A0A077ZFV4_TRITR Loading...

protein-serine/threonine phosphatase

AlphaFold DB , UniProt , Accession A0A077ZFV4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 351 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	27.1	Very low	35	Very low	245 Å²	245	117.6 Å²	117.6	100%	1.207	57%	0.574	S	S	*	*				0	126	0	-78.7	-175.8	-178.8	0	0	107.6
2	R	27.5	Very low	36.3	Very low	223 Å²	223	117.3 Å²	117.3	84%	0.842	57%	0.567	S	S	*	*			trans	44.6	84.7	-173.3	-77.8	-176.3	175.1	177.6	-0.8	117.6	Q4	R2-Q4 VanDerWaalsContact C-N 3.29Å; R2-Q4 PolarHBondContact O-N 3.05Å; R2-Q4 VanDerWaalsContact O-N 3.15Å
3	N	25.6	Very low	37	Very low	160 Å²	160	109 Å²	109	86%	0.856	53%	0.531	S	S	*	.			trans	-67.5	93.4	141.8	-88.9	-3.7	0	0	0	106.9	N5	N3-N5 PolarHBondContact O-N 2.88Å
4	Q	30.1	Very low	37.3	Very low	142 Å²	142	101.4 Å²	101.4	66%	0.664	50%	0.495	S	S	*	.			trans	-70.6	110.8	157.9	-82	178	-25.2	0	0	105.8	R2 E6	R2-Q4 VanDerWaalsContact C-N 3.29Å; R2-Q4 PolarHBondContact O-N 3.05Å; R2-Q4 VanDerWaalsContact O-N 3.15Å; Q4-E6 VanDerWaalsContact C-N 3.28Å; Q4-E6 PolarHBondContact O-N 3.48Å
5	N	28.1	Very low	38.4	Very low	116 Å²	116	94.8 Å²	94.8	62%	0.62	46%	0.463	S	S	*	.			trans	-62.6	93.6	172.3	-81.4	-0	0	0	0	108.2	N3	N3-N5 PolarHBondContact O-N 2.88Å
6	E	37	Very low	39.3	Very low	66 Å²	66	91.1 Å²	91.1	31%	0.308	45%	0.448	S	S	.	.			trans	-74.2	128.2	169.4	-69.6	177.3	167.5	0	0	108.8	Q4 Y8 I17 T55	Q4-E6 VanDerWaalsContact C-N 3.28Å; Q4-E6 PolarHBondContact O-N 3.48Å; E6-Y8 HydrophobicContact CB-CE2 4.31Å; E6-I17 HydrophobicContact CB-CG2 4Å; E6-I17 HydrophobicContact CG-CG2 4.25Å; E6-T55 VanDerWaalsContact OE1-CG2 3.27Å; E6-T55 WeakPolarHBondContact OE1-CG2 3.24Å
7	C	32.3	Very low	40	Very low	55 Å²	55	86.7 Å²	86.7	37%	0.372	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.9	175.8	-81.1	0	0	0	0	109.3	L18	C7-L18 PolarHBondContact O-N 3.15Å
8	Y	43	Very low	39.9	Very low	106 Å²	106	84.7 Å²	84.7	42%	0.416	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	114.4	176.3	-60.8	-99.7	0	0	0	108.3	E6 I17 L47	E6-Y8 HydrophobicContact CB-CE2 4.31Å; Y8-I17 HydrophobicContact CD1-CD1 3.83Å; Y8-I17 HydrophobicContact CD1-CG1 3.58Å; Y8-I17 HydrophobicContact CE1-CD1 3.46Å; Y8-I17 VanDerWaalsContact CE1-CD1 3.46Å; Y8-I17 HydrophobicContact CE1-CG1 3.69Å; Y8-I17 HydrophobicContact CG-CG1 4.35Å; Y8-L47 HydrophobicContact CE1-CD1 4.32Å
9	F	43.3	Very low	39.4	Very low	94 Å²	94	84.2 Å²	84.2	41%	0.412	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	108	167.4	-100	-91.8	0	0	0	108.4	A15 V16 L18	F9-A15 CarbonylContact O-C 3.54Å; F9-A15 VanDerWaalsContact O-CA 3.24Å; F9-A15 WeakPolarHBondContact O-CA 3.41Å; F9-V16 PolarHBondContact N-O 3.03Å; F9-V16 PolarHBondContact O-N 3.49Å; F9-L18 HydrophobicContact CD2-CD1 4Å; F9-L18 HydrophobicContact CE2-CD1 4.48Å
10	A	45.1	Very low	38.8	Very low	41 Å²	41	87.5 Å²	87.5	34%	0.339	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	106.6	168.3	0	0	0	0	0	108.6	A14 I39	A10-A14 CarbonylContact C-O 3.45Å; A10-A14 WeakPolarHBondContact CA-O 3.35Å; A10-I39 HydrophobicContact CB-CG2 4.22Å
11	V	46.5	Very low	38.4	Very low	46 Å²	46	90.5 Å²	90.5	28%	0.279	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	154.8	158.7	-171.5	0	0	0	0	107.2	G13 A14 D233	V11-G13 PolarHBondContact O-N 3.3Å; V11-A14 CarbonylContact C-O 3.35Å; V11-A14 WeakPolarHBondContact CA-O 3.48Å; V11-A14 HydrophobicContact CB-CB 4.41Å; V11-A14 PolarHBondContact N-O 3.48Å; V11-A14 CarbonylContact O-C 3.54Å; V11-A14 PolarHBondContact O-N 3.27Å; V11-D233 VanDerWaalsContact CG1-CG 3.45Å; V11-D233 WeakPolarHBondContact CG1-OD1 3.17Å; V11-D233 WeakPolarHBondContact CG1-OD2 3.31Å
12	K	50.1	Low	38.5	Very low	113 Å²	113	84.6 Å²	84.6	49%	0.491	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	108	-179.3	-85.3	178.5	175.9	171.1	0	109.6	E234	K12-E234 IonicContact NZ-OE1 2.7Å; K12-E234 PolarHBondContact NZ-OE1 3.27Å
13	G	46	Very low	38.4	Very low	10 Å²	10	77.6 Å²	77.6	10%	0.103	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-3.5	-178.7	0	0	0	0	0	116.5	V11 R61	V11-G13 PolarHBondContact O-N 3.3Å; G13-R61 WeakPolarHBondContact O-CB 3.45Å; G13-R61 PolarHBondContact O-N 3.16Å
14	A	40.7	Very low	38.4	Very low	2 Å²	2	74.1 Å²	74.1	2%	0.017	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	131.9	177.9	0	0	0	0	0	110.8	A10 V11 V60	A10-A14 CarbonylContact C-O 3.45Å; A10-A14 WeakPolarHBondContact CA-O 3.35Å; V11-A14 CarbonylContact C-O 3.35Å; V11-A14 WeakPolarHBondContact CA-O 3.48Å; V11-A14 HydrophobicContact CB-CB 4.41Å; V11-A14 PolarHBondContact N-O 3.48Å; V11-A14 CarbonylContact O-C 3.54Å; V11-A14 PolarHBondContact O-N 3.27Å; A14-V60 HydrophobicContact CB-CG1 4.38Å; A14-V60 HydrophobicContact CB-CG2 3.8Å
15	A	54.4	Low	38.2	Very low	3 Å²	3	73.7 Å²	73.7	3%	0.025	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.3	170.9	0	0	0	0	0	109.6	F9 L43 M58 A59	F9-A15 CarbonylContact O-C 3.54Å; F9-A15 VanDerWaalsContact O-CA 3.24Å; F9-A15 WeakPolarHBondContact O-CA 3.41Å; A15-L43 HydrophobicContact CB-CD1 3.36Å; A15-L43 HydrophobicContact CB-CD2 3.63Å; A15-L43 HydrophobicContact CB-CG 4.11Å; A15-M58 WeakPolarHBondContact O-CA 3.35Å; A15-A59 PolarHBondContact N-O 2.89Å; A15-A59 PolarHBondContact O-N 2.81Å
16	V	51.6	Low	38.2	Very low	35 Å²	35	75.7 Å²	75.7	21%	0.212	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.7	177.8	-175.8	0	0	0	0	108.3	F9 L18 M58	F9-V16 PolarHBondContact N-O 3.03Å; F9-V16 PolarHBondContact O-N 3.49Å; V16-L18 HydrophobicContact CG1-CD2 4.33Å; V16-M58 HydrophobicContact CG2-CE 3.74Å
17	I	52	Low	37.6	Very low	17 Å²	17	83.9 Å²	83.9	9%	0.087	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	104.9	175.9	-68.8	159.7	0	0	0	107.1	E6 Y8 L56 K57	E6-I17 HydrophobicContact CB-CG2 4Å; E6-I17 HydrophobicContact CG-CG2 4.25Å; Y8-I17 HydrophobicContact CD1-CD1 3.83Å; Y8-I17 HydrophobicContact CD1-CG1 3.58Å; Y8-I17 HydrophobicContact CE1-CD1 3.46Å; Y8-I17 VanDerWaalsContact CE1-CD1 3.46Å; Y8-I17 HydrophobicContact CE1-CG1 3.69Å; Y8-I17 HydrophobicContact CG-CG1 4.35Å; I17-L56 HydrophobicContact CD1-CB 3.65Å; I17-L56 HydrophobicContact CD1-CD2 4.02Å; I17-L56 HydrophobicContact CD1-CG 3.8Å; I17-L56 WeakPolarHBondContact CD1-O 3.2Å; I17-K57 PolarHBondContact N-O 3.33Å; I17-K57 VanDerWaalsContact N-O 3.14Å
18	L	37.2	Very low	37.5	Very low	50 Å²	50	92 Å²	92	26%	0.262	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	116.9	174.8	-68.4	172.9	0	0	0	108.5	C7 F9 V16	C7-L18 PolarHBondContact O-N 3.15Å; F9-L18 HydrophobicContact CD2-CD1 4Å; F9-L18 HydrophobicContact CE2-CD1 4.48Å; V16-L18 HydrophobicContact CG1-CD2 4.33Å
19	A	30.9	Very low	36.7	Very low	76 Å²	76	95.5 Å²	95.5	63%	0.628	48%	0.479	S	S	*	.			trans	-60.7	142.5	158.8	0	0	0	0	0	107.8	N21	A19-N21 PolarHBondContact O-N 3.17Å
20	K	28.2	Very low	36.2	Very low	149 Å²	149	95.9 Å²	95.9	65%	0.648	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	23.3	-156.9	-138.6	-179.2	-177.8	-172.6	0	118
21	N	29.4	Very low	35.3	Very low	152 Å²	152	98.8 Å²	98.8	81%	0.813	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-11.9	-178.1	-82.5	13.1	0	0	0	116	A19	A19-N21 PolarHBondContact O-N 3.17Å
22	D	28.8	Very low	34.4	Very low	121 Å²	121	101.8 Å²	101.8	65%	0.647	54%	0.54	S	S	*	.			trans	-112.1	17.8	-174.1	-64.7	-30.2	0	0	0	115.1	S24	D22-S24 PolarHBondContact O-N 3.06Å; D22-S24 VanDerWaalsContact O-N 3.13Å
23	C	26.7	Very low	33.7	Very low	75 Å²	75	100.4 Å²	100.4	51%	0.507	55%	0.545	S	S	.	.			trans	-88.9	77.1	179.2	-70.1	0	0	0	0	112.8
24	S	24.2	Very low	33.3	Very low	88 Å²	88	103.6 Å²	103.6	62%	0.615	58%	0.578	S	S	*	*			trans	-127.6	55.9	156.5	58	0	0	0	0	111	D22	D22-S24 PolarHBondContact O-N 3.06Å; D22-S24 VanDerWaalsContact O-N 3.13Å
25	M	27.6	Very low	33.6	Very low	132 Å²	132	105.7 Å²	105.7	65%	0.65	60%	0.6	S	S	*	*	S	Bend	trans	-141.1	146.3	166.1	-86.1	-60.8	150.6	0	0	112.2
26	H	27.8	Very low	33.7	Very low	158 Å²	158	108.7 Å²	108.7	73%	0.731	62%	0.62	S	S	*	*			trans	-57.2	131.5	-153.4	-70.6	-68	0	0	0	116.8	R28	H26-R28 PolarHBondContact O-N 2.88Å
27	R	24.5	Very low	34.3	Very low	238 Å²	238	108.9 Å²	108.9	90%	0.898	63%	0.629	S	S	*	*			trans	-65.9	77.3	162.3	-161.2	-176.7	-150.4	-171.9	6.2	109.8	Q29	R27-Q29 PolarHBondContact O-N 3.13Å
28	R	29.3	Very low	35.5	Very low	226 Å²	226	111.1 Å²	111.1	85%	0.853	64%	0.639	S	S	*	*			trans	-79.2	109.1	164	-77.1	-172.1	178.4	-179	1.5	108.1	H26 A30	H26-R28 PolarHBondContact O-N 2.88Å; R28-A30 PolarHBondContact O-N 3.46Å
29	Q	25.9	Very low	37.3	Very low	180 Å²	180	109.1 Å²	109.1	84%	0.841	63%	0.629	S	S	*	*			trans	-58.7	105.6	168.5	-70.1	175.8	-15.6	0	0	108.2	R27 S31	R27-Q29 PolarHBondContact O-N 3.13Å; Q29-S31 PolarHBondContact O-N 3.03Å
30	A	32.5	Very low	39.4	Very low	102 Å²	102	110.7 Å²	110.7	84%	0.843	62%	0.623	S	S	*	*			trans	-87	100	170.7	0	0	0	0	0	109	R28	R28-A30 PolarHBondContact O-N 3.46Å
31	S	26.2	Very low	42	Very low	102 Å²	102	109.3 Å²	109.3	71%	0.713	61%	0.614	S	S	*	*			trans	-66.2	134.5	160.5	46.9	0	0	0	0	110.7	Q29	Q29-S31 PolarHBondContact O-N 3.03Å
32	S	29.1	Very low	44.8	Very low	109 Å²	109	102.2 Å²	102.2	76%	0.762	58%	0.576	S	S	*	*			trans	54.6	98.2	155.8	61.6	0	0	0	0	119.6
33	S	34.7	Very low	47.4	Very low	84 Å²	84	97.1 Å²	97.1	59%	0.587	55%	0.548	S	S	*	.			trans	-175.4	136.6	137	45.6	0	0	0	0	110.4	G35	S33-G35 PolarHBondContact O-N 3.02Å
34	G	37.3	Very low	50.2	Low	77 Å²	77	99.8 Å²	99.8	79%	0.794	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-7.6	-163.7	0	0	0	0	0	118.5
35	G	48	Very low	53.1	Low	46 Å²	46	96.8 Å²	96.8	47%	0.474	53%	0.532	S	S	.	.	H	α-helix	trans	-72.9	-27.9	-178.3	0	0	0	0	0	115.1	S33 G37 E38 I39	S33-G35 PolarHBondContact O-N 3.02Å; G35-G37 VanDerWaalsContact C-N 3.33Å; G35-G37 PolarHBondContact O-N 3.39Å; G35-E38 PolarHBondContact O-N 3.27Å; G35-I39 PolarHBondContact O-N 3.34Å
36	S	55.5	Low	56	Low	65 Å²	65	90.6 Å²	90.6	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-69.6	-31.3	-179.6	-173.3	0	0	0	0	112.6	I39 Q40	S36-I39 WeakPolarHBondContact O-CG2 3.31Å; S36-Q40 WeakPolarHBondContact O-CG 3.47Å; S36-Q40 PolarHBondContact O-N 3.05Å
37	G	65.2	Low	58.9	Low	39 Å²	39	86.2 Å²	86.2	40%	0.402	48%	0.484	S	S	.	.	H	α-helix	trans	-72.6	-31.7	176.3	0	0	0	0	0	113.3	G35 R41	G35-G37 VanDerWaalsContact C-N 3.33Å; G35-G37 PolarHBondContact O-N 3.39Å; G37-R41 PolarHBondContact O-N 2.99Å
38	E	76.2	Confident	61.9	Low	65 Å²	65	82.5 Å²	82.5	30%	0.304	48%	0.476	S	S	.	.	H	α-helix	trans	-67.4	-48.9	177.6	-176.8	179.5	-164.2	0	0	111.6	G35 Q40 R41 H42	G35-E38 PolarHBondContact O-N 3.27Å; E38-Q40 VanDerWaalsContact C-N 3.33Å; E38-Q40 PolarHBondContact O-N 3.3Å; E38-R41 WeakPolarHBondContact O-CB 3.42Å; E38-R41 PolarHBondContact O-N 2.88Å; E38-R41 VanDerWaalsContact O-N 3.16Å; E38-H42 WeakPolarHBondContact CG-CE1 3.17Å; E38-H42 PolarHBondContact O-CD2 3.27Å; E38-H42 PolarHBondContact O-N 3.02Å; E38-H42 IonicContact OE1-CE1 2.85Å; E38-H42 PolarHBondContact OE1-CE1 2.99Å; E38-H42 VanDerWaalsContact OE1-CE1 3.29Å; E38-H42 IonicContact OE1-NE2 3.89Å
39	I	75.6	Confident	64.8	Low	8 Å²	8	73.4 Å²	73.4	4%	0.041	44%	0.444	C	S	.	.	H	α-helix	trans	-63.3	-40.2	-179.6	-163	161	0	0	0	111.6	A10 G35 S36 R41 H42 L43 Y72	A10-I39 HydrophobicContact CB-CG2 4.22Å; G35-I39 PolarHBondContact O-N 3.34Å; S36-I39 WeakPolarHBondContact O-CG2 3.31Å; I39-R41 VanDerWaalsContact C-N 3.31Å; I39-R41 PolarHBondContact O-N 3.26Å; I39-H42 PolarHBondContact O-N 3.29Å; I39-L43 HydrophobicContact CG1-CD1 4.18Å; I39-L43 HydrophobicContact CG1-CG 4.42Å; I39-L43 WeakPolarHBondContact O-CD1 3.16Å; I39-L43 WeakPolarHBondContact O-CG 3.21Å; I39-L43 PolarHBondContact O-N 3.46Å; I39-Y72 HydrophobicContact CD1-CE1 4.2Å; I39-Y72 HydrophobicContact CG1-CE1 4.17Å
40	Q	75.5	Confident	67.9	Low	108 Å²	108	65.6 Å²	65.6	51%	0.505	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-42.2	175.4	-75.6	-178.3	-12.3	0	0	112.2	S36 E38 L43 Q44	S36-Q40 WeakPolarHBondContact O-CG 3.47Å; S36-Q40 PolarHBondContact O-N 3.05Å; E38-Q40 VanDerWaalsContact C-N 3.33Å; E38-Q40 PolarHBondContact O-N 3.3Å; Q40-L43 PolarHBondContact O-N 3.22Å; Q40-Q44 WeakPolarHBondContact O-CG 3.43Å; Q40-Q44 PolarHBondContact O-N 3.12Å; Q40-Q44 VanDerWaalsContact O-N 3.07Å
41	R	82.3	Confident	70.7	Confident	120 Å²	120	63.9 Å²	63.9	45%	0.453	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-46	176.5	-162.3	-164.9	-36.5	104	2.9	111.4	G37 E38 I39 L43 Q44 S45	G37-R41 PolarHBondContact O-N 2.99Å; E38-R41 WeakPolarHBondContact O-CB 3.42Å; E38-R41 PolarHBondContact O-N 2.88Å; E38-R41 VanDerWaalsContact O-N 3.16Å; I39-R41 VanDerWaalsContact C-N 3.31Å; I39-R41 PolarHBondContact O-N 3.26Å; R41-L43 VanDerWaalsContact C-N 3.3Å; R41-L43 PolarHBondContact O-N 3.23Å; R41-Q44 PolarHBondContact O-N 2.93Å; R41-S45 PolarHBondContact O-N 3.43Å; R41-S45 VanDerWaalsContact O-N 3.08Å; R41-S45 PolarHBondContact O-OG 3.23Å
42	H	87.5	Confident	73.5	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.019	39%	0.39	C	S	.	.	H	α-helix	trans	-62.5	-39.3	179.1	-65.4	176.3	0	0	0	111.6	E38 I39 S45 M46 Y72 Y94	E38-H42 WeakPolarHBondContact CG-CE1 3.17Å; E38-H42 PolarHBondContact O-CD2 3.27Å; E38-H42 PolarHBondContact O-N 3.02Å; E38-H42 IonicContact OE1-CE1 2.85Å; E38-H42 PolarHBondContact OE1-CE1 2.99Å; E38-H42 VanDerWaalsContact OE1-CE1 3.29Å; E38-H42 IonicContact OE1-NE2 3.89Å; I39-H42 PolarHBondContact O-N 3.29Å; H42-S45 PolarHBondContact O-N 2.95Å; H42-M46 WeakPolarHBondContact O-CB 3.47Å; H42-M46 PolarHBondContact O-N 3.04Å; H42-Y72 HydrophobicContact CB-CE2 4.01Å; H42-Y72 AromaticContact ND1-CE2 3.45Å; H42-Y72 WeakPolarHBondContact ND1-CE2 3.48Å; H42-Y72 AromaticContact ND1-CZ 3.66Å; H42-Y72 PolarHBondContact ND1-OH 3.4Å; H42-Y94 HydrophobicContact CB-CD2 4.48Å; H42-Y94 AromaticContact CD2-CD1 3.87Å; H42-Y94 AromaticContact CD2-CD2 3.67Å; H42-Y94 AromaticContact CD2-CE1 3.65Å; H42-Y94 AromaticContact CD2-CE2 3.4Å; H42-Y94 VanDerWaalsContact CD2-CE2 3.4Å; H42-Y94 WeakPolarHBondContact CD2-CE2 3.35Å; H42-Y94 AromaticContact CD2-CG 3.89Å; H42-Y94 AromaticContact CD2-CZ 3.4Å; H42-Y94 VanDerWaalsContact CD2-CZ 3.4Å; H42-Y94 AromaticContact CE1-CD1 3.68Å; H42-Y94 AromaticContact CE1-CE1 3.99Å; H42-Y94 AromaticContact CE1-CG 3.95Å; H42-Y94 AromaticContact CG-CD2 3.98Å; H42-Y94 AromaticContact NE2-CD1 3.35Å; H42-Y94 WeakPolarHBondContact NE2-CD1 3.35Å; H42-Y94 AromaticContact NE2-CE1 3.19Å; H42-Y94 WeakPolarHBondContact NE2-CE1 3.09Å; H42-Y94 AromaticContact NE2-CE2 3.9Å; H42-Y94 AromaticContact NE2-CG 3.8Å; H42-Y94 AromaticContact NE2-CZ 3.48Å
43	L	84.3	Confident	76.3	Confident	13 Å²	13	69.1 Å²	69.1	7%	0.068	39%	0.391	C	S	.	.	H	α-helix	trans	-64.4	-44.2	176.4	-68.1	163	0	0	0	112.2	A15 I39 Q40 R41 S45 M46 L47 L56 A59	A15-L43 HydrophobicContact CB-CD1 3.36Å; A15-L43 HydrophobicContact CB-CD2 3.63Å; A15-L43 HydrophobicContact CB-CG 4.11Å; I39-L43 HydrophobicContact CG1-CD1 4.18Å; I39-L43 HydrophobicContact CG1-CG 4.42Å; I39-L43 WeakPolarHBondContact O-CD1 3.16Å; I39-L43 WeakPolarHBondContact O-CG 3.21Å; I39-L43 PolarHBondContact O-N 3.46Å; Q40-L43 PolarHBondContact O-N 3.22Å; R41-L43 VanDerWaalsContact C-N 3.3Å; R41-L43 PolarHBondContact O-N 3.23Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 2.86Å; L43-M46 WeakPolarHBondContact O-CB 3.37Å; L43-M46 PolarHBondContact O-N 3.34Å; L43-L47 WeakPolarHBondContact O-CG 3.39Å; L43-L47 PolarHBondContact O-N 2.88Å; L43-L56 HydrophobicContact CD2-CD2 4.41Å; L43-A59 HydrophobicContact CD2-CB 3.57Å
44	Q	84.7	Confident	79.1	Confident	131 Å²	131	65.8 Å²	65.8	61%	0.612	37%	0.366	S	S	*	.	H	α-helix	trans	-59.8	-42.6	176.1	-74.6	-179.6	-0.5	0	0	111.6	Q40 R41 L47	Q40-Q44 WeakPolarHBondContact O-CG 3.43Å; Q40-Q44 PolarHBondContact O-N 3.12Å; Q40-Q44 VanDerWaalsContact O-N 3.07Å; R41-Q44 PolarHBondContact O-N 2.93Å; Q44-L47 PolarHBondContact O-N 2.96Å
45	S	85.8	Confident	81.7	Confident	25 Å²	25	63.9 Å²	63.9	18%	0.175	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-37.7	175.5	-57	0	0	0	0	112.1	R41 H42 L43 L47 Q48	R41-S45 PolarHBondContact O-N 3.43Å; R41-S45 VanDerWaalsContact O-N 3.08Å; R41-S45 PolarHBondContact O-OG 3.23Å; H42-S45 PolarHBondContact O-N 2.95Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 2.86Å; S45-L47 VanDerWaalsContact C-N 3.34Å; S45-L47 PolarHBondContact O-N 3.35Å; S45-Q48 WeakPolarHBondContact O-CB 3.35Å; S45-Q48 PolarHBondContact O-N 2.96Å; S45-Q48 VanDerWaalsContact O-N 3.14Å
46	M	89.1	Confident	83.7	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-62.2	-41.5	176.7	-172.5	-176.6	-65.4	0	0	111.6	H42 L43 Q48 L49 L50 L56 A59 Y72 A74 V92	H42-M46 WeakPolarHBondContact O-CB 3.47Å; H42-M46 PolarHBondContact O-N 3.04Å; L43-M46 WeakPolarHBondContact O-CB 3.37Å; L43-M46 PolarHBondContact O-N 3.34Å; M46-Q48 PolarHBondContact O-N 2.98Å; M46-Q48 VanDerWaalsContact O-N 3.14Å; M46-L49 VanDerWaalsContact O-CB 3.32Å; M46-L49 WeakPolarHBondContact O-CB 3.19Å; M46-L49 PolarHBondContact O-N 3.13Å; M46-L50 HydrophobicContact CG-CD1 4.28Å; M46-L50 WeakPolarHBondContact O-CD1 3.3Å; M46-L56 HydrophobicContact SD-CD1 3.99Å; M46-L56 HydrophobicContact SD-CD2 4.15Å; M46-A59 HydrophobicContact CE-CB 4.04Å; M46-A59 HydrophobicContact SD-CB 3.84Å; M46-Y72 HydrophobicContact CE-CD2 4.44Å; M46-Y72 HydrophobicContact CE-CG 3.98Å; M46-A74 HydrophobicContact CE-CB 4.44Å; M46-A74 HydrophobicContact SD-CB 3.66Å; M46-V92 HydrophobicContact CE-CB 3.99Å; M46-V92 HydrophobicContact CE-CG1 4.22Å; M46-V92 HydrophobicContact CE-CG2 4.05Å; M46-V92 HydrophobicContact CG-CG2 4.25Å; M46-V92 HydrophobicContact SD-CG2 4.38Å
47	L	87.2	Confident	85.3	Confident	65 Å²	65	62.3 Å²	62.3	34%	0.34	31%	0.311	S	S	.	.	H	α-helix	trans	-58.8	-25.3	176.1	-71.1	172.3	0	0	0	113.1	Y8 L43 Q44 S45 L49 L50 L56	Y8-L47 HydrophobicContact CE1-CD1 4.32Å; L43-L47 WeakPolarHBondContact O-CG 3.39Å; L43-L47 PolarHBondContact O-N 2.88Å; Q44-L47 PolarHBondContact O-N 2.96Å; S45-L47 VanDerWaalsContact C-N 3.34Å; S45-L47 PolarHBondContact O-N 3.35Å; L47-L49 VanDerWaalsContact C-N 3.32Å; L47-L50 PolarHBondContact O-N 3.48Å; L47-L56 HydrophobicContact CD2-CB 4.02Å; L47-L56 HydrophobicContact CD2-CD2 4.04Å
48	Q	87.8	Confident	86.5	Confident	160 Å²	160	60.7 Å²	60.7	75%	0.748	29%	0.294	S	S	*	.	H	α-helix	trans	-75.3	-20.1	175.6	-59.7	177	10.2	0	0	113.1	S45 M46	S45-Q48 WeakPolarHBondContact O-CB 3.35Å; S45-Q48 PolarHBondContact O-N 2.96Å; S45-Q48 VanDerWaalsContact O-N 3.14Å; M46-Q48 PolarHBondContact O-N 2.98Å; M46-Q48 VanDerWaalsContact O-N 3.14Å
49	L	90.1	Very high	87.3	Confident	35 Å²	35	57.6 Å²	57.6	18%	0.183	28%	0.279	C	S	.	.	H	α-helix	trans	-76.4	-29.7	174	-62.3	177.4	0	0	0	112	M46 L47 V92 P100 I102 Y172	M46-L49 VanDerWaalsContact O-CB 3.32Å; M46-L49 WeakPolarHBondContact O-CB 3.19Å; M46-L49 PolarHBondContact O-N 3.13Å; L47-L49 VanDerWaalsContact C-N 3.32Å; L49-V92 HydrophobicContact CD1-CG1 4Å; L49-V92 HydrophobicContact CD1-CG2 4.5Å; L49-P100 HydrophobicContact CD1-CB 3.86Å; L49-P100 HydrophobicContact CD1-CG 3.83Å; L49-P100 HydrophobicContact CD2-CG 4.35Å; L49-P100 HydrophobicContact CG-CG 4.03Å; L49-I102 HydrophobicContact CD1-CG1 4.19Å; L49-Y172 WeakPolarHBondContact O-CE1 3.26Å; L49-Y172 PolarHBondContact O-OH 3.35Å
50	L	91.4	Very high	88.1	Confident	17 Å²	17	57.2 Å²	57.2	9%	0.089	28%	0.277	C	S	.	.	S	Bend	trans	-70	152.1	-176.1	-82.1	69	0	0	0	111.3	M46 L47 L56 V76 Y173	M46-L50 HydrophobicContact CG-CD1 4.28Å; M46-L50 WeakPolarHBondContact O-CD1 3.3Å; L47-L50 PolarHBondContact O-N 3.48Å; L50-L56 HydrophobicContact CD2-CB 3.81Å; L50-L56 HydrophobicContact CD2-CD1 4.47Å; L50-V76 HydrophobicContact CD1-CG2 4.37Å; L50-V76 HydrophobicContact CD2-CG1 4.03Å; L50-V76 HydrophobicContact CD2-CG2 4.07Å; L50-V76 HydrophobicContact CG-CG1 4.28Å; L50-V76 HydrophobicContact CG-CG2 4.18Å; L50-Y173 WeakPolarHBondContact CA-OH 3.4Å
51	R	91.7	Very high	88.9	Confident	66 Å²	66	56.1 Å²	56.1	25%	0.249	27%	0.268	C	S	.	.			trans	-67.3	149.3	166.9	-53.7	-173	-39.9	165	11.3	108.8	K53 D54 Y172 Y173	R51-K53 PolarHBondContact O-N 3.15Å; R51-D54 HydrophobicContact CB-CB 4.42Å; R51-D54 VanDerWaalsContact CB-OD2 3.31Å; R51-D54 WeakPolarHBondContact CB-OD2 3.37Å; R51-D54 WeakPolarHBondContact CD-OD2 3.37Å; R51-D54 WeakPolarHBondContact CG-OD2 3.49Å; R51-D54 IonicContact CZ-OD1 3.62Å; R51-D54 IonicContact CZ-OD2 3.15Å; R51-D54 IonicContact NE-OD1 2.78Å; R51-D54 PolarHBondContact NE-OD1 3.27Å; R51-D54 VanDerWaalsContact NE-OD1 3.15Å; R51-D54 IonicContact NE-OD2 3.39Å; R51-D54 PolarHBondContact NE-OD2 2.95Å; R51-D54 IonicContact NH2-OD1 2.73Å; R51-D54 PolarHBondContact NH2-OD1 2.97Å; R51-D54 IonicContact NH2-OD2 2.77Å; R51-D54 PolarHBondContact O-N 3.23Å; R51-Y172 HydrophobicContact CB-CE1 4.46Å; R51-Y172 HydrophobicContact CG-CD1 3.45Å; R51-Y172 VanDerWaalsContact CG-CD1 3.45Å; R51-Y172 HydrophobicContact CG-CD2 3.86Å; R51-Y172 HydrophobicContact CG-CE1 3.29Å; R51-Y172 HydrophobicContact CG-CE2 3.67Å; R51-Y172 HydrophobicContact CG-CG 3.71Å; R51-Y173 HydrophobicContact CG-CE2 4.38Å; R51-Y173 PolarHBondContact N-OH 2.72Å
52	P	85.3	Confident	89.4	Confident	140 Å²	140	50.5 Å²	50.5	91%	0.909	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-17.3	179.6	-26.4	34.4	0	0	0	115.8
53	K	87.9	Confident	89.5	Confident	180 Å²	180	53.7 Å²	53.7	78%	0.783	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-9.2	-179.7	-66.7	-171.8	176.7	-174.9	0	113.7	R51	R51-K53 PolarHBondContact O-N 3.15Å
54	D	92.8	Very high	89.7	Confident	14 Å²	14	54.5 Å²	54.5	8%	0.075	27%	0.269	C	S	.	.			trans	-99.4	143.3	-171.2	-55.9	-7	0	0	0	108.8	R51 V76 A78 Y173	R51-D54 HydrophobicContact CB-CB 4.42Å; R51-D54 VanDerWaalsContact CB-OD2 3.31Å; R51-D54 WeakPolarHBondContact CB-OD2 3.37Å; R51-D54 WeakPolarHBondContact CD-OD2 3.37Å; R51-D54 WeakPolarHBondContact CG-OD2 3.49Å; R51-D54 IonicContact CZ-OD1 3.62Å; R51-D54 IonicContact CZ-OD2 3.15Å; R51-D54 IonicContact NE-OD1 2.78Å; R51-D54 PolarHBondContact NE-OD1 3.27Å; R51-D54 VanDerWaalsContact NE-OD1 3.15Å; R51-D54 IonicContact NE-OD2 3.39Å; R51-D54 PolarHBondContact NE-OD2 2.95Å; R51-D54 IonicContact NH2-OD1 2.73Å; R51-D54 PolarHBondContact NH2-OD1 2.97Å; R51-D54 IonicContact NH2-OD2 2.77Å; R51-D54 PolarHBondContact O-N 3.23Å; D54-V76 HydrophobicContact CB-CG1 3.79Å; D54-A78 HydrophobicContact CB-CB 4.48Å; D54-A78 WeakPolarHBondContact OD1-CB 3.27Å; D54-Y173 WeakPolarHBondContact OD2-CE2 3.48Å; D54-Y173 PolarHBondContact OD2-OH 2.78Å; D54-Y173 VanDerWaalsContact OD2-OH 3.04Å
55	T	91.1	Very high	89.6	Confident	38 Å²	38	54.6 Å²	54.6	23%	0.233	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.6	-174.9	-55.5	0	0	0	0	109.4	E6 K57 V76 S77	E6-T55 VanDerWaalsContact OE1-CG2 3.27Å; E6-T55 WeakPolarHBondContact OE1-CG2 3.24Å; T55-K57 HydrophobicContact CG2-CD 4.18Å; T55-K57 PolarHBondContact O-N 3.03Å; T55-V76 WeakPolarHBondContact O-CA 3.32Å; T55-S77 PolarHBondContact N-O 2.77Å; T55-S77 PolarHBondContact O-N 2.75Å
56	L	91.5	Very high	89.2	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.016	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	126.3	164.4	-170.9	64.7	0	0	0	107.5	I17 L43 M46 L47 L50 M58 A59 A74 V76	I17-L56 HydrophobicContact CD1-CB 3.65Å; I17-L56 HydrophobicContact CD1-CD2 4.02Å; I17-L56 HydrophobicContact CD1-CG 3.8Å; I17-L56 WeakPolarHBondContact CD1-O 3.2Å; L43-L56 HydrophobicContact CD2-CD2 4.41Å; M46-L56 HydrophobicContact SD-CD1 3.99Å; M46-L56 HydrophobicContact SD-CD2 4.15Å; L47-L56 HydrophobicContact CD2-CB 4.02Å; L47-L56 HydrophobicContact CD2-CD2 4.04Å; L50-L56 HydrophobicContact CD2-CB 3.81Å; L50-L56 HydrophobicContact CD2-CD1 4.47Å; L56-M58 WeakPolarHBondContact CD1-O 3.22Å; L56-A59 HydrophobicContact CD2-CB 4.37Å; L56-A74 HydrophobicContact CD1-CB 3.74Å; L56-V76 HydrophobicContact CD1-CG2 4.18Å
57	K	88.6	Confident	88.7	Confident	74 Å²	74	60.8 Å²	60.8	32%	0.322	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-30.3	174.5	-65	-60.9	-177.1	-176.8	0	111.8	I17 T55 I75 S77	I17-K57 PolarHBondContact N-O 3.33Å; I17-K57 VanDerWaalsContact N-O 3.14Å; T55-K57 HydrophobicContact CG2-CD 4.18Å; T55-K57 PolarHBondContact O-N 3.03Å; K57-I75 HydrophobicContact CB-CB 4.41Å; K57-I75 HydrophobicContact CB-CG2 4.25Å; K57-I75 PolarHBondContact N-O 3.14Å; K57-S77 WeakPolarHBondContact CG-OG 3.35Å
58	M	90.7	Very high	88.3	Confident	6 Å²	6	67.7 Å²	67.7	3%	0.03	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	147.5	-171.9	163.6	167.6	-77.9	0	0	109.6	A15 V16 L56 V60 A74 I75 S143 V144 A147	A15-M58 WeakPolarHBondContact O-CA 3.35Å; V16-M58 HydrophobicContact CG2-CE 3.74Å; L56-M58 WeakPolarHBondContact CD1-O 3.22Å; M58-V60 HydrophobicContact CE-CG2 4.3Å; M58-V60 HydrophobicContact CG-CG2 3.81Å; M58-V60 HydrophobicContact SD-CG2 3.94Å; M58-A74 CarbonylContact O-C 3.54Å; M58-A74 WeakPolarHBondContact O-CA 3.48Å; M58-I75 HydrophobicContact CB-CB 4.3Å; M58-I75 HydrophobicContact CB-CD1 4.48Å; M58-I75 PolarHBondContact O-N 3.28Å; M58-I75 HydrophobicContact SD-CD1 4.09Å; M58-S143 VanDerWaalsContact CE-C 3.42Å; M58-S143 WeakPolarHBondContact CE-O 3.33Å; M58-V144 HydrophobicContact SD-CB 4.45Å; M58-V144 HydrophobicContact SD-CG2 4.14Å; M58-A147 HydrophobicContact CE-CB 3.57Å; M58-A147 HydrophobicContact SD-CB 3.4Å; M58-A147 WeakPolarHBondContact SD-CB 3.23Å
59	A	92.1	Very high	88.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	126.5	162.3	0	0	0	0	0	110.1	A15 L43 M46 L56 V73 A74	A15-A59 PolarHBondContact N-O 2.89Å; A15-A59 PolarHBondContact O-N 2.81Å; L43-A59 HydrophobicContact CD2-CB 3.57Å; M46-A59 HydrophobicContact CE-CB 4.04Å; M46-A59 HydrophobicContact SD-CB 3.84Å; L56-A59 HydrophobicContact CD2-CB 4.37Å; A59-V73 CarbonylContact C-O 3.55Å; A59-V73 VanDerWaalsContact CA-O 3.28Å; A59-V73 WeakPolarHBondContact CA-O 3.43Å; A59-A74 HydrophobicContact CB-CB 4.41Å
60	V	92.1	Very high	88.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.2	-176.3	175.9	0	0	0	0	110.1	A14 M58 Y72 V73 P135 A140 V144	A14-V60 HydrophobicContact CB-CG1 4.38Å; A14-V60 HydrophobicContact CB-CG2 3.8Å; M58-V60 HydrophobicContact CE-CG2 4.3Å; M58-V60 HydrophobicContact CG-CG2 3.81Å; M58-V60 HydrophobicContact SD-CG2 3.94Å; V60-Y72 CarbonylContact O-C 3.58Å; V60-Y72 VanDerWaalsContact O-CA 3.24Å; V60-Y72 WeakPolarHBondContact O-CA 3.38Å; V60-V73 HydrophobicContact CB-CG1 4.01Å; V60-V73 PolarHBondContact N-O 3.41Å; V60-V73 PolarHBondContact O-N 3.4Å; V60-P135 HydrophobicContact CG1-CB 4.32Å; V60-A140 HydrophobicContact CG1-CB 3.65Å; V60-V144 HydrophobicContact CB-CG2 3.47Å; V60-V144 VanDerWaalsContact CB-CG2 3.47Å; V60-V144 HydrophobicContact CG1-CG2 3.62Å; V60-V144 HydrophobicContact CG2-CG2 3.53Å
