A0A077Z1P3_TRITR Loading...

receptor protein serine/threonine kinase

AlphaFold DB , UniProt , Accession A0A077Z1P3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 509 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	34.2	Very low	72.4	Confident	236 Å²	236	103.8 Å²	103.8	100%	1.163	53%	0.526	S	S	*	.				0	125.3	0	-69.5	-176.7	174.7	0	0	107.9	R3	M1-R3 PolarHBondContact O-N 2.91Å
2	P	43.1	Very low	74	Confident	125 Å²	125	96 Å²	96	81%	0.812	49%	0.488	S	S	*	.			trans	-63.5	129.8	170.4	11.3	-0.9	0	0	0	107.5	L4	P2-L4 PolarHBondContact O-N 3.27Å
3	R	50.4	Low	74.8	Confident	251 Å²	251	92.2 Å²	92.2	95%	0.947	48%	0.475	S	S	*	.			trans	-61.5	108.8	174	-75.1	-176	-177.5	-166.1	0.9	107.3	M1 S5	M1-R3 PolarHBondContact O-N 2.91Å; R3-S5 PolarHBondContact O-N 3.36Å
4	L	62.5	Low	74.6	Confident	130 Å²	130	91.6 Å²	91.6	68%	0.681	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-55.9	133.2	169.9	-78.3	153.4	0	0	0	108.2	P2 P27	P2-L4 PolarHBondContact O-N 3.27Å; L4-P27 HydrophobicContact CB-CB 4.49Å
5	S	69.3	Low	73.7	Confident	32 Å²	32	98.5 Å²	98.5	22%	0.224	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-58.2	139.2	174.8	47.7	0	0	0	0	109.7	R3 G28	R3-S5 PolarHBondContact O-N 3.36Å; S5-G28 PolarHBondContact O-N 3.45Å; S5-G28 WeakPolarHBondContact OG-CA 3.43Å
6	A	79.9	Confident	73.3	Confident	74 Å²	74	100.9 Å²	100.9	61%	0.612	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-60.2	150	174.1	0	0	0	0	0	110.1	V8	A6-V8 PolarHBondContact O-N 2.94Å
7	P	86.6	Confident	73.2	Confident	72 Å²	72	98.8 Å²	98.8	47%	0.468	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-52.3	133.8	169.9	-25.9	35.5	0	0	0	111	V24 T25 P27	P7-V24 HydrophobicContact CB-CG1 4Å; P7-T25 WeakPolarHBondContact CB-O 3.35Å; P7-P27 HydrophobicContact CG-CG 4.3Å
8	V	90.1	Very high	73.7	Confident	12 Å²	12	94.6 Å²	94.6	7%	0.073	51%	0.511	C	S	.	.			trans	-120.4	144.8	173.2	-71.2	0	0	0	0	109.3	A6 T25 D86	A6-V8 PolarHBondContact O-N 2.94Å; V8-T25 HydrophobicContact CG2-CG2 3.89Å; V8-T25 WeakPolarHBondContact CG2-OG1 3.39Å; V8-T25 PolarHBondContact N-OG1 3.44Å; V8-T25 PolarHBondContact O-N 3.28Å; V8-T25 PolarHBondContact O-OG1 3.22Å; V8-D86 WeakPolarHBondContact CA-OD1 3.41Å
9	R	93	Very high	74.2	Confident	124 Å²	124	95.3 Å²	95.3	47%	0.468	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.8	172.8	-172.4	174.3	-78.5	173.3	-5	108.8	C23 V24 D86 F87	R9-C23 CarbonylContact C-O 3.55Å; R9-C23 WeakPolarHBondContact CA-O 3.39Å; R9-V24 HydrophobicContact CB-CG2 4.5Å; R9-V24 HydrophobicContact CG-CG2 4.42Å; R9-D86 HydrophobicContact CB-CB 4.19Å; R9-D86 PolarHBondContact N-OD1 2.93Å; R9-D86 CarbonylContact O-C 3.54Å; R9-D86 WeakPolarHBondContact O-CA 3.42Å; R9-F87 VanDerWaalsContact CD-CZ 3.48Å; R9-F87 HydrophobicContact CG-CE1 4.12Å; R9-F87 HydrophobicContact CG-CE2 4.33Å; R9-F87 HydrophobicContact CG-CZ 3.82Å; R9-F87 PolarHBondContact O-N 3.48Å
10	C	93.1	Very high	74.8	Confident	0 Å²	0	98.2 Å²	98.2	0%	0	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	153	180	-46	0	0	0	0	110.5	T22 C23 T25 C31 C54	C10-T22 VanDerWaalsContact O-CA 3.24Å; C10-T22 WeakPolarHBondContact O-CA 3.33Å; C10-C23 PolarHBondContact N-O 3.42Å; C10-C23 PolarHBondContact O-N 3.31Å; C10-T25 WeakPolarHBondContact SG-CG2 3.46Å; C10-C31 HydrophobicContact CB-CB 3.61Å; C10-C31 WeakPolarHBondContact CB-SG 3.49Å; C10-C31 WeakPolarHBondContact SG-CA 3.37Å; C10-C31 WeakPolarHBondContact SG-CB 3.48Å; C10-C31 CovalentContact SG-SG 2.01Å; C10-C31 PolarHBondContact SG-SG 3.34Å; C10-C54 PolarHBondContact SG-SG 3.09Å
11	Y	93.9	Very high	75.5	Confident	86 Å²	86	95.7 Å²	95.7	34%	0.337	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.6	163.3	-178.7	-106.9	0	0	0	109.7	A21 Y52 G53 N89 L90	Y11-A21 WeakPolarHBondContact CD2-O 3.36Å; Y11-A21 HydrophobicContact CE2-CB 4.08Å; Y11-Y52 AromaticContact CD1-CD1 3.94Å; Y11-Y52 HydrophobicContact CD1-CD1 3.94Å; Y11-Y52 AromaticContact CD1-CD2 3.95Å; Y11-Y52 HydrophobicContact CD1-CD2 3.95Å; Y11-Y52 AromaticContact CD1-CG 3.6Å; Y11-Y52 HydrophobicContact CD1-CG 3.6Å; Y11-Y52 AromaticContact CE1-CD2 3.86Å; Y11-Y52 HydrophobicContact CE1-CD2 3.86Å; Y11-Y52 HydrophobicContact CE1-CE2 4.31Å; Y11-Y52 HydrophobicContact CE1-CG 4.02Å; Y11-Y52 WeakPolarHBondContact O-CB 3.31Å; Y11-G53 PolarHBondContact O-N 3.25Å; Y11-N89 PolarHBondContact N-OD1 3.37Å; Y11-N89 PolarHBondContact O-ND2 3.18Å; Y11-L90 HydrophobicContact CD1-CD2 3.68Å; Y11-L90 HydrophobicContact CD2-CD2 4.21Å; Y11-L90 HydrophobicContact CE1-CD2 4.39Å; Y11-L90 HydrophobicContact CG-CD2 3.57Å; Y11-L90 HydrophobicContact CG-CG 4.27Å
12	C	91.7	Very high	78.2	Confident	10 Å²	10	86 Å²	86	7%	0.068	48%	0.48	C	S	.	.			trans	-143.9	121.7	-167.3	-167.2	0	0	0	0	109.3	C18 A21 C23 Y52	C12-C18 VanDerWaalsContact CA-SG 3.5Å; C12-C18 HydrophobicContact CB-CB 3.62Å; C12-C18 WeakPolarHBondContact CB-SG 3.35Å; C12-C18 VanDerWaalsContact SG-CA 3.57Å; C12-C18 WeakPolarHBondContact SG-CB 3.05Å; C12-C18 CovalentContact SG-SG 1.98Å; C12-C18 PolarHBondContact SG-SG 3.03Å; C12-A21 PolarHBondContact N-O 3Å; C12-A21 CarbonylContact O-C 3.59Å; C12-A21 WeakPolarHBondContact O-CA 3.46Å; C12-C23 HydrophobicContact CB-CB 4.1Å; C12-Y52 WeakPolarHBondContact CA-O 3.4Å
13	S	85.4	Confident	80.5	Confident	47 Å²	47	80.9 Å²	80.9	33%	0.329	45%	0.447	S	S	.	.			trans	-101.9	-16.9	-170.5	61.5	0	0	0	0	115.2	Y52	S13-Y52 PolarHBondContact N-O 3.22Å; S13-Y52 PolarHBondContact OG-N 3.22Å; S13-Y52 PolarHBondContact OG-O 3.01Å
14	D	70.7	Confident	82.5	Confident	83 Å²	83	73 Å²	73	44%	0.444	43%	0.427	S	S	.	.	S	Bend	trans	-92.8	131.7	-177.4	-79.6	-25.8	0	0	0	112	V16 C18	D14-V16 PolarHBondContact O-N 2.87Å; D14-C18 VanDerWaalsContact O-CB 3.31Å; D14-C18 WeakPolarHBondContact O-CB 3.35Å; D14-C18 PolarHBondContact O-SG 3.33Å
15	E	62.2	Low	83.7	Confident	195 Å²	195	67 Å²	67	91%	0.911	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.4	179.8	-66.3	-175.7	166.3	0	0	113.6	G17	E15-G17 PolarHBondContact O-N 3.29Å
16	V	67.5	Low	84.4	Confident	138 Å²	138	70.6 Å²	70.6	84%	0.836	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	105.2	179.3	-172.2	0	0	0	0	110.5	D14	D14-V16 PolarHBondContact O-N 2.87Å
17	G	70.3	Confident	84.5	Confident	64 Å²	64	70.8 Å²	70.8	66%	0.66	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	-8.7	174.2	0	0	0	0	0	114.8	E15	E15-G17 PolarHBondContact O-N 3.29Å
18	C	83.5	Confident	84.1	Confident	24 Å²	24	68.6 Å²	68.6	16%	0.162	39%	0.393	C	S	.	.			trans	-86.7	133.8	168.4	-51.5	0	0	0	0	110.6	C12 D14 T22	C12-C18 VanDerWaalsContact CA-SG 3.5Å; C12-C18 HydrophobicContact CB-CB 3.62Å; C12-C18 WeakPolarHBondContact CB-SG 3.35Å; C12-C18 VanDerWaalsContact SG-CA 3.57Å; C12-C18 WeakPolarHBondContact SG-CB 3.05Å; C12-C18 CovalentContact SG-SG 1.98Å; C12-C18 PolarHBondContact SG-SG 3.03Å; D14-C18 VanDerWaalsContact O-CB 3.31Å; D14-C18 WeakPolarHBondContact O-CB 3.35Å; D14-C18 PolarHBondContact O-SG 3.33Å; C18-T22 CarbonylContact C-O 3.57Å; C18-T22 WeakPolarHBondContact CA-O 3.47Å
19	V	83.3	Confident	83.9	Confident	107 Å²	107	68 Å²	68	65%	0.648	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-113.9	119.7	169.6	-176.9	0	0	0	0	107.3	A21 T22	V19-A21 PolarHBondContact O-N 3.18Å; V19-T22 PolarHBondContact N-O 3.13Å; V19-T22 PolarHBondContact O-N 3.05Å; V19-T22 VanDerWaalsContact O-O 3.07Å; V19-T22 PolarHBondContact O-OG1 3.44Å
20	N	85.7	Confident	83.8	Confident	153 Å²	153	64.1 Å²	64.1	82%	0.818	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	47.9	-175	-65.8	-16.8	0	0	0	113.7	T22	N20-T22 PolarHBondContact O-N 3.05Å; N20-T22 VanDerWaalsContact O-N 3.16Å
21	A	89.3	Confident	83.7	Confident	47 Å²	47	64.1 Å²	64.1	39%	0.388	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	22.3	-176.8	0	0	0	0	0	114.7	Y11 C12 V19	Y11-A21 WeakPolarHBondContact CD2-O 3.36Å; Y11-A21 HydrophobicContact CE2-CB 4.08Å; C12-A21 PolarHBondContact N-O 3Å; C12-A21 CarbonylContact O-C 3.59Å; C12-A21 WeakPolarHBondContact O-CA 3.46Å; V19-A21 PolarHBondContact O-N 3.18Å
22	T	91.7	Very high	83.7	Confident	33 Å²	33	61.6 Å²	61.6	20%	0.202	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	155.6	178.5	68.8	0	0	0	0	111.7	C10 C18 V19 N20 F87	C10-T22 VanDerWaalsContact O-CA 3.24Å; C10-T22 WeakPolarHBondContact O-CA 3.33Å; C18-T22 CarbonylContact C-O 3.57Å; C18-T22 WeakPolarHBondContact CA-O 3.47Å; V19-T22 PolarHBondContact N-O 3.13Å; V19-T22 PolarHBondContact O-N 3.05Å; V19-T22 VanDerWaalsContact O-O 3.07Å; V19-T22 PolarHBondContact O-OG1 3.44Å; N20-T22 PolarHBondContact O-N 3.05Å; N20-T22 VanDerWaalsContact O-N 3.16Å; T22-F87 HydrophobicContact CG2-CE1 3.65Å; T22-F87 HydrophobicContact CG2-CZ 4.13Å
23	C	91	Very high	83.7	Confident	16 Å²	16	61.5 Å²	61.5	11%	0.108	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	162.7	166.3	62.9	0	0	0	0	108.8	R9 C10 C12 G53 C54	R9-C23 CarbonylContact C-O 3.55Å; R9-C23 WeakPolarHBondContact CA-O 3.39Å; C10-C23 PolarHBondContact N-O 3.42Å; C10-C23 PolarHBondContact O-N 3.31Å; C12-C23 HydrophobicContact CB-CB 4.1Å; C23-G53 VanDerWaalsContact SG-C 3.53Å; C23-C54 HydrophobicContact CB-CB 4.05Å; C23-C54 WeakPolarHBondContact CB-SG 3.45Å; C23-C54 WeakPolarHBondContact SG-CB 3.25Å; C23-C54 PolarHBondContact SG-N 3.14Å; C23-C54 CovalentContact SG-SG 2.04Å; C23-C54 PolarHBondContact SG-SG 3.3Å
24	V	91	Very high	83.9	Confident	86 Å²	86	60.1 Å²	60.1	52%	0.521	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.2	176.1	-179.1	0	0	0	0	108.3	P7 R9	P7-V24 HydrophobicContact CB-CG1 4Å; R9-V24 HydrophobicContact CB-CG2 4.5Å; R9-V24 HydrophobicContact CG-CG2 4.42Å
25	T	87.8	Confident	84.8	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.025	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-68	144.4	-179.8	60.1	0	0	0	0	111.3	P7 V8 C10 A29 C54	P7-T25 WeakPolarHBondContact CB-O 3.35Å; V8-T25 HydrophobicContact CG2-CG2 3.89Å; V8-T25 WeakPolarHBondContact CG2-OG1 3.39Å; V8-T25 PolarHBondContact N-OG1 3.44Å; V8-T25 PolarHBondContact O-N 3.28Å; V8-T25 PolarHBondContact O-OG1 3.22Å; C10-T25 WeakPolarHBondContact SG-CG2 3.46Å; T25-A29 HydrophobicContact CG2-CB 4.36Å; T25-C54 HydrophobicContact CG2-CB 4.07Å
26	K	85.2	Confident	86	Confident	108 Å²	108	51.5 Å²	51.5	47%	0.47	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.4	156.3	163.1	-71	179.8	179.1	-178.8	0	109.1	G28 A29 T57 E58	K26-G28 PolarHBondContact O-N 2.95Å; K26-A29 WeakPolarHBondContact O-CB 3.4Å; K26-A29 PolarHBondContact O-N 3.01Å; K26-T57 HydrophobicContact CB-CG2 3.68Å; K26-T57 VanDerWaalsContact CD-OG1 3.26Å; K26-T57 WeakPolarHBondContact CD-OG1 3.47Å; K26-E58 IonicContact NZ-OE1 2.82Å; K26-E58 PolarHBondContact NZ-OE1 3.24Å
27	P	82.2	Confident	86.8	Confident	77 Å²	77	47.2 Å²	47.2	50%	0.5	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	126.8	175.8	-26	34.2	0	0	0	111.9	L4 P7	L4-P27 HydrophobicContact CB-CB 4.49Å; P7-P27 HydrophobicContact CG-CG 4.3Å
28	G	78.6	Confident	87.3	Confident	27 Å²	27	50.6 Å²	50.6	28%	0.278	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	-7.6	-175.5	0	0	0	0	0	116.5	S5 K26	S5-G28 PolarHBondContact O-N 3.45Å; S5-G28 WeakPolarHBondContact OG-CA 3.43Å; K26-G28 PolarHBondContact O-N 2.95Å
29	A	85.4	Confident	87.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.296	C	S	.	.			trans	-82.7	166.5	170.6	0	0	0	0	0	112.4	T25 K26 L55 T57	T25-A29 HydrophobicContact CG2-CB 4.36Å; K26-A29 WeakPolarHBondContact O-CB 3.4Å; K26-A29 PolarHBondContact O-N 3.01Å; A29-L55 WeakPolarHBondContact CB-O 3.28Å; A29-T57 HydrophobicContact CB-CG2 3.53Å
30	Q	89.5	Confident	87.1	Confident	42 Å²	42	51.5 Å²	51.5	20%	0.196	28%	0.275	C	S	.	.			trans	-125.1	151	-175.9	-57	178.5	-15.7	0	0	110.2	L55 C81 C82 F83	Q30-L55 HydrophobicContact CB-CD1 4.39Å; Q30-L55 PolarHBondContact O-N 3.03Å; Q30-C81 HydrophobicContact CB-CB 3.97Å; Q30-C82 WeakPolarHBondContact CA-O 3.35Å; Q30-C82 WeakPolarHBondContact CB-O 3.48Å; Q30-F83 HydrophobicContact CG-CB 4.18Å; Q30-F83 HydrophobicContact CG-CD1 4.09Å
31	C	92.4	Very high	86.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	148.1	164.3	-54.2	0	0	0	0	109.3	C10 G53 C81 C82 N89	C10-C31 HydrophobicContact CB-CB 3.61Å; C10-C31 WeakPolarHBondContact CB-SG 3.49Å; C10-C31 WeakPolarHBondContact SG-CA 3.37Å; C10-C31 WeakPolarHBondContact SG-CB 3.48Å; C10-C31 CovalentContact SG-SG 2.01Å; C10-C31 PolarHBondContact SG-SG 3.34Å; C31-G53 CarbonylContact C-O 3.57Å; C31-G53 WeakPolarHBondContact CA-O 3.43Å; C31-C81 CarbonylContact O-C 3.48Å; C31-C81 WeakPolarHBondContact O-CA 3.45Å; C31-C81 WeakPolarHBondContact O-CB 3.32Å; C31-C82 PolarHBondContact N-O 3.42Å; C31-C82 PolarHBondContact O-N 3.27Å; C31-N89 HydrophobicContact CB-CB 3.71Å
32	F	92.4	Very high	86.5	Confident	33 Å²	33	51.3 Å²	51.3	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	157.7	174.4	78	-90.8	0	0	0	113.1	A34 F51 Y52 G53 L55 I79 K80 C81 N89	F32-A34 HydrophobicContact CD2-CB 3.99Å; F32-A34 HydrophobicContact CE2-CB 4.13Å; F32-F51 HydrophobicContact CE2-CB 4.09Å; F32-F51 WeakPolarHBondContact CE2-O 3.41Å; F32-Y52 WeakPolarHBondContact O-CA 3.48Å; F32-G53 VanDerWaalsContact CD1-C 3.41Å; F32-G53 VanDerWaalsContact CD1-O 3.29Å; F32-G53 WeakPolarHBondContact CD1-O 3.36Å; F32-G53 VanDerWaalsContact CE1-C 3.41Å; F32-G53 VanDerWaalsContact CE1-CA 3.45Å; F32-G53 PolarHBondContact N-O 3.05Å; F32-G53 PolarHBondContact O-N 3.15Å; F32-L55 HydrophobicContact CB-CD1 4.44Å; F32-L55 HydrophobicContact CB-CD2 4.38Å; F32-L55 HydrophobicContact CB-CG 4.19Å; F32-L55 HydrophobicContact CD1-CD2 3.84Å; F32-L55 HydrophobicContact CD1-CG 3.96Å; F32-L55 HydrophobicContact CE1-CD2 4.48Å; F32-L55 HydrophobicContact CG-CD2 4.27Å; F32-L55 HydrophobicContact CG-CG 4.43Å; F32-I79 HydrophobicContact CB-CD1 4.05Å; F32-I79 HydrophobicContact CB-CG1 4.22Å; F32-I79 HydrophobicContact CD2-CD1 4.07Å; F32-I79 HydrophobicContact CD2-CG1 4.44Å; F32-I79 HydrophobicContact CG-CD1 4.21Å; F32-K80 WeakPolarHBondContact CA-O 3.33Å; F32-C81 HydrophobicContact CB-CB 4.47Å; F32-N89 WeakPolarHBondContact O-CB 3.33Å; F32-N89 PolarHBondContact O-ND2 3.27Å
33	H	93	Very high	86	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.037	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	122.3	160	177.7	-172.2	0	0	0	107	H50 F51 Y52 K80 L92 P94	H33-H50 AromaticContact CE1-ND1 3.56Å; H33-H50 AromaticContact NE2-CE1 3.82Å; H33-H50 AromaticContact NE2-CG 3.82Å; H33-H50 AromaticContact NE2-ND1 2.87Å; H33-H50 PolarHBondContact NE2-ND1 3.07Å; H33-F51 CarbonylContact C-O 3.59Å; H33-F51 WeakPolarHBondContact CA-O 3.34Å; H33-Y52 HydrophobicContact CB-CD1 3.85Å; H33-Y52 HydrophobicContact CB-CE1 3.83Å; H33-Y52 AromaticContact CD2-CD1 3.96Å; H33-Y52 AromaticContact CD2-CE1 3.49Å; H33-Y52 VanDerWaalsContact CD2-CE1 3.49Å; H33-Y52 WeakPolarHBondContact CD2-CE1 3.29Å; H33-Y52 AromaticContact CD2-CZ 3.55Å; H33-Y52 AromaticContact CE1-CE1 3.72Å; H33-Y52 AromaticContact CE1-CZ 3.58Å; H33-Y52 PolarHBondContact CE1-OH 2.93Å; H33-Y52 AromaticContact CG-CD1 3.78Å; H33-Y52 AromaticContact CG-CE1 3.3Å; H33-Y52 AromaticContact CG-CZ 3.83Å; H33-Y52 AromaticContact ND1-CE1 3.42Å; H33-Y52 WeakPolarHBondContact ND1-CE1 3.47Å; H33-Y52 AromaticContact ND1-CZ 3.8Å; H33-Y52 AromaticContact NE2-CE1 3.79Å; H33-Y52 AromaticContact NE2-CZ 3.44Å; H33-Y52 PolarHBondContact NE2-OH 2.79Å; H33-K80 PolarHBondContact N-O 2.84Å; H33-K80 PolarHBondContact O-N 2.83Å; H33-L92 HydrophobicContact CB-CB 3.81Å; H33-L92 HydrophobicContact CB-CD1 4.22Å; H33-L92 PolarHBondContact CE1-O 3.47Å; H33-L92 PolarHBondContact ND1-O 3.27Å; H33-P94 HydrophobicContact CB-CG 4.17Å; H33-P94 VanDerWaalsContact CE1-CD 3.47Å; H33-P94 WeakPolarHBondContact CE1-CD 3.34Å; H33-P94 VanDerWaalsContact ND1-CD 3.32Å; H33-P94 WeakPolarHBondContact ND1-CD 3.44Å; H33-P94 WeakPolarHBondContact O-CG 3.5Å
34	A	90.2	Very high	85.4	Confident	17 Å²	17	58.2 Å²	58.2	14%	0.14	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	148.6	177.5	0	0	0	0	0	111	F32 F51 S78 I79	F32-A34 HydrophobicContact CD2-CB 3.99Å; F32-A34 HydrophobicContact CE2-CB 4.13Å; A34-F51 HydrophobicContact CB-CB 4.45Å; A34-F51 PolarHBondContact N-O 2.98Å; A34-F51 PolarHBondContact O-N 3.3Å; A34-S78 CarbonylContact C-O 3.54Å; A34-S78 VanDerWaalsContact CA-O 3.26Å; A34-S78 WeakPolarHBondContact CA-O 3.31Å; A34-I79 HydrophobicContact CB-CB 4.01Å; A34-I79 HydrophobicContact CB-CD1 4.19Å; A34-I79 HydrophobicContact CB-CG1 3.94Å
35	I	89.3	Confident	84.9	Confident	10 Å²	10	56.5 Å²	56.5	5%	0.051	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	145.2	173.8	64	178.4	0	0	0	110.5	T48 L49 H50 T77 S78 P94 Y96	I35-T48 HydrophobicContact CB-CG2 3.8Å; I35-T48 HydrophobicContact CG2-CG2 4.05Å; I35-L49 CarbonylContact C-O 3.56Å; I35-L49 VanDerWaalsContact CA-O 3.26Å; I35-L49 WeakPolarHBondContact CA-O 3.32Å; I35-H50 WeakPolarHBondContact CG2-ND1 3.29Å; I35-T77 VanDerWaalsContact O-CA 3.3Å; I35-T77 WeakPolarHBondContact O-CA 3.34Å; I35-S78 PolarHBondContact N-O 3.44Å; I35-S78 PolarHBondContact O-N 3.26Å; I35-S78 VanDerWaalsContact O-N 3.09Å; I35-P94 HydrophobicContact CD1-CB 4.03Å; I35-P94 WeakPolarHBondContact CD1-O 3.35Å; I35-P94 HydrophobicContact CG1-CB 3.93Å; I35-P94 HydrophobicContact CG2-CB 4.25Å; I35-P94 HydrophobicContact CG2-CG 4.2Å; I35-Y96 HydrophobicContact CD1-CD1 4.38Å; I35-Y96 HydrophobicContact CD1-CD2 4.13Å; I35-Y96 HydrophobicContact CD1-CE1 3.93Å; I35-Y96 HydrophobicContact CD1-CE2 3.68Å; I35-Y96 HydrophobicContact CD1-CG 4.45Å; I35-Y96 HydrophobicContact CG1-CE1 3.9Å; I35-Y96 HydrophobicContact CG1-CE2 4.33Å
36	K	86.1	Confident	84.5	Confident	87 Å²	87	60.7 Å²	60.7	38%	0.378	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	130.8	174.8	-177.1	171.2	-177.6	177.7	0	109.9	L49 F51 T75 P76 T77 Y96	K36-L49 PolarHBondContact N-O 3.45Å; K36-L49 PolarHBondContact O-N 3.45Å; K36-F51 HydrophobicContact CB-CE2 4.03Å; K36-T75 WeakPolarHBondContact CE-OG1 3.34Å; K36-P76 WeakPolarHBondContact CA-O 3.43Å; K36-T77 HydrophobicContact CB-CG2 3.95Å; K36-T77 HydrophobicContact CD-CG2 4.03Å; K36-T77 HydrophobicContact CG-CG2 3.7Å; K36-Y96 WeakPolarHBondContact CA-OH 3.46Å; K36-Y96 PolarHBondContact N-OH 3.48Å
37	E	84.2	Confident	84.4	Confident	48 Å²	48	59.7 Å²	59.7	22%	0.224	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	133	172	-89.1	-178.8	172	0	0	110.3	M46 E47 P76 Y96	E37-M46 HydrophobicContact CB-CE 3.78Å; E37-M46 HydrophobicContact CG-CB 4.43Å; E37-M46 HydrophobicContact CG-CE 4.42Å; E37-M46 WeakPolarHBondContact OE2-CE 3.49Å; E37-E47 WeakPolarHBondContact CA-O 3.35Å; E37-P76 HydrophobicContact CB-CB 4.37Å; E37-P76 PolarHBondContact N-O 2.88Å; E37-P76 VanDerWaalsContact N-O 3.12Å; E37-Y96 HydrophobicContact CG-CE2 3.8Å; E37-Y96 PolarHBondContact N-OH 2.89Å
38	K	82.5	Confident	84.6	Confident	136 Å²	136	58.9 Å²	58.9	59%	0.591	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	130.3	172.2	-171.2	-178.7	178.6	-173.7	0	108.6	N40 E47 L49	K38-N40 PolarHBondContact O-N 3.08Å; K38-E47 PolarHBondContact N-O 3.01Å; K38-E47 PolarHBondContact O-N 3.14Å; K38-L49 HydrophobicContact CB-CD1 3.83Å; K38-L49 HydrophobicContact CB-CG 4.37Å; K38-L49 HydrophobicContact CD-CD1 3.79Å; K38-L49 HydrophobicContact CG-CD1 4.47Å
39	F	81	Confident	85.1	Confident	113 Å²	113	60.6 Å²	60.6	50%	0.496	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	123.2	172.9	-174.6	-104.8	0	0	0	109.8	P41 P44 M46	F39-P41 HydrophobicContact CE1-CB 4.37Å; F39-P41 WeakPolarHBondContact O-CD 3.31Å; F39-P44 HydrophobicContact CZ-CB 4.09Å; F39-M46 HydrophobicContact CB-SD 3.84Å; F39-M46 HydrophobicContact CD2-SD 3.97Å; F39-M46 HydrophobicContact CG-SD 4.43Å
40	N	80.4	Confident	85.3	Confident	37 Å²	37	65 Å²	65	20%	0.198	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	112.4	170.9	-174.4	-8.9	0	0	0	109	K38 A42 V43 S45 E47	K38-N40 PolarHBondContact O-N 3.08Å; N40-A42 PolarHBondContact O-N 3.31Å; N40-A42 WeakPolarHBondContact OD1-CB 3.26Å; N40-A42 PolarHBondContact OD1-N 3.12Å; N40-V43 CarbonylContact O-C 3.59Å; N40-V43 VanDerWaalsContact O-C 3.23Å; N40-S45 PolarHBondContact N-O 3.16Å; N40-E47 HydrophobicContact CB-CG 3.98Å; N40-E47 VanDerWaalsContact ND2-CD 3.26Å; N40-E47 PolarHBondContact ND2-OE1 3.18Å; N40-E47 PolarHBondContact ND2-OE2 3.05Å
41	P	79.6	Confident	85.4	Confident	110 Å²	110	66 Å²	66	71%	0.714	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-18.4	178.8	27.2	-32.7	0	0	0	113.6	F39	F39-P41 HydrophobicContact CE1-CB 4.37Å; F39-P41 WeakPolarHBondContact O-CD 3.31Å
42	A	83.3	Confident	85.4	Confident	85 Å²	85	68.1 Å²	68.1	70%	0.702	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-31.6	179.6	0	0	0	0	0	112.9	N40	N40-A42 PolarHBondContact O-N 3.31Å; N40-A42 WeakPolarHBondContact OD1-CB 3.26Å; N40-A42 PolarHBondContact OD1-N 3.12Å
43	V	81.8	Confident	85.4	Confident	84 Å²	84	66.8 Å²	66.8	51%	0.509	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	101	171.4	-176.8	0	0	0	0	105.6	N40 S45	N40-V43 CarbonylContact O-C 3.59Å; N40-V43 VanDerWaalsContact O-C 3.23Å; V43-S45 PolarHBondContact O-N 3.38Å; V43-S45 PolarHBondContact O-OG 3.34Å
44	P	76.8	Confident	85.3	Confident	111 Å²	111	68 Å²	68	72%	0.721	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	74.4	-163.2	28.7	-35	0	0	0	111.6	F39	F39-P44 HydrophobicContact CZ-CB 4.09Å
45	S	81.1	Confident	85.1	Confident	49 Å²	49	67.7 Å²	67.7	34%	0.343	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	153.4	-171.6	63.8	0	0	0	0	107.9	N40 V43	N40-S45 PolarHBondContact N-O 3.16Å; V43-S45 PolarHBondContact O-N 3.38Å; V43-S45 PolarHBondContact O-OG 3.34Å
46	M	79.4	Confident	84.6	Confident	93 Å²	93	70.7 Å²	70.7	46%	0.458	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126.5	173.5	-64.1	-68.6	-91.8	0	0	108.3	E37 F39	E37-M46 HydrophobicContact CB-CE 3.78Å; E37-M46 HydrophobicContact CG-CB 4.43Å; E37-M46 HydrophobicContact CG-CE 4.42Å; E37-M46 WeakPolarHBondContact OE2-CE 3.49Å; F39-M46 HydrophobicContact CB-SD 3.84Å; F39-M46 HydrophobicContact CD2-SD 3.97Å; F39-M46 HydrophobicContact CG-SD 4.43Å
47	E	84.2	Confident	83.8	Confident	86 Å²	86	68.7 Å²	68.7	40%	0.402	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.9	172.4	-71.4	-179.6	173.4	0	0	109.7	E37 K38 N40	E37-E47 WeakPolarHBondContact CA-O 3.35Å; K38-E47 PolarHBondContact N-O 3.01Å; K38-E47 PolarHBondContact O-N 3.14Å; N40-E47 HydrophobicContact CB-CG 3.98Å; N40-E47 VanDerWaalsContact ND2-CD 3.26Å; N40-E47 PolarHBondContact ND2-OE1 3.18Å; N40-E47 PolarHBondContact ND2-OE2 3.05Å
48	T	86.2	Confident	82.6	Confident	60 Å²	60	72.9 Å²	72.9	37%	0.368	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.7	175.8	-55.3	0	0	0	0	109.4	I35 H50	I35-T48 HydrophobicContact CB-CG2 3.8Å; I35-T48 HydrophobicContact CG2-CG2 4.05Å; T48-H50 PolarHBondContact O-CD2 3.48Å
49	L	87.4	Confident	81.2	Confident	64 Å²	64	75.7 Å²	75.7	34%	0.335	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	131	172.1	-64	174.2	0	0	0	109.7	I35 K36 K38 F51	I35-L49 CarbonylContact C-O 3.56Å; I35-L49 VanDerWaalsContact CA-O 3.26Å; I35-L49 WeakPolarHBondContact CA-O 3.32Å; K36-L49 PolarHBondContact N-O 3.45Å; K36-L49 PolarHBondContact O-N 3.45Å; K38-L49 HydrophobicContact CB-CD1 3.83Å; K38-L49 HydrophobicContact CB-CG 4.37Å; K38-L49 HydrophobicContact CD-CD1 3.79Å; K38-L49 HydrophobicContact CG-CD1 4.47Å; L49-F51 HydrophobicContact CB-CE2 3.63Å; L49-F51 HydrophobicContact CB-CZ 3.82Å; L49-F51 HydrophobicContact CD1-CZ 4.31Å
50	H	90.9	Very high	79.9	Confident	92 Å²	92	72.8 Å²	72.8	43%	0.426	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.1	-179.7	-69.8	-104.3	0	0	0	110.8	H33 I35 T48 Y52	H33-H50 AromaticContact CE1-ND1 3.56Å; H33-H50 AromaticContact NE2-CE1 3.82Å; H33-H50 AromaticContact NE2-CG 3.82Å; H33-H50 AromaticContact NE2-ND1 2.87Å; H33-H50 PolarHBondContact NE2-ND1 3.07Å; I35-H50 WeakPolarHBondContact CG2-ND1 3.29Å; T48-H50 PolarHBondContact O-CD2 3.48Å; H50-Y52 HydrophobicContact CB-CE2 3.84Å
51	F	90.6	Very high	78.8	Confident	64 Å²	64	71.7 Å²	71.7	28%	0.281	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.3	179.9	-55.9	-89.2	0	0	0	110	F32 H33 A34 K36 L49	F32-F51 HydrophobicContact CE2-CB 4.09Å; F32-F51 WeakPolarHBondContact CE2-O 3.41Å; H33-F51 CarbonylContact C-O 3.59Å; H33-F51 WeakPolarHBondContact CA-O 3.34Å; A34-F51 HydrophobicContact CB-CB 4.45Å; A34-F51 PolarHBondContact N-O 2.98Å; A34-F51 PolarHBondContact O-N 3.3Å; K36-F51 HydrophobicContact CB-CE2 4.03Å; L49-F51 HydrophobicContact CB-CE2 3.63Å; L49-F51 HydrophobicContact CB-CZ 3.82Å; L49-F51 HydrophobicContact CD1-CZ 4.31Å
52	Y	93.4	Very high	77.9	Confident	44 Å²	44	67 Å²	67	17%	0.173	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.3	-179.9	-59.6	-97.7	0	0	0	110.1	Y11 C12 S13 F32 H33 H50	Y11-Y52 AromaticContact CD1-CD1 3.94Å; Y11-Y52 HydrophobicContact CD1-CD1 3.94Å; Y11-Y52 AromaticContact CD1-CD2 3.95Å; Y11-Y52 HydrophobicContact CD1-CD2 3.95Å; Y11-Y52 AromaticContact CD1-CG 3.6Å; Y11-Y52 HydrophobicContact CD1-CG 3.6Å; Y11-Y52 AromaticContact CE1-CD2 3.86Å; Y11-Y52 HydrophobicContact CE1-CD2 3.86Å; Y11-Y52 HydrophobicContact CE1-CE2 4.31Å; Y11-Y52 HydrophobicContact CE1-CG 4.02Å; Y11-Y52 WeakPolarHBondContact O-CB 3.31Å; C12-Y52 WeakPolarHBondContact CA-O 3.4Å; S13-Y52 PolarHBondContact N-O 3.22Å; S13-Y52 PolarHBondContact OG-N 3.22Å; S13-Y52 PolarHBondContact OG-O 3.01Å; F32-Y52 WeakPolarHBondContact O-CA 3.48Å; H33-Y52 HydrophobicContact CB-CD1 3.85Å; H33-Y52 HydrophobicContact CB-CE1 3.83Å; H33-Y52 AromaticContact CD2-CD1 3.96Å; H33-Y52 AromaticContact CD2-CE1 3.49Å; H33-Y52 VanDerWaalsContact CD2-CE1 3.49Å; H33-Y52 WeakPolarHBondContact CD2-CE1 3.29Å; H33-Y52 AromaticContact CD2-CZ 3.55Å; H33-Y52 AromaticContact CE1-CE1 3.72Å; H33-Y52 AromaticContact CE1-CZ 3.58Å; H33-Y52 PolarHBondContact CE1-OH 2.93Å; H33-Y52 AromaticContact CG-CD1 3.78Å; H33-Y52 AromaticContact CG-CE1 3.3Å; H33-Y52 AromaticContact CG-CZ 3.83Å; H33-Y52 AromaticContact ND1-CE1 3.42Å; H33-Y52 WeakPolarHBondContact ND1-CE1 3.47Å; H33-Y52 AromaticContact ND1-CZ 3.8Å; H33-Y52 AromaticContact NE2-CE1 3.79Å; H33-Y52 AromaticContact NE2-CZ 3.44Å; H33-Y52 PolarHBondContact NE2-OH 2.79Å; H50-Y52 HydrophobicContact CB-CE2 3.84Å
53	G	91.7	Very high	77.2	Confident	4 Å²	4	66.3 Å²	66.3	4%	0.041	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.7	-159.2	174.3	0	0	0	0	0	114.3	Y11 C23 C31 F32	Y11-G53 PolarHBondContact O-N 3.25Å; C23-G53 VanDerWaalsContact SG-C 3.53Å; C31-G53 CarbonylContact C-O 3.57Å; C31-G53 WeakPolarHBondContact CA-O 3.43Å; F32-G53 VanDerWaalsContact CD1-C 3.41Å; F32-G53 VanDerWaalsContact CD1-O 3.29Å; F32-G53 WeakPolarHBondContact CD1-O 3.36Å; F32-G53 VanDerWaalsContact CE1-C 3.41Å; F32-G53 VanDerWaalsContact CE1-CA 3.45Å; F32-G53 PolarHBondContact N-O 3.05Å; F32-G53 PolarHBondContact O-N 3.15Å
54	C	90.4	Very high	76.6	Confident	33 Å²	33	68.8 Å²	68.8	22%	0.223	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.6	-178.8	-63.1	0	0	0	0	109.2	C10 C23 T25	C10-C54 PolarHBondContact SG-SG 3.09Å; C23-C54 HydrophobicContact CB-CB 4.05Å; C23-C54 WeakPolarHBondContact CB-SG 3.45Å; C23-C54 WeakPolarHBondContact SG-CB 3.25Å; C23-C54 PolarHBondContact SG-N 3.14Å; C23-C54 CovalentContact SG-SG 2.04Å; C23-C54 PolarHBondContact SG-SG 3.3Å; T25-C54 HydrophobicContact CG2-CB 4.07Å
55	L	87.7	Confident	76.7	Confident	12 Å²	12	67.6 Å²	67.6	6%	0.063	37%	0.37	C	S	.	.			trans	-72.8	141.2	175.7	-69.2	173	0	0	0	111.1	A29 Q30 F32 Q65 C66 C81	A29-L55 WeakPolarHBondContact CB-O 3.28Å; Q30-L55 HydrophobicContact CB-CD1 4.39Å; Q30-L55 PolarHBondContact O-N 3.03Å; F32-L55 HydrophobicContact CB-CD1 4.44Å; F32-L55 HydrophobicContact CB-CD2 4.38Å; F32-L55 HydrophobicContact CB-CG 4.19Å; F32-L55 HydrophobicContact CD1-CD2 3.84Å; F32-L55 HydrophobicContact CD1-CG 3.96Å; F32-L55 HydrophobicContact CE1-CD2 4.48Å; F32-L55 HydrophobicContact CG-CD2 4.27Å; F32-L55 HydrophobicContact CG-CG 4.43Å; L55-Q65 HydrophobicContact CD2-CB 4.04Å; L55-C66 HydrophobicContact CD1-CB 4.45Å; L55-C81 HydrophobicContact CD1-CB 4.3Å
56	P	77.5	Confident	76.6	Confident	72 Å²	72	66.1 Å²	66.1	47%	0.468	36%	0.36	S	S	.	.			trans	-71	147.7	174	28.2	-32.2	0	0	0	111.6
57	T	69.1	Low	76.4	Confident	45 Å²	45	66.4 Å²	66.4	28%	0.276	36%	0.36	S	S	.	.			trans	-87.2	-12.8	177.6	46.3	0	0	0	0	114.2	K26 A29 E59	K26-T57 HydrophobicContact CB-CG2 3.68Å; K26-T57 VanDerWaalsContact CD-OG1 3.26Å; K26-T57 WeakPolarHBondContact CD-OG1 3.47Å; A29-T57 HydrophobicContact CB-CG2 3.53Å; T57-E59 PolarHBondContact O-N 3.25Å
58	E	59.9	Low	75.6	Confident	136 Å²	136	63.2 Å²	63.2	64%	0.636	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-76.2	126.7	-170.1	-65.2	177	-154.2	0	0	109.2	K26	K26-E58 IonicContact NZ-OE1 2.82Å; K26-E58 PolarHBondContact NZ-OE1 3.24Å
59	E	53.9	Low	74.7	Confident	196 Å²	196	63.7 Å²	63.7	92%	0.916	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	78.8	21.1	-179.7	-50.1	-171	163.9	0	0	118.4	T57 G61	T57-E59 PolarHBondContact O-N 3.25Å; E59-G61 PolarHBondContact O-N 3.35Å; E59-G61 VanDerWaalsContact O-N 3.13Å
60	G	52.5	Low	73.8	Confident	51 Å²	51	66.4 Å²	66.4	53%	0.526	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	66.8	13.2	-176.3	0	0	0	0	0	112.6	S62	G60-S62 VanDerWaalsContact C-N 3.34Å; G60-S62 PolarHBondContact O-N 2.87Å
61	G	56.7	Low	72.4	Confident	15 Å²	15	65.8 Å²	65.8	16%	0.155	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-31.3	-172.7	0	0	0	0	0	114.1	E59 S63 L64 Q65	E59-G61 PolarHBondContact O-N 3.35Å; E59-G61 VanDerWaalsContact O-N 3.13Å; G61-S63 VanDerWaalsContact C-N 3.32Å; G61-S63 PolarHBondContact O-N 3.43Å; G61-L64 PolarHBondContact O-N 2.94Å; G61-Q65 VanDerWaalsContact O-CB 3.25Å; G61-Q65 WeakPolarHBondContact O-CB 3.45Å; G61-Q65 WeakPolarHBondContact O-CG 3.39Å; G61-Q65 PolarHBondContact O-N 2.95Å
62	S	62.5	Low	70.9	Confident	11 Å²	11	69 Å²	69	8%	0.077	39%	0.392	C	S	.	.	H	α-helix	trans	-57.7	-41.8	-178.6	-175.5	0	0	0	0	112.7	G60 C66	G60-S62 VanDerWaalsContact C-N 3.34Å; G60-S62 PolarHBondContact O-N 2.87Å; S62-C66 WeakPolarHBondContact O-CB 3.4Å; S62-C66 PolarHBondContact O-N 2.9Å
63	S	67.7	Low	69.5	Low	71 Å²	71	71.1 Å²	71.1	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-70.2	-48.9	178.4	-173.1	0	0	0	0	111.5	G61 Q65 C66 H67	G61-S63 VanDerWaalsContact C-N 3.32Å; G61-S63 PolarHBondContact O-N 3.43Å; S63-Q65 PolarHBondContact O-N 3.23Å; S63-C66 PolarHBondContact O-N 2.93Å; S63-H67 PolarHBondContact O-CD2 3.44Å; S63-H67 PolarHBondContact O-N 2.89Å
64	L	69.9	Low	68.3	Low	135 Å²	135	81.4 Å²	81.4	71%	0.707	45%	0.447	S	S	*	.	H	α-helix	trans	-62.7	-42.6	-179.8	-80.3	158.6	0	0	0	112.5	G61 C66 H67 G68	G61-L64 PolarHBondContact O-N 2.94Å; L64-C66 VanDerWaalsContact C-N 3.32Å; L64-C66 PolarHBondContact O-N 3.46Å; L64-H67 CarbonylContact O-C 3.49Å; L64-H67 PolarHBondContact O-N 3.44Å; L64-G68 PolarHBondContact O-N 3.48Å
65	Q	77.6	Confident	67.3	Low	87 Å²	87	82.6 Å²	82.6	41%	0.407	45%	0.453	S	S	.	.	H	α-helix	trans	-64.9	-37.9	178.4	-76.9	174.6	-29.3	0	0	111.4	L55 G61 S63 H67 G68 I79	L55-Q65 HydrophobicContact CD2-CB 4.04Å; G61-Q65 VanDerWaalsContact O-CB 3.25Å; G61-Q65 WeakPolarHBondContact O-CB 3.45Å; G61-Q65 WeakPolarHBondContact O-CG 3.39Å; G61-Q65 PolarHBondContact O-N 2.95Å; S63-Q65 PolarHBondContact O-N 3.23Å; Q65-H67 PolarHBondContact O-N 3.17Å; Q65-G68 PolarHBondContact O-N 3.1Å; Q65-I79 WeakPolarHBondContact O-CG2 3.49Å
66	C	79.1	Confident	66.7	Low	18 Å²	18	84.5 Å²	84.5	12%	0.122	47%	0.467	C	S	.	.	H	α-helix	trans	-66.9	-26.9	177.3	-154.7	0	0	0	0	113.7	L55 S62 S63 L64 G68 H69 C81	L55-C66 HydrophobicContact CD1-CB 4.45Å; S62-C66 WeakPolarHBondContact O-CB 3.4Å; S62-C66 PolarHBondContact O-N 2.9Å; S63-C66 PolarHBondContact O-N 2.93Å; L64-C66 VanDerWaalsContact C-N 3.32Å; L64-C66 PolarHBondContact O-N 3.46Å; C66-G68 VanDerWaalsContact C-N 3.3Å; C66-H69 PolarHBondContact O-ND1 2.85Å; C66-C81 WeakPolarHBondContact CA-SG 3.4Å; C66-C81 HydrophobicContact CB-CB 4.03Å; C66-C81 WeakPolarHBondContact CB-SG 3.38Å; C66-C81 WeakPolarHBondContact SG-CB 3.29Å; C66-C81 PolarHBondContact SG-N 3.48Å; C66-C81 VanDerWaalsContact SG-N 3.38Å; C66-C81 CovalentContact SG-SG 2.01Å; C66-C81 PolarHBondContact SG-SG 3.47Å
67	H	75.5	Confident	66.7	Low	99 Å²	99	83.1 Å²	83.1	46%	0.458	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	7.5	174.2	-71.3	-64.3	0	0	0	113.8	S63 L64 Q65 H69 L70	S63-H67 PolarHBondContact O-CD2 3.44Å; S63-H67 PolarHBondContact O-N 2.89Å; L64-H67 CarbonylContact O-C 3.49Å; L64-H67 PolarHBondContact O-N 3.44Å; Q65-H67 PolarHBondContact O-N 3.17Å; H67-H69 PolarHBondContact O-N 3.34Å; H67-L70 HydrophobicContact CB-CD1 4.11Å; H67-L70 WeakPolarHBondContact O-CB 3.3Å; H67-L70 PolarHBondContact O-N 3.26Å
68	G	66.8	Low	67.6	Low	18 Å²	18	81.5 Å²	81.5	19%	0.186	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-56.4	-26.8	-179.7	0	0	0	0	0	114.3	L64 Q65 C66 L70 T71 H73	L64-G68 PolarHBondContact O-N 3.48Å; Q65-G68 PolarHBondContact O-N 3.1Å; C66-G68 VanDerWaalsContact C-N 3.3Å; G68-L70 PolarHBondContact O-N 3.5Å; G68-T71 PolarHBondContact O-N 3.41Å; G68-T71 PolarHBondContact O-OG1 3.5Å; G68-H73 PolarHBondContact O-NE2 2.93Å
69	H	68.9	Low	68.9	Low	70 Å²	70	76.3 Å²	76.3	32%	0.324	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-65.2	-13.7	175.9	71.1	-87.3	0	0	0	114.4	C66 H67 T71	C66-H69 PolarHBondContact O-ND1 2.85Å; H67-H69 PolarHBondContact O-N 3.34Å; H69-T71 VanDerWaalsContact C-N 3.31Å
70	L	66.9	Low	70.7	Confident	122 Å²	122	70.8 Å²	70.8	64%	0.639	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-83.5	-6.5	178.5	-63.3	176.3	0	0	0	113.5	H67 G68	H67-L70 HydrophobicContact CB-CD1 4.11Å; H67-L70 WeakPolarHBondContact O-CB 3.3Å; H67-L70 PolarHBondContact O-N 3.26Å; G68-L70 PolarHBondContact O-N 3.5Å
71	T	61.6	Low	72.5	Confident	78 Å²	78	69.5 Å²	69.5	48%	0.479	38%	0.379	S	S	.	.	S	Bend	trans	-108.4	134.4	177.8	28.7	0	0	0	0	110.1	G68 H69 H73	G68-T71 PolarHBondContact O-N 3.41Å; G68-T71 PolarHBondContact O-OG1 3.5Å; H69-T71 VanDerWaalsContact C-N 3.31Å; T71-H73 PolarHBondContact O-CD2 2.77Å; T71-H73 PolarHBondContact O-N 2.82Å; T71-H73 PolarHBondContact O-NE2 2.81Å
72	P	60.3	Low	74.1	Confident	132 Å²	132	69 Å²	69	86%	0.857	37%	0.374	S	S	*	.			trans	-64.3	123.5	174.1	-1.8	10.7	0	0	0	109.7
73	H	63.4	Low	75.5	Confident	88 Å²	88	72.9 Å²	72.9	41%	0.407	39%	0.389	S	S	.	.			trans	-102.9	141.9	175.9	-65.7	-79.4	0	0	0	110.4	G68 T71 T75 T77	G68-H73 PolarHBondContact O-NE2 2.93Å; T71-H73 PolarHBondContact O-CD2 2.77Å; T71-H73 PolarHBondContact O-N 2.82Å; T71-H73 PolarHBondContact O-NE2 2.81Å; H73-T75 VanDerWaalsContact C-N 3.3Å; H73-T75 WeakPolarHBondContact CB-O 3.33Å; H73-T75 PolarHBondContact O-N 3.34Å; H73-T77 VanDerWaalsContact CB-OG1 3.29Å; H73-T77 WeakPolarHBondContact CB-OG1 3.28Å; H73-T77 PolarHBondContact CD2-OG1 3.45Å
74	F	66.9	Low	76.4	Confident	220 Å²	220	75.5 Å²	75.5	97%	0.965	39%	0.393	S	S	*	.	S	Bend	trans	-61.1	-38.4	178.7	-174.7	-94.6	0	0	0	112.5
75	T	69.4	Low	77.4	Confident	59 Å²	59	74.6 Å²	74.6	36%	0.362	38%	0.381	S	S	.	.	S	Bend	trans	-99	130.5	163.5	37	0	0	0	0	108.8	K36 H73 T77	K36-T75 WeakPolarHBondContact CE-OG1 3.34Å; H73-T75 VanDerWaalsContact C-N 3.3Å; H73-T75 WeakPolarHBondContact CB-O 3.33Å; H73-T75 PolarHBondContact O-N 3.34Å; T75-T77 PolarHBondContact O-N 3.39Å
76	P	73.7	Confident	78.2	Confident	52 Å²	52	74.4 Å²	74.4	34%	0.338	38%	0.383	S	S	.	.			trans	-53.5	115.4	177.7	-26.2	34.9	0	0	0	111.2	K36 E37 Y96	K36-P76 WeakPolarHBondContact CA-O 3.43Å; E37-P76 HydrophobicContact CB-CB 4.37Å; E37-P76 PolarHBondContact N-O 2.88Å; E37-P76 VanDerWaalsContact N-O 3.12Å; P76-Y96 HydrophobicContact CB-CD1 3.68Å; P76-Y96 HydrophobicContact CB-CE1 3.63Å; P76-Y96 HydrophobicContact CB-CG 4.44Å; P76-Y96 VanDerWaalsContact O-CE1 3.25Å; P76-Y96 WeakPolarHBondContact O-CE1 3.36Å
77	T	79.2	Confident	78.9	Confident	42 Å²	42	77 Å²	77	26%	0.258	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.8	175.9	52.1	0	0	0	0	110.2	I35 K36 H73 T75	I35-T77 VanDerWaalsContact O-CA 3.3Å; I35-T77 WeakPolarHBondContact O-CA 3.34Å; K36-T77 HydrophobicContact CB-CG2 3.95Å; K36-T77 HydrophobicContact CD-CG2 4.03Å; K36-T77 HydrophobicContact CG-CG2 3.7Å; H73-T77 VanDerWaalsContact CB-OG1 3.29Å; H73-T77 WeakPolarHBondContact CB-OG1 3.28Å; H73-T77 PolarHBondContact CD2-OG1 3.45Å; T75-T77 PolarHBondContact O-N 3.39Å
78	S	86.8	Confident	79.7	Confident	12 Å²	12	72.4 Å²	72.4	8%	0.084	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	143.7	174.9	-173.1	0	0	0	0	109.1	A34 I35 T95	A34-S78 CarbonylContact C-O 3.54Å; A34-S78 VanDerWaalsContact CA-O 3.26Å; A34-S78 WeakPolarHBondContact CA-O 3.31Å; I35-S78 PolarHBondContact N-O 3.44Å; I35-S78 PolarHBondContact O-N 3.26Å; I35-S78 VanDerWaalsContact O-N 3.09Å; S78-T95 WeakPolarHBondContact CB-O 3.32Å; S78-T95 PolarHBondContact OG-O 3.47Å
