8	F478 I519 L520 K521 L526 K527	F478-T523 HydrophobicContact CE1-CG2 3.88Å; F478-T523 HydrophobicContact CE2-CG2 4.38Å; F478-T523 HydrophobicContact CZ-CG2 3.5Å; I519-T523 PolarHBondContact O-N 3.35Å; I519-T523 PolarHBondContact O-OG1 3.28Å; L520-T523 PolarHBondContact O-N 3.41Å; K521-T523 VanDerWaalsContact C-N 3.34Å; K521-T523 PolarHBondContact O-N 3.32Å; T523-L526 PolarHBondContact O-N 2.88Å; T523-K527 VanDerWaalsContact O-CB 3.25Å; T523-K527 WeakPolarHBondContact O-CB 3.41Å; T523-K527 PolarHBondContact O-N 2.94Å
524	L	70	Confident	69.1	Low	78 Å²	78	92.9 Å²	92.9	41%	0.408	47%	0.471	S	S	.	.	H	α-helix	trans	-57.8	-50.9	171.8	-85.4	164.9	0	0	0	111	P477 L520 K521 L526 K527 E528	P477-L524 HydrophobicContact CB-CD2 4.49Å; P477-L524 HydrophobicContact CG-CD2 3.31Å; P477-L524 HydrophobicContact CG-CG 3.74Å; L520-L524 HydrophobicContact CD1-CD1 4.23Å; L520-L524 HydrophobicContact CD1-CG 4.34Å; L520-L524 HydrophobicContact CG-CD1 4.07Å; L520-L524 WeakPolarHBondContact O-CB 3.34Å; L520-L524 WeakPolarHBondContact O-CG 3.49Å; L520-L524 PolarHBondContact O-N 2.86Å; K521-L524 WeakPolarHBondContact O-CB 3.39Å; K521-L524 PolarHBondContact O-N 2.89Å; L524-L526 PolarHBondContact O-N 2.97Å; L524-K527 PolarHBondContact O-N 2.9Å; L524-E528 PolarHBondContact O-N 2.93Å
525	T	73.8	Confident	70.8	Confident	70 Å²	70	88.7 Å²	88.7	43%	0.429	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-43.9	176.8	-57.8	0	0	0	0	111.6	K521 T522 K527 E528 N529	K521-T525 PolarHBondContact O-N 2.95Å; K521-T525 PolarHBondContact O-OG1 2.87Å; T522-T525 PolarHBondContact O-N 2.96Å; T525-K527 PolarHBondContact O-N 3.2Å; T525-E528 PolarHBondContact O-N 3.29Å; T525-N529 WeakPolarHBondContact O-CB 3.26Å; T525-N529 PolarHBondContact O-N 3.25Å; T525-N529 PolarHBondContact O-OD1 2.62Å
526	L	75.6	Confident	72.8	Confident	105 Å²	105	88 Å²	88	55%	0.55	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-39.3	176.1	-72.3	170	0	0	0	112.7	T522 T523 L524 S530	T522-L526 HydrophobicContact CG2-CD1 4.06Å; T522-L526 WeakPolarHBondContact O-CB 3.35Å; T522-L526 VanDerWaalsContact O-CG 3.27Å; T522-L526 WeakPolarHBondContact O-CG 3.42Å; T522-L526 PolarHBondContact O-N 2.86Å; T523-L526 PolarHBondContact O-N 2.88Å; L524-L526 PolarHBondContact O-N 2.97Å; L526-S530 WeakPolarHBondContact O-CB 3.37Å; L526-S530 PolarHBondContact O-N 2.9Å
527	K	75.4	Confident	74.3	Confident	118 Å²	118	88.4 Å²	88.4	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-68.2	-40.8	178.5	-169.1	177.2	-173.9	179.7	0	111.5	P477 T523 L524 T525 S530 R531	P477-K527 HydrophobicContact CB-CD 3.94Å; P477-K527 PolarHBondContact O-NZ 3.07Å; T523-K527 VanDerWaalsContact O-CB 3.25Å; T523-K527 WeakPolarHBondContact O-CB 3.41Å; T523-K527 PolarHBondContact O-N 2.94Å; L524-K527 PolarHBondContact O-N 2.9Å; T525-K527 PolarHBondContact O-N 3.2Å; K527-S530 WeakPolarHBondContact O-CB 3.5Å; K527-S530 PolarHBondContact O-N 3.39Å; K527-R531 WeakPolarHBondContact O-CB 3.33Å; K527-R531 PolarHBondContact O-N 3.41Å
528	E	78.3	Confident	76.2	Confident	63 Å²	63	88.6 Å²	88.6	29%	0.294	46%	0.457	S	S	.	.	H	α-helix	trans	-68.1	-43.2	174.7	-177.9	55.1	-160.5	0	0	111.6	L524 T525 S530 R531 Q532	L524-E528 PolarHBondContact O-N 2.93Å; T525-E528 PolarHBondContact O-N 3.29Å; E528-S530 VanDerWaalsContact C-N 3.29Å; E528-S530 PolarHBondContact O-N 2.94Å; E528-R531 VanDerWaalsContact CD-NH2 3.28Å; E528-R531 WeakPolarHBondContact O-CB 3.39Å; E528-R531 PolarHBondContact O-N 2.79Å; E528-R531 VanDerWaalsContact O-N 3.13Å; E528-R531 IonicContact OE1-CZ 3.61Å; E528-R531 IonicContact OE1-NE 3.6Å; E528-R531 IonicContact OE1-NH2 2.77Å; E528-R531 PolarHBondContact OE1-NH2 3.41Å; E528-R531 IonicContact OE2-CZ 3.26Å; E528-R531 VanDerWaalsContact OE2-CZ 3.26Å; E528-R531 IonicContact OE2-NE 2.76Å; E528-R531 PolarHBondContact OE2-NE 3.3Å; E528-R531 IonicContact OE2-NH2 3.01Å; E528-R531 PolarHBondContact OE2-NH2 3.33Å; E528-Q532 WeakPolarHBondContact O-CG 3.5Å; E528-Q532 PolarHBondContact O-N 3.17Å; E528-Q532 PolarHBondContact OE1-NE2 2.68Å