61	R	92.6	Very high	88.4	Confident	84 Å²	84	59.3 Å²	59.3	32%	0.317	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	137.4	176.6	-174.8	174.3	175.2	166.3	10.1	109.9	G13 T70 R71 Y72 I136	G13-R61 WeakPolarHBondContact O-CB 3.45Å; G13-R61 PolarHBondContact O-N 3.16Å; R61-T70 HydrophobicContact CG-CG2 3.89Å; R61-R71 WeakPolarHBondContact CA-O 3.4Å; R61-Y72 HydrophobicContact CB-CD1 4.06Å; R61-Y72 HydrophobicContact CB-CE1 3.73Å; R61-Y72 HydrophobicContact CG-CE1 4.4Å; R61-I136 HydrophobicContact CB-CD1 4.17Å; R61-I136 HydrophobicContact CB-CG1 4.45Å; R61-I136 HydrophobicContact CB-CG2 4.35Å; R61-I136 HydrophobicContact CG-CD1 4.34Å; R61-I136 HydrophobicContact CG-CG2 3.92Å; R61-I136 PolarHBondContact O-N 2.85Å
62	L	92.5	Very high	88.5	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	159.6	174.7	-53.9	-179.1	0	0	0	111	R71 V73 L133 K134 P135 I136 W187	L62-R71 HydrophobicContact CB-CB 4.1Å; L62-R71 PolarHBondContact N-O 3.05Å; L62-V73 HydrophobicContact CD1-CB 4.15Å; L62-V73 HydrophobicContact CD2-CB 4.26Å; L62-V73 HydrophobicContact CD2-CG1 3.76Å; L62-V73 HydrophobicContact CG-CB 4.35Å; L62-V73 HydrophobicContact CG-CG1 4.3Å; L62-L133 HydrophobicContact CD1-CB 4.35Å; L62-L133 HydrophobicContact CD1-CD2 3.9Å; L62-L133 HydrophobicContact CD2-CB 4.28Å; L62-K134 CarbonylContact C-O 3.57Å; L62-K134 VanDerWaalsContact CA-O 3.27Å; L62-K134 WeakPolarHBondContact CA-O 3.26Å; L62-K134 WeakPolarHBondContact CB-O 3.24Å; L62-P135 HydrophobicContact CD2-CG 4.15Å; L62-I136 VanDerWaalsContact C-CG2 3.43Å; L62-W187 HydrophobicContact CD1-CH2 3.63Å; L62-W187 HydrophobicContact CD1-CZ3 3.53Å
63	E	90.9	Very high	89	Confident	70 Å²	70	49.9 Å²	49.9	33%	0.327	24%	0.244	S	C	.	.			trans	-59.3	140.9	162.8	-65.7	-177.6	-148.4	0	0	109.6	K134 I136	E63-K134 HydrophobicContact CB-CB 4.34Å; E63-K134 HydrophobicContact CG-CG 4.29Å; E63-K134 PolarHBondContact N-O 3.25Å; E63-K134 WeakPolarHBondContact OE1-CD 3.33Å; E63-K134 WeakPolarHBondContact OE1-CE 3.33Å; E63-K134 WeakPolarHBondContact OE1-CG 3.29Å; E63-K134 IonicContact OE1-NZ 2.88Å; E63-K134 WeakPolarHBondContact OE2-CD 3.29Å; E63-K134 IonicContact OE2-NZ 3.06Å; E63-I136 HydrophobicContact CG-CG2 4.44Å
64	S	88.1	Confident	89.3	Confident	31 Å²	31	41.3 Å²	41.3	22%	0.217	21%	0.207	C	C	.	.			trans	-113.5	128.8	170.5	174.6	0	0	0	0	110	F66 G67 H69 E186	S64-F66 VanDerWaalsContact C-N 3.28Å; S64-F66 PolarHBondContact O-N 3.29Å; S64-F66 PolarHBondContact OG-N 2.88Å; S64-G67 PolarHBondContact OG-N 3.24Å; S64-H69 PolarHBondContact OG-CE1 3.48Å; S64-E186 WeakPolarHBondContact CA-OE1 3.29Å; S64-E186 PolarHBondContact OG-OE2 3.05Å; S64-E186 VanDerWaalsContact OG-OE2 3.1Å
65	L	82.9	Confident	89.4	Confident	133 Å²	133	40.8 Å²	40.8	70%	0.696	20%	0.204	S	C	*	.	S	Bend	trans	-63.7	-35.2	175.1	-63	179.6	0	0	0	111.8	E186 V189	L65-E186 HydrophobicContact CB-CG 4.13Å; L65-E186 HydrophobicContact CD1-CG 3.82Å; L65-E186 HydrophobicContact CG-CG 3.99Å; L65-E186 PolarHBondContact N-OE1 2.84Å; L65-V189 HydrophobicContact CD1-CG2 4.42Å
66	F	77.5	Confident	89.6	Confident	91 Å²	91	39 Å²	39	40%	0.399	19%	0.193	S	C	.	.	S	Bend	trans	-89.9	-20	-176.6	-58.8	-62.5	0	0	0	113.4	S64 R68 P182 E186	S64-F66 VanDerWaalsContact C-N 3.28Å; S64-F66 PolarHBondContact O-N 3.29Å; S64-F66 PolarHBondContact OG-N 2.88Å; F66-R68 PolarHBondContact O-N 3.24Å; F66-P182 HydrophobicContact CD2-CG 4.17Å; F66-P182 HydrophobicContact CE1-CG 4.46Å; F66-P182 HydrophobicContact CE2-CB 3.86Å; F66-P182 HydrophobicContact CE2-CG 3.97Å; F66-P182 HydrophobicContact CZ-CB 3.84Å; F66-P182 HydrophobicContact CZ-CG 4.12Å; F66-E186 HydrophobicContact CD2-CG 4.35Å; F66-E186 WeakPolarHBondContact CD2-OE2 3.46Å; F66-E186 HydrophobicContact CE2-CB 4.17Å; F66-E186 HydrophobicContact CE2-CG 4.07Å
67	G	77.3	Confident	89.7	Confident	67 Å²	67	39 Å²	39	69%	0.691	19%	0.193	S	C	*	.	S	Bend	trans	63.2	4.2	-178.4	0	0	0	0	0	115.4	S64	S64-G67 PolarHBondContact OG-N 3.24Å
68	R	80.1	Confident	90	Very high	209 Å²	209	35.8 Å²	35.8	79%	0.789	18%	0.181	S	C	*	.	S	Bend	trans	-96.4	-12	-176.4	-71	-178.4	-179.3	-174.3	0.1	114.1	F66	F66-R68 PolarHBondContact O-N 3.24Å
69	H	88.3	Confident	89.9	Confident	9 Å²	9	39.5 Å²	39.5	4%	0.042	21%	0.206	C	C	.	.	S	Bend	trans	-138.7	161.8	177	68.2	-72.9	0	0	0	109.3	S64 R71 D93 Y94 T95 F183 E186	S64-H69 PolarHBondContact OG-CE1 3.48Å; H69-R71 WeakPolarHBondContact CD2-CG 3.2Å; H69-R71 VanDerWaalsContact NE2-CD 3.3Å; H69-R71 WeakPolarHBondContact NE2-CD 3.1Å; H69-R71 WeakPolarHBondContact NE2-CG 3.41Å; H69-D93 IonicContact CD2-OD1 3.6Å; H69-D93 PolarHBondContact CD2-OD1 3.44Å; H69-D93 IonicContact NE2-OD1 3.38Å; H69-Y94 WeakPolarHBondContact CA-O 3.47Å; H69-Y94 WeakPolarHBondContact CB-O 3.43Å; H69-T95 HydrophobicContact CB-CG2 4.31Å; H69-F183 HydrophobicContact CB-CD1 4.5Å; H69-F183 HydrophobicContact CB-CD2 4.39Å; H69-F183 HydrophobicContact CB-CE1 4.19Å; H69-F183 HydrophobicContact CB-CE2 4.09Å; H69-F183 HydrophobicContact CB-CZ 3.98Å; H69-F183 AromaticContact CE1-CD1 3.35Å; H69-F183 WeakPolarHBondContact CE1-CD1 3.32Å; H69-F183 AromaticContact CE1-CE1 3.97Å; H69-F183 AromaticContact CE1-CG 3.79Å; H69-F183 AromaticContact CG-CD1 3.8Å; H69-F183 AromaticContact CG-CE1 3.91Å; H69-F183 AromaticContact CG-CG 3.97Å; H69-F183 AromaticContact ND1-CD1 3.26Å; H69-F183 VanDerWaalsContact ND1-CD1 3.26Å; H69-F183 WeakPolarHBondContact ND1-CD1 3.49Å; H69-F183 AromaticContact ND1-CE1 3.4Å; H69-F183 WeakPolarHBondContact ND1-CE1 3.44Å; H69-F183 AromaticContact ND1-CG 3.85Å; H69-F183 AromaticContact NE2-CD1 3.94Å; H69-F183 AromaticContact NE2-CG 3.91Å; H69-E186 IonicContact CE1-OE2 3.02Å; H69-E186 PolarHBondContact CE1-OE2 3.13Å; H69-E186 IonicContact NE2-OE2 3.97Å
70	T	90.2	Very high	89.5	Confident	15 Å²	15	40 Å²	40	9%	0.092	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.6	172.4	-58.4	0	0	0	0	108.9	R61 Y72 Y94	R61-T70 HydrophobicContact CG-CG2 3.89Å; T70-Y72 HydrophobicContact CG2-CD2 4.03Å; T70-Y72 HydrophobicContact CG2-CE2 3.34Å; T70-Y94 PolarHBondContact N-O 3.21Å; T70-Y94 PolarHBondContact O-N 2.76Å
71	R	92.9	Very high	88.9	Confident	13 Å²	13	49.2 Å²	49.2	5%	0.049	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	135.7	178.8	-61.9	177.8	67.9	-161.5	2.3	109.6	R61 L62 H69 E186 W187	R61-R71 WeakPolarHBondContact CA-O 3.4Å; L62-R71 HydrophobicContact CB-CB 4.1Å; L62-R71 PolarHBondContact N-O 3.05Å; H69-R71 WeakPolarHBondContact CD2-CG 3.2Å; H69-R71 VanDerWaalsContact NE2-CD 3.3Å; H69-R71 WeakPolarHBondContact NE2-CD 3.1Å; H69-R71 WeakPolarHBondContact NE2-CG 3.41Å; R71-E186 VanDerWaalsContact CD-OE1 3.32Å; R71-E186 WeakPolarHBondContact CD-OE1 3.32Å; R71-E186 IonicContact CZ-OE1 3.53Å; R71-E186 IonicContact NE-OE1 3.79Å; R71-E186 PolarHBondContact NH1-O 3.14Å; R71-E186 IonicContact NH1-OE1 2.67Å; R71-E186 PolarHBondContact NH1-OE1 3.41Å; R71-E186 PolarHBondContact NH2-O 2.94Å; R71-W187 HydrophobicContact CB-CH2 4.07Å; R71-W187 HydrophobicContact CB-CZ2 3.87Å; R71-W187 HydrophobicContact CG-CZ2 4.12Å
72	Y	93.5	Very high	88.4	Confident	5 Å²	5	50.6 Å²	50.6	2%	0.02	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.2	170.3	-69.8	-90.3	0	0	0	110.1	I39 H42 M46 V60 R61 T70 G91 V92 W187	I39-Y72 HydrophobicContact CD1-CE1 4.2Å; I39-Y72 HydrophobicContact CG1-CE1 4.17Å; H42-Y72 HydrophobicContact CB-CE2 4.01Å; H42-Y72 AromaticContact ND1-CE2 3.45Å; H42-Y72 WeakPolarHBondContact ND1-CE2 3.48Å; H42-Y72 AromaticContact ND1-CZ 3.66Å; H42-Y72 PolarHBondContact ND1-OH 3.4Å; M46-Y72 HydrophobicContact CE-CD2 4.44Å; M46-Y72 HydrophobicContact CE-CG 3.98Å; V60-Y72 CarbonylContact O-C 3.58Å; V60-Y72 VanDerWaalsContact O-CA 3.24Å; V60-Y72 WeakPolarHBondContact O-CA 3.38Å; R61-Y72 HydrophobicContact CB-CD1 4.06Å; R61-Y72 HydrophobicContact CB-CE1 3.73Å; R61-Y72 HydrophobicContact CG-CE1 4.4Å; T70-Y72 HydrophobicContact CG2-CD2 4.03Å; T70-Y72 HydrophobicContact CG2-CE2 3.34Å; Y72-G91 WeakPolarHBondContact O-CA 3.13Å; Y72-V92 PolarHBondContact N-O 3.43Å; Y72-V92 PolarHBondContact O-N 2.96Å; Y72-W187 WeakPolarHBondContact O-CH2 3.47Å
73	V	94.6	Very high	88	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.8	158.1	64.7	0	0	0	0	108.6	A59 V60 L62 V89 L133 V144	A59-V73 CarbonylContact C-O 3.55Å; A59-V73 VanDerWaalsContact CA-O 3.28Å; A59-V73 WeakPolarHBondContact CA-O 3.43Å; V60-V73 HydrophobicContact CB-CG1 4.01Å; V60-V73 PolarHBondContact N-O 3.41Å; V60-V73 PolarHBondContact O-N 3.4Å; L62-V73 HydrophobicContact CD1-CB 4.15Å; L62-V73 HydrophobicContact CD2-CB 4.26Å; L62-V73 HydrophobicContact CD2-CG1 3.76Å; L62-V73 HydrophobicContact CG-CB 4.35Å; L62-V73 HydrophobicContact CG-CG1 4.3Å; V73-V89 HydrophobicContact CG2-CG1 3.31Å; V73-L133 HydrophobicContact CB-CD1 4.32Å; V73-L133 HydrophobicContact CG2-CD1 3.81Å; V73-V144 HydrophobicContact CG1-CG1 4.29Å; V73-V144 HydrophobicContact CG1-CG2 3.85Å
74	A	94.3	Very high	87.8	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.8	175.6	0	0	0	0	0	110.5	M46 L56 M58 A59 V89 V90	M46-A74 HydrophobicContact CE-CB 4.44Å; M46-A74 HydrophobicContact SD-CB 3.66Å; L56-A74 HydrophobicContact CD1-CB 3.74Å; M58-A74 CarbonylContact O-C 3.54Å; M58-A74 WeakPolarHBondContact O-CA 3.48Å; A59-A74 HydrophobicContact CB-CB 4.41Å; A74-V89 CarbonylContact O-C 3.48Å; A74-V89 WeakPolarHBondContact O-CA 3.4Å; A74-V90 HydrophobicContact CB-CB 4.46Å; A74-V90 PolarHBondContact N-O 3.43Å; A74-V90 PolarHBondContact O-N 3.03Å
75	I	95.2	Very high	88	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.8	169.4	-62.7	171.2	0	0	0	107.1	K57 M58 I88 A147 L148 V151	K57-I75 HydrophobicContact CB-CB 4.41Å; K57-I75 HydrophobicContact CB-CG2 4.25Å; K57-I75 PolarHBondContact N-O 3.14Å; M58-I75 HydrophobicContact CB-CB 4.3Å; M58-I75 HydrophobicContact CB-CD1 4.48Å; M58-I75 PolarHBondContact O-N 3.28Å; M58-I75 HydrophobicContact SD-CD1 4.09Å; I75-I88 WeakPolarHBondContact CA-O 3.32Å; I75-A147 HydrophobicContact CD1-CB 3.46Å; I75-A147 VanDerWaalsContact CD1-CB 3.46Å; I75-L148 HydrophobicContact CD1-CD2 3.92Å; I75-L148 HydrophobicContact CD1-CG 4.14Å; I75-L148 HydrophobicContact CG1-CD2 4.32Å; I75-V151 HydrophobicContact CG2-CG1 3.91Å; I75-V151 HydrophobicContact CG2-CG2 4.45Å
76	V	95.1	Very high	88.6	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.6	178.3	-178.7	0	0	0	0	108.1	L50 D54 T55 L56 S87 I88 V90 W169	L50-V76 HydrophobicContact CD1-CG2 4.37Å; L50-V76 HydrophobicContact CD2-CG1 4.03Å; L50-V76 HydrophobicContact CD2-CG2 4.07Å; L50-V76 HydrophobicContact CG-CG1 4.28Å; L50-V76 HydrophobicContact CG-CG2 4.18Å; D54-V76 HydrophobicContact CB-CG1 3.79Å; T55-V76 WeakPolarHBondContact O-CA 3.32Å; L56-V76 HydrophobicContact CD1-CG2 4.18Å; V76-S87 CarbonylContact O-C 3.51Å; V76-S87 VanDerWaalsContact O-CA 3.29Å; V76-S87 WeakPolarHBondContact O-CA 3.33Å; V76-I88 HydrophobicContact CB-CG1 4.01Å; V76-I88 PolarHBondContact N-O 3.45Å; V76-I88 PolarHBondContact O-N 3.13Å; V76-V90 HydrophobicContact CB-CG2 4.45Å; V76-V90 HydrophobicContact CG2-CG2 3.9Å; V76-W169 HydrophobicContact CG1-CH2 4.42Å; V76-W169 HydrophobicContact CG1-CZ3 4.38Å
77	S	94.9	Very high	89.5	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	145.7	175.5	-58.7	0	0	0	0	111.2	T55 K57 Q85 E86 S87	T55-S77 PolarHBondContact N-O 2.77Å; T55-S77 PolarHBondContact O-N 2.75Å; K57-S77 WeakPolarHBondContact CG-OG 3.35Å; S77-Q85 VanDerWaalsContact CB-NE2 3.29Å; S77-Q85 PolarHBondContact OG-NE2 3.26Å; S77-E86 CarbonylContact C-O 3.44Å; S77-E86 VanDerWaalsContact CA-O 3.23Å; S77-E86 WeakPolarHBondContact CA-O 3.4Å; S77-S87 PolarHBondContact OG-OG 3.43Å
78	A	93.6	Very high	90.4	Very high	6 Å²	6	44 Å²	44	5%	0.05	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	156	171.2	0	0	0	0	0	110.1	D54 G80 E86 W169	D54-A78 HydrophobicContact CB-CB 4.48Å; D54-A78 WeakPolarHBondContact OD1-CB 3.27Å; A78-G80 PolarHBondContact O-N 3.39Å; A78-E86 PolarHBondContact N-O 3.32Å; A78-E86 PolarHBondContact O-N 3.11Å; A78-W169 HydrophobicContact CB-CD2 4.06Å; A78-W169 HydrophobicContact CB-CH2 4.18Å; A78-W169 HydrophobicContact CB-CZ2 3.71Å
79	C	89.9	Confident	91.2	Very high	84 Å²	84	34 Å²	34	57%	0.568	17%	0.17	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	117.5	166.4	-155.7	0	0	0	0	108.4	D83	C79-D83 VanDerWaalsContact SG-C 3.59Å; C79-D83 VanDerWaalsContact SG-CA 3.58Å
80	G	83.1	Confident	91.5	Very high	10 Å²	10	33.9 Å²	33.9	10%	0.103	17%	0.17	C	C	.	.			trans	-68.2	179.8	177.5	0	0	0	0	0	112.9	A78 Q82 D83 N84 E86	A78-G80 PolarHBondContact O-N 3.39Å; G80-Q82 PolarHBondContact O-N 3.29Å; G80-D83 PolarHBondContact O-N 2.88Å; G80-N84 PolarHBondContact N-O 3.31Å; G80-E86 VanDerWaalsContact CA-OE1 3.26Å; G80-E86 WeakPolarHBondContact CA-OE1 3.44Å
81	R	80.4	Confident	91.8	Very high	194 Å²	194	33.1 Å²	33.1	73%	0.732	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.4	176.5	-69.1	-175.9	-180	-176.4	0.4	113.6
82	Q	81.3	Confident	91.9	Very high	114 Å²	114	32.8 Å²	32.8	53%	0.533	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	17.8	-179.1	-61	-175.8	-48.1	0	0	112	G80 N84	G80-Q82 PolarHBondContact O-N 3.29Å; Q82-N84 PolarHBondContact O-N 2.74Å
83	D	83	Confident	91.9	Very high	141 Å²	141	32.6 Å²	32.6	75%	0.754	16%	0.164	S	C	*	.	S	Bend	trans	57.7	12.6	-175.2	-64.1	-41.4	0	0	0	115.2	C79 G80	C79-D83 VanDerWaalsContact SG-C 3.59Å; C79-D83 VanDerWaalsContact SG-CA 3.58Å; G80-D83 PolarHBondContact O-N 2.88Å
84	N	88.5	Confident	91.6	Very high	36 Å²	36	34.1 Å²	34.1	19%	0.193	17%	0.17	C	C	.	.	S	Bend	trans	-93.6	150.1	174.6	-60.4	-36.9	0	0	0	110.7	G80 Q82 E86 Y158 Y160	G80-N84 PolarHBondContact N-O 3.31Å; Q82-N84 PolarHBondContact O-N 2.74Å; N84-E86 PolarHBondContact O-N 2.76Å; N84-Y158 HydrophobicContact CB-CD1 4.42Å; N84-Y158 HydrophobicContact CB-CD2 4.35Å; N84-Y158 HydrophobicContact CB-CG 4.24Å; N84-Y158 WeakPolarHBondContact ND2-CD1 3.47Å; N84-Y158 WeakPolarHBondContact OD1-CE1 3.4Å; N84-Y160 WeakPolarHBondContact CB-OH 3.39Å
85	Q	91.7	Very high	91.3	Very high	70 Å²	70	35.2 Å²	35.2	33%	0.327	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	124.2	176.2	-171.9	-176.4	3.3	0	0	110.1	S77 V154 Y160	S77-Q85 VanDerWaalsContact CB-NE2 3.29Å; S77-Q85 PolarHBondContact OG-NE2 3.26Å; Q85-V154 HydrophobicContact CB-CG1 4.31Å; Q85-Y160 VanDerWaalsContact O-CE2 3.29Å; Q85-Y160 WeakPolarHBondContact O-CE2 3.28Å; Q85-Y160 PolarHBondContact O-OH 2.91Å
86	E	95.1	Very high	90.5	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.009	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	144.5	172.3	-64.1	172.2	-179.4	0	0	107.8	S77 A78 G80 N84 Y160 T166 H167 W169	S77-E86 CarbonylContact C-O 3.44Å; S77-E86 VanDerWaalsContact CA-O 3.23Å; S77-E86 WeakPolarHBondContact CA-O 3.4Å; A78-E86 PolarHBondContact N-O 3.32Å; A78-E86 PolarHBondContact O-N 3.11Å; G80-E86 VanDerWaalsContact CA-OE1 3.26Å; G80-E86 WeakPolarHBondContact CA-OE1 3.44Å; N84-E86 PolarHBondContact O-N 2.76Å; E86-Y160 HydrophobicContact CG-CE2 4.26Å; E86-T166 VanDerWaalsContact OE1-CA 3.29Å; E86-T166 WeakPolarHBondContact OE1-CA 3.37Å; E86-T166 WeakPolarHBondContact OE1-CB 2.88Å; E86-H167 PolarHBondContact OE1-N 3.44Å; E86-H167 VanDerWaalsContact OE2-CA 3.28Å; E86-H167 WeakPolarHBondContact OE2-CA 3.29Å; E86-H167 PolarHBondContact OE2-N 3.46Å; E86-W169 HydrophobicContact CB-CZ2 4.14Å; E86-W169 VanDerWaalsContact OE2-CD1 3.23Å; E86-W169 PolarHBondContact OE2-NE1 2.88Å
87	S	96.4	Very high	89.5	Confident	6 Å²	6	45.8 Å²	45.8	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.2	-175	-60.4	0	0	0	0	112.6	V76 S77 V108 H167	V76-S87 CarbonylContact O-C 3.51Å; V76-S87 VanDerWaalsContact O-CA 3.29Å; V76-S87 WeakPolarHBondContact O-CA 3.33Å; S77-S87 PolarHBondContact OG-OG 3.43Å; S87-V108 WeakPolarHBondContact O-CB 3.37Å; S87-V108 PolarHBondContact O-N 2.85Å; S87-H167 PolarHBondContact N-NE2 2.91Å; S87-H167 PolarHBondContact O-NE2 3.09Å
88	I	96.3	Very high	88.8	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	153.5	172.6	67.6	177.4	0	0	0	110.8	I75 V76 V90 V105 L106 P107 W169 V170 Y173	I75-I88 WeakPolarHBondContact CA-O 3.32Å; V76-I88 HydrophobicContact CB-CG1 4.01Å; V76-I88 PolarHBondContact N-O 3.45Å; V76-I88 PolarHBondContact O-N 3.13Å; I88-V90 HydrophobicContact CD1-CG2 3.56Å; I88-V90 HydrophobicContact CG1-CG2 3.72Å; I88-V105 HydrophobicContact CD1-CG1 4.13Å; I88-L106 CarbonylContact C-O 3.56Å; I88-L106 VanDerWaalsContact CA-O 3.28Å; I88-L106 WeakPolarHBondContact CA-O 3.28Å; I88-P107 HydrophobicContact CG2-CB 4.32Å; I88-P107 HydrophobicContact CG2-CG 4.5Å; I88-W169 HydrophobicContact CB-CH2 4.21Å; I88-W169 HydrophobicContact CD1-CE3 4.37Å; I88-W169 HydrophobicContact CD1-CH2 3.86Å; I88-W169 HydrophobicContact CD1-CZ3 3.42Å; I88-W169 VanDerWaalsContact CD1-CZ3 3.42Å; I88-W169 HydrophobicContact CG1-CH2 3.65Å; I88-W169 HydrophobicContact CG1-CZ3 3.78Å; I88-W169 HydrophobicContact CG2-CH2 3.74Å; I88-W169 HydrophobicContact CG2-CZ2 4.14Å; I88-W169 HydrophobicContact CG2-CZ3 4.16Å; I88-V170 HydrophobicContact CG2-CG2 3.42Å; I88-V170 VanDerWaalsContact CG2-CG2 3.42Å; I88-Y173 HydrophobicContact CD1-CD1 4.33Å; I88-Y173 HydrophobicContact CD1-CD2 3.53Å; I88-Y173 HydrophobicContact CD1-CE2 4Å; I88-Y173 HydrophobicContact CD1-CG 3.72Å
89	V	96.3	Very high	88.5	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.7	164.4	-175.7	0	0	0	0	108	V73 A74 V105 L106 V108 I124 L148	V73-V89 HydrophobicContact CG2-CG1 3.31Å; A74-V89 CarbonylContact O-C 3.48Å; A74-V89 WeakPolarHBondContact O-CA 3.4Å; V89-V105 CarbonylContact O-C 3.48Å; V89-V105 WeakPolarHBondContact O-CA 3.28Å; V89-L106 HydrophobicContact CB-CB 4.2Å; V89-L106 PolarHBondContact N-O 3.38Å; V89-L106 PolarHBondContact O-N 3.28Å; V89-V108 HydrophobicContact CG2-CG2 4.06Å; V89-I124 HydrophobicContact CG2-CD1 4.41Å; V89-L148 HydrophobicContact CG2-CD2 3.49Å; V89-L148 VanDerWaalsContact CG2-CD2 3.49Å
90	V	95.8	Very high	88.6	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.03	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.6	177.4	-172.2	0	0	0	0	108.6	A74 V76 I88 V92 I102 L104 Y173	A74-V90 HydrophobicContact CB-CB 4.46Å; A74-V90 PolarHBondContact N-O 3.43Å; A74-V90 PolarHBondContact O-N 3.03Å; V76-V90 HydrophobicContact CB-CG2 4.45Å; V76-V90 HydrophobicContact CG2-CG2 3.9Å; I88-V90 HydrophobicContact CD1-CG2 3.56Å; I88-V90 HydrophobicContact CG1-CG2 3.72Å; V90-V92 HydrophobicContact CG1-CG2 3.86Å; V90-I102 HydrophobicContact CG1-CG1 4.25Å; V90-I102 HydrophobicContact CG1-CG2 3.89Å; V90-L104 CarbonylContact C-O 3.58Å; V90-L104 WeakPolarHBondContact CA-O 3.36Å; V90-Y173 HydrophobicContact CG2-CD1 4.42Å
91	G	95.6	Very high	89.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.5	166.7	0	0	0	0	0	109.5	Y72 G103 L104 W187	Y72-G91 WeakPolarHBondContact O-CA 3.13Å; G91-G103 PolarHBondContact O-N 3.24Å; G91-L104 PolarHBondContact N-O 3.29Å; G91-L104 PolarHBondContact O-N 3.19Å; G91-W187 VanDerWaalsContact CA-CH2 3.48Å
92	V	94.7	Very high	89.8	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.03	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.3	-178.4	-177.4	0	0	0	0	109.1	M46 L49 Y72 V90 P100 T101	M46-V92 HydrophobicContact CE-CB 3.99Å; M46-V92 HydrophobicContact CE-CG1 4.22Å; M46-V92 HydrophobicContact CE-CG2 4.05Å; M46-V92 HydrophobicContact CG-CG2 4.25Å; M46-V92 HydrophobicContact SD-CG2 4.38Å; L49-V92 HydrophobicContact CD1-CG1 4Å; L49-V92 HydrophobicContact CD1-CG2 4.5Å; Y72-V92 PolarHBondContact N-O 3.43Å; Y72-V92 PolarHBondContact O-N 2.96Å; V90-V92 HydrophobicContact CG1-CG2 3.86Å; V92-P100 HydrophobicContact CG1-CB 3.75Å; V92-T101 CarbonylContact C-O 3.55Å; V92-T101 VanDerWaalsContact CA-O 3.32Å; V92-T101 WeakPolarHBondContact CA-O 3.41Å
93	D	93.6	Very high	90.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	136.1	177.3	-61.1	-51.2	0	0	0	110.6	H69 P100 T101 S179 W187	H69-D93 IonicContact CD2-OD1 3.6Å; H69-D93 PolarHBondContact CD2-OD1 3.44Å; H69-D93 IonicContact NE2-OD1 3.38Å; D93-P100 WeakPolarHBondContact O-CA 3.37Å; D93-T101 PolarHBondContact N-O 3.24Å; D93-T101 PolarHBondContact O-N 2.79Å; D93-T101 PolarHBondContact O-OG1 3.27Å; D93-S179 VanDerWaalsContact OD2-CB 3.23Å; D93-S179 WeakPolarHBondContact OD2-CB 3.4Å; D93-S179 PolarHBondContact OD2-OG 3.46Å; D93-W187 VanDerWaalsContact CG-NE1 3.27Å; D93-W187 WeakPolarHBondContact OD1-CZ2 3.23Å; D93-W187 PolarHBondContact OD1-NE1 3.43Å; D93-W187 PolarHBondContact OD2-NE1 3.38Å
94	Y	89.6	Confident	91	Very high	35 Å²	35	30.9 Å²	30.9	14%	0.137	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.5	177.8	-161.4	-80.1	0	0	0	110.4	H42 H69 T70 P100	H42-Y94 HydrophobicContact CB-CD2 4.48Å; H42-Y94 AromaticContact CD2-CD1 3.87Å; H42-Y94 AromaticContact CD2-CD2 3.67Å; H42-Y94 AromaticContact CD2-CE1 3.65Å; H42-Y94 AromaticContact CD2-CE2 3.4Å; H42-Y94 VanDerWaalsContact CD2-CE2 3.4Å; H42-Y94 WeakPolarHBondContact CD2-CE2 3.35Å; H42-Y94 AromaticContact CD2-CG 3.89Å; H42-Y94 AromaticContact CD2-CZ 3.4Å; H42-Y94 VanDerWaalsContact CD2-CZ 3.4Å; H42-Y94 AromaticContact CE1-CD1 3.68Å; H42-Y94 AromaticContact CE1-CE1 3.99Å; H42-Y94 AromaticContact CE1-CG 3.95Å; H42-Y94 AromaticContact CG-CD2 3.98Å; H42-Y94 AromaticContact NE2-CD1 3.35Å; H42-Y94 WeakPolarHBondContact NE2-CD1 3.35Å; H42-Y94 AromaticContact NE2-CE1 3.19Å; H42-Y94 WeakPolarHBondContact NE2-CE1 3.09Å; H42-Y94 AromaticContact NE2-CE2 3.9Å; H42-Y94 AromaticContact NE2-CG 3.8Å; H42-Y94 AromaticContact NE2-CZ 3.48Å; H69-Y94 WeakPolarHBondContact CA-O 3.47Å; H69-Y94 WeakPolarHBondContact CB-O 3.43Å; T70-Y94 PolarHBondContact N-O 3.21Å; T70-Y94 PolarHBondContact O-N 2.76Å; Y94-P100 HydrophobicContact CD2-CB 4.19Å
95	T	86.8	Confident	91.4	Very high	24 Å²	24	29.7 Å²	29.7	15%	0.147	18%	0.181	C	C	.	.			trans	-105.5	155.9	167.5	64	0	0	0	0	109.1	H69 S97 D98 F183	H69-T95 HydrophobicContact CB-CG2 4.31Å; T95-S97 PolarHBondContact O-N 2.95Å; T95-D98 VanDerWaalsContact OG1-CB 3.24Å; T95-D98 WeakPolarHBondContact OG1-CB 3.23Å; T95-D98 PolarHBondContact OG1-N 3.37Å; T95-D98 PolarHBondContact OG1-OD2 2.83Å; T95-F183 HydrophobicContact CG2-CD2 4.46Å; T95-F183 HydrophobicContact CG2-CE2 3.48Å; T95-F183 VanDerWaalsContact CG2-CE2 3.48Å; T95-F183 HydrophobicContact CG2-CZ 4.05Å
96	S	78.3	Confident	91.5	Very high	115 Å²	115	27.1 Å²	27.1	80%	0.804	17%	0.169	S	C	*	.	S	Bend	trans	-58.9	-14	-175	-19.6	0	0	0	0	114.6
97	S	75.6	Confident	91.5	Very high	109 Å²	109	28 Å²	28	76%	0.762	18%	0.175	S	C	*	.	S	Bend	trans	-128.7	-16.2	-165.3	-51.8	0	0	0	0	114.3	T95	T95-S97 PolarHBondContact O-N 2.95Å
98	D	79.9	Confident	91.5	Very high	93 Å²	93	28 Å²	28	50%	0.497	18%	0.175	S	C	.	.	S	Bend	trans	-114.7	157.8	-171.8	-54.9	-55.5	0	0	0	111.9	T95	T95-D98 VanDerWaalsContact OG1-CB 3.24Å; T95-D98 WeakPolarHBondContact OG1-CB 3.23Å; T95-D98 PolarHBondContact OG1-N 3.37Å; T95-D98 PolarHBondContact OG1-OD2 2.83Å
99	P	86.8	Confident	91.4	Very high	100 Å²	100	29.3 Å²	29.3	65%	0.649	18%	0.18	S	C	*	.			trans	-57.8	151.9	167.2	26.4	-35.7	0	0	0	110.9	T101	P99-T101 PolarHBondContact O-N 2.99Å
100	P	91.5	Very high	91.3	Very high	12 Å²	12	30 Å²	30	8%	0.078	19%	0.185	C	C	.	.			trans	-60.5	141.3	178.2	28.4	-36.2	0	0	0	110.4	L49 V92 D93 Y94	L49-P100 HydrophobicContact CD1-CB 3.86Å; L49-P100 HydrophobicContact CD1-CG 3.83Å; L49-P100 HydrophobicContact CD2-CG 4.35Å; L49-P100 HydrophobicContact CG-CG 4.03Å; V92-P100 HydrophobicContact CG1-CB 3.75Å; D93-P100 WeakPolarHBondContact O-CA 3.37Å; Y94-P100 HydrophobicContact CD2-CB 4.19Å
101	T	94.1	Very high	91.2	Very high	25 Å²	25	32.3 Å²	32.3	15%	0.153	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	151.9	-179.6	49	0	0	0	0	110.3	V92 D93 P99 S179	V92-T101 CarbonylContact C-O 3.55Å; V92-T101 VanDerWaalsContact CA-O 3.32Å; V92-T101 WeakPolarHBondContact CA-O 3.41Å; D93-T101 PolarHBondContact N-O 3.24Å; D93-T101 PolarHBondContact O-N 2.79Å; D93-T101 PolarHBondContact O-OG1 3.27Å; P99-T101 PolarHBondContact O-N 2.99Å; T101-S179 PolarHBondContact OG1-OG 3.44Å
102	I	95.7	Very high	91.1	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.1	175.7	-61.4	171.5	0	0	0	107.7	L49 V90 V105 Y173 R176 I177 S178 S179	L49-I102 HydrophobicContact CD1-CG1 4.19Å; V90-I102 HydrophobicContact CG1-CG1 4.25Å; V90-I102 HydrophobicContact CG1-CG2 3.89Å; I102-V105 HydrophobicContact CG2-CG2 3.6Å; I102-Y173 HydrophobicContact CD1-CD1 3.96Å; I102-R176 HydrophobicContact CD1-CB 4.12Å; I102-I177 HydrophobicContact CG2-CG1 4.08Å; I102-I177 CarbonylContact O-C 3.55Å; I102-I177 VanDerWaalsContact O-CA 3.28Å; I102-I177 WeakPolarHBondContact O-CA 3.46Å; I102-S178 PolarHBondContact O-N 2.79Å; I102-S179 PolarHBondContact O-N 3.48Å; I102-S179 PolarHBondContact O-OG 2.82Å
103	G	94.2	Very high	91	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-21	178	0	0	0	0	0	113.8	G91 S179 L184	G91-G103 PolarHBondContact O-N 3.24Å; G103-S179 WeakPolarHBondContact CA-OG 3.48Å; G103-S179 PolarHBondContact N-OG 3Å; G103-S179 VanDerWaalsContact N-OG 3.16Å; G103-L184 WeakPolarHBondContact O-CD2 3.36Å
104	L	95.2	Very high	91	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	141.6	-177	178.9	64.4	0	0	0	110.7	V90 G91 L106 H131 W187	V90-L104 CarbonylContact C-O 3.58Å; V90-L104 WeakPolarHBondContact CA-O 3.36Å; G91-L104 PolarHBondContact N-O 3.29Å; G91-L104 PolarHBondContact O-N 3.19Å; L104-L106 HydrophobicContact CD1-CD1 4.09Å; L104-L106 HydrophobicContact CD1-CD2 3.87Å; L104-L106 HydrophobicContact CD1-CG 3.75Å; L104-L106 HydrophobicContact CD2-CD1 3.8Å; L104-L106 HydrophobicContact CD2-CG 4.19Å; L104-L106 HydrophobicContact CG-CD1 4.08Å; L104-L106 HydrophobicContact CG-CG 3.89Å; L104-H131 WeakPolarHBondContact CD1-CE1 3.22Å; L104-W187 HydrophobicContact CB-CB 4.05Å; L104-W187 HydrophobicContact CB-CD2 3.87Å; L104-W187 HydrophobicContact CB-CE3 3.93Å; L104-W187 HydrophobicContact CB-CG 3.94Å; L104-W187 HydrophobicContact CD2-CB 4.45Å; L104-W187 HydrophobicContact CD2-CD2 4.28Å; L104-W187 HydrophobicContact CD2-CE3 3.56Å; L104-W187 HydrophobicContact CD2-CZ3 4.22Å; L104-W187 HydrophobicContact CG-CE3 4.41Å
105	V	95.7	Very high	91.1	Very high	12 Å²	12	35.4 Å²	35.4	7%	0.073	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	122.1	170.9	179.8	0	0	0	0	108	I88 V89 I102 V170 E174 I177	I88-V105 HydrophobicContact CD1-CG1 4.13Å; V89-V105 CarbonylContact O-C 3.48Å; V89-V105 WeakPolarHBondContact O-CA 3.28Å; I102-V105 HydrophobicContact CG2-CG2 3.6Å; V105-V170 HydrophobicContact CG1-CG1 3.87Å; V105-E174 HydrophobicContact CB-CG 4.13Å; V105-E174 HydrophobicContact CG1-CG 3.93Å; V105-I177 HydrophobicContact CB-CD1 4.41Å; V105-I177 HydrophobicContact CG2-CD1 4.15Å; V105-I177 HydrophobicContact CG2-CG1 4.01Å