79	I	88.6	Confident	81	Confident	26 Å²	26	71.6 Å²	71.6	13%	0.133	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.2	-177.6	-174.8	168.5	0	0	0	109.5	F32 A34 Q65	F32-I79 HydrophobicContact CB-CD1 4.05Å; F32-I79 HydrophobicContact CB-CG1 4.22Å; F32-I79 HydrophobicContact CD2-CD1 4.07Å; F32-I79 HydrophobicContact CD2-CG1 4.44Å; F32-I79 HydrophobicContact CG-CD1 4.21Å; A34-I79 HydrophobicContact CB-CB 4.01Å; A34-I79 HydrophobicContact CB-CD1 4.19Å; A34-I79 HydrophobicContact CB-CG1 3.94Å; Q65-I79 WeakPolarHBondContact O-CG2 3.49Å
80	K	90.5	Very high	82.1	Confident	81 Å²	81	72.5 Å²	72.5	35%	0.352	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	151.3	168.5	-71.6	-173	175.4	172.5	0	109.1	F32 H33 L92 T93 P94	F32-K80 WeakPolarHBondContact CA-O 3.33Å; H33-K80 PolarHBondContact N-O 2.84Å; H33-K80 PolarHBondContact O-N 2.83Å; K80-L92 HydrophobicContact CB-CB 4.24Å; K80-L92 HydrophobicContact CB-CD1 4.09Å; K80-L92 HydrophobicContact CB-CD2 4.15Å; K80-L92 HydrophobicContact CB-CG 4.41Å; K80-L92 WeakPolarHBondContact O-CD1 3.32Å; K80-T93 WeakPolarHBondContact CD-O 3.3Å; K80-T93 VanDerWaalsContact CE-O 3.29Å; K80-T93 WeakPolarHBondContact CE-O 3.37Å; K80-T93 PolarHBondContact NZ-O 3.46Å; K80-P94 HydrophobicContact CB-CG 4.45Å; K80-P94 HydrophobicContact CG-CB 4.46Å
81	C	91.3	Very high	83.2	Confident	24 Å²	24	72.1 Å²	72.1	16%	0.162	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	159.3	178.2	-26.6	0	0	0	0	111.9	Q30 C31 F32 L55 C66	Q30-C81 HydrophobicContact CB-CB 3.97Å; C31-C81 CarbonylContact O-C 3.48Å; C31-C81 WeakPolarHBondContact O-CA 3.45Å; C31-C81 WeakPolarHBondContact O-CB 3.32Å; F32-C81 HydrophobicContact CB-CB 4.47Å; L55-C81 HydrophobicContact CD1-CB 4.3Å; C66-C81 WeakPolarHBondContact CA-SG 3.4Å; C66-C81 HydrophobicContact CB-CB 4.03Å; C66-C81 WeakPolarHBondContact CB-SG 3.38Å; C66-C81 WeakPolarHBondContact SG-CB 3.29Å; C66-C81 PolarHBondContact SG-N 3.48Å; C66-C81 VanDerWaalsContact SG-N 3.38Å; C66-C81 CovalentContact SG-SG 2.01Å; C66-C81 PolarHBondContact SG-SG 3.47Å
82	C	90.6	Very high	84.6	Confident	5 Å²	5	69.8 Å²	69.8	3%	0.034	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	160.6	-176.4	63.8	0	0	0	0	110.1	Q30 C31 Q84 C88 N89 L92	Q30-C82 WeakPolarHBondContact CA-O 3.35Å; Q30-C82 WeakPolarHBondContact CB-O 3.48Å; C31-C82 PolarHBondContact N-O 3.42Å; C31-C82 PolarHBondContact O-N 3.27Å; C82-Q84 VanDerWaalsContact CB-OE1 3.27Å; C82-C88 HydrophobicContact CB-CB 3.76Å; C82-C88 WeakPolarHBondContact CB-SG 3.24Å; C82-C88 WeakPolarHBondContact SG-CB 3.39Å; C82-C88 PolarHBondContact SG-O 3.04Å; C82-C88 CovalentContact SG-SG 2.03Å; C82-C88 PolarHBondContact SG-SG 2.86Å; C82-N89 PolarHBondContact SG-N 3.35Å; C82-L92 HydrophobicContact CB-CD1 4.08Å; C82-L92 HydrophobicContact CB-CD2 4.18Å; C82-L92 HydrophobicContact CB-CG 4.38Å
83	F	90.4	Very high	86	Confident	92 Å²	92	68.1 Å²	68.1	40%	0.404	34%	0.34	S	S	.	.			trans	-151.2	11.8	-179.2	62.1	-90.7	0	0	0	113.4	Q30	Q30-F83 HydrophobicContact CG-CB 4.18Å; Q30-F83 HydrophobicContact CG-CD1 4.09Å
84	Q	87	Confident	87.1	Confident	125 Å²	125	64.5 Å²	64.5	58%	0.584	33%	0.325	S	S	*	.	S	Bend	trans	-82.1	-31.8	-166.7	-62.1	84.9	-8	0	0	113.5	C82	C82-Q84 VanDerWaalsContact CB-OE1 3.27Å
85	Y	91.6	Very high	87.7	Confident	116 Å²	116	58.2 Å²	58.2	46%	0.455	30%	0.304	S	S	.	.	S	Bend	trans	-159	164.2	-176.6	54.3	-90.2	0	0	0	110.4	C88 N91	Y85-C88 HydrophobicContact CD1-CB 4.33Å; Y85-C88 HydrophobicContact CD2-CB 3.98Å; Y85-C88 HydrophobicContact CE1-CB 4.14Å; Y85-C88 HydrophobicContact CE2-CB 3.78Å; Y85-C88 HydrophobicContact CG-CB 4.24Å; Y85-C88 VanDerWaalsContact O-CB 3.26Å; Y85-C88 WeakPolarHBondContact O-CB 3.48Å; Y85-C88 PolarHBondContact O-N 2.86Å; Y85-N91 PolarHBondContact OH-ND2 2.91Å
86	D	93.4	Very high	87.9	Confident	83 Å²	83	58.3 Å²	58.3	44%	0.444	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	136.5	177.4	-73.1	-11.1	0	0	0	111.4	V8 R9 C88	V8-D86 WeakPolarHBondContact CA-OD1 3.41Å; R9-D86 HydrophobicContact CB-CB 4.19Å; R9-D86 PolarHBondContact N-OD1 2.93Å; R9-D86 CarbonylContact O-C 3.54Å; R9-D86 WeakPolarHBondContact O-CA 3.42Å; D86-C88 PolarHBondContact O-N 3.44Å
87	F	93.5	Very high	87.3	Confident	74 Å²	74	62.8 Å²	62.8	33%	0.325	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	22.5	-177.7	-50.8	-82.7	0	0	0	114.5	R9 T22 N89 L90	R9-F87 VanDerWaalsContact CD-CZ 3.48Å; R9-F87 HydrophobicContact CG-CE1 4.12Å; R9-F87 HydrophobicContact CG-CE2 4.33Å; R9-F87 HydrophobicContact CG-CZ 3.82Å; R9-F87 PolarHBondContact O-N 3.48Å; T22-F87 HydrophobicContact CG2-CE1 3.65Å; T22-F87 HydrophobicContact CG2-CZ 4.13Å; F87-N89 PolarHBondContact O-N 3.34Å; F87-L90 HydrophobicContact CB-CD1 3.92Å; F87-L90 HydrophobicContact CB-CG 4.42Å; F87-L90 WeakPolarHBondContact O-CB 3.44Å; F87-L90 PolarHBondContact O-N 2.85Å
88	C	92.8	Very high	86	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.014	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-55.8	-25.5	178.9	66.9	0	0	0	0	113.5	C82 Y85 D86 L90 N91	C82-C88 HydrophobicContact CB-CB 3.76Å; C82-C88 WeakPolarHBondContact CB-SG 3.24Å; C82-C88 WeakPolarHBondContact SG-CB 3.39Å; C82-C88 PolarHBondContact SG-O 3.04Å; C82-C88 CovalentContact SG-SG 2.03Å; C82-C88 PolarHBondContact SG-SG 2.86Å; Y85-C88 HydrophobicContact CD1-CB 4.33Å; Y85-C88 HydrophobicContact CD2-CB 3.98Å; Y85-C88 HydrophobicContact CE1-CB 4.14Å; Y85-C88 HydrophobicContact CE2-CB 3.78Å; Y85-C88 HydrophobicContact CG-CB 4.24Å; Y85-C88 VanDerWaalsContact O-CB 3.26Å; Y85-C88 WeakPolarHBondContact O-CB 3.48Å; Y85-C88 PolarHBondContact O-N 2.86Å; D86-C88 PolarHBondContact O-N 3.44Å; C88-L90 VanDerWaalsContact C-N 3.27Å; C88-L90 PolarHBondContact O-N 3.11Å; C88-N91 PolarHBondContact O-N 3.18Å
89	N	93.5	Very high	84.2	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-73.4	-16	-178.4	63.3	-27.7	0	0	0	114.3	Y11 C31 F32 C82 F87 N91 L92	Y11-N89 PolarHBondContact N-OD1 3.37Å; Y11-N89 PolarHBondContact O-ND2 3.18Å; C31-N89 HydrophobicContact CB-CB 3.71Å; F32-N89 WeakPolarHBondContact O-CB 3.33Å; F32-N89 PolarHBondContact O-ND2 3.27Å; C82-N89 PolarHBondContact SG-N 3.35Å; F87-N89 PolarHBondContact O-N 3.34Å; N89-N91 PolarHBondContact O-N 3.41Å; N89-L92 HydrophobicContact CB-CD1 4.05Å; N89-L92 PolarHBondContact O-N 3.43Å
90	L	92.8	Very high	81.9	Confident	90 Å²	90	81.8 Å²	81.8	47%	0.471	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-66.4	-27.2	171.1	-70.4	176	0	0	0	112.3	Y11 F87 C88	Y11-L90 HydrophobicContact CD1-CD2 3.68Å; Y11-L90 HydrophobicContact CD2-CD2 4.21Å; Y11-L90 HydrophobicContact CE1-CD2 4.39Å; Y11-L90 HydrophobicContact CG-CD2 3.57Å; Y11-L90 HydrophobicContact CG-CG 4.27Å; F87-L90 HydrophobicContact CB-CD1 3.92Å; F87-L90 HydrophobicContact CB-CG 4.42Å; F87-L90 WeakPolarHBondContact O-CB 3.44Å; F87-L90 PolarHBondContact O-N 2.85Å; C88-L90 VanDerWaalsContact C-N 3.27Å; C88-L90 PolarHBondContact O-N 3.11Å
91	N	90.6	Very high	79.4	Confident	114 Å²	114	83.1 Å²	83.1	61%	0.61	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-92.8	2.2	-179.7	-68.6	-23.4	0	0	0	113.1	Y85 C88 N89	Y85-N91 PolarHBondContact OH-ND2 2.91Å; C88-N91 PolarHBondContact O-N 3.18Å; N89-N91 PolarHBondContact O-N 3.41Å
92	L	90.4	Very high	76.7	Confident	29 Å²	29	89 Å²	89	15%	0.152	45%	0.446	C	S	.	.			trans	-83.6	137.7	177.2	-66	178.5	0	0	0	110.4	H33 K80 C82 N89	H33-L92 HydrophobicContact CB-CB 3.81Å; H33-L92 HydrophobicContact CB-CD1 4.22Å; H33-L92 PolarHBondContact CE1-O 3.47Å; H33-L92 PolarHBondContact ND1-O 3.27Å; K80-L92 HydrophobicContact CB-CB 4.24Å; K80-L92 HydrophobicContact CB-CD1 4.09Å; K80-L92 HydrophobicContact CB-CD2 4.15Å; K80-L92 HydrophobicContact CB-CG 4.41Å; K80-L92 WeakPolarHBondContact O-CD1 3.32Å; C82-L92 HydrophobicContact CB-CD1 4.08Å; C82-L92 HydrophobicContact CB-CD2 4.18Å; C82-L92 HydrophobicContact CB-CG 4.38Å; N89-L92 HydrophobicContact CB-CD1 4.05Å; N89-L92 PolarHBondContact O-N 3.43Å
93	T	89.3	Confident	73.9	Confident	97 Å²	97	94.8 Å²	94.8	60%	0.595	48%	0.481	S	S	*	.			trans	-126.6	87.2	175.3	48	0	0	0	0	109.9	K80	K80-T93 WeakPolarHBondContact CD-O 3.3Å; K80-T93 VanDerWaalsContact CE-O 3.29Å; K80-T93 WeakPolarHBondContact CE-O 3.37Å; K80-T93 PolarHBondContact NZ-O 3.46Å
94	P	86	Confident	71.2	Confident	12 Å²	12	97.2 Å²	97.2	8%	0.078	50%	0.498	C	S	.	.			trans	-62	143.1	172.2	-15.1	29.1	0	0	0	109.5	H33 I35 K80	H33-P94 HydrophobicContact CB-CG 4.17Å; H33-P94 VanDerWaalsContact CE1-CD 3.47Å; H33-P94 WeakPolarHBondContact CE1-CD 3.34Å; H33-P94 VanDerWaalsContact ND1-CD 3.32Å; H33-P94 WeakPolarHBondContact ND1-CD 3.44Å; H33-P94 WeakPolarHBondContact O-CG 3.5Å; I35-P94 HydrophobicContact CD1-CB 4.03Å; I35-P94 WeakPolarHBondContact CD1-O 3.35Å; I35-P94 HydrophobicContact CG1-CB 3.93Å; I35-P94 HydrophobicContact CG2-CB 4.25Å; I35-P94 HydrophobicContact CG2-CG 4.2Å; K80-P94 HydrophobicContact CB-CG 4.45Å; K80-P94 HydrophobicContact CG-CB 4.46Å
95	T	79.6	Confident	68.8	Low	87 Å²	87	97.3 Å²	97.3	53%	0.534	50%	0.503	S	S	.	.			trans	-132	146	178.3	51.9	0	0	0	0	109.3	S78	S78-T95 WeakPolarHBondContact CB-O 3.32Å; S78-T95 PolarHBondContact OG-O 3.47Å
96	Y	74.2	Confident	66.1	Low	61 Å²	61	97.2 Å²	97.2	24%	0.239	52%	0.517	C	S	.	.			trans	-72	136.6	169.4	-60.6	-63	0	0	0	109.9	I35 K36 E37 P76 K98	I35-Y96 HydrophobicContact CD1-CD1 4.38Å; I35-Y96 HydrophobicContact CD1-CD2 4.13Å; I35-Y96 HydrophobicContact CD1-CE1 3.93Å; I35-Y96 HydrophobicContact CD1-CE2 3.68Å; I35-Y96 HydrophobicContact CD1-CG 4.45Å; I35-Y96 HydrophobicContact CG1-CE1 3.9Å; I35-Y96 HydrophobicContact CG1-CE2 4.33Å; K36-Y96 WeakPolarHBondContact CA-OH 3.46Å; K36-Y96 PolarHBondContact N-OH 3.48Å; E37-Y96 HydrophobicContact CG-CE2 3.8Å; E37-Y96 PolarHBondContact N-OH 2.89Å; P76-Y96 HydrophobicContact CB-CD1 3.68Å; P76-Y96 HydrophobicContact CB-CE1 3.63Å; P76-Y96 HydrophobicContact CB-CG 4.44Å; P76-Y96 VanDerWaalsContact O-CE1 3.25Å; P76-Y96 WeakPolarHBondContact O-CE1 3.36Å; Y96-K98 PolarHBondContact O-N 2.92Å
97	L	61.3	Low	63.7	Low	146 Å²	146	99.9 Å²	99.9	76%	0.764	53%	0.531	S	S	*	.			trans	-79.8	100.9	162.3	-73	164.9	0	0	0	106.4	P99	L97-P99 WeakPolarHBondContact O-CD 3.32Å
98	K	51.5	Low	61.2	Low	158 Å²	158	103.1 Å²	103.1	69%	0.687	55%	0.551	S	S	*	*			trans	-60.6	125.3	171.1	-85.6	-172.8	163.4	-157.2	0	109.1	Y96 D101	Y96-K98 PolarHBondContact O-N 2.92Å; K98-D101 IonicContact NZ-OD2 3.86Å; K98-D101 PolarHBondContact NZ-OD2 3.34Å
99	P	49.5	Very low	58.7	Low	111 Å²	111	110.4 Å²	110.4	72%	0.721	59%	0.587	S	S	*	*			trans	-60	137.8	158.8	-13.9	28.8	0	0	0	108.2	L97 D101	L97-P99 WeakPolarHBondContact O-CD 3.32Å; P99-D101 PolarHBondContact O-N 3.37Å; P99-D101 VanDerWaalsContact O-N 3.11Å
100	F	39.7	Very low	56.7	Low	210 Å²	210	114.9 Å²	114.9	92%	0.921	61%	0.611	S	S	*	*			trans	-36.3	111.3	-178.2	-72.4	-97.4	0	0	0	114	I102	F100-I102 PolarHBondContact O-N 3.46Å
101	D	38.4	Very low	55.1	Low	109 Å²	109	116.5 Å²	116.5	58%	0.583	63%	0.63	S	S	*	*			trans	-71.9	109.3	166.2	-74.7	-37.1	0	0	0	107.6	K98 P99 V103	K98-D101 IonicContact NZ-OD2 3.86Å; K98-D101 PolarHBondContact NZ-OD2 3.34Å; P99-D101 PolarHBondContact O-N 3.37Å; P99-D101 VanDerWaalsContact O-N 3.11Å; D101-V103 PolarHBondContact O-N 3.04Å
102	I	34.5	Very low	54.1	Low	147 Å²	147	113.2 Å²	113.2	75%	0.754	62%	0.616	S	S	*	*			trans	-71.7	111.2	164.6	-62.2	172.8	0	0	0	106.1	F100 D104	F100-I102 PolarHBondContact O-N 3.46Å; I102-D104 PolarHBondContact O-N 2.87Å
103	V	32.8	Very low	53	Low	128 Å²	128	116.6 Å²	116.6	78%	0.776	63%	0.634	S	S	*	*			trans	-81.7	106.7	174	178.7	0	0	0	0	107.6	D101	D101-V103 PolarHBondContact O-N 3.04Å
104	D	33.3	Very low	52.3	Low	142 Å²	142	116.2 Å²	116.2	76%	0.759	63%	0.633	S	S	*	*			trans	-107.8	115.9	161	-81.4	-36.7	0	0	0	108.7	I102 P106	I102-D104 PolarHBondContact O-N 2.87Å; D104-P106 WeakPolarHBondContact O-CD 3.36Å
105	D	35.2	Very low	51.9	Low	128 Å²	128	121.6 Å²	121.6	68%	0.684	66%	0.66	S	S	*	*			trans	-70.8	116.4	174.8	-178.9	3.5	0	0	0	110.1	N107	D105-N107 PolarHBondContact O-N 3.08Å
106	P	35.4	Very low	51.9	Low	114 Å²	114	121.3 Å²	121.3	74%	0.74	66%	0.655	S	S	*	*			trans	-91.7	69.9	179.8	36.6	-30.5	0	0	0	109.7	D104	D104-P106 WeakPolarHBondContact O-CD 3.36Å
107	N	43.9	Very low	52.3	Low	139 Å²	139	123.4 Å²	123.4	74%	0.743	67%	0.669	S	S	*	*			trans	-151	61.3	168.6	-87.5	-40.1	0	0	0	110.6	D105	D105-N107 PolarHBondContact O-N 3.08Å
108	N	41.2	Very low	53.4	Low	141 Å²	141	121.1 Å²	121.1	75%	0.754	67%	0.665	S	S	*	*			trans	-155.5	131.4	153.3	-128.1	-22.9	0	0	0	112.2
109	M	39.8	Very low	55.1	Low	156 Å²	156	119 Å²	119	77%	0.768	66%	0.66	S	S	*	*			trans	25.2	117.4	145.8	-77.7	162	49.9	0	0	116.7
110	D	52	Low	56.9	Low	94 Å²	94	118.2 Å²	118.2	50%	0.503	65%	0.649	S	S	.	*				-176.8	138.7	82.3	-151.4	-11	0	0	0	109.4	S112 L113	D110-S112 WeakPolarHBondContact CB-OG 3.26Å; D110-S112 PolarHBondContact O-N 3.23Å; D110-S112 PolarHBondContact OD2-OG 3.4Å; D110-L113 WeakPolarHBondContact O-CB 3.44Å; D110-L113 PolarHBondContact O-N 2.98Å
111	S	59.6	Low	59.2	Low	124 Å²	124	109.9 Å²	109.9	87%	0.867	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-4.6	177.2	25.6	0	0	0	0	114.3
112	S	68.8	Low	61.7	Low	45 Å²	45	106.2 Å²	106.2	32%	0.315	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	-9.9	175.9	54.6	0	0	0	0	114.1	D110 P114 L115 I116	D110-S112 WeakPolarHBondContact CB-OG 3.26Å; D110-S112 PolarHBondContact O-N 3.23Å; D110-S112 PolarHBondContact OD2-OG 3.4Å; S112-P114 VanDerWaalsContact C-CD 3.43Å; S112-L115 PolarHBondContact O-N 2.71Å; S112-L115 VanDerWaalsContact O-N 3.14Å; S112-I116 PolarHBondContact O-N 2.93Å; S112-I116 VanDerWaalsContact O-N 3.16Å
113	L	67.3	Low	64.4	Low	99 Å²	99	103.9 Å²	103.9	52%	0.518	60%	0.603	S	S	.	*	H	α-helix	trans	-55.3	-42.5	-175.2	-153.5	80	0	0	0	115	D110 L115 I116 L117	D110-L113 WeakPolarHBondContact O-CB 3.44Å; D110-L113 PolarHBondContact O-N 2.98Å; L113-L115 VanDerWaalsContact C-N 3.28Å; L113-L115 PolarHBondContact O-N 3.09Å; L113-I116 PolarHBondContact O-N 3.47Å; L113-L117 HydrophobicContact CD2-CD1 4.27Å; L113-L117 HydrophobicContact CG-CD1 4.12Å; L113-L117 WeakPolarHBondContact O-CB 3.48Å; L113-L117 WeakPolarHBondContact O-CG 3.26Å; L113-L117 PolarHBondContact O-N 2.81Å
114	P	74.4	Confident	67.2	Low	90 Å²	90	102.1 Å²	102.1	58%	0.584	59%	0.592	S	S	*	*	H	α-helix	trans	-63.2	-36.5	180	-17.2	28.8	0	0	0	112.3	S112 C118	S112-P114 VanDerWaalsContact C-CD 3.43Å; P114-C118 WeakPolarHBondContact O-CB 3.41Å; P114-C118 PolarHBondContact O-N 3.49Å; P114-C118 PolarHBondContact O-SG 3.25Å
115	L	77.4	Confident	70	Confident	125 Å²	125	100.9 Å²	100.9	65%	0.654	59%	0.585	S	S	*	*	H	α-helix	trans	-73.4	-39.3	-177.5	-128.3	148.1	0	0	0	110.9	S112 L113 C118 L119	S112-L115 PolarHBondContact O-N 2.71Å; S112-L115 VanDerWaalsContact O-N 3.14Å; L113-L115 VanDerWaalsContact C-N 3.28Å; L113-L115 PolarHBondContact O-N 3.09Å; L115-C118 PolarHBondContact O-N 3.39Å; L115-L119 HydrophobicContact CD2-CD1 4.47Å; L115-L119 WeakPolarHBondContact O-CG 3.29Å; L115-L119 PolarHBondContact O-N 2.97Å
116	I	79.8	Confident	72.7	Confident	80 Å²	80	101 Å²	101	41%	0.41	58%	0.584	S	S	.	*	H	α-helix	trans	-65.9	-44.4	174.6	-64.2	169	0	0	0	110.6	S112 L113 C118 L119 I120	S112-I116 PolarHBondContact O-N 2.93Å; S112-I116 VanDerWaalsContact O-N 3.16Å; L113-I116 PolarHBondContact O-N 3.47Å; I116-C118 PolarHBondContact O-N 3.19Å; I116-L119 PolarHBondContact O-N 3.49Å; I116-I120 HydrophobicContact CG2-CD1 3.73Å; I116-I120 HydrophobicContact CG2-CG1 4.36Å; I116-I120 VanDerWaalsContact O-CG1 3.32Å; I116-I120 WeakPolarHBondContact O-CG1 3.47Å; I116-I120 PolarHBondContact O-N 3.14Å
117	L	82.3	Confident	75.4	Confident	105 Å²	105	98.4 Å²	98.4	55%	0.55	57%	0.573	S	S	.	*	H	α-helix	trans	-63.1	-39.6	177.2	-73.8	168.7	0	0	0	112.3	L113 G121	L113-L117 HydrophobicContact CD2-CD1 4.27Å; L113-L117 HydrophobicContact CG-CD1 4.12Å; L113-L117 WeakPolarHBondContact O-CB 3.48Å; L113-L117 WeakPolarHBondContact O-CG 3.26Å; L113-L117 PolarHBondContact O-N 2.81Å; L117-G121 PolarHBondContact O-N 3.26Å
118	C	85.6	Confident	77.7	Confident	98 Å²	98	94.5 Å²	94.5	66%	0.662	56%	0.557	S	S	*	*	H	α-helix	trans	-63.4	-41	173.4	-80.3	0	0	0	0	112.6	P114 L115 I116 G122	P114-C118 WeakPolarHBondContact O-CB 3.41Å; P114-C118 PolarHBondContact O-N 3.49Å; P114-C118 PolarHBondContact O-SG 3.25Å; L115-C118 PolarHBondContact O-N 3.39Å; I116-C118 PolarHBondContact O-N 3.19Å; C118-G122 PolarHBondContact O-N 2.95Å
119	L	85.9	Confident	80.2	Confident	115 Å²	115	92.7 Å²	92.7	60%	0.602	55%	0.546	S	S	*	.	H	α-helix	trans	-66	-45.4	177	-73.6	169.5	0	0	0	111.7	L115 I116 G122 V123	L115-L119 HydrophobicContact CD2-CD1 4.47Å; L115-L119 WeakPolarHBondContact O-CG 3.29Å; L115-L119 PolarHBondContact O-N 2.97Å; I116-L119 PolarHBondContact O-N 3.49Å; L119-G122 PolarHBondContact O-N 3.43Å; L119-V123 WeakPolarHBondContact O-CG2 3.3Å; L119-V123 PolarHBondContact O-N 3.32Å
120	I	87.5	Confident	82.7	Confident	94 Å²	94	87.8 Å²	87.8	48%	0.482	53%	0.531	S	S	.	.	H	α-helix	trans	-61.9	-46.1	176	-65.9	168.8	0	0	0	110.2	I116 G122 V123 V124	I116-I120 HydrophobicContact CG2-CD1 3.73Å; I116-I120 HydrophobicContact CG2-CG1 4.36Å; I116-I120 VanDerWaalsContact O-CG1 3.32Å; I116-I120 WeakPolarHBondContact O-CG1 3.47Å; I116-I120 PolarHBondContact O-N 3.14Å; I120-G122 VanDerWaalsContact C-N 3.32Å; I120-G122 PolarHBondContact O-N 3.33Å; I120-V123 PolarHBondContact O-N 3.25Å; I120-V124 HydrophobicContact CG2-CG2 4.3Å; I120-V124 VanDerWaalsContact O-CG2 3.3Å; I120-V124 WeakPolarHBondContact O-CG2 3.27Å; I120-V124 PolarHBondContact O-N 3.05Å
121	G	88	Confident	84.6	Confident	35 Å²	35	85.6 Å²	85.6	36%	0.361	53%	0.525	S	S	.	.	H	α-helix	trans	-58.1	-42.3	176.5	0	0	0	0	0	112.6	L117 V124 L125	L117-G121 PolarHBondContact O-N 3.26Å; G121-V124 PolarHBondContact O-N 3.2Å; G121-L125 WeakPolarHBondContact O-CB 3.46Å; G121-L125 PolarHBondContact O-N 3.29Å
122	G	90.5	Very high	86.2	Confident	32 Å²	32	83.8 Å²	83.8	33%	0.33	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-42.6	175.7	0	0	0	0	0	113.4	C118 L119 I120 L125 L126	C118-G122 PolarHBondContact O-N 2.95Å; L119-G122 PolarHBondContact O-N 3.43Å; I120-G122 VanDerWaalsContact C-N 3.32Å; I120-G122 PolarHBondContact O-N 3.33Å; G122-L125 PolarHBondContact O-N 3.3Å; G122-L126 WeakPolarHBondContact O-CB 3.48Å; G122-L126 WeakPolarHBondContact O-CG 3.47Å; G122-L126 PolarHBondContact O-N 3.32Å
123	V	91.7	Very high	87.4	Confident	98 Å²	98	86.9 Å²	86.9	59%	0.594	52%	0.521	S	S	*	.	H	α-helix	trans	-65.5	-42.6	176.7	173.3	0	0	0	0	111.2	L119 I120 L126 A127	L119-V123 WeakPolarHBondContact O-CG2 3.3Å; L119-V123 PolarHBondContact O-N 3.32Å; I120-V123 PolarHBondContact O-N 3.25Å; V123-L126 PolarHBondContact O-N 3.04Å; V123-A127 VanDerWaalsContact O-CB 3.31Å; V123-A127 WeakPolarHBondContact O-CB 3.46Å; V123-A127 PolarHBondContact O-N 2.91Å
124	V	91.4	Very high	88.7	Confident	91 Å²	91	87.6 Å²	87.6	55%	0.552	53%	0.525	S	S	*	.	H	α-helix	trans	-66.2	-39.6	177.3	173.2	0	0	0	0	111.3	I120 G121 A127 S128	I120-V124 HydrophobicContact CG2-CG2 4.3Å; I120-V124 VanDerWaalsContact O-CG2 3.3Å; I120-V124 WeakPolarHBondContact O-CG2 3.27Å; I120-V124 PolarHBondContact O-N 3.05Å; G121-V124 PolarHBondContact O-N 3.2Å; V124-A127 PolarHBondContact O-N 2.92Å; V124-S128 WeakPolarHBondContact O-CB 3.42Å; V124-S128 PolarHBondContact O-N 2.96Å; V124-S128 PolarHBondContact O-OG 3.39Å
125	L	92.3	Very high	89.5	Confident	116 Å²	116	88.9 Å²	88.9	61%	0.607	53%	0.526	S	S	*	.	H	α-helix	trans	-62.7	-45.1	173.2	-106.3	156.5	0	0	0	111.9	G121 G122 S128 L129	G121-L125 WeakPolarHBondContact O-CB 3.46Å; G121-L125 PolarHBondContact O-N 3.29Å; G122-L125 PolarHBondContact O-N 3.3Å; L125-S128 WeakPolarHBondContact CA-OG 3.28Å; L125-S128 PolarHBondContact O-N 3.02Å; L125-S128 PolarHBondContact O-OG 3.46Å; L125-L129 VanDerWaalsContact O-CB 3.32Å; L125-L129 WeakPolarHBondContact O-CB 3.15Å; L125-L129 PolarHBondContact O-N 2.86Å
126	L	92.6	Very high	90.1	Very high	129 Å²	129	85.8 Å²	85.8	68%	0.675	51%	0.512	S	S	*	.	H	α-helix	trans	-65.7	-41	177.2	-73.5	170.3	0	0	0	112.1	G122 V123 L129 A130	G122-L126 WeakPolarHBondContact O-CB 3.48Å; G122-L126 WeakPolarHBondContact O-CG 3.47Å; G122-L126 PolarHBondContact O-N 3.32Å; V123-L126 PolarHBondContact O-N 3.04Å; L126-L129 PolarHBondContact O-N 2.91Å; L126-A130 VanDerWaalsContact O-CB 3.29Å; L126-A130 WeakPolarHBondContact O-CB 3.32Å; L126-A130 PolarHBondContact O-N 3.48Å
127	A	91.9	Very high	90.6	Very high	60 Å²	60	84.6 Å²	84.6	50%	0.496	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-42.8	177.2	0	0	0	0	0	111.9	V123 V124 A130 A131	V123-A127 VanDerWaalsContact O-CB 3.31Å; V123-A127 WeakPolarHBondContact O-CB 3.46Å; V123-A127 PolarHBondContact O-N 2.91Å; V124-A127 PolarHBondContact O-N 2.92Å; A127-A130 PolarHBondContact O-N 3.5Å; A127-A131 WeakPolarHBondContact O-CB 3.26Å; A127-A131 PolarHBondContact O-N 3.33Å
128	S	91.5	Very high	91	Very high	58 Å²	58	83.5 Å²	83.5	41%	0.406	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-40.1	175.9	59.9	0	0	0	0	112.1	V124 L125 A131 V132	V124-S128 WeakPolarHBondContact O-CB 3.42Å; V124-S128 PolarHBondContact O-N 2.96Å; V124-S128 PolarHBondContact O-OG 3.39Å; L125-S128 WeakPolarHBondContact CA-OG 3.28Å; L125-S128 PolarHBondContact O-N 3.02Å; L125-S128 PolarHBondContact O-OG 3.46Å; S128-A131 PolarHBondContact O-N 2.96Å; S128-V132 VanDerWaalsContact O-CG2 3.32Å; S128-V132 WeakPolarHBondContact O-CG2 3.32Å; S128-V132 PolarHBondContact O-N 3.24Å
129	L	93.4	Very high	91	Very high	103 Å²	103	85 Å²	85	54%	0.539	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-41.3	176	-148.6	119.4	0	0	0	111.5	L125 L126 V132 L133	L125-L129 VanDerWaalsContact O-CB 3.32Å; L125-L129 WeakPolarHBondContact O-CB 3.15Å; L125-L129 PolarHBondContact O-N 2.86Å; L126-L129 PolarHBondContact O-N 2.91Å; L129-V132 PolarHBondContact O-N 2.93Å; L129-L133 HydrophobicContact CD2-CD1 4.13Å; L129-L133 WeakPolarHBondContact O-CB 3.39Å; L129-L133 VanDerWaalsContact O-CG 3.29Å; L129-L133 WeakPolarHBondContact O-CG 3.39Å; L129-L133 PolarHBondContact O-N 3.36Å
130	A	93.3	Very high	91.2	Very high	53 Å²	53	88.5 Å²	88.5	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-42.6	173.5	0	0	0	0	0	111.8	L126 A127 L133 L134	L126-A130 VanDerWaalsContact O-CB 3.29Å; L126-A130 WeakPolarHBondContact O-CB 3.32Å; L126-A130 PolarHBondContact O-N 3.48Å; A127-A130 PolarHBondContact O-N 3.5Å; A130-L133 PolarHBondContact O-N 2.95Å; A130-L134 WeakPolarHBondContact O-CB 3.33Å; A130-L134 PolarHBondContact O-N 3.31Å
131	A	92.4	Very high	91.2	Very high	47 Å²	47	92.9 Å²	92.9	39%	0.388	52%	0.524	S	S	.	.	H	α-helix	trans	-62.6	-44.2	175.8	0	0	0	0	0	111.9	A127 S128 L134 I135	A127-A131 WeakPolarHBondContact O-CB 3.26Å; A127-A131 PolarHBondContact O-N 3.33Å; S128-A131 PolarHBondContact O-N 2.96Å; A131-L134 PolarHBondContact O-N 2.89Å; A131-I135 VanDerWaalsContact O-CG1 3.26Å; A131-I135 WeakPolarHBondContact O-CG1 3.4Å; A131-I135 PolarHBondContact O-N 3.02Å
132	V	92.9	Very high	90.9	Very high	86 Å²	86	95.1 Å²	95.1	52%	0.521	53%	0.531	S	S	.	.	H	α-helix	trans	-62.2	-44.1	175.3	171.5	0	0	0	0	111	S128 L129 L134 I135 V136	S128-V132 VanDerWaalsContact O-CG2 3.32Å; S128-V132 WeakPolarHBondContact O-CG2 3.32Å; S128-V132 PolarHBondContact O-N 3.24Å; L129-V132 PolarHBondContact O-N 2.93Å; V132-L134 VanDerWaalsContact C-N 3.33Å; V132-L134 PolarHBondContact O-N 2.91Å; V132-I135 PolarHBondContact O-N 3.38Å; V132-V136 HydrophobicContact CG1-CG2 4.4Å; V132-V136 WeakPolarHBondContact O-CB 3.39Å; V132-V136 VanDerWaalsContact O-CG2 3.29Å; V132-V136 WeakPolarHBondContact O-CG2 3.34Å; V132-V136 PolarHBondContact O-N 3.48Å
133	L	93.6	Very high	90.6	Very high	110 Å²	110	100.8 Å²	100.8	58%	0.576	55%	0.547	S	S	*	.	H	α-helix	trans	-62.3	-39.6	175.9	-72.7	173.1	0	0	0	112.1	L129 A130 V136 A137	L129-L133 HydrophobicContact CD2-CD1 4.13Å; L129-L133 WeakPolarHBondContact O-CB 3.39Å; L129-L133 VanDerWaalsContact O-CG 3.29Å; L129-L133 WeakPolarHBondContact O-CG 3.39Å; L129-L133 PolarHBondContact O-N 3.36Å; A130-L133 PolarHBondContact O-N 2.95Å; L133-V136 PolarHBondContact O-N 2.94Å; L133-A137 VanDerWaalsContact O-CB 3.25Å; L133-A137 WeakPolarHBondContact O-CB 3.37Å; L133-A137 PolarHBondContact O-N 2.88Å
134	L	93.5	Very high	90.2	Very high	115 Å²	115	102.6 Å²	102.6	60%	0.602	55%	0.547	S	S	*	.	H	α-helix	trans	-64	-45.7	174.8	-119.9	163.4	0	0	0	111.5	A130 A131 V132 V136 A137 V138	A130-L134 WeakPolarHBondContact O-CB 3.33Å; A130-L134 PolarHBondContact O-N 3.31Å; A131-L134 PolarHBondContact O-N 2.89Å; V132-L134 VanDerWaalsContact C-N 3.33Å; V132-L134 PolarHBondContact O-N 2.91Å; L134-V136 PolarHBondContact O-N 3.31Å; L134-A137 PolarHBondContact O-N 3.03Å; L134-V138 HydrophobicContact CD2-CG2 4.26Å; L134-V138 WeakPolarHBondContact O-CB 3.32Å; L134-V138 VanDerWaalsContact O-CG2 3.28Å; L134-V138 WeakPolarHBondContact O-CG2 3.36Å; L134-V138 PolarHBondContact O-N 3.08Å
135	I	91.4	Very high	89.6	Confident	117 Å²	117	102.1 Å²	102.1	60%	0.6	54%	0.54	S	S	*	.	H	α-helix	trans	-60.8	-45.5	176.3	-69.2	165	0	0	0	110.4	A131 V132 V138 H139	A131-I135 VanDerWaalsContact O-CG1 3.26Å; A131-I135 WeakPolarHBondContact O-CG1 3.4Å; A131-I135 PolarHBondContact O-N 3.02Å; V132-I135 PolarHBondContact O-N 3.38Å; I135-V138 PolarHBondContact O-N 3.49Å; I135-H139 VanDerWaalsContact O-CB 3.27Å; I135-H139 WeakPolarHBondContact O-CB 3.27Å; I135-H139 PolarHBondContact O-N 3.36Å
136	V	91.4	Very high	88.8	Confident	59 Å²	59	103.9 Å²	103.9	36%	0.358	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-41.8	177.1	171.5	0	0	0	0	111.2	V132 L133 L134 H139 R140	V132-V136 HydrophobicContact CG1-CG2 4.4Å; V132-V136 WeakPolarHBondContact O-CB 3.39Å; V132-V136 VanDerWaalsContact O-CG2 3.29Å; V132-V136 WeakPolarHBondContact O-CG2 3.34Å; V132-V136 PolarHBondContact O-N 3.48Å; L133-V136 PolarHBondContact O-N 2.94Å; L134-V136 PolarHBondContact O-N 3.31Å; V136-H139 PolarHBondContact O-N 3.03Å; V136-R140 HydrophobicContact CG1-CG 4.36Å; V136-R140 WeakPolarHBondContact O-CB 3.26Å; V136-R140 VanDerWaalsContact O-CG 3.28Å; V136-R140 WeakPolarHBondContact O-CG 3.28Å; V136-R140 PolarHBondContact O-N 3.44Å
137	A	90.6	Very high	88	Confident	55 Å²	55	100.3 Å²	100.3	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-64.4	-44.9	177.8	0	0	0	0	0	111.7	L133 L134 R140 R141	L133-A137 VanDerWaalsContact O-CB 3.25Å; L133-A137 WeakPolarHBondContact O-CB 3.37Å; L133-A137 PolarHBondContact O-N 2.88Å; L134-A137 PolarHBondContact O-N 3.03Å; A137-R140 PolarHBondContact O-N 3.2Å; A137-R141 WeakPolarHBondContact O-CB 3.46Å; A137-R141 PolarHBondContact O-N 3.01Å
138	V	88.9	Confident	87.3	Confident	83 Å²	83	100.2 Å²	100.2	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-60	-52.6	173.7	171.2	0	0	0	0	109.3	L134 I135 R140 R141 T142	L134-V138 HydrophobicContact CD2-CG2 4.26Å; L134-V138 WeakPolarHBondContact O-CB 3.32Å; L134-V138 VanDerWaalsContact O-CG2 3.28Å; L134-V138 WeakPolarHBondContact O-CG2 3.36Å; L134-V138 PolarHBondContact O-N 3.08Å; I135-V138 PolarHBondContact O-N 3.49Å; V138-R140 VanDerWaalsContact C-N 3.33Å; V138-R140 PolarHBondContact O-N 3.46Å; V138-R141 CarbonylContact O-C 3.57Å; V138-R141 WeakPolarHBondContact O-CA 3.42Å; V138-R141 WeakPolarHBondContact O-CB 3.46Å; V138-R141 PolarHBondContact O-N 3.31Å; V138-T142 PolarHBondContact O-N 2.94Å; V138-T142 PolarHBondContact O-OG1 3.45Å
139	H	87.4	Confident	86.2	Confident	130 Å²	130	102.8 Å²	102.8	60%	0.602	53%	0.525	S	S	*	.	H	α-helix	trans	-60.1	-40.4	-178.2	-158.7	81.2	0	0	0	112.5	I135 V136 K143	I135-H139 VanDerWaalsContact O-CB 3.27Å; I135-H139 WeakPolarHBondContact O-CB 3.27Å; I135-H139 PolarHBondContact O-N 3.36Å; V136-H139 PolarHBondContact O-N 3.03Å; H139-K143 VanDerWaalsContact O-CB 3.28Å; H139-K143 WeakPolarHBondContact O-CB 3.39Å; H139-K143 PolarHBondContact O-N 3.17Å
140	R	88.6	Confident	85.1	Confident	188 Å²	188	102.8 Å²	102.8	71%	0.709	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-42.2	172.8	-76.7	-179.8	177.7	179.5	1	111.7	V136 A137 V138 K143 F144	V136-R140 HydrophobicContact CG1-CG 4.36Å; V136-R140 WeakPolarHBondContact O-CB 3.26Å; V136-R140 VanDerWaalsContact O-CG 3.28Å; V136-R140 WeakPolarHBondContact O-CG 3.28Å; V136-R140 PolarHBondContact O-N 3.44Å; A137-R140 PolarHBondContact O-N 3.2Å; V138-R140 VanDerWaalsContact C-N 3.33Å; V138-R140 PolarHBondContact O-N 3.46Å; R140-K143 PolarHBondContact O-N 3.23Å; R140-F144 WeakPolarHBondContact O-CB 3.38Å; R140-F144 PolarHBondContact O-N 3.34Å
141	R	88	Confident	83.9	Confident	186 Å²	186	107.6 Å²	107.6	70%	0.702	53%	0.531	S	S	*	.	H	α-helix	trans	-66.1	-43.4	177.9	-165.3	178.9	-177.7	-172.5	0.4	111.5	A137 V138 F144 I145	A137-R141 WeakPolarHBondContact O-CB 3.46Å; A137-R141 PolarHBondContact O-N 3.01Å; V138-R141 CarbonylContact O-C 3.57Å; V138-R141 WeakPolarHBondContact O-CA 3.42Å; V138-R141 WeakPolarHBondContact O-CB 3.46Å; V138-R141 PolarHBondContact O-N 3.31Å; R141-F144 PolarHBondContact O-N 2.9Å; R141-I145 HydrophobicContact CG-CD1 4.12Å; R141-I145 VanDerWaalsContact O-CG1 3.29Å; R141-I145 WeakPolarHBondContact O-CG1 3.31Å; R141-I145 PolarHBondContact O-N 3.33Å
142	T	81.8	Confident	82.5	Confident	82 Å²	82	110 Å²	110	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-64.3	-43.9	176.7	-23.2	0	0	0	0	111	V138 F144 I145 Y146	V138-T142 PolarHBondContact O-N 2.94Å; V138-T142 PolarHBondContact O-OG1 3.45Å; T142-F144 VanDerWaalsContact C-N 3.34Å; T142-F144 PolarHBondContact O-N 3.3Å; T142-I145 PolarHBondContact O-N 2.92Å; T142-Y146 VanDerWaalsContact O-CB 3.32Å; T142-Y146 WeakPolarHBondContact O-CB 3.44Å; T142-Y146 PolarHBondContact O-N 3.17Å
143	K	84	Confident	80.7	Confident	151 Å²	151	110.3 Å²	110.3	66%	0.657	54%	0.542	S	S	*	.	H	α-helix	trans	-64.7	-37.7	177.3	-158.7	178	-172.9	176.5	0	111.9	H139 R140 S147	H139-K143 VanDerWaalsContact O-CB 3.28Å; H139-K143 WeakPolarHBondContact O-CB 3.39Å; H139-K143 PolarHBondContact O-N 3.17Å; R140-K143 PolarHBondContact O-N 3.23Å; K143-S147 WeakPolarHBondContact O-CB 3.35Å; K143-S147 PolarHBondContact O-N 2.99Å
144	F	82.8	Confident	78.7	Confident	136 Å²	136	113.9 Å²	113.9	60%	0.596	55%	0.548	S	S	*	.	H	α-helix	trans	-64.3	-50.4	174	-178.1	-100.4	0	0	0	111.6	R140 R141 T142 Y146 S147 V148	R140-F144 WeakPolarHBondContact O-CB 3.38Å; R140-F144 PolarHBondContact O-N 3.34Å; R141-F144 PolarHBondContact O-N 2.9Å; T142-F144 VanDerWaalsContact C-N 3.34Å; T142-F144 PolarHBondContact O-N 3.3Å; F144-Y146 VanDerWaalsContact C-N 3.32Å; F144-Y146 PolarHBondContact O-N 2.87Å; F144-S147 PolarHBondContact O-N 2.87Å; F144-S147 VanDerWaalsContact O-N 3.09Å; F144-S147 PolarHBondContact O-OG 3.31Å; F144-V148 HydrophobicContact CD1-CG2 4.28Å; F144-V148 HydrophobicContact CE1-CG2 3.9Å; F144-V148 HydrophobicContact CE2-CG2 4.32Å; F144-V148 HydrophobicContact CZ-CG2 3.92Å; F144-V148 WeakPolarHBondContact O-CG2 3.38Å; F144-V148 PolarHBondContact O-N 3.26Å
145	I	80	Confident	76.8	Confident	80 Å²	80	115 Å²	115	41%	0.41	55%	0.554	S	S	.	*	H	α-helix	trans	-58.4	-44.9	177.4	-68.7	167.3	0	0	0	110.7	R141 T142 S147 V148 Q149	R141-I145 HydrophobicContact CG-CD1 4.12Å; R141-I145 VanDerWaalsContact O-CG1 3.29Å; R141-I145 WeakPolarHBondContact O-CG1 3.31Å; R141-I145 PolarHBondContact O-N 3.33Å; T142-I145 PolarHBondContact O-N 2.92Å; I145-S147 VanDerWaalsContact C-N 3.33Å; I145-S147 PolarHBondContact O-N 3.44Å; I145-V148 PolarHBondContact O-N 2.82Å; I145-Q149 PolarHBondContact O-N 3.03Å
146	Y	75	Confident	74.8	Confident	153 Å²	153	117.2 Å²	117.2	60%	0.6	56%	0.561	S	S	*	*	H	α-helix	trans	-61	-40.9	176.2	-172.5	-96.2	0	0	0	111.9	T142 F144 V148 Q149 K150	T142-Y146 VanDerWaalsContact O-CB 3.32Å; T142-Y146 WeakPolarHBondContact O-CB 3.44Å; T142-Y146 PolarHBondContact O-N 3.17Å; F144-Y146 VanDerWaalsContact C-N 3.32Å; F144-Y146 PolarHBondContact O-N 2.87Å; Y146-V148 PolarHBondContact O-N 2.76Å; Y146-Q149 PolarHBondContact O-N 2.84Å; Y146-K150 WeakPolarHBondContact O-CB 3.34Å; Y146-K150 PolarHBondContact O-N 2.84Å
147	S	76.4	Confident	72.4	Confident	54 Å²	54	117.6 Å²	117.6	38%	0.378	58%	0.577	S	S	.	*	H	α-helix	trans	-66.5	-35.5	177.2	79.2	0	0	0	0	113.3	K143 F144 I145 K151	K143-S147 WeakPolarHBondContact O-CB 3.35Å; K143-S147 PolarHBondContact O-N 2.99Å; F144-S147 PolarHBondContact O-N 2.87Å; F144-S147 VanDerWaalsContact O-N 3.09Å; F144-S147 PolarHBondContact O-OG 3.31Å; I145-S147 VanDerWaalsContact C-N 3.33Å; I145-S147 PolarHBondContact O-N 3.44Å; S147-K151 PolarHBondContact O-N 2.86Å; S147-K151 VanDerWaalsContact O-N 3.14Å
148	V	76.3	Confident	69.9	Low	58 Å²	58	122.5 Å²	122.5	35%	0.352	60%	0.596	S	S	.	*	H	α-helix	trans	-71.8	-43.8	176.9	172.6	0	0	0	0	110.5	F144 I145 Y146 K150 K151 L152	F144-V148 HydrophobicContact CD1-CG2 4.28Å; F144-V148 HydrophobicContact CE1-CG2 3.9Å; F144-V148 HydrophobicContact CE2-CG2 4.32Å; F144-V148 HydrophobicContact CZ-CG2 3.92Å; F144-V148 WeakPolarHBondContact O-CG2 3.38Å; F144-V148 PolarHBondContact O-N 3.26Å; I145-V148 PolarHBondContact O-N 2.82Å; Y146-V148 PolarHBondContact O-N 2.76Å; V148-K150 PolarHBondContact O-N 3.33Å; V148-K151 PolarHBondContact O-N 3.19Å; V148-L152 HydrophobicContact CG1-CD1 3.89Å; V148-L152 PolarHBondContact O-N 2.96Å
149	Q	68.8	Low	67.3	Low	113 Å²	113	122.3 Å²	122.3	53%	0.528	61%	0.611	S	S	.	*	H	α-helix	trans	-61.9	-42.9	174.9	-76.4	-179.6	-21.8	0	0	111.8	I145 Y146 K151 L152 C153	I145-Q149 PolarHBondContact O-N 3.03Å; Y146-Q149 PolarHBondContact O-N 2.84Å; Q149-K151 VanDerWaalsContact C-N 3.27Å; Q149-K151 PolarHBondContact O-N 3.34Å; Q149-L152 PolarHBondContact O-N 3.41Å; Q149-C153 PolarHBondContact O-N 3.49Å; Q149-C153 PolarHBondContact O-SG 3.38Å
150	K	71.1	Confident	64.6	Low	102 Å²	102	120 Å²	120	44%	0.443	62%	0.622	S	S	.	*	H	α-helix	trans	-61.9	-33.1	175.7	-170.2	174.3	-176.3	173.1	0	112.7	Y146 V148 R154	Y146-K150 WeakPolarHBondContact O-CB 3.34Å; Y146-K150 PolarHBondContact O-N 2.84Å; V148-K150 PolarHBondContact O-N 3.33Å; K150-R154 WeakPolarHBondContact O-CG 3.5Å; K150-R154 PolarHBondContact O-N 3.33Å
151	K	66.2	Low	61.8	Low	155 Å²	155	116.5 Å²	116.5	67%	0.674	63%	0.627	S	S	*	*	H	α-helix	trans	-73.1	-40.9	173.7	-82.8	-176.8	176.6	-177.4	0	112.4	S147 V148 Q149 R154 L155	S147-K151 PolarHBondContact O-N 2.86Å; S147-K151 VanDerWaalsContact O-N 3.14Å; V148-K151 PolarHBondContact O-N 3.19Å; Q149-K151 VanDerWaalsContact C-N 3.27Å; Q149-K151 PolarHBondContact O-N 3.34Å; K151-R154 PolarHBondContact O-N 3.44Å; K151-L155 PolarHBondContact O-N 3.35Å
152	L	63.2	Low	59.1	Low	96 Å²	96	112 Å²	112	50%	0.503	63%	0.629	S	S	.	*	H	α-helix	trans	-64.8	-44.1	178.3	-78.5	157.8	0	0	0	112.2	V148 Q149 R154 L155 E156	V148-L152 HydrophobicContact CG1-CD1 3.89Å; V148-L152 PolarHBondContact O-N 2.96Å; Q149-L152 PolarHBondContact O-N 3.41Å; L152-R154 PolarHBondContact O-N 3.27Å; L152-L155 PolarHBondContact O-N 2.91Å; L152-E156 PolarHBondContact O-N 2.86Å
153	C	56.8	Low	56.6	Low	93 Å²	93	118.8 Å²	118.8	63%	0.628	65%	0.647	S	S	*	*	H	α-helix	trans	-66.4	-22.4	177	-65.9	0	0	0	0	113.6	Q149	Q149-C153 PolarHBondContact O-N 3.49Å; Q149-C153 PolarHBondContact O-SG 3.38Å
154	R	51.2	Low	54.2	Low	186 Å²	186	116.7 Å²	116.7	70%	0.702	66%	0.658	S	S	*	*	H	α-helix	trans	-79.8	-21.3	173.1	-76	179.7	177.8	-167.3	-3.6	113.2	K150 K151 L152	K150-R154 WeakPolarHBondContact O-CG 3.5Å; K150-R154 PolarHBondContact O-N 3.33Å; K151-R154 PolarHBondContact O-N 3.44Å; L152-R154 PolarHBondContact O-N 3.27Å
155	L	53.8	Low	51.6	Low	139 Å²	139	114.8 Å²	114.8	73%	0.728	66%	0.661	S	S	*	*	H	α-helix	trans	-89.2	-22	-179.9	-75.1	160.4	0	0	0	112.7	K151 L152	K151-L155 PolarHBondContact O-N 3.35Å; L152-L155 PolarHBondContact O-N 2.91Å
156	E	48.7	Very low	49.4	Very low	162 Å²	162	118 Å²	118	76%	0.757	68%	0.678	S	S	*	*	S	Bend	trans	-89.3	-0.8	176.9	-72	179	153.6	0	0	113.8	L152	L152-E156 PolarHBondContact O-N 2.86Å
157	G	41.8	Very low	47.5	Very low	67 Å²	67	118 Å²	118	69%	0.691	69%	0.688	S	S	*	*	S	Bend	trans	-91.3	4	-176.8	0	0	0	0	0	116.5
158	D	37.9	Very low	45.2	Very low	158 Å²	158	123.9 Å²	123.9	85%	0.845	71%	0.71	S	S	*	*	S	Bend	trans	-137	52.7	-170	-161.8	22	0	0	0	113.2
159	G	33.4	Very low	43.3	Very low	79 Å²	79	128.1 Å²	128.1	81%	0.814	73%	0.73	S	S	*	*			trans	-167.1	111.4	177	0	0	0	0	0	115.8
160	G	31.2	Very low	41.6	Very low	82 Å²	82	128.6 Å²	128.6	85%	0.845	74%	0.741	S	S	*	*			trans	116.7	80.8	142.1	0	0	0	0	0	118.1
161	S	28.8	Very low	40.2	Very low	115 Å²	115	127.2 Å²	127.2	80%	0.804	74%	0.742	S	S	*	*			trans	-73.4	138.3	153.1	173.2	0	0	0	0	110.6
162	A	32.7	Very low	39.4	Very low	91 Å²	91	122.1 Å²	122.1	75%	0.752	72%	0.721	S	S	*	*			trans	178.6	109.5	142.7	0	0	0	0	0	113.6
163	Y	28.9	Very low	38.8	Very low	225 Å²	225	120.9 Å²	120.9	88%	0.882	72%	0.718	S	S	*	*			trans	24.2	131.2	141.3	-72.3	-91.3	0	0	0	122.4
164	A	32.7	Very low	38.4	Very low	106 Å²	106	120.3 Å²	120.3	88%	0.876	71%	0.708	S	S	*	*				-153.2	134.5	129.1	0	0	0	0	0	111
165	S	28.6	Very low	38.3	Very low	97 Å²	97	114.1 Å²	114.1	68%	0.678	69%	0.689	S	S	*	*			trans	-94.3	169.5	-174.5	50	0	0	0	0	113.9
166	I	35.3	Very low	38.2	Very low	147 Å²	147	109 Å²	109	75%	0.754	67%	0.666	S	S	*	*			trans	90.2	120.3	165	-50.1	159.9	0	0	0	112.1
