A0A087Y5S3_POEFO Loading...

Protein phosphatase, Mg2+/Mn2+ dependent, 1H

AlphaFold DB , UniProt , Accession A0A087Y5S3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 515 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	38.5	Very low	40	Very low	190 Å²	190	87.6 Å²	87.6	94%	0.936	48%	0.483	S	S	*	.				0	-53.4	0	-83.5	177.3	-177.8	0	0	112.3	T3 R4	M1-T3 PolarHBondContact O-N 3.1Å; M1-R4 PolarHBondContact O-N 2.76Å; M1-R4 VanDerWaalsContact O-N 3.07Å
2	L	38.6	Very low	40.1	Very low	107 Å²	107	89.3 Å²	89.3	56%	0.56	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-15.5	174.6	-81.4	157.6	0	0	0	116	K6	L2-K6 WeakPolarHBondContact O-CD 3.4Å; L2-K6 WeakPolarHBondContact O-CG 3.26Å
3	T	36.3	Very low	39.8	Very low	103 Å²	103	95.1 Å²	95.1	63%	0.632	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-22.8	176.5	40.3	0	0	0	0	113.9	M1 S7	M1-T3 PolarHBondContact O-N 3.1Å; T3-S7 PolarHBondContact O-N 3.02Å
4	R	45.1	Very low	39.3	Very low	160 Å²	160	91.9 Å²	91.9	60%	0.604	51%	0.514	S	S	*	.	H	α-helix	trans	-77.5	-49.7	-171	-65.7	-175.8	177.6	176.4	-3.7	112.4	M1 K6 S7	M1-R4 PolarHBondContact O-N 2.76Å; M1-R4 VanDerWaalsContact O-N 3.07Å; R4-K6 VanDerWaalsContact C-N 3.28Å; R4-K6 PolarHBondContact O-N 3.31Å; R4-S7 WeakPolarHBondContact O-CB 3.24Å; R4-S7 PolarHBondContact O-N 3.4Å; R4-S7 VanDerWaalsContact O-N 3.16Å
5	V	44.9	Very low	38.7	Very low	24 Å²	24	91.1 Å²	91.1	15%	0.145	54%	0.536	C	S	.	.	H	α-helix	trans	-68.3	-26.5	174.4	-173.4	0	0	0	0	112.4	S7 A8 V9 F371	V5-S7 VanDerWaalsContact C-N 3.26Å; V5-S7 PolarHBondContact O-N 2.98Å; V5-A8 PolarHBondContact O-N 3.15Å; V5-V9 HydrophobicContact CG1-CG2 4.37Å; V5-V9 VanDerWaalsContact O-CG2 3.28Å; V5-V9 WeakPolarHBondContact O-CG2 3.22Å; V5-V9 PolarHBondContact O-N 3.34Å; V5-F371 HydrophobicContact CB-CD2 4.39Å; V5-F371 HydrophobicContact CB-CE1 4.14Å; V5-F371 HydrophobicContact CB-CE2 3.58Å; V5-F371 HydrophobicContact CB-CZ 3.41Å; V5-F371 VanDerWaalsContact CB-CZ 3.41Å; V5-F371 HydrophobicContact CG1-CD1 3.91Å; V5-F371 HydrophobicContact CG1-CD2 4Å; V5-F371 HydrophobicContact CG1-CE1 3.43Å; V5-F371 VanDerWaalsContact CG1-CE1 3.43Å; V5-F371 HydrophobicContact CG1-CE2 3.55Å; V5-F371 HydrophobicContact CG1-CG 4.16Å; V5-F371 HydrophobicContact CG1-CZ 3.23Å; V5-F371 HydrophobicContact CG2-CD2 4.36Å; V5-F371 HydrophobicContact CG2-CE2 3.77Å; V5-F371 HydrophobicContact CG2-CZ 4.16Å
6	K	42.8	Very low	38	Very low	123 Å²	123	92.1 Å²	92.1	54%	0.535	54%	0.542	S	S	.	.	H	α-helix	trans	-63.3	-30.7	173.4	-81.6	-176.2	178.4	-173.8	0	112.7	L2 R4 A10	L2-K6 WeakPolarHBondContact O-CD 3.4Å; L2-K6 WeakPolarHBondContact O-CG 3.26Å; R4-K6 VanDerWaalsContact C-N 3.28Å; R4-K6 PolarHBondContact O-N 3.31Å; K6-A10 VanDerWaalsContact O-CB 3.23Å; K6-A10 WeakPolarHBondContact O-CB 3.42Å; K6-A10 PolarHBondContact O-N 3.32Å
7	S	36.9	Very low	37.6	Very low	77 Å²	77	96.9 Å²	96.9	54%	0.538	56%	0.561	S	S	.	*	H	α-helix	trans	-72.3	-42.8	179.9	-162	0	0	0	0	111.9	T3 R4 V5 V9 A10 S11	T3-S7 PolarHBondContact O-N 3.02Å; R4-S7 WeakPolarHBondContact O-CB 3.24Å; R4-S7 PolarHBondContact O-N 3.4Å; R4-S7 VanDerWaalsContact O-N 3.16Å; V5-S7 VanDerWaalsContact C-N 3.26Å; V5-S7 PolarHBondContact O-N 2.98Å; S7-V9 VanDerWaalsContact C-N 3.31Å; S7-V9 PolarHBondContact O-N 2.76Å; S7-A10 PolarHBondContact O-N 2.94Å; S7-S11 PolarHBondContact O-N 2.88Å; S7-S11 VanDerWaalsContact O-N 3.16Å
8	A	40.9	Very low	37	Very low	32 Å²	32	95.4 Å²	95.4	26%	0.264	56%	0.562	S	S	.	*	H	α-helix	trans	-61.5	-39.9	173.7	0	0	0	0	0	111.8	V5 H401	V5-A8 PolarHBondContact O-N 3.15Å; A8-H401 HydrophobicContact CB-CB 4.33Å
9	V	43.7	Very low	36.5	Very low	27 Å²	27	93.8 Å²	93.8	16%	0.164	57%	0.568	C	S	.	*	H	α-helix	trans	-74.1	-34	178.3	175.4	0	0	0	0	112.9	V5 S7 L12 M13 Y375	V5-V9 HydrophobicContact CG1-CG2 4.37Å; V5-V9 VanDerWaalsContact O-CG2 3.28Å; V5-V9 WeakPolarHBondContact O-CG2 3.22Å; V5-V9 PolarHBondContact O-N 3.34Å; S7-V9 VanDerWaalsContact C-N 3.31Å; S7-V9 PolarHBondContact O-N 2.76Å; V9-L12 PolarHBondContact O-N 3.49Å; V9-M13 PolarHBondContact O-N 3.29Å; V9-Y375 HydrophobicContact CG1-CE1 4.41Å; V9-Y375 WeakPolarHBondContact CG1-OH 3.49Å
10	A	36.6	Very low	36.1	Very low	68 Å²	68	92.9 Å²	92.9	56%	0.562	58%	0.578	S	S	*	*	H	α-helix	trans	-71.2	-34.5	178.7	0	0	0	0	0	112.7	K6 S7 L12 M13	K6-A10 VanDerWaalsContact O-CB 3.23Å; K6-A10 WeakPolarHBondContact O-CB 3.42Å; K6-A10 PolarHBondContact O-N 3.32Å; S7-A10 PolarHBondContact O-N 2.94Å; A10-L12 VanDerWaalsContact C-N 3.26Å; A10-L12 PolarHBondContact O-N 3.39Å; A10-M13 PolarHBondContact O-N 2.84Å
11	S	35.9	Very low	35.6	Very low	53 Å²	53	94.1 Å²	94.1	37%	0.371	59%	0.59	S	S	.	*	H	α-helix	trans	-60.4	-37.8	171.5	-169.6	0	0	0	0	111.5	S7 G14	S7-S11 PolarHBondContact O-N 2.88Å; S7-S11 VanDerWaalsContact O-N 3.16Å; S11-G14 PolarHBondContact O-N 2.9Å
12	L	40.8	Very low	35.3	Very low	108 Å²	108	91.6 Å²	91.6	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-72.5	-29.6	-177.3	-146.1	82	0	0	0	114.5	V9 A10	V9-L12 PolarHBondContact O-N 3.49Å; A10-L12 VanDerWaalsContact C-N 3.26Å; A10-L12 PolarHBondContact O-N 3.39Å
13	M	36.5	Very low	34.8	Very low	164 Å²	164	89.6 Å²	89.6	81%	0.808	59%	0.586	S	S	*	*	H	α-helix	trans	-83.9	-10.5	176.8	-76.6	-151.8	160.7	0	0	113.7	V9 A10	V9-M13 PolarHBondContact O-N 3.29Å; A10-M13 PolarHBondContact O-N 2.84Å
14	G	32.4	Very low	34.6	Very low	50 Å²	50	91.4 Å²	91.4	52%	0.515	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.9	-1.9	-173.5	0	0	0	0	0	116.2	S11 V16	S11-G14 PolarHBondContact O-N 2.9Å; G14-V16 PolarHBondContact O-N 3.45Å
15	G	31	Very low	34	Very low	81 Å²	81	92.2 Å²	92.2	84%	0.835	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.2	17	179.3	0	0	0	0	0	114.6
16	V	27	Very low	33.6	Very low	106 Å²	106	97.1 Å²	97.1	64%	0.642	63%	0.634	S	S	*	*			trans	-118.4	106	172.1	179.6	0	0	0	0	104.6	G14 A18	G14-V16 PolarHBondContact O-N 3.45Å; V16-A18 VanDerWaalsContact C-N 3.32Å; V16-A18 PolarHBondContact O-N 2.98Å
17	M	30.8	Very low	33.3	Very low	175 Å²	175	95.2 Å²	95.2	86%	0.862	65%	0.65	S	S	*	*			trans	-52.2	105.8	159.2	-73.2	-85	-166	0	0	105.6	G19	M17-G19 PolarHBondContact O-N 2.86Å
18	A	27.8	Very low	33.6	Very low	69 Å²	69	94.4 Å²	94.4	57%	0.57	65%	0.653	S	S	*	*			trans	-55.8	112.1	161.9	0	0	0	0	0	104.8	V16 G20	V16-A18 VanDerWaalsContact C-N 3.32Å; V16-A18 PolarHBondContact O-N 2.98Å; A18-G20 PolarHBondContact O-N 2.88Å
19	G	27.4	Very low	34.1	Very low	66 Å²	66	98.6 Å²	98.6	68%	0.68	68%	0.678	S	S	*	*			trans	-44.6	130.4	176.3	0	0	0	0	0	107.9	M17 S21	M17-G19 PolarHBondContact O-N 2.86Å; G19-S21 PolarHBondContact O-N 2.66Å
20	G	27.4	Very low	35.8	Very low	74 Å²	74	105 Å²	105	76%	0.763	71%	0.711	S	S	*	*			trans	-47.3	111.3	175.3	0	0	0	0	0	107.3	A18 N22	A18-G20 PolarHBondContact O-N 2.88Å; G20-N22 PolarHBondContact O-N 2.67Å
21	S	27	Very low	38	Very low	120 Å²	120	105.3 Å²	105.3	84%	0.839	70%	0.703	S	S	*	*			trans	-58.1	106.8	158.2	-104.2	0	0	0	0	103.5	G19 G23	G19-S21 PolarHBondContact O-N 2.66Å; S21-G23 VanDerWaalsContact C-N 3.3Å; S21-G23 PolarHBondContact O-N 3.15Å
22	N	31.5	Very low	40.7	Very low	136 Å²	136	106.5 Å²	106.5	73%	0.727	71%	0.709	S	S	*	*			trans	-41.5	110.9	151.4	-87.5	-4.1	0	0	0	105.2	G20 D24	G20-N22 PolarHBondContact O-N 2.67Å; N22-D24 PolarHBondContact O-N 3.08Å
23	G	28.6	Very low	43	Very low	66 Å²	66	106 Å²	106	68%	0.68	71%	0.706	S	S	*	*			trans	-63.6	85.2	157.1	0	0	0	0	0	105.1	S21 H25	S21-G23 VanDerWaalsContact C-N 3.3Å; S21-G23 PolarHBondContact O-N 3.15Å; G23-H25 PolarHBondContact O-N 3.13Å
24	D	31.9	Very low	45.7	Very low	141 Å²	141	101.1 Å²	101.1	75%	0.754	68%	0.681	S	S	*	*			trans	-60.5	82.6	159.9	-86.1	-14.9	0	0	0	105.9	N22 P26	N22-D24 PolarHBondContact O-N 3.08Å; D24-P26 WeakPolarHBondContact O-CD 3.31Å
25	H	32.3	Very low	48.6	Very low	176 Å²	176	101.7 Å²	101.7	82%	0.815	67%	0.669	S	S	*	*			trans	-68.7	117.8	154.6	-86.8	-58.8	0	0	0	106.3	G23 G27	G23-H25 PolarHBondContact O-N 3.13Å; H25-G27 PolarHBondContact O-N 3.3Å
26	P	36.2	Very low	51.6	Low	128 Å²	128	102.3 Å²	102.3	83%	0.831	66%	0.658	S	S	*	*	S	Bend	trans	-72	114.2	173.2	28.9	-29.1	0	0	0	108.4	D24	D24-P26 WeakPolarHBondContact O-CD 3.31Å
27	G	36.5	Very low	54.8	Low	83 Å²	83	100 Å²	100	86%	0.856	64%	0.639	S	S	*	*			trans	94.1	64.9	151	0	0	0	0	0	118.3	H25	H25-G27 PolarHBondContact O-N 3.3Å
28	G	43.6	Very low	57.7	Low	59 Å²	59	93.3 Å²	93.3	61%	0.608	61%	0.609	S	S	*	*			trans	-125	148.5	153.8	0	0	0	0	0	110	D30	G28-D30 PolarHBondContact O-N 2.71Å
29	P	51.7	Low	60.9	Low	120 Å²	120	90.4 Å²	90.4	78%	0.779	58%	0.583	S	S	*	*			trans	-62.1	132.7	172.1	26.5	-31.4	0	0	0	109.2	L31	P29-L31 PolarHBondContact O-N 2.77Å
30	D	78.5	Confident	64.2	Low	163 Å²	163	87.4 Å²	87.4	87%	0.872	55%	0.552	S	S	*	*			trans	-53.3	111.6	172.2	-77.3	-29.4	0	0	0	108.6	G28	G28-D30 PolarHBondContact O-N 2.71Å
31	L	83.9	Confident	67.3	Low	73 Å²	73	90 Å²	90	38%	0.382	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-61.3	141.5	177.8	-69.5	175.8	0	0	0	108.9	P29 N265	P29-L31 PolarHBondContact O-N 2.77Å; L31-N265 HydrophobicContact CB-CB 4.17Å
32	P	91.7	Very high	70.5	Confident	78 Å²	78	85.4 Å²	85.4	51%	0.506	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-64.4	154	177.4	28.1	-34.5	0	0	0	111.1	F264 N265	P32-F264 HydrophobicContact CG-CD1 4.12Å; P32-F264 HydrophobicContact CG-CE1 4.47Å; P32-F264 CarbonylContact O-C 3.26Å; P32-F264 WeakPolarHBondContact O-CA 3.3Å; P32-F264 WeakPolarHBondContact O-CB 3.39Å; P32-N265 PolarHBondContact O-N 2.85Å
33	L	89.5	Confident	73.5	Confident	97 Å²	97	78.9 Å²	78.9	51%	0.508	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-77.7	133.2	166.3	-64.8	171	0	0	0	109.2	N265	L33-N265 HydrophobicContact CD2-CB 4.07Å; L33-N265 WeakPolarHBondContact CD2-O 3.25Å
34	K	92.4	Very high	76.5	Confident	62 Å²	62	76.9 Å²	76.9	27%	0.27	45%	0.453	S	S	.	.	S	Bend	trans	-68.7	-47.2	171.6	-174.1	173.2	-179.3	-176.4	0	110.9	E260 F264	K34-E260 WeakPolarHBondContact CD-OE2 3.42Å; K34-E260 VanDerWaalsContact CE-OE2 3.3Å; K34-E260 WeakPolarHBondContact CE-OE2 3.4Å; K34-E260 IonicContact NZ-OE1 3.96Å; K34-E260 PolarHBondContact NZ-OE1 3.27Å; K34-E260 IonicContact NZ-OE2 2.75Å; K34-E260 PolarHBondContact NZ-OE2 2.79Å; K34-F264 HydrophobicContact CB-CB 4Å; K34-F264 HydrophobicContact CB-CD1 3.66Å; K34-F264 HydrophobicContact CB-CD2 3.95Å; K34-F264 HydrophobicContact CB-CE1 4.04Å; K34-F264 HydrophobicContact CB-CE2 4.31Å; K34-F264 HydrophobicContact CB-CG 3.61Å; K34-F264 HydrophobicContact CB-CZ 4.35Å; K34-F264 HydrophobicContact CD-CD2 4.09Å; K34-F264 HydrophobicContact CD-CE2 3.98Å; K34-F264 HydrophobicContact CD-CZ 4.41Å; K34-F264 HydrophobicContact CG-CD1 4.38Å; K34-F264 HydrophobicContact CG-CD2 4.31Å; K34-F264 HydrophobicContact CG-CE1 4.28Å; K34-F264 HydrophobicContact CG-CE2 4.21Å; K34-F264 HydrophobicContact CG-CG 4.39Å; K34-F264 HydrophobicContact CG-CZ 4.19Å
35	F	94.9	Very high	79.4	Confident	63 Å²	63	72.1 Å²	72.1	28%	0.276	43%	0.428	S	S	.	.	S	Bend	trans	-125.8	118	175	-58	-65	0	0	0	107.1	V157 M158 R161 L162	F35-V157 HydrophobicContact CB-CG1 3.68Å; F35-M158 HydrophobicContact CD2-CG 4.48Å; F35-M158 HydrophobicContact CE2-CG 4.29Å; F35-R161 HydrophobicContact CD1-CG 4.36Å; F35-R161 HydrophobicContact CD2-CB 4.37Å; F35-R161 HydrophobicContact CD2-CG 4.34Å; F35-R161 HydrophobicContact CE1-CB 4.47Å; F35-R161 HydrophobicContact CE2-CB 4.08Å; F35-R161 HydrophobicContact CE2-CG 4.5Å; F35-R161 HydrophobicContact CG-CG 4.26Å; F35-R161 HydrophobicContact CZ-CB 4.13Å; F35-L162 HydrophobicContact CE2-CD1 3.93Å; F35-L162 HydrophobicContact CE2-CG 4.17Å; F35-L162 HydrophobicContact CZ-CD1 4.3Å; F35-L162 HydrophobicContact CZ-CD2 4.28Å; F35-L162 HydrophobicContact CZ-CG 4.31Å
36	P	93.1	Very high	82.2	Confident	93 Å²	93	66.4 Å²	66.4	60%	0.604	41%	0.407	S	S	*	.			trans	-58.7	150.9	171.8	-23.4	34.3	0	0	0	111.1	S38	P36-S38 PolarHBondContact O-N 3.21Å
37	Y	93.2	Very high	84.7	Confident	58 Å²	58	64.1 Å²	64.1	23%	0.227	40%	0.4	C	S	.	.			trans	-59	137.1	172.2	172.2	-98.1	0	0	0	110.7	R39 L87 N88 S153 V157	Y37-R39 VanDerWaalsContact OH-CD 3.29Å; Y37-R39 WeakPolarHBondContact OH-CD 3.21Å; Y37-L87 HydrophobicContact CD1-CD1 3.91Å; Y37-L87 HydrophobicContact CD1-CD2 4.12Å; Y37-L87 HydrophobicContact CD2-CD1 3.98Å; Y37-L87 HydrophobicContact CE1-CB 4.31Å; Y37-L87 HydrophobicContact CE1-CD1 4.14Å; Y37-L87 HydrophobicContact CE1-CD2 3.76Å; Y37-L87 HydrophobicContact CE1-CG 4.29Å; Y37-L87 HydrophobicContact CE2-CB 4.05Å; Y37-L87 HydrophobicContact CE2-CD1 4.21Å; Y37-L87 HydrophobicContact CG-CD1 3.81Å; Y37-N88 VanDerWaalsContact CE2-O 3.24Å; Y37-N88 WeakPolarHBondContact CE2-O 3.28Å; Y37-N88 PolarHBondContact OH-N 2.72Å; Y37-N88 PolarHBondContact OH-O 3.47Å; Y37-S153 WeakPolarHBondContact CD2-OG 3.17Å; Y37-V157 HydrophobicContact CD2-CG2 4.41Å
38	S	91.8	Very high	87.3	Confident	35 Å²	35	65.7 Å²	65.7	25%	0.245	39%	0.389	C	S	.	.			trans	-153.7	155.5	170.6	52.6	0	0	0	0	108.8	P36 Q91	P36-S38 PolarHBondContact O-N 3.21Å; S38-Q91 PolarHBondContact O-NE2 2.81Å; S38-Q91 PolarHBondContact O-OE1 2.81Å
39	R	95.4	Very high	89.7	Confident	7 Å²	7	66.2 Å²	66.2	3%	0.026	38%	0.375	C	S	.	.	S	Bend	trans	-67.2	162.9	163.2	-56.4	-61.8	-74.6	-129	7.4	109.2	Y37 E41 L43 L45 V50 E78 N88	Y37-R39 VanDerWaalsContact OH-CD 3.29Å; Y37-R39 WeakPolarHBondContact OH-CD 3.21Å; R39-E41 PolarHBondContact O-N 2.88Å; R39-L43 HydrophobicContact CB-CD1 4.05Å; R39-L45 HydrophobicContact CB-CD1 4.03Å; R39-L45 HydrophobicContact CG-CD1 3.97Å; R39-V50 HydrophobicContact CG-CG1 4.46Å; R39-V50 HydrophobicContact CG-CG2 4.38Å; R39-E78 IonicContact CZ-OE1 3.24Å; R39-E78 IonicContact NE-OE1 3.9Å; R39-E78 PolarHBondContact NE-OE1 2.92Å; R39-E78 IonicContact NE-OE2 2.6Å; R39-E78 IonicContact NH2-OE1 3.92Å; R39-E78 PolarHBondContact NH2-OE1 3.46Å; R39-E78 IonicContact NH2-OE2 2.82Å; R39-E78 PolarHBondContact NH2-OE2 3.02Å; R39-N88 VanDerWaalsContact CZ-ND2 3.34Å; R39-N88 PolarHBondContact NH2-ND2 2.95Å
40	P	96.4	Very high	91.5	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.019	35%	0.349	C	S	.	.			trans	-47.3	125.2	176.5	-30.3	35.6	0	0	0	112.7	F42 L43 Y76 A92	P40-F42 HydrophobicContact CB-CD1 4.24Å; P40-F42 HydrophobicContact CB-CD2 4.3Å; P40-F42 HydrophobicContact CB-CE1 3.7Å; P40-F42 HydrophobicContact CB-CE2 3.77Å; P40-F42 HydrophobicContact CB-CZ 3.45Å; P40-F42 VanDerWaalsContact CB-CZ 3.45Å; P40-F42 HydrophobicContact CG-CZ 4.28Å; P40-F42 PolarHBondContact O-N 2.78Å; P40-F42 VanDerWaalsContact O-N 3.13Å; P40-L43 HydrophobicContact CB-CD1 4.1Å; P40-L43 HydrophobicContact CB-CG 4.34Å; P40-L43 HydrophobicContact CG-CD1 4.2Å; P40-L43 WeakPolarHBondContact O-CB 3.5Å; P40-L43 PolarHBondContact O-N 2.98Å; P40-Y76 HydrophobicContact CG-CE1 4.46Å; P40-A92 HydrophobicContact CB-CB 4.25Å; P40-A92 HydrophobicContact CG-CB 3.82Å
41	E	92.9	Very high	92.1	Very high	130 Å²	130	61.8 Å²	61.8	61%	0.607	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-58.5	-34.4	-168.1	-177.2	172	166.5	0	0	113	R39 L43 G44 R161	R39-E41 PolarHBondContact O-N 2.88Å; E41-L43 PolarHBondContact O-N 3.23Å; E41-L43 VanDerWaalsContact O-N 3.14Å; E41-G44 PolarHBondContact O-N 2.71Å; E41-G44 VanDerWaalsContact O-N 3.09Å; E41-R161 IonicContact OE2-CZ 3.23Å; E41-R161 IonicContact OE2-NH1 2.87Å; E41-R161 PolarHBondContact OE2-NH1 3.36Å; E41-R161 IonicContact OE2-NH2 2.73Å; E41-R161 PolarHBondContact OE2-NH2 3.16Å
42	F	94.9	Very high	92.4	Very high	22 Å²	22	62.4 Å²	62.4	10%	0.096	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-64.7	-15.3	179.2	57.1	-113.7	0	0	0	113.7	P40 G44 L64 R69 L70 Y76 A92 Y504	P40-F42 HydrophobicContact CB-CD1 4.24Å; P40-F42 HydrophobicContact CB-CD2 4.3Å; P40-F42 HydrophobicContact CB-CE1 3.7Å; P40-F42 HydrophobicContact CB-CE2 3.77Å; P40-F42 HydrophobicContact CB-CZ 3.45Å; P40-F42 VanDerWaalsContact CB-CZ 3.45Å; P40-F42 HydrophobicContact CG-CZ 4.28Å; P40-F42 PolarHBondContact O-N 2.78Å; P40-F42 VanDerWaalsContact O-N 3.13Å; F42-G44 PolarHBondContact O-N 3.31Å; F42-L64 HydrophobicContact CD2-CD2 3.41Å; F42-L64 VanDerWaalsContact CD2-CD2 3.41Å; F42-L64 HydrophobicContact CE2-CD2 3.96Å; F42-L64 HydrophobicContact CG-CD2 4.37Å; F42-R69 HydrophobicContact CB-CB 4.4Å; F42-R69 WeakPolarHBondContact O-CD 2.9Å; F42-L70 HydrophobicContact CB-CD2 3.9Å; F42-L70 HydrophobicContact CD1-CD2 3.85Å; F42-L70 HydrophobicContact CD2-CD2 4.13Å; F42-L70 HydrophobicContact CE1-CD2 4.39Å; F42-L70 HydrophobicContact CG-CD2 3.7Å; F42-Y76 AromaticContact CE2-CD1 3.49Å; F42-Y76 HydrophobicContact CE2-CD1 3.49Å; F42-Y76 VanDerWaalsContact CE2-CD1 3.49Å; F42-Y76 HydrophobicContact CE2-CD2 4.34Å; F42-Y76 AromaticContact CE2-CE1 3.77Å; F42-Y76 HydrophobicContact CE2-CE1 3.77Å; F42-Y76 AromaticContact CE2-CG 3.76Å; F42-Y76 HydrophobicContact CE2-CG 3.76Å; F42-Y76 HydrophobicContact CZ-CD1 4.03Å; F42-Y76 HydrophobicContact CZ-CD2 4.15Å; F42-Y76 HydrophobicContact CZ-CE1 4.05Å; F42-Y76 HydrophobicContact CZ-CE2 4.22Å; F42-Y76 HydrophobicContact CZ-CG 4.04Å; F42-A92 HydrophobicContact CE1-CB 4.21Å; F42-A92 HydrophobicContact CZ-CB 3.85Å; F42-Y504 WeakPolarHBondContact CE1-OH 3.44Å; F42-Y504 HydrophobicContact CZ-CE1 4.22Å; F42-Y504 AromaticContact CZ-CZ 3.99Å; F42-Y504 VanDerWaalsContact CZ-OH 3.24Å; F42-Y504 WeakPolarHBondContact CZ-OH 3.4Å
43	L	95.1	Very high	92.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-67.9	-25.2	173.8	-69.4	167.4	0	0	0	112.2	R39 P40 E41 L45 Y76 E78	R39-L43 HydrophobicContact CB-CD1 4.05Å; P40-L43 HydrophobicContact CB-CD1 4.1Å; P40-L43 HydrophobicContact CB-CG 4.34Å; P40-L43 HydrophobicContact CG-CD1 4.2Å; P40-L43 WeakPolarHBondContact O-CB 3.5Å; P40-L43 PolarHBondContact O-N 2.98Å; E41-L43 PolarHBondContact O-N 3.23Å; E41-L43 VanDerWaalsContact O-N 3.14Å; L43-L45 VanDerWaalsContact C-N 3.35Å; L43-L45 HydrophobicContact CB-CD1 4.37Å; L43-L45 HydrophobicContact CB-CD2 4.36Å; L43-L45 HydrophobicContact CB-CG 3.91Å; L43-L45 HydrophobicContact CD1-CD1 4.4Å; L43-L45 PolarHBondContact O-N 3.27Å; L43-Y76 HydrophobicContact CD1-CE1 4.27Å; L43-Y76 HydrophobicContact CD2-CD1 3.87Å; L43-Y76 HydrophobicContact CD2-CE1 4.01Å; L43-Y76 HydrophobicContact CG-CE1 4.36Å; L43-E78 HydrophobicContact CD1-CG 4.25Å; L43-E78 WeakPolarHBondContact CD1-OE1 3.36Å
44	G	91.1	Very high	92.6	Very high	23 Å²	23	55.8 Å²	55.8	24%	0.237	32%	0.317	C	S	.	.			trans	64.5	35.8	176.3	0	0	0	0	0	114.1	E41 F42 K65 R69	E41-G44 PolarHBondContact O-N 2.71Å; E41-G44 VanDerWaalsContact O-N 3.09Å; F42-G44 PolarHBondContact O-N 3.31Å; G44-K65 WeakPolarHBondContact O-CD 3.46Å; G44-K65 WeakPolarHBondContact O-CE 3.34Å; G44-K65 PolarHBondContact O-NZ 3.35Å; G44-R69 VanDerWaalsContact CA-NH1 3.28Å
45	L	92.3	Very high	92.6	Very high	42 Å²	42	56.2 Å²	56.2	22%	0.22	32%	0.322	C	S	.	.			trans	-75.7	142.5	178	-54.6	-179.4	0	0	0	111.2	R39 L43 E49 V50 L62	R39-L45 HydrophobicContact CB-CD1 4.03Å; R39-L45 HydrophobicContact CG-CD1 3.97Å; L43-L45 VanDerWaalsContact C-N 3.35Å; L43-L45 HydrophobicContact CB-CD1 4.37Å; L43-L45 HydrophobicContact CB-CD2 4.36Å; L43-L45 HydrophobicContact CB-CG 3.91Å; L43-L45 HydrophobicContact CD1-CD1 4.4Å; L43-L45 PolarHBondContact O-N 3.27Å; L45-E49 WeakPolarHBondContact CA-OE2 3.35Å; L45-E49 HydrophobicContact CB-CB 4.07Å; L45-E49 HydrophobicContact CD2-CB 4.35Å; L45-V50 HydrophobicContact CB-CG2 3.81Å; L45-V50 HydrophobicContact CD1-CG2 4.26Å; L45-L62 HydrophobicContact CD1-CD1 3.79Å
46	S	91.5	Very high	92.6	Very high	55 Å²	55	55.4 Å²	55.4	39%	0.385	32%	0.319	S	S	.	.			trans	-73.7	167.5	165.5	76.4	0	0	0	0	110.6	D48 E49 V50	S46-D48 VanDerWaalsContact C-N 3.3Å; S46-D48 PolarHBondContact O-N 2.82Å; S46-E49 PolarHBondContact N-OE2 3.2Å; S46-E49 PolarHBondContact O-N 3.11Å; S46-E49 WeakPolarHBondContact OG-CG 3.49Å; S46-E49 PolarHBondContact OG-N 3.26Å; S46-E49 PolarHBondContact OG-OE2 3.16Å; S46-V50 WeakPolarHBondContact O-CG2 3.45Å; S46-V50 PolarHBondContact O-N 2.93Å
47	A	88.8	Confident	92.5	Very high	81 Å²	81	57.3 Å²	57.3	67%	0.669	32%	0.323	S	S	*	.	H	α-helix	trans	-58	-43.6	175.6	0	0	0	0	0	112	E49 V50 E51	A47-E49 VanDerWaalsContact C-N 3.32Å; A47-E49 PolarHBondContact O-N 3.38Å; A47-V50 PolarHBondContact O-N 2.72Å; A47-E51 PolarHBondContact O-N 3.42Å
48	D	91	Very high	92.5	Very high	116 Å²	116	57 Å²	57	62%	0.62	33%	0.332	S	S	*	.	H	α-helix	trans	-63.5	-37.7	178.5	-57.2	-9.3	0	0	0	111.6	S46 E51 C52	S46-D48 VanDerWaalsContact C-N 3.3Å; S46-D48 PolarHBondContact O-N 2.82Å; D48-E51 PolarHBondContact O-N 3.45Å; D48-C52 WeakPolarHBondContact O-CB 3.42Å; D48-C52 PolarHBondContact O-N 2.84Å; D48-C52 PolarHBondContact O-SG 3.19Å
49	E	92.5	Very high	92.7	Very high	69 Å²	69	55.4 Å²	55.4	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-71.9	-34.6	176.6	-72.5	168.9	136.9	0	0	112.2	L45 S46 A47 E51 C52 S53 K65	L45-E49 WeakPolarHBondContact CA-OE2 3.35Å; L45-E49 HydrophobicContact CB-CB 4.07Å; L45-E49 HydrophobicContact CD2-CB 4.35Å; S46-E49 PolarHBondContact N-OE2 3.2Å; S46-E49 PolarHBondContact O-N 3.11Å; S46-E49 WeakPolarHBondContact OG-CG 3.49Å; S46-E49 PolarHBondContact OG-N 3.26Å; S46-E49 PolarHBondContact OG-OE2 3.16Å; A47-E49 VanDerWaalsContact C-N 3.32Å; A47-E49 PolarHBondContact O-N 3.38Å; E49-E51 VanDerWaalsContact C-N 3.33Å; E49-C52 PolarHBondContact O-N 3.06Å; E49-S53 WeakPolarHBondContact O-CB 3.23Å; E49-S53 PolarHBondContact O-N 3.32Å; E49-K65 VanDerWaalsContact OE1-CE 3.23Å; E49-K65 WeakPolarHBondContact OE1-CE 3.32Å; E49-K65 IonicContact OE1-NZ 3.82Å; E49-K65 PolarHBondContact OE1-NZ 3.26Å; E49-K65 IonicContact OE2-NZ 3.58Å; E49-K65 PolarHBondContact OE2-NZ 3.03Å
50	V	90.8	Very high	92.8	Very high	39 Å²	39	57 Å²	57	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-43.1	172	171.7	0	0	0	0	110.1	R39 L45 S46 A47 S53	R39-V50 HydrophobicContact CG-CG1 4.46Å; R39-V50 HydrophobicContact CG-CG2 4.38Å; L45-V50 HydrophobicContact CB-CG2 3.81Å; L45-V50 HydrophobicContact CD1-CG2 4.26Å; S46-V50 WeakPolarHBondContact O-CG2 3.45Å; S46-V50 PolarHBondContact O-N 2.93Å; A47-V50 PolarHBondContact O-N 2.72Å; V50-S53 WeakPolarHBondContact O-CB 3.3Å; V50-S53 PolarHBondContact O-N 2.84Å; V50-S53 PolarHBondContact O-OG 3.12Å
51	E	90	Very high	92.8	Very high	151 Å²	151	58.2 Å²	58.2	71%	0.706	34%	0.338	S	S	*	.	H	α-helix	trans	-62.5	-47.1	175.2	-172.8	174.1	-174.6	0	0	111.4	A47 D48 E49 S53 A54	A47-E51 PolarHBondContact O-N 3.42Å; D48-E51 PolarHBondContact O-N 3.45Å; E49-E51 VanDerWaalsContact C-N 3.33Å; E51-S53 PolarHBondContact O-N 3.29Å; E51-A54 WeakPolarHBondContact O-CB 3.28Å; E51-A54 PolarHBondContact O-N 2.99Å; E51-A54 VanDerWaalsContact O-N 3.12Å
52	C	90.8	Very high	93.1	Very high	87 Å²	87	53 Å²	53	59%	0.588	31%	0.314	S	S	*	.	H	α-helix	trans	-62.9	-29.7	176.6	-67.4	0	0	0	0	112.7	D48 E49 A54 D55	D48-C52 WeakPolarHBondContact O-CB 3.42Å; D48-C52 PolarHBondContact O-N 2.84Å; D48-C52 PolarHBondContact O-SG 3.19Å; E49-C52 PolarHBondContact O-N 3.06Å; C52-A54 PolarHBondContact O-N 2.88Å; C52-D55 WeakPolarHBondContact O-CB 3.43Å; C52-D55 PolarHBondContact O-N 3.02Å
53	S	92.5	Very high	93.1	Very high	4 Å²	4	54.6 Å²	54.6	3%	0.028	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-14.2	177.7	80.3	0	0	0	0	114.2	E49 V50 E51 D55	E49-S53 WeakPolarHBondContact O-CB 3.23Å; E49-S53 PolarHBondContact O-N 3.32Å; V50-S53 WeakPolarHBondContact O-CB 3.3Å; V50-S53 PolarHBondContact O-N 2.84Å; V50-S53 PolarHBondContact O-OG 3.12Å; E51-S53 PolarHBondContact O-N 3.29Å; S53-D55 VanDerWaalsContact C-N 3.3Å
54	A	92.4	Very high	92.9	Very high	32 Å²	32	54.9 Å²	54.9	26%	0.264	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	9.2	177	0	0	0	0	0	113.3	E51 C52 H56 I80	E51-A54 WeakPolarHBondContact O-CB 3.28Å; E51-A54 PolarHBondContact O-N 2.99Å; E51-A54 VanDerWaalsContact O-N 3.12Å; C52-A54 PolarHBondContact O-N 2.88Å; A54-H56 PolarHBondContact O-CE1 3.49Å; A54-H56 VanDerWaalsContact O-CE1 3.27Å; A54-H56 PolarHBondContact O-N 3.35Å; A54-H56 PolarHBondContact O-ND1 2.88Å; A54-I80 HydrophobicContact CB-CD1 4.41Å
55	D	94.1	Very high	92.5	Very high	71 Å²	71	58.7 Å²	58.7	38%	0.38	34%	0.335	S	S	.	.			trans	-72.8	105.6	174.8	-172.5	-21.9	0	0	0	111.1	C52 S53 I57 A58 R59	C52-D55 WeakPolarHBondContact O-CB 3.43Å; C52-D55 PolarHBondContact O-N 3.02Å; S53-D55 VanDerWaalsContact C-N 3.3Å; D55-I57 VanDerWaalsContact C-N 3.3Å; D55-I57 PolarHBondContact O-N 2.99Å; D55-I57 WeakPolarHBondContact OD1-CA 3.39Å; D55-I57 WeakPolarHBondContact OD1-CB 3.44Å; D55-I57 PolarHBondContact OD1-N 3.15Å; D55-A58 HydrophobicContact CB-CB 4.25Å; D55-A58 PolarHBondContact OD1-N 3.29Å; D55-A58 WeakPolarHBondContact OD2-CB 3.29Å; D55-R59 VanDerWaalsContact O-CA 3.23Å; D55-R59 WeakPolarHBondContact O-CA 3.47Å; D55-R59 PolarHBondContact O-N 2.98Å
56	H	94	Very high	92.1	Very high	46 Å²	46	61.8 Å²	61.8	21%	0.213	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-12.1	179.5	-63.9	83.6	0	0	0	113.9	A54 R59 I80 N81 G83 S85	A54-H56 PolarHBondContact O-CE1 3.49Å; A54-H56 VanDerWaalsContact O-CE1 3.27Å; A54-H56 PolarHBondContact O-N 3.35Å; A54-H56 PolarHBondContact O-ND1 2.88Å; H56-R59 VanDerWaalsContact O-CG 3.27Å; H56-R59 WeakPolarHBondContact O-CG 3.31Å; H56-I80 VanDerWaalsContact NE2-CD1 3.31Å; H56-I80 WeakPolarHBondContact NE2-CD1 3.36Å; H56-N81 PolarHBondContact CD2-O 3.02Å; H56-N81 VanDerWaalsContact CD2-O 3.31Å; H56-G83 VanDerWaalsContact CD2-CA 3.45Å; H56-G83 WeakPolarHBondContact CD2-CA 3.33Å; H56-G83 PolarHBondContact CD2-N 2.85Å; H56-G83 VanDerWaalsContact CD2-N 3.28Å; H56-S85 PolarHBondContact CE1-O 3.43Å; H56-S85 PolarHBondContact NE2-O 2.96Å
57	I	90.9	Very high	91.3	Very high	133 Å²	133	59.8 Å²	59.8	68%	0.682	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-51.4	175.8	-59.6	176.6	0	0	0	109.2	D55 W488	D55-I57 VanDerWaalsContact C-N 3.3Å; D55-I57 PolarHBondContact O-N 2.99Å; D55-I57 WeakPolarHBondContact OD1-CA 3.39Å; D55-I57 WeakPolarHBondContact OD1-CB 3.44Å; D55-I57 PolarHBondContact OD1-N 3.15Å; I57-W488 WeakPolarHBondContact O-CZ2 3.4Å
58	A	93.4	Very high	90.9	Very high	52 Å²	52	64.3 Å²	64.3	43%	0.43	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-32.3	179.8	0	0	0	0	0	112.5	D55	D55-A58 HydrophobicContact CB-CB 4.25Å; D55-A58 PolarHBondContact OD1-N 3.29Å; D55-A58 WeakPolarHBondContact OD2-CB 3.29Å
59	R	96.3	Very high	90.7	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.329	C	S	.	.			trans	43.2	61.4	-175.7	-63.7	-178.5	67.7	-161.4	3.3	111.5	D55 H56 I61 V79 I80 N81 R480 W488 S497 D499	D55-R59 VanDerWaalsContact O-CA 3.23Å; D55-R59 WeakPolarHBondContact O-CA 3.47Å; D55-R59 PolarHBondContact O-N 2.98Å; H56-R59 VanDerWaalsContact O-CG 3.27Å; H56-R59 WeakPolarHBondContact O-CG 3.31Å; R59-I61 PolarHBondContact O-N 3.09Å; R59-V79 HydrophobicContact CB-CG2 3.74Å; R59-V79 WeakPolarHBondContact O-CG2 3.44Å; R59-I80 HydrophobicContact CG-CG2 4.36Å; R59-I80 VanDerWaalsContact CZ-O 3.27Å; R59-I80 PolarHBondContact NE-O 3.08Å; R59-I80 PolarHBondContact NH2-O 2.82Å; R59-N81 PolarHBondContact NE-O 2.85Å; R59-R480 PolarHBondContact O-NH1 2.85Å; R59-W488 HydrophobicContact CB-CH2 4.09Å; R59-W488 HydrophobicContact CB-CZ2 3.97Å; R59-W488 HydrophobicContact CG-CH2 4.47Å; R59-W488 HydrophobicContact CG-CZ2 3.85Å; R59-S497 PolarHBondContact NH1-O 2.81Å; R59-S497 PolarHBondContact NH2-O 3.1Å; R59-D499 PolarHBondContact NH2-O 3.09Å
60	P	96.6	Very high	90.6	Very high	42 Å²	42	61.1 Å²	61.1	27%	0.273	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-61.4	134.3	-174.7	27.2	-34.7	0	0	0	110.7	L62	P60-L62 HydrophobicContact CB-CD2 4.48Å; P60-L62 PolarHBondContact O-N 2.92Å
61	I	97.7	Very high	90.7	Very high	27 Å²	27	60.5 Å²	60.5	14%	0.138	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-79.9	119.4	173.9	-58.5	172.6	0	0	0	107.6	R59 I63 A77 E78 V79 Q473 V476 M477	R59-I61 PolarHBondContact O-N 3.09Å; I61-I63 HydrophobicContact CG2-CG2 4.41Å; I61-A77 HydrophobicContact CG2-CB 4.27Å; I61-E78 WeakPolarHBondContact CA-O 3.37Å; I61-V79 HydrophobicContact CG1-CB 4.33Å; I61-V79 HydrophobicContact CG1-CG2 4.46Å; I61-Q473 HydrophobicContact CG2-CG 3.94Å; I61-V476 HydrophobicContact CD1-CG1 4.1Å; I61-V476 HydrophobicContact CG1-CG1 3.97Å; I61-V476 HydrophobicContact CG2-CB 4.25Å; I61-V476 HydrophobicContact CG2-CG1 3.89Å; I61-M477 HydrophobicContact CD1-CB 3.72Å; I61-M477 HydrophobicContact CD1-CE 4.43Å; I61-M477 HydrophobicContact CD1-CG 4.25Å
62	L	97.6	Very high	90.8	Very high	22 Å²	22	54.4 Å²	54.4	12%	0.115	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	139.5	177.9	-49	180	0	0	0	109.1	L45 P60 A77 E78	L45-L62 HydrophobicContact CD1-CD1 3.79Å; P60-L62 HydrophobicContact CB-CD2 4.48Å; P60-L62 PolarHBondContact O-N 2.92Å; L62-A77 CarbonylContact O-C 3.59Å; L62-A77 VanDerWaalsContact O-CA 3.22Å; L62-A77 WeakPolarHBondContact O-CA 3.27Å; L62-E78 HydrophobicContact CB-CG 4.02Å; L62-E78 HydrophobicContact CD1-CG 4.4Å; L62-E78 PolarHBondContact N-O 3.27Å; L62-E78 PolarHBondContact O-N 2.68Å
63	I	96	Very high	90.9	Very high	55 Å²	55	51.6 Å²	51.6	28%	0.282	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	168.6	177.9	60.8	170.9	0	0	0	109.5	I61 K65 A77 T469 Q473	I61-I63 HydrophobicContact CG2-CG2 4.41Å; I63-K65 PolarHBondContact O-N 3.11Å; I63-A77 HydrophobicContact CG2-CB 3.97Å; I63-T469 HydrophobicContact CB-CG2 3.79Å; I63-T469 HydrophobicContact CD1-CG2 4.32Å; I63-T469 HydrophobicContact CG2-CG2 4.23Å; I63-Q473 HydrophobicContact CG2-CB 3.87Å; I63-Q473 HydrophobicContact CG2-CG 3.89Å
64	L	90.8	Very high	91.1	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.031	26%	0.264	C	S	.	.			trans	-59.1	125.4	171.5	-60.4	171.6	0	0	0	110.8	F42 E66 L70 T74 T469	F42-L64 HydrophobicContact CD2-CD2 3.41Å; F42-L64 VanDerWaalsContact CD2-CD2 3.41Å; F42-L64 HydrophobicContact CE2-CD2 3.96Å; F42-L64 HydrophobicContact CG-CD2 4.37Å; L64-E66 VanDerWaalsContact C-N 3.32Å; L64-L70 HydrophobicContact CD1-CD1 3.64Å; L64-L70 HydrophobicContact CD1-CG 3.91Å; L64-L70 HydrophobicContact CD2-CD1 4.01Å; L64-L70 HydrophobicContact CD2-CG 4.05Å; L64-L70 HydrophobicContact CG-CD1 4.38Å; L64-T74 WeakPolarHBondContact CD1-O 3.46Å; L64-T469 HydrophobicContact CB-CG2 4.41Å
65	K	83.6	Confident	91.3	Very high	102 Å²	102	49.9 Å²	49.9	44%	0.443	25%	0.251	S	S	.	.	S	Bend	trans	-68.5	-34.1	168.6	-71.4	-175.6	177.1	179.2	0	112.8	G44 E49 I63	G44-K65 WeakPolarHBondContact O-CD 3.46Å; G44-K65 WeakPolarHBondContact O-CE 3.34Å; G44-K65 PolarHBondContact O-NZ 3.35Å; E49-K65 VanDerWaalsContact OE1-CE 3.23Å; E49-K65 WeakPolarHBondContact OE1-CE 3.32Å; E49-K65 IonicContact OE1-NZ 3.82Å; E49-K65 PolarHBondContact OE1-NZ 3.26Å; E49-K65 IonicContact OE2-NZ 3.58Å; E49-K65 PolarHBondContact OE2-NZ 3.03Å; I63-K65 PolarHBondContact O-N 3.11Å
66	E	83.3	Confident	91.5	Very high	107 Å²	107	46.5 Å²	46.5	50%	0.5	23%	0.233	S	C	.	.			trans	-131.9	110.2	-176.2	-69.8	169	-172.5	0	0	109	L64 K68 R69	L64-E66 VanDerWaalsContact C-N 3.32Å; E66-K68 PolarHBondContact O-N 3.08Å; E66-K68 VanDerWaalsContact O-N 3.13Å; E66-R69 HydrophobicContact CB-CG 3.99Å; E66-R69 WeakPolarHBondContact O-CB 3.49Å; E66-R69 PolarHBondContact O-N 3.27Å; E66-R69 VanDerWaalsContact O-N 3.16Å; E66-R69 IonicContact OE1-NH2 3.52Å; E66-R69 IonicContact OE2-CZ 2.68Å; E66-R69 IonicContact OE2-NE 2.7Å; E66-R69 PolarHBondContact OE2-NE 2.92Å; E66-R69 IonicContact OE2-NH2 3.31Å; E66-R69 PolarHBondContact OE2-NH2 3.26Å; E66-R69 VanDerWaalsContact OE2-NH2 3.14Å
67	T	74.3	Confident	91.7	Very high	14 Å²	14	44.3 Å²	44.3	9%	0.086	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-62.2	-21.7	-176.4	47.7	0	0	0	0	114.1	R69 Q465 H466	T67-R69 VanDerWaalsContact C-N 3.27Å; T67-R69 PolarHBondContact O-N 2.9Å; T67-Q465 WeakPolarHBondContact CG2-O 3.41Å; T67-H466 HydrophobicContact CG2-CB 4.33Å; T67-H466 WeakPolarHBondContact CG2-CD2 3.27Å
68	K	81.1	Confident	92.1	Very high	176 Å²	176	38 Å²	38	77%	0.765	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-77.6	-5.5	178.8	-64.7	-176.3	-179.8	178	0	114.5	E66 L70	E66-K68 PolarHBondContact O-N 3.08Å; E66-K68 VanDerWaalsContact O-N 3.13Å; K68-L70 VanDerWaalsContact C-N 3.28Å
69	R	85.3	Confident	92.3	Very high	110 Å²	110	35.5 Å²	35.5	42%	0.415	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-72.6	-22.6	178.1	-71	-175.9	177.2	-143.8	0.4	113.2	F42 G44 E66 T67	F42-R69 HydrophobicContact CB-CB 4.4Å; F42-R69 WeakPolarHBondContact O-CD 2.9Å; G44-R69 VanDerWaalsContact CA-NH1 3.28Å; E66-R69 HydrophobicContact CB-CG 3.99Å; E66-R69 WeakPolarHBondContact O-CB 3.49Å; E66-R69 PolarHBondContact O-N 3.27Å; E66-R69 VanDerWaalsContact O-N 3.16Å; E66-R69 IonicContact OE1-NH2 3.52Å; E66-R69 IonicContact OE2-CZ 2.68Å; E66-R69 IonicContact OE2-NE 2.7Å; E66-R69 PolarHBondContact OE2-NE 2.92Å; E66-R69 IonicContact OE2-NH2 3.31Å; E66-R69 PolarHBondContact OE2-NH2 3.26Å; E66-R69 VanDerWaalsContact OE2-NH2 3.14Å; T67-R69 VanDerWaalsContact C-N 3.27Å; T67-R69 PolarHBondContact O-N 2.9Å
70	L	91.8	Very high	92.4	Very high	8 Å²	8	35.5 Å²	35.5	4%	0.042	17%	0.17	C	C	.	.	S	Bend	trans	-108.4	143.3	175.7	-59.3	-170.4	0	0	0	111.2	F42 L64 K68 T74 C94 Y504	F42-L70 HydrophobicContact CB-CD2 3.9Å; F42-L70 HydrophobicContact CD1-CD2 3.85Å; F42-L70 HydrophobicContact CD2-CD2 4.13Å; F42-L70 HydrophobicContact CE1-CD2 4.39Å; F42-L70 HydrophobicContact CG-CD2 3.7Å; L64-L70 HydrophobicContact CD1-CD1 3.64Å; L64-L70 HydrophobicContact CD1-CG 3.91Å; L64-L70 HydrophobicContact CD2-CD1 4.01Å; L64-L70 HydrophobicContact CD2-CG 4.05Å; L64-L70 HydrophobicContact CG-CD1 4.38Å; K68-L70 VanDerWaalsContact C-N 3.28Å; L70-T74 HydrophobicContact CD1-CG2 3.89Å; L70-C94 HydrophobicContact CD2-CB 3.67Å; L70-Y504 HydrophobicContact CD1-CD1 4.43Å; L70-Y504 HydrophobicContact CD1-CE1 3.86Å
71	P	92.2	Very high	92.4	Very high	26 Å²	26	33.5 Å²	33.5	17%	0.169	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-62.8	157.9	172.6	28.7	-34.5	0	0	0	110.9	A73 T74 C94 V96 W144	P71-A73 PolarHBondContact O-N 3.34Å; P71-A73 VanDerWaalsContact O-N 3.1Å; P71-T74 WeakPolarHBondContact O-CB 3.12Å; P71-T74 PolarHBondContact O-N 3.26Å; P71-T74 PolarHBondContact O-OG1 3.18Å; P71-C94 WeakPolarHBondContact CD-SG 3.37Å; P71-C94 VanDerWaalsContact CG-SG 3.55Å; P71-V96 HydrophobicContact CB-CG2 4.04Å; P71-V96 HydrophobicContact CG-CG2 4.08Å; P71-W144 HydrophobicContact CB-CZ2 4.47Å; P71-W144 HydrophobicContact CG-CZ2 3.76Å
72	W	92.6	Very high	92.2	Very high	23 Å²	23	34.3 Å²	34.3	9%	0.087	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	58.8	24.5	173.3	-58.7	2.4	0	0	0	113.9	T74 H142 W144 C277 L422 I506 P507 Y510	W72-T74 PolarHBondContact O-N 3.27Å; W72-T74 VanDerWaalsContact O-N 3.08Å; W72-H142 AromaticContact NE1-CD2 3.56Å; W72-H142 AromaticContact NE1-NE2 3.54Å; W72-W144 AromaticContact CD2-CH2 3.88Å; W72-W144 HydrophobicContact CD2-CH2 3.88Å; W72-W144 HydrophobicContact CD2-CZ2 4.11Å; W72-W144 AromaticContact CE3-CH2 3.69Å; W72-W144 HydrophobicContact CE3-CH2 3.69Å; W72-W144 HydrophobicContact CE3-CZ2 4.02Å; W72-W144 HydrophobicContact CG-CZ2 4.43Å; W72-W144 HydrophobicContact CH2-CH2 4.1Å; W72-W144 HydrophobicContact CZ2-CH2 4.26Å; W72-W144 AromaticContact CZ3-CH2 3.81Å; W72-W144 HydrophobicContact CZ3-CH2 3.81Å; W72-C277 HydrophobicContact CH2-CB 3.78Å; W72-C277 VanDerWaalsContact CH2-SG 3.5Å; W72-C277 HydrophobicContact CZ2-CB 4.24Å; W72-L422 HydrophobicContact CH2-CD2 4.09Å; W72-I506 HydrophobicContact CE3-CG2 3.78Å; W72-I506 HydrophobicContact CZ3-CG2 4.2Å; W72-P507 HydrophobicContact CB-CG 4.43Å; W72-P507 WeakPolarHBondContact O-CD 3.14Å; W72-P507 WeakPolarHBondContact O-CG 3.49Å; W72-Y510 HydrophobicContact CB-CD2 3.62Å; W72-Y510 HydrophobicContact CB-CE2 4.32Å; W72-Y510 HydrophobicContact CB-CG 3.92Å; W72-Y510 VanDerWaalsContact CG-CB 3.5Å; W72-Y510 HydrophobicContact CG-CD2 4.18Å; W72-Y510 HydrophobicContact CG-CG 4.03Å; W72-Y510 WeakPolarHBondContact O-CD2 3.27Å; W72-Y510 WeakPolarHBondContact O-CE2 3.37Å
73	A	92.2	Very high	92	Very high	27 Å²	27	35.8 Å²	35.8	22%	0.223	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	51.3	32.3	-172.7	0	0	0	0	0	112.5	P71 G75 Y468	P71-A73 PolarHBondContact O-N 3.34Å; P71-A73 VanDerWaalsContact O-N 3.1Å; A73-G75 PolarHBondContact O-N 2.9Å; A73-Y468 HydrophobicContact CB-CD2 4.34Å; A73-Y468 VanDerWaalsContact O-CD2 3.27Å; A73-Y468 WeakPolarHBondContact O-CD2 3.33Å
74	T	96.3	Very high	91.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.			trans	-53.6	131.1	-179.8	-63.1	0	0	0	0	109.8	L64 L70 P71 W72 W144 Y504 I506	L64-T74 WeakPolarHBondContact CD1-O 3.46Å; L70-T74 HydrophobicContact CD1-CG2 3.89Å; P71-T74 WeakPolarHBondContact O-CB 3.12Å; P71-T74 PolarHBondContact O-N 3.26Å; P71-T74 PolarHBondContact O-OG1 3.18Å; W72-T74 PolarHBondContact O-N 3.27Å; W72-T74 VanDerWaalsContact O-N 3.08Å; T74-W144 PolarHBondContact OG1-NE1 3.13Å; T74-W144 VanDerWaalsContact OG1-NE1 3.09Å; T74-Y504 HydrophobicContact CG2-CD1 3.57Å; T74-Y504 HydrophobicContact CG2-CE1 4.17Å; T74-Y504 HydrophobicContact CG2-CG 4.47Å; T74-I506 HydrophobicContact CG2-CG1 3.73Å
75	G	97.7	Very high	91.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	141.7	171.3	0	0	0	0	0	111.6	A73 Y468 Y504 I505	A73-G75 PolarHBondContact O-N 2.9Å; G75-Y468 VanDerWaalsContact CA-C 3.47Å; G75-Y504 WeakPolarHBondContact O-CA 3.4Å; G75-I505 PolarHBondContact N-O 2.86Å; G75-I505 PolarHBondContact O-N 2.97Å