106	L	95	Very high	91.2	Very high	16 Å²	16	35 Å²	35	8%	0.084	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	111	179.3	-59	172.6	0	0	0	110.5	I88 V89 L104 H131	I88-L106 CarbonylContact C-O 3.56Å; I88-L106 VanDerWaalsContact CA-O 3.28Å; I88-L106 WeakPolarHBondContact CA-O 3.28Å; V89-L106 HydrophobicContact CB-CB 4.2Å; V89-L106 PolarHBondContact N-O 3.38Å; V89-L106 PolarHBondContact O-N 3.28Å; L104-L106 HydrophobicContact CD1-CD1 4.09Å; L104-L106 HydrophobicContact CD1-CD2 3.87Å; L104-L106 HydrophobicContact CD1-CG 3.75Å; L104-L106 HydrophobicContact CD2-CD1 3.8Å; L104-L106 HydrophobicContact CD2-CG 4.19Å; L104-L106 HydrophobicContact CG-CD1 4.08Å; L104-L106 HydrophobicContact CG-CG 3.89Å; L106-H131 HydrophobicContact CD1-CB 3.89Å; L106-H131 WeakPolarHBondContact CD1-CD2 3.48Å; L106-H131 WeakPolarHBondContact CD2-CD2 3.17Å; L106-H131 VanDerWaalsContact CD2-NE2 3.27Å; L106-H131 WeakPolarHBondContact CD2-NE2 3.49Å
107	P	95.3	Very high	91.6	Very high	21 Å²	21	30.8 Å²	30.8	14%	0.136	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	142.4	168	-21.1	34.9	0	0	0	111.4	I88 W109 V170	I88-P107 HydrophobicContact CG2-CB 4.32Å; I88-P107 HydrophobicContact CG2-CG 4.5Å; P107-W109 HydrophobicContact CB-CD2 4.17Å; P107-W109 HydrophobicContact CB-CH2 3.78Å; P107-W109 HydrophobicContact CB-CZ2 3.3Å; P107-W109 HydrophobicContact CB-CZ3 4.39Å; P107-W109 HydrophobicContact CG-CH2 4.34Å; P107-W109 HydrophobicContact CG-CZ2 3.7Å; P107-V170 HydrophobicContact CG-CB 4.45Å; P107-V170 HydrophobicContact CG-CG1 3.72Å; P107-V170 HydrophobicContact CG-CG2 4.12Å
108	V	95.2	Very high	91.9	Very high	6 Å²	6	25.7 Å²	25.7	4%	0.036	15%	0.153	C	C	.	.			trans	-93.1	112.2	175.5	-176.9	0	0	0	0	109.2	S87 V89 V151 N152 A155	S87-V108 WeakPolarHBondContact O-CB 3.37Å; S87-V108 PolarHBondContact O-N 2.85Å; V89-V108 HydrophobicContact CG2-CG2 4.06Å; V108-V151 HydrophobicContact CG1-CG2 4.2Å; V108-V151 HydrophobicContact CG2-CG2 4.05Å; V108-N152 HydrophobicContact CG1-CB 4.24Å; V108-A155 HydrophobicContact CG1-CB 4.24Å
109	W	94.9	Very high	92.1	Very high	27 Å²	27	22.6 Å²	22.6	10%	0.102	14%	0.137	C	C	.	.			trans	-100	164.8	-179.7	-52.9	120.6	0	0	0	111.7	P107 T111 T112 P162 H167	P107-W109 HydrophobicContact CB-CD2 4.17Å; P107-W109 HydrophobicContact CB-CH2 3.78Å; P107-W109 HydrophobicContact CB-CZ2 3.3Å; P107-W109 HydrophobicContact CB-CZ3 4.39Å; P107-W109 HydrophobicContact CG-CH2 4.34Å; P107-W109 HydrophobicContact CG-CZ2 3.7Å; W109-T111 PolarHBondContact O-N 3.37Å; W109-T112 PolarHBondContact N-OG1 3.33Å; W109-T112 WeakPolarHBondContact O-CB 3.49Å; W109-T112 PolarHBondContact O-N 3.15Å; W109-T112 VanDerWaalsContact O-N 3.12Å; W109-T112 PolarHBondContact O-OG1 3.34Å; W109-P162 HydrophobicContact CD2-CG 4.05Å; W109-P162 HydrophobicContact CG-CG 4.1Å; W109-P162 HydrophobicContact CZ2-CB 4.43Å; W109-P162 HydrophobicContact CZ2-CG 4.4Å; W109-H167 HydrophobicContact CH2-CB 3.83Å; W109-H167 AromaticContact CH2-CG 3.96Å; W109-H167 HydrophobicContact CZ3-CB 4.05Å; W109-H167 AromaticContact CZ3-CE1 3.96Å; W109-H167 AromaticContact CZ3-CG 3.76Å; W109-H167 AromaticContact CZ3-ND1 3.33Å; W109-H167 VanDerWaalsContact CZ3-ND1 3.33Å; W109-H167 WeakPolarHBondContact CZ3-ND1 3.47Å
110	A	93.3	Very high	92	Very high	14 Å²	14	18 Å²	18	12%	0.116	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-33.2	171.6	0	0	0	0	0	112.2	T112 A155 R156 Y160 Y161	A110-T112 VanDerWaalsContact C-N 3.34Å; A110-A155 VanDerWaalsContact CB-O 3.31Å; A110-A155 WeakPolarHBondContact CB-O 3.47Å; A110-R156 HydrophobicContact CB-CG 4.37Å; A110-R156 PolarHBondContact O-NE 3.17Å; A110-Y160 PolarHBondContact N-O 3.49Å; A110-Y161 HydrophobicContact CB-CE1 4.1Å
111	T	93.4	Very high	92	Very high	54 Å²	54	17.5 Å²	17.5	33%	0.331	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-9.7	179.4	52	0	0	0	0	113.4	W109 S113 D127 Y161	W109-T111 PolarHBondContact O-N 3.37Å; T111-S113 PolarHBondContact O-N 3.27Å; T111-D127 WeakPolarHBondContact CB-OD2 3.43Å; T111-D127 PolarHBondContact OG1-OD2 2.9Å; T111-Y161 HydrophobicContact CG2-CD1 4.22Å; T111-Y161 HydrophobicContact CG2-CE1 4.06Å
112	T	94.4	Very high	91.9	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.018	10%	0.097	C	C	.	.			trans	-60.5	128.3	178.8	-60	0	0	0	0	110.1	W109 A110 I114 I124 E125 N152	W109-T112 PolarHBondContact N-OG1 3.33Å; W109-T112 WeakPolarHBondContact O-CB 3.49Å; W109-T112 PolarHBondContact O-N 3.15Å; W109-T112 VanDerWaalsContact O-N 3.12Å; W109-T112 PolarHBondContact O-OG1 3.34Å; A110-T112 VanDerWaalsContact C-N 3.34Å; T112-I114 HydrophobicContact CG2-CG1 4.37Å; T112-I124 HydrophobicContact CG2-CG2 3.72Å; T112-E125 CarbonylContact C-O 3.57Å; T112-E125 WeakPolarHBondContact CA-O 3.34Å; T112-N152 PolarHBondContact O-ND2 3.41Å
113	S	93.3	Very high	91.7	Very high	40 Å²	40	17 Å²	17	28%	0.28	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	135.7	174.9	179	0	0	0	0	109.4	T111 I124 E125	T111-S113 PolarHBondContact O-N 3.27Å; S113-I124 WeakPolarHBondContact O-CA 3.34Å; S113-E125 PolarHBondContact N-O 3.23Å; S113-E125 PolarHBondContact O-N 2.7Å
114	I	93	Very high	91.7	Very high	14 Å²	14	17.5 Å²	17.5	7%	0.072	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121	179.7	-59.2	151.6	0	0	0	106.9	T112 I122 Y123 Y145 L148 N152	T112-I114 HydrophobicContact CG2-CG1 4.37Å; I114-I122 HydrophobicContact CG2-CG2 3.92Å; I114-Y123 WeakPolarHBondContact CA-O 2.99Å; I114-Y145 HydrophobicContact CG2-CD2 4.29Å; I114-Y145 HydrophobicContact CG2-CE2 4.17Å; I114-L148 HydrophobicContact CD1-CB 3.74Å; I114-L148 HydrophobicContact CG1-CB 4.43Å; I114-L148 HydrophobicContact CG2-CB 4.47Å; I114-L148 HydrophobicContact CG2-CD1 4.38Å; I114-N152 HydrophobicContact CD1-CB 3.8Å
115	T	91.4	Very high	91.5	Very high	49 Å²	49	20.2 Å²	20.2	30%	0.301	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157.5	-179.1	59.5	0	0	0	0	111	Y123	T115-Y123 PolarHBondContact N-O 2.92Å; T115-Y123 PolarHBondContact O-N 3.39Å
116	L	89.3	Confident	91.1	Very high	16 Å²	16	20.5 Å²	20.5	8%	0.084	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	153.4	169.8	-63.9	-176.6	0	0	0	111.4	G121 I122 M141 Y145 D260 L264	L116-G121 WeakPolarHBondContact CA-O 3.44Å; L116-I122 HydrophobicContact CD2-CG1 3.77Å; L116-M141 HydrophobicContact CD2-CG 4.49Å; L116-M141 HydrophobicContact CD2-SD 4.28Å; L116-Y145 HydrophobicContact CD2-CD2 3.82Å; L116-Y145 HydrophobicContact CD2-CE2 4.08Å; L116-Y145 HydrophobicContact CG-CD2 4.24Å; L116-Y145 HydrophobicContact CG-CE2 4.02Å; L116-D260 HydrophobicContact CB-CB 4.18Å; L116-D260 HydrophobicContact CD1-CB 3.78Å; L116-L264 HydrophobicContact CD1-CD1 3.5Å; L116-L264 HydrophobicContact CD1-CD2 4.29Å; L116-L264 HydrophobicContact CD1-CG 3.84Å; L116-L264 HydrophobicContact CG-CD1 4.33Å
117	D	85.8	Confident	90.5	Very high	26 Å²	26	24.8 Å²	24.8	14%	0.139	14%	0.14	C	C	.	.			trans	-93.4	-10.6	-179.1	78.2	-24.9	0	0	0	114.6	D119 G120 G121 F132	D117-D119 WeakPolarHBondContact OD1-CA 3.45Å; D117-D119 PolarHBondContact OD1-N 3.23Å; D117-G120 PolarHBondContact OD1-N 3.27Å; D117-G121 PolarHBondContact N-O 2.76Å; D117-G121 VanDerWaalsContact OD1-CA 3.29Å; D117-G121 WeakPolarHBondContact OD1-CA 3.38Å; D117-G121 PolarHBondContact OD1-N 3.35Å; D117-F132 HydrophobicContact CB-CE2 3.86Å; D117-F132 WeakPolarHBondContact OD2-CE2 3.34Å; D117-F132 WeakPolarHBondContact OD2-CZ 3.31Å
118	G	81.9	Confident	89.8	Confident	2 Å²	2	29.4 Å²	29.4	2%	0.021	17%	0.168	C	C	.	.	S	Bend	trans	94.3	-1.9	-175.6	0	0	0	0	0	114.7	R241 D260	G118-R241 PolarHBondContact O-NH1 3.23Å; G118-D260 VanDerWaalsContact C-CG 3.49Å; G118-D260 VanDerWaalsContact CA-CG 3.43Å; G118-D260 WeakPolarHBondContact CA-OD2 3.4Å; G118-D260 PolarHBondContact N-OD2 3.13Å
119	D	84.8	Confident	89.4	Confident	29 Å²	29	30.8 Å²	30.8	16%	0.155	18%	0.178	C	C	.	.	S	Bend	trans	-129.1	22.5	179.1	-77.3	41.9	0	0	0	111.2	D117 G121 R241 K256 D260	D117-D119 WeakPolarHBondContact OD1-CA 3.45Å; D117-D119 PolarHBondContact OD1-N 3.23Å; D119-G121 VanDerWaalsContact C-N 3.27Å; D119-G121 PolarHBondContact O-N 3.26Å; D119-R241 IonicContact OD1-CZ 3.8Å; D119-R241 IonicContact OD1-NH1 3.51Å; D119-R241 PolarHBondContact OD1-NH1 2.95Å; D119-R241 IonicContact OD1-NH2 3.29Å; D119-R241 IonicContact OD2-CZ 3.59Å; D119-R241 IonicContact OD2-NH1 3.94Å; D119-R241 PolarHBondContact OD2-NH1 2.98Å; D119-R241 IonicContact OD2-NH2 2.66Å; D119-R241 PolarHBondContact OD2-NH2 3.24Å; D119-K256 WeakPolarHBondContact OD1-CD 3.39Å; D119-K256 VanDerWaalsContact OD1-CE 3.29Å; D119-K256 WeakPolarHBondContact OD1-CE 3.26Å; D119-K256 IonicContact OD1-NZ 3.78Å; D119-K256 PolarHBondContact OD1-NZ 3.12Å; D119-K256 IonicContact OD2-NZ 3.54Å; D119-K256 PolarHBondContact OD2-NZ 2.89Å; D119-D260 PolarHBondContact N-OD2 3.18Å
120	G	84.6	Confident	89.1	Confident	4 Å²	4	33 Å²	33	4%	0.041	19%	0.189	C	C	.	.	S	Bend	trans	76.4	7.6	-178.8	0	0	0	0	0	115.9	D117 M141 S237 D260	D117-G120 PolarHBondContact OD1-N 3.27Å; G120-M141 WeakPolarHBondContact CA-SD 3.06Å; G120-S237 VanDerWaalsContact CA-CB 3.42Å; G120-S237 WeakPolarHBondContact CA-OG 3.4Å; G120-D260 PolarHBondContact N-OD1 2.96Å; G120-D260 PolarHBondContact N-OD2 2.81Å; G120-D260 VanDerWaalsContact N-OD2 3.13Å
121	G	91	Very high	89.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-82.7	141.7	171.5	0	0	0	0	0	111.6	L116 D117 D119 L133	L116-G121 WeakPolarHBondContact CA-O 3.44Å; D117-G121 PolarHBondContact N-O 2.76Å; D117-G121 VanDerWaalsContact OD1-CA 3.29Å; D117-G121 WeakPolarHBondContact OD1-CA 3.38Å; D117-G121 PolarHBondContact OD1-N 3.35Å; D119-G121 VanDerWaalsContact C-N 3.27Å; D119-G121 PolarHBondContact O-N 3.26Å; G121-L133 CarbonylContact C-O 3.55Å; G121-L133 WeakPolarHBondContact CA-O 3.28Å
122	I	92.6	Very high	88.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.2	176	-57.6	170.5	0	0	0	108.1	I114 L116 I124 L133 P135 M141 V144 L148	I114-I122 HydrophobicContact CG2-CG2 3.92Å; L116-I122 HydrophobicContact CD2-CG1 3.77Å; I122-I124 HydrophobicContact CG2-CG1 4.39Å; I122-L133 HydrophobicContact CB-CB 4.45Å; I122-L133 PolarHBondContact N-O 3.15Å; I122-L133 PolarHBondContact O-N 2.84Å; I122-P135 HydrophobicContact CD1-CG 4.07Å; I122-M141 HydrophobicContact CD1-CG 4.25Å; I122-M141 HydrophobicContact CG1-CG 4.3Å; I122-V144 HydrophobicContact CD1-CB 3.62Å; I122-V144 HydrophobicContact CD1-CG1 3.49Å; I122-V144 VanDerWaalsContact CD1-CG1 3.49Å; I122-L148 HydrophobicContact CG2-CD1 3.87Å
123	Y	91.9	Very high	88.9	Confident	20 Å²	20	32 Å²	32	8%	0.078	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.3	177.3	-171.6	-107.6	0	0	0	110.2	I114 T115 E125 Q130	I114-Y123 WeakPolarHBondContact CA-O 2.99Å; T115-Y123 PolarHBondContact N-O 2.92Å; T115-Y123 PolarHBondContact O-N 3.39Å; Y123-E125 HydrophobicContact CD1-CB 4.25Å; Y123-E125 HydrophobicContact CE1-CB 3.8Å; Y123-Q130 HydrophobicContact CE2-CB 4.09Å; Y123-Q130 WeakPolarHBondContact OH-CB 3.23Å; Y123-Q130 VanDerWaalsContact OH-CG 3.24Å; Y123-Q130 WeakPolarHBondContact OH-CG 3.44Å; Y123-Q130 PolarHBondContact OH-NE2 3.33Å; Y123-Q130 VanDerWaalsContact OH-NE2 3.1Å; Y123-Q130 PolarHBondContact OH-OE1 2.95Å
124	I	93.3	Very high	88.8	Confident	9 Å²	9	32.5 Å²	32.5	5%	0.046	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.2	176.7	-54.8	177.9	0	0	0	107.6	V89 T112 S113 I122 Q130 H131 L133 L148	V89-I124 HydrophobicContact CG2-CD1 4.41Å; T112-I124 HydrophobicContact CG2-CG2 3.72Å; S113-I124 WeakPolarHBondContact O-CA 3.34Å; I122-I124 HydrophobicContact CG2-CG1 4.39Å; I124-Q130 WeakPolarHBondContact O-CA 3.25Å; I124-H131 PolarHBondContact N-O 3.44Å; I124-H131 PolarHBondContact O-N 2.82Å; I124-L133 HydrophobicContact CD1-CD1 3.57Å; I124-L133 HydrophobicContact CD1-CG 4.33Å; I124-L133 HydrophobicContact CG1-CD1 4.41Å; I124-L148 HydrophobicContact CD1-CD1 3.76Å; I124-L148 HydrophobicContact CD1-CD2 4.1Å; I124-L148 HydrophobicContact CG1-CD1 4.19Å
125	E	91.6	Very high	88.8	Confident	63 Å²	63	32 Å²	32	29%	0.294	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.6	177	176.3	172.6	-134.4	0	0	109.4	T112 S113 Y123 Q130	T112-E125 CarbonylContact C-O 3.57Å; T112-E125 WeakPolarHBondContact CA-O 3.34Å; S113-E125 PolarHBondContact N-O 3.23Å; S113-E125 PolarHBondContact O-N 2.7Å; Y123-E125 HydrophobicContact CD1-CB 4.25Å; Y123-E125 HydrophobicContact CE1-CB 3.8Å; E125-Q130 HydrophobicContact CB-CG 4.36Å; E125-Q130 HydrophobicContact CG-CG 4.05Å; E125-Q130 PolarHBondContact OE1-NE2 3.03Å
126	S	87.4	Confident	88.9	Confident	18 Å²	18	32.1 Å²	32.1	13%	0.126	17%	0.171	C	C	.	.			trans	-112.7	172.8	168.4	70.6	0	0	0	0	109.4	T128 S129	S126-T128 PolarHBondContact O-N 3.5Å; S126-T128 VanDerWaalsContact O-N 3.09Å; S126-T128 PolarHBondContact OG-N 2.9Å; S126-T128 PolarHBondContact OG-OG1 3.07Å; S126-S129 PolarHBondContact N-O 2.99Å; S126-S129 PolarHBondContact OG-N 3.4Å; S126-S129 PolarHBondContact OG-O 3.29Å; S126-S129 VanDerWaalsContact OG-O 3.04Å; S126-S129 PolarHBondContact OG-OG 3.38Å; S126-S129 VanDerWaalsContact OG-OG 3.12Å
127	D	82.4	Confident	89	Confident	105 Å²	105	31.5 Å²	31.5	56%	0.561	17%	0.168	S	C	*	.	S	Bend	trans	-60.3	-21.8	177.5	-59	-40.4	0	0	0	113	T111	T111-D127 WeakPolarHBondContact CB-OD2 3.43Å; T111-D127 PolarHBondContact OG1-OD2 2.9Å
128	T	80.7	Confident	89.4	Confident	119 Å²	119	30.2 Å²	30.2	73%	0.73	16%	0.161	S	C	*	.	S	Bend	trans	-115.7	-19.8	-173	53.3	0	0	0	0	114.5	S126	S126-T128 PolarHBondContact O-N 3.5Å; S126-T128 VanDerWaalsContact O-N 3.09Å; S126-T128 PolarHBondContact OG-N 2.9Å; S126-T128 PolarHBondContact OG-OG1 3.07Å
129	S	86	Confident	89.7	Confident	34 Å²	34	32.9 Å²	32.9	24%	0.238	17%	0.173	C	C	.	.			trans	-154.8	155	-172.5	72.3	0	0	0	0	113.3	S126 H131	S126-S129 PolarHBondContact N-O 2.99Å; S126-S129 PolarHBondContact OG-N 3.4Å; S126-S129 PolarHBondContact OG-O 3.29Å; S126-S129 VanDerWaalsContact OG-O 3.04Å; S126-S129 PolarHBondContact OG-OG 3.38Å; S126-S129 VanDerWaalsContact OG-OG 3.12Å; S129-H131 VanDerWaalsContact CB-NE2 3.29Å; S129-H131 WeakPolarHBondContact CB-NE2 3.28Å; S129-H131 PolarHBondContact OG-CD2 3.34Å; S129-H131 PolarHBondContact OG-NE2 3.43Å
130	Q	89.2	Confident	90.1	Very high	74 Å²	74	31.6 Å²	31.6	35%	0.346	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.3	179.2	-68.6	174.9	-15.8	0	0	108.4	Y123 I124 E125	Y123-Q130 HydrophobicContact CE2-CB 4.09Å; Y123-Q130 WeakPolarHBondContact OH-CB 3.23Å; Y123-Q130 VanDerWaalsContact OH-CG 3.24Å; Y123-Q130 WeakPolarHBondContact OH-CG 3.44Å; Y123-Q130 PolarHBondContact OH-NE2 3.33Å; Y123-Q130 VanDerWaalsContact OH-NE2 3.1Å; Y123-Q130 PolarHBondContact OH-OE1 2.95Å; I124-Q130 WeakPolarHBondContact O-CA 3.25Å; E125-Q130 HydrophobicContact CB-CG 4.36Å; E125-Q130 HydrophobicContact CG-CG 4.05Å; E125-Q130 PolarHBondContact OE1-NE2 3.03Å
131	H	92.1	Very high	90.5	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.037	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	143.9	-177.3	-64.1	-84.7	0	0	0	111.2	L104 L106 I124 S129 W187 H188	L104-H131 WeakPolarHBondContact CD1-CE1 3.22Å; L106-H131 HydrophobicContact CD1-CB 3.89Å; L106-H131 WeakPolarHBondContact CD1-CD2 3.48Å; L106-H131 WeakPolarHBondContact CD2-CD2 3.17Å; L106-H131 VanDerWaalsContact CD2-NE2 3.27Å; L106-H131 WeakPolarHBondContact CD2-NE2 3.49Å; I124-H131 PolarHBondContact N-O 3.44Å; I124-H131 PolarHBondContact O-N 2.82Å; S129-H131 VanDerWaalsContact CB-NE2 3.29Å; S129-H131 WeakPolarHBondContact CB-NE2 3.28Å; S129-H131 PolarHBondContact OG-CD2 3.34Å; S129-H131 PolarHBondContact OG-NE2 3.43Å; H131-W187 PolarHBondContact ND1-O 2.99Å; H131-H188 AromaticContact CE1-CD2 3.88Å
132	F	91	Very high	90.5	Very high	41 Å²	41	32.1 Å²	32.1	18%	0.18	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.2	-178.4	-177.4	-106.9	0	0	0	109.9	D117 K134	D117-F132 HydrophobicContact CB-CE2 3.86Å; D117-F132 WeakPolarHBondContact OD2-CE2 3.34Å; D117-F132 WeakPolarHBondContact OD2-CZ 3.31Å; F132-K134 HydrophobicContact CE1-CB 4.01Å; F132-K134 HydrophobicContact CE1-CD 4.19Å; F132-K134 HydrophobicContact CE1-CG 4.5Å; F132-K134 HydrophobicContact CZ-CB 4.42Å; F132-K134 HydrophobicContact CZ-CD 4.33Å
133	L	92.9	Very high	90.4	Very high	2 Å²	2	33 Å²	33	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.8	179.1	-52.4	178.8	0	0	0	108.6	L62 V73 G121 I122 I124 P135 W187	L62-L133 HydrophobicContact CD1-CB 4.35Å; L62-L133 HydrophobicContact CD1-CD2 3.9Å; L62-L133 HydrophobicContact CD2-CB 4.28Å; V73-L133 HydrophobicContact CB-CD1 4.32Å; V73-L133 HydrophobicContact CG2-CD1 3.81Å; G121-L133 CarbonylContact C-O 3.55Å; G121-L133 WeakPolarHBondContact CA-O 3.28Å; I122-L133 HydrophobicContact CB-CB 4.45Å; I122-L133 PolarHBondContact N-O 3.15Å; I122-L133 PolarHBondContact O-N 2.84Å; I124-L133 HydrophobicContact CD1-CD1 3.57Å; I124-L133 HydrophobicContact CD1-CG 4.33Å; I124-L133 HydrophobicContact CG1-CD1 4.41Å; L133-P135 WeakPolarHBondContact O-CD 3.21Å; L133-W187 HydrophobicContact CD2-CE3 4.4Å; L133-W187 HydrophobicContact CD2-CZ3 3.97Å
134	K	92.2	Very high	90.4	Very high	49 Å²	49	32 Å²	32	21%	0.213	17%	0.169	C	C	.	.			trans	-122.9	94.5	177.5	-159.1	168.9	-179.3	-177	0	111.1	L62 E63 F132	L62-K134 CarbonylContact C-O 3.57Å; L62-K134 VanDerWaalsContact CA-O 3.27Å; L62-K134 WeakPolarHBondContact CA-O 3.26Å; L62-K134 WeakPolarHBondContact CB-O 3.24Å; E63-K134 HydrophobicContact CB-CB 4.34Å; E63-K134 HydrophobicContact CG-CG 4.29Å; E63-K134 PolarHBondContact N-O 3.25Å; E63-K134 WeakPolarHBondContact OE1-CD 3.33Å; E63-K134 WeakPolarHBondContact OE1-CE 3.33Å; E63-K134 WeakPolarHBondContact OE1-CG 3.29Å; E63-K134 IonicContact OE1-NZ 2.88Å; E63-K134 WeakPolarHBondContact OE2-CD 3.29Å; E63-K134 IonicContact OE2-NZ 3.06Å; F132-K134 HydrophobicContact CE1-CB 4.01Å; F132-K134 HydrophobicContact CE1-CD 4.19Å; F132-K134 HydrophobicContact CE1-CG 4.5Å; F132-K134 HydrophobicContact CZ-CB 4.42Å; F132-K134 HydrophobicContact CZ-CD 4.33Å
135	P	93.6	Very high	90.4	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.032	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-62.7	147.8	178.1	-26.8	40.5	0	0	0	111.6	V60 L62 I122 L133 S137 A140 M141 V144	V60-P135 HydrophobicContact CG1-CB 4.32Å; L62-P135 HydrophobicContact CD2-CG 4.15Å; I122-P135 HydrophobicContact CD1-CG 4.07Å; L133-P135 WeakPolarHBondContact O-CD 3.21Å; P135-S137 PolarHBondContact O-N 3.21Å; P135-A140 HydrophobicContact CB-CB 3.85Å; P135-M141 HydrophobicContact CB-CB 4.12Å; P135-M141 HydrophobicContact CG-CB 4.2Å; P135-V144 HydrophobicContact CG-CB 4.47Å; P135-V144 HydrophobicContact CG-CG2 4.25Å
136	I	92.2	Very high	90.3	Very high	51 Å²	51	35.2 Å²	35.2	26%	0.262	18%	0.182	S	C	.	.	S	Bend	trans	-72.2	-9.3	-172.8	63	165.5	0	0	0	115.1	R61 L62 E63 A140	R61-I136 HydrophobicContact CB-CD1 4.17Å; R61-I136 HydrophobicContact CB-CG1 4.45Å; R61-I136 HydrophobicContact CB-CG2 4.35Å; R61-I136 HydrophobicContact CG-CD1 4.34Å; R61-I136 HydrophobicContact CG-CG2 3.92Å; R61-I136 PolarHBondContact O-N 2.85Å; L62-I136 VanDerWaalsContact C-CG2 3.43Å; E63-I136 HydrophobicContact CG-CG2 4.44Å; I136-A140 HydrophobicContact CG1-CB 4.48Å
137	S	92.6	Very high	90.5	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.014	18%	0.184	C	C	.	.	S	Bend	trans	-153.8	163.8	-178.9	70.2	0	0	0	0	111.2	P135 Q139 A140 M141 D233 V235	P135-S137 PolarHBondContact O-N 3.21Å; S137-Q139 VanDerWaalsContact C-N 3.3Å; S137-Q139 PolarHBondContact O-N 2.85Å; S137-A140 WeakPolarHBondContact O-CB 3.23Å; S137-A140 PolarHBondContact O-N 3.36Å; S137-A140 VanDerWaalsContact OG-CB 3.26Å; S137-A140 WeakPolarHBondContact OG-CB 3.27Å; S137-A140 PolarHBondContact OG-N 3.24Å; S137-A140 VanDerWaalsContact OG-N 3.12Å; S137-M141 WeakPolarHBondContact O-CB 3.39Å; S137-M141 PolarHBondContact O-N 3.41Å; S137-D233 VanDerWaalsContact CB-O 3.28Å; S137-D233 WeakPolarHBondContact CB-O 3.41Å; S137-V235 CarbonylContact C-O 3.57Å; S137-V235 WeakPolarHBondContact CA-O 3.44Å
138	V	92.5	Very high	91.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-37.7	176.8	171.4	0	0	0	0	111.3	M141 W142 M227 L232 V235 I240 M263 L267	V138-M141 HydrophobicContact CG1-CE 4.23Å; V138-M141 WeakPolarHBondContact O-CB 3.38Å; V138-M141 PolarHBondContact O-N 3.47Å; V138-W142 PolarHBondContact O-N 2.7Å; V138-M227 HydrophobicContact CG1-CE 4.26Å; V138-L232 HydrophobicContact CG1-CD2 4.35Å; V138-V235 HydrophobicContact CG2-CG2 4.49Å; V138-V235 PolarHBondContact N-O 3.47Å; V138-I240 HydrophobicContact CB-CD1 4.35Å; V138-I240 HydrophobicContact CG1-CD1 4.39Å; V138-I240 HydrophobicContact CG2-CD1 3.67Å; V138-I240 HydrophobicContact CG2-CG1 4.3Å; V138-M263 HydrophobicContact CG2-SD 4.46Å; V138-L267 HydrophobicContact CG1-CD1 3.6Å; V138-L267 HydrophobicContact CG1-CD2 4.25Å; V138-L267 HydrophobicContact CG1-CG 4.31Å
139	Q	90	Very high	91.6	Very high	58 Å²	58	28 Å²	28	27%	0.271	14%	0.138	S	C	.	.	H	α-helix	trans	-69.3	-37.4	175.9	-168.3	69.7	-48	0	0	112.7	S137 M141 S143 L232 D233	S137-Q139 VanDerWaalsContact C-N 3.3Å; S137-Q139 PolarHBondContact O-N 2.85Å; Q139-M141 VanDerWaalsContact C-N 3.35Å; Q139-S143 WeakPolarHBondContact O-CB 3.37Å; Q139-S143 PolarHBondContact O-N 2.92Å; Q139-S143 PolarHBondContact O-OG 2.98Å; Q139-L232 HydrophobicContact CB-CB 4.35Å; Q139-L232 WeakPolarHBondContact CB-O 3.48Å; Q139-L232 PolarHBondContact N-O 2.74Å; Q139-L232 VanDerWaalsContact N-O 3.17Å; Q139-D233 WeakPolarHBondContact CB-OD1 3.48Å; Q139-D233 WeakPolarHBondContact CG-OD1 3.29Å
140	A	91.5	Very high	91.9	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-64.3	-41.4	172.3	0	0	0	0	0	111.2	V60 P135 I136 S137 S143 V144	V60-A140 HydrophobicContact CG1-CB 3.65Å; P135-A140 HydrophobicContact CB-CB 3.85Å; I136-A140 HydrophobicContact CG1-CB 4.48Å; S137-A140 WeakPolarHBondContact O-CB 3.23Å; S137-A140 PolarHBondContact O-N 3.36Å; S137-A140 VanDerWaalsContact OG-CB 3.26Å; S137-A140 WeakPolarHBondContact OG-CB 3.27Å; S137-A140 PolarHBondContact OG-N 3.24Å; S137-A140 VanDerWaalsContact OG-N 3.12Å; A140-S143 PolarHBondContact O-N 3.29Å; A140-V144 WeakPolarHBondContact O-CG2 3.37Å; A140-V144 PolarHBondContact O-N 3.24Å
141	M	92.9	Very high	92.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-59.4	-51.5	174.7	179.3	-164.8	67.2	0	0	111.8	L116 G120 I122 P135 S137 V138 Q139 S143 V144 Y145 L264	L116-M141 HydrophobicContact CD2-CG 4.49Å; L116-M141 HydrophobicContact CD2-SD 4.28Å; G120-M141 WeakPolarHBondContact CA-SD 3.06Å; I122-M141 HydrophobicContact CD1-CG 4.25Å; I122-M141 HydrophobicContact CG1-CG 4.3Å; P135-M141 HydrophobicContact CB-CB 4.12Å; P135-M141 HydrophobicContact CG-CB 4.2Å; S137-M141 WeakPolarHBondContact O-CB 3.39Å; S137-M141 PolarHBondContact O-N 3.41Å; V138-M141 HydrophobicContact CG1-CE 4.23Å; V138-M141 WeakPolarHBondContact O-CB 3.38Å; V138-M141 PolarHBondContact O-N 3.47Å; Q139-M141 VanDerWaalsContact C-N 3.35Å; M141-S143 VanDerWaalsContact C-N 3.3Å; M141-S143 PolarHBondContact O-N 3.37Å; M141-V144 PolarHBondContact O-N 3.09Å; M141-Y145 VanDerWaalsContact O-CB 3.29Å; M141-Y145 WeakPolarHBondContact O-CB 3.47Å; M141-Y145 PolarHBondContact O-N 3.02Å; M141-L264 HydrophobicContact CE-CD2 4.08Å
142	W	91.2	Very high	92.2	Very high	15 Å²	15	30.5 Å²	30.5	6%	0.057	14%	0.144	C	C	.	.	H	α-helix	trans	-52.3	-49.9	175.8	174.5	-123.4	0	0	0	112	V138 V144 Y145 Q146 L264 L267 W286	V138-W142 PolarHBondContact O-N 2.7Å; W142-V144 PolarHBondContact O-N 3.16Å; W142-Y145 PolarHBondContact O-N 2.81Å; W142-Q146 HydrophobicContact CD2-CG 3.79Å; W142-Q146 HydrophobicContact CE3-CG 3.9Å; W142-Q146 HydrophobicContact CH2-CG 3.89Å; W142-Q146 HydrophobicContact CZ2-CG 3.79Å; W142-Q146 HydrophobicContact CZ3-CG 3.93Å; W142-Q146 VanDerWaalsContact NE1-OE1 3.11Å; W142-Q146 WeakPolarHBondContact O-CG 3.47Å; W142-Q146 PolarHBondContact O-N 3.3Å; W142-L264 HydrophobicContact CE3-CB 4.42Å; W142-L264 HydrophobicContact CE3-CD2 3.61Å; W142-L264 HydrophobicContact CZ3-CB 4.12Å; W142-L264 HydrophobicContact CZ3-CD2 4.07Å; W142-L267 HydrophobicContact CB-CD1 3.74Å; W142-L267 HydrophobicContact CD2-CB 4Å; W142-L267 HydrophobicContact CD2-CD1 4.4Å; W142-L267 HydrophobicContact CE3-CB 4.21Å; W142-L267 HydrophobicContact CE3-CD1 4.44Å; W142-L267 HydrophobicContact CG-CB 4.24Å; W142-L267 HydrophobicContact CG-CD1 4.16Å; W142-W286 AromaticContact CH2-CE2 3.96Å; W142-W286 HydrophobicContact CH2-CZ2 4.05Å; W142-W286 AromaticContact CH2-NE1 3.95Å; W142-W286 HydrophobicContact CZ3-CZ2 4.43Å
143	S	90.9	Very high	92.1	Very high	17 Å²	17	31 Å²	31	12%	0.119	16%	0.156	C	C	.	.	H	α-helix	trans	-57.5	-52.8	-179.5	-58.5	0	0	0	0	111.1	M58 Q139 A140 M141 Y145 Q146 A147	M58-S143 VanDerWaalsContact CE-C 3.42Å; M58-S143 WeakPolarHBondContact CE-O 3.33Å; Q139-S143 WeakPolarHBondContact O-CB 3.37Å; Q139-S143 PolarHBondContact O-N 2.92Å; Q139-S143 PolarHBondContact O-OG 2.98Å; A140-S143 PolarHBondContact O-N 3.29Å; M141-S143 VanDerWaalsContact C-N 3.3Å; M141-S143 PolarHBondContact O-N 3.37Å; S143-Y145 VanDerWaalsContact C-N 3.33Å; S143-Y145 PolarHBondContact O-N 3.33Å; S143-Q146 PolarHBondContact O-N 3.12Å; S143-A147 WeakPolarHBondContact O-CB 3.35Å; S143-A147 PolarHBondContact O-N 3.02Å
144	V	92.9	Very high	92	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-60.1	-45.1	178.7	177.6	0	0	0	0	111.1	M58 V60 V73 I122 P135 A140 M141 W142 A147 L148	M58-V144 HydrophobicContact SD-CB 4.45Å; M58-V144 HydrophobicContact SD-CG2 4.14Å; V60-V144 HydrophobicContact CB-CG2 3.47Å; V60-V144 VanDerWaalsContact CB-CG2 3.47Å; V60-V144 HydrophobicContact CG1-CG2 3.62Å; V60-V144 HydrophobicContact CG2-CG2 3.53Å; V73-V144 HydrophobicContact CG1-CG1 4.29Å; V73-V144 HydrophobicContact CG1-CG2 3.85Å; I122-V144 HydrophobicContact CD1-CB 3.62Å; I122-V144 HydrophobicContact CD1-CG1 3.49Å; I122-V144 VanDerWaalsContact CD1-CG1 3.49Å; P135-V144 HydrophobicContact CG-CB 4.47Å; P135-V144 HydrophobicContact CG-CG2 4.25Å; A140-V144 WeakPolarHBondContact O-CG2 3.37Å; A140-V144 PolarHBondContact O-N 3.24Å; M141-V144 PolarHBondContact O-N 3.09Å; W142-V144 PolarHBondContact O-N 3.16Å; V144-A147 PolarHBondContact O-N 2.78Å; V144-L148 HydrophobicContact CG1-CD1 3.63Å; V144-L148 HydrophobicContact CG1-CG 4.08Å; V144-L148 WeakPolarHBondContact O-CB 3.45Å; V144-L148 VanDerWaalsContact O-CG 3.25Å; V144-L148 WeakPolarHBondContact O-CG 3.45Å; V144-L148 PolarHBondContact O-N 3.38Å