167	D	33.6	Very low	38.2	Very low	152 Å²	152	107.6 Å²	107.6	81%	0.813	66%	0.66	S	S	*	*				-157.4	159.7	51.2	-130.5	-17.2	0	0	0	113.7
168	E	29.5	Very low	38.3	Very low	178 Å²	178	111.7 Å²	111.7	83%	0.832	66%	0.661	S	S	*	*			trans	-71.7	115.8	-176.6	-65.7	176.7	140.8	0	0	114
169	N	36.4	Very low	38.5	Very low	147 Å²	147	106.3 Å²	106.3	79%	0.786	63%	0.634	S	S	*	*			trans	-177.7	121.3	139.5	-98.5	-25.9	0	0	0	110.9	T171	N169-T171 PolarHBondContact O-N 3.11Å
170	T	32.7	Very low	38.8	Very low	123 Å²	123	108.5 Å²	108.5	76%	0.755	64%	0.637	S	S	*	*			trans	-58.5	115.4	-175.9	40.4	0	0	0	0	112.7
171	T	41.6	Very low	39.2	Very low	74 Å²	74	107 Å²	107	45%	0.454	62%	0.621	S	S	.	*			trans	-143.4	168.4	177.8	48.4	0	0	0	0	110.2	N169 T173 D174	N169-T171 PolarHBondContact O-N 3.11Å; T171-T173 PolarHBondContact O-N 3.08Å; T171-T173 PolarHBondContact O-OG1 2.89Å; T171-D174 PolarHBondContact O-N 3.15Å; T171-D174 VanDerWaalsContact O-N 3.14Å
172	L	48.7	Very low	40.2	Very low	48 Å²	48	103.5 Å²	103.5	25%	0.251	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-32.8	-24.5	-171	-94.1	159.7	0	0	0	118.8	D174 L175 A176 W217 E220	L172-D174 VanDerWaalsContact C-N 3.32Å; L172-D174 PolarHBondContact O-N 3.5Å; L172-L175 PolarHBondContact O-N 2.78Å; L172-A176 PolarHBondContact O-N 3.46Å; L172-W217 HydrophobicContact CD2-CE3 4.28Å; L172-W217 HydrophobicContact CD2-CZ3 3.76Å; L172-E220 HydrophobicContact CD1-CB 3.56Å; L172-E220 HydrophobicContact CD1-CG 3.54Å; L172-E220 HydrophobicContact CG-CB 4.37Å; L172-E220 HydrophobicContact CG-CG 3.93Å
173	T	50.8	Low	41.2	Very low	69 Å²	69	100.8 Å²	100.8	42%	0.423	58%	0.578	S	S	.	*	H	α-helix	trans	-51.6	-43.3	173.2	-10.4	0	0	0	0	112.8	T171 L175 A176 E177	T171-T173 PolarHBondContact O-N 3.08Å; T171-T173 PolarHBondContact O-OG1 2.89Å; T173-L175 VanDerWaalsContact C-N 3.32Å; T173-L175 PolarHBondContact O-N 2.95Å; T173-A176 PolarHBondContact O-N 3.03Å; T173-A176 VanDerWaalsContact O-N 3.12Å; T173-E177 WeakPolarHBondContact O-CB 3.22Å; T173-E177 WeakPolarHBondContact O-CG 3.35Å; T173-E177 PolarHBondContact O-N 2.64Å
174	D	48.5	Very low	42.7	Very low	81 Å²	81	90.8 Å²	90.8	43%	0.433	54%	0.541	S	S	.	.	H	α-helix	trans	-67.1	-30.3	-177.1	-72	-27.6	0	0	0	113.2	T171 L172 Q178	T171-D174 PolarHBondContact O-N 3.15Å; T171-D174 VanDerWaalsContact O-N 3.14Å; L172-D174 VanDerWaalsContact C-N 3.32Å; L172-D174 PolarHBondContact O-N 3.5Å; D174-Q178 VanDerWaalsContact O-CG 3.3Å; D174-Q178 WeakPolarHBondContact O-CG 3.34Å; D174-Q178 PolarHBondContact O-N 2.93Å; D174-Q178 VanDerWaalsContact O-N 3.14Å
175	L	49.8	Very low	44.1	Very low	57 Å²	57	86.6 Å²	86.6	30%	0.298	51%	0.508	S	S	.	.	H	α-helix	trans	-81.7	-23.5	176.5	-74.4	165.5	0	0	0	112.3	L172 T173 L186	L172-L175 PolarHBondContact O-N 2.78Å; T173-L175 VanDerWaalsContact C-N 3.32Å; T173-L175 PolarHBondContact O-N 2.95Å; L175-L186 HydrophobicContact CB-CD2 4.34Å
176	A	50.1	Low	46	Very low	30 Å²	30	82.9 Å²	82.9	25%	0.248	48%	0.48	C	S	.	.	H	α-helix	trans	-77.9	-34.9	170.2	0	0	0	0	0	111.5	L172 T173 T179	L172-A176 PolarHBondContact O-N 3.46Å; T173-A176 PolarHBondContact O-N 3.03Å; T173-A176 VanDerWaalsContact O-N 3.12Å; A176-T179 PolarHBondContact O-N 3.5Å; A176-T179 PolarHBondContact O-OG1 3.48Å
177	E	49.4	Very low	47.6	Very low	133 Å²	133	79.6 Å²	79.6	62%	0.621	47%	0.468	S	S	*	.	H	α-helix	trans	-77.8	-21.8	179.1	-72.4	-176.1	-178.8	0	0	113.6	T173 T179	T173-E177 WeakPolarHBondContact O-CB 3.22Å; T173-E177 WeakPolarHBondContact O-CG 3.35Å; T173-E177 PolarHBondContact O-N 2.64Å; E177-T179 PolarHBondContact O-N 2.94Å
178	Q	43.8	Very low	49.2	Very low	154 Å²	154	78.1 Å²	78.1	72%	0.72	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	0.4	167	-77.9	177.7	12.2	0	0	114	D174	D174-Q178 VanDerWaalsContact O-CG 3.3Å; D174-Q178 WeakPolarHBondContact O-CG 3.34Å; D174-Q178 PolarHBondContact O-N 2.93Å; D174-Q178 VanDerWaalsContact O-N 3.14Å
179	T	42.9	Very low	50.4	Low	45 Å²	45	76.7 Å²	76.7	28%	0.276	46%	0.457	S	S	.	.			trans	-100.5	62	172.5	73.2	0	0	0	0	111.9	A176 E177 G181	A176-T179 PolarHBondContact O-N 3.5Å; A176-T179 PolarHBondContact O-OG1 3.48Å; E177-T179 PolarHBondContact O-N 2.94Å; T179-G181 PolarHBondContact O-N 2.98Å
180	S	39.7	Very low	51.8	Low	124 Å²	124	72.1 Å²	72.1	87%	0.867	43%	0.434	S	S	*	.			trans	-68.7	33.4	164.3	-70.8	0	0	0	0	112.9
181	G	39	Very low	53.8	Low	51 Å²	51	66.8 Å²	66.8	53%	0.526	40%	0.401	S	S	.	.	S	Bend	trans	-141.2	40.7	-170.2	0	0	0	0	0	113.5	T179 G183	T179-G181 PolarHBondContact O-N 2.98Å; G181-G183 VanDerWaalsContact C-N 3.33Å; G181-G183 PolarHBondContact O-N 3.31Å
182	S	50	Low	55.2	Low	42 Å²	42	72.6 Å²	72.6	29%	0.294	42%	0.415	S	S	.	.	S	Bend	trans	59.1	-1	153.7	-64.4	0	0	0	0	122.8	V245 R317	S182-V245 WeakPolarHBondContact O-CA 3.38Å; S182-V245 WeakPolarHBondContact O-CG1 3.47Å; S182-V245 WeakPolarHBondContact O-CG2 2.96Å; S182-R317 VanDerWaalsContact CB-NH1 3.29Å; S182-R317 WeakPolarHBondContact OG-CD 3.35Å; S182-R317 PolarHBondContact OG-NH1 3.35Å
183	G	52.5	Low	56.6	Low	33 Å²	33	73.4 Å²	73.4	34%	0.34	42%	0.421	S	S	.	.	S	Bend	trans	-100.3	137.8	165.1	0	0	0	0	0	111	G181 G185	G181-G183 VanDerWaalsContact C-N 3.33Å; G181-G183 PolarHBondContact O-N 3.31Å; G183-G185 PolarHBondContact O-N 3Å
184	S	60.9	Low	58.4	Low	15 Å²	15	70.1 Å²	70.1	11%	0.105	40%	0.401	C	S	.	.	S	Bend	trans	-70.5	118	168.3	12.6	0	0	0	0	109.5	Y242 T244 F255	S184-Y242 VanDerWaalsContact CB-O 3.26Å; S184-Y242 WeakPolarHBondContact CB-O 3.14Å; S184-Y242 PolarHBondContact OG-O 2.67Å; S184-T244 PolarHBondContact OG-O 3.29Å; S184-F255 WeakPolarHBondContact O-CD1 3.27Å; S184-F255 VanDerWaalsContact O-CE1 3.27Å; S184-F255 WeakPolarHBondContact O-CE1 3.42Å
185	G	63.3	Low	60.2	Low	18 Å²	18	66.4 Å²	66.4	19%	0.186	38%	0.382	C	S	.	.	S	Bend	trans	119.4	175.2	175.3	0	0	0	0	0	114	G183 I256	G183-G185 PolarHBondContact O-N 3Å; G185-I256 WeakPolarHBondContact CA-O 3.29Å
186	L	66.9	Low	61.9	Low	20 Å²	20	74.6 Å²	74.6	11%	0.105	41%	0.409	C	S	.	.	S	Bend	trans	-69.5	161.9	-175.9	-68.3	161.6	0	0	0	112.8	L175 V190 Q191 I194 W217 I256	L175-L186 HydrophobicContact CB-CD2 4.34Å; L186-V190 HydrophobicContact CB-CB 4.39Å; L186-V190 HydrophobicContact CB-CG1 4.28Å; L186-V190 HydrophobicContact CD1-CG1 4.2Å; L186-Q191 HydrophobicContact CB-CG 4.02Å; L186-Q191 VanDerWaalsContact O-CD 3.31Å; L186-Q191 VanDerWaalsContact O-CG 3.3Å; L186-Q191 WeakPolarHBondContact O-CG 3.24Å; L186-Q191 PolarHBondContact O-NE2 3.48Å; L186-I194 HydrophobicContact CD1-CD1 3.58Å; L186-W217 HydrophobicContact CD1-CH2 3.46Å; L186-W217 VanDerWaalsContact CD1-CH2 3.46Å; L186-W217 HydrophobicContact CD1-CZ2 4.19Å; L186-W217 HydrophobicContact CD1-CZ3 4.12Å; L186-I256 HydrophobicContact CD1-CG2 3.88Å; L186-I256 PolarHBondContact N-O 3.2Å; L186-I256 VanDerWaalsContact N-O 3.15Å
187	P	68.8	Low	63.8	Low	77 Å²	77	77.5 Å²	77.5	50%	0.5	42%	0.417	S	S	.	.			trans	-56.6	142.9	171.9	-24.5	34	0	0	0	112.7	L189 V190 Q191	P187-L189 VanDerWaalsContact C-N 3.3Å; P187-L189 PolarHBondContact O-N 2.86Å; P187-L189 VanDerWaalsContact O-N 3.12Å; P187-V190 HydrophobicContact CB-CG2 4.37Å; P187-V190 WeakPolarHBondContact O-CA 3.49Å; P187-V190 WeakPolarHBondContact O-CB 3.26Å; P187-V190 PolarHBondContact O-N 2.69Å; P187-Q191 PolarHBondContact O-N 3.19Å
188	L	67.2	Low	65.9	Low	121 Å²	121	72.1 Å²	72.1	63%	0.634	39%	0.393	S	S	*	.	H	α-helix	trans	-50.7	-40.9	-172.8	-71.5	173.3	0	0	0	114.9	V190 Q191 R192	L188-V190 VanDerWaalsContact C-N 3.33Å; L188-Q191 WeakPolarHBondContact O-CB 3.24Å; L188-Q191 PolarHBondContact O-N 2.87Å; L188-R192 PolarHBondContact O-N 3.48Å
189	L	55.8	Low	68.3	Low	148 Å²	148	70.5 Å²	70.5	78%	0.775	39%	0.385	S	S	*	.	H	α-helix	trans	-66.1	-37.2	178.5	-71.1	175.7	0	0	0	112.2	P187	P187-L189 VanDerWaalsContact C-N 3.3Å; P187-L189 PolarHBondContact O-N 2.86Å; P187-L189 VanDerWaalsContact O-N 3.12Å
190	V	65.9	Low	70.8	Confident	51 Å²	51	71.7 Å²	71.7	31%	0.309	39%	0.388	S	S	.	.	H	α-helix	trans	-68.1	-45.4	174.9	179.8	0	0	0	0	109.1	L186 P187 L188 R192 T193 I194	L186-V190 HydrophobicContact CB-CB 4.39Å; L186-V190 HydrophobicContact CB-CG1 4.28Å; L186-V190 HydrophobicContact CD1-CG1 4.2Å; P187-V190 HydrophobicContact CB-CG2 4.37Å; P187-V190 WeakPolarHBondContact O-CA 3.49Å; P187-V190 WeakPolarHBondContact O-CB 3.26Å; P187-V190 PolarHBondContact O-N 2.69Å; L188-V190 VanDerWaalsContact C-N 3.33Å; V190-R192 VanDerWaalsContact C-N 3.27Å; V190-R192 PolarHBondContact O-N 3.1Å; V190-T193 PolarHBondContact O-N 3.49Å; V190-T193 VanDerWaalsContact O-N 3.08Å; V190-T193 PolarHBondContact O-OG1 3.26Å; V190-I194 WeakPolarHBondContact O-CG1 3.27Å
191	Q	74.6	Confident	73.5	Confident	12 Å²	12	69.2 Å²	69.2	6%	0.056	37%	0.365	C	S	.	.	H	α-helix	trans	-52	-44.6	179.6	-66.4	-171.8	4.4	0	0	112.2	L186 P187 L188 T193 I194 A257 D259	L186-Q191 HydrophobicContact CB-CG 4.02Å; L186-Q191 VanDerWaalsContact O-CD 3.31Å; L186-Q191 VanDerWaalsContact O-CG 3.3Å; L186-Q191 WeakPolarHBondContact O-CG 3.24Å; L186-Q191 PolarHBondContact O-NE2 3.48Å; P187-Q191 PolarHBondContact O-N 3.19Å; L188-Q191 WeakPolarHBondContact O-CB 3.24Å; L188-Q191 PolarHBondContact O-N 2.87Å; Q191-T193 PolarHBondContact O-N 3.29Å; Q191-I194 PolarHBondContact O-N 3.19Å; Q191-A257 HydrophobicContact CB-CB 4.1Å; Q191-A257 HydrophobicContact CG-CB 3.8Å; Q191-D259 WeakPolarHBondContact O-CB 3.45Å; Q191-D259 VanDerWaalsContact O-OD2 3.06Å
192	R	70.7	Confident	76.2	Confident	196 Å²	196	72 Å²	72	74%	0.74	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	3.9	-178.4	-71.7	-172.6	177.4	-177.6	-0.3	116.4	L188 V190 D259	L188-R192 PolarHBondContact O-N 3.48Å; V190-R192 VanDerWaalsContact C-N 3.27Å; V190-R192 PolarHBondContact O-N 3.1Å; R192-D259 VanDerWaalsContact C-OD2 3.31Å; R192-D259 VanDerWaalsContact CA-OD1 3.24Å; R192-D259 WeakPolarHBondContact CA-OD1 3.28Å
193	T	79.2	Confident	78.4	Confident	64 Å²	64	72.3 Å²	72.3	39%	0.393	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-4.2	-177.8	62.1	0	0	0	0	113.8	V190 Q191 A195 R196 D259	V190-T193 PolarHBondContact O-N 3.49Å; V190-T193 VanDerWaalsContact O-N 3.08Å; V190-T193 PolarHBondContact O-OG1 3.26Å; Q191-T193 PolarHBondContact O-N 3.29Å; T193-A195 PolarHBondContact O-N 3.15Å; T193-R196 PolarHBondContact O-N 3.25Å; T193-D259 PolarHBondContact N-OD2 3.34Å
194	I	87	Confident	80.4	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-69.5	-36.7	-173.4	-70.7	168.5	0	0	0	110.7	L186 V190 Q191 R196 Q197 L198 W217 A257 D259 I272	L186-I194 HydrophobicContact CD1-CD1 3.58Å; V190-I194 WeakPolarHBondContact O-CG1 3.27Å; Q191-I194 PolarHBondContact O-N 3.19Å; I194-R196 PolarHBondContact O-N 3.13Å; I194-Q197 WeakPolarHBondContact O-CA 3.26Å; I194-Q197 PolarHBondContact O-N 3.38Å; I194-L198 HydrophobicContact CG2-CD1 4.45Å; I194-L198 HydrophobicContact CG2-CD2 4.21Å; I194-L198 HydrophobicContact CG2-CG 4.15Å; I194-L198 PolarHBondContact O-N 3.05Å; I194-W217 HydrophobicContact CD1-CH2 4.46Å; I194-W217 HydrophobicContact CD1-CZ2 4.14Å; I194-W217 HydrophobicContact CG1-CZ2 3.96Å; I194-W217 HydrophobicContact CG2-CD2 4.4Å; I194-W217 HydrophobicContact CG2-CG 4.43Å; I194-A257 HydrophobicContact CD1-CB 3.27Å; I194-D259 PolarHBondContact N-OD2 3.5Å; I194-I272 HydrophobicContact CG2-CD1 4.4Å; I194-I272 HydrophobicContact CG2-CG1 4.4Å
195	A	87.2	Confident	81.7	Confident	3 Å²	3	74.7 Å²	74.7	3%	0.025	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-57.9	-27.1	-177.6	0	0	0	0	0	114	T193 D259 K261 L270	T193-A195 PolarHBondContact O-N 3.15Å; A195-D259 HydrophobicContact CB-CB 4.13Å; A195-D259 WeakPolarHBondContact CB-OD2 3.25Å; A195-D259 PolarHBondContact N-OD2 3.3Å; A195-K261 HydrophobicContact CB-CB 3.91Å; A195-K261 HydrophobicContact CB-CD 4.23Å; A195-K261 HydrophobicContact CB-CG 4.34Å; A195-L270 HydrophobicContact CB-CD1 3.52Å
196	R	85.9	Confident	82.9	Confident	229 Å²	229	82 Å²	82	86%	0.864	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-77.4	-22.1	176.3	-65.9	-175.9	177	-174.2	-0.9	113	T193 I194	T193-R196 PolarHBondContact O-N 3.25Å; I194-R196 PolarHBondContact O-N 3.13Å
197	Q	89.6	Confident	83.6	Confident	90 Å²	90	83.4 Å²	83.4	42%	0.421	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-7.5	-177.7	-60.2	176.2	2.3	0	0	112.7	I194 W217	I194-Q197 WeakPolarHBondContact O-CA 3.26Å; I194-Q197 PolarHBondContact O-N 3.38Å; Q197-W217 VanDerWaalsContact OE1-NE1 3.11Å
198	L	93.6	Very high	84.2	Confident	20 Å²	20	87.9 Å²	87.9	11%	0.105	43%	0.431	C	S	.	.			trans	-74.8	125.5	179.4	-70.4	173.9	0	0	0	111.5	I194 M200 A215 W217 V222 V224 L270 I272	I194-L198 HydrophobicContact CG2-CD1 4.45Å; I194-L198 HydrophobicContact CG2-CD2 4.21Å; I194-L198 HydrophobicContact CG2-CG 4.15Å; I194-L198 PolarHBondContact O-N 3.05Å; L198-M200 HydrophobicContact CB-SD 4.37Å; L198-A215 HydrophobicContact CD2-CB 4.41Å; L198-W217 HydrophobicContact CD2-CB 3.88Å; L198-W217 HydrophobicContact CD2-CG 4.25Å; L198-V222 HydrophobicContact CD2-CG2 3.89Å; L198-V224 HydrophobicContact CD1-CG1 4.18Å; L198-V224 HydrophobicContact CD1-CG2 3.92Å; L198-V224 HydrophobicContact CD2-CG2 4.14Å; L198-L270 HydrophobicContact CD1-CD1 4.1Å; L198-I272 HydrophobicContact CD1-CG1 4.12Å
199	Q	95	Very high	85	Confident	121 Å²	121	82.9 Å²	82.9	57%	0.565	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	101.5	165.8	-175.1	-175.8	15.9	0	0	109.1	L201 A215 R216	Q199-L201 HydrophobicContact CG-CD2 4.27Å; Q199-A215 CarbonylContact O-C 3.52Å; Q199-A215 VanDerWaalsContact O-CA 3.23Å; Q199-A215 WeakPolarHBondContact O-CA 3.38Å; Q199-A215 WeakPolarHBondContact O-CB 3.07Å; Q199-R216 HydrophobicContact CB-CB 4.31Å; Q199-R216 PolarHBondContact N-O 3.13Å; Q199-R216 PolarHBondContact O-N 3.16Å
200	M	94.9	Very high	86.6	Confident	69 Å²	69	76 Å²	76	34%	0.34	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.4	177.6	-54	-58.6	-69.9	0	0	110.2	L198 W213 A215 V224 I226	L198-M200 HydrophobicContact CB-SD 4.37Å; M200-W213 HydrophobicContact CB-CE3 4.24Å; M200-W213 HydrophobicContact CE-CB 3.28Å; M200-W213 HydrophobicContact CE-CD2 3.71Å; M200-W213 HydrophobicContact CE-CE3 4.07Å; M200-W213 HydrophobicContact CE-CG 3.36Å; M200-A215 HydrophobicContact SD-CB 4.01Å; M200-V224 HydrophobicContact CE-CB 4.24Å; M200-V224 HydrophobicContact CE-CG1 4.3Å; M200-V224 HydrophobicContact SD-CG2 4.45Å; M200-I226 HydrophobicContact CE-CD1 3.84Å
201	L	96.4	Very high	88	Confident	72 Å²	72	75.6 Å²	75.6	38%	0.377	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-68.2	-177.6	-53.8	178	0	0	0	112.4	Q199 K214 R216	Q199-L201 HydrophobicContact CG-CD2 4.27Å; L201-K214 WeakPolarHBondContact CA-O 3.41Å; L201-K214 VanDerWaalsContact CB-O 3.29Å; L201-K214 WeakPolarHBondContact CB-O 3.33Å; L201-K214 HydrophobicContact CD1-CD 4.43Å; L201-K214 HydrophobicContact CD1-CG 4.2Å; L201-K214 PolarHBondContact N-O 3.05Å; L201-R216 HydrophobicContact CD1-CG 3.84Å; L201-R216 HydrophobicContact CD2-CG 4.23Å; L201-R216 HydrophobicContact CG-CG 4.32Å
202	K	96.3	Very high	89	Confident	111 Å²	111	77.2 Å²	77.2	48%	0.483	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143.7	-176.4	65.8	172.5	-176.1	176.4	0	111.3	V204 W213 K214	K202-V204 HydrophobicContact CD-CG1 4.44Å; K202-V204 HydrophobicContact CG-CG1 4.1Å; K202-W213 CarbonylContact O-C 3.48Å; K202-W213 WeakPolarHBondContact O-CA 3.14Å; K202-K214 HydrophobicContact CG-CB 3.86Å; K202-K214 HydrophobicContact CG-CD 4.32Å; K202-K214 PolarHBondContact N-O 3.36Å; K202-K214 PolarHBondContact O-N 3.2Å
203	S	95.8	Very high	90.2	Very high	48 Å²	48	70.9 Å²	70.9	34%	0.336	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	132	165.7	178.8	0	0	0	0	109.2	E211	S203-E211 WeakPolarHBondContact CB-OE1 3.4Å; S203-E211 VanDerWaalsContact OG-CD 3.32Å; S203-E211 WeakPolarHBondContact OG-CG 3.39Å; S203-E211 PolarHBondContact OG-OE1 3.24Å
204	V	93.2	Very high	91.1	Very high	66 Å²	66	69.2 Å²	69.2	40%	0.4	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-20	-179.4	-64.8	0	0	0	0	113	K202 V212 K214 F275	K202-V204 HydrophobicContact CD-CG1 4.44Å; K202-V204 HydrophobicContact CG-CG1 4.1Å; V204-V212 HydrophobicContact CG2-CB 3.9Å; V204-V212 HydrophobicContact CG2-CG1 3.61Å; V204-V212 VanDerWaalsContact CG2-O 3.22Å; V204-V212 WeakPolarHBondContact CG2-O 3.31Å; V204-V212 PolarHBondContact N-O 3.4Å; V204-K214 HydrophobicContact CG1-CB 3.88Å; V204-F275 HydrophobicContact CG1-CE2 4.04Å; V204-F275 HydrophobicContact CG1-CZ 4.29Å; V204-F275 HydrophobicContact CG2-CE2 4.41Å
205	G	88.5	Confident	91.6	Very high	32 Å²	32	69.2 Å²	69.2	33%	0.33	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	145.7	176.8	0	0	0	0	0	112.6	E211 V212	G205-E211 CarbonylContact O-C 3.53Å; G205-E211 WeakPolarHBondContact O-CA 3.27Å; G205-V212 PolarHBondContact N-O 3.43Å; G205-V212 PolarHBondContact O-N 3.14Å
206	K	89.6	Confident	92.1	Very high	171 Å²	171	74.3 Å²	74.3	74%	0.743	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	132.1	171.1	-69.1	179	179.3	-178.2	0	108.5	E211	K206-E211 WeakPolarHBondContact CE-OE1 3.37Å; K206-E211 HydrophobicContact CG-CB 4.35Å; K206-E211 HydrophobicContact CG-CG 3.85Å; K206-E211 IonicContact NZ-OE1 3.51Å
207	G	80.3	Confident	92.5	Very high	50 Å²	50	63.6 Å²	63.6	52%	0.515	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	-177.1	-178.9	0	0	0	0	0	111.8	Y209 G210	G207-Y209 PolarHBondContact O-N 3.29Å; G207-G210 PolarHBondContact N-O 2.88Å; G207-G210 PolarHBondContact O-N 3.27Å
208	R	81.7	Confident	92.5	Very high	170 Å²	170	66.3 Å²	66.3	64%	0.642	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-41.3	178.4	177.8	-179.5	173.7	170.5	1.6	112.5
209	Y	84.8	Confident	92.3	Very high	16 Å²	16	68 Å²	68	6%	0.063	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-14.6	-170.1	-54.5	-65.3	0	0	0	114	G207 F227 F228 E231 S234 L347	G207-Y209 PolarHBondContact O-N 3.29Å; Y209-F227 WeakPolarHBondContact O-CA 3.33Å; Y209-F228 PolarHBondContact O-N 3.21Å; Y209-E231 HydrophobicContact CD1-CG 4.35Å; Y209-E231 VanDerWaalsContact CD1-OE2 3.29Å; Y209-E231 WeakPolarHBondContact CD1-OE2 3.39Å; Y209-S234 WeakPolarHBondContact CD1-OG 3.45Å; Y209-S234 WeakPolarHBondContact CE1-OG 3.47Å; Y209-L347 WeakPolarHBondContact OH-CD2 3.48Å
210	G	89.5	Confident	92.2	Very high	5 Å²	5	65.7 Å²	65.7	5%	0.052	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.2	-153	-170.9	0	0	0	0	0	113.5	G207 I226	G207-G210 PolarHBondContact N-O 2.88Å; G207-G210 PolarHBondContact O-N 3.27Å; G210-I226 CarbonylContact C-O 3.59Å; G210-I226 VanDerWaalsContact CA-O 3.24Å; G210-I226 WeakPolarHBondContact CA-O 3.06Å
211	E	94.1	Very high	92.3	Very high	42 Å²	42	64.2 Å²	64.2	20%	0.196	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.1	-174.1	-172.5	174.5	-147.6	0	0	111.1	S203 G205 K206 W213 I226	S203-E211 WeakPolarHBondContact CB-OE1 3.4Å; S203-E211 VanDerWaalsContact OG-CD 3.32Å; S203-E211 WeakPolarHBondContact OG-CG 3.39Å; S203-E211 PolarHBondContact OG-OE1 3.24Å; G205-E211 CarbonylContact O-C 3.53Å; G205-E211 WeakPolarHBondContact O-CA 3.27Å; K206-E211 WeakPolarHBondContact CE-OE1 3.37Å; K206-E211 HydrophobicContact CG-CB 4.35Å; K206-E211 HydrophobicContact CG-CG 3.85Å; K206-E211 IonicContact NZ-OE1 3.51Å; E211-W213 VanDerWaalsContact CG-NE1 3.34Å; E211-W213 PolarHBondContact OE2-NE1 3.14Å; E211-I226 PolarHBondContact N-O 2.9Å; E211-I226 PolarHBondContact O-N 3.36Å
212	V	95.8	Very high	92.4	Very high	45 Å²	45	60.8 Å²	60.8	27%	0.273	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.8	175.3	-173.4	0	0	0	0	108.9	V204 G205 A223 V224 K225	V204-V212 HydrophobicContact CG2-CB 3.9Å; V204-V212 HydrophobicContact CG2-CG1 3.61Å; V204-V212 VanDerWaalsContact CG2-O 3.22Å; V204-V212 WeakPolarHBondContact CG2-O 3.31Å; V204-V212 PolarHBondContact N-O 3.4Å; G205-V212 PolarHBondContact N-O 3.43Å; G205-V212 PolarHBondContact O-N 3.14Å; V212-A223 HydrophobicContact CG1-CB 4.39Å; V212-V224 CarbonylContact C-O 3.55Å; V212-V224 WeakPolarHBondContact CA-O 3.33Å; V212-K225 HydrophobicContact CG2-CB 4.19Å; V212-K225 HydrophobicContact CG2-CG 4.05Å
213	W	97	Very high	92.4	Very high	63 Å²	63	56 Å²	56	24%	0.239	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.8	180	-74.1	73.3	0	0	0	111.3	M200 K202 E211 A223 V224 I226	M200-W213 HydrophobicContact CB-CE3 4.24Å; M200-W213 HydrophobicContact CE-CB 3.28Å; M200-W213 HydrophobicContact CE-CD2 3.71Å; M200-W213 HydrophobicContact CE-CE3 4.07Å; M200-W213 HydrophobicContact CE-CG 3.36Å; K202-W213 CarbonylContact O-C 3.48Å; K202-W213 WeakPolarHBondContact O-CA 3.14Å; E211-W213 VanDerWaalsContact CG-NE1 3.34Å; E211-W213 PolarHBondContact OE2-NE1 3.14Å; W213-A223 CarbonylContact O-C 3.56Å; W213-A223 WeakPolarHBondContact O-CA 3.45Å; W213-V224 HydrophobicContact CB-CB 4.48Å; W213-V224 PolarHBondContact N-O 3.42Å; W213-V224 PolarHBondContact O-N 3.45Å; W213-I226 HydrophobicContact CG-CD1 4.38Å
214	K	97.7	Very high	92.5	Very high	30 Å²	30	53.7 Å²	53.7	13%	0.13	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	129.5	160	-171.4	179	-170.1	169.4	0	108.1	L201 K202 V204 T221 F275 E277	L201-K214 WeakPolarHBondContact CA-O 3.41Å; L201-K214 VanDerWaalsContact CB-O 3.29Å; L201-K214 WeakPolarHBondContact CB-O 3.33Å; L201-K214 HydrophobicContact CD1-CD 4.43Å; L201-K214 HydrophobicContact CD1-CG 4.2Å; L201-K214 PolarHBondContact N-O 3.05Å; K202-K214 HydrophobicContact CG-CB 3.86Å; K202-K214 HydrophobicContact CG-CD 4.32Å; K202-K214 PolarHBondContact N-O 3.36Å; K202-K214 PolarHBondContact O-N 3.2Å; V204-K214 HydrophobicContact CG1-CB 3.88Å; K214-T221 HydrophobicContact CD-CG2 4.17Å; K214-T221 HydrophobicContact CG-CG2 3.76Å; K214-F275 HydrophobicContact CB-CD2 4.22Å; K214-F275 HydrophobicContact CB-CE2 3.77Å; K214-F275 HydrophobicContact CB-CZ 4.14Å; K214-F275 HydrophobicContact CD-CD1 4.38Å; K214-F275 HydrophobicContact CD-CE1 3.81Å; K214-F275 HydrophobicContact CD-CE2 4.19Å; K214-F275 HydrophobicContact CD-CZ 3.71Å; K214-F275 HydrophobicContact CG-CD1 4.32Å; K214-F275 HydrophobicContact CG-CD2 4.02Å; K214-F275 HydrophobicContact CG-CE1 4.11Å; K214-F275 HydrophobicContact CG-CE2 3.81Å; K214-F275 HydrophobicContact CG-CG 4.29Å; K214-F275 HydrophobicContact CG-CZ 3.87Å; K214-E277 WeakPolarHBondContact CE-OE1 3.44Å; K214-E277 IonicContact NZ-OE1 2.79Å; K214-E277 PolarHBondContact NZ-OE1 3.17Å; K214-E277 IonicContact NZ-OE2 2.73Å; K214-E277 PolarHBondContact NZ-OE2 2.94Å
215	A	97.3	Very high	92.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	164.5	177.9	0	0	0	0	0	111.2	L198 Q199 M200 T221 V222 V224	L198-A215 HydrophobicContact CD2-CB 4.41Å; Q199-A215 CarbonylContact O-C 3.52Å; Q199-A215 VanDerWaalsContact O-CA 3.23Å; Q199-A215 WeakPolarHBondContact O-CA 3.38Å; Q199-A215 WeakPolarHBondContact O-CB 3.07Å; M200-A215 HydrophobicContact SD-CB 4.01Å; A215-T221 WeakPolarHBondContact O-CA 3.34Å; A215-V222 HydrophobicContact CB-CG2 3.98Å; A215-V222 PolarHBondContact N-O 2.98Å; A215-V222 PolarHBondContact O-N 2.93Å; A215-V224 HydrophobicContact CB-CG2 3.65Å
216	R	97.1	Very high	92.9	Very high	111 Å²	111	51.5 Å²	51.5	42%	0.419	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	137.7	164.6	-64.2	-170.5	177.5	-89.4	1.6	110.9	Q199 L201 G219 E220	Q199-R216 HydrophobicContact CB-CB 4.31Å; Q199-R216 PolarHBondContact N-O 3.13Å; Q199-R216 PolarHBondContact O-N 3.16Å; L201-R216 HydrophobicContact CD1-CG 3.84Å; L201-R216 HydrophobicContact CD2-CG 4.23Å; L201-R216 HydrophobicContact CG-CG 4.32Å; R216-G219 PolarHBondContact NH1-O 3.46Å; R216-G219 VanDerWaalsContact NH1-O 3.11Å; R216-E220 CarbonylContact C-O 3.55Å; R216-E220 VanDerWaalsContact CA-O 3.23Å; R216-E220 WeakPolarHBondContact CA-O 3.44Å
217	W	94.2	Very high	93.1	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.011	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	117.8	169.7	-176	53.8	0	0	0	108.9	L172 L186 I194 Q197 L198 G219 E220 V222 I256	L172-W217 HydrophobicContact CD2-CE3 4.28Å; L172-W217 HydrophobicContact CD2-CZ3 3.76Å; L186-W217 HydrophobicContact CD1-CH2 3.46Å; L186-W217 VanDerWaalsContact CD1-CH2 3.46Å; L186-W217 HydrophobicContact CD1-CZ2 4.19Å; L186-W217 HydrophobicContact CD1-CZ3 4.12Å; I194-W217 HydrophobicContact CD1-CH2 4.46Å; I194-W217 HydrophobicContact CD1-CZ2 4.14Å; I194-W217 HydrophobicContact CG1-CZ2 3.96Å; I194-W217 HydrophobicContact CG2-CD2 4.4Å; I194-W217 HydrophobicContact CG2-CG 4.43Å; Q197-W217 VanDerWaalsContact OE1-NE1 3.11Å; L198-W217 HydrophobicContact CD2-CB 3.88Å; L198-W217 HydrophobicContact CD2-CG 4.25Å; W217-G219 VanDerWaalsContact C-N 3.25Å; W217-G219 PolarHBondContact O-N 2.93Å; W217-E220 PolarHBondContact N-O 2.79Å; W217-E220 WeakPolarHBondContact O-CB 3.42Å; W217-E220 PolarHBondContact O-N 2.9Å; W217-V222 HydrophobicContact CB-CG1 4.15Å; W217-V222 HydrophobicContact CB-CG2 4.06Å; W217-I256 HydrophobicContact CE3-CG2 4.2Å; W217-I256 HydrophobicContact CH2-CG2 4.4Å; W217-I256 HydrophobicContact CZ3-CG2 3.74Å
218	R	90.3	Very high	93.5	Very high	148 Å²	148	46.7 Å²	46.7	56%	0.558	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	42	-177.9	-59.6	-178.7	174.9	-168.2	-2.1	113.7	E220	R218-E220 PolarHBondContact O-N 3.29Å
219	G	89.7	Confident	93.8	Very high	54 Å²	54	42.4 Å²	42.4	56%	0.557	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.2	-27.1	-178.5	0	0	0	0	0	114.4	R216 W217	R216-G219 PolarHBondContact NH1-O 3.46Å; R216-G219 VanDerWaalsContact NH1-O 3.11Å; W217-G219 VanDerWaalsContact C-N 3.25Å; W217-G219 PolarHBondContact O-N 2.93Å
220	E	93	Very high	93.9	Very high	73 Å²	73	47.3 Å²	47.3	34%	0.341	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	151.4	-177.6	-66.3	-65.9	155	0	0	112.6	L172 R216 W217 R218	L172-E220 HydrophobicContact CD1-CB 3.56Å; L172-E220 HydrophobicContact CD1-CG 3.54Å; L172-E220 HydrophobicContact CG-CB 4.37Å; L172-E220 HydrophobicContact CG-CG 3.93Å; R216-E220 CarbonylContact C-O 3.55Å; R216-E220 VanDerWaalsContact CA-O 3.23Å; R216-E220 WeakPolarHBondContact CA-O 3.44Å; W217-E220 PolarHBondContact N-O 2.79Å; W217-E220 WeakPolarHBondContact O-CB 3.42Å; W217-E220 PolarHBondContact O-N 2.9Å; R218-E220 PolarHBondContact O-N 3.29Å
221	T	96.4	Very high	93.9	Very high	39 Å²	39	49 Å²	49	24%	0.239	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.7	178.7	-56.9	0	0	0	0	110	K214 A215 F275	K214-T221 HydrophobicContact CD-CG2 4.17Å; K214-T221 HydrophobicContact CG-CG2 3.76Å; A215-T221 WeakPolarHBondContact O-CA 3.34Å; T221-F275 HydrophobicContact CG2-CB 3.76Å; T221-F275 HydrophobicContact CG2-CD1 3.57Å; T221-F275 HydrophobicContact CG2-CE1 4.38Å; T221-F275 HydrophobicContact CG2-CG 3.72Å
222	V	97.6	Very high	93.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.2	-178	-59.4	0	0	0	0	111.4	L198 A215 W217 V224 I256 I272	L198-V222 HydrophobicContact CD2-CG2 3.89Å; A215-V222 HydrophobicContact CB-CG2 3.98Å; A215-V222 PolarHBondContact N-O 2.98Å; A215-V222 PolarHBondContact O-N 2.93Å; W217-V222 HydrophobicContact CB-CG1 4.15Å; W217-V222 HydrophobicContact CB-CG2 4.06Å; V222-V224 HydrophobicContact CG2-CG2 4.1Å; V222-I256 HydrophobicContact CB-CD1 4.33Å; V222-I256 HydrophobicContact CG1-CD1 3.6Å; V222-I272 HydrophobicContact CB-CG2 3.92Å; V222-I272 HydrophobicContact CG1-CG2 4.36Å; V222-I272 HydrophobicContact CG2-CG2 3.99Å
223	A	97.3	Very high	93.5	Very high	10 Å²	10	54.2 Å²	54.2	8%	0.083	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	133.9	170.2	0	0	0	0	0	108.8	V212 W213 I272 T273 F275	V212-A223 HydrophobicContact CG1-CB 4.39Å; W213-A223 CarbonylContact O-C 3.56Å; W213-A223 WeakPolarHBondContact O-CA 3.45Å; A223-I272 WeakPolarHBondContact O-CA 3.35Å; A223-T273 PolarHBondContact N-O 2.61Å; A223-T273 PolarHBondContact O-N 3.06Å; A223-F275 HydrophobicContact CB-CB 4.39Å; A223-F275 HydrophobicContact CB-CD2 3.93Å
224	V	96.9	Very high	93.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	106.4	-179.2	-175.8	0	0	0	0	108.2	L198 M200 V212 W213 A215 V222 I226 L270 L271 I272	L198-V224 HydrophobicContact CD1-CG1 4.18Å; L198-V224 HydrophobicContact CD1-CG2 3.92Å; L198-V224 HydrophobicContact CD2-CG2 4.14Å; M200-V224 HydrophobicContact CE-CB 4.24Å; M200-V224 HydrophobicContact CE-CG1 4.3Å; M200-V224 HydrophobicContact SD-CG2 4.45Å; V212-V224 CarbonylContact C-O 3.55Å; V212-V224 WeakPolarHBondContact CA-O 3.33Å; W213-V224 HydrophobicContact CB-CB 4.48Å; W213-V224 PolarHBondContact N-O 3.42Å; W213-V224 PolarHBondContact O-N 3.45Å; A215-V224 HydrophobicContact CB-CG2 3.65Å; V222-V224 HydrophobicContact CG2-CG2 4.1Å; V224-I226 HydrophobicContact CG1-CG1 4.16Å; V224-L270 HydrophobicContact CG1-CB 4.36Å; V224-L270 HydrophobicContact CG1-CD2 4.01Å; V224-L271 WeakPolarHBondContact CA-O 3.23Å; V224-I272 HydrophobicContact CG2-CG1 4.36Å
225	K	96.1	Very high	93.1	Very high	28 Å²	28	52 Å²	52	12%	0.122	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	113.2	171.7	-173.1	176.2	-179.2	-175.5	0	108.3	V212 F227 E238 L270 L271 D344	V212-K225 HydrophobicContact CG2-CB 4.19Å; V212-K225 HydrophobicContact CG2-CG 4.05Å; K225-F227 HydrophobicContact CB-CE2 4.02Å; K225-F227 HydrophobicContact CD-CE1 4.22Å; K225-F227 HydrophobicContact CD-CE2 3.73Å; K225-F227 HydrophobicContact CD-CZ 3.48Å; K225-F227 VanDerWaalsContact CD-CZ 3.48Å; K225-F227 VanDerWaalsContact CE-CZ 3.5Å; K225-F227 HydrophobicContact CG-CD2 4.16Å; K225-F227 HydrophobicContact CG-CE2 3.58Å; K225-F227 HydrophobicContact CG-CZ 3.86Å; K225-E238 IonicContact NZ-OE1 2.83Å; K225-E238 PolarHBondContact NZ-OE1 2.99Å; K225-E238 IonicContact NZ-OE2 3.77Å; K225-E238 PolarHBondContact NZ-OE2 2.9Å; K225-L270 WeakPolarHBondContact O-CA 3.47Å; K225-L271 HydrophobicContact CB-CB 4.31Å; K225-L271 PolarHBondContact N-O 3.49Å; K225-L271 PolarHBondContact O-N 3.19Å; K225-D344 IonicContact NZ-OD1 3.86Å; K225-D344 PolarHBondContact NZ-OD1 2.86Å
226	I	95	Very high	93	Very high	24 Å²	24	54.3 Å²	54.3	12%	0.123	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.6	177	-48	-175.6	0	0	0	107.5	M200 G210 E211 W213 V224 Q268 L270	M200-I226 HydrophobicContact CE-CD1 3.84Å; G210-I226 CarbonylContact C-O 3.59Å; G210-I226 VanDerWaalsContact CA-O 3.24Å; G210-I226 WeakPolarHBondContact CA-O 3.06Å; E211-I226 PolarHBondContact N-O 2.9Å; E211-I226 PolarHBondContact O-N 3.36Å; W213-I226 HydrophobicContact CG-CD1 4.38Å; V224-I226 HydrophobicContact CG1-CG1 4.16Å; I226-Q268 HydrophobicContact CG2-CB 4.11Å; I226-Q268 HydrophobicContact CG2-CG 4.2Å; I226-L270 HydrophobicContact CB-CD2 4.15Å; I226-L270 HydrophobicContact CD1-CD2 4.34Å; I226-L270 HydrophobicContact CG1-CD2 3.7Å; I226-L270 HydrophobicContact CG2-CD2 3.98Å
227	F	94.2	Very high	92.9	Very high	5 Å²	5	49.9 Å²	49.9	2%	0.022	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	147.3	-179.3	-67	-108.3	0	0	0	111	Y209 K225 E231 W235 E238 M269 L271	Y209-F227 WeakPolarHBondContact O-CA 3.33Å; K225-F227 HydrophobicContact CB-CE2 4.02Å; K225-F227 HydrophobicContact CD-CE1 4.22Å; K225-F227 HydrophobicContact CD-CE2 3.73Å; K225-F227 HydrophobicContact CD-CZ 3.48Å; K225-F227 VanDerWaalsContact CD-CZ 3.48Å; K225-F227 VanDerWaalsContact CE-CZ 3.5Å; K225-F227 HydrophobicContact CG-CD2 4.16Å; K225-F227 HydrophobicContact CG-CE2 3.58Å; K225-F227 HydrophobicContact CG-CZ 3.86Å; F227-E231 HydrophobicContact CD1-CB 4.49Å; F227-W235 HydrophobicContact CB-CB 4.2Å; F227-W235 HydrophobicContact CD1-CB 3.79Å; F227-W235 HydrophobicContact CD2-CB 3.98Å; F227-W235 AromaticContact CD2-CD1 3.52Å; F227-W235 HydrophobicContact CD2-CG 4.1Å; F227-W235 HydrophobicContact CE1-CB 4.07Å; F227-W235 HydrophobicContact CE2-CB 4.27Å; F227-W235 AromaticContact CE2-CD1 3.61Å; F227-W235 HydrophobicContact CE2-CG 4.35Å; F227-W235 HydrophobicContact CG-CB 3.73Å; F227-W235 HydrophobicContact CG-CG 4.3Å; F227-W235 HydrophobicContact CZ-CB 4.29Å; F227-E238 WeakPolarHBondContact CZ-OE2 3.46Å; F227-M269 HydrophobicContact CB-CB 4.29Å; F227-M269 HydrophobicContact CB-CE 4.05Å; F227-M269 PolarHBondContact N-O 3.33Å; F227-L271 HydrophobicContact CE2-CB 3.74Å; F227-L271 HydrophobicContact CZ-CB 4.48Å
228	F	88.7	Confident	92.9	Very high	114 Å²	114	50 Å²	50	50%	0.5	28%	0.275	S	S	.	.			trans	-64.7	146.5	164.1	-59.4	-52.9	0	0	0	109.8	Y209 T230 E231 M269	Y209-F228 PolarHBondContact O-N 3.21Å; F228-T230 PolarHBondContact O-N 3.45Å; F228-E231 HydrophobicContact CB-CG 4.32Å; F228-E231 WeakPolarHBondContact O-CA 3.4Å; F228-E231 WeakPolarHBondContact O-CB 3.22Å; F228-E231 PolarHBondContact O-N 3.49Å; F228-M269 WeakPolarHBondContact O-CE 3.31Å
229	T	86.6	Confident	93.2	Very high	80 Å²	80	43.5 Å²	43.5	49%	0.491	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-59.4	-30.5	178.6	47.8	0	0	0	0	112.6	E231 E232 T267	T229-E231 PolarHBondContact O-N 2.99Å; T229-E232 PolarHBondContact O-N 2.86Å; T229-T267 WeakPolarHBondContact CG2-O 3.47Å
230	T	87.6	Confident	93.5	Very high	119 Å²	119	44.9 Å²	44.9	73%	0.73	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-66.2	-14.7	173.9	53.4	0	0	0	0	113.7	F228	F228-T230 PolarHBondContact O-N 3.45Å
231	E	89.6	Confident	93.6	Very high	42 Å²	42	41.4 Å²	41.4	20%	0.196	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-108	26.6	-176.1	-64.8	-68.6	162.6	0	0	111.9	Y209 F227 F228 T229 A233 S234 W235	Y209-E231 HydrophobicContact CD1-CG 4.35Å; Y209-E231 VanDerWaalsContact CD1-OE2 3.29Å; Y209-E231 WeakPolarHBondContact CD1-OE2 3.39Å; F227-E231 HydrophobicContact CD1-CB 4.49Å; F228-E231 HydrophobicContact CB-CG 4.32Å; F228-E231 WeakPolarHBondContact O-CA 3.4Å; F228-E231 WeakPolarHBondContact O-CB 3.22Å; F228-E231 PolarHBondContact O-N 3.49Å; T229-E231 PolarHBondContact O-N 2.99Å; E231-A233 VanDerWaalsContact C-N 3.27Å; E231-A233 PolarHBondContact O-N 3.26Å; E231-S234 WeakPolarHBondContact O-CB 3.45Å; E231-S234 PolarHBondContact O-N 2.85Å; E231-S234 VanDerWaalsContact O-N 3.08Å; E231-S234 PolarHBondContact OE2-OG 3.04Å; E231-W235 PolarHBondContact O-N 3.46Å
232	E	91.4	Very high	93.6	Very high	116 Å²	116	39.7 Å²	39.7	54%	0.542	22%	0.217	S	C	.	.	H	α-helix	trans	-56.1	-38.9	176.6	179.5	175.5	-173.9	0	0	112.6	T229 S234 W235 T236 M269	T229-E232 PolarHBondContact O-N 2.86Å; E232-S234 VanDerWaalsContact C-N 3.33Å; E232-S234 PolarHBondContact O-N 3.44Å; E232-W235 PolarHBondContact O-N 2.92Å; E232-T236 VanDerWaalsContact O-CB 3.31Å; E232-T236 WeakPolarHBondContact O-CB 3.34Å; E232-T236 PolarHBondContact O-N 2.91Å; E232-T236 PolarHBondContact O-OG1 3.41Å; E232-M269 VanDerWaalsContact CA-CE 3.49Å; E232-M269 HydrophobicContact CB-CE 3.87Å; E232-M269 HydrophobicContact CB-SD 3.75Å; E232-M269 HydrophobicContact CG-SD 3.77Å
233	A	90.6	Very high	93.5	Very high	80 Å²	80	42.6 Å²	42.6	66%	0.661	23%	0.23	S	C	*	.	H	α-helix	trans	-61.9	-41.7	176	0	0	0	0	0	111.8	E231 R237	E231-A233 VanDerWaalsContact C-N 3.27Å; E231-A233 PolarHBondContact O-N 3.26Å; A233-R237 VanDerWaalsContact O-CB 3.24Å; A233-R237 WeakPolarHBondContact O-CB 3.42Å; A233-R237 PolarHBondContact O-N 3.48Å
234	S	91.7	Very high	93.4	Very high	14 Å²	14	42.4 Å²	42.4	10%	0.098	23%	0.228	C	C	.	.	H	α-helix	trans	-66.7	-43.4	177.3	-57.5	0	0	0	0	111.3	Y209 E231 E232 R237 E238	Y209-S234 WeakPolarHBondContact CD1-OG 3.45Å; Y209-S234 WeakPolarHBondContact CE1-OG 3.47Å; E231-S234 WeakPolarHBondContact O-CB 3.45Å; E231-S234 PolarHBondContact O-N 2.85Å; E231-S234 VanDerWaalsContact O-N 3.08Å; E231-S234 PolarHBondContact OE2-OG 3.04Å; E232-S234 VanDerWaalsContact C-N 3.33Å; E232-S234 PolarHBondContact O-N 3.44Å; S234-R237 PolarHBondContact O-N 3.42Å; S234-E238 VanDerWaalsContact O-CB 3.32Å; S234-E238 WeakPolarHBondContact O-CB 3.41Å; S234-E238 PolarHBondContact O-N 3.25Å
235	W	94.5	Very high	93.2	Very high	33 Å²	33	44.5 Å²	44.5	13%	0.125	24%	0.241	C	C	.	.	H	α-helix	trans	-63.3	-47.4	175.8	171.6	75.6	0	0	0	112.5	F227 E231 E232 R237 E238 T239 A258 I260 M269 L270	F227-W235 HydrophobicContact CB-CB 4.2Å; F227-W235 HydrophobicContact CD1-CB 3.79Å; F227-W235 HydrophobicContact CD2-CB 3.98Å; F227-W235 AromaticContact CD2-CD1 3.52Å; F227-W235 HydrophobicContact CD2-CG 4.1Å; F227-W235 HydrophobicContact CE1-CB 4.07Å; F227-W235 HydrophobicContact CE2-CB 4.27Å; F227-W235 AromaticContact CE2-CD1 3.61Å; F227-W235 HydrophobicContact CE2-CG 4.35Å; F227-W235 HydrophobicContact CG-CB 3.73Å; F227-W235 HydrophobicContact CG-CG 4.3Å; F227-W235 HydrophobicContact CZ-CB 4.29Å; E231-W235 PolarHBondContact O-N 3.46Å; E232-W235 PolarHBondContact O-N 2.92Å; W235-R237 VanDerWaalsContact C-N 3.31Å; W235-R237 PolarHBondContact O-N 2.66Å; W235-E238 PolarHBondContact O-N 3.19Å; W235-T239 VanDerWaalsContact O-CB 3.32Å; W235-T239 WeakPolarHBondContact O-CB 3.45Å; W235-T239 PolarHBondContact O-N 2.9Å; W235-T239 PolarHBondContact O-OG1 2.9Å; W235-A258 HydrophobicContact CZ2-CB 4.03Å; W235-I260 HydrophobicContact CH2-CD1 3.67Å; W235-I260 HydrophobicContact CH2-CG1 3.79Å; W235-I260 HydrophobicContact CZ2-CD1 4.34Å; W235-I260 HydrophobicContact CZ2-CG1 3.94Å; W235-I260 HydrophobicContact CZ3-CD1 4.12Å; W235-M269 HydrophobicContact CB-CB 4.36Å; W235-M269 HydrophobicContact CB-CE 4.43Å; W235-M269 HydrophobicContact CB-SD 4.34Å; W235-M269 HydrophobicContact CD2-CB 3.77Å; W235-M269 HydrophobicContact CD2-CG 4.14Å; W235-M269 HydrophobicContact CD2-SD 4.06Å; W235-M269 HydrophobicContact CE3-CB 4.36Å; W235-M269 HydrophobicContact CE3-CG 4.23Å; W235-M269 HydrophobicContact CE3-SD 3.78Å; W235-M269 HydrophobicContact CG-CB 3.73Å; W235-M269 HydrophobicContact CG-CG 4.46Å; W235-M269 HydrophobicContact CG-SD 4.31Å; W235-M269 HydrophobicContact CZ3-SD 4.46Å; W235-L270 PolarHBondContact NE1-O 2.71Å