76	Y	98.5	Very high	92.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	139.9	170.3	-179	-93.7	0	0	0	111	P40 F42 L43 E78 A92 L146 V503 Y504	P40-Y76 HydrophobicContact CG-CE1 4.46Å; F42-Y76 AromaticContact CE2-CD1 3.49Å; F42-Y76 HydrophobicContact CE2-CD1 3.49Å; F42-Y76 VanDerWaalsContact CE2-CD1 3.49Å; F42-Y76 HydrophobicContact CE2-CD2 4.34Å; F42-Y76 AromaticContact CE2-CE1 3.77Å; F42-Y76 HydrophobicContact CE2-CE1 3.77Å; F42-Y76 AromaticContact CE2-CG 3.76Å; F42-Y76 HydrophobicContact CE2-CG 3.76Å; F42-Y76 HydrophobicContact CZ-CD1 4.03Å; F42-Y76 HydrophobicContact CZ-CD2 4.15Å; F42-Y76 HydrophobicContact CZ-CE1 4.05Å; F42-Y76 HydrophobicContact CZ-CE2 4.22Å; F42-Y76 HydrophobicContact CZ-CG 4.04Å; L43-Y76 HydrophobicContact CD1-CE1 4.27Å; L43-Y76 HydrophobicContact CD2-CD1 3.87Å; L43-Y76 HydrophobicContact CD2-CE1 4.01Å; L43-Y76 HydrophobicContact CG-CE1 4.36Å; Y76-E78 HydrophobicContact CE1-CB 3.93Å; Y76-E78 HydrophobicContact CE1-CG 3.68Å; Y76-E78 PolarHBondContact OH-OE2 3.39Å; Y76-A92 HydrophobicContact CE2-CB 3.57Å; Y76-A92 WeakPolarHBondContact OH-CB 3.48Å; Y76-L146 HydrophobicContact CE2-CD2 3.95Å; Y76-V503 VanDerWaalsContact CA-O 3.3Å; Y76-V503 WeakPolarHBondContact CA-O 3.4Å; Y76-V503 WeakPolarHBondContact CD2-O 3.34Å; Y76-Y504 AromaticContact CD2-CD1 3.54Å; Y76-Y504 HydrophobicContact CD2-CD1 3.54Å; Y76-Y504 HydrophobicContact CD2-CD2 4.17Å; Y76-Y504 AromaticContact CD2-CE1 3.41Å; Y76-Y504 HydrophobicContact CD2-CE1 3.41Å; Y76-Y504 VanDerWaalsContact CD2-CE1 3.41Å; Y76-Y504 HydrophobicContact CD2-CE2 4.08Å; Y76-Y504 AromaticContact CD2-CG 3.92Å; Y76-Y504 HydrophobicContact CD2-CG 3.92Å; Y76-Y504 AromaticContact CD2-CZ 3.72Å; Y76-Y504 HydrophobicContact CE2-CD2 4.47Å; Y76-Y504 HydrophobicContact CE2-CE1 4.26Å; Y76-Y504 HydrophobicContact CE2-CE2 4.2Å; Y76-Y504 HydrophobicContact CG-CD1 4.19Å; Y76-Y504 AromaticContact CG-CE1 3.98Å; Y76-Y504 HydrophobicContact CG-CE1 3.98Å
77	A	98.6	Very high	92.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	148.7	170.3	0	0	0	0	0	110.3	I61 L62 I63 A472 Q473 V476 V503	I61-A77 HydrophobicContact CG2-CB 4.27Å; L62-A77 CarbonylContact O-C 3.59Å; L62-A77 VanDerWaalsContact O-CA 3.22Å; L62-A77 WeakPolarHBondContact O-CA 3.27Å; I63-A77 HydrophobicContact CG2-CB 3.97Å; A77-A472 HydrophobicContact CB-CB 3.87Å; A77-Q473 HydrophobicContact CB-CB 4.43Å; A77-V476 HydrophobicContact CB-CB 4.36Å; A77-V476 HydrophobicContact CB-CG2 3.77Å; A77-V503 PolarHBondContact N-O 3.34Å; A77-V503 VanDerWaalsContact N-O 3.15Å; A77-V503 PolarHBondContact O-N 3.07Å
78	E	98.6	Very high	93.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	158.7	174.3	60.4	171.3	-160.3	0	0	113	R39 L43 I61 L62 Y76 N88 I501	R39-E78 IonicContact CZ-OE1 3.24Å; R39-E78 IonicContact NE-OE1 3.9Å; R39-E78 PolarHBondContact NE-OE1 2.92Å; R39-E78 IonicContact NE-OE2 2.6Å; R39-E78 IonicContact NH2-OE1 3.92Å; R39-E78 PolarHBondContact NH2-OE1 3.46Å; R39-E78 IonicContact NH2-OE2 2.82Å; R39-E78 PolarHBondContact NH2-OE2 3.02Å; L43-E78 HydrophobicContact CD1-CG 4.25Å; L43-E78 WeakPolarHBondContact CD1-OE1 3.36Å; I61-E78 WeakPolarHBondContact CA-O 3.37Å; L62-E78 HydrophobicContact CB-CG 4.02Å; L62-E78 HydrophobicContact CD1-CG 4.4Å; L62-E78 PolarHBondContact N-O 3.27Å; L62-E78 PolarHBondContact O-N 2.68Å; Y76-E78 HydrophobicContact CE1-CB 3.93Å; Y76-E78 HydrophobicContact CE1-CG 3.68Å; Y76-E78 PolarHBondContact OH-OE2 3.39Å; E78-N88 PolarHBondContact OE2-ND2 2.95Å; E78-I501 CarbonylContact C-O 3.47Å; E78-I501 WeakPolarHBondContact CA-O 3.41Å; E78-I501 WeakPolarHBondContact CB-O 3.32Å
79	V	98.3	Very high	94.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	143.7	171.8	66.6	0	0	0	0	110.4	R59 I61 V476 R480 D500 I501	R59-V79 HydrophobicContact CB-CG2 3.74Å; R59-V79 WeakPolarHBondContact O-CG2 3.44Å; I61-V79 HydrophobicContact CG1-CB 4.33Å; I61-V79 HydrophobicContact CG1-CG2 4.46Å; V79-V476 HydrophobicContact CB-CG1 3.89Å; V79-V476 HydrophobicContact CG1-CG1 3.47Å; V79-V476 VanDerWaalsContact CG1-CG1 3.47Å; V79-R480 HydrophobicContact CG1-CB 4.37Å; V79-R480 HydrophobicContact CG1-CG 4.36Å; V79-D500 WeakPolarHBondContact O-CA 3.41Å; V79-I501 HydrophobicContact CG1-CB 3.86Å; V79-I501 HydrophobicContact CG1-CD1 3.81Å; V79-I501 HydrophobicContact CG1-CG1 3.85Å; V79-I501 PolarHBondContact N-O 3.45Å; V79-I501 PolarHBondContact O-N 3.05Å
80	I	97.6	Very high	95.1	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	16%	0.157	C	C	.	.			trans	-69.2	157.5	175.3	-164.7	165.8	0	0	0	111.7	A54 H56 R59 N88 D500	A54-I80 HydrophobicContact CB-CD1 4.41Å; H56-I80 VanDerWaalsContact NE2-CD1 3.31Å; H56-I80 WeakPolarHBondContact NE2-CD1 3.36Å; R59-I80 HydrophobicContact CG-CG2 4.36Å; R59-I80 VanDerWaalsContact CZ-O 3.27Å; R59-I80 PolarHBondContact NE-O 3.08Å; R59-I80 PolarHBondContact NH2-O 2.82Å; I80-N88 HydrophobicContact CB-CB 4.38Å; I80-N88 HydrophobicContact CD1-CB 4.4Å; I80-N88 HydrophobicContact CG1-CB 4.08Å; I80-D500 VanDerWaalsContact CA-OD1 3.26Å; I80-D500 WeakPolarHBondContact CA-OD1 3.33Å
81	N	96.3	Very high	95.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.156	C	C	.	.			trans	-62	174.9	175.4	65.8	81.1	0	0	0	113.4	H56 R59 G83 K84 S85 G498 D499 D500	H56-N81 PolarHBondContact CD2-O 3.02Å; H56-N81 VanDerWaalsContact CD2-O 3.31Å; R59-N81 PolarHBondContact NE-O 2.85Å; N81-G83 VanDerWaalsContact C-N 3.33Å; N81-G83 PolarHBondContact O-N 3.45Å; N81-G83 PolarHBondContact OD1-N 3.45Å; N81-K84 HydrophobicContact CB-CB 4.4Å; N81-K84 PolarHBondContact OD1-N 2.87Å; N81-S85 PolarHBondContact ND2-OG 2.91Å; N81-S85 PolarHBondContact OD1-N 3.3Å; N81-G498 WeakPolarHBondContact CB-O 3.3Å; N81-D499 VanDerWaalsContact CA-C 3.46Å; N81-D499 WeakPolarHBondContact CA-O 3.46Å; N81-D499 VanDerWaalsContact CB-C 3.49Å; N81-D500 WeakPolarHBondContact CB-OD1 3.42Å; N81-D500 PolarHBondContact N-OD1 3.03Å; N81-D500 PolarHBondContact ND2-OD1 3.1Å; N81-D500 PolarHBondContact ND2-OD2 3.29Å
82	A	94.4	Very high	95.7	Very high	44 Å²	44	24.3 Å²	24.3	36%	0.364	15%	0.15	S	C	.	.	S	Bend	trans	-94.6	37.5	-177.6	0	0	0	0	0	113.5	G498	A82-G498 PolarHBondContact N-O 3.31Å
83	G	91.9	Very high	95.9	Very high	52 Å²	52	23.6 Å²	23.6	54%	0.536	15%	0.149	S	C	.	.	S	Bend	trans	97.2	22.3	174.6	0	0	0	0	0	114.5	H56 N81	H56-G83 VanDerWaalsContact CD2-CA 3.45Å; H56-G83 WeakPolarHBondContact CD2-CA 3.33Å; H56-G83 PolarHBondContact CD2-N 2.85Å; H56-G83 VanDerWaalsContact CD2-N 3.28Å; N81-G83 VanDerWaalsContact C-N 3.33Å; N81-G83 PolarHBondContact O-N 3.45Å; N81-G83 PolarHBondContact OD1-N 3.45Å
84	K	89.6	Confident	96.2	Very high	119 Å²	119	23 Å²	23	52%	0.517	14%	0.143	S	C	.	.	S	Bend	trans	-73.9	-39.3	175.5	-66.1	-175.9	-179.7	-179.1	0	112.1	N81 G498 D499	N81-K84 HydrophobicContact CB-CB 4.4Å; N81-K84 PolarHBondContact OD1-N 2.87Å; K84-G498 VanDerWaalsContact CE-O 3.27Å; K84-G498 WeakPolarHBondContact CE-O 3.4Å; K84-D499 WeakPolarHBondContact CD-OD1 3.5Å; K84-D499 IonicContact NZ-OD1 3.7Å; K84-D499 PolarHBondContact NZ-OD1 3.28Å; K84-D499 IonicContact NZ-OD2 3.42Å; K84-D499 PolarHBondContact NZ-OD2 3.27Å
85	S	92.2	Very high	96.2	Very high	24 Å²	24	27 Å²	27	17%	0.168	16%	0.161	C	C	.	.	S	Bend	trans	-132.5	173.2	179.2	57.7	0	0	0	0	109.2	H56 N81 L87 E89	H56-S85 PolarHBondContact CE1-O 3.43Å; H56-S85 PolarHBondContact NE2-O 2.96Å; N81-S85 PolarHBondContact ND2-OG 2.91Å; N81-S85 PolarHBondContact OD1-N 3.3Å; S85-L87 PolarHBondContact OG-O 3.29Å; S85-E89 WeakPolarHBondContact CB-OE2 3.33Å
86	T	91.7	Very high	96.1	Very high	117 Å²	117	30.7 Å²	30.7	72%	0.718	18%	0.184	S	C	*	.	S	Bend	trans	-85.8	-21	179.6	50.6	0	0	0	0	113.2
87	L	92.8	Very high	95.9	Very high	60 Å²	60	31.8 Å²	31.8	31%	0.314	19%	0.189	S	C	.	.	S	Bend	trans	-129.4	158.9	-175.2	-60.7	176.5	0	0	0	108.3	Y37 S85 E89	Y37-L87 HydrophobicContact CD1-CD1 3.91Å; Y37-L87 HydrophobicContact CD1-CD2 4.12Å; Y37-L87 HydrophobicContact CD2-CD1 3.98Å; Y37-L87 HydrophobicContact CE1-CB 4.31Å; Y37-L87 HydrophobicContact CE1-CD1 4.14Å; Y37-L87 HydrophobicContact CE1-CD2 3.76Å; Y37-L87 HydrophobicContact CE1-CG 4.29Å; Y37-L87 HydrophobicContact CE2-CB 4.05Å; Y37-L87 HydrophobicContact CE2-CD1 4.21Å; Y37-L87 HydrophobicContact CG-CD1 3.81Å; S85-L87 PolarHBondContact OG-O 3.29Å; L87-E89 PolarHBondContact O-N 2.81Å
88	N	97.1	Very high	95.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.214	C	C	.	.			trans	-68.7	118.4	163.5	-176.9	-3.1	0	0	0	107.5	Y37 R39 E78 I80 D90 D500	Y37-N88 VanDerWaalsContact CE2-O 3.24Å; Y37-N88 WeakPolarHBondContact CE2-O 3.28Å; Y37-N88 PolarHBondContact OH-N 2.72Å; Y37-N88 PolarHBondContact OH-O 3.47Å; R39-N88 VanDerWaalsContact CZ-ND2 3.34Å; R39-N88 PolarHBondContact NH2-ND2 2.95Å; E78-N88 PolarHBondContact OE2-ND2 2.95Å; I80-N88 HydrophobicContact CB-CB 4.38Å; I80-N88 HydrophobicContact CD1-CB 4.4Å; I80-N88 HydrophobicContact CG1-CB 4.08Å; N88-D90 VanDerWaalsContact C-N 3.33Å; N88-D90 WeakPolarHBondContact OD1-CA 3.45Å; N88-D90 WeakPolarHBondContact OD1-CB 3.22Å; N88-D90 PolarHBondContact OD1-N 3.13Å; N88-D500 WeakPolarHBondContact OD1-CB 3.43Å; N88-D500 PolarHBondContact OD1-OD1 2.88Å; N88-D500 PolarHBondContact OD1-OD2 3.48Å; N88-D500 VanDerWaalsContact OD1-OD2 3.12Å
89	E	97.5	Very high	95.2	Very high	35 Å²	35	37 Å²	37	16%	0.164	22%	0.215	C	C	.	.			trans	-84.3	-15.9	-179.1	-59.9	-175.2	113.8	0	0	111.6	S85 L87 G149 G152 D500	S85-E89 WeakPolarHBondContact CB-OE2 3.33Å; L87-E89 PolarHBondContact O-N 2.81Å; E89-G149 WeakPolarHBondContact CB-O 2.95Å; E89-G149 WeakPolarHBondContact O-CA 3.46Å; E89-G149 PolarHBondContact O-N 2.93Å; E89-G152 WeakPolarHBondContact OE1-CA 3.27Å; E89-G152 PolarHBondContact OE1-N 3.36Å; E89-D500 PolarHBondContact N-OD2 3.16Å
90	D	98.6	Very high	94.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.242	C	C	.	.			trans	-61.7	146.6	170.2	-71.8	-7.7	0	0	0	111.8	N88 F147 D148 T437 D500 S502	N88-D90 VanDerWaalsContact C-N 3.33Å; N88-D90 WeakPolarHBondContact OD1-CA 3.45Å; N88-D90 WeakPolarHBondContact OD1-CB 3.22Å; N88-D90 PolarHBondContact OD1-N 3.13Å; D90-F147 CarbonylContact C-O 3.59Å; D90-F147 VanDerWaalsContact CA-O 3.27Å; D90-F147 WeakPolarHBondContact CA-O 3.41Å; D90-D148 WeakPolarHBondContact OD1-CA 3.32Å; D90-T437 WeakPolarHBondContact OD2-CG2 3.42Å; D90-T437 PolarHBondContact OD2-OG1 2.95Å; D90-D500 HydrophobicContact CB-CB 4.38Å; D90-S502 WeakPolarHBondContact CB-OG 3.49Å; D90-S502 WeakPolarHBondContact OD2-CB 3.49Å; D90-S502 PolarHBondContact OD2-N 3.36Å; D90-S502 PolarHBondContact OD2-OG 3.38Å
91	Q	98.5	Very high	93.6	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.019	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	155.1	167.5	-71.4	-68.6	-51	0	0	111	S38 L146 F147 A156 V157	S38-Q91 PolarHBondContact O-NE2 2.81Å; S38-Q91 PolarHBondContact O-OE1 2.81Å; Q91-L146 CarbonylContact O-C 3.55Å; Q91-L146 WeakPolarHBondContact O-CA 3.35Å; Q91-F147 HydrophobicContact CB-CB 4.29Å; Q91-F147 HydrophobicContact CB-CD2 4.39Å; Q91-F147 PolarHBondContact N-O 2.78Å; Q91-F147 PolarHBondContact O-N 3.32Å; Q91-A156 HydrophobicContact CB-CB 4.1Å; Q91-A156 HydrophobicContact CG-CB 3.85Å; Q91-V157 HydrophobicContact CG-CG2 3.86Å
92	A	98.5	Very high	92.2	Very high	4 Å²	4	55.3 Å²	55.3	3%	0.033	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	147.9	174.8	0	0	0	0	0	110	P40 F42 Y76 A145 L146 Y504	P40-A92 HydrophobicContact CB-CB 4.25Å; P40-A92 HydrophobicContact CG-CB 3.82Å; F42-A92 HydrophobicContact CE1-CB 4.21Å; F42-A92 HydrophobicContact CZ-CB 3.85Å; Y76-A92 HydrophobicContact CE2-CB 3.57Å; Y76-A92 WeakPolarHBondContact OH-CB 3.48Å; A92-A145 VanDerWaalsContact CA-O 3.25Å; A92-A145 WeakPolarHBondContact CA-O 3.48Å; A92-L146 HydrophobicContact CB-CD2 3.69Å; A92-Y504 HydrophobicContact CB-CE2 4.02Å
93	C	97.8	Very high	90.4	Very high	9 Å²	9	58.6 Å²	58.6	6%	0.061	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	158.5	168.9	62.7	0	0	0	0	111.2	W144 A145 S160 Y504	C93-W144 WeakPolarHBondContact O-CA 3.41Å; C93-A145 PolarHBondContact N-O 2.92Å; C93-A145 PolarHBondContact O-N 3.23Å; C93-S160 WeakPolarHBondContact CB-O 3.48Å; C93-S160 PolarHBondContact SG-O 3.04Å; C93-Y504 PolarHBondContact O-OH 3.23Å
94	C	97.4	Very high	88.5	Confident	15 Å²	15	64.4 Å²	64.4	10%	0.101	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	129	177.5	-178.2	0	0	0	0	109.3	L70 P71 Y143 W144	L70-C94 HydrophobicContact CD2-CB 3.67Å; P71-C94 WeakPolarHBondContact CD-SG 3.37Å; P71-C94 VanDerWaalsContact CG-SG 3.55Å; C94-Y143 CarbonylContact C-O 3.59Å; C94-Y143 WeakPolarHBondContact CA-O 3.24Å; C94-Y143 PolarHBondContact SG-O 2.93Å; C94-W144 PolarHBondContact SG-NE1 2.81Å
95	E	96.3	Very high	86.3	Confident	83 Å²	83	67.2 Å²	67.2	39%	0.388	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	151	-171	-64.6	-63.2	158.8	0	0	110.9	L97 Y143	E95-L97 HydrophobicContact CB-CD1 3.45Å; E95-L97 VanDerWaalsContact CB-CD1 3.45Å; E95-L97 HydrophobicContact CB-CG 4.29Å; E95-L97 HydrophobicContact CG-CD1 4.47Å; E95-Y143 PolarHBondContact N-O 3.04Å; E95-Y143 PolarHBondContact O-N 2.86Å
96	V	95.3	Very high	83.7	Confident	77 Å²	77	71.3 Å²	71.3	47%	0.467	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	109.3	167.8	-176.6	0	0	0	0	107.5	P71 T140	P71-V96 HydrophobicContact CB-CG2 4.04Å; P71-V96 HydrophobicContact CG-CG2 4.08Å; V96-T140 HydrophobicContact CG1-CG2 3.81Å
97	L	94.7	Very high	81	Confident	23 Å²	23	71.6 Å²	71.6	12%	0.12	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.3	-172.5	-68.6	107	0	0	0	110.8	E95 T140 F141 H164 A168	E95-L97 HydrophobicContact CB-CD1 3.45Å; E95-L97 VanDerWaalsContact CB-CD1 3.45Å; E95-L97 HydrophobicContact CB-CG 4.29Å; E95-L97 HydrophobicContact CG-CD1 4.47Å; L97-T140 CarbonylContact O-C 3.47Å; L97-T140 VanDerWaalsContact O-CA 3.29Å; L97-T140 WeakPolarHBondContact O-CA 3.42Å; L97-F141 HydrophobicContact CB-CD1 3.94Å; L97-F141 HydrophobicContact CB-CE1 3.48Å; L97-F141 VanDerWaalsContact CB-CE1 3.48Å; L97-F141 HydrophobicContact CB-CE2 4.43Å; L97-F141 HydrophobicContact CB-CZ 3.78Å; L97-F141 HydrophobicContact CD1-CE1 4.27Å; L97-F141 HydrophobicContact CD1-CE2 3.79Å; L97-F141 HydrophobicContact CD1-CZ 3.65Å; L97-F141 HydrophobicContact CD2-CZ 4.27Å; L97-F141 HydrophobicContact CG-CE1 4.3Å; L97-F141 HydrophobicContact CG-CZ 4.1Å; L97-F141 PolarHBondContact N-O 2.89Å; L97-F141 PolarHBondContact O-N 3.17Å; L97-H164 HydrophobicContact CD1-CB 4.19Å; L97-A168 HydrophobicContact CD2-CB 4.16Å
98	M	92.6	Very high	78.3	Confident	107 Å²	107	71.4 Å²	71.4	53%	0.527	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	115.5	172.7	-175.4	-177.9	-71.6	0	0	109.2	D138	M98-D138 HydrophobicContact CG-CB 3.97Å; M98-D138 HydrophobicContact SD-CB 4.28Å
99	L	90.6	Very high	75.5	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.01	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	127.7	176.4	-54.8	179.3	0	0	0	109.3	L139 F141 A168 L171 Q172 M175	L99-L139 HydrophobicContact CB-CB 4.19Å; L99-L139 WeakPolarHBondContact CB-O 3.33Å; L99-L139 HydrophobicContact CD1-CB 4.48Å; L99-L139 HydrophobicContact CD1-CD2 4.17Å; L99-L139 PolarHBondContact N-O 3.45Å; L99-L139 PolarHBondContact O-N 3.49Å; L99-L139 VanDerWaalsContact O-N 3.13Å; L99-F141 HydrophobicContact CD1-CD1 4.14Å; L99-F141 HydrophobicContact CD1-CE1 4.13Å; L99-F141 HydrophobicContact CD2-CE1 3.91Å; L99-F141 HydrophobicContact CG-CD1 4.15Å; L99-F141 HydrophobicContact CG-CE1 4.05Å; L99-A168 HydrophobicContact CD2-CB 3.57Å; L99-L171 HydrophobicContact CD1-CB 3.46Å; L99-L171 VanDerWaalsContact CD1-CB 3.46Å; L99-L171 HydrophobicContact CD1-CD1 4.05Å; L99-L171 HydrophobicContact CD1-CG 4.41Å; L99-Q172 HydrophobicContact CB-CG 4.25Å; L99-Q172 HydrophobicContact CD2-CG 4.03Å; L99-M175 HydrophobicContact CB-SD 3.52Å; L99-M175 VanDerWaalsContact CB-SD 3.52Å
100	K	86.5	Confident	72.6	Confident	129 Å²	129	83 Å²	83	56%	0.561	46%	0.456	S	S	*	.			trans	-107.5	147.7	176.9	-62.9	-171.7	176.3	-172.5	0	109.9	R102 M175	K100-R102 PolarHBondContact O-N 2.85Å; K100-M175 VanDerWaalsContact C-CE 3.4Å
101	R	75.6	Confident	69.5	Low	108 Å²	108	94.9 Å²	94.9	41%	0.408	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-61.7	133.7	172.5	-76.3	-174.7	-179.1	173.2	0.1	108	P103 M175	R101-P103 WeakPolarHBondContact O-CD 3.38Å; R101-M175 HydrophobicContact CB-CE 3.87Å; R101-M175 HydrophobicContact CG-CE 3.22Å
102	R	67.3	Low	66.3	Low	150 Å²	150	101.8 Å²	101.8	57%	0.566	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-60.7	127.2	166.1	-65.3	-171.1	-151.7	173.4	9.9	106.3	K100 L104 E173	K100-R102 PolarHBondContact O-N 2.85Å; R102-L104 PolarHBondContact O-N 3.31Å; R102-E173 IonicContact NH2-OE1 2.59Å
103	P	56.3	Low	63.2	Low	113 Å²	113	108 Å²	108	73%	0.734	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-53.8	131.1	169.9	-20	30.6	0	0	0	107.4	R101 E105	R101-P103 WeakPolarHBondContact O-CD 3.38Å; P103-E105 VanDerWaalsContact C-N 3.27Å; P103-E105 PolarHBondContact O-N 3.09Å
104	L	50.7	Low	60.1	Low	173 Å²	173	111.9 Å²	111.9	91%	0.906	61%	0.611	S	S	*	*			trans	-61.3	98.1	171.2	-165.8	75.4	0	0	0	106.1	R102 S106	R102-L104 PolarHBondContact O-N 3.31Å; L104-S106 PolarHBondContact O-N 2.69Å
105	E	43.7	Very low	57.1	Low	178 Å²	178	115.6 Å²	115.6	83%	0.832	64%	0.642	S	S	*	*			trans	-60.6	107.9	173.3	-74.5	-168.8	170.4	0	0	106.1	P103 S107	P103-E105 VanDerWaalsContact C-N 3.27Å; P103-E105 PolarHBondContact O-N 3.09Å; E105-S107 PolarHBondContact O-N 2.99Å
106	S	37.6	Very low	54.1	Low	110 Å²	110	122.5 Å²	122.5	77%	0.769	67%	0.665	S	S	*	*			trans	-52.9	112.4	169.6	57.4	0	0	0	0	106.6	L104 G108	L104-S106 PolarHBondContact O-N 2.69Å; S106-G108 PolarHBondContact O-N 3.1Å
107	S	36.2	Very low	51	Low	123 Å²	123	130.4 Å²	130.4	86%	0.86	69%	0.686	S	S	*	*			trans	-62.1	81.5	174	52.6	0	0	0	0	109.3	E105	E105-S107 PolarHBondContact O-N 2.99Å
108	G	35.2	Very low	48	Very low	57 Å²	57	140.8 Å²	140.8	59%	0.588	72%	0.724	S	S	*	*			trans	-90.7	135.6	166.8	0	0	0	0	0	108.8	S106 N110	S106-G108 PolarHBondContact O-N 3.1Å; G108-N110 PolarHBondContact O-N 2.8Å
109	P	39.4	Very low	45	Very low	128 Å²	128	141.2 Å²	141.2	83%	0.831	74%	0.738	S	S	*	*			trans	-73.4	131	-173.5	29.4	-31.8	0	0	0	111
110	N	36.2	Very low	42.3	Very low	149 Å²	149	146.3 Å²	146.3	80%	0.797	77%	0.774	S	S	*	*			trans	51	106	154.7	-89.2	-11.6	0	0	0	119	G108	G108-N110 PolarHBondContact O-N 2.8Å
111	R	33.7	Very low	39.9	Very low	251 Å²	251	148.2 Å²	148.2	95%	0.947	79%	0.789	S	S	*	*			trans	-140	123.1	138.5	-81.8	-167.4	166.9	175.9	-4.5	111.7
112	N	30.2	Very low	38.2	Very low	149 Å²	149	149.1 Å²	149.1	80%	0.797	81%	0.809	S	S	*	*			trans	-52.8	144	178.9	-69.3	-22.4	0	0	0	113.6
113	P	34.8	Very low	36.5	Very low	134 Å²	134	150.1 Å²	150.1	87%	0.87	83%	0.825	S	S	*	*			trans	-90.8	107.9	171.5	33.4	-26.5	0	0	0	110
114	A	32.7	Very low	35.3	Very low	91 Å²	91	148.2 Å²	148.2	75%	0.752	83%	0.827	S	S	*	*			trans	-136.3	111.9	165	0	0	0	0	0	110.6
115	A	33.3	Very low	34.4	Very low	92 Å²	92	149.5 Å²	149.5	76%	0.76	83%	0.828	S	S	*	*			trans	65.3	116.5	155.7	0	0	0	0	0	118.9
116	R	33.6	Very low	33.8	Very low	228 Å²	228	144.2 Å²	144.2	86%	0.86	82%	0.821	S	S	*	*				169.1	126.4	99.7	-90.8	176.3	174.9	-171.2	-1.2	113.7
117	R	30.4	Very low	33.4	Very low	243 Å²	243	147.9 Å²	147.9	92%	0.917	83%	0.831	S	S	*	*			trans	48.4	138	131.8	-66.8	-170.4	-177.3	-161.2	1	123.2
118	R	32.6	Very low	33	Very low	241 Å²	241	145.6 Å²	145.6	91%	0.909	83%	0.827	S	S	*	*			trans	-41.9	164.5	165.5	-75.9	178.1	177.1	-165.3	-1.7	118.5
119	S	29.1	Very low	33.1	Very low	117 Å²	117	151 Å²	151	82%	0.818	84%	0.841	S	S	*	*			trans	81.6	141.4	161.6	72.3	0	0	0	0	114.5
120	S	32.7	Very low	32.8	Very low	109 Å²	109	156.5 Å²	156.5	76%	0.762	85%	0.846	S	S	*	*			cis	-166.5	170.2	10.5	32.2	0	0	0	0	107.4
121	L	37.6	Very low	32.7	Very low	169 Å²	169	157 Å²	157	89%	0.885	85%	0.848	S	S	*	*			trans	-20.9	157.8	169.7	-63.2	160.6	0	0	0	118.2
122	P	39.9	Very low	32.6	Very low	127 Å²	127	148 Å²	148	83%	0.825	83%	0.834	S	S	*	*			trans	-137.1	140.8	134.9	34.5	-19	0	0	0	115.4
123	N	30.9	Very low	33	Very low	170 Å²	170	146.6 Å²	146.6	91%	0.909	84%	0.835	S	S	*	*			trans	-83.4	148.9	154.9	-97.1	-5.3	0	0	0	109.5
124	G	30.8	Very low	33.3	Very low	74 Å²	74	146.9 Å²	146.9	76%	0.763	83%	0.829	S	S	*	*			trans	97.2	108.7	136.5	0	0	0	0	0	119.3
125	E	31.5	Very low	33.8	Very low	199 Å²	199	146 Å²	146	93%	0.93	83%	0.829	S	S	*	*			trans	80.9	104.7	144.5	-57.4	-164.7	155.2	0	0	121
126	G	30.8	Very low	34.8	Very low	67 Å²	67	144 Å²	144	69%	0.691	81%	0.809	S	S	*	*				81.7	107.9	113.9	0	0	0	0	0	118.5
127	L	30.2	Very low	36.3	Very low	188 Å²	188	138.7 Å²	138.7	98%	0.984	80%	0.795	S	S	*	*				162.8	130.8	125.1	-86.6	157.7	0	0	0	111.3
128	G	27.8	Very low	38.7	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	77%	0.768	S	S	*	*			trans	106.1	94.3	145.8	0	0	0	0	0	117	R130	G128-R130 PolarHBondContact O-N 2.95Å
129	L	37.8	Very low	41.4	Very low	171 Å²	171	119.5 Å²	119.5	90%	0.895	73%	0.728	S	S	*	*			trans	-44.2	122.8	155.8	-75.9	146.7	0	0	0	111.8
130	R	31.8	Very low	44.4	Very low	244 Å²	244	116.6 Å²	116.6	92%	0.921	71%	0.705	S	S	*	*			trans	-133.5	92.9	143.1	-92.3	-172.6	162.6	-157.5	-5.3	107.3	G128 G132	G128-R130 PolarHBondContact O-N 2.95Å; R130-G132 PolarHBondContact O-N 2.85Å
131	D	35	Very low	47.3	Very low	160 Å²	160	111.4 Å²	111.4	86%	0.856	67%	0.669	S	S	*	*			trans	-65.4	88.6	160.4	-160.9	10.9	0	0	0	106.6
132	G	30.5	Very low	50.1	Low	62 Å²	62	104.3 Å²	104.3	64%	0.639	63%	0.631	S	S	*	*			trans	-110.9	96.7	171.3	0	0	0	0	0	106.2	R130 D134	R130-G132 PolarHBondContact O-N 2.85Å; G132-D134 PolarHBondContact O-N 2.81Å
133	S	39.7	Very low	52.9	Low	118 Å²	118	98.2 Å²	98.2	83%	0.825	59%	0.592	S	S	*	*			trans	-60.9	80.1	164.2	57.9	0	0	0	0	108.8	G135	S133-G135 PolarHBondContact O-N 3.3Å
134	D	41.3	Very low	56.1	Low	141 Å²	141	90.1 Å²	90.1	75%	0.754	55%	0.549	S	S	*	.			trans	-75.3	107.2	161.4	-157.7	10.4	0	0	0	105.3	G132 S136	G132-D134 PolarHBondContact O-N 2.81Å; D134-S136 PolarHBondContact O-N 2.98Å
135	G	43.3	Very low	59.3	Low	73 Å²	73	86.6 Å²	86.6	75%	0.753	51%	0.512	S	S	*	.			trans	-70.7	45	-179.7	0	0	0	0	0	112.2	S133 E137	S133-G135 PolarHBondContact O-N 3.3Å; G135-E137 PolarHBondContact O-N 2.89Å
136	S	53.6	Low	62.5	Low	48 Å²	48	77.1 Å²	77.1	34%	0.336	47%	0.468	S	S	.	.			trans	-76	104	172.5	65.8	0	0	0	0	108.1	D134 D138	D134-S136 PolarHBondContact O-N 2.98Å; S136-D138 PolarHBondContact O-N 3.28Å
137	E	65.6	Low	65.8	Low	118 Å²	118	74 Å²	74	55%	0.551	44%	0.435	S	S	*	.			trans	-63.6	103.3	169.6	-70.1	-174.8	171.5	0	0	109.2	G135 C179	G135-E137 PolarHBondContact O-N 2.89Å; E137-C179 HydrophobicContact CB-CB 4.3Å; E137-C179 VanDerWaalsContact OE2-O 3.07Å
138	D	81.5	Confident	69	Low	69 Å²	69	65.6 Å²	65.6	37%	0.369	39%	0.392	S	S	.	.			trans	-70.9	130.9	171.2	-75.2	-17.1	0	0	0	109.1	M98 S136	M98-D138 HydrophobicContact CG-CB 3.97Å; M98-D138 HydrophobicContact SD-CB 4.28Å; S136-D138 PolarHBondContact O-N 3.28Å
139	L	88.3	Confident	72.4	Confident	12 Å²	12	62.2 Å²	62.2	6%	0.063	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	110.9	-179.3	-171.2	64.2	0	0	0	109.4	L99 M175 L178 L278 Q279	L99-L139 HydrophobicContact CB-CB 4.19Å; L99-L139 WeakPolarHBondContact CB-O 3.33Å; L99-L139 HydrophobicContact CD1-CB 4.48Å; L99-L139 HydrophobicContact CD1-CD2 4.17Å; L99-L139 PolarHBondContact N-O 3.45Å; L99-L139 PolarHBondContact O-N 3.49Å; L99-L139 VanDerWaalsContact O-N 3.13Å; L139-M175 HydrophobicContact CB-CG 4.02Å; L139-M175 HydrophobicContact CB-SD 3.88Å; L139-M175 HydrophobicContact CD2-CG 3.92Å; L139-L178 HydrophobicContact CD2-CB 4.17Å; L139-L178 HydrophobicContact CD2-CD1 3.87Å; L139-L278 HydrophobicContact CD1-CD1 3.61Å; L139-L278 HydrophobicContact CD2-CD1 3.79Å; L139-L278 HydrophobicContact CG-CD1 3.55Å; L139-Q279 HydrophobicContact CD1-CG 3.89Å
140	T	91.5	Very high	75.2	Confident	55 Å²	55	56.4 Å²	56.4	34%	0.337	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136.2	177.4	-58.4	0	0	0	0	110.5	V96 L97	V96-T140 HydrophobicContact CG1-CG2 3.81Å; L97-T140 CarbonylContact O-C 3.47Å; L97-T140 VanDerWaalsContact O-CA 3.29Å; L97-T140 WeakPolarHBondContact O-CA 3.42Å
141	F	93.9	Very high	78.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.9	169.1	75.2	-83.7	0	0	0	112.1	L97 L99 Y143 I167 A168 L171 A276 C277 L278	L97-F141 HydrophobicContact CB-CD1 3.94Å; L97-F141 HydrophobicContact CB-CE1 3.48Å; L97-F141 VanDerWaalsContact CB-CE1 3.48Å; L97-F141 HydrophobicContact CB-CE2 4.43Å; L97-F141 HydrophobicContact CB-CZ 3.78Å; L97-F141 HydrophobicContact CD1-CE1 4.27Å; L97-F141 HydrophobicContact CD1-CE2 3.79Å; L97-F141 HydrophobicContact CD1-CZ 3.65Å; L97-F141 HydrophobicContact CD2-CZ 4.27Å; L97-F141 HydrophobicContact CG-CE1 4.3Å; L97-F141 HydrophobicContact CG-CZ 4.1Å; L97-F141 PolarHBondContact N-O 2.89Å; L97-F141 PolarHBondContact O-N 3.17Å; L99-F141 HydrophobicContact CD1-CD1 4.14Å; L99-F141 HydrophobicContact CD1-CE1 4.13Å; L99-F141 HydrophobicContact CD2-CE1 3.91Å; L99-F141 HydrophobicContact CG-CD1 4.15Å; L99-F141 HydrophobicContact CG-CE1 4.05Å; F141-Y143 HydrophobicContact CE2-CD2 4.28Å; F141-I167 HydrophobicContact CE2-CG2 4.36Å; F141-I167 HydrophobicContact CZ-CG2 4.27Å; F141-A168 HydrophobicContact CE1-CB 4.22Å; F141-A168 HydrophobicContact CZ-CB 4.25Å; F141-L171 HydrophobicContact CD1-CD1 4.11Å; F141-L171 HydrophobicContact CE1-CD1 4Å; F141-L171 HydrophobicContact CZ-CD1 4.3Å; F141-A276 HydrophobicContact CD2-CB 4.26Å; F141-C277 VanDerWaalsContact CA-O 3.25Å; F141-C277 WeakPolarHBondContact CA-O 3.15Å; F141-C277 VanDerWaalsContact CB-O 3.31Å; F141-C277 WeakPolarHBondContact CB-O 3.43Å; F141-L278 HydrophobicContact CB-CB 4.1Å; F141-L278 HydrophobicContact CB-CD1 3.93Å
142	H	96.5	Very high	81.1	Confident	20 Å²	20	41.6 Å²	41.6	9%	0.093	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.8	174.9	-59.5	59.1	0	0	0	108.5	W72 W144 A276 C277 Q514	W72-H142 AromaticContact NE1-CD2 3.56Å; W72-H142 AromaticContact NE1-NE2 3.54Å; H142-W144 HydrophobicContact CB-CE3 4.34Å; H142-W144 HydrophobicContact CB-CH2 3.34Å; H142-W144 HydrophobicContact CB-CZ2 4.24Å; H142-W144 HydrophobicContact CB-CZ3 3.4Å; H142-W144 VanDerWaalsContact CB-CZ3 3.4Å; H142-A276 CarbonylContact O-C 3.57Å; H142-A276 VanDerWaalsContact O-CA 3.3Å; H142-A276 WeakPolarHBondContact O-CA 3.46Å; H142-C277 HydrophobicContact CB-CB 4.18Å; H142-C277 PolarHBondContact N-O 2.89Å; H142-C277 VanDerWaalsContact N-O 3.09Å; H142-C277 PolarHBondContact O-N 2.98Å; H142-Q514 PolarHBondContact CE1-NE2 2.79Å; H142-Q514 PolarHBondContact CE1-OE1 3.42Å; H142-Q514 PolarHBondContact ND1-OE1 2.75Å; H142-Q514 PolarHBondContact NE2-NE2 3.17Å; H142-Q514 VanDerWaalsContact NE2-NE2 3.17Å
143	Y	98.3	Very high	84.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.1	-173.4	179.6	-90.1	0	0	0	110.5	C94 E95 F141 A145 L163 H164 I167 M274 V275	C94-Y143 CarbonylContact C-O 3.59Å; C94-Y143 WeakPolarHBondContact CA-O 3.24Å; C94-Y143 PolarHBondContact SG-O 2.93Å; E95-Y143 PolarHBondContact N-O 3.04Å; E95-Y143 PolarHBondContact O-N 2.86Å; F141-Y143 HydrophobicContact CE2-CD2 4.28Å; Y143-A145 HydrophobicContact CE1-CB 3.58Å; Y143-A145 VanDerWaalsContact OH-CB 3.25Å; Y143-A145 WeakPolarHBondContact OH-CB 3.45Å; Y143-L163 WeakPolarHBondContact OH-CD2 3.46Å; Y143-H164 HydrophobicContact CD1-CB 3.71Å; Y143-H164 HydrophobicContact CD2-CB 4.09Å; Y143-H164 HydrophobicContact CE1-CB 3.75Å; Y143-H164 HydrophobicContact CE2-CB 4.09Å; Y143-H164 HydrophobicContact CG-CB 3.88Å; Y143-I167 HydrophobicContact CD2-CD1 4.24Å; Y143-I167 HydrophobicContact CE2-CD1 3.53Å; Y143-M274 HydrophobicContact CE2-CB 3.82Å; Y143-M274 HydrophobicContact CE2-CE 4.11Å; Y143-M274 HydrophobicContact CE2-CG 4.49Å; Y143-V275 CarbonylContact C-O 3.53Å; Y143-V275 VanDerWaalsContact CA-O 3.31Å; Y143-V275 WeakPolarHBondContact CA-O 3.45Å
144	W	98.7	Very high	86.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142.2	169.5	-60.2	-104.1	0	0	0	108.4	P71 W72 T74 C93 C94 H142 M274 V275 C277 Y504 I506	P71-W144 HydrophobicContact CB-CZ2 4.47Å; P71-W144 HydrophobicContact CG-CZ2 3.76Å; W72-W144 AromaticContact CD2-CH2 3.88Å; W72-W144 HydrophobicContact CD2-CH2 3.88Å; W72-W144 HydrophobicContact CD2-CZ2 4.11Å; W72-W144 AromaticContact CE3-CH2 3.69Å; W72-W144 HydrophobicContact CE3-CH2 3.69Å; W72-W144 HydrophobicContact CE3-CZ2 4.02Å; W72-W144 HydrophobicContact CG-CZ2 4.43Å; W72-W144 HydrophobicContact CH2-CH2 4.1Å; W72-W144 HydrophobicContact CZ2-CH2 4.26Å; W72-W144 AromaticContact CZ3-CH2 3.81Å; W72-W144 HydrophobicContact CZ3-CH2 3.81Å; T74-W144 PolarHBondContact OG1-NE1 3.13Å; T74-W144 VanDerWaalsContact OG1-NE1 3.09Å; C93-W144 WeakPolarHBondContact O-CA 3.41Å; C94-W144 PolarHBondContact SG-NE1 2.81Å; H142-W144 HydrophobicContact CB-CE3 4.34Å; H142-W144 HydrophobicContact CB-CH2 3.34Å; H142-W144 HydrophobicContact CB-CZ2 4.24Å; H142-W144 HydrophobicContact CB-CZ3 3.4Å; H142-W144 VanDerWaalsContact CB-CZ3 3.4Å; W144-M274 CarbonylContact O-C 3.59Å; W144-M274 WeakPolarHBondContact O-CA 3.33Å; W144-V275 HydrophobicContact CB-CB 4.49Å; W144-V275 HydrophobicContact CE3-CB 4.35Å; W144-V275 HydrophobicContact CE3-CG1 4.2Å; W144-V275 PolarHBondContact N-O 3.34Å; W144-V275 PolarHBondContact O-N 2.7Å; W144-C277 HydrophobicContact CZ3-CB 4.15Å; W144-Y504 HydrophobicContact CB-CE2 4.47Å; W144-I506 HydrophobicContact CB-CD1 3.98Å; W144-I506 HydrophobicContact CD2-CD1 3.75Å; W144-I506 HydrophobicContact CD2-CG1 4.44Å; W144-I506 HydrophobicContact CE3-CD1 4.3Å; W144-I506 HydrophobicContact CG-CD1 3.6Å; W144-I506 HydrophobicContact CG-CG1 4.35Å; W144-I506 HydrophobicContact CH2-CG2 4.31Å; W144-I506 HydrophobicContact CZ2-CG2 3.97Å
145	A	98.8	Very high	89.6	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	149	171.3	0	0	0	0	0	113.5	A92 C93 Y143 F147 L273 M274	A92-A145 VanDerWaalsContact CA-O 3.25Å; A92-A145 WeakPolarHBondContact CA-O 3.48Å; C93-A145 PolarHBondContact N-O 2.92Å; C93-A145 PolarHBondContact O-N 3.23Å; Y143-A145 HydrophobicContact CE1-CB 3.58Å; Y143-A145 VanDerWaalsContact OH-CB 3.25Å; Y143-A145 WeakPolarHBondContact OH-CB 3.45Å; A145-F147 HydrophobicContact CB-CD2 4.44Å; A145-F147 HydrophobicContact CB-CE2 3.53Å; A145-F147 HydrophobicContact CB-CZ 3.6Å; A145-L273 CarbonylContact C-O 3.52Å; A145-L273 WeakPolarHBondContact CA-O 3.24Å; A145-L273 WeakPolarHBondContact CB-O 3.14Å; A145-M274 HydrophobicContact CB-CB 4.02Å
146	L	98.8	Very high	92.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	141.4	167.3	-62.6	-180	0	0	0	109.2	Y76 Q91 A92 L273 L435 T437 Y504	Y76-L146 HydrophobicContact CE2-CD2 3.95Å; Q91-L146 CarbonylContact O-C 3.55Å; Q91-L146 WeakPolarHBondContact O-CA 3.35Å; A92-L146 HydrophobicContact CB-CD2 3.69Å; L146-L273 PolarHBondContact N-O 2.88Å; L146-L273 PolarHBondContact O-N 3.28Å; L146-L435 HydrophobicContact CD1-CB 3.7Å; L146-L435 HydrophobicContact CG-CB 4.37Å; L146-T437 HydrophobicContact CB-CG2 4.22Å; L146-T437 HydrophobicContact CD1-CG2 4.33Å; L146-Y504 HydrophobicContact CD1-CD2 4.4Å; L146-Y504 HydrophobicContact CD2-CD2 3.57Å; L146-Y504 HydrophobicContact CD2-CE2 3.52Å; L146-Y504 HydrophobicContact CG-CD2 3.85Å; L146-Y504 HydrophobicContact CG-CE2 4.1Å
147	F	98.9	Very high	94.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	107.7	176.4	-53.6	-87.5	0	0	0	108	D90 Q91 A145 G149 A156 A159 S160 L163 C270 T271 A272 F393	D90-F147 CarbonylContact C-O 3.59Å; D90-F147 VanDerWaalsContact CA-O 3.27Å; D90-F147 WeakPolarHBondContact CA-O 3.41Å; Q91-F147 HydrophobicContact CB-CB 4.29Å; Q91-F147 HydrophobicContact CB-CD2 4.39Å; Q91-F147 PolarHBondContact N-O 2.78Å; Q91-F147 PolarHBondContact O-N 3.32Å; A145-F147 HydrophobicContact CB-CD2 4.44Å; A145-F147 HydrophobicContact CB-CE2 3.53Å; A145-F147 HydrophobicContact CB-CZ 3.6Å; F147-G149 PolarHBondContact O-N 3.36Å; F147-A156 HydrophobicContact CB-CB 3.96Å; F147-A159 HydrophobicContact CD1-CB 3.59Å; F147-A159 HydrophobicContact CE1-CB 3.53Å; F147-A159 HydrophobicContact CG-CB 4.23Å; F147-A159 HydrophobicContact CZ-CB 4.13Å; F147-S160 VanDerWaalsContact CE2-CA 3.41Å; F147-L163 HydrophobicContact CE1-CD2 3.78Å; F147-L163 HydrophobicContact CZ-CB 4.3Å; F147-L163 HydrophobicContact CZ-CD2 3.96Å; F147-C270 HydrophobicContact CB-CB 4.45Å; F147-T271 WeakPolarHBondContact CA-O 3.31Å; F147-A272 HydrophobicContact CD1-CB 3.77Å; F147-A272 HydrophobicContact CE1-CB 3.81Å; F147-F393 HydrophobicContact CE1-CE2 4.22Å
148	D	98.8	Very high	95.9	Very high	13 Å²	13	16.8 Å²	16.8	7%	0.07	11%	0.109	C	C	.	.			trans	-83.6	109.3	175.9	-169.6	-28.8	0	0	0	108.5	D90 C270 T271 T437 D438	D90-D148 WeakPolarHBondContact OD1-CA 3.32Å; D148-C270 CarbonylContact O-C 3.56Å; D148-C270 WeakPolarHBondContact O-CA 3.35Å; D148-C270 VanDerWaalsContact O-CB 3.24Å; D148-C270 WeakPolarHBondContact O-CB 3.48Å; D148-T271 HydrophobicContact CB-CG2 3.97Å; D148-T271 WeakPolarHBondContact CB-OG1 3.25Å; D148-T271 PolarHBondContact N-OG1 3.15Å; D148-T271 VanDerWaalsContact N-OG1 3.14Å; D148-T271 PolarHBondContact O-N 3.23Å; D148-T437 HydrophobicContact CB-CG2 3.92Å; D148-D438 PolarHBondContact OD2-N 3.38Å; D148-D438 VanDerWaalsContact OD2-OD1 3.13Å
149	G	98.3	Very high	96.8	Very high	3 Å²	3	13.5 Å²	13.5	3%	0.031	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	149.4	-174.2	0	0	0	0	0	112.5	E89 F147	E89-G149 WeakPolarHBondContact CB-O 2.95Å; E89-G149 WeakPolarHBondContact O-CA 3.46Å; E89-G149 PolarHBondContact O-N 2.93Å; F147-G149 PolarHBondContact O-N 3.36Å
150	H	96.8	Very high	97.2	Very high	48 Å²	48	13.1 Å²	13.1	22%	0.222	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148	175.3	60.9	-97.9	0	0	0	112.6	G152 G268 G269 D395	H150-G152 PolarHBondContact O-N 3.37Å; H150-G268 WeakPolarHBondContact O-CA 3.34Å; H150-G269 VanDerWaalsContact CE1-C 3.44Å; H150-G269 PolarHBondContact N-O 3.18Å; H150-G269 PolarHBondContact O-N 2.93Å; H150-D395 IonicContact CD2-OD2 3.41Å; H150-D395 IonicContact CE1-OD2 2.71Å; H150-D395 PolarHBondContact CE1-OD2 3.11Å; H150-D395 IonicContact NE2-OD1 2.71Å; H150-D395 IonicContact NE2-OD2 2.85Å; H150-D395 PolarHBondContact NE2-OD2 3.2Å
151	A	95.1	Very high	97.6	Very high	78 Å²	78	14.4 Å²	14.4	65%	0.645	9%	0.089	S	C	*	.	S	Bend	trans	56	36.7	-177.2	0	0	0	0	0	112.8	G268	A151-G268 VanDerWaalsContact O-CA 3.3Å; A151-G268 WeakPolarHBondContact O-CA 3.21Å; A151-G268 PolarHBondContact O-N 3.29Å
152	G	94.4	Very high	97.8	Very high	16 Å²	16	15.6 Å²	15.6	17%	0.165	10%	0.095	C	C	.	.	S	Bend	trans	118.4	147.5	-174.7	0	0	0	0	0	112.2	E89 H150 G154	E89-G152 WeakPolarHBondContact OE1-CA 3.27Å; E89-G152 PolarHBondContact OE1-N 3.36Å; H150-G152 PolarHBondContact O-N 3.37Å; G152-G154 VanDerWaalsContact C-N 3.32Å; G152-G154 PolarHBondContact O-N 2.83Å
153	S	95.7	Very high	97.9	Very high	16 Å²	16	14.7 Å²	14.7	11%	0.112	9%	0.091	C	C	.	.	S	Bend	trans	-84.1	-1.6	178.9	68.8	0	0	0	0	114.1	Y37 A155 A156 V157	Y37-S153 WeakPolarHBondContact CD2-OG 3.17Å; S153-A155 PolarHBondContact O-N 3.29Å; S153-A156 PolarHBondContact O-N 3.36Å; S153-V157 WeakPolarHBondContact O-CB 3.4Å; S153-V157 VanDerWaalsContact O-CG2 3.27Å; S153-V157 WeakPolarHBondContact O-CG2 3.49Å; S153-V157 PolarHBondContact O-N 2.99Å
154	G	97	Very high	97.9	Very high	14 Å²	14	15 Å²	15	14%	0.144	9%	0.092	C	C	.	.	H	α-helix	trans	-60.5	-46.8	-167	0	0	0	0	0	113.5	G152 M158 S267	G152-G154 VanDerWaalsContact C-N 3.32Å; G152-G154 PolarHBondContact O-N 2.83Å; G154-M158 WeakPolarHBondContact O-CB 3.34Å; G154-M158 PolarHBondContact O-N 3.36Å; G154-S267 WeakPolarHBondContact CA-O 3.39Å; G154-S267 PolarHBondContact N-O 3.45Å; G154-S267 PolarHBondContact N-OG 3.01Å
155	A	98.1	Very high	97.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63	-46.2	176.3	0	0	0	0	0	112	S153 M158 A159 S267 C270	S153-A155 PolarHBondContact O-N 3.29Å; A155-M158 PolarHBondContact O-N 2.86Å; A155-A159 WeakPolarHBondContact O-CB 3.47Å; A155-A159 PolarHBondContact O-N 3.39Å; A155-S267 PolarHBondContact N-O 2.9Å; A155-C270 HydrophobicContact CB-CB 4.47Å
156	A	98.6	Very high	97.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.7	-44.9	179.2	0	0	0	0	0	112.1	Q91 F147 S153 M158 A159 S160 C270	Q91-A156 HydrophobicContact CB-CB 4.1Å; Q91-A156 HydrophobicContact CG-CB 3.85Å; F147-A156 HydrophobicContact CB-CB 3.96Å; S153-A156 PolarHBondContact O-N 3.36Å; A156-M158 VanDerWaalsContact C-N 3.34Å; A156-M158 PolarHBondContact O-N 2.91Å; A156-A159 PolarHBondContact O-N 2.95Å; A156-S160 WeakPolarHBondContact O-CB 3.22Å; A156-S160 PolarHBondContact O-N 2.91Å; A156-S160 PolarHBondContact O-OG 3.32Å; A156-C270 HydrophobicContact CB-CB 3.81Å
157	V	98.4	Very high	97.9	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.024	12%	0.119	C	C	.	.	H	α-helix	trans	-63	-41.2	177.1	170.5	0	0	0	0	111	F35 Y37 Q91 S153 S160 R161	F35-V157 HydrophobicContact CB-CG1 3.68Å; Y37-V157 HydrophobicContact CD2-CG2 4.41Å; Q91-V157 HydrophobicContact CG-CG2 3.86Å; S153-V157 WeakPolarHBondContact O-CB 3.4Å; S153-V157 VanDerWaalsContact O-CG2 3.27Å; S153-V157 WeakPolarHBondContact O-CG2 3.49Å; S153-V157 PolarHBondContact O-N 2.99Å; V157-S160 PolarHBondContact O-OG 2.94Å; V157-R161 VanDerWaalsContact O-CG 3.23Å; V157-R161 WeakPolarHBondContact O-CG 3.26Å; V157-R161 PolarHBondContact O-N 3.46Å