529	N	79	Confident	77.7	Confident	85 Å²	85	89.5 Å²	89.5	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-59.4	-39.7	173.2	-67.8	0.9	0	0	0	111.6	T525 Q532 A533	T525-N529 WeakPolarHBondContact O-CB 3.26Å; T525-N529 PolarHBondContact O-N 3.25Å; T525-N529 PolarHBondContact O-OD1 2.62Å; N529-Q532 PolarHBondContact O-N 2.78Å; N529-A533 WeakPolarHBondContact O-CB 3.46Å; N529-A533 PolarHBondContact O-N 2.9Å
530	S	82.1	Confident	78.9	Confident	58 Å²	58	87.3 Å²	87.3	41%	0.406	46%	0.456	S	S	.	.	H	α-helix	trans	-62.5	-45.8	173.5	-165.1	0	0	0	0	111.4	L526 K527 E528 Q532 A533 E534	L526-S530 WeakPolarHBondContact O-CB 3.37Å; L526-S530 PolarHBondContact O-N 2.9Å; K527-S530 WeakPolarHBondContact O-CB 3.5Å; K527-S530 PolarHBondContact O-N 3.39Å; E528-S530 VanDerWaalsContact C-N 3.29Å; E528-S530 PolarHBondContact O-N 2.94Å; S530-Q532 VanDerWaalsContact C-N 3.33Å; S530-Q532 PolarHBondContact O-N 2.87Å; S530-A533 PolarHBondContact O-N 3.41Å; S530-E534 WeakPolarHBondContact O-CG 3.44Å; S530-E534 PolarHBondContact O-N 2.86Å; S530-E534 PolarHBondContact OG-OE1 2.75Å
531	R	81.2	Confident	80	Confident	157 Å²	157	90.1 Å²	90.1	59%	0.592	47%	0.468	S	S	*	.	H	α-helix	trans	-61.8	-40.1	177.8	-169	178.5	72.5	117.4	6.3	112	K527 E528 S535	K527-R531 WeakPolarHBondContact O-CB 3.33Å; K527-R531 PolarHBondContact O-N 3.41Å; E528-R531 VanDerWaalsContact CD-NH2 3.28Å; E528-R531 WeakPolarHBondContact O-CB 3.39Å; E528-R531 PolarHBondContact O-N 2.79Å; E528-R531 VanDerWaalsContact O-N 3.13Å; E528-R531 IonicContact OE1-CZ 3.61Å; E528-R531 IonicContact OE1-NE 3.6Å; E528-R531 IonicContact OE1-NH2 2.77Å; E528-R531 PolarHBondContact OE1-NH2 3.41Å; E528-R531 IonicContact OE2-CZ 3.26Å; E528-R531 VanDerWaalsContact OE2-CZ 3.26Å; E528-R531 IonicContact OE2-NE 2.76Å; E528-R531 PolarHBondContact OE2-NE 3.3Å; E528-R531 IonicContact OE2-NH2 3.01Å; E528-R531 PolarHBondContact OE2-NH2 3.33Å; R531-S535 WeakPolarHBondContact O-CB 3.3Å; R531-S535 PolarHBondContact O-N 3.08Å
532	Q	84.3	Confident	81.1	Confident	102 Å²	102	87.4 Å²	87.4	48%	0.477	46%	0.463	S	S	.	.	H	α-helix	trans	-68	-40.3	175	-70.1	177.2	11.6	0	0	111.9	E528 N529 S530 S535 T536	E528-Q532 WeakPolarHBondContact O-CG 3.5Å; E528-Q532 PolarHBondContact O-N 3.17Å; E528-Q532 PolarHBondContact OE1-NE2 2.68Å; N529-Q532 PolarHBondContact O-N 2.78Å; S530-Q532 VanDerWaalsContact C-N 3.33Å; S530-Q532 PolarHBondContact O-N 2.87Å; Q532-S535 PolarHBondContact O-N 3.14Å; Q532-T536 WeakPolarHBondContact O-CB 3.35Å; Q532-T536 PolarHBondContact O-N 3.22Å; Q532-T536 PolarHBondContact O-OG1 2.75Å
533	A	83.9	Confident	82.2	Confident	51 Å²	51	92.2 Å²	92.2	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-44.4	174.1	0	0	0	0	0	112	N529 S530 T536 L537	N529-A533 WeakPolarHBondContact O-CB 3.46Å; N529-A533 PolarHBondContact O-N 2.9Å; S530-A533 PolarHBondContact O-N 3.41Å; A533-T536 PolarHBondContact O-N 3.47Å; A533-L537 WeakPolarHBondContact O-CB 3.43Å; A533-L537 WeakPolarHBondContact O-CG 3.18Å; A533-L537 PolarHBondContact O-N 2.92Å
534	E	87.8	Confident	82.9	Confident	93 Å²	93	93.9 Å²	93.9	44%	0.435	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-42.9	174.2	-75.3	172.7	-138.6	0	0	112.4	S530 L537 R538	S530-E534 WeakPolarHBondContact O-CG 3.44Å; S530-E534 PolarHBondContact O-N 2.86Å; S530-E534 PolarHBondContact OG-OE1 2.75Å; E534-L537 PolarHBondContact O-N 3.26Å; E534-R538 WeakPolarHBondContact O-CG 3.32Å; E534-R538 PolarHBondContact O-N 2.66Å
535	S	87.3	Confident	83.5	Confident	77 Å²	77	96.4 Å²	96.4	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-61.8	-44.8	175	-170.9	0	0	0	0	111.5	R531 Q532 R538 A539	R531-S535 WeakPolarHBondContact O-CB 3.3Å; R531-S535 PolarHBondContact O-N 3.08Å; Q532-S535 PolarHBondContact O-N 3.14Å; S535-R538 PolarHBondContact O-N 2.81Å; S535-A539 PolarHBondContact O-N 3.15Å
536	T	89.4	Confident	83.9	Confident	81 Å²	81	100.3 Å²	100.3	50%	0.497	50%	0.501	S	S	.	.	H	α-helix	trans	-63.1	-42.3	177.2	-54.1	0	0	0	0	111.3	Q532 A533 A539 L540	Q532-T536 WeakPolarHBondContact O-CB 3.35Å; Q532-T536 PolarHBondContact O-N 3.22Å; Q532-T536 PolarHBondContact O-OG1 2.75Å; A533-T536 PolarHBondContact O-N 3.47Å; T536-A539 PolarHBondContact O-N 3.49Å; T536-L540 HydrophobicContact CG2-CD1 4.09Å; T536-L540 HydrophobicContact CG2-CG 4.48Å; T536-L540 WeakPolarHBondContact O-CB 3.49Å; T536-L540 VanDerWaalsContact O-CG 3.31Å; T536-L540 WeakPolarHBondContact O-CG 3.32Å; T536-L540 PolarHBondContact O-N 3.31Å