145	Y	92.3	Very high	92	Very high	53 Å²	53	30.3 Å²	30.3	21%	0.208	16%	0.156	C	C	.	.	H	α-helix	trans	-59.5	-51.2	-178.7	-170.8	-95.3	0	0	0	111.5	I114 L116 M141 W142 S143 A147 L148 H149 L264	I114-Y145 HydrophobicContact CG2-CD2 4.29Å; I114-Y145 HydrophobicContact CG2-CE2 4.17Å; L116-Y145 HydrophobicContact CD2-CD2 3.82Å; L116-Y145 HydrophobicContact CD2-CE2 4.08Å; L116-Y145 HydrophobicContact CG-CD2 4.24Å; L116-Y145 HydrophobicContact CG-CE2 4.02Å; M141-Y145 VanDerWaalsContact O-CB 3.29Å; M141-Y145 WeakPolarHBondContact O-CB 3.47Å; M141-Y145 PolarHBondContact O-N 3.02Å; W142-Y145 PolarHBondContact O-N 2.81Å; S143-Y145 VanDerWaalsContact C-N 3.33Å; S143-Y145 PolarHBondContact O-N 3.33Å; Y145-A147 PolarHBondContact O-N 3.11Å; Y145-L148 PolarHBondContact O-N 2.77Å; Y145-H149 AromaticContact CD1-CD2 3.71Å; Y145-H149 AromaticContact CE1-CD2 3.38Å; Y145-H149 WeakPolarHBondContact CE1-CD2 3.47Å; Y145-H149 AromaticContact CE1-NE2 3.58Å; Y145-H149 AromaticContact CE2-CD2 3.73Å; Y145-H149 AromaticContact CE2-NE2 3.39Å; Y145-H149 WeakPolarHBondContact CE2-NE2 3.5Å; Y145-H149 AromaticContact CZ-CD2 3.4Å; Y145-H149 AromaticContact CZ-NE2 3.07Å; Y145-H149 PolarHBondContact O-CD2 2.74Å; Y145-H149 VanDerWaalsContact O-CD2 3.29Å; Y145-H149 PolarHBondContact O-N 3.1Å; Y145-H149 PolarHBondContact OH-NE2 3.33Å; Y145-H149 VanDerWaalsContact OH-NE2 3.12Å; Y145-L264 HydrophobicContact CD1-CD1 3.76Å; Y145-L264 HydrophobicContact CD1-CD2 4.13Å; Y145-L264 HydrophobicContact CD2-CD1 4.38Å; Y145-L264 HydrophobicContact CE1-CD1 3.46Å; Y145-L264 VanDerWaalsContact CE1-CD1 3.46Å; Y145-L264 HydrophobicContact CE2-CD1 4.14Å; Y145-L264 HydrophobicContact CG-CD1 4.21Å; Y145-L264 HydrophobicContact CG-CD2 4.27Å
146	Q	90	Very high	91.9	Very high	86 Å²	86	37.2 Å²	37.2	40%	0.402	18%	0.181	S	C	.	.	H	α-helix	trans	-60.2	-45.6	177.5	-71.6	-169.8	-55.9	0	0	112.3	W142 S143 L148 H149 K150	W142-Q146 HydrophobicContact CD2-CG 3.79Å; W142-Q146 HydrophobicContact CE3-CG 3.9Å; W142-Q146 HydrophobicContact CH2-CG 3.89Å; W142-Q146 HydrophobicContact CZ2-CG 3.79Å; W142-Q146 HydrophobicContact CZ3-CG 3.93Å; W142-Q146 VanDerWaalsContact NE1-OE1 3.11Å; W142-Q146 WeakPolarHBondContact O-CG 3.47Å; W142-Q146 PolarHBondContact O-N 3.3Å; S143-Q146 PolarHBondContact O-N 3.12Å; Q146-L148 PolarHBondContact O-N 2.73Å; Q146-H149 PolarHBondContact O-N 3.43Å; Q146-K150 WeakPolarHBondContact O-CB 3.32Å; Q146-K150 PolarHBondContact O-N 3.22Å
147	A	92.3	Very high	91.7	Very high	19 Å²	19	38.8 Å²	38.8	16%	0.157	20%	0.197	C	C	.	.	H	α-helix	trans	-66.7	-39.4	-176.9	0	0	0	0	0	111.9	M58 I75 S143 V144 Y145 K150 V151	M58-A147 HydrophobicContact CE-CB 3.57Å; M58-A147 HydrophobicContact SD-CB 3.4Å; M58-A147 WeakPolarHBondContact SD-CB 3.23Å; I75-A147 HydrophobicContact CD1-CB 3.46Å; I75-A147 VanDerWaalsContact CD1-CB 3.46Å; S143-A147 WeakPolarHBondContact O-CB 3.35Å; S143-A147 PolarHBondContact O-N 3.02Å; V144-A147 PolarHBondContact O-N 2.78Å; Y145-A147 PolarHBondContact O-N 3.11Å; A147-K150 PolarHBondContact O-N 2.89Å; A147-V151 WeakPolarHBondContact O-CG2 3.27Å; A147-V151 PolarHBondContact O-N 2.9Å; A147-V151 VanDerWaalsContact O-N 3.09Å
148	L	94.5	Very high	91.6	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-63.4	-46.5	173.9	-73.1	174.7	0	0	0	111.6	I75 V89 I114 I122 I124 V144 Y145 Q146 K150 V151 N152	I75-L148 HydrophobicContact CD1-CD2 3.92Å; I75-L148 HydrophobicContact CD1-CG 4.14Å; I75-L148 HydrophobicContact CG1-CD2 4.32Å; V89-L148 HydrophobicContact CG2-CD2 3.49Å; V89-L148 VanDerWaalsContact CG2-CD2 3.49Å; I114-L148 HydrophobicContact CD1-CB 3.74Å; I114-L148 HydrophobicContact CG1-CB 4.43Å; I114-L148 HydrophobicContact CG2-CB 4.47Å; I114-L148 HydrophobicContact CG2-CD1 4.38Å; I122-L148 HydrophobicContact CG2-CD1 3.87Å; I124-L148 HydrophobicContact CD1-CD1 3.76Å; I124-L148 HydrophobicContact CD1-CD2 4.1Å; I124-L148 HydrophobicContact CG1-CD1 4.19Å; V144-L148 HydrophobicContact CG1-CD1 3.63Å; V144-L148 HydrophobicContact CG1-CG 4.08Å; V144-L148 WeakPolarHBondContact O-CB 3.45Å; V144-L148 VanDerWaalsContact O-CG 3.25Å; V144-L148 WeakPolarHBondContact O-CG 3.45Å; V144-L148 PolarHBondContact O-N 3.38Å; Y145-L148 PolarHBondContact O-N 2.77Å; Q146-L148 PolarHBondContact O-N 2.73Å; L148-K150 VanDerWaalsContact C-N 3.3Å; L148-K150 PolarHBondContact O-N 2.88Å; L148-V151 VanDerWaalsContact O-CG2 3.27Å; L148-V151 WeakPolarHBondContact O-CG2 3.35Å; L148-V151 PolarHBondContact O-N 3.16Å; L148-N152 VanDerWaalsContact O-CB 3.23Å; L148-N152 WeakPolarHBondContact O-CB 3.27Å; L148-N152 PolarHBondContact O-N 3.35Å
149	H	91.7	Very high	91.3	Very high	68 Å²	68	47.2 Å²	47.2	32%	0.315	24%	0.239	S	C	.	.	H	α-helix	trans	-62.5	-37.6	177	-87.7	-78.8	0	0	0	112.3	Y145 Q146 N152 A153	Y145-H149 AromaticContact CD1-CD2 3.71Å; Y145-H149 AromaticContact CE1-CD2 3.38Å; Y145-H149 WeakPolarHBondContact CE1-CD2 3.47Å; Y145-H149 AromaticContact CE1-NE2 3.58Å; Y145-H149 AromaticContact CE2-CD2 3.73Å; Y145-H149 AromaticContact CE2-NE2 3.39Å; Y145-H149 WeakPolarHBondContact CE2-NE2 3.5Å; Y145-H149 AromaticContact CZ-CD2 3.4Å; Y145-H149 AromaticContact CZ-NE2 3.07Å; Y145-H149 PolarHBondContact O-CD2 2.74Å; Y145-H149 VanDerWaalsContact O-CD2 3.29Å; Y145-H149 PolarHBondContact O-N 3.1Å; Y145-H149 PolarHBondContact OH-NE2 3.33Å; Y145-H149 VanDerWaalsContact OH-NE2 3.12Å; Q146-H149 PolarHBondContact O-N 3.43Å; H149-N152 PolarHBondContact O-N 3.41Å; H149-A153 WeakPolarHBondContact O-CB 3.49Å; H149-A153 PolarHBondContact O-N 2.99Å
150	K	91.3	Very high	91.3	Very high	156 Å²	156	44.8 Å²	44.8	68%	0.678	23%	0.228	S	C	*	.	H	α-helix	trans	-61.3	-49.9	175.1	-175.8	172.6	-175.5	166.9	0	112	Q146 A147 L148 N152 A153 V154	Q146-K150 WeakPolarHBondContact O-CB 3.32Å; Q146-K150 PolarHBondContact O-N 3.22Å; A147-K150 PolarHBondContact O-N 2.89Å; L148-K150 VanDerWaalsContact C-N 3.3Å; L148-K150 PolarHBondContact O-N 2.88Å; K150-N152 VanDerWaalsContact C-N 3.33Å; K150-N152 PolarHBondContact O-N 3.42Å; K150-A153 PolarHBondContact O-N 3.46Å; K150-V154 PolarHBondContact O-N 3.02Å
151	V	93.4	Very high	91.3	Very high	11 Å²	11	50.6 Å²	50.6	7%	0.067	25%	0.25	C	S	.	.	H	α-helix	trans	-70.8	-30.5	179.4	-62.4	0	0	0	0	112.7	I75 V108 A147 L148 V154 A155	I75-V151 HydrophobicContact CG2-CG1 3.91Å; I75-V151 HydrophobicContact CG2-CG2 4.45Å; V108-V151 HydrophobicContact CG1-CG2 4.2Å; V108-V151 HydrophobicContact CG2-CG2 4.05Å; A147-V151 WeakPolarHBondContact O-CG2 3.27Å; A147-V151 PolarHBondContact O-N 2.9Å; A147-V151 VanDerWaalsContact O-N 3.09Å; L148-V151 VanDerWaalsContact O-CG2 3.27Å; L148-V151 WeakPolarHBondContact O-CG2 3.35Å; L148-V151 PolarHBondContact O-N 3.16Å; V151-V154 PolarHBondContact O-N 3.41Å; V151-A155 PolarHBondContact O-N 2.76Å
152	N	93.4	Very high	91.1	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.011	27%	0.268	C	S	.	.	H	α-helix	trans	-66.8	-40.8	173.4	-170.1	-69.7	0	0	0	111.9	V108 T112 I114 L148 H149 K150 V154 A155 R156	V108-N152 HydrophobicContact CG1-CB 4.24Å; T112-N152 PolarHBondContact O-ND2 3.41Å; I114-N152 HydrophobicContact CD1-CB 3.8Å; L148-N152 VanDerWaalsContact O-CB 3.23Å; L148-N152 WeakPolarHBondContact O-CB 3.27Å; L148-N152 PolarHBondContact O-N 3.35Å; H149-N152 PolarHBondContact O-N 3.41Å; K150-N152 VanDerWaalsContact C-N 3.33Å; K150-N152 PolarHBondContact O-N 3.42Å; N152-V154 VanDerWaalsContact C-N 3.29Å; N152-V154 PolarHBondContact O-N 3.12Å; N152-A155 CarbonylContact O-C 3.52Å; N152-A155 PolarHBondContact O-N 3.29Å; N152-A155 VanDerWaalsContact O-N 3.11Å; N152-R156 WeakPolarHBondContact O-CG 3.37Å; N152-R156 PolarHBondContact O-N 2.9Å; N152-R156 WeakPolarHBondContact OD1-CD 3.47Å; N152-R156 PolarHBondContact OD1-NE 2.78Å
153	A	90.1	Very high	90.8	Very high	52 Å²	52	56.7 Å²	56.7	43%	0.43	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-39.6	175	0	0	0	0	0	112	H149 K150 R156 S157	H149-A153 WeakPolarHBondContact O-CB 3.49Å; H149-A153 PolarHBondContact O-N 2.99Å; K150-A153 PolarHBondContact O-N 3.46Å; A153-R156 PolarHBondContact O-N 2.82Å; A153-S157 WeakPolarHBondContact O-CB 3.27Å; A153-S157 PolarHBondContact O-N 2.87Å; A153-S157 PolarHBondContact O-OG 3.4Å
154	V	90.8	Very high	90.5	Very high	34 Å²	34	57.8 Å²	57.8	21%	0.206	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-47.4	172.2	177.6	0	0	0	0	110.8	Q85 K150 V151 N152 R156 S157 Y158	Q85-V154 HydrophobicContact CB-CG1 4.31Å; K150-V154 PolarHBondContact O-N 3.02Å; V151-V154 PolarHBondContact O-N 3.41Å; N152-V154 VanDerWaalsContact C-N 3.29Å; N152-V154 PolarHBondContact O-N 3.12Å; V154-R156 PolarHBondContact O-N 3.15Å; V154-S157 PolarHBondContact O-N 3.09Å; V154-S157 VanDerWaalsContact O-N 3.12Å; V154-Y158 HydrophobicContact CG1-CD2 4Å; V154-Y158 HydrophobicContact CG1-CE2 4.39Å; V154-Y158 PolarHBondContact O-N 2.89Å
155	A	92.6	Very high	90.2	Very high	2 Å²	2	67.9 Å²	67.9	2%	0.017	36%	0.36	C	S	.	.	H	α-helix	trans	-63.6	-24.1	178.5	0	0	0	0	0	113.9	V108 A110 V151 N152 Y158 P159 Y160	V108-A155 HydrophobicContact CG1-CB 4.24Å; A110-A155 VanDerWaalsContact CB-O 3.31Å; A110-A155 WeakPolarHBondContact CB-O 3.47Å; V151-A155 PolarHBondContact O-N 2.76Å; N152-A155 CarbonylContact O-C 3.52Å; N152-A155 PolarHBondContact O-N 3.29Å; N152-A155 VanDerWaalsContact O-N 3.11Å; A155-Y158 CarbonylContact C-O 3.45Å; A155-Y158 CarbonylContact O-C 3.58Å; A155-P159 WeakPolarHBondContact O-CA 3.38Å; A155-Y160 HydrophobicContact CB-CD2 3.73Å; A155-Y160 HydrophobicContact CB-CE2 4.39Å; A155-Y160 PolarHBondContact O-N 3.36Å; A155-Y160 VanDerWaalsContact O-N 3.16Å
156	R	90.9	Very high	90.2	Very high	150 Å²	150	66 Å²	66	57%	0.566	35%	0.354	S	S	*	.	H	α-helix	trans	-82.1	-35.7	172.4	-73.3	179.6	176	172.3	7.2	112.9	A110 N152 A153 V154 Y158	A110-R156 HydrophobicContact CB-CG 4.37Å; A110-R156 PolarHBondContact O-NE 3.17Å; N152-R156 WeakPolarHBondContact O-CG 3.37Å; N152-R156 PolarHBondContact O-N 2.9Å; N152-R156 WeakPolarHBondContact OD1-CD 3.47Å; N152-R156 PolarHBondContact OD1-NE 2.78Å; A153-R156 PolarHBondContact O-N 2.82Å; V154-R156 PolarHBondContact O-N 3.15Å; R156-Y158 VanDerWaalsContact C-N 3.35Å
157	S	88.7	Confident	90.4	Very high	85 Å²	85	62.4 Å²	62.4	59%	0.594	34%	0.337	S	S	*	.	H	α-helix	trans	-68.3	-38.7	177.8	-56.7	0	0	0	0	111.2	A153 V154 P159	A153-S157 WeakPolarHBondContact O-CB 3.27Å; A153-S157 PolarHBondContact O-N 2.87Å; A153-S157 PolarHBondContact O-OG 3.4Å; V154-S157 PolarHBondContact O-N 3.09Å; V154-S157 VanDerWaalsContact O-N 3.12Å; S157-P159 WeakPolarHBondContact O-CD 3.4Å
158	Y	89.3	Confident	90.4	Very high	101 Å²	101	64.8 Å²	64.8	40%	0.396	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	90.1	169.6	-56.2	-76	0	0	0	107.3	N84 V154 A155 R156 Y160	N84-Y158 HydrophobicContact CB-CD1 4.42Å; N84-Y158 HydrophobicContact CB-CD2 4.35Å; N84-Y158 HydrophobicContact CB-CG 4.24Å; N84-Y158 WeakPolarHBondContact ND2-CD1 3.47Å; N84-Y158 WeakPolarHBondContact OD1-CE1 3.4Å; V154-Y158 HydrophobicContact CG1-CD2 4Å; V154-Y158 HydrophobicContact CG1-CE2 4.39Å; V154-Y158 PolarHBondContact O-N 2.89Å; A155-Y158 CarbonylContact C-O 3.45Å; A155-Y158 CarbonylContact O-C 3.58Å; R156-Y158 VanDerWaalsContact C-N 3.35Å; Y158-Y160 VanDerWaalsContact C-N 3.32Å; Y158-Y160 VanDerWaalsContact CB-CE1 3.49Å; Y158-Y160 WeakPolarHBondContact O-CD1 3.46Å; Y158-Y160 WeakPolarHBondContact O-CE1 3.4Å; Y158-Y160 PolarHBondContact O-N 2.99Å
159	P	86	Confident	90.3	Very high	77 Å²	77	65.3 Å²	65.3	50%	0.5	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	89.9	-162.2	25.8	-35.8	0	0	0	111.7	A155 S157 Y161	A155-P159 WeakPolarHBondContact O-CA 3.38Å; S157-P159 WeakPolarHBondContact O-CD 3.4Å; P159-Y161 HydrophobicContact CB-CE2 3.66Å; P159-Y161 HydrophobicContact CG-CE2 4.5Å; P159-Y161 WeakPolarHBondContact O-CD2 3.31Å; P159-Y161 WeakPolarHBondContact O-CE2 3.21Å
160	Y	90.5	Very high	90.4	Very high	8 Å²	8	62.3 Å²	62.3	3%	0.031	34%	0.338	C	S	.	.			trans	-83.4	125.5	-178.7	-58.8	-33.9	0	0	0	109.2	N84 Q85 E86 A110 A155 Y158 T166 H167	N84-Y160 WeakPolarHBondContact CB-OH 3.39Å; Q85-Y160 VanDerWaalsContact O-CE2 3.29Å; Q85-Y160 WeakPolarHBondContact O-CE2 3.28Å; Q85-Y160 PolarHBondContact O-OH 2.91Å; E86-Y160 HydrophobicContact CG-CE2 4.26Å; A110-Y160 PolarHBondContact N-O 3.49Å; A155-Y160 HydrophobicContact CB-CD2 3.73Å; A155-Y160 HydrophobicContact CB-CE2 4.39Å; A155-Y160 PolarHBondContact O-N 3.36Å; A155-Y160 VanDerWaalsContact O-N 3.16Å; Y158-Y160 VanDerWaalsContact C-N 3.32Å; Y158-Y160 VanDerWaalsContact CB-CE1 3.49Å; Y158-Y160 WeakPolarHBondContact O-CD1 3.46Å; Y158-Y160 WeakPolarHBondContact O-CE1 3.4Å; Y158-Y160 PolarHBondContact O-N 2.99Å; Y160-T166 HydrophobicContact CD1-CG2 3.58Å; Y160-T166 HydrophobicContact CE1-CG2 3.73Å; Y160-H167 AromaticContact CD2-CE1 3.55Å; Y160-H167 AromaticContact CG-CE1 3.93Å
161	Y	90.7	Very high	90.5	Very high	122 Å²	122	60.7 Å²	60.7	48%	0.478	33%	0.333	S	S	.	.			trans	-124.7	149.4	179.1	-60.4	-71.4	0	0	0	111.1	A110 T111 P159 G163 G164	A110-Y161 HydrophobicContact CB-CE1 4.1Å; T111-Y161 HydrophobicContact CG2-CD1 4.22Å; T111-Y161 HydrophobicContact CG2-CE1 4.06Å; P159-Y161 HydrophobicContact CB-CE2 3.66Å; P159-Y161 HydrophobicContact CG-CE2 4.5Å; P159-Y161 WeakPolarHBondContact O-CD2 3.31Å; P159-Y161 WeakPolarHBondContact O-CE2 3.21Å; Y161-G163 PolarHBondContact O-N 3.42Å; Y161-G164 PolarHBondContact O-N 3.34Å; Y161-G164 VanDerWaalsContact O-N 3.12Å
162	P	89.4	Confident	90.6	Very high	57 Å²	57	62.8 Å²	62.8	37%	0.37	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	138.2	170.6	-23.8	32.2	0	0	0	111.9	W109 G164	W109-P162 HydrophobicContact CD2-CG 4.05Å; W109-P162 HydrophobicContact CG-CG 4.1Å; W109-P162 HydrophobicContact CZ2-CB 4.43Å; W109-P162 HydrophobicContact CZ2-CG 4.4Å; P162-G164 PolarHBondContact O-N 3.02Å
163	G	84.7	Confident	90.8	Very high	88 Å²	88	62.8 Å²	62.8	91%	0.907	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	2.2	-178.8	0	0	0	0	0	115.2	Y161	Y161-G163 PolarHBondContact O-N 3.42Å
164	G	85.1	Confident	91	Very high	40 Å²	40	64 Å²	64	41%	0.412	34%	0.337	S	S	.	.	S	Bend	trans	-73.1	-169.7	172.2	0	0	0	0	0	114	Y161 P162 T166	Y161-G164 PolarHBondContact O-N 3.34Å; Y161-G164 VanDerWaalsContact O-N 3.12Å; P162-G164 PolarHBondContact O-N 3.02Å; G164-T166 VanDerWaalsContact C-N 3.31Å
165	W	86.9	Confident	91.2	Very high	212 Å²	212	66.3 Å²	66.3	80%	0.803	36%	0.355	S	S	*	.	S	Bend	trans	-89.3	3.3	-179	-58.4	78.5	0	0	0	113.7
166	T	92.2	Very high	91.3	Very high	15 Å²	15	71.4 Å²	71.4	9%	0.092	37%	0.374	C	S	.	.	S	Bend	trans	-102.5	169	-177.8	67.1	0	0	0	0	110.2	E86 Y160 G164 T168	E86-T166 VanDerWaalsContact OE1-CA 3.29Å; E86-T166 WeakPolarHBondContact OE1-CA 3.37Å; E86-T166 WeakPolarHBondContact OE1-CB 2.88Å; Y160-T166 HydrophobicContact CD1-CG2 3.58Å; Y160-T166 HydrophobicContact CE1-CG2 3.73Å; G164-T166 VanDerWaalsContact C-N 3.31Å; T166-T168 PolarHBondContact O-N 3.47Å
167	H	93.3	Very high	91.5	Very high	9 Å²	9	67.7 Å²	67.7	4%	0.042	36%	0.364	C	S	.	.			trans	59.7	20.8	177.9	-65.4	87.5	0	0	0	113.8	E86 S87 W109 Y160 W169 V170	E86-H167 PolarHBondContact OE1-N 3.44Å; E86-H167 VanDerWaalsContact OE2-CA 3.28Å; E86-H167 WeakPolarHBondContact OE2-CA 3.29Å; E86-H167 PolarHBondContact OE2-N 3.46Å; S87-H167 PolarHBondContact N-NE2 2.91Å; S87-H167 PolarHBondContact O-NE2 3.09Å; W109-H167 HydrophobicContact CH2-CB 3.83Å; W109-H167 AromaticContact CH2-CG 3.96Å; W109-H167 HydrophobicContact CZ3-CB 4.05Å; W109-H167 AromaticContact CZ3-CE1 3.96Å; W109-H167 AromaticContact CZ3-CG 3.76Å; W109-H167 AromaticContact CZ3-ND1 3.33Å; W109-H167 VanDerWaalsContact CZ3-ND1 3.33Å; W109-H167 WeakPolarHBondContact CZ3-ND1 3.47Å; Y160-H167 AromaticContact CD2-CE1 3.55Å; Y160-H167 AromaticContact CG-CE1 3.93Å; H167-W169 PolarHBondContact O-N 3.17Å; H167-V170 HydrophobicContact CB-CG2 3.66Å; H167-V170 VanDerWaalsContact O-CB 3.26Å; H167-V170 WeakPolarHBondContact O-CB 3.24Å; H167-V170 WeakPolarHBondContact O-CG2 3.34Å; H167-V170 PolarHBondContact O-N 3.06Å
168	T	91.9	Very high	91.7	Very high	70 Å²	70	67.2 Å²	67.2	43%	0.429	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.4	-179.8	59.1	0	0	0	0	114.1	T166	T166-T168 PolarHBondContact O-N 3.47Å
169	W	93.5	Very high	91.9	Very high	12 Å²	12	62.6 Å²	62.6	5%	0.045	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-12.3	177.9	55.5	-87	0	0	0	113.8	V76 A78 E86 I88 H167 Q171 Y172 Y173	V76-W169 HydrophobicContact CG1-CH2 4.42Å; V76-W169 HydrophobicContact CG1-CZ3 4.38Å; A78-W169 HydrophobicContact CB-CD2 4.06Å; A78-W169 HydrophobicContact CB-CH2 4.18Å; A78-W169 HydrophobicContact CB-CZ2 3.71Å; E86-W169 HydrophobicContact CB-CZ2 4.14Å; E86-W169 VanDerWaalsContact OE2-CD1 3.23Å; E86-W169 PolarHBondContact OE2-NE1 2.88Å; I88-W169 HydrophobicContact CB-CH2 4.21Å; I88-W169 HydrophobicContact CD1-CE3 4.37Å; I88-W169 HydrophobicContact CD1-CH2 3.86Å; I88-W169 HydrophobicContact CD1-CZ3 3.42Å; I88-W169 VanDerWaalsContact CD1-CZ3 3.42Å; I88-W169 HydrophobicContact CG1-CH2 3.65Å; I88-W169 HydrophobicContact CG1-CZ3 3.78Å; I88-W169 HydrophobicContact CG2-CH2 3.74Å; I88-W169 HydrophobicContact CG2-CZ2 4.14Å; I88-W169 HydrophobicContact CG2-CZ3 4.16Å; H167-W169 PolarHBondContact O-N 3.17Å; W169-Q171 PolarHBondContact O-N 3.5Å; W169-Y172 WeakPolarHBondContact O-CB 3.32Å; W169-Y172 PolarHBondContact O-N 3.23Å; W169-Y173 AromaticContact CE3-CD2 3.75Å; W169-Y173 HydrophobicContact CE3-CD2 3.75Å; W169-Y173 AromaticContact CE3-CE2 3.48Å; W169-Y173 HydrophobicContact CE3-CE2 3.48Å; W169-Y173 VanDerWaalsContact CE3-CE2 3.48Å; W169-Y173 AromaticContact CZ3-CD2 3.74Å; W169-Y173 HydrophobicContact CZ3-CD2 3.74Å; W169-Y173 AromaticContact CZ3-CE2 3.38Å; W169-Y173 HydrophobicContact CZ3-CE2 3.38Å
170	V	94	Very high	92.1	Very high	5 Å²	5	62 Å²	62	3%	0.03	34%	0.34	C	S	.	.	H	α-helix	trans	-59.3	-34.9	-177.8	171	0	0	0	0	112	I88 V105 P107 H167 Y172 Y173 E174	I88-V170 HydrophobicContact CG2-CG2 3.42Å; I88-V170 VanDerWaalsContact CG2-CG2 3.42Å; V105-V170 HydrophobicContact CG1-CG1 3.87Å; P107-V170 HydrophobicContact CG-CB 4.45Å; P107-V170 HydrophobicContact CG-CG1 3.72Å; P107-V170 HydrophobicContact CG-CG2 4.12Å; H167-V170 HydrophobicContact CB-CG2 3.66Å; H167-V170 VanDerWaalsContact O-CB 3.26Å; H167-V170 WeakPolarHBondContact O-CB 3.24Å; H167-V170 WeakPolarHBondContact O-CG2 3.34Å; H167-V170 PolarHBondContact O-N 3.06Å; V170-Y172 PolarHBondContact O-N 3.09Å; V170-Y173 WeakPolarHBondContact O-CA 3.28Å; V170-Y173 PolarHBondContact O-N 2.85Å; V170-E174 HydrophobicContact CG1-CG 3.82Å; V170-E174 PolarHBondContact O-N 3.36Å
171	Q	93.4	Very high	91.9	Very high	122 Å²	122	67.8 Å²	67.8	57%	0.57	37%	0.367	S	S	*	.	H	α-helix	trans	-53.1	-30.4	176.4	-171.4	64.7	59.5	0	0	113	W169 Y173 S175	W169-Q171 PolarHBondContact O-N 3.5Å; Q171-Y173 VanDerWaalsContact C-N 3.32Å; Q171-Y173 PolarHBondContact O-N 2.84Å; Q171-S175 WeakPolarHBondContact O-CB 3.49Å; Q171-S175 PolarHBondContact O-N 3.02Å; Q171-S175 PolarHBondContact O-OG 3.15Å
172	Y	95.8	Very high	91.8	Very high	56 Å²	56	64.7 Å²	64.7	22%	0.22	36%	0.361	C	S	.	.	H	α-helix	trans	-58.9	-44.5	173.8	171.7	-88.7	0	0	0	111.7	L49 R51 W169 V170 S175 R176	L49-Y172 WeakPolarHBondContact O-CE1 3.26Å; L49-Y172 PolarHBondContact O-OH 3.35Å; R51-Y172 HydrophobicContact CB-CE1 4.46Å; R51-Y172 HydrophobicContact CG-CD1 3.45Å; R51-Y172 VanDerWaalsContact CG-CD1 3.45Å; R51-Y172 HydrophobicContact CG-CD2 3.86Å; R51-Y172 HydrophobicContact CG-CE1 3.29Å; R51-Y172 HydrophobicContact CG-CE2 3.67Å; R51-Y172 HydrophobicContact CG-CG 3.71Å; W169-Y172 WeakPolarHBondContact O-CB 3.32Å; W169-Y172 PolarHBondContact O-N 3.23Å; V170-Y172 PolarHBondContact O-N 3.09Å; Y172-S175 PolarHBondContact O-OG 3.23Å; Y172-R176 WeakPolarHBondContact O-CD 3.22Å; Y172-R176 WeakPolarHBondContact O-CG 3.21Å; Y172-R176 PolarHBondContact OH-NH1 2.99Å
173	Y	96.6	Very high	91.8	Very high	2 Å²	2	63 Å²	63	1%	0.008	35%	0.349	C	S	.	.	H	α-helix	trans	-77.4	-43.5	179.6	-67.5	-83.8	0	0	0	111.3	L50 R51 D54 I88 V90 I102 W169 V170 Q171 S175 R176 I177	L50-Y173 WeakPolarHBondContact CA-OH 3.4Å; R51-Y173 HydrophobicContact CG-CE2 4.38Å; R51-Y173 PolarHBondContact N-OH 2.72Å; D54-Y173 WeakPolarHBondContact OD2-CE2 3.48Å; D54-Y173 PolarHBondContact OD2-OH 2.78Å; D54-Y173 VanDerWaalsContact OD2-OH 3.04Å; I88-Y173 HydrophobicContact CD1-CD1 4.33Å; I88-Y173 HydrophobicContact CD1-CD2 3.53Å; I88-Y173 HydrophobicContact CD1-CE2 4Å; I88-Y173 HydrophobicContact CD1-CG 3.72Å; V90-Y173 HydrophobicContact CG2-CD1 4.42Å; I102-Y173 HydrophobicContact CD1-CD1 3.96Å; W169-Y173 AromaticContact CE3-CD2 3.75Å; W169-Y173 HydrophobicContact CE3-CD2 3.75Å; W169-Y173 AromaticContact CE3-CE2 3.48Å; W169-Y173 HydrophobicContact CE3-CE2 3.48Å; W169-Y173 VanDerWaalsContact CE3-CE2 3.48Å; W169-Y173 AromaticContact CZ3-CD2 3.74Å; W169-Y173 HydrophobicContact CZ3-CD2 3.74Å; W169-Y173 AromaticContact CZ3-CE2 3.38Å; W169-Y173 HydrophobicContact CZ3-CE2 3.38Å; V170-Y173 WeakPolarHBondContact O-CA 3.28Å; V170-Y173 PolarHBondContact O-N 2.85Å; Q171-Y173 VanDerWaalsContact C-N 3.32Å; Q171-Y173 PolarHBondContact O-N 2.84Å; Y173-S175 VanDerWaalsContact C-N 3.32Å; Y173-S175 PolarHBondContact O-N 3.33Å; Y173-R176 CarbonylContact O-C 3.5Å; Y173-R176 PolarHBondContact O-N 3.13Å; Y173-I177 PolarHBondContact O-N 3.44Å
174	E	94.5	Very high	92	Very high	78 Å²	78	60.6 Å²	60.6	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-40.8	179.1	-72.7	174.4	158.4	0	0	112.3	V105 V170 R176 I177	V105-E174 HydrophobicContact CB-CG 4.13Å; V105-E174 HydrophobicContact CG1-CG 3.93Å; V170-E174 HydrophobicContact CG1-CG 3.82Å; V170-E174 PolarHBondContact O-N 3.36Å; E174-R176 PolarHBondContact O-N 3.03Å; E174-R176 VanDerWaalsContact O-N 3.1Å; E174-I177 WeakPolarHBondContact O-CG1 3.26Å; E174-I177 PolarHBondContact O-N 3.31Å
175	S	95.6	Very high	92.2	Very high	82 Å²	82	61.1 Å²	61.1	57%	0.573	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-11.7	176.8	66.7	0	0	0	0	114.2	Q171 Y172 Y173	Q171-S175 WeakPolarHBondContact O-CB 3.49Å; Q171-S175 PolarHBondContact O-N 3.02Å; Q171-S175 PolarHBondContact O-OG 3.15Å; Y172-S175 PolarHBondContact O-OG 3.23Å; Y173-S175 VanDerWaalsContact C-N 3.32Å; Y173-S175 PolarHBondContact O-N 3.33Å
176	R	94.4	Very high	92.3	Very high	109 Å²	109	51.3 Å²	51.3	41%	0.411	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	12.5	-177.2	-67.9	178.9	179.7	-166.8	3.1	113.2	I102 Y172 Y173 E174 S178	I102-R176 HydrophobicContact CD1-CB 4.12Å; Y172-R176 WeakPolarHBondContact O-CD 3.22Å; Y172-R176 WeakPolarHBondContact O-CG 3.21Å; Y172-R176 PolarHBondContact OH-NH1 2.99Å; Y173-R176 CarbonylContact O-C 3.5Å; Y173-R176 PolarHBondContact O-N 3.13Å; E174-R176 PolarHBondContact O-N 3.03Å; E174-R176 VanDerWaalsContact O-N 3.1Å; R176-S178 PolarHBondContact O-N 2.94Å
177	I	94.4	Very high	92.2	Very high	72 Å²	72	50.7 Å²	50.7	37%	0.369	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-61.8	113.2	167.1	-64.1	171.4	0	0	0	107.2	I102 V105 Y173 E174 L184	I102-I177 HydrophobicContact CG2-CG1 4.08Å; I102-I177 CarbonylContact O-C 3.55Å; I102-I177 VanDerWaalsContact O-CA 3.28Å; I102-I177 WeakPolarHBondContact O-CA 3.46Å; V105-I177 HydrophobicContact CB-CD1 4.41Å; V105-I177 HydrophobicContact CG2-CD1 4.15Å; V105-I177 HydrophobicContact CG2-CG1 4.01Å; Y173-I177 PolarHBondContact O-N 3.44Å; E174-I177 WeakPolarHBondContact O-CG1 3.26Å; E174-I177 PolarHBondContact O-N 3.31Å; I177-L184 HydrophobicContact CG2-CD2 3.64Å
178	S	93.8	Very high	91.7	Very high	74 Å²	74	55 Å²	55	52%	0.517	29%	0.291	S	S	.	.			trans	-146.7	9.6	-169.5	77.7	0	0	0	0	113.5	I102 R176	I102-S178 PolarHBondContact O-N 2.79Å; R176-S178 PolarHBondContact O-N 2.94Å
179	S	92.4	Very high	90.7	Very high	5 Å²	5	55 Å²	55	4%	0.035	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-58.5	137.8	174	-65.3	0	0	0	0	110	D93 T101 I102 G103 L184	D93-S179 VanDerWaalsContact OD2-CB 3.23Å; D93-S179 WeakPolarHBondContact OD2-CB 3.4Å; D93-S179 PolarHBondContact OD2-OG 3.46Å; T101-S179 PolarHBondContact OG1-OG 3.44Å; I102-S179 PolarHBondContact O-N 3.48Å; I102-S179 PolarHBondContact O-OG 2.82Å; G103-S179 WeakPolarHBondContact CA-OG 3.48Å; G103-S179 PolarHBondContact N-OG 3Å; G103-S179 VanDerWaalsContact N-OG 3.16Å; S179-L184 WeakPolarHBondContact O-CD1 3.25Å; S179-L184 WeakPolarHBondContact O-CG 3.47Å
180	P	90.2	Very high	89.3	Confident	65 Å²	65	59.5 Å²	59.5	42%	0.422	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-72.3	152.3	176.3	29.5	-34.5	0	0	0	110.8	F183	P180-F183 HydrophobicContact CG-CD2 3.59Å; P180-F183 HydrophobicContact CG-CE2 3.66Å; P180-F183 WeakPolarHBondContact O-CA 3.44Å; P180-F183 VanDerWaalsContact O-CB 3.3Å; P180-F183 WeakPolarHBondContact O-CB 3.3Å; P180-F183 PolarHBondContact O-N 2.9Å
181	E	87.7	Confident	87.5	Confident	129 Å²	129	63.6 Å²	63.6	60%	0.603	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	139.6	162.9	-69.8	-65.3	177.2	0	0	109.8	L184 S185	E181-L184 WeakPolarHBondContact OE1-CB 3.31Å; E181-S185 PolarHBondContact OE2-N 3.37Å
182	P	87.2	Confident	85.6	Confident	56 Å²	56	65.5 Å²	65.5	36%	0.364	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.8	8.5	13.4	37	-36.9	0	0	0	115.2	F66 L184 S185 E186	F66-P182 HydrophobicContact CD2-CG 4.17Å; F66-P182 HydrophobicContact CE1-CG 4.46Å; F66-P182 HydrophobicContact CE2-CB 3.86Å; F66-P182 HydrophobicContact CE2-CG 3.97Å; F66-P182 HydrophobicContact CZ-CB 3.84Å; F66-P182 HydrophobicContact CZ-CG 4.12Å; P182-L184 PolarHBondContact O-N 3.43Å; P182-S185 PolarHBondContact O-N 2.93Å; P182-S185 PolarHBondContact O-OG 3.37Å; P182-E186 PolarHBondContact O-N 2.87Å
183	F	90.1	Very high	83.4	Confident	23 Å²	23	67 Å²	67	10%	0.101	35%	0.346	C	S	.	.	H	α-helix	trans	-68.7	-36.2	-171.4	-49.6	-24.4	0	0	0	112.2	H69 T95 P180 S185 E186 W187	H69-F183 HydrophobicContact CB-CD1 4.5Å; H69-F183 HydrophobicContact CB-CD2 4.39Å; H69-F183 HydrophobicContact CB-CE1 4.19Å; H69-F183 HydrophobicContact CB-CE2 4.09Å; H69-F183 HydrophobicContact CB-CZ 3.98Å; H69-F183 AromaticContact CE1-CD1 3.35Å; H69-F183 WeakPolarHBondContact CE1-CD1 3.32Å; H69-F183 AromaticContact CE1-CE1 3.97Å; H69-F183 AromaticContact CE1-CG 3.79Å; H69-F183 AromaticContact CG-CD1 3.8Å; H69-F183 AromaticContact CG-CE1 3.91Å; H69-F183 AromaticContact CG-CG 3.97Å; H69-F183 AromaticContact ND1-CD1 3.26Å; H69-F183 VanDerWaalsContact ND1-CD1 3.26Å; H69-F183 WeakPolarHBondContact ND1-CD1 3.49Å; H69-F183 AromaticContact ND1-CE1 3.4Å; H69-F183 WeakPolarHBondContact ND1-CE1 3.44Å; H69-F183 AromaticContact ND1-CG 3.85Å; H69-F183 AromaticContact NE2-CD1 3.94Å; H69-F183 AromaticContact NE2-CG 3.91Å; T95-F183 HydrophobicContact CG2-CD2 4.46Å; T95-F183 HydrophobicContact CG2-CE2 3.48Å; T95-F183 VanDerWaalsContact CG2-CE2 3.48Å; T95-F183 HydrophobicContact CG2-CZ 4.05Å; P180-F183 HydrophobicContact CG-CD2 3.59Å; P180-F183 HydrophobicContact CG-CE2 3.66Å; P180-F183 WeakPolarHBondContact O-CA 3.44Å; P180-F183 VanDerWaalsContact O-CB 3.3Å; P180-F183 WeakPolarHBondContact O-CB 3.3Å; P180-F183 PolarHBondContact O-N 2.9Å; F183-S185 VanDerWaalsContact C-N 3.33Å; F183-S185 PolarHBondContact O-N 3.45Å; F183-E186 WeakPolarHBondContact O-CB 3.43Å; F183-E186 PolarHBondContact O-N 3.5Å; F183-E186 VanDerWaalsContact O-N 3.08Å; F183-W187 VanDerWaalsContact O-CD1 3.23Å