158	M	98.3	Very high	97.8	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.02	12%	0.122	C	C	.	.	H	α-helix	trans	-68.8	-42.8	178	-174.7	173.2	175.5	0	0	111.9	F35 G154 A155 A156 R161 L162 M253 Q256 I257 E260 I266	F35-M158 HydrophobicContact CD2-CG 4.48Å; F35-M158 HydrophobicContact CE2-CG 4.29Å; G154-M158 WeakPolarHBondContact O-CB 3.34Å; G154-M158 PolarHBondContact O-N 3.36Å; A155-M158 PolarHBondContact O-N 2.86Å; A156-M158 VanDerWaalsContact C-N 3.34Å; A156-M158 PolarHBondContact O-N 2.91Å; M158-R161 PolarHBondContact O-N 3.31Å; M158-L162 HydrophobicContact CE-CD1 3.73Å; M158-L162 HydrophobicContact CG-CD1 3.83Å; M158-L162 WeakPolarHBondContact O-CB 3.46Å; M158-L162 PolarHBondContact O-N 2.87Å; M158-L162 VanDerWaalsContact O-N 3.15Å; M158-M253 HydrophobicContact CE-CE 3.83Å; M158-M253 HydrophobicContact CG-CE 3.79Å; M158-M253 HydrophobicContact SD-CE 4.23Å; M158-Q256 HydrophobicContact CE-CB 4.2Å; M158-Q256 HydrophobicContact CE-CG 3.6Å; M158-I257 HydrophobicContact CE-CG1 4.28Å; M158-I257 HydrophobicContact CG-CG1 4.3Å; M158-I257 HydrophobicContact SD-CB 4.46Å; M158-I257 HydrophobicContact SD-CG1 3.65Å; M158-E260 HydrophobicContact CE-CB 4.25Å; M158-E260 HydrophobicContact CE-CG 4.37Å; M158-E260 WeakPolarHBondContact CE-OE2 3.48Å; M158-I266 HydrophobicContact CE-CD1 4.38Å; M158-I266 HydrophobicContact SD-CD1 3.39Å; M158-I266 WeakPolarHBondContact SD-CD1 3.2Å; M158-I266 HydrophobicContact SD-CG1 4.28Å
159	A	98.7	Very high	97.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.6	-41	179.7	0	0	0	0	0	111.9	F147 A155 A156 R161 L162 L163 F393	F147-A159 HydrophobicContact CD1-CB 3.59Å; F147-A159 HydrophobicContact CE1-CB 3.53Å; F147-A159 HydrophobicContact CG-CB 4.23Å; F147-A159 HydrophobicContact CZ-CB 4.13Å; A155-A159 WeakPolarHBondContact O-CB 3.47Å; A155-A159 PolarHBondContact O-N 3.39Å; A156-A159 PolarHBondContact O-N 2.95Å; A159-R161 PolarHBondContact O-N 2.69Å; A159-L162 PolarHBondContact O-N 2.87Å; A159-L163 WeakPolarHBondContact O-CB 3.47Å; A159-L163 PolarHBondContact O-N 2.86Å; A159-F393 HydrophobicContact CB-CD2 3.94Å; A159-F393 HydrophobicContact CB-CE2 4.22Å
160	S	98.6	Very high	97.7	Very high	5 Å²	5	25.9 Å²	25.9	4%	0.035	15%	0.146	C	C	.	.	H	α-helix	trans	-61.4	-31.2	177	75.4	0	0	0	0	112.8	C93 F147 A156 V157	C93-S160 WeakPolarHBondContact CB-O 3.48Å; C93-S160 PolarHBondContact SG-O 3.04Å; F147-S160 VanDerWaalsContact CE2-CA 3.41Å; A156-S160 WeakPolarHBondContact O-CB 3.22Å; A156-S160 PolarHBondContact O-N 2.91Å; A156-S160 PolarHBondContact O-OG 3.32Å; V157-S160 PolarHBondContact O-OG 2.94Å
161	R	98.1	Very high	97.6	Very high	82 Å²	82	23.7 Å²	23.7	31%	0.309	14%	0.135	S	C	.	.	H	α-helix	trans	-84.4	-23.3	178.8	-64.4	-68.1	-175.3	170.6	-3.4	114.4	F35 E41 V157 M158 A159 H164 H165	F35-R161 HydrophobicContact CD1-CG 4.36Å; F35-R161 HydrophobicContact CD2-CB 4.37Å; F35-R161 HydrophobicContact CD2-CG 4.34Å; F35-R161 HydrophobicContact CE1-CB 4.47Å; F35-R161 HydrophobicContact CE2-CB 4.08Å; F35-R161 HydrophobicContact CE2-CG 4.5Å; F35-R161 HydrophobicContact CG-CG 4.26Å; F35-R161 HydrophobicContact CZ-CB 4.13Å; E41-R161 IonicContact OE2-CZ 3.23Å; E41-R161 IonicContact OE2-NH1 2.87Å; E41-R161 PolarHBondContact OE2-NH1 3.36Å; E41-R161 IonicContact OE2-NH2 2.73Å; E41-R161 PolarHBondContact OE2-NH2 3.16Å; V157-R161 VanDerWaalsContact O-CG 3.23Å; V157-R161 WeakPolarHBondContact O-CG 3.26Å; V157-R161 PolarHBondContact O-N 3.46Å; M158-R161 PolarHBondContact O-N 3.31Å; A159-R161 PolarHBondContact O-N 2.69Å; R161-H164 PolarHBondContact O-CE1 3.15Å; R161-H164 VanDerWaalsContact O-CE1 3.26Å; R161-H165 PolarHBondContact O-CD2 3.1Å
162	L	98.6	Very high	97.6	Very high	25 Å²	25	22.6 Å²	22.6	13%	0.131	12%	0.117	C	C	.	.	H	α-helix	trans	-128.3	-23.1	-164.1	-63.6	179.1	0	0	0	115.7	F35 M158 A159 H164 H165 H166 M253	F35-L162 HydrophobicContact CE2-CD1 3.93Å; F35-L162 HydrophobicContact CE2-CG 4.17Å; F35-L162 HydrophobicContact CZ-CD1 4.3Å; F35-L162 HydrophobicContact CZ-CD2 4.28Å; F35-L162 HydrophobicContact CZ-CG 4.31Å; M158-L162 HydrophobicContact CE-CD1 3.73Å; M158-L162 HydrophobicContact CG-CD1 3.83Å; M158-L162 WeakPolarHBondContact O-CB 3.46Å; M158-L162 PolarHBondContact O-N 2.87Å; M158-L162 VanDerWaalsContact O-N 3.15Å; A159-L162 PolarHBondContact O-N 2.87Å; L162-H164 VanDerWaalsContact C-N 3.34Å; L162-H164 PolarHBondContact O-N 3.14Å; L162-H165 WeakPolarHBondContact O-CB 3.12Å; L162-H165 PolarHBondContact O-N 2.91Å; L162-H165 VanDerWaalsContact O-N 3.08Å; L162-H166 PolarHBondContact O-CD2 2.68Å; L162-H166 PolarHBondContact O-N 3.25Å; L162-M253 HydrophobicContact CB-CE 4.04Å; L162-M253 HydrophobicContact CB-SD 3.7Å; L162-M253 HydrophobicContact CD1-CE 4.24Å
163	L	98.8	Very high	97.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-42.2	-173.8	178.9	59.3	0	0	0	112.6	Y143 F147 A159 H165 H166 I167 F250 M253 F393	Y143-L163 WeakPolarHBondContact OH-CD2 3.46Å; F147-L163 HydrophobicContact CE1-CD2 3.78Å; F147-L163 HydrophobicContact CZ-CB 4.3Å; F147-L163 HydrophobicContact CZ-CD2 3.96Å; A159-L163 WeakPolarHBondContact O-CB 3.47Å; A159-L163 PolarHBondContact O-N 2.86Å; L163-H165 PolarHBondContact O-N 2.79Å; L163-H166 PolarHBondContact O-N 3.29Å; L163-I167 HydrophobicContact CD1-CD1 4.37Å; L163-I167 HydrophobicContact CG-CD1 4.01Å; L163-I167 WeakPolarHBondContact O-CG1 3.24Å; L163-I167 PolarHBondContact O-N 2.96Å; L163-F250 HydrophobicContact CD1-CD2 3.88Å; L163-F250 HydrophobicContact CD1-CE2 4.11Å; L163-F250 HydrophobicContact CD1-CG 4.47Å; L163-F250 HydrophobicContact CD2-CD2 4.37Å; L163-F250 HydrophobicContact CD2-CE2 3.81Å; L163-F250 HydrophobicContact CD2-CZ 3.95Å; L163-F250 HydrophobicContact CG-CE2 4.45Å; L163-M253 HydrophobicContact CB-CG 4.42Å; L163-M253 HydrophobicContact CB-SD 4.31Å; L163-M253 HydrophobicContact CD1-CB 3.98Å; L163-M253 HydrophobicContact CD1-CG 4.2Å; L163-F393 HydrophobicContact CD1-CZ 4.13Å; L163-F393 HydrophobicContact CD2-CE2 4.03Å; L163-F393 HydrophobicContact CD2-CZ 4.15Å
164	H	98.6	Very high	97.3	Very high	6 Å²	6	28.3 Å²	28.3	3%	0.028	14%	0.139	C	C	.	.	H	α-helix	trans	-64.5	-28.3	178.3	58.6	-92.2	0	0	0	112.9	L97 Y143 R161 L162 A168	L97-H164 HydrophobicContact CD1-CB 4.19Å; Y143-H164 HydrophobicContact CD1-CB 3.71Å; Y143-H164 HydrophobicContact CD2-CB 4.09Å; Y143-H164 HydrophobicContact CE1-CB 3.75Å; Y143-H164 HydrophobicContact CE2-CB 4.09Å; Y143-H164 HydrophobicContact CG-CB 3.88Å; R161-H164 PolarHBondContact O-CE1 3.15Å; R161-H164 VanDerWaalsContact O-CE1 3.26Å; L162-H164 VanDerWaalsContact C-N 3.34Å; L162-H164 PolarHBondContact O-N 3.14Å; H164-A168 WeakPolarHBondContact O-CB 3.08Å; H164-A168 PolarHBondContact O-N 2.98Å
165	H	98.3	Very high	97	Very high	95 Å²	95	27.8 Å²	27.8	44%	0.44	13%	0.133	S	C	.	.	H	α-helix	trans	-71.7	-40.9	173.4	-67	-43.6	0	0	0	112	R161 L162 L163 I167 A168 L169	R161-H165 PolarHBondContact O-CD2 3.1Å; L162-H165 WeakPolarHBondContact O-CB 3.12Å; L162-H165 PolarHBondContact O-N 2.91Å; L162-H165 VanDerWaalsContact O-N 3.08Å; L163-H165 PolarHBondContact O-N 2.79Å; H165-I167 VanDerWaalsContact C-N 3.33Å; H165-I167 PolarHBondContact O-N 2.83Å; H165-A168 WeakPolarHBondContact O-CB 3.48Å; H165-A168 PolarHBondContact O-N 2.83Å; H165-L169 WeakPolarHBondContact O-CG 3.3Å; H165-L169 PolarHBondContact O-N 3.04Å
166	H	98.6	Very high	96.6	Very high	26 Å²	26	34 Å²	34	12%	0.12	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-43.8	172.8	-73.9	-63.3	0	0	0	111.6	L162 L163 A168 L169 H170 A249 Q256	L162-H166 PolarHBondContact O-CD2 2.68Å; L162-H166 PolarHBondContact O-N 3.25Å; L163-H166 PolarHBondContact O-N 3.29Å; H166-A168 VanDerWaalsContact C-N 3.33Å; H166-A168 PolarHBondContact O-N 2.57Å; H166-L169 PolarHBondContact O-N 2.96Å; H166-H170 PolarHBondContact O-CD2 3.16Å; H166-H170 VanDerWaalsContact O-CD2 3.3Å; H166-H170 PolarHBondContact O-N 2.81Å; H166-H170 VanDerWaalsContact O-N 3.13Å; H166-A249 HydrophobicContact CB-CB 3.71Å; H166-Q256 PolarHBondContact CE1-OE1 3.01Å; H166-Q256 VanDerWaalsContact CE1-OE1 3.29Å; H166-Q256 PolarHBondContact NE2-OE1 3.06Å
167	I	98.6	Very high	96.3	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-46.3	175.4	-66.5	160.9	0	0	0	110.3	F141 Y143 L163 H165 L169 H170 L171 I246 A249 M274	F141-I167 HydrophobicContact CE2-CG2 4.36Å; F141-I167 HydrophobicContact CZ-CG2 4.27Å; Y143-I167 HydrophobicContact CD2-CD1 4.24Å; Y143-I167 HydrophobicContact CE2-CD1 3.53Å; L163-I167 HydrophobicContact CD1-CD1 4.37Å; L163-I167 HydrophobicContact CG-CD1 4.01Å; L163-I167 WeakPolarHBondContact O-CG1 3.24Å; L163-I167 PolarHBondContact O-N 2.96Å; H165-I167 VanDerWaalsContact C-N 3.33Å; H165-I167 PolarHBondContact O-N 2.83Å; I167-L169 VanDerWaalsContact C-N 3.31Å; I167-L169 PolarHBondContact O-N 3.32Å; I167-H170 PolarHBondContact O-N 3.25Å; I167-L171 HydrophobicContact CG2-CD1 3.74Å; I167-L171 HydrophobicContact CG2-CG 4.13Å; I167-L171 WeakPolarHBondContact O-CB 3.3Å; I167-L171 VanDerWaalsContact O-CG 3.3Å; I167-L171 WeakPolarHBondContact O-CG 3.41Å; I167-L171 PolarHBondContact O-N 2.98Å; I167-I246 HydrophobicContact CG2-CG1 4.4Å; I167-A249 HydrophobicContact CB-CB 4.28Å; I167-A249 HydrophobicContact CG1-CB 3.53Å; I167-M274 HydrophobicContact CD1-CE 3.36Å; I167-M274 HydrophobicContact CG1-CE 4.35Å
168	A	97.7	Very high	95.9	Very high	9 Å²	9	35 Å²	35	7%	0.074	17%	0.167	C	C	.	.	H	α-helix	trans	-58.8	-40.7	177.6	0	0	0	0	0	112.7	L97 L99 F141 H164 H165 H166 L171 Q172	L97-A168 HydrophobicContact CD2-CB 4.16Å; L99-A168 HydrophobicContact CD2-CB 3.57Å; F141-A168 HydrophobicContact CE1-CB 4.22Å; F141-A168 HydrophobicContact CZ-CB 4.25Å; H164-A168 WeakPolarHBondContact O-CB 3.08Å; H164-A168 PolarHBondContact O-N 2.98Å; H165-A168 WeakPolarHBondContact O-CB 3.48Å; H165-A168 PolarHBondContact O-N 2.83Å; H166-A168 VanDerWaalsContact C-N 3.33Å; H166-A168 PolarHBondContact O-N 2.57Å; A168-L171 PolarHBondContact O-N 2.91Å; A168-Q172 VanDerWaalsContact O-CG 3.26Å; A168-Q172 WeakPolarHBondContact O-CG 3.33Å; A168-Q172 PolarHBondContact O-N 2.89Å
169	L	96.7	Very high	95.4	Very high	89 Å²	89	35.2 Å²	35.2	47%	0.466	17%	0.169	S	C	.	.	H	α-helix	trans	-62.6	-47.2	177.5	-71.8	171.8	0	0	0	112	H165 H166 I167 Q172 E173	H165-L169 WeakPolarHBondContact O-CG 3.3Å; H165-L169 PolarHBondContact O-N 3.04Å; H166-L169 PolarHBondContact O-N 2.96Å; I167-L169 VanDerWaalsContact C-N 3.31Å; I167-L169 PolarHBondContact O-N 3.32Å; L169-Q172 WeakPolarHBondContact O-CB 3.35Å; L169-Q172 PolarHBondContact O-N 2.82Å; L169-E173 PolarHBondContact O-N 2.94Å
170	H	97.4	Very high	94.8	Very high	26 Å²	26	37.6 Å²	37.6	12%	0.12	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-37.5	177.9	-77.4	-74.9	0	0	0	112.4	H166 I167 Q172 E173 A245 N248 D252	H166-H170 PolarHBondContact O-CD2 3.16Å; H166-H170 VanDerWaalsContact O-CD2 3.3Å; H166-H170 PolarHBondContact O-N 2.81Å; H166-H170 VanDerWaalsContact O-N 3.13Å; I167-H170 PolarHBondContact O-N 3.25Å; H170-Q172 VanDerWaalsContact C-N 3.31Å; H170-Q172 PolarHBondContact O-N 3.09Å; H170-E173 WeakPolarHBondContact O-CB 3.4Å; H170-E173 PolarHBondContact O-N 3.29Å; H170-A245 HydrophobicContact CB-CB 3.58Å; H170-N248 VanDerWaalsContact CE1-CB 3.48Å; H170-N248 WeakPolarHBondContact CE1-CB 3.11Å; H170-D252 IonicContact CD2-OD2 3.81Å; H170-D252 IonicContact CE1-OD2 2.6Å; H170-D252 PolarHBondContact CE1-OD2 3.05Å; H170-D252 IonicContact NE2-OD2 3.95Å; H170-D252 PolarHBondContact NE2-OD2 3.14Å
171	L	96.1	Very high	93.9	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-35.8	175	-71.8	177.3	0	0	0	112.3	L99 F141 I167 A168 E173 V174 M175 L178 V242 A245 L278	L99-L171 HydrophobicContact CD1-CB 3.46Å; L99-L171 VanDerWaalsContact CD1-CB 3.46Å; L99-L171 HydrophobicContact CD1-CD1 4.05Å; L99-L171 HydrophobicContact CD1-CG 4.41Å; F141-L171 HydrophobicContact CD1-CD1 4.11Å; F141-L171 HydrophobicContact CE1-CD1 4Å; F141-L171 HydrophobicContact CZ-CD1 4.3Å; I167-L171 HydrophobicContact CG2-CD1 3.74Å; I167-L171 HydrophobicContact CG2-CG 4.13Å; I167-L171 WeakPolarHBondContact O-CB 3.3Å; I167-L171 VanDerWaalsContact O-CG 3.3Å; I167-L171 WeakPolarHBondContact O-CG 3.41Å; I167-L171 PolarHBondContact O-N 2.98Å; A168-L171 PolarHBondContact O-N 2.91Å; L171-E173 PolarHBondContact O-N 2.77Å; L171-V174 WeakPolarHBondContact O-CG2 3.5Å; L171-V174 PolarHBondContact O-N 2.93Å; L171-M175 WeakPolarHBondContact O-CA 3.18Å; L171-M175 WeakPolarHBondContact O-CB 3.33Å; L171-M175 PolarHBondContact O-N 2.82Å; L171-L178 HydrophobicContact CD2-CD1 4.2Å; L171-V242 HydrophobicContact CD2-CB 4.39Å; L171-V242 HydrophobicContact CD2-CG1 4.1Å; L171-V242 HydrophobicContact CD2-CG2 4.13Å; L171-A245 HydrophobicContact CD2-CB 3.93Å; L171-A245 HydrophobicContact CG-CB 4.34Å; L171-L278 HydrophobicContact CD1-CD2 4.25Å; L171-L278 HydrophobicContact CD2-CD2 4.12Å
172	Q	94.4	Very high	93	Very high	55 Å²	55	45.3 Å²	45.3	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-60.7	-32.2	175.1	-78.4	170.8	4	0	0	112.8	L99 A168 L169 H170 V174 M175	L99-Q172 HydrophobicContact CB-CG 4.25Å; L99-Q172 HydrophobicContact CD2-CG 4.03Å; A168-Q172 VanDerWaalsContact O-CG 3.26Å; A168-Q172 WeakPolarHBondContact O-CG 3.33Å; A168-Q172 PolarHBondContact O-N 2.89Å; L169-Q172 WeakPolarHBondContact O-CB 3.35Å; L169-Q172 PolarHBondContact O-N 2.82Å; H170-Q172 VanDerWaalsContact C-N 3.31Å; H170-Q172 PolarHBondContact O-N 3.09Å; Q172-V174 VanDerWaalsContact C-N 3.3Å; Q172-V174 PolarHBondContact O-N 2.92Å; Q172-M175 PolarHBondContact O-N 2.81Å
173	E	92.1	Very high	92.3	Very high	125 Å²	125	47.1 Å²	47.1	58%	0.584	25%	0.246	S	C	*	.	H	α-helix	trans	-69	-29.7	179.6	-66.5	-178.4	172.8	0	0	112.8	R102 L169 H170 L171	R102-E173 IonicContact NH2-OE1 2.59Å; L169-E173 PolarHBondContact O-N 2.94Å; H170-E173 WeakPolarHBondContact O-CB 3.4Å; H170-E173 PolarHBondContact O-N 3.29Å; L171-E173 PolarHBondContact O-N 2.77Å
174	V	92.4	Very high	91.6	Very high	27 Å²	27	52.5 Å²	52.5	16%	0.164	27%	0.271	C	S	.	.	H	α-helix	trans	-105	2.2	179.7	-64.4	0	0	0	0	113	L171 Q172 E176 I177 L178 L241	L171-V174 WeakPolarHBondContact O-CG2 3.5Å; L171-V174 PolarHBondContact O-N 2.93Å; Q172-V174 VanDerWaalsContact C-N 3.3Å; Q172-V174 PolarHBondContact O-N 2.92Å; V174-E176 VanDerWaalsContact C-N 3.31Å; V174-E176 PolarHBondContact O-N 2.9Å; V174-I177 WeakPolarHBondContact O-CB 3.43Å; V174-I177 PolarHBondContact O-N 2.82Å; V174-L178 HydrophobicContact CG2-CD1 3.86Å; V174-L178 HydrophobicContact CG2-CG 4.19Å; V174-L178 WeakPolarHBondContact O-CG 3.42Å; V174-L178 PolarHBondContact O-N 2.83Å; V174-L178 VanDerWaalsContact O-N 3.08Å; V174-L241 HydrophobicContact CB-CB 4.35Å; V174-L241 HydrophobicContact CB-CD1 4.2Å; V174-L241 HydrophobicContact CG1-CB 4.27Å; V174-L241 HydrophobicContact CG1-CD1 4.27Å; V174-L241 HydrophobicContact CG1-CD2 4.34Å; V174-L241 HydrophobicContact CG2-CB 4.38Å
175	M	90.8	Very high	91	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.015	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-34.2	-168.4	-167.4	177.3	67.5	0	0	113.6	L99 K100 R101 L139 L171 Q172 I177 L178 C179	L99-M175 HydrophobicContact CB-SD 3.52Å; L99-M175 VanDerWaalsContact CB-SD 3.52Å; K100-M175 VanDerWaalsContact C-CE 3.4Å; R101-M175 HydrophobicContact CB-CE 3.87Å; R101-M175 HydrophobicContact CG-CE 3.22Å; L139-M175 HydrophobicContact CB-CG 4.02Å; L139-M175 HydrophobicContact CB-SD 3.88Å; L139-M175 HydrophobicContact CD2-CG 3.92Å; L171-M175 WeakPolarHBondContact O-CA 3.18Å; L171-M175 WeakPolarHBondContact O-CB 3.33Å; L171-M175 PolarHBondContact O-N 2.82Å; Q172-M175 PolarHBondContact O-N 2.81Å; M175-I177 VanDerWaalsContact C-N 3.27Å; M175-I177 PolarHBondContact O-N 2.86Å; M175-L178 PolarHBondContact O-N 2.9Å; M175-C179 PolarHBondContact O-N 2.79Å; M175-C179 PolarHBondContact O-SG 3.13Å; M175-C179 VanDerWaalsContact O-SG 3.36Å
176	E	89.4	Confident	90.3	Very high	132 Å²	132	52.1 Å²	52.1	62%	0.617	28%	0.278	S	S	*	.	H	α-helix	trans	-58.4	-42.5	175.2	-177.1	177.4	-172.4	0	0	111.7	V174 T180 L183	V174-E176 VanDerWaalsContact C-N 3.31Å; V174-E176 PolarHBondContact O-N 2.9Å; E176-T180 VanDerWaalsContact O-CB 3.27Å; E176-T180 WeakPolarHBondContact O-CB 3.29Å; E176-T180 PolarHBondContact O-N 2.98Å; E176-T180 VanDerWaalsContact O-N 3.11Å; E176-T180 PolarHBondContact O-OG1 3.34Å; E176-L183 HydrophobicContact CG-CD2 4.22Å
177	I	91.1	Very high	89.6	Confident	19 Å²	19	56 Å²	56	10%	0.097	30%	0.303	C	S	.	.	H	α-helix	trans	-70.1	-39.3	178.3	-57.3	157.7	0	0	0	110.4	V174 M175 L183 P185 Q238 L241	V174-I177 WeakPolarHBondContact O-CB 3.43Å; V174-I177 PolarHBondContact O-N 2.82Å; M175-I177 VanDerWaalsContact C-N 3.27Å; M175-I177 PolarHBondContact O-N 2.86Å; I177-L183 HydrophobicContact CG1-CD2 4.29Å; I177-P185 HydrophobicContact CD1-CB 4.05Å; I177-P185 HydrophobicContact CG2-CG 4.11Å; I177-Q238 HydrophobicContact CG2-CG 4.31Å; I177-Q238 PolarHBondContact O-NE2 2.92Å; I177-L241 HydrophobicContact CB-CD1 4.18Å; I177-L241 HydrophobicContact CD1-CD1 3.97Å; I177-L241 HydrophobicContact CG2-CD1 3.8Å
178	L	90.8	Very high	88.8	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-66.6	-42.2	179.2	-62.3	-178.3	0	0	0	112.1	L139 L171 V174 M175 Q238 V242 L278 Q279	L139-L178 HydrophobicContact CD2-CB 4.17Å; L139-L178 HydrophobicContact CD2-CD1 3.87Å; L171-L178 HydrophobicContact CD2-CD1 4.2Å; V174-L178 HydrophobicContact CG2-CD1 3.86Å; V174-L178 HydrophobicContact CG2-CG 4.19Å; V174-L178 WeakPolarHBondContact O-CG 3.42Å; V174-L178 PolarHBondContact O-N 2.83Å; V174-L178 VanDerWaalsContact O-N 3.08Å; M175-L178 PolarHBondContact O-N 2.9Å; L178-Q238 HydrophobicContact CD2-CB 3.84Å; L178-Q238 HydrophobicContact CD2-CG 4.18Å; L178-V242 HydrophobicContact CD1-CG2 4Å; L178-V242 HydrophobicContact CD2-CG2 3.87Å; L178-L278 HydrophobicContact CD1-CD2 4.41Å; L178-Q279 PolarHBondContact O-NE2 3.33Å
179	C	88.4	Confident	87.7	Confident	10 Å²	10	65.7 Å²	65.7	7%	0.068	36%	0.357	C	S	.	.	H	α-helix	trans	-81.2	-13.7	-179.2	-58.8	0	0	0	0	113.3	E137 M175 P181	E137-C179 HydrophobicContact CB-CB 4.3Å; E137-C179 VanDerWaalsContact OE2-O 3.07Å; M175-C179 PolarHBondContact O-N 2.79Å; M175-C179 PolarHBondContact O-SG 3.13Å; M175-C179 VanDerWaalsContact O-SG 3.36Å; C179-P181 WeakPolarHBondContact O-CD 3.32Å
180	T	86.3	Confident	86.5	Confident	49 Å²	49	69.3 Å²	69.3	30%	0.301	38%	0.377	S	S	.	.	S	Bend	trans	-102.7	109.2	-178.1	-51	0	0	0	0	111	E176 N182 L183	E176-T180 VanDerWaalsContact O-CB 3.27Å; E176-T180 WeakPolarHBondContact O-CB 3.29Å; E176-T180 PolarHBondContact O-N 2.98Å; E176-T180 VanDerWaalsContact O-N 3.11Å; E176-T180 PolarHBondContact O-OG1 3.34Å; T180-N182 PolarHBondContact O-N 3.26Å; T180-L183 HydrophobicContact CG2-CB 3.8Å; T180-L183 HydrophobicContact CG2-CD2 4.18Å; T180-L183 WeakPolarHBondContact O-CB 3.3Å; T180-L183 PolarHBondContact O-N 2.96Å
181	P	77.8	Confident	84.6	Confident	100 Å²	100	75.1 Å²	75.1	65%	0.649	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	134.4	178.7	-23.9	33.9	0	0	0	111.7	C179 L183	C179-P181 WeakPolarHBondContact O-CD 3.32Å; P181-L183 PolarHBondContact O-N 3.37Å; P181-L183 VanDerWaalsContact O-N 3.15Å
182	N	80.9	Confident	82.2	Confident	149 Å²	149	83 Å²	83	80%	0.797	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	1.2	179.3	-48.4	-64.4	0	0	0	116.3	T180 Q184	T180-N182 PolarHBondContact O-N 3.26Å; N182-Q184 PolarHBondContact O-N 3.1Å
183	L	83.7	Confident	79.7	Confident	64 Å²	64	85.2 Å²	85.2	34%	0.335	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-65.7	119.1	171.5	-174.9	57.4	0	0	0	108.7	E176 I177 T180 P181	E176-L183 HydrophobicContact CG-CD2 4.22Å; I177-L183 HydrophobicContact CG1-CD2 4.29Å; T180-L183 HydrophobicContact CG2-CB 3.8Å; T180-L183 HydrophobicContact CG2-CD2 4.18Å; T180-L183 WeakPolarHBondContact O-CB 3.3Å; T180-L183 PolarHBondContact O-N 2.96Å; P181-L183 PolarHBondContact O-N 3.37Å; P181-L183 VanDerWaalsContact O-N 3.15Å
184	Q	82.9	Confident	77.3	Confident	113 Å²	113	84.8 Å²	84.8	53%	0.528	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-80	140.1	174.1	-67.6	-61.6	-68.7	0	0	109.2	N182	N182-Q184 PolarHBondContact O-N 3.1Å
185	P	85.8	Confident	74.6	Confident	24 Å²	24	90.5 Å²	90.5	16%	0.156	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-58.9	128	173	-17.1	29.1	0	0	0	109.4	I177 T187 V236 L241	I177-P185 HydrophobicContact CD1-CB 4.05Å; I177-P185 HydrophobicContact CG2-CG 4.11Å; P185-T187 PolarHBondContact O-N 3.06Å; P185-V236 HydrophobicContact CG-CB 4.11Å; P185-V236 HydrophobicContact CG-CG1 4.12Å; P185-L241 HydrophobicContact CB-CD1 4.09Å; P185-L241 HydrophobicContact CB-CD2 4.35Å; P185-L241 HydrophobicContact CG-CD1 3.67Å; P185-L241 HydrophobicContact CG-CD2 4.34Å; P185-L241 HydrophobicContact CG-CG 4.19Å
186	P	83.8	Confident	72.2	Confident	69 Å²	69	98.5 Å²	98.5	45%	0.448	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-64.9	136	173.4	28	-33.5	0	0	0	109.4	C188 L189	P186-C188 VanDerWaalsContact C-N 3.28Å; P186-C188 PolarHBondContact O-N 2.86Å; P186-L189 HydrophobicContact CG-CD2 3.75Å
187	T	84.6	Confident	69.6	Low	107 Å²	107	99.7 Å²	99.7	66%	0.656	54%	0.542	S	S	*	.	S	Bend	trans	-66.6	-33.4	176.9	-64.8	0	0	0	0	111.6	P185 E233	P185-T187 PolarHBondContact O-N 3.06Å; T187-E233 WeakPolarHBondContact CB-OE1 3.34Å; T187-E233 PolarHBondContact OG1-OE1 3.08Å
188	C	82.8	Confident	66.9	Low	60 Å²	60	107 Å²	107	41%	0.405	58%	0.58	S	S	.	*	S	Bend	trans	-134.3	127	174.8	-67.4	0	0	0	0	109.3	P186 D190 E191	P186-C188 VanDerWaalsContact C-N 3.28Å; P186-C188 PolarHBondContact O-N 2.86Å; C188-D190 VanDerWaalsContact C-N 3.34Å; C188-D190 PolarHBondContact O-N 3.41Å; C188-E191 HydrophobicContact CB-CB 4.21Å; C188-E191 HydrophobicContact CB-CG 3.8Å
189	L	74.1	Confident	63.9	Low	152 Å²	152	111.2 Å²	111.2	80%	0.796	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-26.6	-176.5	-70	168.2	0	0	0	113.8	P186	P186-L189 HydrophobicContact CG-CD2 3.75Å
190	D	70.6	Confident	61.4	Low	166 Å²	166	115.3 Å²	115.3	89%	0.888	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	5.4	-177.7	-61.2	-43.9	0	0	0	113.5	C188	C188-D190 VanDerWaalsContact C-N 3.34Å; C188-D190 PolarHBondContact O-N 3.41Å
191	E	56.8	Low	58.8	Low	147 Å²	147	118.8 Å²	118.8	69%	0.687	67%	0.666	S	S	*	*	S	Bend	trans	-93.2	111.2	173.4	-69.2	-165.6	164.1	0	0	109.7	C188	C188-E191 HydrophobicContact CB-CB 4.21Å; C188-E191 HydrophobicContact CB-CG 3.8Å
192	E	46.1	Very low	56.6	Low	168 Å²	168	119.7 Å²	119.7	79%	0.785	68%	0.675	S	S	*	*			trans	-47.5	135.1	172.6	-75.3	-75.3	134.5	0	0	110.6	V194	E192-V194 PolarHBondContact O-N 3.21Å
193	P	43.1	Very low	54.5	Low	102 Å²	102	120 Å²	120	66%	0.662	68%	0.677	S	S	*	*			trans	-59.3	113.8	177.6	23.5	-30.8	0	0	0	108.5	N195	P193-N195 VanDerWaalsContact C-N 3.3Å; P193-N195 PolarHBondContact O-N 3.31Å
194	V	41.9	Very low	52.1	Low	116 Å²	116	128.4 Å²	128.4	70%	0.703	70%	0.704	S	S	*	*			trans	-65	99.4	169.8	-176	0	0	0	0	106.2	E192 H196	E192-V194 PolarHBondContact O-N 3.21Å; V194-H196 PolarHBondContact O-CD2 3.08Å; V194-H196 PolarHBondContact O-N 3.12Å
195	N	35.4	Very low	49.6	Very low	146 Å²	146	127.8 Å²	127.8	78%	0.781	72%	0.718	S	S	*	*			trans	-47.4	97.8	177.5	-86.7	-34.9	0	0	0	110.9	P193 L197	P193-N195 VanDerWaalsContact C-N 3.3Å; P193-N195 PolarHBondContact O-N 3.31Å; N195-L197 PolarHBondContact O-N 3.22Å
196	H	39.6	Very low	47.2	Very low	172 Å²	172	134.8 Å²	134.8	80%	0.796	75%	0.753	S	S	*	*			trans	-90.9	35.3	170.5	-81.5	-64	0	0	0	112	V194	V194-H196 PolarHBondContact O-CD2 3.08Å; V194-H196 PolarHBondContact O-N 3.12Å
197	L	34.4	Very low	45.1	Very low	156 Å²	156	137.2 Å²	137.2	82%	0.817	77%	0.772	S	S	*	*			trans	-121.8	49.6	175	-74.9	174.8	0	0	0	112.3	N195	N195-L197 PolarHBondContact O-N 3.22Å
198	L	35.2	Very low	42.7	Very low	173 Å²	173	144.2 Å²	144.2	91%	0.906	79%	0.786	S	S	*	*	S	Bend	trans	-156.7	95.3	149.1	-75.3	-174.8	0	0	0	109
199	S	28.4	Very low	40.5	Very low	92 Å²	92	146.2 Å²	146.2	64%	0.643	81%	0.807	S	S	*	*			trans	158.4	96.5	136.9	-168.7	0	0	0	0	109.9	T201	S199-T201 PolarHBondContact O-N 3.36Å; S199-T201 PolarHBondContact OG-O 2.89Å
200	A	36	Very low	38.4	Very low	97 Å²	97	143.8 Å²	143.8	80%	0.802	81%	0.809	S	S	*	*	S	Bend	trans	-57.6	125.5	144.3	0	0	0	0	0	106.4
201	T	31.8	Very low	36.7	Very low	121 Å²	121	140.9 Å²	140.9	74%	0.742	80%	0.801	S	S	*	*	S	Bend	trans	93.9	128.5	-176.3	74.7	0	0	0	0	116.4	S199	S199-T201 PolarHBondContact O-N 3.36Å; S199-T201 PolarHBondContact OG-O 2.89Å
202	S	30.3	Very low	35.6	Very low	120 Å²	120	142.3 Å²	142.3	84%	0.839	81%	0.813	S	S	*	*			trans	92.7	106.3	164.2	-151.1	0	0	0	0	118.1	R204	S202-R204 PolarHBondContact O-N 3.38Å
203	N	37.3	Very low	35.2	Very low	156 Å²	156	145.8 Å²	145.8	83%	0.834	82%	0.819	S	S	*	*			trans	-50.4	119.2	160.5	-70.7	-35.4	0	0	0	111.7
204	R	32.9	Very low	34.6	Very low	240 Å²	240	144.4 Å²	144.4	91%	0.906	82%	0.823	S	S	*	*			trans	178.4	116	139.4	-104.2	168.3	-179.9	-173.8	0.3	111.4	S202	S202-R204 PolarHBondContact O-N 3.38Å
205	A	31.1	Very low	34.3	Very low	100 Å²	100	143.7 Å²	143.7	83%	0.826	83%	0.83	S	S	*	*			trans	-70.5	132	168.1	0	0	0	0	0	110.4
206	L	35.1	Very low	34.4	Very low	171 Å²	171	142 Å²	142	90%	0.895	84%	0.835	S	S	*	*			trans	-110.3	104.7	167.9	-77.8	167.1	0	0	0	108
207	S	38.6	Very low	34.1	Very low	120 Å²	120	137.3 Å²	137.3	84%	0.839	83%	0.834	S	S	*	*			trans	-84.5	122.8	170.1	-61.7	0	0	0	0	110	A209	S207-A209 PolarHBondContact O-N 2.78Å
208	R	35.5	Very low	34.3	Very low	254 Å²	254	134.9 Å²	134.9	96%	0.958	84%	0.836	S	S	*	*			trans	-77.7	115.5	169.1	-95.1	178.4	169.1	172.3	-3.4	109.2
209	A	35.9	Very low	34.9	Very low	102 Å²	102	133 Å²	133	84%	0.843	83%	0.834	S	S	*	*			trans	-85.1	133.9	170.4	0	0	0	0	0	110.3	S207	S207-A209 PolarHBondContact O-N 2.78Å
210	A	31.4	Very low	35.1	Very low	101 Å²	101	132.3 Å²	132.3	84%	0.835	84%	0.843	S	S	*	*			trans	-121.5	103.1	161.9	0	0	0	0	0	110.2
211	S	34	Very low	35.2	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	85%	0.845	S	S	*	*			trans	67.5	115.7	137.6	-143.6	0	0	0	0	120.3
212	L	33.2	Very low	36	Very low	177 Å²	177	133.4 Å²	133.4	93%	0.927	85%	0.846	S	S	*	*				-150.9	138.1	123.6	-95.7	171.6	0	0	0	109.6
213	R	37.7	Very low	36.3	Very low	241 Å²	241	133.5 Å²	133.5	91%	0.909	85%	0.847	S	S	*	*			trans	-76.3	151.6	-169.4	-56.3	175.4	-144.9	-150.1	2	112.5
214	G	31.5	Very low	36.9	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	84%	0.843	S	S	*	*			trans	167.2	94.9	157.6	0	0	0	0	0	116.3
215	A	36	Very low	37.8	Very low	101 Å²	101	124.4 Å²	124.4	84%	0.835	84%	0.835	S	S	*	*			trans	60.7	119.7	147.7	0	0	0	0	0	122.7
216	A	36.5	Very low	38.7	Very low	109 Å²	109	124.9 Å²	124.9	90%	0.901	83%	0.83	S	S	*	*			trans	62	117.3	138.1	0	0	0	0	0	122
217	G	34.1	Very low	39.6	Very low	75 Å²	75	121.7 Å²	121.7	77%	0.773	82%	0.819	S	S	*	*			trans	108.1	96.8	133.4	0	0	0	0	0	119.3
218	A	38.9	Very low	40.5	Very low	104 Å²	104	121.9 Å²	121.9	86%	0.86	82%	0.816	S	S	*	*			trans	59.6	158.5	140.5	0	0	0	0	0	121.5
219	P	46	Very low	41.4	Very low	133 Å²	133	119.9 Å²	119.9	86%	0.864	81%	0.808	S	S	*	*			trans	-102.4	148.3	-147	38	-32.1	0	0	0	115.4
220	G	33.4	Very low	42.4	Very low	79 Å²	79	124.3 Å²	124.3	81%	0.814	81%	0.809	S	S	*	*			trans	170.5	100	167.3	0	0	0	0	0	112.5
221	S	37.9	Very low	43.7	Very low	121 Å²	121	127.8 Å²	127.8	85%	0.846	81%	0.805	S	S	*	*			trans	-85.5	158.7	159.8	-77.4	0	0	0	0	109
222	P	48.6	Very low	45.5	Very low	120 Å²	120	129.2 Å²	129.2	78%	0.779	81%	0.81	S	S	*	*			cis	-134.9	138	26.7	36.5	-17.3	0	0	0	114.6
223	S	37.9	Very low	47.6	Very low	122 Å²	122	126.9 Å²	126.9	85%	0.853	79%	0.794	S	S	*	*			trans	-146.6	111.3	160.9	-56.7	0	0	0	0	107.3
224	A	49.1	Very low	49.7	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-51.8	141.3	176.2	0	0	0	0	0	110
225	P	51.2	Low	52.3	Low	115 Å²	115	129.3 Å²	129.3	75%	0.747	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-56.6	138.5	171.8	23.4	-30.3	0	0	0	108.4
226	P	51	Low	54.8	Low	109 Å²	109	127.4 Å²	127.4	71%	0.708	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-54.6	138.9	175.8	22.9	-31.1	0	0	0	108.2	T228	P226-T228 PolarHBondContact O-N 2.78Å
227	P	53	Low	57.5	Low	104 Å²	104	124.8 Å²	124.8	68%	0.675	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-55.9	120.4	176.8	22.4	-31.1	0	0	0	107.6	R229	P227-R229 VanDerWaalsContact C-N 3.35Å; P227-R229 WeakPolarHBondContact O-CG 3.31Å; P227-R229 PolarHBondContact O-N 2.72Å
228	T	58.3	Low	60.2	Low	125 Å²	125	124.1 Å²	124.1	77%	0.767	72%	0.72	S	S	*	*			trans	-58.8	99.2	173.2	26.5	0	0	0	0	107.2	P226 F230	P226-T228 PolarHBondContact O-N 2.78Å; T228-F230 PolarHBondContact O-N 3.35Å
229	R	54.8	Low	62.8	Low	211 Å²	211	122 Å²	122	80%	0.796	69%	0.692	S	S	*	*	S	Bend	trans	-68.7	-4.5	-166.1	-76	-172.3	-177.7	179.9	0.1	114.8	P227	P227-R229 VanDerWaalsContact C-N 3.35Å; P227-R229 WeakPolarHBondContact O-CG 3.31Å; P227-R229 PolarHBondContact O-N 2.72Å
230	F	57.3	Low	65.2	Low	196 Å²	196	118.6 Å²	118.6	86%	0.86	67%	0.671	S	S	*	*			trans	-148.4	72.5	-175.8	-55	-76.1	0	0	0	111.2	T228	T228-F230 PolarHBondContact O-N 3.35Å
231	F	57.7	Low	68.1	Low	173 Å²	173	116.3 Å²	116.3	76%	0.759	64%	0.64	S	S	*	*			trans	-117.4	91.5	164.8	-157.1	-87.4	0	0	0	108.9
232	T	71.9	Confident	71	Confident	135 Å²	135	110.6 Å²	110.6	83%	0.828	60%	0.6	S	S	*	*			trans	-126.4	105.3	168.6	51.5	0	0	0	0	107.1
233	E	76.7	Confident	73.4	Confident	128 Å²	128	106.5 Å²	106.5	60%	0.598	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-71.7	129.5	172.2	-170.5	166.6	-153.7	0	0	109	T187	T187-E233 WeakPolarHBondContact CB-OE1 3.34Å; T187-E233 PolarHBondContact OG1-OE1 3.08Å
234	K	83	Confident	76.2	Confident	182 Å²	182	101.8 Å²	101.8	79%	0.791	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-79	127.9	-179.1	-175.8	-179.8	177	-175	0	108.6	V236	K234-V236 PolarHBondContact O-N 3.38Å
235	K	84.4	Confident	78.6	Confident	184 Å²	184	97.8 Å²	97.8	80%	0.8	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-66.6	125.1	169.9	-66.3	-173.7	178	-175.8	0	109.7
236	V	90.2	Very high	80.9	Confident	61 Å²	61	92.3 Å²	92.3	37%	0.37	47%	0.473	S	S	.	.			trans	-104.4	125.7	176.5	-179.7	0	0	0	0	108.4	P185 K234 L241	P185-V236 HydrophobicContact CG-CB 4.11Å; P185-V236 HydrophobicContact CG-CG1 4.12Å; K234-V236 PolarHBondContact O-N 3.38Å; V236-L241 HydrophobicContact CG1-CD2 4.11Å; V236-L241 HydrophobicContact CG1-CG 4.39Å
237	S	91.6	Very high	83.1	Confident	53 Å²	53	90.5 Å²	90.5	37%	0.371	46%	0.456	S	S	.	.			trans	-84.8	154.3	179	76.5	0	0	0	0	111.3	E239 S240 L241	S237-E239 PolarHBondContact O-N 2.81Å; S237-S240 WeakPolarHBondContact O-CB 3.35Å; S237-S240 PolarHBondContact O-N 2.75Å; S237-S240 VanDerWaalsContact O-N 3.08Å; S237-S240 PolarHBondContact OG-N 2.83Å; S237-S240 PolarHBondContact OG-OG 3.31Å; S237-L241 PolarHBondContact O-N 2.76Å
238	Q	91.1	Very high	85.3	Confident	62 Å²	62	88.7 Å²	88.7	29%	0.29	44%	0.44	S	S	.	.	H	α-helix	trans	-55.6	-37.9	170.4	-74.5	175.3	-20.3	0	0	111.8	I177 L178 S240 L241 V242	I177-Q238 HydrophobicContact CG2-CG 4.31Å; I177-Q238 PolarHBondContact O-NE2 2.92Å; L178-Q238 HydrophobicContact CD2-CB 3.84Å; L178-Q238 HydrophobicContact CD2-CG 4.18Å; Q238-S240 VanDerWaalsContact C-N 3.32Å; Q238-S240 PolarHBondContact O-N 2.77Å; Q238-L241 WeakPolarHBondContact O-CB 3.29Å; Q238-L241 PolarHBondContact O-N 3.41Å; Q238-L241 VanDerWaalsContact O-N 3.1Å; Q238-V242 PolarHBondContact O-N 2.83Å; Q238-V242 VanDerWaalsContact O-N 3.12Å
239	E	94.3	Very high	87.3	Confident	60 Å²	60	82.7 Å²	82.7	28%	0.28	40%	0.403	S	S	.	.	H	α-helix	trans	-59.7	-41.9	175.8	-175.6	179.1	101.3	0	0	112	S237 L241 V242 I243 K281 Y283 V419	S237-E239 PolarHBondContact O-N 2.81Å; E239-L241 VanDerWaalsContact C-N 3.26Å; E239-L241 PolarHBondContact O-N 3.46Å; E239-V242 PolarHBondContact O-N 2.88Å; E239-I243 HydrophobicContact CG-CD1 4.16Å; E239-I243 WeakPolarHBondContact O-CG1 3.41Å; E239-I243 PolarHBondContact O-N 3.24Å; E239-K281 IonicContact OE2-NZ 2.68Å; E239-K281 PolarHBondContact OE2-NZ 3.04Å; E239-Y283 HydrophobicContact CG-CE1 3.86Å; E239-V419 HydrophobicContact CG-CB 4.47Å; E239-V419 HydrophobicContact CG-CG1 4.21Å; E239-V419 HydrophobicContact CG-CG2 3.9Å
240	S	95.7	Very high	89.4	Confident	60 Å²	60	72.7 Å²	72.7	42%	0.42	37%	0.366	S	S	.	.	H	α-helix	trans	-64.5	-30.6	176.2	-53.9	0	0	0	0	112.6	S237 Q238 G244	S237-S240 WeakPolarHBondContact O-CB 3.35Å; S237-S240 PolarHBondContact O-N 2.75Å; S237-S240 VanDerWaalsContact O-N 3.08Å; S237-S240 PolarHBondContact OG-N 2.83Å; S237-S240 PolarHBondContact OG-OG 3.31Å; Q238-S240 VanDerWaalsContact C-N 3.32Å; Q238-S240 PolarHBondContact O-N 2.77Å; S240-G244 PolarHBondContact O-N 2.99Å
241	L	95.8	Very high	91.3	Very high	31 Å²	31	67.1 Å²	67.1	16%	0.162	34%	0.341	C	S	.	.	H	α-helix	trans	-68.5	-43.2	173.4	-64.1	179.1	0	0	0	111.6	V174 I177 P185 V236 S237 Q238 E239 I243 G244 A245	V174-L241 HydrophobicContact CB-CB 4.35Å; V174-L241 HydrophobicContact CB-CD1 4.2Å; V174-L241 HydrophobicContact CG1-CB 4.27Å; V174-L241 HydrophobicContact CG1-CD1 4.27Å; V174-L241 HydrophobicContact CG1-CD2 4.34Å; V174-L241 HydrophobicContact CG2-CB 4.38Å; I177-L241 HydrophobicContact CB-CD1 4.18Å; I177-L241 HydrophobicContact CD1-CD1 3.97Å; I177-L241 HydrophobicContact CG2-CD1 3.8Å; P185-L241 HydrophobicContact CB-CD1 4.09Å; P185-L241 HydrophobicContact CB-CD2 4.35Å; P185-L241 HydrophobicContact CG-CD1 3.67Å; P185-L241 HydrophobicContact CG-CD2 4.34Å; P185-L241 HydrophobicContact CG-CG 4.19Å; V236-L241 HydrophobicContact CG1-CD2 4.11Å; V236-L241 HydrophobicContact CG1-CG 4.39Å; S237-L241 PolarHBondContact O-N 2.76Å; Q238-L241 WeakPolarHBondContact O-CB 3.29Å; Q238-L241 PolarHBondContact O-N 3.41Å; Q238-L241 VanDerWaalsContact O-N 3.1Å; E239-L241 VanDerWaalsContact C-N 3.26Å; E239-L241 PolarHBondContact O-N 3.46Å; L241-I243 VanDerWaalsContact C-N 3.35Å; L241-G244 PolarHBondContact O-N 3.31Å; L241-A245 WeakPolarHBondContact O-CB 3.36Å; L241-A245 PolarHBondContact O-N 2.83Å
242	V	97.4	Very high	93.3	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-62.9	-42.8	176.2	176.9	0	0	0	0	110.9	L171 L178 Q238 E239 A245 I246 L278 Y283	L171-V242 HydrophobicContact CD2-CB 4.39Å; L171-V242 HydrophobicContact CD2-CG1 4.1Å; L171-V242 HydrophobicContact CD2-CG2 4.13Å; L178-V242 HydrophobicContact CD1-CG2 4Å; L178-V242 HydrophobicContact CD2-CG2 3.87Å; Q238-V242 PolarHBondContact O-N 2.83Å; Q238-V242 VanDerWaalsContact O-N 3.12Å; E239-V242 PolarHBondContact O-N 2.88Å; V242-A245 WeakPolarHBondContact O-CB 3.46Å; V242-A245 PolarHBondContact O-N 3.22Å; V242-I246 HydrophobicContact CG1-CD1 4.09Å; V242-I246 WeakPolarHBondContact O-CG1 3.38Å; V242-I246 PolarHBondContact O-N 2.97Å; V242-L278 HydrophobicContact CG1-CD2 4.15Å; V242-L278 HydrophobicContact CG2-CD2 3.86Å; V242-Y283 HydrophobicContact CB-CD1 4.23Å; V242-Y283 HydrophobicContact CB-CE1 3.63Å; V242-Y283 HydrophobicContact CB-CE2 4.45Å; V242-Y283 HydrophobicContact CG1-CD1 3.59Å; V242-Y283 HydrophobicContact CG1-CD2 3.92Å; V242-Y283 HydrophobicContact CG1-CE1 3.41Å; V242-Y283 VanDerWaalsContact CG1-CE1 3.41Å; V242-Y283 HydrophobicContact CG1-CE2 3.77Å; V242-Y283 HydrophobicContact CG1-CG 3.84Å; V242-Y283 HydrophobicContact CG2-CE1 4.42Å
243	I	98.5	Very high	94.6	Very high	34 Å²	34	55.7 Å²	55.7	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-49.2	174.5	-67.7	165.8	0	0	0	110.3	E239 L241 A245 I246 E247 Y283 V417 V419	E239-I243 HydrophobicContact CG-CD1 4.16Å; E239-I243 WeakPolarHBondContact O-CG1 3.41Å; E239-I243 PolarHBondContact O-N 3.24Å; L241-I243 VanDerWaalsContact C-N 3.35Å; I243-A245 VanDerWaalsContact C-N 3.31Å; I243-A245 PolarHBondContact O-N 2.73Å; I243-I246 PolarHBondContact O-N 2.6Å; I243-E247 HydrophobicContact CG2-CG 4.35Å; I243-E247 WeakPolarHBondContact O-CG 3.34Å; I243-E247 PolarHBondContact O-N 2.87Å; I243-Y283 HydrophobicContact CG1-CD1 4.35Å; I243-Y283 HydrophobicContact CG1-CE1 4.47Å; I243-V417 HydrophobicContact CG1-CB 4.32Å; I243-V417 HydrophobicContact CG1-CG1 3.99Å; I243-V417 HydrophobicContact CG2-CB 4.08Å; I243-V417 HydrophobicContact CG2-CG2 4.26Å; I243-V419 HydrophobicContact CD1-CG2 4Å; I243-V419 HydrophobicContact CG1-CG2 4.27Å
244	G	98.3	Very high	95.6	Very high	22 Å²	22	50.2 Å²	50.2	23%	0.227	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-37.1	178	0	0	0	0	0	113.4	S240 L241 E247 N248	S240-G244 PolarHBondContact O-N 2.99Å; L241-G244 PolarHBondContact O-N 3.31Å; G244-E247 PolarHBondContact O-N 2.86Å; G244-N248 WeakPolarHBondContact O-CB 3.23Å; G244-N248 PolarHBondContact O-N 2.81Å; G244-N248 PolarHBondContact O-ND2 3.16Å
245	A	98.5	Very high	96.4	Very high	6 Å²	6	44 Å²	44	5%	0.05	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-43.8	174.6	0	0	0	0	0	111.9	H170 L171 L241 V242 I243 A249	H170-A245 HydrophobicContact CB-CB 3.58Å; L171-A245 HydrophobicContact CD2-CB 3.93Å; L171-A245 HydrophobicContact CG-CB 4.34Å; L241-A245 WeakPolarHBondContact O-CB 3.36Å; L241-A245 PolarHBondContact O-N 2.83Å; V242-A245 WeakPolarHBondContact O-CB 3.46Å; V242-A245 PolarHBondContact O-N 3.22Å; I243-A245 VanDerWaalsContact C-N 3.31Å; I243-A245 PolarHBondContact O-N 2.73Å; A245-A249 WeakPolarHBondContact O-CB 3.23Å; A245-A249 PolarHBondContact O-N 2.77Å