236	T	94.4	Very high	93	Very high	48 Å²	48	48.2 Å²	48.2	29%	0.294	26%	0.26	S	S	.	.	H	α-helix	trans	-58.9	-47.9	177.9	-58.8	0	0	0	0	109.4	E232 T239 E240	E232-T236 VanDerWaalsContact O-CB 3.31Å; E232-T236 WeakPolarHBondContact O-CB 3.34Å; E232-T236 PolarHBondContact O-N 2.91Å; E232-T236 PolarHBondContact O-OG1 3.41Å; T236-T239 PolarHBondContact O-N 3.29Å; T236-E240 HydrophobicContact CG2-CG 4.48Å; T236-E240 WeakPolarHBondContact O-CG 3.27Å; T236-E240 PolarHBondContact O-N 3.25Å
237	R	94.7	Very high	93	Very high	18 Å²	18	47.1 Å²	47.1	7%	0.068	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-48.1	-178.3	-177.2	56.4	-175.4	-179.8	-4.2	112.6	A233 S234 W235 T239 E240 I241 S348 D359	A233-R237 VanDerWaalsContact O-CB 3.24Å; A233-R237 WeakPolarHBondContact O-CB 3.42Å; A233-R237 PolarHBondContact O-N 3.48Å; S234-R237 PolarHBondContact O-N 3.42Å; W235-R237 VanDerWaalsContact C-N 3.31Å; W235-R237 PolarHBondContact O-N 2.66Å; R237-T239 VanDerWaalsContact C-N 3.3Å; R237-T239 PolarHBondContact O-N 3.07Å; R237-E240 IonicContact NH1-OE2 2.87Å; R237-E240 PolarHBondContact O-N 3.01Å; R237-I241 WeakPolarHBondContact O-CG1 3.34Å; R237-I241 PolarHBondContact O-N 2.75Å; R237-S348 VanDerWaalsContact CZ-O 3.27Å; R237-S348 PolarHBondContact NE-O 3.13Å; R237-S348 PolarHBondContact NH2-O 3.18Å; R237-D359 IonicContact CZ-OD1 2.83Å; R237-D359 IonicContact CZ-OD2 3.61Å; R237-D359 VanDerWaalsContact CZ-OD2 3.23Å; R237-D359 IonicContact NH1-OD1 3.3Å; R237-D359 IonicContact NH1-OD2 3.6Å; R237-D359 PolarHBondContact NH1-OD2 2.7Å; R237-D359 VanDerWaalsContact NH2-CG 3.25Å; R237-D359 IonicContact NH2-OD1 3.51Å; R237-D359 PolarHBondContact NH2-OD1 3.29Å; R237-D359 IonicContact NH2-OD2 2.77Å; R237-D359 PolarHBondContact NH2-OD2 3.21Å
238	E	95.8	Very high	93	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.019	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-41.7	-180	-169	165.8	176.7	0	0	111.1	K225 F227 S234 W235 I241 Y242 L271 D344 F345	K225-E238 IonicContact NZ-OE1 2.83Å; K225-E238 PolarHBondContact NZ-OE1 2.99Å; K225-E238 IonicContact NZ-OE2 3.77Å; K225-E238 PolarHBondContact NZ-OE2 2.9Å; F227-E238 WeakPolarHBondContact CZ-OE2 3.46Å; S234-E238 VanDerWaalsContact O-CB 3.32Å; S234-E238 WeakPolarHBondContact O-CB 3.41Å; S234-E238 PolarHBondContact O-N 3.25Å; W235-E238 PolarHBondContact O-N 3.19Å; E238-I241 PolarHBondContact O-N 2.84Å; E238-Y242 HydrophobicContact CG-CD2 3.78Å; E238-Y242 HydrophobicContact CG-CE2 3.61Å; E238-Y242 WeakPolarHBondContact O-CB 3.35Å; E238-Y242 WeakPolarHBondContact O-CD2 3.46Å; E238-Y242 PolarHBondContact O-N 3.49Å; E238-L271 HydrophobicContact CG-CD2 3.77Å; E238-L271 WeakPolarHBondContact OE1-CD2 3.45Å; E238-D344 WeakPolarHBondContact OE1-CA 3.46Å; E238-F345 HydrophobicContact CG-CB 4.27Å
239	T	95.4	Very high	93.4	Very high	12 Å²	12	51 Å²	51	7%	0.074	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-47.8	175.7	-58.8	0	0	0	0	111.9	W235 T236 R237 I241 Y242 Q243 A258	W235-T239 VanDerWaalsContact O-CB 3.32Å; W235-T239 WeakPolarHBondContact O-CB 3.45Å; W235-T239 PolarHBondContact O-N 2.9Å; W235-T239 PolarHBondContact O-OG1 2.9Å; T236-T239 PolarHBondContact O-N 3.29Å; R237-T239 VanDerWaalsContact C-N 3.3Å; R237-T239 PolarHBondContact O-N 3.07Å; T239-I241 VanDerWaalsContact C-N 3.34Å; T239-I241 PolarHBondContact O-N 3.34Å; T239-Y242 PolarHBondContact O-N 3.41Å; T239-Q243 HydrophobicContact CG2-CG 4.42Å; T239-Q243 WeakPolarHBondContact O-CB 3.33Å; T239-Q243 VanDerWaalsContact O-CG 3.3Å; T239-Q243 WeakPolarHBondContact O-CG 3.33Å; T239-Q243 PolarHBondContact O-N 3.22Å; T239-A258 HydrophobicContact CG2-CB 3.46Å; T239-A258 VanDerWaalsContact CG2-CB 3.46Å
240	E	95.3	Very high	93.9	Very high	83 Å²	83	53.1 Å²	53.1	39%	0.388	27%	0.272	S	S	.	.	H	α-helix	trans	-60.8	-41.3	177.9	-77	179.6	176.5	0	0	112.7	T236 R237 Q243 T244	T236-E240 HydrophobicContact CG2-CG 4.48Å; T236-E240 WeakPolarHBondContact O-CG 3.27Å; T236-E240 PolarHBondContact O-N 3.25Å; R237-E240 IonicContact NH1-OE2 2.87Å; R237-E240 PolarHBondContact O-N 3.01Å; E240-Q243 PolarHBondContact O-N 3.22Å; E240-T244 PolarHBondContact O-N 2.72Å; E240-T244 PolarHBondContact O-OG1 3.35Å
241	I	96.6	Very high	94.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-52.9	175.4	-66.1	-64.7	0	0	0	109.1	R237 E238 T239 Q243 T244 L247 I322 F345 R350	R237-I241 WeakPolarHBondContact O-CG1 3.34Å; R237-I241 PolarHBondContact O-N 2.75Å; E238-I241 PolarHBondContact O-N 2.84Å; T239-I241 VanDerWaalsContact C-N 3.34Å; T239-I241 PolarHBondContact O-N 3.34Å; I241-Q243 PolarHBondContact O-N 3.21Å; I241-Q243 VanDerWaalsContact O-N 3.14Å; I241-T244 WeakPolarHBondContact O-CB 3.29Å; I241-T244 PolarHBondContact O-N 2.7Å; I241-T244 PolarHBondContact O-OG1 3.25Å; I241-L247 HydrophobicContact CG2-CD2 4.06Å; I241-L247 WeakPolarHBondContact O-CD2 3.4Å; I241-I322 HydrophobicContact CG2-CD1 4.43Å; I241-F345 HydrophobicContact CB-CB 3.79Å; I241-F345 HydrophobicContact CB-CG 4.44Å; I241-F345 HydrophobicContact CG1-CB 4.32Å; I241-F345 HydrophobicContact CG2-CB 3.51Å; I241-F345 HydrophobicContact CG2-CD1 4.08Å; I241-F345 HydrophobicContact CG2-CD2 4.17Å; I241-F345 HydrophobicContact CG2-CG 3.66Å; I241-R350 HydrophobicContact CD1-CG 3.71Å
242	Y	96.8	Very high	94.8	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-56	-33.1	179.2	-87.8	-61.4	0	0	0	113.7	S184 E238 T239 T244 L253 F255 L271 F345	S184-Y242 VanDerWaalsContact CB-O 3.26Å; S184-Y242 WeakPolarHBondContact CB-O 3.14Å; S184-Y242 PolarHBondContact OG-O 2.67Å; E238-Y242 HydrophobicContact CG-CD2 3.78Å; E238-Y242 HydrophobicContact CG-CE2 3.61Å; E238-Y242 WeakPolarHBondContact O-CB 3.35Å; E238-Y242 WeakPolarHBondContact O-CD2 3.46Å; E238-Y242 PolarHBondContact O-N 3.49Å; T239-Y242 PolarHBondContact O-N 3.41Å; Y242-T244 VanDerWaalsContact C-N 3.29Å; Y242-T244 PolarHBondContact O-N 2.86Å; Y242-L253 HydrophobicContact CE1-CB 4.43Å; Y242-L253 WeakPolarHBondContact CE1-O 3.29Å; Y242-F255 HydrophobicContact CD1-CB 3.49Å; Y242-F255 VanDerWaalsContact CD1-CB 3.49Å; Y242-F255 HydrophobicContact CD1-CD2 4.41Å; Y242-F255 HydrophobicContact CD1-CG 4.23Å; Y242-F255 HydrophobicContact CD2-CD2 4.17Å; Y242-F255 HydrophobicContact CE1-CB 4.16Å; Y242-F255 HydrophobicContact CG-CB 3.79Å; Y242-F255 AromaticContact CG-CD2 3.85Å; Y242-F255 HydrophobicContact CG-CD2 3.85Å; Y242-F255 HydrophobicContact CG-CG 4.01Å; Y242-L271 HydrophobicContact CD2-CD1 4.11Å; Y242-L271 HydrophobicContact CD2-CD2 4Å; Y242-L271 HydrophobicContact CE2-CD2 3.69Å; Y242-F345 AromaticContact CD1-CD2 3.91Å; Y242-F345 HydrophobicContact CD1-CD2 3.91Å; Y242-F345 AromaticContact CD1-CE2 3.92Å; Y242-F345 HydrophobicContact CD1-CE2 3.92Å; Y242-F345 HydrophobicContact CD2-CD2 4.02Å; Y242-F345 AromaticContact CE1-CD2 3.55Å; Y242-F345 HydrophobicContact CE1-CD2 3.55Å; Y242-F345 AromaticContact CE1-CE2 3.32Å; Y242-F345 HydrophobicContact CE1-CE2 3.32Å; Y242-F345 AromaticContact CE2-CD2 3.6Å; Y242-F345 HydrophobicContact CE2-CD2 3.6Å; Y242-F345 HydrophobicContact CE2-CE2 4.19Å; Y242-F345 HydrophobicContact CG-CD2 4.16Å; Y242-F345 AromaticContact CZ-CD2 3.37Å; Y242-F345 AromaticContact CZ-CE2 3.46Å; Y242-F345 VanDerWaalsContact CZ-CE2 3.46Å
243	Q	94.6	Very high	95.1	Very high	60 Å²	60	41 Å²	41	28%	0.28	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.3	177.6	-70.1	178	-13.3	0	0	114	T239 E240 I241 V245 F255	T239-Q243 HydrophobicContact CG2-CG 4.42Å; T239-Q243 WeakPolarHBondContact O-CB 3.33Å; T239-Q243 VanDerWaalsContact O-CG 3.3Å; T239-Q243 WeakPolarHBondContact O-CG 3.33Å; T239-Q243 PolarHBondContact O-N 3.22Å; E240-Q243 PolarHBondContact O-N 3.22Å; I241-Q243 PolarHBondContact O-N 3.21Å; I241-Q243 VanDerWaalsContact O-N 3.14Å; Q243-V245 PolarHBondContact O-N 3.34Å; Q243-F255 HydrophobicContact CG-CE1 3.82Å; Q243-F255 HydrophobicContact CG-CZ 4.04Å
244	T	94.4	Very high	95.4	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.043	18%	0.181	C	C	.	.	S	Bend	trans	-60.2	132.3	178	-67.4	0	0	0	0	110.7	S184 E240 I241 Y242 M246 L247 K319 P320 I322	S184-T244 PolarHBondContact OG-O 3.29Å; E240-T244 PolarHBondContact O-N 2.72Å; E240-T244 PolarHBondContact O-OG1 3.35Å; I241-T244 WeakPolarHBondContact O-CB 3.29Å; I241-T244 PolarHBondContact O-N 2.7Å; I241-T244 PolarHBondContact O-OG1 3.25Å; Y242-T244 VanDerWaalsContact C-N 3.29Å; Y242-T244 PolarHBondContact O-N 2.86Å; T244-M246 PolarHBondContact O-N 2.97Å; T244-L247 WeakPolarHBondContact O-CB 3.48Å; T244-L247 PolarHBondContact O-N 3.16Å; T244-L247 VanDerWaalsContact O-N 3.1Å; T244-K319 HydrophobicContact CG2-CG 4.35Å; T244-P320 HydrophobicContact CG2-CG 3.95Å; T244-I322 HydrophobicContact CG2-CD1 4.32Å
245	V	92.7	Very high	95.6	Very high	44 Å²	44	37.4 Å²	37.4	27%	0.267	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	135.7	179.5	178.3	0	0	0	0	110.9	S182 Q243 L247 R317 K319	S182-V245 WeakPolarHBondContact O-CA 3.38Å; S182-V245 WeakPolarHBondContact O-CG1 3.47Å; S182-V245 WeakPolarHBondContact O-CG2 2.96Å; Q243-V245 PolarHBondContact O-N 3.34Å; V245-L247 PolarHBondContact O-N 3.08Å; V245-L247 VanDerWaalsContact O-N 3.13Å; V245-R317 HydrophobicContact CG1-CB 3.86Å; V245-R317 VanDerWaalsContact CG1-O 3.23Å; V245-R317 WeakPolarHBondContact CG1-O 3.47Å; V245-K319 WeakPolarHBondContact O-CB 3.45Å; V245-K319 WeakPolarHBondContact O-CG 3.25Å
246	M	92.7	Very high	95.6	Very high	105 Å²	105	36.5 Å²	36.5	52%	0.517	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	19.1	179.6	-62.5	-74.6	-76.5	0	0	114.3	T244 H308 I313 K319	T244-M246 PolarHBondContact O-N 2.97Å; M246-H308 PolarHBondContact O-CE1 3.05Å; M246-H308 PolarHBondContact O-NE2 2.94Å; M246-I313 HydrophobicContact CB-CD1 4.37Å; M246-K319 HydrophobicContact CB-CB 4.05Å
247	L	95.5	Very high	95.5	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	16%	0.161	C	C	.	.			trans	-73.3	-33.9	174.9	-178.8	62.5	0	0	0	112.9	I241 T244 V245 H249 I252 H308 L309 I322	I241-L247 HydrophobicContact CG2-CD2 4.06Å; I241-L247 WeakPolarHBondContact O-CD2 3.4Å; T244-L247 WeakPolarHBondContact O-CB 3.48Å; T244-L247 PolarHBondContact O-N 3.16Å; T244-L247 VanDerWaalsContact O-N 3.1Å; V245-L247 PolarHBondContact O-N 3.08Å; V245-L247 VanDerWaalsContact O-N 3.13Å; L247-H249 PolarHBondContact O-N 3.12Å; L247-I252 HydrophobicContact CG-CG2 4.41Å; L247-H308 PolarHBondContact O-CD2 2.95Å; L247-H308 PolarHBondContact O-NE2 3.23Å; L247-L309 HydrophobicContact CD1-CD2 3.66Å; L247-I322 HydrophobicContact CD1-CD1 3.89Å
248	R	94	Very high	95.5	Very high	145 Å²	145	33.8 Å²	33.8	55%	0.547	16%	0.162	S	C	.	.			trans	-53.9	126.1	-177.9	-172.2	176.2	177	99.4	-1.8	111
249	H	96.3	Very high	95.4	Very high	55 Å²	55	34 Å²	34	26%	0.255	16%	0.163	S	C	.	.			trans	-158.6	150.6	-177.7	178.1	-94.5	0	0	0	109.1	L247 N251 I252 H308	L247-H249 PolarHBondContact O-N 3.12Å; H249-N251 PolarHBondContact CE1-OD1 3.45Å; H249-N251 VanDerWaalsContact CE1-OD1 3.25Å; H249-N251 PolarHBondContact ND1-N 3.48Å; H249-N251 PolarHBondContact O-N 2.77Å; H249-N251 VanDerWaalsContact O-N 3.13Å; H249-I252 HydrophobicContact CB-CB 4.34Å; H249-I252 HydrophobicContact CB-CG1 3.92Å; H249-I252 PolarHBondContact O-N 3.25Å; H249-I252 VanDerWaalsContact O-O 3.12Å; H249-H308 VanDerWaalsContact CB-CD2 3.46Å; H249-H308 WeakPolarHBondContact CB-CD2 3.41Å; H249-H308 AromaticContact CD2-CG 3.89Å; H249-H308 AromaticContact CD2-ND1 3.95Å; H249-H308 AromaticContact CG-CD2 3.86Å; H249-H308 AromaticContact CG-CG 3.82Å
250	E	97.3	Very high	95.1	Very high	124 Å²	124	37.7 Å²	37.7	58%	0.579	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-35	-176.8	-174.5	-175.1	-164	0	0	112.4	K335 I339	E250-K335 PolarHBondContact O-NZ 3.02Å; E250-I339 HydrophobicContact CG-CG2 4.22Å
251	N	98.6	Very high	94.6	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	23	179.8	-47.5	121.6	0	0	0	114.4	H249 T301 S304 G305 I339 C340 A341 I342	H249-N251 PolarHBondContact CE1-OD1 3.45Å; H249-N251 VanDerWaalsContact CE1-OD1 3.25Å; H249-N251 PolarHBondContact ND1-N 3.48Å; H249-N251 PolarHBondContact O-N 2.77Å; H249-N251 VanDerWaalsContact O-N 3.13Å; N251-T301 WeakPolarHBondContact CB-O 3.19Å; N251-T301 VanDerWaalsContact ND2-CB 3.33Å; N251-T301 WeakPolarHBondContact ND2-CB 3.29Å; N251-T301 PolarHBondContact OD1-O 3.5Å; N251-S304 VanDerWaalsContact OD1-CB 3.26Å; N251-S304 WeakPolarHBondContact OD1-CB 3.31Å; N251-S304 PolarHBondContact OD1-OG 3.3Å; N251-G305 WeakPolarHBondContact O-CA 3.49Å; N251-I339 WeakPolarHBondContact ND2-CG2 3.37Å; N251-C340 VanDerWaalsContact CA-O 3.27Å; N251-C340 WeakPolarHBondContact CA-O 3.44Å; N251-C340 WeakPolarHBondContact CB-O 3.34Å; N251-C340 PolarHBondContact ND2-O 2.88Å; N251-A341 WeakPolarHBondContact O-CA 3.49Å; N251-I342 PolarHBondContact O-N 3.12Å
252	I	98.4	Very high	93.8	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.021	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-121.1	140.7	167.4	-59.8	-61.3	0	0	0	107.4	L247 H249 G254 L309 I342 F345	L247-I252 HydrophobicContact CG-CG2 4.41Å; H249-I252 HydrophobicContact CB-CB 4.34Å; H249-I252 HydrophobicContact CB-CG1 3.92Å; H249-I252 PolarHBondContact O-N 3.25Å; H249-I252 VanDerWaalsContact O-O 3.12Å; I252-G254 PolarHBondContact O-N 3.02Å; I252-L309 HydrophobicContact CD1-CD1 3.92Å; I252-L309 HydrophobicContact CD1-CD2 3.96Å; I252-L309 HydrophobicContact CD1-CG 3.69Å; I252-I342 HydrophobicContact CD1-CB 4.07Å; I252-F345 HydrophobicContact CD1-CZ 4.33Å; I252-F345 HydrophobicContact CG2-CE2 3.99Å; I252-F345 HydrophobicContact CG2-CZ 3.83Å
253	L	98	Very high	92.7	Very high	16 Å²	16	42.5 Å²	42.5	8%	0.084	22%	0.222	C	C	.	.			trans	-61.5	133.1	-178.2	-176.6	62.4	0	0	0	109.9	Y242 F255 T273 I333 I342 A343	Y242-L253 HydrophobicContact CE1-CB 4.43Å; Y242-L253 WeakPolarHBondContact CE1-O 3.29Å; L253-F255 PolarHBondContact O-N 3.34Å; L253-F255 VanDerWaalsContact O-N 3.14Å; L253-T273 HydrophobicContact CD2-CG2 4.04Å; L253-T273 HydrophobicContact CG-CG2 4.34Å; L253-I333 HydrophobicContact CD1-CG1 4.36Å; L253-I333 HydrophobicContact CD2-CG1 4.39Å; L253-I342 WeakPolarHBondContact CB-O 3.24Å; L253-I342 PolarHBondContact N-O 3.3Å; L253-A343 HydrophobicContact CB-CB 3.96Å; L253-A343 HydrophobicContact CD2-CB 3.59Å; L253-A343 HydrophobicContact CG-CB 4.39Å
254	G	96.2	Very high	91.7	Very high	9 Å²	9	43.8 Å²	43.8	9%	0.093	25%	0.252	C	S	.	.			trans	-71.2	109.2	-176	0	0	0	0	0	111.2	I252 T273 D274	I252-G254 PolarHBondContact O-N 3.02Å; G254-T273 CarbonylContact O-C 3.41Å; G254-T273 WeakPolarHBondContact O-CA 3.39Å; G254-T273 WeakPolarHBondContact O-CB 3.49Å; G254-D274 WeakPolarHBondContact CA-OD2 3.17Å; G254-D274 PolarHBondContact O-N 2.77Å
255	F	96.2	Very high	90.7	Very high	9 Å²	9	47.5 Å²	47.5	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.7	171.3	171.9	-100.4	0	0	0	111.1	S184 Y242 Q243 L253 A257 A258 L271	S184-F255 WeakPolarHBondContact O-CD1 3.27Å; S184-F255 VanDerWaalsContact O-CE1 3.27Å; S184-F255 WeakPolarHBondContact O-CE1 3.42Å; Y242-F255 HydrophobicContact CD1-CB 3.49Å; Y242-F255 VanDerWaalsContact CD1-CB 3.49Å; Y242-F255 HydrophobicContact CD1-CD2 4.41Å; Y242-F255 HydrophobicContact CD1-CG 4.23Å; Y242-F255 HydrophobicContact CD2-CD2 4.17Å; Y242-F255 HydrophobicContact CE1-CB 4.16Å; Y242-F255 HydrophobicContact CG-CB 3.79Å; Y242-F255 AromaticContact CG-CD2 3.85Å; Y242-F255 HydrophobicContact CG-CD2 3.85Å; Y242-F255 HydrophobicContact CG-CG 4.01Å; Q243-F255 HydrophobicContact CG-CE1 3.82Å; Q243-F255 HydrophobicContact CG-CZ 4.04Å; L253-F255 PolarHBondContact O-N 3.34Å; L253-F255 VanDerWaalsContact O-N 3.14Å; F255-A257 VanDerWaalsContact CE2-O 3.3Å; F255-A257 WeakPolarHBondContact CE2-O 3.49Å; F255-A257 VanDerWaalsContact CZ-CA 3.41Å; F255-A258 HydrophobicContact CE2-CB 4.26Å; F255-A258 HydrophobicContact CZ-CB 4.3Å; F255-L271 HydrophobicContact CD2-CD1 3.89Å; F255-L271 HydrophobicContact CE2-CD1 3.56Å
256	I	93.4	Very high	90.1	Very high	13 Å²	13	52.9 Å²	52.9	7%	0.067	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-57	176.7	-61.1	174.5	0	0	0	109.3	G185 L186 W217 V222 I272	G185-I256 WeakPolarHBondContact CA-O 3.29Å; L186-I256 HydrophobicContact CD1-CG2 3.88Å; L186-I256 PolarHBondContact N-O 3.2Å; L186-I256 VanDerWaalsContact N-O 3.15Å; W217-I256 HydrophobicContact CE3-CG2 4.2Å; W217-I256 HydrophobicContact CH2-CG2 4.4Å; W217-I256 HydrophobicContact CZ3-CG2 3.74Å; V222-I256 HydrophobicContact CB-CD1 4.33Å; V222-I256 HydrophobicContact CG1-CD1 3.6Å; I256-I272 HydrophobicContact CB-CB 4.45Å; I256-I272 HydrophobicContact CB-CG2 4.15Å; I256-I272 WeakPolarHBondContact CB-O 3.14Å; I256-I272 HydrophobicContact CD1-CG2 4.18Å; I256-I272 HydrophobicContact CG2-CG2 4.41Å; I256-I272 PolarHBondContact N-O 2.98Å
257	A	93.4	Very high	89.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	165.2	-175.9	0	0	0	0	0	112.7	Q191 I194 F255 I272	Q191-A257 HydrophobicContact CB-CB 4.1Å; Q191-A257 HydrophobicContact CG-CB 3.8Å; I194-A257 HydrophobicContact CD1-CB 3.27Å; F255-A257 VanDerWaalsContact CE2-O 3.3Å; F255-A257 WeakPolarHBondContact CE2-O 3.49Å; F255-A257 VanDerWaalsContact CZ-CA 3.41Å; A257-I272 HydrophobicContact CB-CD1 4.39Å; A257-I272 PolarHBondContact N-O 3.27Å; A257-I272 WeakPolarHBondContact O-CD1 3.47Å; A257-I272 PolarHBondContact O-N 2.88Å
258	A	94	Very high	89.3	Confident	9 Å²	9	53.3 Å²	53.3	7%	0.074	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.6	162.6	0	0	0	0	0	108.8	W235 T239 F255 L270 L271	W235-A258 HydrophobicContact CZ2-CB 4.03Å; T239-A258 HydrophobicContact CG2-CB 3.46Å; T239-A258 VanDerWaalsContact CG2-CB 3.46Å; F255-A258 HydrophobicContact CE2-CB 4.26Å; F255-A258 HydrophobicContact CZ-CB 4.3Å; A258-L270 CarbonylContact C-O 3.23Å; A258-L270 VanDerWaalsContact CA-O 3.27Å; A258-L270 WeakPolarHBondContact CA-O 3.18Å; A258-L271 HydrophobicContact CB-CD1 4.3Å
259	D	92.8	Very high	89.3	Confident	9 Å²	9	46.8 Å²	46.8	5%	0.048	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.2	-177.3	-158.2	-4.8	0	0	0	110.9	Q191 R192 T193 I194 A195 L270 I272	Q191-D259 WeakPolarHBondContact O-CB 3.45Å; Q191-D259 VanDerWaalsContact O-OD2 3.06Å; R192-D259 VanDerWaalsContact C-OD2 3.31Å; R192-D259 VanDerWaalsContact CA-OD1 3.24Å; R192-D259 WeakPolarHBondContact CA-OD1 3.28Å; T193-D259 PolarHBondContact N-OD2 3.34Å; I194-D259 PolarHBondContact N-OD2 3.5Å; A195-D259 HydrophobicContact CB-CB 4.13Å; A195-D259 WeakPolarHBondContact CB-OD2 3.25Å; A195-D259 PolarHBondContact N-OD2 3.3Å; D259-L270 PolarHBondContact N-O 2.89Å; D259-L270 WeakPolarHBondContact O-CB 3.35Å; D259-L270 PolarHBondContact O-N 3.26Å; D259-I272 HydrophobicContact CB-CD1 4.36Å
260	I	89.6	Confident	89.3	Confident	89 Å²	89	44.4 Å²	44.4	46%	0.456	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.3	177.3	-62.1	-179.4	0	0	0	108.9	W235 T267 Q268 M269	W235-I260 HydrophobicContact CH2-CD1 3.67Å; W235-I260 HydrophobicContact CH2-CG1 3.79Å; W235-I260 HydrophobicContact CZ2-CD1 4.34Å; W235-I260 HydrophobicContact CZ2-CG1 3.94Å; W235-I260 HydrophobicContact CZ3-CD1 4.12Å; I260-T267 HydrophobicContact CG2-CG2 3.18Å; I260-Q268 CarbonylContact C-O 3.55Å; I260-Q268 WeakPolarHBondContact CA-O 3.28Å; I260-M269 HydrophobicContact CG1-CG 4.4Å
261	K	85	Confident	89.2	Confident	76 Å²	76	38.6 Å²	38.6	33%	0.33	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.4	179.6	-173.2	178.9	179.9	173.6	0	111	A195 T263 Q268 L270	A195-K261 HydrophobicContact CB-CB 3.91Å; A195-K261 HydrophobicContact CB-CD 4.23Å; A195-K261 HydrophobicContact CB-CG 4.34Å; K261-T263 HydrophobicContact CG-CG2 4.41Å; K261-Q268 HydrophobicContact CB-CB 4.41Å; K261-Q268 PolarHBondContact N-O 3Å; K261-Q268 PolarHBondContact O-N 2.81Å; K261-L270 HydrophobicContact CB-CD1 4.37Å
262	G	79.8	Confident	89.1	Confident	59 Å²	59	38.4 Å²	38.4	61%	0.608	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.8	166.3	0	0	0	0	0	110.6
263	T	73.4	Confident	89	Confident	53 Å²	53	38.7 Å²	38.7	33%	0.325	24%	0.238	S	C	.	.			trans	-107.3	26	174.8	57.8	0	0	0	0	112.3	K261 S265 W266 Q268	K261-T263 HydrophobicContact CG-CG2 4.41Å; T263-S265 PolarHBondContact O-N 3.12Å; T263-S265 VanDerWaalsContact O-N 3.07Å; T263-W266 PolarHBondContact N-O 3.17Å; T263-W266 PolarHBondContact OG1-NE1 3.1Å; T263-W266 VanDerWaalsContact OG1-NE1 3.11Å; T263-W266 PolarHBondContact OG1-O 3.28Å; T263-W266 VanDerWaalsContact OG1-O 3.13Å; T263-Q268 HydrophobicContact CG2-CG 4.27Å
264	G	73.8	Confident	88.9	Confident	88 Å²	88	40.2 Å²	40.2	91%	0.907	25%	0.246	S	C	*	.	S	Bend	trans	82.3	-48.9	-178.3	0	0	0	0	0	113.5
265	S	74	Confident	89	Confident	85 Å²	85	41.4 Å²	41.4	59%	0.594	25%	0.249	S	C	*	.	S	Bend	trans	-102.7	-18.1	-176.3	44.7	0	0	0	0	114.8	T263	T263-S265 PolarHBondContact O-N 3.12Å; T263-S265 VanDerWaalsContact O-N 3.07Å
266	W	79.1	Confident	89	Confident	156 Å²	156	42.7 Å²	42.7	59%	0.591	26%	0.255	S	S	*	.	S	Bend	trans	-157.7	167.3	174.6	54.4	82.6	0	0	0	110.9	T263	T263-W266 PolarHBondContact N-O 3.17Å; T263-W266 PolarHBondContact OG1-NE1 3.1Å; T263-W266 VanDerWaalsContact OG1-NE1 3.11Å; T263-W266 PolarHBondContact OG1-O 3.28Å; T263-W266 VanDerWaalsContact OG1-O 3.13Å
267	T	84.5	Confident	89.1	Confident	69 Å²	69	47.4 Å²	47.4	42%	0.423	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.6	177.8	-59.7	0	0	0	0	109.2	T229 I260	T229-T267 WeakPolarHBondContact CG2-O 3.47Å; I260-T267 HydrophobicContact CG2-CG2 3.18Å
268	Q	87.9	Confident	89.3	Confident	47 Å²	47	50.1 Å²	50.1	22%	0.22	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120.3	172.5	-67.1	-175	-34.5	0	0	109.1	I226 I260 K261 T263 L270	I226-Q268 HydrophobicContact CG2-CB 4.11Å; I226-Q268 HydrophobicContact CG2-CG 4.2Å; I260-Q268 CarbonylContact C-O 3.55Å; I260-Q268 WeakPolarHBondContact CA-O 3.28Å; K261-Q268 HydrophobicContact CB-CB 4.41Å; K261-Q268 PolarHBondContact N-O 3Å; K261-Q268 PolarHBondContact O-N 2.81Å; T263-Q268 HydrophobicContact CG2-CG 4.27Å; Q268-L270 HydrophobicContact CB-CD2 4.19Å
269	M	93.9	Very high	89.4	Confident	9 Å²	9	50.8 Å²	50.8	4%	0.044	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.6	171.8	-63.5	172.5	-60.3	0	0	108.3	F227 F228 E232 W235 I260	F227-M269 HydrophobicContact CB-CB 4.29Å; F227-M269 HydrophobicContact CB-CE 4.05Å; F227-M269 PolarHBondContact N-O 3.33Å; F228-M269 WeakPolarHBondContact O-CE 3.31Å; E232-M269 VanDerWaalsContact CA-CE 3.49Å; E232-M269 HydrophobicContact CB-CE 3.87Å; E232-M269 HydrophobicContact CB-SD 3.75Å; E232-M269 HydrophobicContact CG-SD 3.77Å; W235-M269 HydrophobicContact CB-CB 4.36Å; W235-M269 HydrophobicContact CB-CE 4.43Å; W235-M269 HydrophobicContact CB-SD 4.34Å; W235-M269 HydrophobicContact CD2-CB 3.77Å; W235-M269 HydrophobicContact CD2-CG 4.14Å; W235-M269 HydrophobicContact CD2-SD 4.06Å; W235-M269 HydrophobicContact CE3-CB 4.36Å; W235-M269 HydrophobicContact CE3-CG 4.23Å; W235-M269 HydrophobicContact CE3-SD 3.78Å; W235-M269 HydrophobicContact CG-CB 3.73Å; W235-M269 HydrophobicContact CG-CG 4.46Å; W235-M269 HydrophobicContact CG-SD 4.31Å; W235-M269 HydrophobicContact CZ3-SD 4.46Å; I260-M269 HydrophobicContact CG1-CG 4.4Å
270	L	95.4	Very high	89.6	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.4	-172.3	-52.9	-178.3	0	0	0	110.1	A195 L198 V224 K225 I226 W235 A258 D259 K261 Q268 I272	A195-L270 HydrophobicContact CB-CD1 3.52Å; L198-L270 HydrophobicContact CD1-CD1 4.1Å; V224-L270 HydrophobicContact CG1-CB 4.36Å; V224-L270 HydrophobicContact CG1-CD2 4.01Å; K225-L270 WeakPolarHBondContact O-CA 3.47Å; I226-L270 HydrophobicContact CB-CD2 4.15Å; I226-L270 HydrophobicContact CD1-CD2 4.34Å; I226-L270 HydrophobicContact CG1-CD2 3.7Å; I226-L270 HydrophobicContact CG2-CD2 3.98Å; W235-L270 PolarHBondContact NE1-O 2.71Å; A258-L270 CarbonylContact C-O 3.23Å; A258-L270 VanDerWaalsContact CA-O 3.27Å; A258-L270 WeakPolarHBondContact CA-O 3.18Å; D259-L270 PolarHBondContact N-O 2.89Å; D259-L270 WeakPolarHBondContact O-CB 3.35Å; D259-L270 PolarHBondContact O-N 3.26Å; K261-L270 HydrophobicContact CB-CD1 4.37Å; Q268-L270 HydrophobicContact CB-CD2 4.19Å; L270-I272 HydrophobicContact CB-CD1 4Å
271	L	95.5	Very high	90	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.5	165.6	-175.4	85.1	0	0	0	107.9	V224 K225 F227 E238 Y242 F255 A258 T273	V224-L271 WeakPolarHBondContact CA-O 3.23Å; K225-L271 HydrophobicContact CB-CB 4.31Å; K225-L271 PolarHBondContact N-O 3.49Å; K225-L271 PolarHBondContact O-N 3.19Å; F227-L271 HydrophobicContact CE2-CB 3.74Å; F227-L271 HydrophobicContact CZ-CB 4.48Å; E238-L271 HydrophobicContact CG-CD2 3.77Å; E238-L271 WeakPolarHBondContact OE1-CD2 3.45Å; Y242-L271 HydrophobicContact CD2-CD1 4.11Å; Y242-L271 HydrophobicContact CD2-CD2 4Å; Y242-L271 HydrophobicContact CE2-CD2 3.69Å; F255-L271 HydrophobicContact CD2-CD1 3.89Å; F255-L271 HydrophobicContact CE2-CD1 3.56Å; A258-L271 HydrophobicContact CB-CD1 4.3Å; L271-T273 HydrophobicContact CD2-CG2 4.47Å; L271-T273 HydrophobicContact CG-CG2 4.5Å
272	I	96.3	Very high	90.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.1	-174.8	-54.7	88.7	0	0	0	109	I194 L198 V222 A223 V224 I256 A257 D259 L270	I194-I272 HydrophobicContact CG2-CD1 4.4Å; I194-I272 HydrophobicContact CG2-CG1 4.4Å; L198-I272 HydrophobicContact CD1-CG1 4.12Å; V222-I272 HydrophobicContact CB-CG2 3.92Å; V222-I272 HydrophobicContact CG1-CG2 4.36Å; V222-I272 HydrophobicContact CG2-CG2 3.99Å; A223-I272 WeakPolarHBondContact O-CA 3.35Å; V224-I272 HydrophobicContact CG2-CG1 4.36Å; I256-I272 HydrophobicContact CB-CB 4.45Å; I256-I272 HydrophobicContact CB-CG2 4.15Å; I256-I272 WeakPolarHBondContact CB-O 3.14Å; I256-I272 HydrophobicContact CD1-CG2 4.18Å; I256-I272 HydrophobicContact CG2-CG2 4.41Å; I256-I272 PolarHBondContact N-O 2.98Å; A257-I272 HydrophobicContact CB-CD1 4.39Å; A257-I272 PolarHBondContact N-O 3.27Å; A257-I272 WeakPolarHBondContact O-CD1 3.47Å; A257-I272 PolarHBondContact O-N 2.88Å; D259-I272 HydrophobicContact CB-CD1 4.36Å; L270-I272 HydrophobicContact CB-CD1 4Å
273	T	96.9	Very high	91.5	Very high	10 Å²	10	44.8 Å²	44.8	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	170.8	178.7	68.9	0	0	0	0	111.2	A223 L253 G254 L271	A223-T273 PolarHBondContact N-O 2.61Å; A223-T273 PolarHBondContact O-N 3.06Å; L253-T273 HydrophobicContact CD2-CG2 4.04Å; L253-T273 HydrophobicContact CG-CG2 4.34Å; G254-T273 CarbonylContact O-C 3.41Å; G254-T273 WeakPolarHBondContact O-CA 3.39Å; G254-T273 WeakPolarHBondContact O-CB 3.49Å; L271-T273 HydrophobicContact CD2-CG2 4.47Å; L271-T273 HydrophobicContact CG-CG2 4.5Å
274	D	96.1	Very high	92.6	Very high	47 Å²	47	43 Å²	43	25%	0.251	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	142.1	166.6	-63.7	-20.4	0	0	0	110.3	G254	G254-D274 WeakPolarHBondContact CA-OD2 3.17Å; G254-D274 PolarHBondContact O-N 2.77Å
275	F	97.4	Very high	93.8	Very high	35 Å²	35	38.8 Å²	38.8	15%	0.154	20%	0.202	C	C	.	.			trans	-99.3	136.9	173.4	-172.6	-93.9	0	0	0	110.6	V204 K214 T221 A223 E277	V204-F275 HydrophobicContact CG1-CE2 4.04Å; V204-F275 HydrophobicContact CG1-CZ 4.29Å; V204-F275 HydrophobicContact CG2-CE2 4.41Å; K214-F275 HydrophobicContact CB-CD2 4.22Å; K214-F275 HydrophobicContact CB-CE2 3.77Å; K214-F275 HydrophobicContact CB-CZ 4.14Å; K214-F275 HydrophobicContact CD-CD1 4.38Å; K214-F275 HydrophobicContact CD-CE1 3.81Å; K214-F275 HydrophobicContact CD-CE2 4.19Å; K214-F275 HydrophobicContact CD-CZ 3.71Å; K214-F275 HydrophobicContact CG-CD1 4.32Å; K214-F275 HydrophobicContact CG-CD2 4.02Å; K214-F275 HydrophobicContact CG-CE1 4.11Å; K214-F275 HydrophobicContact CG-CE2 3.81Å; K214-F275 HydrophobicContact CG-CG 4.29Å; K214-F275 HydrophobicContact CG-CZ 3.87Å; T221-F275 HydrophobicContact CG2-CB 3.76Å; T221-F275 HydrophobicContact CG2-CD1 3.57Å; T221-F275 HydrophobicContact CG2-CE1 4.38Å; T221-F275 HydrophobicContact CG2-CG 3.72Å; A223-F275 HydrophobicContact CB-CB 4.39Å; A223-F275 HydrophobicContact CB-CD2 3.93Å; F275-E277 HydrophobicContact CE1-CG 4.25Å; F275-E277 WeakPolarHBondContact CE1-OE2 3.44Å
276	H	96.9	Very high	94.9	Very high	35 Å²	35	41 Å²	41	16%	0.162	20%	0.201	C	C	.	.			trans	-127.1	122.7	176.2	-61.9	-56.5	0	0	0	110.3	N278 G279 I333 K335	H276-N278 VanDerWaalsContact C-N 3.29Å; H276-N278 PolarHBondContact O-N 3.49Å; H276-G279 PolarHBondContact O-N 3.17Å; H276-G279 VanDerWaalsContact O-N 3.15Å; H276-I333 HydrophobicContact CB-CG2 3.61Å; H276-K335 WeakPolarHBondContact NE2-CE 3.48Å
277	E	95.5	Very high	95.7	Very high	112 Å²	112	39.3 Å²	39.3	52%	0.523	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-29.5	-171.5	-61.7	-70.5	166.6	0	0	113.5	K214 F275 G279	K214-E277 WeakPolarHBondContact CE-OE1 3.44Å; K214-E277 IonicContact NZ-OE1 2.79Å; K214-E277 PolarHBondContact NZ-OE1 3.17Å; K214-E277 IonicContact NZ-OE2 2.73Å; K214-E277 PolarHBondContact NZ-OE2 2.94Å; F275-E277 HydrophobicContact CE1-CG 4.25Å; F275-E277 WeakPolarHBondContact CE1-OE2 3.44Å; E277-G279 PolarHBondContact O-N 3.35Å
278	N	96.7	Very high	96.2	Very high	58 Å²	58	39 Å²	39	31%	0.31	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-12	178.5	-70.9	-28.6	0	0	0	113.1	H276 F284 V334 K335	H276-N278 VanDerWaalsContact C-N 3.29Å; H276-N278 PolarHBondContact O-N 3.49Å; N278-F284 HydrophobicContact CB-CD2 3.89Å; N278-F284 HydrophobicContact CB-CE2 4.35Å; N278-V334 HydrophobicContact CB-CB 4Å; N278-V334 HydrophobicContact CB-CG1 4.16Å; N278-V334 WeakPolarHBondContact CB-O 3.42Å; N278-K335 PolarHBondContact ND2-O 3.4Å; N278-K335 VanDerWaalsContact ND2-O 3.09Å
279	G	96.3	Very high	96.5	Very high	23 Å²	23	42.1 Å²	42.1	24%	0.237	22%	0.221	C	C	.	.			trans	69	-152.3	177.1	0	0	0	0	0	113.5	H276 E277 I333 V334	H276-G279 PolarHBondContact O-N 3.17Å; H276-G279 VanDerWaalsContact O-N 3.15Å; E277-G279 PolarHBondContact O-N 3.35Å; G279-I333 WeakPolarHBondContact O-CG2 3.49Å; G279-V334 PolarHBondContact O-N 3.38Å
280	S	97.6	Very high	96.5	Very high	10 Å²	10	42.3 Å²	42.3	7%	0.07	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-73.7	159.1	178.5	72.2	0	0	0	0	111.7	H282 D283 F284 K330 I332	S280-H282 PolarHBondContact O-N 2.94Å; S280-H282 WeakPolarHBondContact OG-CB 3.33Å; S280-D283 PolarHBondContact N-OD2 3.28Å; S280-D283 PolarHBondContact O-N 3.29Å; S280-D283 VanDerWaalsContact OG-CG 3.22Å; S280-D283 PolarHBondContact OG-N 2.95Å; S280-D283 PolarHBondContact OG-OD2 3.35Å; S280-F284 WeakPolarHBondContact O-CB 3.3Å; S280-F284 PolarHBondContact O-N 3.46Å; S280-K330 WeakPolarHBondContact CB-O 3.14Å; S280-I332 CarbonylContact C-O 3.57Å; S280-I332 VanDerWaalsContact CA-O 3.28Å; S280-I332 WeakPolarHBondContact CA-O 3.46Å
281	L	98.6	Very high	96.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-33.7	174.3	179.3	64.9	0	0	0	110.7	F284 L285 L298 S329 I332 V334 V400 V404	L281-F284 PolarHBondContact O-N 2.83Å; L281-L285 HydrophobicContact CD1-CD1 3.98Å; L281-L285 HydrophobicContact CD1-CD2 4.19Å; L281-L285 HydrophobicContact CD1-CG 3.81Å; L281-L285 HydrophobicContact CD2-CD1 4.48Å; L281-L285 HydrophobicContact CG-CD1 3.84Å; L281-L285 HydrophobicContact CG-CG 4.12Å; L281-L285 WeakPolarHBondContact O-CB 3.4Å; L281-L285 WeakPolarHBondContact O-CG 3.49Å; L281-L285 PolarHBondContact O-N 3.01Å; L281-L298 HydrophobicContact CD1-CD1 4.17Å; L281-L298 HydrophobicContact CD1-CD2 4.14Å; L281-S329 WeakPolarHBondContact CB-O 3.46Å; L281-S329 PolarHBondContact N-O 2.98Å; L281-I332 HydrophobicContact CB-CB 4.09Å; L281-I332 HydrophobicContact CB-CG2 4.17Å; L281-I332 HydrophobicContact CD2-CB 4.4Å; L281-I332 HydrophobicContact CD2-CD1 4.31Å; L281-I332 HydrophobicContact CD2-CG2 4.24Å; L281-I332 PolarHBondContact N-O 3.31Å; L281-V334 HydrophobicContact CB-CG2 4.09Å; L281-V334 HydrophobicContact CD1-CG2 3.87Å; L281-V400 HydrophobicContact CD2-CG1 3.68Å; L281-V404 HydrophobicContact CD1-CG2 4.41Å; L281-V404 HydrophobicContact CD2-CG2 4.03Å
282	H	97.9	Very high	96.3	Very high	25 Å²	25	49.9 Å²	49.9	12%	0.116	26%	0.258	C	S	.	.	H	α-helix	trans	-56	-52.4	170.6	174.6	82.9	0	0	0	111.9	S280 F284 K286 S329 K330 Y413	S280-H282 PolarHBondContact O-N 2.94Å; S280-H282 WeakPolarHBondContact OG-CB 3.33Å; H282-F284 VanDerWaalsContact C-N 3.34Å; H282-K286 VanDerWaalsContact O-CB 3.3Å; H282-K286 WeakPolarHBondContact O-CB 3.38Å; H282-K286 PolarHBondContact O-N 3.28Å; H282-K286 VanDerWaalsContact O-N 3.12Å; H282-S329 PolarHBondContact N-O 2.88Å; H282-S329 VanDerWaalsContact N-O 3.15Å; H282-K330 HydrophobicContact CB-CG 3.63Å; H282-K330 VanDerWaalsContact CD2-CE 3.49Å; H282-K330 WeakPolarHBondContact CD2-CE 3.34Å; H282-K330 WeakPolarHBondContact NE2-CE 3.4Å; H282-Y413 AromaticContact CE1-CE1 3.61Å; H282-Y413 AromaticContact ND1-CE1 3.59Å; H282-Y413 AromaticContact ND1-CZ 3.5Å; H282-Y413 PolarHBondContact ND1-OH 3.02Å
283	D	96.8	Very high	96.2	Very high	70 Å²	70	52.1 Å²	52.1	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-66.9	-38.8	179.7	-55.5	-48.6	0	0	0	111.2	S280 K286 N287	S280-D283 PolarHBondContact N-OD2 3.28Å; S280-D283 PolarHBondContact O-N 3.29Å; S280-D283 VanDerWaalsContact OG-CG 3.22Å; S280-D283 PolarHBondContact OG-N 2.95Å; S280-D283 PolarHBondContact OG-OD2 3.35Å; D283-K286 PolarHBondContact O-N 2.97Å; D283-N287 WeakPolarHBondContact O-CB 3.28Å; D283-N287 VanDerWaalsContact O-CG 3.3Å; D283-N287 PolarHBondContact O-N 2.97Å; D283-N287 VanDerWaalsContact O-N 3.09Å; D283-N287 PolarHBondContact O-ND2 3.47Å
284	F	98	Very high	96.2	Very high	16 Å²	16	53.4 Å²	53.4	7%	0.07	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-50.7	179.7	-172.4	-94.6	0	0	0	112	N278 S280 L281 H282 K286 N287 N288 I290 L294 L298 V334	N278-F284 HydrophobicContact CB-CD2 3.89Å; N278-F284 HydrophobicContact CB-CE2 4.35Å; S280-F284 WeakPolarHBondContact O-CB 3.3Å; S280-F284 PolarHBondContact O-N 3.46Å; L281-F284 PolarHBondContact O-N 2.83Å; H282-F284 VanDerWaalsContact C-N 3.34Å; F284-K286 VanDerWaalsContact C-N 3.31Å; F284-K286 PolarHBondContact O-N 2.82Å; F284-N287 PolarHBondContact O-N 2.75Å; F284-N288 HydrophobicContact CE1-CB 4.44Å; F284-N288 HydrophobicContact CZ-CB 4.44Å; F284-N288 WeakPolarHBondContact O-CB 3.37Å; F284-N288 PolarHBondContact O-N 3.04Å; F284-N288 PolarHBondContact O-ND2 3.23Å; F284-I290 HydrophobicContact CE1-CG2 4.1Å; F284-L294 HydrophobicContact CE1-CD2 4.04Å; F284-L294 HydrophobicContact CZ-CD2 4.05Å; F284-L298 HydrophobicContact CD1-CD1 4.35Å; F284-L298 HydrophobicContact CE1-CD1 4.11Å; F284-V334 HydrophobicContact CB-CB 4.3Å; F284-V334 HydrophobicContact CB-CG2 3.79Å; F284-V334 HydrophobicContact CD1-CG1 4.41Å; F284-V334 HydrophobicContact CD1-CG2 4.28Å; F284-V334 HydrophobicContact CD2-CB 4.18Å; F284-V334 HydrophobicContact CD2-CG1 3.86Å; F284-V334 HydrophobicContact CD2-CG2 4.42Å; F284-V334 HydrophobicContact CE2-CG1 3.98Å; F284-V334 HydrophobicContact CG-CB 4.18Å; F284-V334 HydrophobicContact CG-CG1 4.07Å; F284-V334 HydrophobicContact CG-CG2 3.91Å; F284-V334 HydrophobicContact CZ-CG1 4.33Å
285	L	98.1	Very high	96.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.5	-34.4	179.8	-66.5	174.1	0	0	0	112.1	L281 I290 L298 E403 V404 R407 Y413	L281-L285 HydrophobicContact CD1-CD1 3.98Å; L281-L285 HydrophobicContact CD1-CD2 4.19Å; L281-L285 HydrophobicContact CD1-CG 3.81Å; L281-L285 HydrophobicContact CD2-CD1 4.48Å; L281-L285 HydrophobicContact CG-CD1 3.84Å; L281-L285 HydrophobicContact CG-CG 4.12Å; L281-L285 WeakPolarHBondContact O-CB 3.4Å; L281-L285 WeakPolarHBondContact O-CG 3.49Å; L281-L285 PolarHBondContact O-N 3.01Å; L285-I290 HydrophobicContact CD2-CD1 4.03Å; L285-I290 HydrophobicContact CD2-CG2 4.36Å; L285-L298 HydrophobicContact CD2-CD1 4.37Å; L285-E403 HydrophobicContact CD1-CB 3.99Å; L285-V404 HydrophobicContact CD1-CG2 3.96Å; L285-V404 HydrophobicContact CD2-CG2 4.42Å; L285-R407 HydrophobicContact CB-CG 4.39Å; L285-R407 HydrophobicContact CD2-CB 4.02Å; L285-R407 HydrophobicContact CD2-CG 4.03Å; L285-R407 VanDerWaalsContact O-CD 3.23Å; L285-R407 WeakPolarHBondContact O-CD 3.43Å; L285-R407 PolarHBondContact O-NE 3.25Å; L285-Y413 HydrophobicContact CB-CD2 3.55Å; L285-Y413 HydrophobicContact CB-CE2 3.68Å; L285-Y413 HydrophobicContact CB-CG 4.49Å; L285-Y413 HydrophobicContact CD1-CD2 4.49Å; L285-Y413 HydrophobicContact CD1-CE2 4.04Å