184	L	89.3	Confident	80.7	Confident	36 Å²	36	73.1 Å²	73.1	19%	0.188	38%	0.379	C	S	.	.	H	α-helix	trans	-57.6	-44.1	172.4	-75.7	173.6	0	0	0	112.1	G103 I177 S179 E181 P182 E186 W187 H188	G103-L184 WeakPolarHBondContact O-CD2 3.36Å; I177-L184 HydrophobicContact CG2-CD2 3.64Å; S179-L184 WeakPolarHBondContact O-CD1 3.25Å; S179-L184 WeakPolarHBondContact O-CG 3.47Å; E181-L184 WeakPolarHBondContact OE1-CB 3.31Å; P182-L184 PolarHBondContact O-N 3.43Å; L184-E186 PolarHBondContact O-N 3.12Å; L184-W187 PolarHBondContact O-N 3.45Å; L184-W187 VanDerWaalsContact O-N 3.1Å; L184-H188 PolarHBondContact O-ND1 3.06Å
185	S	88.2	Confident	78.1	Confident	51 Å²	51	74.6 Å²	74.6	36%	0.357	40%	0.398	S	S	.	.	H	α-helix	trans	-57.6	-31.1	177	77.5	0	0	0	0	113	E181 P182 F183 W187 H188 V189	E181-S185 PolarHBondContact OE2-N 3.37Å; P182-S185 PolarHBondContact O-N 2.93Å; P182-S185 PolarHBondContact O-OG 3.37Å; F183-S185 VanDerWaalsContact C-N 3.33Å; F183-S185 PolarHBondContact O-N 3.45Å; S185-W187 VanDerWaalsContact C-N 3.29Å; S185-W187 PolarHBondContact O-N 3.41Å; S185-H188 PolarHBondContact O-N 3Å; S185-V189 WeakPolarHBondContact O-CG2 3.39Å; S185-V189 PolarHBondContact O-N 3.39Å
186	E	89.8	Confident	75.5	Confident	6 Å²	6	78.3 Å²	78.3	3%	0.028	41%	0.406	C	S	.	.	H	α-helix	trans	-69.7	-24.5	-179.9	-139.6	-170.1	130.6	0	0	113.4	S64 L65 F66 H69 R71 P182 F183 L184	S64-E186 WeakPolarHBondContact CA-OE1 3.29Å; S64-E186 PolarHBondContact OG-OE2 3.05Å; S64-E186 VanDerWaalsContact OG-OE2 3.1Å; L65-E186 HydrophobicContact CB-CG 4.13Å; L65-E186 HydrophobicContact CD1-CG 3.82Å; L65-E186 HydrophobicContact CG-CG 3.99Å; L65-E186 PolarHBondContact N-OE1 2.84Å; F66-E186 HydrophobicContact CD2-CG 4.35Å; F66-E186 WeakPolarHBondContact CD2-OE2 3.46Å; F66-E186 HydrophobicContact CE2-CB 4.17Å; F66-E186 HydrophobicContact CE2-CG 4.07Å; H69-E186 IonicContact CE1-OE2 3.02Å; H69-E186 PolarHBondContact CE1-OE2 3.13Å; H69-E186 IonicContact NE2-OE2 3.97Å; R71-E186 VanDerWaalsContact CD-OE1 3.32Å; R71-E186 WeakPolarHBondContact CD-OE1 3.32Å; R71-E186 IonicContact CZ-OE1 3.53Å; R71-E186 IonicContact NE-OE1 3.79Å; R71-E186 PolarHBondContact NH1-O 3.14Å; R71-E186 IonicContact NH1-OE1 2.67Å; R71-E186 PolarHBondContact NH1-OE1 3.41Å; R71-E186 PolarHBondContact NH2-O 2.94Å; P182-E186 PolarHBondContact O-N 2.87Å; F183-E186 WeakPolarHBondContact O-CB 3.43Å; F183-E186 PolarHBondContact O-N 3.5Å; F183-E186 VanDerWaalsContact O-N 3.08Å; L184-E186 PolarHBondContact O-N 3.12Å
187	W	89.3	Confident	73	Confident	3 Å²	3	78 Å²	78	1%	0.011	41%	0.412	C	S	.	.	H	α-helix	trans	-82.6	-19.5	174.5	-66.2	105.4	0	0	0	113.5	L62 R71 Y72 G91 D93 L104 H131 L133 F183 L184 S185	L62-W187 HydrophobicContact CD1-CH2 3.63Å; L62-W187 HydrophobicContact CD1-CZ3 3.53Å; R71-W187 HydrophobicContact CB-CH2 4.07Å; R71-W187 HydrophobicContact CB-CZ2 3.87Å; R71-W187 HydrophobicContact CG-CZ2 4.12Å; Y72-W187 WeakPolarHBondContact O-CH2 3.47Å; G91-W187 VanDerWaalsContact CA-CH2 3.48Å; D93-W187 VanDerWaalsContact CG-NE1 3.27Å; D93-W187 WeakPolarHBondContact OD1-CZ2 3.23Å; D93-W187 PolarHBondContact OD1-NE1 3.43Å; D93-W187 PolarHBondContact OD2-NE1 3.38Å; L104-W187 HydrophobicContact CB-CB 4.05Å; L104-W187 HydrophobicContact CB-CD2 3.87Å; L104-W187 HydrophobicContact CB-CE3 3.93Å; L104-W187 HydrophobicContact CB-CG 3.94Å; L104-W187 HydrophobicContact CD2-CB 4.45Å; L104-W187 HydrophobicContact CD2-CD2 4.28Å; L104-W187 HydrophobicContact CD2-CE3 3.56Å; L104-W187 HydrophobicContact CD2-CZ3 4.22Å; L104-W187 HydrophobicContact CG-CE3 4.41Å; H131-W187 PolarHBondContact ND1-O 2.99Å; L133-W187 HydrophobicContact CD2-CE3 4.4Å; L133-W187 HydrophobicContact CD2-CZ3 3.97Å; F183-W187 VanDerWaalsContact O-CD1 3.23Å; L184-W187 PolarHBondContact O-N 3.45Å; L184-W187 VanDerWaalsContact O-N 3.1Å; S185-W187 VanDerWaalsContact C-N 3.29Å; S185-W187 PolarHBondContact O-N 3.41Å
188	H	83.7	Confident	70.5	Confident	98 Å²	98	85.2 Å²	85.2	45%	0.454	43%	0.434	S	S	.	.	S	Bend	trans	-111.2	15.8	-174.4	-60.6	89.4	0	0	0	112.8	H131 L184 S185 I190	H131-H188 AromaticContact CE1-CD2 3.88Å; L184-H188 PolarHBondContact O-ND1 3.06Å; S185-H188 PolarHBondContact O-N 3Å; H188-I190 PolarHBondContact O-N 3.3Å
189	V	71.6	Confident	67.9	Low	70 Å²	70	86.7 Å²	86.7	42%	0.424	44%	0.436	S	S	.	.			trans	-61.3	108.4	174.7	180	0	0	0	0	108.8	L65 S185 Y191	L65-V189 HydrophobicContact CD1-CG2 4.42Å; S185-V189 WeakPolarHBondContact O-CG2 3.39Å; S185-V189 PolarHBondContact O-N 3.39Å; V189-Y191 PolarHBondContact O-N 3.33Å; V189-Y191 VanDerWaalsContact O-N 3.12Å
190	I	62.8	Low	65.8	Low	107 Å²	107	88.5 Å²	88.5	55%	0.549	45%	0.449	S	S	.	.			trans	-70.7	107.6	175.2	-60.3	175	0	0	0	107.5	H188 H192	H188-I190 PolarHBondContact O-N 3.3Å; I190-H192 PolarHBondContact O-N 3.24Å; I190-H192 VanDerWaalsContact O-N 3.16Å
191	Y	56.6	Low	63.7	Low	92 Å²	92	88.5 Å²	88.5	36%	0.361	45%	0.454	S	S	.	.			trans	-75.7	102.8	170.3	-166.3	-89.2	0	0	0	108.7	V189 K193	V189-Y191 PolarHBondContact O-N 3.33Å; V189-Y191 VanDerWaalsContact O-N 3.12Å; Y191-K193 VanDerWaalsContact C-N 3.26Å; Y191-K193 HydrophobicContact CD1-CB 4.03Å; Y191-K193 HydrophobicContact CE1-CB 4.11Å; Y191-K193 HydrophobicContact CE1-CG 4.41Å; Y191-K193 PolarHBondContact O-N 3.12Å
192	H	52.8	Low	61.7	Low	161 Å²	161	89.1 Å²	89.1	75%	0.745	46%	0.461	S	S	*	.			trans	-72.3	86.3	167.9	-79.8	-79.7	0	0	0	108.9	I190 N194	I190-H192 PolarHBondContact O-N 3.24Å; I190-H192 VanDerWaalsContact O-N 3.16Å; H192-N194 PolarHBondContact O-N 3.48Å
193	K	50.7	Low	60	Low	89 Å²	89	90.9 Å²	90.9	39%	0.387	46%	0.464	S	S	.	.			trans	-62.2	111.4	164.2	-162.3	169.6	-173	170.3	0	105.6	Y191 S195	Y191-K193 VanDerWaalsContact C-N 3.26Å; Y191-K193 HydrophobicContact CD1-CB 4.03Å; Y191-K193 HydrophobicContact CE1-CB 4.11Å; Y191-K193 HydrophobicContact CE1-CG 4.41Å; Y191-K193 PolarHBondContact O-N 3.12Å; K193-S195 PolarHBondContact O-N 2.73Å
194	N	39.9	Very low	58	Low	129 Å²	129	99 Å²	99	69%	0.69	49%	0.494	S	S	*	.			trans	-49.5	114.6	167.8	-87	-9.6	0	0	0	106.3	H192 E196	H192-N194 PolarHBondContact O-N 3.48Å; N194-E196 PolarHBondContact O-N 3.27Å
195	S	40.5	Very low	56.1	Low	109 Å²	109	106 Å²	106	76%	0.762	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-69.9	22.3	-167.4	53.2	0	0	0	0	113.5	K193 I197	K193-S195 PolarHBondContact O-N 2.73Å; S195-I197 PolarHBondContact O-N 3.06Å
196	E	39.4	Very low	54.7	Low	161 Å²	161	112.3 Å²	112.3	75%	0.752	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-76.9	-9.9	-177.1	-66.3	-173.5	154.7	0	0	112.7	N194	N194-E196 PolarHBondContact O-N 3.27Å
197	I	42.3	Very low	53.3	Low	102 Å²	102	121 Å²	121	52%	0.523	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-121.9	27.6	-173.4	-35.8	179.4	0	0	0	113.3	S195 N199	S195-I197 PolarHBondContact O-N 3.06Å; I197-N199 PolarHBondContact O-N 3.04Å
198	R	42.9	Very low	52.3	Low	223 Å²	223	124.9 Å²	124.9	84%	0.842	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	11.2	163.4	-98.4	-176.9	84.5	166.6	5.1	113.8	S200	R198-S200 VanDerWaalsContact C-N 3.29Å; R198-S200 PolarHBondContact O-N 3.06Å
199	N	39.3	Very low	52.2	Low	106 Å²	106	124.2 Å²	124.2	57%	0.567	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	5.6	173.5	-71.7	-24.6	0	0	0	114.3	I197 A201 L202 E203	I197-N199 PolarHBondContact O-N 3.04Å; N199-A201 PolarHBondContact O-N 2.96Å; N199-L202 PolarHBondContact O-N 2.8Å; N199-E203 HydrophobicContact CB-CG 4.01Å; N199-E203 VanDerWaalsContact O-CG 3.32Å; N199-E203 WeakPolarHBondContact O-CG 3.4Å; N199-E203 PolarHBondContact O-N 2.95Å
200	S	47.8	Very low	52.8	Low	42 Å²	42	124.7 Å²	124.7	29%	0.294	61%	0.613	S	S	.	*	H	α-helix	trans	-64.9	-15.2	-169.3	71.4	0	0	0	0	116.1	R198 R204	R198-S200 VanDerWaalsContact C-N 3.29Å; R198-S200 PolarHBondContact O-N 3.06Å; S200-R204 VanDerWaalsContact O-CG 3.28Å; S200-R204 WeakPolarHBondContact O-CG 3.09Å; S200-R204 PolarHBondContact O-NE 3.25Å
201	A	45	Very low	53.9	Low	65 Å²	65	127.5 Å²	127.5	54%	0.537	62%	0.624	S	S	.	*	H	α-helix	trans	-81.1	-41.6	176.1	0	0	0	0	0	112.4	N199 F205	N199-A201 PolarHBondContact O-N 2.96Å; A201-F205 VanDerWaalsContact O-CD2 3.23Å; A201-F205 WeakPolarHBondContact O-CD2 3.37Å; A201-F205 WeakPolarHBondContact O-CE2 3.2Å
202	L	46.9	Very low	55.4	Low	143 Å²	143	127.2 Å²	127.2	75%	0.749	62%	0.622	S	S	*	*	H	α-helix	trans	-80.4	-33.2	178.1	-91.9	148.6	0	0	0	112	N199 R204 F205 R206	N199-L202 PolarHBondContact O-N 2.8Å; L202-R204 VanDerWaalsContact C-N 3.29Å; L202-R204 PolarHBondContact O-N 2.9Å; L202-F205 PolarHBondContact O-N 3.3Å; L202-R206 PolarHBondContact O-N 3.05Å
203	E	50.3	Low	57.1	Low	92 Å²	92	123.5 Å²	123.5	43%	0.43	61%	0.605	S	S	.	*	H	α-helix	trans	-67.1	-28.7	177.3	-67.8	-123.3	131.3	0	0	113	N199 F205 R206	N199-E203 HydrophobicContact CB-CG 4.01Å; N199-E203 VanDerWaalsContact O-CG 3.32Å; N199-E203 WeakPolarHBondContact O-CG 3.4Å; N199-E203 PolarHBondContact O-N 2.95Å; E203-F205 PolarHBondContact O-N 3.05Å; E203-R206 WeakPolarHBondContact O-CB 3.46Å; E203-R206 PolarHBondContact O-N 2.94Å; E203-R206 VanDerWaalsContact O-N 3.09Å; E203-R206 IonicContact OE1-NH1 3.73Å
204	R	48	Very low	59	Low	193 Å²	193	121.8 Å²	121.8	73%	0.728	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-26	174.5	-86.3	-175.5	-110.5	-163.2	-7	113.8	S200 L202	S200-R204 VanDerWaalsContact O-CG 3.28Å; S200-R204 WeakPolarHBondContact O-CG 3.09Å; S200-R204 PolarHBondContact O-NE 3.25Å; L202-R204 VanDerWaalsContact C-N 3.29Å; L202-R204 PolarHBondContact O-N 2.9Å
205	F	49.9	Very low	61.5	Low	183 Å²	183	116.4 Å²	116.4	80%	0.803	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-8.8	177.1	-63.7	-75.2	0	0	0	113.1	A201 L202 E203	A201-F205 VanDerWaalsContact O-CD2 3.23Å; A201-F205 WeakPolarHBondContact O-CD2 3.37Å; A201-F205 WeakPolarHBondContact O-CE2 3.2Å; L202-F205 PolarHBondContact O-N 3.3Å; E203-F205 PolarHBondContact O-N 3.05Å
206	R	59.4	Low	64	Low	184 Å²	184	112 Å²	112	69%	0.694	55%	0.548	S	S	*	.	S	Bend	trans	-74.7	126.9	171.1	-119.1	176.4	174.4	168	-1.8	107.6	L202 E203 K208	L202-R206 PolarHBondContact O-N 3.05Å; E203-R206 WeakPolarHBondContact O-CB 3.46Å; E203-R206 PolarHBondContact O-N 2.94Å; E203-R206 VanDerWaalsContact O-N 3.09Å; E203-R206 IonicContact OE1-NH1 3.73Å; R206-K208 PolarHBondContact O-N 3.02Å
207	Q	59.9	Low	66.5	Low	190 Å²	190	111.5 Å²	111.5	89%	0.888	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-54.3	117.7	169.9	-77.5	-179.2	-3.3	0	0	107.9
208	K	68.8	Low	69	Low	83 Å²	83	110.1 Å²	110.1	36%	0.361	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-64.5	140.3	176.4	-69.9	-173.3	-178.5	-172.9	0	107.7	R206 A210 E213 E216	R206-K208 PolarHBondContact O-N 3.02Å; K208-A210 PolarHBondContact O-N 2.99Å; K208-E213 HydrophobicContact CB-CG 3.94Å; K208-E216 IonicContact NZ-OE1 2.77Å; K208-E216 PolarHBondContact NZ-OE1 3.07Å; K208-E216 IonicContact NZ-OE2 3.23Å; K208-E216 PolarHBondContact NZ-OE2 2.97Å
209	P	82.2	Confident	71.5	Confident	84 Å²	84	99.6 Å²	99.6	55%	0.545	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-53.9	140.1	172.7	-22.3	31.7	0	0	0	109.9	E211 R212 E213	P209-E211 PolarHBondContact O-N 3.43Å; P209-E211 VanDerWaalsContact O-N 3.1Å; P209-R212 HydrophobicContact CB-CB 4.47Å; P209-R212 WeakPolarHBondContact O-CA 3.39Å; P209-R212 WeakPolarHBondContact O-CB 3.44Å; P209-R212 PolarHBondContact O-N 2.84Å; P209-E213 PolarHBondContact O-N 3.36Å; P209-E213 VanDerWaalsContact O-N 3.16Å
210	A	84.2	Confident	74.1	Confident	80 Å²	80	98.2 Å²	98.2	66%	0.661	48%	0.483	S	S	*	.	H	α-helix	trans	-55	-32.4	-179.5	0	0	0	0	0	112.6	K208 E213 A214	K208-A210 PolarHBondContact O-N 2.99Å; A210-E213 PolarHBondContact O-N 2.78Å; A210-A214 WeakPolarHBondContact O-CB 3.09Å; A210-A214 PolarHBondContact O-N 2.93Å
211	E	85.6	Confident	76.3	Confident	167 Å²	167	100.9 Å²	100.9	78%	0.78	49%	0.494	S	S	*	.	H	α-helix	trans	-62.8	-41.1	174.2	-65.8	176.3	-179.1	0	0	112.4	P209 A214 A215	P209-E211 PolarHBondContact O-N 3.43Å; P209-E211 VanDerWaalsContact O-N 3.1Å; E211-A214 PolarHBondContact O-N 2.88Å; E211-A215 WeakPolarHBondContact O-CB 3.47Å; E211-A215 PolarHBondContact O-N 3.25Å
212	R	88.3	Confident	78.7	Confident	85 Å²	85	99 Å²	99	32%	0.321	48%	0.476	S	S	.	.	H	α-helix	trans	-67.5	-41.4	177.4	-174.5	174.5	-179.6	147	7.5	111	P209 A214 A215 E216 Y255	P209-R212 HydrophobicContact CB-CB 4.47Å; P209-R212 WeakPolarHBondContact O-CA 3.39Å; P209-R212 WeakPolarHBondContact O-CB 3.44Å; P209-R212 PolarHBondContact O-N 2.84Å; R212-A214 VanDerWaalsContact C-N 3.35Å; R212-A215 PolarHBondContact O-N 3.34Å; R212-E216 HydrophobicContact CG-CG 4.35Å; R212-E216 IonicContact CZ-OE1 2.76Å; R212-E216 IonicContact NE-OE1 3.38Å; R212-E216 PolarHBondContact NE-OE1 2.94Å; R212-E216 WeakPolarHBondContact O-CB 3.45Å; R212-E216 VanDerWaalsContact O-CG 3.3Å; R212-E216 WeakPolarHBondContact O-CG 3.4Å; R212-E216 PolarHBondContact O-N 3.44Å; R212-Y255 HydrophobicContact CG-CE1 4.08Å
213	E	88.1	Confident	81.1	Confident	83 Å²	83	92.2 Å²	92.2	39%	0.388	44%	0.441	S	S	.	.	H	α-helix	trans	-64.4	-40	176.3	-66.6	-171.4	169.2	0	0	112.2	K208 P209 A210 E216 R217	K208-E213 HydrophobicContact CB-CG 3.94Å; P209-E213 PolarHBondContact O-N 3.36Å; P209-E213 VanDerWaalsContact O-N 3.16Å; A210-E213 PolarHBondContact O-N 2.78Å; E213-E216 PolarHBondContact O-N 3.04Å; E213-R217 WeakPolarHBondContact O-CG 3.45Å; E213-R217 PolarHBondContact O-N 2.87Å
214	A	90.4	Very high	83.1	Confident	53 Å²	53	89.9 Å²	89.9	44%	0.438	43%	0.429	S	S	.	.	H	α-helix	trans	-63.4	-45.1	174.9	0	0	0	0	0	111.2	A210 E211 R212 R217 T218	A210-A214 WeakPolarHBondContact O-CB 3.09Å; A210-A214 PolarHBondContact O-N 2.93Å; E211-A214 PolarHBondContact O-N 2.88Å; R212-A214 VanDerWaalsContact C-N 3.35Å; A214-R217 PolarHBondContact O-N 3.26Å; A214-T218 PolarHBondContact O-N 3.35Å; A214-T218 VanDerWaalsContact O-N 3.09Å; A214-T218 PolarHBondContact O-OG1 3.43Å; A214-T218 VanDerWaalsContact O-OG1 3.13Å
215	A	92.1	Very high	85.3	Confident	17 Å²	17	85.2 Å²	85.2	14%	0.14	42%	0.418	C	S	.	.	H	α-helix	trans	-61.4	-46.4	175.1	0	0	0	0	0	112	E211 R212 R217 T218 I219 Y255	E211-A215 WeakPolarHBondContact O-CB 3.47Å; E211-A215 PolarHBondContact O-N 3.25Å; R212-A215 PolarHBondContact O-N 3.34Å; A215-R217 VanDerWaalsContact C-N 3.28Å; A215-R217 PolarHBondContact O-N 3.02Å; A215-T218 PolarHBondContact O-N 2.86Å; A215-I219 WeakPolarHBondContact O-CB 3.48Å; A215-I219 WeakPolarHBondContact O-CD1 3.32Å; A215-I219 VanDerWaalsContact O-CG1 3.23Å; A215-I219 WeakPolarHBondContact O-CG1 3.46Å; A215-I219 PolarHBondContact O-N 3.24Å; A215-Y255 HydrophobicContact CB-CE1 4.31Å
216	E	93.7	Very high	87.5	Confident	15 Å²	15	76.5 Å²	76.5	7%	0.07	38%	0.38	C	S	.	.	H	α-helix	trans	-60.5	-34.8	177.6	-76.6	178.8	-172.8	0	0	112.1	K208 R212 E213 R220 Y255 F258	K208-E216 IonicContact NZ-OE1 2.77Å; K208-E216 PolarHBondContact NZ-OE1 3.07Å; K208-E216 IonicContact NZ-OE2 3.23Å; K208-E216 PolarHBondContact NZ-OE2 2.97Å; R212-E216 HydrophobicContact CG-CG 4.35Å; R212-E216 IonicContact CZ-OE1 2.76Å; R212-E216 IonicContact NE-OE1 3.38Å; R212-E216 PolarHBondContact NE-OE1 2.94Å; R212-E216 WeakPolarHBondContact O-CB 3.45Å; R212-E216 VanDerWaalsContact O-CG 3.3Å; R212-E216 WeakPolarHBondContact O-CG 3.4Å; R212-E216 PolarHBondContact O-N 3.44Å; E213-E216 PolarHBondContact O-N 3.04Å; E216-R220 WeakPolarHBondContact O-CB 3.32Å; E216-R220 PolarHBondContact O-N 2.94Å; E216-Y255 HydrophobicContact CG-CD1 4.24Å; E216-Y255 HydrophobicContact CG-CE1 4.07Å; E216-F258 HydrophobicContact CB-CE1 3.85Å; E216-F258 HydrophobicContact CB-CE2 4.09Å; E216-F258 HydrophobicContact CB-CZ 3.62Å; E216-F258 HydrophobicContact CG-CD1 4.02Å; E216-F258 HydrophobicContact CG-CD2 4.14Å; E216-F258 HydrophobicContact CG-CE1 3.87Å; E216-F258 HydrophobicContact CG-CE2 4Å; E216-F258 HydrophobicContact CG-CG 4.16Å; E216-F258 HydrophobicContact CG-CZ 3.87Å; E216-F258 WeakPolarHBondContact O-CZ 3.28Å
217	R	92.1	Very high	89.2	Confident	151 Å²	151	67.8 Å²	67.8	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-66.5	-50.7	172.9	-73.2	178.2	-161.8	174.7	8.2	111.9	E213 A214 A215 I219 R220 D221	E213-R217 WeakPolarHBondContact O-CG 3.45Å; E213-R217 PolarHBondContact O-N 2.87Å; A214-R217 PolarHBondContact O-N 3.26Å; A215-R217 VanDerWaalsContact C-N 3.28Å; A215-R217 PolarHBondContact O-N 3.02Å; R217-I219 VanDerWaalsContact C-N 3.28Å; R217-I219 PolarHBondContact O-N 3.5Å; R217-R220 WeakPolarHBondContact O-CB 3.31Å; R217-R220 PolarHBondContact O-N 3.29Å; R217-R220 VanDerWaalsContact O-N 3.15Å; R217-D221 PolarHBondContact O-N 2.84Å
218	T	94.5	Very high	90.7	Very high	74 Å²	74	64.5 Å²	64.5	45%	0.454	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-39.9	179	-52.2	0	0	0	0	111.8	A214 A215 T222 L248	A214-T218 PolarHBondContact O-N 3.35Å; A214-T218 VanDerWaalsContact O-N 3.09Å; A214-T218 PolarHBondContact O-OG1 3.43Å; A214-T218 VanDerWaalsContact O-OG1 3.13Å; A215-T218 PolarHBondContact O-N 2.86Å; T218-T222 WeakPolarHBondContact O-CB 3.31Å; T218-T222 PolarHBondContact O-N 3.07Å; T218-T222 VanDerWaalsContact O-N 3.12Å; T218-T222 PolarHBondContact O-OG1 2.92Å; T218-L248 HydrophobicContact CG2-CD2 3.76Å
219	I	95.5	Very high	91.8	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-50.2	174.3	-73	163.9	0	0	0	110.4	A215 R217 D221 T222 L223 L244 L248 L252 Y255 F258 V259	A215-I219 WeakPolarHBondContact O-CB 3.48Å; A215-I219 WeakPolarHBondContact O-CD1 3.32Å; A215-I219 VanDerWaalsContact O-CG1 3.23Å; A215-I219 WeakPolarHBondContact O-CG1 3.46Å; A215-I219 PolarHBondContact O-N 3.24Å; R217-I219 VanDerWaalsContact C-N 3.28Å; R217-I219 PolarHBondContact O-N 3.5Å; I219-D221 PolarHBondContact O-N 3.38Å; I219-T222 PolarHBondContact O-N 2.85Å; I219-L223 WeakPolarHBondContact O-CB 3.42Å; I219-L223 PolarHBondContact O-N 2.83Å; I219-L244 HydrophobicContact CG2-CD2 4Å; I219-L248 HydrophobicContact CG1-CD1 3.76Å; I219-L252 HydrophobicContact CD1-CD2 3.6Å; I219-L252 HydrophobicContact CG1-CD2 3.93Å; I219-Y255 HydrophobicContact CD1-CD1 3.66Å; I219-Y255 HydrophobicContact CD1-CD2 4.14Å; I219-Y255 HydrophobicContact CD1-CE1 4.09Å; I219-Y255 HydrophobicContact CD1-CG 3.68Å; I219-F258 HydrophobicContact CB-CE1 4.11Å; I219-F258 HydrophobicContact CG2-CD1 4.05Å; I219-F258 HydrophobicContact CG2-CE1 3.7Å; I219-V259 HydrophobicContact CG2-CG2 4Å
220	R	94.3	Very high	92.3	Very high	77 Å²	77	61.7 Å²	61.7	29%	0.291	32%	0.323	S	S	.	.	H	α-helix	trans	-56.8	-49.7	180	175.8	-177.7	-58.7	98.6	10.1	112	E216 R217 T222 L223 K224 E262	E216-R220 WeakPolarHBondContact O-CB 3.32Å; E216-R220 PolarHBondContact O-N 2.94Å; R217-R220 WeakPolarHBondContact O-CB 3.31Å; R217-R220 PolarHBondContact O-N 3.29Å; R217-R220 VanDerWaalsContact O-N 3.15Å; R220-T222 PolarHBondContact O-N 3.32Å; R220-L223 PolarHBondContact O-N 3.04Å; R220-K224 WeakPolarHBondContact O-CB 3.47Å; R220-K224 PolarHBondContact O-N 3.36Å; R220-E262 HydrophobicContact CB-CG 4.23Å; R220-E262 VanDerWaalsContact CD-OE1 3.27Å; R220-E262 WeakPolarHBondContact CD-OE1 3.38Å; R220-E262 HydrophobicContact CG-CG 4.06Å; R220-E262 VanDerWaalsContact CG-OE1 3.32Å; R220-E262 WeakPolarHBondContact CG-OE1 3.48Å; R220-E262 IonicContact CZ-OE1 2.86Å; R220-E262 IonicContact CZ-OE2 2.63Å; R220-E262 IonicContact NE-OE1 3.36Å; R220-E262 PolarHBondContact NE-OE1 2.93Å; R220-E262 IonicContact NE-OE2 3.56Å; R220-E262 PolarHBondContact NE-OE2 3.14Å; R220-E262 IonicContact NH2-OE2 3.31Å; R220-E262 PolarHBondContact NH2-OE2 3.14Å
221	D	93	Very high	92.7	Very high	98 Å²	98	62 Å²	62	52%	0.524	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-46.3	-176.3	-64.6	-20.8	0	0	0	110.6	R217 I219 L223 K224 D225	R217-D221 PolarHBondContact O-N 2.84Å; I219-D221 PolarHBondContact O-N 3.38Å; D221-L223 PolarHBondContact O-N 3.49Å; D221-K224 PolarHBondContact O-N 2.88Å; D221-D225 PolarHBondContact O-N 3.28Å; D221-D225 VanDerWaalsContact O-N 3.13Å
222	T	96	Very high	93	Very high	26 Å²	26	54.8 Å²	54.8	16%	0.16	28%	0.281	C	S	.	.	H	α-helix	trans	-68.2	-37.7	179.4	-49.4	0	0	0	0	112.1	T218 I219 R220 D225 I226 L244 R247 L248	T218-T222 WeakPolarHBondContact O-CB 3.31Å; T218-T222 PolarHBondContact O-N 3.07Å; T218-T222 VanDerWaalsContact O-N 3.12Å; T218-T222 PolarHBondContact O-OG1 2.92Å; I219-T222 PolarHBondContact O-N 2.85Å; R220-T222 PolarHBondContact O-N 3.32Å; T222-D225 PolarHBondContact O-N 3.17Å; T222-I226 HydrophobicContact CG2-CD1 4.23Å; T222-I226 VanDerWaalsContact O-CG1 3.31Å; T222-I226 WeakPolarHBondContact O-CG1 3.46Å; T222-I226 PolarHBondContact O-N 2.9Å; T222-L244 HydrophobicContact CG2-CD1 3.75Å; T222-R247 HydrophobicContact CG2-CB 4.03Å; T222-L248 HydrophobicContact CG2-CD2 4.18Å; T222-L248 HydrophobicContact CG2-CG 4.34Å; T222-L248 WeakPolarHBondContact OG1-CD2 3.37Å
223	L	96.2	Very high	92.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-45.3	176.4	179.2	63.4	0	0	0	111	I219 R220 D221 D225 I226 M227 I240 L244 V259 E262 M263 I266	I219-L223 WeakPolarHBondContact O-CB 3.42Å; I219-L223 PolarHBondContact O-N 2.83Å; R220-L223 PolarHBondContact O-N 3.04Å; D221-L223 PolarHBondContact O-N 3.49Å; L223-D225 VanDerWaalsContact C-N 3.32Å; L223-D225 PolarHBondContact O-N 3.46Å; L223-I226 PolarHBondContact O-N 2.86Å; L223-M227 HydrophobicContact CD1-CG 4.17Å; L223-M227 HydrophobicContact CD1-SD 4.01Å; L223-M227 HydrophobicContact CG-CG 4.45Å; L223-M227 HydrophobicContact CG-SD 3.94Å; L223-M227 WeakPolarHBondContact O-CB 3.48Å; L223-M227 VanDerWaalsContact O-CG 3.31Å; L223-M227 WeakPolarHBondContact O-CG 2.92Å; L223-M227 PolarHBondContact O-N 3.23Å; L223-I240 HydrophobicContact CD1-CG2 3.4Å; L223-I240 VanDerWaalsContact CD1-CG2 3.4Å; L223-L244 HydrophobicContact CB-CD1 4.23Å; L223-L244 HydrophobicContact CB-CD2 4.47Å; L223-L244 HydrophobicContact CD1-CD2 4.34Å; L223-V259 HydrophobicContact CD1-CG1 4.47Å; L223-V259 HydrophobicContact CD2-CG1 4.35Å; L223-E262 HydrophobicContact CD2-CB 3.9Å; L223-E262 HydrophobicContact CD2-CG 3.99Å; L223-M263 HydrophobicContact CD1-CG 3.93Å; L223-M263 HydrophobicContact CD2-CG 3.92Å; L223-M263 HydrophobicContact CG-CG 4.34Å; L223-I266 HydrophobicContact CB-CD1 4.18Å; L223-I266 HydrophobicContact CD2-CD1 3.73Å; L223-I266 HydrophobicContact CG-CD1 3.65Å
224	K	93.9	Very high	93	Very high	43 Å²	43	54.5 Å²	54.5	19%	0.187	29%	0.285	C	S	.	.	H	α-helix	trans	-58	-45.3	176.4	-170.9	175.6	-178.7	178	0	111	R220 D221 M227 Q228 I266 D292	R220-K224 WeakPolarHBondContact O-CB 3.47Å; R220-K224 PolarHBondContact O-N 3.36Å; D221-K224 PolarHBondContact O-N 2.88Å; K224-M227 PolarHBondContact O-N 2.75Å; K224-Q228 VanDerWaalsContact O-CG 3.29Å; K224-Q228 WeakPolarHBondContact O-CG 3.42Å; K224-Q228 PolarHBondContact O-N 3.12Å; K224-I266 HydrophobicContact CB-CD1 4.09Å; K224-I266 HydrophobicContact CB-CG1 4.46Å; K224-D292 IonicContact NZ-OD2 3.05Å; K224-D292 PolarHBondContact NZ-OD2 2.91Å
225	D	94.1	Very high	93.1	Very high	95 Å²	95	52.7 Å²	52.7	51%	0.508	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-43	176.5	-75.1	-7.7	0	0	0	112.6	D221 T222 L223 S229	D221-D225 PolarHBondContact O-N 3.28Å; D221-D225 VanDerWaalsContact O-N 3.13Å; T222-D225 PolarHBondContact O-N 3.17Å; L223-D225 VanDerWaalsContact C-N 3.32Å; L223-D225 PolarHBondContact O-N 3.46Å; D225-S229 WeakPolarHBondContact O-CB 3.5Å; D225-S229 PolarHBondContact O-N 2.73Å; D225-S229 PolarHBondContact O-OG 3.14Å
226	I	95.4	Very high	93.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.9	-51.5	176.3	-69.9	166.6	0	0	0	109.9	T222 L223 Q228 S229 V230 I240 K243 L244	T222-I226 HydrophobicContact CG2-CD1 4.23Å; T222-I226 VanDerWaalsContact O-CG1 3.31Å; T222-I226 WeakPolarHBondContact O-CG1 3.46Å; T222-I226 PolarHBondContact O-N 2.9Å; L223-I226 PolarHBondContact O-N 2.86Å; I226-Q228 VanDerWaalsContact C-N 3.27Å; I226-Q228 PolarHBondContact O-N 2.98Å; I226-S229 PolarHBondContact O-N 2.96Å; I226-S229 PolarHBondContact O-OG 3.21Å; I226-V230 HydrophobicContact CG2-CG1 4.35Å; I226-V230 WeakPolarHBondContact O-CG2 3.46Å; I226-V230 PolarHBondContact O-N 3.4Å; I226-I240 HydrophobicContact CG2-CG2 4.22Å; I226-K243 HydrophobicContact CD1-CB 4.24Å; I226-K243 HydrophobicContact CG2-CB 4.48Å; I226-K243 HydrophobicContact CG2-CD 4.4Å; I226-L244 HydrophobicContact CD1-CB 3.89Å; I226-L244 HydrophobicContact CD1-CD1 3.85Å; I226-L244 HydrophobicContact CD1-CG 4.49Å
227	M	94.5	Very high	93	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-62.5	-32.5	-176.2	-71	-179	75.6	0	0	112.9	V138 L223 K224 S229 L232 I240 M263 I266 L267	V138-M227 HydrophobicContact CG1-CE 4.26Å; L223-M227 HydrophobicContact CD1-CG 4.17Å; L223-M227 HydrophobicContact CD1-SD 4.01Å; L223-M227 HydrophobicContact CG-CG 4.45Å; L223-M227 HydrophobicContact CG-SD 3.94Å; L223-M227 WeakPolarHBondContact O-CB 3.48Å; L223-M227 VanDerWaalsContact O-CG 3.31Å; L223-M227 WeakPolarHBondContact O-CG 2.92Å; L223-M227 PolarHBondContact O-N 3.23Å; K224-M227 PolarHBondContact O-N 2.75Å; M227-S229 VanDerWaalsContact C-N 3.29Å; M227-S229 PolarHBondContact O-N 2.86Å; M227-L232 HydrophobicContact CB-CD2 4.35Å; M227-L232 HydrophobicContact CE-CD2 4.28Å; M227-L232 HydrophobicContact CG-CD2 4.44Å; M227-I240 HydrophobicContact CG-CD1 4Å; M227-I240 HydrophobicContact CG-CG2 4.48Å; M227-M263 HydrophobicContact CE-CB 4.14Å; M227-M263 HydrophobicContact CE-CG 4.18Å; M227-M263 HydrophobicContact SD-CB 4.17Å; M227-M263 HydrophobicContact SD-CG 3.74Å; M227-I266 HydrophobicContact CB-CG2 4.13Å; M227-I266 HydrophobicContact CE-CB 4.18Å; M227-I266 HydrophobicContact CE-CG2 4Å; M227-I266 HydrophobicContact SD-CB 3.86Å; M227-I266 HydrophobicContact SD-CD1 3.75Å; M227-I266 HydrophobicContact SD-CG1 4.43Å; M227-I266 HydrophobicContact SD-CG2 3.72Å; M227-L267 HydrophobicContact CE-CD1 4.28Å; M227-L267 HydrophobicContact CE-CD2 4.22Å; M227-L267 HydrophobicContact CE-CG 3.74Å
228	Q	91.3	Very high	92.9	Very high	122 Å²	122	50.4 Å²	50.4	57%	0.57	26%	0.262	S	S	*	.	H	α-helix	trans	-73.3	-19.7	173.6	-71.6	177.6	13	0	0	113.7	K224 I226	K224-Q228 VanDerWaalsContact O-CG 3.29Å; K224-Q228 WeakPolarHBondContact O-CG 3.42Å; K224-Q228 PolarHBondContact O-N 3.12Å; I226-Q228 VanDerWaalsContact C-N 3.27Å; I226-Q228 PolarHBondContact O-N 2.98Å
229	S	92.5	Very high	92.8	Very high	78 Å²	78	50 Å²	50	55%	0.545	26%	0.257	S	S	.	.	H	α-helix	trans	-96.5	-14.5	-175.4	72.3	0	0	0	0	114.7	D225 I226 M227	D225-S229 WeakPolarHBondContact O-CB 3.5Å; D225-S229 PolarHBondContact O-N 2.73Å; D225-S229 PolarHBondContact O-OG 3.14Å; I226-S229 PolarHBondContact O-N 2.96Å; I226-S229 PolarHBondContact O-OG 3.21Å; M227-S229 VanDerWaalsContact C-N 3.29Å; M227-S229 PolarHBondContact O-N 2.86Å