246	I	98.8	Very high	97.1	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-47.6	175.9	-66.4	164.8	0	0	0	110.7	I167 V242 I243 N248 A249 F250 M274 Y283 P415 V417	I167-I246 HydrophobicContact CG2-CG1 4.4Å; V242-I246 HydrophobicContact CG1-CD1 4.09Å; V242-I246 WeakPolarHBondContact O-CG1 3.38Å; V242-I246 PolarHBondContact O-N 2.97Å; I243-I246 PolarHBondContact O-N 2.6Å; I246-N248 VanDerWaalsContact C-N 3.32Å; I246-N248 PolarHBondContact O-N 2.94Å; I246-A249 WeakPolarHBondContact O-CB 3.43Å; I246-A249 PolarHBondContact O-N 2.95Å; I246-F250 HydrophobicContact CG2-CD2 4.06Å; I246-F250 HydrophobicContact CG2-CE2 3.85Å; I246-F250 VanDerWaalsContact O-CD2 3.28Å; I246-F250 WeakPolarHBondContact O-CD2 3.42Å; I246-F250 PolarHBondContact O-N 3.45Å; I246-M274 HydrophobicContact CB-CE 4.37Å; I246-M274 HydrophobicContact CD1-CE 3.74Å; I246-M274 HydrophobicContact CD1-SD 4.42Å; I246-M274 HydrophobicContact CG1-CE 3.71Å; I246-M274 HydrophobicContact CG2-CE 3.74Å; I246-M274 HydrophobicContact CG2-SD 4.17Å; I246-Y283 HydrophobicContact CD1-CD1 4.41Å; I246-Y283 HydrophobicContact CD1-CG 4.24Å; I246-P415 HydrophobicContact CG2-CG 4.35Å; I246-V417 HydrophobicContact CB-CG2 4.38Å; I246-V417 HydrophobicContact CD1-CG1 4.28Å; I246-V417 HydrophobicContact CG2-CG2 3.91Å
247	E	98.8	Very high	97.4	Very high	71 Å²	71	34.4 Å²	34.4	33%	0.332	19%	0.189	S	C	.	.	H	α-helix	trans	-60.5	-39.9	179.9	-72	175.6	169.7	0	0	112.6	I243 G244 K251 P415 V417	I243-E247 HydrophobicContact CG2-CG 4.35Å; I243-E247 WeakPolarHBondContact O-CG 3.34Å; I243-E247 PolarHBondContact O-N 2.87Å; G244-E247 PolarHBondContact O-N 2.86Å; E247-K251 WeakPolarHBondContact O-CG 3.44Å; E247-K251 PolarHBondContact O-N 3.14Å; E247-P415 HydrophobicContact CG-CG 4.34Å; E247-V417 HydrophobicContact CG-CG2 4.44Å
248	N	98.8	Very high	97.7	Very high	65 Å²	65	36.5 Å²	36.5	35%	0.348	19%	0.193	S	C	.	.	H	α-helix	trans	-71.5	-37.8	176	-73.2	-21.5	0	0	0	112.1	H170 G244 I246 F250 K251 D252	H170-N248 VanDerWaalsContact CE1-CB 3.48Å; H170-N248 WeakPolarHBondContact CE1-CB 3.11Å; G244-N248 WeakPolarHBondContact O-CB 3.23Å; G244-N248 PolarHBondContact O-N 2.81Å; G244-N248 PolarHBondContact O-ND2 3.16Å; I246-N248 VanDerWaalsContact C-N 3.32Å; I246-N248 PolarHBondContact O-N 2.94Å; N248-F250 VanDerWaalsContact C-N 3.28Å; N248-F250 PolarHBondContact O-N 3.41Å; N248-K251 WeakPolarHBondContact O-CB 3.41Å; N248-K251 PolarHBondContact O-N 2.8Å; N248-K251 VanDerWaalsContact O-N 3.11Å; N248-K251 PolarHBondContact OD1-NZ 2.69Å; N248-K251 VanDerWaalsContact OD1-NZ 3.13Å; N248-D252 PolarHBondContact O-N 2.98Å
249	A	98.9	Very high	98	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.7	-37.8	174.7	0	0	0	0	0	112.7	H166 I167 A245 I246 D252 M253	H166-A249 HydrophobicContact CB-CB 3.71Å; I167-A249 HydrophobicContact CB-CB 4.28Å; I167-A249 HydrophobicContact CG1-CB 3.53Å; A245-A249 WeakPolarHBondContact O-CB 3.23Å; A245-A249 PolarHBondContact O-N 2.77Å; I246-A249 WeakPolarHBondContact O-CB 3.43Å; I246-A249 PolarHBondContact O-N 2.95Å; A249-D252 PolarHBondContact O-N 3Å; A249-M253 WeakPolarHBondContact O-CB 3.43Å; A249-M253 PolarHBondContact O-N 2.98Å
250	F	98.9	Very high	98.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-41.1	174.2	-88.1	-119.6	0	0	0	112.1	L163 I246 N248 M253 D254 A272 M274 A287 F393 C413 P415	L163-F250 HydrophobicContact CD1-CD2 3.88Å; L163-F250 HydrophobicContact CD1-CE2 4.11Å; L163-F250 HydrophobicContact CD1-CG 4.47Å; L163-F250 HydrophobicContact CD2-CD2 4.37Å; L163-F250 HydrophobicContact CD2-CE2 3.81Å; L163-F250 HydrophobicContact CD2-CZ 3.95Å; L163-F250 HydrophobicContact CG-CE2 4.45Å; I246-F250 HydrophobicContact CG2-CD2 4.06Å; I246-F250 HydrophobicContact CG2-CE2 3.85Å; I246-F250 VanDerWaalsContact O-CD2 3.28Å; I246-F250 WeakPolarHBondContact O-CD2 3.42Å; I246-F250 PolarHBondContact O-N 3.45Å; N248-F250 VanDerWaalsContact C-N 3.28Å; N248-F250 PolarHBondContact O-N 3.41Å; F250-M253 PolarHBondContact O-N 3.09Å; F250-D254 PolarHBondContact O-N 2.9Å; F250-A272 HydrophobicContact CE1-CB 3.76Å; F250-A272 HydrophobicContact CZ-CB 4.21Å; F250-M274 HydrophobicContact CE2-CG 3.82Å; F250-M274 HydrophobicContact CZ-CG 3.81Å; F250-A287 HydrophobicContact CD1-CB 4.15Å; F250-A287 HydrophobicContact CE1-CB 3.86Å; F250-F393 HydrophobicContact CB-CE1 3.89Å; F250-F393 HydrophobicContact CB-CZ 4.1Å; F250-F393 AromaticContact CD1-CE1 3.51Å; F250-F393 HydrophobicContact CD1-CE1 3.51Å; F250-F393 HydrophobicContact CD1-CE2 4.3Å; F250-F393 AromaticContact CD1-CZ 3.24Å; F250-F393 HydrophobicContact CD1-CZ 3.24Å; F250-F393 HydrophobicContact CD2-CZ 4.34Å; F250-F393 HydrophobicContact CE1-CE1 4.31Å; F250-F393 HydrophobicContact CE1-CE2 4.36Å; F250-F393 AromaticContact CE1-CZ 3.67Å; F250-F393 HydrophobicContact CE1-CZ 3.67Å; F250-F393 AromaticContact CG-CE1 3.89Å; F250-F393 HydrophobicContact CG-CE1 3.89Å; F250-F393 AromaticContact CG-CZ 3.64Å; F250-F393 HydrophobicContact CG-CZ 3.64Å; F250-F393 HydrophobicContact CZ-CZ 4.38Å; F250-F393 VanDerWaalsContact O-CE1 3.27Å; F250-F393 WeakPolarHBondContact O-CE1 3.48Å; F250-C413 VanDerWaalsContact CD1-O 3.29Å; F250-C413 WeakPolarHBondContact CD1-O 3.47Å; F250-P415 HydrophobicContact CB-CG 4.16Å; F250-P415 HydrophobicContact CD1-CB 3.83Å; F250-P415 HydrophobicContact CD1-CG 3.74Å; F250-P415 HydrophobicContact CD2-CB 4.47Å; F250-P415 HydrophobicContact CD2-CG 3.81Å; F250-P415 HydrophobicContact CE1-CB 3.68Å; F250-P415 HydrophobicContact CE1-CG 4.01Å; F250-P415 HydrophobicContact CE2-CB 4.33Å; F250-P415 HydrophobicContact CE2-CG 4.07Å; F250-P415 HydrophobicContact CG-CB 4.24Å; F250-P415 HydrophobicContact CG-CG 3.63Å; F250-P415 HydrophobicContact CZ-CB 3.94Å; F250-P415 HydrophobicContact CZ-CG 4.17Å
251	K	98.9	Very high	98	Very high	80 Å²	80	38.8 Å²	38.8	35%	0.348	19%	0.194	S	C	.	.	H	α-helix	trans	-63.1	-46	175.5	-64.6	169.3	-163.8	156.6	0	111.1	E247 N248 M253 D254 V255	E247-K251 WeakPolarHBondContact O-CG 3.44Å; E247-K251 PolarHBondContact O-N 3.14Å; N248-K251 WeakPolarHBondContact O-CB 3.41Å; N248-K251 PolarHBondContact O-N 2.8Å; N248-K251 VanDerWaalsContact O-N 3.11Å; N248-K251 PolarHBondContact OD1-NZ 2.69Å; N248-K251 VanDerWaalsContact OD1-NZ 3.13Å; K251-M253 VanDerWaalsContact C-N 3.34Å; K251-M253 PolarHBondContact O-N 3.37Å; K251-D254 PolarHBondContact O-N 2.98Å; K251-V255 WeakPolarHBondContact O-CB 3.04Å; K251-V255 VanDerWaalsContact O-CG2 3.27Å; K251-V255 WeakPolarHBondContact O-CG2 3.05Å; K251-V255 PolarHBondContact O-N 3.38Å
252	D	98.9	Very high	97.6	Very high	68 Å²	68	40.9 Å²	40.9	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-65.7	-38	-179.7	-72.9	-17.9	0	0	0	112	H170 N248 A249 V255 Q256	H170-D252 IonicContact CD2-OD2 3.81Å; H170-D252 IonicContact CE1-OD2 2.6Å; H170-D252 PolarHBondContact CE1-OD2 3.05Å; H170-D252 IonicContact NE2-OD2 3.95Å; H170-D252 PolarHBondContact NE2-OD2 3.14Å; N248-D252 PolarHBondContact O-N 2.98Å; A249-D252 PolarHBondContact O-N 3Å; D252-V255 PolarHBondContact O-N 2.99Å; D252-Q256 VanDerWaalsContact O-CB 3.29Å; D252-Q256 WeakPolarHBondContact O-CB 3.02Å; D252-Q256 PolarHBondContact O-N 3.19Å
253	M	98.9	Very high	97.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61	-48.8	173.3	-171.9	67.3	-106.7	0	0	111.5	M158 L162 L163 A249 F250 K251 V255 Q256 I257 F393	M158-M253 HydrophobicContact CE-CE 3.83Å; M158-M253 HydrophobicContact CG-CE 3.79Å; M158-M253 HydrophobicContact SD-CE 4.23Å; L162-M253 HydrophobicContact CB-CE 4.04Å; L162-M253 HydrophobicContact CB-SD 3.7Å; L162-M253 HydrophobicContact CD1-CE 4.24Å; L163-M253 HydrophobicContact CB-CG 4.42Å; L163-M253 HydrophobicContact CB-SD 4.31Å; L163-M253 HydrophobicContact CD1-CB 3.98Å; L163-M253 HydrophobicContact CD1-CG 4.2Å; A249-M253 WeakPolarHBondContact O-CB 3.43Å; A249-M253 PolarHBondContact O-N 2.98Å; F250-M253 PolarHBondContact O-N 3.09Å; K251-M253 VanDerWaalsContact C-N 3.34Å; K251-M253 PolarHBondContact O-N 3.37Å; M253-V255 PolarHBondContact O-N 2.85Å; M253-Q256 HydrophobicContact CE-CB 4.46Å; M253-Q256 PolarHBondContact O-N 2.7Å; M253-I257 HydrophobicContact CE-CD1 3.93Å; M253-I257 HydrophobicContact CE-CG1 3.73Å; M253-I257 HydrophobicContact CG-CD1 4.36Å; M253-I257 WeakPolarHBondContact O-CG1 3.43Å; M253-I257 PolarHBondContact O-N 3.4Å; M253-F393 HydrophobicContact CB-CE1 4.24Å; M253-F393 HydrophobicContact CB-CZ 4.2Å; M253-F393 HydrophobicContact CG-CD2 4.41Å; M253-F393 HydrophobicContact CG-CE1 4.44Å; M253-F393 HydrophobicContact CG-CE2 4.14Å; M253-F393 HydrophobicContact CG-CZ 4.14Å
254	D	98.8	Very high	97.2	Very high	12 Å²	12	45.3 Å²	45.3	6%	0.064	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-41.3	179.2	-167.5	52.4	0	0	0	112.2	F250 K251 Q256 I257 E258 F393 G394 H396 K408 C413	F250-D254 PolarHBondContact O-N 2.9Å; K251-D254 PolarHBondContact O-N 2.98Å; D254-Q256 VanDerWaalsContact C-N 3.33Å; D254-I257 PolarHBondContact O-N 3.14Å; D254-E258 PolarHBondContact O-N 3.13Å; D254-F393 HydrophobicContact CB-CD1 3.92Å; D254-F393 WeakPolarHBondContact OD1-CA 3.23Å; D254-G394 PolarHBondContact OD1-N 3.28Å; D254-H396 PolarHBondContact O-NE2 3.46Å; D254-H396 IonicContact OD1-CE1 3.43Å; D254-H396 IonicContact OD1-NE2 2.68Å; D254-H396 PolarHBondContact OD1-NE2 2.93Å; D254-H396 VanDerWaalsContact OD1-NE2 3.09Å; D254-H396 IonicContact OD2-CE1 3.32Å; D254-H396 PolarHBondContact OD2-CE1 3.36Å; D254-H396 IonicContact OD2-NE2 3.47Å; D254-K408 VanDerWaalsContact CG-NZ 3.29Å; D254-K408 IonicContact OD1-NZ 2.71Å; D254-K408 PolarHBondContact OD1-NZ 3.46Å; D254-K408 VanDerWaalsContact OD1-NZ 3.12Å; D254-K408 IonicContact OD2-NZ 3.35Å; D254-K408 PolarHBondContact OD2-NZ 2.93Å; D254-C413 HydrophobicContact CB-CB 3.56Å
255	V	98.6	Very high	96.9	Very high	53 Å²	53	48.3 Å²	48.3	32%	0.321	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-38.4	174.8	167.6	0	0	0	0	111	K251 D252 M253 E258 K259	K251-V255 WeakPolarHBondContact O-CB 3.04Å; K251-V255 VanDerWaalsContact O-CG2 3.27Å; K251-V255 WeakPolarHBondContact O-CG2 3.05Å; K251-V255 PolarHBondContact O-N 3.38Å; D252-V255 PolarHBondContact O-N 2.99Å; M253-V255 PolarHBondContact O-N 2.85Å; V255-E258 PolarHBondContact O-N 3.36Å; V255-K259 HydrophobicContact CG1-CD 3.93Å; V255-K259 VanDerWaalsContact CG1-CE 3.44Å; V255-K259 HydrophobicContact CG1-CG 4.44Å; V255-K259 WeakPolarHBondContact O-CB 3.41Å; V255-K259 VanDerWaalsContact O-CG 3.32Å; V255-K259 WeakPolarHBondContact O-CG 3.47Å; V255-K259 PolarHBondContact O-N 2.87Å
256	Q	98.4	Very high	96.7	Very high	40 Å²	40	49.2 Å²	49.2	19%	0.187	26%	0.257	C	S	.	.	H	α-helix	trans	-66.7	-42.6	176.7	-167.2	-178.2	1.9	0	0	111.2	M158 H166 D252 M253 D254 E258 K259 E260	M158-Q256 HydrophobicContact CE-CB 4.2Å; M158-Q256 HydrophobicContact CE-CG 3.6Å; H166-Q256 PolarHBondContact CE1-OE1 3.01Å; H166-Q256 VanDerWaalsContact CE1-OE1 3.29Å; H166-Q256 PolarHBondContact NE2-OE1 3.06Å; D252-Q256 VanDerWaalsContact O-CB 3.29Å; D252-Q256 WeakPolarHBondContact O-CB 3.02Å; D252-Q256 PolarHBondContact O-N 3.19Å; M253-Q256 HydrophobicContact CE-CB 4.46Å; M253-Q256 PolarHBondContact O-N 2.7Å; D254-Q256 VanDerWaalsContact C-N 3.33Å; Q256-E258 VanDerWaalsContact C-N 3.3Å; Q256-E258 PolarHBondContact O-N 3.35Å; Q256-K259 PolarHBondContact O-N 2.87Å; Q256-E260 HydrophobicContact CG-CG 4.18Å; Q256-E260 WeakPolarHBondContact CG-OE1 3.32Å; Q256-E260 PolarHBondContact NE2-OE1 2.98Å; Q256-E260 VanDerWaalsContact O-CB 3.3Å; Q256-E260 WeakPolarHBondContact O-CB 3.02Å; Q256-E260 WeakPolarHBondContact O-CG 3.44Å; Q256-E260 PolarHBondContact O-N 2.94Å
257	I	98.4	Very high	96.5	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.015	27%	0.271	C	S	.	.	H	α-helix	trans	-56.5	-46.2	172.6	-73	163.2	0	0	0	110.2	M158 M253 D254 K259 E260 K261 I266 F393	M158-I257 HydrophobicContact CE-CG1 4.28Å; M158-I257 HydrophobicContact CG-CG1 4.3Å; M158-I257 HydrophobicContact SD-CB 4.46Å; M158-I257 HydrophobicContact SD-CG1 3.65Å; M253-I257 HydrophobicContact CE-CD1 3.93Å; M253-I257 HydrophobicContact CE-CG1 3.73Å; M253-I257 HydrophobicContact CG-CD1 4.36Å; M253-I257 WeakPolarHBondContact O-CG1 3.43Å; M253-I257 PolarHBondContact O-N 3.4Å; D254-I257 PolarHBondContact O-N 3.14Å; I257-K259 PolarHBondContact O-N 2.91Å; I257-E260 PolarHBondContact O-N 3.03Å; I257-K261 WeakPolarHBondContact O-CB 3.17Å; I257-K261 PolarHBondContact O-N 2.92Å; I257-K261 VanDerWaalsContact O-N 3.07Å; I257-I266 HydrophobicContact CG2-CG2 4.09Å; I257-F393 HydrophobicContact CD1-CB 3.74Å; I257-F393 HydrophobicContact CD1-CG 4.31Å
258	E	97.5	Very high	96.3	Very high	97 Å²	97	48.8 Å²	48.8	45%	0.453	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-48	178.1	-166	179.1	-169	0	0	112.8	D254 V255 Q256 K261 H396	D254-E258 PolarHBondContact O-N 3.13Å; V255-E258 PolarHBondContact O-N 3.36Å; Q256-E258 VanDerWaalsContact C-N 3.3Å; Q256-E258 PolarHBondContact O-N 3.35Å; E258-K261 WeakPolarHBondContact O-CG 3.41Å; E258-H396 HydrophobicContact CG-CB 4.11Å; E258-H396 IonicContact OE1-ND1 2.88Å; E258-H396 IonicContact OE2-CE1 2.91Å; E258-H396 IonicContact OE2-ND1 3.94Å
259	K	96.9	Very high	96.3	Very high	147 Å²	147	45.7 Å²	45.7	64%	0.639	25%	0.248	S	C	*	.	H	α-helix	trans	-66.4	-42.2	-177.3	-74.9	172	179.7	170.7	0	111.6	V255 Q256 I257	V255-K259 HydrophobicContact CG1-CD 3.93Å; V255-K259 VanDerWaalsContact CG1-CE 3.44Å; V255-K259 HydrophobicContact CG1-CG 4.44Å; V255-K259 WeakPolarHBondContact O-CB 3.41Å; V255-K259 VanDerWaalsContact O-CG 3.32Å; V255-K259 WeakPolarHBondContact O-CG 3.47Å; V255-K259 PolarHBondContact O-N 2.87Å; Q256-K259 PolarHBondContact O-N 2.87Å; I257-K259 PolarHBondContact O-N 2.91Å
260	E	96.7	Very high	96.3	Very high	35 Å²	35	45.7 Å²	45.7	16%	0.164	25%	0.248	C	C	.	.	H	α-helix	trans	-83.8	-20.3	-171.4	-71.5	-170.4	-172.5	0	0	113.3	K34 M158 Q256 I257 A262 S263 F264 I266	K34-E260 WeakPolarHBondContact CD-OE2 3.42Å; K34-E260 VanDerWaalsContact CE-OE2 3.3Å; K34-E260 WeakPolarHBondContact CE-OE2 3.4Å; K34-E260 IonicContact NZ-OE1 3.96Å; K34-E260 PolarHBondContact NZ-OE1 3.27Å; K34-E260 IonicContact NZ-OE2 2.75Å; K34-E260 PolarHBondContact NZ-OE2 2.79Å; M158-E260 HydrophobicContact CE-CB 4.25Å; M158-E260 HydrophobicContact CE-CG 4.37Å; M158-E260 WeakPolarHBondContact CE-OE2 3.48Å; Q256-E260 HydrophobicContact CG-CG 4.18Å; Q256-E260 WeakPolarHBondContact CG-OE1 3.32Å; Q256-E260 PolarHBondContact NE2-OE1 2.98Å; Q256-E260 VanDerWaalsContact O-CB 3.3Å; Q256-E260 WeakPolarHBondContact O-CB 3.02Å; Q256-E260 WeakPolarHBondContact O-CG 3.44Å; Q256-E260 PolarHBondContact O-N 2.94Å; I257-E260 PolarHBondContact O-N 3.03Å; E260-A262 PolarHBondContact O-N 2.78Å; E260-A262 VanDerWaalsContact O-N 3.1Å; E260-S263 CarbonylContact O-C 3.56Å; E260-S263 PolarHBondContact O-N 3.3Å; E260-F264 HydrophobicContact CB-CD2 4.09Å; E260-F264 PolarHBondContact O-N 2.75Å; E260-I266 HydrophobicContact CB-CD1 3.76Å
261	K	92.6	Very high	96.3	Very high	47 Å²	47	45.8 Å²	45.8	20%	0.204	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.4	178.6	83.9	-173.4	-168.2	175.5	0	113.7	I257 E258 S263 F264 I266 H396 N397	I257-K261 WeakPolarHBondContact O-CB 3.17Å; I257-K261 PolarHBondContact O-N 2.92Å; I257-K261 VanDerWaalsContact O-N 3.07Å; E258-K261 WeakPolarHBondContact O-CG 3.41Å; K261-S263 VanDerWaalsContact C-N 3.31Å; K261-F264 CarbonylContact C-O 3.58Å; K261-F264 VanDerWaalsContact C-O 3.26Å; K261-F264 VanDerWaalsContact CA-O 3.3Å; K261-F264 WeakPolarHBondContact CA-O 3.48Å; K261-I266 HydrophobicContact CB-CB 4.04Å; K261-I266 HydrophobicContact CB-CD1 4.43Å; K261-H396 HydrophobicContact CD-CB 4.35Å; K261-N397 PolarHBondContact NZ-ND2 2.64Å; K261-N397 PolarHBondContact NZ-OD1 2.87Å
262	A	88.4	Confident	96.3	Very high	75 Å²	75	42 Å²	42	62%	0.62	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-22	174.8	0	0	0	0	0	112.1	E260	E260-A262 PolarHBondContact O-N 2.78Å; E260-A262 VanDerWaalsContact O-N 3.1Å
263	S	94.2	Very high	96.3	Very high	71 Å²	71	38.7 Å²	38.7	50%	0.497	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-27.1	-179.4	-58.6	0	0	0	0	112.5	E260 K261	E260-S263 CarbonylContact O-C 3.56Å; E260-S263 PolarHBondContact O-N 3.3Å; K261-S263 VanDerWaalsContact C-N 3.31Å
264	F	93.8	Very high	96.3	Very high	58 Å²	58	38.7 Å²	38.7	25%	0.254	22%	0.215	S	C	.	.	S	Bend	trans	-130.8	149.8	-177.6	-57.7	-76.8	0	0	0	110.4	P32 K34 E260 K261 I266	P32-F264 HydrophobicContact CG-CD1 4.12Å; P32-F264 HydrophobicContact CG-CE1 4.47Å; P32-F264 CarbonylContact O-C 3.26Å; P32-F264 WeakPolarHBondContact O-CA 3.3Å; P32-F264 WeakPolarHBondContact O-CB 3.39Å; K34-F264 HydrophobicContact CB-CB 4Å; K34-F264 HydrophobicContact CB-CD1 3.66Å; K34-F264 HydrophobicContact CB-CD2 3.95Å; K34-F264 HydrophobicContact CB-CE1 4.04Å; K34-F264 HydrophobicContact CB-CE2 4.31Å; K34-F264 HydrophobicContact CB-CG 3.61Å; K34-F264 HydrophobicContact CB-CZ 4.35Å; K34-F264 HydrophobicContact CD-CD2 4.09Å; K34-F264 HydrophobicContact CD-CE2 3.98Å; K34-F264 HydrophobicContact CD-CZ 4.41Å; K34-F264 HydrophobicContact CG-CD1 4.38Å; K34-F264 HydrophobicContact CG-CD2 4.31Å; K34-F264 HydrophobicContact CG-CE1 4.28Å; K34-F264 HydrophobicContact CG-CE2 4.21Å; K34-F264 HydrophobicContact CG-CG 4.39Å; K34-F264 HydrophobicContact CG-CZ 4.19Å; E260-F264 HydrophobicContact CB-CD2 4.09Å; E260-F264 PolarHBondContact O-N 2.75Å; K261-F264 CarbonylContact C-O 3.58Å; K261-F264 VanDerWaalsContact C-O 3.26Å; K261-F264 VanDerWaalsContact CA-O 3.3Å; K261-F264 WeakPolarHBondContact CA-O 3.48Å; F264-I266 HydrophobicContact CB-CD1 4.36Å; F264-I266 HydrophobicContact CB-CG1 4.13Å; F264-I266 PolarHBondContact O-N 2.82Å
265	N	90.8	Very high	96.3	Very high	86 Å²	86	38.1 Å²	38.1	46%	0.46	21%	0.212	S	C	.	.			trans	-75.2	73.8	177.1	-171.3	18.1	0	0	0	111.6	L31 P32 L33	L31-N265 HydrophobicContact CB-CB 4.17Å; P32-N265 PolarHBondContact O-N 2.85Å; L33-N265 HydrophobicContact CD2-CB 4.07Å; L33-N265 WeakPolarHBondContact CD2-O 3.25Å
266	I	94.7	Very high	96.2	Very high	25 Å²	25	35.8 Å²	35.8	13%	0.128	20%	0.198	C	C	.	.			trans	-91.4	100.9	175.6	-56.3	165.2	0	0	0	108	M158 I257 E260 K261 F264	M158-I266 HydrophobicContact CE-CD1 4.38Å; M158-I266 HydrophobicContact SD-CD1 3.39Å; M158-I266 WeakPolarHBondContact SD-CD1 3.2Å; M158-I266 HydrophobicContact SD-CG1 4.28Å; I257-I266 HydrophobicContact CG2-CG2 4.09Å; E260-I266 HydrophobicContact CB-CD1 3.76Å; K261-I266 HydrophobicContact CB-CB 4.04Å; K261-I266 HydrophobicContact CB-CD1 4.43Å; F264-I266 HydrophobicContact CB-CD1 4.36Å; F264-I266 HydrophobicContact CB-CG1 4.13Å; F264-I266 PolarHBondContact O-N 2.82Å
267	S	94	Very high	96.2	Very high	42 Å²	42	33.9 Å²	33.9	29%	0.294	19%	0.189	S	C	.	.			trans	-87.2	157	179.4	54.8	0	0	0	0	112.9	G154 A155	G154-S267 WeakPolarHBondContact CA-O 3.39Å; G154-S267 PolarHBondContact N-O 3.45Å; G154-S267 PolarHBondContact N-OG 3.01Å; A155-S267 PolarHBondContact N-O 2.9Å
268	G	95.3	Very high	96	Very high	20 Å²	20	33.9 Å²	33.9	21%	0.206	19%	0.189	C	C	.	.	S	Bend	trans	70.7	-163	165.7	0	0	0	0	0	116.6	H150 A151 D395	H150-G268 WeakPolarHBondContact O-CA 3.34Å; A151-G268 VanDerWaalsContact O-CA 3.3Å; A151-G268 WeakPolarHBondContact O-CA 3.21Å; A151-G268 PolarHBondContact O-N 3.29Å; G268-D395 PolarHBondContact O-N 2.9Å; G268-D395 VanDerWaalsContact O-N 3.09Å
269	G	98.3	Very high	95.7	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	178.4	168.3	0	0	0	0	0	110	H150 F393	H150-G269 VanDerWaalsContact CE1-C 3.44Å; H150-G269 PolarHBondContact N-O 3.18Å; H150-G269 PolarHBondContact O-N 2.93Å; G269-F393 CarbonylContact C-O 3.58Å; G269-F393 WeakPolarHBondContact CA-O 3.28Å
270	C	98.8	Very high	95.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	154.8	170.9	61.1	0	0	0	0	112	F147 D148 A155 A156 G392 F393	F147-C270 HydrophobicContact CB-CB 4.45Å; D148-C270 CarbonylContact O-C 3.56Å; D148-C270 WeakPolarHBondContact O-CA 3.35Å; D148-C270 VanDerWaalsContact O-CB 3.24Å; D148-C270 WeakPolarHBondContact O-CB 3.48Å; A155-C270 HydrophobicContact CB-CB 4.47Å; A156-C270 HydrophobicContact CB-CB 3.81Å; C270-G392 CarbonylContact O-C 3.57Å; C270-G392 WeakPolarHBondContact O-CA 3.36Å; C270-F393 PolarHBondContact N-O 2.96Å; C270-F393 PolarHBondContact O-N 3.37Å
271	T	98.8	Very high	95.4	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.012	16%	0.161	C	C	.	.			trans	-72.1	167.2	160.3	77.4	0	0	0	0	110.2	F147 D148 A287 D289 S290 V389	F147-T271 WeakPolarHBondContact CA-O 3.31Å; D148-T271 HydrophobicContact CB-CG2 3.97Å; D148-T271 WeakPolarHBondContact CB-OG1 3.25Å; D148-T271 PolarHBondContact N-OG1 3.15Å; D148-T271 VanDerWaalsContact N-OG1 3.14Å; D148-T271 PolarHBondContact O-N 3.23Å; T271-A287 CarbonylContact C-O 3.39Å; T271-A287 VanDerWaalsContact CA-O 3.29Å; T271-A287 WeakPolarHBondContact CA-O 3.46Å; T271-D289 WeakPolarHBondContact CG2-OD1 3.4Å; T271-S290 PolarHBondContact OG1-OG 2.92Å; T271-V389 HydrophobicContact CG2-CG1 4.2Å
272	A	98.8	Very high	95.6	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	116.9	173.1	0	0	0	0	0	110.9	F147 F250 N286 A287 F393	F147-A272 HydrophobicContact CD1-CB 3.77Å; F147-A272 HydrophobicContact CE1-CB 3.81Å; F250-A272 HydrophobicContact CE1-CB 3.76Å; F250-A272 HydrophobicContact CZ-CB 4.21Å; A272-N286 CarbonylContact O-C 3.51Å; A272-N286 WeakPolarHBondContact O-CA 3.3Å; A272-A287 PolarHBondContact N-O 2.95Å; A272-A287 PolarHBondContact O-N 3.04Å; A272-F393 HydrophobicContact CB-CD2 3.92Å; A272-F393 HydrophobicContact CB-CE2 3.4Å; A272-F393 HydrophobicContact CB-CZ 4.05Å
273	L	98.9	Very high	96.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	113.1	171.9	175.7	64.3	0	0	0	108.5	A145 L146 V284 G285 N286 R291 A292 L435	A145-L273 CarbonylContact C-O 3.52Å; A145-L273 WeakPolarHBondContact CA-O 3.24Å; A145-L273 WeakPolarHBondContact CB-O 3.14Å; L146-L273 PolarHBondContact N-O 2.88Å; L146-L273 PolarHBondContact O-N 3.28Å; L273-V284 HydrophobicContact CD1-CG1 3.99Å; L273-G285 WeakPolarHBondContact CA-O 3.48Å; L273-N286 HydrophobicContact CD1-CB 3.92Å; L273-R291 WeakPolarHBondContact CD2-O 3.4Å; L273-A292 HydrophobicContact CD1-CB 4.08Å; L273-A292 HydrophobicContact CD2-CB 4.11Å; L273-L435 HydrophobicContact CD2-CB 3.93Å; L273-L435 HydrophobicContact CD2-CD2 4.24Å; L273-L435 HydrophobicContact CD2-CG 3.9Å; L273-L435 HydrophobicContact CG-CD2 4.24Å; L273-L435 HydrophobicContact CG-CG 4.32Å
274	M	98.8	Very high	96.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	153.9	-179.7	66.1	76.5	93.6	0	0	112.2	Y143 W144 A145 I167 I246 F250 A276 V284 G285	Y143-M274 HydrophobicContact CE2-CB 3.82Å; Y143-M274 HydrophobicContact CE2-CE 4.11Å; Y143-M274 HydrophobicContact CE2-CG 4.49Å; W144-M274 CarbonylContact O-C 3.59Å; W144-M274 WeakPolarHBondContact O-CA 3.33Å; A145-M274 HydrophobicContact CB-CB 4.02Å; I167-M274 HydrophobicContact CD1-CE 3.36Å; I167-M274 HydrophobicContact CG1-CE 4.35Å; I246-M274 HydrophobicContact CB-CE 4.37Å; I246-M274 HydrophobicContact CD1-CE 3.74Å; I246-M274 HydrophobicContact CD1-SD 4.42Å; I246-M274 HydrophobicContact CG1-CE 3.71Å; I246-M274 HydrophobicContact CG2-CE 3.74Å; I246-M274 HydrophobicContact CG2-SD 4.17Å; F250-M274 HydrophobicContact CE2-CG 3.82Å; F250-M274 HydrophobicContact CZ-CG 3.81Å; M274-A276 HydrophobicContact CE-CB 4.1Å; M274-V284 CarbonylContact O-C 3.45Å; M274-V284 VanDerWaalsContact O-CA 3.32Å; M274-V284 WeakPolarHBondContact O-CA 3.38Å; M274-G285 PolarHBondContact N-O 2.56Å; M274-G285 PolarHBondContact O-N 3.45Å; M274-G285 PolarHBondContact SD-N 3.47Å
275	V	98.8	Very high	96.6	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124.7	171.1	179.8	0	0	0	0	107.9	Y143 W144 L282 Y283 V284 L433 L435	Y143-V275 CarbonylContact C-O 3.53Å; Y143-V275 VanDerWaalsContact CA-O 3.31Å; Y143-V275 WeakPolarHBondContact CA-O 3.45Å; W144-V275 HydrophobicContact CB-CB 4.49Å; W144-V275 HydrophobicContact CE3-CB 4.35Å; W144-V275 HydrophobicContact CE3-CG1 4.2Å; W144-V275 PolarHBondContact N-O 3.34Å; W144-V275 PolarHBondContact O-N 2.7Å; V275-L282 HydrophobicContact CG1-CD2 4.17Å; V275-Y283 CarbonylContact C-O 3.5Å; V275-Y283 VanDerWaalsContact CA-O 3.29Å; V275-Y283 WeakPolarHBondContact CA-O 3.25Å; V275-V284 HydrophobicContact CG2-CG1 4.33Å; V275-V284 HydrophobicContact CG2-CG2 4.17Å; V275-L433 HydrophobicContact CB-CD2 4.34Å; V275-L433 HydrophobicContact CG1-CD2 3.74Å; V275-L433 HydrophobicContact CG2-CD2 3.7Å; V275-L435 HydrophobicContact CG2-CD1 4Å; V275-L435 HydrophobicContact CG2-CD2 3.84Å; V275-L435 HydrophobicContact CG2-CG 4.27Å
276	A	98.1	Very high	97	Very high	3 Å²	3	11.4 Å²	11.4	3%	0.025	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.4	168	0	0	0	0	0	110	F141 H142 M274 L282 Y283	F141-A276 HydrophobicContact CD2-CB 4.26Å; H142-A276 CarbonylContact O-C 3.57Å; H142-A276 VanDerWaalsContact O-CA 3.3Å; H142-A276 WeakPolarHBondContact O-CA 3.46Å; M274-A276 HydrophobicContact CE-CB 4.1Å; A276-L282 WeakPolarHBondContact O-CA 3.33Å; A276-Y283 PolarHBondContact N-O 3.34Å; A276-Y283 PolarHBondContact O-N 3.25Å
277	C	97.3	Very high	97.2	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.007	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114	167.4	-176.5	0	0	0	0	109.8	W72 F141 H142 W144 K281 L282	W72-C277 HydrophobicContact CH2-CB 3.78Å; W72-C277 VanDerWaalsContact CH2-SG 3.5Å; W72-C277 HydrophobicContact CZ2-CB 4.24Å; F141-C277 VanDerWaalsContact CA-O 3.25Å; F141-C277 WeakPolarHBondContact CA-O 3.15Å; F141-C277 VanDerWaalsContact CB-O 3.31Å; F141-C277 WeakPolarHBondContact CB-O 3.43Å; H142-C277 HydrophobicContact CB-CB 4.18Å; H142-C277 PolarHBondContact N-O 2.89Å; H142-C277 VanDerWaalsContact N-O 3.09Å; H142-C277 PolarHBondContact O-N 2.98Å; W144-C277 HydrophobicContact CZ3-CB 4.15Å; C277-K281 WeakPolarHBondContact CA-O 3.25Å; C277-L282 HydrophobicContact CB-CD2 3.56Å
278	L	94.3	Very high	97.4	Very high	2 Å²	2	8.2 Å²	8.2	1%	0.01	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	128.1	-176.6	176.5	66.9	0	0	0	110	L139 F141 L171 L178 V242 G280 K281 Y283	L139-L278 HydrophobicContact CD1-CD1 3.61Å; L139-L278 HydrophobicContact CD2-CD1 3.79Å; L139-L278 HydrophobicContact CG-CD1 3.55Å; F141-L278 HydrophobicContact CB-CB 4.1Å; F141-L278 HydrophobicContact CB-CD1 3.93Å; L171-L278 HydrophobicContact CD1-CD2 4.25Å; L171-L278 HydrophobicContact CD2-CD2 4.12Å; L178-L278 HydrophobicContact CD1-CD2 4.41Å; V242-L278 HydrophobicContact CG1-CD2 4.15Å; V242-L278 HydrophobicContact CG2-CD2 3.86Å; L278-G280 VanDerWaalsContact C-N 3.32Å; L278-G280 PolarHBondContact O-N 2.98Å; L278-K281 PolarHBondContact N-O 3.47Å; L278-K281 PolarHBondContact O-N 3.46Å; L278-Y283 HydrophobicContact CB-CD2 4.41Å; L278-Y283 HydrophobicContact CB-CE2 4.1Å
279	Q	90.8	Very high	97.5	Very high	78 Å²	78	8.5 Å²	8.5	36%	0.364	4%	0.042	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	46.5	176.4	-62.2	-178.6	-44.4	0	0	113.8	L139 L178 K281	L139-Q279 HydrophobicContact CD1-CG 3.89Å; L178-Q279 PolarHBondContact O-NE2 3.33Å; Q279-K281 VanDerWaalsContact C-N 3.28Å; Q279-K281 PolarHBondContact O-N 3.39Å
280	G	92.1	Very high	97.5	Very high	5 Å²	5	8.5 Å²	8.5	5%	0.052	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	20.9	178.8	0	0	0	0	0	114.6	L278 L422 S423	L278-G280 VanDerWaalsContact C-N 3.32Å; L278-G280 PolarHBondContact O-N 2.98Å; G280-L422 WeakPolarHBondContact O-CB 3.42Å; G280-L422 PolarHBondContact O-N 3.11Å; G280-L422 VanDerWaalsContact O-N 3.08Å; G280-S423 PolarHBondContact O-N 3.21Å; G280-S423 PolarHBondContact O-OG 3.24Å
281	K	95.9	Very high	97.5	Very high	55 Å²	55	10.7 Å²	10.7	24%	0.239	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.2	174.3	-61.6	-178.2	-179.9	-175.3	0	110.9	E239 C277 L278 Q279 Y283 V419 Y420	E239-K281 IonicContact OE2-NZ 2.68Å; E239-K281 PolarHBondContact OE2-NZ 3.04Å; C277-K281 WeakPolarHBondContact CA-O 3.25Å; L278-K281 PolarHBondContact N-O 3.47Å; L278-K281 PolarHBondContact O-N 3.46Å; Q279-K281 VanDerWaalsContact C-N 3.28Å; Q279-K281 PolarHBondContact O-N 3.39Å; K281-Y283 HydrophobicContact CB-CD2 4.37Å; K281-Y283 HydrophobicContact CB-CE2 3.72Å; K281-V419 HydrophobicContact CB-CG1 4.1Å; K281-V419 HydrophobicContact CD-CG1 3.97Å; K281-V419 HydrophobicContact CG-CG1 4.43Å; K281-Y420 WeakPolarHBondContact CA-O 3.31Å
282	L	98	Very high	97.5	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.005	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.9	167.2	-58.2	175.4	0	0	0	109	V275 A276 C277 V419 Y420 L422 L433 L508	V275-L282 HydrophobicContact CG1-CD2 4.17Å; A276-L282 WeakPolarHBondContact O-CA 3.33Å; C277-L282 HydrophobicContact CB-CD2 3.56Å; L282-V419 CarbonylContact O-C 3.41Å; L282-V419 WeakPolarHBondContact O-CA 3.22Å; L282-Y420 HydrophobicContact CD1-CD1 4.05Å; L282-Y420 HydrophobicContact CG-CD1 4.47Å; L282-Y420 PolarHBondContact N-O 3.36Å; L282-Y420 PolarHBondContact O-N 2.99Å; L282-L422 HydrophobicContact CD1-CD1 4.02Å; L282-L422 HydrophobicContact CD1-CD2 4.41Å; L282-L422 HydrophobicContact CD2-CD2 3.9Å; L282-L422 HydrophobicContact CG-CB 4.3Å; L282-L422 HydrophobicContact CG-CD1 4.32Å; L282-L422 HydrophobicContact CG-CD2 3.97Å; L282-L422 HydrophobicContact CG-CG 4.46Å; L282-L433 HydrophobicContact CD1-CD2 4.19Å; L282-L508 HydrophobicContact CD1-CD2 3.65Å
283	Y	98.7	Very high	97.5	Very high	4 Å²	4	10.6 Å²	10.6	2%	0.016	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	113.4	172.1	-61.2	-97.5	0	0	0	107.9	E239 V242 I243 I246 V275 A276 L278 K281 V417 V419	E239-Y283 HydrophobicContact CG-CE1 3.86Å; V242-Y283 HydrophobicContact CB-CD1 4.23Å; V242-Y283 HydrophobicContact CB-CE1 3.63Å; V242-Y283 HydrophobicContact CB-CE2 4.45Å; V242-Y283 HydrophobicContact CG1-CD1 3.59Å; V242-Y283 HydrophobicContact CG1-CD2 3.92Å; V242-Y283 HydrophobicContact CG1-CE1 3.41Å; V242-Y283 VanDerWaalsContact CG1-CE1 3.41Å; V242-Y283 HydrophobicContact CG1-CE2 3.77Å; V242-Y283 HydrophobicContact CG1-CG 3.84Å; V242-Y283 HydrophobicContact CG2-CE1 4.42Å; I243-Y283 HydrophobicContact CG1-CD1 4.35Å; I243-Y283 HydrophobicContact CG1-CE1 4.47Å; I246-Y283 HydrophobicContact CD1-CD1 4.41Å; I246-Y283 HydrophobicContact CD1-CG 4.24Å; V275-Y283 CarbonylContact C-O 3.5Å; V275-Y283 VanDerWaalsContact CA-O 3.29Å; V275-Y283 WeakPolarHBondContact CA-O 3.25Å; A276-Y283 PolarHBondContact N-O 3.34Å; A276-Y283 PolarHBondContact O-N 3.25Å; L278-Y283 HydrophobicContact CB-CD2 4.41Å; L278-Y283 HydrophobicContact CB-CE2 4.1Å; K281-Y283 HydrophobicContact CB-CD2 4.37Å; K281-Y283 HydrophobicContact CB-CE2 3.72Å; Y283-V417 HydrophobicContact CD1-CG1 4.46Å; Y283-V419 HydrophobicContact CD1-CG1 4.29Å; Y283-V419 HydrophobicContact CD1-CG2 3.64Å; Y283-V419 HydrophobicContact CE1-CG1 4.11Å; Y283-V419 HydrophobicContact CE1-CG2 3.83Å
284	V	98.9	Very high	97.5	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.006	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	105.9	-178.2	-173.5	0	0	0	0	108.6	L273 M274 V275 A292 M303 V417 R418	L273-V284 HydrophobicContact CD1-CG1 3.99Å; M274-V284 CarbonylContact O-C 3.45Å; M274-V284 VanDerWaalsContact O-CA 3.32Å; M274-V284 WeakPolarHBondContact O-CA 3.38Å; V275-V284 HydrophobicContact CG2-CG1 4.33Å; V275-V284 HydrophobicContact CG2-CG2 4.17Å; V284-A292 HydrophobicContact CG1-CB 3.95Å; V284-M303 HydrophobicContact CB-CB 4.35Å; V284-M303 HydrophobicContact CB-CE 4.25Å; V284-M303 HydrophobicContact CG1-CB 4.22Å; V284-M303 WeakPolarHBondContact CG1-O 3.38Å; V284-M303 HydrophobicContact CG2-CB 4.11Å; V284-M303 HydrophobicContact CG2-CE 3.71Å; V284-V417 CarbonylContact O-C 3.5Å; V284-V417 WeakPolarHBondContact O-CA 3.25Å; V284-R418 PolarHBondContact N-O 3.05Å; V284-R418 PolarHBondContact O-N 2.97Å
285	G	98.8	Very high	97.5	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.3	179	0	0	0	0	0	111.1	L273 M274 E416	L273-G285 WeakPolarHBondContact CA-O 3.48Å; M274-G285 PolarHBondContact N-O 2.56Å; M274-G285 PolarHBondContact O-N 3.45Å; M274-G285 PolarHBondContact SD-N 3.47Å; G285-E416 CarbonylContact C-O 3.45Å; G285-E416 WeakPolarHBondContact CA-O 3.43Å
286	N	98.9	Very high	97.3	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.005	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.7	178.5	-167.9	36	0	0	0	113	A272 L273 G288 S290 S305 F307 P415 E416	A272-N286 CarbonylContact O-C 3.51Å; A272-N286 WeakPolarHBondContact O-CA 3.3Å; L273-N286 HydrophobicContact CD1-CB 3.92Å; N286-G288 PolarHBondContact ND2-O 3.03Å; N286-S290 PolarHBondContact ND2-O 2.86Å; N286-S290 PolarHBondContact OD1-O 3.01Å; N286-S305 PolarHBondContact ND2-O 2.95Å; N286-F307 HydrophobicContact CB-CE2 4.29Å; N286-F307 VanDerWaalsContact O-CE2 3.3Å; N286-F307 WeakPolarHBondContact O-CE2 3.37Å; N286-P415 CarbonylContact O-C 3.52Å; N286-P415 VanDerWaalsContact O-CA 3.22Å; N286-P415 WeakPolarHBondContact O-CA 3.22Å; N286-E416 PolarHBondContact N-O 3.48Å; N286-E416 PolarHBondContact O-N 3.46Å
287	A	98.8	Very high	97	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	92.3	169.5	0	0	0	0	0	109.4	F250 T271 A272 R391 P415	F250-A287 HydrophobicContact CD1-CB 4.15Å; F250-A287 HydrophobicContact CE1-CB 3.86Å; T271-A287 CarbonylContact C-O 3.39Å; T271-A287 VanDerWaalsContact CA-O 3.29Å; T271-A287 WeakPolarHBondContact CA-O 3.46Å; A272-A287 PolarHBondContact N-O 2.95Å; A272-A287 PolarHBondContact O-N 3.04Å; A287-R391 HydrophobicContact CB-CB 4.07Å; A287-P415 HydrophobicContact CB-CB 4.47Å
288	G	98.3	Very high	96.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	139.4	-155.6	-178.7	0	0	0	0	0	111.8	N286 F307 R391	N286-G288 PolarHBondContact ND2-O 3.03Å; G288-F307 WeakPolarHBondContact O-CD2 3.34Å; G288-F307 PolarHBondContact O-N 2.95Å; G288-R391 WeakPolarHBondContact CA-O 3.47Å
289	D	97.8	Very high	96.6	Very high	25 Å²	25	25 Å²	25	13%	0.134	14%	0.144	C	C	.	.	S	Bend	trans	-112.3	6.5	-178.7	52.3	-1.6	0	0	0	114.3	T271 E306 V389	T271-D289 WeakPolarHBondContact CG2-OD1 3.4Å; D289-E306 HydrophobicContact CB-CB 4.16Å; D289-E306 HydrophobicContact CB-CG 4.21Å; D289-V389 HydrophobicContact CB-CG1 4.3Å; D289-V389 VanDerWaalsContact OD1-CG1 3.29Å; D289-V389 WeakPolarHBondContact OD1-CG1 3.47Å; D289-V389 WeakPolarHBondContact OD2-CG1 3.33Å
290	S	98.4	Very high	97	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.138	C	C	.	.			trans	-58.8	150.9	155.8	-72.7	0	0	0	0	110.9	T271 N286	T271-S290 PolarHBondContact OG1-OG 2.92Å; N286-S290 PolarHBondContact ND2-O 2.86Å; N286-S290 PolarHBondContact OD1-O 3.01Å
291	R	98.3	Very high	97.3	Very high	47 Å²	47	24.9 Å²	24.9	18%	0.177	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.1	-173	-165.5	-167.2	-62.5	-173.3	-1.1	113.5	L273 S304 E306 G436 W441 N446	L273-R291 WeakPolarHBondContact CD2-O 3.4Å; R291-S304 WeakPolarHBondContact CA-OG 3.38Å; R291-E306 IonicContact CZ-OE1 2.81Å; R291-E306 IonicContact CZ-OE2 3.77Å; R291-E306 IonicContact NE-OE1 3.13Å; R291-E306 PolarHBondContact NE-OE1 3.46Å; R291-E306 IonicContact NH2-OE1 3.77Å; R291-E306 PolarHBondContact NH2-OE1 2.78Å; R291-E306 IonicContact NH2-OE2 3.44Å; R291-E306 PolarHBondContact NH2-OE2 3.17Å; R291-G436 PolarHBondContact N-O 2.93Å; R291-G436 PolarHBondContact O-N 3.49Å; R291-W441 HydrophobicContact CB-CD2 3.87Å; R291-W441 HydrophobicContact CB-CG 3.88Å; R291-W441 HydrophobicContact CB-CZ2 4.19Å; R291-W441 HydrophobicContact CG-CD2 4.42Å; R291-W441 WeakPolarHBondContact O-CZ2 3.44Å; R291-W441 PolarHBondContact O-NE1 3.34Å; R291-N446 WeakPolarHBondContact CD-OD1 3.02Å; R291-N446 PolarHBondContact NH1-OD1 3.06Å
292	A	98.8	Very high	97.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.8	175.1	0	0	0	0	0	112.2	L273 V284 M303 S304 L433 I434 L435	L273-A292 HydrophobicContact CD1-CB 4.08Å; L273-A292 HydrophobicContact CD2-CB 4.11Å; V284-A292 HydrophobicContact CG1-CB 3.95Å; A292-M303 HydrophobicContact CB-CB 4.09Å; A292-M303 PolarHBondContact O-N 3.27Å; A292-S304 PolarHBondContact N-OG 3.12Å; A292-S304 PolarHBondContact O-N 3.24Å; A292-L433 HydrophobicContact CB-CD1 4.3Å; A292-I434 CarbonylContact C-O 3.57Å; A292-I434 VanDerWaalsContact CA-O 3.24Å; A292-I434 WeakPolarHBondContact CA-O 3.17Å; A292-L435 HydrophobicContact CB-CD1 4.48Å; A292-L435 HydrophobicContact CB-CG 4.25Å
293	I	98.9	Very high	97.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.5	172.3	67.4	178.3	0	0	0	110.4	V295 V300 I301 I434 W441 N446 V449	I293-V295 HydrophobicContact CD1-CG2 4.4Å; I293-V300 HydrophobicContact CB-CG1 4.19Å; I293-V300 HydrophobicContact CD1-CG1 4.02Å; I293-V300 HydrophobicContact CG2-CG1 4.4Å; I293-I301 WeakPolarHBondContact CA-O 3.46Å; I293-I434 HydrophobicContact CD1-CD1 4.4Å; I293-I434 HydrophobicContact CG1-CB 4.09Å; I293-I434 HydrophobicContact CG1-CD1 4.33Å; I293-I434 PolarHBondContact N-O 2.7Å; I293-I434 PolarHBondContact O-N 3.41Å; I293-W441 HydrophobicContact CD1-CH2 3.86Å; I293-W441 HydrophobicContact CD1-CZ3 4.19Å; I293-W441 HydrophobicContact CG1-CH2 3.97Å; I293-W441 HydrophobicContact CG2-CH2 4.2Å; I293-N446 HydrophobicContact CD1-CB 4.42Å; I293-N446 HydrophobicContact CG2-CB 4.48Å; I293-V449 HydrophobicContact CD1-CB 4.35Å; I293-V449 HydrophobicContact CD1-CG1 4.03Å
294	I	98.8	Very high	97.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	137.2	163	-74	169.8	0	0	0	108.2	R296 V300 I301 M303 Y420 V432 L433 L508	I294-R296 HydrophobicContact CG2-CB 3.87Å; I294-V300 WeakPolarHBondContact O-CA 3.47Å; I294-I301 HydrophobicContact CB-CB 4.12Å; I294-I301 HydrophobicContact CG2-CB 4.49Å; I294-I301 HydrophobicContact CG2-CD1 4.17Å; I294-I301 PolarHBondContact N-O 2.93Å; I294-I301 PolarHBondContact O-N 2.93Å; I294-M303 HydrophobicContact CB-CG 4.34Å; I294-M303 HydrophobicContact CD1-CG 3.72Å; I294-M303 HydrophobicContact CD1-SD 3.94Å; I294-M303 HydrophobicContact CG1-CG 3.73Å; I294-Y420 HydrophobicContact CD1-CD1 3.7Å; I294-Y420 HydrophobicContact CD1-CD2 3.62Å; I294-Y420 HydrophobicContact CD1-CE1 3.98Å; I294-Y420 HydrophobicContact CD1-CE2 3.93Å; I294-Y420 HydrophobicContact CD1-CG 3.5Å; I294-Y420 VanDerWaalsContact CD1-CG 3.5Å; I294-V432 WeakPolarHBondContact CA-O 3.44Å; I294-L433 HydrophobicContact CG1-CB 4.11Å; I294-L433 HydrophobicContact CG1-CD1 3.72Å; I294-L433 HydrophobicContact CG1-CG 4.49Å; I294-L508 HydrophobicContact CD1-CD1 4.4Å; I294-L508 HydrophobicContact CG1-CD1 4.29Å; I294-L508 HydrophobicContact CG2-CD1 3.76Å