537	L	89	Confident	84.3	Confident	104 Å²	104	101.2 Å²	101.2	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-59.1	-48.8	174.2	-78.3	168.5	0	0	0	111.5	A533 E534 A539 L540 E541	A533-L537 WeakPolarHBondContact O-CB 3.43Å; A533-L537 WeakPolarHBondContact O-CG 3.18Å; A533-L537 PolarHBondContact O-N 2.92Å; E534-L537 PolarHBondContact O-N 3.26Å; L537-A539 VanDerWaalsContact C-N 3.32Å; L537-A539 PolarHBondContact O-N 2.81Å; L537-L540 PolarHBondContact O-N 3.07Å; L537-E541 WeakPolarHBondContact O-CG 2.92Å; L537-E541 PolarHBondContact O-N 3.45Å
538	R	87.6	Confident	84.3	Confident	165 Å²	165	98.7 Å²	98.7	62%	0.623	51%	0.514	S	S	*	.	H	α-helix	trans	-61.4	-38.2	177.5	-68.8	176.9	-167.5	-169.9	7.1	112.7	E534 S535 T542	E534-R538 WeakPolarHBondContact O-CG 3.32Å; E534-R538 PolarHBondContact O-N 2.66Å; S535-R538 PolarHBondContact O-N 2.81Å; R538-T542 WeakPolarHBondContact O-CB 3.39Å; R538-T542 PolarHBondContact O-N 2.96Å; R538-T542 PolarHBondContact O-OG1 3.29Å
539	A	87.6	Confident	84	Confident	60 Å²	60	99.3 Å²	99.3	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-43.7	174.9	0	0	0	0	0	111.6	S535 T536 L537 T542 R543	S535-A539 PolarHBondContact O-N 3.15Å; T536-A539 PolarHBondContact O-N 3.49Å; L537-A539 VanDerWaalsContact C-N 3.32Å; L537-A539 PolarHBondContact O-N 2.81Å; A539-T542 PolarHBondContact O-N 3.17Å; A539-R543 WeakPolarHBondContact O-CB 3.14Å; A539-R543 PolarHBondContact O-N 3Å
540	L	87	Confident	83.2	Confident	90 Å²	90	101 Å²	101	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-43.4	176.4	-71.2	171.2	0	0	0	112.3	T536 L537 T542 R543 L544	T536-L540 HydrophobicContact CG2-CD1 4.09Å; T536-L540 HydrophobicContact CG2-CG 4.48Å; T536-L540 WeakPolarHBondContact O-CB 3.49Å; T536-L540 VanDerWaalsContact O-CG 3.31Å; T536-L540 WeakPolarHBondContact O-CG 3.32Å; T536-L540 PolarHBondContact O-N 3.31Å; L537-L540 PolarHBondContact O-N 3.07Å; L540-T542 VanDerWaalsContact C-N 3.28Å; L540-T542 PolarHBondContact O-N 2.98Å; L540-R543 PolarHBondContact O-N 2.68Å; L540-L544 WeakPolarHBondContact O-CB 2.99Å; L540-L544 WeakPolarHBondContact O-CG 3.44Å; L540-L544 PolarHBondContact O-N 2.75Å
541	E	86.4	Confident	82	Confident	95 Å²	95	102.3 Å²	102.3	44%	0.444	54%	0.542	S	S	.	.	H	α-helix	trans	-58.1	-40.5	172.7	-76.1	179.6	179.1	0	0	112.1	L537 L544 K545	L537-E541 WeakPolarHBondContact O-CG 2.92Å; L537-E541 PolarHBondContact O-N 3.45Å; E541-L544 PolarHBondContact O-N 2.78Å; E541-K545 VanDerWaalsContact O-CG 3.31Å; E541-K545 WeakPolarHBondContact O-CG 3.4Å; E541-K545 PolarHBondContact O-N 2.97Å
542	T	85.5	Confident	80.8	Confident	75 Å²	75	101.1 Å²	101.1	46%	0.46	55%	0.552	S	S	.	*	H	α-helix	trans	-66.5	-42.3	177.5	-57.4	0	0	0	0	110.9	R538 A539 L540 K545 Q546	R538-T542 WeakPolarHBondContact O-CB 3.39Å; R538-T542 PolarHBondContact O-N 2.96Å; R538-T542 PolarHBondContact O-OG1 3.29Å; A539-T542 PolarHBondContact O-N 3.17Å; L540-T542 VanDerWaalsContact C-N 3.28Å; L540-T542 PolarHBondContact O-N 2.98Å; T542-K545 PolarHBondContact O-N 3.16Å; T542-Q546 WeakPolarHBondContact O-CG 3.33Å; T542-Q546 PolarHBondContact O-N 3.42Å
543	R	86.6	Confident	79.1	Confident	170 Å²	170	100.7 Å²	100.7	64%	0.642	57%	0.566	S	S	*	*	H	α-helix	trans	-67.8	-37.3	176.3	-163.5	172.9	-176.9	175	1.4	112.6	A539 L540 Q546 L547	A539-R543 WeakPolarHBondContact O-CB 3.14Å; A539-R543 PolarHBondContact O-N 3Å; L540-R543 PolarHBondContact O-N 2.68Å; R543-Q546 PolarHBondContact O-N 3.28Å; R543-L547 HydrophobicContact CG-CD1 4.41Å; R543-L547 VanDerWaalsContact O-CG 3.32Å; R543-L547 WeakPolarHBondContact O-CG 3.38Å; R543-L547 PolarHBondContact O-N 3Å
