A0A2K5LUI6_CERAT Loading...

Sarcalumenin

AlphaFold DB , UniProt , Accession A0A2K5LUI6, Species CERAT (Cercocebus atys, Sooty mangabey), Gene n/a, Length 473 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	50.1	Low	42.1	Very low	241 Å²	241	132.2 Å²	132.2	100%	1.187	72%	0.724	S	S	*	*				0	45	0	-132.1	-176.9	-73.2	0	0	112.4
2	R	43.9	Very low	41.6	Very low	227 Å²	227	126.2 Å²	126.2	86%	0.857	71%	0.705	S	S	*	*			trans	-141.6	3.7	172.5	-84.6	-171.4	174.7	179	-2.4	113.9
3	A	43.3	Very low	41.2	Very low	85 Å²	85	122.6 Å²	122.6	70%	0.702	69%	0.693	S	S	*	*	S	Bend	trans	-104.6	-9.4	-178.5	0	0	0	0	0	114.3
4	L	41.5	Very low	40.7	Very low	166 Å²	166	122.8 Å²	122.8	87%	0.869	69%	0.691	S	S	*	*	S	Bend	trans	-92.9	-9.6	177.1	-106.7	97.1	0	0	0	114.4
5	V	44.4	Very low	40.1	Very low	116 Å²	116	124.5 Å²	124.5	70%	0.703	70%	0.696	S	S	*	*	S	Bend	trans	-90.5	-19.1	-179.5	-178.2	0	0	0	0	111.9
6	L	43.1	Very low	39.7	Very low	123 Å²	123	126.3 Å²	126.3	64%	0.644	70%	0.703	S	S	*	*	H	α-helix	trans	-84.8	-19.7	-179.4	-92	142.9	0	0	0	114.3
7	L	41.6	Very low	39.3	Very low	127 Å²	127	124.8 Å²	124.8	67%	0.665	70%	0.703	S	S	*	*	H	α-helix	trans	-81.4	-22.5	175.7	-120.5	82.6	0	0	0	113.1
8	G	39.1	Very low	38.7	Very low	50 Å²	50	121.2 Å²	121.2	52%	0.515	70%	0.699	S	S	.	*	H	α-helix	trans	-76.2	-27.6	178.2	0	0	0	0	0	114
9	C	40.6	Very low	38.2	Very low	96 Å²	96	124.4 Å²	124.4	65%	0.649	71%	0.707	S	S	*	*	H	α-helix	trans	-85.9	-18.5	179.4	-74.5	0	0	0	0	114.1	S13	C9-S13 PolarHBondContact O-OG 3.03Å
10	L	39.3	Very low	37.6	Very low	111 Å²	111	122.9 Å²	122.9	58%	0.581	71%	0.71	S	S	*	*	H	α-helix	trans	-89.3	-20.6	178.8	-92.1	151.9	0	0	0	113.6	S13	L10-S13 PolarHBondContact O-OG 3Å
11	L	36.4	Very low	37.1	Very low	112 Å²	112	124.7 Å²	124.7	59%	0.586	71%	0.712	S	S	*	*	H	α-helix	trans	-87.6	-21.3	173.4	-86.6	154.4	0	0	0	113
12	A	36.3	Very low	36	Very low	60 Å²	60	121.8 Å²	121.8	50%	0.496	70%	0.696	S	S	.	*	H	α-helix	trans	-77.3	-23.8	173.2	0	0	0	0	0	112.9
13	S	36.4	Very low	35.2	Very low	80 Å²	80	116.1 Å²	116.1	56%	0.559	69%	0.686	S	S	*	*	S	Bend	trans	-86.9	-11.1	178.2	49	0	0	0	0	114.4	C9 L10	C9-S13 PolarHBondContact O-OG 3.03Å; L10-S13 PolarHBondContact O-OG 3Å
14	L	33.9	Very low	34.5	Very low	125 Å²	125	120.3 Å²	120.3	65%	0.654	69%	0.692	S	S	*	*	S	Bend	trans	-104.6	-2.1	179.1	-98.9	137.5	0	0	0	114.3
15	L	32	Very low	34	Very low	148 Å²	148	119.5 Å²	119.5	78%	0.775	69%	0.688	S	S	*	*	S	Bend	trans	-110	4.4	175.8	-81.1	160	0	0	0	113.5
16	L	34.1	Very low	33.5	Very low	153 Å²	153	117.8 Å²	117.8	80%	0.801	69%	0.686	S	S	*	*			trans	-107	11.6	172.3	-94.7	137.6	0	0	0	113.2	G18	L16-G18 PolarHBondContact O-N 3.06Å
17	S	32.3	Very low	33.4	Very low	101 Å²	101	119.1 Å²	119.1	71%	0.706	69%	0.694	S	S	*	*			trans	-76.8	57.7	157.4	60.7	0	0	0	0	109.4
18	G	29.2	Very low	33.5	Very low	61 Å²	61	121.5 Å²	121.5	63%	0.629	70%	0.701	S	S	*	*			trans	-64.1	133.9	158.2	0	0	0	0	0	106.9	L16 A20	L16-G18 PolarHBondContact O-N 3.06Å; G18-A20 PolarHBondContact O-N 3.38Å
19	Q	28.5	Very low	34.3	Very low	182 Å²	182	127.3 Å²	127.3	85%	0.85	72%	0.715	S	S	*	*			trans	-42.7	106.2	174.6	-68.7	161.8	-58.6	0	0	109.1	E21	Q19-E21 PolarHBondContact O-N 3.37Å
20	A	26.5	Very low	35.2	Very low	93 Å²	93	125.8 Å²	125.8	77%	0.769	71%	0.71	S	S	*	*			trans	-67.1	92.3	146.9	0	0	0	0	0	103.3	G18 E22	G18-A20 PolarHBondContact O-N 3.38Å; A20-E22 PolarHBondContact O-N 3.28Å
21	E	27.1	Very low	36.8	Very low	162 Å²	162	124.2 Å²	124.2	76%	0.757	71%	0.706	S	S	*	*			trans	-51.9	106.1	151.8	-79.3	178.6	155.6	0	0	104.3	Q19 T23	Q19-E21 PolarHBondContact O-N 3.37Å; E21-T23 PolarHBondContact O-N 2.94Å
22	E	26.9	Very low	39	Very low	180 Å²	180	124.1 Å²	124.1	84%	0.841	71%	0.706	S	S	*	*			trans	-53.5	89.1	150.5	-71.6	176	159.8	0	0	104.4	A20 E24	A20-E22 PolarHBondContact O-N 3.28Å; E22-E24 PolarHBondContact O-N 3.4Å
23	T	27.1	Very low	41.5	Very low	108 Å²	108	122.7 Å²	122.7	66%	0.663	69%	0.687	S	S	*	*			trans	-59.4	92.1	148.8	43.7	0	0	0	0	103.3	E21 D25	E21-T23 PolarHBondContact O-N 2.94Å; T23-D25 PolarHBondContact O-N 3.43Å
24	E	29	Very low	43.8	Very low	173 Å²	173	124.2 Å²	124.2	81%	0.808	69%	0.689	S	S	*	*			trans	-42.1	101.8	144.5	-71.6	-176.5	154.9	0	0	104	E22 A26	E22-E24 PolarHBondContact O-N 3.4Å; E24-A26 PolarHBondContact O-N 3.02Å
25	D	30.3	Very low	46.4	Very low	149 Å²	149	121.5 Å²	121.5	80%	0.797	67%	0.67	S	S	*	*			trans	-60	82.7	158.4	-83.7	-33	0	0	0	103.7	T23 N27	T23-D25 PolarHBondContact O-N 3.43Å; D25-N27 PolarHBondContact O-N 2.69Å
26	A	33.1	Very low	49	Very low	79 Å²	79	117.5 Å²	117.5	65%	0.653	65%	0.654	S	S	*	*			trans	-55.2	98	156.2	0	0	0	0	0	103.2	E24 E28	E24-A26 PolarHBondContact O-N 3.02Å; A26-E28 PolarHBondContact O-N 2.67Å
27	N	40.7	Very low	51.6	Low	152 Å²	152	111.3 Å²	111.3	81%	0.813	62%	0.621	S	S	*	*			trans	-55.3	80	153.3	-98.3	-16.7	0	0	0	105.4	D25 E29	D25-N27 PolarHBondContact O-N 2.69Å; N27-E29 PolarHBondContact O-N 2.71Å
28	E	44.1	Very low	54.3	Low	176 Å²	176	106.5 Å²	106.5	82%	0.822	59%	0.588	S	S	*	*			trans	-56.2	99.4	148.3	-76.3	-172.4	157.6	0	0	103.4	A26 A30	A26-E28 PolarHBondContact O-N 2.67Å; E28-A30 VanDerWaalsContact C-N 3.34Å; E28-A30 PolarHBondContact O-N 2.93Å
29	E	55.6	Low	57.2	Low	172 Å²	172	107.9 Å²	107.9	80%	0.804	58%	0.578	S	S	*	*			trans	-51	106.9	172.9	-74.8	-176.4	158.6	0	0	106.2	N27	N27-E29 PolarHBondContact O-N 2.71Å
30	A	61.1	Low	60	Low	65 Å²	65	106.6 Å²	106.6	54%	0.537	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-50.7	134.5	-179.7	0	0	0	0	0	108	E28 L32	E28-A30 VanDerWaalsContact C-N 3.34Å; E28-A30 PolarHBondContact O-N 2.93Å; A30-L32 PolarHBondContact O-N 3.26Å
31	P	71.3	Confident	62.9	Low	77 Å²	77	103.1 Å²	103.1	50%	0.5	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-53.2	129.7	-175.8	18.1	-29.7	0	0	0	110.2	E297	P31-E297 HydrophobicContact CG-CG 4.47Å; P31-E297 WeakPolarHBondContact CG-OE1 3.34Å
32	L	84	Confident	65.8	Low	111 Å²	111	95.4 Å²	95.4	58%	0.581	50%	0.503	S	S	*	.	B	Isolated β-bridge	trans	-78.5	141.1	176.5	-58.9	175.8	0	0	0	109.2	A30 P295	A30-L32 PolarHBondContact O-N 3.26Å; L32-P295 CarbonylContact C-O 3.59Å; L32-P295 WeakPolarHBondContact CA-O 3.34Å; L32-P295 HydrophobicContact CD2-CB 4.05Å; L32-P295 HydrophobicContact CD2-CG 4.3Å
33	R	87.9	Confident	68.4	Low	30 Å²	30	89 Å²	89	11%	0.113	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-62.7	143.2	175.3	-66.4	-167.8	-62.3	132.8	-4.8	110.9	Y112 S292 W294 P295 Q296 E297 Y298 E311	R33-Y112 PolarHBondContact NH1-OH 3.02Å; R33-Y112 VanDerWaalsContact NH2-CZ 3.33Å; R33-Y112 PolarHBondContact NH2-OH 2.73Å; R33-Y112 VanDerWaalsContact NH2-OH 3.15Å; R33-S292 PolarHBondContact NH2-O 3.4Å; R33-W294 PolarHBondContact NE-O 3.02Å; R33-W294 PolarHBondContact NH2-O 2.86Å; R33-P295 PolarHBondContact N-O 3.45Å; R33-Q296 VanDerWaalsContact CD-O 3.22Å; R33-Q296 WeakPolarHBondContact CD-O 3.33Å; R33-Q296 WeakPolarHBondContact CG-O 3.27Å; R33-Q296 PolarHBondContact NE-O 3.26Å; R33-E297 HydrophobicContact CG-CG 4.21Å; R33-Y298 VanDerWaalsContact NH1-CZ 3.32Å; R33-Y298 PolarHBondContact NH1-OH 3.44Å; R33-E311 IonicContact CZ-OE2 3.27Å; R33-E311 IonicContact NH1-OE2 3.79Å; R33-E311 PolarHBondContact NH1-OE2 3.21Å; R33-E311 IonicContact NH2-OE2 3.17Å
34	D	85.7	Confident	70.9	Confident	112 Å²	112	84.8 Å²	84.8	60%	0.599	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-60.2	138	169.2	-178.2	27.5	0	0	0	110.5	S36 H37	D34-S36 WeakPolarHBondContact OD1-CB 3.43Å; D34-S36 PolarHBondContact OD1-N 3.45Å; D34-S36 PolarHBondContact OD1-OG 3.1Å; D34-S36 WeakPolarHBondContact OD2-CB 3.06Å; D34-S36 PolarHBondContact OD2-OG 3.04Å; D34-H37 PolarHBondContact O-CE1 2.88Å; D34-H37 VanDerWaalsContact O-CE1 3.32Å; D34-H37 PolarHBondContact O-ND1 2.95Å
35	R	87.7	Confident	73	Confident	68 Å²	68	81.8 Å²	81.8	26%	0.257	44%	0.436	S	S	.	.			trans	-116.2	7.4	-179.4	-67.4	174.5	63	-117.2	-11.7	112.1	H37 I38 Y112 L113	R35-H37 PolarHBondContact O-N 3.03Å; R35-I38 HydrophobicContact CB-CD1 4.22Å; R35-I38 HydrophobicContact CG-CD1 4.21Å; R35-I38 WeakPolarHBondContact O-CB 3.35Å; R35-I38 PolarHBondContact O-N 3.15Å; R35-Y112 HydrophobicContact CG-CE2 4.01Å; R35-Y112 VanDerWaalsContact CZ-O 3.29Å; R35-Y112 PolarHBondContact NE-O 3.48Å; R35-Y112 VanDerWaalsContact NE-O 3.11Å; R35-Y112 PolarHBondContact NH2-O 3.33Å; R35-L113 PolarHBondContact NH2-O 3.34Å
36	S	87.1	Confident	75	Confident	63 Å²	63	80 Å²	80	44%	0.441	42%	0.423	S	S	.	.	H	α-helix	trans	-57	-32.2	-179.4	72	0	0	0	0	113.2	D34 I38 E39 K40	D34-S36 WeakPolarHBondContact OD1-CB 3.43Å; D34-S36 PolarHBondContact OD1-N 3.45Å; D34-S36 PolarHBondContact OD1-OG 3.1Å; D34-S36 WeakPolarHBondContact OD2-CB 3.06Å; D34-S36 PolarHBondContact OD2-OG 3.04Å; S36-I38 VanDerWaalsContact C-N 3.31Å; S36-I38 PolarHBondContact O-N 3.03Å; S36-E39 PolarHBondContact O-N 3.49Å; S36-K40 WeakPolarHBondContact O-CB 3.46Å; S36-K40 PolarHBondContact O-N 3.13Å
37	H	88.9	Confident	76.3	Confident	23 Å²	23	83.7 Å²	83.7	11%	0.106	43%	0.432	C	S	.	.	H	α-helix	trans	-64.6	-33.5	175.1	65.4	-71.5	0	0	0	112.4	D34 R35 K40 T41 E311	D34-H37 PolarHBondContact O-CE1 2.88Å; D34-H37 VanDerWaalsContact O-CE1 3.32Å; D34-H37 PolarHBondContact O-ND1 2.95Å; R35-H37 PolarHBondContact O-N 3.03Å; H37-K40 PolarHBondContact O-N 3.49Å; H37-T41 VanDerWaalsContact O-CB 3.28Å; H37-T41 WeakPolarHBondContact O-CB 3.42Å; H37-T41 PolarHBondContact O-N 3.03Å; H37-T41 PolarHBondContact O-OG1 3.4Å; H37-E311 IonicContact CD2-OE1 3.89Å; H37-E311 IonicContact CE1-OE1 2.66Å; H37-E311 VanDerWaalsContact NE2-CD 3.31Å; H37-E311 IonicContact NE2-OE1 3.19Å; H37-E311 PolarHBondContact NE2-OE1 3.23Å; H37-E311 IonicContact NE2-OE2 3.01Å
38	I	89.6	Confident	77.3	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-64	-49.4	177	-55.7	-176.2	0	0	0	109.8	R35 S36 K40 T41 L42 Y112 L315	R35-I38 HydrophobicContact CB-CD1 4.22Å; R35-I38 HydrophobicContact CG-CD1 4.21Å; R35-I38 WeakPolarHBondContact O-CB 3.35Å; R35-I38 PolarHBondContact O-N 3.15Å; S36-I38 VanDerWaalsContact C-N 3.31Å; S36-I38 PolarHBondContact O-N 3.03Å; I38-K40 VanDerWaalsContact C-N 3.3Å; I38-K40 PolarHBondContact O-N 3.42Å; I38-T41 PolarHBondContact O-N 3.46Å; I38-L42 HydrophobicContact CG2-CD1 3.78Å; I38-L42 HydrophobicContact CG2-CG 4.4Å; I38-L42 VanDerWaalsContact O-CB 3.3Å; I38-L42 WeakPolarHBondContact O-CB 3.34Å; I38-L42 WeakPolarHBondContact O-CG 3.49Å; I38-L42 PolarHBondContact O-N 3.43Å; I38-Y112 HydrophobicContact CD1-CD1 4.5Å; I38-Y112 HydrophobicContact CD1-CE1 3.89Å; I38-Y112 HydrophobicContact CD1-CE2 4.38Å; I38-L315 HydrophobicContact CB-CD1 4.41Å; I38-L315 HydrophobicContact CG1-CD1 3.99Å; I38-L315 HydrophobicContact CG2-CD2 4.21Å