230	V	93.3	Very high	92.8	Very high	29 Å²	29	50 Å²	50	18%	0.176	26%	0.257	C	S	.	.	S	Bend	trans	-109.8	158.7	-174.1	-60.6	0	0	0	0	111.8	I226 L232 V235	I226-V230 HydrophobicContact CG2-CG1 4.35Å; I226-V230 WeakPolarHBondContact O-CG2 3.46Å; I226-V230 PolarHBondContact O-N 3.4Å; V230-L232 HydrophobicContact CG2-CD2 3.88Å; V230-L232 PolarHBondContact O-N 3.26Å; V230-V235 HydrophobicContact CB-CG1 4.23Å; V230-V235 HydrophobicContact CG2-CG1 4.45Å; V230-V235 HydrophobicContact CG2-CG2 3.97Å
231	D	91.9	Very high	92.7	Very high	86 Å²	86	47.2 Å²	47.2	46%	0.46	25%	0.246	S	C	.	.			trans	-80.9	107.1	167.6	-169.8	-12.6	0	0	0	109.8	D233 E234 V235	D231-D233 PolarHBondContact O-N 3.4Å; D231-D233 WeakPolarHBondContact OD1-CB 3.38Å; D231-D233 PolarHBondContact OD1-N 3.49Å; D231-D233 VanDerWaalsContact OD1-N 3.14Å; D231-E234 PolarHBondContact O-N 2.93Å; D231-E234 VanDerWaalsContact O-N 3.07Å; D231-V235 WeakPolarHBondContact O-CG2 3.19Å; D231-V235 PolarHBondContact O-N 3.47Å
232	L	91.3	Very high	92.7	Very high	16 Å²	16	45.7 Å²	45.7	8%	0.084	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-14.1	-176.3	-63.1	173.5	0	0	0	113.8	V138 Q139 M227 V230 E234 V235 I240 L267 M270	V138-L232 HydrophobicContact CG1-CD2 4.35Å; Q139-L232 HydrophobicContact CB-CB 4.35Å; Q139-L232 WeakPolarHBondContact CB-O 3.48Å; Q139-L232 PolarHBondContact N-O 2.74Å; Q139-L232 VanDerWaalsContact N-O 3.17Å; M227-L232 HydrophobicContact CB-CD2 4.35Å; M227-L232 HydrophobicContact CE-CD2 4.28Å; M227-L232 HydrophobicContact CG-CD2 4.44Å; V230-L232 HydrophobicContact CG2-CD2 3.88Å; V230-L232 PolarHBondContact O-N 3.26Å; L232-E234 VanDerWaalsContact C-N 3.34Å; L232-V235 HydrophobicContact CD2-CG2 4.23Å; L232-I240 HydrophobicContact CD2-CD1 4.11Å; L232-L267 HydrophobicContact CD1-CD2 3.82Å; L232-M270 HydrophobicContact CD1-CE 3.75Å; L232-M270 HydrophobicContact CD1-SD 3.76Å
233	D	87.9	Confident	92.7	Very high	44 Å²	44	48.2 Å²	48.2	24%	0.235	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-17.5	173.5	-73.4	-44.8	0	0	0	112.9	V11 S137 Q139 D231	V11-D233 VanDerWaalsContact CG1-CG 3.45Å; V11-D233 WeakPolarHBondContact CG1-OD1 3.17Å; V11-D233 WeakPolarHBondContact CG1-OD2 3.31Å; S137-D233 VanDerWaalsContact CB-O 3.28Å; S137-D233 WeakPolarHBondContact CB-O 3.41Å; Q139-D233 WeakPolarHBondContact CB-OD1 3.48Å; Q139-D233 WeakPolarHBondContact CG-OD1 3.29Å; D231-D233 PolarHBondContact O-N 3.4Å; D231-D233 WeakPolarHBondContact OD1-CB 3.38Å; D231-D233 PolarHBondContact OD1-N 3.49Å; D231-D233 VanDerWaalsContact OD1-N 3.14Å
234	E	89	Confident	92.6	Very high	119 Å²	119	48.2 Å²	48.2	56%	0.556	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.9	-0.4	-174.3	-59.3	-163.9	161.3	0	0	114	K12 D231 L232	K12-E234 IonicContact NZ-OE1 2.7Å; K12-E234 PolarHBondContact NZ-OE1 3.27Å; D231-E234 PolarHBondContact O-N 2.93Å; D231-E234 VanDerWaalsContact O-N 3.07Å; L232-E234 VanDerWaalsContact C-N 3.34Å
235	V	93	Very high	92.7	Very high	15 Å²	15	48.5 Å²	48.5	9%	0.091	25%	0.249	C	C	.	.			trans	-114.5	141.6	178.7	-61.1	0	0	0	0	111.9	S137 V138 V230 D231 L232 D239 I240	S137-V235 CarbonylContact C-O 3.57Å; S137-V235 WeakPolarHBondContact CA-O 3.44Å; V138-V235 HydrophobicContact CG2-CG2 4.49Å; V138-V235 PolarHBondContact N-O 3.47Å; V230-V235 HydrophobicContact CB-CG1 4.23Å; V230-V235 HydrophobicContact CG2-CG1 4.45Å; V230-V235 HydrophobicContact CG2-CG2 3.97Å; D231-V235 WeakPolarHBondContact O-CG2 3.19Å; D231-V235 PolarHBondContact O-N 3.47Å; L232-V235 HydrophobicContact CD2-CG2 4.23Å; V235-D239 HydrophobicContact CB-CB 4.37Å; V235-I240 HydrophobicContact CB-CG1 4.38Å; V235-I240 HydrophobicContact CG2-CD1 3.93Å; V235-I240 HydrophobicContact CG2-CG1 3.95Å
236	T	92.3	Very high	92.7	Very high	27 Å²	27	51 Å²	51	17%	0.166	26%	0.258	C	S	.	.			trans	-90.4	162.7	170.8	68.3	0	0	0	0	111.1	K238 D239 I240	T236-K238 PolarHBondContact O-N 3.12Å; T236-K238 PolarHBondContact OG1-N 3.01Å; T236-D239 WeakPolarHBondContact CB-OD2 3.27Å; T236-D239 PolarHBondContact N-OD2 3.44Å; T236-D239 PolarHBondContact O-N 3.09Å; T236-D239 PolarHBondContact OG1-N 2.84Å; T236-D239 VanDerWaalsContact OG1-N 3.14Å; T236-D239 PolarHBondContact OG1-OD2 3.02Å; T236-I240 PolarHBondContact O-N 2.83Å; T236-I240 VanDerWaalsContact O-N 3.08Å
237	S	91	Very high	92.7	Very high	6 Å²	6	57.5 Å²	57.5	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-57.6	-31.6	172	-64.2	0	0	0	0	112.4	G120 R241	G120-S237 VanDerWaalsContact CA-CB 3.42Å; G120-S237 WeakPolarHBondContact CA-OG 3.4Å; S237-R241 WeakPolarHBondContact O-CB 3.47Å; S237-R241 PolarHBondContact O-N 3.4Å
238	K	90.4	Very high	92.7	Very high	101 Å²	101	58.9 Å²	58.9	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-65	-46.6	173.7	-173.9	-173.6	172.8	-166.8	0	111.2	T236 I240 R241 D242	T236-K238 PolarHBondContact O-N 3.12Å; T236-K238 PolarHBondContact OG1-N 3.01Å; K238-I240 VanDerWaalsContact C-N 3.29Å; K238-I240 PolarHBondContact O-N 3.04Å; K238-R241 PolarHBondContact O-N 3.47Å; K238-D242 WeakPolarHBondContact O-CB 3.46Å; K238-D242 PolarHBondContact O-N 2.81Å
239	D	93.1	Very high	92.7	Very high	66 Å²	66	62 Å²	62	35%	0.353	30%	0.304	S	S	.	.	H	α-helix	trans	-62.6	-38	179.3	-56.3	-49.1	0	0	0	111.9	V235 T236 K243	V235-D239 HydrophobicContact CB-CB 4.37Å; T236-D239 WeakPolarHBondContact CB-OD2 3.27Å; T236-D239 PolarHBondContact N-OD2 3.44Å; T236-D239 PolarHBondContact O-N 3.09Å; T236-D239 PolarHBondContact OG1-N 2.84Å; T236-D239 VanDerWaalsContact OG1-N 3.14Å; T236-D239 PolarHBondContact OG1-OD2 3.02Å; D239-K243 WeakPolarHBondContact O-CG 3.37Å; D239-K243 PolarHBondContact O-N 2.88Å; D239-K243 VanDerWaalsContact O-N 3.13Å
240	I	94.4	Very high	92.5	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-45.7	175	-62.9	-166.5	0	0	0	110.5	V138 L223 I226 M227 L232 V235 T236 K238 K243 L244 M263	V138-I240 HydrophobicContact CB-CD1 4.35Å; V138-I240 HydrophobicContact CG1-CD1 4.39Å; V138-I240 HydrophobicContact CG2-CD1 3.67Å; V138-I240 HydrophobicContact CG2-CG1 4.3Å; L223-I240 HydrophobicContact CD1-CG2 3.4Å; L223-I240 VanDerWaalsContact CD1-CG2 3.4Å; I226-I240 HydrophobicContact CG2-CG2 4.22Å; M227-I240 HydrophobicContact CG-CD1 4Å; M227-I240 HydrophobicContact CG-CG2 4.48Å; L232-I240 HydrophobicContact CD2-CD1 4.11Å; V235-I240 HydrophobicContact CB-CG1 4.38Å; V235-I240 HydrophobicContact CG2-CD1 3.93Å; V235-I240 HydrophobicContact CG2-CG1 3.95Å; T236-I240 PolarHBondContact O-N 2.83Å; T236-I240 VanDerWaalsContact O-N 3.08Å; K238-I240 VanDerWaalsContact C-N 3.29Å; K238-I240 PolarHBondContact O-N 3.04Å; I240-K243 PolarHBondContact O-N 2.92Å; I240-L244 WeakPolarHBondContact O-CB 3.37Å; I240-L244 PolarHBondContact O-N 2.95Å; I240-M263 HydrophobicContact CB-SD 4.18Å; I240-M263 HydrophobicContact CD1-SD 4.09Å; I240-M263 HydrophobicContact CG2-SD 3.98Å
241	R	92.7	Very high	92.3	Very high	18 Å²	18	66.4 Å²	66.4	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-62.3	-45.9	177.2	-179.2	-179.4	60.9	-140.6	5.3	111.8	G118 D119 S237 K238 K243 L244 E245	G118-R241 PolarHBondContact O-NH1 3.23Å; D119-R241 IonicContact OD1-CZ 3.8Å; D119-R241 IonicContact OD1-NH1 3.51Å; D119-R241 PolarHBondContact OD1-NH1 2.95Å; D119-R241 IonicContact OD1-NH2 3.29Å; D119-R241 IonicContact OD2-CZ 3.59Å; D119-R241 IonicContact OD2-NH1 3.94Å; D119-R241 PolarHBondContact OD2-NH1 2.98Å; D119-R241 IonicContact OD2-NH2 2.66Å; D119-R241 PolarHBondContact OD2-NH2 3.24Å; S237-R241 WeakPolarHBondContact O-CB 3.47Å; S237-R241 PolarHBondContact O-N 3.4Å; K238-R241 PolarHBondContact O-N 3.47Å; R241-K243 VanDerWaalsContact C-N 3.28Å; R241-K243 PolarHBondContact O-N 2.98Å; R241-L244 CarbonylContact O-C 3.56Å; R241-L244 WeakPolarHBondContact O-CA 3.28Å; R241-L244 WeakPolarHBondContact O-CB 3.4Å; R241-L244 PolarHBondContact O-N 2.83Å; R241-E245 HydrophobicContact CG-CG 4.17Å; R241-E245 WeakPolarHBondContact O-CG 3.39Å; R241-E245 PolarHBondContact O-N 2.85Å
242	D	93	Very high	92.1	Very high	66 Å²	66	62.3 Å²	62.3	35%	0.353	30%	0.297	S	S	.	.	H	α-helix	trans	-60.5	-41.4	-178.6	-67.2	-5.4	0	0	0	110	K238 L244 E246	K238-D242 WeakPolarHBondContact O-CB 3.46Å; K238-D242 PolarHBondContact O-N 2.81Å; D242-L244 PolarHBondContact O-N 2.89Å; D242-E246 WeakPolarHBondContact O-CB 3.33Å; D242-E246 PolarHBondContact O-N 3.26Å
243	K	94.6	Very high	91.8	Very high	79 Å²	79	68.8 Å²	68.8	34%	0.343	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-36	171.9	-74.9	176.2	-179.9	176.8	0	113.6	I226 D239 I240 R241 R247	I226-K243 HydrophobicContact CD1-CB 4.24Å; I226-K243 HydrophobicContact CG2-CB 4.48Å; I226-K243 HydrophobicContact CG2-CD 4.4Å; D239-K243 WeakPolarHBondContact O-CG 3.37Å; D239-K243 PolarHBondContact O-N 2.88Å; D239-K243 VanDerWaalsContact O-N 3.13Å; I240-K243 PolarHBondContact O-N 2.92Å; R241-K243 VanDerWaalsContact C-N 3.28Å; R241-K243 PolarHBondContact O-N 2.98Å; K243-R247 WeakPolarHBondContact O-CG 3.4Å; K243-R247 PolarHBondContact O-N 2.78Å
244	L	95.3	Very high	91.8	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-71.2	-43	179.5	-176.6	69.8	0	0	0	111.2	I219 T222 L223 I226 I240 R241 D242 E246 R247 L248 L252 V259	I219-L244 HydrophobicContact CG2-CD2 4Å; T222-L244 HydrophobicContact CG2-CD1 3.75Å; L223-L244 HydrophobicContact CB-CD1 4.23Å; L223-L244 HydrophobicContact CB-CD2 4.47Å; L223-L244 HydrophobicContact CD1-CD2 4.34Å; I226-L244 HydrophobicContact CD1-CB 3.89Å; I226-L244 HydrophobicContact CD1-CD1 3.85Å; I226-L244 HydrophobicContact CD1-CG 4.49Å; I240-L244 WeakPolarHBondContact O-CB 3.37Å; I240-L244 PolarHBondContact O-N 2.95Å; R241-L244 CarbonylContact O-C 3.56Å; R241-L244 WeakPolarHBondContact O-CA 3.28Å; R241-L244 WeakPolarHBondContact O-CB 3.4Å; R241-L244 PolarHBondContact O-N 2.83Å; D242-L244 PolarHBondContact O-N 2.89Å; L244-E246 VanDerWaalsContact C-N 3.33Å; L244-R247 PolarHBondContact O-N 2.79Å; L244-L248 HydrophobicContact CD1-CD1 3.84Å; L244-L248 HydrophobicContact CD1-CG 4.32Å; L244-L248 HydrophobicContact CG-CD1 4.01Å; L244-L248 WeakPolarHBondContact O-CB 3.46Å; L244-L248 WeakPolarHBondContact O-CG 3.43Å; L244-L248 PolarHBondContact O-N 2.99Å; L244-L252 HydrophobicContact CB-CD1 4.07Å; L244-L252 HydrophobicContact CD2-CD1 3.38Å; L244-L252 HydrophobicContact CG-CD1 3.51Å; L244-V259 HydrophobicContact CD2-CG1 4.26Å; L244-V259 HydrophobicContact CD2-CG2 3.99Å
245	E	95	Very high	91.9	Very high	50 Å²	50	70.2 Å²	70.2	23%	0.234	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-41.4	173.4	-70.1	-169.1	150.7	0	0	111.2	R241 E249 M250 L252	R241-E245 HydrophobicContact CG-CG 4.17Å; R241-E245 WeakPolarHBondContact O-CG 3.39Å; R241-E245 PolarHBondContact O-N 2.85Å; E245-E249 WeakPolarHBondContact O-CA 3.49Å; E245-E249 PolarHBondContact O-N 2.81Å; E245-M250 WeakPolarHBondContact CB-O 3.37Å; E245-M250 WeakPolarHBondContact CG-O 3.29Å; E245-M250 PolarHBondContact O-N 3.01Å; E245-L252 HydrophobicContact CG-CB 3.84Å; E245-L252 HydrophobicContact CG-CD1 3.72Å; E245-L252 HydrophobicContact CG-CG 3.75Å; E245-L252 PolarHBondContact OE1-N 2.79Å
246	E	95	Very high	91.7	Very high	148 Å²	148	72.3 Å²	72.3	69%	0.692	34%	0.336	S	S	*	.	H	α-helix	trans	-62	-47.8	175.3	-174.9	-175.6	-178.1	0	0	111.9	D242 L244 E249	D242-E246 WeakPolarHBondContact O-CB 3.33Å; D242-E246 PolarHBondContact O-N 3.26Å; L244-E246 VanDerWaalsContact C-N 3.33Å; E246-E249 PolarHBondContact O-N 2.89Å
247	R	94.9	Very high	91.4	Very high	136 Å²	136	74.3 Å²	74.3	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-69.4	-33.8	-178.1	-75.6	-166.4	-170.8	-175.7	3.9	113.9	T222 K243 L244	T222-R247 HydrophobicContact CG2-CB 4.03Å; K243-R247 WeakPolarHBondContact O-CG 3.4Å; K243-R247 PolarHBondContact O-N 2.78Å; L244-R247 PolarHBondContact O-N 2.79Å
248	L	94.1	Very high	91.4	Very high	30 Å²	30	75.1 Å²	75.1	16%	0.157	35%	0.347	C	S	.	.	H	α-helix	trans	-89.3	-13.1	-178.9	-66.4	178.7	0	0	0	112.9	T218 I219 T222 L244 M250 L252	T218-L248 HydrophobicContact CG2-CD2 3.76Å; I219-L248 HydrophobicContact CG1-CD1 3.76Å; T222-L248 HydrophobicContact CG2-CD2 4.18Å; T222-L248 HydrophobicContact CG2-CG 4.34Å; T222-L248 WeakPolarHBondContact OG1-CD2 3.37Å; L244-L248 HydrophobicContact CD1-CD1 3.84Å; L244-L248 HydrophobicContact CD1-CG 4.32Å; L244-L248 HydrophobicContact CG-CD1 4.01Å; L244-L248 WeakPolarHBondContact O-CB 3.46Å; L244-L248 WeakPolarHBondContact O-CG 3.43Å; L244-L248 PolarHBondContact O-N 2.99Å; L248-M250 HydrophobicContact CB-CB 4.09Å; L248-M250 HydrophobicContact CB-CG 4.3Å; L248-M250 HydrophobicContact CB-SD 4.41Å; L248-M250 WeakPolarHBondContact O-CG 3.43Å; L248-M250 PolarHBondContact O-N 3.16Å; L248-L252 HydrophobicContact CD1-CD1 4.44Å
249	E	92.4	Very high	91.5	Very high	188 Å²	188	70.4 Å²	70.4	88%	0.879	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	34.5	-169.9	-57.9	-176.3	171.6	0	0	112.2	E245 E246	E245-E249 WeakPolarHBondContact O-CA 3.49Å; E245-E249 PolarHBondContact O-N 2.81Å; E246-E249 PolarHBondContact O-N 2.89Å
250	M	88.3	Confident	91.4	Very high	81 Å²	81	67.3 Å²	67.3	40%	0.399	31%	0.31	S	S	.	.	S	Bend	trans	-126.1	141.4	-174.6	-74.9	177.5	68.1	0	0	111	E245 L248 L252	E245-M250 WeakPolarHBondContact CB-O 3.37Å; E245-M250 WeakPolarHBondContact CG-O 3.29Å; E245-M250 PolarHBondContact O-N 3.01Å; L248-M250 HydrophobicContact CB-CB 4.09Å; L248-M250 HydrophobicContact CB-CG 4.3Å; L248-M250 HydrophobicContact CB-SD 4.41Å; L248-M250 WeakPolarHBondContact O-CG 3.43Å; L248-M250 PolarHBondContact O-N 3.16Å; M250-L252 HydrophobicContact CB-CD2 4.44Å; M250-L252 PolarHBondContact O-N 2.76Å
251	N	88.1	Confident	91.2	Very high	117 Å²	117	71.9 Å²	71.9	63%	0.626	33%	0.331	S	S	*	.			trans	-76.9	121.3	168.3	-171.5	-77.4	0	0	0	109.7	K253	N251-K253 WeakPolarHBondContact OD1-CB 3.16Å; N251-K253 PolarHBondContact OD1-N 2.87Å
252	L	87.8	Confident	91.2	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	33%	0.332	C	S	.	.			trans	-103.4	17.4	-175.8	-63.3	176	0	0	0	112.8	I219 L244 E245 L248 M250 E254 Y255 K256	I219-L252 HydrophobicContact CD1-CD2 3.6Å; I219-L252 HydrophobicContact CG1-CD2 3.93Å; L244-L252 HydrophobicContact CB-CD1 4.07Å; L244-L252 HydrophobicContact CD2-CD1 3.38Å; L244-L252 HydrophobicContact CG-CD1 3.51Å; E245-L252 HydrophobicContact CG-CB 3.84Å; E245-L252 HydrophobicContact CG-CD1 3.72Å; E245-L252 HydrophobicContact CG-CG 3.75Å; E245-L252 PolarHBondContact OE1-N 2.79Å; L248-L252 HydrophobicContact CD1-CD1 4.44Å; M250-L252 HydrophobicContact CB-CD2 4.44Å; M250-L252 PolarHBondContact O-N 2.76Å; L252-E254 PolarHBondContact O-N 2.76Å; L252-Y255 HydrophobicContact CD2-CD2 4.01Å; L252-Y255 HydrophobicContact CD2-CG 4.37Å; L252-Y255 CarbonylContact O-C 3.5Å; L252-Y255 WeakPolarHBondContact O-CA 2.97Å; L252-Y255 PolarHBondContact O-N 3.44Å; L252-K256 PolarHBondContact O-N 2.82Å; L252-K256 VanDerWaalsContact O-N 3.16Å
253	K	86.5	Confident	91.2	Very high	153 Å²	153	68.7 Å²	68.7	67%	0.665	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-56.3	-36.7	-179.2	-172.8	179.3	178.7	-175	0	112.8	N251 Y255 K256	N251-K253 WeakPolarHBondContact OD1-CB 3.16Å; N251-K253 PolarHBondContact OD1-N 2.87Å; K253-Y255 VanDerWaalsContact C-N 3.32Å; K253-K256 WeakPolarHBondContact O-CG 3.43Å
254	E	87.5	Confident	91	Very high	162 Å²	162	65.4 Å²	65.4	76%	0.757	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-78.5	-16.3	177.1	-61.3	-172.9	170.6	0	0	113.5	L252	L252-E254 PolarHBondContact O-N 2.76Å
255	Y	89.9	Confident	90.7	Very high	31 Å²	31	67.1 Å²	67.1	12%	0.122	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-101.8	3.4	-178.1	-63.5	-86.5	0	0	0	112.9	R212 A215 E216 I219 L252 K253 E257 F258 V259	R212-Y255 HydrophobicContact CG-CE1 4.08Å; A215-Y255 HydrophobicContact CB-CE1 4.31Å; E216-Y255 HydrophobicContact CG-CD1 4.24Å; E216-Y255 HydrophobicContact CG-CE1 4.07Å; I219-Y255 HydrophobicContact CD1-CD1 3.66Å; I219-Y255 HydrophobicContact CD1-CD2 4.14Å; I219-Y255 HydrophobicContact CD1-CE1 4.09Å; I219-Y255 HydrophobicContact CD1-CG 3.68Å; L252-Y255 HydrophobicContact CD2-CD2 4.01Å; L252-Y255 HydrophobicContact CD2-CG 4.37Å; L252-Y255 CarbonylContact O-C 3.5Å; L252-Y255 WeakPolarHBondContact O-CA 2.97Å; L252-Y255 PolarHBondContact O-N 3.44Å; K253-Y255 VanDerWaalsContact C-N 3.32Å; Y255-E257 PolarHBondContact O-N 3.13Å; Y255-F258 CarbonylContact O-C 3.53Å; Y255-F258 WeakPolarHBondContact O-CA 3.49Å; Y255-F258 WeakPolarHBondContact O-CB 3.32Å; Y255-F258 PolarHBondContact O-N 2.97Å; Y255-V259 WeakPolarHBondContact O-CG2 3Å; Y255-V259 PolarHBondContact O-N 3.26Å
256	K	88.9	Confident	90.5	Very high	58 Å²	58	65 Å²	65	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-48.6	-51.5	-177.8	-78.1	-174.9	169.2	-151.1	0	113.8	D119 L252 K253 F258 V259 D260	D119-K256 WeakPolarHBondContact OD1-CD 3.39Å; D119-K256 VanDerWaalsContact OD1-CE 3.29Å; D119-K256 WeakPolarHBondContact OD1-CE 3.26Å; D119-K256 IonicContact OD1-NZ 3.78Å; D119-K256 PolarHBondContact OD1-NZ 3.12Å; D119-K256 IonicContact OD2-NZ 3.54Å; D119-K256 PolarHBondContact OD2-NZ 2.89Å; L252-K256 PolarHBondContact O-N 2.82Å; L252-K256 VanDerWaalsContact O-N 3.16Å; K253-K256 WeakPolarHBondContact O-CG 3.43Å; K256-F258 VanDerWaalsContact C-N 3.32Å; K256-F258 PolarHBondContact O-N 2.73Å; K256-V259 PolarHBondContact O-N 3.35Å; K256-D260 PolarHBondContact O-N 2.8Å
257	E	87	Confident	90.3	Very high	70 Å²	70	58.2 Å²	58.2	33%	0.327	27%	0.27	S	S	.	.	H	α-helix	trans	-64.4	-37.4	179	-176.6	175.4	-177.8	0	0	112	Y255 Q261	Y255-E257 PolarHBondContact O-N 3.13Å; E257-Q261 WeakPolarHBondContact O-CB 3.33Å; E257-Q261 VanDerWaalsContact O-CG 3.26Å; E257-Q261 WeakPolarHBondContact O-CG 3.47Å; E257-Q261 PolarHBondContact O-N 3.22Å; E257-Q261 PolarHBondContact OE1-NE2 3.48Å
258	F	90.7	Very high	89.8	Confident	22 Å²	22	51.9 Å²	51.9	10%	0.096	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-44.3	176.6	172.8	-101.5	0	0	0	111.6	E216 I219 Y255 K256 D260 Q261 E262	E216-F258 HydrophobicContact CB-CE1 3.85Å; E216-F258 HydrophobicContact CB-CE2 4.09Å; E216-F258 HydrophobicContact CB-CZ 3.62Å; E216-F258 HydrophobicContact CG-CD1 4.02Å; E216-F258 HydrophobicContact CG-CD2 4.14Å; E216-F258 HydrophobicContact CG-CE1 3.87Å; E216-F258 HydrophobicContact CG-CE2 4Å; E216-F258 HydrophobicContact CG-CG 4.16Å; E216-F258 HydrophobicContact CG-CZ 3.87Å; E216-F258 WeakPolarHBondContact O-CZ 3.28Å; I219-F258 HydrophobicContact CB-CE1 4.11Å; I219-F258 HydrophobicContact CG2-CD1 4.05Å; I219-F258 HydrophobicContact CG2-CE1 3.7Å; Y255-F258 CarbonylContact O-C 3.53Å; Y255-F258 WeakPolarHBondContact O-CA 3.49Å; Y255-F258 WeakPolarHBondContact O-CB 3.32Å; Y255-F258 PolarHBondContact O-N 2.97Å; K256-F258 VanDerWaalsContact C-N 3.32Å; K256-F258 PolarHBondContact O-N 2.73Å; F258-D260 PolarHBondContact O-N 2.78Å; F258-Q261 PolarHBondContact O-N 3.37Å; F258-E262 HydrophobicContact CZ-CB 4.45Å; F258-E262 HydrophobicContact CZ-CG 4.42Å; F258-E262 WeakPolarHBondContact CZ-OE2 3.41Å; F258-E262 VanDerWaalsContact O-CB 3.27Å; F258-E262 WeakPolarHBondContact O-CB 3.38Å; F258-E262 PolarHBondContact O-N 3.49Å
259	V	93.1	Very high	89.5	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-45.6	178	172.6	0	0	0	0	110.6	I219 L223 L244 Y255 K256 E262 M263	I219-V259 HydrophobicContact CG2-CG2 4Å; L223-V259 HydrophobicContact CD1-CG1 4.47Å; L223-V259 HydrophobicContact CD2-CG1 4.35Å; L244-V259 HydrophobicContact CD2-CG1 4.26Å; L244-V259 HydrophobicContact CD2-CG2 3.99Å; Y255-V259 WeakPolarHBondContact O-CG2 3Å; Y255-V259 PolarHBondContact O-N 3.26Å; K256-V259 PolarHBondContact O-N 3.35Å; V259-E262 PolarHBondContact O-N 3.23Å; V259-M263 HydrophobicContact CG1-CE 4.08Å; V259-M263 WeakPolarHBondContact O-CB 3.45Å; V259-M263 WeakPolarHBondContact O-CG 3.4Å; V259-M263 PolarHBondContact O-N 3.46Å
260	D	89.9	Confident	89.1	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.011	22%	0.223	C	C	.	.	H	α-helix	trans	-60.9	-45.5	176.7	-95.9	17.2	0	0	0	112.5	L116 G118 D119 G120 K256 F258 M263 L264	L116-D260 HydrophobicContact CB-CB 4.18Å; L116-D260 HydrophobicContact CD1-CB 3.78Å; G118-D260 VanDerWaalsContact C-CG 3.49Å; G118-D260 VanDerWaalsContact CA-CG 3.43Å; G118-D260 WeakPolarHBondContact CA-OD2 3.4Å; G118-D260 PolarHBondContact N-OD2 3.13Å; D119-D260 PolarHBondContact N-OD2 3.18Å; G120-D260 PolarHBondContact N-OD1 2.96Å; G120-D260 PolarHBondContact N-OD2 2.81Å; G120-D260 VanDerWaalsContact N-OD2 3.13Å; K256-D260 PolarHBondContact O-N 2.8Å; F258-D260 PolarHBondContact O-N 2.78Å; D260-M263 HydrophobicContact CB-CE 4.42Å; D260-M263 PolarHBondContact O-N 2.83Å; D260-M263 WeakPolarHBondContact OD1-CE 3.39Å; D260-L264 PolarHBondContact O-N 3.2Å
261	Q	89.5	Confident	88.8	Confident	97 Å²	97	47.6 Å²	47.6	45%	0.453	23%	0.23	S	C	.	.	H	α-helix	trans	-64.3	-43.7	176.6	-72.9	172.9	8.1	0	0	111.8	E257 F258 M263 L264 V265	E257-Q261 WeakPolarHBondContact O-CB 3.33Å; E257-Q261 VanDerWaalsContact O-CG 3.26Å; E257-Q261 WeakPolarHBondContact O-CG 3.47Å; E257-Q261 PolarHBondContact O-N 3.22Å; E257-Q261 PolarHBondContact OE1-NE2 3.48Å; F258-Q261 PolarHBondContact O-N 3.37Å; Q261-M263 VanDerWaalsContact C-N 3.34Å; Q261-M263 PolarHBondContact O-N 3.01Å; Q261-L264 WeakPolarHBondContact O-CB 3.36Å; Q261-L264 PolarHBondContact O-N 2.96Å; Q261-V265 WeakPolarHBondContact O-CG2 3.26Å; Q261-V265 PolarHBondContact O-N 3.46Å; Q261-V265 VanDerWaalsContact O-N 3.09Å
262	E	93.2	Very high	88.8	Confident	17 Å²	17	49.9 Å²	49.9	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-68.7	-33.5	180	-164.3	71.5	-140.5	0	0	111.4	R220 L223 F258 V259 L264 V265 I266	R220-E262 HydrophobicContact CB-CG 4.23Å; R220-E262 VanDerWaalsContact CD-OE1 3.27Å; R220-E262 WeakPolarHBondContact CD-OE1 3.38Å; R220-E262 HydrophobicContact CG-CG 4.06Å; R220-E262 VanDerWaalsContact CG-OE1 3.32Å; R220-E262 WeakPolarHBondContact CG-OE1 3.48Å; R220-E262 IonicContact CZ-OE1 2.86Å; R220-E262 IonicContact CZ-OE2 2.63Å; R220-E262 IonicContact NE-OE1 3.36Å; R220-E262 PolarHBondContact NE-OE1 2.93Å; R220-E262 IonicContact NE-OE2 3.56Å; R220-E262 PolarHBondContact NE-OE2 3.14Å; R220-E262 IonicContact NH2-OE2 3.31Å; R220-E262 PolarHBondContact NH2-OE2 3.14Å; L223-E262 HydrophobicContact CD2-CB 3.9Å; L223-E262 HydrophobicContact CD2-CG 3.99Å; F258-E262 HydrophobicContact CZ-CB 4.45Å; F258-E262 HydrophobicContact CZ-CG 4.42Å; F258-E262 WeakPolarHBondContact CZ-OE2 3.41Å; F258-E262 VanDerWaalsContact O-CB 3.27Å; F258-E262 WeakPolarHBondContact O-CB 3.38Å; F258-E262 PolarHBondContact O-N 3.49Å; V259-E262 PolarHBondContact O-N 3.23Å; E262-L264 VanDerWaalsContact C-N 3.33Å; E262-L264 PolarHBondContact O-N 3.46Å; E262-V265 WeakPolarHBondContact O-CB 3.24Å; E262-V265 PolarHBondContact O-N 2.96Å; E262-I266 HydrophobicContact CG-CD1 4.14Å; E262-I266 VanDerWaalsContact O-CG1 3.31Å; E262-I266 WeakPolarHBondContact O-CG1 3.2Å; E262-I266 PolarHBondContact O-N 2.85Å
263	M	93.1	Very high	89	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-44.5	170.7	-79.4	-169.9	-68.1	0	0	111.6	V138 L223 M227 I240 V259 D260 Q261 V265 I266 L267	V138-M263 HydrophobicContact CG2-SD 4.46Å; L223-M263 HydrophobicContact CD1-CG 3.93Å; L223-M263 HydrophobicContact CD2-CG 3.92Å; L223-M263 HydrophobicContact CG-CG 4.34Å; M227-M263 HydrophobicContact CE-CB 4.14Å; M227-M263 HydrophobicContact CE-CG 4.18Å; M227-M263 HydrophobicContact SD-CB 4.17Å; M227-M263 HydrophobicContact SD-CG 3.74Å; I240-M263 HydrophobicContact CB-SD 4.18Å; I240-M263 HydrophobicContact CD1-SD 4.09Å; I240-M263 HydrophobicContact CG2-SD 3.98Å; V259-M263 HydrophobicContact CG1-CE 4.08Å; V259-M263 WeakPolarHBondContact O-CB 3.45Å; V259-M263 WeakPolarHBondContact O-CG 3.4Å; V259-M263 PolarHBondContact O-N 3.46Å; D260-M263 HydrophobicContact CB-CE 4.42Å; D260-M263 PolarHBondContact O-N 2.83Å; D260-M263 WeakPolarHBondContact OD1-CE 3.39Å; Q261-M263 VanDerWaalsContact C-N 3.34Å; Q261-M263 PolarHBondContact O-N 3.01Å; M263-V265 VanDerWaalsContact C-N 3.32Å; M263-V265 PolarHBondContact O-N 3.18Å; M263-I266 PolarHBondContact O-N 2.78Å; M263-L267 WeakPolarHBondContact O-CB 3.28Å; M263-L267 WeakPolarHBondContact O-CD1 3.36Å; M263-L267 VanDerWaalsContact O-CG 3.28Å; M263-L267 WeakPolarHBondContact O-CG 3.49Å; M263-L267 PolarHBondContact O-N 2.86Å
264	L	90.4	Very high	89.4	Confident	9 Å²	9	46.3 Å²	46.3	5%	0.047	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-40.1	175.3	-64	178.8	0	0	0	111.8	L116 M141 W142 Y145 D260 Q261 E262 L267 G268	L116-L264 HydrophobicContact CD1-CD1 3.5Å; L116-L264 HydrophobicContact CD1-CD2 4.29Å; L116-L264 HydrophobicContact CD1-CG 3.84Å; L116-L264 HydrophobicContact CG-CD1 4.33Å; M141-L264 HydrophobicContact CE-CD2 4.08Å; W142-L264 HydrophobicContact CE3-CB 4.42Å; W142-L264 HydrophobicContact CE3-CD2 3.61Å; W142-L264 HydrophobicContact CZ3-CB 4.12Å; W142-L264 HydrophobicContact CZ3-CD2 4.07Å; Y145-L264 HydrophobicContact CD1-CD1 3.76Å; Y145-L264 HydrophobicContact CD1-CD2 4.13Å; Y145-L264 HydrophobicContact CD2-CD1 4.38Å; Y145-L264 HydrophobicContact CE1-CD1 3.46Å; Y145-L264 VanDerWaalsContact CE1-CD1 3.46Å; Y145-L264 HydrophobicContact CE2-CD1 4.14Å; Y145-L264 HydrophobicContact CG-CD1 4.21Å; Y145-L264 HydrophobicContact CG-CD2 4.27Å; D260-L264 PolarHBondContact O-N 3.2Å; Q261-L264 WeakPolarHBondContact O-CB 3.36Å; Q261-L264 PolarHBondContact O-N 2.96Å; E262-L264 VanDerWaalsContact C-N 3.33Å; E262-L264 PolarHBondContact O-N 3.46Å; L264-L267 PolarHBondContact O-N 3.06Å; L264-G268 PolarHBondContact O-N 3.08Å
265	V	89.5	Confident	89.7	Confident	37 Å²	37	44 Å²	44	22%	0.224	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-49.3	176.4	176.1	0	0	0	0	110.6	Q261 E262 M263 G268 Q269 W286	Q261-V265 WeakPolarHBondContact O-CG2 3.26Å; Q261-V265 PolarHBondContact O-N 3.46Å; Q261-V265 VanDerWaalsContact O-N 3.09Å; E262-V265 WeakPolarHBondContact O-CB 3.24Å; E262-V265 PolarHBondContact O-N 2.96Å; M263-V265 VanDerWaalsContact C-N 3.32Å; M263-V265 PolarHBondContact O-N 3.18Å; V265-G268 PolarHBondContact O-N 2.86Å; V265-Q269 HydrophobicContact CG1-CG 4.46Å; V265-Q269 WeakPolarHBondContact O-CB 3.39Å; V265-Q269 VanDerWaalsContact O-CG 3.25Å; V265-Q269 WeakPolarHBondContact O-CG 3.16Å; V265-Q269 PolarHBondContact O-N 2.94Å; V265-W286 VanDerWaalsContact CA-CZ3 3.49Å; V265-W286 HydrophobicContact CB-CZ3 4.02Å; V265-W286 HydrophobicContact CG1-CE3 4.43Å; V265-W286 HydrophobicContact CG1-CZ3 4.25Å; V265-W286 HydrophobicContact CG2-CZ3 3.82Å