544	L	84.1	Confident	77.4	Confident	75 Å²	75	104.4 Å²	104.4	39%	0.393	58%	0.583	S	S	.	*	H	α-helix	trans	-64.3	-42.9	173.4	-76.6	166.4	0	0	0	111.7	L540 E541 Q546 L547 G548 V549	L540-L544 WeakPolarHBondContact O-CB 2.99Å; L540-L544 WeakPolarHBondContact O-CG 3.44Å; L540-L544 PolarHBondContact O-N 2.75Å; E541-L544 PolarHBondContact O-N 2.78Å; L544-Q546 PolarHBondContact O-N 3.35Å; L544-L547 CarbonylContact O-C 3.6Å; L544-L547 PolarHBondContact O-N 3.35Å; L544-L547 VanDerWaalsContact O-N 3.15Å; L544-G548 PolarHBondContact O-N 3.08Å; L544-V549 HydrophobicContact CB-CB 4.41Å; L544-V549 HydrophobicContact CD2-CB 4.02Å; L544-V549 HydrophobicContact CD2-CG1 4.12Å; L544-V549 HydrophobicContact CD2-CG2 4.39Å; L544-V549 PolarHBondContact O-N 3.16Å
545	K	81	Confident	75.4	Confident	130 Å²	130	104.9 Å²	104.9	57%	0.565	60%	0.597	S	S	*	*	H	α-helix	trans	-60.7	-41.4	172.9	-74.4	168.4	-177.8	167.7	0	112.2	E541 T542 L547 G548	E541-K545 VanDerWaalsContact O-CG 3.31Å; E541-K545 WeakPolarHBondContact O-CG 3.4Å; E541-K545 PolarHBondContact O-N 2.97Å; T542-K545 PolarHBondContact O-N 3.16Å; K545-L547 VanDerWaalsContact C-N 3.28Å; K545-L547 PolarHBondContact O-N 3.44Å; K545-G548 PolarHBondContact O-N 3.08Å; K545-G548 VanDerWaalsContact O-N 3.16Å
546	Q	82.4	Confident	73.4	Confident	152 Å²	152	108 Å²	108	71%	0.71	61%	0.607	S	S	*	*	H	α-helix	trans	-63.6	-32.3	174.5	-73.4	171.7	-9.4	0	0	112.9	T542 R543 L544 G548	T542-Q546 WeakPolarHBondContact O-CG 3.33Å; T542-Q546 PolarHBondContact O-N 3.42Å; R543-Q546 PolarHBondContact O-N 3.28Å; L544-Q546 PolarHBondContact O-N 3.35Å; Q546-G548 VanDerWaalsContact C-N 3.27Å; Q546-G548 PolarHBondContact O-N 2.78Å
547	L	83.8	Confident	71.3	Confident	125 Å²	125	109.5 Å²	109.5	65%	0.654	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	7.7	175.9	-67.2	168.7	0	0	0	113.5	R543 L544 K545 V549	R543-L547 HydrophobicContact CG-CD1 4.41Å; R543-L547 VanDerWaalsContact O-CG 3.32Å; R543-L547 WeakPolarHBondContact O-CG 3.38Å; R543-L547 PolarHBondContact O-N 3Å; L544-L547 CarbonylContact O-C 3.6Å; L544-L547 PolarHBondContact O-N 3.35Å; L544-L547 VanDerWaalsContact O-N 3.15Å; K545-L547 VanDerWaalsContact C-N 3.28Å; K545-L547 PolarHBondContact O-N 3.44Å; L547-V549 VanDerWaalsContact C-N 3.26Å; L547-V549 HydrophobicContact CB-CG2 4.48Å; L547-V549 PolarHBondContact O-N 3.4Å
548	G	75.6	Confident	69.2	Low	65 Å²	65	110.5 Å²	110.5	67%	0.67	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.6	10.8	178.8	0	0	0	0	0	115	L544 K545 Q546	L544-G548 PolarHBondContact O-N 3.08Å; K545-G548 PolarHBondContact O-N 3.08Å; K545-G548 VanDerWaalsContact O-N 3.16Å; Q546-G548 VanDerWaalsContact C-N 3.27Å; Q546-G548 PolarHBondContact O-N 2.78Å
549	V	73.4	Confident	67.1	Low	75 Å²	75	106.8 Å²	106.8	46%	0.455	64%	0.636	S	S	.	*			trans	-91.2	105.9	179.8	-175.6	0	0	0	0	109.5	L544 L547	L544-V549 HydrophobicContact CB-CB 4.41Å; L544-V549 HydrophobicContact CD2-CB 4.02Å; L544-V549 HydrophobicContact CD2-CG1 4.12Å; L544-V549 HydrophobicContact CD2-CG2 4.39Å; L544-V549 PolarHBondContact O-N 3.16Å; L547-V549 VanDerWaalsContact C-N 3.26Å; L547-V549 HydrophobicContact CB-CG2 4.48Å; L547-V549 PolarHBondContact O-N 3.4Å
550	T	60.9	Low	64.9	Low	121 Å²	121	109.5 Å²	109.5	74%	0.742	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-71.6	127.3	170.4	48.5	0	0	0	0	110.3	V552	T550-V552 PolarHBondContact O-N 3.3Å
551	P	57.7	Low	62.7	Low	85 Å²	85	110.7 Å²	110.7	55%	0.552	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-63.5	134.6	173.6	26.8	-33.1	0	0	0	109.9	A553	P551-A553 PolarHBondContact O-N 3.49Å
552	V	55.9	Low	60.4	Low	133 Å²	133	112.2 Å²	112.2	81%	0.806	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-65	117.9	174	177.4	0	0	0	0	108.1	T550 T554	T550-V552 PolarHBondContact O-N 3.3Å; V552-T554 PolarHBondContact O-N 3.37Å
553	A	48.7	Very low	58.5	Low	92 Å²	92	115.4 Å²	115.4	76%	0.76	70%	0.7	S	S	*	*			trans	-68.2	102.7	174.4	0	0	0	0	0	109.4	P551 S555	P551-A553 PolarHBondContact O-N 3.49Å; A553-S555 PolarHBondContact O-N 3.09Å
554	T	48.1	Very low	56	Low	129 Å²	129	118.5 Å²	118.5	79%	0.791	71%	0.711	S	S	*	*			trans	-72.7	93.1	167.1	51.3	0	0	0	0	108.7	V552 D556	V552-T554 PolarHBondContact O-N 3.37Å; T554-D556 PolarHBondContact O-N 3.01Å