295	V	98.4	Very high	97.2	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.018	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	115.3	163.7	-177.3	0	0	0	0	106.7	I293 E299 D431 V432 I434 A450	I293-V295 HydrophobicContact CD1-CG2 4.4Å; V295-E299 WeakPolarHBondContact CA-O 3.46Å; V295-D431 CarbonylContact O-C 3.57Å; V295-D431 VanDerWaalsContact O-CA 3.3Å; V295-D431 WeakPolarHBondContact O-CA 3.43Å; V295-V432 HydrophobicContact CB-CG2 4.31Å; V295-V432 PolarHBondContact N-O 3.31Å; V295-V432 PolarHBondContact O-N 3.39Å; V295-I434 HydrophobicContact CG2-CD1 3.83Å; V295-A450 HydrophobicContact CG1-CB 4.48Å; V295-A450 HydrophobicContact CG2-CB 3.66Å
296	R	95.9	Very high	97	Very high	41 Å²	41	30.3 Å²	30.3	16%	0.155	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124.7	-179.3	-179.4	-170	67.3	-174.6	5.3	110.1	I294 G298 E299 Y420 F425 D431	I294-R296 HydrophobicContact CG2-CB 3.87Å; R296-G298 PolarHBondContact O-N 2.84Å; R296-G298 VanDerWaalsContact O-N 3.16Å; R296-E299 PolarHBondContact N-O 3.27Å; R296-E299 WeakPolarHBondContact O-CB 3.44Å; R296-E299 PolarHBondContact O-N 3.28Å; R296-Y420 VanDerWaalsContact CD-OH 3.31Å; R296-Y420 WeakPolarHBondContact CD-OH 3.47Å; R296-Y420 PolarHBondContact NH1-OH 3.48Å; R296-F425 VanDerWaalsContact NH1-CE1 3.3Å; R296-F425 VanDerWaalsContact NH1-CE2 3.29Å; R296-D431 VanDerWaalsContact CA-OD1 3.23Å; R296-D431 WeakPolarHBondContact CA-OD1 3.39Å; R296-D431 HydrophobicContact CG-CB 4.37Å
297	A	91.2	Very high	97	Very high	85 Å²	85	30.6 Å²	30.6	70%	0.702	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	36.2	-177.5	0	0	0	0	0	113	E299 D431	A297-E299 PolarHBondContact O-N 2.64Å; A297-D431 PolarHBondContact N-OD1 3.12Å
298	G	87.8	Confident	96.9	Very high	56 Å²	56	32.1 Å²	32.1	58%	0.577	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	-3.1	-176.3	0	0	0	0	0	115.4	R296	R296-G298 PolarHBondContact O-N 2.84Å; R296-G298 VanDerWaalsContact O-N 3.16Å
299	E	95.8	Very high	96.9	Very high	122 Å²	122	32.1 Å²	32.1	57%	0.57	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	140.4	175.4	-61	-169.4	140.6	0	0	111.7	V295 R296 A297	V295-E299 WeakPolarHBondContact CA-O 3.46Å; R296-E299 PolarHBondContact N-O 3.27Å; R296-E299 WeakPolarHBondContact O-CB 3.44Å; R296-E299 PolarHBondContact O-N 3.28Å; A297-E299 PolarHBondContact O-N 2.64Å
300	V	98.3	Very high	96.7	Very high	39 Å²	39	35.4 Å²	35.4	24%	0.236	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.9	176.8	-174.6	0	0	0	0	110.3	I293 I294 N446 A450	I293-V300 HydrophobicContact CB-CG1 4.19Å; I293-V300 HydrophobicContact CD1-CG1 4.02Å; I293-V300 HydrophobicContact CG2-CG1 4.4Å; I294-V300 WeakPolarHBondContact O-CA 3.47Å; V300-N446 HydrophobicContact CG1-CB 4.14Å; V300-A450 HydrophobicContact CG2-CB 3.36Å
301	I	98.4	Very high	96.6	Very high	42 Å²	42	38.7 Å²	38.7	22%	0.215	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	107.8	-178.9	-54.3	171.3	0	0	0	108.7	I293 I294 M303 Y420	I293-I301 WeakPolarHBondContact CA-O 3.46Å; I294-I301 HydrophobicContact CB-CB 4.12Å; I294-I301 HydrophobicContact CG2-CB 4.49Å; I294-I301 HydrophobicContact CG2-CD1 4.17Å; I294-I301 PolarHBondContact N-O 2.93Å; I294-I301 PolarHBondContact O-N 2.93Å; I301-M303 HydrophobicContact CG2-SD 4.21Å; I301-M303 PolarHBondContact O-N 3.41Å; I301-Y420 HydrophobicContact CD1-CE2 4.37Å
302	P	98.3	Very high	96.6	Very high	62 Å²	62	37.8 Å²	37.8	40%	0.403	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	119.2	178.7	-21.5	33.6	0	0	0	112.5	R418	P302-R418 PolarHBondContact O-NH1 2.73Å
303	M	98.6	Very high	96.5	Very high	9 Å²	9	38.8 Å²	38.8	4%	0.044	23%	0.233	C	C	.	.			trans	-101.9	-2.9	-178.8	-70.5	-52.9	-57.6	0	0	114	V284 A292 I294 I301 R418 L433	V284-M303 HydrophobicContact CB-CB 4.35Å; V284-M303 HydrophobicContact CB-CE 4.25Å; V284-M303 HydrophobicContact CG1-CB 4.22Å; V284-M303 WeakPolarHBondContact CG1-O 3.38Å; V284-M303 HydrophobicContact CG2-CB 4.11Å; V284-M303 HydrophobicContact CG2-CE 3.71Å; A292-M303 HydrophobicContact CB-CB 4.09Å; A292-M303 PolarHBondContact O-N 3.27Å; I294-M303 HydrophobicContact CB-CG 4.34Å; I294-M303 HydrophobicContact CD1-CG 3.72Å; I294-M303 HydrophobicContact CD1-SD 3.94Å; I294-M303 HydrophobicContact CG1-CG 3.73Å; I301-M303 HydrophobicContact CG2-SD 4.21Å; I301-M303 PolarHBondContact O-N 3.41Å; M303-R418 HydrophobicContact CE-CB 3.93Å; M303-R418 WeakPolarHBondContact O-CD 3.35Å; M303-L433 HydrophobicContact CB-CD1 4.44Å; M303-L433 HydrophobicContact CG-CD1 4.32Å
304	S	98.1	Very high	96.4	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.042	26%	0.255	C	S	.	.			trans	-149.2	171.6	165.5	70	0	0	0	0	111.5	R291 A292	R291-S304 WeakPolarHBondContact CA-OG 3.38Å; A292-S304 PolarHBondContact N-OG 3.12Å; A292-S304 PolarHBondContact O-N 3.24Å
305	S	94.4	Very high	96.3	Very high	47 Å²	47	46.6 Å²	46.6	33%	0.329	27%	0.267	S	S	.	.			trans	-125.6	155.4	166.5	-55.8	0	0	0	0	109.8	N286 F307 R418	N286-S305 PolarHBondContact ND2-O 2.95Å; S305-F307 WeakPolarHBondContact O-CE2 3.27Å; S305-R418 PolarHBondContact OG-NH2 3.23Å
306	E	95.6	Very high	96.3	Very high	52 Å²	52	46.4 Å²	46.4	24%	0.243	27%	0.266	C	S	.	.			trans	-81.5	138.8	178.1	-63.9	169.9	161.1	0	0	111.7	D289 R291 T308 S311	D289-E306 HydrophobicContact CB-CB 4.16Å; D289-E306 HydrophobicContact CB-CG 4.21Å; R291-E306 IonicContact CZ-OE1 2.81Å; R291-E306 IonicContact CZ-OE2 3.77Å; R291-E306 IonicContact NE-OE1 3.13Å; R291-E306 PolarHBondContact NE-OE1 3.46Å; R291-E306 IonicContact NH2-OE1 3.77Å; R291-E306 PolarHBondContact NH2-OE1 2.78Å; R291-E306 IonicContact NH2-OE2 3.44Å; R291-E306 PolarHBondContact NH2-OE2 3.17Å; E306-T308 HydrophobicContact CB-CG2 4.11Å; E306-S311 PolarHBondContact O-OG 3.42Å
307	F	97.8	Very high	96.4	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.026	26%	0.259	C	S	.	.			trans	-104.5	72.9	-179.1	-66.5	-68.3	0	0	0	111.9	N286 G288 S305 E312 T390 R391 E416	N286-F307 HydrophobicContact CB-CE2 4.29Å; N286-F307 VanDerWaalsContact O-CE2 3.3Å; N286-F307 WeakPolarHBondContact O-CE2 3.37Å; G288-F307 WeakPolarHBondContact O-CD2 3.34Å; G288-F307 PolarHBondContact O-N 2.95Å; S305-F307 WeakPolarHBondContact O-CE2 3.27Å; F307-E312 HydrophobicContact CB-CG 4.35Å; F307-E312 HydrophobicContact CD1-CG 3.72Å; F307-T390 PolarHBondContact O-N 3.23Å; F307-T390 PolarHBondContact O-OG1 3.44Å; F307-R391 HydrophobicContact CB-CB 4Å; F307-R391 HydrophobicContact CB-CG 3.82Å; F307-R391 HydrophobicContact CD1-CG 4.33Å; F307-R391 VanDerWaalsContact CD1-NE 3.33Å; F307-R391 HydrophobicContact CD2-CG 4.5Å; F307-R391 VanDerWaalsContact CE1-CZ 3.4Å; F307-R391 HydrophobicContact CG-CB 4.31Å; F307-R391 HydrophobicContact CG-CG 3.96Å; F307-E416 HydrophobicContact CE2-CB 3.97Å; F307-E416 HydrophobicContact CZ-CB 3.46Å; F307-E416 VanDerWaalsContact CZ-CB 3.46Å; F307-E416 HydrophobicContact CZ-CG 4.4Å
308	T	97.1	Very high	96.8	Very high	32 Å²	32	45.4 Å²	45.4	20%	0.196	25%	0.247	C	C	.	.			trans	-94	165.5	179.3	74.8	0	0	0	0	111.5	E306 E310 S311 E312 T390	E306-T308 HydrophobicContact CB-CG2 4.11Å; T308-E310 PolarHBondContact O-N 2.88Å; T308-E310 PolarHBondContact OG1-N 3.42Å; T308-S311 PolarHBondContact N-OG 2.59Å; T308-S311 PolarHBondContact O-N 2.92Å; T308-S311 PolarHBondContact O-OG 2.85Å; T308-S311 PolarHBondContact OG1-N 3.18Å; T308-S311 PolarHBondContact OG1-OG 3.4Å; T308-E312 PolarHBondContact O-N 2.93Å; T308-T390 WeakPolarHBondContact O-CG2 3.48Å
309	P	97.6	Very high	97.3	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-35.4	175.1	-28.1	32.5	0	0	0	113.2	R313 I374 A381 V383 G388 T390	P309-R313 WeakPolarHBondContact O-CA 3.44Å; P309-R313 PolarHBondContact O-N 2.67Å; P309-I374 HydrophobicContact CB-CG1 4.12Å; P309-I374 HydrophobicContact CB-CG2 3.73Å; P309-I374 WeakPolarHBondContact O-CD1 3.33Å; P309-A381 HydrophobicContact CB-CB 4.11Å; P309-A381 HydrophobicContact CG-CB 4.2Å; P309-V383 HydrophobicContact CB-CG2 4.05Å; P309-V383 HydrophobicContact CG-CG2 3.9Å; P309-G388 WeakPolarHBondContact CD-O 3.49Å; P309-T390 HydrophobicContact CB-CG2 4.39Å; P309-T390 HydrophobicContact CG-CG2 4.18Å
310	E	95.3	Very high	97.4	Very high	93 Å²	93	38.5 Å²	38.5	44%	0.435	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-45	-179.5	-66.1	-178.3	142.8	0	0	112.1	T308 E312 R313 E377 G378 A381	T308-E310 PolarHBondContact O-N 2.88Å; T308-E310 PolarHBondContact OG1-N 3.42Å; E310-E312 VanDerWaalsContact C-N 3.27Å; E310-E312 PolarHBondContact O-N 3.12Å; E310-R313 WeakPolarHBondContact O-CB 3.4Å; E310-R313 PolarHBondContact O-N 3.23Å; E310-E377 WeakPolarHBondContact OE1-CA 3.48Å; E310-G378 VanDerWaalsContact CD-N 3.29Å; E310-G378 PolarHBondContact OE1-N 2.92Å; E310-G378 WeakPolarHBondContact OE2-CA 3.47Å; E310-G378 PolarHBondContact OE2-N 3.42Å; E310-A381 HydrophobicContact CG-CB 3.97Å
311	S	95.8	Very high	97.3	Very high	70 Å²	70	42.4 Å²	42.4	49%	0.49	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-33.3	-180	68.2	0	0	0	0	111.9	E306 T308	E306-S311 PolarHBondContact O-OG 3.42Å; T308-S311 PolarHBondContact N-OG 2.59Å; T308-S311 PolarHBondContact O-N 2.92Å; T308-S311 PolarHBondContact O-OG 2.85Å; T308-S311 PolarHBondContact OG1-N 3.18Å; T308-S311 PolarHBondContact OG1-OG 3.4Å
312	E	97.4	Very high	97.3	Very high	28 Å²	28	45.8 Å²	45.8	13%	0.131	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	13.9	-178.2	-68.4	-92	109.3	0	0	113.3	F307 T308 E310 Q314 R315 L316 T390 R391	F307-E312 HydrophobicContact CB-CG 4.35Å; F307-E312 HydrophobicContact CD1-CG 3.72Å; T308-E312 PolarHBondContact O-N 2.93Å; E310-E312 VanDerWaalsContact C-N 3.27Å; E310-E312 PolarHBondContact O-N 3.12Å; E312-Q314 VanDerWaalsContact C-N 3.3Å; E312-Q314 PolarHBondContact O-N 3.15Å; E312-Q314 VanDerWaalsContact O-N 3.16Å; E312-R315 WeakPolarHBondContact O-CB 3.38Å; E312-R315 PolarHBondContact O-N 3.01Å; E312-R315 WeakPolarHBondContact OE2-CD 3.29Å; E312-R315 IonicContact OE2-CZ 3.49Å; E312-R315 IonicContact OE2-NE 3.42Å; E312-R315 PolarHBondContact OE2-NE 2.81Å; E312-R315 IonicContact OE2-NH2 2.97Å; E312-R315 PolarHBondContact OE2-NH2 3.2Å; E312-L316 HydrophobicContact CB-CG 4.49Å; E312-L316 WeakPolarHBondContact O-CG 3.27Å; E312-L316 PolarHBondContact O-N 2.89Å; E312-T390 HydrophobicContact CB-CG2 4.27Å; E312-T390 WeakPolarHBondContact CG-OG1 3.45Å; E312-R391 VanDerWaalsContact CD-NH2 3.29Å; E312-R391 IonicContact OE1-CZ 3.09Å; E312-R391 IonicContact OE1-NH2 3.54Å; E312-R391 PolarHBondContact OE1-NH2 2.82Å; E312-R391 IonicContact OE2-CZ 2.96Å; E312-R391 VanDerWaalsContact OE2-CZ 3.32Å; E312-R391 IonicContact OE2-NE 2.69Å; E312-R391 PolarHBondContact OE2-NE 2.95Å; E312-R391 IonicContact OE2-NH2 3.12Å; E312-R391 PolarHBondContact OE2-NH2 3.18Å
313	R	97.1	Very high	97.3	Very high	20 Å²	20	46.5 Å²	46.5	8%	0.075	23%	0.226	C	C	.	.	H	α-helix	trans	-46.5	-50.8	-176.2	177.8	-162.8	60.7	97.5	-5.5	112.8	P309 E310 R315 L316 Q317 E335 D353 M356 I374	P309-R313 WeakPolarHBondContact O-CA 3.44Å; P309-R313 PolarHBondContact O-N 2.67Å; E310-R313 WeakPolarHBondContact O-CB 3.4Å; E310-R313 PolarHBondContact O-N 3.23Å; R313-R315 PolarHBondContact O-N 2.78Å; R313-L316 PolarHBondContact O-N 3.14Å; R313-Q317 HydrophobicContact CG-CG 4.19Å; R313-Q317 WeakPolarHBondContact O-CB 3.19Å; R313-Q317 VanDerWaalsContact O-CG 3.31Å; R313-Q317 WeakPolarHBondContact O-CG 3.27Å; R313-Q317 PolarHBondContact O-N 3.02Å; R313-E335 WeakPolarHBondContact CD-OE2 3.34Å; R313-D353 PolarHBondContact NH1-O 3.49Å; R313-M356 PolarHBondContact NH1-O 3.37Å; R313-M356 PolarHBondContact NH2-O 3.23Å; R313-I374 HydrophobicContact CB-CD1 3.81Å; R313-I374 HydrophobicContact CG-CD1 3.66Å
314	Q	96.8	Very high	97.2	Very high	97 Å²	97	49.9 Å²	49.9	45%	0.453	25%	0.249	S	C	.	.	H	α-helix	trans	-64.2	-40.6	-176.1	-67.4	-174.1	-67.1	0	0	112	E312 F318 F354	E312-Q314 VanDerWaalsContact C-N 3.3Å; E312-Q314 PolarHBondContact O-N 3.15Å; E312-Q314 VanDerWaalsContact O-N 3.16Å; Q314-F318 WeakPolarHBondContact O-CB 3.36Å; Q314-F318 PolarHBondContact O-N 3.48Å; Q314-F354 WeakPolarHBondContact CG-O 3.26Å; Q314-F354 PolarHBondContact NE2-O 2.91Å
315	R	97.5	Very high	97.1	Very high	67 Å²	67	55.8 Å²	55.8	25%	0.253	28%	0.275	S	S	.	.	H	α-helix	trans	-62.1	-46.7	176	-176.3	-173.5	64.8	83.4	-5.7	110.7	E312 R313 F318 L319 T390 F410	E312-R315 WeakPolarHBondContact O-CB 3.38Å; E312-R315 PolarHBondContact O-N 3.01Å; E312-R315 WeakPolarHBondContact OE2-CD 3.29Å; E312-R315 IonicContact OE2-CZ 3.49Å; E312-R315 IonicContact OE2-NE 3.42Å; E312-R315 PolarHBondContact OE2-NE 2.81Å; E312-R315 IonicContact OE2-NH2 2.97Å; E312-R315 PolarHBondContact OE2-NH2 3.2Å; R313-R315 PolarHBondContact O-N 2.78Å; R315-F318 PolarHBondContact O-N 3.23Å; R315-L319 PolarHBondContact O-N 3.47Å; R315-T390 PolarHBondContact NH2-O 3.47Å; R315-T390 VanDerWaalsContact NH2-O 3.09Å; R315-F410 PolarHBondContact NH1-O 3.01Å; R315-F410 PolarHBondContact NH2-O 3.09Å; R315-F410 VanDerWaalsContact NH2-O 3.11Å
316	L	98.4	Very high	97.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-49.5	-179.6	-66	174.9	0	0	0	111.7	E312 R313 F318 L319 A320 L373 I374 V383 T390 F410	E312-L316 HydrophobicContact CB-CG 4.49Å; E312-L316 WeakPolarHBondContact O-CG 3.27Å; E312-L316 PolarHBondContact O-N 2.89Å; R313-L316 PolarHBondContact O-N 3.14Å; L316-F318 VanDerWaalsContact C-N 3.34Å; L316-F318 PolarHBondContact O-N 2.79Å; L316-L319 PolarHBondContact O-N 3.46Å; L316-A320 WeakPolarHBondContact O-CB 3.17Å; L316-A320 PolarHBondContact O-N 2.81Å; L316-L373 HydrophobicContact CB-CD2 3.89Å; L316-L373 WeakPolarHBondContact O-CD2 3.34Å; L316-I374 HydrophobicContact CD1-CD1 4Å; L316-I374 HydrophobicContact CD1-CG1 4.09Å; L316-V383 HydrophobicContact CD1-CG2 3.72Å; L316-V383 HydrophobicContact CD2-CG2 4.43Å; L316-T390 HydrophobicContact CD1-CG2 3.8Å; L316-T390 HydrophobicContact CD2-CG2 4.48Å; L316-F410 HydrophobicContact CD2-CB 3.86Å; L316-F410 HydrophobicContact CD2-CD1 3.96Å; L316-F410 HydrophobicContact CD2-CG 4.39Å; L316-F410 WeakPolarHBondContact CD2-O 3.31Å
317	Q	98.1	Very high	97.3	Very high	4 Å²	4	53 Å²	53	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-38.4	178.6	-69	-178.2	-47.8	0	0	111.9	R313 A320 Y321 H333 F354 L373	R313-Q317 HydrophobicContact CG-CG 4.19Å; R313-Q317 WeakPolarHBondContact O-CB 3.19Å; R313-Q317 VanDerWaalsContact O-CG 3.31Å; R313-Q317 WeakPolarHBondContact O-CG 3.27Å; R313-Q317 PolarHBondContact O-N 3.02Å; Q317-A320 PolarHBondContact O-N 3.48Å; Q317-Y321 VanDerWaalsContact O-CB 3.32Å; Q317-Y321 WeakPolarHBondContact O-CB 3.49Å; Q317-Y321 PolarHBondContact O-N 2.71Å; Q317-H333 VanDerWaalsContact CD-O 3.28Å; Q317-H333 WeakPolarHBondContact CG-O 3.04Å; Q317-H333 PolarHBondContact NE2-O 3.18Å; Q317-F354 HydrophobicContact CB-CB 3.63Å; Q317-L373 HydrophobicContact CG-CD2 4.4Å
318	F	98.4	Very high	97.2	Very high	100 Å²	100	54.5 Å²	54.5	44%	0.439	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-45.9	175.8	176.1	-115.3	0	0	0	111.8	Q314 R315 L316 A320 Y321 M322 F354	Q314-F318 WeakPolarHBondContact O-CB 3.36Å; Q314-F318 PolarHBondContact O-N 3.48Å; R315-F318 PolarHBondContact O-N 3.23Å; L316-F318 VanDerWaalsContact C-N 3.34Å; L316-F318 PolarHBondContact O-N 2.79Å; F318-A320 VanDerWaalsContact C-N 3.33Å; F318-A320 PolarHBondContact O-N 3.23Å; F318-Y321 PolarHBondContact O-N 3.48Å; F318-M322 HydrophobicContact CD2-CG 4.05Å; F318-M322 HydrophobicContact CE1-CG 4.18Å; F318-M322 HydrophobicContact CE2-CG 3.61Å; F318-M322 HydrophobicContact CE2-SD 3.96Å; F318-M322 HydrophobicContact CZ-CG 3.69Å; F318-M322 HydrophobicContact CZ-SD 4.19Å; F318-M322 WeakPolarHBondContact O-CB 3.35Å; F318-M322 WeakPolarHBondContact O-CG 3.17Å; F318-M322 PolarHBondContact O-N 3.26Å; F318-F354 HydrophobicContact CB-CB 4.11Å; F318-F354 HydrophobicContact CB-CD2 3.92Å; F318-F354 HydrophobicContact CB-CG 4.07Å; F318-F354 AromaticContact CD2-CD2 3.65Å; F318-F354 HydrophobicContact CD2-CD2 3.65Å; F318-F354 AromaticContact CD2-CE2 3.47Å; F318-F354 HydrophobicContact CD2-CE2 3.47Å; F318-F354 VanDerWaalsContact CD2-CE2 3.47Å; F318-F354 HydrophobicContact CD2-CG 4.33Å; F318-F354 HydrophobicContact CD2-CZ 4.03Å; F318-F354 HydrophobicContact CE2-CE2 4.09Å; F318-F354 HydrophobicContact CG-CD2 4.21Å; F318-F354 HydrophobicContact CG-CE2 4.45Å
319	L	98.4	Very high	97	Very high	34 Å²	34	58.5 Å²	58.5	18%	0.178	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-45.4	175.1	176.7	58.3	0	0	0	111.4	R315 L316 Y321 M322 Q323 L326 P409 F410	R315-L319 PolarHBondContact O-N 3.47Å; L316-L319 PolarHBondContact O-N 3.46Å; L319-Y321 VanDerWaalsContact C-N 3.33Å; L319-Y321 PolarHBondContact O-N 2.88Å; L319-M322 PolarHBondContact O-N 2.96Å; L319-Q323 VanDerWaalsContact CD1-OE1 3.31Å; L319-Q323 PolarHBondContact O-N 3.23Å; L319-L326 HydrophobicContact CD1-CD1 4.27Å; L319-L326 HydrophobicContact CG-CD1 4.26Å; L319-P409 HydrophobicContact CD2-CB 4.36Å; L319-P409 HydrophobicContact CD2-CG 4.13Å; L319-F410 HydrophobicContact CB-CE1 4.23Å; L319-F410 HydrophobicContact CD2-CD1 3.75Å; L319-F410 HydrophobicContact CD2-CE1 4Å; L319-F410 HydrophobicContact CD2-CG 4.37Å; L319-F410 HydrophobicContact CG-CD1 4.25Å; L319-F410 HydrophobicContact CG-CE1 3.98Å
320	A	97.9	Very high	96.9	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65	-35	177.8	0	0	0	0	0	113.3	L316 Q317 F318 Q323 P324 L327 H333 L373 F410	L316-A320 WeakPolarHBondContact O-CB 3.17Å; L316-A320 PolarHBondContact O-N 2.81Å; Q317-A320 PolarHBondContact O-N 3.48Å; F318-A320 VanDerWaalsContact C-N 3.33Å; F318-A320 PolarHBondContact O-N 3.23Å; A320-Q323 CarbonylContact O-C 3.54Å; A320-P324 VanDerWaalsContact O-CA 3.28Å; A320-P324 WeakPolarHBondContact O-CA 3.33Å; A320-L327 HydrophobicContact CB-CD1 4.07Å; A320-L327 HydrophobicContact CB-CD2 3.87Å; A320-L327 HydrophobicContact CB-CG 4.16Å; A320-H333 HydrophobicContact CB-CB 3.61Å; A320-L373 HydrophobicContact CB-CD2 3.71Å; A320-F410 HydrophobicContact CB-CE1 3.81Å; A320-F410 HydrophobicContact CB-CZ 3.98Å
321	Y	97.4	Very high	96.9	Very high	121 Å²	121	57.9 Å²	57.9	48%	0.475	29%	0.293	S	S	.	.	H	α-helix	trans	-67	-45.4	173.1	171.3	-96.3	0	0	0	111.6	Q317 F318 L319 H333 F354	Q317-Y321 VanDerWaalsContact O-CB 3.32Å; Q317-Y321 WeakPolarHBondContact O-CB 3.49Å; Q317-Y321 PolarHBondContact O-N 2.71Å; F318-Y321 PolarHBondContact O-N 3.48Å; L319-Y321 VanDerWaalsContact C-N 3.33Å; L319-Y321 PolarHBondContact O-N 2.88Å; Y321-H333 AromaticContact CD2-NE2 3.75Å; Y321-F354 HydrophobicContact CD1-CD1 4.41Å; Y321-F354 AromaticContact CD1-CE1 3.52Å; Y321-F354 HydrophobicContact CD1-CE1 3.52Å; Y321-F354 AromaticContact CD1-CZ 3.76Å; Y321-F354 HydrophobicContact CD1-CZ 3.76Å; Y321-F354 HydrophobicContact CD2-CD1 4.48Å; Y321-F354 AromaticContact CD2-CE1 3.8Å; Y321-F354 HydrophobicContact CD2-CE1 3.8Å; Y321-F354 AromaticContact CE1-CE1 3.99Å; Y321-F354 HydrophobicContact CE1-CE1 3.99Å; Y321-F354 AromaticContact CE1-CZ 3.99Å; Y321-F354 HydrophobicContact CE1-CZ 3.99Å; Y321-F354 HydrophobicContact CE2-CE1 4.23Å; Y321-F354 HydrophobicContact CG-CD1 4.03Å; Y321-F354 AromaticContact CG-CE1 3.42Å; Y321-F354 HydrophobicContact CG-CE1 3.42Å; Y321-F354 VanDerWaalsContact CG-CE1 3.42Å; Y321-F354 HydrophobicContact CG-CZ 4.16Å
322	M	98.1	Very high	96.9	Very high	112 Å²	112	55 Å²	55	55%	0.552	27%	0.272	S	S	*	.	H	α-helix	trans	-70.4	-31.3	179.5	-70.6	-59	-60.3	0	0	112.8	F318 L319	F318-M322 HydrophobicContact CD2-CG 4.05Å; F318-M322 HydrophobicContact CE1-CG 4.18Å; F318-M322 HydrophobicContact CE2-CG 3.61Å; F318-M322 HydrophobicContact CE2-SD 3.96Å; F318-M322 HydrophobicContact CZ-CG 3.69Å; F318-M322 HydrophobicContact CZ-SD 4.19Å; F318-M322 WeakPolarHBondContact O-CB 3.35Å; F318-M322 WeakPolarHBondContact O-CG 3.17Å; F318-M322 PolarHBondContact O-N 3.26Å; L319-M322 PolarHBondContact O-N 2.96Å
323	Q	97.8	Very high	96.9	Very high	77 Å²	77	55.4 Å²	55.4	36%	0.36	27%	0.274	S	S	.	.			trans	-130.5	68.9	-176.6	-64.5	-168.5	-57.6	0	0	111.3	L319 A320 H325 L326	L319-Q323 VanDerWaalsContact CD1-OE1 3.31Å; L319-Q323 PolarHBondContact O-N 3.23Å; A320-Q323 CarbonylContact O-C 3.54Å; Q323-H325 PolarHBondContact O-N 2.92Å; Q323-H325 VanDerWaalsContact O-N 3.1Å; Q323-L326 HydrophobicContact CB-CD1 3.62Å; Q323-L326 HydrophobicContact CB-CG 3.88Å; Q323-L326 WeakPolarHBondContact O-CB 3.21Å; Q323-L326 WeakPolarHBondContact O-CG 3.24Å; Q323-L326 PolarHBondContact O-N 2.71Å
324	P	96.4	Very high	96.9	Very high	80 Å²	80	55.4 Å²	55.4	52%	0.519	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-65.1	-20.6	-173.4	25.3	-35.1	0	0	0	113.9	A320 L326 L327	A320-P324 VanDerWaalsContact O-CA 3.28Å; A320-P324 WeakPolarHBondContact O-CA 3.33Å; P324-L326 PolarHBondContact O-N 3.1Å; P324-L327 WeakPolarHBondContact O-CB 3.05Å; P324-L327 PolarHBondContact O-N 3.26Å; P324-L327 VanDerWaalsContact O-N 3.09Å
325	H	96.8	Very high	96.8	Very high	131 Å²	131	52.8 Å²	52.8	61%	0.606	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-62	-26.1	174.3	64.2	-85.3	0	0	0	112.7	Q323 L327 G328	Q323-H325 PolarHBondContact O-N 2.92Å; Q323-H325 VanDerWaalsContact O-N 3.1Å; H325-L327 PolarHBondContact O-N 2.71Å; H325-G328 PolarHBondContact O-N 3.05Å
326	L	97.3	Very high	96.7	Very high	34 Å²	34	50.5 Å²	50.5	18%	0.178	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-65.8	-19.7	175.4	-61.7	177.7	0	0	0	112.9	L319 Q323 P324 G328 I405 P409 F410	L319-L326 HydrophobicContact CD1-CD1 4.27Å; L319-L326 HydrophobicContact CG-CD1 4.26Å; Q323-L326 HydrophobicContact CB-CD1 3.62Å; Q323-L326 HydrophobicContact CB-CG 3.88Å; Q323-L326 WeakPolarHBondContact O-CB 3.21Å; Q323-L326 WeakPolarHBondContact O-CG 3.24Å; Q323-L326 PolarHBondContact O-N 2.71Å; P324-L326 PolarHBondContact O-N 3.1Å; L326-G328 VanDerWaalsContact C-N 3.29Å; L326-I405 VanDerWaalsContact O-CG2 3.24Å; L326-I405 WeakPolarHBondContact O-CG2 3.11Å; L326-P409 HydrophobicContact CD1-CG 3.55Å; L326-P409 HydrophobicContact CD2-CG 4.3Å; L326-F410 HydrophobicContact CB-CE2 3.89Å; L326-F410 HydrophobicContact CB-CZ 3.97Å; L326-F410 HydrophobicContact CD1-CE2 4.43Å; L326-F410 HydrophobicContact CD1-CZ 4.28Å
327	L	97	Very high	96.5	Very high	6 Å²	6	53.6 Å²	53.6	3%	0.031	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-85.1	-2.5	178.1	-59.9	177.7	0	0	0	113.2	A320 P324 H325 N329 E330 F331 H333 L373 L384 I405 F410	A320-L327 HydrophobicContact CB-CD1 4.07Å; A320-L327 HydrophobicContact CB-CD2 3.87Å; A320-L327 HydrophobicContact CB-CG 4.16Å; P324-L327 WeakPolarHBondContact O-CB 3.05Å; P324-L327 PolarHBondContact O-N 3.26Å; P324-L327 VanDerWaalsContact O-N 3.09Å; H325-L327 PolarHBondContact O-N 2.71Å; L327-N329 PolarHBondContact O-N 3.35Å; L327-E330 PolarHBondContact O-N 3.4Å; L327-F331 HydrophobicContact CB-CB 4.04Å; L327-F331 WeakPolarHBondContact CD1-O 3.44Å; L327-F331 HydrophobicContact CD2-CB 3.92Å; L327-F331 HydrophobicContact CG-CB 4.46Å; L327-F331 PolarHBondContact O-N 3.18Å; L327-H333 HydrophobicContact CD1-CB 4.43Å; L327-L373 HydrophobicContact CD2-CD1 3.77Å; L327-L384 HydrophobicContact CD2-CD2 4.34Å; L327-I405 WeakPolarHBondContact O-CD1 3.07Å; L327-F410 HydrophobicContact CD2-CZ 4.02Å
328	G	95.3	Very high	96.2	Very high	38 Å²	38	59.2 Å²	59.2	39%	0.392	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	17.6	179.6	0	0	0	0	0	115.3	H325 L326 E330	H325-G328 PolarHBondContact O-N 3.05Å; L326-G328 VanDerWaalsContact C-N 3.29Å; G328-E330 PolarHBondContact O-N 3.35Å; G328-E330 VanDerWaalsContact O-N 3.14Å
329	N	93.2	Very high	95.9	Very high	116 Å²	116	58.8 Å²	58.8	62%	0.62	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	11.8	-169.8	-161.3	42.8	0	0	0	114.6	L327 K370	L327-N329 PolarHBondContact O-N 3.35Å; N329-K370 WeakPolarHBondContact O-CE 3.33Å; N329-K370 VanDerWaalsContact OD1-CE 3.24Å; N329-K370 WeakPolarHBondContact OD1-CE 3.37Å; N329-K370 PolarHBondContact OD1-NZ 3.43Å
330	E	94.1	Very high	95.7	Very high	74 Å²	74	57.6 Å²	57.6	35%	0.346	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-27.9	178.4	-61.8	-170.3	-116	0	0	111.7	L327 G328 K370 F371 S403 I405	L327-E330 PolarHBondContact O-N 3.4Å; G328-E330 PolarHBondContact O-N 3.35Å; G328-E330 VanDerWaalsContact O-N 3.14Å; E330-K370 WeakPolarHBondContact O-CB 3.28Å; E330-F371 PolarHBondContact O-N 2.98Å; E330-S403 PolarHBondContact OE1-OG 3.29Å; E330-I405 HydrophobicContact CB-CD1 4.17Å; E330-I405 HydrophobicContact CG-CD1 4.3Å
331	F	96.4	Very high	95.6	Very high	6 Å²	6	61.6 Å²	61.6	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	157.9	-177.1	-63.3	-96.4	0	0	0	112.3	L327 F371 L384 V400 I405	L327-F331 HydrophobicContact CB-CB 4.04Å; L327-F331 WeakPolarHBondContact CD1-O 3.44Å; L327-F331 HydrophobicContact CD2-CB 3.92Å; L327-F331 HydrophobicContact CG-CB 4.46Å; L327-F331 PolarHBondContact O-N 3.18Å; F331-F371 CarbonylContact C-O 3.5Å; F331-F371 WeakPolarHBondContact CA-O 3.44Å; F331-F371 WeakPolarHBondContact CB-O 3.36Å; F331-F371 HydrophobicContact CD1-CB 3.51Å; F331-F371 HydrophobicContact CE1-CB 3.64Å; F331-F371 HydrophobicContact CG-CB 4.27Å; F331-F371 HydrophobicContact CZ-CB 4.48Å; F331-L384 HydrophobicContact CB-CD2 3.91Å; F331-L384 HydrophobicContact CD1-CD2 3.52Å; F331-L384 HydrophobicContact CD2-CD2 3.66Å; F331-L384 HydrophobicContact CE1-CB 4.23Å; F331-L384 HydrophobicContact CE1-CD2 3.88Å; F331-L384 HydrophobicContact CE2-CD2 4.02Å; F331-L384 HydrophobicContact CG-CD2 3.41Å; F331-L384 VanDerWaalsContact CG-CD2 3.41Å; F331-L384 HydrophobicContact CZ-CB 4.23Å; F331-L384 HydrophobicContact CZ-CD2 4.11Å; F331-V400 HydrophobicContact CE2-CG1 4.11Å; F331-V400 HydrophobicContact CE2-CG2 4.45Å; F331-V400 HydrophobicContact CZ-CG1 3.88Å; F331-I405 HydrophobicContact CD2-CD1 3.75Å; F331-I405 HydrophobicContact CE2-CD1 3.72Å
332	T	96.1	Very high	95.6	Very high	9 Å²	9	64.6 Å²	64.6	6%	0.055	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143.2	171.8	-178.4	0	0	0	0	110	L334 K370 F371 L373	T332-L334 VanDerWaalsContact C-N 3.27Å; T332-L334 PolarHBondContact OG1-N 2.84Å; T332-L334 VanDerWaalsContact OG1-N 3.14Å; T332-K370 HydrophobicContact CG2-CB 4.22Å; T332-F371 PolarHBondContact N-O 3.22Å; T332-L373 WeakPolarHBondContact O-CB 3.17Å; T332-L373 PolarHBondContact O-N 3.46Å
333	H	96.3	Very high	95.6	Very high	38 Å²	38	65.9 Å²	65.9	18%	0.176	32%	0.317	C	S	.	.	S	Bend	trans	-75.6	-20	171.5	64.6	-80	0	0	0	111.4	Q317 A320 Y321 L327 D353	Q317-H333 VanDerWaalsContact CD-O 3.28Å; Q317-H333 WeakPolarHBondContact CG-O 3.04Å; Q317-H333 PolarHBondContact NE2-O 3.18Å; A320-H333 HydrophobicContact CB-CB 3.61Å; Y321-H333 AromaticContact CD2-NE2 3.75Å; L327-H333 HydrophobicContact CD1-CB 4.43Å; H333-D353 IonicContact CD2-OD1 3.19Å; H333-D353 PolarHBondContact CD2-OD1 3.37Å; H333-D353 VanDerWaalsContact CD2-OD1 3.23Å; H333-D353 IonicContact NE2-OD1 3.58Å
334	L	96.4	Very high	95.6	Very high	20 Å²	20	63.1 Å²	63.1	11%	0.105	30%	0.304	C	S	.	.			trans	-70.8	140	177.4	-62.1	-177.2	0	0	0	110.9	T332 F336 Y351 D353 K362	T332-L334 VanDerWaalsContact C-N 3.27Å; T332-L334 PolarHBondContact OG1-N 2.84Å; T332-L334 VanDerWaalsContact OG1-N 3.14Å; L334-F336 HydrophobicContact CB-CE2 3.86Å; L334-F336 HydrophobicContact CB-CZ 4.16Å; L334-F336 HydrophobicContact CD1-CZ 4.36Å; L334-Y351 HydrophobicContact CD1-CD2 4.41Å; L334-Y351 HydrophobicContact CD2-CD2 4.1Å; L334-Y351 HydrophobicContact CD2-CE2 4.28Å; L334-D353 HydrophobicContact CD2-CB 3.87Å; L334-K362 HydrophobicContact CD1-CD 4.13Å
335	E	95.5	Very high	95.7	Very high	41 Å²	41	61.8 Å²	61.8	19%	0.192	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-104.3	138.6	174.6	-171	-175.9	157.6	0	0	110.7	R313 Y351 R352 W359	R313-E335 WeakPolarHBondContact CD-OE2 3.34Å; E335-Y351 CarbonylContact O-C 3.41Å; E335-Y351 WeakPolarHBondContact O-CA 3.29Å; E335-R352 HydrophobicContact CB-CG 3.93Å; E335-R352 PolarHBondContact N-O 3.43Å; E335-R352 PolarHBondContact O-N 2.88Å; E335-R352 IonicContact OE1-CZ 3.13Å; E335-R352 IonicContact OE1-NE 2.98Å; E335-R352 PolarHBondContact OE1-NE 2.91Å; E335-R352 IonicContact OE1-NH2 3.14Å; E335-R352 PolarHBondContact OE1-NH2 3.01Å; E335-R352 IonicContact OE2-CZ 2.69Å; E335-R352 IonicContact OE2-NE 2.8Å; E335-R352 PolarHBondContact OE2-NE 2.88Å; E335-R352 IonicContact OE2-NH2 2.77Å; E335-R352 PolarHBondContact OE2-NH2 3.17Å; E335-W359 HydrophobicContact CG-CH2 4.12Å
336	F	95.7	Very high	95.7	Very high	19 Å²	19	58.2 Å²	58.2	8%	0.083	29%	0.294	C	S	.	.			trans	-123.8	151.3	175.1	-61.7	-86.4	0	0	0	108.4	L334 R338 V340 M349 L350 K362 I364 D368	L334-F336 HydrophobicContact CB-CE2 3.86Å; L334-F336 HydrophobicContact CB-CZ 4.16Å; L334-F336 HydrophobicContact CD1-CZ 4.36Å; F336-R338 VanDerWaalsContact CB-O 3.28Å; F336-R338 WeakPolarHBondContact CB-O 3.36Å; F336-R338 PolarHBondContact O-N 3.33Å; F336-V340 HydrophobicContact CB-CG2 4.11Å; F336-V340 HydrophobicContact CD1-CG2 3.76Å; F336-V340 HydrophobicContact CD2-CG2 3.71Å; F336-V340 HydrophobicContact CE1-CG2 4.1Å; F336-V340 HydrophobicContact CE2-CG2 4.03Å; F336-V340 HydrophobicContact CG-CG2 3.56Å; F336-V340 HydrophobicContact CZ-CG2 4.23Å; F336-M349 HydrophobicContact CB-CE 4.23Å; F336-M349 HydrophobicContact CD1-CG 4.4Å; F336-M349 HydrophobicContact CD1-SD 4.39Å; F336-L350 WeakPolarHBondContact CD1-O 3.27Å; F336-K362 HydrophobicContact CE1-CD 4.16Å; F336-K362 HydrophobicContact CE1-CG 4.43Å; F336-K362 HydrophobicContact CZ-CD 4.23Å; F336-I364 HydrophobicContact CD1-CD1 4.08Å; F336-I364 HydrophobicContact CE1-CD1 3.42Å; F336-I364 VanDerWaalsContact CE1-CD1 3.42Å; F336-I364 HydrophobicContact CZ-CD1 4.13Å; F336-D368 HydrophobicContact CE2-CB 4.07Å; F336-D368 HydrophobicContact CZ-CB 3.72Å; F336-D368 WeakPolarHBondContact CZ-OD1 3.49Å
337	P	93.7	Very high	95.8	Very high	65 Å²	65	62.3 Å²	62.3	42%	0.422	31%	0.31	S	S	.	.	S	Bend	trans	-59.1	-17.6	178.5	-24.4	33	0	0	0	114.2	L350 W359	P337-L350 WeakPolarHBondContact CD-O 3.29Å; P337-L350 HydrophobicContact CG-CB 3.71Å; P337-L350 HydrophobicContact CG-CD1 4.28Å; P337-W359 VanDerWaalsContact CD-CZ3 3.47Å; P337-W359 HydrophobicContact CG-CE3 4.16Å; P337-W359 HydrophobicContact CG-CH2 4.1Å; P337-W359 HydrophobicContact CG-CZ3 3.78Å
338	R	92.4	Very high	95.8	Very high	123 Å²	123	70.3 Å²	70.3	46%	0.464	34%	0.34	S	S	.	.	S	Bend	trans	-159.6	170.1	169.4	59.2	164.9	173.4	75.4	0.2	109.5	F336 V340 E344 M349	F336-R338 VanDerWaalsContact CB-O 3.28Å; F336-R338 WeakPolarHBondContact CB-O 3.36Å; F336-R338 PolarHBondContact O-N 3.33Å; R338-V340 PolarHBondContact O-N 3.02Å; R338-E344 IonicContact CZ-OE1 3.21Å; R338-E344 VanDerWaalsContact CZ-OE1 3.24Å; R338-E344 IonicContact CZ-OE2 3.23Å; R338-E344 IonicContact NH1-OE1 2.64Å; R338-E344 PolarHBondContact NH1-OE1 3.49Å; R338-E344 IonicContact NH1-OE2 2.92Å; R338-E344 PolarHBondContact NH1-OE2 3.49Å; R338-E344 IonicContact NH2-OE1 2.92Å; R338-E344 PolarHBondContact NH2-OE1 3.18Å; R338-E344 IonicContact NH2-OE2 3.38Å; R338-M349 HydrophobicContact CG-CE 3.81Å
339	R	91.6	Very high	96	Very high	91 Å²	91	69.7 Å²	69.7	34%	0.343	33%	0.327	S	S	.	.			trans	-51.9	127	171.8	-171.1	174.4	-177.9	-176.8	4.4	111.7
340	V	95.4	Very high	96.2	Very high	8 Å²	8	66.8 Å²	66.8	5%	0.048	31%	0.311	C	S	.	.			trans	-70.9	137.5	175.6	-175.2	0	0	0	0	109.8	F336 R338 E344 M349 I364 D368 L369	F336-V340 HydrophobicContact CB-CG2 4.11Å; F336-V340 HydrophobicContact CD1-CG2 3.76Å; F336-V340 HydrophobicContact CD2-CG2 3.71Å; F336-V340 HydrophobicContact CE1-CG2 4.1Å; F336-V340 HydrophobicContact CE2-CG2 4.03Å; F336-V340 HydrophobicContact CG-CG2 3.56Å; F336-V340 HydrophobicContact CZ-CG2 4.23Å; R338-V340 PolarHBondContact O-N 3.02Å; V340-E344 HydrophobicContact CG1-CB 4.39Å; V340-M349 HydrophobicContact CG2-SD 4.16Å; V340-I364 HydrophobicContact CG1-CD1 4.31Å; V340-I364 HydrophobicContact CG1-CG1 4.3Å; V340-I364 HydrophobicContact CG1-CG2 3.46Å; V340-I364 VanDerWaalsContact CG1-CG2 3.46Å; V340-I364 HydrophobicContact CG2-CD1 4.34Å; V340-D368 WeakPolarHBondContact CB-O 3.42Å; V340-D368 HydrophobicContact CG2-CB 4.41Å; V340-L369 HydrophobicContact CB-CD2 4.36Å; V340-L369 HydrophobicContact CG1-CD2 3.9Å
341	Q	95.8	Very high	96.4	Very high	84 Å²	84	65.9 Å²	65.9	39%	0.393	31%	0.305	S	S	.	.			trans	-106.1	148.8	179.1	-58	-176.7	11.9	0	0	110.7	K343 E344 L369	Q341-K343 HydrophobicContact CB-CG 4.14Å; Q341-K343 PolarHBondContact O-N 3.32Å; Q341-E344 HydrophobicContact CB-CG 4.24Å; Q341-E344 PolarHBondContact N-OE2 3.02Å; Q341-E344 WeakPolarHBondContact O-CA 3.29Å; Q341-E344 VanDerWaalsContact O-CB 3.25Å; Q341-E344 WeakPolarHBondContact O-CB 3.34Å; Q341-E344 PolarHBondContact O-N 3.08Å; Q341-L369 VanDerWaalsContact C-CD2 3.48Å
342	R	97	Very high	96.4	Very high	184 Å²	184	68.1 Å²	68.1	69%	0.694	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-55.5	-30.2	179.8	-174.1	172	-81.3	-179.3	-7.1	113.8	E344 V345 L369	R342-E344 PolarHBondContact O-N 2.79Å; R342-E344 VanDerWaalsContact O-N 3.16Å; R342-V345 WeakPolarHBondContact O-CG2 3.37Å; R342-V345 PolarHBondContact O-N 3.04Å; R342-L369 HydrophobicContact CB-CD1 4.29Å; R342-L369 HydrophobicContact CB-CD2 4.47Å; R342-L369 HydrophobicContact CG-CD1 4.36Å
343	K	97.3	Very high	96.3	Very high	140 Å²	140	68.9 Å²	68.9	61%	0.609	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-69.1	-4.9	175.4	75.8	-172.6	-170.5	-161	0	114.5	Q341 K347	Q341-K343 HydrophobicContact CB-CG 4.14Å; Q341-K343 PolarHBondContact O-N 3.32Å; K343-K347 WeakPolarHBondContact O-CE 3.25Å; K343-K347 PolarHBondContact O-NZ 3.02Å
344	E	97.6	Very high	96.3	Very high	18 Å²	18	68.9 Å²	68.9	8%	0.084	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-104.6	-9.8	-176.1	-59.1	170.6	158.8	0	0	112.2	R338 V340 Q341 R342 G346 K347 I364	R338-E344 IonicContact CZ-OE1 3.21Å; R338-E344 VanDerWaalsContact CZ-OE1 3.24Å; R338-E344 IonicContact CZ-OE2 3.23Å; R338-E344 IonicContact NH1-OE1 2.64Å; R338-E344 PolarHBondContact NH1-OE1 3.49Å; R338-E344 IonicContact NH1-OE2 2.92Å; R338-E344 PolarHBondContact NH1-OE2 3.49Å; R338-E344 IonicContact NH2-OE1 2.92Å; R338-E344 PolarHBondContact NH2-OE1 3.18Å; R338-E344 IonicContact NH2-OE2 3.38Å; V340-E344 HydrophobicContact CG1-CB 4.39Å; Q341-E344 HydrophobicContact CB-CG 4.24Å; Q341-E344 PolarHBondContact N-OE2 3.02Å; Q341-E344 WeakPolarHBondContact O-CA 3.29Å; Q341-E344 VanDerWaalsContact O-CB 3.25Å; Q341-E344 WeakPolarHBondContact O-CB 3.34Å; Q341-E344 PolarHBondContact O-N 3.08Å; R342-E344 PolarHBondContact O-N 2.79Å; R342-E344 VanDerWaalsContact O-N 3.16Å; E344-G346 PolarHBondContact O-N 2.97Å; E344-K347 VanDerWaalsContact O-CB 3.27Å; E344-K347 WeakPolarHBondContact O-CB 3.42Å; E344-K347 PolarHBondContact O-N 2.75Å; E344-I364 WeakPolarHBondContact O-CB 3.02Å
345	V	98	Very high	96.3	Very high	52 Å²	52	72.7 Å²	72.7	32%	0.315	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	130.3	171.8	-179.2	0	0	0	0	109.7	R342 K347 I364 L369	R342-V345 WeakPolarHBondContact O-CG2 3.37Å; R342-V345 PolarHBondContact O-N 3.04Å; V345-K347 VanDerWaalsContact C-N 3.33Å; V345-I364 HydrophobicContact CG2-CG2 4.24Å; V345-L369 HydrophobicContact CG2-CD1 4.13Å; V345-L369 HydrophobicContact CG2-CD2 4.32Å; V345-L369 HydrophobicContact CG2-CG 4.35Å
346	G	98.1	Very high	96.3	Very high	57 Å²	57	72.4 Å²	72.4	59%	0.588	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-7.1	-173.2	0	0	0	0	0	115.6	E344 I364	E344-G346 PolarHBondContact O-N 2.97Å; G346-I364 PolarHBondContact N-O 3.45Å
347	K	98.4	Very high	96.3	Very high	120 Å²	120	76.9 Å²	76.9	52%	0.522	37%	0.373	S	S	.	.	S	Bend	trans	-93.2	161.6	175.1	-58.5	-177.2	-178.6	154.7	0	111.2	K343 E344 V345 T363 I364	K343-K347 WeakPolarHBondContact O-CE 3.25Å; K343-K347 PolarHBondContact O-NZ 3.02Å; E344-K347 VanDerWaalsContact O-CB 3.27Å; E344-K347 WeakPolarHBondContact O-CB 3.42Å; E344-K347 PolarHBondContact O-N 2.75Å; V345-K347 VanDerWaalsContact C-N 3.33Å; K347-T363 WeakPolarHBondContact O-CA 3.2Å; K347-I364 PolarHBondContact O-N 3.16Å
348	R	98.3	Very high	96.4	Very high	174 Å²	174	75.6 Å²	75.6	66%	0.657	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	131.5	172.7	-63.6	-172	73.1	-166.9	4.8	111	Y361 K362	R348-Y361 HydrophobicContact CB-CD1 4.28Å; R348-Y361 VanDerWaalsContact NH2-CB 3.3Å; R348-Y361 PolarHBondContact NH2-O 2.68Å; R348-K362 CarbonylContact C-O 3.55Å; R348-K362 VanDerWaalsContact CA-O 3.25Å; R348-K362 WeakPolarHBondContact CA-O 3.4Å
349	M	98.1	Very high	96.6	Very high	24 Å²	24	74.7 Å²	74.7	12%	0.118	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151	176.5	-173.6	166.1	179.8	0	0	110.5	F336 R338 V340 Y361 K362 I364	F336-M349 HydrophobicContact CB-CE 4.23Å; F336-M349 HydrophobicContact CD1-CG 4.4Å; F336-M349 HydrophobicContact CD1-SD 4.39Å; R338-M349 HydrophobicContact CG-CE 3.81Å; V340-M349 HydrophobicContact CG2-SD 4.16Å; M349-Y361 WeakPolarHBondContact O-CA 3.35Å; M349-K362 PolarHBondContact N-O 2.97Å; M349-K362 PolarHBondContact O-N 3.26Å; M349-I364 HydrophobicContact CB-CD1 3.74Å; M349-I364 HydrophobicContact CB-CG1 3.74Å; M349-I364 HydrophobicContact SD-CD1 4.46Å