39	E	88.1	Confident	77.7	Confident	89 Å²	89	76.1 Å²	76.1	42%	0.416	40%	0.399	S	S	.	.	H	α-helix	trans	-62.6	-40.7	179.8	-60.1	-171.7	173.6	0	0	111.9	S36 M43 L44	S36-E39 PolarHBondContact O-N 3.49Å; E39-M43 PolarHBondContact O-N 2.97Å; E39-M43 VanDerWaalsContact O-N 3.14Å; E39-L44 HydrophobicContact CG-CD1 4.36Å; E39-L44 PolarHBondContact O-N 3.18Å
40	K	88.5	Confident	77.7	Confident	155 Å²	155	71.9 Å²	71.9	67%	0.674	39%	0.388	S	S	*	.	H	α-helix	trans	-66.2	-51.7	178.4	-174.6	-178.7	177.1	-174.3	0	111.7	S36 H37 I38 M43	S36-K40 WeakPolarHBondContact O-CB 3.46Å; S36-K40 PolarHBondContact O-N 3.13Å; H37-K40 PolarHBondContact O-N 3.49Å; I38-K40 VanDerWaalsContact C-N 3.3Å; I38-K40 PolarHBondContact O-N 3.42Å; K40-M43 PolarHBondContact O-N 2.91Å
41	T	87.8	Confident	77.5	Confident	21 Å²	21	74.5 Å²	74.5	13%	0.129	39%	0.393	C	S	.	.	H	α-helix	trans	-68.5	-36.8	-176	-58.2	0	0	0	0	112	H37 I38 M43 L315 E316 N319	H37-T41 VanDerWaalsContact O-CB 3.28Å; H37-T41 WeakPolarHBondContact O-CB 3.42Å; H37-T41 PolarHBondContact O-N 3.03Å; H37-T41 PolarHBondContact O-OG1 3.4Å; I38-T41 PolarHBondContact O-N 3.46Å; T41-M43 VanDerWaalsContact C-N 3.27Å; T41-M43 PolarHBondContact O-N 2.98Å; T41-L315 HydrophobicContact CG2-CB 3.59Å; T41-E316 HydrophobicContact CG2-CG 3.71Å; T41-N319 PolarHBondContact O-ND2 3.36Å
42	L	86.8	Confident	77.3	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	0.5	177.1	-61.2	-176.8	0	0	0	113.7	I38 L44 L182 R185 L315 L318 N319	I38-L42 HydrophobicContact CG2-CD1 3.78Å; I38-L42 HydrophobicContact CG2-CG 4.4Å; I38-L42 VanDerWaalsContact O-CB 3.3Å; I38-L42 WeakPolarHBondContact O-CB 3.34Å; I38-L42 WeakPolarHBondContact O-CG 3.49Å; I38-L42 PolarHBondContact O-N 3.43Å; L42-L44 VanDerWaalsContact C-N 3.29Å; L42-L44 HydrophobicContact CB-CD2 3.91Å; L42-L44 HydrophobicContact CB-CG 3.93Å; L42-L44 PolarHBondContact O-N 3.48Å; L42-L182 HydrophobicContact CD1-CD1 4.03Å; L42-L182 HydrophobicContact CD1-CD2 3.66Å; L42-L182 HydrophobicContact CD1-CG 4.47Å; L42-R185 PolarHBondContact O-NH1 2.99Å; L42-L315 HydrophobicContact CD1-CD2 4.04Å; L42-L315 HydrophobicContact CD2-CB 4.29Å; L42-L315 HydrophobicContact CD2-CD2 4.17Å; L42-L315 WeakPolarHBondContact CD2-O 3.5Å; L42-L315 HydrophobicContact CG-CD2 4.14Å; L42-L318 HydrophobicContact CD1-CD2 4.46Å; L42-L318 HydrophobicContact CD2-CB 4.48Å; L42-L318 HydrophobicContact CD2-CD2 4.06Å; L42-L318 HydrophobicContact CD2-CG 4.2Å; L42-N319 HydrophobicContact CD2-CB 4.14Å
43	M	82.8	Confident	77	Confident	45 Å²	45	72.7 Å²	72.7	22%	0.222	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	43.3	178.7	-56.8	174	171.8	0	0	112.3	E39 K40 T41 N45 E46	E39-M43 PolarHBondContact O-N 2.97Å; E39-M43 VanDerWaalsContact O-N 3.14Å; K40-M43 PolarHBondContact O-N 2.91Å; T41-M43 VanDerWaalsContact C-N 3.27Å; T41-M43 PolarHBondContact O-N 2.98Å; M43-N45 PolarHBondContact O-N 3.2Å; M43-E46 PolarHBondContact O-N 3.43Å
44	L	79	Confident	76.8	Confident	19 Å²	19	74.1 Å²	74.1	10%	0.099	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-15	-175.5	-59.4	-175.5	0	0	0	113.4	E39 L42 K181 L182	E39-L44 HydrophobicContact CG-CD1 4.36Å; E39-L44 PolarHBondContact O-N 3.18Å; L42-L44 VanDerWaalsContact C-N 3.29Å; L42-L44 HydrophobicContact CB-CD2 3.91Å; L42-L44 HydrophobicContact CB-CG 3.93Å; L42-L44 PolarHBondContact O-N 3.48Å; L44-K181 WeakPolarHBondContact O-CD 3.25Å; L44-K181 PolarHBondContact O-NZ 2.89Å; L44-L182 HydrophobicContact CD2-CB 3.89Å; L44-L182 HydrophobicContact CD2-CD1 4.12Å
45	N	72.7	Confident	76.9	Confident	110 Å²	110	71.2 Å²	71.2	59%	0.588	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.3	-178.1	-66.9	-31.2	0	0	0	113.6	M43	M43-N45 PolarHBondContact O-N 3.2Å
46	E	72.1	Confident	76.9	Confident	111 Å²	111	68.5 Å²	68.5	52%	0.519	37%	0.374	S	S	.	.	S	Bend	trans	-95.5	120.2	177.5	-63.1	-173.3	171.3	0	0	110.8	M43 K48	M43-E46 PolarHBondContact O-N 3.43Å; E46-K48 PolarHBondContact O-N 3.17Å
47	D	61.1	Low	77.1	Confident	157 Å²	157	67 Å²	67	84%	0.84	36%	0.361	S	S	*	.			trans	-73.2	107.6	170.9	-70.1	-31.2	0	0	0	109.2
48	K	61	Low	77.1	Confident	68 Å²	68	72.3 Å²	72.3	30%	0.296	39%	0.386	S	S	.	.			trans	-86.4	139.9	174.3	-73.4	-171.9	178.8	-179.7	0	111	E46 S50 E323	E46-K48 PolarHBondContact O-N 3.17Å; K48-S50 PolarHBondContact O-N 3.08Å; K48-E323 IonicContact NZ-OE1 3.6Å; K48-E323 PolarHBondContact NZ-OE1 3.27Å; K48-E323 IonicContact NZ-OE2 3.69Å; K48-E323 PolarHBondContact NZ-OE2 2.99Å
49	P	53.1	Low	77.3	Confident	101 Å²	101	79 Å²	79	66%	0.656	41%	0.411	S	S	*	.			trans	-63.1	111.4	175	24.6	-30.8	0	0	0	109.7	D51	P49-D51 PolarHBondContact O-N 2.85Å
50	S	56	Low	77.5	Confident	83 Å²	83	74.9 Å²	74.9	58%	0.58	39%	0.392	S	S	*	.	S	Bend	trans	-62.6	-26	177.4	49.8	0	0	0	0	113.2	K48 D52	K48-S50 PolarHBondContact O-N 3.08Å; S50-D52 PolarHBondContact O-N 3.42Å
51	D	55.6	Low	77.8	Confident	120 Å²	120	72.8 Å²	72.8	64%	0.642	38%	0.38	S	S	*	.	H	α-helix	trans	-74.5	-32.2	-159.2	-65.4	-7	0	0	0	113	P49 S54	P49-D51 PolarHBondContact O-N 2.85Å; D51-S54 PolarHBondContact O-OG 3.25Å
52	D	67.3	Low	78.1	Confident	99 Å²	99	79.1 Å²	79.1	53%	0.529	41%	0.405	S	S	.	.	H	α-helix	trans	-71.8	-37	-178.2	-161.1	22.7	0	0	0	112.2	S50 S54 A55 V56	S50-D52 PolarHBondContact O-N 3.42Å; D52-S54 PolarHBondContact O-N 3.05Å; D52-A55 PolarHBondContact O-N 3.21Å; D52-V56 WeakPolarHBondContact O-CG2 3.27Å; D52-V56 PolarHBondContact O-N 3Å
53	Y	79.4	Confident	78.5	Confident	51 Å²	51	79.4 Å²	79.4	20%	0.2	41%	0.407	C	S	.	.	H	α-helix	trans	-63.6	-42.8	179.3	-73.2	-83.6	0	0	0	112.4	A55 V56 L57 R325 L326	Y53-A55 PolarHBondContact O-N 3.41Å; Y53-V56 PolarHBondContact O-N 3Å; Y53-L57 WeakPolarHBondContact O-CG 3.47Å; Y53-L57 PolarHBondContact O-N 3.46Å; Y53-R325 VanDerWaalsContact CD1-NE 3.34Å; Y53-R325 HydrophobicContact CE1-CG 4.28Å; Y53-R325 VanDerWaalsContact CE1-NE 3.3Å; Y53-L326 HydrophobicContact CD1-CD1 3.29Å; Y53-L326 HydrophobicContact CD1-CD2 3.92Å; Y53-L326 HydrophobicContact CD1-CG 3.5Å; Y53-L326 VanDerWaalsContact CD1-CG 3.5Å; Y53-L326 HydrophobicContact CE1-CD1 3.57Å; Y53-L326 HydrophobicContact CE1-CG 3.71Å; Y53-L326 HydrophobicContact CG-CD1 4.22Å
54	S	82.8	Confident	79.1	Confident	60 Å²	60	77.4 Å²	77.4	42%	0.42	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-40.9	-177.3	74.9	0	0	0	0	111.9	D51 D52 L57 Q58	D51-S54 PolarHBondContact O-OG 3.25Å; D52-S54 PolarHBondContact O-N 3.05Å; S54-L57 PolarHBondContact O-N 2.88Å; S54-Q58 VanDerWaalsContact O-CG 3.28Å; S54-Q58 WeakPolarHBondContact O-CG 3.39Å; S54-Q58 PolarHBondContact O-N 3.14Å
55	A	87.1	Confident	79.9	Confident	51 Å²	51	79.5 Å²	79.5	42%	0.421	41%	0.406	S	S	.	.	H	α-helix	trans	-66.9	-43	179.5	0	0	0	0	0	112	D52 Y53 Q58 R59	D52-A55 PolarHBondContact O-N 3.21Å; Y53-A55 PolarHBondContact O-N 3.41Å; A55-Q58 PolarHBondContact O-N 3.24Å; A55-R59 PolarHBondContact O-N 3.07Å
56	V	89.1	Confident	80.9	Confident	11 Å²	11	76.7 Å²	76.7	7%	0.067	40%	0.395	C	S	.	.	H	α-helix	trans	-64.2	-43.5	177.3	175.9	0	0	0	0	111	D52 Y53 Q58 R59 L60 L326 I330 L446	D52-V56 WeakPolarHBondContact O-CG2 3.27Å; D52-V56 PolarHBondContact O-N 3Å; Y53-V56 PolarHBondContact O-N 3Å; V56-Q58 PolarHBondContact O-N 3.22Å; V56-R59 PolarHBondContact O-N 2.87Å; V56-L60 WeakPolarHBondContact O-CB 3.2Å; V56-L60 PolarHBondContact O-N 2.69Å; V56-L326 HydrophobicContact CB-CD1 4.24Å; V56-L326 HydrophobicContact CG1-CD1 4.15Å; V56-L326 HydrophobicContact CG1-CD2 4.44Å; V56-I330 HydrophobicContact CG1-CD1 4.47Å; V56-L446 HydrophobicContact CG2-CD2 4.16Å
57	L	89.5	Confident	82	Confident	31 Å²	31	71.8 Å²	71.8	16%	0.162	37%	0.373	C	S	.	.	H	α-helix	trans	-63.6	-40.5	176.7	-71.3	175.8	0	0	0	112.3	Y53 S54 R59 L60 R61 L326	Y53-L57 WeakPolarHBondContact O-CG 3.47Å; Y53-L57 PolarHBondContact O-N 3.46Å; S54-L57 PolarHBondContact O-N 2.88Å; L57-R59 VanDerWaalsContact C-N 3.34Å; L57-R59 PolarHBondContact O-N 3.02Å; L57-L60 PolarHBondContact O-N 2.99Å; L57-R61 WeakPolarHBondContact O-CB 3.38Å; L57-R61 PolarHBondContact O-N 3.24Å; L57-L326 HydrophobicContact CD2-CD2 3.8Å; L57-L326 HydrophobicContact CG-CD2 3.99Å
58	Q	90.8	Very high	83.7	Confident	136 Å²	136	64.3 Å²	64.3	64%	0.636	33%	0.333	S	S	*	.	H	α-helix	trans	-62.4	-41.7	174.3	-74.7	176	8.6	0	0	111.9	S54 A55 V56 R61 K62	S54-Q58 VanDerWaalsContact O-CG 3.28Å; S54-Q58 WeakPolarHBondContact O-CG 3.39Å; S54-Q58 PolarHBondContact O-N 3.14Å; A55-Q58 PolarHBondContact O-N 3.24Å; V56-Q58 PolarHBondContact O-N 3.22Å; Q58-R61 PolarHBondContact O-N 2.99Å; Q58-K62 WeakPolarHBondContact O-CB 3.4Å; Q58-K62 PolarHBondContact O-N 3.13Å
59	R	92.3	Very high	85.3	Confident	141 Å²	141	63.4 Å²	63.4	53%	0.532	33%	0.329	S	S	.	.	H	α-helix	trans	-66.9	-40.8	176.3	-171.8	165.1	171.1	-170.8	1.8	111.7	A55 V56 L57 K62 I63 L442	A55-R59 PolarHBondContact O-N 3.07Å; V56-R59 PolarHBondContact O-N 2.87Å; L57-R59 VanDerWaalsContact C-N 3.34Å; L57-R59 PolarHBondContact O-N 3.02Å; R59-K62 WeakPolarHBondContact O-CB 3.36Å; R59-K62 PolarHBondContact O-N 3.36Å; R59-I63 HydrophobicContact CG-CD1 4.46Å; R59-I63 WeakPolarHBondContact O-CG1 3.32Å; R59-I63 PolarHBondContact O-N 2.88Å; R59-L442 HydrophobicContact CB-CD2 4.36Å; R59-L442 HydrophobicContact CG-CD2 3.9Å
60	L	93.5	Very high	87.3	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-46	174.7	-174.8	61.8	0	0	0	111.4	V56 L57 K62 I63 Y64 I90 K329 I330 I333 L439 L442	V56-L60 WeakPolarHBondContact O-CB 3.2Å; V56-L60 PolarHBondContact O-N 2.69Å; L57-L60 PolarHBondContact O-N 2.99Å; L60-K62 VanDerWaalsContact C-N 3.32Å; L60-K62 PolarHBondContact O-N 3.39Å; L60-I63 PolarHBondContact O-N 3.06Å; L60-Y64 PolarHBondContact O-N 2.92Å; L60-I90 HydrophobicContact CD2-CG2 4.13Å; L60-I90 HydrophobicContact CG-CG2 4.15Å; L60-K329 HydrophobicContact CD2-CB 4.37Å; L60-K329 HydrophobicContact CD2-CG 3.76Å; L60-I330 HydrophobicContact CD1-CG1 4.28Å; L60-I330 HydrophobicContact CD2-CG1 4.29Å; L60-I333 HydrophobicContact CD1-CB 4.13Å; L60-I333 HydrophobicContact CD1-CG1 4.2Å; L60-I333 HydrophobicContact CD1-CG2 4.06Å; L60-I333 HydrophobicContact CD2-CG1 4.14Å; L60-I333 HydrophobicContact CG-CG1 4.28Å; L60-L439 HydrophobicContact CD1-CD2 3.42Å; L60-L439 VanDerWaalsContact CD1-CD2 3.42Å; L60-L442 HydrophobicContact CB-CD1 4.42Å; L60-L442 HydrophobicContact CD1-CD1 4.23Å