555	S	45.6	Very low	53.8	Low	104 Å²	104	121.2 Å²	121.2	73%	0.727	73%	0.726	S	S	*	*			trans	-66.6	95.8	164.1	53.7	0	0	0	0	109.3	A553	A553-S555 PolarHBondContact O-N 3.09Å
556	D	44.7	Very low	52	Low	141 Å²	141	123.6 Å²	123.6	75%	0.754	74%	0.739	S	S	*	*	S	Bend	trans	155.9	142.2	140	-79	-20.8	0	0	0	110.5	T554	T554-D556 PolarHBondContact O-N 3.01Å
557	P	45.6	Very low	49.6	Very low	113 Å²	113	128.5 Å²	128.5	73%	0.734	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-69.5	137	172.1	29.7	-33.1	0	0	0	110	A559	P557-A559 PolarHBondContact O-N 3.47Å
558	P	45.3	Very low	47.6	Very low	126 Å²	126	129 Å²	129	82%	0.818	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-66	128.8	179.6	26.5	-33.4	0	0	0	110.7
559	A	42.7	Very low	45.6	Very low	86 Å²	86	133.4 Å²	133.4	71%	0.711	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-58.9	148.9	171.9	0	0	0	0	0	111	P557	P557-A559 PolarHBondContact O-N 3.47Å
560	P	42.6	Very low	43.9	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-60.2	139	-179.7	25.1	-34.2	0	0	0	111
561	P	41	Very low	42.7	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-68.2	142.2	-172.4	27.1	-34.5	0	0	0	111.6
562	P	37.9	Very low	41.6	Very low	126 Å²	126	138.7 Å²	138.7	82%	0.818	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.4	134.3	177.4	29.1	-34.2	0	0	0	110.8	R564	P562-R564 PolarHBondContact O-N 2.93Å
563	T	44.6	Very low	40.6	Very low	143 Å²	143	138.3 Å²	138.3	88%	0.877	80%	0.796	S	S	*	*			trans	-67.4	113.7	171.4	46.4	0	0	0	0	110.9
564	R	35.1	Very low	39.7	Very low	235 Å²	235	144.9 Å²	144.9	89%	0.887	80%	0.801	S	S	*	*			trans	-154	154.5	154.9	-149.4	167.1	-179	175.8	-0.1	113.8	P562	P562-R564 PolarHBondContact O-N 2.93Å
565	D	37.3	Very low	38.6	Very low	132 Å²	132	144.7 Å²	144.7	71%	0.706	80%	0.802	S	S	*	*			trans	-64.6	149.1	-163.8	-55	-84.1	0	0	0	117.5
566	Q	42.8	Very low	37.8	Very low	179 Å²	179	147 Å²	147	84%	0.836	81%	0.807	S	S	*	*			trans	35.6	112.3	143.8	-59.9	-176.2	16.3	0	0	118.9
567	R	32.8	Very low	37.1	Very low	256 Å²	256	144.2 Å²	144.2	97%	0.966	80%	0.798	S	S	*	*				-147	138	128.2	-108.5	165.6	-157.4	-150	3	111.2
568	T	41.1	Very low	36.1	Very low	136 Å²	136	147.3 Å²	147.3	83%	0.834	81%	0.807	S	S	*	*			trans	-73.2	138.1	-177	46.9	0	0	0	0	112.2
569	N	34.9	Very low	35.4	Very low	156 Å²	156	146.9 Å²	146.9	83%	0.834	80%	0.797	S	S	*	*			trans	-138.3	147	153.3	-100.3	-17.2	0	0	0	109
570	P	37.6	Very low	35	Very low	121 Å²	121	148.1 Å²	148.1	79%	0.786	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.9	143.7	-173.3	28.9	-34.5	0	0	0	112.3
571	L	34	Very low	34.2	Very low	166 Å²	166	145.6 Å²	145.6	87%	0.869	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.1	146.3	171.6	-72.9	160.5	0	0	0	110.6
572	P	35.9	Very low	33.4	Very low	106 Å²	106	143.9 Å²	143.9	69%	0.688	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-63.6	157	171.6	28.5	-34.8	0	0	0	111.4
573	P	33.7	Very low	32.9	Very low	124 Å²	124	143.5 Å²	143.5	81%	0.805	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-60.9	146.6	178.8	25.9	-34	0	0	0	111.5
574	R	30.5	Very low	32.1	Very low	230 Å²	230	143.9 Å²	143.9	87%	0.868	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-64.3	141.6	178.1	-68.6	175.9	174.5	166.6	-0.7	110.4
575	P	25.8	Very low	31.7	Very low	126 Å²	126	137.9 Å²	137.9	82%	0.818	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.7	155	30.2	-31.4	0	0	0	109
576	D	28.5	Very low	31.5	Very low	153 Å²	153	139.6 Å²	139.6	82%	0.818	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71.3	146	171.5	-82.8	-48.7	0	0	0	111.4
577	S	28.8	Very low	31	Very low	81 Å²	81	138.5 Å²	138.5	57%	0.566	76%	0.756	S	S	*	*			trans	47.3	97.6	155.4	179.1	0	0	0	0	118.6
578	L	26	Very low	30.8	Very low	179 Å²	179	133.2 Å²	133.2	94%	0.937	74%	0.742	S	S	*	*			trans	-122.6	113.2	144.3	-77.4	176.7	0	0	0	110.5
579	I	30.6	Very low	30.3	Very low	117 Å²	117	131 Å²	131	60%	0.6	73%	0.729	S	S	*	*			trans	-84.9	151.4	-163.3	-70.1	164.8	0	0	0	111.3	G581	I579-G581 PolarHBondContact O-N 3.39Å
580	L	34.1	Very low	30.1	Very low	111 Å²	111	130.4 Å²	130.4	58%	0.581	72%	0.721	S	S	*	*			trans	-68.8	94.5	163.9	-83.5	157.4	0	0	0	109.5