350	L	98.3	Very high	96.9	Very high	55 Å²	55	72.1 Å²	72.1	29%	0.288	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	136.1	172.9	-70.7	171.3	0	0	0	109.9	F336 P337 W359 A360 Y361	F336-L350 WeakPolarHBondContact CD1-O 3.27Å; P337-L350 WeakPolarHBondContact CD-O 3.29Å; P337-L350 HydrophobicContact CG-CB 3.71Å; P337-L350 HydrophobicContact CG-CD1 4.28Å; L350-W359 HydrophobicContact CB-CE3 4.11Å; L350-W359 HydrophobicContact CD2-CB 4.09Å; L350-A360 CarbonylContact C-O 3.52Å; L350-A360 VanDerWaalsContact CA-O 3.25Å; L350-A360 WeakPolarHBondContact CA-O 3.39Å; L350-Y361 HydrophobicContact CD2-CD1 4.16Å; L350-Y361 HydrophobicContact CD2-CD2 3.9Å; L350-Y361 HydrophobicContact CD2-CE1 3.85Å; L350-Y361 HydrophobicContact CD2-CE2 3.57Å; L350-Y361 HydrophobicContact CD2-CG 4.17Å; L350-Y361 HydrophobicContact CG-CD1 4.29Å; L350-Y361 HydrophobicContact CG-CE1 3.78Å; L350-Y361 HydrophobicContact CG-CE2 4.36Å
351	Y	97.8	Very high	97.1	Very high	56 Å²	56	78.1 Å²	78.1	22%	0.22	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	163.5	172.9	87.3	-70.6	0	0	0	110.1	L334 E335 D353 M356 A360 K362	L334-Y351 HydrophobicContact CD1-CD2 4.41Å; L334-Y351 HydrophobicContact CD2-CD2 4.1Å; L334-Y351 HydrophobicContact CD2-CE2 4.28Å; E335-Y351 CarbonylContact O-C 3.41Å; E335-Y351 WeakPolarHBondContact O-CA 3.29Å; Y351-D353 HydrophobicContact CE2-CB 4.43Å; Y351-M356 HydrophobicContact CE2-SD 4.22Å; Y351-A360 HydrophobicContact CD1-CB 4.42Å; Y351-A360 VanDerWaalsContact CD1-O 3.22Å; Y351-A360 WeakPolarHBondContact CD1-O 3.43Å; Y351-A360 HydrophobicContact CE1-CB 3.87Å; Y351-A360 PolarHBondContact N-O 3.44Å; Y351-A360 PolarHBondContact O-N 2.97Å; Y351-K362 HydrophobicContact CD1-CB 3.58Å; Y351-K362 HydrophobicContact CD1-CD 3.93Å; Y351-K362 HydrophobicContact CD1-CG 3.63Å; Y351-K362 HydrophobicContact CD2-CD 3.9Å; Y351-K362 HydrophobicContact CE1-CB 3.61Å; Y351-K362 HydrophobicContact CE1-CD 4.37Å; Y351-K362 HydrophobicContact CE1-CG 4.15Å; Y351-K362 HydrophobicContact CE2-CD 4.32Å; Y351-K362 HydrophobicContact CG-CB 4.25Å; Y351-K362 HydrophobicContact CG-CD 3.68Å; Y351-K362 HydrophobicContact CG-CG 3.84Å
352	R	96.6	Very high	97.2	Very high	53 Å²	53	75.9 Å²	75.9	20%	0.2	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-144.3	152.1	165	65.5	-179.4	-177.9	-175.7	-4.5	111.2	E335 M356 G358 W359	E335-R352 HydrophobicContact CB-CG 3.93Å; E335-R352 PolarHBondContact N-O 3.43Å; E335-R352 PolarHBondContact O-N 2.88Å; E335-R352 IonicContact OE1-CZ 3.13Å; E335-R352 IonicContact OE1-NE 2.98Å; E335-R352 PolarHBondContact OE1-NE 2.91Å; E335-R352 IonicContact OE1-NH2 3.14Å; E335-R352 PolarHBondContact OE1-NH2 3.01Å; E335-R352 IonicContact OE2-CZ 2.69Å; E335-R352 IonicContact OE2-NE 2.8Å; E335-R352 PolarHBondContact OE2-NE 2.88Å; E335-R352 IonicContact OE2-NH2 2.77Å; E335-R352 PolarHBondContact OE2-NH2 3.17Å; R352-M356 HydrophobicContact CB-CB 4.23Å; R352-M356 HydrophobicContact CB-CE 4.27Å; R352-M356 HydrophobicContact CB-SD 4.42Å; R352-G358 WeakPolarHBondContact CB-O 3.41Å; R352-W359 HydrophobicContact CB-CD2 4.4Å; R352-W359 HydrophobicContact CB-CE3 4.15Å; R352-W359 HydrophobicContact CB-CZ3 4.44Å; R352-W359 HydrophobicContact CG-CD2 4.34Å; R352-W359 HydrophobicContact CG-CE3 4.07Å; R352-W359 HydrophobicContact CG-CH2 4.09Å; R352-W359 HydrophobicContact CG-CZ2 4.36Å; R352-W359 HydrophobicContact CG-CZ3 3.92Å
353	D	95.1	Very high	97.2	Very high	25 Å²	25	70.7 Å²	70.7	13%	0.134	37%	0.367	C	S	.	.			trans	-118.6	177.2	-179.8	-167.4	16.3	0	0	0	111.3	R313 H333 L334 Y351 T355 M356	R313-D353 PolarHBondContact NH1-O 3.49Å; H333-D353 IonicContact CD2-OD1 3.19Å; H333-D353 PolarHBondContact CD2-OD1 3.37Å; H333-D353 VanDerWaalsContact CD2-OD1 3.23Å; H333-D353 IonicContact NE2-OD1 3.58Å; L334-D353 HydrophobicContact CD2-CB 3.87Å; Y351-D353 HydrophobicContact CE2-CB 4.43Å; D353-T355 PolarHBondContact O-N 3.34Å; D353-M356 HydrophobicContact CB-SD 4.16Å; D353-M356 PolarHBondContact N-SD 3.06Å; D353-M356 PolarHBondContact O-N 3.2Å
354	F	95.7	Very high	97.3	Very high	38 Å²	38	64.1 Å²	64.1	17%	0.167	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.6	-177.2	71.2	-89.9	0	0	0	113.1	Q314 Q317 F318 Y321 M356	Q314-F354 WeakPolarHBondContact CG-O 3.26Å; Q314-F354 PolarHBondContact NE2-O 2.91Å; Q317-F354 HydrophobicContact CB-CB 3.63Å; F318-F354 HydrophobicContact CB-CB 4.11Å; F318-F354 HydrophobicContact CB-CD2 3.92Å; F318-F354 HydrophobicContact CB-CG 4.07Å; F318-F354 AromaticContact CD2-CD2 3.65Å; F318-F354 HydrophobicContact CD2-CD2 3.65Å; F318-F354 AromaticContact CD2-CE2 3.47Å; F318-F354 HydrophobicContact CD2-CE2 3.47Å; F318-F354 VanDerWaalsContact CD2-CE2 3.47Å; F318-F354 HydrophobicContact CD2-CG 4.33Å; F318-F354 HydrophobicContact CD2-CZ 4.03Å; F318-F354 HydrophobicContact CE2-CE2 4.09Å; F318-F354 HydrophobicContact CG-CD2 4.21Å; F318-F354 HydrophobicContact CG-CE2 4.45Å; Y321-F354 HydrophobicContact CD1-CD1 4.41Å; Y321-F354 AromaticContact CD1-CE1 3.52Å; Y321-F354 HydrophobicContact CD1-CE1 3.52Å; Y321-F354 AromaticContact CD1-CZ 3.76Å; Y321-F354 HydrophobicContact CD1-CZ 3.76Å; Y321-F354 HydrophobicContact CD2-CD1 4.48Å; Y321-F354 AromaticContact CD2-CE1 3.8Å; Y321-F354 HydrophobicContact CD2-CE1 3.8Å; Y321-F354 AromaticContact CE1-CE1 3.99Å; Y321-F354 HydrophobicContact CE1-CE1 3.99Å; Y321-F354 AromaticContact CE1-CZ 3.99Å; Y321-F354 HydrophobicContact CE1-CZ 3.99Å; Y321-F354 HydrophobicContact CE2-CE1 4.23Å; Y321-F354 HydrophobicContact CG-CD1 4.03Å; Y321-F354 AromaticContact CG-CE1 3.42Å; Y321-F354 HydrophobicContact CG-CE1 3.42Å; Y321-F354 VanDerWaalsContact CG-CE1 3.42Å; Y321-F354 HydrophobicContact CG-CZ 4.16Å; F354-M356 VanDerWaalsContact C-N 3.28Å; F354-M356 PolarHBondContact O-N 3.49Å
355	T	96.4	Very high	97.3	Very high	100 Å²	100	68.9 Å²	68.9	61%	0.613	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-10.5	178.3	58.2	0	0	0	0	114	D353	D353-T355 PolarHBondContact O-N 3.34Å
356	M	96.3	Very high	97.2	Very high	35 Å²	35	71.7 Å²	71.7	17%	0.172	37%	0.374	C	S	.	.			trans	-105.4	132.2	-169.4	-62	172.7	63	0	0	111.4	R313 Y351 R352 D353 F354 A360	R313-M356 PolarHBondContact NH1-O 3.37Å; R313-M356 PolarHBondContact NH2-O 3.23Å; Y351-M356 HydrophobicContact CE2-SD 4.22Å; R352-M356 HydrophobicContact CB-CB 4.23Å; R352-M356 HydrophobicContact CB-CE 4.27Å; R352-M356 HydrophobicContact CB-SD 4.42Å; D353-M356 HydrophobicContact CB-SD 4.16Å; D353-M356 PolarHBondContact N-SD 3.06Å; D353-M356 PolarHBondContact O-N 3.2Å; F354-M356 VanDerWaalsContact C-N 3.28Å; F354-M356 PolarHBondContact O-N 3.49Å; M356-A360 HydrophobicContact CE-CB 3.52Å
357	S	94.2	Very high	97.1	Very high	113 Å²	113	73.2 Å²	73.2	79%	0.79	37%	0.368	S	S	*	.	S	Bend	trans	-89.5	-28.7	164	55.5	0	0	0	0	112.5
358	G	95.6	Very high	97	Very high	37 Å²	37	67.8 Å²	67.8	38%	0.381	35%	0.345	S	S	.	.	S	Bend	trans	-99.1	-166.7	176.5	0	0	0	0	0	113.9	R352	R352-G358 WeakPolarHBondContact CB-O 3.41Å
359	W	97.9	Very high	96.9	Very high	105 Å²	105	61.1 Å²	61.1	40%	0.398	32%	0.322	S	S	.	.			trans	-115.6	147.3	177.8	-64.4	85.8	0	0	0	111	E335 P337 L350 R352	E335-W359 HydrophobicContact CG-CH2 4.12Å; P337-W359 VanDerWaalsContact CD-CZ3 3.47Å; P337-W359 HydrophobicContact CG-CE3 4.16Å; P337-W359 HydrophobicContact CG-CH2 4.1Å; P337-W359 HydrophobicContact CG-CZ3 3.78Å; L350-W359 HydrophobicContact CB-CE3 4.11Å; L350-W359 HydrophobicContact CD2-CB 4.09Å; R352-W359 HydrophobicContact CB-CD2 4.4Å; R352-W359 HydrophobicContact CB-CE3 4.15Å; R352-W359 HydrophobicContact CB-CZ3 4.44Å; R352-W359 HydrophobicContact CG-CD2 4.34Å; R352-W359 HydrophobicContact CG-CE3 4.07Å; R352-W359 HydrophobicContact CG-CH2 4.09Å; R352-W359 HydrophobicContact CG-CZ2 4.36Å; R352-W359 HydrophobicContact CG-CZ3 3.92Å
360	A	98.2	Very high	96.7	Very high	36 Å²	36	61.7 Å²	61.7	30%	0.298	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	168.7	172	0	0	0	0	0	110.4	L350 Y351 M356	L350-A360 CarbonylContact C-O 3.52Å; L350-A360 VanDerWaalsContact CA-O 3.25Å; L350-A360 WeakPolarHBondContact CA-O 3.39Å; Y351-A360 HydrophobicContact CD1-CB 4.42Å; Y351-A360 VanDerWaalsContact CD1-O 3.22Å; Y351-A360 WeakPolarHBondContact CD1-O 3.43Å; Y351-A360 HydrophobicContact CE1-CB 3.87Å; Y351-A360 PolarHBondContact N-O 3.44Å; Y351-A360 PolarHBondContact O-N 2.97Å; M356-A360 HydrophobicContact CE-CB 3.52Å
361	Y	98.3	Very high	96.5	Very high	135 Å²	135	59.9 Å²	59.9	53%	0.529	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.6	175.6	-77.4	-83.5	0	0	0	111.1	R348 M349 L350	R348-Y361 HydrophobicContact CB-CD1 4.28Å; R348-Y361 VanDerWaalsContact NH2-CB 3.3Å; R348-Y361 PolarHBondContact NH2-O 2.68Å; M349-Y361 WeakPolarHBondContact O-CA 3.35Å; L350-Y361 HydrophobicContact CD2-CD1 4.16Å; L350-Y361 HydrophobicContact CD2-CD2 3.9Å; L350-Y361 HydrophobicContact CD2-CE1 3.85Å; L350-Y361 HydrophobicContact CD2-CE2 3.57Å; L350-Y361 HydrophobicContact CD2-CG 4.17Å; L350-Y361 HydrophobicContact CG-CD1 4.29Å; L350-Y361 HydrophobicContact CG-CE1 3.78Å; L350-Y361 HydrophobicContact CG-CE2 4.36Å
362	K	97.7	Very high	96.3	Very high	37 Å²	37	58.5 Å²	58.5	16%	0.161	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	158.8	166	73.7	180	-61.1	-108.3	0	111.4	L334 F336 R348 M349 Y351 I364 D368	L334-K362 HydrophobicContact CD1-CD 4.13Å; F336-K362 HydrophobicContact CE1-CD 4.16Å; F336-K362 HydrophobicContact CE1-CG 4.43Å; F336-K362 HydrophobicContact CZ-CD 4.23Å; R348-K362 CarbonylContact C-O 3.55Å; R348-K362 VanDerWaalsContact CA-O 3.25Å; R348-K362 WeakPolarHBondContact CA-O 3.4Å; M349-K362 PolarHBondContact N-O 2.97Å; M349-K362 PolarHBondContact O-N 3.26Å; Y351-K362 HydrophobicContact CD1-CB 3.58Å; Y351-K362 HydrophobicContact CD1-CD 3.93Å; Y351-K362 HydrophobicContact CD1-CG 3.63Å; Y351-K362 HydrophobicContact CD2-CD 3.9Å; Y351-K362 HydrophobicContact CE1-CB 3.61Å; Y351-K362 HydrophobicContact CE1-CD 4.37Å; Y351-K362 HydrophobicContact CE1-CG 4.15Å; Y351-K362 HydrophobicContact CE2-CD 4.32Å; Y351-K362 HydrophobicContact CG-CB 4.25Å; Y351-K362 HydrophobicContact CG-CD 3.68Å; Y351-K362 HydrophobicContact CG-CG 3.84Å; K362-I364 HydrophobicContact CG-CD1 4.38Å; K362-D368 IonicContact NZ-OD1 2.67Å; K362-D368 PolarHBondContact NZ-OD1 3.01Å; K362-D368 IonicContact NZ-OD2 3.97Å; K362-D368 PolarHBondContact NZ-OD2 3.44Å
363	T	98.4	Very high	96.3	Very high	75 Å²	75	56.1 Å²	56.1	46%	0.46	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.7	164.4	-57.6	0	0	0	0	108.5	K347	K347-T363 WeakPolarHBondContact O-CA 3.2Å
364	I	98.4	Very high	96.4	Very high	2 Å²	2	56 Å²	56	1%	0.01	30%	0.302	C	S	.	.			trans	-75.5	133.8	-179.2	-65.4	-54.1	0	0	0	110.8	F336 V340 E344 V345 G346 K347 M349 K362 D368	F336-I364 HydrophobicContact CD1-CD1 4.08Å; F336-I364 HydrophobicContact CE1-CD1 3.42Å; F336-I364 VanDerWaalsContact CE1-CD1 3.42Å; F336-I364 HydrophobicContact CZ-CD1 4.13Å; V340-I364 HydrophobicContact CG1-CD1 4.31Å; V340-I364 HydrophobicContact CG1-CG1 4.3Å; V340-I364 HydrophobicContact CG1-CG2 3.46Å; V340-I364 VanDerWaalsContact CG1-CG2 3.46Å; V340-I364 HydrophobicContact CG2-CD1 4.34Å; E344-I364 WeakPolarHBondContact O-CB 3.02Å; V345-I364 HydrophobicContact CG2-CG2 4.24Å; G346-I364 PolarHBondContact N-O 3.45Å; K347-I364 PolarHBondContact O-N 3.16Å; M349-I364 HydrophobicContact CB-CD1 3.74Å; M349-I364 HydrophobicContact CB-CG1 3.74Å; M349-I364 HydrophobicContact SD-CD1 4.46Å; K362-I364 HydrophobicContact CG-CD1 4.38Å; I364-D368 WeakPolarHBondContact CA-OD2 3.22Å; I364-D368 HydrophobicContact CD1-CB 4.32Å; I364-D368 HydrophobicContact CG2-CB 4.14Å
365	E	97.4	Very high	96.2	Very high	118 Å²	118	56.8 Å²	56.8	55%	0.551	30%	0.304	S	S	*	.			trans	-113.8	166.3	177.5	-63.5	172.3	168.6	0	0	110.1	D367 D368	E365-D367 PolarHBondContact O-N 3.31Å; E365-D368 PolarHBondContact N-OD2 3.21Å; E365-D368 WeakPolarHBondContact O-CB 3.4Å; E365-D368 PolarHBondContact O-N 2.89Å; E365-D368 VanDerWaalsContact O-N 3.1Å
366	D	96.5	Very high	96	Very high	110 Å²	110	53.7 Å²	53.7	59%	0.588	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-59.5	-30.5	178.2	-77.7	-56.8	0	0	0	112.7	D368 L369	D366-D368 PolarHBondContact O-N 3.13Å; D366-L369 VanDerWaalsContact O-CB 3.29Å; D366-L369 WeakPolarHBondContact O-CB 3.47Å; D366-L369 WeakPolarHBondContact O-CG 3.38Å; D366-L369 PolarHBondContact O-N 2.9Å
367	D	94.8	Very high	95.8	Very high	89 Å²	89	59.1 Å²	59.1	48%	0.476	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-67.3	-24.5	179.4	-133.5	54.1	0	0	0	112.7	E365 L369 K370	E365-D367 PolarHBondContact O-N 3.31Å; D367-L369 PolarHBondContact O-N 3.13Å; D367-K370 WeakPolarHBondContact O-CB 3.47Å; D367-K370 WeakPolarHBondContact O-CD 3.48Å; D367-K370 VanDerWaalsContact O-CG 3.26Å; D367-K370 WeakPolarHBondContact O-CG 3.33Å; D367-K370 PolarHBondContact O-N 2.97Å; D367-K370 WeakPolarHBondContact OD1-CE 3.3Å; D367-K370 IonicContact OD1-NZ 3.01Å; D367-K370 PolarHBondContact OD1-NZ 3.48Å; D367-K370 IonicContact OD2-NZ 2.7Å; D367-K370 PolarHBondContact OD2-NZ 3.3Å
368	D	96.3	Very high	95.6	Very high	6 Å²	6	55.7 Å²	55.7	3%	0.032	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-75	-7.4	176.6	-59.5	-44.9	0	0	0	112.9	F336 V340 K362 I364 E365 D366 K370	F336-D368 HydrophobicContact CE2-CB 4.07Å; F336-D368 HydrophobicContact CZ-CB 3.72Å; F336-D368 WeakPolarHBondContact CZ-OD1 3.49Å; V340-D368 WeakPolarHBondContact CB-O 3.42Å; V340-D368 HydrophobicContact CG2-CB 4.41Å; K362-D368 IonicContact NZ-OD1 2.67Å; K362-D368 PolarHBondContact NZ-OD1 3.01Å; K362-D368 IonicContact NZ-OD2 3.97Å; K362-D368 PolarHBondContact NZ-OD2 3.44Å; I364-D368 WeakPolarHBondContact CA-OD2 3.22Å; I364-D368 HydrophobicContact CD1-CB 4.32Å; I364-D368 HydrophobicContact CG2-CB 4.14Å; E365-D368 PolarHBondContact N-OD2 3.21Å; E365-D368 WeakPolarHBondContact O-CB 3.4Å; E365-D368 PolarHBondContact O-N 2.89Å; E365-D368 VanDerWaalsContact O-N 3.1Å; D366-D368 PolarHBondContact O-N 3.13Å; D368-K370 PolarHBondContact O-N 3.44Å
369	L	96.4	Very high	95.3	Very high	34 Å²	34	59.7 Å²	59.7	18%	0.178	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-75.9	-9.1	175	-61	175.8	0	0	0	113.1	V340 Q341 R342 V345 D366 D367	V340-L369 HydrophobicContact CB-CD2 4.36Å; V340-L369 HydrophobicContact CG1-CD2 3.9Å; Q341-L369 VanDerWaalsContact C-CD2 3.48Å; R342-L369 HydrophobicContact CB-CD1 4.29Å; R342-L369 HydrophobicContact CB-CD2 4.47Å; R342-L369 HydrophobicContact CG-CD1 4.36Å; V345-L369 HydrophobicContact CG2-CD1 4.13Å; V345-L369 HydrophobicContact CG2-CD2 4.32Å; V345-L369 HydrophobicContact CG2-CG 4.35Å; D366-L369 VanDerWaalsContact O-CB 3.29Å; D366-L369 WeakPolarHBondContact O-CB 3.47Å; D366-L369 WeakPolarHBondContact O-CG 3.38Å; D366-L369 PolarHBondContact O-N 2.9Å; D367-L369 PolarHBondContact O-N 3.13Å
370	K	95.4	Very high	95	Very high	37 Å²	37	62.6 Å²	62.6	16%	0.161	32%	0.322	C	S	.	.	S	Bend	trans	-61.5	159.3	173.6	-69.8	174.7	-168.4	169.8	0	111.3	N329 E330 T332 D367 D368	N329-K370 WeakPolarHBondContact O-CE 3.33Å; N329-K370 VanDerWaalsContact OD1-CE 3.24Å; N329-K370 WeakPolarHBondContact OD1-CE 3.37Å; N329-K370 PolarHBondContact OD1-NZ 3.43Å; E330-K370 WeakPolarHBondContact O-CB 3.28Å; T332-K370 HydrophobicContact CG2-CB 4.22Å; D367-K370 WeakPolarHBondContact O-CB 3.47Å; D367-K370 WeakPolarHBondContact O-CD 3.48Å; D367-K370 VanDerWaalsContact O-CG 3.26Å; D367-K370 WeakPolarHBondContact O-CG 3.33Å; D367-K370 PolarHBondContact O-N 2.97Å; D367-K370 WeakPolarHBondContact OD1-CE 3.3Å; D367-K370 IonicContact OD1-NZ 3.01Å; D367-K370 PolarHBondContact OD1-NZ 3.48Å; D367-K370 IonicContact OD2-NZ 2.7Å; D367-K370 PolarHBondContact OD2-NZ 3.3Å; D368-K370 PolarHBondContact O-N 3.44Å
371	F	93.9	Very high	94.9	Very high	17 Å²	17	60.9 Å²	60.9	8%	0.075	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	143	178.9	-71.5	-88	0	0	0	110.9	V5 E330 F331 T332	V5-F371 HydrophobicContact CB-CD2 4.39Å; V5-F371 HydrophobicContact CB-CE1 4.14Å; V5-F371 HydrophobicContact CB-CE2 3.58Å; V5-F371 HydrophobicContact CB-CZ 3.41Å; V5-F371 VanDerWaalsContact CB-CZ 3.41Å; V5-F371 HydrophobicContact CG1-CD1 3.91Å; V5-F371 HydrophobicContact CG1-CD2 4Å; V5-F371 HydrophobicContact CG1-CE1 3.43Å; V5-F371 VanDerWaalsContact CG1-CE1 3.43Å; V5-F371 HydrophobicContact CG1-CE2 3.55Å; V5-F371 HydrophobicContact CG1-CG 4.16Å; V5-F371 HydrophobicContact CG1-CZ 3.23Å; V5-F371 HydrophobicContact CG2-CD2 4.36Å; V5-F371 HydrophobicContact CG2-CE2 3.77Å; V5-F371 HydrophobicContact CG2-CZ 4.16Å; E330-F371 PolarHBondContact O-N 2.98Å; F331-F371 CarbonylContact C-O 3.5Å; F331-F371 WeakPolarHBondContact CA-O 3.44Å; F331-F371 WeakPolarHBondContact CB-O 3.36Å; F331-F371 HydrophobicContact CD1-CB 3.51Å; F331-F371 HydrophobicContact CE1-CB 3.64Å; F331-F371 HydrophobicContact CG-CB 4.27Å; F331-F371 HydrophobicContact CZ-CB 4.48Å; T332-F371 PolarHBondContact N-O 3.22Å
372	P	93.5	Very high	94.8	Very high	26 Å²	26	58.1 Å²	58.1	17%	0.169	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	142.9	176.8	30.8	-35.6	0	0	0	110.2	I374 Y375	P372-I374 WeakPolarHBondContact CB-O 3.45Å; P372-I374 WeakPolarHBondContact CG-O 3.48Å; P372-I374 PolarHBondContact O-N 2.79Å; P372-Y375 HydrophobicContact CG-CD2 4.15Å
373	L	96.3	Very high	94.8	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.016	29%	0.289	C	S	.	.	S	Bend	trans	-54.5	-37.9	174.3	177	62.1	0	0	0	112.2	L316 Q317 A320 L327 T332 V383 L384 F410	L316-L373 HydrophobicContact CB-CD2 3.89Å; L316-L373 WeakPolarHBondContact O-CD2 3.34Å; Q317-L373 HydrophobicContact CG-CD2 4.4Å; A320-L373 HydrophobicContact CB-CD2 3.71Å; L327-L373 HydrophobicContact CD2-CD1 3.77Å; T332-L373 WeakPolarHBondContact O-CB 3.17Å; T332-L373 PolarHBondContact O-N 3.46Å; L373-V383 HydrophobicContact CD1-CG1 4.34Å; L373-L384 HydrophobicContact CD1-CD2 3.51Å; L373-L384 HydrophobicContact CD1-CG 3.82Å; L373-L384 PolarHBondContact O-N 3.32Å; L373-F410 HydrophobicContact CD1-CD1 4.26Å; L373-F410 HydrophobicContact CD1-CE1 3.96Å; L373-F410 HydrophobicContact CD1-CE2 4.27Å; L373-F410 HydrophobicContact CD1-CZ 3.96Å; L373-F410 HydrophobicContact CD2-CE1 4.12Å
374	I	96.3	Very high	94.8	Very high	22 Å²	22	52.9 Å²	52.9	11%	0.113	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.9	175.1	-64.5	155.5	0	0	0	107.3	P309 R313 L316 P372 A381	P309-I374 HydrophobicContact CB-CG1 4.12Å; P309-I374 HydrophobicContact CB-CG2 3.73Å; P309-I374 WeakPolarHBondContact O-CD1 3.33Å; R313-I374 HydrophobicContact CB-CD1 3.81Å; R313-I374 HydrophobicContact CG-CD1 3.66Å; L316-I374 HydrophobicContact CD1-CD1 4Å; L316-I374 HydrophobicContact CD1-CG1 4.09Å; P372-I374 WeakPolarHBondContact CB-O 3.45Å; P372-I374 WeakPolarHBondContact CG-O 3.48Å; P372-I374 PolarHBondContact O-N 2.79Å; I374-A381 HydrophobicContact CG2-CB 4.5Å
375	Y	92.3	Very high	94.6	Very high	55 Å²	55	54.6 Å²	54.6	22%	0.216	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.3	-176.9	-174.8	-92.1	0	0	0	110.6	V9 P372 A381 R382 A385	V9-Y375 HydrophobicContact CG1-CE1 4.41Å; V9-Y375 WeakPolarHBondContact CG1-OH 3.49Å; P372-Y375 HydrophobicContact CG-CD2 4.15Å; Y375-A381 CarbonylContact O-C 3.51Å; Y375-A381 VanDerWaalsContact O-CA 3.3Å; Y375-A381 WeakPolarHBondContact O-CA 3.43Å; Y375-R382 PolarHBondContact N-O 3.23Å; Y375-R382 PolarHBondContact O-N 2.89Å; Y375-A385 HydrophobicContact CD1-CB 4.31Å; Y375-A385 HydrophobicContact CG-CB 4.28Å
376	G	91.9	Very high	94.6	Very high	35 Å²	35	50.9 Å²	50.9	36%	0.361	27%	0.267	S	S	.	.	S	Bend	trans	90	-179.3	-175.5	0	0	0	0	0	112.4
377	E	91.4	Very high	94.6	Very high	150 Å²	150	46.1 Å²	46.1	70%	0.701	24%	0.242	S	C	*	.	S	Bend	trans	-138.4	150.9	-176.9	-66.9	178.4	-178.2	0	0	109.9	E310 K379 K380 A381	E310-E377 WeakPolarHBondContact OE1-CA 3.48Å; E377-K379 PolarHBondContact O-N 3.46Å; E377-K380 PolarHBondContact O-N 3Å; E377-K380 VanDerWaalsContact O-N 3.15Å; E377-A381 PolarHBondContact O-N 3.28Å
378	G	91.4	Very high	94.7	Very high	40 Å²	40	42.9 Å²	42.9	41%	0.412	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	53.1	-135	-177.7	0	0	0	0	0	112.2	E310 K380 A381	E310-G378 VanDerWaalsContact CD-N 3.29Å; E310-G378 PolarHBondContact OE1-N 2.92Å; E310-G378 WeakPolarHBondContact OE2-CA 3.47Å; E310-G378 PolarHBondContact OE2-N 3.42Å; G378-K380 PolarHBondContact O-N 3Å; G378-A381 WeakPolarHBondContact O-CB 3.26Å; G378-A381 PolarHBondContact O-N 2.75Å
379	K	88.3	Confident	94.8	Very high	121 Å²	121	43 Å²	43	53%	0.526	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-61.4	-15.4	179.9	-60.4	-171.3	178.7	-172.7	0	115.2	E377 R382 D442	E377-K379 PolarHBondContact O-N 3.46Å; K379-R382 PolarHBondContact O-NH1 3.27Å; K379-D442 WeakPolarHBondContact CD-OD2 3.45Å; K379-D442 VanDerWaalsContact CE-CG 3.47Å; K379-D442 WeakPolarHBondContact CE-OD1 3.31Å; K379-D442 WeakPolarHBondContact CE-OD2 3.46Å; K379-D442 VanDerWaalsContact NZ-C 3.3Å; K379-D442 PolarHBondContact NZ-O 3.36Å; K379-D442 IonicContact NZ-OD1 2.9Å; K379-D442 PolarHBondContact NZ-OD1 2.85Å; K379-D442 IonicContact NZ-OD2 2.64Å; K379-D442 PolarHBondContact NZ-OD2 3.47Å
380	K	91.9	Very high	94.9	Very high	166 Å²	166	41.4 Å²	41.4	72%	0.722	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-95.9	-1.1	176.7	-63.5	-176.2	-179	-179.2	0	112.5	E377 G378	E377-K380 PolarHBondContact O-N 3Å; E377-K380 VanDerWaalsContact O-N 3.15Å; G378-K380 PolarHBondContact O-N 3Å
381	A	95.6	Very high	95.1	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.008	22%	0.221	C	C	.	.			trans	-64.2	136.5	174	0	0	0	0	0	110	P309 E310 I374 Y375 E377 G378	P309-A381 HydrophobicContact CB-CB 4.11Å; P309-A381 HydrophobicContact CG-CB 4.2Å; E310-A381 HydrophobicContact CG-CB 3.97Å; I374-A381 HydrophobicContact CG2-CB 4.5Å; Y375-A381 CarbonylContact O-C 3.51Å; Y375-A381 VanDerWaalsContact O-CA 3.3Å; Y375-A381 WeakPolarHBondContact O-CA 3.43Å; E377-A381 PolarHBondContact O-N 3.28Å; G378-A381 WeakPolarHBondContact O-CB 3.26Å; G378-A381 PolarHBondContact O-N 2.75Å
382	R	97.4	Very high	95.3	Very high	77 Å²	77	40.5 Å²	40.5	29%	0.291	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	136	-179.1	-64	-66.2	178.9	-89.1	6.8	110.4	Y375 K379 L384 I387	Y375-R382 PolarHBondContact N-O 3.23Å; Y375-R382 PolarHBondContact O-N 2.89Å; K379-R382 PolarHBondContact O-NH1 3.27Å; R382-L384 PolarHBondContact O-N 2.8Å; R382-I387 CarbonylContact C-O 3.41Å; R382-I387 WeakPolarHBondContact CA-O 3.49Å; R382-I387 WeakPolarHBondContact CD-O 3.15Å
383	V	98	Very high	95.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.3	166.9	-178.4	0	0	0	0	108.4	P309 L316 L373 A385 T386 I387 T390 F410	P309-V383 HydrophobicContact CB-CG2 4.05Å; P309-V383 HydrophobicContact CG-CG2 3.9Å; L316-V383 HydrophobicContact CD1-CG2 3.72Å; L316-V383 HydrophobicContact CD2-CG2 4.43Å; L373-V383 HydrophobicContact CD1-CG1 4.34Å; V383-A385 PolarHBondContact O-N 3.37Å; V383-A385 VanDerWaalsContact O-N 3.1Å; V383-T386 PolarHBondContact O-N 3.26Å; V383-I387 HydrophobicContact CB-CG2 3.94Å; V383-I387 HydrophobicContact CG2-CG2 4.44Å; V383-I387 PolarHBondContact N-O 3.26Å; V383-I387 PolarHBondContact O-N 2.84Å; V383-T390 HydrophobicContact CG2-CG2 3.79Å; V383-F410 HydrophobicContact CG1-CB 3.88Å; V383-F410 HydrophobicContact CG1-CG 4.25Å
384	L	97	Very high	95.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	36.8	-178.6	-59.1	168.2	0	0	0	112.5	L327 F331 L373 R382 T386 V400 I405 I407 F410	L327-L384 HydrophobicContact CD2-CD2 4.34Å; F331-L384 HydrophobicContact CB-CD2 3.91Å; F331-L384 HydrophobicContact CD1-CD2 3.52Å; F331-L384 HydrophobicContact CD2-CD2 3.66Å; F331-L384 HydrophobicContact CE1-CB 4.23Å; F331-L384 HydrophobicContact CE1-CD2 3.88Å; F331-L384 HydrophobicContact CE2-CD2 4.02Å; F331-L384 HydrophobicContact CG-CD2 3.41Å; F331-L384 VanDerWaalsContact CG-CD2 3.41Å; F331-L384 HydrophobicContact CZ-CB 4.23Å; F331-L384 HydrophobicContact CZ-CD2 4.11Å; L373-L384 HydrophobicContact CD1-CD2 3.51Å; L373-L384 HydrophobicContact CD1-CG 3.82Å; L373-L384 PolarHBondContact O-N 3.32Å; R382-L384 PolarHBondContact O-N 2.8Å; L384-T386 PolarHBondContact O-N 3.33Å; L384-T386 VanDerWaalsContact O-N 3.09Å; L384-T386 PolarHBondContact O-OG1 3.3Å; L384-V400 HydrophobicContact CB-CG2 3.51Å; L384-V400 HydrophobicContact CD1-CG2 3.88Å; L384-V400 HydrophobicContact CG-CG2 4.25Å; L384-I405 HydrophobicContact CD1-CG2 3.79Å; L384-I407 HydrophobicContact CB-CD1 4.1Å; L384-I407 HydrophobicContact CD1-CD1 3.97Å; L384-F410 HydrophobicContact CD1-CD2 3.88Å; L384-F410 HydrophobicContact CD1-CE2 4Å
385	A	95.1	Very high	95.7	Very high	38 Å²	38	38.8 Å²	38.8	31%	0.314	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	23.6	-175.2	0	0	0	0	0	115	Y375 V383	Y375-A385 HydrophobicContact CD1-CB 4.31Å; Y375-A385 HydrophobicContact CG-CB 4.28Å; V383-A385 PolarHBondContact O-N 3.37Å; V383-A385 VanDerWaalsContact O-N 3.1Å
386	T	96.8	Very high	95.9	Very high	41 Å²	41	37.2 Å²	37.2	25%	0.252	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-60.4	-171	-54.1	0	0	0	0	112.8	V383 L384 L398 V400 I407	V383-T386 PolarHBondContact O-N 3.26Å; L384-T386 PolarHBondContact O-N 3.33Å; L384-T386 VanDerWaalsContact O-N 3.09Å; L384-T386 PolarHBondContact O-OG1 3.3Å; T386-L398 HydrophobicContact CG2-CD1 4.08Å; T386-L398 HydrophobicContact CG2-CD2 4.09Å; T386-L398 HydrophobicContact CG2-CG 4.04Å; T386-V400 WeakPolarHBondContact OG1-CA 3.37Å; T386-I407 HydrophobicContact CG2-CD1 3.86Å; T386-I407 HydrophobicContact CG2-CG1 3.94Å
387	I	97.1	Very high	96	Very high	10 Å²	10	40.3 Å²	40.3	5%	0.051	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-115.3	140.6	-170.5	-167	166.3	0	0	0	112.9	R382 V383 V389 D395 L398 I407 L411	R382-I387 CarbonylContact C-O 3.41Å; R382-I387 WeakPolarHBondContact CA-O 3.49Å; R382-I387 WeakPolarHBondContact CD-O 3.15Å; V383-I387 HydrophobicContact CB-CG2 3.94Å; V383-I387 HydrophobicContact CG2-CG2 4.44Å; V383-I387 PolarHBondContact N-O 3.26Å; V383-I387 PolarHBondContact O-N 2.84Å; I387-V389 HydrophobicContact CD1-CG2 3.79Å; I387-V389 HydrophobicContact CG1-CG2 3.85Å; I387-V389 WeakPolarHBondContact CG2-O 3.24Å; I387-D395 WeakPolarHBondContact CD1-OD2 3.4Å; I387-L398 HydrophobicContact CB-CD2 4.24Å; I387-L398 HydrophobicContact CD1-CD2 4.01Å; I387-I407 HydrophobicContact CB-CG2 4.48Å; I387-I407 HydrophobicContact CG2-CG2 3.61Å; I387-L411 HydrophobicContact CD1-CD1 4.17Å; I387-L411 HydrophobicContact CD1-CD2 3.98Å
388	G	97.1	Very high	96.3	Very high	21 Å²	21	35.6 Å²	35.6	22%	0.216	19%	0.189	C	C	.	.	S	Bend	trans	-86.4	-15.7	-177.8	0	0	0	0	0	115.2	P309	P309-G388 WeakPolarHBondContact CD-O 3.49Å
389	V	97.8	Very high	96.5	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.055	19%	0.189	C	C	.	.			trans	-112.2	154.7	175.7	-65.7	0	0	0	0	110.9	T271 D289 I387 L411	T271-V389 HydrophobicContact CG2-CG1 4.2Å; D289-V389 HydrophobicContact CB-CG1 4.3Å; D289-V389 VanDerWaalsContact OD1-CG1 3.29Å; D289-V389 WeakPolarHBondContact OD1-CG1 3.47Å; D289-V389 WeakPolarHBondContact OD2-CG1 3.33Å; I387-V389 HydrophobicContact CD1-CG2 3.79Å; I387-V389 HydrophobicContact CG1-CG2 3.85Å; I387-V389 WeakPolarHBondContact CG2-O 3.24Å; V389-L411 HydrophobicContact CG2-CD1 4.31Å
390	T	98.4	Very high	96.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-115.7	-6.2	179.8	67	0	0	0	0	113.1	F307 T308 P309 E312 R315 L316 V383 L411 S412	F307-T390 PolarHBondContact O-N 3.23Å; F307-T390 PolarHBondContact O-OG1 3.44Å; T308-T390 WeakPolarHBondContact O-CG2 3.48Å; P309-T390 HydrophobicContact CB-CG2 4.39Å; P309-T390 HydrophobicContact CG-CG2 4.18Å; E312-T390 HydrophobicContact CB-CG2 4.27Å; E312-T390 WeakPolarHBondContact CG-OG1 3.45Å; R315-T390 PolarHBondContact NH2-O 3.47Å; R315-T390 VanDerWaalsContact NH2-O 3.09Å; L316-T390 HydrophobicContact CD1-CG2 3.8Å; L316-T390 HydrophobicContact CD2-CG2 4.48Å; V383-T390 HydrophobicContact CG2-CG2 3.79Å; T390-L411 WeakPolarHBondContact O-CA 3.27Å; T390-S412 PolarHBondContact O-N 3.05Å
391	R	98.8	Very high	96.7	Very high	34 Å²	34	31.3 Å²	31.3	13%	0.128	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-135.9	148.9	172	-56.2	-171.3	-171.6	-167.9	14.1	111.2	A287 G288 F307 E312 S412 C414	A287-R391 HydrophobicContact CB-CB 4.07Å; G288-R391 WeakPolarHBondContact CA-O 3.47Å; F307-R391 HydrophobicContact CB-CB 4Å; F307-R391 HydrophobicContact CB-CG 3.82Å; F307-R391 HydrophobicContact CD1-CG 4.33Å; F307-R391 VanDerWaalsContact CD1-NE 3.33Å; F307-R391 HydrophobicContact CD2-CG 4.5Å; F307-R391 VanDerWaalsContact CE1-CZ 3.4Å; F307-R391 HydrophobicContact CG-CB 4.31Å; F307-R391 HydrophobicContact CG-CG 3.96Å; E312-R391 VanDerWaalsContact CD-NH2 3.29Å; E312-R391 IonicContact OE1-CZ 3.09Å; E312-R391 IonicContact OE1-NH2 3.54Å; E312-R391 PolarHBondContact OE1-NH2 2.82Å; E312-R391 IonicContact OE2-CZ 2.96Å; E312-R391 VanDerWaalsContact OE2-CZ 3.32Å; E312-R391 IonicContact OE2-NE 2.69Å; E312-R391 PolarHBondContact OE2-NE 2.95Å; E312-R391 IonicContact OE2-NH2 3.12Å; E312-R391 PolarHBondContact OE2-NH2 3.18Å; R391-S412 CarbonylContact C-O 3.51Å; R391-S412 WeakPolarHBondContact CA-O 3.32Å; R391-S412 VanDerWaalsContact CB-O 3.27Å; R391-S412 WeakPolarHBondContact CB-O 3.3Å; R391-C414 WeakPolarHBondContact CD-O 3.27Å; R391-C414 PolarHBondContact NH1-O 2.68Å; R391-C414 VanDerWaalsContact NH1-O 3.17Å
392	G	98.5	Very high	96.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.01	19%	0.188	C	C	.	.			trans	152.9	178.4	-176.8	0	0	0	0	0	112.7	C270 S412 C413	C270-G392 CarbonylContact O-C 3.57Å; C270-G392 WeakPolarHBondContact O-CA 3.36Å; G392-S412 PolarHBondContact N-O 3.2Å; G392-C413 VanDerWaalsContact O-CA 3.31Å; G392-C413 WeakPolarHBondContact O-CA 3.44Å
393	F	98.8	Very high	96.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	160.2	176.1	-57.5	-47.4	0	0	0	112.3	F147 A159 L163 F250 M253 D254 I257 G269 C270 A272 C413	F147-F393 HydrophobicContact CE1-CE2 4.22Å; A159-F393 HydrophobicContact CB-CD2 3.94Å; A159-F393 HydrophobicContact CB-CE2 4.22Å; L163-F393 HydrophobicContact CD1-CZ 4.13Å; L163-F393 HydrophobicContact CD2-CE2 4.03Å; L163-F393 HydrophobicContact CD2-CZ 4.15Å; F250-F393 HydrophobicContact CB-CE1 3.89Å; F250-F393 HydrophobicContact CB-CZ 4.1Å; F250-F393 AromaticContact CD1-CE1 3.51Å; F250-F393 HydrophobicContact CD1-CE1 3.51Å; F250-F393 HydrophobicContact CD1-CE2 4.3Å; F250-F393 AromaticContact CD1-CZ 3.24Å; F250-F393 HydrophobicContact CD1-CZ 3.24Å; F250-F393 HydrophobicContact CD2-CZ 4.34Å; F250-F393 HydrophobicContact CE1-CE1 4.31Å; F250-F393 HydrophobicContact CE1-CE2 4.36Å; F250-F393 AromaticContact CE1-CZ 3.67Å; F250-F393 HydrophobicContact CE1-CZ 3.67Å; F250-F393 AromaticContact CG-CE1 3.89Å; F250-F393 HydrophobicContact CG-CE1 3.89Å; F250-F393 AromaticContact CG-CZ 3.64Å; F250-F393 HydrophobicContact CG-CZ 3.64Å; F250-F393 HydrophobicContact CZ-CZ 4.38Å; F250-F393 VanDerWaalsContact O-CE1 3.27Å; F250-F393 WeakPolarHBondContact O-CE1 3.48Å; M253-F393 HydrophobicContact CB-CE1 4.24Å; M253-F393 HydrophobicContact CB-CZ 4.2Å; M253-F393 HydrophobicContact CG-CD2 4.41Å; M253-F393 HydrophobicContact CG-CE1 4.44Å; M253-F393 HydrophobicContact CG-CE2 4.14Å; M253-F393 HydrophobicContact CG-CZ 4.14Å; D254-F393 HydrophobicContact CB-CD1 3.92Å; D254-F393 WeakPolarHBondContact OD1-CA 3.23Å; I257-F393 HydrophobicContact CD1-CB 3.74Å; I257-F393 HydrophobicContact CD1-CG 4.31Å; G269-F393 CarbonylContact C-O 3.58Å; G269-F393 WeakPolarHBondContact CA-O 3.28Å; C270-F393 PolarHBondContact N-O 2.96Å; C270-F393 PolarHBondContact O-N 3.37Å; A272-F393 HydrophobicContact CB-CD2 3.92Å; A272-F393 HydrophobicContact CB-CE2 3.4Å; A272-F393 HydrophobicContact CB-CZ 4.05Å; F393-C413 HydrophobicContact CD1-CB 3.85Å; F393-C413 HydrophobicContact CE1-CB 4.07Å
394	G	98.3	Very high	95.9	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.2	-151.2	173.2	0	0	0	0	0	112.7	D254 H396 K408	D254-G394 PolarHBondContact OD1-N 3.28Å; G394-H396 PolarHBondContact O-N 3.42Å; G394-K408 WeakPolarHBondContact O-CE 3.17Å; G394-K408 PolarHBondContact O-NZ 3.29Å
395	D	97.8	Very high	95.9	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.07	22%	0.217	C	C	.	.			trans	54.9	23	-177.5	-68.2	-49.6	0	0	0	115.6	H150 G268 I387 N397 L398 L411	H150-D395 IonicContact CD2-OD2 3.41Å; H150-D395 IonicContact CE1-OD2 2.71Å; H150-D395 PolarHBondContact CE1-OD2 3.11Å; H150-D395 IonicContact NE2-OD1 2.71Å; H150-D395 IonicContact NE2-OD2 2.85Å; H150-D395 PolarHBondContact NE2-OD2 3.2Å; G268-D395 PolarHBondContact O-N 2.9Å; G268-D395 VanDerWaalsContact O-N 3.09Å; I387-D395 WeakPolarHBondContact CD1-OD2 3.4Å; D395-N397 PolarHBondContact O-N 3.42Å; D395-N397 VanDerWaalsContact O-N 3.08Å; D395-L398 HydrophobicContact CB-CB 3.79Å; D395-L398 HydrophobicContact CB-CD2 4.04Å; D395-L398 VanDerWaalsContact O-CB 3.3Å; D395-L398 WeakPolarHBondContact O-CB 3.18Å; D395-L398 PolarHBondContact O-N 3.25Å; D395-L411 HydrophobicContact CB-CD2 3.61Å
396	H	97.1	Very high	96	Very high	22 Å²	22	43.9 Å²	43.9	10%	0.102	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.3	-176.5	-74	-73.8	0	0	0	114.1	D254 E258 K261 G394 K408	D254-H396 PolarHBondContact O-NE2 3.46Å; D254-H396 IonicContact OD1-CE1 3.43Å; D254-H396 IonicContact OD1-NE2 2.68Å; D254-H396 PolarHBondContact OD1-NE2 2.93Å; D254-H396 VanDerWaalsContact OD1-NE2 3.09Å; D254-H396 IonicContact OD2-CE1 3.32Å; D254-H396 PolarHBondContact OD2-CE1 3.36Å; D254-H396 IonicContact OD2-NE2 3.47Å; E258-H396 HydrophobicContact CG-CB 4.11Å; E258-H396 IonicContact OE1-ND1 2.88Å; E258-H396 IonicContact OE2-CE1 2.91Å; E258-H396 IonicContact OE2-ND1 3.94Å; K261-H396 HydrophobicContact CD-CB 4.35Å; G394-H396 PolarHBondContact O-N 3.42Å; H396-K408 VanDerWaalsContact CE1-CE 3.44Å; H396-K408 WeakPolarHBondContact CE1-CE 3.41Å; H396-K408 PolarHBondContact CE1-NZ 2.94Å; H396-K408 VanDerWaalsContact ND1-CE 3.29Å; H396-K408 WeakPolarHBondContact ND1-CE 2.99Å
397	N	94.6	Very high	96	Very high	101 Å²	101	41.9 Å²	41.9	54%	0.54	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	3.9	175.2	-76.7	-11.1	0	0	0	113.4	K261 D395 R399	K261-N397 PolarHBondContact NZ-ND2 2.64Å; K261-N397 PolarHBondContact NZ-OD1 2.87Å; D395-N397 PolarHBondContact O-N 3.42Å; D395-N397 VanDerWaalsContact O-N 3.08Å; N397-R399 PolarHBondContact O-N 2.77Å
398	L	96.6	Very high	96.1	Very high	50 Å²	50	43.4 Å²	43.4	26%	0.262	22%	0.215	S	C	.	.			trans	-67.5	127.4	-176.4	-174.8	64.1	0	0	0	109.8	T386 I387 D395 I407	T386-L398 HydrophobicContact CG2-CD1 4.08Å; T386-L398 HydrophobicContact CG2-CD2 4.09Å; T386-L398 HydrophobicContact CG2-CG 4.04Å; I387-L398 HydrophobicContact CB-CD2 4.24Å; I387-L398 HydrophobicContact CD1-CD2 4.01Å; D395-L398 HydrophobicContact CB-CB 3.79Å; D395-L398 HydrophobicContact CB-CD2 4.04Å; D395-L398 VanDerWaalsContact O-CB 3.3Å; D395-L398 WeakPolarHBondContact O-CB 3.18Å; D395-L398 PolarHBondContact O-N 3.25Å; L398-I407 HydrophobicContact CB-CB 4.41Å; L398-I407 HydrophobicContact CB-CG1 4.21Å; L398-I407 HydrophobicContact CD2-CB 4.22Å; L398-I407 HydrophobicContact CD2-CG1 3.79Å; L398-I407 HydrophobicContact CD2-CG2 4.41Å; L398-I407 HydrophobicContact CG-CB 4.31Å; L398-I407 HydrophobicContact CG-CG1 3.67Å; L398-I407 PolarHBondContact O-N 2.95Å
399	R	96.8	Very high	96.1	Very high	108 Å²	108	45.1 Å²	45.1	41%	0.408	22%	0.223	S	C	.	.	B	Isolated β-bridge	trans	-124.4	154.8	-179.7	-63.7	173.8	-146.8	177.5	4.6	109.9	N397 H401 I405 Y406	N397-R399 PolarHBondContact O-N 2.77Å; R399-H401 PolarHBondContact O-N 3.42Å; R399-I405 CarbonylContact C-O 3.6Å; R399-I405 WeakPolarHBondContact CA-O 3.42Å; R399-I405 WeakPolarHBondContact CB-O 3.09Å; R399-Y406 HydrophobicContact CG-CD1 3.78Å; R399-Y406 HydrophobicContact CG-CD2 4.42Å; R399-Y406 HydrophobicContact CG-CE1 3.79Å; R399-Y406 HydrophobicContact CG-CE2 4.43Å; R399-Y406 HydrophobicContact CG-CG 4.12Å; R399-Y406 VanDerWaalsContact CZ-OH 3.24Å; R399-Y406 PolarHBondContact NE-OH 2.92Å; R399-Y406 PolarHBondContact NH2-OH 2.88Å; R399-Y406 VanDerWaalsContact NH2-OH 3.13Å
400	V	95.8	Very high	96.1	Very high	13 Å²	13	44.8 Å²	44.8	8%	0.079	22%	0.22	C	C	.	.			trans	-57.8	133.3	165.8	179.8	0	0	0	0	108.9	F331 L384 T386 D402 S403 I405 I407	F331-V400 HydrophobicContact CE2-CG1 4.11Å; F331-V400 HydrophobicContact CE2-CG2 4.45Å; F331-V400 HydrophobicContact CZ-CG1 3.88Å; L384-V400 HydrophobicContact CB-CG2 3.51Å; L384-V400 HydrophobicContact CD1-CG2 3.88Å; L384-V400 HydrophobicContact CG-CG2 4.25Å; T386-V400 WeakPolarHBondContact OG1-CA 3.37Å; V400-D402 PolarHBondContact O-N 2.82Å; V400-S403 PolarHBondContact O-N 2.89Å; V400-I405 HydrophobicContact CB-CB 4.27Å; V400-I405 HydrophobicContact CG2-CB 3.91Å; V400-I405 HydrophobicContact CG2-CG2 3.84Å; V400-I405 PolarHBondContact N-O 3.45Å; V400-I407 HydrophobicContact CG2-CD1 3.85Å
401	H	88.4	Confident	96.1	Very high	116 Å²	116	45 Å²	45	54%	0.537	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	131.2	-179.9	-176.5	-75.4	0	0	0	111.6	A8 R399 S403	A8-H401 HydrophobicContact CB-CB 4.33Å; R399-H401 PolarHBondContact O-N 3.42Å; H401-S403 PolarHBondContact O-N 2.96Å
402	D	87.9	Confident	96.1	Very high	115 Å²	115	44.8 Å²	44.8	62%	0.615	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	24.7	-176.5	-67.5	-28.1	0	0	0	115.7	V400	V400-D402 PolarHBondContact O-N 2.82Å
403	S	92.1	Very high	96.1	Very high	19 Å²	19	45.4 Å²	45.4	13%	0.133	23%	0.229	C	C	.	.	S	Bend	trans	-134.2	166.1	177.6	-176.8	0	0	0	0	112.2	E330 V400 H401 I405	E330-S403 PolarHBondContact OE1-OG 3.29Å; V400-S403 PolarHBondContact O-N 2.89Å; H401-S403 PolarHBondContact O-N 2.96Å; S403-I405 VanDerWaalsContact C-N 3.34Å; S403-I405 WeakPolarHBondContact OG-CD1 3.35Å; S403-I405 WeakPolarHBondContact OG-CG1 3.19Å; S403-I405 PolarHBondContact OG-N 3.28Å