61	R	93.9	Very high	89.1	Confident	112 Å²	112	56.1 Å²	56.1	42%	0.423	28%	0.28	S	S	.	.	H	α-helix	trans	-57.7	-44.5	173.9	-175.7	177.5	179.7	-159.7	-0.1	111.3	L57 Q58 I63 Y64 H65 D87 I90	L57-R61 WeakPolarHBondContact O-CB 3.38Å; L57-R61 PolarHBondContact O-N 3.24Å; Q58-R61 PolarHBondContact O-N 2.99Å; R61-I63 PolarHBondContact O-N 2.84Å; R61-Y64 PolarHBondContact O-N 3.5Å; R61-H65 PolarHBondContact O-CD2 3.33Å; R61-H65 VanDerWaalsContact O-CD2 3.25Å; R61-H65 PolarHBondContact O-N 2.85Å; R61-D87 IonicContact CZ-OD1 3.3Å; R61-D87 IonicContact CZ-OD2 3.59Å; R61-D87 IonicContact NE-OD1 2.78Å; R61-D87 PolarHBondContact NE-OD1 2.94Å; R61-D87 IonicContact NE-OD2 3.97Å; R61-D87 PolarHBondContact NE-OD2 3.08Å; R61-D87 IonicContact NH2-OD1 3.06Å; R61-D87 IonicContact NH2-OD2 3.61Å; R61-D87 PolarHBondContact NH2-OD2 3.12Å; R61-I90 HydrophobicContact CB-CG2 4.36Å
62	K	94.8	Very high	90.9	Very high	153 Å²	153	50.5 Å²	50.5	67%	0.665	25%	0.249	S	C	*	.	H	α-helix	trans	-58.6	-47.8	176.2	-174.9	179.1	179.1	178.6	0	111.8	Q58 R59 L60 Y64 H65 S66	Q58-K62 WeakPolarHBondContact O-CB 3.4Å; Q58-K62 PolarHBondContact O-N 3.13Å; R59-K62 WeakPolarHBondContact O-CB 3.36Å; R59-K62 PolarHBondContact O-N 3.36Å; L60-K62 VanDerWaalsContact C-N 3.32Å; L60-K62 PolarHBondContact O-N 3.39Å; K62-Y64 VanDerWaalsContact C-N 3.33Å; K62-Y64 PolarHBondContact O-N 3Å; K62-H65 PolarHBondContact O-N 3.35Å; K62-S66 WeakPolarHBondContact O-CB 3.19Å; K62-S66 PolarHBondContact O-N 3.35Å; K62-S66 PolarHBondContact O-OG 3Å
63	I	95.3	Very high	92.2	Very high	7 Å²	7	51.3 Å²	51.3	4%	0.036	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-44.3	178	-65.7	168.5	0	0	0	110.7	R59 L60 R61 S66 S67 A434 E438 L439 L442	R59-I63 HydrophobicContact CG-CD1 4.46Å; R59-I63 WeakPolarHBondContact O-CG1 3.32Å; R59-I63 PolarHBondContact O-N 2.88Å; L60-I63 PolarHBondContact O-N 3.06Å; R61-I63 PolarHBondContact O-N 2.84Å; I63-S66 PolarHBondContact O-N 2.89Å; I63-S67 VanDerWaalsContact O-CB 3.27Å; I63-S67 WeakPolarHBondContact O-CB 3.42Å; I63-S67 PolarHBondContact O-N 3.37Å; I63-A434 HydrophobicContact CG2-CB 3.88Å; I63-E438 HydrophobicContact CD1-CB 3.91Å; I63-L439 HydrophobicContact CD1-CD2 4.16Å; I63-L439 HydrophobicContact CG2-CD2 4.05Å; I63-L439 HydrophobicContact CG2-CG 4.3Å; I63-L442 HydrophobicContact CD1-CD1 3.7Å; I63-L442 HydrophobicContact CD1-CG 4.37Å
64	Y	95.6	Very high	92.9	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.008	25%	0.252	C	S	.	.	I	π-helix	trans	-58.3	-52.5	178.1	178.1	-101.7	0	0	0	111.7	L60 R61 K62 S66 I68 K69 E72 I85 I90	L60-Y64 PolarHBondContact O-N 2.92Å; R61-Y64 PolarHBondContact O-N 3.5Å; K62-Y64 VanDerWaalsContact C-N 3.33Å; K62-Y64 PolarHBondContact O-N 3Å; Y64-S66 PolarHBondContact O-N 3.25Å; Y64-I68 HydrophobicContact CD2-CB 3.93Å; Y64-I68 HydrophobicContact CD2-CD1 4.07Å; Y64-I68 HydrophobicContact CD2-CG2 4.01Å; Y64-I68 HydrophobicContact CE2-CB 4.3Å; Y64-I68 HydrophobicContact CE2-CG2 3.95Å; Y64-I68 WeakPolarHBondContact O-CB 3.26Å; Y64-I68 PolarHBondContact O-N 3.19Å; Y64-K69 HydrophobicContact CD1-CB 4.43Å; Y64-K69 HydrophobicContact CE1-CB 4.09Å; Y64-K69 HydrophobicContact CE1-CD 4.07Å; Y64-K69 HydrophobicContact CE1-CG 4.33Å; Y64-K69 WeakPolarHBondContact O-CB 3.33Å; Y64-K69 PolarHBondContact O-N 2.74Å; Y64-E72 PolarHBondContact OH-OE1 2.97Å; Y64-E72 PolarHBondContact OH-OE2 2.98Å; Y64-I85 HydrophobicContact CE2-CB 4.33Å; Y64-I85 HydrophobicContact CE2-CG2 4.46Å; Y64-I85 PolarHBondContact OH-O 2.81Å; Y64-I90 HydrophobicContact CD1-CD1 3.5Å; Y64-I90 VanDerWaalsContact CD1-CD1 3.5Å; Y64-I90 HydrophobicContact CD2-CD1 4.38Å; Y64-I90 HydrophobicContact CE1-CD1 4.13Å; Y64-I90 HydrophobicContact CG-CD1 3.65Å
65	H	95	Very high	93.5	Very high	63 Å²	63	47.7 Å²	47.7	29%	0.292	23%	0.232	S	C	.	.	I	π-helix	trans	-68.6	-34.5	-179.2	-76.3	-75.5	0	0	0	114	R61 K62 K69 P70 D87	R61-H65 PolarHBondContact O-CD2 3.33Å; R61-H65 VanDerWaalsContact O-CD2 3.25Å; R61-H65 PolarHBondContact O-N 2.85Å; K62-H65 PolarHBondContact O-N 3.35Å; H65-K69 VanDerWaalsContact ND1-CD 3.33Å; H65-K69 WeakPolarHBondContact ND1-CD 3.45Å; H65-P70 WeakPolarHBondContact O-CD 2.95Å; H65-D87 IonicContact CD2-OD1 3.32Å; H65-D87 IonicContact CE1-OD1 3.59Å; H65-D87 IonicContact CE1-OD2 3.74Å; H65-D87 IonicContact NE2-OD1 3.35Å; H65-D87 PolarHBondContact NE2-OD1 2.96Å; H65-D87 IonicContact NE2-OD2 2.78Å; H65-D87 PolarHBondContact NE2-OD2 2.81Å
66	S	94.1	Very high	93.8	Very high	51 Å²	51	48.5 Å²	48.5	36%	0.357	23%	0.226	S	C	.	.	I	π-helix	trans	-83.2	-32.6	-176.5	66.9	0	0	0	0	113.8	K62 I63 Y64	K62-S66 WeakPolarHBondContact O-CB 3.19Å; K62-S66 PolarHBondContact O-N 3.35Å; K62-S66 PolarHBondContact O-OG 3Å; I63-S66 PolarHBondContact O-N 2.89Å; Y64-S66 PolarHBondContact O-N 3.25Å
67	S	95.1	Very high	94	Very high	8 Å²	8	48.4 Å²	48.4	6%	0.056	23%	0.225	C	C	.	.	I	π-helix	trans	-121.5	-26.3	-163.9	-53	0	0	0	0	113.7	I63 I431	I63-S67 VanDerWaalsContact O-CB 3.27Å; I63-S67 WeakPolarHBondContact O-CB 3.42Å; I63-S67 PolarHBondContact O-N 3.37Å; S67-I431 WeakPolarHBondContact O-CB 3.47Å
68	I	95.7	Very high	94	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.226	C	C	.	.	I	π-helix	trans	-106.8	-56.6	-175.7	-57.6	169.5	0	0	0	110.9	Y64 P70 L71 E72 I333 A337 V340 I431	Y64-I68 HydrophobicContact CD2-CB 3.93Å; Y64-I68 HydrophobicContact CD2-CD1 4.07Å; Y64-I68 HydrophobicContact CD2-CG2 4.01Å; Y64-I68 HydrophobicContact CE2-CB 4.3Å; Y64-I68 HydrophobicContact CE2-CG2 3.95Å; Y64-I68 WeakPolarHBondContact O-CB 3.26Å; Y64-I68 PolarHBondContact O-N 3.19Å; I68-P70 VanDerWaalsContact C-CD 3.42Å; I68-L71 PolarHBondContact O-N 3.18Å; I68-L71 VanDerWaalsContact O-N 3.12Å; I68-E72 PolarHBondContact O-N 2.98Å; I68-E72 VanDerWaalsContact O-N 3.08Å; I68-I333 HydrophobicContact CD1-CG2 3.56Å; I68-A337 HydrophobicContact CD1-CB 3.65Å; I68-A337 HydrophobicContact CG1-CB 3.86Å; I68-A337 HydrophobicContact CG2-CB 4.47Å; I68-V340 HydrophobicContact CG2-CG2 4.36Å; I68-I431 HydrophobicContact CG1-CD1 4.49Å; I68-I431 HydrophobicContact CG1-CG1 4.32Å; I68-I431 HydrophobicContact CG2-CD1 4.34Å
69	K	95	Very high	93.9	Very high	50 Å²	50	46.2 Å²	46.2	22%	0.217	22%	0.215	C	C	.	.	H	α-helix	trans	-53.9	-39.7	-174.9	-169.2	173.8	-174.7	169.3	0	114.7	Y64 H65 L71 E72 Q73	Y64-K69 HydrophobicContact CD1-CB 4.43Å; Y64-K69 HydrophobicContact CE1-CB 4.09Å; Y64-K69 HydrophobicContact CE1-CD 4.07Å; Y64-K69 HydrophobicContact CE1-CG 4.33Å; Y64-K69 WeakPolarHBondContact O-CB 3.33Å; Y64-K69 PolarHBondContact O-N 2.74Å; H65-K69 VanDerWaalsContact ND1-CD 3.33Å; H65-K69 WeakPolarHBondContact ND1-CD 3.45Å; K69-L71 VanDerWaalsContact C-N 3.32Å; K69-L71 PolarHBondContact O-N 2.94Å; K69-E72 WeakPolarHBondContact O-CB 3.44Å; K69-E72 PolarHBondContact O-N 3.07Å; K69-Q73 VanDerWaalsContact CE-NE2 3.33Å; K69-Q73 HydrophobicContact CG-CG 4.3Å; K69-Q73 WeakPolarHBondContact O-CG 3.49Å; K69-Q73 PolarHBondContact O-N 3.25Å
70	P	94.4	Very high	93.7	Very high	31 Å²	31	41 Å²	41	20%	0.201	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-37.9	179.1	-24.5	36	0	0	0	113.1	H65 I68 S74 F427	H65-P70 WeakPolarHBondContact O-CD 2.95Å; I68-P70 VanDerWaalsContact C-CD 3.42Å; P70-S74 VanDerWaalsContact O-CB 3.26Å; P70-S74 WeakPolarHBondContact O-CB 2.99Å; P70-S74 PolarHBondContact O-N 3.26Å; P70-F427 HydrophobicContact CB-CD1 4.09Å; P70-F427 HydrophobicContact CB-CE1 3.8Å; P70-F427 HydrophobicContact CB-CE2 4.26Å; P70-F427 HydrophobicContact CB-CG 4.45Å; P70-F427 HydrophobicContact CB-CZ 3.9Å
71	L	94.4	Very high	92.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-75.9	-38.4	178.3	-167	67.8	0	0	0	111.2	I68 K69 Q73 S74 Y75 V340 A344 L416 F427 I431	I68-L71 PolarHBondContact O-N 3.18Å; I68-L71 VanDerWaalsContact O-N 3.12Å; K69-L71 VanDerWaalsContact C-N 3.32Å; K69-L71 PolarHBondContact O-N 2.94Å; L71-Q73 VanDerWaalsContact C-N 3.34Å; L71-Q73 PolarHBondContact O-N 3.01Å; L71-S74 PolarHBondContact O-N 3.33Å; L71-Y75 HydrophobicContact CD1-CD2 3.54Å; L71-Y75 HydrophobicContact CD1-CE2 3.55Å; L71-Y75 HydrophobicContact CG-CD2 4.16Å; L71-Y75 PolarHBondContact O-N 3.45Å; L71-Y75 VanDerWaalsContact O-N 3.08Å; L71-V340 HydrophobicContact CB-CG1 4.14Å; L71-V340 HydrophobicContact CD2-CG1 4.24Å; L71-V340 HydrophobicContact CG-CG1 4.21Å; L71-A344 HydrophobicContact CD1-CB 3.95Å; L71-A344 HydrophobicContact CD2-CB 3.84Å; L71-A344 HydrophobicContact CG-CB 3.86Å; L71-L416 HydrophobicContact CD1-CD2 4Å; L71-F427 HydrophobicContact CB-CB 4.41Å; L71-F427 HydrophobicContact CD1-CB 3.88Å; L71-I431 HydrophobicContact CD2-CB 4.35Å; L71-I431 HydrophobicContact CD2-CD1 3.91Å; L71-I431 HydrophobicContact CD2-CG2 3.75Å
72	E	94.4	Very high	91.7	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-54.7	-48.8	173.1	-171	-169.1	107.9	0	0	111.3	Y64 I68 K69 K76 Y77 N78 H336 V340	Y64-E72 PolarHBondContact OH-OE1 2.97Å; Y64-E72 PolarHBondContact OH-OE2 2.98Å; I68-E72 PolarHBondContact O-N 2.98Å; I68-E72 VanDerWaalsContact O-N 3.08Å; K69-E72 WeakPolarHBondContact O-CB 3.44Å; K69-E72 PolarHBondContact O-N 3.07Å; E72-K76 WeakPolarHBondContact O-CA 3.4Å; E72-K76 PolarHBondContact O-N 2.81Å; E72-Y77 HydrophobicContact CG-CD1 4.24Å; E72-Y77 PolarHBondContact O-N 3.04Å; E72-N78 PolarHBondContact OE1-ND2 3.35Å; E72-N78 PolarHBondContact OE1-OD1 3.2Å; E72-N78 VanDerWaalsContact OE1-OD1 3.13Å; E72-H336 IonicContact OE2-CD2 3.33Å; E72-H336 IonicContact OE2-CE1 2.62Å; E72-H336 IonicContact OE2-NE2 3.29Å; E72-H336 PolarHBondContact OE2-NE2 3.06Å; E72-V340 HydrophobicContact CB-CG1 4.12Å; E72-V340 HydrophobicContact CB-CG2 4.27Å; E72-V340 HydrophobicContact CG-CG2 4.24Å