581	G	25.8	Very low	29.6	Very low	65 Å²	65	133.6 Å²	133.6	67%	0.67	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-83.2	154.9	169.5	0	0	0	0	0	112.9	I579	I579-G581 PolarHBondContact O-N 3.39Å
582	A	24.4	Very low	29.4	Very low	80 Å²	80	135.2 Å²	135.2	66%	0.661	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-68.2	169.8	166.8	0	0	0	0	0	110.7
583	P	27.1	Very low	29.2	Very low	118 Å²	118	137.6 Å²	137.6	77%	0.766	71%	0.714	S	S	*	*	S	Bend	trans	-58.6	143.2	-177.4	23	-34.7	0	0	0	112.9	N585	P583-N585 PolarHBondContact O-N 3.14Å
584	I	26.6	Very low	29	Very low	151 Å²	151	138.8 Å²	138.8	77%	0.774	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-63.7	131.3	-173.3	-64.8	164.3	0	0	0	110.5
585	N	28.3	Very low	29	Very low	108 Å²	108	133.7 Å²	133.7	58%	0.578	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-87.4	118.5	179	-173.5	-2.5	0	0	0	110.1	P583 K587 E588	P583-N585 PolarHBondContact O-N 3.14Å; N585-K587 PolarHBondContact O-N 3.05Å; N585-E588 PolarHBondContact O-N 3.44Å
586	H	33.3	Very low	29.2	Very low	169 Å²	169	135 Å²	135	78%	0.782	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	4.8	-177.2	-82.4	-76.3	0	0	0	116.3
587	K	30.9	Very low	29.3	Very low	156 Å²	156	136.5 Å²	136.5	68%	0.678	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-15.4	176.1	-78.2	-168.8	168.7	-169.8	0	115.4	N585	N585-K587 PolarHBondContact O-N 3.05Å
588	E	28.5	Very low	29.4	Very low	144 Å²	144	140.3 Å²	140.3	67%	0.673	71%	0.71	S	S	*	*	S	Bend	trans	-82.9	-16.4	-178	-68.1	-173.3	151.3	0	0	113.9	N585	N585-E588 PolarHBondContact O-N 3.44Å
589	V	31.7	Very low	29.5	Very low	90 Å²	90	139.8 Å²	139.8	55%	0.545	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	-38.4	179.6	-177.1	0	0	0	0	111.5	R591 R592	V589-R591 PolarHBondContact O-N 3.13Å; V589-R592 PolarHBondContact O-N 2.94Å
590	Q	29.3	Very low	29.4	Very low	143 Å²	143	143.2 Å²	143.2	67%	0.668	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-15.8	-174	-77.2	-175.1	-49.8	0	0	115.5
591	R	28.1	Very low	29	Very low	188 Å²	188	145.1 Å²	145.1	71%	0.709	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-26.2	176.3	-68.4	-168.9	-170.8	-171.2	1.7	113.4	V589 E593 E594	V589-R591 PolarHBondContact O-N 3.13Å; R591-E593 PolarHBondContact O-N 2.82Å; R591-E594 PolarHBondContact O-N 2.83Å
592	R	29.7	Very low	29.1	Very low	200 Å²	200	145.6 Å²	145.6	76%	0.755	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-12.9	-178.5	-70.5	-173.3	176.2	-174.1	-1.2	113.8	V589	V589-R592 PolarHBondContact O-N 2.94Å
593	E	31.3	Very low	29.2	Very low	156 Å²	156	151.2 Å²	151.2	73%	0.729	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-8	175.9	-63.7	-179.7	159.2	0	0	112.6	R591	R591-E593 PolarHBondContact O-N 2.82Å
594	E	29.6	Very low	29.1	Very low	149 Å²	149	155.3 Å²	155.3	70%	0.696	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-23.5	179.4	-66.1	-177.1	157.3	0	0	113.3	R591	R591-E594 PolarHBondContact O-N 2.83Å
595	D	29.9	Very low	29	Very low	124 Å²	124	152.7 Å²	152.7	66%	0.663	77%	0.765	S	S	*	*	S	Bend	trans	-86.3	-19.8	-177.8	-68	-30.4	0	0	0	113.7	E597 Q598	D595-E597 VanDerWaalsContact C-N 3.26Å; D595-E597 PolarHBondContact O-N 3.33Å; D595-Q598 PolarHBondContact O-N 3.49Å
596	D	30.1	Very low	28.8	Very low	153 Å²	153	156.9 Å²	156.9	82%	0.818	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-2.7	-176.3	-90.2	-7.3	0	0	0	114.5
597	E	31.7	Very low	28.3	Very low	184 Å²	184	157.8 Å²	157.8	86%	0.86	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	1.2	176.2	-74.5	-162.2	154.8	0	0	114.5	D595	D595-E597 VanDerWaalsContact C-N 3.26Å; D595-E597 PolarHBondContact O-N 3.33Å
598	Q	30.1	Very low	28	Very low	162 Å²	162	155.8 Å²	155.8	76%	0.757	79%	0.793	S	S	*	*	S	Bend	trans	-136.3	68.2	-175.8	-68.2	-179.5	45.5	0	0	113.8	D595	D595-Q598 PolarHBondContact O-N 3.49Å
599	D	27.5	Very low	27.7	Very low	168 Å²	168	154.8 Å²	154.8	90%	0.898	80%	0.797	S	S	*	*			trans	-161.9	63.5	156.3	-101.6	-23.8	0	0	0	112.6
600	E	28.6	Very low	27.4	Very low	189 Å²	189	157 Å²	157	88%	0.883	81%	0.806	S	S	*	*			trans	-105.9	133.7	147.7	-83.6	-162.9	162.5	0	0	109.1