266	I	91.4	Very high	90	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-46.1	179.8	-67.6	160.9	0	0	0	110.2	L223 K224 M227 E262 M263 G268 Q269 M270	L223-I266 HydrophobicContact CB-CD1 4.18Å; L223-I266 HydrophobicContact CD2-CD1 3.73Å; L223-I266 HydrophobicContact CG-CD1 3.65Å; K224-I266 HydrophobicContact CB-CD1 4.09Å; K224-I266 HydrophobicContact CB-CG1 4.46Å; M227-I266 HydrophobicContact CB-CG2 4.13Å; M227-I266 HydrophobicContact CE-CB 4.18Å; M227-I266 HydrophobicContact CE-CG2 4Å; M227-I266 HydrophobicContact SD-CB 3.86Å; M227-I266 HydrophobicContact SD-CD1 3.75Å; M227-I266 HydrophobicContact SD-CG1 4.43Å; M227-I266 HydrophobicContact SD-CG2 3.72Å; E262-I266 HydrophobicContact CG-CD1 4.14Å; E262-I266 VanDerWaalsContact O-CG1 3.31Å; E262-I266 WeakPolarHBondContact O-CG1 3.2Å; E262-I266 PolarHBondContact O-N 2.85Å; M263-I266 PolarHBondContact O-N 2.78Å; I266-G268 PolarHBondContact O-N 3.4Å; I266-Q269 CarbonylContact O-C 3.59Å; I266-Q269 PolarHBondContact O-N 3.48Å; I266-M270 HydrophobicContact CG2-CG 4.34Å; I266-M270 HydrophobicContact CG2-SD 4.17Å; I266-M270 VanDerWaalsContact O-CG 3.28Å; I266-M270 WeakPolarHBondContact O-CG 3.49Å; I266-M270 PolarHBondContact O-N 3.35Å
267	L	89.7	Confident	90.2	Very high	6 Å²	6	48.4 Å²	48.4	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-48.5	176.3	-79.1	160	0	0	0	111.9	V138 W142 M227 L232 M263 L264 Q269 M270	V138-L267 HydrophobicContact CG1-CD1 3.6Å; V138-L267 HydrophobicContact CG1-CD2 4.25Å; V138-L267 HydrophobicContact CG1-CG 4.31Å; W142-L267 HydrophobicContact CB-CD1 3.74Å; W142-L267 HydrophobicContact CD2-CB 4Å; W142-L267 HydrophobicContact CD2-CD1 4.4Å; W142-L267 HydrophobicContact CE3-CB 4.21Å; W142-L267 HydrophobicContact CE3-CD1 4.44Å; W142-L267 HydrophobicContact CG-CB 4.24Å; W142-L267 HydrophobicContact CG-CD1 4.16Å; M227-L267 HydrophobicContact CE-CD1 4.28Å; M227-L267 HydrophobicContact CE-CD2 4.22Å; M227-L267 HydrophobicContact CE-CG 3.74Å; L232-L267 HydrophobicContact CD1-CD2 3.82Å; M263-L267 WeakPolarHBondContact O-CB 3.28Å; M263-L267 WeakPolarHBondContact O-CD1 3.36Å; M263-L267 VanDerWaalsContact O-CG 3.28Å; M263-L267 WeakPolarHBondContact O-CG 3.49Å; M263-L267 PolarHBondContact O-N 2.86Å; L264-L267 PolarHBondContact O-N 3.06Å; L267-Q269 PolarHBondContact O-N 3.04Å; L267-M270 PolarHBondContact O-N 3.42Å
268	G	85.6	Confident	90.5	Very high	3 Å²	3	50.4 Å²	50.4	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-34.6	176.6	0	0	0	0	0	112.8	L264 V265 I266 W286	L264-G268 PolarHBondContact O-N 3.08Å; V265-G268 PolarHBondContact O-N 2.86Å; I266-G268 PolarHBondContact O-N 3.4Å; G268-W286 WeakPolarHBondContact O-CB 3.42Å
269	Q	86.5	Confident	90.6	Very high	28 Å²	28	54 Å²	54	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-80.5	-11.9	179.3	-72.1	-179.4	-2.9	0	0	114.4	V265 I266 L267 W286 S289 N290	V265-Q269 HydrophobicContact CG1-CG 4.46Å; V265-Q269 WeakPolarHBondContact O-CB 3.39Å; V265-Q269 VanDerWaalsContact O-CG 3.25Å; V265-Q269 WeakPolarHBondContact O-CG 3.16Å; V265-Q269 PolarHBondContact O-N 2.94Å; I266-Q269 CarbonylContact O-C 3.59Å; I266-Q269 PolarHBondContact O-N 3.48Å; L267-Q269 PolarHBondContact O-N 3.04Å; Q269-W286 HydrophobicContact CG-CB 4.33Å; Q269-W286 WeakPolarHBondContact CG-O 3Å; Q269-S289 PolarHBondContact NE2-OG 2.77Å; Q269-N290 HydrophobicContact CG-CB 4.04Å
270	M	84.8	Confident	90.8	Very high	79 Å²	79	56.2 Å²	56.2	39%	0.389	29%	0.287	S	S	.	.	H	α-helix	trans	-76.4	-25.1	179.6	-77.6	175.7	76.8	0	0	112.9	L232 I266 L267 K272	L232-M270 HydrophobicContact CD1-CE 3.75Å; L232-M270 HydrophobicContact CD1-SD 3.76Å; I266-M270 HydrophobicContact CG2-CG 4.34Å; I266-M270 HydrophobicContact CG2-SD 4.17Å; I266-M270 VanDerWaalsContact O-CG 3.28Å; I266-M270 WeakPolarHBondContact O-CG 3.49Å; I266-M270 PolarHBondContact O-N 3.35Å; L267-M270 PolarHBondContact O-N 3.42Å; M270-K272 PolarHBondContact O-N 3.35Å
271	D	82	Confident	91.1	Very high	103 Å²	103	59.5 Å²	59.5	55%	0.551	30%	0.3	S	S	*	.	S	Bend	trans	-75.1	106.5	172.9	-82	-26.6	0	0	0	110.1	N287	D271-N287 PolarHBondContact O-ND2 3.36Å
272	K	87.5	Confident	91.4	Very high	165 Å²	165	60.4 Å²	60.4	72%	0.717	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-64.2	145.5	-178	-66.6	-173.6	179.8	-174.4	0	111.8	M270	M270-K272 PolarHBondContact O-N 3.35Å
273	P	92.5	Very high	91.5	Very high	20 Å²	20	61.8 Å²	61.8	13%	0.13	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-65.4	144.3	173.7	30	-34.4	0	0	0	109.9	Q275 Y281 L282 N287 E293	P273-Q275 PolarHBondContact O-N 3.3Å; P273-Y281 HydrophobicContact CB-CD1 4.31Å; P273-Y281 HydrophobicContact CG-CD1 4.05Å; P273-L282 CarbonylContact C-O 3.57Å; P273-L282 VanDerWaalsContact CA-O 3.32Å; P273-L282 WeakPolarHBondContact CA-O 3.43Å; P273-L282 WeakPolarHBondContact CB-O 3.4Å; P273-N287 HydrophobicContact CB-CB 4.41Å; P273-N287 WeakPolarHBondContact CD-ND2 3.44Å; P273-E293 WeakPolarHBondContact CD-OE1 3.32Å; P273-E293 WeakPolarHBondContact CD-OE2 3.29Å
274	S	94.2	Very high	91.4	Very high	57 Å²	57	65.3 Å²	65.3	40%	0.399	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.8	175.9	-69.2	0	0	0	0	110.1	V276 Y281 L282	S274-V276 PolarHBondContact O-N 3.08Å; S274-Y281 CarbonylContact O-C 3.6Å; S274-Y281 WeakPolarHBondContact O-CA 3.44Å; S274-L282 PolarHBondContact N-O 3.24Å; S274-L282 PolarHBondContact O-N 3.24Å
275	Q	95	Very high	91.4	Very high	114 Å²	114	69.3 Å²	69.3	53%	0.533	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	105.9	172.8	-168	176.1	26.6	0	0	109.7	P273 F277 Y281	P273-Q275 PolarHBondContact O-N 3.3Å; Q275-F277 VanDerWaalsContact CG-O 3.24Å; Q275-F277 WeakPolarHBondContact CG-O 3.24Å; Q275-Y281 HydrophobicContact CB-CD1 3.91Å; Q275-Y281 HydrophobicContact CB-CE1 3.7Å; Q275-Y281 HydrophobicContact CG-CD1 4.17Å; Q275-Y281 HydrophobicContact CG-CE1 3.76Å; Q275-Y281 PolarHBondContact NE2-OH 3.07Å
276	V	95.6	Very high	91.5	Very high	77 Å²	77	70.6 Å²	70.6	47%	0.467	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-43.3	178.7	-176.9	0	0	0	0	110.2	S274 L280 L282	S274-V276 PolarHBondContact O-N 3.08Å; V276-L280 HydrophobicContact CB-CD2 4.37Å; V276-L280 HydrophobicContact CB-CG 4.48Å; V276-L280 PolarHBondContact N-O 2.91Å; V276-L282 HydrophobicContact CG2-CB 3.98Å
277	F	93.9	Very high	91.5	Very high	105 Å²	105	70.8 Å²	70.8	46%	0.461	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	165	172.8	-62.5	-66.8	0	0	0	109.4	Q275 Y279 L280	Q275-F277 VanDerWaalsContact CG-O 3.24Å; Q275-F277 WeakPolarHBondContact CG-O 3.24Å; F277-Y279 HydrophobicContact CB-CD1 3.96Å; F277-Y279 HydrophobicContact CB-CE1 3.6Å; F277-Y279 HydrophobicContact CG-CE1 4.11Å; F277-Y279 PolarHBondContact O-N 3.42Å; F277-L280 HydrophobicContact CB-CB 4.11Å; F277-L280 HydrophobicContact CD2-CB 4.19Å; F277-L280 HydrophobicContact CD2-CD2 3.95Å; F277-L280 HydrophobicContact CE2-CD2 4.46Å; F277-L280 PolarHBondContact N-O 2.95Å; F277-L280 VanDerWaalsContact N-O 3.16Å; F277-L280 PolarHBondContact O-N 3.44Å; F277-L280 VanDerWaalsContact O-O 3.06Å
278	P	92.8	Very high	91.7	Very high	111 Å²	111	71.6 Å²	71.6	72%	0.721	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-29.8	176.4	-30.5	37.1	0	0	0	114.7
279	Y	93	Very high	92	Very high	98 Å²	98	72.6 Å²	72.6	38%	0.384	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	5.3	-178.9	61.7	-87.7	0	0	0	113.8	F277 I343 K347	F277-Y279 HydrophobicContact CB-CD1 3.96Å; F277-Y279 HydrophobicContact CB-CE1 3.6Å; F277-Y279 HydrophobicContact CG-CE1 4.11Å; F277-Y279 PolarHBondContact O-N 3.42Å; Y279-I343 HydrophobicContact CD2-CG2 4.48Å; Y279-I343 HydrophobicContact CE2-CG2 4.01Å; Y279-K347 HydrophobicContact CD1-CD 4.21Å; Y279-K347 HydrophobicContact CD1-CG 4.08Å; Y279-K347 HydrophobicContact CD2-CB 3.88Å; Y279-K347 HydrophobicContact CD2-CD 4.27Å; Y279-K347 HydrophobicContact CD2-CG 4Å; Y279-K347 HydrophobicContact CE1-CD 3.92Å; Y279-K347 HydrophobicContact CE1-CG 4.3Å; Y279-K347 HydrophobicContact CE2-CB 4.18Å; Y279-K347 HydrophobicContact CE2-CD 3.95Å; Y279-K347 HydrophobicContact CE2-CG 4.19Å; Y279-K347 HydrophobicContact CG-CB 4.22Å; Y279-K347 HydrophobicContact CG-CD 4.4Å; Y279-K347 HydrophobicContact CG-CG 3.94Å
280	L	96	Very high	92.2	Very high	49 Å²	49	72 Å²	72	26%	0.257	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	115.5	-174.3	-175.5	65	0	0	0	111.5	V276 F277 I343	V276-L280 HydrophobicContact CB-CD2 4.37Å; V276-L280 HydrophobicContact CB-CG 4.48Å; V276-L280 PolarHBondContact N-O 2.91Å; F277-L280 HydrophobicContact CB-CB 4.11Å; F277-L280 HydrophobicContact CD2-CB 4.19Å; F277-L280 HydrophobicContact CD2-CD2 3.95Å; F277-L280 HydrophobicContact CE2-CD2 4.46Å; F277-L280 PolarHBondContact N-O 2.95Å; F277-L280 VanDerWaalsContact N-O 3.16Å; F277-L280 PolarHBondContact O-N 3.44Å; F277-L280 VanDerWaalsContact O-O 3.06Å; L280-I343 HydrophobicContact CD1-CD1 4.48Å; L280-I343 HydrophobicContact CD1-CG1 4.45Å; L280-I343 HydrophobicContact CD1-CG2 4.41Å
281	Y	97.1	Very high	92.5	Very high	71 Å²	71	73.3 Å²	73.3	28%	0.278	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	142.1	171.1	-67.3	-92.3	0	0	0	110.1	P273 S274 Q275 N297	P273-Y281 HydrophobicContact CB-CD1 4.31Å; P273-Y281 HydrophobicContact CG-CD1 4.05Å; S274-Y281 CarbonylContact O-C 3.6Å; S274-Y281 WeakPolarHBondContact O-CA 3.44Å; Q275-Y281 HydrophobicContact CB-CD1 3.91Å; Q275-Y281 HydrophobicContact CB-CE1 3.7Å; Q275-Y281 HydrophobicContact CG-CD1 4.17Å; Q275-Y281 HydrophobicContact CG-CE1 3.76Å; Q275-Y281 PolarHBondContact NE2-OH 3.07Å; Y281-N297 HydrophobicContact CE2-CB 4.05Å
282	L	96.4	Very high	92.9	Very high	116 Å²	116	72.5 Å²	72.5	61%	0.607	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.9	168	-179	66.3	0	0	0	107.9	P273 S274 V276	P273-L282 CarbonylContact C-O 3.57Å; P273-L282 VanDerWaalsContact CA-O 3.32Å; P273-L282 WeakPolarHBondContact CA-O 3.43Å; P273-L282 WeakPolarHBondContact CB-O 3.4Å; S274-L282 PolarHBondContact N-O 3.24Å; S274-L282 PolarHBondContact O-N 3.24Å; V276-L282 HydrophobicContact CG2-CB 3.98Å
283	G	94	Very high	93.1	Very high	46 Å²	46	66 Å²	66	47%	0.474	35%	0.349	S	S	.	.			trans	-146.7	178.1	-177.6	0	0	0	0	0	112	N287	G283-N287 WeakPolarHBondContact CA-OD1 3.36Å
284	T	91.3	Very high	93.2	Very high	74 Å²	74	65.8 Å²	65.8	45%	0.454	35%	0.346	S	S	.	.			trans	-96.9	179.2	177.9	67.7	0	0	0	0	111.3	W286 N287 A288	T284-W286 PolarHBondContact O-N 3.2Å; T284-W286 PolarHBondContact OG1-N 3.34Å; T284-N287 PolarHBondContact N-OD1 3.38Å; T284-N287 PolarHBondContact O-N 3.07Å; T284-N287 PolarHBondContact OG1-OD1 3.45Å; T284-A288 PolarHBondContact O-N 3.38Å; T284-A288 VanDerWaalsContact O-N 3.11Å
285	E	91.4	Very high	93.1	Very high	92 Å²	92	69.1 Å²	69.1	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-56.8	-31.6	169.6	65.7	179.4	177.4	0	0	112.6	A288 S289 V309	E285-A288 PolarHBondContact O-N 3.16Å; E285-S289 PolarHBondContact O-N 2.9Å; E285-S289 PolarHBondContact O-OG 3.04Å; E285-V309 HydrophobicContact CB-CG1 3.87Å; E285-V309 HydrophobicContact CB-CG2 4.17Å; E285-V309 VanDerWaalsContact OE2-CG2 3.28Å; E285-V309 WeakPolarHBondContact OE2-CG2 3.19Å
286	W	90.2	Very high	93	Very high	64 Å²	64	71.1 Å²	71.1	24%	0.242	36%	0.362	C	S	.	.	H	α-helix	trans	-68.1	-43.6	179.5	-59.6	103.3	0	0	0	111	W142 V265 G268 Q269 T284 A288 S289 N290	W142-W286 AromaticContact CH2-CE2 3.96Å; W142-W286 HydrophobicContact CH2-CZ2 4.05Å; W142-W286 AromaticContact CH2-NE1 3.95Å; W142-W286 HydrophobicContact CZ3-CZ2 4.43Å; V265-W286 VanDerWaalsContact CA-CZ3 3.49Å; V265-W286 HydrophobicContact CB-CZ3 4.02Å; V265-W286 HydrophobicContact CG1-CE3 4.43Å; V265-W286 HydrophobicContact CG1-CZ3 4.25Å; V265-W286 HydrophobicContact CG2-CZ3 3.82Å; G268-W286 WeakPolarHBondContact O-CB 3.42Å; Q269-W286 HydrophobicContact CG-CB 4.33Å; Q269-W286 WeakPolarHBondContact CG-O 3Å; T284-W286 PolarHBondContact O-N 3.2Å; T284-W286 PolarHBondContact OG1-N 3.34Å; W286-A288 VanDerWaalsContact C-N 3.31Å; W286-A288 PolarHBondContact O-N 2.63Å; W286-S289 PolarHBondContact O-N 3.1Å; W286-S289 PolarHBondContact O-OG 3.34Å; W286-N290 PolarHBondContact O-N 3.4Å
287	N	92.4	Very high	92.9	Very high	9 Å²	9	69.3 Å²	69.3	5%	0.048	35%	0.35	C	S	.	.	H	α-helix	trans	-61.5	-41.7	172.9	-56.1	115.7	0	0	0	111.4	D271 P273 G283 T284 S289 N290 E293	D271-N287 PolarHBondContact O-ND2 3.36Å; P273-N287 HydrophobicContact CB-CB 4.41Å; P273-N287 WeakPolarHBondContact CD-ND2 3.44Å; G283-N287 WeakPolarHBondContact CA-OD1 3.36Å; T284-N287 PolarHBondContact N-OD1 3.38Å; T284-N287 PolarHBondContact O-N 3.07Å; T284-N287 PolarHBondContact OG1-OD1 3.45Å; N287-S289 PolarHBondContact O-N 2.9Å; N287-N290 PolarHBondContact O-N 3.37Å; N287-N290 VanDerWaalsContact O-N 3.13Å; N287-E293 PolarHBondContact ND2-OE2 3.42Å
288	A	93.4	Very high	92.9	Very high	23 Å²	23	71 Å²	71	19%	0.19	36%	0.364	C	S	.	.	H	α-helix	trans	-66.6	-22.4	179.1	0	0	0	0	0	113.7	T284 E285 W286 F312	T284-A288 PolarHBondContact O-N 3.38Å; T284-A288 VanDerWaalsContact O-N 3.11Å; E285-A288 PolarHBondContact O-N 3.16Å; W286-A288 VanDerWaalsContact C-N 3.31Å; W286-A288 PolarHBondContact O-N 2.63Å; A288-F312 HydrophobicContact CB-CD2 3.9Å; A288-F312 HydrophobicContact CB-CE2 4.25Å; A288-F312 WeakPolarHBondContact O-CB 3.46Å
289	S	91.6	Very high	93	Very high	24 Å²	24	67.1 Å²	67.1	17%	0.168	34%	0.338	C	S	.	.	H	α-helix	trans	-89.2	-6.8	174.9	69.4	0	0	0	0	113.8	Q269 E285 W286 N287 W291 F313	Q269-S289 PolarHBondContact NE2-OG 2.77Å; E285-S289 PolarHBondContact O-N 2.9Å; E285-S289 PolarHBondContact O-OG 3.04Å; W286-S289 PolarHBondContact O-N 3.1Å; W286-S289 PolarHBondContact O-OG 3.34Å; N287-S289 PolarHBondContact O-N 2.9Å; S289-W291 PolarHBondContact O-N 3.37Å; S289-F313 WeakPolarHBondContact O-CE2 3.45Å; S289-F313 VanDerWaalsContact O-CZ 3.28Å; S289-F313 WeakPolarHBondContact O-CZ 3.44Å
290	N	91.7	Very high	93.1	Very high	15 Å²	15	63.7 Å²	63.7	8%	0.08	33%	0.333	C	S	.	.			trans	-92.7	92.1	-177.7	-171.2	-15.9	0	0	0	111.6	Q269 W286 N287 D292 E293 L294	Q269-N290 HydrophobicContact CG-CB 4.04Å; W286-N290 PolarHBondContact O-N 3.4Å; N287-N290 PolarHBondContact O-N 3.37Å; N287-N290 VanDerWaalsContact O-N 3.13Å; N290-D292 VanDerWaalsContact C-N 3.31Å; N290-D292 PolarHBondContact O-N 2.87Å; N290-D292 PolarHBondContact OD1-N 3.27Å; N290-E293 HydrophobicContact CB-CB 3.94Å; N290-E293 VanDerWaalsContact CG-CB 3.46Å; N290-E293 WeakPolarHBondContact ND2-CB 3.12Å; N290-E293 PolarHBondContact O-N 3.38Å; N290-E293 PolarHBondContact OD1-N 3.1Å; N290-E293 VanDerWaalsContact OD1-N 3.17Å; N290-L294 WeakPolarHBondContact O-CG 3.12Å; N290-L294 PolarHBondContact O-N 3.06Å
291	W	90.3	Very high	93.2	Very high	107 Å²	107	62.7 Å²	62.7	41%	0.405	33%	0.327	S	S	.	.	H	α-helix	trans	-57.6	-40.8	-179	179.4	81.2	0	0	0	113.4	S289 L294 K295 F313	S289-W291 PolarHBondContact O-N 3.37Å; W291-L294 PolarHBondContact O-N 3.02Å; W291-K295 HydrophobicContact CH2-CD 3.68Å; W291-K295 HydrophobicContact CZ2-CD 3.71Å; W291-K295 HydrophobicContact CZ3-CD 4.22Å; W291-K295 WeakPolarHBondContact O-CB 3.29Å; W291-K295 PolarHBondContact O-N 3.35Å; W291-F313 HydrophobicContact CB-CE1 4.08Å; W291-F313 HydrophobicContact CB-CE2 4Å; W291-F313 HydrophobicContact CB-CZ 3.67Å
292	D	90.3	Very high	93.2	Very high	86 Å²	86	60.2 Å²	60.2	46%	0.46	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-43.6	-179.6	-64.8	-43.3	0	0	0	111.2	K224 N290 K295 H296	K224-D292 IonicContact NZ-OD2 3.05Å; K224-D292 PolarHBondContact NZ-OD2 2.91Å; N290-D292 VanDerWaalsContact C-N 3.31Å; N290-D292 PolarHBondContact O-N 2.87Å; N290-D292 PolarHBondContact OD1-N 3.27Å; D292-K295 PolarHBondContact O-N 3.16Å; D292-H296 VanDerWaalsContact O-CB 3.23Å; D292-H296 WeakPolarHBondContact O-CB 3.47Å; D292-H296 PolarHBondContact O-N 2.86Å
293	E	91.8	Very high	93.2	Very high	28 Å²	28	57.3 Å²	57.3	13%	0.131	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-43.4	178.6	-180	170.5	-109	0	0	111.6	P273 N287 N290 K295 H296 N297	P273-E293 WeakPolarHBondContact CD-OE1 3.32Å; P273-E293 WeakPolarHBondContact CD-OE2 3.29Å; N287-E293 PolarHBondContact ND2-OE2 3.42Å; N290-E293 HydrophobicContact CB-CB 3.94Å; N290-E293 VanDerWaalsContact CG-CB 3.46Å; N290-E293 WeakPolarHBondContact ND2-CB 3.12Å; N290-E293 PolarHBondContact O-N 3.38Å; N290-E293 PolarHBondContact OD1-N 3.1Å; N290-E293 VanDerWaalsContact OD1-N 3.17Å; E293-K295 VanDerWaalsContact C-N 3.32Å; E293-K295 PolarHBondContact O-N 2.85Å; E293-H296 PolarHBondContact O-N 3.19Å; E293-N297 WeakPolarHBondContact CG-ND2 3.32Å; E293-N297 WeakPolarHBondContact O-CB 3.49Å; E293-N297 PolarHBondContact O-N 3.36Å; E293-N297 PolarHBondContact O-ND2 2.7Å
294	L	94.6	Very high	93.3	Very high	15 Å²	15	56 Å²	56	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-44.6	175.7	-69	172.1	0	0	0	111.2	N290 W291 N298 V299 I302 F313 F317	N290-L294 WeakPolarHBondContact O-CG 3.12Å; N290-L294 PolarHBondContact O-N 3.06Å; W291-L294 PolarHBondContact O-N 3.02Å; L294-N298 PolarHBondContact O-N 2.83Å; L294-V299 HydrophobicContact CB-CB 4.3Å; L294-V299 HydrophobicContact CD2-CB 3.95Å; L294-V299 HydrophobicContact CD2-CG1 3.94Å; L294-V299 HydrophobicContact CD2-CG2 3.96Å; L294-V299 WeakPolarHBondContact O-CB 3.39Å; L294-V299 PolarHBondContact O-N 3.47Å; L294-I302 HydrophobicContact CD1-CD1 3.99Å; L294-I302 HydrophobicContact CD2-CD1 4.11Å; L294-F313 HydrophobicContact CD1-CD2 4.25Å; L294-F313 HydrophobicContact CD1-CE2 4.3Å; L294-F317 HydrophobicContact CB-CE1 4.23Å; L294-F317 HydrophobicContact CB-CZ 3.93Å; L294-F317 HydrophobicContact CD1-CE2 3.96Å; L294-F317 HydrophobicContact CD1-CZ 3.79Å; L294-F317 HydrophobicContact CG-CZ 4.48Å
295	K	93.2	Very high	93.6	Very high	128 Å²	128	55.3 Å²	55.3	56%	0.557	28%	0.28	S	S	*	.	H	α-helix	trans	-68.1	-43.9	178	-173.4	178.9	179.2	-177.2	0	112	W291 D292 E293 N297 N298	W291-K295 HydrophobicContact CH2-CD 3.68Å; W291-K295 HydrophobicContact CZ2-CD 3.71Å; W291-K295 HydrophobicContact CZ3-CD 4.22Å; W291-K295 WeakPolarHBondContact O-CB 3.29Å; W291-K295 PolarHBondContact O-N 3.35Å; D292-K295 PolarHBondContact O-N 3.16Å; E293-K295 VanDerWaalsContact C-N 3.32Å; E293-K295 PolarHBondContact O-N 2.85Å; K295-N297 VanDerWaalsContact C-N 3.28Å; K295-N297 PolarHBondContact O-N 3.31Å; K295-N298 PolarHBondContact O-N 2.66Å; K295-N298 PolarHBondContact O-OD1 2.85Å
296	H	92.8	Very high	93.6	Very high	155 Å²	155	52.4 Å²	52.4	72%	0.718	27%	0.269	S	S	*	.	H	α-helix	trans	-60.2	-39.5	178	-179.2	74.1	0	0	0	111.9	D292 E293 N298	D292-H296 VanDerWaalsContact O-CB 3.23Å; D292-H296 WeakPolarHBondContact O-CB 3.47Å; D292-H296 PolarHBondContact O-N 2.86Å; E293-H296 PolarHBondContact O-N 3.19Å; H296-N298 PolarHBondContact O-N 3.03Å
297	N	93	Very high	93.5	Very high	39 Å²	39	55.5 Å²	55.5	21%	0.209	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	6.3	176.9	-68.4	-35.2	0	0	0	113.6	Y281 E293 K295 V299	Y281-N297 HydrophobicContact CE2-CB 4.05Å; E293-N297 WeakPolarHBondContact CG-ND2 3.32Å; E293-N297 WeakPolarHBondContact O-CB 3.49Å; E293-N297 PolarHBondContact O-N 3.36Å; E293-N297 PolarHBondContact O-ND2 2.7Å; K295-N297 VanDerWaalsContact C-N 3.28Å; K295-N297 PolarHBondContact O-N 3.31Å; N297-V299 VanDerWaalsContact C-N 3.27Å; N297-V299 HydrophobicContact CB-CG2 3.99Å; N297-V299 PolarHBondContact O-N 2.86Å
298	N	93.6	Very high	93.2	Very high	140 Å²	140	61.6 Å²	61.6	75%	0.749	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	43	-176.7	-63.3	-50.5	0	0	0	113.4	L294 K295 H296 G300	L294-N298 PolarHBondContact O-N 2.83Å; K295-N298 PolarHBondContact O-N 2.66Å; K295-N298 PolarHBondContact O-OD1 2.85Å; H296-N298 PolarHBondContact O-N 3.03Å; N298-G300 PolarHBondContact O-N 2.83Å
299	V	95.2	Very high	92.9	Very high	31 Å²	31	61.3 Å²	61.3	19%	0.188	31%	0.308	C	S	.	.			trans	-74.3	118.7	178	179.4	0	0	0	0	109.5	L294 N297 F301 I302 F317	L294-V299 HydrophobicContact CB-CB 4.3Å; L294-V299 HydrophobicContact CD2-CB 3.95Å; L294-V299 HydrophobicContact CD2-CG1 3.94Å; L294-V299 HydrophobicContact CD2-CG2 3.96Å; L294-V299 WeakPolarHBondContact O-CB 3.39Å; L294-V299 PolarHBondContact O-N 3.47Å; N297-V299 VanDerWaalsContact C-N 3.27Å; N297-V299 HydrophobicContact CB-CG2 3.99Å; N297-V299 PolarHBondContact O-N 2.86Å; V299-F301 WeakPolarHBondContact CG1-O 3.46Å; V299-I302 HydrophobicContact CG1-CD1 4.37Å; V299-I302 HydrophobicContact CG1-CG1 3.82Å; V299-F317 VanDerWaalsContact O-CD1 3.24Å; V299-F317 WeakPolarHBondContact O-CD1 3.45Å; V299-F317 WeakPolarHBondContact O-CE1 3.46Å
300	G	94.6	Very high	92.9	Very high	26 Å²	26	65.5 Å²	65.5	27%	0.268	33%	0.329	S	S	.	.			trans	-104.4	-19.7	172.1	0	0	0	0	0	114.5	N298 H318	N298-G300 PolarHBondContact O-N 2.83Å; G300-H318 PolarHBondContact O-N 2.87Å
301	F	97.3	Very high	93	Very high	28 Å²	28	67 Å²	67	12%	0.123	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.7	-172.6	-70.3	-104.7	0	0	0	110.5	V299 H318 F342 K345 A346 V349	V299-F301 WeakPolarHBondContact CG1-O 3.46Å; F301-H318 CarbonylContact C-O 3.51Å; F301-H318 WeakPolarHBondContact CA-O 3.38Å; F301-H318 HydrophobicContact CD1-CB 3.37Å; F301-H318 HydrophobicContact CE1-CB 3.46Å; F301-H318 VanDerWaalsContact CE1-CB 3.46Å; F301-H318 AromaticContact CE1-CD2 3.67Å; F301-H318 AromaticContact CE1-CG 3.69Å; F301-H318 AromaticContact CE2-CD2 3.72Å; F301-H318 HydrophobicContact CG-CB 3.93Å; F301-H318 HydrophobicContact CZ-CB 4.08Å; F301-H318 AromaticContact CZ-CD2 3.35Å; F301-H318 WeakPolarHBondContact CZ-CD2 3.44Å; F301-H318 AromaticContact CZ-CG 3.88Å; F301-F342 HydrophobicContact CB-CE1 4.04Å; F301-F342 HydrophobicContact CB-CZ 4.03Å; F301-F342 HydrophobicContact CD1-CE1 4.26Å; F301-F342 AromaticContact CD1-CE2 3.87Å; F301-F342 HydrophobicContact CD1-CE2 3.87Å; F301-F342 AromaticContact CD1-CZ 3.7Å; F301-F342 HydrophobicContact CD1-CZ 3.7Å; F301-F342 HydrophobicContact CG-CZ 4.37Å; F301-K345 HydrophobicContact CE1-CD 4.36Å; F301-K345 HydrophobicContact CE1-CG 4.46Å; F301-A346 HydrophobicContact CB-CB 3.69Å; F301-A346 HydrophobicContact CD1-CB 3.91Å; F301-A346 HydrophobicContact CD2-CB 3.6Å; F301-A346 HydrophobicContact CE1-CB 4.49Å; F301-A346 HydrophobicContact CE2-CB 4.21Å; F301-A346 HydrophobicContact CG-CB 3.45Å; F301-A346 VanDerWaalsContact CG-CB 3.45Å; F301-V349 HydrophobicContact CE2-CB 3.93Å; F301-V349 HydrophobicContact CE2-CG1 3.8Å; F301-V349 HydrophobicContact CE2-CG2 4.37Å; F301-V349 HydrophobicContact CZ-CB 3.99Å; F301-V349 HydrophobicContact CZ-CG1 3.89Å; F301-V349 HydrophobicContact CZ-CG2 3.92Å
302	I	97.5	Very high	93.1	Very high	19 Å²	19	65.2 Å²	65.2	10%	0.097	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	119.1	178.7	-60.9	172.6	0	0	0	109.6	L294 V299 F317 H318 Y319 L320	L294-I302 HydrophobicContact CD1-CD1 3.99Å; L294-I302 HydrophobicContact CD2-CD1 4.11Å; V299-I302 HydrophobicContact CG1-CD1 4.37Å; V299-I302 HydrophobicContact CG1-CG1 3.82Å; I302-F317 HydrophobicContact CD1-CB 4.05Å; I302-F317 HydrophobicContact CD1-CD1 4.14Å; I302-F317 HydrophobicContact CD1-CD2 3.81Å; I302-F317 HydrophobicContact CD1-CE2 4.29Å; I302-F317 HydrophobicContact CD1-CG 3.73Å; I302-F317 HydrophobicContact CG1-CB 4.32Å; I302-F317 HydrophobicContact CG1-CG 4.38Å; I302-H318 PolarHBondContact N-O 2.66Å; I302-Y319 HydrophobicContact CB-CD1 3.83Å; I302-Y319 HydrophobicContact CB-CE1 3.48Å; I302-Y319 VanDerWaalsContact CB-CE1 3.48Å; I302-Y319 HydrophobicContact CD1-CE1 4.16Å; I302-Y319 HydrophobicContact CD1-CE2 4.36Å; I302-Y319 WeakPolarHBondContact CD1-OH 3.49Å; I302-Y319 HydrophobicContact CG1-CE1 4.39Å; I302-Y319 HydrophobicContact CG2-CD1 3.93Å; I302-Y319 HydrophobicContact CG2-CE1 3.34Å; I302-Y319 WeakPolarHBondContact O-CA 3.41Å; I302-L320 PolarHBondContact O-N 3.13Å
303	L	97.6	Very high	93.2	Very high	55 Å²	55	64.3 Å²	64.3	29%	0.288	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	106.6	171.4	171.8	57.5	0	0	0	108.6	V305 L320 I322 T339 F342 I343	L303-V305 HydrophobicContact CD1-CG2 3.84Å; L303-V305 HydrophobicContact CD2-CG2 4.12Å; L303-V305 HydrophobicContact CG-CG2 3.63Å; L303-L320 WeakPolarHBondContact CA-O 3.35Å; L303-L320 HydrophobicContact CD1-CB 4.01Å; L303-L320 HydrophobicContact CD1-CD2 3.83Å; L303-L320 HydrophobicContact CD1-CG 3.79Å; L303-I322 HydrophobicContact CD1-CG1 4.13Å; L303-T339 HydrophobicContact CD1-CG2 3.87Å; L303-T339 HydrophobicContact CD2-CG2 3.92Å; L303-F342 HydrophobicContact CB-CD1 4.18Å; L303-F342 HydrophobicContact CB-CE1 4.05Å; L303-I343 HydrophobicContact CD2-CD1 4.22Å
304	N	96.6	Very high	93	Very high	18 Å²	18	68 Å²	68	10%	0.096	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.5	177.8	179.1	-3.9	0	0	0	109.5	T306 V309 N311 L320 K321 I322	N304-T306 PolarHBondContact OD1-N 2.83Å; N304-T306 PolarHBondContact OD1-OG1 2.79Å; N304-V309 PolarHBondContact ND2-O 3.22Å; N304-N311 PolarHBondContact ND2-OD1 3.38Å; N304-L320 PolarHBondContact N-O 3.06Å; N304-K321 HydrophobicContact CB-CG 4.36Å; N304-K321 CarbonylContact O-C 3.52Å; N304-K321 WeakPolarHBondContact O-CA 3.19Å; N304-I322 PolarHBondContact O-N 2.93Å
305	V	95.9	Very high	92.8	Very high	59 Å²	59	71 Å²	71	36%	0.358	39%	0.385	S	S	.	.			trans	-109.3	53.1	-176.7	-164.5	0	0	0	0	110.4	L303 I322 I324 L332	L303-V305 HydrophobicContact CD1-CG2 3.84Å; L303-V305 HydrophobicContact CD2-CG2 4.12Å; L303-V305 HydrophobicContact CG-CG2 3.63Å; V305-I322 CarbonylContact C-O 3.52Å; V305-I322 WeakPolarHBondContact CA-O 3.43Å; V305-I322 HydrophobicContact CG1-CB 4.21Å; V305-I322 HydrophobicContact CG1-CG2 4.31Å; V305-I324 HydrophobicContact CG1-CG2 3.7Å; V305-L332 HydrophobicContact CG1-CD2 4.4Å
306	T	91.6	Very high	92.8	Very high	32 Å²	32	70.7 Å²	70.7	20%	0.196	39%	0.389	C	S	.	.			trans	-136.7	155.2	179.2	70.9	0	0	0	0	110.9	N304 V309 I322	N304-T306 PolarHBondContact OD1-N 2.83Å; N304-T306 PolarHBondContact OD1-OG1 2.79Å; T306-V309 HydrophobicContact CG2-CG2 4.2Å; T306-V309 VanDerWaalsContact OG1-CB 3.27Å; T306-V309 WeakPolarHBondContact OG1-CB 3.27Å; T306-V309 PolarHBondContact OG1-N 3.43Å; T306-V309 PolarHBondContact OG1-O 2.82Å; T306-I322 PolarHBondContact N-O 3.16Å
307	K	89.1	Confident	92.9	Very high	129 Å²	129	64.5 Å²	64.5	56%	0.561	36%	0.36	S	S	*	.	S	Bend	trans	-85.6	-40.6	174.5	-174.3	177.3	177.8	-177.5	0	111	I324	K307-I324 PolarHBondContact N-O 2.82Å
308	E	85.5	Confident	93	Very high	136 Å²	136	67.7 Å²	67.7	64%	0.636	37%	0.373	S	S	*	.	S	Bend	trans	-90	-28.4	-166	62.7	-71.5	166.2	0	0	114.2
309	V	88.1	Confident	93.1	Very high	17 Å²	17	63.4 Å²	63.4	10%	0.103	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-93	122.3	-177.7	-167.7	0	0	0	0	110.1	E285 N304 T306 F312 K321	E285-V309 HydrophobicContact CB-CG1 3.87Å; E285-V309 HydrophobicContact CB-CG2 4.17Å; E285-V309 VanDerWaalsContact OE2-CG2 3.28Å; E285-V309 WeakPolarHBondContact OE2-CG2 3.19Å; N304-V309 PolarHBondContact ND2-O 3.22Å; T306-V309 HydrophobicContact CG2-CG2 4.2Å; T306-V309 VanDerWaalsContact OG1-CB 3.27Å; T306-V309 WeakPolarHBondContact OG1-CB 3.27Å; T306-V309 PolarHBondContact OG1-N 3.43Å; T306-V309 PolarHBondContact OG1-O 2.82Å; V309-F312 HydrophobicContact CG1-CE2 3.68Å; V309-F312 HydrophobicContact CG1-CZ 4Å; V309-K321 WeakPolarHBondContact O-CE 3.33Å; V309-K321 PolarHBondContact O-NZ 3.29Å