73	Q	93.7	Very high	90.9	Very high	116 Å²	116	44.2 Å²	44.2	54%	0.542	21%	0.214	S	C	.	.	H	α-helix	trans	-70.7	-44.5	179.1	-70.2	-179.9	-25.7	0	0	112.3	K69 L71 Y75 K76	K69-Q73 VanDerWaalsContact CE-NE2 3.33Å; K69-Q73 HydrophobicContact CG-CG 4.3Å; K69-Q73 WeakPolarHBondContact O-CG 3.49Å; K69-Q73 PolarHBondContact O-N 3.25Å; L71-Q73 VanDerWaalsContact C-N 3.34Å; L71-Q73 PolarHBondContact O-N 3.01Å; Q73-Y75 PolarHBondContact O-N 3.47Å; Q73-K76 PolarHBondContact O-N 2.89Å; Q73-K76 VanDerWaalsContact O-N 3.17Å
74	S	94.3	Very high	90.2	Very high	35 Å²	35	48.9 Å²	48.9	25%	0.245	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-29.1	-177.5	-178.4	0	0	0	0	113.4	P70 L71 Q419	P70-S74 VanDerWaalsContact O-CB 3.26Å; P70-S74 WeakPolarHBondContact O-CB 2.99Å; P70-S74 PolarHBondContact O-N 3.26Å; L71-S74 PolarHBondContact O-N 3.33Å; S74-Q419 PolarHBondContact OG-NE2 3.42Å
75	Y	94.6	Very high	89.9	Confident	1 Å²	1	49 Å²	49	0%	0.004	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	6.3	177.2	-72.8	-85.5	0	0	0	112.8	L71 Q73 Y77 H343 A344 V347 F404 F413 K414 L416 Q419	L71-Y75 HydrophobicContact CD1-CD2 3.54Å; L71-Y75 HydrophobicContact CD1-CE2 3.55Å; L71-Y75 HydrophobicContact CG-CD2 4.16Å; L71-Y75 PolarHBondContact O-N 3.45Å; L71-Y75 VanDerWaalsContact O-N 3.08Å; Q73-Y75 PolarHBondContact O-N 3.47Å; Y75-Y77 VanDerWaalsContact C-N 3.31Å; Y75-Y77 PolarHBondContact O-N 3.36Å; Y75-H343 PolarHBondContact O-NE2 3.36Å; Y75-A344 HydrophobicContact CD1-CB 4.37Å; Y75-A344 HydrophobicContact CD2-CB 3.68Å; Y75-A344 HydrophobicContact CE2-CB 4.06Å; Y75-A344 HydrophobicContact CG-CB 3.86Å; Y75-V347 HydrophobicContact CD1-CB 3.69Å; Y75-V347 HydrophobicContact CD1-CG1 3.65Å; Y75-V347 HydrophobicContact CD1-CG2 4.39Å; Y75-V347 HydrophobicContact CE1-CB 4.14Å; Y75-V347 HydrophobicContact CE1-CG1 3.98Å; Y75-F404 WeakPolarHBondContact O-CZ 3.45Å; Y75-F413 HydrophobicContact CD1-CD1 4.17Å; Y75-K414 PolarHBondContact OH-O 2.91Å; Y75-L416 HydrophobicContact CE2-CD2 3.56Å; Y75-L416 HydrophobicContact CE2-CG 4.37Å; Y75-L416 WeakPolarHBondContact OH-CA 3.41Å; Y75-L416 WeakPolarHBondContact OH-CD2 3.36Å; Y75-L416 WeakPolarHBondContact OH-CG 3.46Å; Y75-L416 PolarHBondContact OH-N 3.05Å; Y75-Q419 HydrophobicContact CE2-CG 4.33Å
76	K	94.4	Very high	89.5	Confident	68 Å²	68	47 Å²	47	30%	0.296	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	40.5	175.4	-55.3	178.6	166.6	-150.6	0	114	E72 Q73 N78 E79 F404 N408 F413	E72-K76 WeakPolarHBondContact O-CA 3.4Å; E72-K76 PolarHBondContact O-N 2.81Å; Q73-K76 PolarHBondContact O-N 2.89Å; Q73-K76 VanDerWaalsContact O-N 3.17Å; K76-N78 PolarHBondContact O-N 3.37Å; K76-N78 VanDerWaalsContact O-N 3.09Å; K76-E79 HydrophobicContact CB-CG 4.24Å; K76-E79 WeakPolarHBondContact CD-OE1 3.25Å; K76-E79 IonicContact NZ-OE1 3.57Å; K76-E79 WeakPolarHBondContact O-CB 3.3Å; K76-E79 PolarHBondContact O-N 3.42Å; K76-F404 HydrophobicContact CB-CE2 4.24Å; K76-F404 HydrophobicContact CB-CZ 4.39Å; K76-N408 WeakPolarHBondContact CD-OD1 3.25Å; K76-N408 WeakPolarHBondContact CE-OD1 3.45Å; K76-N408 PolarHBondContact NZ-OD1 2.99Å; K76-F413 HydrophobicContact CB-CE1 4.5Å; K76-F413 HydrophobicContact CD-CE1 4.16Å; K76-F413 HydrophobicContact CD-CZ 4.15Å; K76-F413 HydrophobicContact CG-CE1 4.24Å
77	Y	93.3	Very high	89.3	Confident	8 Å²	8	46.6 Å²	46.6	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-56	-32.7	-176.6	180	-107.5	0	0	0	113.4	E72 Y75 E79 L80 R81 H336 R339 V340 H343	E72-Y77 HydrophobicContact CG-CD1 4.24Å; E72-Y77 PolarHBondContact O-N 3.04Å; Y75-Y77 VanDerWaalsContact C-N 3.31Å; Y75-Y77 PolarHBondContact O-N 3.36Å; Y77-E79 PolarHBondContact O-N 2.85Å; Y77-L80 HydrophobicContact CE2-CD2 4.3Å; Y77-L80 WeakPolarHBondContact O-CB 3.45Å; Y77-L80 PolarHBondContact O-N 2.96Å; Y77-R81 HydrophobicContact CE1-CB 4.44Å; Y77-R81 PolarHBondContact O-N 3.31Å; Y77-R81 WeakPolarHBondContact OH-CD 3.27Å; Y77-H336 AromaticContact CD1-CE1 3.76Å; Y77-H336 AromaticContact CE1-CE1 3.51Å; Y77-H336 AromaticContact CE1-ND1 3.82Å; Y77-R339 HydrophobicContact CE2-CB 4.31Å; Y77-R339 VanDerWaalsContact OH-CB 3.25Å; Y77-R339 WeakPolarHBondContact OH-CB 3.06Å; Y77-V340 HydrophobicContact CD1-CG2 3.62Å; Y77-V340 HydrophobicContact CE1-CG2 3.98Å; Y77-V340 HydrophobicContact CG-CG2 3.91Å; Y77-H343 HydrophobicContact CD2-CB 3.55Å; Y77-H343 AromaticContact CD2-CD2 3.76Å; Y77-H343 AromaticContact CD2-CG 3.58Å; Y77-H343 HydrophobicContact CE2-CB 3.89Å
78	N	89.8	Confident	88.9	Confident	37 Å²	37	46.3 Å²	46.3	20%	0.198	22%	0.221	C	C	.	.	H	α-helix	trans	-64.6	-26.7	-179.6	-62.4	-15.4	0	0	0	112.5	E72 K76 L80 Q82	E72-N78 PolarHBondContact OE1-ND2 3.35Å; E72-N78 PolarHBondContact OE1-OD1 3.2Å; E72-N78 VanDerWaalsContact OE1-OD1 3.13Å; K76-N78 PolarHBondContact O-N 3.37Å; K76-N78 VanDerWaalsContact O-N 3.09Å; N78-L80 VanDerWaalsContact C-N 3.29Å; N78-L80 PolarHBondContact O-N 3.35Å; N78-Q82 WeakPolarHBondContact O-CA 3.4Å; N78-Q82 PolarHBondContact O-N 2.04Å
79	E	88.6	Confident	88.6	Confident	85 Å²	85	46.7 Å²	46.7	40%	0.397	22%	0.222	S	C	.	.	H	α-helix	trans	-73.4	-21.5	175	-58.8	-171.9	-149.4	0	0	112.3	K76 Y77 F404 N408	K76-E79 HydrophobicContact CB-CG 4.24Å; K76-E79 WeakPolarHBondContact CD-OE1 3.25Å; K76-E79 IonicContact NZ-OE1 3.57Å; K76-E79 WeakPolarHBondContact O-CB 3.3Å; K76-E79 PolarHBondContact O-N 3.42Å; Y77-E79 PolarHBondContact O-N 2.85Å; E79-F404 HydrophobicContact CB-CD2 4.4Å; E79-F404 HydrophobicContact CB-CE2 4.31Å; E79-N408 PolarHBondContact OE2-ND2 3.17Å; E79-N408 PolarHBondContact OE2-OD1 3.13Å
80	L	87.4	Confident	88.4	Confident	31 Å²	31	44.3 Å²	44.3	16%	0.162	21%	0.212	C	C	.	.	H	α-helix	trans	-80.6	-39.4	175	-174.1	73.3	0	0	0	112.5	Y77 N78 H343 P396 A400 F404	Y77-L80 HydrophobicContact CE2-CD2 4.3Å; Y77-L80 WeakPolarHBondContact O-CB 3.45Å; Y77-L80 PolarHBondContact O-N 2.96Å; N78-L80 VanDerWaalsContact C-N 3.29Å; N78-L80 PolarHBondContact O-N 3.35Å; L80-H343 WeakPolarHBondContact CD2-ND1 3.39Å; L80-P396 HydrophobicContact CD2-CG 4.5Å; L80-A400 HydrophobicContact CD1-CB 3.92Å; L80-F404 HydrophobicContact CB-CD2 4.12Å; L80-F404 HydrophobicContact CD1-CB 3.93Å; L80-F404 HydrophobicContact CD1-CD2 4.35Å; L80-F404 HydrophobicContact CD1-CG 4.31Å
81	R	76.1	Confident	88.2	Confident	131 Å²	131	45.7 Å²	45.7	49%	0.494	22%	0.22	S	C	.	.	H	α-helix	trans	-111.7	-6.7	-170.3	-100.8	-144	-179.3	-154.2	-0.7	115.8	Y77 H83	Y77-R81 HydrophobicContact CE1-CB 4.44Å; Y77-R81 PolarHBondContact O-N 3.31Å; Y77-R81 WeakPolarHBondContact OH-CD 3.27Å; R81-H83 PolarHBondContact O-N 3.03Å
82	Q	70	Confident	88	Confident	168 Å²	168	47.2 Å²	47.2	79%	0.785	23%	0.231	S	C	*	.	S	Bend	trans	52.1	18.9	-178.6	-57.8	-178.8	-4.1	0	0	114.8	N78	N78-Q82 WeakPolarHBondContact O-CA 3.4Å; N78-Q82 PolarHBondContact O-N 2.04Å
83	H	77.1	Confident	87.9	Confident	35 Å²	35	50.1 Å²	50.1	16%	0.162	24%	0.243	C	C	.	.			trans	-124.9	104.8	179.4	179.3	98	0	0	0	108.5	R81 E89 R217 F332	R81-H83 PolarHBondContact O-N 3.03Å; H83-E89 IonicContact CE1-OE1 2.81Å; H83-E89 IonicContact NE2-OE1 2.82Å; H83-R217 PolarHBondContact CE1-NH1 3.15Å; H83-R217 PolarHBondContact CE1-NH2 3.39Å; H83-R217 PolarHBondContact ND1-NH1 2.72Å; H83-R217 PolarHBondContact ND1-NH2 3.43Å; H83-F332 AromaticContact NE2-CZ 3.89Å
84	E	81.2	Confident	87.9	Confident	105 Å²	105	44.8 Å²	44.8	49%	0.491	22%	0.219	S	C	.	.			trans	-94.3	133	173	-177.7	173.3	-171.9	0	0	109.7	R217	E84-R217 PolarHBondContact O-NH2 2.99Å
85	I	88.3	Confident	88	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	21%	0.209	C	C	.	.			trans	-87.3	114.8	174.5	-61.8	-179.9	0	0	0	108.2	Y64 I90 F332 I333 H336	Y64-I85 HydrophobicContact CE2-CB 4.33Å; Y64-I85 HydrophobicContact CE2-CG2 4.46Å; Y64-I85 PolarHBondContact OH-O 2.81Å; I85-I90 HydrophobicContact CG2-CD1 4.16Å; I85-I90 HydrophobicContact CG2-CG1 3.74Å; I85-F332 HydrophobicContact CD1-CE1 3.61Å; I85-F332 HydrophobicContact CD1-CZ 3.82Å; I85-F332 HydrophobicContact CG1-CE1 4.13Å; I85-F332 HydrophobicContact CG1-CZ 4.13Å; I85-F332 HydrophobicContact CG2-CE1 4.47Å; I85-I333 HydrophobicContact CD1-CD1 4.15Å; I85-I333 HydrophobicContact CG2-CD1 4.16Å; I85-H336 HydrophobicContact CD1-CB 3.77Å; I85-H336 VanDerWaalsContact CD1-CD2 3.45Å; I85-H336 WeakPolarHBondContact CD1-CD2 3.24Å
86	T	88.4	Confident	88.1	Confident	22 Å²	22	43.5 Å²	43.5	14%	0.135	21%	0.209	C	C	.	.			trans	-88.1	160.1	177.1	65.2	0	0	0	0	111.5	G88 E89 I90 P161	T86-G88 PolarHBondContact O-N 3.27Å; T86-E89 WeakPolarHBondContact O-CB 3.37Å; T86-E89 PolarHBondContact O-N 3.18Å; T86-E89 VanDerWaalsContact O-N 3.1Å; T86-E89 PolarHBondContact OG1-N 3.06Å; T86-I90 PolarHBondContact O-N 3.28Å; T86-P161 HydrophobicContact CG2-CG 3.8Å
87	D	88.5	Confident	88.3	Confident	43 Å²	43	40.3 Å²	40.3	23%	0.23	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-40.8	173.1	-86.1	-34.4	0	0	0	112.1	R61 H65 E89 I90 T91	R61-D87 IonicContact CZ-OD1 3.3Å; R61-D87 IonicContact CZ-OD2 3.59Å; R61-D87 IonicContact NE-OD1 2.78Å; R61-D87 PolarHBondContact NE-OD1 2.94Å; R61-D87 IonicContact NE-OD2 3.97Å; R61-D87 PolarHBondContact NE-OD2 3.08Å; R61-D87 IonicContact NH2-OD1 3.06Å; R61-D87 IonicContact NH2-OD2 3.61Å; R61-D87 PolarHBondContact NH2-OD2 3.12Å; H65-D87 IonicContact CD2-OD1 3.32Å; H65-D87 IonicContact CE1-OD1 3.59Å; H65-D87 IonicContact CE1-OD2 3.74Å; H65-D87 IonicContact NE2-OD1 3.35Å; H65-D87 PolarHBondContact NE2-OD1 2.96Å; H65-D87 IonicContact NE2-OD2 2.78Å; H65-D87 PolarHBondContact NE2-OD2 2.81Å; D87-E89 VanDerWaalsContact C-N 3.26Å; D87-E89 PolarHBondContact O-N 3.48Å; D87-I90 PolarHBondContact O-N 3.13Å; D87-T91 PolarHBondContact O-N 3.47Å; D87-T91 VanDerWaalsContact O-N 3.12Å; D87-T91 PolarHBondContact O-OG1 2.92Å
88	G	87.2	Confident	88.5	Confident	2 Å²	2	39.9 Å²	39.9	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-34.7	175.9	0	0	0	0	0	112.9	T86 T91 S92	T86-G88 PolarHBondContact O-N 3.27Å; G88-T91 PolarHBondContact O-OG1 3.48Å; G88-S92 WeakPolarHBondContact O-CA 3.27Å; G88-S92 VanDerWaalsContact O-CB 3.25Å; G88-S92 WeakPolarHBondContact O-CB 3.4Å; G88-S92 PolarHBondContact O-N 3.09Å