601	V	27.4	Very low	27.2	Very low	151 Å²	151	156.1 Å²	156.1	92%	0.915	81%	0.811	S	S	*	*			trans	109.6	114	168.7	-178.7	0	0	0	0	116.2
602	G	26.7	Very low	27.1	Very low	75 Å²	75	155.8 Å²	155.8	77%	0.773	82%	0.817	S	S	*	*			trans	127.5	94.7	142.6	0	0	0	0	0	117.6
603	E	27.1	Very low	27	Very low	197 Å²	197	158.1 Å²	158.1	92%	0.921	83%	0.826	S	S	*	*			trans	-76.8	146.6	156	-64.9	177.9	120.2	0	0	110.5
604	E	24.4	Very low	26.7	Very low	204 Å²	204	156.7 Å²	156.7	95%	0.953	83%	0.828	S	S	*	*				-167.6	159.3	129.3	-111.1	177.5	-163.3	0	0	111.5
605	A	25.1	Very low	26.6	Very low	97 Å²	97	156 Å²	156	80%	0.802	83%	0.833	S	S	*	*			trans	-117	158.1	-164.2	0	0	0	0	0	114
606	M	24.4	Very low	26.3	Very low	195 Å²	195	158.9 Å²	158.9	96%	0.961	84%	0.843	S	S	*	*			trans	-157.1	146.2	151.9	-131.4	176.8	-174.9	0	0	114.4
607	E	23.1	Very low	26.1	Very low	189 Å²	189	154.9 Å²	154.9	88%	0.883	84%	0.838	S	S	*	*			trans	-87.8	155.8	176.8	-55.5	169.2	115.3	0	0	112.2
608	S	24.1	Very low	25.8	Very low	114 Å²	114	152.1 Å²	152.1	80%	0.797	84%	0.839	S	S	*	*			trans	-168	130.6	130.8	63.3	0	0	0	0	114.1
609	T	22.8	Very low	25.7	Very low	122 Å²	122	150 Å²	150	75%	0.748	84%	0.842	S	S	*	*			trans	-43.7	163.6	157.5	54.6	0	0	0	0	113.7
610	D	24.3	Very low	25.6	Very low	136 Å²	136	144.8 Å²	144.8	73%	0.727	83%	0.827	S	S	*	*			cis	179	172.3	39.4	-146.9	-13.9	0	0	0	114
611	T	25.3	Very low	25.5	Very low	126 Å²	126	141.8 Å²	141.8	77%	0.773	83%	0.828	S	S	*	*			trans	73.4	128.4	152.2	52.2	0	0	0	0	123.9
612	E	25.6	Very low	25.4	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	82%	0.824	S	S	*	*			trans	-81	166.8	169.2	-48.6	166.7	118.8	0	0	113.2
613	R	27.5	Very low	25.4	Very low	250 Å²	250	144.9 Å²	144.9	94%	0.943	82%	0.824	S	S	*	*			trans	-157.8	138.2	138.9	-112.7	171.7	-161.7	-172.7	6.1	113.3
614	T	25.2	Very low	25.4	Very low	126 Å²	126	145.8 Å²	145.8	77%	0.773	82%	0.819	S	S	*	*			trans	-107.7	-163.8	-176.2	42.2	0	0	0	0	112
615	V	27.2	Very low	25.5	Very low	133 Å²	133	143.1 Å²	143.1	81%	0.806	81%	0.805	S	S	*	*			trans	92.2	137.6	175.8	-176.1	0	0	0	0	113.9
616	E	24.2	Very low	25.5	Very low	186 Å²	186	146.3 Å²	146.3	87%	0.869	80%	0.803	S	S	*	*			cis	163.6	161.1	-29.8	-107.6	-164.2	165.4	0	0	106.9
617	G	25.8	Very low	25.6	Very low	69 Å²	69	141.1 Å²	141.1	71%	0.711	79%	0.786	S	S	*	*			trans	105.9	117	174.5	0	0	0	0	0	113.7
618	S	25.9	Very low	25.9	Very low	125 Å²	125	143.2 Å²	143.2	87%	0.874	79%	0.787	S	S	*	*			cis	63.9	127.9	37.3	-153.2	0	0	0	0	112.6
619	S	27.1	Very low	26	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	78%	0.784	S	S	*	*			cis	-145.1	-163.6	-1.8	66	0	0	0	0	108.6
620	G	25.8	Very low	26.2	Very low	57 Å²	57	144.1 Å²	144.1	59%	0.588	79%	0.789	S	S	*	*			cis	167.5	-179.5	8.8	0	0	0	0	0	110.9
621	S	26.5	Very low	26.3	Very low	127 Å²	127	145.4 Å²	145.4	89%	0.888	80%	0.795	S	S	*	*			trans	53.5	159.5	165.8	56.5	0	0	0	0	121
622	E	25.5	Very low	26.4	Very low	178 Å²	178	148.3 Å²	148.3	83%	0.832	80%	0.8	S	S	*	*			cis	-168.5	172.7	-42.9	-140.4	-172.3	-179.1	0	0	109.1
623	S	26.4	Very low	26.4	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	79%	0.794	S	S	*	*			trans	76	153	158.4	89.7	0	0	0	0	119
624	R	26.4	Very low	26.4	Very low	215 Å²	215	137.7 Å²	137.7	81%	0.811	79%	0.789	S	S	*	*			cis	-173.2	163.4	-33.1	-142.4	-178.3	170.1	166.2	-1.1	110.2
625	K	27	Very low	26.4	Very low	149 Å²	149	138 Å²	138	65%	0.648	80%	0.796	S	S	*	*			trans	76.3	119.4	152.4	-74.4	177.4	166.1	-168	0	119.4
626	Q	26.3	Very low	26.3	Very low	164 Å²	164	139.6 Å²	139.6	77%	0.766	80%	0.799	S	S	*	*				90.8	151.5	95.9	-78.5	179.3	-51.1	0	0	113.1
627	S	25.3	Very low	26.5	Very low	86 Å²	86	134.5 Å²	134.5	60%	0.601	80%	0.797	S	S	*	*			cis	-171.3	-178.6	-9.4	176.8	0	0	0	0	108.2
628	Y	28.9	Very low	26.5	Very low	232 Å²	232	140.3 Å²	140.3	91%	0.91	81%	0.805	S	S	*	*			trans	78.8	143.7	174.3	-56.8	-86.9	0	0	0	116.3
629	G	26.4	Very low	26.7	Very low	70 Å²	70	143.1 Å²	143.1	72%	0.722	81%	0.81	S	S	*	*			cis	165.7	131.4	-5.8	0	0	0	0	0	112.9
630	E	27.5	Very low	26.7	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.864	81%	0.805	S	S	*	*			trans	-12.6	148.8	168.9	-62.9	162.3	164.2	0	0	121.4