404	N	92.9	Very high	96.1	Very high	135 Å²	135	47.4 Å²	47.4	72%	0.722	24%	0.243	S	C	*	.	S	Bend	trans	-96.5	11.5	173.1	-70.3	-37.4	0	0	0	112.4	Y406	N404-Y406 WeakPolarHBondContact O-CD2 3.45Å
405	I	96.9	Very high	96.1	Very high	11 Å²	11	47.6 Å²	47.6	6%	0.056	24%	0.244	C	C	.	.			trans	-80.8	120.2	176.3	-62.6	163.5	0	0	0	108.7	L326 L327 E330 F331 L384 R399 V400 S403	L326-I405 VanDerWaalsContact O-CG2 3.24Å; L326-I405 WeakPolarHBondContact O-CG2 3.11Å; L327-I405 WeakPolarHBondContact O-CD1 3.07Å; E330-I405 HydrophobicContact CB-CD1 4.17Å; E330-I405 HydrophobicContact CG-CD1 4.3Å; F331-I405 HydrophobicContact CD2-CD1 3.75Å; F331-I405 HydrophobicContact CE2-CD1 3.72Å; L384-I405 HydrophobicContact CD1-CG2 3.79Å; R399-I405 CarbonylContact C-O 3.6Å; R399-I405 WeakPolarHBondContact CA-O 3.42Å; R399-I405 WeakPolarHBondContact CB-O 3.09Å; V400-I405 HydrophobicContact CB-CB 4.27Å; V400-I405 HydrophobicContact CG2-CB 3.91Å; V400-I405 HydrophobicContact CG2-CG2 3.84Å; V400-I405 PolarHBondContact N-O 3.45Å; S403-I405 VanDerWaalsContact C-N 3.34Å; S403-I405 WeakPolarHBondContact OG-CD1 3.35Å; S403-I405 WeakPolarHBondContact OG-CG1 3.19Å; S403-I405 PolarHBondContact OG-N 3.28Å
406	Y	97.4	Very high	96.1	Very high	101 Å²	101	50 Å²	50	40%	0.396	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-83.3	149.2	174.8	-72.8	-96.2	0	0	0	111.1	R399 N404	R399-Y406 HydrophobicContact CG-CD1 3.78Å; R399-Y406 HydrophobicContact CG-CD2 4.42Å; R399-Y406 HydrophobicContact CG-CE1 3.79Å; R399-Y406 HydrophobicContact CG-CE2 4.43Å; R399-Y406 HydrophobicContact CG-CG 4.12Å; R399-Y406 VanDerWaalsContact CZ-OH 3.24Å; R399-Y406 PolarHBondContact NE-OH 2.92Å; R399-Y406 PolarHBondContact NH2-OH 2.88Å; R399-Y406 VanDerWaalsContact NH2-OH 3.13Å; N404-Y406 WeakPolarHBondContact O-CD2 3.45Å
407	I	98	Very high	96.2	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-75.6	-42.4	177.4	-61.4	-51.9	0	0	0	111.4	L384 T386 I387 L398 V400 F410 L411	L384-I407 HydrophobicContact CB-CD1 4.1Å; L384-I407 HydrophobicContact CD1-CD1 3.97Å; T386-I407 HydrophobicContact CG2-CD1 3.86Å; T386-I407 HydrophobicContact CG2-CG1 3.94Å; I387-I407 HydrophobicContact CB-CG2 4.48Å; I387-I407 HydrophobicContact CG2-CG2 3.61Å; L398-I407 HydrophobicContact CB-CB 4.41Å; L398-I407 HydrophobicContact CB-CG1 4.21Å; L398-I407 HydrophobicContact CD2-CB 4.22Å; L398-I407 HydrophobicContact CD2-CG1 3.79Å; L398-I407 HydrophobicContact CD2-CG2 4.41Å; L398-I407 HydrophobicContact CG-CB 4.31Å; L398-I407 HydrophobicContact CG-CG1 3.67Å; L398-I407 PolarHBondContact O-N 2.95Å; V400-I407 HydrophobicContact CG2-CD1 3.85Å; I407-F410 WeakPolarHBondContact O-CA 3.36Å; I407-F410 VanDerWaalsContact O-CB 3.25Å; I407-F410 WeakPolarHBondContact O-CB 3.46Å; I407-F410 PolarHBondContact O-N 3.15Å; I407-L411 HydrophobicContact CG2-CB 4Å
408	K	97.9	Very high	96.4	Very high	42 Å²	42	48.7 Å²	48.7	18%	0.183	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	135.7	166.4	-69.6	-169.2	-172.4	-107.8	0	108.7	D254 G394 H396 L411	D254-K408 VanDerWaalsContact CG-NZ 3.29Å; D254-K408 IonicContact OD1-NZ 2.71Å; D254-K408 PolarHBondContact OD1-NZ 3.46Å; D254-K408 VanDerWaalsContact OD1-NZ 3.12Å; D254-K408 IonicContact OD2-NZ 3.35Å; D254-K408 PolarHBondContact OD2-NZ 2.93Å; G394-K408 WeakPolarHBondContact O-CE 3.17Å; G394-K408 PolarHBondContact O-NZ 3.29Å; H396-K408 VanDerWaalsContact CE1-CE 3.44Å; H396-K408 WeakPolarHBondContact CE1-CE 3.41Å; H396-K408 PolarHBondContact CE1-NZ 2.94Å; H396-K408 VanDerWaalsContact ND1-CE 3.29Å; H396-K408 WeakPolarHBondContact ND1-CE 2.99Å; K408-L411 HydrophobicContact CG-CB 4.31Å
409	P	97.6	Very high	96.5	Very high	57 Å²	57	48.1 Å²	48.1	37%	0.37	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	cis	-95.5	11.9	16.1	34.3	-32.3	0	0	0	116.7	L319 L326 L411	L319-P409 HydrophobicContact CD2-CB 4.36Å; L319-P409 HydrophobicContact CD2-CG 4.13Å; L326-P409 HydrophobicContact CD1-CG 3.55Å; L326-P409 HydrophobicContact CD2-CG 4.3Å; P409-L411 VanDerWaalsContact C-N 3.31Å; P409-L411 PolarHBondContact O-N 3.32Å
410	F	98.4	Very high	96.6	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-35.6	176.8	-64.7	-71.7	0	0	0	112.6	R315 L316 L319 A320 L326 L327 L373 V383 L384 I407	R315-F410 PolarHBondContact NH1-O 3.01Å; R315-F410 PolarHBondContact NH2-O 3.09Å; R315-F410 VanDerWaalsContact NH2-O 3.11Å; L316-F410 HydrophobicContact CD2-CB 3.86Å; L316-F410 HydrophobicContact CD2-CD1 3.96Å; L316-F410 HydrophobicContact CD2-CG 4.39Å; L316-F410 WeakPolarHBondContact CD2-O 3.31Å; L319-F410 HydrophobicContact CB-CE1 4.23Å; L319-F410 HydrophobicContact CD2-CD1 3.75Å; L319-F410 HydrophobicContact CD2-CE1 4Å; L319-F410 HydrophobicContact CD2-CG 4.37Å; L319-F410 HydrophobicContact CG-CD1 4.25Å; L319-F410 HydrophobicContact CG-CE1 3.98Å; A320-F410 HydrophobicContact CB-CE1 3.81Å; A320-F410 HydrophobicContact CB-CZ 3.98Å; L326-F410 HydrophobicContact CB-CE2 3.89Å; L326-F410 HydrophobicContact CB-CZ 3.97Å; L326-F410 HydrophobicContact CD1-CE2 4.43Å; L326-F410 HydrophobicContact CD1-CZ 4.28Å; L327-F410 HydrophobicContact CD2-CZ 4.02Å; L373-F410 HydrophobicContact CD1-CD1 4.26Å; L373-F410 HydrophobicContact CD1-CE1 3.96Å; L373-F410 HydrophobicContact CD1-CE2 4.27Å; L373-F410 HydrophobicContact CD1-CZ 3.96Å; L373-F410 HydrophobicContact CD2-CE1 4.12Å; V383-F410 HydrophobicContact CG1-CB 3.88Å; V383-F410 HydrophobicContact CG1-CG 4.25Å; L384-F410 HydrophobicContact CD1-CD2 3.88Å; L384-F410 HydrophobicContact CD1-CE2 4Å; I407-F410 WeakPolarHBondContact O-CA 3.36Å; I407-F410 VanDerWaalsContact O-CB 3.25Å; I407-F410 WeakPolarHBondContact O-CB 3.46Å; I407-F410 PolarHBondContact O-N 3.15Å
411	L	98.6	Very high	96.6	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.026	23%	0.231	C	C	.	.	S	Bend	trans	-80.6	113.7	168.5	-179.9	67.9	0	0	0	110.5	I387 V389 T390 D395 I407 K408 P409	I387-L411 HydrophobicContact CD1-CD1 4.17Å; I387-L411 HydrophobicContact CD1-CD2 3.98Å; V389-L411 HydrophobicContact CG2-CD1 4.31Å; T390-L411 WeakPolarHBondContact O-CA 3.27Å; D395-L411 HydrophobicContact CB-CD2 3.61Å; I407-L411 HydrophobicContact CG2-CB 4Å; K408-L411 HydrophobicContact CG-CB 4.31Å; P409-L411 VanDerWaalsContact C-N 3.31Å; P409-L411 PolarHBondContact O-N 3.32Å
412	S	98.5	Very high	96.9	Very high	29 Å²	29	38.9 Å²	38.9	20%	0.203	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-104.5	138.5	-179.5	-177.7	0	0	0	0	112.2	T390 R391 G392 C414	T390-S412 PolarHBondContact O-N 3.05Å; R391-S412 CarbonylContact C-O 3.51Å; R391-S412 WeakPolarHBondContact CA-O 3.32Å; R391-S412 VanDerWaalsContact CB-O 3.27Å; R391-S412 WeakPolarHBondContact CB-O 3.3Å; G392-S412 PolarHBondContact N-O 3.2Å; S412-C414 VanDerWaalsContact C-N 3.3Å; S412-C414 PolarHBondContact OG-N 3.43Å
413	C	98.6	Very high	97.1	Very high	14 Å²	14	36.1 Å²	36.1	10%	0.095	20%	0.195	C	C	.	.			trans	-82	-5.6	171.3	59.5	0	0	0	0	113.7	F250 D254 G392 F393	F250-C413 VanDerWaalsContact CD1-O 3.29Å; F250-C413 WeakPolarHBondContact CD1-O 3.47Å; D254-C413 HydrophobicContact CB-CB 3.56Å; G392-C413 VanDerWaalsContact O-CA 3.31Å; G392-C413 WeakPolarHBondContact O-CA 3.44Å; F393-C413 HydrophobicContact CD1-CB 3.85Å; F393-C413 HydrophobicContact CE1-CB 4.07Å
414	C	98.1	Very high	97.2	Very high	42 Å²	42	42 Å²	42	28%	0.284	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-73.3	123.3	-173.8	-64.4	0	0	0	0	111.7	R391 S412	R391-C414 WeakPolarHBondContact CD-O 3.27Å; R391-C414 PolarHBondContact NH1-O 2.68Å; R391-C414 VanDerWaalsContact NH1-O 3.17Å; S412-C414 VanDerWaalsContact C-N 3.3Å; S412-C414 PolarHBondContact OG-N 3.43Å
415	P	98.6	Very high	97.1	Very high	6 Å²	6	39.1 Å²	39.1	4%	0.039	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-75.8	158.9	178.5	32.4	-34.1	0	0	0	111.7	I246 E247 F250 N286 A287 V417	I246-P415 HydrophobicContact CG2-CG 4.35Å; E247-P415 HydrophobicContact CG-CG 4.34Å; F250-P415 HydrophobicContact CB-CG 4.16Å; F250-P415 HydrophobicContact CD1-CB 3.83Å; F250-P415 HydrophobicContact CD1-CG 3.74Å; F250-P415 HydrophobicContact CD2-CB 4.47Å; F250-P415 HydrophobicContact CD2-CG 3.81Å; F250-P415 HydrophobicContact CE1-CB 3.68Å; F250-P415 HydrophobicContact CE1-CG 4.01Å; F250-P415 HydrophobicContact CE2-CB 4.33Å; F250-P415 HydrophobicContact CE2-CG 4.07Å; F250-P415 HydrophobicContact CG-CB 4.24Å; F250-P415 HydrophobicContact CG-CG 3.63Å; F250-P415 HydrophobicContact CZ-CB 3.94Å; F250-P415 HydrophobicContact CZ-CG 4.17Å; N286-P415 CarbonylContact O-C 3.52Å; N286-P415 VanDerWaalsContact O-CA 3.22Å; N286-P415 WeakPolarHBondContact O-CA 3.22Å; A287-P415 HydrophobicContact CB-CB 4.47Å; P415-V417 HydrophobicContact CB-CG2 4.49Å; P415-V417 HydrophobicContact CG-CG2 4.2Å
416	E	98.5	Very high	96.9	Very high	64 Å²	64	47.4 Å²	47.4	30%	0.299	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.6	151.2	174.8	179.5	112.2	0	0	108.3	G285 N286 F307 R418	G285-E416 CarbonylContact C-O 3.45Å; G285-E416 WeakPolarHBondContact CA-O 3.43Å; N286-E416 PolarHBondContact N-O 3.48Å; N286-E416 PolarHBondContact O-N 3.46Å; F307-E416 HydrophobicContact CE2-CB 3.97Å; F307-E416 HydrophobicContact CZ-CB 3.46Å; F307-E416 VanDerWaalsContact CZ-CB 3.46Å; F307-E416 HydrophobicContact CZ-CG 4.4Å; E416-R418 IonicContact OE1-CZ 2.83Å; E416-R418 VanDerWaalsContact OE1-CZ 3.31Å; E416-R418 IonicContact OE1-NE 3.04Å; E416-R418 PolarHBondContact OE1-NE 3.01Å; E416-R418 IonicContact OE1-NH2 2.57Å; E416-R418 PolarHBondContact OE1-NH2 2.88Å
417	V	98.7	Very high	96.8	Very high	22 Å²	22	43.4 Å²	43.4	13%	0.133	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.3	177.3	-172.8	0	0	0	0	110.1	I243 I246 E247 Y283 V284 P415	I243-V417 HydrophobicContact CG1-CB 4.32Å; I243-V417 HydrophobicContact CG1-CG1 3.99Å; I243-V417 HydrophobicContact CG2-CB 4.08Å; I243-V417 HydrophobicContact CG2-CG2 4.26Å; I246-V417 HydrophobicContact CB-CG2 4.38Å; I246-V417 HydrophobicContact CD1-CG1 4.28Å; I246-V417 HydrophobicContact CG2-CG2 3.91Å; E247-V417 HydrophobicContact CG-CG2 4.44Å; Y283-V417 HydrophobicContact CD1-CG1 4.46Å; V284-V417 CarbonylContact O-C 3.5Å; V284-V417 WeakPolarHBondContact O-CA 3.25Å; P415-V417 HydrophobicContact CB-CG2 4.49Å; P415-V417 HydrophobicContact CG-CG2 4.2Å
418	R	98.6	Very high	96.6	Very high	73 Å²	73	45.2 Å²	45.2	28%	0.275	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	145.6	170.4	-63.8	-167.3	-174.7	-176.1	-5	110.6	V284 P302 M303 S305 E416	V284-R418 PolarHBondContact N-O 3.05Å; V284-R418 PolarHBondContact O-N 2.97Å; P302-R418 PolarHBondContact O-NH1 2.73Å; M303-R418 HydrophobicContact CE-CB 3.93Å; M303-R418 WeakPolarHBondContact O-CD 3.35Å; S305-R418 PolarHBondContact OG-NH2 3.23Å; E416-R418 IonicContact OE1-CZ 2.83Å; E416-R418 VanDerWaalsContact OE1-CZ 3.31Å; E416-R418 IonicContact OE1-NE 3.04Å; E416-R418 PolarHBondContact OE1-NE 3.01Å; E416-R418 IonicContact OE1-NH2 2.57Å; E416-R418 PolarHBondContact OE1-NH2 2.88Å
419	V	98.5	Very high	96.4	Very high	38 Å²	38	44.3 Å²	44.3	23%	0.23	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.7	-178.6	-170.9	0	0	0	0	109.9	E239 I243 K281 L282 Y283	E239-V419 HydrophobicContact CG-CB 4.47Å; E239-V419 HydrophobicContact CG-CG1 4.21Å; E239-V419 HydrophobicContact CG-CG2 3.9Å; I243-V419 HydrophobicContact CD1-CG2 4Å; I243-V419 HydrophobicContact CG1-CG2 4.27Å; K281-V419 HydrophobicContact CB-CG1 4.1Å; K281-V419 HydrophobicContact CD-CG1 3.97Å; K281-V419 HydrophobicContact CG-CG1 4.43Å; L282-V419 CarbonylContact O-C 3.41Å; L282-V419 WeakPolarHBondContact O-CA 3.22Å; Y283-V419 HydrophobicContact CD1-CG1 4.29Å; Y283-V419 HydrophobicContact CD1-CG2 3.64Å; Y283-V419 HydrophobicContact CE1-CG1 4.11Å; Y283-V419 HydrophobicContact CE1-CG2 3.83Å
420	Y	97.8	Very high	96.3	Very high	10 Å²	10	44.3 Å²	44.3	4%	0.039	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121	171.9	178.4	-100.1	0	0	0	109.6	K281 L282 I294 R296 I301 L422 F425 H427	K281-Y420 WeakPolarHBondContact CA-O 3.31Å; L282-Y420 HydrophobicContact CD1-CD1 4.05Å; L282-Y420 HydrophobicContact CG-CD1 4.47Å; L282-Y420 PolarHBondContact N-O 3.36Å; L282-Y420 PolarHBondContact O-N 2.99Å; I294-Y420 HydrophobicContact CD1-CD1 3.7Å; I294-Y420 HydrophobicContact CD1-CD2 3.62Å; I294-Y420 HydrophobicContact CD1-CE1 3.98Å; I294-Y420 HydrophobicContact CD1-CE2 3.93Å; I294-Y420 HydrophobicContact CD1-CG 3.5Å; I294-Y420 VanDerWaalsContact CD1-CG 3.5Å; R296-Y420 VanDerWaalsContact CD-OH 3.31Å; R296-Y420 WeakPolarHBondContact CD-OH 3.47Å; R296-Y420 PolarHBondContact NH1-OH 3.48Å; I301-Y420 HydrophobicContact CD1-CE2 4.37Å; Y420-L422 VanDerWaalsContact C-N 3.28Å; Y420-L422 HydrophobicContact CD1-CB 4.22Å; Y420-L422 HydrophobicContact CD1-CD1 4.14Å; Y420-L422 HydrophobicContact CE1-CB 4.38Å; Y420-L422 HydrophobicContact CE1-CD1 3.82Å; Y420-L422 PolarHBondContact O-N 3.19Å; Y420-F425 HydrophobicContact CE1-CD2 4.35Å; Y420-F425 HydrophobicContact CE2-CD2 4.05Å; Y420-F425 AromaticContact CE2-CE2 3.97Å; Y420-F425 HydrophobicContact CE2-CE2 3.97Å; Y420-F425 AromaticContact CZ-CD2 3.68Å; Y420-F425 WeakPolarHBondContact OH-CD2 3.42Å; Y420-H427 AromaticContact CE1-CE1 3.9Å; Y420-H427 AromaticContact CE1-NE2 3.52Å; Y420-H427 AromaticContact CZ-NE2 3.54Å; Y420-H427 PolarHBondContact OH-NE2 3.48Å
421	P	95.9	Very high	96.2	Very high	33 Å²	33	45.3 Å²	45.3	21%	0.214	25%	0.246	C	C	.	.			trans	-80.5	77.7	-177.2	33.1	-33	0	0	0	110.5	S423 Q424 F425	P421-S423 VanDerWaalsContact C-N 3.33Å; P421-S423 PolarHBondContact O-N 3.3Å; P421-Q424 HydrophobicContact CB-CB 4.23Å; P421-Q424 HydrophobicContact CB-CG 3.93Å; P421-Q424 HydrophobicContact CG-CB 4.49Å; P421-Q424 WeakPolarHBondContact O-CB 3.41Å; P421-Q424 PolarHBondContact O-N 2.92Å; P421-F425 HydrophobicContact CG-CE2 3.8Å; P421-F425 WeakPolarHBondContact O-CD2 3.48Å
422	L	94.9	Very high	96.2	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-49.9	-48.4	-174.2	-170.2	63.9	0	0	0	112.9	W72 G280 L282 Y420 Q424 F425 H427 L508 N512	W72-L422 HydrophobicContact CH2-CD2 4.09Å; G280-L422 WeakPolarHBondContact O-CB 3.42Å; G280-L422 PolarHBondContact O-N 3.11Å; G280-L422 VanDerWaalsContact O-N 3.08Å; L282-L422 HydrophobicContact CD1-CD1 4.02Å; L282-L422 HydrophobicContact CD1-CD2 4.41Å; L282-L422 HydrophobicContact CD2-CD2 3.9Å; L282-L422 HydrophobicContact CG-CB 4.3Å; L282-L422 HydrophobicContact CG-CD1 4.32Å; L282-L422 HydrophobicContact CG-CD2 3.97Å; L282-L422 HydrophobicContact CG-CG 4.46Å; Y420-L422 VanDerWaalsContact C-N 3.28Å; Y420-L422 HydrophobicContact CD1-CB 4.22Å; Y420-L422 HydrophobicContact CD1-CD1 4.14Å; Y420-L422 HydrophobicContact CE1-CB 4.38Å; Y420-L422 HydrophobicContact CE1-CD1 3.82Å; Y420-L422 PolarHBondContact O-N 3.19Å; L422-Q424 PolarHBondContact O-N 3.42Å; L422-Q424 VanDerWaalsContact O-N 3.16Å; L422-F425 PolarHBondContact O-N 3.11Å; L422-H427 PolarHBondContact O-CE1 3.48Å; L422-H427 VanDerWaalsContact O-CE1 3.27Å; L422-L508 HydrophobicContact CD1-CB 4.07Å; L422-L508 HydrophobicContact CD1-CD2 3.92Å; L422-L508 HydrophobicContact CD1-CG 4.46Å; L422-N512 PolarHBondContact O-OD1 2.7Å
423	S	92.4	Very high	96.2	Very high	56 Å²	56	43.7 Å²	43.7	39%	0.392	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-69.7	-10.3	-177.5	60.3	0	0	0	0	114.9	G280 P421 F425	G280-S423 PolarHBondContact O-N 3.21Å; G280-S423 PolarHBondContact O-OG 3.24Å; P421-S423 VanDerWaalsContact C-N 3.33Å; P421-S423 PolarHBondContact O-N 3.3Å; S423-F425 VanDerWaalsContact C-N 3.33Å
424	Q	93.5	Very high	96.2	Very high	142 Å²	142	43 Å²	43	66%	0.664	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-86.1	-6.2	177.9	-63.9	-178.6	10	0	0	113.1	P421 L422	P421-Q424 HydrophobicContact CB-CB 4.23Å; P421-Q424 HydrophobicContact CB-CG 3.93Å; P421-Q424 HydrophobicContact CG-CB 4.49Å; P421-Q424 WeakPolarHBondContact O-CB 3.41Å; P421-Q424 PolarHBondContact O-N 2.92Å; L422-Q424 PolarHBondContact O-N 3.42Å; L422-Q424 VanDerWaalsContact O-N 3.16Å
425	F	92.5	Very high	96.3	Very high	75 Å²	75	41 Å²	41	33%	0.329	22%	0.217	S	C	.	.	S	Bend	trans	-128.2	144.4	-178.1	-57.2	-75.6	0	0	0	111	R296 Y420 P421 L422 S423 H427 N512	R296-F425 VanDerWaalsContact NH1-CE1 3.3Å; R296-F425 VanDerWaalsContact NH1-CE2 3.29Å; Y420-F425 HydrophobicContact CE1-CD2 4.35Å; Y420-F425 HydrophobicContact CE2-CD2 4.05Å; Y420-F425 AromaticContact CE2-CE2 3.97Å; Y420-F425 HydrophobicContact CE2-CE2 3.97Å; Y420-F425 AromaticContact CZ-CD2 3.68Å; Y420-F425 WeakPolarHBondContact OH-CD2 3.42Å; P421-F425 HydrophobicContact CG-CE2 3.8Å; P421-F425 WeakPolarHBondContact O-CD2 3.48Å; L422-F425 PolarHBondContact O-N 3.11Å; S423-F425 VanDerWaalsContact C-N 3.33Å; F425-H427 PolarHBondContact O-CE1 2.9Å; F425-H427 VanDerWaalsContact O-CE1 3.31Å; F425-H427 PolarHBondContact O-ND1 3.37Å; F425-H427 VanDerWaalsContact O-ND1 3.11Å; F425-N512 PolarHBondContact O-ND2 3.08Å
426	E	91.8	Very high	96.3	Very high	185 Å²	185	40.7 Å²	40.7	86%	0.864	22%	0.215	S	C	*	.			trans	-80.2	139.2	165.9	-67.9	-174.7	174.7	0	0	109.5
427	H	95.1	Very high	96.3	Very high	18 Å²	18	37.7 Å²	37.7	8%	0.083	20%	0.201	C	C	.	.			trans	-128.1	127.3	-178.2	-60.7	94.6	0	0	0	109.5	Y420 L422 F425 D431 L508 M509 N512	Y420-H427 AromaticContact CE1-CE1 3.9Å; Y420-H427 AromaticContact CE1-NE2 3.52Å; Y420-H427 AromaticContact CZ-NE2 3.54Å; Y420-H427 PolarHBondContact OH-NE2 3.48Å; L422-H427 PolarHBondContact O-CE1 3.48Å; L422-H427 VanDerWaalsContact O-CE1 3.27Å; F425-H427 PolarHBondContact O-CE1 2.9Å; F425-H427 VanDerWaalsContact O-CE1 3.31Å; F425-H427 PolarHBondContact O-ND1 3.37Å; F425-H427 VanDerWaalsContact O-ND1 3.11Å; H427-D431 VanDerWaalsContact CA-OD2 3.28Å; H427-D431 WeakPolarHBondContact CA-OD2 3.21Å; H427-D431 HydrophobicContact CB-CB 4.05Å; H427-L508 HydrophobicContact CB-CB 3.85Å; H427-M509 HydrophobicContact CB-CB 4.47Å; H427-M509 WeakPolarHBondContact O-CB 3.24Å; H427-N512 PolarHBondContact ND1-ND2 3.14Å
428	G	93.8	Very high	96.2	Very high	37 Å²	37	37.7 Å²	37.7	38%	0.381	20%	0.201	S	C	.	.			trans	-81.6	178.6	170.5	0	0	0	0	0	112.5	D430 D431	G428-D430 PolarHBondContact O-N 2.82Å; G428-D431 PolarHBondContact N-OD2 3.23Å; G428-D431 PolarHBondContact O-N 3.44Å
429	A	93.9	Very high	96.2	Very high	24 Å²	24	34.2 Å²	34.2	20%	0.198	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.9	178.6	0	0	0	0	0	113.9	P462 R467 Y468 M509	A429-P462 HydrophobicContact CB-CB 4.25Å; A429-R467 VanDerWaalsContact CB-NH1 3.31Å; A429-R467 PolarHBondContact O-NH1 2.83Å; A429-Y468 WeakPolarHBondContact O-CE1 3.32Å; A429-Y468 PolarHBondContact O-OH 3.26Å; A429-M509 HydrophobicContact CB-CE 4.28Å; A429-M509 HydrophobicContact CB-SD 3.82Å
430	D	95.9	Very high	96.2	Very high	56 Å²	56	32.4 Å²	32.4	30%	0.299	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-6.8	179.1	-61.5	-4.3	0	0	0	112	G428 V432 R467	G428-D430 PolarHBondContact O-N 2.82Å; D430-V432 PolarHBondContact O-N 3.33Å; D430-R467 IonicContact OD1-CZ 3.12Å; D430-R467 IonicContact OD1-NH1 3.86Å; D430-R467 PolarHBondContact OD1-NH1 3.02Å; D430-R467 IonicContact OD1-NH2 2.67Å; D430-R467 PolarHBondContact OD1-NH2 3.46Å
431	D	96.8	Very high	96.2	Very high	22 Å²	22	32.6 Å²	32.6	12%	0.118	18%	0.177	C	C	.	.			trans	-85.4	114.1	178.7	-60.7	-36.4	0	0	0	109.7	V295 R296 A297 H427 G428 L508	V295-D431 CarbonylContact O-C 3.57Å; V295-D431 VanDerWaalsContact O-CA 3.3Å; V295-D431 WeakPolarHBondContact O-CA 3.43Å; R296-D431 VanDerWaalsContact CA-OD1 3.23Å; R296-D431 WeakPolarHBondContact CA-OD1 3.39Å; R296-D431 HydrophobicContact CG-CB 4.37Å; A297-D431 PolarHBondContact N-OD1 3.12Å; H427-D431 VanDerWaalsContact CA-OD2 3.28Å; H427-D431 WeakPolarHBondContact CA-OD2 3.21Å; H427-D431 HydrophobicContact CB-CB 4.05Å; G428-D431 PolarHBondContact N-OD2 3.23Å; G428-D431 PolarHBondContact O-N 3.44Å; D431-L508 HydrophobicContact CB-CD1 4.48Å; D431-L508 WeakPolarHBondContact O-CB 3.47Å; D431-L508 PolarHBondContact O-N 2.73Å
432	V	98.3	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	149.7	-168.5	-63.6	0	0	0	0	112	I294 V295 D430 I434 V453 L457 Y468 I505 I506	I294-V432 WeakPolarHBondContact CA-O 3.44Å; V295-V432 HydrophobicContact CB-CG2 4.31Å; V295-V432 PolarHBondContact N-O 3.31Å; V295-V432 PolarHBondContact O-N 3.39Å; D430-V432 PolarHBondContact O-N 3.33Å; V432-I434 HydrophobicContact CG2-CD1 4.13Å; V432-I434 HydrophobicContact CG2-CG1 3.93Å; V432-V453 HydrophobicContact CG2-CG1 3.88Å; V432-L457 HydrophobicContact CG1-CD1 3.86Å; V432-L457 HydrophobicContact CG2-CD1 4.43Å; V432-Y468 HydrophobicContact CG1-CD1 4.02Å; V432-Y468 HydrophobicContact CG1-CE1 3.77Å; V432-I505 HydrophobicContact CB-CG2 3.94Å; V432-I505 HydrophobicContact CG1-CG2 3.85Å; V432-I505 HydrophobicContact CG2-CG2 4.22Å; V432-I506 CarbonylContact C-O 3.49Å; V432-I506 WeakPolarHBondContact CA-O 3.2Å
433	L	98.8	Very high	96.3	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.7	162.2	169.9	67.2	0	0	0	108.7	V275 L282 A292 I294 M303 L435 I506 L508	V275-L433 HydrophobicContact CB-CD2 4.34Å; V275-L433 HydrophobicContact CG1-CD2 3.74Å; V275-L433 HydrophobicContact CG2-CD2 3.7Å; L282-L433 HydrophobicContact CD1-CD2 4.19Å; A292-L433 HydrophobicContact CB-CD1 4.3Å; I294-L433 HydrophobicContact CG1-CB 4.11Å; I294-L433 HydrophobicContact CG1-CD1 3.72Å; I294-L433 HydrophobicContact CG1-CG 4.49Å; M303-L433 HydrophobicContact CB-CD1 4.44Å; M303-L433 HydrophobicContact CG-CD1 4.32Å; L433-L435 HydrophobicContact CD1-CD1 4.1Å; L433-L435 HydrophobicContact CD2-CD1 3.94Å; L433-L435 HydrophobicContact CG-CD1 3.6Å; L433-I506 HydrophobicContact CB-CB 4.29Å; L433-I506 HydrophobicContact CD2-CD1 4.18Å; L433-I506 PolarHBondContact N-O 3.49Å; L433-I506 PolarHBondContact O-N 3.32Å; L433-L508 HydrophobicContact CB-CD2 3.89Å
434	I	98.9	Very high	96.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.1	-179.2	-56	164.7	0	0	0	108.4	A292 I293 V295 V432 V449 V453 L475 Y504 I505	A292-I434 CarbonylContact C-O 3.57Å; A292-I434 VanDerWaalsContact CA-O 3.24Å; A292-I434 WeakPolarHBondContact CA-O 3.17Å; I293-I434 HydrophobicContact CD1-CD1 4.4Å; I293-I434 HydrophobicContact CG1-CB 4.09Å; I293-I434 HydrophobicContact CG1-CD1 4.33Å; I293-I434 PolarHBondContact N-O 2.7Å; I293-I434 PolarHBondContact O-N 3.41Å; V295-I434 HydrophobicContact CG2-CD1 3.83Å; V432-I434 HydrophobicContact CG2-CD1 4.13Å; V432-I434 HydrophobicContact CG2-CG1 3.93Å; I434-V449 HydrophobicContact CD1-CG1 3.91Å; I434-V449 HydrophobicContact CG2-CG1 4.08Å; I434-V453 HydrophobicContact CD1-CB 4.02Å; I434-V453 HydrophobicContact CD1-CG1 4.13Å; I434-V453 HydrophobicContact CD1-CG2 3.79Å; I434-L475 HydrophobicContact CG2-CD2 4.19Å; I434-Y504 WeakPolarHBondContact CA-O 3.3Å; I434-I505 HydrophobicContact CG1-CG1 4.49Å
435	L	98.8	Very high	96.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142.7	171.2	-69	58.9	0	0	0	108	L146 L273 V275 A292 L433 V503 Y504 I506	L146-L435 HydrophobicContact CD1-CB 3.7Å; L146-L435 HydrophobicContact CG-CB 4.37Å; L273-L435 HydrophobicContact CD2-CB 3.93Å; L273-L435 HydrophobicContact CD2-CD2 4.24Å; L273-L435 HydrophobicContact CD2-CG 3.9Å; L273-L435 HydrophobicContact CG-CD2 4.24Å; L273-L435 HydrophobicContact CG-CG 4.32Å; V275-L435 HydrophobicContact CG2-CD1 4Å; V275-L435 HydrophobicContact CG2-CD2 3.84Å; V275-L435 HydrophobicContact CG2-CG 4.27Å; A292-L435 HydrophobicContact CB-CD1 4.48Å; A292-L435 HydrophobicContact CB-CG 4.25Å; L433-L435 HydrophobicContact CD1-CD1 4.1Å; L433-L435 HydrophobicContact CD2-CD1 3.94Å; L433-L435 HydrophobicContact CG-CD1 3.6Å; L435-V503 VanDerWaalsContact O-CA 3.3Å; L435-V503 WeakPolarHBondContact O-CA 3.48Å; L435-Y504 HydrophobicContact CD2-CD2 4.22Å; L435-Y504 PolarHBondContact N-O 3.34Å; L435-Y504 PolarHBondContact O-N 2.93Å; L435-I506 HydrophobicContact CD1-CD1 3.91Å
436	G	98.8	Very high	97	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	152.9	168.8	0	0	0	0	0	113.2	R291 W441 S502	R291-G436 PolarHBondContact N-O 2.93Å; R291-G436 PolarHBondContact O-N 3.49Å; G436-W441 VanDerWaalsContact C-NE1 3.26Å; G436-W441 PolarHBondContact O-NE1 2.69Å; G436-S502 VanDerWaalsContact CA-O 3.24Å; G436-S502 WeakPolarHBondContact CA-O 3.5Å
437	T	98.8	Very high	97.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.133	C	C	.	.			trans	-73.5	169.1	165.8	52.6	0	0	0	0	111.3	D90 L146 D148 G439 L440 S502	D90-T437 WeakPolarHBondContact OD2-CG2 3.42Å; D90-T437 PolarHBondContact OD2-OG1 2.95Å; L146-T437 HydrophobicContact CB-CG2 4.22Å; L146-T437 HydrophobicContact CD1-CG2 4.33Å; D148-T437 HydrophobicContact CB-CG2 3.92Å; T437-G439 PolarHBondContact O-N 3.5Å; T437-G439 VanDerWaalsContact O-N 3.14Å; T437-L440 PolarHBondContact O-N 3.44Å; T437-S502 PolarHBondContact N-O 3.02Å; T437-S502 VanDerWaalsContact N-O 3.14Å; T437-S502 PolarHBondContact OG1-N 2.87Å
438	D	97.5	Very high	97.4	Very high	23 Å²	23	24.4 Å²	24.4	12%	0.123	14%	0.141	C	C	.	.	H	α-helix	trans	-59	-30.8	-171.8	77.4	-12.6	0	0	0	111.9	D148 L440 W441 D442	D148-D438 PolarHBondContact OD2-N 3.38Å; D148-D438 VanDerWaalsContact OD2-OD1 3.13Å; D438-L440 CarbonylContact O-C 3.59Å; D438-L440 PolarHBondContact O-N 2.9Å; D438-W441 PolarHBondContact O-N 3.38Å; D438-D442 WeakPolarHBondContact O-CB 3.39Å; D438-D442 PolarHBondContact O-N 3.34Å
439	G	97.9	Very high	97.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.5	-21.7	177.2	0	0	0	0	0	114.4	T437 S497 D500	T437-G439 PolarHBondContact O-N 3.5Å; T437-G439 VanDerWaalsContact O-N 3.14Å; G439-S497 WeakPolarHBondContact CA-OG 3.42Å; G439-S497 WeakPolarHBondContact O-CB 3.24Å; G439-S497 PolarHBondContact O-OG 3.21Å; G439-D500 WeakPolarHBondContact CA-O 3.47Å
440	L	98.6	Very high	97.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-79.3	-57.4	167.5	174.5	64.7	0	0	0	111.2	T437 D438 D442 V443 L444 V449 L475 A479 I501 V503	T437-L440 PolarHBondContact O-N 3.44Å; D438-L440 CarbonylContact O-C 3.59Å; D438-L440 PolarHBondContact O-N 2.9Å; L440-D442 PolarHBondContact O-N 3.07Å; L440-V443 WeakPolarHBondContact O-CG2 3.3Å; L440-V443 PolarHBondContact O-N 3.4Å; L440-L444 HydrophobicContact CD1-CD1 3.82Å; L440-L444 PolarHBondContact O-N 3.4Å; L440-L444 VanDerWaalsContact O-N 3.1Å; L440-V449 HydrophobicContact CD1-CG2 4.29Å; L440-V449 HydrophobicContact CD2-CG2 4.3Å; L440-V449 HydrophobicContact CG-CG2 4.34Å; L440-L475 HydrophobicContact CD1-CD1 4.17Å; L440-L475 HydrophobicContact CD1-CD2 4.02Å; L440-L475 HydrophobicContact CD1-CG 3.72Å; L440-L475 HydrophobicContact CD2-CD2 3.77Å; L440-L475 HydrophobicContact CD2-CG 4.41Å; L440-A479 HydrophobicContact CD1-CB 3.82Å; L440-I501 HydrophobicContact CB-CG2 3.96Å; L440-V503 HydrophobicContact CD2-CG2 3.95Å
441	W	97.6	Very high	98	Very high	14 Å²	14	24.5 Å²	24.5	5%	0.053	13%	0.127	C	C	.	.	H	α-helix	trans	-71.4	-19.7	-168.4	-56.1	110.1	0	0	0	113.4	R291 I293 G436 D438 V443 N446 V449	R291-W441 HydrophobicContact CB-CD2 3.87Å; R291-W441 HydrophobicContact CB-CG 3.88Å; R291-W441 HydrophobicContact CB-CZ2 4.19Å; R291-W441 HydrophobicContact CG-CD2 4.42Å; R291-W441 WeakPolarHBondContact O-CZ2 3.44Å; R291-W441 PolarHBondContact O-NE1 3.34Å; I293-W441 HydrophobicContact CD1-CH2 3.86Å; I293-W441 HydrophobicContact CD1-CZ3 4.19Å; I293-W441 HydrophobicContact CG1-CH2 3.97Å; I293-W441 HydrophobicContact CG2-CH2 4.2Å; G436-W441 VanDerWaalsContact C-NE1 3.26Å; G436-W441 PolarHBondContact O-NE1 2.69Å; D438-W441 PolarHBondContact O-N 3.38Å; W441-V443 PolarHBondContact O-N 2.99Å; W441-N446 WeakPolarHBondContact CZ3-OD1 3.48Å; W441-V449 HydrophobicContact CE3-CG2 4.17Å; W441-V449 HydrophobicContact CH2-CB 4.39Å; W441-V449 HydrophobicContact CH2-CG1 4.06Å; W441-V449 HydrophobicContact CH2-CG2 4.22Å; W441-V449 HydrophobicContact CZ3-CB 4.05Å; W441-V449 HydrophobicContact CZ3-CG1 4.24Å; W441-V449 HydrophobicContact CZ3-CG2 3.65Å
442	D	95.8	Very high	98	Very high	58 Å²	58	23.7 Å²	23.7	31%	0.31	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-26.6	176.6	-104.4	9.8	0	0	0	112.9	K379 D438 L440	K379-D442 WeakPolarHBondContact CD-OD2 3.45Å; K379-D442 VanDerWaalsContact CE-CG 3.47Å; K379-D442 WeakPolarHBondContact CE-OD1 3.31Å; K379-D442 WeakPolarHBondContact CE-OD2 3.46Å; K379-D442 VanDerWaalsContact NZ-C 3.3Å; K379-D442 PolarHBondContact NZ-O 3.36Å; K379-D442 IonicContact NZ-OD1 2.9Å; K379-D442 PolarHBondContact NZ-OD1 2.85Å; K379-D442 IonicContact NZ-OD2 2.64Å; K379-D442 PolarHBondContact NZ-OD2 3.47Å; D438-D442 WeakPolarHBondContact O-CB 3.39Å; D438-D442 PolarHBondContact O-N 3.34Å; L440-D442 PolarHBondContact O-N 3.07Å
443	V	97.3	Very high	98	Very high	25 Å²	25	23.8 Å²	23.8	15%	0.152	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-17.5	-173.9	-64.8	0	0	0	0	113.4	L440 W441 A479 I490	L440-V443 WeakPolarHBondContact O-CG2 3.3Å; L440-V443 PolarHBondContact O-N 3.4Å; W441-V443 PolarHBondContact O-N 2.99Å; V443-A479 HydrophobicContact CG2-CB 3.78Å; V443-I490 HydrophobicContact CB-CD1 4.31Å
444	L	97.6	Very high	97.9	Very high	11 Å²	11	26.1 Å²	26.1	6%	0.058	14%	0.138	C	C	.	.	S	Bend	trans	-123.3	132.7	175.6	-59.3	-178.9	0	0	0	111.3	L440 E448 V449 L475 R478 A479 I490	L440-L444 HydrophobicContact CD1-CD1 3.82Å; L440-L444 PolarHBondContact O-N 3.4Å; L440-L444 VanDerWaalsContact O-N 3.1Å; L444-E448 HydrophobicContact CB-CB 4.39Å; L444-E448 HydrophobicContact CD2-CB 4.37Å; L444-V449 HydrophobicContact CB-CG2 3.77Å; L444-V449 HydrophobicContact CD1-CG2 4.34Å; L444-L475 HydrophobicContact CD1-CD1 3.95Å; L444-R478 HydrophobicContact CD1-CB 4.16Å; L444-A479 HydrophobicContact CD1-CB 4.09Å; L444-A479 HydrophobicContact CG-CB 4.45Å; L444-I490 HydrophobicContact CD2-CD1 4.38Å
445	S	97.4	Very high	97.9	Very high	50 Å²	50	27.8 Å²	27.8	35%	0.35	16%	0.155	S	C	.	.			trans	-74.7	163.1	171.1	63.5	0	0	0	0	112.2	Q447 E448 V449	S445-Q447 PolarHBondContact O-N 2.87Å; S445-Q447 VanDerWaalsContact O-N 3.15Å; S445-E448 WeakPolarHBondContact CB-OE2 3.4Å; S445-E448 PolarHBondContact N-OE2 2.96Å; S445-E448 PolarHBondContact O-N 2.81Å; S445-E448 VanDerWaalsContact O-N 3.12Å; S445-E448 WeakPolarHBondContact OG-CG 3.27Å; S445-E448 PolarHBondContact OG-N 2.97Å; S445-E448 PolarHBondContact OG-OE2 3.09Å; S445-V449 WeakPolarHBondContact O-CG2 3.44Å; S445-V449 PolarHBondContact O-N 2.88Å
446	N	98	Very high	97.8	Very high	39 Å²	39	29.9 Å²	29.9	21%	0.209	16%	0.164	C	C	.	.	H	α-helix	trans	-52.3	-38.4	174.6	-67.7	-1	0	0	0	112.6	R291 I293 V300 W441 A450	R291-N446 WeakPolarHBondContact CD-OD1 3.02Å; R291-N446 PolarHBondContact NH1-OD1 3.06Å; I293-N446 HydrophobicContact CD1-CB 4.42Å; I293-N446 HydrophobicContact CG2-CB 4.48Å; V300-N446 HydrophobicContact CG1-CB 4.14Å; W441-N446 WeakPolarHBondContact CZ3-OD1 3.48Å; N446-A450 VanDerWaalsContact O-CB 3.32Å; N446-A450 WeakPolarHBondContact O-CB 3.44Å; N446-A450 PolarHBondContact O-N 2.86Å
447	Q	98.1	Very high	97.7	Very high	98 Å²	98	29.9 Å²	29.9	46%	0.458	16%	0.164	S	C	.	.	H	α-helix	trans	-70.7	-44.5	-179.9	-172.1	60.5	35	0	0	111.5	S445 V449 A450 E451	S445-Q447 PolarHBondContact O-N 2.87Å; S445-Q447 VanDerWaalsContact O-N 3.15Å; Q447-V449 VanDerWaalsContact C-N 3.32Å; Q447-V449 PolarHBondContact O-N 3.1Å; Q447-A450 PolarHBondContact O-N 2.78Å; Q447-E451 HydrophobicContact CG-CG 4.48Å; Q447-E451 VanDerWaalsContact CG-OE1 3.31Å; Q447-E451 WeakPolarHBondContact CG-OE1 3.25Å; Q447-E451 PolarHBondContact NE2-OE1 2.89Å; Q447-E451 WeakPolarHBondContact O-CB 3.44Å; Q447-E451 VanDerWaalsContact O-CG 3.3Å; Q447-E451 WeakPolarHBondContact O-CG 3.08Å; Q447-E451 PolarHBondContact O-N 3.37Å
448	E	97.9	Very high	97.5	Very high	55 Å²	55	33 Å²	33	26%	0.257	19%	0.19	S	C	.	.	H	α-helix	trans	-62.7	-39.3	176.5	-72.8	164.3	119.3	0	0	111.9	L444 S445 A452 R494	L444-E448 HydrophobicContact CB-CB 4.39Å; L444-E448 HydrophobicContact CD2-CB 4.37Å; S445-E448 WeakPolarHBondContact CB-OE2 3.4Å; S445-E448 PolarHBondContact N-OE2 2.96Å; S445-E448 PolarHBondContact O-N 2.81Å; S445-E448 VanDerWaalsContact O-N 3.12Å; S445-E448 WeakPolarHBondContact OG-CG 3.27Å; S445-E448 PolarHBondContact OG-N 2.97Å; S445-E448 PolarHBondContact OG-OE2 3.09Å; E448-A452 VanDerWaalsContact O-CB 3.27Å; E448-A452 WeakPolarHBondContact O-CB 3.45Å; E448-A452 PolarHBondContact O-N 3.41Å; E448-R494 IonicContact OE1-CZ 2.9Å; E448-R494 VanDerWaalsContact OE1-CZ 3.24Å; E448-R494 IonicContact OE1-NH1 3.84Å; E448-R494 PolarHBondContact OE1-NH1 3.35Å; E448-R494 IonicContact OE1-NH2 3.24Å; E448-R494 PolarHBondContact OE1-NH2 3.43Å; E448-R494 IonicContact OE2-NH1 3.51Å
449	V	98.4	Very high	97.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-48.8	174.7	171.2	0	0	0	0	110.7	I293 I434 L440 W441 L444 S445 Q447 E451 A452 V453 L475	I293-V449 HydrophobicContact CD1-CB 4.35Å; I293-V449 HydrophobicContact CD1-CG1 4.03Å; I434-V449 HydrophobicContact CD1-CG1 3.91Å; I434-V449 HydrophobicContact CG2-CG1 4.08Å; L440-V449 HydrophobicContact CD1-CG2 4.29Å; L440-V449 HydrophobicContact CD2-CG2 4.3Å; L440-V449 HydrophobicContact CG-CG2 4.34Å; W441-V449 HydrophobicContact CE3-CG2 4.17Å; W441-V449 HydrophobicContact CH2-CB 4.39Å; W441-V449 HydrophobicContact CH2-CG1 4.06Å; W441-V449 HydrophobicContact CH2-CG2 4.22Å; W441-V449 HydrophobicContact CZ3-CB 4.05Å; W441-V449 HydrophobicContact CZ3-CG1 4.24Å; W441-V449 HydrophobicContact CZ3-CG2 3.65Å; L444-V449 HydrophobicContact CB-CG2 3.77Å; L444-V449 HydrophobicContact CD1-CG2 4.34Å; S445-V449 WeakPolarHBondContact O-CG2 3.44Å; S445-V449 PolarHBondContact O-N 2.88Å; Q447-V449 VanDerWaalsContact C-N 3.32Å; Q447-V449 PolarHBondContact O-N 3.1Å; V449-E451 PolarHBondContact O-N 3.09Å; V449-A452 PolarHBondContact O-N 2.91Å; V449-V453 WeakPolarHBondContact O-CG2 3.29Å; V449-V453 PolarHBondContact O-N 2.77Å; V449-L475 HydrophobicContact CB-CD1 4.34Å; V449-L475 HydrophobicContact CG1-CD1 4.1Å; V449-L475 HydrophobicContact CG1-CD2 3.76Å; V449-L475 HydrophobicContact CG2-CD1 4.16Å
450	A	98.5	Very high	97.2	Very high	4 Å²	4	40 Å²	40	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-42.7	-179.9	0	0	0	0	0	112.5	V295 V300 N446 Q447 T454	V295-A450 HydrophobicContact CG1-CB 4.48Å; V295-A450 HydrophobicContact CG2-CB 3.66Å; V300-A450 HydrophobicContact CG2-CB 3.36Å; N446-A450 VanDerWaalsContact O-CB 3.32Å; N446-A450 WeakPolarHBondContact O-CB 3.44Å; N446-A450 PolarHBondContact O-N 2.86Å; Q447-A450 PolarHBondContact O-N 2.78Å; A450-T454 WeakPolarHBondContact O-CB 3.45Å; A450-T454 PolarHBondContact O-N 2.83Å; A450-T454 PolarHBondContact O-OG1 3.28Å
451	E	97.9	Very high	96.9	Very high	115 Å²	115	44.7 Å²	44.7	54%	0.537	25%	0.254	S	S	.	.	H	α-helix	trans	-64.1	-42.7	176.3	-74.7	171.3	-172.3	0	0	112.1	Q447 V449 G455	Q447-E451 HydrophobicContact CG-CG 4.48Å; Q447-E451 VanDerWaalsContact CG-OE1 3.31Å; Q447-E451 WeakPolarHBondContact CG-OE1 3.25Å; Q447-E451 PolarHBondContact NE2-OE1 2.89Å; Q447-E451 WeakPolarHBondContact O-CB 3.44Å; Q447-E451 VanDerWaalsContact O-CG 3.3Å; Q447-E451 WeakPolarHBondContact O-CG 3.08Å; Q447-E451 PolarHBondContact O-N 3.37Å; V449-E451 PolarHBondContact O-N 3.09Å; E451-G455 PolarHBondContact O-N 3.34Å
452	A	97.7	Very high	96.5	Very high	6 Å²	6	47.4 Å²	47.4	5%	0.05	27%	0.273	C	S	.	.	H	α-helix	trans	-61.2	-50.2	176.9	0	0	0	0	0	111.2	E448 V449 F456 L475	E448-A452 VanDerWaalsContact O-CB 3.27Å; E448-A452 WeakPolarHBondContact O-CB 3.45Å; E448-A452 PolarHBondContact O-N 3.41Å; V449-A452 PolarHBondContact O-N 2.91Å; A452-F456 VanDerWaalsContact O-CB 3.29Å; A452-F456 WeakPolarHBondContact O-CB 3.45Å; A452-F456 PolarHBondContact O-N 2.69Å; A452-L475 HydrophobicContact CB-CD1 4.14Å
453	V	98.3	Very high	96.1	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-68.5	-45.3	-178.5	175.3	0	0	0	0	111.5	V432 I434 V449 G455 F456 L457 L475 I505	V432-V453 HydrophobicContact CG2-CG1 3.88Å; I434-V453 HydrophobicContact CD1-CB 4.02Å; I434-V453 HydrophobicContact CD1-CG1 4.13Å; I434-V453 HydrophobicContact CD1-CG2 3.79Å; V449-V453 WeakPolarHBondContact O-CG2 3.29Å; V449-V453 PolarHBondContact O-N 2.77Å; V453-G455 PolarHBondContact O-N 3.12Å; V453-F456 PolarHBondContact O-N 3.09Å; V453-L457 HydrophobicContact CG1-CD1 3.69Å; V453-L457 HydrophobicContact CG1-CG 4.11Å; V453-L457 WeakPolarHBondContact O-CB 3.44Å; V453-L457 VanDerWaalsContact O-CG 3.25Å; V453-L457 WeakPolarHBondContact O-CG 2.82Å; V453-L457 PolarHBondContact O-N 3.47Å; V453-L475 HydrophobicContact CG2-CD2 4.25Å; V453-I505 HydrophobicContact CG1-CD1 4.14Å; V453-I505 HydrophobicContact CG2-CD1 3.82Å
454	T	97.1	Very high	95.8	Very high	50 Å²	50	53 Å²	53	31%	0.307	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-45.6	177.3	-55	0	0	0	0	111	A450 F456 A458	A450-T454 WeakPolarHBondContact O-CB 3.45Å; A450-T454 PolarHBondContact O-N 2.83Å; A450-T454 PolarHBondContact O-OG1 3.28Å; T454-F456 PolarHBondContact O-N 2.93Å; T454-A458 VanDerWaalsContact O-CB 3.26Å; T454-A458 WeakPolarHBondContact O-CB 3.29Å; T454-A458 PolarHBondContact O-N 3.48Å
455	G	96.8	Very high	95.4	Very high	34 Å²	34	57.9 Å²	57.9	35%	0.351	33%	0.325	S	S	.	.	H	α-helix	trans	-65.8	-36.7	178.7	0	0	0	0	0	112.8	E451 V453 N459	E451-G455 PolarHBondContact O-N 3.34Å; V453-G455 PolarHBondContact O-N 3.12Å; G455-N459 PolarHBondContact O-ND2 3.35Å