286	K	96.7	Very high	96.1	Very high	131 Å²	131	49.5 Å²	49.5	57%	0.57	26%	0.256	S	S	*	.	H	α-helix	trans	-64	-40.2	175.6	-173.1	178.6	-178.5	179.9	0	112.3	H282 D283 F284 Y413	H282-K286 VanDerWaalsContact O-CB 3.3Å; H282-K286 WeakPolarHBondContact O-CB 3.38Å; H282-K286 PolarHBondContact O-N 3.28Å; H282-K286 VanDerWaalsContact O-N 3.12Å; D283-K286 PolarHBondContact O-N 2.97Å; F284-K286 VanDerWaalsContact C-N 3.31Å; F284-K286 PolarHBondContact O-N 2.82Å; K286-Y413 HydrophobicContact CB-CD1 3.78Å; K286-Y413 HydrophobicContact CB-CE1 4.27Å; K286-Y413 HydrophobicContact CB-CG 4.14Å; K286-Y413 HydrophobicContact CG-CD1 4.07Å
287	N	95.8	Very high	96.1	Very high	120 Å²	120	49.4 Å²	49.4	64%	0.642	25%	0.254	S	S	*	.	H	α-helix	trans	-96.4	-13.5	-171.5	-64.9	-36.5	0	0	0	114.4	D283 F284	D283-N287 WeakPolarHBondContact O-CB 3.28Å; D283-N287 VanDerWaalsContact O-CG 3.3Å; D283-N287 PolarHBondContact O-N 2.97Å; D283-N287 VanDerWaalsContact O-N 3.09Å; D283-N287 PolarHBondContact O-ND2 3.47Å; F284-N287 PolarHBondContact O-N 2.75Å
288	N	95.9	Very high	96.2	Very high	64 Å²	64	44.1 Å²	44.1	34%	0.342	23%	0.229	S	C	.	.			trans	-126.3	145.3	-174.5	-59.7	-84.4	0	0	0	111.5	F284 R407	F284-N288 HydrophobicContact CE1-CB 4.44Å; F284-N288 HydrophobicContact CZ-CB 4.44Å; F284-N288 WeakPolarHBondContact O-CB 3.37Å; F284-N288 PolarHBondContact O-N 3.04Å; F284-N288 PolarHBondContact O-ND2 3.23Å; N288-R407 PolarHBondContact O-NE 2.94Å; N288-R407 PolarHBondContact O-NH2 2.79Å
289	T	93.2	Very high	96.3	Very high	111 Å²	111	41.4 Å²	41.4	68%	0.681	22%	0.215	S	C	*	.			trans	-77	153.5	156.5	47.4	0	0	0	0	109	R407	T289-R407 VanDerWaalsContact CA-NH2 3.32Å
290	I	95.1	Very high	96.4	Very high	13 Å²	13	43.4 Å²	43.4	7%	0.067	22%	0.216	C	C	.	.			trans	-129.2	142.3	177.4	67.4	176.7	0	0	0	109.6	F284 L285 L294 M295 L298 V404 R407 F408	F284-I290 HydrophobicContact CE1-CG2 4.1Å; L285-I290 HydrophobicContact CD2-CD1 4.03Å; L285-I290 HydrophobicContact CD2-CG2 4.36Å; I290-L294 HydrophobicContact CB-CB 4.36Å; I290-L294 HydrophobicContact CB-CD2 3.95Å; I290-L294 HydrophobicContact CB-CG 4.14Å; I290-L294 HydrophobicContact CG2-CD2 3.68Å; I290-L294 HydrophobicContact CG2-CG 4.09Å; I290-M295 HydrophobicContact CD1-CB 4.03Å; I290-M295 HydrophobicContact CD1-CG 4.33Å; I290-L298 HydrophobicContact CD1-CD1 4.43Å; I290-L298 HydrophobicContact CG2-CD1 4.4Å; I290-V404 HydrophobicContact CD1-CG1 4.08Å; I290-V404 WeakPolarHBondContact CD1-O 3.29Å; I290-R407 HydrophobicContact CD1-CB 4.11Å; I290-R407 HydrophobicContact CD1-CG 4.32Å; I290-R407 HydrophobicContact CG1-CB 4.34Å; I290-R407 HydrophobicContact CG1-CG 4.16Å; I290-F408 HydrophobicContact CD1-CB 4.07Å; I290-F408 HydrophobicContact CG1-CB 3.93Å
291	D	93.9	Very high	96.4	Very high	98 Å²	98	43.2 Å²	43.2	52%	0.524	21%	0.214	S	C	.	.			trans	-91.7	-178.4	171.9	65	28.5	0	0	0	111.1	E293 L294 M295 F408	D291-E293 VanDerWaalsContact C-N 3.33Å; D291-E293 PolarHBondContact O-N 3.09Å; D291-E293 PolarHBondContact OD1-N 2.83Å; D291-E293 VanDerWaalsContact OD1-N 3.08Å; D291-L294 WeakPolarHBondContact OD1-CB 3.4Å; D291-L294 PolarHBondContact OD1-N 3.01Å; D291-M295 VanDerWaalsContact O-CB 3.3Å; D291-M295 WeakPolarHBondContact O-CB 3.43Å; D291-M295 PolarHBondContact O-N 2.77Å; D291-F408 VanDerWaalsContact C-CD2 3.49Å
292	R	93.3	Very high	96.4	Very high	68 Å²	68	43.2 Å²	43.2	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-61.8	-40.7	-177.7	-175.8	-177.1	-76.3	168.7	-3.1	112.1	A296 F408 D450 V452 A488	R292-A296 WeakPolarHBondContact O-CB 3.47Å; R292-A296 PolarHBondContact O-N 2.92Å; R292-A296 VanDerWaalsContact O-N 3.11Å; R292-F408 VanDerWaalsContact CA-CE2 3.5Å; R292-F408 HydrophobicContact CB-CE2 3.78Å; R292-F408 HydrophobicContact CB-CZ 3.79Å; R292-F408 HydrophobicContact CG-CZ 4.26Å; R292-D450 IonicContact CZ-OD2 3.79Å; R292-D450 IonicContact NH2-OD2 3.79Å; R292-D450 PolarHBondContact NH2-OD2 3.28Å; R292-V452 HydrophobicContact CG-CG1 4.39Å; R292-A488 HydrophobicContact CG-CB 3.98Å
293	E	93.7	Very high	96.5	Very high	48 Å²	48	42 Å²	42	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-69.9	-45.9	-177.4	-171.8	-179.8	136.6	0	0	110.7	D291 A296 R297 L485 S492	D291-E293 VanDerWaalsContact C-N 3.33Å; D291-E293 PolarHBondContact O-N 3.09Å; D291-E293 PolarHBondContact OD1-N 2.83Å; D291-E293 VanDerWaalsContact OD1-N 3.08Å; E293-A296 PolarHBondContact O-N 3.24Å; E293-R297 VanDerWaalsContact O-CB 3.26Å; E293-R297 WeakPolarHBondContact O-CB 3.41Å; E293-R297 PolarHBondContact O-N 3.13Å; E293-R297 IonicContact OE1-CZ 3.9Å; E293-R297 IonicContact OE1-NH2 2.82Å; E293-R297 PolarHBondContact OE1-NH2 2.71Å; E293-L485 HydrophobicContact CG-CD1 4.43Å; E293-S492 WeakPolarHBondContact OE2-CB 3.39Å; E293-S492 PolarHBondContact OE2-OG 2.99Å
294	L	95.8	Very high	96.6	Very high	36 Å²	36	38.9 Å²	38.9	19%	0.188	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-41.3	177	-177.4	55.3	0	0	0	111.6	F284 I290 D291 A296 R297 L298	F284-L294 HydrophobicContact CE1-CD2 4.04Å; F284-L294 HydrophobicContact CZ-CD2 4.05Å; I290-L294 HydrophobicContact CB-CB 4.36Å; I290-L294 HydrophobicContact CB-CD2 3.95Å; I290-L294 HydrophobicContact CB-CG 4.14Å; I290-L294 HydrophobicContact CG2-CD2 3.68Å; I290-L294 HydrophobicContact CG2-CG 4.09Å; D291-L294 WeakPolarHBondContact OD1-CB 3.4Å; D291-L294 PolarHBondContact OD1-N 3.01Å; L294-A296 PolarHBondContact O-N 3.41Å; L294-R297 PolarHBondContact O-N 2.99Å; L294-L298 HydrophobicContact CD1-CD1 4.18Å; L294-L298 HydrophobicContact CD1-CD2 4.32Å; L294-L298 HydrophobicContact CD1-CG 3.97Å; L294-L298 HydrophobicContact CG-CD1 4.06Å; L294-L298 HydrophobicContact CG-CG 4.34Å; L294-L298 WeakPolarHBondContact O-CB 3.5Å; L294-L298 VanDerWaalsContact O-CG 3.24Å; L294-L298 WeakPolarHBondContact O-CG 3.39Å; L294-L298 PolarHBondContact O-N 2.86Å
295	M	96.4	Very high	96.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-55.3	-52.8	173.2	-176.4	-163.5	57.9	0	0	111.3	I290 D291 R297 L298 A299 V404 F408 V452 L453 F456	I290-M295 HydrophobicContact CD1-CB 4.03Å; I290-M295 HydrophobicContact CD1-CG 4.33Å; D291-M295 VanDerWaalsContact O-CB 3.3Å; D291-M295 WeakPolarHBondContact O-CB 3.43Å; D291-M295 PolarHBondContact O-N 2.77Å; M295-R297 VanDerWaalsContact C-N 3.3Å; M295-R297 PolarHBondContact O-N 2.67Å; M295-L298 PolarHBondContact O-N 3.27Å; M295-A299 WeakPolarHBondContact O-CB 3.49Å; M295-A299 PolarHBondContact O-N 3.47Å; M295-A299 VanDerWaalsContact O-N 3.15Å; M295-V404 HydrophobicContact CB-CG1 4.45Å; M295-V404 HydrophobicContact CG-CG1 3.66Å; M295-F408 HydrophobicContact CB-CB 4.03Å; M295-F408 HydrophobicContact CB-CD2 4.48Å; M295-F408 HydrophobicContact CB-CG 4.17Å; M295-F408 HydrophobicContact CE-CD1 3.74Å; M295-F408 HydrophobicContact CE-CE1 4.04Å; M295-F408 HydrophobicContact CE-CG 4.26Å; M295-F408 HydrophobicContact CG-CB 3.87Å; M295-F408 HydrophobicContact CG-CG 4.23Å; M295-F408 HydrophobicContact SD-CB 3.48Å; M295-F408 WeakPolarHBondContact SD-CB 3.4Å; M295-F408 HydrophobicContact SD-CD1 3.26Å; M295-F408 WeakPolarHBondContact SD-CD1 3.23Å; M295-F408 HydrophobicContact SD-CE1 4.15Å; M295-F408 HydrophobicContact SD-CG 3.5Å; M295-F408 VanDerWaalsContact SD-CG 3.5Å; M295-V452 HydrophobicContact CE-CG1 3.71Å; M295-L453 HydrophobicContact SD-CD2 4.47Å; M295-F456 HydrophobicContact CE-CD2 4.1Å; M295-F456 HydrophobicContact CE-CE2 4.4Å; M295-F456 HydrophobicContact CG-CE2 4.38Å; M295-F456 HydrophobicContact SD-CD2 4.29Å; M295-F456 HydrophobicContact SD-CE2 4.34Å
296	A	95.3	Very high	96.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-38	-180	0	0	0	0	0	111.8	R292 E293 L294 Y300 L485	R292-A296 WeakPolarHBondContact O-CB 3.47Å; R292-A296 PolarHBondContact O-N 2.92Å; R292-A296 VanDerWaalsContact O-N 3.11Å; E293-A296 PolarHBondContact O-N 3.24Å; L294-A296 PolarHBondContact O-N 3.41Å; A296-Y300 WeakPolarHBondContact O-CB 3.28Å; A296-Y300 PolarHBondContact O-N 3.06Å; A296-L485 HydrophobicContact CB-CB 4.02Å; A296-L485 HydrophobicContact CB-CD1 3.97Å
297	R	97.4	Very high	96.7	Very high	32 Å²	32	32.1 Å²	32.1	12%	0.121	16%	0.164	C	C	.	.	H	α-helix	trans	-67.4	-46.6	179.6	-169.7	-175.8	-58.8	-84.8	-1.3	112.6	E293 L294 M295 A299 Y300 T301 G337 G338 I339 L485	E293-R297 VanDerWaalsContact O-CB 3.26Å; E293-R297 WeakPolarHBondContact O-CB 3.41Å; E293-R297 PolarHBondContact O-N 3.13Å; E293-R297 IonicContact OE1-CZ 3.9Å; E293-R297 IonicContact OE1-NH2 2.82Å; E293-R297 PolarHBondContact OE1-NH2 2.71Å; L294-R297 PolarHBondContact O-N 2.99Å; M295-R297 VanDerWaalsContact C-N 3.3Å; M295-R297 PolarHBondContact O-N 2.67Å; R297-A299 PolarHBondContact O-N 3.44Å; R297-Y300 PolarHBondContact O-N 2.82Å; R297-T301 HydrophobicContact CG-CG2 4.47Å; R297-T301 WeakPolarHBondContact O-CB 3.32Å; R297-T301 VanDerWaalsContact O-CG2 3.31Å; R297-T301 WeakPolarHBondContact O-CG2 3.47Å; R297-T301 PolarHBondContact O-N 2.89Å; R297-T301 PolarHBondContact O-OG1 2.89Å; R297-G337 WeakPolarHBondContact CD-O 3.5Å; R297-G338 WeakPolarHBondContact CG-O 3.44Å; R297-I339 HydrophobicContact CG-CD1 4.21Å; R297-L485 HydrophobicContact CB-CD1 4.04Å
298	L	98.4	Very high	96.9	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-58.9	-48	176.4	-68.3	169.3	0	0	0	110.4	L281 F284 L285 I290 L294 M295 T301 A302 V334 C340	L281-L298 HydrophobicContact CD1-CD1 4.17Å; L281-L298 HydrophobicContact CD1-CD2 4.14Å; F284-L298 HydrophobicContact CD1-CD1 4.35Å; F284-L298 HydrophobicContact CE1-CD1 4.11Å; L285-L298 HydrophobicContact CD2-CD1 4.37Å; I290-L298 HydrophobicContact CD1-CD1 4.43Å; I290-L298 HydrophobicContact CG2-CD1 4.4Å; L294-L298 HydrophobicContact CD1-CD1 4.18Å; L294-L298 HydrophobicContact CD1-CD2 4.32Å; L294-L298 HydrophobicContact CD1-CG 3.97Å; L294-L298 HydrophobicContact CG-CD1 4.06Å; L294-L298 HydrophobicContact CG-CG 4.34Å; L294-L298 WeakPolarHBondContact O-CB 3.5Å; L294-L298 VanDerWaalsContact O-CG 3.24Å; L294-L298 WeakPolarHBondContact O-CG 3.39Å; L294-L298 PolarHBondContact O-N 2.86Å; M295-L298 PolarHBondContact O-N 3.27Å; L298-T301 PolarHBondContact O-OG1 2.88Å; L298-A302 VanDerWaalsContact O-CB 3.26Å; L298-A302 WeakPolarHBondContact O-CB 3.35Å; L298-A302 PolarHBondContact O-N 3.35Å; L298-V334 HydrophobicContact CD2-CG1 4.08Å; L298-V334 HydrophobicContact CD2-CG2 4.14Å; L298-C340 VanDerWaalsContact CD2-SG 3.5Å
299	A	98.1	Very high	97	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-65.7	-43.2	179.4	0	0	0	0	0	113	M295 R297 S303 L401 F456 M481	M295-A299 WeakPolarHBondContact O-CB 3.49Å; M295-A299 PolarHBondContact O-N 3.47Å; M295-A299 VanDerWaalsContact O-N 3.15Å; R297-A299 PolarHBondContact O-N 3.44Å; A299-S303 VanDerWaalsContact O-CB 3.27Å; A299-S303 WeakPolarHBondContact O-CB 3.45Å; A299-S303 PolarHBondContact O-N 3Å; A299-S303 PolarHBondContact O-OG 3.15Å; A299-L401 HydrophobicContact CB-CD2 3.71Å; A299-F456 HydrophobicContact CB-CE2 3.77Å; A299-F456 HydrophobicContact CB-CZ 3.63Å; A299-M481 HydrophobicContact CB-CG 4.08Å; A299-M481 HydrophobicContact CB-SD 3.58Å; A299-M481 VanDerWaalsContact CB-SD 3.58Å
300	Y	98.3	Very high	97.3	Very high	65 Å²	65	20 Å²	20	26%	0.255	9%	0.094	S	C	.	.	H	α-helix	trans	-62.1	-49	177.3	172.6	-112.7	0	0	0	111.8	A296 R297 S303 S304 K478 M481 A482 L485	A296-Y300 WeakPolarHBondContact O-CB 3.28Å; A296-Y300 PolarHBondContact O-N 3.06Å; R297-Y300 PolarHBondContact O-N 2.82Å; Y300-S303 PolarHBondContact O-N 3.44Å; Y300-S303 PolarHBondContact O-OG 3.36Å; Y300-S304 VanDerWaalsContact O-CB 3.27Å; Y300-S304 WeakPolarHBondContact O-CB 3.38Å; Y300-S304 PolarHBondContact O-N 3.06Å; Y300-K478 HydrophobicContact CD2-CG 4.27Å; Y300-K478 HydrophobicContact CE2-CG 3.83Å; Y300-M481 HydrophobicContact CD2-CB 4.21Å; Y300-A482 HydrophobicContact CD2-CB 3.93Å; Y300-A482 HydrophobicContact CE2-CB 3.63Å; Y300-L485 HydrophobicContact CD1-CD2 3.64Å; Y300-L485 HydrophobicContact CE1-CD2 4.37Å; Y300-L485 HydrophobicContact CG-CD2 4Å
301	T	98.7	Very high	97.4	Very high	5 Å²	5	22.4 Å²	22.4	3%	0.031	11%	0.109	C	C	.	.	H	α-helix	trans	-69.6	-41.7	-176.8	52.6	0	0	0	0	111.8	N251 R297 L298 S304 G305 I339 C340	N251-T301 WeakPolarHBondContact CB-O 3.19Å; N251-T301 VanDerWaalsContact ND2-CB 3.33Å; N251-T301 WeakPolarHBondContact ND2-CB 3.29Å; N251-T301 PolarHBondContact OD1-O 3.5Å; R297-T301 HydrophobicContact CG-CG2 4.47Å; R297-T301 WeakPolarHBondContact O-CB 3.32Å; R297-T301 VanDerWaalsContact O-CG2 3.31Å; R297-T301 WeakPolarHBondContact O-CG2 3.47Å; R297-T301 PolarHBondContact O-N 2.89Å; R297-T301 PolarHBondContact O-OG1 2.89Å; L298-T301 PolarHBondContact O-OG1 2.88Å; T301-S304 WeakPolarHBondContact O-CB 3.46Å; T301-S304 PolarHBondContact O-N 3.26Å; T301-G305 PolarHBondContact O-N 3.43Å; T301-I339 HydrophobicContact CG2-CB 4.46Å; T301-I339 HydrophobicContact CG2-CD1 3.71Å; T301-I339 HydrophobicContact CG2-CG2 4.03Å; T301-C340 WeakPolarHBondContact OG1-CB 3.46Å; T301-C340 PolarHBondContact OG1-N 3.4Å
302	A	98.8	Very high	97.5	Very high	2 Å²	2	20.9 Å²	20.9	2%	0.017	10%	0.098	C	C	.	.	H	α-helix	trans	-63	-44.4	174.7	0	0	0	0	0	112	L298 S304 G305 L306 I332 C340 F397	L298-A302 VanDerWaalsContact O-CB 3.26Å; L298-A302 WeakPolarHBondContact O-CB 3.35Å; L298-A302 PolarHBondContact O-N 3.35Å; A302-S304 VanDerWaalsContact C-N 3.31Å; A302-S304 PolarHBondContact O-N 3.29Å; A302-G305 PolarHBondContact O-N 2.6Å; A302-L306 PolarHBondContact O-N 2.96Å; A302-I332 HydrophobicContact CB-CD1 4.43Å; A302-I332 HydrophobicContact CB-CG2 4.42Å; A302-C340 HydrophobicContact CB-CB 3.86Å; A302-F397 HydrophobicContact CB-CE2 3.77Å; A302-F397 HydrophobicContact CB-CZ 3.99Å
303	S	98.7	Very high	97.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-67.4	-30.9	176.4	61.3	0	0	0	0	112.9	A299 Y300 L306 A307 K478	A299-S303 VanDerWaalsContact O-CB 3.27Å; A299-S303 WeakPolarHBondContact O-CB 3.45Å; A299-S303 PolarHBondContact O-N 3Å; A299-S303 PolarHBondContact O-OG 3.15Å; Y300-S303 PolarHBondContact O-N 3.44Å; Y300-S303 PolarHBondContact O-OG 3.36Å; S303-L306 PolarHBondContact O-N 2.84Å; S303-A307 VanDerWaalsContact O-CB 3.24Å; S303-A307 WeakPolarHBondContact O-CB 3.12Å; S303-A307 PolarHBondContact O-N 3.24Å; S303-K478 WeakPolarHBondContact OG-CA 3.14Å
304	S	98.7	Very high	97.3	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.028	12%	0.123	C	C	.	.	H	α-helix	trans	-64.5	-43.4	173	-172.7	0	0	0	0	111.7	N251 Y300 T301 A302 A307 H308 K478	N251-S304 VanDerWaalsContact OD1-CB 3.26Å; N251-S304 WeakPolarHBondContact OD1-CB 3.31Å; N251-S304 PolarHBondContact OD1-OG 3.3Å; Y300-S304 VanDerWaalsContact O-CB 3.27Å; Y300-S304 WeakPolarHBondContact O-CB 3.38Å; Y300-S304 PolarHBondContact O-N 3.06Å; T301-S304 WeakPolarHBondContact O-CB 3.46Å; T301-S304 PolarHBondContact O-N 3.26Å; A302-S304 VanDerWaalsContact C-N 3.31Å; A302-S304 PolarHBondContact O-N 3.29Å; S304-A307 PolarHBondContact O-N 2.79Å; S304-H308 PolarHBondContact O-N 3.12Å; S304-K478 WeakPolarHBondContact OG-CE 2.95Å; S304-K478 PolarHBondContact OG-NZ 3.47Å
305	G	98.8	Very high	96.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.8	-45.4	172.6	0	0	0	0	0	112.5	N251 T301 A302 A307 H308 L309 I342	N251-G305 WeakPolarHBondContact O-CA 3.49Å; T301-G305 PolarHBondContact O-N 3.43Å; A302-G305 PolarHBondContact O-N 2.6Å; G305-A307 PolarHBondContact O-N 2.94Å; G305-H308 WeakPolarHBondContact O-CB 3.35Å; G305-H308 PolarHBondContact O-N 2.98Å; G305-L309 PolarHBondContact O-N 3.32Å; G305-I342 VanDerWaalsContact C-CD1 3.5Å
306	L	98.8	Very high	95.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-39.5	-179.3	-170.1	60.2	0	0	0	111.4	A302 S303 H308 L309 H310 V327 I342 D393 M394 F397 A474	A302-L306 PolarHBondContact O-N 2.96Å; S303-L306 PolarHBondContact O-N 2.84Å; L306-H308 VanDerWaalsContact C-N 3.32Å; L306-H308 PolarHBondContact O-N 3.09Å; L306-L309 HydrophobicContact CD1-CD1 4.41Å; L306-L309 PolarHBondContact O-N 3.06Å; L306-H310 WeakPolarHBondContact CD1-NE2 3.48Å; L306-H310 WeakPolarHBondContact O-CB 2.89Å; L306-H310 PolarHBondContact O-N 3.4Å; L306-V327 HydrophobicContact CD1-CG2 4.27Å; L306-I342 HydrophobicContact CB-CD1 3.77Å; L306-I342 HydrophobicContact CD1-CD1 4.23Å; L306-D393 HydrophobicContact CD1-CB 4.43Å; L306-M394 HydrophobicContact CD2-SD 3.76Å; L306-F397 HydrophobicContact CD2-CB 3.84Å; L306-F397 HydrophobicContact CD2-CD1 4.15Å; L306-F397 HydrophobicContact CD2-CD2 4.12Å; L306-F397 HydrophobicContact CD2-CG 3.76Å; L306-A474 HydrophobicContact CB-CB 4.17Å; L306-A474 HydrophobicContact CD2-CB 4.24Å; L306-A474 HydrophobicContact CG-CB 3.95Å
307	A	98.8	Very high	95.2	Very high	4 Å²	4	39.3 Å²	39.3	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-40.5	174.3	0	0	0	0	0	111.7	S303 S304 G305 H310 T311 A474 K478	S303-A307 VanDerWaalsContact O-CB 3.24Å; S303-A307 WeakPolarHBondContact O-CB 3.12Å; S303-A307 PolarHBondContact O-N 3.24Å; S304-A307 PolarHBondContact O-N 2.79Å; G305-A307 PolarHBondContact O-N 2.94Å; A307-H310 PolarHBondContact O-N 2.65Å; A307-T311 VanDerWaalsContact O-CB 3.27Å; A307-T311 WeakPolarHBondContact O-CB 3.28Å; A307-T311 PolarHBondContact O-N 3.43Å; A307-T311 PolarHBondContact O-OG1 2.7Å; A307-A474 HydrophobicContact CB-CB 3.98Å; A307-K478 HydrophobicContact CB-CD 4.28Å
308	H	98.5	Very high	94.7	Very high	31 Å²	31	39 Å²	39	14%	0.144	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-44.4	174.6	-178.8	68.5	0	0	0	112.1	M246 L247 H249 S304 G305 L306 T311 K319	M246-H308 PolarHBondContact O-CE1 3.05Å; M246-H308 PolarHBondContact O-NE2 2.94Å; L247-H308 PolarHBondContact O-CD2 2.95Å; L247-H308 PolarHBondContact O-NE2 3.23Å; H249-H308 VanDerWaalsContact CB-CD2 3.46Å; H249-H308 WeakPolarHBondContact CB-CD2 3.41Å; H249-H308 AromaticContact CD2-CG 3.89Å; H249-H308 AromaticContact CD2-ND1 3.95Å; H249-H308 AromaticContact CG-CD2 3.86Å; H249-H308 AromaticContact CG-CG 3.82Å; S304-H308 PolarHBondContact O-N 3.12Å; G305-H308 WeakPolarHBondContact O-CB 3.35Å; G305-H308 PolarHBondContact O-N 2.98Å; L306-H308 VanDerWaalsContact C-N 3.32Å; L306-H308 PolarHBondContact O-N 3.09Å; H308-T311 PolarHBondContact O-N 2.59Å; H308-K319 WeakPolarHBondContact O-CE 3.23Å; H308-K319 PolarHBondContact O-NZ 2.98Å
309	L	98.5	Very high	94.6	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.3	-52.2	174.5	-71.7	168.9	0	0	0	111.5	L247 I252 G305 L306 T311 K319 I322 I342 F345	L247-L309 HydrophobicContact CD1-CD2 3.66Å; I252-L309 HydrophobicContact CD1-CD1 3.92Å; I252-L309 HydrophobicContact CD1-CD2 3.96Å; I252-L309 HydrophobicContact CD1-CG 3.69Å; G305-L309 PolarHBondContact O-N 3.32Å; L306-L309 HydrophobicContact CD1-CD1 4.41Å; L306-L309 PolarHBondContact O-N 3.06Å; L309-T311 VanDerWaalsContact C-N 3.25Å; L309-T311 PolarHBondContact O-N 2.73Å; L309-K319 PolarHBondContact O-NZ 3.13Å; L309-I322 CarbonylContact C-O 3.6Å; L309-I322 VanDerWaalsContact C-O 3.29Å; L309-I322 HydrophobicContact CB-CB 4.44Å; L309-I322 HydrophobicContact CD2-CB 4.24Å; L309-I322 HydrophobicContact CD2-CD1 4.32Å; L309-I322 HydrophobicContact CD2-CG2 4.12Å; L309-I322 PolarHBondContact O-N 3.24Å; L309-I342 HydrophobicContact CD1-CB 4.36Å; L309-I342 HydrophobicContact CD1-CD1 3.83Å; L309-I342 HydrophobicContact CD1-CG2 4Å; L309-F345 HydrophobicContact CD1-CE1 3.78Å; L309-F345 HydrophobicContact CD2-CE1 3.82Å; L309-F345 HydrophobicContact CD2-CZ 4.35Å; L309-F345 HydrophobicContact CG-CE1 4.45Å
310	H	98.6	Very high	94.5	Very high	11 Å²	11	40.4 Å²	40.4	5%	0.051	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-19.9	-174.6	-75.9	-166.1	0	0	0	114.4	L306 A307 A321 I322 R390 D393	L306-H310 WeakPolarHBondContact CD1-NE2 3.48Å; L306-H310 WeakPolarHBondContact O-CB 2.89Å; L306-H310 PolarHBondContact O-N 3.4Å; A307-H310 PolarHBondContact O-N 2.65Å; H310-A321 WeakPolarHBondContact O-CB 3.4Å; H310-I322 PolarHBondContact CD2-O 2.87Å; H310-I322 VanDerWaalsContact CD2-O 3.29Å; H310-R390 HydrophobicContact CB-CG 4.47Å; H310-R390 PolarHBondContact CE1-O 3.3Å; H310-R390 PolarHBondContact O-NH1 2.73Å; H310-D393 IonicContact CD2-OD2 2.85Å; H310-D393 IonicContact CE1-OD2 3.49Å; H310-D393 IonicContact NE2-OD2 2.7Å; H310-D393 PolarHBondContact NE2-OD2 3.36Å
311	T	97.4	Very high	94.4	Very high	63 Å²	63	37.4 Å²	37.4	39%	0.387	22%	0.216	S	C	.	.			trans	-88.5	128.3	-176.7	-59.1	0	0	0	0	110.9	A307 H308 L309 K319	A307-T311 VanDerWaalsContact O-CB 3.27Å; A307-T311 WeakPolarHBondContact O-CB 3.28Å; A307-T311 PolarHBondContact O-N 3.43Å; A307-T311 PolarHBondContact O-OG1 2.7Å; H308-T311 PolarHBondContact O-N 2.59Å; L309-T311 VanDerWaalsContact C-N 3.25Å; L309-T311 PolarHBondContact O-N 2.73Å; T311-K319 PolarHBondContact O-NZ 3.33Å
312	E	95.8	Very high	94.4	Very high	65 Å²	65	37.1 Å²	37.1	30%	0.304	22%	0.215	S	C	.	.			trans	-78.7	132.6	167.3	-174.5	178.7	-166.8	0	0	109.4	L314 K319 A321 S353	E312-L314 HydrophobicContact CG-CD2 4.09Å; E312-K319 CarbonylContact C-O 3.29Å; E312-K319 WeakPolarHBondContact CA-O 3.3Å; E312-K319 WeakPolarHBondContact CG-O 3.44Å; E312-A321 HydrophobicContact CB-CB 4.22Å; E312-S353 WeakPolarHBondContact OE1-CB 3.41Å; E312-S353 PolarHBondContact OE1-OG 3.09Å
313	I	93.9	Very high	94.4	Very high	55 Å²	55	37 Å²	37	28%	0.282	21%	0.214	S	C	.	.	B	Isolated β-bridge	trans	-106.7	113.6	173.7	-57.1	175	0	0	0	107	M246 G318 K319	M246-I313 HydrophobicContact CB-CD1 4.37Å; I313-G318 CarbonylContact O-C 3.48Å; I313-G318 WeakPolarHBondContact O-CA 3.42Å; I313-K319 HydrophobicContact CB-CB 3.81Å; I313-K319 HydrophobicContact CD1-CB 3.99Å; I313-K319 HydrophobicContact CD1-CD 4.02Å; I313-K319 HydrophobicContact CG1-CB 3.99Å; I313-K319 HydrophobicContact CG1-CD 4.44Å; I313-K319 PolarHBondContact N-O 3.06Å; I313-K319 PolarHBondContact O-N 3.3Å
314	L	89.7	Confident	94.3	Very high	135 Å²	135	37 Å²	37	71%	0.707	21%	0.214	S	C	*	.			trans	-78.4	141.6	-179.6	-57.7	176.4	0	0	0	110.8	E312	E312-L314 HydrophobicContact CG-CD2 4.09Å
315	G	84.9	Confident	94.2	Very high	59 Å²	59	38.2 Å²	38.2	61%	0.608	22%	0.218	S	C	*	.	S	Bend	trans	158	172.8	176.4	0	0	0	0	0	111.9	R317 G318	G315-R317 PolarHBondContact O-N 3.03Å; G315-G318 PolarHBondContact O-N 3.43Å; G315-G318 VanDerWaalsContact O-N 3.08Å
316	T	77.2	Confident	94.1	Very high	153 Å²	153	38.6 Å²	38.6	94%	0.939	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-26	175.4	51	0	0	0	0	112.7
317	R	81.3	Confident	94.1	Very high	138 Å²	138	38.9 Å²	38.9	52%	0.521	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.7	53	174.1	-66.3	-162.6	178	173.5	-1.6	109	S182 V245 G315	S182-R317 VanDerWaalsContact CB-NH1 3.29Å; S182-R317 WeakPolarHBondContact OG-CD 3.35Å; S182-R317 PolarHBondContact OG-NH1 3.35Å; V245-R317 HydrophobicContact CG1-CB 3.86Å; V245-R317 VanDerWaalsContact CG1-O 3.23Å; V245-R317 WeakPolarHBondContact CG1-O 3.47Å; G315-R317 PolarHBondContact O-N 3.03Å
318	G	88	Confident	94.1	Very high	27 Å²	27	40.1 Å²	40.1	28%	0.278	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-68.3	157.7	-177.5	0	0	0	0	0	113.2	I313 G315	I313-G318 CarbonylContact O-C 3.48Å; I313-G318 WeakPolarHBondContact O-CA 3.42Å; G315-G318 PolarHBondContact O-N 3.43Å; G315-G318 VanDerWaalsContact O-N 3.08Å
319	K	95	Very high	94.1	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.009	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-100.4	122.1	170.9	-171.4	-167.1	145.6	-65	0	108.3	T244 V245 M246 H308 L309 T311 E312 I313	T244-K319 HydrophobicContact CG2-CG 4.35Å; V245-K319 WeakPolarHBondContact O-CB 3.45Å; V245-K319 WeakPolarHBondContact O-CG 3.25Å; M246-K319 HydrophobicContact CB-CB 4.05Å; H308-K319 WeakPolarHBondContact O-CE 3.23Å; H308-K319 PolarHBondContact O-NZ 2.98Å; L309-K319 PolarHBondContact O-NZ 3.13Å; T311-K319 PolarHBondContact O-NZ 3.33Å; E312-K319 CarbonylContact C-O 3.29Å; E312-K319 WeakPolarHBondContact CA-O 3.3Å; E312-K319 WeakPolarHBondContact CG-O 3.44Å; I313-K319 HydrophobicContact CB-CB 3.81Å; I313-K319 HydrophobicContact CD1-CB 3.99Å; I313-K319 HydrophobicContact CD1-CD 4.02Å; I313-K319 HydrophobicContact CG1-CB 3.99Å; I313-K319 HydrophobicContact CG1-CD 4.44Å; I313-K319 PolarHBondContact N-O 3.06Å; I313-K319 PolarHBondContact O-N 3.3Å
320	P	96.1	Very high	94.1	Very high	29 Å²	29	44.3 Å²	44.3	19%	0.188	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-64.5	154.2	170	27.3	-32.6	0	0	0	110.8	T244 R350 Y351	T244-P320 HydrophobicContact CG2-CG 3.95Å; P320-R350 HydrophobicContact CB-CB 4.28Å; P320-R350 HydrophobicContact CG-CB 4.26Å; P320-R350 HydrophobicContact CG-CG 4.09Å; P320-Y351 VanDerWaalsContact CB-O 3.31Å; P320-Y351 WeakPolarHBondContact CB-O 3.16Å
321	A	97.3	Very high	94	Very high	2 Å²	2	44.4 Å²	44.4	2%	0.017	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-65.6	137.9	167.1	0	0	0	0	0	109.5	H310 E312 R350 Y351 F386	H310-A321 WeakPolarHBondContact O-CB 3.4Å; E312-A321 HydrophobicContact CB-CB 4.22Å; A321-R350 WeakPolarHBondContact O-CA 3.21Å; A321-Y351 PolarHBondContact O-N 3.08Å; A321-F386 VanDerWaalsContact C-CZ 3.48Å; A321-F386 HydrophobicContact CB-CD1 4.37Å; A321-F386 HydrophobicContact CB-CE1 3.45Å; A321-F386 VanDerWaalsContact CB-CE1 3.45Å; A321-F386 HydrophobicContact CB-CZ 3.72Å; A321-F386 WeakPolarHBondContact O-CZ 3.3Å
322	I	97.9	Very high	94.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.5	-178.7	-65.1	159.2	0	0	0	108.6	I241 T244 L247 L309 H310 V349 R350	I241-I322 HydrophobicContact CG2-CD1 4.43Å; T244-I322 HydrophobicContact CG2-CD1 4.32Å; L247-I322 HydrophobicContact CD1-CD1 3.89Å; L309-I322 CarbonylContact C-O 3.6Å; L309-I322 VanDerWaalsContact C-O 3.29Å; L309-I322 HydrophobicContact CB-CB 4.44Å; L309-I322 HydrophobicContact CD2-CB 4.24Å; L309-I322 HydrophobicContact CD2-CD1 4.32Å; L309-I322 HydrophobicContact CD2-CG2 4.12Å; L309-I322 PolarHBondContact O-N 3.24Å; H310-I322 PolarHBondContact CD2-O 2.87Å; H310-I322 VanDerWaalsContact CD2-O 3.29Å; I322-V349 VanDerWaalsContact CA-O 3.29Å; I322-V349 WeakPolarHBondContact CA-O 3.4Å; I322-R350 HydrophobicContact CG1-CG 3.91Å
323	A	97.7	Very high	94.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.7	166.8	0	0	0	0	0	109.2	R325 S348 V349 F386 Y389 D393	A323-R325 HydrophobicContact CB-CG 4.5Å; A323-S348 CarbonylContact O-C 3.38Å; A323-S348 WeakPolarHBondContact O-CA 3.34Å; A323-S348 VanDerWaalsContact O-CB 3.32Å; A323-S348 WeakPolarHBondContact O-CB 3.47Å; A323-V349 HydrophobicContact CB-CG2 3.87Å; A323-V349 PolarHBondContact N-O 3.1Å; A323-V349 PolarHBondContact O-N 3.14Å; A323-F386 HydrophobicContact CB-CE2 3.92Å; A323-F386 HydrophobicContact CB-CZ 3.98Å; A323-Y389 VanDerWaalsContact CB-CB 3.47Å; A323-D393 WeakPolarHBondContact CA-OD2 3.47Å
324	H	98	Very high	94.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.			trans	-77.9	-46.7	-168.1	-172.9	-84.6	0	0	0	112.7	D326 V327 I342 A343 D344 F345 S348 D393	H324-D326 PolarHBondContact CE1-O 3.06Å; H324-D326 VanDerWaalsContact CE1-O 3.31Å; H324-D326 PolarHBondContact ND1-N 2.87Å; H324-D326 PolarHBondContact ND1-O 2.97Å; H324-D326 PolarHBondContact O-N 3.39Å; H324-V327 HydrophobicContact CB-CG2 3.64Å; H324-V327 PolarHBondContact ND1-N 2.76Å; H324-I342 VanDerWaalsContact CD2-CG2 3.49Å; H324-I342 WeakPolarHBondContact CD2-CG2 3.44Å; H324-A343 PolarHBondContact NE2-O 3.15Å; H324-D344 PolarHBondContact CE1-O 3.36Å; H324-D344 PolarHBondContact NE2-O 3.21Å; H324-F345 AromaticContact CD2-CD1 3.64Å; H324-F345 AromaticContact CD2-CE1 3.6Å; H324-F345 AromaticContact NE2-CD1 3.92Å; H324-F345 AromaticContact NE2-CE1 3.98Å; H324-S348 WeakPolarHBondContact CA-OG 3.18Å; H324-S348 WeakPolarHBondContact O-CA 3.3Å; H324-S348 PolarHBondContact O-OG 2.92Å; H324-S348 VanDerWaalsContact O-OG 3.08Å; H324-D393 PolarHBondContact N-OD1 3.5Å; H324-D393 PolarHBondContact N-OD2 3.33Å
325	R	96.7	Very high	94.8	Very high	29 Å²	29	32.4 Å²	32.4	11%	0.109	18%	0.18	C	C	.	.	S	Bend	trans	70	-4.6	176.6	-54.9	178.8	59	-154.7	6.8	117.3	A323 L347 V349 N363 P364 V366 Y389 D393	A323-R325 HydrophobicContact CB-CG 4.5Å; R325-L347 HydrophobicContact CB-CB 4.48Å; R325-L347 WeakPolarHBondContact CD-O 3.49Å; R325-L347 PolarHBondContact NH1-O 3.47Å; R325-V349 HydrophobicContact CG-CG2 4.37Å; R325-N363 PolarHBondContact NH2-O 3.28Å; R325-P364 PolarHBondContact NH2-O 3.48Å; R325-V366 VanDerWaalsContact CZ-CG2 3.44Å; R325-Y389 HydrophobicContact CG-CD1 4.11Å; R325-D393 WeakPolarHBondContact CA-OD1 3.37Å; R325-D393 PolarHBondContact N-OD1 2.55Å
326	D	97.2	Very high	95.2	Very high	8 Å²	8	35.5 Å²	35.5	4%	0.043	18%	0.182	C	C	.	.			trans	-138.1	45.6	170	-163.1	31.4	0	0	0	112.2	H324 K328 N331 L347 G367 T368	H324-D326 PolarHBondContact CE1-O 3.06Å; H324-D326 VanDerWaalsContact CE1-O 3.31Å; H324-D326 PolarHBondContact ND1-N 2.87Å; H324-D326 PolarHBondContact ND1-O 2.97Å; H324-D326 PolarHBondContact O-N 3.39Å; D326-K328 PolarHBondContact O-N 3.49Å; D326-K328 IonicContact OD1-NZ 2.6Å; D326-K328 IonicContact OD2-NZ 2.91Å; D326-K328 PolarHBondContact OD2-NZ 3.1Å; D326-N331 PolarHBondContact O-ND2 3.25Å; D326-N331 PolarHBondContact OD2-ND2 2.75Å; D326-L347 HydrophobicContact CB-CD1 3.95Å; D326-G367 WeakPolarHBondContact OD1-CA 3.4Å; D326-T368 VanDerWaalsContact OD1-CB 3.3Å; D326-T368 WeakPolarHBondContact OD1-CB 2.87Å; D326-T368 PolarHBondContact OD1-N 3.02Å; D326-T368 PolarHBondContact OD1-OG1 3.49Å
327	V	98.7	Very high	96	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.03	16%	0.162	C	C	.	.			trans	-67.2	122.5	177.3	179.4	0	0	0	0	109.3	L306 H324 D393 S396 F397 V400	L306-V327 HydrophobicContact CD1-CG2 4.27Å; H324-V327 HydrophobicContact CB-CG2 3.64Å; H324-V327 PolarHBondContact ND1-N 2.76Å; V327-D393 HydrophobicContact CG2-CB 4.13Å; V327-S396 WeakPolarHBondContact O-CB 3.29Å; V327-F397 HydrophobicContact CG1-CB 4.18Å; V327-F397 HydrophobicContact CG1-CD2 4.12Å; V327-V400 HydrophobicContact CG1-CG2 4.34Å
328	K	98.3	Very high	96.6	Very high	30 Å²	30	24.3 Å²	24.3	13%	0.13	14%	0.14	C	C	.	.	S	Bend	trans	-162.3	161	177.1	62.6	-165.8	-177.2	-154	0	109.9	D326 K330 N331 T368 Y371	D326-K328 PolarHBondContact O-N 3.49Å; D326-K328 IonicContact OD1-NZ 2.6Å; D326-K328 IonicContact OD2-NZ 2.91Å; D326-K328 PolarHBondContact OD2-NZ 3.1Å; K328-K330 HydrophobicContact CD-CB 4.48Å; K328-K330 HydrophobicContact CG-CB 4.24Å; K328-K330 PolarHBondContact O-N 2.77Å; K328-K330 VanDerWaalsContact O-N 3.14Å; K328-N331 VanDerWaalsContact CE-ND2 3.34Å; K328-N331 WeakPolarHBondContact CE-ND2 3.37Å; K328-N331 WeakPolarHBondContact CE-OD1 3.46Å; K328-N331 HydrophobicContact CG-CB 4Å; K328-N331 PolarHBondContact O-N 3.27Å; K328-T368 HydrophobicContact CD-CG2 4.21Å; K328-T368 WeakPolarHBondContact CD-OG1 3.49Å; K328-T368 PolarHBondContact NZ-OG1 2.7Å; K328-Y371 HydrophobicContact CB-CD1 3.92Å; K328-Y371 HydrophobicContact CB-CD2 3.81Å; K328-Y371 HydrophobicContact CB-CE1 3.87Å; K328-Y371 HydrophobicContact CB-CE2 3.77Å; K328-Y371 HydrophobicContact CB-CG 3.89Å
329	S	98.5	Very high	97.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-58.5	-27.8	179.9	53.4	0	0	0	0	114	L281 H282 N331 Y371 E403	L281-S329 WeakPolarHBondContact CB-O 3.46Å; L281-S329 PolarHBondContact N-O 2.98Å; H282-S329 PolarHBondContact N-O 2.88Å; H282-S329 VanDerWaalsContact N-O 3.15Å; S329-N331 VanDerWaalsContact C-N 3.32Å; S329-N331 PolarHBondContact O-N 2.94Å; S329-Y371 PolarHBondContact OG-OH 3.28Å; S329-E403 WeakPolarHBondContact CB-OE1 3.45Å; S329-E403 VanDerWaalsContact CB-OE2 3.28Å; S329-E403 WeakPolarHBondContact CB-OE2 3.48Å; S329-E403 PolarHBondContact OG-OE1 2.95Å; S329-E403 PolarHBondContact OG-OE2 2.82Å
330	K	97.4	Very high	97.3	Very high	120 Å²	120	24.2 Å²	24.2	52%	0.522	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-70.7	-22	173.5	-70.9	-173.7	175.7	-174.1	0	114.7	S280 H282 K328	S280-K330 WeakPolarHBondContact CB-O 3.14Å; H282-K330 HydrophobicContact CB-CG 3.63Å; H282-K330 VanDerWaalsContact CD2-CE 3.49Å; H282-K330 WeakPolarHBondContact CD2-CE 3.34Å; H282-K330 WeakPolarHBondContact NE2-CE 3.4Å; K328-K330 HydrophobicContact CD-CB 4.48Å; K328-K330 HydrophobicContact CG-CB 4.24Å; K328-K330 PolarHBondContact O-N 2.77Å; K328-K330 VanDerWaalsContact O-N 3.14Å
331	N	97.9	Very high	97.4	Very high	12 Å²	12	22.9 Å²	22.9	6%	0.064	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-102.4	14.6	-179.1	-72.6	7.4	0	0	0	112.5	D326 K328 S329 A343 D344	D326-N331 PolarHBondContact O-ND2 3.25Å; D326-N331 PolarHBondContact OD2-ND2 2.75Å; K328-N331 VanDerWaalsContact CE-ND2 3.34Å; K328-N331 WeakPolarHBondContact CE-ND2 3.37Å; K328-N331 WeakPolarHBondContact CE-OD1 3.46Å; K328-N331 HydrophobicContact CG-CB 4Å; K328-N331 PolarHBondContact O-N 3.27Å; S329-N331 VanDerWaalsContact C-N 3.32Å; S329-N331 PolarHBondContact O-N 2.94Å; N331-A343 PolarHBondContact O-N 2.7Å; N331-D344 HydrophobicContact CB-CB 4.26Å; N331-D344 PolarHBondContact ND2-OD2 3.15Å; N331-D344 PolarHBondContact OD1-OD2 3.23Å
332	I	98.7	Very high	97.5	Very high	3 Å²	3	23 Å²	23	2%	0.015	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	124	172.8	-62.3	168.7	0	0	0	106.4	S280 L281 A302 C340 A341 V400	S280-I332 CarbonylContact C-O 3.57Å; S280-I332 VanDerWaalsContact CA-O 3.28Å; S280-I332 WeakPolarHBondContact CA-O 3.46Å; L281-I332 HydrophobicContact CB-CB 4.09Å; L281-I332 HydrophobicContact CB-CG2 4.17Å; L281-I332 HydrophobicContact CD2-CB 4.4Å; L281-I332 HydrophobicContact CD2-CD1 4.31Å; L281-I332 HydrophobicContact CD2-CG2 4.24Å; L281-I332 PolarHBondContact N-O 3.31Å; A302-I332 HydrophobicContact CB-CD1 4.43Å; A302-I332 HydrophobicContact CB-CG2 4.42Å; I332-C340 HydrophobicContact CG2-CB 3.67Å; I332-A341 CarbonylContact C-O 3.55Å; I332-A341 WeakPolarHBondContact CA-O 3.45Å; I332-V400 HydrophobicContact CD1-CG1 3.77Å; I332-V400 HydrophobicContact CD1-CG2 4.39Å
333	I	98.4	Very high	97.5	Very high	30 Å²	30	23.4 Å²	23.4	15%	0.154	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.5	-179	-54.7	-56.9	0	0	0	109.3	L253 H276 G279 C340 A341 A343	L253-I333 HydrophobicContact CD1-CG1 4.36Å; L253-I333 HydrophobicContact CD2-CG1 4.39Å; H276-I333 HydrophobicContact CB-CG2 3.61Å; G279-I333 WeakPolarHBondContact O-CG2 3.49Å; I333-C340 CarbonylContact O-C 3.49Å; I333-C340 VanDerWaalsContact O-CA 3.29Å; I333-C340 WeakPolarHBondContact O-CA 3.41Å; I333-A341 PolarHBondContact N-O 3.4Å; I333-A341 PolarHBondContact O-N 2.86Å; I333-A343 HydrophobicContact CG1-CB 3.9Å
334	V	98.6	Very high	97.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123.4	174.5	-176.1	0	0	0	0	108.4	N278 G279 L281 F284 L298	N278-V334 HydrophobicContact CB-CB 4Å; N278-V334 HydrophobicContact CB-CG1 4.16Å; N278-V334 WeakPolarHBondContact CB-O 3.42Å; G279-V334 PolarHBondContact O-N 3.38Å; L281-V334 HydrophobicContact CB-CG2 4.09Å; L281-V334 HydrophobicContact CD1-CG2 3.87Å; F284-V334 HydrophobicContact CB-CB 4.3Å; F284-V334 HydrophobicContact CB-CG2 3.79Å; F284-V334 HydrophobicContact CD1-CG1 4.41Å; F284-V334 HydrophobicContact CD1-CG2 4.28Å; F284-V334 HydrophobicContact CD2-CB 4.18Å; F284-V334 HydrophobicContact CD2-CG1 3.86Å; F284-V334 HydrophobicContact CD2-CG2 4.42Å; F284-V334 HydrophobicContact CE2-CG1 3.98Å; F284-V334 HydrophobicContact CG-CB 4.18Å; F284-V334 HydrophobicContact CG-CG1 4.07Å; F284-V334 HydrophobicContact CG-CG2 3.91Å; F284-V334 HydrophobicContact CZ-CG1 4.33Å; L298-V334 HydrophobicContact CD2-CG1 4.08Å; L298-V334 HydrophobicContact CD2-CG2 4.14Å
335	K	97.4	Very high	97.2	Very high	33 Å²	33	24.6 Å²	24.6	14%	0.143	13%	0.134	C	C	.	.			trans	-87.6	177.4	173.9	-52.6	-172.8	176.6	-179.8	0	110.2	E250 H276 N278 G338 I339 A341	E250-K335 PolarHBondContact O-NZ 3.02Å; H276-K335 WeakPolarHBondContact NE2-CE 3.48Å; N278-K335 PolarHBondContact ND2-O 3.4Å; N278-K335 VanDerWaalsContact ND2-O 3.09Å; K335-G338 PolarHBondContact O-N 2.99Å; K335-I339 HydrophobicContact CB-CB 4.25Å; K335-I339 WeakPolarHBondContact CB-O 3.45Å; K335-I339 HydrophobicContact CD-CG2 4.39Å; K335-I339 WeakPolarHBondContact CG-O 3.46Å; K335-I339 PolarHBondContact N-O 2.94Å; K335-A341 VanDerWaalsContact CE-CB 3.44Å
336	N	93.9	Very high	97.1	Very high	125 Å²	125	23.5 Å²	23.5	67%	0.668	13%	0.132	S	C	*	.	G	3₁₀ helix	trans	-58.5	143.1	168.6	-67.4	-12.8	0	0	0	110.3	G338	N336-G338 VanDerWaalsContact C-N 3.34Å; N336-G338 PolarHBondContact O-N 2.82Å
337	G	92.9	Very high	97	Very high	50 Å²	50	24.3 Å²	24.3	52%	0.515	14%	0.136	S	C	.	.	G	3₁₀ helix	trans	76.3	12.6	-179.3	0	0	0	0	0	115.6	R297	R297-G337 WeakPolarHBondContact CD-O 3.5Å
338	G	94.7	Very high	96.8	Very high	5 Å²	5	24.1 Å²	24.1	5%	0.052	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	75.6	25.5	175.5	0	0	0	0	0	114.2	R297 K335 N336	R297-G338 WeakPolarHBondContact CG-O 3.44Å; K335-G338 PolarHBondContact O-N 2.99Å; N336-G338 VanDerWaalsContact C-N 3.34Å; N336-G338 PolarHBondContact O-N 2.82Å
339	I	98	Very high	96.7	Very high	28 Å²	28	22.7 Å²	22.7	14%	0.144	13%	0.129	C	C	.	.			trans	-89.7	123.9	175.7	-55.5	-59.4	0	0	0	109.4	E250 N251 R297 T301 K335	E250-I339 HydrophobicContact CG-CG2 4.22Å; N251-I339 WeakPolarHBondContact ND2-CG2 3.37Å; R297-I339 HydrophobicContact CG-CD1 4.21Å; T301-I339 HydrophobicContact CG2-CB 4.46Å; T301-I339 HydrophobicContact CG2-CD1 3.71Å; T301-I339 HydrophobicContact CG2-CG2 4.03Å; K335-I339 HydrophobicContact CB-CB 4.25Å; K335-I339 WeakPolarHBondContact CB-O 3.45Å; K335-I339 HydrophobicContact CD-CG2 4.39Å; K335-I339 WeakPolarHBondContact CG-O 3.46Å; K335-I339 PolarHBondContact N-O 2.94Å