631	L	27	Very low	26.8	Very low	163 Å²	163	148.2 Å²	148.2	85%	0.853	82%	0.817	S	S	*	*				-175.4	165.9	107.9	-96.4	163.5	0	0	0	114.6
632	E	26.5	Very low	26.8	Very low	188 Å²	188	152 Å²	152	88%	0.879	82%	0.821	S	S	*	*			trans	-101.4	176.7	-159.2	-53.2	169.4	117.2	0	0	115.4
633	G	25.9	Very low	26.8	Very low	70 Å²	70	151.5 Å²	151.5	72%	0.722	82%	0.818	S	S	*	*			trans	174.7	54.5	172.6	0	0	0	0	0	119.4
634	T	26.9	Very low	27.1	Very low	136 Å²	136	152 Å²	152	83%	0.834	82%	0.819	S	S	*	*			trans	20.7	132.2	141.1	44.6	0	0	0	0	123.7
635	C	26	Very low	27.1	Very low	134 Å²	134	146.1 Å²	146.1	91%	0.905	82%	0.816	S	S	*	*				-161.2	140	127.5	-119.8	0	0	0	0	113.6
636	N	26.2	Very low	26.9	Very low	166 Å²	166	145.2 Å²	145.2	89%	0.888	82%	0.823	S	S	*	*			trans	-96.7	162.9	-177.4	-76	-17.3	0	0	0	113
637	G	26.9	Very low	26.8	Very low	79 Å²	79	144 Å²	144	81%	0.814	83%	0.826	S	S	*	*			trans	-179.2	94.1	166.4	0	0	0	0	0	112.9
638	E	27.1	Very low	26.7	Very low	191 Å²	191	144.4 Å²	144.4	89%	0.893	83%	0.83	S	S	*	*			trans	-84.5	151.7	-175.4	-57.8	173.4	124.8	0	0	113.5
639	L	28.6	Very low	26.5	Very low	184 Å²	184	141.9 Å²	141.9	96%	0.963	83%	0.831	S	S	*	*			trans	-159	136.5	145.3	-108.8	161.6	0	0	0	109.2
640	A	28.7	Very low	26.4	Very low	89 Å²	89	146.9 Å²	146.9	74%	0.736	84%	0.835	S	S	*	*			trans	-105.8	140.3	-156.1	0	0	0	0	0	115.7
641	K	27.3	Very low	26.4	Very low	194 Å²	194	146 Å²	146	84%	0.843	84%	0.836	S	S	*	*			trans	40.2	130.5	144.1	-67.5	-172.6	173	-171	0	121.1
642	E	25.7	Very low	26.3	Very low	205 Å²	205	142 Å²	142	96%	0.958	83%	0.833	S	S	*	*				-142.9	140.2	114.7	-111.8	175.4	-168.5	0	0	110.2
643	E	26.9	Very low	26.3	Very low	168 Å²	168	139.3 Å²	139.3	79%	0.785	83%	0.83	S	S	*	*			trans	-114.2	147.2	176.2	-124	178.3	-151.8	0	0	107
644	P	32.7	Very low	26.3	Very low	125 Å²	125	140.7 Å²	140.7	81%	0.812	83%	0.834	S	S	*	*				-149.5	-173.4	79.4	42.9	-24.1	0	0	0	112.4
645	A	24.6	Very low	26.1	Very low	90 Å²	90	144.8 Å²	144.8	74%	0.744	83%	0.834	S	S	*	*			cis	-144.9	152.7	5.8	0	0	0	0	0	110.6
646	V	23.9	Very low	26	Very low	130 Å²	130	147.7 Å²	147.7	79%	0.788	84%	0.837	S	S	*	*			trans	-82.3	135.4	176.9	176.7	0	0	0	0	111.2
647	V	24.1	Very low	26	Very low	138 Å²	138	145.6 Å²	145.6	84%	0.836	83%	0.83	S	S	*	*			trans	-115.9	123.8	160.4	-179.8	0	0	0	0	108
648	S	23.4	Very low	26.1	Very low	96 Å²	96	151.7 Å²	151.7	67%	0.671	86%	0.858	S	S	*	*			trans	-76.7	133.2	-172.5	49.6	0	0	0	0	113.2
649	L	25.5	Very low	26.1	Very low	178 Å²	178	149.8 Å²	149.8	93%	0.932	86%	0.856	S	S	*	*			trans	-89.7	107.6	167.5	-80.4	161.8	0	0	0	110.2
650	E	23.8	Very low	25.9	Very low	175 Å²	175	147.9 Å²	147.9	82%	0.818	85%	0.851	S	S	*	*			trans	-93.2	108.3	168.3	-72.4	-165.4	143.9	0	0	111.6
651	L	27.1	Very low	25.8	Very low	168 Å²	168	151.2 Å²	151.2	88%	0.88	86%	0.857	S	S	*	*			trans	46.5	114.4	140.3	-65.9	164.4	0	0	0	120.1
652	G	24.9	Very low	25.7	Very low	77 Å²	77	148.7 Å²	148.7	79%	0.794	86%	0.858	S	S	*	*			trans	-162.4	39	169	0	0	0	0	0	114.8
653	V	26.4	Very low	25.7	Very low	133 Å²	133	145.2 Å²	145.2	81%	0.806	85%	0.852	S	S	*	*			trans	-85.7	112.2	-177.8	-179.7	0	0	0	0	111.4
654	A	25.1	Very low	25.6	Very low	98 Å²	98	143.7 Å²	143.7	81%	0.81	86%	0.856	S	S	*	*			trans	-80.6	115.4	165.2	0	0	0	0	0	110.2
655	R	23.7	Very low	25.1	Very low	222 Å²	222	145 Å²	145	84%	0.838	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-71.9	132.8	169.4	-74.6	176.3	168.8	171.9	-4.4	110
656	M	23.1	Very low	25.1	Very low	196 Å²	196	149.2 Å²	149.2	97%	0.966	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-102.5	123.6	143.6	-75.8	-172.1	177.9	0	0	107.7
657	T	25.8	Very low	25.2	Very low	122 Å²	122	150.8 Å²	150.8	75%	0.748	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-86	151.5	169.5	43.6	0	0	0	0	110.3
658	C	30.1	Very low	25.3	Very low	207 Å²	207	152 Å²	152	100%	1.399	88%	0.878	S	S	*	*			trans	-21.2	0	-179.9	-51.2	0	0	0	0	117.7

Retrieved 658 of 658 residues in 1571.9 ms (Link to these results)

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