89	E	89.8	Confident	88.7	Confident	7 Å²	7	38.2 Å²	38.2	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-72.7	-33.1	176.6	-175.6	167.4	171.7	0	0	112.9	H83 T86 D87 S92 R217 K329	H83-E89 IonicContact CE1-OE1 2.81Å; H83-E89 IonicContact NE2-OE1 2.82Å; T86-E89 WeakPolarHBondContact O-CB 3.37Å; T86-E89 PolarHBondContact O-N 3.18Å; T86-E89 VanDerWaalsContact O-N 3.1Å; T86-E89 PolarHBondContact OG1-N 3.06Å; D87-E89 VanDerWaalsContact C-N 3.26Å; D87-E89 PolarHBondContact O-N 3.48Å; E89-S92 PolarHBondContact O-OG 3.36Å; E89-R217 IonicContact OE1-NE 3.39Å; E89-R217 IonicContact OE1-NH2 2.67Å; E89-R217 IonicContact OE2-CZ 3.89Å; E89-R217 VanDerWaalsContact OE2-CZ 3.28Å; E89-R217 IonicContact OE2-NE 2.73Å; E89-R217 PolarHBondContact OE2-NE 3.33Å; E89-R217 IonicContact OE2-NH2 3.67Å; E89-R217 PolarHBondContact OE2-NH2 3Å; E89-K329 PolarHBondContact O-NZ 3.27Å
90	I	90.5	Very high	88.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.7	-42.4	174.7	-60.9	172.9	0	0	0	110.1	L60 R61 Y64 I85 T86 D87 I333	L60-I90 HydrophobicContact CD2-CG2 4.13Å; L60-I90 HydrophobicContact CG-CG2 4.15Å; R61-I90 HydrophobicContact CB-CG2 4.36Å; Y64-I90 HydrophobicContact CD1-CD1 3.5Å; Y64-I90 VanDerWaalsContact CD1-CD1 3.5Å; Y64-I90 HydrophobicContact CD2-CD1 4.38Å; Y64-I90 HydrophobicContact CE1-CD1 4.13Å; Y64-I90 HydrophobicContact CG-CD1 3.65Å; I85-I90 HydrophobicContact CG2-CD1 4.16Å; I85-I90 HydrophobicContact CG2-CG1 3.74Å; T86-I90 PolarHBondContact O-N 3.28Å; D87-I90 PolarHBondContact O-N 3.13Å; I90-I333 HydrophobicContact CG1-CD1 4.06Å
91	T	89.4	Confident	88.9	Confident	60 Å²	60	34 Å²	34	37%	0.368	17%	0.166	S	C	.	.	S	Bend	trans	-90	0.3	-178.5	58.1	0	0	0	0	113.9	D87 G88	D87-T91 PolarHBondContact O-N 3.47Å; D87-T91 VanDerWaalsContact O-N 3.12Å; D87-T91 PolarHBondContact O-OG1 2.92Å; G88-T91 PolarHBondContact O-OG1 3.48Å
92	S	90.5	Very high	89.4	Confident	32 Å²	32	31.8 Å²	31.8	22%	0.224	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-67.6	148.9	-176.1	78.8	0	0	0	0	111.6	G88 E89 K329	G88-S92 WeakPolarHBondContact O-CA 3.27Å; G88-S92 VanDerWaalsContact O-CB 3.25Å; G88-S92 WeakPolarHBondContact O-CB 3.4Å; G88-S92 PolarHBondContact O-N 3.09Å; E89-S92 PolarHBondContact O-OG 3.36Å; S92-K329 PolarHBondContact OG-NZ 3.01Å; S92-K329 VanDerWaalsContact OG-NZ 3.1Å
93	K	92.3	Very high	90.2	Very high	62 Å²	62	25.6 Å²	25.6	27%	0.27	13%	0.134	S	C	.	.	P	Polyproline II helix	trans	-66.9	158.7	164.9	-64.8	173	-172.4	176.8	0	110	M95 L183 E184	K93-M95 PolarHBondContact O-N 3.34Å; K93-L183 PolarHBondContact NZ-O 3.25Å; K93-E184 WeakPolarHBondContact CD-O 3.34Å; K93-E184 WeakPolarHBondContact CE-O 3.37Å; K93-E184 PolarHBondContact NZ-O 2.89Å; K93-E184 VanDerWaalsContact NZ-O 3.16Å
94	P	94.2	Very high	90.9	Very high	4 Å²	4	24.1 Å²	24.1	3%	0.026	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-57.6	139	171.2	23.5	-33.8	0	0	0	110.9	R185 V186 T187 D219 V321 R325	P94-R185 VanDerWaalsContact CD-O 3.24Å; P94-R185 WeakPolarHBondContact CD-O 3.46Å; P94-R185 WeakPolarHBondContact CG-O 3.31Å; P94-V186 HydrophobicContact CG-CG2 4.33Å; P94-V186 WeakPolarHBondContact O-CG2 3.31Å; P94-T187 PolarHBondContact O-N 3.22Å; P94-D219 WeakPolarHBondContact CA-OD2 3.37Å; P94-D219 HydrophobicContact CB-CB 4.09Å; P94-V321 HydrophobicContact CB-CG1 4.23Å; P94-R325 HydrophobicContact CG-CB 4.05Å
95	M	96	Very high	91.4	Very high	9 Å²	9	19.7 Å²	19.7	4%	0.044	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.9	-179.8	-178.8	-170.7	-60.9	0	0	110.2	K93 F159 T187 V189 F214 R217 D219 L220	K93-M95 PolarHBondContact O-N 3.34Å; M95-F159 HydrophobicContact CE-CE1 4.17Å; M95-T187 WeakPolarHBondContact CA-O 3.29Å; M95-V189 HydrophobicContact CG-CG2 3.77Å; M95-V189 HydrophobicContact SD-CG2 3.88Å; M95-F214 HydrophobicContact CE-CD1 4.38Å; M95-F214 HydrophobicContact SD-CD1 3.87Å; M95-R217 HydrophobicContact CE-CB 4.2Å; M95-R217 HydrophobicContact SD-CB 4.47Å; M95-D219 PolarHBondContact N-OD2 3.5Å; M95-D219 PolarHBondContact O-N 2.94Å; M95-L220 PolarHBondContact O-N 3.28Å
96	V	97.8	Very high	91.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.7	173.3	177.9	0	0	0	0	108.6	F98 V186 T187 F188 V189 L220 F222 L318	V96-F98 HydrophobicContact CG1-CE2 4.07Å; V96-V186 HydrophobicContact CB-CG2 4.36Å; V96-V186 HydrophobicContact CG2-CG2 3.45Å; V96-V186 VanDerWaalsContact CG2-CG2 3.45Å; V96-T187 PolarHBondContact N-O 2.98Å; V96-F188 HydrophobicContact CB-CD1 3.58Å; V96-F188 HydrophobicContact CB-CE1 3.75Å; V96-F188 HydrophobicContact CG1-CD1 3.82Å; V96-F188 HydrophobicContact CG1-CE1 3.82Å; V96-F188 HydrophobicContact CG2-CD1 4.27Å; V96-F188 HydrophobicContact CG2-CE1 4.02Å; V96-F188 WeakPolarHBondContact O-CA 3.43Å; V96-V189 PolarHBondContact O-N 3.49Å; V96-L220 WeakPolarHBondContact CA-O 3.2Å; V96-L220 HydrophobicContact CG1-CB 4.49Å; V96-L220 HydrophobicContact CG1-CD2 4.4Å; V96-L220 HydrophobicContact CG2-CB 4.13Å; V96-L220 HydrophobicContact CG2-CD2 4.27Å; V96-F222 HydrophobicContact CG1-CD2 3.88Å; V96-F222 HydrophobicContact CG1-CE2 3.89Å; V96-F222 HydrophobicContact CG1-CG 4.4Å; V96-F222 HydrophobicContact CG1-CZ 4.42Å; V96-L318 HydrophobicContact CG2-CD1 3.59Å
97	L	97.9	Very high	91.9	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.9	-174	-178.4	66.1	0	0	0	111	L99 V189 T191 F214 I215 A218 L220 I221 F222	L97-L99 HydrophobicContact CD1-CD2 4.44Å; L97-L99 HydrophobicContact CD2-CD1 3.95Å; L97-L99 HydrophobicContact CD2-CD2 3.99Å; L97-L99 HydrophobicContact CD2-CG 3.99Å; L97-L99 HydrophobicContact CG-CD1 4.44Å; L97-L99 HydrophobicContact CG-CD2 4.04Å; L97-L99 HydrophobicContact CG-CG 3.98Å; L97-V189 HydrophobicContact CD1-CB 3.74Å; L97-V189 HydrophobicContact CD1-CG1 3.59Å; L97-T191 HydrophobicContact CD1-CG2 3.47Å; L97-T191 VanDerWaalsContact CD1-CG2 3.47Å; L97-T191 HydrophobicContact CG-CG2 4.37Å; L97-F214 HydrophobicContact CD1-CB 3.84Å; L97-F214 HydrophobicContact CD1-CD1 4.5Å; L97-F214 HydrophobicContact CD1-CG 4.31Å; L97-F214 HydrophobicContact CD2-CB 3.94Å; L97-I215 HydrophobicContact CD2-CB 4.49Å; L97-I215 HydrophobicContact CD2-CG1 3.78Å; L97-A218 HydrophobicContact CB-CB 3.78Å; L97-A218 HydrophobicContact CD2-CB 4.26Å; L97-L220 PolarHBondContact N-O 2.78Å; L97-I221 HydrophobicContact CB-CG1 4.47Å; L97-I221 WeakPolarHBondContact O-CA 3.27Å; L97-F222 PolarHBondContact O-N 2.76Å
98	F	97.2	Very high	92.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.9	174.8	-70.2	-102.1	0	0	0	110.9	V96 K106 M109 I110 L113 F188 V189 T191 F222 V224	V96-F98 HydrophobicContact CG1-CE2 4.07Å; F98-K106 HydrophobicContact CB-CB 4.2Å; F98-K106 HydrophobicContact CB-CD 4.21Å; F98-K106 HydrophobicContact CB-CG 4.35Å; F98-M109 HydrophobicContact CE1-CB 4.35Å; F98-M109 HydrophobicContact CE1-CE 4.29Å; F98-M109 HydrophobicContact CE1-CG 3.94Å; F98-M109 HydrophobicContact CE1-SD 3.79Å; F98-I110 HydrophobicContact CD1-CG1 4.34Å; F98-I110 HydrophobicContact CD2-CD1 3.68Å; F98-I110 HydrophobicContact CD2-CG1 3.82Å; F98-I110 HydrophobicContact CE1-CG1 4.01Å; F98-I110 HydrophobicContact CE2-CD1 3.82Å; F98-I110 HydrophobicContact CE2-CG1 3.44Å; F98-I110 VanDerWaalsContact CE2-CG1 3.44Å; F98-I110 HydrophobicContact CG-CD1 4.1Å; F98-I110 HydrophobicContact CG-CG1 4.25Å; F98-I110 HydrophobicContact CZ-CD1 4.36Å; F98-I110 HydrophobicContact CZ-CG1 3.56Å; F98-L113 HydrophobicContact CZ-CD1 4.08Å; F98-F188 HydrophobicContact CE2-CB 4.37Å; F98-F188 AromaticContact CE2-CD1 3.56Å; F98-F188 HydrophobicContact CE2-CD1 3.56Å; F98-F188 HydrophobicContact CE2-CE1 4.16Å; F98-F188 HydrophobicContact CE2-CG 4.25Å; F98-F188 HydrophobicContact CZ-CD1 4.25Å; F98-F188 HydrophobicContact CZ-CE1 4.45Å; F98-V189 PolarHBondContact N-O 2.93Å; F98-T191 WeakPolarHBondContact O-CB 3.44Å; F98-T191 WeakPolarHBondContact O-CG2 3.47Å; F98-T191 PolarHBondContact O-N 3.38Å; F98-T191 PolarHBondContact O-OG1 3.49Å; F98-F222 HydrophobicContact CD1-CB 4.07Å; F98-F222 HydrophobicContact CD1-CD2 4.15Å; F98-F222 HydrophobicContact CE1-CB 4.31Å; F98-F222 AromaticContact CE1-CD2 3.57Å; F98-F222 HydrophobicContact CE1-CD2 3.57Å; F98-F222 HydrophobicContact CE1-CE2 4.42Å; F98-F222 HydrophobicContact CE1-CG 4.44Å; F98-F222 HydrophobicContact CE2-CD2 4.29Å; F98-F222 AromaticContact CZ-CD2 3.64Å; F98-F222 HydrophobicContact CZ-CD2 3.64Å; F98-F222 HydrophobicContact CZ-CE2 4.18Å; F98-V224 HydrophobicContact CD1-CG2 4.28Å
99	L	94.4	Very high	92.5	Very high	1 Å²	1	19 Å²	19	1%	0.005	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.8	177.6	-60.3	172.6	0	0	0	110.5	L97 T191 I215 I221 F222 V223 V224 L239 L243	L97-L99 HydrophobicContact CD1-CD2 4.44Å; L97-L99 HydrophobicContact CD2-CD1 3.95Å; L97-L99 HydrophobicContact CD2-CD2 3.99Å; L97-L99 HydrophobicContact CD2-CG 3.99Å; L97-L99 HydrophobicContact CG-CD1 4.44Å; L97-L99 HydrophobicContact CG-CD2 4.04Å; L97-L99 HydrophobicContact CG-CG 3.98Å; L99-T191 HydrophobicContact CD2-CG2 3.7Å; L99-I215 HydrophobicContact CD1-CD1 4.16Å; L99-I215 HydrophobicContact CD1-CG1 4.02Å; L99-I221 HydrophobicContact CD1-CG2 3.54Å; L99-I221 HydrophobicContact CG-CG2 4.22Å; L99-F222 PolarHBondContact N-O 2.9Å; L99-V223 WeakPolarHBondContact O-CA 3.42Å; L99-V224 PolarHBondContact O-N 3.15Å; L99-L239 HydrophobicContact CB-CD2 3.98Å; L99-L239 HydrophobicContact CD1-CD1 4.02Å; L99-L239 HydrophobicContact CD1-CD2 4.25Å; L99-L239 HydrophobicContact CD1-CG 4.4Å; L99-L239 HydrophobicContact CD2-CD1 4.28Å; L99-L243 HydrophobicContact CD1-CD1 4.43Å; L99-L243 HydrophobicContact CD1-CD2 4.06Å
100	G	91.4	Very high	92.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.106	C	C	.	.			trans	149.6	169.2	171.8	0	0	0	0	0	113.4	K106 I194	G100-K106 PolarHBondContact O-NZ 3.04Å; G100-I194 PolarHBondContact O-N 3.27Å
101	P	88.8	Confident	92.9	Very high	28 Å²	28	18.8 Å²	18.8	18%	0.182	11%	0.106	C	C	.	.	B	Isolated β-bridge	trans	-55.3	165.8	-179.8	-24.4	33	0	0	0	113.8	V104 K106 I194	P101-V104 HydrophobicContact CB-CG1 3.82Å; P101-V104 HydrophobicContact CG-CG1 4.2Å; P101-V104 WeakPolarHBondContact O-CG2 2.77Å; P101-K106 PolarHBondContact O-NZ 2.79Å; P101-I194 WeakPolarHBondContact CA-O 3.33Å
102	W	86.8	Confident	93.1	Very high	84 Å²	84	15.9 Å²	15.9	32%	0.318	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	148.4	172.7	176.7	65.5	0	0	0	111.8	V104 A127 E128 I194 I195	W102-V104 VanDerWaalsContact C-N 3.25Å; W102-V104 PolarHBondContact O-N 3.4Å; W102-A127 WeakPolarHBondContact CH2-O 3.22Å; W102-A127 WeakPolarHBondContact CZ2-O 3.4Å; W102-E128 WeakPolarHBondContact CZ2-O 3.38Å; W102-E128 PolarHBondContact NE1-O 2.82Å; W102-E128 VanDerWaalsContact NE1-O 3.12Å; W102-I194 PolarHBondContact N-O 2.93Å; W102-I195 HydrophobicContact CB-CG1 4.18Å