340	C	98.7	Very high	96.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	149.7	175.6	-71.4	0	0	0	0	112.5	N251 L298 T301 A302 I332 I333	N251-C340 VanDerWaalsContact CA-O 3.27Å; N251-C340 WeakPolarHBondContact CA-O 3.44Å; N251-C340 WeakPolarHBondContact CB-O 3.34Å; N251-C340 PolarHBondContact ND2-O 2.88Å; L298-C340 VanDerWaalsContact CD2-SG 3.5Å; T301-C340 WeakPolarHBondContact OG1-CB 3.46Å; T301-C340 PolarHBondContact OG1-N 3.4Å; A302-C340 HydrophobicContact CB-CB 3.86Å; I332-C340 HydrophobicContact CG2-CB 3.67Å; I333-C340 CarbonylContact O-C 3.49Å; I333-C340 VanDerWaalsContact O-CA 3.29Å; I333-C340 WeakPolarHBondContact O-CA 3.41Å
341	A	98.7	Very high	96.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	133.5	166.9	0	0	0	0	0	111.9	N251 I332 I333 K335	N251-A341 WeakPolarHBondContact O-CA 3.49Å; I332-A341 CarbonylContact C-O 3.55Å; I332-A341 WeakPolarHBondContact CA-O 3.45Å; I333-A341 PolarHBondContact N-O 3.4Å; I333-A341 PolarHBondContact O-N 2.86Å; K335-A341 VanDerWaalsContact CE-CB 3.44Å
342	I	98.7	Very high	96.1	Very high	5 Å²	5	27 Å²	27	3%	0.026	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	138	177.3	-57.2	177.9	0	0	0	109.8	N251 I252 L253 G305 L306 L309 H324 F345	N251-I342 PolarHBondContact O-N 3.12Å; I252-I342 HydrophobicContact CD1-CB 4.07Å; L253-I342 WeakPolarHBondContact CB-O 3.24Å; L253-I342 PolarHBondContact N-O 3.3Å; G305-I342 VanDerWaalsContact C-CD1 3.5Å; L306-I342 HydrophobicContact CB-CD1 3.77Å; L306-I342 HydrophobicContact CD1-CD1 4.23Å; L309-I342 HydrophobicContact CD1-CB 4.36Å; L309-I342 HydrophobicContact CD1-CD1 3.83Å; L309-I342 HydrophobicContact CD1-CG2 4Å; H324-I342 VanDerWaalsContact CD2-CG2 3.49Å; H324-I342 WeakPolarHBondContact CD2-CG2 3.44Å; I342-F345 HydrophobicContact CB-CZ 4.43Å; I342-F345 HydrophobicContact CG2-CE1 3.9Å; I342-F345 HydrophobicContact CG2-CZ 4.09Å; I342-F345 WeakPolarHBondContact O-CZ 3.11Å
343	A	97.4	Very high	95.5	Very high	8 Å²	8	29.7 Å²	29.7	7%	0.066	17%	0.165	C	C	.	.			trans	-134.8	174.1	-178.7	0	0	0	0	0	111.2	L253 H324 N331 I333	L253-A343 HydrophobicContact CB-CB 3.96Å; L253-A343 HydrophobicContact CD2-CB 3.59Å; L253-A343 HydrophobicContact CG-CB 4.39Å; H324-A343 PolarHBondContact NE2-O 3.15Å; N331-A343 PolarHBondContact O-N 2.7Å; I333-A343 HydrophobicContact CG1-CB 3.9Å
344	D	95.3	Very high	94.8	Very high	26 Å²	26	37.3 Å²	37.3	14%	0.139	20%	0.2	C	C	.	.			trans	65.6	72.2	175.7	-160.9	10.3	0	0	0	114.8	K225 E238 H324 N331 G346	K225-D344 IonicContact NZ-OD1 3.86Å; K225-D344 PolarHBondContact NZ-OD1 2.86Å; E238-D344 WeakPolarHBondContact OE1-CA 3.46Å; H324-D344 PolarHBondContact CE1-O 3.36Å; H324-D344 PolarHBondContact NE2-O 3.21Å; N331-D344 HydrophobicContact CB-CB 4.26Å; N331-D344 PolarHBondContact ND2-OD2 3.15Å; N331-D344 PolarHBondContact OD1-OD2 3.23Å; D344-G346 VanDerWaalsContact C-N 3.33Å; D344-G346 PolarHBondContact O-N 3.25Å
345	F	95.9	Very high	94.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.221	C	C	.	.			trans	-90.1	13.1	-177.9	-57.5	-67.2	0	0	0	114.5	E238 I241 Y242 I252 L309 H324 I342 L347 S348	E238-F345 HydrophobicContact CG-CB 4.27Å; I241-F345 HydrophobicContact CB-CB 3.79Å; I241-F345 HydrophobicContact CB-CG 4.44Å; I241-F345 HydrophobicContact CG1-CB 4.32Å; I241-F345 HydrophobicContact CG2-CB 3.51Å; I241-F345 HydrophobicContact CG2-CD1 4.08Å; I241-F345 HydrophobicContact CG2-CD2 4.17Å; I241-F345 HydrophobicContact CG2-CG 3.66Å; Y242-F345 AromaticContact CD1-CD2 3.91Å; Y242-F345 HydrophobicContact CD1-CD2 3.91Å; Y242-F345 AromaticContact CD1-CE2 3.92Å; Y242-F345 HydrophobicContact CD1-CE2 3.92Å; Y242-F345 HydrophobicContact CD2-CD2 4.02Å; Y242-F345 AromaticContact CE1-CD2 3.55Å; Y242-F345 HydrophobicContact CE1-CD2 3.55Å; Y242-F345 AromaticContact CE1-CE2 3.32Å; Y242-F345 HydrophobicContact CE1-CE2 3.32Å; Y242-F345 AromaticContact CE2-CD2 3.6Å; Y242-F345 HydrophobicContact CE2-CD2 3.6Å; Y242-F345 HydrophobicContact CE2-CE2 4.19Å; Y242-F345 HydrophobicContact CG-CD2 4.16Å; Y242-F345 AromaticContact CZ-CD2 3.37Å; Y242-F345 AromaticContact CZ-CE2 3.46Å; Y242-F345 VanDerWaalsContact CZ-CE2 3.46Å; I252-F345 HydrophobicContact CD1-CZ 4.33Å; I252-F345 HydrophobicContact CG2-CE2 3.99Å; I252-F345 HydrophobicContact CG2-CZ 3.83Å; L309-F345 HydrophobicContact CD1-CE1 3.78Å; L309-F345 HydrophobicContact CD2-CE1 3.82Å; L309-F345 HydrophobicContact CD2-CZ 4.35Å; L309-F345 HydrophobicContact CG-CE1 4.45Å; H324-F345 AromaticContact CD2-CD1 3.64Å; H324-F345 AromaticContact CD2-CE1 3.6Å; H324-F345 AromaticContact NE2-CD1 3.92Å; H324-F345 AromaticContact NE2-CE1 3.98Å; I342-F345 HydrophobicContact CB-CZ 4.43Å; I342-F345 HydrophobicContact CG2-CE1 3.9Å; I342-F345 HydrophobicContact CG2-CZ 4.09Å; I342-F345 WeakPolarHBondContact O-CZ 3.11Å; F345-L347 PolarHBondContact O-N 3.37Å; F345-S348 WeakPolarHBondContact CA-OG 3.5Å; F345-S348 WeakPolarHBondContact O-CB 2.95Å; F345-S348 PolarHBondContact O-N 3.44Å; F345-S348 PolarHBondContact O-OG 3.26Å
346	G	93.8	Very high	93.7	Very high	6 Å²	6	40.4 Å²	40.4	6%	0.062	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.2	-175.5	0	0	0	0	0	114.9	D344	D344-G346 VanDerWaalsContact C-N 3.33Å; D344-G346 PolarHBondContact O-N 3.25Å
347	L	94.1	Very high	93.4	Very high	25 Å²	25	37.7 Å²	37.7	13%	0.131	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-2.6	177.6	-61.4	-178.9	0	0	0	114.2	Y209 R325 D326 F345 V366	Y209-L347 WeakPolarHBondContact OH-CD2 3.48Å; R325-L347 HydrophobicContact CB-CB 4.48Å; R325-L347 WeakPolarHBondContact CD-O 3.49Å; R325-L347 PolarHBondContact NH1-O 3.47Å; D326-L347 HydrophobicContact CB-CD1 3.95Å; F345-L347 PolarHBondContact O-N 3.37Å; L347-V366 HydrophobicContact CB-CG2 4.28Å; L347-V366 HydrophobicContact CD1-CB 4.21Å; L347-V366 HydrophobicContact CD1-CG2 4.02Å; L347-V366 HydrophobicContact CD2-CB 4.28Å; L347-V366 HydrophobicContact CD2-CG2 4.15Å; L347-V366 HydrophobicContact CG-CG2 4.38Å
348	S	96	Very high	93.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.201	C	C	.	.			trans	-70.3	151.6	-170.5	-60	0	0	0	0	112.7	R237 A323 H324 F345	R237-S348 VanDerWaalsContact CZ-O 3.27Å; R237-S348 PolarHBondContact NE-O 3.13Å; R237-S348 PolarHBondContact NH2-O 3.18Å; A323-S348 CarbonylContact O-C 3.38Å; A323-S348 WeakPolarHBondContact O-CA 3.34Å; A323-S348 VanDerWaalsContact O-CB 3.32Å; A323-S348 WeakPolarHBondContact O-CB 3.47Å; H324-S348 WeakPolarHBondContact CA-OG 3.18Å; H324-S348 WeakPolarHBondContact O-CA 3.3Å; H324-S348 PolarHBondContact O-OG 2.92Å; H324-S348 VanDerWaalsContact O-OG 3.08Å; F345-S348 WeakPolarHBondContact CA-OG 3.5Å; F345-S348 WeakPolarHBondContact O-CB 2.95Å; F345-S348 PolarHBondContact O-N 3.44Å; F345-S348 PolarHBondContact O-OG 3.26Å
349	V	95.3	Very high	93	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.7	-178.4	-64.9	0	0	0	0	111.1	I322 A323 R325 V358 I360 F386 Y389	I322-V349 VanDerWaalsContact CA-O 3.29Å; I322-V349 WeakPolarHBondContact CA-O 3.4Å; A323-V349 HydrophobicContact CB-CG2 3.87Å; A323-V349 PolarHBondContact N-O 3.1Å; A323-V349 PolarHBondContact O-N 3.14Å; R325-V349 HydrophobicContact CG-CG2 4.37Å; V349-V358 HydrophobicContact CB-CG1 3.54Å; V349-V358 HydrophobicContact CG1-CG1 3.93Å; V349-V358 HydrophobicContact CG2-CG1 4.08Å; V349-I360 HydrophobicContact CG1-CD1 3.63Å; V349-I360 HydrophobicContact CG1-CG1 3.7Å; V349-F386 HydrophobicContact CG2-CD2 4.44Å; V349-F386 HydrophobicContact CG2-CE2 4.13Å; V349-Y389 HydrophobicContact CG2-CD2 4.32Å; V349-Y389 HydrophobicContact CG2-CG 4.18Å
350	R	95.6	Very high	92.3	Very high	68 Å²	68	39.5 Å²	39.5	26%	0.257	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	141.4	174.9	-66.1	179	-64.5	-173.4	1.2	110.1	I241 P320 A321 I322 V358 D359	I241-R350 HydrophobicContact CD1-CG 3.71Å; P320-R350 HydrophobicContact CB-CB 4.28Å; P320-R350 HydrophobicContact CG-CB 4.26Å; P320-R350 HydrophobicContact CG-CG 4.09Å; A321-R350 WeakPolarHBondContact O-CA 3.21Å; I322-R350 HydrophobicContact CG1-CG 3.91Å; R350-V358 WeakPolarHBondContact O-CA 3.17Å; R350-D359 HydrophobicContact CB-CB 4.27Å; R350-D359 WeakPolarHBondContact CB-OD2 3.35Å; R350-D359 IonicContact CZ-OD2 3.2Å; R350-D359 PolarHBondContact N-OD1 3.2Å; R350-D359 IonicContact NE-OD2 3.94Å; R350-D359 PolarHBondContact NE-OD2 2.96Å; R350-D359 IonicContact NH2-OD2 2.65Å; R350-D359 PolarHBondContact NH2-OD2 3.23Å; R350-D359 PolarHBondContact O-N 3.45Å; R350-D359 VanDerWaalsContact O-N 3.07Å
351	Y	95	Very high	91.1	Very high	67 Å²	67	50.8 Å²	50.8	26%	0.263	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	124.1	166.1	-175.8	-123.2	0	0	0	109.9	P320 A321 F386	P320-Y351 VanDerWaalsContact CB-O 3.31Å; P320-Y351 WeakPolarHBondContact CB-O 3.16Å; A321-Y351 PolarHBondContact O-N 3.08Å; Y351-F386 HydrophobicContact CD2-CB 3.52Å; Y351-F386 HydrophobicContact CD2-CD1 4.37Å; Y351-F386 HydrophobicContact CD2-CD2 4.37Å; Y351-F386 AromaticContact CD2-CG 3.85Å; Y351-F386 HydrophobicContact CD2-CG 3.85Å; Y351-F386 HydrophobicContact CE2-CB 4.15Å; Y351-F386 HydrophobicContact CG-CB 4.14Å; Y351-F386 HydrophobicContact CG-CD1 4.14Å; Y351-F386 HydrophobicContact CG-CD2 4.41Å; Y351-F386 AromaticContact CG-CG 3.97Å; Y351-F386 HydrophobicContact CG-CG 3.97Å
352	M	90.9	Very high	89.5	Confident	86 Å²	86	53.5 Å²	53.5	42%	0.424	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	95.8	171.5	-63.4	-176.7	69.1	0	0	108.1	E354 S355 G356 T357 D359	M352-E354 PolarHBondContact O-N 3.17Å; M352-S355 VanDerWaalsContact CB-OG 3.24Å; M352-S355 WeakPolarHBondContact CB-OG 3.26Å; M352-S355 PolarHBondContact O-N 2.73Å; M352-S355 PolarHBondContact O-OG 3.49Å; M352-G356 WeakPolarHBondContact O-CA 3.27Å; M352-G356 PolarHBondContact O-N 3.01Å; M352-T357 PolarHBondContact N-O 3.31Å; M352-T357 PolarHBondContact O-N 2.87Å; M352-D359 HydrophobicContact CG-CB 3.95Å; M352-D359 HydrophobicContact SD-CB 3.83Å
353	S	86.5	Confident	88.8	Confident	60 Å²	60	57.8 Å²	57.8	42%	0.42	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-25.1	-174.4	46.9	0	0	0	0	113.9	E312	E312-S353 WeakPolarHBondContact OE1-CB 3.41Å; E312-S353 PolarHBondContact OE1-OG 3.09Å
354	E	84.4	Confident	87.8	Confident	190 Å²	190	58.8 Å²	58.8	89%	0.888	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-42.8	176.2	-63.4	177.3	175.7	0	0	112.9	M352	M352-E354 PolarHBondContact O-N 3.17Å
355	S	86.6	Confident	87.2	Confident	64 Å²	64	60.7 Å²	60.7	45%	0.448	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-14.7	179.9	57.1	0	0	0	0	113.2	M352 T357	M352-S355 VanDerWaalsContact CB-OG 3.24Å; M352-S355 WeakPolarHBondContact CB-OG 3.26Å; M352-S355 PolarHBondContact O-N 2.73Å; M352-S355 PolarHBondContact O-OG 3.49Å; S355-T357 PolarHBondContact O-N 3.31Å; S355-T357 PolarHBondContact OG-N 3.31Å; S355-T357 PolarHBondContact OG-OG1 3.29Å
356	G	85.6	Confident	86.9	Confident	34 Å²	34	62.1 Å²	62.1	35%	0.351	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	19.5	-170.9	0	0	0	0	0	113.3	M352	M352-G356 WeakPolarHBondContact O-CA 3.27Å; M352-G356 PolarHBondContact O-N 3.01Å
357	T	88.1	Confident	86.8	Confident	69 Å²	69	62.4 Å²	62.4	42%	0.423	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	170.6	-175.6	65.1	0	0	0	0	112.4	M352 S355	M352-T357 PolarHBondContact N-O 3.31Å; M352-T357 PolarHBondContact O-N 2.87Å; S355-T357 PolarHBondContact O-N 3.31Å; S355-T357 PolarHBondContact OG-N 3.31Å; S355-T357 PolarHBondContact OG-OG1 3.29Å
358	V	89.7	Confident	86.8	Confident	19 Å²	19	63.3 Å²	63.3	12%	0.115	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	144.4	167	-177.5	0	0	0	0	109.1	V349 R350 I360 F386 Y389	V349-V358 HydrophobicContact CB-CG1 3.54Å; V349-V358 HydrophobicContact CG1-CG1 3.93Å; V349-V358 HydrophobicContact CG2-CG1 4.08Å; R350-V358 WeakPolarHBondContact O-CA 3.17Å; V358-I360 VanDerWaalsContact C-N 3.29Å; V358-I360 PolarHBondContact O-N 2.65Å; V358-F386 HydrophobicContact CG2-CB 4.41Å; V358-F386 HydrophobicContact CG2-CD2 4.33Å; V358-Y389 HydrophobicContact CG2-CD2 4.42Å; V358-Y389 HydrophobicContact CG2-CE2 4Å
359	D	89.4	Confident	86.8	Confident	37 Å²	37	65.9 Å²	65.9	20%	0.198	34%	0.34	C	S	.	.	S	Bend	trans	-73.4	-11.4	-171.5	71	-29.3	0	0	0	115.8	R237 R350 M352	R237-D359 IonicContact CZ-OD1 2.83Å; R237-D359 IonicContact CZ-OD2 3.61Å; R237-D359 VanDerWaalsContact CZ-OD2 3.23Å; R237-D359 IonicContact NH1-OD1 3.3Å; R237-D359 IonicContact NH1-OD2 3.6Å; R237-D359 PolarHBondContact NH1-OD2 2.7Å; R237-D359 VanDerWaalsContact NH2-CG 3.25Å; R237-D359 IonicContact NH2-OD1 3.51Å; R237-D359 PolarHBondContact NH2-OD1 3.29Å; R237-D359 IonicContact NH2-OD2 2.77Å; R237-D359 PolarHBondContact NH2-OD2 3.21Å; R350-D359 HydrophobicContact CB-CB 4.27Å; R350-D359 WeakPolarHBondContact CB-OD2 3.35Å; R350-D359 IonicContact CZ-OD2 3.2Å; R350-D359 PolarHBondContact N-OD1 3.2Å; R350-D359 IonicContact NE-OD2 3.94Å; R350-D359 PolarHBondContact NE-OD2 2.96Å; R350-D359 IonicContact NH2-OD2 2.65Å; R350-D359 PolarHBondContact NH2-OD2 3.23Å; R350-D359 PolarHBondContact O-N 3.45Å; R350-D359 VanDerWaalsContact O-N 3.07Å; M352-D359 HydrophobicContact CG-CB 3.95Å; M352-D359 HydrophobicContact SD-CB 3.83Å
360	I	82.3	Confident	87	Confident	64 Å²	64	66.5 Å²	66.5	33%	0.328	34%	0.343	S	S	.	.	S	Bend	trans	-129.1	158.4	177.7	61.9	168.9	0	0	0	111.8	V349 V358 P362	V349-I360 HydrophobicContact CG1-CD1 3.63Å; V349-I360 HydrophobicContact CG1-CG1 3.7Å; V358-I360 VanDerWaalsContact C-N 3.29Å; V358-I360 PolarHBondContact O-N 2.65Å; I360-P362 WeakPolarHBondContact O-CD 3.3Å
361	R	73.2	Confident	87.1	Confident	237 Å²	237	64 Å²	64	89%	0.894	33%	0.333	S	S	*	.			trans	-56.3	125.3	175.6	-76.5	-168.4	-176.6	-172	2.2	109.9	N363	R361-N363 PolarHBondContact O-N 2.7Å
362	P	66.5	Low	87.2	Confident	58 Å²	58	61.1 Å²	61.1	38%	0.377	32%	0.322	S	S	.	.			trans	-69.6	106.4	-177.9	-16.4	29.1	0	0	0	111.2	I360 A383	I360-P362 WeakPolarHBondContact O-CD 3.3Å; P362-A383 HydrophobicContact CB-CB 3.33Å; P362-A383 HydrophobicContact CG-CB 4.05Å
363	N	83.5	Confident	87.6	Confident	94 Å²	94	57.1 Å²	57.1	50%	0.503	30%	0.303	S	S	.	.			trans	-106.6	96.6	153.7	176.4	1.3	0	0	0	106.8	R325 R361 R365 V366	R325-N363 PolarHBondContact NH2-O 3.28Å; R361-N363 PolarHBondContact O-N 2.7Å; N363-R365 VanDerWaalsContact C-N 3.28Å; N363-R365 PolarHBondContact O-N 3.31Å; N363-R365 PolarHBondContact OD1-N 3.14Å; N363-V366 HydrophobicContact CB-CG1 4.42Å
364	P	76	Confident	88.1	Confident	30 Å²	30	54.3 Å²	54.3	20%	0.195	28%	0.283	C	S	.	.			trans	-63.4	-33.1	-171.9	20.8	-29.4	0	0	0	113.6	R325 V366 V381	R325-P364 PolarHBondContact NH2-O 3.48Å; P364-V366 VanDerWaalsContact C-N 3.28Å; P364-V366 PolarHBondContact O-N 3.18Å; P364-V381 HydrophobicContact CB-CG1 3.16Å; P364-V381 HydrophobicContact CG-CG1 3.86Å
365	R	83.4	Confident	88.7	Confident	66 Å²	66	45.7 Å²	45.7	25%	0.249	24%	0.243	C	C	.	.			trans	-86.5	59.5	-168.6	-161.5	179	-172.7	-171.9	5.8	112.3	N363 E379 F427	N363-R365 VanDerWaalsContact C-N 3.28Å; N363-R365 PolarHBondContact O-N 3.31Å; N363-R365 PolarHBondContact OD1-N 3.14Å; R365-E379 IonicContact CZ-OE1 2.97Å; R365-E379 IonicContact NE-OE1 2.68Å; R365-E379 IonicContact NH1-OE1 3.29Å; R365-E379 PolarHBondContact NH1-OE1 3.39Å; R365-E379 IonicContact NH2-OE1 2.78Å; R365-F427 HydrophobicContact CG-CD1 4.04Å; R365-F427 HydrophobicContact CG-CE1 3.33Å; R365-F427 HydrophobicContact CG-CZ 3.66Å; R365-F427 VanDerWaalsContact NE-CE1 3.34Å; R365-F427 VanDerWaalsContact NH2-CG 3.28Å
366	V	88.4	Confident	89.2	Confident	29 Å²	29	43.3 Å²	43.3	18%	0.176	23%	0.225	C	C	.	.			trans	-124.9	160.4	174.7	-52.5	0	0	0	0	110.5	R325 L347 N363 P364 M372	R325-V366 VanDerWaalsContact CZ-CG2 3.44Å; L347-V366 HydrophobicContact CB-CG2 4.28Å; L347-V366 HydrophobicContact CD1-CB 4.21Å; L347-V366 HydrophobicContact CD1-CG2 4.02Å; L347-V366 HydrophobicContact CD2-CB 4.28Å; L347-V366 HydrophobicContact CD2-CG2 4.15Å; L347-V366 HydrophobicContact CG-CG2 4.38Å; N363-V366 HydrophobicContact CB-CG1 4.42Å; P364-V366 VanDerWaalsContact C-N 3.28Å; P364-V366 PolarHBondContact O-N 3.18Å; V366-M372 VanDerWaalsContact C-CE 3.46Å; V366-M372 WeakPolarHBondContact O-CE 3.32Å
367	G	91.4	Very high	89.7	Confident	13 Å²	13	41.7 Å²	41.7	13%	0.134	21%	0.209	C	C	.	.	S	Bend	trans	107.1	-169.7	-177.2	0	0	0	0	0	112.4	D326 K369 M372	D326-G367 WeakPolarHBondContact OD1-CA 3.4Å; G367-K369 PolarHBondContact O-N 3.06Å; G367-M372 VanDerWaalsContact O-CE 3.25Å; G367-M372 WeakPolarHBondContact O-CE 3.39Å
368	T	95	Very high	90	Very high	43 Å²	43	41.2 Å²	41.2	26%	0.264	20%	0.204	S	C	.	.			trans	-85.8	111.7	-177	-54.9	0	0	0	0	110.3	D326 K328 R370 Y371 M372	D326-T368 VanDerWaalsContact OD1-CB 3.3Å; D326-T368 WeakPolarHBondContact OD1-CB 2.87Å; D326-T368 PolarHBondContact OD1-N 3.02Å; D326-T368 PolarHBondContact OD1-OG1 3.49Å; K328-T368 HydrophobicContact CD-CG2 4.21Å; K328-T368 WeakPolarHBondContact CD-OG1 3.49Å; K328-T368 PolarHBondContact NZ-OG1 2.7Å; T368-R370 PolarHBondContact O-N 2.99Å; T368-Y371 HydrophobicContact CG2-CD2 3.91Å; T368-Y371 HydrophobicContact CG2-CE2 4.47Å; T368-Y371 PolarHBondContact O-N 3.31Å; T368-M372 PolarHBondContact O-N 2.63Å
369	K	96.8	Very high	90.2	Very high	54 Å²	54	45.8 Å²	45.8	24%	0.235	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-47.4	-42.7	-172.7	-54	159.1	-162.9	145.7	0	113.7	G367 Y371 M372 D424 P425 F427 M430	G367-K369 PolarHBondContact O-N 3.06Å; K369-Y371 PolarHBondContact O-N 2.77Å; K369-M372 HydrophobicContact CG-CE 4.44Å; K369-M372 WeakPolarHBondContact O-CB 3.45Å; K369-M372 PolarHBondContact O-N 2.76Å; K369-M372 VanDerWaalsContact O-N 3.14Å; K369-D424 IonicContact NZ-OD1 3.54Å; K369-D424 PolarHBondContact NZ-OD1 3.28Å; K369-D424 IonicContact NZ-OD2 3.23Å; K369-P425 WeakPolarHBondContact CD-O 3.37Å; K369-P425 PolarHBondContact NZ-O 3.41Å; K369-P425 VanDerWaalsContact NZ-O 3.15Å; K369-F427 HydrophobicContact CD-CD2 4.5Å; K369-F427 HydrophobicContact CG-CD1 4.11Å; K369-F427 HydrophobicContact CG-CE1 3.99Å; K369-F427 HydrophobicContact CG-CE2 4.41Å; K369-F427 HydrophobicContact CG-CG 4.39Å; K369-F427 HydrophobicContact CG-CZ 4.14Å; K369-M430 HydrophobicContact CB-CG 4.29Å
370	R	98	Very high	90.4	Very high	15 Å²	15	48.7 Å²	48.7	6%	0.057	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-56.5	-30.3	178.2	-176.4	-179.9	-67.4	-74.8	-2	114	T368 P416 Y417 P422 S423 P425 M430	T368-R370 PolarHBondContact O-N 2.99Å; R370-P416 WeakPolarHBondContact CD-O 3.38Å; R370-P416 WeakPolarHBondContact CG-O 3.22Å; R370-P416 PolarHBondContact NH1-O 2.69Å; R370-Y417 HydrophobicContact CG-CD2 4.23Å; R370-Y417 VanDerWaalsContact NH1-C 3.35Å; R370-Y417 PolarHBondContact NH1-O 2.92Å; R370-P422 PolarHBondContact NH2-O 3.3Å; R370-S423 PolarHBondContact NH2-O 2.92Å; R370-P425 HydrophobicContact CB-CG 4.35Å; R370-M430 WeakPolarHBondContact O-CE 3.31Å
371	Y	98.4	Very high	90.8	Very high	14 Å²	14	46.4 Å²	46.4	6%	0.055	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-102	-1.5	-177.1	-68.6	-98.6	0	0	0	113.1	K328 S329 T368 K369 S396 L399 V400 E403 P416	K328-Y371 HydrophobicContact CB-CD1 3.92Å; K328-Y371 HydrophobicContact CB-CD2 3.81Å; K328-Y371 HydrophobicContact CB-CE1 3.87Å; K328-Y371 HydrophobicContact CB-CE2 3.77Å; K328-Y371 HydrophobicContact CB-CG 3.89Å; S329-Y371 PolarHBondContact OG-OH 3.28Å; T368-Y371 HydrophobicContact CG2-CD2 3.91Å; T368-Y371 HydrophobicContact CG2-CE2 4.47Å; T368-Y371 PolarHBondContact O-N 3.31Å; K369-Y371 PolarHBondContact O-N 2.77Å; Y371-S396 WeakPolarHBondContact O-CB 3.24Å; Y371-S396 PolarHBondContact O-OG 3.33Å; Y371-L399 HydrophobicContact CD1-CB 3.98Å; Y371-L399 HydrophobicContact CD1-CD1 3.98Å; Y371-L399 HydrophobicContact CE1-CB 4.14Å; Y371-L399 HydrophobicContact CG-CD1 4.37Å; Y371-V400 HydrophobicContact CE1-CG2 4.18Å; Y371-E403 PolarHBondContact OH-OE1 3.45Å; Y371-P416 HydrophobicContact CE1-CG 3.87Å; Y371-P416 WeakPolarHBondContact OH-CD 3.49Å
372	M	98	Very high	91.6	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.039	21%	0.211	C	C	.	.			trans	-68.2	137.3	-177.3	-70.8	-174.6	179.9	0	0	111.7	V366 G367 T368 K369 V376 L377 Y395 F427	V366-M372 VanDerWaalsContact C-CE 3.46Å; V366-M372 WeakPolarHBondContact O-CE 3.32Å; G367-M372 VanDerWaalsContact O-CE 3.25Å; G367-M372 WeakPolarHBondContact O-CE 3.39Å; T368-M372 PolarHBondContact O-N 2.63Å; K369-M372 HydrophobicContact CG-CE 4.44Å; K369-M372 WeakPolarHBondContact O-CB 3.45Å; K369-M372 PolarHBondContact O-N 2.76Å; K369-M372 VanDerWaalsContact O-N 3.14Å; M372-V376 HydrophobicContact CB-CB 4.31Å; M372-V376 HydrophobicContact CB-CG1 4.24Å; M372-V376 HydrophobicContact CG-CG1 4.14Å; M372-V376 HydrophobicContact SD-CG1 3.88Å; M372-L377 HydrophobicContact CB-CD1 4.41Å; M372-L377 HydrophobicContact CB-CD2 3.8Å; M372-L377 HydrophobicContact CB-CG 3.77Å; M372-L377 HydrophobicContact SD-CD2 4.11Å; M372-Y395 WeakPolarHBondContact O-CE1 3.42Å; M372-F427 HydrophobicContact CE-CE1 3.59Å; M372-F427 HydrophobicContact CE-CZ 4.09Å; M372-F427 HydrophobicContact SD-CD1 4.05Å; M372-F427 HydrophobicContact SD-CE1 3.47Å; M372-F427 WeakPolarHBondContact SD-CE1 3.21Å
373	A	97.9	Very high	92.5	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.008	20%	0.201	C	C	.	.			trans	-66.5	154.6	174.4	0	0	0	0	0	111.6	E375 V376 L377 A392 Y395	A373-E375 VanDerWaalsContact C-N 3.27Å; A373-E375 WeakPolarHBondContact CB-OE1 3.36Å; A373-E375 WeakPolarHBondContact CB-OE2 3.2Å; A373-E375 PolarHBondContact O-N 3.23Å; A373-V376 HydrophobicContact CB-CG2 4.21Å; A373-V376 WeakPolarHBondContact O-CA 3.3Å; A373-V376 WeakPolarHBondContact O-CB 3.42Å; A373-V376 PolarHBondContact O-N 3.19Å; A373-L377 PolarHBondContact O-N 2.71Å; A373-A392 HydrophobicContact CB-CB 4.02Å; A373-Y395 HydrophobicContact CB-CD1 3.76Å; A373-Y395 HydrophobicContact CB-CD2 4.44Å; A373-Y395 HydrophobicContact CB-CE1 4.48Å; A373-Y395 HydrophobicContact CB-CG 3.74Å
374	P	97.7	Very high	92.6	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-51.7	-45.1	-178.5	-22.2	27.2	0	0	0	113.1	V376 L377 D378 Y395 V434 C435 Q466	P374-V376 PolarHBondContact O-N 3.21Å; P374-L377 PolarHBondContact O-N 3.31Å; P374-L377 VanDerWaalsContact O-N 3.09Å; P374-D378 PolarHBondContact O-N 3.4Å; P374-Y395 HydrophobicContact CG-CD2 4.49Å; P374-Y395 HydrophobicContact CG-CE2 4.15Å; P374-V434 HydrophobicContact CB-CG1 4.2Å; P374-V434 HydrophobicContact CG-CG1 3.77Å; P374-C435 VanDerWaalsContact CA-SG 3.57Å; P374-C435 PolarHBondContact O-SG 3.36Å; P374-Q466 VanDerWaalsContact CB-NE2 3.3Å
375	E	96.8	Very high	93.2	Very high	10 Å²	10	41.1 Å²	41.1	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-67.8	-18.6	-179.8	71.4	-80.9	-166.2	0	0	114	A373 D378 E379 T380 V381 P468 R471	A373-E375 VanDerWaalsContact C-N 3.27Å; A373-E375 WeakPolarHBondContact CB-OE1 3.36Å; A373-E375 WeakPolarHBondContact CB-OE2 3.2Å; A373-E375 PolarHBondContact O-N 3.23Å; E375-D378 WeakPolarHBondContact CA-OD1 3.45Å; E375-E379 PolarHBondContact O-N 3.31Å; E375-T380 WeakPolarHBondContact CA-OG1 3.48Å; E375-T380 WeakPolarHBondContact CB-OG1 3.3Å; E375-T380 PolarHBondContact O-N 3.04Å; E375-V381 HydrophobicContact CB-CB 4.38Å; E375-V381 HydrophobicContact CG-CB 4.01Å; E375-V381 HydrophobicContact CG-CG2 4.26Å; E375-V381 WeakPolarHBondContact O-CB 3.38Å; E375-V381 PolarHBondContact O-N 3.37Å; E375-P468 HydrophobicContact CB-CG 4.36Å; E375-P468 HydrophobicContact CG-CG 4.03Å; E375-R471 IonicContact OE1-CZ 3.52Å; E375-R471 IonicContact OE1-NH1 3.51Å; E375-R471 PolarHBondContact OE1-NH1 3.11Å; E375-R471 IonicContact OE1-NH2 2.75Å; E375-R471 PolarHBondContact OE1-NH2 3.28Å; E375-R471 IonicContact OE2-CZ 3.92Å; E375-R471 IonicContact OE2-NH1 3.5Å; E375-R471 PolarHBondContact OE2-NH1 3.38Å; E375-R471 IonicContact OE2-NH2 2.72Å; E375-R471 PolarHBondContact OE2-NH2 3.14Å
376	V	96.6	Very high	93.7	Very high	13 Å²	13	38.5 Å²	38.5	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-86.1	-35.1	173.7	-179.6	0	0	0	0	110.1	M372 A373 P374 A392	M372-V376 HydrophobicContact CB-CB 4.31Å; M372-V376 HydrophobicContact CB-CG1 4.24Å; M372-V376 HydrophobicContact CG-CG1 4.14Å; M372-V376 HydrophobicContact SD-CG1 3.88Å; A373-V376 HydrophobicContact CB-CG2 4.21Å; A373-V376 WeakPolarHBondContact O-CA 3.3Å; A373-V376 WeakPolarHBondContact O-CB 3.42Å; A373-V376 PolarHBondContact O-N 3.19Å; P374-V376 PolarHBondContact O-N 3.21Å; V376-A392 HydrophobicContact CG2-CB 3.99Å
377	L	96.5	Very high	94.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-73.5	-36.5	179.2	-72.1	169.5	0	0	0	113	M372 A373 P374 F427 M430 R431 V434	M372-L377 HydrophobicContact CB-CD1 4.41Å; M372-L377 HydrophobicContact CB-CD2 3.8Å; M372-L377 HydrophobicContact CB-CG 3.77Å; M372-L377 HydrophobicContact SD-CD2 4.11Å; A373-L377 PolarHBondContact O-N 2.71Å; P374-L377 PolarHBondContact O-N 3.31Å; P374-L377 VanDerWaalsContact O-N 3.09Å; L377-F427 HydrophobicContact CD2-CD1 4.31Å; L377-M430 HydrophobicContact CD1-CB 3.98Å; L377-M430 HydrophobicContact CD2-CB 3.61Å; L377-M430 HydrophobicContact CG-CB 4.46Å; L377-R431 HydrophobicContact CB-CB 4.31Å; L377-V434 HydrophobicContact CD1-CB 3.87Å; L377-V434 HydrophobicContact CD1-CG1 4.02Å; L377-V434 HydrophobicContact CD1-CG2 4.22Å
378	D	94.3	Very high	94.2	Very high	58 Å²	58	40.6 Å²	40.6	31%	0.31	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	2.1	177.8	68.1	17.1	0	0	0	113.9	P374 E375 T380 R431	P374-D378 PolarHBondContact O-N 3.4Å; E375-D378 WeakPolarHBondContact CA-OD1 3.45Å; D378-T380 HydrophobicContact CB-CG2 4.48Å; D378-T380 PolarHBondContact O-N 3.05Å; D378-T380 VanDerWaalsContact OD1-CB 3.28Å; D378-T380 WeakPolarHBondContact OD1-CB 3.36Å; D378-T380 VanDerWaalsContact OD1-CG2 3.25Å; D378-T380 WeakPolarHBondContact OD1-CG2 3.47Å; D378-T380 PolarHBondContact OD1-N 2.65Å; D378-T380 PolarHBondContact OD1-OG1 3.37Å; D378-R431 HydrophobicContact CB-CG 4.45Å
379	E	93.3	Very high	94.3	Very high	115 Å²	115	39 Å²	39	54%	0.537	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	24	177.2	-54.2	-178.5	-146.9	0	0	114.6	R365 E375	R365-E379 IonicContact CZ-OE1 2.97Å; R365-E379 IonicContact NE-OE1 2.68Å; R365-E379 IonicContact NH1-OE1 3.29Å; R365-E379 PolarHBondContact NH1-OE1 3.39Å; R365-E379 IonicContact NH2-OE1 2.78Å; E375-E379 PolarHBondContact O-N 3.31Å
380	T	94	Very high	94.3	Very high	98 Å²	98	40 Å²	40	60%	0.601	21%	0.205	S	C	*	.			trans	-88.6	-1.9	176.5	62.7	0	0	0	0	114.5	E375 D378 N382	E375-T380 WeakPolarHBondContact CA-OG1 3.48Å; E375-T380 WeakPolarHBondContact CB-OG1 3.3Å; E375-T380 PolarHBondContact O-N 3.04Å; D378-T380 HydrophobicContact CB-CG2 4.48Å; D378-T380 PolarHBondContact O-N 3.05Å; D378-T380 VanDerWaalsContact OD1-CB 3.28Å; D378-T380 WeakPolarHBondContact OD1-CB 3.36Å; D378-T380 VanDerWaalsContact OD1-CG2 3.25Å; D378-T380 WeakPolarHBondContact OD1-CG2 3.47Å; D378-T380 PolarHBondContact OD1-N 2.65Å; D378-T380 PolarHBondContact OD1-OG1 3.37Å; T380-N382 PolarHBondContact O-N 3.08Å
381	V	91.3	Very high	94.3	Very high	16 Å²	16	40.4 Å²	40.4	10%	0.097	21%	0.208	C	C	.	.			trans	-61.3	130.9	178.8	64.9	0	0	0	0	112.3	P364 E375 A383	P364-V381 HydrophobicContact CB-CG1 3.16Å; P364-V381 HydrophobicContact CG-CG1 3.86Å; E375-V381 HydrophobicContact CB-CB 4.38Å; E375-V381 HydrophobicContact CG-CB 4.01Å; E375-V381 HydrophobicContact CG-CG2 4.26Å; E375-V381 WeakPolarHBondContact O-CB 3.38Å; E375-V381 PolarHBondContact O-N 3.37Å; V381-A383 PolarHBondContact O-N 3.32Å
382	N	90.3	Very high	94.3	Very high	87 Å²	87	40.3 Å²	40.3	47%	0.465	21%	0.21	S	C	.	.			trans	-76.4	97.4	174.9	-175.5	-13.8	0	0	0	110.3	T380 H384 C385	T380-N382 PolarHBondContact O-N 3.08Å; N382-H384 PolarHBondContact O-N 3.46Å; N382-H384 VanDerWaalsContact O-N 3.13Å; N382-H384 PolarHBondContact OD1-N 3.4Å; N382-C385 HydrophobicContact CB-CB 3.99Å; N382-C385 PolarHBondContact O-N 3.48Å; N382-C385 PolarHBondContact OD1-N 3.07Å
383	A	85.8	Confident	94.3	Very high	18 Å²	18	40 Å²	40	15%	0.149	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-15.2	-175.8	0	0	0	0	0	114.2	P362 V381 Y389	P362-A383 HydrophobicContact CB-CB 3.33Å; P362-A383 HydrophobicContact CG-CB 4.05Å; V381-A383 PolarHBondContact O-N 3.32Å; A383-Y389 WeakPolarHBondContact CA-OH 3.44Å; A383-Y389 PolarHBondContact O-OH 2.6Å
384	H	84.3	Confident	94.4	Very high	155 Å²	155	40.1 Å²	40.1	72%	0.718	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.1	174.8	-57.7	-66.7	0	0	0	112.9	N382	N382-H384 PolarHBondContact O-N 3.46Å; N382-H384 VanDerWaalsContact O-N 3.13Å; N382-H384 PolarHBondContact OD1-N 3.4Å
385	C	90.1	Very high	94.4	Very high	48 Å²	48	40.1 Å²	40.1	32%	0.324	21%	0.209	S	C	.	.			trans	-103.4	110	179.7	-169.1	0	0	0	0	110.4	N382 E387 S388	N382-C385 HydrophobicContact CB-CB 3.99Å; N382-C385 PolarHBondContact O-N 3.48Å; N382-C385 PolarHBondContact OD1-N 3.07Å; C385-E387 PolarHBondContact O-N 2.88Å; C385-S388 WeakPolarHBondContact O-CB 3.43Å; C385-S388 PolarHBondContact O-N 3.45Å
386	F	93.7	Very high	94.5	Very high	12 Å²	12	40.1 Å²	40.1	5%	0.053	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-33	178.3	-179.5	-99.4	0	0	0	113	A321 A323 V349 Y351 V358 S388 Y389 R390	A321-F386 VanDerWaalsContact C-CZ 3.48Å; A321-F386 HydrophobicContact CB-CD1 4.37Å; A321-F386 HydrophobicContact CB-CE1 3.45Å; A321-F386 VanDerWaalsContact CB-CE1 3.45Å; A321-F386 HydrophobicContact CB-CZ 3.72Å; A321-F386 WeakPolarHBondContact O-CZ 3.3Å; A323-F386 HydrophobicContact CB-CE2 3.92Å; A323-F386 HydrophobicContact CB-CZ 3.98Å; V349-F386 HydrophobicContact CG2-CD2 4.44Å; V349-F386 HydrophobicContact CG2-CE2 4.13Å; Y351-F386 HydrophobicContact CD2-CB 3.52Å; Y351-F386 HydrophobicContact CD2-CD1 4.37Å; Y351-F386 HydrophobicContact CD2-CD2 4.37Å; Y351-F386 AromaticContact CD2-CG 3.85Å; Y351-F386 HydrophobicContact CD2-CG 3.85Å; Y351-F386 HydrophobicContact CE2-CB 4.15Å; Y351-F386 HydrophobicContact CG-CB 4.14Å; Y351-F386 HydrophobicContact CG-CD1 4.14Å; Y351-F386 HydrophobicContact CG-CD2 4.41Å; Y351-F386 AromaticContact CG-CG 3.97Å; Y351-F386 HydrophobicContact CG-CG 3.97Å; V358-F386 HydrophobicContact CG2-CB 4.41Å; V358-F386 HydrophobicContact CG2-CD2 4.33Å; F386-S388 PolarHBondContact O-N 2.8Å; F386-Y389 PolarHBondContact O-N 2.87Å; F386-Y389 VanDerWaalsContact O-N 3.1Å; F386-R390 HydrophobicContact CD1-CG 4.22Å; F386-R390 HydrophobicContact CE1-CG 3.65Å; F386-R390 HydrophobicContact CZ-CG 4.2Å; F386-R390 PolarHBondContact O-N 2.7Å
387	E	95.3	Very high	94.6	Very high	68 Å²	68	39.6 Å²	39.6	32%	0.318	21%	0.206	S	C	.	.	H	α-helix	trans	-59.9	-33	178.1	-176.4	58.3	-163.7	0	0	112.8	C385 Y389 R390 Q391	C385-E387 PolarHBondContact O-N 2.88Å; E387-Y389 VanDerWaalsContact C-N 3.27Å; E387-Y389 PolarHBondContact O-N 2.85Å; E387-R390 PolarHBondContact O-N 2.83Å; E387-R390 IonicContact OE2-CZ 2.85Å; E387-R390 IonicContact OE2-NE 3.7Å; E387-R390 PolarHBondContact OE2-NE 2.85Å; E387-R390 IonicContact OE2-NH2 3.55Å; E387-R390 PolarHBondContact OE2-NH2 2.87Å; E387-Q391 HydrophobicContact CG-CG 4.29Å; E387-Q391 WeakPolarHBondContact O-CG 3.29Å; E387-Q391 PolarHBondContact O-N 3.03Å; E387-Q391 PolarHBondContact OE1-NE2 3.14Å
388	S	94.8	Very high	94.7	Very high	18 Å²	18	39.5 Å²	39.5	13%	0.126	21%	0.206	C	C	.	.	H	α-helix	trans	-62	-36	177.2	-59.8	0	0	0	0	112	C385 F386 Q391 A392	C385-S388 WeakPolarHBondContact O-CB 3.43Å; C385-S388 PolarHBondContact O-N 3.45Å; F386-S388 PolarHBondContact O-N 2.8Å; S388-Q391 PolarHBondContact O-N 2.91Å; S388-A392 WeakPolarHBondContact O-CB 3.49Å; S388-A392 PolarHBondContact O-N 3.28Å
389	Y	95.9	Very high	94.9	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-70.5	-38.8	174.9	-61.5	-75.3	0	0	0	112.5	A323 R325 V349 V358 A383 F386 E387 Q391 A392 D393	A323-Y389 VanDerWaalsContact CB-CB 3.47Å; R325-Y389 HydrophobicContact CG-CD1 4.11Å; V349-Y389 HydrophobicContact CG2-CD2 4.32Å; V349-Y389 HydrophobicContact CG2-CG 4.18Å; V358-Y389 HydrophobicContact CG2-CD2 4.42Å; V358-Y389 HydrophobicContact CG2-CE2 4Å; A383-Y389 WeakPolarHBondContact CA-OH 3.44Å; A383-Y389 PolarHBondContact O-OH 2.6Å; F386-Y389 PolarHBondContact O-N 2.87Å; F386-Y389 VanDerWaalsContact O-N 3.1Å; E387-Y389 VanDerWaalsContact C-N 3.27Å; E387-Y389 PolarHBondContact O-N 2.85Å; Y389-Q391 VanDerWaalsContact C-N 3.34Å; Y389-A392 PolarHBondContact O-N 2.95Å; Y389-D393 PolarHBondContact O-N 2.87Å
390	R	97.3	Very high	95.2	Very high	75 Å²	75	31.4 Å²	31.4	28%	0.283	17%	0.166	S	C	.	.	H	α-helix	trans	-62.6	-42.3	174.4	-70.6	-161.4	-71.3	-157.3	-1.9	111.6	H310 F386 E387 A392 D393 M394	H310-R390 HydrophobicContact CB-CG 4.47Å; H310-R390 PolarHBondContact CE1-O 3.3Å; H310-R390 PolarHBondContact O-NH1 2.73Å; F386-R390 HydrophobicContact CD1-CG 4.22Å; F386-R390 HydrophobicContact CE1-CG 3.65Å; F386-R390 HydrophobicContact CZ-CG 4.2Å; F386-R390 PolarHBondContact O-N 2.7Å; E387-R390 PolarHBondContact O-N 2.83Å; E387-R390 IonicContact OE2-CZ 2.85Å; E387-R390 IonicContact OE2-NE 3.7Å; E387-R390 PolarHBondContact OE2-NE 2.85Å; E387-R390 IonicContact OE2-NH2 3.55Å; E387-R390 PolarHBondContact OE2-NH2 2.87Å; R390-A392 VanDerWaalsContact C-N 3.34Å; R390-D393 WeakPolarHBondContact O-CB 3.17Å; R390-D393 PolarHBondContact O-N 3.37Å; R390-M394 WeakPolarHBondContact O-CG 3.43Å; R390-M394 PolarHBondContact O-N 2.89Å; R390-M394 VanDerWaalsContact O-N 3.1Å
391	Q	98.2	Very high	95.4	Very high	25 Å²	25	26.8 Å²	26.8	12%	0.117	14%	0.138	C	C	.	.	H	α-helix	trans	-67.4	-35.4	178.5	-69.8	169.8	-12.5	0	0	112	E387 S388 Y389 M394 Y395 P468 R471	E387-Q391 HydrophobicContact CG-CG 4.29Å; E387-Q391 WeakPolarHBondContact O-CG 3.29Å; E387-Q391 PolarHBondContact O-N 3.03Å; E387-Q391 PolarHBondContact OE1-NE2 3.14Å; S388-Q391 PolarHBondContact O-N 2.91Å; Y389-Q391 VanDerWaalsContact C-N 3.34Å; Q391-M394 PolarHBondContact O-N 3.15Å; Q391-Y395 PolarHBondContact O-N 2.88Å; Q391-P468 HydrophobicContact CB-CB 3.89Å; Q391-P468 HydrophobicContact CG-CB 4.41Å; Q391-R471 VanDerWaalsContact C-NH1 3.33Å; Q391-R471 VanDerWaalsContact O-CD 3.31Å; Q391-R471 WeakPolarHBondContact O-CD 3.03Å; Q391-R471 PolarHBondContact O-NH1 2.72Å
392	A	98	Very high	95.7	Very high	11 Å²	11	26.6 Å²	26.6	9%	0.091	14%	0.136	C	C	.	.	H	α-helix	trans	-64.6	-44.2	172.6	0	0	0	0	0	111.7	A373 V376 S388 Y389 R390 M394 Y395 S396	A373-A392 HydrophobicContact CB-CB 4.02Å; V376-A392 HydrophobicContact CG2-CB 3.99Å; S388-A392 WeakPolarHBondContact O-CB 3.49Å; S388-A392 PolarHBondContact O-N 3.28Å; Y389-A392 PolarHBondContact O-N 2.95Å; R390-A392 VanDerWaalsContact C-N 3.34Å; A392-M394 PolarHBondContact O-N 3.27Å; A392-Y395 WeakPolarHBondContact O-CB 3.47Å; A392-Y395 PolarHBondContact O-N 3.41Å; A392-S396 PolarHBondContact O-N 2.72Å; A392-S396 VanDerWaalsContact O-N 3.12Å; A392-S396 PolarHBondContact O-OG 3.14Å
393	D	98.6	Very high	96.1	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.011	11%	0.114	C	C	.	.	H	α-helix	trans	-56.5	-39.2	173.7	-77	-16.1	0	0	0	111.9	L306 H310 A323 H324 R325 V327 Y389 R390 S396 F397	L306-D393 HydrophobicContact CD1-CB 4.43Å; H310-D393 IonicContact CD2-OD2 2.85Å; H310-D393 IonicContact CE1-OD2 3.49Å; H310-D393 IonicContact NE2-OD2 2.7Å; H310-D393 PolarHBondContact NE2-OD2 3.36Å; A323-D393 WeakPolarHBondContact CA-OD2 3.47Å; H324-D393 PolarHBondContact N-OD1 3.5Å; H324-D393 PolarHBondContact N-OD2 3.33Å; R325-D393 WeakPolarHBondContact CA-OD1 3.37Å; R325-D393 PolarHBondContact N-OD1 2.55Å; V327-D393 HydrophobicContact CG2-CB 4.13Å; Y389-D393 PolarHBondContact O-N 2.87Å; R390-D393 WeakPolarHBondContact O-CB 3.17Å; R390-D393 PolarHBondContact O-N 3.37Å; D393-S396 PolarHBondContact O-N 3.31Å; D393-F397 VanDerWaalsContact O-CB 3.31Å; D393-F397 WeakPolarHBondContact O-CB 3.37Å; D393-F397 PolarHBondContact O-N 3.23Å
394	M	98.8	Very high	96.7	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.02	11%	0.107	C	C	.	.	H	α-helix	trans	-68.4	-34.5	180	-68.8	-53.6	-52.6	0	0	113.1	L306 R390 Q391 A392 F397 G398 C463 R471 L472 A474 V477	L306-M394 HydrophobicContact CD2-SD 3.76Å; R390-M394 WeakPolarHBondContact O-CG 3.43Å; R390-M394 PolarHBondContact O-N 2.89Å; R390-M394 VanDerWaalsContact O-N 3.1Å; Q391-M394 PolarHBondContact O-N 3.15Å; A392-M394 PolarHBondContact O-N 3.27Å; M394-F397 HydrophobicContact CE-CD1 4.18Å; M394-F397 PolarHBondContact O-N 3.12Å; M394-G398 PolarHBondContact O-N 3.32Å; M394-C463 CarbonylContact C-O 3.6Å; M394-R471 HydrophobicContact CB-CB 4.48Å; M394-L472 WeakPolarHBondContact CE-O 3.49Å; M394-L472 WeakPolarHBondContact CG-O 3.49Å; M394-A474 HydrophobicContact CE-CB 4.47Å; M394-A474 VanDerWaalsContact SD-CA 3.54Å; M394-A474 HydrophobicContact SD-CB 3.64Å; M394-A474 PolarHBondContact SD-N 2.92Å; M394-V477 HydrophobicContact CE-CB 4.4Å; M394-V477 HydrophobicContact CE-CG2 3.62Å