310	D	90.8	Very high	93.2	Very high	112 Å²	112	63.2 Å²	63.2	60%	0.599	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-78.2	162.7	173.5	-80.3	-34.4	0	0	0	113	F312 K321	D310-F312 PolarHBondContact O-N 3.04Å; D310-K321 IonicContact OD1-NZ 2.93Å; D310-K321 PolarHBondContact OD1-NZ 3.42Å
311	N	93.8	Very high	93.3	Very high	48 Å²	48	63.9 Å²	63.9	26%	0.257	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-71.8	122	178.1	-66	-11.5	0	0	0	109	N304 Y319	N304-N311 PolarHBondContact ND2-OD1 3.38Å; N311-Y319 HydrophobicContact CB-CD1 3.8Å; N311-Y319 HydrophobicContact CB-CD2 4.21Å; N311-Y319 HydrophobicContact CB-CE1 3.66Å; N311-Y319 HydrophobicContact CB-CE2 4.1Å; N311-Y319 HydrophobicContact CB-CG 4.07Å; N311-Y319 WeakPolarHBondContact ND2-CB 3.45Å; N311-Y319 WeakPolarHBondContact ND2-CD1 3.39Å; N311-Y319 WeakPolarHBondContact OD1-CD1 3.44Å
312	F	91.8	Very high	93.2	Very high	69 Å²	69	63.1 Å²	63.1	30%	0.303	34%	0.337	S	S	.	.	S	Bend	trans	-70	154.2	168.3	-59.1	-77	0	0	0	110.2	A288 V309 D310 Y319	A288-F312 HydrophobicContact CB-CD2 3.9Å; A288-F312 HydrophobicContact CB-CE2 4.25Å; A288-F312 WeakPolarHBondContact O-CB 3.46Å; V309-F312 HydrophobicContact CG1-CE2 3.68Å; V309-F312 HydrophobicContact CG1-CZ 4Å; D310-F312 PolarHBondContact O-N 3.04Å; F312-Y319 VanDerWaalsContact O-CE2 3.26Å; F312-Y319 WeakPolarHBondContact O-CE2 3.4Å; F312-Y319 VanDerWaalsContact O-CZ 3.23Å; F312-Y319 PolarHBondContact O-OH 3.36Å
313	F	93	Very high	93.1	Very high	66 Å²	66	70.5 Å²	70.5	29%	0.289	36%	0.364	S	S	.	.	S	Bend	trans	48.4	50.5	173.3	-46.5	-62.4	0	0	0	115.4	S289 W291 L294 G315 L316 F317	S289-F313 WeakPolarHBondContact O-CE2 3.45Å; S289-F313 VanDerWaalsContact O-CZ 3.28Å; S289-F313 WeakPolarHBondContact O-CZ 3.44Å; W291-F313 HydrophobicContact CB-CE1 4.08Å; W291-F313 HydrophobicContact CB-CE2 4Å; W291-F313 HydrophobicContact CB-CZ 3.67Å; L294-F313 HydrophobicContact CD1-CD2 4.25Å; L294-F313 HydrophobicContact CD1-CE2 4.3Å; F313-G315 PolarHBondContact O-N 3Å; F313-L316 HydrophobicContact CB-CB 4.34Å; F313-L316 HydrophobicContact CB-CD1 4.16Å; F313-L316 PolarHBondContact O-N 3.38Å; F313-L316 VanDerWaalsContact O-N 3.14Å; F313-F317 HydrophobicContact CB-CD2 4.01Å; F313-F317 HydrophobicContact CB-CE2 3.72Å; F313-F317 AromaticContact CD2-CE2 3.9Å; F313-F317 HydrophobicContact CD2-CE2 3.9Å; F313-F317 HydrophobicContact CG-CE2 4.13Å
314	P	88.4	Confident	92.8	Very high	107 Å²	107	68.7 Å²	68.7	70%	0.695	36%	0.355	S	S	*	.	B	Isolated β-bridge	trans	-58.7	133.8	-175.3	26	-34.9	0	0	0	111.1
315	G	89.1	Confident	92.2	Very high	78 Å²	78	69.3 Å²	69.3	80%	0.804	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	-12	-179.1	0	0	0	0	0	115.3	F313	F313-G315 PolarHBondContact O-N 3Å
316	L	93	Very high	91.8	Very high	120 Å²	120	74.7 Å²	74.7	63%	0.628	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-24.6	175.6	-61.2	-173.1	0	0	0	113.4	F313	F313-L316 HydrophobicContact CB-CB 4.34Å; F313-L316 HydrophobicContact CB-CD1 4.16Å; F313-L316 PolarHBondContact O-N 3.38Å; F313-L316 VanDerWaalsContact O-N 3.14Å
317	F	94.7	Very high	91.4	Very high	25 Å²	25	77.9 Å²	77.9	11%	0.11	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-123.9	154.8	178.4	-53.9	-81.6	0	0	0	110.9	L294 V299 I302 F313 Y319	L294-F317 HydrophobicContact CB-CE1 4.23Å; L294-F317 HydrophobicContact CB-CZ 3.93Å; L294-F317 HydrophobicContact CD1-CE2 3.96Å; L294-F317 HydrophobicContact CD1-CZ 3.79Å; L294-F317 HydrophobicContact CG-CZ 4.48Å; V299-F317 VanDerWaalsContact O-CD1 3.24Å; V299-F317 WeakPolarHBondContact O-CD1 3.45Å; V299-F317 WeakPolarHBondContact O-CE1 3.46Å; I302-F317 HydrophobicContact CD1-CB 4.05Å; I302-F317 HydrophobicContact CD1-CD1 4.14Å; I302-F317 HydrophobicContact CD1-CD2 3.81Å; I302-F317 HydrophobicContact CD1-CE2 4.29Å; I302-F317 HydrophobicContact CD1-CG 3.73Å; I302-F317 HydrophobicContact CG1-CB 4.32Å; I302-F317 HydrophobicContact CG1-CG 4.38Å; F313-F317 HydrophobicContact CB-CD2 4.01Å; F313-F317 HydrophobicContact CB-CE2 3.72Å; F313-F317 AromaticContact CD2-CE2 3.9Å; F313-F317 HydrophobicContact CD2-CE2 3.9Å; F313-F317 HydrophobicContact CG-CE2 4.13Å; F317-Y319 HydrophobicContact CB-CD2 4.06Å; F317-Y319 HydrophobicContact CB-CE2 3.75Å; F317-Y319 HydrophobicContact CD2-CE2 4.11Å; F317-Y319 HydrophobicContact CG-CE2 4.4Å; F317-Y319 PolarHBondContact O-N 3.14Å
318	H	95.6	Very high	91.1	Very high	107 Å²	107	81.8 Å²	81.8	50%	0.495	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	114.3	166.8	-67.6	-60.3	0	0	0	109.2	G300 F301 I302 F342	G300-H318 PolarHBondContact O-N 2.87Å; F301-H318 CarbonylContact C-O 3.51Å; F301-H318 WeakPolarHBondContact CA-O 3.38Å; F301-H318 HydrophobicContact CD1-CB 3.37Å; F301-H318 HydrophobicContact CE1-CB 3.46Å; F301-H318 VanDerWaalsContact CE1-CB 3.46Å; F301-H318 AromaticContact CE1-CD2 3.67Å; F301-H318 AromaticContact CE1-CG 3.69Å; F301-H318 AromaticContact CE2-CD2 3.72Å; F301-H318 HydrophobicContact CG-CB 3.93Å; F301-H318 HydrophobicContact CZ-CB 4.08Å; F301-H318 AromaticContact CZ-CD2 3.35Å; F301-H318 WeakPolarHBondContact CZ-CD2 3.44Å; F301-H318 AromaticContact CZ-CG 3.88Å; I302-H318 PolarHBondContact N-O 2.66Å; H318-F342 WeakPolarHBondContact O-CZ 3.42Å
319	Y	96.9	Very high	91.2	Very high	50 Å²	50	79.9 Å²	79.9	20%	0.196	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.4	-178.6	-87.7	-84.1	0	0	0	112.9	I302 N311 F312 F317	I302-Y319 HydrophobicContact CB-CD1 3.83Å; I302-Y319 HydrophobicContact CB-CE1 3.48Å; I302-Y319 VanDerWaalsContact CB-CE1 3.48Å; I302-Y319 HydrophobicContact CD1-CE1 4.16Å; I302-Y319 HydrophobicContact CD1-CE2 4.36Å; I302-Y319 WeakPolarHBondContact CD1-OH 3.49Å; I302-Y319 HydrophobicContact CG1-CE1 4.39Å; I302-Y319 HydrophobicContact CG2-CD1 3.93Å; I302-Y319 HydrophobicContact CG2-CE1 3.34Å; I302-Y319 WeakPolarHBondContact O-CA 3.41Å; N311-Y319 HydrophobicContact CB-CD1 3.8Å; N311-Y319 HydrophobicContact CB-CD2 4.21Å; N311-Y319 HydrophobicContact CB-CE1 3.66Å; N311-Y319 HydrophobicContact CB-CE2 4.1Å; N311-Y319 HydrophobicContact CB-CG 4.07Å; N311-Y319 WeakPolarHBondContact ND2-CB 3.45Å; N311-Y319 WeakPolarHBondContact ND2-CD1 3.39Å; N311-Y319 WeakPolarHBondContact OD1-CD1 3.44Å; F312-Y319 VanDerWaalsContact O-CE2 3.26Å; F312-Y319 WeakPolarHBondContact O-CE2 3.4Å; F312-Y319 VanDerWaalsContact O-CZ 3.23Å; F312-Y319 PolarHBondContact O-OH 3.36Å; F317-Y319 HydrophobicContact CB-CD2 4.06Å; F317-Y319 HydrophobicContact CB-CE2 3.75Å; F317-Y319 HydrophobicContact CD2-CE2 4.11Å; F317-Y319 HydrophobicContact CG-CE2 4.4Å; F317-Y319 PolarHBondContact O-N 3.14Å
320	L	97.1	Very high	91.2	Very high	27 Å²	27	80.5 Å²	80.5	14%	0.141	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	114.3	157.9	174.6	59.1	0	0	0	108	I302 L303 N304 I322 I338 T339 F342	I302-L320 PolarHBondContact O-N 3.13Å; L303-L320 WeakPolarHBondContact CA-O 3.35Å; L303-L320 HydrophobicContact CD1-CB 4.01Å; L303-L320 HydrophobicContact CD1-CD2 3.83Å; L303-L320 HydrophobicContact CD1-CG 3.79Å; N304-L320 PolarHBondContact N-O 3.06Å; L320-I322 HydrophobicContact CD1-CD1 4.02Å; L320-I322 HydrophobicContact CD2-CD1 4.45Å; L320-I322 HydrophobicContact CG-CD1 4.13Å; L320-I322 HydrophobicContact CG-CG1 4.37Å; L320-I338 HydrophobicContact CD1-CD1 4.12Å; L320-I338 HydrophobicContact CD1-CG1 4.4Å; L320-I338 HydrophobicContact CD2-CG1 4.06Å; L320-T339 HydrophobicContact CD2-CG2 4.35Å; L320-F342 HydrophobicContact CB-CD1 4.06Å; L320-F342 HydrophobicContact CB-CD2 3.67Å; L320-F342 HydrophobicContact CB-CE1 4.01Å; L320-F342 HydrophobicContact CB-CE2 3.61Å; L320-F342 HydrophobicContact CB-CG 3.88Å; L320-F342 HydrophobicContact CB-CZ 3.77Å; L320-F342 HydrophobicContact CD2-CB 3.58Å; L320-F342 HydrophobicContact CD2-CD1 4.25Å; L320-F342 HydrophobicContact CD2-CD2 4.05Å; L320-F342 HydrophobicContact CD2-CG 3.71Å; L320-F342 HydrophobicContact CG-CD2 4.46Å; L320-F342 HydrophobicContact CG-CG 4.45Å
321	K	96.1	Very high	91.2	Very high	40 Å²	40	81.1 Å²	81.1	17%	0.174	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.8	176.4	-170.9	171.7	-174.7	173.1	0	110.4	N304 V309 D310 R323	N304-K321 HydrophobicContact CB-CG 4.36Å; N304-K321 CarbonylContact O-C 3.52Å; N304-K321 WeakPolarHBondContact O-CA 3.19Å; V309-K321 WeakPolarHBondContact O-CE 3.33Å; V309-K321 PolarHBondContact O-NZ 3.29Å; D310-K321 IonicContact OD1-NZ 2.93Å; D310-K321 PolarHBondContact OD1-NZ 3.42Å; K321-R323 HydrophobicContact CD-CG 4.42Å; K321-R323 HydrophobicContact CG-CG 4.32Å
322	I	96.1	Very high	91.1	Very high	11 Å²	11	84 Å²	84	6%	0.056	44%	0.441	C	S	.	.			trans	-104.4	106.4	171.8	-55.7	-58.6	0	0	0	107.7	L303 N304 V305 T306 L320 I324 F335 I338 T339	L303-I322 HydrophobicContact CD1-CG1 4.13Å; N304-I322 PolarHBondContact O-N 2.93Å; V305-I322 CarbonylContact C-O 3.52Å; V305-I322 WeakPolarHBondContact CA-O 3.43Å; V305-I322 HydrophobicContact CG1-CB 4.21Å; V305-I322 HydrophobicContact CG1-CG2 4.31Å; T306-I322 PolarHBondContact N-O 3.16Å; L320-I322 HydrophobicContact CD1-CD1 4.02Å; L320-I322 HydrophobicContact CD2-CD1 4.45Å; L320-I322 HydrophobicContact CG-CD1 4.13Å; L320-I322 HydrophobicContact CG-CG1 4.37Å; I322-I324 HydrophobicContact CG2-CB 4.42Å; I322-I324 HydrophobicContact CG2-CG2 4.35Å; I322-I324 PolarHBondContact O-N 3.06Å; I322-I324 VanDerWaalsContact O-N 3.15Å; I322-F335 HydrophobicContact CD1-CD1 4.05Å; I322-F335 HydrophobicContact CD1-CG 4.45Å; I322-F335 HydrophobicContact CG2-CB 4.24Å; I322-F335 HydrophobicContact CG2-CD1 3.92Å; I322-F335 HydrophobicContact CG2-CD2 3.67Å; I322-F335 HydrophobicContact CG2-CE1 4.13Å; I322-F335 HydrophobicContact CG2-CE2 3.88Å; I322-F335 HydrophobicContact CG2-CG 3.67Å; I322-F335 HydrophobicContact CG2-CZ 4.1Å; I322-I338 HydrophobicContact CD1-CG2 4.29Å; I322-T339 HydrophobicContact CD1-CG2 4.44Å; I322-T339 HydrophobicContact CG1-CG2 3.96Å
323	R	93.7	Very high	91.1	Very high	174 Å²	174	87.8 Å²	87.8	66%	0.657	46%	0.463	S	S	*	.			trans	-80.2	95.2	178.7	-68.6	-174.4	173.1	95.8	-2	110	K321	K321-R323 HydrophobicContact CD-CG 4.42Å; K321-R323 HydrophobicContact CG-CG 4.32Å
324	I	91.2	Very high	91.2	Very high	18 Å²	18	90.8 Å²	90.8	9%	0.092	48%	0.476	C	S	.	.			trans	-135.7	143.9	177.4	-160.5	172.8	0	0	0	109.8	V305 K307 I322 L332 F335	V305-I324 HydrophobicContact CG1-CG2 3.7Å; K307-I324 PolarHBondContact N-O 2.82Å; I322-I324 HydrophobicContact CG2-CB 4.42Å; I322-I324 HydrophobicContact CG2-CG2 4.35Å; I322-I324 PolarHBondContact O-N 3.06Å; I322-I324 VanDerWaalsContact O-N 3.15Å; I324-L332 HydrophobicContact CD1-CD2 3.64Å; I324-L332 HydrophobicContact CD1-CG 3.84Å; I324-L332 HydrophobicContact CG2-CD2 4.14Å; I324-F335 HydrophobicContact CD1-CD2 4.23Å; I324-F335 HydrophobicContact CD1-CE2 3.93Å
325	S	85.8	Confident	91.5	Very high	31 Å²	31	88.4 Å²	88.4	22%	0.217	46%	0.455	C	S	.	.			trans	-82.4	147	173.3	-59.6	0	0	0	0	110.2	E327 S330	S325-E327 WeakPolarHBondContact CB-OE1 3.28Å; S325-E327 PolarHBondContact O-N 3.29Å; S325-E327 PolarHBondContact OG-OE1 2.96Å; S325-S330 WeakPolarHBondContact O-CB 3.4Å; S325-S330 PolarHBondContact O-OG 3.23Å
326	D	86.3	Confident	91.8	Very high	171 Å²	171	92.4 Å²	92.4	91%	0.914	45%	0.446	S	S	*	.	S	Bend	trans	-78.2	72.8	170.6	-170.6	24.1	0	0	0	110.9
327	E	84.4	Confident	92	Very high	100 Å²	100	91.9 Å²	91.9	47%	0.467	44%	0.444	S	S	.	.			trans	-129.8	144.5	-179.4	-68.2	170.3	-147.9	0	0	109.5	S325 S329 S330	S325-E327 WeakPolarHBondContact CB-OE1 3.28Å; S325-E327 PolarHBondContact O-N 3.29Å; S325-E327 PolarHBondContact OG-OE1 2.96Å; E327-S329 PolarHBondContact O-N 3.12Å; E327-S329 VanDerWaalsContact O-N 3.13Å; E327-S330 WeakPolarHBondContact O-CB 3.18Å; E327-S330 PolarHBondContact O-N 2.93Å
328	E	82.6	Confident	92.1	Very high	211 Å²	211	94.7 Å²	94.7	99%	0.986	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.6	179.4	-66.5	-174.3	173.7	0	0	112.9	S330	E328-S330 VanDerWaalsContact C-N 3.29Å; E328-S330 PolarHBondContact O-N 3.19Å
329	S	87	Confident	92.1	Very high	95 Å²	95	90.6 Å²	90.6	66%	0.664	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.8	176.3	44.3	0	0	0	0	114.5	E327 E331	E327-S329 PolarHBondContact O-N 3.12Å; E327-S329 VanDerWaalsContact O-N 3.13Å; S329-E331 PolarHBondContact O-N 3.24Å
330	S	88.2	Confident	92.1	Very high	30 Å²	30	93.7 Å²	93.7	21%	0.21	46%	0.456	C	S	.	.			trans	-72.9	122.6	-177.9	-77.1	0	0	0	0	112.3	S325 E327 E328 L332	S325-S330 WeakPolarHBondContact O-CB 3.4Å; S325-S330 PolarHBondContact O-OG 3.23Å; E327-S330 WeakPolarHBondContact O-CB 3.18Å; E327-S330 PolarHBondContact O-N 2.93Å; E328-S330 VanDerWaalsContact C-N 3.29Å; E328-S330 PolarHBondContact O-N 3.19Å; S330-L332 PolarHBondContact O-N 3.1Å
331	E	90.7	Very high	92.1	Very high	126 Å²	126	99.1 Å²	99.1	59%	0.589	48%	0.479	S	S	*	.			trans	-75.7	84.1	175.7	-66	176.5	159.8	0	0	112	S329 K334	S329-E331 PolarHBondContact O-N 3.24Å; E331-K334 HydrophobicContact CB-CD 3.99Å; E331-K334 VanDerWaalsContact O-CE 3.3Å; E331-K334 WeakPolarHBondContact O-CE 3.39Å; E331-K334 WeakPolarHBondContact O-CG 3.33Å; E331-K334 IonicContact OE2-NZ 3.96Å; E331-K334 PolarHBondContact OE2-NZ 3.18Å
332	L	91.2	Very high	92.1	Very high	109 Å²	109	98.6 Å²	98.6	57%	0.571	48%	0.477	S	S	*	.			trans	-67.6	-35.8	175	-78.1	161.5	0	0	0	112.9	V305 I324 S330 K334 F335	V305-L332 HydrophobicContact CG1-CD2 4.4Å; I324-L332 HydrophobicContact CD1-CD2 3.64Å; I324-L332 HydrophobicContact CD1-CG 3.84Å; I324-L332 HydrophobicContact CG2-CD2 4.14Å; S330-L332 PolarHBondContact O-N 3.1Å; L332-K334 VanDerWaalsContact C-N 3.25Å; L332-K334 PolarHBondContact O-N 3.42Å; L332-F335 PolarHBondContact O-N 3.08Å
333	L	92.8	Very high	92.1	Very high	148 Å²	148	100.1 Å²	100.1	78%	0.775	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-58.4	-31.9	-172.8	-84.6	158.5	0	0	0	113.8	F335 W336	L333-F335 PolarHBondContact O-N 3.37Å; L333-F335 VanDerWaalsContact O-N 3.15Å; L333-W336 WeakPolarHBondContact O-CB 3.3Å; L333-W336 PolarHBondContact O-N 2.97Å
334	K	93.9	Very high	92.2	Very high	128 Å²	128	94.2 Å²	94.2	56%	0.557	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-64.4	-19.8	178.8	72.7	-166.7	165.8	-165.2	0	113.6	E331 L332	E331-K334 HydrophobicContact CB-CD 3.99Å; E331-K334 VanDerWaalsContact O-CE 3.3Å; E331-K334 WeakPolarHBondContact O-CE 3.39Å; E331-K334 WeakPolarHBondContact O-CG 3.33Å; E331-K334 IonicContact OE2-NZ 3.96Å; E331-K334 PolarHBondContact OE2-NZ 3.18Å; L332-K334 VanDerWaalsContact C-N 3.25Å; L332-K334 PolarHBondContact O-N 3.42Å
335	F	95.3	Very high	92.4	Very high	57 Å²	57	99 Å²	99	25%	0.25	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-95.4	-2.1	178.1	-56.2	-68.4	0	0	0	113	I322 I324 L332 L333 D337 I338 T339	I322-F335 HydrophobicContact CD1-CD1 4.05Å; I322-F335 HydrophobicContact CD1-CG 4.45Å; I322-F335 HydrophobicContact CG2-CB 4.24Å; I322-F335 HydrophobicContact CG2-CD1 3.92Å; I322-F335 HydrophobicContact CG2-CD2 3.67Å; I322-F335 HydrophobicContact CG2-CE1 4.13Å; I322-F335 HydrophobicContact CG2-CE2 3.88Å; I322-F335 HydrophobicContact CG2-CG 3.67Å; I322-F335 HydrophobicContact CG2-CZ 4.1Å; I324-F335 HydrophobicContact CD1-CD2 4.23Å; I324-F335 HydrophobicContact CD1-CE2 3.93Å; L332-F335 PolarHBondContact O-N 3.08Å; L333-F335 PolarHBondContact O-N 3.37Å; L333-F335 VanDerWaalsContact O-N 3.15Å; F335-D337 PolarHBondContact O-N 3.5Å; F335-I338 HydrophobicContact CB-CG2 4.14Å; F335-I338 HydrophobicContact CD1-CG2 4.44Å; F335-I338 WeakPolarHBondContact O-CG2 3.38Å; F335-I338 PolarHBondContact O-N 2.61Å; F335-T339 HydrophobicContact CB-CG2 4.37Å; F335-T339 WeakPolarHBondContact O-CG2 3.23Å; F335-T339 PolarHBondContact O-N 2.85Å; F335-T339 PolarHBondContact O-OG1 2.67Å
336	W	95.2	Very high	92.8	Very high	163 Å²	163	98.6 Å²	98.6	62%	0.617	49%	0.486	S	S	*	.	H	α-helix	trans	-55.1	-49.7	-174.5	-176.1	-95.8	0	0	0	112.8	L333 I338 T339 F340	L333-W336 WeakPolarHBondContact O-CB 3.3Å; L333-W336 PolarHBondContact O-N 2.97Å; W336-I338 PolarHBondContact O-N 3.5Å; W336-T339 PolarHBondContact O-N 2.96Å; W336-T339 PolarHBondContact O-OG1 2.78Å; W336-T339 VanDerWaalsContact O-OG1 3.13Å; W336-F340 WeakPolarHBondContact O-CB 3.08Å; W336-F340 PolarHBondContact O-N 3.48Å
337	D	96.2	Very high	93.1	Very high	108 Å²	108	93.9 Å²	93.9	58%	0.578	46%	0.458	S	S	*	.	H	α-helix	trans	-65	-38.7	-176.4	-75.6	-16.5	0	0	0	112.7	F335 K341	F335-D337 PolarHBondContact O-N 3.5Å; D337-K341 VanDerWaalsContact O-CB 3.31Å; D337-K341 WeakPolarHBondContact O-CB 3.34Å; D337-K341 WeakPolarHBondContact O-CD 3.21Å; D337-K341 WeakPolarHBondContact O-CG 3.32Å; D337-K341 PolarHBondContact O-N 3.16Å
338	I	97.2	Very high	93.3	Very high	84 Å²	84	95.7 Å²	95.7	43%	0.431	46%	0.461	S	S	.	.	H	α-helix	trans	-73.1	-41.9	-178.9	-172.6	171.4	0	0	0	111.1	L320 I322 F335 W336 F342	L320-I338 HydrophobicContact CD1-CD1 4.12Å; L320-I338 HydrophobicContact CD1-CG1 4.4Å; L320-I338 HydrophobicContact CD2-CG1 4.06Å; I322-I338 HydrophobicContact CD1-CG2 4.29Å; F335-I338 HydrophobicContact CB-CG2 4.14Å; F335-I338 HydrophobicContact CD1-CG2 4.44Å; F335-I338 WeakPolarHBondContact O-CG2 3.38Å; F335-I338 PolarHBondContact O-N 2.61Å; W336-I338 PolarHBondContact O-N 3.5Å; I338-F342 WeakPolarHBondContact O-CB 3.08Å; I338-F342 PolarHBondContact O-N 2.86Å
339	T	96.9	Very high	92.9	Very high	22 Å²	22	89 Å²	89	14%	0.135	43%	0.434	C	S	.	.	H	α-helix	trans	-70.2	-40.4	178.4	57.4	0	0	0	0	111.4	L303 L320 I322 F335 W336 F342 I343	L303-T339 HydrophobicContact CD1-CG2 3.87Å; L303-T339 HydrophobicContact CD2-CG2 3.92Å; L320-T339 HydrophobicContact CD2-CG2 4.35Å; I322-T339 HydrophobicContact CD1-CG2 4.44Å; I322-T339 HydrophobicContact CG1-CG2 3.96Å; F335-T339 HydrophobicContact CB-CG2 4.37Å; F335-T339 WeakPolarHBondContact O-CG2 3.23Å; F335-T339 PolarHBondContact O-N 2.85Å; F335-T339 PolarHBondContact O-OG1 2.67Å; W336-T339 PolarHBondContact O-N 2.96Å; W336-T339 PolarHBondContact O-OG1 2.78Å; W336-T339 VanDerWaalsContact O-OG1 3.13Å; T339-F342 WeakPolarHBondContact O-CB 3.19Å; T339-F342 PolarHBondContact O-N 2.83Å; T339-I343 WeakPolarHBondContact O-CG1 3.38Å; T339-I343 PolarHBondContact O-N 3.38Å
340	F	95.8	Very high	91.5	Very high	114 Å²	114	90.7 Å²	90.7	50%	0.5	44%	0.436	S	S	.	.	H	α-helix	trans	-60.8	-49.9	174.7	179.6	-100.3	0	0	0	111.6	W336 F342 I343 V344	W336-F340 WeakPolarHBondContact O-CB 3.08Å; W336-F340 PolarHBondContact O-N 3.48Å; F340-F342 PolarHBondContact O-N 3.26Å; F340-I343 PolarHBondContact O-N 2.9Å; F340-V344 HydrophobicContact CD1-CG2 4.05Å; F340-V344 HydrophobicContact CD2-CG2 4.4Å; F340-V344 HydrophobicContact CE1-CG2 3.63Å; F340-V344 HydrophobicContact CE2-CG2 4.02Å; F340-V344 HydrophobicContact CG-CG2 4.42Å; F340-V344 HydrophobicContact CZ-CG2 3.61Å; F340-V344 WeakPolarHBondContact O-CB 3.3Å; F340-V344 VanDerWaalsContact O-CG2 3.31Å; F340-V344 WeakPolarHBondContact O-CG2 3.26Å; F340-V344 PolarHBondContact O-N 3.25Å
341	K	96.7	Very high	89.4	Confident	141 Å²	141	99.2 Å²	99.2	61%	0.613	48%	0.475	S	S	*	.	H	α-helix	trans	-59.6	-36.3	177.1	-75.3	170.6	-174	170.4	0	112.2	D337 K345	D337-K341 VanDerWaalsContact O-CB 3.31Å; D337-K341 WeakPolarHBondContact O-CB 3.34Å; D337-K341 WeakPolarHBondContact O-CD 3.21Å; D337-K341 WeakPolarHBondContact O-CG 3.32Å; D337-K341 PolarHBondContact O-N 3.16Å; K341-K345 WeakPolarHBondContact O-CB 3.35Å; K341-K345 PolarHBondContact O-N 2.95Å
342	F	97.3	Very high	89.3	Confident	30 Å²	30	97.9 Å²	97.9	13%	0.132	47%	0.469	C	S	.	.	H	α-helix	trans	-66	-46.2	176.7	-177.2	-96.9	0	0	0	112.3	F301 L303 H318 L320 I338 T339 F340 K345 A346	F301-F342 HydrophobicContact CB-CE1 4.04Å; F301-F342 HydrophobicContact CB-CZ 4.03Å; F301-F342 HydrophobicContact CD1-CE1 4.26Å; F301-F342 AromaticContact CD1-CE2 3.87Å; F301-F342 HydrophobicContact CD1-CE2 3.87Å; F301-F342 AromaticContact CD1-CZ 3.7Å; F301-F342 HydrophobicContact CD1-CZ 3.7Å; F301-F342 HydrophobicContact CG-CZ 4.37Å; L303-F342 HydrophobicContact CB-CD1 4.18Å; L303-F342 HydrophobicContact CB-CE1 4.05Å; H318-F342 WeakPolarHBondContact O-CZ 3.42Å; L320-F342 HydrophobicContact CB-CD1 4.06Å; L320-F342 HydrophobicContact CB-CD2 3.67Å; L320-F342 HydrophobicContact CB-CE1 4.01Å; L320-F342 HydrophobicContact CB-CE2 3.61Å; L320-F342 HydrophobicContact CB-CG 3.88Å; L320-F342 HydrophobicContact CB-CZ 3.77Å; L320-F342 HydrophobicContact CD2-CB 3.58Å; L320-F342 HydrophobicContact CD2-CD1 4.25Å; L320-F342 HydrophobicContact CD2-CD2 4.05Å; L320-F342 HydrophobicContact CD2-CG 3.71Å; L320-F342 HydrophobicContact CG-CD2 4.46Å; L320-F342 HydrophobicContact CG-CG 4.45Å; I338-F342 WeakPolarHBondContact O-CB 3.08Å; I338-F342 PolarHBondContact O-N 2.86Å; T339-F342 WeakPolarHBondContact O-CB 3.19Å; T339-F342 PolarHBondContact O-N 2.83Å; F340-F342 PolarHBondContact O-N 3.26Å; F342-K345 WeakPolarHBondContact O-CB 3.15Å; F342-K345 PolarHBondContact O-N 2.63Å; F342-A346 PolarHBondContact O-N 3.1Å
343	I	96.3	Very high	89.2	Confident	42 Å²	42	97.3 Å²	97.3	22%	0.215	46%	0.464	C	S	.	.	H	α-helix	trans	-63.6	-42.9	175.9	-67.2	163.3	0	0	0	110.8	Y279 L280 L303 T339 F340 K345 A346 K347	Y279-I343 HydrophobicContact CD2-CG2 4.48Å; Y279-I343 HydrophobicContact CE2-CG2 4.01Å; L280-I343 HydrophobicContact CD1-CD1 4.48Å; L280-I343 HydrophobicContact CD1-CG1 4.45Å; L280-I343 HydrophobicContact CD1-CG2 4.41Å; L303-I343 HydrophobicContact CD2-CD1 4.22Å; T339-I343 WeakPolarHBondContact O-CG1 3.38Å; T339-I343 PolarHBondContact O-N 3.38Å; F340-I343 PolarHBondContact O-N 2.9Å; I343-K345 VanDerWaalsContact C-N 3.35Å; I343-K345 PolarHBondContact O-N 2.85Å; I343-A346 PolarHBondContact O-N 3.35Å; I343-K347 PolarHBondContact O-N 3.32Å
344	V	95.2	Very high	89	Confident	50 Å²	50	94.5 Å²	94.5	30%	0.303	45%	0.447	S	S	.	.	H	α-helix	trans	-61.2	-44	175.8	169.7	0	0	0	0	110.9	F340 A346 K347 Y348	F340-V344 HydrophobicContact CD1-CG2 4.05Å; F340-V344 HydrophobicContact CD2-CG2 4.4Å; F340-V344 HydrophobicContact CE1-CG2 3.63Å; F340-V344 HydrophobicContact CE2-CG2 4.02Å; F340-V344 HydrophobicContact CG-CG2 4.42Å; F340-V344 HydrophobicContact CZ-CG2 3.61Å; F340-V344 WeakPolarHBondContact O-CB 3.3Å; F340-V344 VanDerWaalsContact O-CG2 3.31Å; F340-V344 WeakPolarHBondContact O-CG2 3.26Å; F340-V344 PolarHBondContact O-N 3.25Å; V344-A346 PolarHBondContact O-N 3.18Å; V344-K347 WeakPolarHBondContact O-CB 3.49Å; V344-K347 PolarHBondContact O-N 3.46Å; V344-Y348 HydrophobicContact CG1-CD2 4.04Å; V344-Y348 HydrophobicContact CG1-CE2 3.9Å; V344-Y348 WeakPolarHBondContact O-CD2 3.4Å; V344-Y348 PolarHBondContact O-N 3.48Å
345	K	94.8	Very high	88.7	Confident	120 Å²	120	92.5 Å²	92.5	52%	0.522	44%	0.44	S	S	.	.	H	α-helix	trans	-57.6	-49.7	174.8	-178.6	-177.6	177.2	-174.9	0	110.7	F301 K341 F342 I343 K347 Y348 V349	F301-K345 HydrophobicContact CE1-CD 4.36Å; F301-K345 HydrophobicContact CE1-CG 4.46Å; K341-K345 WeakPolarHBondContact O-CB 3.35Å; K341-K345 PolarHBondContact O-N 2.95Å; F342-K345 WeakPolarHBondContact O-CB 3.15Å; F342-K345 PolarHBondContact O-N 2.63Å; I343-K345 VanDerWaalsContact C-N 3.35Å; I343-K345 PolarHBondContact O-N 2.85Å; K345-K347 VanDerWaalsContact C-N 3.25Å; K345-K347 PolarHBondContact O-N 2.83Å; K345-Y348 PolarHBondContact O-N 3.02Å; K345-Y348 VanDerWaalsContact O-N 3.12Å; K345-V349 HydrophobicContact CG-CG2 3.94Å; K345-V349 WeakPolarHBondContact O-CG2 3.24Å; K345-V349 PolarHBondContact O-N 3.37Å
346	A	94	Very high	88.3	Confident	22 Å²	22	94.8 Å²	94.8	18%	0.182	45%	0.452	C	S	.	.	H	α-helix	trans	-56.8	-39.9	179.4	0	0	0	0	0	112.4	F301 F342 I343 V344 Y348 V349	F301-A346 HydrophobicContact CB-CB 3.69Å; F301-A346 HydrophobicContact CD1-CB 3.91Å; F301-A346 HydrophobicContact CD2-CB 3.6Å; F301-A346 HydrophobicContact CE1-CB 4.49Å; F301-A346 HydrophobicContact CE2-CB 4.21Å; F301-A346 HydrophobicContact CG-CB 3.45Å; F301-A346 VanDerWaalsContact CG-CB 3.45Å; F342-A346 PolarHBondContact O-N 3.1Å; I343-A346 PolarHBondContact O-N 3.35Å; V344-A346 PolarHBondContact O-N 3.18Å; A346-Y348 PolarHBondContact O-N 3.45Å; A346-V349 PolarHBondContact O-N 2.98Å
347	K	92.7	Very high	87.9	Confident	72 Å²	72	90.2 Å²	90.2	31%	0.313	44%	0.441	S	S	.	.	H	α-helix	trans	-59.5	-30.1	178.5	-176	-177.2	178	-175.1	0	114.1	Y279 I343 V344 K345	Y279-K347 HydrophobicContact CD1-CD 4.21Å; Y279-K347 HydrophobicContact CD1-CG 4.08Å; Y279-K347 HydrophobicContact CD2-CB 3.88Å; Y279-K347 HydrophobicContact CD2-CD 4.27Å; Y279-K347 HydrophobicContact CD2-CG 4Å; Y279-K347 HydrophobicContact CE1-CD 3.92Å; Y279-K347 HydrophobicContact CE1-CG 4.3Å; Y279-K347 HydrophobicContact CE2-CB 4.18Å; Y279-K347 HydrophobicContact CE2-CD 3.95Å; Y279-K347 HydrophobicContact CE2-CG 4.19Å; Y279-K347 HydrophobicContact CG-CB 4.22Å; Y279-K347 HydrophobicContact CG-CD 4.4Å; Y279-K347 HydrophobicContact CG-CG 3.94Å; I343-K347 PolarHBondContact O-N 3.32Å; V344-K347 WeakPolarHBondContact O-CB 3.49Å; V344-K347 PolarHBondContact O-N 3.46Å; K345-K347 VanDerWaalsContact C-N 3.25Å; K345-K347 PolarHBondContact O-N 2.83Å
348	Y	88.7	Confident	87.3	Confident	138 Å²	138	88.9 Å²	88.9	54%	0.541	43%	0.431	S	S	.	.	H	α-helix	trans	-107.7	-2.9	-174.1	-67.4	-69.7	0	0	0	114.3	V344 K345 A346 D350	V344-Y348 HydrophobicContact CG1-CD2 4.04Å; V344-Y348 HydrophobicContact CG1-CE2 3.9Å; V344-Y348 WeakPolarHBondContact O-CD2 3.4Å; V344-Y348 PolarHBondContact O-N 3.48Å; K345-Y348 PolarHBondContact O-N 3.02Å; K345-Y348 VanDerWaalsContact O-N 3.12Å; A346-Y348 PolarHBondContact O-N 3.45Å; Y348-D350 VanDerWaalsContact C-N 3.34Å
349	V	75.2	Confident	86.5	Confident	69 Å²	69	89.3 Å²	89.3	42%	0.418	43%	0.431	S	S	.	.	H	α-helix	trans	-80.1	-16.7	-177.1	165.7	0	0	0	0	112.8	F301 K345 A346	F301-V349 HydrophobicContact CE2-CB 3.93Å; F301-V349 HydrophobicContact CE2-CG1 3.8Å; F301-V349 HydrophobicContact CE2-CG2 4.37Å; F301-V349 HydrophobicContact CZ-CB 3.99Å; F301-V349 HydrophobicContact CZ-CG1 3.89Å; F301-V349 HydrophobicContact CZ-CG2 3.92Å; K345-V349 HydrophobicContact CG-CG2 3.94Å; K345-V349 WeakPolarHBondContact O-CG2 3.24Å; K345-V349 PolarHBondContact O-N 3.37Å; A346-V349 PolarHBondContact O-N 2.98Å
350	D	56.4	Low	85.6	Confident	132 Å²	132	94.9 Å²	94.9	71%	0.706	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	31.8	178.6	-69.3	-46.3	0	0	0	113.5	Y348	Y348-D350 VanDerWaalsContact C-N 3.34Å
351	M	44.6	Very low	84.7	Confident	209 Å²	209	93.2 Å²	93.2	100%	1.03	45%	0.452	S	S	*	.			trans	-108.5	0	166.5	-76.6	-168.2	-176.5	0	0	112.4

Retrieved 351 of 351 residues in 481.9 ms (Link to these results)

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