103	S	87.3	Confident	93.3	Very high	39 Å²	39	14.5 Å²	14.5	27%	0.273	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	9.9	176.6	178.6	0	0	0	0	116.5	G105 K229 K256	S103-G105 PolarHBondContact O-N 3.41Å; S103-K229 PolarHBondContact OG-NZ 2.91Å; S103-K256 PolarHBondContact O-NZ 3.3Å
104	V	90.8	Very high	93.3	Very high	3 Å²	3	11.7 Å²	11.7	2%	0.018	7%	0.066	C	C	.	.	S	Bend	trans	-79.9	-8.8	179	-56.4	0	0	0	0	115.3	P101 W102 K106 V224 D226 N255	P101-V104 HydrophobicContact CB-CG1 3.82Å; P101-V104 HydrophobicContact CG-CG1 4.2Å; P101-V104 WeakPolarHBondContact O-CG2 2.77Å; W102-V104 VanDerWaalsContact C-N 3.25Å; W102-V104 PolarHBondContact O-N 3.4Å; V104-K106 HydrophobicContact CG2-CG 3.86Å; V104-V224 HydrophobicContact CB-CG1 4.2Å; V104-V224 HydrophobicContact CG2-CB 3.89Å; V104-V224 HydrophobicContact CG2-CG1 3.87Å; V104-V224 WeakPolarHBondContact CG2-O 3.39Å; V104-D226 HydrophobicContact CB-CB 4.3Å; V104-D226 HydrophobicContact CG1-CB 4.02Å; V104-N255 PolarHBondContact O-ND2 3.03Å
105	G	91.8	Very high	93.1	Very high	13 Å²	13	12.5 Å²	12.5	13%	0.134	8%	0.075	C	C	.	.	S	Bend	trans	95.5	28.3	174.7	0	0	0	0	0	116.3	S103 M109	S103-G105 PolarHBondContact O-N 3.41Å; G105-M109 VanDerWaalsContact O-CB 3.31Å; G105-M109 WeakPolarHBondContact O-CB 3.17Å; G105-M109 PolarHBondContact O-N 2.74Å
106	K	93.9	Very high	92.8	Very high	8 Å²	8	12.3 Å²	12.3	4%	0.035	8%	0.075	C	C	.	.	H	α-helix	trans	-58.2	-56.6	176.3	-61.3	-176	-63.7	-71	0	112.5	F98 G100 P101 V104 T108 M109 I110 D190 T191 V224	F98-K106 HydrophobicContact CB-CB 4.2Å; F98-K106 HydrophobicContact CB-CD 4.21Å; F98-K106 HydrophobicContact CB-CG 4.35Å; G100-K106 PolarHBondContact O-NZ 3.04Å; P101-K106 PolarHBondContact O-NZ 2.79Å; V104-K106 HydrophobicContact CG2-CG 3.86Å; K106-T108 VanDerWaalsContact C-N 3.34Å; K106-T108 PolarHBondContact O-N 3.46Å; K106-M109 WeakPolarHBondContact O-CB 3.49Å; K106-M109 PolarHBondContact O-N 2.88Å; K106-I110 PolarHBondContact O-N 3.09Å; K106-D190 WeakPolarHBondContact CB-OD1 3.32Å; K106-T191 WeakPolarHBondContact CE-O 3.47Å; K106-V224 HydrophobicContact CG-CB 4.24Å; K106-V224 HydrophobicContact CG-CG2 4.19Å
107	S	93.3	Very high	92.1	Very high	14 Å²	14	14.5 Å²	14.5	10%	0.098	9%	0.085	C	C	.	.	H	α-helix	trans	-63.9	-38.5	-180	-34.1	0	0	0	0	112.1	M109 I110 N111 D190	S107-M109 PolarHBondContact O-N 3.2Å; S107-I110 PolarHBondContact O-N 3.01Å; S107-N111 PolarHBondContact O-N 3.03Å; S107-N111 PolarHBondContact O-ND2 3.46Å; S107-D190 VanDerWaalsContact CB-OD2 3.25Å; S107-D190 WeakPolarHBondContact CB-OD2 3.14Å; S107-D190 PolarHBondContact OG-OD2 3.04Å
108	T	93.6	Very high	91.2	Very high	35 Å²	35	20.7 Å²	20.7	22%	0.215	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-44.8	173.8	-51.8	0	0	0	0	111.4	K106 I110 N111 Y112 T125 W294	K106-T108 VanDerWaalsContact C-N 3.34Å; K106-T108 PolarHBondContact O-N 3.46Å; T108-I110 VanDerWaalsContact C-N 3.33Å; T108-I110 PolarHBondContact O-N 2.97Å; T108-N111 WeakPolarHBondContact O-CB 3.38Å; T108-N111 PolarHBondContact O-N 3.23Å; T108-Y112 WeakPolarHBondContact O-CB 3.43Å; T108-Y112 PolarHBondContact O-N 3.37Å; T108-T125 WeakPolarHBondContact OG1-CG2 3.4Å; T108-W294 HydrophobicContact CG2-CB 3.98Å
109	M	95.1	Very high	90.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.4	-39.2	177.2	-179.8	172.1	-179.6	0	0	112	F98 G105 K106 S107 Y112 L113 F222 I253 F293 L314	F98-M109 HydrophobicContact CE1-CB 4.35Å; F98-M109 HydrophobicContact CE1-CE 4.29Å; F98-M109 HydrophobicContact CE1-CG 3.94Å; F98-M109 HydrophobicContact CE1-SD 3.79Å; G105-M109 VanDerWaalsContact O-CB 3.31Å; G105-M109 WeakPolarHBondContact O-CB 3.17Å; G105-M109 PolarHBondContact O-N 2.74Å; K106-M109 WeakPolarHBondContact O-CB 3.49Å; K106-M109 PolarHBondContact O-N 2.88Å; S107-M109 PolarHBondContact O-N 3.2Å; M109-Y112 PolarHBondContact O-N 3.14Å; M109-L113 HydrophobicContact CE-CD1 4.17Å; M109-L113 HydrophobicContact CG-CD1 4.24Å; M109-L113 HydrophobicContact CG-CG 4.44Å; M109-L113 WeakPolarHBondContact O-CB 3.06Å; M109-L113 VanDerWaalsContact O-CG 3.28Å; M109-L113 WeakPolarHBondContact O-CG 3.07Å; M109-L113 PolarHBondContact O-N 3.5Å; M109-F222 HydrophobicContact CE-CD2 4.3Å; M109-F222 HydrophobicContact CE-CE2 4.33Å; M109-I253 HydrophobicContact CE-CD1 3.47Å; M109-I253 VanDerWaalsContact CE-CD1 3.47Å; M109-I253 HydrophobicContact SD-CD1 3.78Å; M109-F293 HydrophobicContact CB-CB 4.08Å; M109-F293 HydrophobicContact CE-CB 4.48Å; M109-F293 HydrophobicContact CE-CD1 3.72Å; M109-F293 HydrophobicContact CE-CD2 4.46Å; M109-F293 HydrophobicContact CE-CE1 4.02Å; M109-F293 HydrophobicContact CE-CG 3.97Å; M109-F293 HydrophobicContact CG-CB 3.72Å; M109-F293 HydrophobicContact CG-CG 4.2Å; M109-F293 HydrophobicContact SD-CB 4.08Å; M109-F293 HydrophobicContact SD-CD1 4.36Å; M109-F293 HydrophobicContact SD-CD2 4.31Å; M109-F293 HydrophobicContact SD-CG 3.99Å; M109-L314 HydrophobicContact CE-CD2 3.32Å
110	I	95.3	Very high	89.9	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-62.8	-46.9	174.3	-66.2	167.5	0	0	0	110.8	F98 K106 S107 T108 Y112 L113 L114 L123 L137 D190	F98-I110 HydrophobicContact CD1-CG1 4.34Å; F98-I110 HydrophobicContact CD2-CD1 3.68Å; F98-I110 HydrophobicContact CD2-CG1 3.82Å; F98-I110 HydrophobicContact CE1-CG1 4.01Å; F98-I110 HydrophobicContact CE2-CD1 3.82Å; F98-I110 HydrophobicContact CE2-CG1 3.44Å; F98-I110 VanDerWaalsContact CE2-CG1 3.44Å; F98-I110 HydrophobicContact CG-CD1 4.1Å; F98-I110 HydrophobicContact CG-CG1 4.25Å; F98-I110 HydrophobicContact CZ-CD1 4.36Å; F98-I110 HydrophobicContact CZ-CG1 3.56Å; K106-I110 PolarHBondContact O-N 3.09Å; S107-I110 PolarHBondContact O-N 3.01Å; T108-I110 VanDerWaalsContact C-N 3.33Å; T108-I110 PolarHBondContact O-N 2.97Å; I110-Y112 VanDerWaalsContact C-N 3.26Å; I110-Y112 PolarHBondContact O-N 3.25Å; I110-L113 PolarHBondContact O-N 3.21Å; I110-L114 HydrophobicContact CG2-CD1 3.78Å; I110-L114 WeakPolarHBondContact O-CB 3.38Å; I110-L114 PolarHBondContact O-N 3.21Å; I110-L123 HydrophobicContact CB-CD1 3.96Å; I110-L123 HydrophobicContact CD1-CD1 4.25Å; I110-L123 HydrophobicContact CG2-CD1 3.66Å; I110-L137 HydrophobicContact CG2-CD1 4.36Å; I110-L137 HydrophobicContact CG2-CD2 3.79Å; I110-D190 HydrophobicContact CD1-CB 3.57Å
111	N	93.9	Very high	89.3	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.6	-41.6	175.4	-73	-25.8	0	0	0	111.5	S107 T108 G115 L116 Q122 L123	S107-N111 PolarHBondContact O-N 3.03Å; S107-N111 PolarHBondContact O-ND2 3.46Å; T108-N111 WeakPolarHBondContact O-CB 3.38Å; T108-N111 PolarHBondContact O-N 3.23Å; N111-G115 CarbonylContact O-C 3.56Å; N111-G115 WeakPolarHBondContact O-CA 3.44Å; N111-G115 PolarHBondContact O-N 2.73Å; N111-L116 PolarHBondContact O-N 3.33Å; N111-Q122 WeakPolarHBondContact ND2-CG 3.44Å; N111-L123 PolarHBondContact ND2-O 3.45Å; N111-L123 WeakPolarHBondContact OD1-CB 3.29Å; N111-L123 WeakPolarHBondContact OD1-CG 3.49Å; N111-L123 PolarHBondContact OD1-N 3.38Å
112	Y	93.6	Very high	89.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.9	-44.9	179	176.2	-112.7	0	0	0	112.8	R33 R35 I38 T108 M109 I110 L114 G115 F293 W294 P295 E311	R33-Y112 PolarHBondContact NH1-OH 3.02Å; R33-Y112 VanDerWaalsContact NH2-CZ 3.33Å; R33-Y112 PolarHBondContact NH2-OH 2.73Å; R33-Y112 VanDerWaalsContact NH2-OH 3.15Å; R35-Y112 HydrophobicContact CG-CE2 4.01Å; R35-Y112 VanDerWaalsContact CZ-O 3.29Å; R35-Y112 PolarHBondContact NE-O 3.48Å; R35-Y112 VanDerWaalsContact NE-O 3.11Å; R35-Y112 PolarHBondContact NH2-O 3.33Å; I38-Y112 HydrophobicContact CD1-CD1 4.5Å; I38-Y112 HydrophobicContact CD1-CE1 3.89Å; I38-Y112 HydrophobicContact CD1-CE2 4.38Å; T108-Y112 WeakPolarHBondContact O-CB 3.43Å; T108-Y112 PolarHBondContact O-N 3.37Å; M109-Y112 PolarHBondContact O-N 3.14Å; I110-Y112 VanDerWaalsContact C-N 3.26Å; I110-Y112 PolarHBondContact O-N 3.25Å; Y112-L114 VanDerWaalsContact C-N 3.35Å; Y112-L114 PolarHBondContact O-N 3.24Å; Y112-G115 PolarHBondContact O-N 3.29Å; Y112-F293 HydrophobicContact CD1-CB 4.12Å; Y112-W294 VanDerWaalsContact CD2-C 3.41Å; Y112-W294 WeakPolarHBondContact CE2-O 3.49Å; Y112-P295 HydrophobicContact CD2-CB 4.24Å; Y112-E311 WeakPolarHBondContact CE1-OE1 3.1Å; Y112-E311 VanDerWaalsContact CZ-OE1 3.26Å; Y112-E311 PolarHBondContact OH-OE1 2.86Å; Y112-E311 PolarHBondContact OH-OE2 3.15Å
113	L	93.3	Very high	89.1	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-40.2	177	-71.1	174.4	0	0	0	112.1	R35 F98 M109 I110 L315	R35-L113 PolarHBondContact NH2-O 3.34Å; F98-L113 HydrophobicContact CZ-CD1 4.08Å; M109-L113 HydrophobicContact CE-CD1 4.17Å; M109-L113 HydrophobicContact CG-CD1 4.24Å; M109-L113 HydrophobicContact CG-CG 4.44Å; M109-L113 WeakPolarHBondContact O-CB 3.06Å; M109-L113 VanDerWaalsContact O-CG 3.28Å; M109-L113 WeakPolarHBondContact O-CG 3.07Å; M109-L113 PolarHBondContact O-N 3.5Å; I110-L113 PolarHBondContact O-N 3.21Å; L113-L315 HydrophobicContact CD2-CD2 3.61Å
114	L	92.6	Very high	88.9	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-89	-10	-178.5	-68.9	175.8	0	0	0	113.9	I110 Y112 L116 L137 H180 L182 L183 F188	I110-L114 HydrophobicContact CG2-CD1 3.78Å; I110-L114 WeakPolarHBondContact O-CB 3.38Å; I110-L114 PolarHBondContact O-N 3.21Å; Y112-L114 VanDerWaalsContact C-N 3.35Å; Y112-L114 PolarHBondContact O-N 3.24Å; L114-L116 HydrophobicContact CB-CD1 3.84Å; L114-L116 HydrophobicContact CB-CD2 3.95Å; L114-L116 HydrophobicContact CB-CG 3.54Å; L114-L116 HydrophobicContact CD1-CD1 3.79Å; L114-L116 HydrophobicContact CD1-CG 4.44Å; L114-L116 HydrophobicContact CG-CD1 4.49Å; L114-L137 HydrophobicContact CD1-CD2 3.67Å; L114-H180 WeakPolarHBondContact CD2-ND1 3.44Å; L114-H180 PolarHBondContact O-CD2 3.43Å; L114-H180 PolarHBondContact O-NE2 3.5Å; L114-L182 HydrophobicContact CD2-CB 4.2Å; L114-L182 HydrophobicContact CD2-CD2 4.05Å; L114-L182 HydrophobicContact CD2-CG 4.46Å; L114-L183 HydrophobicContact CD1-CD1 4.39Å; L114-L183 HydrophobicContact CD1-CD2 4.29Å; L114-L183 HydrophobicContact CD2-CD1 4.44Å; L114-L183 HydrophobicContact CD2-CD2 4.03Å; L114-L183 HydrophobicContact CD2-CG 3.93Å; L114-F188 HydrophobicContact CD1-CD2 4.15Å; L114-F188 HydrophobicContact CD2-CD2 4.28Å; L114-F188 HydrophobicContact CD2-CE2 3.9Å; L114-F188 HydrophobicContact CG-CD2 4.36Å; L114-F188 HydrophobicContact CG-CE2 4.22Å