395	Y	98.8	Very high	97.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.3	-51	170	170.4	-83.9	0	0	0	110.6	M372 A373 P374 Q391 A392 F397 G398 L399 Y417 V434 C463 W464	M372-Y395 WeakPolarHBondContact O-CE1 3.42Å; A373-Y395 HydrophobicContact CB-CD1 3.76Å; A373-Y395 HydrophobicContact CB-CD2 4.44Å; A373-Y395 HydrophobicContact CB-CE1 4.48Å; A373-Y395 HydrophobicContact CB-CG 3.74Å; P374-Y395 HydrophobicContact CG-CD2 4.49Å; P374-Y395 HydrophobicContact CG-CE2 4.15Å; Q391-Y395 PolarHBondContact O-N 2.88Å; A392-Y395 WeakPolarHBondContact O-CB 3.47Å; A392-Y395 PolarHBondContact O-N 3.41Å; Y395-F397 VanDerWaalsContact C-N 3.26Å; Y395-F397 PolarHBondContact O-N 2.69Å; Y395-G398 PolarHBondContact O-N 3.14Å; Y395-G398 VanDerWaalsContact O-N 3.08Å; Y395-L399 HydrophobicContact CD1-CD1 4.25Å; Y395-L399 HydrophobicContact CE1-CD1 3.63Å; Y395-L399 HydrophobicContact CE1-CG 4.28Å; Y395-L399 PolarHBondContact O-N 3.11Å; Y395-Y417 PolarHBondContact OH-OH 2.77Å; Y395-V434 WeakPolarHBondContact OH-CG1 3.17Å; Y395-C463 WeakPolarHBondContact CA-O 3.47Å; Y395-W464 HydrophobicContact CD2-CB 3.72Å; Y395-W464 HydrophobicContact CE2-CB 3.92Å; Y395-W464 HydrophobicContact CG-CB 4.48Å
396	S	98.8	Very high	97.5	Very high	10 Å²	10	12.4 Å²	12.4	7%	0.07	6%	0.06	C	C	.	.	H	α-helix	trans	-61.1	-38	179.7	-55	0	0	0	0	111.6	V327 Y371 A392 D393 L399 V400	V327-S396 WeakPolarHBondContact O-CB 3.29Å; Y371-S396 WeakPolarHBondContact O-CB 3.24Å; Y371-S396 PolarHBondContact O-OG 3.33Å; A392-S396 PolarHBondContact O-N 2.72Å; A392-S396 VanDerWaalsContact O-N 3.12Å; A392-S396 PolarHBondContact O-OG 3.14Å; D393-S396 PolarHBondContact O-N 3.31Å; S396-L399 WeakPolarHBondContact O-CB 3.38Å; S396-L399 PolarHBondContact O-N 2.65Å; S396-V400 PolarHBondContact O-N 2.97Å
397	F	98.8	Very high	97.7	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.009	6%	0.064	C	C	.	.	H	α-helix	trans	-67.7	-35	175.5	-168.6	-116	0	0	0	112.5	A302 L306 V327 D393 M394 Y395 L399 V400 L401 V477	A302-F397 HydrophobicContact CB-CE2 3.77Å; A302-F397 HydrophobicContact CB-CZ 3.99Å; L306-F397 HydrophobicContact CD2-CB 3.84Å; L306-F397 HydrophobicContact CD2-CD1 4.15Å; L306-F397 HydrophobicContact CD2-CD2 4.12Å; L306-F397 HydrophobicContact CD2-CG 3.76Å; V327-F397 HydrophobicContact CG1-CB 4.18Å; V327-F397 HydrophobicContact CG1-CD2 4.12Å; D393-F397 VanDerWaalsContact O-CB 3.31Å; D393-F397 WeakPolarHBondContact O-CB 3.37Å; D393-F397 PolarHBondContact O-N 3.23Å; M394-F397 HydrophobicContact CE-CD1 4.18Å; M394-F397 PolarHBondContact O-N 3.12Å; Y395-F397 VanDerWaalsContact C-N 3.26Å; Y395-F397 PolarHBondContact O-N 2.69Å; F397-L399 PolarHBondContact O-N 3.15Å; F397-V400 HydrophobicContact CD2-CB 4.4Å; F397-V400 WeakPolarHBondContact O-CB 3.24Å; F397-V400 PolarHBondContact O-N 2.61Å; F397-V400 VanDerWaalsContact O-N 3.12Å; F397-L401 HydrophobicContact CD1-CD1 3.89Å; F397-L401 HydrophobicContact CD1-CG 4.11Å; F397-L401 HydrophobicContact CE1-CD1 3.75Å; F397-L401 HydrophobicContact CE1-CD2 3.9Å; F397-L401 HydrophobicContact CE1-CG 3.85Å; F397-L401 HydrophobicContact CZ-CD2 3.87Å; F397-L401 HydrophobicContact CZ-CG 4.15Å; F397-L401 WeakPolarHBondContact O-CG 3.48Å; F397-L401 PolarHBondContact O-N 3.34Å; F397-V477 HydrophobicContact CE1-CG1 3.92Å
398	G	98.7	Very high	97.6	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-56.1	-39.5	170.9	0	0	0	0	0	112.7	M394 Y395 L401 W402	M394-G398 PolarHBondContact O-N 3.32Å; Y395-G398 PolarHBondContact O-N 3.14Å; Y395-G398 VanDerWaalsContact O-N 3.08Å; G398-L401 PolarHBondContact O-N 3.14Å; G398-W402 PolarHBondContact O-N 2.79Å
399	L	98.8	Very high	97.6	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-66.8	-39.8	174.9	-58.3	173.3	0	0	0	112.4	Y371 Y395 S396 F397 L401 W402 E403 P416 Y417 P441 W464	Y371-L399 HydrophobicContact CD1-CB 3.98Å; Y371-L399 HydrophobicContact CD1-CD1 3.98Å; Y371-L399 HydrophobicContact CE1-CB 4.14Å; Y371-L399 HydrophobicContact CG-CD1 4.37Å; Y395-L399 HydrophobicContact CD1-CD1 4.25Å; Y395-L399 HydrophobicContact CE1-CD1 3.63Å; Y395-L399 HydrophobicContact CE1-CG 4.28Å; Y395-L399 PolarHBondContact O-N 3.11Å; S396-L399 WeakPolarHBondContact O-CB 3.38Å; S396-L399 PolarHBondContact O-N 2.65Å; F397-L399 PolarHBondContact O-N 3.15Å; L399-L401 VanDerWaalsContact C-N 3.34Å; L399-W402 WeakPolarHBondContact O-CB 3.48Å; L399-W402 PolarHBondContact O-N 2.78Å; L399-E403 PolarHBondContact O-N 2.68Å; L399-E403 VanDerWaalsContact O-N 3.13Å; L399-P416 HydrophobicContact CB-CB 4.19Å; L399-P416 HydrophobicContact CB-CG 3.82Å; L399-P416 HydrophobicContact CD2-CB 4.14Å; L399-Y417 HydrophobicContact CD1-CE2 4.01Å; L399-Y417 HydrophobicContact CD2-CE2 3.78Å; L399-P441 HydrophobicContact CD2-CG 3.7Å; L399-W464 HydrophobicContact CD2-CE3 3.67Å; L399-W464 HydrophobicContact CD2-CZ3 3.99Å; L399-W464 HydrophobicContact CG-CE3 4.44Å
400	V	98.8	Very high	97.5	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.012	9%	0.092	C	C	.	.	H	α-helix	trans	-63.1	-41.9	174.3	174	0	0	0	0	111.4	L281 V327 I332 Y371 S396 F397 W402 E403 V404	L281-V400 HydrophobicContact CD2-CG1 3.68Å; V327-V400 HydrophobicContact CG1-CG2 4.34Å; I332-V400 HydrophobicContact CD1-CG1 3.77Å; I332-V400 HydrophobicContact CD1-CG2 4.39Å; Y371-V400 HydrophobicContact CE1-CG2 4.18Å; S396-V400 PolarHBondContact O-N 2.97Å; F397-V400 HydrophobicContact CD2-CB 4.4Å; F397-V400 WeakPolarHBondContact O-CB 3.24Å; F397-V400 PolarHBondContact O-N 2.61Å; F397-V400 VanDerWaalsContact O-N 3.12Å; V400-W402 VanDerWaalsContact C-N 3.27Å; V400-W402 PolarHBondContact O-N 3.29Å; V400-E403 WeakPolarHBondContact O-CB 3.21Å; V400-E403 PolarHBondContact O-N 3.27Å; V400-V404 WeakPolarHBondContact O-CG2 3.43Å; V400-V404 PolarHBondContact O-N 2.98Å; V400-V404 VanDerWaalsContact O-N 3.14Å
401	L	98.4	Very high	97.2	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-61.9	-38.3	176	-69.9	176.4	0	0	0	111.2	A299 F397 G398 L399 V404 A405 F456 L459 I460 V477	A299-L401 HydrophobicContact CB-CD2 3.71Å; F397-L401 HydrophobicContact CD1-CD1 3.89Å; F397-L401 HydrophobicContact CD1-CG 4.11Å; F397-L401 HydrophobicContact CE1-CD1 3.75Å; F397-L401 HydrophobicContact CE1-CD2 3.9Å; F397-L401 HydrophobicContact CE1-CG 3.85Å; F397-L401 HydrophobicContact CZ-CD2 3.87Å; F397-L401 HydrophobicContact CZ-CG 4.15Å; F397-L401 WeakPolarHBondContact O-CG 3.48Å; F397-L401 PolarHBondContact O-N 3.34Å; G398-L401 PolarHBondContact O-N 3.14Å; L399-L401 VanDerWaalsContact C-N 3.34Å; L401-V404 PolarHBondContact O-N 3.03Å; L401-A405 WeakPolarHBondContact O-CB 3.32Å; L401-A405 PolarHBondContact O-N 3.03Å; L401-F456 HydrophobicContact CB-CE1 3.88Å; L401-F456 HydrophobicContact CB-CZ 4.42Å; L401-F456 HydrophobicContact CD2-CE1 4.18Å; L401-F456 HydrophobicContact CD2-CZ 3.85Å; L401-F456 WeakPolarHBondContact O-CE1 3.42Å; L401-L459 HydrophobicContact CD1-CD2 3.42Å; L401-L459 VanDerWaalsContact CD1-CD2 3.42Å; L401-I460 HydrophobicContact CB-CD1 4.31Å; L401-I460 HydrophobicContact CB-CG1 3.7Å; L401-V477 HydrophobicContact CD1-CG1 4.2Å
402	W	98.2	Very high	97	Very high	13 Å²	13	18 Å²	18	5%	0.049	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-41.3	173.3	176.5	88.8	0	0	0	112.8	G398 L399 V400 V404 A405 S406 K414 P416 P441 P442 W447 I460 W464	G398-W402 PolarHBondContact O-N 2.79Å; L399-W402 WeakPolarHBondContact O-CB 3.48Å; L399-W402 PolarHBondContact O-N 2.78Å; V400-W402 VanDerWaalsContact C-N 3.27Å; V400-W402 PolarHBondContact O-N 3.29Å; W402-V404 VanDerWaalsContact C-N 3.3Å; W402-V404 PolarHBondContact O-N 3.44Å; W402-A405 PolarHBondContact O-N 3.25Å; W402-S406 VanDerWaalsContact CE2-OG 3.25Å; W402-S406 WeakPolarHBondContact O-CB 3.27Å; W402-S406 PolarHBondContact O-N 3.44Å; W402-S406 PolarHBondContact O-OG 3.36Å; W402-K414 HydrophobicContact CH2-CB 4.35Å; W402-P416 HydrophobicContact CE3-CG 4.31Å; W402-P441 HydrophobicContact CD2-CB 3.55Å; W402-P441 HydrophobicContact CD2-CG 4.32Å; W402-P441 VanDerWaalsContact CE2-CB 3.4Å; W402-P441 HydrophobicContact CE3-CB 4.07Å; W402-P441 HydrophobicContact CG-CB 3.91Å; W402-P441 HydrophobicContact CH2-CB 4.33Å; W402-P441 HydrophobicContact CZ2-CB 3.83Å; W402-P441 HydrophobicContact CZ3-CB 4.44Å; W402-P442 PolarHBondContact NE1-O 3.41Å; W402-W447 AromaticContact CD1-CH2 3.83Å; W402-I460 HydrophobicContact CB-CD1 4.21Å; W402-I460 HydrophobicContact CB-CG2 4.2Å; W402-W464 HydrophobicContact CB-CH2 4.02Å; W402-W464 HydrophobicContact CB-CZ3 3.6Å; W402-W464 AromaticContact CD1-CH2 3.68Å; W402-W464 AromaticContact CG-CH2 3.98Å; W402-W464 HydrophobicContact CG-CH2 3.98Å; W402-W464 AromaticContact CG-CZ3 3.94Å; W402-W464 HydrophobicContact CG-CZ3 3.94Å
403	E	98.3	Very high	96.9	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.009	12%	0.119	C	C	.	.	H	α-helix	trans	-59.2	-42.9	174.9	-65.5	174.8	-97.8	0	0	111.5	L285 S329 Y371 L399 V400 R407 Y413 P416	L285-E403 HydrophobicContact CD1-CB 3.99Å; S329-E403 WeakPolarHBondContact CB-OE1 3.45Å; S329-E403 VanDerWaalsContact CB-OE2 3.28Å; S329-E403 WeakPolarHBondContact CB-OE2 3.48Å; S329-E403 PolarHBondContact OG-OE1 2.95Å; S329-E403 PolarHBondContact OG-OE2 2.82Å; Y371-E403 PolarHBondContact OH-OE1 3.45Å; L399-E403 PolarHBondContact O-N 2.68Å; L399-E403 VanDerWaalsContact O-N 3.13Å; V400-E403 WeakPolarHBondContact O-CB 3.21Å; V400-E403 PolarHBondContact O-N 3.27Å; E403-R407 WeakPolarHBondContact O-CB 3.39Å; E403-R407 PolarHBondContact O-N 2.86Å; E403-Y413 HydrophobicContact CB-CE2 4.35Å; E403-Y413 PolarHBondContact OE2-OH 3.27Å; E403-P416 HydrophobicContact CG-CG 3.93Å
404	V	98	Very high	96.8	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-65.4	-48.9	177.9	173.6	0	0	0	0	110.9	L281 L285 I290 M295 V400 L401 W402 R407 F408	L281-V404 HydrophobicContact CD1-CG2 4.41Å; L281-V404 HydrophobicContact CD2-CG2 4.03Å; L285-V404 HydrophobicContact CD1-CG2 3.96Å; L285-V404 HydrophobicContact CD2-CG2 4.42Å; I290-V404 HydrophobicContact CD1-CG1 4.08Å; I290-V404 WeakPolarHBondContact CD1-O 3.29Å; M295-V404 HydrophobicContact CB-CG1 4.45Å; M295-V404 HydrophobicContact CG-CG1 3.66Å; V400-V404 WeakPolarHBondContact O-CG2 3.43Å; V400-V404 PolarHBondContact O-N 2.98Å; V400-V404 VanDerWaalsContact O-N 3.14Å; L401-V404 PolarHBondContact O-N 3.03Å; W402-V404 VanDerWaalsContact C-N 3.3Å; W402-V404 PolarHBondContact O-N 3.44Å; V404-R407 PolarHBondContact O-N 2.93Å; V404-F408 PolarHBondContact O-N 3.42Å; V404-F408 VanDerWaalsContact O-N 3.14Å
405	A	96.6	Very high	96.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.9	-43.2	-178.4	0	0	0	0	0	112.8	L401 W402 R407 F408 A409 W447 L453 F456 I460	L401-A405 WeakPolarHBondContact O-CB 3.32Å; L401-A405 PolarHBondContact O-N 3.03Å; W402-A405 PolarHBondContact O-N 3.25Å; A405-R407 PolarHBondContact O-N 3.44Å; A405-F408 PolarHBondContact O-N 3.33Å; A405-F408 VanDerWaalsContact O-N 3.17Å; A405-A409 WeakPolarHBondContact O-CB 3.23Å; A405-A409 PolarHBondContact O-N 2.92Å; A405-W447 HydrophobicContact CB-CE3 4.4Å; A405-W447 HydrophobicContact CB-CH2 3.37Å; A405-W447 HydrophobicContact CB-CZ2 4.09Å; A405-W447 HydrophobicContact CB-CZ3 3.55Å; A405-L453 HydrophobicContact CB-CD2 4.3Å; A405-F456 HydrophobicContact CB-CD1 3.59Å; A405-F456 HydrophobicContact CB-CE1 3.76Å; A405-F456 HydrophobicContact CB-CG 4.46Å; A405-I460 HydrophobicContact CB-CD1 3.92Å
406	S	95.8	Very high	96.7	Very high	6 Å²	6	23.6 Å²	23.6	4%	0.042	14%	0.139	C	C	.	.	H	α-helix	trans	-59.8	-39.7	176.9	-51.1	0	0	0	0	110.6	W402 F408 A409 G410 E411	W402-S406 VanDerWaalsContact CE2-OG 3.25Å; W402-S406 WeakPolarHBondContact O-CB 3.27Å; W402-S406 PolarHBondContact O-N 3.44Å; W402-S406 PolarHBondContact O-OG 3.36Å; S406-F408 PolarHBondContact O-N 2.92Å; S406-A409 PolarHBondContact O-N 2.96Å; S406-G410 PolarHBondContact O-N 2.88Å; S406-E411 WeakPolarHBondContact O-CB 3.4Å; S406-E411 PolarHBondContact O-N 3.15Å; S406-E411 VanDerWaalsContact O-N 3.1Å
407	R	96.2	Very high	96.6	Very high	38 Å²	38	23.4 Å²	23.4	14%	0.143	14%	0.137	C	C	.	.	H	α-helix	trans	-66	-38.9	177.8	-169.2	65.3	-167.2	95.7	-11.7	113.1	L285 N288 T289 I290 E403 V404 A405 G410	L285-R407 HydrophobicContact CB-CG 4.39Å; L285-R407 HydrophobicContact CD2-CB 4.02Å; L285-R407 HydrophobicContact CD2-CG 4.03Å; L285-R407 VanDerWaalsContact O-CD 3.23Å; L285-R407 WeakPolarHBondContact O-CD 3.43Å; L285-R407 PolarHBondContact O-NE 3.25Å; N288-R407 PolarHBondContact O-NE 2.94Å; N288-R407 PolarHBondContact O-NH2 2.79Å; T289-R407 VanDerWaalsContact CA-NH2 3.32Å; I290-R407 HydrophobicContact CD1-CB 4.11Å; I290-R407 HydrophobicContact CD1-CG 4.32Å; I290-R407 HydrophobicContact CG1-CB 4.34Å; I290-R407 HydrophobicContact CG1-CG 4.16Å; E403-R407 WeakPolarHBondContact O-CB 3.39Å; E403-R407 PolarHBondContact O-N 2.86Å; V404-R407 PolarHBondContact O-N 2.93Å; A405-R407 PolarHBondContact O-N 3.44Å; R407-G410 PolarHBondContact O-N 2.89Å
408	F	94.8	Very high	96.5	Very high	40 Å²	40	27.6 Å²	27.6	18%	0.175	16%	0.156	C	C	.	.	H	α-helix	trans	-66.3	-39	173	170.9	-117.7	0	0	0	112.1	I290 D291 R292 M295 V404 A405 S406 G410 L453	I290-F408 HydrophobicContact CD1-CB 4.07Å; I290-F408 HydrophobicContact CG1-CB 3.93Å; D291-F408 VanDerWaalsContact C-CD2 3.49Å; R292-F408 VanDerWaalsContact CA-CE2 3.5Å; R292-F408 HydrophobicContact CB-CE2 3.78Å; R292-F408 HydrophobicContact CB-CZ 3.79Å; R292-F408 HydrophobicContact CG-CZ 4.26Å; M295-F408 HydrophobicContact CB-CB 4.03Å; M295-F408 HydrophobicContact CB-CD2 4.48Å; M295-F408 HydrophobicContact CB-CG 4.17Å; M295-F408 HydrophobicContact CE-CD1 3.74Å; M295-F408 HydrophobicContact CE-CE1 4.04Å; M295-F408 HydrophobicContact CE-CG 4.26Å; M295-F408 HydrophobicContact CG-CB 3.87Å; M295-F408 HydrophobicContact CG-CG 4.23Å; M295-F408 HydrophobicContact SD-CB 3.48Å; M295-F408 WeakPolarHBondContact SD-CB 3.4Å; M295-F408 HydrophobicContact SD-CD1 3.26Å; M295-F408 WeakPolarHBondContact SD-CD1 3.23Å; M295-F408 HydrophobicContact SD-CE1 4.15Å; M295-F408 HydrophobicContact SD-CG 3.5Å; M295-F408 VanDerWaalsContact SD-CG 3.5Å; V404-F408 PolarHBondContact O-N 3.42Å; V404-F408 VanDerWaalsContact O-N 3.14Å; A405-F408 PolarHBondContact O-N 3.33Å; A405-F408 VanDerWaalsContact O-N 3.17Å; S406-F408 PolarHBondContact O-N 2.92Å; F408-G410 PolarHBondContact O-N 3.11Å; F408-L453 HydrophobicContact CD1-CD1 4.08Å; F408-L453 HydrophobicContact CD1-CD2 3.62Å; F408-L453 HydrophobicContact CD1-CG 3.72Å; F408-L453 HydrophobicContact CE1-CD1 4.04Å; F408-L453 HydrophobicContact CE1-CD2 4.18Å; F408-L453 HydrophobicContact CE1-CG 3.73Å
409	A	94.4	Very high	96.3	Very high	35 Å²	35	33 Å²	33	29%	0.289	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-0.7	176.1	0	0	0	0	0	113.9	A405 S406 E411 L453	A405-A409 WeakPolarHBondContact O-CB 3.23Å; A405-A409 PolarHBondContact O-N 2.92Å; S406-A409 PolarHBondContact O-N 2.96Å; A409-E411 VanDerWaalsContact C-N 3.32Å; A409-E411 HydrophobicContact CB-CG 4.22Å; A409-L453 HydrophobicContact CB-CD1 3.92Å; A409-L453 HydrophobicContact CB-CD2 4.36Å
410	G	92.5	Very high	96.2	Very high	57 Å²	57	37.1 Å²	37.1	59%	0.588	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.4	9.4	179.3	0	0	0	0	0	113.5	S406 R407 F408	S406-G410 PolarHBondContact O-N 2.88Å; R407-G410 PolarHBondContact O-N 2.89Å; F408-G410 PolarHBondContact O-N 3.11Å
411	E	92.1	Very high	96.1	Very high	52 Å²	52	37.8 Å²	37.8	24%	0.243	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-75	148.6	179.3	-56.4	176	-161.2	0	0	110.5	S406 A409 Y413 W447	S406-E411 WeakPolarHBondContact O-CB 3.4Å; S406-E411 PolarHBondContact O-N 3.15Å; S406-E411 VanDerWaalsContact O-N 3.1Å; A409-E411 VanDerWaalsContact C-N 3.32Å; A409-E411 HydrophobicContact CB-CG 4.22Å; E411-Y413 PolarHBondContact O-N 2.87Å; E411-W447 PolarHBondContact OE1-NE1 2.84Å
412	P	93.5	Very high	96	Very high	102 Å²	102	41 Å²	41	66%	0.662	23%	0.232	S	C	*	.	P	Polyproline II helix	trans	-55.9	139.7	170.2	-22.9	33.5	0	0	0	110.6	K414	P412-K414 PolarHBondContact O-N 3.23Å
413	Y	96.2	Very high	95.8	Very high	40 Å²	40	46 Å²	46	16%	0.157	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-61.8	124.7	177.2	177.5	-99	0	0	0	110.5	H282 L285 K286 E403 E411 V415	H282-Y413 AromaticContact CE1-CE1 3.61Å; H282-Y413 AromaticContact ND1-CE1 3.59Å; H282-Y413 AromaticContact ND1-CZ 3.5Å; H282-Y413 PolarHBondContact ND1-OH 3.02Å; L285-Y413 HydrophobicContact CB-CD2 3.55Å; L285-Y413 HydrophobicContact CB-CE2 3.68Å; L285-Y413 HydrophobicContact CB-CG 4.49Å; L285-Y413 HydrophobicContact CD1-CD2 4.49Å; L285-Y413 HydrophobicContact CD1-CE2 4.04Å; K286-Y413 HydrophobicContact CB-CD1 3.78Å; K286-Y413 HydrophobicContact CB-CE1 4.27Å; K286-Y413 HydrophobicContact CB-CG 4.14Å; K286-Y413 HydrophobicContact CG-CD1 4.07Å; E403-Y413 HydrophobicContact CB-CE2 4.35Å; E403-Y413 PolarHBondContact OE2-OH 3.27Å; E411-Y413 PolarHBondContact O-N 2.87Å; Y413-V415 HydrophobicContact CE1-CG1 4.4Å
414	K	96.1	Very high	95.6	Very high	66 Å²	66	51.9 Å²	51.9	29%	0.287	30%	0.3	S	S	.	.			trans	-132.3	148.2	174.1	-65.9	-172.7	-178.7	-166.2	0	109.6	W402 P412 E418 D419	W402-K414 HydrophobicContact CH2-CB 4.35Å; P412-K414 PolarHBondContact O-N 3.23Å; K414-E418 WeakPolarHBondContact CA-OE2 3.5Å; K414-E418 HydrophobicContact CB-CB 4.24Å; K414-D419 IonicContact NZ-OD1 2.71Å; K414-D419 PolarHBondContact NZ-OD1 3.33Å; K414-D419 IonicContact NZ-OD2 2.65Å; K414-D419 PolarHBondContact NZ-OD2 2.9Å
415	V	96.9	Very high	95.6	Very high	27 Å²	27	52 Å²	52	16%	0.164	30%	0.301	C	S	.	.			trans	-74.9	156	165.5	-63.1	0	0	0	0	110.4	Y413 Y417 E418	Y413-V415 HydrophobicContact CE1-CG1 4.4Å; V415-Y417 PolarHBondContact O-N 3.3Å; V415-E418 HydrophobicContact CG2-CB 3.89Å; V415-E418 HydrophobicContact CG2-CG 4.2Å; V415-E418 WeakPolarHBondContact CG2-OE2 3.45Å; V415-E418 PolarHBondContact N-OE2 2.9Å; V415-E418 VanDerWaalsContact O-CB 3.28Å; V415-E418 WeakPolarHBondContact O-CB 3.33Å; V415-E418 PolarHBondContact O-N 2.73Å; V415-E418 VanDerWaalsContact O-N 3.12Å
416	P	98	Very high	95.6	Very high	0 Å²	0	54 Å²	54	0%	0	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	134.6	176.6	-25.2	34.4	0	0	0	111.2	R370 Y371 L399 W402 E403 E418 P441	R370-P416 WeakPolarHBondContact CD-O 3.38Å; R370-P416 WeakPolarHBondContact CG-O 3.22Å; R370-P416 PolarHBondContact NH1-O 2.69Å; Y371-P416 HydrophobicContact CE1-CG 3.87Å; Y371-P416 WeakPolarHBondContact OH-CD 3.49Å; L399-P416 HydrophobicContact CB-CB 4.19Å; L399-P416 HydrophobicContact CB-CG 3.82Å; L399-P416 HydrophobicContact CD2-CB 4.14Å; W402-P416 HydrophobicContact CE3-CG 4.31Å; E403-P416 HydrophobicContact CG-CG 3.93Å; P416-E418 PolarHBondContact O-N 3.35Å; P416-P441 HydrophobicContact CB-CG 4Å
417	Y	97.9	Very high	95.6	Very high	7 Å²	7	56.4 Å²	56.4	3%	0.027	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	17.3	-179.2	-43.4	-76.5	0	0	0	115.3	R370 Y395 L399 V415 D419 L420 V421 M430 L433 V434 P441	R370-Y417 HydrophobicContact CG-CD2 4.23Å; R370-Y417 VanDerWaalsContact NH1-C 3.35Å; R370-Y417 PolarHBondContact NH1-O 2.92Å; Y395-Y417 PolarHBondContact OH-OH 2.77Å; L399-Y417 HydrophobicContact CD1-CE2 4.01Å; L399-Y417 HydrophobicContact CD2-CE2 3.78Å; V415-Y417 PolarHBondContact O-N 3.3Å; Y417-D419 PolarHBondContact O-N 3.05Å; Y417-L420 HydrophobicContact CD1-CD1 4.35Å; Y417-L420 PolarHBondContact O-N 3.05Å; Y417-V421 WeakPolarHBondContact O-CG2 3.46Å; Y417-V421 PolarHBondContact O-N 3.28Å; Y417-V421 VanDerWaalsContact O-N 3.15Å; Y417-M430 HydrophobicContact CD2-CE 3.96Å; Y417-M430 HydrophobicContact CE2-CE 4.11Å; Y417-L433 HydrophobicContact CD1-CD2 3.55Å; Y417-L433 HydrophobicContact CE1-CD2 4.18Å; Y417-L433 HydrophobicContact CG-CD2 3.95Å; Y417-V434 HydrophobicContact CE1-CG2 4.32Å; Y417-V434 HydrophobicContact CE2-CG2 4.49Å; Y417-P441 HydrophobicContact CD1-CG 4.28Å; Y417-P441 VanDerWaalsContact CE1-CD 3.49Å; Y417-P441 HydrophobicContact CE1-CG 3.99Å; Y417-P441 HydrophobicContact CE2-CG 4.33Å
418	E	96.4	Very high	95.6	Very high	89 Å²	89	59.2 Å²	59.2	42%	0.416	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-39.8	-179.9	-171.4	171.7	117.9	0	0	112.9	K414 V415 P416 L420	K414-E418 WeakPolarHBondContact CA-OE2 3.5Å; K414-E418 HydrophobicContact CB-CB 4.24Å; V415-E418 HydrophobicContact CG2-CB 3.89Å; V415-E418 HydrophobicContact CG2-CG 4.2Å; V415-E418 WeakPolarHBondContact CG2-OE2 3.45Å; V415-E418 PolarHBondContact N-OE2 2.9Å; V415-E418 VanDerWaalsContact O-CB 3.28Å; V415-E418 WeakPolarHBondContact O-CB 3.33Å; V415-E418 PolarHBondContact O-N 2.73Å; V415-E418 VanDerWaalsContact O-N 3.12Å; P416-E418 PolarHBondContact O-N 3.35Å; E418-L420 VanDerWaalsContact C-N 3.27Å; E418-L420 PolarHBondContact O-N 3.4Å
419	D	94.9	Very high	95.7	Very high	114 Å²	114	61 Å²	61	61%	0.61	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-8.5	-179.1	-58.7	-43.5	0	0	0	113.8	K414 Y417	K414-D419 IonicContact NZ-OD1 2.71Å; K414-D419 PolarHBondContact NZ-OD1 3.33Å; K414-D419 IonicContact NZ-OD2 2.65Å; K414-D419 PolarHBondContact NZ-OD2 2.9Å; Y417-D419 PolarHBondContact O-N 3.05Å
420	L	96.2	Very high	95.9	Very high	87 Å²	87	59.3 Å²	59.3	46%	0.455	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-22	-169.6	-61.1	173.8	0	0	0	113.7	Y417 E418 L433 H439	Y417-L420 HydrophobicContact CD1-CD1 4.35Å; Y417-L420 PolarHBondContact O-N 3.05Å; E418-L420 VanDerWaalsContact C-N 3.27Å; E418-L420 PolarHBondContact O-N 3.4Å; L420-L433 HydrophobicContact CB-CD1 3.97Å; L420-L433 HydrophobicContact CB-CD2 4.02Å; L420-L433 HydrophobicContact CD1-CD1 4.11Å; L420-L433 HydrophobicContact CD1-CD2 4.32Å; L420-H439 HydrophobicContact CD1-CB 4.49Å
421	V	96.7	Very high	96.1	Very high	15 Å²	15	60.7 Å²	60.7	9%	0.091	33%	0.325	C	S	.	.	S	Bend	trans	-142.6	151.9	-178.5	-66.1	0	0	0	0	111.3	Y417 P425 M430 L433	Y417-V421 WeakPolarHBondContact O-CG2 3.46Å; Y417-V421 PolarHBondContact O-N 3.28Å; Y417-V421 VanDerWaalsContact O-N 3.15Å; V421-P425 HydrophobicContact CB-CB 4.02Å; V421-P425 HydrophobicContact CG2-CB 4.06Å; V421-P425 HydrophobicContact CG2-CG 4.19Å; V421-M430 HydrophobicContact CG1-SD 4.34Å; V421-M430 HydrophobicContact CG2-SD 3.99Å; V421-L433 HydrophobicContact CG1-CD2 3.87Å
422	P	96.6	Very high	96.4	Very high	69 Å²	69	65.5 Å²	65.5	45%	0.448	34%	0.342	S	S	.	.			trans	-60.8	165.3	179	27.3	-37.2	0	0	0	112.4	R370 D424 P425	R370-P422 PolarHBondContact NH2-O 3.3Å; P422-D424 VanDerWaalsContact C-N 3.34Å; P422-D424 PolarHBondContact O-N 3Å; P422-P425 WeakPolarHBondContact O-CD 3.25Å
423	S	94.4	Very high	96.6	Very high	119 Å²	119	61.1 Å²	61.1	83%	0.832	31%	0.313	S	S	*	.	S	Bend	trans	-53.1	-43.2	-174.5	-57.4	0	0	0	0	114.4	R370 P425	R370-S423 PolarHBondContact NH2-O 2.92Å; S423-P425 WeakPolarHBondContact O-CD 3.5Å
424	D	94.4	Very high	96.7	Very high	124 Å²	124	59.2 Å²	59.2	66%	0.663	31%	0.305	S	S	*	.	S	Bend	trans	-114.6	84.9	170.9	-179.3	24.3	0	0	0	109.8	K369 P422	K369-D424 IonicContact NZ-OD1 3.54Å; K369-D424 PolarHBondContact NZ-OD1 3.28Å; K369-D424 IonicContact NZ-OD2 3.23Å; P422-D424 VanDerWaalsContact C-N 3.34Å; P422-D424 PolarHBondContact O-N 3Å
425	P	96.9	Very high	96.7	Very high	4 Å²	4	57.5 Å²	57.5	3%	0.026	30%	0.301	C	S	.	.			trans	-69.8	151.8	-177.1	31.2	-34.6	0	0	0	110.7	K369 R370 V421 P422 S423 E429 M430	K369-P425 WeakPolarHBondContact CD-O 3.37Å; K369-P425 PolarHBondContact NZ-O 3.41Å; K369-P425 VanDerWaalsContact NZ-O 3.15Å; R370-P425 HydrophobicContact CB-CG 4.35Å; V421-P425 HydrophobicContact CB-CB 4.02Å; V421-P425 HydrophobicContact CG2-CB 4.06Å; V421-P425 HydrophobicContact CG2-CG 4.19Å; P422-P425 WeakPolarHBondContact O-CD 3.25Å; S423-P425 WeakPolarHBondContact O-CD 3.5Å; P425-E429 WeakPolarHBondContact CA-OE2 2.88Å; P425-E429 HydrophobicContact CB-CB 4.49Å; P425-M430 HydrophobicContact CB-CG 3.92Å; P425-M430 HydrophobicContact CB-SD 4.03Å; P425-M430 HydrophobicContact CG-CG 3.81Å; P425-M430 HydrophobicContact CG-SD 3.77Å
426	S	96.9	Very high	96.7	Very high	44 Å²	44	61.8 Å²	61.8	31%	0.308	32%	0.322	S	S	.	.			trans	-74.1	168.6	167.5	70.2	0	0	0	0	110.9	D428 E429 M430	S426-D428 VanDerWaalsContact C-N 3.33Å; S426-E429 WeakPolarHBondContact CB-OE2 3.46Å; S426-E429 PolarHBondContact N-OE2 2.82Å; S426-E429 VanDerWaalsContact OG-CG 3.28Å; S426-E429 WeakPolarHBondContact OG-CG 3.3Å; S426-E429 PolarHBondContact OG-N 2.85Å; S426-E429 PolarHBondContact OG-OE2 3.06Å; S426-M430 PolarHBondContact O-N 2.78Å
427	F	95.3	Very high	96.6	Very high	55 Å²	55	65.9 Å²	65.9	24%	0.241	34%	0.341	C	S	.	.	H	α-helix	trans	-66.7	-35.7	173	-74	-79.9	0	0	0	113	R365 K369 M372 L377 M430 R431	R365-F427 HydrophobicContact CG-CD1 4.04Å; R365-F427 HydrophobicContact CG-CE1 3.33Å; R365-F427 HydrophobicContact CG-CZ 3.66Å; R365-F427 VanDerWaalsContact NE-CE1 3.34Å; R365-F427 VanDerWaalsContact NH2-CG 3.28Å; K369-F427 HydrophobicContact CD-CD2 4.5Å; K369-F427 HydrophobicContact CG-CD1 4.11Å; K369-F427 HydrophobicContact CG-CE1 3.99Å; K369-F427 HydrophobicContact CG-CE2 4.41Å; K369-F427 HydrophobicContact CG-CG 4.39Å; K369-F427 HydrophobicContact CG-CZ 4.14Å; M372-F427 HydrophobicContact CE-CE1 3.59Å; M372-F427 HydrophobicContact CE-CZ 4.09Å; M372-F427 HydrophobicContact SD-CD1 4.05Å; M372-F427 HydrophobicContact SD-CE1 3.47Å; M372-F427 WeakPolarHBondContact SD-CE1 3.21Å; L377-F427 HydrophobicContact CD2-CD1 4.31Å; F427-M430 PolarHBondContact O-N 2.78Å; F427-R431 VanDerWaalsContact O-CB 3.3Å; F427-R431 WeakPolarHBondContact O-CB 3.4Å; F427-R431 PolarHBondContact O-N 2.95Å
428	D	96.6	Very high	96.5	Very high	98 Å²	98	67.8 Å²	67.8	52%	0.524	36%	0.362	S	S	.	.	H	α-helix	trans	-68.1	-39.2	-178.1	-69.7	-42	0	0	0	111.4	S426 R431 R432	S426-D428 VanDerWaalsContact C-N 3.33Å; D428-R431 PolarHBondContact O-N 2.84Å; D428-R431 IonicContact OD1-CZ 2.61Å; D428-R431 IonicContact OD1-NH1 3.06Å; D428-R431 PolarHBondContact OD1-NH1 2.56Å; D428-R432 VanDerWaalsContact O-CB 3.29Å; D428-R432 WeakPolarHBondContact O-CB 3.47Å; D428-R432 PolarHBondContact O-N 2.81Å
429	E	97.6	Very high	96.6	Very high	77 Å²	77	67.6 Å²	67.6	36%	0.36	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-48.8	174.1	-72.6	166.5	141.7	0	0	111.2	P425 S426 R432 L433	P425-E429 WeakPolarHBondContact CA-OE2 2.88Å; P425-E429 HydrophobicContact CB-CB 4.49Å; S426-E429 WeakPolarHBondContact CB-OE2 3.46Å; S426-E429 PolarHBondContact N-OE2 2.82Å; S426-E429 VanDerWaalsContact OG-CG 3.28Å; S426-E429 WeakPolarHBondContact OG-CG 3.3Å; S426-E429 PolarHBondContact OG-N 2.85Å; S426-E429 PolarHBondContact OG-OE2 3.06Å; E429-R432 PolarHBondContact O-N 2.94Å; E429-L433 WeakPolarHBondContact O-CB 3.24Å; E429-L433 PolarHBondContact O-N 3.46Å
430	M	98.2	Very high	96.7	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.2	-42.2	177.7	-70.9	-57.3	-53.3	0	0	112.1	K369 R370 L377 Y417 V421 P425 S426 F427 R432 L433 V434	K369-M430 HydrophobicContact CB-CG 4.29Å; R370-M430 WeakPolarHBondContact O-CE 3.31Å; L377-M430 HydrophobicContact CD1-CB 3.98Å; L377-M430 HydrophobicContact CD2-CB 3.61Å; L377-M430 HydrophobicContact CG-CB 4.46Å; Y417-M430 HydrophobicContact CD2-CE 3.96Å; Y417-M430 HydrophobicContact CE2-CE 4.11Å; V421-M430 HydrophobicContact CG1-SD 4.34Å; V421-M430 HydrophobicContact CG2-SD 3.99Å; P425-M430 HydrophobicContact CB-CG 3.92Å; P425-M430 HydrophobicContact CB-SD 4.03Å; P425-M430 HydrophobicContact CG-CG 3.81Å; P425-M430 HydrophobicContact CG-SD 3.77Å; S426-M430 PolarHBondContact O-N 2.78Å; F427-M430 PolarHBondContact O-N 2.78Å; M430-R432 PolarHBondContact O-N 3.46Å; M430-L433 PolarHBondContact O-N 3.46Å; M430-V434 HydrophobicContact CE-CG2 3.74Å; M430-V434 VanDerWaalsContact O-CB 3.29Å; M430-V434 WeakPolarHBondContact O-CB 3.47Å; M430-V434 WeakPolarHBondContact O-CG2 3.18Å; M430-V434 PolarHBondContact O-N 3.08Å
431	R	97.3	Very high	96.7	Very high	85 Å²	85	60.1 Å²	60.1	32%	0.321	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-45.3	177.4	-171	-174.5	84	-110.1	3.3	110.8	L377 D378 F427 D428 C435 I436	L377-R431 HydrophobicContact CB-CB 4.31Å; D378-R431 HydrophobicContact CB-CG 4.45Å; F427-R431 VanDerWaalsContact O-CB 3.3Å; F427-R431 WeakPolarHBondContact O-CB 3.4Å; F427-R431 PolarHBondContact O-N 2.95Å; D428-R431 PolarHBondContact O-N 2.84Å; D428-R431 IonicContact OD1-CZ 2.61Å; D428-R431 IonicContact OD1-NH1 3.06Å; D428-R431 PolarHBondContact OD1-NH1 2.56Å; R431-C435 HydrophobicContact CG-CB 4.13Å; R431-C435 WeakPolarHBondContact O-CA 3.46Å; R431-C435 WeakPolarHBondContact O-CB 3.39Å; R431-C435 PolarHBondContact O-N 2.98Å; R431-I436 PolarHBondContact O-N 2.93Å
432	R	97.7	Very high	96.6	Very high	154 Å²	154	63.7 Å²	63.7	58%	0.581	34%	0.342	S	S	*	.	I	π-helix	trans	-58.8	-53.3	176.8	179.3	-179.9	173.1	162.4	2.3	110.8	D428 E429 M430 I436 E437	D428-R432 VanDerWaalsContact O-CB 3.29Å; D428-R432 WeakPolarHBondContact O-CB 3.47Å; D428-R432 PolarHBondContact O-N 2.81Å; E429-R432 PolarHBondContact O-N 2.94Å; M430-R432 PolarHBondContact O-N 3.46Å; R432-I436 WeakPolarHBondContact O-CB 3.29Å; R432-I436 PolarHBondContact O-N 2.87Å; R432-E437 HydrophobicContact CG-CG 4.44Å; R432-E437 WeakPolarHBondContact CG-OE1 3.49Å; R432-E437 IonicContact CZ-OE1 3.41Å; R432-E437 IonicContact NE-OE1 3.82Å; R432-E437 PolarHBondContact NE-OE1 2.86Å; R432-E437 IonicContact NH2-OE1 2.67Å; R432-E437 PolarHBondContact O-N 2.83Å
433	L	97.9	Very high	96.4	Very high	10 Å²	10	62.8 Å²	62.8	5%	0.052	34%	0.336	C	S	.	.	I	π-helix	trans	-61.9	-49.6	-176.9	-173.8	76.9	0	0	0	112.6	Y417 L420 V421 E429 M430 G438 H439	Y417-L433 HydrophobicContact CD1-CD2 3.55Å; Y417-L433 HydrophobicContact CE1-CD2 4.18Å; Y417-L433 HydrophobicContact CG-CD2 3.95Å; L420-L433 HydrophobicContact CB-CD1 3.97Å; L420-L433 HydrophobicContact CB-CD2 4.02Å; L420-L433 HydrophobicContact CD1-CD1 4.11Å; L420-L433 HydrophobicContact CD1-CD2 4.32Å; V421-L433 HydrophobicContact CG1-CD2 3.87Å; E429-L433 WeakPolarHBondContact O-CB 3.24Å; E429-L433 PolarHBondContact O-N 3.46Å; M430-L433 PolarHBondContact O-N 3.46Å; L433-G438 PolarHBondContact O-N 2.8Å; L433-H439 HydrophobicContact CD1-CB 3.9Å; L433-H439 HydrophobicContact CG-CB 3.94Å; L433-H439 PolarHBondContact O-N 3Å
434	V	97.9	Very high	96.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.	I	π-helix	trans	-88.7	-40.2	-168.1	173.1	0	0	0	0	112.4	P374 L377 Y395 Y417 M430 R440	P374-V434 HydrophobicContact CB-CG1 4.2Å; P374-V434 HydrophobicContact CG-CG1 3.77Å; L377-V434 HydrophobicContact CD1-CB 3.87Å; L377-V434 HydrophobicContact CD1-CG1 4.02Å; L377-V434 HydrophobicContact CD1-CG2 4.22Å; Y395-V434 WeakPolarHBondContact OH-CG1 3.17Å; Y417-V434 HydrophobicContact CE1-CG2 4.32Å; Y417-V434 HydrophobicContact CE2-CG2 4.49Å; M430-V434 HydrophobicContact CE-CG2 3.74Å; M430-V434 VanDerWaalsContact O-CB 3.29Å; M430-V434 WeakPolarHBondContact O-CB 3.47Å; M430-V434 WeakPolarHBondContact O-CG2 3.18Å; M430-V434 PolarHBondContact O-N 3.08Å; V434-R440 PolarHBondContact O-NH1 2.84Å
435	C	96.7	Very high	96.1	Very high	30 Å²	30	58.1 Å²	58.1	20%	0.203	31%	0.31	C	S	.	.	I	π-helix	trans	-94.3	-38.6	-173.8	-49.3	0	0	0	0	112.6	P374 R431	P374-C435 VanDerWaalsContact CA-SG 3.57Å; P374-C435 PolarHBondContact O-SG 3.36Å; R431-C435 HydrophobicContact CG-CB 4.13Å; R431-C435 WeakPolarHBondContact O-CA 3.46Å; R431-C435 WeakPolarHBondContact O-CB 3.39Å; R431-C435 PolarHBondContact O-N 2.98Å
436	I	96.2	Very high	95.9	Very high	117 Å²	117	60.7 Å²	60.7	60%	0.6	33%	0.328	S	S	*	.	I	π-helix	trans	-91.5	-52.4	-175.6	-53.4	179.5	0	0	0	110.7	R431 R432	R431-I436 PolarHBondContact O-N 2.93Å; R432-I436 WeakPolarHBondContact O-CB 3.29Å; R432-I436 PolarHBondContact O-N 2.87Å
437	E	96.7	Very high	95.8	Very high	86 Å²	86	58.7 Å²	58.7	40%	0.402	31%	0.314	S	S	.	.	S	Bend	trans	-83.5	-15.9	-177.6	-63.5	170.5	-178.7	0	0	112.2	R432 H439	R432-E437 HydrophobicContact CG-CG 4.44Å; R432-E437 WeakPolarHBondContact CG-OE1 3.49Å; R432-E437 IonicContact CZ-OE1 3.41Å; R432-E437 IonicContact NE-OE1 3.82Å; R432-E437 PolarHBondContact NE-OE1 2.86Å; R432-E437 IonicContact NH2-OE1 2.67Å; R432-E437 PolarHBondContact O-N 2.83Å; E437-H439 VanDerWaalsContact C-N 3.27Å; E437-H439 PolarHBondContact O-N 3.29Å; E437-H439 IonicContact OE2-CD2 2.64Å; E437-H439 IonicContact OE2-NE2 3.8Å
438	G	95.7	Very high	95.6	Very high	46 Å²	46	59.5 Å²	59.5	47%	0.474	33%	0.33	S	S	.	.			trans	70.9	17.8	174.7	0	0	0	0	0	114.4	L433	L433-G438 PolarHBondContact O-N 2.8Å
439	H	97.1	Very high	95.3	Very high	85 Å²	85	63.7 Å²	63.7	39%	0.394	34%	0.344	S	S	.	.			trans	-67.9	149.5	-178.5	-76.3	-66.4	0	0	0	112.4	L420 L433 E437	L420-H439 HydrophobicContact CD1-CB 4.49Å; L433-H439 HydrophobicContact CD1-CB 3.9Å; L433-H439 HydrophobicContact CG-CB 3.94Å; L433-H439 PolarHBondContact O-N 3Å; E437-H439 VanDerWaalsContact C-N 3.27Å; E437-H439 PolarHBondContact O-N 3.29Å; E437-H439 IonicContact OE2-CD2 2.64Å; E437-H439 IonicContact OE2-NE2 3.8Å
440	R	97.5	Very high	95	Very high	42 Å²	42	61.9 Å²	61.9	16%	0.158	34%	0.337	C	S	.	.			trans	-135.4	159.6	169.4	-65.9	-62.3	-177.5	-85.3	0.7	108.6	V434 W464	V434-R440 PolarHBondContact O-NH1 2.84Å; R440-W464 HydrophobicContact CB-CZ2 4.09Å; R440-W464 HydrophobicContact CG-CG 4.42Å; R440-W464 PolarHBondContact NE-O 2.99Å; R440-W464 PolarHBondContact NH2-O 2.83Å
441	P	96.8	Very high	94.6	Very high	3 Å²	3	70 Å²	70	2%	0.019	38%	0.375	C	S	.	.			trans	-56.3	137	171.5	-22.3	35.3	0	0	0	109.9	L399 W402 P416 Y417 V443 W464	L399-P441 HydrophobicContact CD2-CG 3.7Å; W402-P441 HydrophobicContact CD2-CB 3.55Å; W402-P441 HydrophobicContact CD2-CG 4.32Å; W402-P441 VanDerWaalsContact CE2-CB 3.4Å; W402-P441 HydrophobicContact CE3-CB 4.07Å; W402-P441 HydrophobicContact CG-CB 3.91Å; W402-P441 HydrophobicContact CH2-CB 4.33Å; W402-P441 HydrophobicContact CZ2-CB 3.83Å; W402-P441 HydrophobicContact CZ3-CB 4.44Å; P416-P441 HydrophobicContact CB-CG 4Å; Y417-P441 HydrophobicContact CD1-CG 4.28Å; Y417-P441 VanDerWaalsContact CE1-CD 3.49Å; Y417-P441 HydrophobicContact CE1-CG 3.99Å; Y417-P441 HydrophobicContact CE2-CG 4.33Å; P441-V443 PolarHBondContact O-N 3.04Å; P441-W464 HydrophobicContact CB-CH2 4.08Å; P441-W464 HydrophobicContact CB-CZ3 4.19Å; P441-W464 HydrophobicContact CG-CH2 4.23Å; P441-W464 HydrophobicContact CG-CZ3 3.91Å; P441-W464 WeakPolarHBondContact O-CH2 3.37Å
442	P	93.6	Very high	94.1	Very high	89 Å²	89	67.1 Å²	67.1	58%	0.578	37%	0.367	S	S	*	.			trans	-67	128.2	-174.5	26.8	-33.6	0	0	0	110.4	W402 S444	W402-P442 PolarHBondContact NE1-O 3.41Å; P442-S444 PolarHBondContact O-N 3.33Å
443	V	93.4	Very high	93.8	Very high	51 Å²	51	60.4 Å²	60.4	31%	0.309	34%	0.342	S	S	.	.			trans	-84.4	108	163.7	176.7	0	0	0	0	106.1	P441 W447 V461 W464	P441-V443 PolarHBondContact O-N 3.04Å; V443-W447 HydrophobicContact CG1-CD2 4.09Å; V443-W447 HydrophobicContact CG1-CE3 3.59Å; V443-W447 HydrophobicContact CG1-CZ3 3.99Å; V443-W447 HydrophobicContact CG2-CZ3 4.5Å; V443-V461 HydrophobicContact CG2-CG2 4.25Å; V443-W464 HydrophobicContact CG2-CH2 4.21Å; V443-W464 HydrophobicContact CG2-CZ2 3.93Å
444	S	91.5	Very high	93.6	Very high	34 Å²	34	61.9 Å²	61.9	24%	0.238	35%	0.353	C	S	.	.			trans	-57.7	135.7	-173.8	174.1	0	0	0	0	110.8	P442 S446 W447	P442-S444 PolarHBondContact O-N 3.33Å; S444-S446 PolarHBondContact O-N 3.12Å; S444-S446 PolarHBondContact OG-N 2.86Å; S444-S446 PolarHBondContact OG-OG 3.08Å; S444-W447 VanDerWaalsContact O-CB 3.26Å; S444-W447 WeakPolarHBondContact O-CB 3.5Å; S444-W447 PolarHBondContact O-N 2.97Å
445	P	91.2	Very high	93.3	Very high	111 Å²	111	63.1 Å²	63.1	72%	0.721	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-54.8	-26.2	173.7	-26.1	34.8	0	0	0	113.3	W447 A448	P445-W447 PolarHBondContact O-N 3.18Å; P445-A448 WeakPolarHBondContact O-CB 3.47Å; P445-A448 PolarHBondContact O-N 2.9Å; P445-A448 VanDerWaalsContact O-N 3.14Å
446	S	92.6	Very high	93.1	Very high	58 Å²	58	61.7 Å²	61.7	41%	0.406	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-63.4	-23.9	176.9	63.5	0	0	0	0	113.4	S444 A448 F449	S444-S446 PolarHBondContact O-N 3.12Å; S444-S446 PolarHBondContact OG-N 2.86Å; S444-S446 PolarHBondContact OG-OG 3.08Å; S446-A448 PolarHBondContact O-N 3.06Å; S446-F449 WeakPolarHBondContact O-CB 3.32Å; S446-F449 WeakPolarHBondContact O-CD2 3.12Å; S446-F449 PolarHBondContact O-N 3.4Å; S446-F449 VanDerWaalsContact O-N 3.09Å
447	W	93.7	Very high	93.1	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.008	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-65.3	-21.8	177.4	-67.9	22.1	0	0	0	111.9	W402 A405 E411 V443 S444 P445 F449 D450 L453 S454 I460	W402-W447 AromaticContact CD1-CH2 3.83Å; A405-W447 HydrophobicContact CB-CE3 4.4Å; A405-W447 HydrophobicContact CB-CH2 3.37Å; A405-W447 HydrophobicContact CB-CZ2 4.09Å; A405-W447 HydrophobicContact CB-CZ3 3.55Å; E411-W447 PolarHBondContact OE1-NE1 2.84Å; V443-W447 HydrophobicContact CG1-CD2 4.09Å; V443-W447 HydrophobicContact CG1-CE3 3.59Å; V443-W447 HydrophobicContact CG1-CZ3 3.99Å; V443-W447 HydrophobicContact CG2-CZ3 4.5Å; S444-W447 VanDerWaalsContact O-CB 3.26Å; S444-W447 WeakPolarHBondContact O-CB 3.5Å; S444-W447 PolarHBondContact O-N 2.97Å; P445-W447 PolarHBondContact O-N 3.18Å; W447-F449 PolarHBondContact O-N 3.09Å; W447-D450 PolarHBondContact O-N 3.19Å; W447-L453 HydrophobicContact CB-CB 3.89Å; W447-L453 HydrophobicContact CD2-CD2 4.01Å; W447-L453 HydrophobicContact CE3-CD2 4.17Å; W447-L453 HydrophobicContact CG-CB 4.18Å; W447-L453 HydrophobicContact CG-CD1 4.29Å; W447-L453 HydrophobicContact CG-CD2 4.27Å; W447-L453 HydrophobicContact CG-CG 4.49Å; W447-S454 PolarHBondContact O-N 3.23Å; W447-S454 VanDerWaalsContact O-N 3.17Å; W447-I460 HydrophobicContact CH2-CD1 4.28Å; W447-I460 HydrophobicContact CZ3-CD1 3.82Å