456	F	97.3	Very high	95.1	Very high	44 Å²	44	59.6 Å²	59.6	19%	0.193	33%	0.327	C	S	.	.	H	α-helix	trans	-66.9	-53.6	174.8	-172.8	-83.4	0	0	0	111	A452 V453 T454 A458 N459 C460 M470 A471 D474	A452-F456 VanDerWaalsContact O-CB 3.29Å; A452-F456 WeakPolarHBondContact O-CB 3.45Å; A452-F456 PolarHBondContact O-N 2.69Å; V453-F456 PolarHBondContact O-N 3.09Å; T454-F456 PolarHBondContact O-N 2.93Å; F456-A458 PolarHBondContact O-N 3.19Å; F456-N459 PolarHBondContact O-N 2.96Å; F456-N459 VanDerWaalsContact O-N 3.1Å; F456-C460 HydrophobicContact CE1-CB 4.5Å; F456-C460 WeakPolarHBondContact CE1-SG 3.09Å; F456-C460 PolarHBondContact O-N 3.48Å; F456-M470 HydrophobicContact CE1-CB 3.74Å; F456-M470 HydrophobicContact CE2-CB 4.47Å; F456-M470 HydrophobicContact CZ-CB 3.41Å; F456-M470 VanDerWaalsContact CZ-CB 3.41Å; F456-A471 HydrophobicContact CD1-CB 3.51Å; F456-A471 HydrophobicContact CE1-CB 3.94Å; F456-A471 HydrophobicContact CG-CB 4.2Å; F456-D474 HydrophobicContact CD2-CB 3.78Å; F456-D474 HydrophobicContact CE2-CB 4.01Å
457	L	96.8	Very high	95	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-44.7	-177	-66.6	178.5	0	0	0	111.4	V432 V453 N459 C460 R467 Y468 A471	V432-L457 HydrophobicContact CG1-CD1 3.86Å; V432-L457 HydrophobicContact CG2-CD1 4.43Å; V453-L457 HydrophobicContact CG1-CD1 3.69Å; V453-L457 HydrophobicContact CG1-CG 4.11Å; V453-L457 WeakPolarHBondContact O-CB 3.44Å; V453-L457 VanDerWaalsContact O-CG 3.25Å; V453-L457 WeakPolarHBondContact O-CG 2.82Å; V453-L457 PolarHBondContact O-N 3.47Å; L457-N459 PolarHBondContact O-N 2.98Å; L457-C460 PolarHBondContact O-N 3.22Å; L457-R467 VanDerWaalsContact C-NH2 3.34Å; L457-R467 HydrophobicContact CD2-CG 3.61Å; L457-R467 PolarHBondContact O-NH2 3.02Å; L457-Y468 HydrophobicContact CD1-CE1 4.31Å; L457-Y468 HydrophobicContact CD2-CD1 3.96Å; L457-Y468 HydrophobicContact CD2-CE1 4.07Å; L457-A471 HydrophobicContact CD2-CB 4.02Å
458	A	94.9	Very high	94.9	Very high	65 Å²	65	53.4 Å²	53.4	54%	0.537	30%	0.297	S	S	.	.	H	α-helix	trans	-58.3	-21.9	179	0	0	0	0	0	114.2	T454 F456	T454-A458 VanDerWaalsContact O-CB 3.26Å; T454-A458 WeakPolarHBondContact O-CB 3.29Å; T454-A458 PolarHBondContact O-N 3.48Å; F456-A458 PolarHBondContact O-N 3.19Å
459	N	94.6	Very high	94.9	Very high	145 Å²	145	51 Å²	51	78%	0.775	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	1.7	178.3	-68.3	-58.9	0	0	0	113.8	G455 F456 L457	G455-N459 PolarHBondContact O-ND2 3.35Å; F456-N459 PolarHBondContact O-N 2.96Å; F456-N459 VanDerWaalsContact O-N 3.1Å; L457-N459 PolarHBondContact O-N 2.98Å
460	C	93.8	Very high	94.8	Very high	26 Å²	26	53.8 Å²	53.8	18%	0.176	30%	0.3	C	S	.	.	S	Bend	trans	-106.7	144.6	175.6	-75.2	0	0	0	0	111.3	F456 L457 P462 R467	F456-C460 HydrophobicContact CE1-CB 4.5Å; F456-C460 WeakPolarHBondContact CE1-SG 3.09Å; F456-C460 PolarHBondContact O-N 3.48Å; L457-C460 PolarHBondContact O-N 3.22Å; C460-P462 WeakPolarHBondContact O-CD 3.43Å; C460-R467 HydrophobicContact CB-CG 3.87Å; C460-R467 PolarHBondContact O-NE 2.94Å; C460-R467 PolarHBondContact O-NH2 2.71Å
461	D	92.6	Very high	94.8	Very high	98 Å²	98	53.6 Å²	53.6	52%	0.524	30%	0.298	S	S	.	.			trans	-55.2	122	172.1	-173.6	-14.5	0	0	0	110	D463 D464 R467	D461-D463 PolarHBondContact O-N 2.6Å; D461-D463 VanDerWaalsContact O-N 3.15Å; D461-D463 PolarHBondContact OD1-N 2.78Å; D461-D464 HydrophobicContact CB-CB 4.25Å; D461-D464 WeakPolarHBondContact O-CB 3.33Å; D461-D464 PolarHBondContact O-N 3.29Å; D461-D464 VanDerWaalsContact O-N 3.08Å; D461-R467 WeakPolarHBondContact O-CD 3.28Å
462	P	89.6	Confident	94.8	Very high	71 Å²	71	48.1 Å²	48.1	46%	0.461	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.5	177.3	-26	35.6	0	0	0	114.6	A429 C460	A429-P462 HydrophobicContact CB-CB 4.25Å; C460-P462 WeakPolarHBondContact O-CD 3.43Å
463	D	88.1	Confident	94.8	Very high	145 Å²	145	50.7 Å²	50.7	78%	0.775	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-2.4	-179.7	-68.2	-38.3	0	0	0	113.3	D461 Q465	D461-D463 PolarHBondContact O-N 2.6Å; D461-D463 VanDerWaalsContact O-N 3.15Å; D461-D463 PolarHBondContact OD1-N 2.78Å; D463-Q465 PolarHBondContact O-N 2.92Å
464	D	91.2	Very high	94.8	Very high	57 Å²	57	52.1 Å²	52.1	31%	0.305	29%	0.292	S	S	.	.			trans	-69.1	120.2	176.2	-173.8	-9.7	0	0	0	111.2	D461 H466 R467 M470	D461-D464 HydrophobicContact CB-CB 4.25Å; D461-D464 WeakPolarHBondContact O-CB 3.33Å; D461-D464 PolarHBondContact O-N 3.29Å; D461-D464 VanDerWaalsContact O-N 3.08Å; D464-H466 PolarHBondContact O-N 2.85Å; D464-H466 VanDerWaalsContact O-N 3.15Å; D464-H466 IonicContact OD1-CG 3.32Å; D464-H466 PolarHBondContact OD1-N 2.81Å; D464-H466 IonicContact OD1-ND1 3.52Å; D464-H466 PolarHBondContact OD1-ND1 3.49Å; D464-R467 HydrophobicContact CB-CB 4.3Å; D464-R467 WeakPolarHBondContact O-CB 3.41Å; D464-R467 PolarHBondContact O-N 2.64Å; D464-R467 VanDerWaalsContact O-N 3.13Å; D464-M470 VanDerWaalsContact OD2-CE 3.22Å; D464-M470 WeakPolarHBondContact OD2-CE 3.44Å
465	Q	87.6	Confident	94.9	Very high	112 Å²	112	49.8 Å²	49.8	52%	0.523	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19	179.6	-64.2	-178.9	15.5	0	0	113.6	T67 D463	T67-Q465 WeakPolarHBondContact CG2-O 3.41Å; D463-Q465 PolarHBondContact O-N 2.92Å
466	H	92.6	Very high	95	Very high	86 Å²	86	48.2 Å²	48.2	40%	0.398	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-1.6	179.8	-53.8	83.8	0	0	0	113	T67 D464 Y468 T469 M470	T67-H466 HydrophobicContact CG2-CB 4.33Å; T67-H466 WeakPolarHBondContact CG2-CD2 3.27Å; D464-H466 PolarHBondContact O-N 2.85Å; D464-H466 VanDerWaalsContact O-N 3.15Å; D464-H466 IonicContact OD1-CG 3.32Å; D464-H466 PolarHBondContact OD1-N 2.81Å; D464-H466 IonicContact OD1-ND1 3.52Å; D464-H466 PolarHBondContact OD1-ND1 3.49Å; H466-Y468 VanDerWaalsContact C-N 3.33Å; H466-Y468 PolarHBondContact O-N 2.75Å; H466-T469 PolarHBondContact O-N 3.14Å; H466-M470 HydrophobicContact CB-CE 4.22Å; H466-M470 HydrophobicContact CB-CG 4.23Å; H466-M470 HydrophobicContact CB-SD 4.5Å; H466-M470 WeakPolarHBondContact O-CG 3.45Å; H466-M470 PolarHBondContact O-N 2.93Å
467	R	94.7	Very high	95	Very high	3 Å²	3	50.1 Å²	50.1	1%	0.011	27%	0.271	C	S	.	.	H	α-helix	trans	-47.3	-51.5	-172.4	-174.6	178.4	-158.5	-141.9	5	113.2	A429 D430 L457 C460 D461 D464 A471	A429-R467 VanDerWaalsContact CB-NH1 3.31Å; A429-R467 PolarHBondContact O-NH1 2.83Å; D430-R467 IonicContact OD1-CZ 3.12Å; D430-R467 IonicContact OD1-NH1 3.86Å; D430-R467 PolarHBondContact OD1-NH1 3.02Å; D430-R467 IonicContact OD1-NH2 2.67Å; D430-R467 PolarHBondContact OD1-NH2 3.46Å; L457-R467 VanDerWaalsContact C-NH2 3.34Å; L457-R467 HydrophobicContact CD2-CG 3.61Å; L457-R467 PolarHBondContact O-NH2 3.02Å; C460-R467 HydrophobicContact CB-CG 3.87Å; C460-R467 PolarHBondContact O-NE 2.94Å; C460-R467 PolarHBondContact O-NH2 2.71Å; D461-R467 WeakPolarHBondContact O-CD 3.28Å; D464-R467 HydrophobicContact CB-CB 4.3Å; D464-R467 WeakPolarHBondContact O-CB 3.41Å; D464-R467 PolarHBondContact O-N 2.64Å; D464-R467 VanDerWaalsContact O-N 3.13Å; R467-A471 WeakPolarHBondContact O-CB 3.36Å; R467-A471 PolarHBondContact O-N 3.31Å
468	Y	97.1	Very high	95.1	Very high	5 Å²	5	55.5 Å²	55.5	2%	0.02	29%	0.291	C	S	.	.	H	α-helix	trans	-75.6	-31.8	-177.9	-53.4	-71.9	0	0	0	112.9	A73 G75 A429 V432 L457 H466 A471 A472 I505 P507 M509	A73-Y468 HydrophobicContact CB-CD2 4.34Å; A73-Y468 VanDerWaalsContact O-CD2 3.27Å; A73-Y468 WeakPolarHBondContact O-CD2 3.33Å; G75-Y468 VanDerWaalsContact CA-C 3.47Å; A429-Y468 WeakPolarHBondContact O-CE1 3.32Å; A429-Y468 PolarHBondContact O-OH 3.26Å; V432-Y468 HydrophobicContact CG1-CD1 4.02Å; V432-Y468 HydrophobicContact CG1-CE1 3.77Å; L457-Y468 HydrophobicContact CD1-CE1 4.31Å; L457-Y468 HydrophobicContact CD2-CD1 3.96Å; L457-Y468 HydrophobicContact CD2-CE1 4.07Å; H466-Y468 VanDerWaalsContact C-N 3.33Å; H466-Y468 PolarHBondContact O-N 2.75Å; Y468-A471 PolarHBondContact O-N 2.91Å; Y468-A472 WeakPolarHBondContact O-CB 3.28Å; Y468-A472 PolarHBondContact O-N 3.46Å; Y468-I505 HydrophobicContact CD1-CG2 3.87Å; Y468-I505 HydrophobicContact CG-CG2 4.45Å; Y468-P507 HydrophobicContact CD1-CB 4.34Å; Y468-P507 HydrophobicContact CD1-CG 4.45Å; Y468-P507 HydrophobicContact CD2-CB 4.38Å; Y468-P507 HydrophobicContact CD2-CG 3.86Å; Y468-P507 HydrophobicContact CE1-CB 3.72Å; Y468-P507 HydrophobicContact CE1-CG 4.22Å; Y468-P507 HydrophobicContact CE2-CB 3.78Å; Y468-P507 HydrophobicContact CE2-CG 3.59Å; Y468-P507 HydrophobicContact CG-CG 4.29Å; Y468-P507 VanDerWaalsContact CZ-CB 3.4Å; Y468-P507 WeakPolarHBondContact OH-CB 3.48Å; Y468-M509 WeakPolarHBondContact OH-CE 3.23Å
469	T	96.8	Very high	95.2	Very high	4 Å²	4	52.4 Å²	52.4	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-43.5	174.3	-61.5	0	0	0	0	111.1	I63 L64 H466 A471 A472 Q473	I63-T469 HydrophobicContact CB-CG2 3.79Å; I63-T469 HydrophobicContact CD1-CG2 4.32Å; I63-T469 HydrophobicContact CG2-CG2 4.23Å; L64-T469 HydrophobicContact CB-CG2 4.41Å; H466-T469 PolarHBondContact O-N 3.14Å; T469-A471 VanDerWaalsContact C-N 3.34Å; T469-A472 PolarHBondContact O-N 2.85Å; T469-Q473 WeakPolarHBondContact O-CB 3.15Å; T469-Q473 PolarHBondContact O-N 3.44Å
470	M	97.1	Very high	95.4	Very high	58 Å²	58	47.2 Å²	47.2	29%	0.286	24%	0.235	S	C	.	.	H	α-helix	trans	-67.4	-36.3	176	-62.5	-173.7	-68	0	0	111.6	F456 D464 H466 Q473 D474	F456-M470 HydrophobicContact CE1-CB 3.74Å; F456-M470 HydrophobicContact CE2-CB 4.47Å; F456-M470 HydrophobicContact CZ-CB 3.41Å; F456-M470 VanDerWaalsContact CZ-CB 3.41Å; D464-M470 VanDerWaalsContact OD2-CE 3.22Å; D464-M470 WeakPolarHBondContact OD2-CE 3.44Å; H466-M470 HydrophobicContact CB-CE 4.22Å; H466-M470 HydrophobicContact CB-CG 4.23Å; H466-M470 HydrophobicContact CB-SD 4.5Å; H466-M470 WeakPolarHBondContact O-CG 3.45Å; H466-M470 PolarHBondContact O-N 2.93Å; M470-Q473 WeakPolarHBondContact O-CB 3.41Å; M470-Q473 PolarHBondContact O-N 2.84Å; M470-D474 WeakPolarHBondContact O-CB 3.25Å; M470-D474 PolarHBondContact O-N 3.16Å
471	A	98.1	Very high	95.5	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-41	172.7	0	0	0	0	0	112	F456 L457 R467 Y468 T469 D474 L475 I505	F456-A471 HydrophobicContact CD1-CB 3.51Å; F456-A471 HydrophobicContact CE1-CB 3.94Å; F456-A471 HydrophobicContact CG-CB 4.2Å; L457-A471 HydrophobicContact CD2-CB 4.02Å; R467-A471 WeakPolarHBondContact O-CB 3.36Å; R467-A471 PolarHBondContact O-N 3.31Å; Y468-A471 PolarHBondContact O-N 2.91Å; T469-A471 VanDerWaalsContact C-N 3.34Å; A471-D474 PolarHBondContact O-N 3.36Å; A471-L475 WeakPolarHBondContact O-CB 3.48Å; A471-L475 PolarHBondContact O-N 3.44Å; A471-I505 VanDerWaalsContact C-CD1 3.48Å; A471-I505 HydrophobicContact CB-CD1 3.58Å
472	A	98.6	Very high	95.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-41.4	175.4	0	0	0	0	0	110.9	A77 Y468 T469 L475 V476 V503 I505	A77-A472 HydrophobicContact CB-CB 3.87Å; Y468-A472 WeakPolarHBondContact O-CB 3.28Å; Y468-A472 PolarHBondContact O-N 3.46Å; T469-A472 PolarHBondContact O-N 2.85Å; A472-L475 PolarHBondContact O-N 3.18Å; A472-V476 WeakPolarHBondContact O-CG2 3.47Å; A472-V476 PolarHBondContact O-N 2.94Å; A472-V503 HydrophobicContact CB-CG1 4.22Å; A472-I505 HydrophobicContact CB-CD1 4.11Å; A472-I505 HydrophobicContact CB-CG1 4.08Å; A472-I505 VanDerWaalsContact N-CD1 3.35Å
473	Q	98.4	Very high	95.7	Very high	59 Å²	59	49.3 Å²	49.3	28%	0.276	24%	0.238	S	C	.	.	H	α-helix	trans	-61.9	-45.5	175.8	-170.2	-177.4	20.4	0	0	112.2	I61 I63 A77 T469 M470 L475 V476 M477	I61-Q473 HydrophobicContact CG2-CG 3.94Å; I63-Q473 HydrophobicContact CG2-CB 3.87Å; I63-Q473 HydrophobicContact CG2-CG 3.89Å; A77-Q473 HydrophobicContact CB-CB 4.43Å; T469-Q473 WeakPolarHBondContact O-CB 3.15Å; T469-Q473 PolarHBondContact O-N 3.44Å; M470-Q473 WeakPolarHBondContact O-CB 3.41Å; M470-Q473 PolarHBondContact O-N 2.84Å; Q473-L475 VanDerWaalsContact C-N 3.29Å; Q473-L475 PolarHBondContact O-N 3.49Å; Q473-V476 PolarHBondContact O-N 3.16Å; Q473-M477 WeakPolarHBondContact O-CB 3.5Å; Q473-M477 PolarHBondContact O-N 3.21Å
474	D	98.2	Very high	95.8	Very high	32 Å²	32	46.8 Å²	46.8	17%	0.171	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-42.5	175.7	-177.8	62.5	0	0	0	110.6	F456 M470 A471 M477 R478	F456-D474 HydrophobicContact CD2-CB 3.78Å; F456-D474 HydrophobicContact CE2-CB 4.01Å; M470-D474 WeakPolarHBondContact O-CB 3.25Å; M470-D474 PolarHBondContact O-N 3.16Å; A471-D474 PolarHBondContact O-N 3.36Å; D474-M477 WeakPolarHBondContact O-CB 3.21Å; D474-M477 PolarHBondContact O-N 2.91Å; D474-R478 VanDerWaalsContact O-CG 3.28Å; D474-R478 WeakPolarHBondContact O-CG 3.38Å; D474-R478 PolarHBondContact O-N 2.85Å; D474-R478 IonicContact OD1-CZ 3.27Å; D474-R478 IonicContact OD1-NE 2.72Å; D474-R478 IonicContact OD1-NH2 2.93Å; D474-R478 IonicContact OD2-CZ 2.77Å; D474-R478 VanDerWaalsContact OD2-CZ 3.27Å; D474-R478 IonicContact OD2-NE 3.58Å; D474-R478 PolarHBondContact OD2-NE 3.35Å; D474-R478 IonicContact OD2-NH2 3.99Å; D474-R478 PolarHBondContact OD2-NH2 2.98Å
475	L	98.2	Very high	95.5	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-65.5	-45.7	178.6	-166.6	63.7	0	0	0	112.6	I434 L440 L444 V449 A452 V453 A471 A472 Q473 M477 R478 A479 V503	I434-L475 HydrophobicContact CG2-CD2 4.19Å; L440-L475 HydrophobicContact CD1-CD1 4.17Å; L440-L475 HydrophobicContact CD1-CD2 4.02Å; L440-L475 HydrophobicContact CD1-CG 3.72Å; L440-L475 HydrophobicContact CD2-CD2 3.77Å; L440-L475 HydrophobicContact CD2-CG 4.41Å; L444-L475 HydrophobicContact CD1-CD1 3.95Å; V449-L475 HydrophobicContact CB-CD1 4.34Å; V449-L475 HydrophobicContact CG1-CD1 4.1Å; V449-L475 HydrophobicContact CG1-CD2 3.76Å; V449-L475 HydrophobicContact CG2-CD1 4.16Å; A452-L475 HydrophobicContact CB-CD1 4.14Å; V453-L475 HydrophobicContact CG2-CD2 4.25Å; A471-L475 WeakPolarHBondContact O-CB 3.48Å; A471-L475 PolarHBondContact O-N 3.44Å; A472-L475 PolarHBondContact O-N 3.18Å; Q473-L475 VanDerWaalsContact C-N 3.29Å; Q473-L475 PolarHBondContact O-N 3.49Å; L475-M477 VanDerWaalsContact C-N 3.31Å; L475-M477 PolarHBondContact O-N 3.42Å; L475-R478 PolarHBondContact O-N 3.04Å; L475-A479 PolarHBondContact O-N 2.82Å; L475-V503 HydrophobicContact CD2-CG1 3.91Å; L475-V503 HydrophobicContact CD2-CG2 4.45Å
476	V	98.6	Very high	95.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.5	-41.4	174.6	172.1	0	0	0	0	110.7	I61 A77 V79 A472 Q473 R478 A479 R480 I501 V503	I61-V476 HydrophobicContact CD1-CG1 4.1Å; I61-V476 HydrophobicContact CG1-CG1 3.97Å; I61-V476 HydrophobicContact CG2-CB 4.25Å; I61-V476 HydrophobicContact CG2-CG1 3.89Å; A77-V476 HydrophobicContact CB-CB 4.36Å; A77-V476 HydrophobicContact CB-CG2 3.77Å; V79-V476 HydrophobicContact CB-CG1 3.89Å; V79-V476 HydrophobicContact CG1-CG1 3.47Å; V79-V476 VanDerWaalsContact CG1-CG1 3.47Å; A472-V476 WeakPolarHBondContact O-CG2 3.47Å; A472-V476 PolarHBondContact O-N 2.94Å; Q473-V476 PolarHBondContact O-N 3.16Å; V476-R478 PolarHBondContact O-N 2.88Å; V476-A479 PolarHBondContact O-N 2.93Å; V476-R480 WeakPolarHBondContact O-CB 3.41Å; V476-R480 PolarHBondContact O-N 3.07Å; V476-I501 HydrophobicContact CG2-CG2 4.23Å; V476-V503 HydrophobicContact CG2-CB 4.09Å; V476-V503 HydrophobicContact CG2-CG2 3.77Å
477	M	98.1	Very high	95	Very high	85 Å²	85	53.7 Å²	53.7	42%	0.419	26%	0.255	S	S	.	.	H	α-helix	trans	-61	-43.6	176.8	-172.4	-178.4	-61.7	0	0	111.7	I61 Q473 D474 L475 G481	I61-M477 HydrophobicContact CD1-CB 3.72Å; I61-M477 HydrophobicContact CD1-CE 4.43Å; I61-M477 HydrophobicContact CD1-CG 4.25Å; Q473-M477 WeakPolarHBondContact O-CB 3.5Å; Q473-M477 PolarHBondContact O-N 3.21Å; D474-M477 WeakPolarHBondContact O-CB 3.21Å; D474-M477 PolarHBondContact O-N 2.91Å; L475-M477 VanDerWaalsContact C-N 3.31Å; L475-M477 PolarHBondContact O-N 3.42Å; M477-G481 WeakPolarHBondContact O-CA 3.3Å; M477-G481 PolarHBondContact O-N 2.9Å
478	R	97.9	Very high	94.9	Very high	112 Å²	112	55.2 Å²	55.2	42%	0.423	26%	0.261	S	S	.	.	H	α-helix	trans	-63.6	-39.5	177	-73	170.6	-169.3	-99.7	-1.5	112.9	L444 D474 L475 V476 I490	L444-R478 HydrophobicContact CD1-CB 4.16Å; D474-R478 VanDerWaalsContact O-CG 3.28Å; D474-R478 WeakPolarHBondContact O-CG 3.38Å; D474-R478 PolarHBondContact O-N 2.85Å; D474-R478 IonicContact OD1-CZ 3.27Å; D474-R478 IonicContact OD1-NE 2.72Å; D474-R478 IonicContact OD1-NH2 2.93Å; D474-R478 IonicContact OD2-CZ 2.77Å; D474-R478 VanDerWaalsContact OD2-CZ 3.27Å; D474-R478 IonicContact OD2-NE 3.58Å; D474-R478 PolarHBondContact OD2-NE 3.35Å; D474-R478 IonicContact OD2-NH2 3.99Å; D474-R478 PolarHBondContact OD2-NH2 2.98Å; L475-R478 PolarHBondContact O-N 3.04Å; V476-R478 PolarHBondContact O-N 2.88Å; R478-I490 WeakPolarHBondContact O-CG2 3.3Å
479	A	98.2	Very high	94.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-75.6	-44.7	-179.9	0	0	0	0	0	112	L440 V443 L444 L475 V476 G481 I490 S497 I501	L440-A479 HydrophobicContact CD1-CB 3.82Å; V443-A479 HydrophobicContact CG2-CB 3.78Å; L444-A479 HydrophobicContact CD1-CB 4.09Å; L444-A479 HydrophobicContact CG-CB 4.45Å; L475-A479 PolarHBondContact O-N 2.82Å; V476-A479 PolarHBondContact O-N 2.93Å; A479-G481 VanDerWaalsContact C-N 3.31Å; A479-G481 PolarHBondContact O-N 3.1Å; A479-I490 WeakPolarHBondContact O-CG2 3.44Å; A479-S497 PolarHBondContact O-N 3.08Å; A479-I501 HydrophobicContact CB-CD1 3.83Å
480	R	97.8	Very high	94.7	Very high	37 Å²	37	57.4 Å²	57.4	14%	0.14	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-41.5	174.9	-172.6	-168.4	70.8	170.1	-4.1	111.4	R59 V79 V476 W488 I501	R59-R480 PolarHBondContact O-NH1 2.85Å; V79-R480 HydrophobicContact CG1-CB 4.37Å; V79-R480 HydrophobicContact CG1-CG 4.36Å; V476-R480 WeakPolarHBondContact O-CB 3.41Å; V476-R480 PolarHBondContact O-N 3.07Å; R480-W488 HydrophobicContact CG-CE3 3.97Å; R480-W488 HydrophobicContact CG-CZ3 3.97Å; R480-I501 HydrophobicContact CB-CD1 4.14Å
481	G	96.3	Very high	94.3	Very high	6 Å²	6	59.2 Å²	59.2	6%	0.062	28%	0.284	C	S	.	.			trans	73.2	-162	-174.2	0	0	0	0	0	113.2	M477 A479 W488 R489	M477-G481 WeakPolarHBondContact O-CA 3.3Å; M477-G481 PolarHBondContact O-N 2.9Å; A479-G481 VanDerWaalsContact C-N 3.31Å; A479-G481 PolarHBondContact O-N 3.1Å; G481-W488 WeakPolarHBondContact O-CZ3 3.29Å; G481-R489 CarbonylContact C-O 3.58Å; G481-R489 VanDerWaalsContact CA-O 3.26Å; G481-R489 WeakPolarHBondContact CA-O 3.26Å
482	E	93.9	Very high	93.9	Very high	132 Å²	132	66.3 Å²	66.3	62%	0.617	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	145.4	179.1	-65.4	178.8	169.4	0	0	110.9	K484 W488 R489	E482-K484 PolarHBondContact O-N 3.18Å; E482-W488 CarbonylContact O-C 3.58Å; E482-W488 WeakPolarHBondContact O-CA 3.46Å; E482-R489 PolarHBondContact N-O 3.18Å; E482-R489 PolarHBondContact O-N 3.41Å
483	L	91.8	Very high	93.4	Very high	101 Å²	101	70.1 Å²	70.1	53%	0.529	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	119.2	175.5	-174.7	63.3	0	0	0	110.2	W488	L483-W488 HydrophobicContact CB-CD2 4.35Å; L483-W488 HydrophobicContact CB-CE3 4.36Å; L483-W488 HydrophobicContact CB-CH2 4.32Å; L483-W488 HydrophobicContact CB-CZ2 4.31Å; L483-W488 HydrophobicContact CB-CZ3 4.35Å; L483-W488 HydrophobicContact CD1-CD2 4.44Å; L483-W488 HydrophobicContact CD1-CG 4.48Å
484	K	90.9	Very high	93.2	Very high	92 Å²	92	71.8 Å²	71.8	40%	0.4	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	174.7	172.5	-57	-172.4	-170.2	171.7	0	109.8	E482 R486 G487 R489 D493	E482-K484 PolarHBondContact O-N 3.18Å; K484-R486 PolarHBondContact O-N 2.94Å; K484-G487 PolarHBondContact N-O 3.3Å; K484-G487 PolarHBondContact O-N 3.35Å; K484-R489 HydrophobicContact CB-CG 4.28Å; K484-R489 HydrophobicContact CD-CB 3.94Å; K484-R489 HydrophobicContact CD-CG 4.03Å; K484-R489 HydrophobicContact CG-CB 4.33Å; K484-R489 HydrophobicContact CG-CG 4.3Å; K484-D493 IonicContact NZ-OD1 3.86Å
485	D	85.2	Confident	93.1	Very high	178 Å²	178	75.7 Å²	75.7	95%	0.952	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-26.1	179.5	-63.3	-21.5	0	0	0	114.1
486	R	80.7	Confident	93	Very high	193 Å²	193	76.1 Å²	76.1	73%	0.728	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	23.9	179.9	-60	-176.8	178.6	-177.9	-0.7	113.2	K484 R489	K484-R486 PolarHBondContact O-N 2.94Å; R486-R489 PolarHBondContact O-NE 2.99Å; R486-R489 PolarHBondContact O-NH2 3.4Å
487	G	88.5	Confident	92.9	Very high	28 Å²	28	76.3 Å²	76.3	29%	0.289	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	90.7	-166.6	-177	0	0	0	0	0	113.5	K484	K484-G487 PolarHBondContact N-O 3.3Å; K484-G487 PolarHBondContact O-N 3.35Å
488	W	92.1	Very high	92.8	Very high	35 Å²	35	73.6 Å²	73.6	13%	0.133	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	127.8	-179.7	-66.1	92.5	0	0	0	111.6	I57 R59 R480 G481 E482 L483 G496	I57-W488 WeakPolarHBondContact O-CZ2 3.4Å; R59-W488 HydrophobicContact CB-CH2 4.09Å; R59-W488 HydrophobicContact CB-CZ2 3.97Å; R59-W488 HydrophobicContact CG-CH2 4.47Å; R59-W488 HydrophobicContact CG-CZ2 3.85Å; R480-W488 HydrophobicContact CG-CE3 3.97Å; R480-W488 HydrophobicContact CG-CZ3 3.97Å; G481-W488 WeakPolarHBondContact O-CZ3 3.29Å; E482-W488 CarbonylContact O-C 3.58Å; E482-W488 WeakPolarHBondContact O-CA 3.46Å; L483-W488 HydrophobicContact CB-CD2 4.35Å; L483-W488 HydrophobicContact CB-CE3 4.36Å; L483-W488 HydrophobicContact CB-CH2 4.32Å; L483-W488 HydrophobicContact CB-CZ2 4.31Å; L483-W488 HydrophobicContact CB-CZ3 4.35Å; L483-W488 HydrophobicContact CD1-CD2 4.44Å; L483-W488 HydrophobicContact CD1-CG 4.48Å; W488-G496 PolarHBondContact O-N 3.5Å
489	R	94.8	Very high	92.7	Very high	45 Å²	45	69.6 Å²	69.6	17%	0.17	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137	-175	-60.5	-67.7	167	178	-6.2	111.6	G481 E482 K484 R486 D493 R494	G481-R489 CarbonylContact C-O 3.58Å; G481-R489 VanDerWaalsContact CA-O 3.26Å; G481-R489 WeakPolarHBondContact CA-O 3.26Å; E482-R489 PolarHBondContact N-O 3.18Å; E482-R489 PolarHBondContact O-N 3.41Å; K484-R489 HydrophobicContact CB-CG 4.28Å; K484-R489 HydrophobicContact CD-CB 3.94Å; K484-R489 HydrophobicContact CD-CG 4.03Å; K484-R489 HydrophobicContact CG-CB 4.33Å; K484-R489 HydrophobicContact CG-CG 4.3Å; R486-R489 PolarHBondContact O-NE 2.99Å; R486-R489 PolarHBondContact O-NH2 3.4Å; R489-D493 WeakPolarHBondContact CD-O 3.37Å; R489-D493 PolarHBondContact NH1-O 2.98Å; R489-R494 WeakPolarHBondContact CA-O 3.43Å
490	I	94.6	Very high	92.7	Very high	10 Å²	10	69.8 Å²	69.8	5%	0.051	35%	0.354	C	S	.	.			trans	-97.2	-172.1	172.7	65.9	173.7	0	0	0	110	V443 L444 R478 A479 D493 R494	V443-I490 HydrophobicContact CB-CD1 4.31Å; L444-I490 HydrophobicContact CD2-CD1 4.38Å; R478-I490 WeakPolarHBondContact O-CG2 3.3Å; A479-I490 WeakPolarHBondContact O-CG2 3.44Å; I490-D493 PolarHBondContact O-N 2.76Å; I490-R494 HydrophobicContact CD1-CB 3.97Å; I490-R494 HydrophobicContact CG1-CB 3.65Å; I490-R494 PolarHBondContact N-O 3.32Å
491	T	89.6	Confident	92.8	Very high	96 Å²	96	68 Å²	68	59%	0.589	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-53.5	146.5	175.1	53.4	0	0	0	0	111.6	D493	T491-D493 PolarHBondContact O-N 3.49Å
492	N	89.2	Confident	92.9	Very high	151 Å²	151	67.7 Å²	67.7	81%	0.807	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	61	22.2	-174.6	-53.2	-33.4	0	0	0	114.8	R494	N492-R494 PolarHBondContact O-N 2.98Å; N492-R494 VanDerWaalsContact O-N 3.13Å
493	D	89.5	Confident	93.1	Very high	79 Å²	79	61.4 Å²	61.4	42%	0.422	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	61.4	18.2	176.8	-148.2	47	0	0	0	114.9	K484 R489 I490 T491	K484-D493 IonicContact NZ-OD1 3.86Å; R489-D493 WeakPolarHBondContact CD-O 3.37Å; R489-D493 PolarHBondContact NH1-O 2.98Å; I490-D493 PolarHBondContact O-N 2.76Å; T491-D493 PolarHBondContact O-N 3.49Å
494	R	94.3	Very high	93.5	Very high	94 Å²	94	56.6 Å²	56.6	36%	0.355	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-63.8	152.5	168.4	-62.9	-175.9	-61.5	-179.8	-0.1	109.7	E448 R489 I490 N492 G496	E448-R494 IonicContact OE1-CZ 2.9Å; E448-R494 VanDerWaalsContact OE1-CZ 3.24Å; E448-R494 IonicContact OE1-NH1 3.84Å; E448-R494 PolarHBondContact OE1-NH1 3.35Å; E448-R494 IonicContact OE1-NH2 3.24Å; E448-R494 PolarHBondContact OE1-NH2 3.43Å; E448-R494 IonicContact OE2-NH1 3.51Å; R489-R494 WeakPolarHBondContact CA-O 3.43Å; I490-R494 HydrophobicContact CD1-CB 3.97Å; I490-R494 HydrophobicContact CG1-CB 3.65Å; I490-R494 PolarHBondContact N-O 3.32Å; N492-R494 PolarHBondContact O-N 2.98Å; N492-R494 VanDerWaalsContact O-N 3.13Å; R494-G496 PolarHBondContact O-N 2.93Å
495	L	94.5	Very high	93.8	Very high	114 Å²	114	52.2 Å²	52.2	60%	0.597	27%	0.271	S	S	*	.	B	Isolated β-bridge	trans	-59.8	130.4	174	-75.5	166.6	0	0	0	109.6
496	G	96.1	Very high	94.4	Very high	11 Å²	11	43.9 Å²	43.9	11%	0.113	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-76.8	168.4	166.6	0	0	0	0	0	111.9	W488 R494 G498	W488-G496 PolarHBondContact O-N 3.5Å; R494-G496 PolarHBondContact O-N 2.93Å; G496-G498 PolarHBondContact O-N 2.84Å
497	S	96.8	Very high	95.2	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.021	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-66.4	126.1	-178.2	-176.5	0	0	0	0	110.4	R59 G439 A479 D499	R59-S497 PolarHBondContact NH1-O 2.81Å; R59-S497 PolarHBondContact NH2-O 3.1Å; G439-S497 WeakPolarHBondContact CA-OG 3.42Å; G439-S497 WeakPolarHBondContact O-CB 3.24Å; G439-S497 PolarHBondContact O-OG 3.21Å; A479-S497 PolarHBondContact O-N 3.08Å; S497-D499 VanDerWaalsContact C-N 3.32Å; S497-D499 PolarHBondContact OG-N 2.67Å; S497-D499 VanDerWaalsContact OG-N 3.16Å
498	G	95.4	Very high	95.5	Very high	28 Å²	28	33.3 Å²	33.3	29%	0.289	18%	0.178	S	C	.	.			trans	-89.6	-0.5	169.4	0	0	0	0	0	113	N81 A82 K84 G496	N81-G498 WeakPolarHBondContact CB-O 3.3Å; A82-G498 PolarHBondContact N-O 3.31Å; K84-G498 VanDerWaalsContact CE-O 3.27Å; K84-G498 WeakPolarHBondContact CE-O 3.4Å; G496-G498 PolarHBondContact O-N 2.84Å
499	D	96.9	Very high	95.6	Very high	29 Å²	29	33.6 Å²	33.6	16%	0.155	18%	0.181	C	C	.	.	S	Bend	trans	-95.6	170.2	-177.9	-118.6	-16.8	0	0	0	113.5	R59 N81 K84 S497	R59-D499 PolarHBondContact NH2-O 3.09Å; N81-D499 VanDerWaalsContact CA-C 3.46Å; N81-D499 WeakPolarHBondContact CA-O 3.46Å; N81-D499 VanDerWaalsContact CB-C 3.49Å; K84-D499 WeakPolarHBondContact CD-OD1 3.5Å; K84-D499 IonicContact NZ-OD1 3.7Å; K84-D499 PolarHBondContact NZ-OD1 3.28Å; K84-D499 IonicContact NZ-OD2 3.42Å; K84-D499 PolarHBondContact NZ-OD2 3.27Å; S497-D499 VanDerWaalsContact C-N 3.32Å; S497-D499 PolarHBondContact OG-N 2.67Å; S497-D499 VanDerWaalsContact OG-N 3.16Å
500	D	98.5	Very high	95.1	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.016	19%	0.186	C	C	.	.			trans	-59.5	141.5	162	-68.1	-37.4	0	0	0	108	V79 I80 N81 N88 E89 D90 G439	V79-D500 WeakPolarHBondContact O-CA 3.41Å; I80-D500 VanDerWaalsContact CA-OD1 3.26Å; I80-D500 WeakPolarHBondContact CA-OD1 3.33Å; N81-D500 WeakPolarHBondContact CB-OD1 3.42Å; N81-D500 PolarHBondContact N-OD1 3.03Å; N81-D500 PolarHBondContact ND2-OD1 3.1Å; N81-D500 PolarHBondContact ND2-OD2 3.29Å; N88-D500 WeakPolarHBondContact OD1-CB 3.43Å; N88-D500 PolarHBondContact OD1-OD1 2.88Å; N88-D500 PolarHBondContact OD1-OD2 3.48Å; N88-D500 VanDerWaalsContact OD1-OD2 3.12Å; E89-D500 PolarHBondContact N-OD2 3.16Å; D90-D500 HydrophobicContact CB-CB 4.38Å; G439-D500 WeakPolarHBondContact CA-O 3.47Å
501	I	98.8	Very high	94.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.7	178.3	-42.7	175.6	0	0	0	107.1	E78 V79 L440 V476 A479 R480 V503	E78-I501 CarbonylContact C-O 3.47Å; E78-I501 WeakPolarHBondContact CA-O 3.41Å; E78-I501 WeakPolarHBondContact CB-O 3.32Å; V79-I501 HydrophobicContact CG1-CB 3.86Å; V79-I501 HydrophobicContact CG1-CD1 3.81Å; V79-I501 HydrophobicContact CG1-CG1 3.85Å; V79-I501 PolarHBondContact N-O 3.45Å; V79-I501 PolarHBondContact O-N 3.05Å; L440-I501 HydrophobicContact CB-CG2 3.96Å; V476-I501 HydrophobicContact CG2-CG2 4.23Å; A479-I501 HydrophobicContact CB-CD1 3.83Å; R480-I501 HydrophobicContact CB-CD1 4.14Å; I501-V503 HydrophobicContact CG2-CG2 4.16Å
502	S	98.8	Very high	92.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.3	174.5	-61.2	0	0	0	0	109.5	D90 G436 T437	D90-S502 WeakPolarHBondContact CB-OG 3.49Å; D90-S502 WeakPolarHBondContact OD2-CB 3.49Å; D90-S502 PolarHBondContact OD2-N 3.36Å; D90-S502 PolarHBondContact OD2-OG 3.38Å; G436-S502 VanDerWaalsContact CA-O 3.24Å; G436-S502 WeakPolarHBondContact CA-O 3.5Å; T437-S502 PolarHBondContact N-O 3.02Å; T437-S502 VanDerWaalsContact N-O 3.14Å; T437-S502 PolarHBondContact OG1-N 2.87Å
503	V	98.8	Very high	91.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.1	-173.9	174.4	0	0	0	0	111.2	Y76 A77 L435 L440 A472 L475 V476 I501 I505	Y76-V503 VanDerWaalsContact CA-O 3.3Å; Y76-V503 WeakPolarHBondContact CA-O 3.4Å; Y76-V503 WeakPolarHBondContact CD2-O 3.34Å; A77-V503 PolarHBondContact N-O 3.34Å; A77-V503 VanDerWaalsContact N-O 3.15Å; A77-V503 PolarHBondContact O-N 3.07Å; L435-V503 VanDerWaalsContact O-CA 3.3Å; L435-V503 WeakPolarHBondContact O-CA 3.48Å; L440-V503 HydrophobicContact CD2-CG2 3.95Å; A472-V503 HydrophobicContact CB-CG1 4.22Å; L475-V503 HydrophobicContact CD2-CG1 3.91Å; L475-V503 HydrophobicContact CD2-CG2 4.45Å; V476-V503 HydrophobicContact CG2-CB 4.09Å; V476-V503 HydrophobicContact CG2-CG2 3.77Å; I501-V503 HydrophobicContact CG2-CG2 4.16Å; V503-I505 HydrophobicContact CG1-CG1 4.2Å
504	Y	98.8	Very high	89.3	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	142.9	161	-77.4	-68.7	0	0	0	111.4	F42 L70 T74 G75 Y76 A92 C93 W144 L146 I434 L435	F42-Y504 WeakPolarHBondContact CE1-OH 3.44Å; F42-Y504 HydrophobicContact CZ-CE1 4.22Å; F42-Y504 AromaticContact CZ-CZ 3.99Å; F42-Y504 VanDerWaalsContact CZ-OH 3.24Å; F42-Y504 WeakPolarHBondContact CZ-OH 3.4Å; L70-Y504 HydrophobicContact CD1-CD1 4.43Å; L70-Y504 HydrophobicContact CD1-CE1 3.86Å; T74-Y504 HydrophobicContact CG2-CD1 3.57Å; T74-Y504 HydrophobicContact CG2-CE1 4.17Å; T74-Y504 HydrophobicContact CG2-CG 4.47Å; G75-Y504 WeakPolarHBondContact O-CA 3.4Å; Y76-Y504 AromaticContact CD2-CD1 3.54Å; Y76-Y504 HydrophobicContact CD2-CD1 3.54Å; Y76-Y504 HydrophobicContact CD2-CD2 4.17Å; Y76-Y504 AromaticContact CD2-CE1 3.41Å; Y76-Y504 HydrophobicContact CD2-CE1 3.41Å; Y76-Y504 VanDerWaalsContact CD2-CE1 3.41Å; Y76-Y504 HydrophobicContact CD2-CE2 4.08Å; Y76-Y504 AromaticContact CD2-CG 3.92Å; Y76-Y504 HydrophobicContact CD2-CG 3.92Å; Y76-Y504 AromaticContact CD2-CZ 3.72Å; Y76-Y504 HydrophobicContact CE2-CD2 4.47Å; Y76-Y504 HydrophobicContact CE2-CE1 4.26Å; Y76-Y504 HydrophobicContact CE2-CE2 4.2Å; Y76-Y504 HydrophobicContact CG-CD1 4.19Å; Y76-Y504 AromaticContact CG-CE1 3.98Å; Y76-Y504 HydrophobicContact CG-CE1 3.98Å; A92-Y504 HydrophobicContact CB-CE2 4.02Å; C93-Y504 PolarHBondContact O-OH 3.23Å; W144-Y504 HydrophobicContact CB-CE2 4.47Å; L146-Y504 HydrophobicContact CD1-CD2 4.4Å; L146-Y504 HydrophobicContact CD2-CD2 3.57Å; L146-Y504 HydrophobicContact CD2-CE2 3.52Å; L146-Y504 HydrophobicContact CG-CD2 3.85Å; L146-Y504 HydrophobicContact CG-CE2 4.1Å; I434-Y504 WeakPolarHBondContact CA-O 3.3Å; L435-Y504 HydrophobicContact CD2-CD2 4.22Å; L435-Y504 PolarHBondContact N-O 3.34Å; L435-Y504 PolarHBondContact O-N 2.93Å
505	I	98.5	Very high	86.6	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	109.2	163.6	-60	-172.2	0	0	0	108.1	G75 V432 I434 V453 Y468 A471 A472 V503	G75-I505 PolarHBondContact N-O 2.86Å; G75-I505 PolarHBondContact O-N 2.97Å; V432-I505 HydrophobicContact CB-CG2 3.94Å; V432-I505 HydrophobicContact CG1-CG2 3.85Å; V432-I505 HydrophobicContact CG2-CG2 4.22Å; I434-I505 HydrophobicContact CG1-CG1 4.49Å; V453-I505 HydrophobicContact CG1-CD1 4.14Å; V453-I505 HydrophobicContact CG2-CD1 3.82Å; Y468-I505 HydrophobicContact CD1-CG2 3.87Å; Y468-I505 HydrophobicContact CG-CG2 4.45Å; A471-I505 VanDerWaalsContact C-CD1 3.48Å; A471-I505 HydrophobicContact CB-CD1 3.58Å; A472-I505 HydrophobicContact CB-CD1 4.11Å; A472-I505 HydrophobicContact CB-CG1 4.08Å; A472-I505 VanDerWaalsContact N-CD1 3.35Å; V503-I505 HydrophobicContact CG1-CG1 4.2Å
506	I	97.9	Very high	86.2	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	110.8	-173.4	-56.4	164.9	0	0	0	108.8	W72 T74 W144 V432 L433 L435	W72-I506 HydrophobicContact CE3-CG2 3.78Å; W72-I506 HydrophobicContact CZ3-CG2 4.2Å; T74-I506 HydrophobicContact CG2-CG1 3.73Å; W144-I506 HydrophobicContact CB-CD1 3.98Å; W144-I506 HydrophobicContact CD2-CD1 3.75Å; W144-I506 HydrophobicContact CD2-CG1 4.44Å; W144-I506 HydrophobicContact CE3-CD1 4.3Å; W144-I506 HydrophobicContact CG-CD1 3.6Å; W144-I506 HydrophobicContact CG-CG1 4.35Å; W144-I506 HydrophobicContact CH2-CG2 4.31Å; W144-I506 HydrophobicContact CZ2-CG2 3.97Å; V432-I506 CarbonylContact C-O 3.49Å; V432-I506 WeakPolarHBondContact CA-O 3.2Å; L433-I506 HydrophobicContact CB-CB 4.29Å; L433-I506 HydrophobicContact CD2-CD1 4.18Å; L433-I506 PolarHBondContact N-O 3.49Å; L433-I506 PolarHBondContact O-N 3.32Å; L435-I506 HydrophobicContact CD1-CD1 3.91Å
507	P	96.5	Very high	85.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	131.5	176.9	25.1	-32.8	0	0	0	113.2	W72 Y468 M509 Y510	W72-P507 HydrophobicContact CB-CG 4.43Å; W72-P507 WeakPolarHBondContact O-CD 3.14Å; W72-P507 WeakPolarHBondContact O-CG 3.49Å; Y468-P507 HydrophobicContact CD1-CB 4.34Å; Y468-P507 HydrophobicContact CD1-CG 4.45Å; Y468-P507 HydrophobicContact CD2-CB 4.38Å; Y468-P507 HydrophobicContact CD2-CG 3.86Å; Y468-P507 HydrophobicContact CE1-CB 3.72Å; Y468-P507 HydrophobicContact CE1-CG 4.22Å; Y468-P507 HydrophobicContact CE2-CB 3.78Å; Y468-P507 HydrophobicContact CE2-CG 3.59Å; Y468-P507 HydrophobicContact CG-CG 4.29Å; Y468-P507 VanDerWaalsContact CZ-CB 3.4Å; Y468-P507 WeakPolarHBondContact OH-CB 3.48Å; P507-M509 HydrophobicContact CB-CG 4.48Å; P507-Y510 HydrophobicContact CB-CD2 4.02Å; P507-Y510 HydrophobicContact CB-CE2 4.01Å; P507-Y510 HydrophobicContact CG-CD2 3.64Å; P507-Y510 HydrophobicContact CG-CE2 3.53Å
508	L	96.2	Very high	85.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-80.7	-22.2	-174.4	-62	-179	0	0	0	113.2	L282 I294 L422 H427 D431 L433 Y510 G511	L282-L508 HydrophobicContact CD1-CD2 3.65Å; I294-L508 HydrophobicContact CD1-CD1 4.4Å; I294-L508 HydrophobicContact CG1-CD1 4.29Å; I294-L508 HydrophobicContact CG2-CD1 3.76Å; L422-L508 HydrophobicContact CD1-CB 4.07Å; L422-L508 HydrophobicContact CD1-CD2 3.92Å; L422-L508 HydrophobicContact CD1-CG 4.46Å; H427-L508 HydrophobicContact CB-CB 3.85Å; D431-L508 HydrophobicContact CB-CD1 4.48Å; D431-L508 WeakPolarHBondContact O-CB 3.47Å; D431-L508 PolarHBondContact O-N 2.73Å; L433-L508 HydrophobicContact CB-CD2 3.89Å; L508-Y510 PolarHBondContact O-N 3.13Å; L508-Y510 VanDerWaalsContact O-N 3.09Å; L508-G511 PolarHBondContact O-N 3Å; L508-G511 VanDerWaalsContact O-N 3.11Å
509	M	92.3	Very high	84.5	Confident	41 Å²	41	36.5 Å²	36.5	20%	0.202	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-59.6	-22.9	-177.5	67	173.8	179.7	0	0	114.8	H427 A429 Y468 P507	H427-M509 HydrophobicContact CB-CB 4.47Å; H427-M509 WeakPolarHBondContact O-CB 3.24Å; A429-M509 HydrophobicContact CB-CE 4.28Å; A429-M509 HydrophobicContact CB-SD 3.82Å; Y468-M509 WeakPolarHBondContact OH-CE 3.23Å; P507-M509 HydrophobicContact CB-CG 4.48Å
510	Y	86.3	Confident	83.7	Confident	71 Å²	71	37 Å²	37	28%	0.278	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-80.6	-24.9	179.6	-64.7	-76.7	0	0	0	113.3	W72 P507 L508 N512 K513	W72-Y510 HydrophobicContact CB-CD2 3.62Å; W72-Y510 HydrophobicContact CB-CE2 4.32Å; W72-Y510 HydrophobicContact CB-CG 3.92Å; W72-Y510 VanDerWaalsContact CG-CB 3.5Å; W72-Y510 HydrophobicContact CG-CD2 4.18Å; W72-Y510 HydrophobicContact CG-CG 4.03Å; W72-Y510 WeakPolarHBondContact O-CD2 3.27Å; W72-Y510 WeakPolarHBondContact O-CE2 3.37Å; P507-Y510 HydrophobicContact CB-CD2 4.02Å; P507-Y510 HydrophobicContact CB-CE2 4.01Å; P507-Y510 HydrophobicContact CG-CD2 3.64Å; P507-Y510 HydrophobicContact CG-CE2 3.53Å; L508-Y510 PolarHBondContact O-N 3.13Å; L508-Y510 VanDerWaalsContact O-N 3.09Å; Y510-N512 VanDerWaalsContact C-N 3.25Å; Y510-N512 PolarHBondContact O-N 3.26Å; Y510-K513 PolarHBondContact O-N 2.71Å
511	G	73.2	Confident	82.7	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.01	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-68.6	-24.4	-179.5	0	0	0	0	0	114	L508 K513	L508-G511 PolarHBondContact O-N 3Å; L508-G511 VanDerWaalsContact O-N 3.11Å; G511-K513 VanDerWaalsContact C-N 3.25Å; G511-K513 PolarHBondContact O-N 3.18Å
512	N	60.9	Low	81.5	Confident	51 Å²	51	42.1 Å²	42.1	27%	0.273	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-74.8	-12.5	177.6	-71.6	-4.3	0	0	0	113.5	L422 F425 H427 Y510	L422-N512 PolarHBondContact O-OD1 2.7Å; F425-N512 PolarHBondContact O-ND2 3.08Å; H427-N512 PolarHBondContact ND1-ND2 3.14Å; Y510-N512 VanDerWaalsContact C-N 3.25Å; Y510-N512 PolarHBondContact O-N 3.26Å
513	K	56.5	Low	80.2	Confident	164 Å²	164	45.3 Å²	45.3	71%	0.713	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-94.4	6.6	-177.4	-62.9	-177.5	-179.8	175.9	0	113.7	Y510 G511	Y510-K513 PolarHBondContact O-N 2.71Å; G511-K513 VanDerWaalsContact C-N 3.25Å; G511-K513 PolarHBondContact O-N 3.18Å
514	Q	49.8	Very low	78.7	Confident	82 Å²	82	49.1 Å²	49.1	38%	0.383	24%	0.235	S	C	.	.			trans	-103.4	11.9	-174.2	-64.4	-170.6	-5.6	0	0	114.7	H142	H142-Q514 PolarHBondContact CE1-NE2 2.79Å; H142-Q514 PolarHBondContact CE1-OE1 3.42Å; H142-Q514 PolarHBondContact ND1-OE1 2.75Å; H142-Q514 PolarHBondContact NE2-NE2 3.17Å; H142-Q514 VanDerWaalsContact NE2-NE2 3.17Å
515	N	37.1	Very low	76.8	Confident	177 Å²	177	53.5 Å²	53.5	95%	0.947	26%	0.256	S	S	*	.			trans	-94.2	0	173.5	-78.8	-5.8	0	0	0	112.1

Retrieved 515 of 515 residues in 136.1 ms (Link to these results)

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