115	G	90.9	Very high	88.5	Confident	22 Å²	22	41.2 Å²	41.2	23%	0.227	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	36.8	-178.2	0	0	0	0	0	113.8	N111 Y112 E117	N111-G115 CarbonylContact O-C 3.56Å; N111-G115 WeakPolarHBondContact O-CA 3.44Å; N111-G115 PolarHBondContact O-N 2.73Å; Y112-G115 PolarHBondContact O-N 3.29Å; G115-E117 VanDerWaalsContact C-N 3.35Å
116	L	88.9	Confident	87.4	Confident	5 Å²	5	42.2 Å²	42.2	3%	0.026	21%	0.213	C	C	.	.			trans	-89.6	-3.7	-176.8	-51	-179.3	0	0	0	112.9	N111 L114 N118 T119 Y121 Q122 L137 V178	N111-L116 PolarHBondContact O-N 3.33Å; L114-L116 HydrophobicContact CB-CD1 3.84Å; L114-L116 HydrophobicContact CB-CD2 3.95Å; L114-L116 HydrophobicContact CB-CG 3.54Å; L114-L116 HydrophobicContact CD1-CD1 3.79Å; L114-L116 HydrophobicContact CD1-CG 4.44Å; L114-L116 HydrophobicContact CG-CD1 4.49Å; L116-N118 PolarHBondContact O-N 2.93Å; L116-T119 WeakPolarHBondContact CA-OG1 3.33Å; L116-T119 WeakPolarHBondContact O-CB 3.41Å; L116-T119 PolarHBondContact O-N 2.67Å; L116-T119 PolarHBondContact O-OG1 3.28Å; L116-Y121 HydrophobicContact CD2-CD2 4.46Å; L116-Q122 WeakPolarHBondContact O-CB 3.15Å; L116-L137 HydrophobicContact CD1-CD2 4.28Å; L116-V178 HydrophobicContact CD2-CG1 4.29Å
117	E	83.4	Confident	85.7	Confident	46 Å²	46	46.2 Å²	46.2	22%	0.215	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	132.3	175.3	-63.5	-78.2	176.2	0	0	110.9	G115 T119 Q122 P295	G115-E117 VanDerWaalsContact C-N 3.35Å; E117-T119 PolarHBondContact O-N 3.25Å; E117-Q122 PolarHBondContact OE2-NE2 3.49Å; E117-P295 HydrophobicContact CG-CB 4.37Å; E117-P295 HydrophobicContact CG-CG 3.76Å; E117-P295 VanDerWaalsContact OE1-CD 3.31Å; E117-P295 WeakPolarHBondContact OE1-CD 3.22Å
118	N	80.2	Confident	84.2	Confident	131 Å²	131	52 Å²	52	70%	0.701	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	14.6	-178.2	-57.3	-32.4	0	0	0	114.8	L116 Q122	L116-N118 PolarHBondContact O-N 2.93Å; N118-Q122 VanDerWaalsContact N-OE1 3.1Å
119	T	83.7	Confident	82.5	Confident	51 Å²	51	54.6 Å²	54.6	31%	0.313	29%	0.29	S	S	.	.	S	Bend	trans	-101.3	158.7	173.3	77.6	0	0	0	0	110.7	L116 E117 Y121 Q122	L116-T119 WeakPolarHBondContact CA-OG1 3.33Å; L116-T119 WeakPolarHBondContact O-CB 3.41Å; L116-T119 PolarHBondContact O-N 2.67Å; L116-T119 PolarHBondContact O-OG1 3.28Å; E117-T119 PolarHBondContact O-N 3.25Å; T119-Y121 PolarHBondContact O-N 3.48Å; T119-Y121 WeakPolarHBondContact OG1-CB 3.44Å; T119-Y121 PolarHBondContact OG1-N 3.06Å; T119-Y121 VanDerWaalsContact OG1-N 3.15Å; T119-Q122 WeakPolarHBondContact O-CB 3.47Å; T119-Q122 PolarHBondContact O-N 3.48Å; T119-Q122 VanDerWaalsContact O-N 3.08Å
120	R	80.1	Confident	80.5	Confident	191 Å²	191	56.3 Å²	56.3	72%	0.721	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-7	169.8	69.9	179.5	-176.7	177.9	2.8	114.3	L143	R120-L143 HydrophobicContact CG-CD2 4.28Å
121	Y	78.1	Confident	78.8	Confident	55 Å²	55	57.5 Å²	57.5	22%	0.216	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-2.8	-179.2	-45.2	-55.3	0	0	0	112.4	L116 T119 L123 L143 V178	L116-Y121 HydrophobicContact CD2-CD2 4.46Å; T119-Y121 PolarHBondContact O-N 3.48Å; T119-Y121 WeakPolarHBondContact OG1-CB 3.44Å; T119-Y121 PolarHBondContact OG1-N 3.06Å; T119-Y121 VanDerWaalsContact OG1-N 3.15Å; Y121-L123 PolarHBondContact O-N 2.92Å; Y121-L143 HydrophobicContact CD1-CB 3.84Å; Y121-L143 HydrophobicContact CD1-CD1 3.47Å; Y121-L143 VanDerWaalsContact CD1-CD1 3.47Å; Y121-L143 HydrophobicContact CD1-CD2 3.47Å; Y121-L143 VanDerWaalsContact CD1-CD2 3.47Å; Y121-L143 HydrophobicContact CD1-CG 3.73Å; Y121-L143 HydrophobicContact CE1-CB 3.45Å; Y121-L143 VanDerWaalsContact CE1-CB 3.45Å; Y121-L143 HydrophobicContact CE1-CD1 4.04Å; Y121-L143 HydrophobicContact CE1-CD2 3.61Å; Y121-L143 HydrophobicContact CE1-CG 3.85Å; Y121-V178 HydrophobicContact CD1-CG1 4.45Å; Y121-V178 HydrophobicContact CD2-CG1 4.4Å; Y121-V178 HydrophobicContact CG-CG1 4.11Å
122	Q	85.9	Confident	77.7	Confident	68 Å²	68	59.7 Å²	59.7	32%	0.318	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-58.2	126.9	-177.8	-171.1	170.9	-6.4	0	0	110.7	N111 L116 E117 N118 T119	N111-Q122 WeakPolarHBondContact ND2-CG 3.44Å; L116-Q122 WeakPolarHBondContact O-CB 3.15Å; E117-Q122 PolarHBondContact OE2-NE2 3.49Å; N118-Q122 VanDerWaalsContact N-OE1 3.1Å; T119-Q122 WeakPolarHBondContact O-CB 3.47Å; T119-Q122 PolarHBondContact O-N 3.48Å; T119-Q122 VanDerWaalsContact O-N 3.08Å
123	L	85.6	Confident	77.4	Confident	12 Å²	12	62.6 Å²	62.6	6%	0.063	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-65.4	136.8	167.5	-60.9	178.8	0	0	0	109	I110 N111 Y121 T125 T135 L137 I176	I110-L123 HydrophobicContact CB-CD1 3.96Å; I110-L123 HydrophobicContact CD1-CD1 4.25Å; I110-L123 HydrophobicContact CG2-CD1 3.66Å; N111-L123 PolarHBondContact ND2-O 3.45Å; N111-L123 WeakPolarHBondContact OD1-CB 3.29Å; N111-L123 WeakPolarHBondContact OD1-CG 3.49Å; N111-L123 PolarHBondContact OD1-N 3.38Å; Y121-L123 PolarHBondContact O-N 2.92Å; L123-T125 PolarHBondContact O-N 2.99Å; L123-T135 HydrophobicContact CD2-CG2 4.18Å; L123-L137 HydrophobicContact CD1-CD1 3.75Å; L123-L137 HydrophobicContact CD1-CD2 4Å; L123-L137 HydrophobicContact CD1-CG 4.49Å; L123-L137 HydrophobicContact CD2-CD1 4Å; L123-L137 HydrophobicContact CD2-CD2 4.08Å; L123-L137 HydrophobicContact CD2-CG 4.32Å; L123-L137 HydrophobicContact CG-CD1 4.42Å; L123-L137 HydrophobicContact CG-CD2 4.19Å; L123-I176 HydrophobicContact CD2-CD1 3.69Å
124	Y	83	Confident	77.4	Confident	156 Å²	156	62.5 Å²	62.5	61%	0.612	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-63.2	119.4	-178.8	-179.7	-121.9	0	0	0	111.2	T130	Y124-T130 HydrophobicContact CD1-CG2 3.78Å; Y124-T130 VanDerWaalsContact CE1-CB 3.44Å; Y124-T130 HydrophobicContact CE1-CG2 3.1Å
125	T	81.5	Confident	77.5	Confident	53 Å²	53	63 Å²	63	33%	0.325	34%	0.34	S	S	.	.			trans	-117	113.9	178.4	51	0	0	0	0	108.9	T108 L123	T108-T125 WeakPolarHBondContact OG1-CG2 3.4Å; L123-T125 PolarHBondContact O-N 2.99Å
126	G	69.8	Low	77.7	Confident	34 Å²	34	62 Å²	62	35%	0.351	33%	0.329	S	S	.	.			trans	-146.8	163.1	-177.9	0	0	0	0	0	112.8	E128	G126-E128 VanDerWaalsContact C-N 3.27Å; G126-E128 PolarHBondContact O-N 2.93Å
127	A	58.7	Low	78	Confident	92 Å²	92	61.8 Å²	61.8	76%	0.76	33%	0.328	S	S	*	.	S	Bend	trans	-81.9	-1.7	-179.7	0	0	0	0	0	113.8	W102	W102-A127 WeakPolarHBondContact CH2-O 3.22Å; W102-A127 WeakPolarHBondContact CZ2-O 3.4Å
128	E	60.4	Low	78.6	Confident	136 Å²	136	60.5 Å²	60.5	64%	0.636	32%	0.322	S	S	*	.	S	Bend	trans	-86.9	162.8	169.3	-66.4	-175.6	171.7	0	0	109.9	W102 G126 T130	W102-E128 WeakPolarHBondContact CZ2-O 3.38Å; W102-E128 PolarHBondContact NE1-O 2.82Å; W102-E128 VanDerWaalsContact NE1-O 3.12Å; G126-E128 VanDerWaalsContact C-N 3.27Å; G126-E128 PolarHBondContact O-N 2.93Å; E128-T130 HydrophobicContact CB-CG2 3.87Å; E128-T130 VanDerWaalsContact O-CG2 3.27Å; E128-T130 WeakPolarHBondContact O-CG2 3.45Å; E128-T130 PolarHBondContact O-N 2.75Å
129	P	59.4	Low	79.2	Confident	89 Å²	89	57 Å²	57	58%	0.578	30%	0.301	S	S	*	.	S	Bend	trans	-66.1	74.2	167.5	24.9	-30.3	0	0	0	110.3
130	T	52.9	Low	79.7	Confident	35 Å²	35	54.7 Å²	54.7	22%	0.215	29%	0.287	C	S	.	.			trans	-81.5	-38.6	-167.8	55.8	0	0	0	0	112.7	Y124 E128 S132	Y124-T130 HydrophobicContact CD1-CG2 3.78Å; Y124-T130 VanDerWaalsContact CE1-CB 3.44Å; Y124-T130 HydrophobicContact CE1-CG2 3.1Å; E128-T130 HydrophobicContact CB-CG2 3.87Å; E128-T130 VanDerWaalsContact O-CG2 3.27Å; E128-T130 WeakPolarHBondContact O-CG2 3.45Å; E128-T130 PolarHBondContact O-N 2.75Å; T130-S132 PolarHBondContact O-N 3.35Å; T130-S132 VanDerWaalsContact O-N 3.15Å
131	T	58.8	Low	80.2	Confident	27 Å²	27	51 Å²	51	17%	0.166	29%	0.288	C	S	.	.			trans	-84.7	85.7	175	50	0	0	0	0	110.4	E133 P192	T131-E133 VanDerWaalsContact C-N 3.3Å; T131-P192 WeakPolarHBondContact O-CA 3.46Å; T131-P192 WeakPolarHBondContact O-CB 3.46Å
132	S	70.5	Confident	80.8	Confident	45 Å²	45	56.1 Å²	56.1	32%	0.315	31%	0.311	S	S	.	.			trans	-85.1	-8.9	165.3	75.8	0	0	0	0	112.7	T130	T130-S132 PolarHBondContact O-N 3.35Å; T130-S132 VanDerWaalsContact O-N 3.15Å
133	E	87.6	Confident	81	Confident	62 Å²	62	55.8 Å²	55.8	29%	0.29	31%	0.311	S	S	.	.	S	Bend	trans	-115.9	148.7	-167.8	-67.4	154	-176.9	0	0	112.1	T131 K172 I174	T131-E133 VanDerWaalsContact C-N 3.3Å; E133-K172 CarbonylContact C-O 3.36Å; E133-K172 WeakPolarHBondContact CA-O 3.48Å; E133-K172 WeakPolarHBondContact CB-O 3.32Å; E133-K172 HydrophobicContact CG-CD 4.17Å; E133-I174 HydrophobicContact CB-CG1 4.48Å; E133-I174 VanDerWaalsContact CD-CD1 3.49Å; E133-I174 HydrophobicContact CG-CD1 4.31Å; E133-I174 WeakPolarHBondContact OE2-CD1 3.4Å
134	F	93.4	Very high	81.4	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	119.6	165.4	-75.1	-99.1	0	0	0	108.6	F169 K172 L173 I174 T191 P192 Y205 F207 V210 F214	F134-F169 AromaticContact CD2-CE2 3.65Å; F134-F169 HydrophobicContact CD2-CE2 3.65Å; F134-F169 HydrophobicContact CD2-CZ 4.38Å; F134-F169 AromaticContact CE2-CE2 3.97Å; F134-F169 HydrophobicContact CE2-CE2 3.97Å; F134-F169 HydrophobicContact CG-CE2 4.28Å; F134-K172 PolarHBondContact N-O 3.35Å; F134-L173 HydrophobicContact CB-CD1 3.86Å; F134-I174 PolarHBondContact O-N 3.49Å; F134-T191 HydrophobicContact CD1-CG2 3.94Å; F134-T191 HydrophobicContact CE1-CG2 3.74Å; F134-P192 HydrophobicContact CD2-CG 3.85Å; F134-P192 HydrophobicContact CE2-CG 3.89Å; F134-P192 HydrophobicContact CG-CG 4.39Å; F134-P192 HydrophobicContact CZ-CG 4.44Å; F134-Y205 AromaticContact CE2-CE2 3.89Å; F134-Y205 HydrophobicContact CE2-CE2 3.89Å; F134-Y205 WeakPolarHBondContact CE2-OH 3.36Å; F134-F207 HydrophobicContact CE2-CD2 4.03Å; F134-F207 HydrophobicContact CE2-CE2 4.01Å; F134-F207 AromaticContact CZ-CD2 3.97Å; F134-F207 HydrophobicContact CZ-CD2 3.97Å; F134-F207 AromaticContact CZ-CE2 3.7Å; F134-F207 HydrophobicContact CZ-CE2 3.7Å; F134-V210 HydrophobicContact CD1-CG1 4.48Å; F134-V210 HydrophobicContact CD2-CG1 4.33Å; F134-V210 HydrophobicContact CE1-CG1 3.98Å; F134-V210 HydrophobicContact CE2-CG1 3.79Å; F134-V210 HydrophobicContact CZ-CB 4.38Å; F134-V210 HydrophobicContact CZ-CG1 3.6Å; F134-F214 HydrophobicContact CB-CE2 4.47Å; F134-F214 AromaticContact CD1-CD2 3.85Å; F134-F214 HydrophobicContact CD1-CD2 3.85Å; F134-F214 AromaticContact CD1-CE2 3.53Å; F134-F214 HydrophobicContact CD1-CE2 3.53Å; F134-F214 HydrophobicContact CD1-CZ 4.25Å; F134-F214 AromaticContact CE1-CD2 3.85Å; F134-F214 HydrophobicContact CE1-CD2 3.85Å; F134-F214 AromaticContact CE1-CE2 3.95Å; F134-F214 HydrophobicContact CE1-CE2 3.95Å; F134-F214 HydrophobicContact CG-CE2 4.12Å