448	A	91.4	Very high	93	Very high	71 Å²	71	59.7 Å²	59.7	59%	0.587	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-68.1	-18.1	175.4	0	0	0	0	0	113.2	P445 S446	P445-A448 WeakPolarHBondContact O-CB 3.47Å; P445-A448 PolarHBondContact O-N 2.9Å; P445-A448 VanDerWaalsContact O-N 3.14Å; S446-A448 PolarHBondContact O-N 3.06Å
449	F	91.3	Very high	93	Very high	186 Å²	186	57.8 Å²	57.8	82%	0.816	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-84.4	-14.2	179.8	-56.9	-57.8	0	0	0	113.9	S446 W447	S446-F449 WeakPolarHBondContact O-CB 3.32Å; S446-F449 WeakPolarHBondContact O-CD2 3.12Å; S446-F449 PolarHBondContact O-N 3.4Å; S446-F449 VanDerWaalsContact O-N 3.09Å; W447-F449 PolarHBondContact O-N 3.09Å
450	D	90.3	Very high	93.1	Very high	39 Å²	39	53.8 Å²	53.8	21%	0.209	30%	0.297	C	S	.	.	S	Bend	trans	-113.1	123.2	171.8	174.7	-81.1	0	0	0	109	R292 W447 V452 L453 S454	R292-D450 IonicContact CZ-OD2 3.79Å; R292-D450 IonicContact NH2-OD2 3.79Å; R292-D450 PolarHBondContact NH2-OD2 3.28Å; W447-D450 PolarHBondContact O-N 3.19Å; D450-V452 PolarHBondContact O-N 3.12Å; D450-V452 WeakPolarHBondContact OD1-CA 3.26Å; D450-V452 VanDerWaalsContact OD1-CB 3.31Å; D450-V452 WeakPolarHBondContact OD1-CB 3.26Å; D450-V452 PolarHBondContact OD1-N 2.92Å; D450-L453 HydrophobicContact CB-CB 4.11Å; D450-L453 HydrophobicContact CB-CD1 4.18Å; D450-L453 HydrophobicContact CB-CG 4.43Å; D450-L453 PolarHBondContact O-N 2.97Å; D450-L453 PolarHBondContact OD1-N 2.93Å; D450-S454 WeakPolarHBondContact O-CB 3.12Å; D450-S454 PolarHBondContact O-N 3.06Å
451	E	89.3	Confident	93.1	Very high	170 Å²	170	55.1 Å²	55.1	79%	0.794	31%	0.31	S	S	*	.	H	α-helix	trans	-59.2	-35.3	-174.3	-173.6	178	-177.9	0	0	112.4	A455	E451-A455 WeakPolarHBondContact O-CB 3.33Å; E451-A455 PolarHBondContact O-N 2.83Å
452	V	88.1	Confident	93.1	Very high	26 Å²	26	59.4 Å²	59.4	16%	0.158	33%	0.33	C	S	.	.	H	α-helix	trans	-72.4	-48.3	-179.6	-175.3	0	0	0	0	110.1	R292 M295 D450 S454 A455 F456	R292-V452 HydrophobicContact CG-CG1 4.39Å; M295-V452 HydrophobicContact CE-CG1 3.71Å; D450-V452 PolarHBondContact O-N 3.12Å; D450-V452 WeakPolarHBondContact OD1-CA 3.26Å; D450-V452 VanDerWaalsContact OD1-CB 3.31Å; D450-V452 WeakPolarHBondContact OD1-CB 3.26Å; D450-V452 PolarHBondContact OD1-N 2.92Å; V452-S454 VanDerWaalsContact C-N 3.29Å; V452-S454 PolarHBondContact O-N 2.88Å; V452-A455 PolarHBondContact O-N 3.23Å; V452-F456 VanDerWaalsContact O-CB 3.3Å; V452-F456 WeakPolarHBondContact O-CB 3.33Å; V452-F456 PolarHBondContact O-N 3.21Å
453	L	91.8	Very high	93.3	Very high	12 Å²	12	55.2 Å²	55.2	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-37.5	174.7	-84	173.6	0	0	0	112.2	M295 A405 F408 A409 W447 D450 F456 G457	M295-L453 HydrophobicContact SD-CD2 4.47Å; A405-L453 HydrophobicContact CB-CD2 4.3Å; F408-L453 HydrophobicContact CD1-CD1 4.08Å; F408-L453 HydrophobicContact CD1-CD2 3.62Å; F408-L453 HydrophobicContact CD1-CG 3.72Å; F408-L453 HydrophobicContact CE1-CD1 4.04Å; F408-L453 HydrophobicContact CE1-CD2 4.18Å; F408-L453 HydrophobicContact CE1-CG 3.73Å; A409-L453 HydrophobicContact CB-CD1 3.92Å; A409-L453 HydrophobicContact CB-CD2 4.36Å; W447-L453 HydrophobicContact CB-CB 3.89Å; W447-L453 HydrophobicContact CD2-CD2 4.01Å; W447-L453 HydrophobicContact CE3-CD2 4.17Å; W447-L453 HydrophobicContact CG-CB 4.18Å; W447-L453 HydrophobicContact CG-CD1 4.29Å; W447-L453 HydrophobicContact CG-CD2 4.27Å; W447-L453 HydrophobicContact CG-CG 4.49Å; D450-L453 HydrophobicContact CB-CB 4.11Å; D450-L453 HydrophobicContact CB-CD1 4.18Å; D450-L453 HydrophobicContact CB-CG 4.43Å; D450-L453 PolarHBondContact O-N 2.97Å; D450-L453 PolarHBondContact OD1-N 2.93Å; L453-F456 PolarHBondContact O-N 2.86Å; L453-G457 PolarHBondContact O-N 2.78Å
454	S	93	Very high	93.5	Very high	41 Å²	41	53.3 Å²	53.3	29%	0.287	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-45.9	175.2	-175.4	0	0	0	0	111.8	W447 D450 V452 F456 G457 R458	W447-S454 PolarHBondContact O-N 3.23Å; W447-S454 VanDerWaalsContact O-N 3.17Å; D450-S454 WeakPolarHBondContact O-CB 3.12Å; D450-S454 PolarHBondContact O-N 3.06Å; V452-S454 VanDerWaalsContact C-N 3.29Å; V452-S454 PolarHBondContact O-N 2.88Å; S454-F456 VanDerWaalsContact C-N 3.34Å; S454-F456 PolarHBondContact O-N 3.33Å; S454-G457 PolarHBondContact O-N 2.89Å; S454-R458 WeakPolarHBondContact O-CG 3.49Å; S454-R458 PolarHBondContact O-N 2.79Å; S454-R458 VanDerWaalsContact O-N 3.1Å
455	A	91.8	Very high	93.8	Very high	26 Å²	26	55.7 Å²	55.7	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-62.8	-41.2	174	0	0	0	0	0	112.2	E451 V452 R458 L459 L484	E451-A455 WeakPolarHBondContact O-CB 3.33Å; E451-A455 PolarHBondContact O-N 2.83Å; V452-A455 PolarHBondContact O-N 3.23Å; A455-R458 PolarHBondContact O-N 2.92Å; A455-L459 PolarHBondContact O-N 2.77Å; A455-L484 HydrophobicContact CB-CD2 4.43Å
456	F	93.2	Very high	94.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.2	-42.5	179.5	-150.9	-79	0	0	0	111.7	M295 A299 L401 A405 V452 L453 S454 L459 I460 M481 L484	M295-F456 HydrophobicContact CE-CD2 4.1Å; M295-F456 HydrophobicContact CE-CE2 4.4Å; M295-F456 HydrophobicContact CG-CE2 4.38Å; M295-F456 HydrophobicContact SD-CD2 4.29Å; M295-F456 HydrophobicContact SD-CE2 4.34Å; A299-F456 HydrophobicContact CB-CE2 3.77Å; A299-F456 HydrophobicContact CB-CZ 3.63Å; L401-F456 HydrophobicContact CB-CE1 3.88Å; L401-F456 HydrophobicContact CB-CZ 4.42Å; L401-F456 HydrophobicContact CD2-CE1 4.18Å; L401-F456 HydrophobicContact CD2-CZ 3.85Å; L401-F456 WeakPolarHBondContact O-CE1 3.42Å; A405-F456 HydrophobicContact CB-CD1 3.59Å; A405-F456 HydrophobicContact CB-CE1 3.76Å; A405-F456 HydrophobicContact CB-CG 4.46Å; V452-F456 VanDerWaalsContact O-CB 3.3Å; V452-F456 WeakPolarHBondContact O-CB 3.33Å; V452-F456 PolarHBondContact O-N 3.21Å; L453-F456 PolarHBondContact O-N 2.86Å; S454-F456 VanDerWaalsContact C-N 3.34Å; S454-F456 PolarHBondContact O-N 3.33Å; F456-L459 PolarHBondContact O-N 2.84Å; F456-I460 HydrophobicContact CD1-CD1 3.55Å; F456-I460 HydrophobicContact CD1-CG1 4.04Å; F456-I460 HydrophobicContact CE1-CD1 3.89Å; F456-I460 HydrophobicContact CE1-CG1 4.22Å; F456-I460 WeakPolarHBondContact O-CG1 3.36Å; F456-I460 PolarHBondContact O-N 3.04Å; F456-M481 HydrophobicContact CD2-CE 3.92Å; F456-M481 HydrophobicContact CD2-SD 3.97Å; F456-M481 HydrophobicContact CE2-CE 3.93Å; F456-M481 HydrophobicContact CE2-SD 3.41Å; F456-M481 WeakPolarHBondContact CE2-SD 3.42Å; F456-M481 HydrophobicContact CZ-SD 4.14Å; F456-L484 HydrophobicContact CD2-CD1 4.21Å
457	G	95.2	Very high	94.2	Very high	4 Å²	4	56.4 Å²	56.4	4%	0.041	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-43.7	174.9	0	0	0	0	0	112.7	L453 S454 L459 I460 V461	L453-G457 PolarHBondContact O-N 2.78Å; S454-G457 PolarHBondContact O-N 2.89Å; G457-L459 VanDerWaalsContact C-N 3.34Å; G457-L459 PolarHBondContact O-N 2.95Å; G457-I460 PolarHBondContact O-N 3.38Å; G457-V461 WeakPolarHBondContact O-CG2 3.34Å; G457-V461 PolarHBondContact O-N 3.05Å
458	R	95	Very high	94.4	Very high	157 Å²	157	57.4 Å²	57.4	59%	0.592	29%	0.291	S	S	*	.	H	α-helix	trans	-59	-45.4	173.5	-73.9	-175.7	-68.1	-166.4	-1.3	112	S454 A455 I460 V461 E462	S454-R458 WeakPolarHBondContact O-CG 3.49Å; S454-R458 PolarHBondContact O-N 2.79Å; S454-R458 VanDerWaalsContact O-N 3.1Å; A455-R458 PolarHBondContact O-N 2.92Å; R458-I460 VanDerWaalsContact C-N 3.35Å; R458-I460 PolarHBondContact O-N 3.47Å; R458-V461 PolarHBondContact O-N 3.48Å; R458-E462 WeakPolarHBondContact O-CG 3.16Å; R458-E462 PolarHBondContact O-N 2.77Å
459	L	96.1	Very high	94.7	Very high	7 Å²	7	58.8 Å²	58.8	4%	0.037	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-40.9	178.8	-178.1	142.6	0	0	0	112.2	L401 A455 F456 G457 V461 E462 C463 L472 V477 T480 M481	L401-L459 HydrophobicContact CD1-CD2 3.42Å; L401-L459 VanDerWaalsContact CD1-CD2 3.42Å; A455-L459 PolarHBondContact O-N 2.77Å; F456-L459 PolarHBondContact O-N 2.84Å; G457-L459 VanDerWaalsContact C-N 3.34Å; G457-L459 PolarHBondContact O-N 2.95Å; L459-V461 VanDerWaalsContact C-N 3.33Å; L459-V461 PolarHBondContact O-N 3.22Å; L459-E462 PolarHBondContact O-N 2.87Å; L459-C463 PolarHBondContact O-N 2.84Å; L459-C463 PolarHBondContact O-SG 2.78Å; L459-C463 VanDerWaalsContact O-SG 3.33Å; L459-L472 HydrophobicContact CD1-CD1 4.28Å; L459-L472 HydrophobicContact CG-CD1 3.91Å; L459-V477 HydrophobicContact CD1-CG1 4.27Å; L459-V477 HydrophobicContact CD1-CG2 4.47Å; L459-V477 HydrophobicContact CD2-CG1 3.91Å; L459-V477 HydrophobicContact CD2-CG2 4.28Å; L459-V477 HydrophobicContact CG-CG2 4.48Å; L459-T480 HydrophobicContact CD1-CG2 3.6Å; L459-M481 HydrophobicContact CD1-CE 3.5Å; L459-M481 HydrophobicContact CD2-CE 4.05Å; L459-M481 HydrophobicContact CG-CE 4.27Å
460	I	97.6	Very high	95	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-47.1	173.8	-73.2	162.9	0	0	0	110.4	L401 W402 A405 W447 F456 G457 R458 E462 C463 W464	L401-I460 HydrophobicContact CB-CD1 4.31Å; L401-I460 HydrophobicContact CB-CG1 3.7Å; W402-I460 HydrophobicContact CB-CD1 4.21Å; W402-I460 HydrophobicContact CB-CG2 4.2Å; A405-I460 HydrophobicContact CB-CD1 3.92Å; W447-I460 HydrophobicContact CH2-CD1 4.28Å; W447-I460 HydrophobicContact CZ3-CD1 3.82Å; F456-I460 HydrophobicContact CD1-CD1 3.55Å; F456-I460 HydrophobicContact CD1-CG1 4.04Å; F456-I460 HydrophobicContact CE1-CD1 3.89Å; F456-I460 HydrophobicContact CE1-CG1 4.22Å; F456-I460 WeakPolarHBondContact O-CG1 3.36Å; F456-I460 PolarHBondContact O-N 3.04Å; G457-I460 PolarHBondContact O-N 3.38Å; R458-I460 VanDerWaalsContact C-N 3.35Å; R458-I460 PolarHBondContact O-N 3.47Å; I460-E462 VanDerWaalsContact C-N 3.3Å; I460-E462 PolarHBondContact O-N 3.43Å; I460-C463 WeakPolarHBondContact O-CB 3.36Å; I460-C463 PolarHBondContact O-N 3.22Å; I460-C463 VanDerWaalsContact O-N 3.08Å; I460-W464 HydrophobicContact CG2-CD2 3.69Å; I460-W464 HydrophobicContact CG2-CE3 3.44Å; I460-W464 VanDerWaalsContact CG2-CE3 3.44Å; I460-W464 HydrophobicContact CG2-CH2 3.17Å; I460-W464 HydrophobicContact CG2-CZ2 3.4Å; I460-W464 HydrophobicContact CG2-CZ3 3.19Å; I460-W464 PolarHBondContact O-N 3.1Å; I460-W464 VanDerWaalsContact O-N 3.13Å
461	V	97.3	Very high	95.4	Very high	71 Å²	71	51.5 Å²	51.5	43%	0.43	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-39.6	-179.6	173	0	0	0	0	112.3	V443 G457 R458 L459 W464 H465	V443-V461 HydrophobicContact CG2-CG2 4.25Å; G457-V461 WeakPolarHBondContact O-CG2 3.34Å; G457-V461 PolarHBondContact O-N 3.05Å; R458-V461 PolarHBondContact O-N 3.48Å; L459-V461 VanDerWaalsContact C-N 3.33Å; L459-V461 PolarHBondContact O-N 3.22Å; V461-W464 HydrophobicContact CG2-CZ2 4.36Å; V461-H465 PolarHBondContact O-N 2.84Å
462	E	97.8	Very high	95.8	Very high	93 Å²	93	44.6 Å²	44.6	44%	0.435	24%	0.236	S	C	.	.	H	α-helix	trans	-69.4	-32.8	175.2	-66	174.4	-175.1	0	0	112.2	R458 L459 I460 R471 L472	R458-E462 WeakPolarHBondContact O-CG 3.16Å; R458-E462 PolarHBondContact O-N 2.77Å; L459-E462 PolarHBondContact O-N 2.87Å; I460-E462 VanDerWaalsContact C-N 3.3Å; I460-E462 PolarHBondContact O-N 3.43Å; E462-R471 WeakPolarHBondContact O-CA 2.82Å; E462-L472 HydrophobicContact CB-CD1 3.86Å; E462-L472 HydrophobicContact CB-CD2 4.28Å; E462-L472 HydrophobicContact CB-CG 3.73Å; E462-L472 WeakPolarHBondContact OE2-CD1 3.1Å; E462-L472 WeakPolarHBondContact OE2-CD2 3.5Å
463	C	98.5	Very high	96.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-39.2	177.4	-75	0	0	0	0	113.4	M394 Y395 L459 I460 R471 V477	M394-C463 CarbonylContact C-O 3.6Å; Y395-C463 WeakPolarHBondContact CA-O 3.47Å; L459-C463 PolarHBondContact O-N 2.84Å; L459-C463 PolarHBondContact O-SG 2.78Å; L459-C463 VanDerWaalsContact O-SG 3.33Å; I460-C463 WeakPolarHBondContact O-CB 3.36Å; I460-C463 PolarHBondContact O-N 3.22Å; I460-C463 VanDerWaalsContact O-N 3.08Å; C463-R471 VanDerWaalsContact O-CD 3.26Å; C463-R471 WeakPolarHBondContact O-CD 2.91Å; C463-R471 VanDerWaalsContact O-CG 3.28Å; C463-R471 WeakPolarHBondContact O-CG 3.29Å; C463-V477 VanDerWaalsContact SG-CG2 3.59Å
464	W	97.7	Very high	96.6	Very high	11 Å²	11	45.9 Å²	45.9	4%	0.042	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	21.1	-175.6	65.7	29.8	0	0	0	114.7	Y395 L399 W402 R440 P441 V443 I460 V461	Y395-W464 HydrophobicContact CD2-CB 3.72Å; Y395-W464 HydrophobicContact CE2-CB 3.92Å; Y395-W464 HydrophobicContact CG-CB 4.48Å; L399-W464 HydrophobicContact CD2-CE3 3.67Å; L399-W464 HydrophobicContact CD2-CZ3 3.99Å; L399-W464 HydrophobicContact CG-CE3 4.44Å; W402-W464 HydrophobicContact CB-CH2 4.02Å; W402-W464 HydrophobicContact CB-CZ3 3.6Å; W402-W464 AromaticContact CD1-CH2 3.68Å; W402-W464 AromaticContact CG-CH2 3.98Å; W402-W464 HydrophobicContact CG-CH2 3.98Å; W402-W464 AromaticContact CG-CZ3 3.94Å; W402-W464 HydrophobicContact CG-CZ3 3.94Å; R440-W464 HydrophobicContact CB-CZ2 4.09Å; R440-W464 HydrophobicContact CG-CG 4.42Å; R440-W464 PolarHBondContact NE-O 2.99Å; R440-W464 PolarHBondContact NH2-O 2.83Å; P441-W464 HydrophobicContact CB-CH2 4.08Å; P441-W464 HydrophobicContact CB-CZ3 4.19Å; P441-W464 HydrophobicContact CG-CH2 4.23Å; P441-W464 HydrophobicContact CG-CZ3 3.91Å; P441-W464 WeakPolarHBondContact O-CH2 3.37Å; V443-W464 HydrophobicContact CG2-CH2 4.21Å; V443-W464 HydrophobicContact CG2-CZ2 3.93Å; I460-W464 HydrophobicContact CG2-CD2 3.69Å; I460-W464 HydrophobicContact CG2-CE3 3.44Å; I460-W464 VanDerWaalsContact CG2-CE3 3.44Å; I460-W464 HydrophobicContact CG2-CH2 3.17Å; I460-W464 HydrophobicContact CG2-CZ2 3.4Å; I460-W464 HydrophobicContact CG2-CZ3 3.19Å; I460-W464 PolarHBondContact O-N 3.1Å; I460-W464 VanDerWaalsContact O-N 3.13Å; V461-W464 HydrophobicContact CG2-CZ2 4.36Å
465	H	97.6	Very high	96.9	Very high	84 Å²	84	47.8 Å²	47.8	39%	0.389	25%	0.254	S	S	.	.			trans	-54	143	178.9	-169	-81.2	0	0	0	111.5	V461 Q467 A470 R471	V461-H465 PolarHBondContact O-N 2.84Å; H465-Q467 PolarHBondContact ND1-N 3.07Å; H465-Q467 PolarHBondContact ND1-O 3.35Å; H465-Q467 PolarHBondContact O-N 3.21Å; H465-A470 HydrophobicContact CB-CB 4.32Å; H465-A470 WeakPolarHBondContact ND1-CB 3.46Å; H465-R471 HydrophobicContact CB-CG 4.12Å; H465-R471 PolarHBondContact O-NE 2.8Å; H465-R471 PolarHBondContact O-NH2 2.82Å
466	Q	95.8	Very high	97.2	Very high	82 Å²	82	52.6 Å²	52.6	38%	0.383	27%	0.266	S	S	.	.	S	Bend	trans	-56.4	-53.9	-178.9	-175.9	64	20	0	0	111.2	P374 P468 R471	P374-Q466 VanDerWaalsContact CB-NE2 3.3Å; Q466-P468 WeakPolarHBondContact O-CD 3.25Å; Q466-R471 PolarHBondContact O-NH2 3.33Å; Q466-R471 VanDerWaalsContact O-NH2 3.15Å
467	Q	96.3	Very high	97.4	Very high	103 Å²	103	52.6 Å²	52.6	48%	0.481	27%	0.266	S	S	.	.	S	Bend	trans	-70.2	120	175.1	-176.7	60.3	37.4	0	0	111.4	H465 T469 A470	H465-Q467 PolarHBondContact ND1-N 3.07Å; H465-Q467 PolarHBondContact ND1-O 3.35Å; H465-Q467 PolarHBondContact O-N 3.21Å; Q467-T469 VanDerWaalsContact C-N 3.32Å; Q467-T469 VanDerWaalsContact CG-OG1 3.27Å; Q467-T469 WeakPolarHBondContact CG-OG1 3.43Å; Q467-T469 PolarHBondContact NE2-OG1 2.8Å; Q467-T469 PolarHBondContact O-N 3.25Å; Q467-A470 HydrophobicContact CB-CB 4.35Å; Q467-A470 PolarHBondContact O-N 3.46Å
468	P	97.3	Very high	97.5	Very high	22 Å²	22	55.1 Å²	55.1	14%	0.143	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-58.1	-38.4	-178.4	-27.6	36	0	0	0	114.5	E375 Q391 Q466 A470 R471	E375-P468 HydrophobicContact CB-CG 4.36Å; E375-P468 HydrophobicContact CG-CG 4.03Å; Q391-P468 HydrophobicContact CB-CB 3.89Å; Q391-P468 HydrophobicContact CG-CB 4.41Å; Q466-P468 WeakPolarHBondContact O-CD 3.25Å; P468-A470 PolarHBondContact O-N 3.46Å; P468-R471 WeakPolarHBondContact O-CB 3.42Å; P468-R471 WeakPolarHBondContact O-CG 3Å; P468-R471 PolarHBondContact O-N 3.47Å; P468-R471 VanDerWaalsContact O-N 3.16Å
469	T	96.8	Very high	97.6	Very high	101 Å²	101	53.1 Å²	53.1	62%	0.62	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-71.1	-13.6	-178	51.5	0	0	0	0	114.6	Q467	Q467-T469 VanDerWaalsContact C-N 3.32Å; Q467-T469 VanDerWaalsContact CG-OG1 3.27Å; Q467-T469 WeakPolarHBondContact CG-OG1 3.43Å; Q467-T469 PolarHBondContact NE2-OG1 2.8Å; Q467-T469 PolarHBondContact O-N 3.25Å
470	A	97.7	Very high	97.6	Very high	52 Å²	52	54.5 Å²	54.5	43%	0.43	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-88.6	-10.1	175.1	0	0	0	0	0	112.6	H465 Q467 P468	H465-A470 HydrophobicContact CB-CB 4.32Å; H465-A470 WeakPolarHBondContact ND1-CB 3.46Å; Q467-A470 HydrophobicContact CB-CB 4.35Å; Q467-A470 PolarHBondContact O-N 3.46Å; P468-A470 PolarHBondContact O-N 3.46Å
471	R	98.5	Very high	97.5	Very high	19 Å²	19	54.5 Å²	54.5	7%	0.072	28%	0.281	C	S	.	.	S	Bend	trans	-71.5	144.3	-177.1	-59.8	176.5	-168.6	147.9	10.8	111.2	E375 Q391 M394 E462 C463 H465 Q466 P468	E375-R471 IonicContact OE1-CZ 3.52Å; E375-R471 IonicContact OE1-NH1 3.51Å; E375-R471 PolarHBondContact OE1-NH1 3.11Å; E375-R471 IonicContact OE1-NH2 2.75Å; E375-R471 PolarHBondContact OE1-NH2 3.28Å; E375-R471 IonicContact OE2-CZ 3.92Å; E375-R471 IonicContact OE2-NH1 3.5Å; E375-R471 PolarHBondContact OE2-NH1 3.38Å; E375-R471 IonicContact OE2-NH2 2.72Å; E375-R471 PolarHBondContact OE2-NH2 3.14Å; Q391-R471 VanDerWaalsContact C-NH1 3.33Å; Q391-R471 VanDerWaalsContact O-CD 3.31Å; Q391-R471 WeakPolarHBondContact O-CD 3.03Å; Q391-R471 PolarHBondContact O-NH1 2.72Å; M394-R471 HydrophobicContact CB-CB 4.48Å; E462-R471 WeakPolarHBondContact O-CA 2.82Å; C463-R471 VanDerWaalsContact O-CD 3.26Å; C463-R471 WeakPolarHBondContact O-CD 2.91Å; C463-R471 VanDerWaalsContact O-CG 3.28Å; C463-R471 WeakPolarHBondContact O-CG 3.29Å; H465-R471 HydrophobicContact CB-CG 4.12Å; H465-R471 PolarHBondContact O-NE 2.8Å; H465-R471 PolarHBondContact O-NH2 2.82Å; Q466-R471 PolarHBondContact O-NH2 3.33Å; Q466-R471 VanDerWaalsContact O-NH2 3.15Å; P468-R471 WeakPolarHBondContact O-CB 3.42Å; P468-R471 WeakPolarHBondContact O-CG 3Å; P468-R471 PolarHBondContact O-N 3.47Å; P468-R471 VanDerWaalsContact O-N 3.16Å
472	L	98.4	Very high	97.3	Very high	25 Å²	25	53 Å²	53	13%	0.131	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-63.1	147.7	172.4	-60.5	179.4	0	0	0	110.8	M394 L459 E462 R476 V477	M394-L472 WeakPolarHBondContact CE-O 3.49Å; M394-L472 WeakPolarHBondContact CG-O 3.49Å; L459-L472 HydrophobicContact CD1-CD1 4.28Å; L459-L472 HydrophobicContact CG-CD1 3.91Å; E462-L472 HydrophobicContact CB-CD1 3.86Å; E462-L472 HydrophobicContact CB-CD2 4.28Å; E462-L472 HydrophobicContact CB-CG 3.73Å; E462-L472 WeakPolarHBondContact OE2-CD1 3.1Å; E462-L472 WeakPolarHBondContact OE2-CD2 3.5Å; L472-R476 HydrophobicContact CB-CG 4.49Å; L472-R476 HydrophobicContact CD2-CG 3.9Å; L472-V477 HydrophobicContact CB-CG2 3.83Å; L472-V477 HydrophobicContact CD1-CG2 3.94Å
473	S	98.5	Very high	97.1	Very high	64 Å²	64	56.3 Å²	56.3	45%	0.448	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-78.7	154.9	167.4	67.7	0	0	0	0	111.3	L475 R476 V477	S473-L475 PolarHBondContact O-N 2.92Å; S473-R476 WeakPolarHBondContact O-CB 3.43Å; S473-R476 PolarHBondContact O-N 2.93Å; S473-R476 PolarHBondContact OG-N 2.01Å; S473-V477 PolarHBondContact O-N 3.38Å
474	A	98.7	Very high	96.7	Very high	2 Å²	2	57.4 Å²	57.4	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-55	-38.2	176.4	0	0	0	0	0	112.3	L306 A307 M394 R476 V477 K478	L306-A474 HydrophobicContact CB-CB 4.17Å; L306-A474 HydrophobicContact CD2-CB 4.24Å; L306-A474 HydrophobicContact CG-CB 3.95Å; A307-A474 HydrophobicContact CB-CB 3.98Å; M394-A474 HydrophobicContact CE-CB 4.47Å; M394-A474 VanDerWaalsContact SD-CA 3.54Å; M394-A474 HydrophobicContact SD-CB 3.64Å; M394-A474 PolarHBondContact SD-N 2.92Å; A474-R476 PolarHBondContact O-N 2.98Å; A474-V477 PolarHBondContact O-N 3.28Å; A474-K478 WeakPolarHBondContact O-CB 3.38Å; A474-K478 PolarHBondContact O-N 3.29Å
475	L	98.3	Very high	96.4	Very high	81 Å²	81	58 Å²	58	42%	0.424	29%	0.293	S	S	.	.	H	α-helix	trans	-63.9	-38.4	176	-178.5	61.4	0	0	0	112.6	S473 K479	S473-L475 PolarHBondContact O-N 2.92Å; L475-K479 WeakPolarHBondContact O-CG 3.39Å; L475-K479 PolarHBondContact O-N 2.82Å
476	R	98.1	Very high	96.1	Very high	127 Å²	127	56.6 Å²	56.6	48%	0.479	30%	0.297	S	S	.	.	H	α-helix	trans	-68.4	-41.2	176.9	177.4	55.4	179.3	-173.5	0.2	111.1	L472 S473 A474 K479 T480	L472-R476 HydrophobicContact CB-CG 4.49Å; L472-R476 HydrophobicContact CD2-CG 3.9Å; S473-R476 WeakPolarHBondContact O-CB 3.43Å; S473-R476 PolarHBondContact O-N 2.93Å; S473-R476 PolarHBondContact OG-N 2.01Å; A474-R476 PolarHBondContact O-N 2.98Å; R476-K479 PolarHBondContact O-N 3.32Å; R476-T480 PolarHBondContact O-N 3.36Å; R476-T480 VanDerWaalsContact O-N 3.11Å; R476-T480 PolarHBondContact O-OG1 3.34Å
477	V	98.3	Very high	95.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-48.9	174	176.5	0	0	0	0	110.7	M394 F397 L401 L459 C463 L472 S473 A474 K479 T480 M481	M394-V477 HydrophobicContact CE-CB 4.4Å; M394-V477 HydrophobicContact CE-CG2 3.62Å; F397-V477 HydrophobicContact CE1-CG1 3.92Å; L401-V477 HydrophobicContact CD1-CG1 4.2Å; L459-V477 HydrophobicContact CD1-CG1 4.27Å; L459-V477 HydrophobicContact CD1-CG2 4.47Å; L459-V477 HydrophobicContact CD2-CG1 3.91Å; L459-V477 HydrophobicContact CD2-CG2 4.28Å; L459-V477 HydrophobicContact CG-CG2 4.48Å; C463-V477 VanDerWaalsContact SG-CG2 3.59Å; L472-V477 HydrophobicContact CB-CG2 3.83Å; L472-V477 HydrophobicContact CD1-CG2 3.94Å; S473-V477 PolarHBondContact O-N 3.38Å; A474-V477 PolarHBondContact O-N 3.28Å; V477-K479 VanDerWaalsContact C-N 3.35Å; V477-K479 PolarHBondContact O-N 3.21Å; V477-T480 PolarHBondContact O-N 3.13Å; V477-M481 HydrophobicContact CG1-CG 4.12Å; V477-M481 WeakPolarHBondContact O-CG 3.49Å; V477-M481 PolarHBondContact O-N 3.28Å
478	K	98.2	Very high	95.1	Very high	56 Å²	56	53.1 Å²	53.1	24%	0.243	29%	0.285	C	S	.	.	H	α-helix	trans	-51	-50.8	174.6	-179.3	-169.9	179.7	165.4	0	112	Y300 S303 S304 A307 A474 T480 M481 A482	Y300-K478 HydrophobicContact CD2-CG 4.27Å; Y300-K478 HydrophobicContact CE2-CG 3.83Å; S303-K478 WeakPolarHBondContact OG-CA 3.14Å; S304-K478 WeakPolarHBondContact OG-CE 2.95Å; S304-K478 PolarHBondContact OG-NZ 3.47Å; A307-K478 HydrophobicContact CB-CD 4.28Å; A474-K478 WeakPolarHBondContact O-CB 3.38Å; A474-K478 PolarHBondContact O-N 3.29Å; K478-T480 VanDerWaalsContact C-N 3.27Å; K478-T480 PolarHBondContact O-N 2.96Å; K478-M481 PolarHBondContact O-N 3.42Å; K478-A482 WeakPolarHBondContact O-CB 3.47Å; K478-A482 PolarHBondContact O-N 3.37Å
479	K	97.2	Very high	94.3	Very high	115 Å²	115	52.3 Å²	52.3	50%	0.5	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-34.8	179.6	-75.7	-177	178.3	-171.6	0	112.7	L475 R476 V477	L475-K479 WeakPolarHBondContact O-CG 3.39Å; L475-K479 PolarHBondContact O-N 2.82Å; R476-K479 PolarHBondContact O-N 3.32Å; V477-K479 VanDerWaalsContact C-N 3.35Å; V477-K479 PolarHBondContact O-N 3.21Å
480	T	95.4	Very high	93.5	Very high	36 Å²	36	49.6 Å²	49.6	22%	0.221	27%	0.267	C	S	.	.	H	α-helix	trans	-73.3	-45.5	178.3	-51.6	0	0	0	0	110.7	L459 R476 V477 K478 A482 R483 L484	L459-T480 HydrophobicContact CD1-CG2 3.6Å; R476-T480 PolarHBondContact O-N 3.36Å; R476-T480 VanDerWaalsContact O-N 3.11Å; R476-T480 PolarHBondContact O-OG1 3.34Å; V477-T480 PolarHBondContact O-N 3.13Å; K478-T480 VanDerWaalsContact C-N 3.27Å; K478-T480 PolarHBondContact O-N 2.96Å; T480-A482 VanDerWaalsContact C-N 3.31Å; T480-A482 PolarHBondContact O-N 3.13Å; T480-R483 WeakPolarHBondContact O-CB 3.31Å; T480-R483 PolarHBondContact O-N 3.07Å; T480-L484 PolarHBondContact O-N 2.99Å
481	M	94.7	Very high	92.2	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-34.5	176.5	-67.7	-59.9	111.8	0	0	112.8	A299 Y300 F456 L459 V477 K478 R483 L484 L485	A299-M481 HydrophobicContact CB-CG 4.08Å; A299-M481 HydrophobicContact CB-SD 3.58Å; A299-M481 VanDerWaalsContact CB-SD 3.58Å; Y300-M481 HydrophobicContact CD2-CB 4.21Å; F456-M481 HydrophobicContact CD2-CE 3.92Å; F456-M481 HydrophobicContact CD2-SD 3.97Å; F456-M481 HydrophobicContact CE2-CE 3.93Å; F456-M481 HydrophobicContact CE2-SD 3.41Å; F456-M481 WeakPolarHBondContact CE2-SD 3.42Å; F456-M481 HydrophobicContact CZ-SD 4.14Å; L459-M481 HydrophobicContact CD1-CE 3.5Å; L459-M481 HydrophobicContact CD2-CE 4.05Å; L459-M481 HydrophobicContact CG-CE 4.27Å; V477-M481 HydrophobicContact CG1-CG 4.12Å; V477-M481 WeakPolarHBondContact O-CG 3.49Å; V477-M481 PolarHBondContact O-N 3.28Å; K478-M481 PolarHBondContact O-N 3.42Å; M481-R483 VanDerWaalsContact C-N 3.27Å; M481-R483 PolarHBondContact O-N 3.22Å; M481-L484 HydrophobicContact CE-CD1 3.53Å; M481-L484 PolarHBondContact O-N 3.01Å; M481-L484 HydrophobicContact SD-CD1 4.22Å; M481-L485 VanDerWaalsContact O-CB 3.31Å; M481-L485 WeakPolarHBondContact O-CB 3.12Å; M481-L485 PolarHBondContact O-N 3.49Å
482	A	94.6	Very high	90.8	Very high	38 Å²	38	53.7 Å²	53.7	31%	0.314	28%	0.278	S	S	.	.	H	α-helix	trans	-58.8	-39.8	174.4	0	0	0	0	0	112.2	Y300 K478 T480 A486	Y300-A482 HydrophobicContact CD2-CB 3.93Å; Y300-A482 HydrophobicContact CE2-CB 3.63Å; K478-A482 WeakPolarHBondContact O-CB 3.47Å; K478-A482 PolarHBondContact O-N 3.37Å; T480-A482 VanDerWaalsContact C-N 3.31Å; T480-A482 PolarHBondContact O-N 3.13Å; A482-A486 WeakPolarHBondContact O-CB 3.07Å; A482-A486 PolarHBondContact O-N 3.07Å
483	R	92.8	Very high	89.3	Confident	164 Å²	164	58.2 Å²	58.2	62%	0.619	29%	0.293	S	S	*	.	H	α-helix	trans	-68	-50.3	176.9	-66.5	173.9	-176.3	179.9	-3.9	110.9	T480 M481 L485 A486 D487	T480-R483 WeakPolarHBondContact O-CB 3.31Å; T480-R483 PolarHBondContact O-N 3.07Å; M481-R483 VanDerWaalsContact C-N 3.27Å; M481-R483 PolarHBondContact O-N 3.22Å; R483-L485 VanDerWaalsContact C-N 3.25Å; R483-L485 PolarHBondContact O-N 2.03Å; R483-A486 WeakPolarHBondContact O-CB 3.12Å; R483-A486 PolarHBondContact O-N 2.79Å; R483-A486 VanDerWaalsContact O-N 3.08Å; R483-D487 VanDerWaalsContact O-CG 3.25Å; R483-D487 PolarHBondContact O-N 2.95Å
484	L	90.1	Very high	87.5	Confident	23 Å²	23	60.4 Å²	60.4	12%	0.12	30%	0.299	C	S	.	.	H	α-helix	trans	-59.3	-37	177.9	-65.2	-179.5	0	0	0	112.6	A455 F456 T480 M481 D487 A488	A455-L484 HydrophobicContact CB-CD2 4.43Å; F456-L484 HydrophobicContact CD2-CD1 4.21Å; T480-L484 PolarHBondContact O-N 2.99Å; M481-L484 HydrophobicContact CE-CD1 3.53Å; M481-L484 PolarHBondContact O-N 3.01Å; M481-L484 HydrophobicContact SD-CD1 4.22Å; L484-D487 PolarHBondContact O-N 3.17Å; L484-A488 WeakPolarHBondContact O-CB 3.38Å; L484-A488 PolarHBondContact O-N 1.98Å
485	L	91.5	Very high	85.6	Confident	22 Å²	22	63.2 Å²	63.2	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-67.7	-42.5	175.4	-179.9	59.2	0	0	0	111.7	E293 A296 R297 Y300 M481 R483 D487 A488 C489	E293-L485 HydrophobicContact CG-CD1 4.43Å; A296-L485 HydrophobicContact CB-CB 4.02Å; A296-L485 HydrophobicContact CB-CD1 3.97Å; R297-L485 HydrophobicContact CB-CD1 4.04Å; Y300-L485 HydrophobicContact CD1-CD2 3.64Å; Y300-L485 HydrophobicContact CE1-CD2 4.37Å; Y300-L485 HydrophobicContact CG-CD2 4Å; M481-L485 VanDerWaalsContact O-CB 3.31Å; M481-L485 WeakPolarHBondContact O-CB 3.12Å; M481-L485 PolarHBondContact O-N 3.49Å; R483-L485 VanDerWaalsContact C-N 3.25Å; R483-L485 PolarHBondContact O-N 2.03Å; L485-D487 VanDerWaalsContact C-N 3.29Å; L485-D487 PolarHBondContact O-N 2.87Å; L485-A488 PolarHBondContact O-N 2.79Å; L485-C489 VanDerWaalsContact O-CB 3.24Å; L485-C489 WeakPolarHBondContact O-CB 2.88Å; L485-C489 PolarHBondContact O-N 2.85Å; L485-C489 PolarHBondContact O-SG 2.94Å
486	A	90.7	Very high	83.6	Confident	56 Å²	56	62.1 Å²	62.1	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-60.2	-42	175.2	0	0	0	0	0	111.5	A482 R483 A490	A482-A486 WeakPolarHBondContact O-CB 3.07Å; A482-A486 PolarHBondContact O-N 3.07Å; R483-A486 WeakPolarHBondContact O-CB 3.12Å; R483-A486 PolarHBondContact O-N 2.79Å; R483-A486 VanDerWaalsContact O-N 3.08Å; A486-A490 WeakPolarHBondContact O-CB 3.26Å; A486-A490 PolarHBondContact O-N 3.37Å
487	D	86.7	Confident	81.5	Confident	104 Å²	104	62.2 Å²	62.2	56%	0.556	32%	0.318	S	S	*	.	H	α-helix	trans	-67.5	-44.6	178.6	-61.6	-24.8	0	0	0	111.7	R483 L484 L485 C489 A490 Y491	R483-D487 VanDerWaalsContact O-CG 3.25Å; R483-D487 PolarHBondContact O-N 2.95Å; L484-D487 PolarHBondContact O-N 3.17Å; L485-D487 VanDerWaalsContact C-N 3.29Å; L485-D487 PolarHBondContact O-N 2.87Å; D487-C489 VanDerWaalsContact C-N 3.35Å; D487-C489 PolarHBondContact O-N 2.9Å; D487-A490 PolarHBondContact O-N 3.01Å; D487-Y491 PolarHBondContact O-N 3.05Å
488	A	84.8	Confident	79.5	Confident	7 Å²	7	70 Å²	70	6%	0.058	36%	0.356	C	S	.	.	H	α-helix	trans	-61.1	-42.9	176.7	0	0	0	0	0	112.2	R292 L484 L485 A490 Y491 S492	R292-A488 HydrophobicContact CG-CB 3.98Å; L484-A488 WeakPolarHBondContact O-CB 3.38Å; L484-A488 PolarHBondContact O-N 1.98Å; L485-A488 PolarHBondContact O-N 2.79Å; A488-A490 VanDerWaalsContact C-N 3.31Å; A488-A490 PolarHBondContact O-N 3.13Å; A488-Y491 PolarHBondContact O-N 2.78Å; A488-S492 PolarHBondContact O-N 2.96Å; A488-S492 PolarHBondContact O-OG 2.94Å
489	C	81.5	Confident	77.4	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.034	38%	0.377	C	S	.	.	H	α-helix	trans	-69	-25.3	176.2	-76.7	0	0	0	0	114.1	L485 D487 S492 R493 C507	L485-C489 VanDerWaalsContact O-CB 3.24Å; L485-C489 WeakPolarHBondContact O-CB 2.88Å; L485-C489 PolarHBondContact O-N 2.85Å; L485-C489 PolarHBondContact O-SG 2.94Å; D487-C489 VanDerWaalsContact C-N 3.35Å; D487-C489 PolarHBondContact O-N 2.9Å; C489-S492 WeakPolarHBondContact CA-OG 3.24Å; C489-S492 PolarHBondContact O-OG 3.47Å; C489-R493 WeakPolarHBondContact O-CG 3.47Å; C489-R493 PolarHBondContact O-N 3.44Å; C489-R493 PolarHBondContact O-NE 2.98Å; C489-R493 VanDerWaalsContact O-NE 3.15Å; C489-C507 WeakPolarHBondContact CB-SG 3.04Å; C489-C507 PolarHBondContact SG-SG 2.7Å
490	A	79.3	Confident	74.7	Confident	44 Å²	44	71.5 Å²	71.5	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-74.9	-41.4	173.3	0	0	0	0	0	110.3	A486 D487 A488 R493 L494	A486-A490 WeakPolarHBondContact O-CB 3.26Å; A486-A490 PolarHBondContact O-N 3.37Å; D487-A490 PolarHBondContact O-N 3.01Å; A488-A490 VanDerWaalsContact C-N 3.31Å; A488-A490 PolarHBondContact O-N 3.13Å; A490-R493 PolarHBondContact O-N 3.34Å; A490-L494 WeakPolarHBondContact O-CG 3.26Å; A490-L494 PolarHBondContact O-N 3.27Å
491	Y	71.3	Confident	72.2	Confident	126 Å²	126	73.5 Å²	73.5	49%	0.494	40%	0.401	S	S	.	.	H	α-helix	trans	-61	-48	175.9	-167.7	-89	0	0	0	111.8	D487 A488 R493 L494 D495	D487-Y491 PolarHBondContact O-N 3.05Å; A488-Y491 PolarHBondContact O-N 2.78Å; Y491-R493 VanDerWaalsContact C-N 3.28Å; Y491-R493 PolarHBondContact O-N 2.01Å; Y491-L494 PolarHBondContact O-N 3.36Å; Y491-L494 VanDerWaalsContact O-N 3.13Å; Y491-D495 WeakPolarHBondContact CE1-OD2 3.43Å; Y491-D495 PolarHBondContact O-N 3.16Å
492	S	68.8	Low	69.3	Low	32 Å²	32	84.1 Å²	84.1	22%	0.224	45%	0.447	C	S	.	.	H	α-helix	trans	-61.5	-35.6	178.2	60.9	0	0	0	0	112.9	E293 A488 C489 L496	E293-S492 WeakPolarHBondContact OE2-CB 3.39Å; E293-S492 PolarHBondContact OE2-OG 2.99Å; A488-S492 PolarHBondContact O-N 2.96Å; A488-S492 PolarHBondContact O-OG 2.94Å; C489-S492 WeakPolarHBondContact CA-OG 3.24Å; C489-S492 PolarHBondContact O-OG 3.47Å; S492-L496 WeakPolarHBondContact O-CB 3.06Å; S492-L496 WeakPolarHBondContact O-CD1 3.37Å; S492-L496 WeakPolarHBondContact O-CG 3.38Å; S492-L496 PolarHBondContact O-N 3.37Å; S492-L496 VanDerWaalsContact O-N 3.08Å
493	R	65.1	Low	66.5	Low	119 Å²	119	84.9 Å²	84.9	45%	0.449	46%	0.459	S	S	.	.	H	α-helix	trans	-69.7	-36.4	174.3	-80.1	-172.9	-92.9	-164.5	-6.5	113.6	C489 A490 Y491 N497 C507	C489-R493 WeakPolarHBondContact O-CG 3.47Å; C489-R493 PolarHBondContact O-N 3.44Å; C489-R493 PolarHBondContact O-NE 2.98Å; C489-R493 VanDerWaalsContact O-NE 3.15Å; A490-R493 PolarHBondContact O-N 3.34Å; Y491-R493 VanDerWaalsContact C-N 3.28Å; Y491-R493 PolarHBondContact O-N 2.01Å; R493-N497 WeakPolarHBondContact O-CB 3.43Å; R493-N497 PolarHBondContact O-N 2.93Å; R493-N497 PolarHBondContact O-ND2 2.04Å; R493-C507 PolarHBondContact NH2-SG 3.28Å
494	L	62.6	Low	63.9	Low	110 Å²	110	80.4 Å²	80.4	58%	0.576	46%	0.463	S	S	*	.	H	α-helix	trans	-66.9	-42.7	176.3	-72.7	167.9	0	0	0	111	A490 Y491 N497 M498	A490-L494 WeakPolarHBondContact O-CG 3.26Å; A490-L494 PolarHBondContact O-N 3.27Å; Y491-L494 PolarHBondContact O-N 3.36Å; Y491-L494 VanDerWaalsContact O-N 3.13Å; L494-N497 PolarHBondContact O-N 3.23Å; L494-M498 WeakPolarHBondContact O-CG 3.39Å; L494-M498 PolarHBondContact O-N 2.81Å
495	D	58.4	Low	61.5	Low	61 Å²	61	86.6 Å²	86.6	33%	0.326	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-43.6	175.6	-77.6	-17.2	0	0	0	111.9	Y491 N497 M498 L499	Y491-D495 WeakPolarHBondContact CE1-OD2 3.43Å; Y491-D495 PolarHBondContact O-N 3.16Å; D495-N497 VanDerWaalsContact C-N 3.34Å; D495-N497 PolarHBondContact O-N 3.07Å; D495-M498 PolarHBondContact O-N 3.41Å; D495-L499 WeakPolarHBondContact O-CB 3.44Å; D495-L499 WeakPolarHBondContact O-CG 3.34Å; D495-L499 PolarHBondContact O-N 2.87Å
496	L	56.4	Low	59.6	Low	59 Å²	59	92.1 Å²	92.1	31%	0.309	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175	-80	160.4	0	0	0	112.6	S492 L499 G500 T501	S492-L496 WeakPolarHBondContact O-CB 3.06Å; S492-L496 WeakPolarHBondContact O-CD1 3.37Å; S492-L496 WeakPolarHBondContact O-CG 3.38Å; S492-L496 PolarHBondContact O-N 3.37Å; S492-L496 VanDerWaalsContact O-N 3.08Å; L496-L499 PolarHBondContact O-N 2.8Å; L496-G500 PolarHBondContact O-N 3.43Å; L496-T501 PolarHBondContact O-N 2.82Å
497	N	54.4	Low	57.3	Low	129 Å²	129	91.3 Å²	91.3	69%	0.69	52%	0.515	S	S	*	.	H	α-helix	trans	-68.8	-34.9	176.8	-74.2	-21.5	0	0	0	112	R493 L494 D495	R493-N497 WeakPolarHBondContact O-CB 3.43Å; R493-N497 PolarHBondContact O-N 2.93Å; R493-N497 PolarHBondContact O-ND2 2.04Å; L494-N497 PolarHBondContact O-N 3.23Å; D495-N497 VanDerWaalsContact C-N 3.34Å; D495-N497 PolarHBondContact O-N 3.07Å
498	M	55.5	Low	55	Low	163 Å²	163	95 Å²	95	80%	0.803	53%	0.527	S	S	*	.	H	α-helix	trans	-72.9	-30	174	-68.5	-131.1	-66.5	0	0	112.8	L494 D495 G500	L494-M498 WeakPolarHBondContact O-CG 3.39Å; L494-M498 PolarHBondContact O-N 2.81Å; D495-M498 PolarHBondContact O-N 3.41Å; M498-G500 VanDerWaalsContact C-N 3.35Å
499	L	53.7	Low	52.5	Low	131 Å²	131	108.2 Å²	108.2	69%	0.686	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	7.3	179.3	-71.1	164	0	0	0	114	D495 L496 T501	D495-L499 WeakPolarHBondContact O-CB 3.44Å; D495-L499 WeakPolarHBondContact O-CG 3.34Å; D495-L499 PolarHBondContact O-N 2.87Å; L496-L499 PolarHBondContact O-N 2.8Å; L499-T501 PolarHBondContact O-N 3.39Å
500	G	41.1	Very low	51.1	Low	71 Å²	71	113.4 Å²	113.4	73%	0.732	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.9	16.5	174.3	0	0	0	0	0	115.2	L496 M498	L496-G500 PolarHBondContact O-N 3.43Å; M498-G500 VanDerWaalsContact C-N 3.35Å
501	T	42.5	Very low	49.6	Very low	78 Å²	78	117 Å²	117	48%	0.479	62%	0.623	S	S	.	*			trans	-103.3	110.5	-173.4	30.2	0	0	0	0	110.8	L496 L499 G503	L496-T501 PolarHBondContact O-N 2.82Å; L499-T501 PolarHBondContact O-N 3.39Å; T501-G503 PolarHBondContact O-N 3.4Å
502	K	34.6	Very low	48.4	Very low	224 Å²	224	116.5 Å²	116.5	97%	0.974	63%	0.63	S	S	*	*			trans	-75.3	97.7	170.4	-73.5	-175.8	178.2	178.5	0	109.4
503	G	34.4	Very low	47.2	Very low	55 Å²	55	121.5 Å²	121.5	57%	0.567	65%	0.654	S	S	*	*			trans	-173.1	116.4	170.3	0	0	0	0	0	113.3	T501	T501-G503 PolarHBondContact O-N 3.4Å
504	G	38.1	Very low	46	Very low	69 Å²	69	121.6 Å²	121.6	71%	0.711	67%	0.667	S	S	*	*			trans	157.7	76.6	172	0	0	0	0	0	114	L506	G504-L506 VanDerWaalsContact C-N 3.3Å; G504-L506 PolarHBondContact O-N 3Å
505	L	41	Very low	44.9	Very low	154 Å²	154	122.4 Å²	122.4	81%	0.806	67%	0.673	S	S	*	*			trans	-79.6	5.8	-172.9	-137.3	82.2	0	0	0	115.4
506	L	50.4	Low	44	Very low	137 Å²	137	126.8 Å²	126.8	72%	0.717	70%	0.697	S	S	*	*			trans	-102.5	14.3	-164.7	-90.1	128.6	0	0	0	115.8	G504	G504-L506 VanDerWaalsContact C-N 3.3Å; G504-L506 PolarHBondContact O-N 3Å
507	C	43.3	Very low	43	Very low	39 Å²	39	132 Å²	132	26%	0.264	73%	0.727	S	S	.	*			trans	-116.9	40.8	-178.8	-130	0	0	0	0	113.2	C489 R493	C489-C507 WeakPolarHBondContact CB-SG 3.04Å; C489-C507 PolarHBondContact SG-SG 2.7Å; R493-C507 PolarHBondContact NH2-SG 3.28Å
508	K	37.7	Very low	42.1	Very low	183 Å²	183	132.3 Å²	132.3	80%	0.796	73%	0.73	S	S	*	*			trans	-104.1	110	172.7	-78.7	-174.1	175.7	-180	0	109.7
509	K	32.6	Very low	40.9	Very low	283 Å²	283	129.5 Å²	129.5	100%	1.23	72%	0.724	S	S	*	*			trans	41.1	0	161	-73.3	-172.1	176.8	-177.7	0	119.5

Retrieved 509 of 509 residues in 1083.4 ms (Link to these results)

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