135	T	94.4	Very high	81.8	Confident	14 Å²	14	57.8 Å²	57.8	9%	0.086	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119	-179	-52.9	0	0	0	0	110.3	L123 L137 I174 I176 V189 D190	L123-T135 HydrophobicContact CD2-CG2 4.18Å; T135-L137 HydrophobicContact CG2-CD1 3.76Å; T135-I174 CarbonylContact C-O 3.51Å; T135-I174 WeakPolarHBondContact CA-O 2.99Å; T135-I176 HydrophobicContact CG2-CD1 3.54Å; T135-I176 HydrophobicContact CG2-CG1 3.94Å; T135-V189 CarbonylContact O-C 3.48Å; T135-V189 WeakPolarHBondContact O-CA 3.27Å; T135-D190 PolarHBondContact N-O 3.44Å; T135-D190 PolarHBondContact O-N 3.23Å
136	V	96.1	Very high	82.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.3	176.7	-176.9	0	0	0	0	109.1	M138 M151 F159 L173 I174 G175 I176 T187 F188 V189 F214	V136-M138 HydrophobicContact CB-CE 4.22Å; V136-M138 HydrophobicContact CG1-CE 3.87Å; V136-M151 HydrophobicContact CB-CE 3.95Å; V136-M151 HydrophobicContact CG1-CE 4.23Å; V136-M151 HydrophobicContact CG2-CE 3.98Å; V136-F159 HydrophobicContact CB-CZ 4.44Å; V136-F159 HydrophobicContact CG1-CE1 4.18Å; V136-F159 HydrophobicContact CG1-CE2 3.95Å; V136-F159 HydrophobicContact CG1-CZ 3.46Å; V136-F159 VanDerWaalsContact CG1-CZ 3.46Å; V136-F159 HydrophobicContact CG2-CE1 4.2Å; V136-F159 HydrophobicContact CG2-CZ 4.27Å; V136-L173 HydrophobicContact CG2-CD1 4Å; V136-I174 PolarHBondContact N-O 3Å; V136-G175 CarbonylContact O-C 3.5Å; V136-G175 WeakPolarHBondContact O-CA 3.36Å; V136-I176 PolarHBondContact O-N 2.96Å; V136-T187 HydrophobicContact CG1-CG2 3.63Å; V136-F188 CarbonylContact C-O 3.58Å; V136-V189 HydrophobicContact CG1-CG2 4.42Å; V136-V189 HydrophobicContact CG2-CG2 4.29Å; V136-F214 HydrophobicContact CG2-CE1 4.38Å
137	L	95.5	Very high	83.6	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	119.5	174.6	-73.3	85.8	0	0	0	109.7	I110 L114 L116 L123 T135 I176 L183 T187 F188	I110-L137 HydrophobicContact CG2-CD1 4.36Å; I110-L137 HydrophobicContact CG2-CD2 3.79Å; L114-L137 HydrophobicContact CD1-CD2 3.67Å; L116-L137 HydrophobicContact CD1-CD2 4.28Å; L123-L137 HydrophobicContact CD1-CD1 3.75Å; L123-L137 HydrophobicContact CD1-CD2 4Å; L123-L137 HydrophobicContact CD1-CG 4.49Å; L123-L137 HydrophobicContact CD2-CD1 4Å; L123-L137 HydrophobicContact CD2-CD2 4.08Å; L123-L137 HydrophobicContact CD2-CG 4.32Å; L123-L137 HydrophobicContact CG-CD1 4.42Å; L123-L137 HydrophobicContact CG-CD2 4.19Å; T135-L137 HydrophobicContact CG2-CD1 3.76Å; L137-I176 WeakPolarHBondContact CA-O 3.42Å; L137-L183 HydrophobicContact CB-CD2 4.45Å; L137-T187 WeakPolarHBondContact O-CG2 3.48Å; L137-F188 HydrophobicContact CB-CB 4.27Å; L137-F188 PolarHBondContact N-O 3.25Å; L137-F188 PolarHBondContact O-N 3.28Å
138	M	94.6	Very high	85.2	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.089	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	162.8	-178	69.7	-168.3	90	0	0	110.7	V136 M151 R157 I176 E177 V178 T187	V136-M138 HydrophobicContact CB-CE 4.22Å; V136-M138 HydrophobicContact CG1-CE 3.87Å; M138-M151 HydrophobicContact CE-CE 3.7Å; M138-M151 HydrophobicContact CE-SD 4.15Å; M138-R157 PolarHBondContact SD-NH1 3.42Å; M138-I176 PolarHBondContact N-O 3.46Å; M138-E177 HydrophobicContact CG-CG 3.67Å; M138-E177 CarbonylContact O-C 3.59Å; M138-E177 VanDerWaalsContact O-CA 3.29Å; M138-E177 WeakPolarHBondContact O-CA 3.33Å; M138-E177 HydrophobicContact SD-CG 4.15Å; M138-V178 PolarHBondContact O-N 2.77Å; M138-T187 HydrophobicContact CB-CG2 4.45Å
139	H	94.2	Very high	86.8	Confident	59 Å²	59	53.8 Å²	53.8	27%	0.273	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	136.8	174.7	176.8	91.6	0	0	0	111.2	V178 H180 L183 E184	H139-V178 WeakPolarHBondContact CA-O 3.27Å; H139-H180 PolarHBondContact ND1-O 3.35Å; H139-L183 VanDerWaalsContact CB-C 3.43Å; H139-L183 HydrophobicContact CB-CB 3.73Å; H139-L183 WeakPolarHBondContact CB-O 3.34Å; H139-E184 HydrophobicContact CB-CG 4.48Å; H139-E184 WeakPolarHBondContact CE1-CG 3.49Å; H139-E184 IonicContact CE1-OE1 3.28Å; H139-E184 PolarHBondContact CE1-OE1 3.1Å; H139-E184 WeakPolarHBondContact ND1-CG 3.13Å; H139-E184 IonicContact ND1-OE1 3.55Å
140	G	92.3	Very high	88.5	Confident	2 Å²	2	53.3 Å²	53.3	2%	0.021	28%	0.281	C	S	.	.			trans	-146.9	162.4	163.7	0	0	0	0	0	110.8	K142 V178 P179	G140-K142 PolarHBondContact O-N 3.36Å; G140-V178 PolarHBondContact N-O 3.26Å; G140-V178 CarbonylContact O-C 3.57Å; G140-P179 WeakPolarHBondContact O-CA 3.43Å; G140-P179 WeakPolarHBondContact O-CB 3.35Å
141	P	91.3	Very high	90.3	Very high	113 Å²	113	51.7 Å²	51.7	73%	0.734	27%	0.271	S	S	*	.	S	Bend	trans	-67	-21.1	-175.9	28.1	-35.7	0	0	0	112.9
142	K	91.1	Very high	91.9	Very high	162 Å²	162	50.5 Å²	50.5	70%	0.704	26%	0.264	S	S	*	.	S	Bend	trans	-143.6	158.1	179.6	-65.3	-175.9	-179	178.5	0	109.2	G140 K144	G140-K142 PolarHBondContact O-N 3.36Å; K142-K144 PolarHBondContact O-N 3.12Å
143	L	90.7	Very high	92.8	Very high	61 Å²	61	52.2 Å²	52.2	32%	0.319	28%	0.281	S	S	.	.			trans	-64	123	171.5	179.1	68.4	0	0	0	110.8	R120 Y121 I176 E177 V178	R120-L143 HydrophobicContact CG-CD2 4.28Å; Y121-L143 HydrophobicContact CD1-CB 3.84Å; Y121-L143 HydrophobicContact CD1-CD1 3.47Å; Y121-L143 VanDerWaalsContact CD1-CD1 3.47Å; Y121-L143 HydrophobicContact CD1-CD2 3.47Å; Y121-L143 VanDerWaalsContact CD1-CD2 3.47Å; Y121-L143 HydrophobicContact CD1-CG 3.73Å; Y121-L143 HydrophobicContact CE1-CB 3.45Å; Y121-L143 VanDerWaalsContact CE1-CB 3.45Å; Y121-L143 HydrophobicContact CE1-CD1 4.04Å; Y121-L143 HydrophobicContact CE1-CD2 3.61Å; Y121-L143 HydrophobicContact CE1-CG 3.85Å; L143-I176 HydrophobicContact CD1-CG2 3.95Å; L143-E177 VanDerWaalsContact CA-O 3.25Å; L143-E177 WeakPolarHBondContact CA-O 3.45Å; L143-E177 WeakPolarHBondContact CD1-O 3.47Å; L143-V178 HydrophobicContact CD1-CG2 4.17Å
144	K	93.1	Very high	92.8	Very high	117 Å²	117	52 Å²	52	51%	0.509	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	131.5	176.7	-176.3	-178.8	176.6	-171.4	0	110	K142 I146 E177	K142-K144 PolarHBondContact O-N 3.12Å; K144-I146 HydrophobicContact CD-CD1 4.39Å; K144-I146 HydrophobicContact CD-CG1 4.15Å; K144-I146 HydrophobicContact CG-CG1 4.08Å; K144-E177 HydrophobicContact CB-CB 4.29Å; K144-E177 PolarHBondContact N-O 3.18Å; K144-E177 PolarHBondContact O-N 3.18Å
145	T	92.6	Very high	92.3	Very high	94 Å²	94	56.5 Å²	56.5	58%	0.577	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	136.1	166	-51	0	0	0	0	108.9	I174 G175	T145-I174 HydrophobicContact CG2-CG2 3.47Å; T145-I174 VanDerWaalsContact CG2-CG2 3.47Å; T145-G175 CarbonylContact C-O 3.52Å; T145-G175 WeakPolarHBondContact CA-O 3.5Å
146	I	93.3	Very high	91.7	Very high	7 Å²	7	59.2 Å²	59.2	4%	0.036	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.3	-177	-54.3	179.4	0	0	0	107.1	K144 V150 M151 G175 E177	K144-I146 HydrophobicContact CD-CD1 4.39Å; K144-I146 HydrophobicContact CD-CG1 4.15Å; K144-I146 HydrophobicContact CG-CG1 4.08Å; I146-V150 HydrophobicContact CG2-CB 3.93Å; I146-V150 HydrophobicContact CG2-CG1 3.94Å; I146-M151 HydrophobicContact CB-CG 4.08Å; I146-M151 HydrophobicContact CG2-CG 3.55Å; I146-G175 PolarHBondContact N-O 3.2Å; I146-G175 PolarHBondContact O-N 2.84Å; I146-E177 VanDerWaalsContact CD1-CD 3.45Å; I146-E177 HydrophobicContact CD1-CG 3.91Å; I146-E177 WeakPolarHBondContact CD1-OE1 3.21Å
147	E	94.1	Very high	91.1	Very high	135 Å²	135	61.6 Å²	61.6	63%	0.631	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	146.9	176.3	-64.2	172.1	-167.5	0	0	110.8	I149 V150 M151	E147-I149 HydrophobicContact CB-CG2 4.24Å; E147-I149 PolarHBondContact O-N 3.05Å; E147-V150 HydrophobicContact CB-CG2 4.37Å; E147-V150 PolarHBondContact O-N 3.34Å; E147-M151 PolarHBondContact O-N 3.15Å
148	G	93.6	Very high	90.7	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-57.6	-34.8	-177.6	0	0	0	0	0	113.5	V150 M151 A152 L170 L173	G148-V150 VanDerWaalsContact C-N 3.34Å; G148-V150 PolarHBondContact O-N 3.07Å; G148-M151 WeakPolarHBondContact O-CB 3.28Å; G148-M151 PolarHBondContact O-N 2.85Å; G148-A152 WeakPolarHBondContact O-CB 3.49Å; G148-A152 PolarHBondContact O-N 2.89Å; G148-L170 WeakPolarHBondContact CA-O 3.36Å; G148-L173 WeakPolarHBondContact CA-O 3.43Å; G148-L173 PolarHBondContact N-O 3.48Å
149	I	93.6	Very high	90.5	Very high	88 Å²	88	61.7 Å²	61.7	45%	0.451	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-39.7	176	-165.3	165.7	0	0	0	112.3	E147 A152 A153 L170	E147-I149 HydrophobicContact CB-CG2 4.24Å; E147-I149 PolarHBondContact O-N 3.05Å; I149-A152 PolarHBondContact O-N 2.83Å; I149-A153 WeakPolarHBondContact O-CB 3.46Å; I149-A153 PolarHBondContact O-N 3.29Å; I149-L170 HydrophobicContact CB-CB 4.44Å; I149-L170 HydrophobicContact CB-CD1 4.43Å; I149-L170 HydrophobicContact CG1-CD1 4.31Å
150	V	94.2	Very high	90.3	Very high	79 Å²	79	60.4 Å²	60.4	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-71.7	-37.9	176.9	-178.9	0	0	0	0	110.2	I146 E147 G148 A152 A153 D154	I146-V150 HydrophobicContact CG2-CB 3.93Å; I146-V150 HydrophobicContact CG2-CG1 3.94Å; E147-V150 HydrophobicContact CB-CG2 4.37Å; E147-V150 PolarHBondContact O-N 3.34Å; G148-V150 VanDerWaalsContact C-N 3.34Å; G148-V150 PolarHBondContact O-N 3.07Å; V150-A152 VanDerWaalsContact C-N 3.35Å; V150-A153 PolarHBondContact O-N 3.35Å; V150-D154 PolarHBondContact O-N 3.19Å
151	M	92.1	Very high	90.2	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-40.2	174.8	-69.2	-177.1	55	0	0	112.9	V136 M138 I146 E147 G148 F159 L173 G175	V136-M151 HydrophobicContact CB-CE 3.95Å; V136-M151 HydrophobicContact CG1-CE 4.23Å; V136-M151 HydrophobicContact CG2-CE 3.98Å; M138-M151 HydrophobicContact CE-CE 3.7Å; M138-M151 HydrophobicContact CE-SD 4.15Å; I146-M151 HydrophobicContact CB-CG 4.08Å; I146-M151 HydrophobicContact CG2-CG 3.55Å; E147-M151 PolarHBondContact O-N 3.15Å; G148-M151 WeakPolarHBondContact O-CB 3.28Å; G148-M151 PolarHBondContact O-N 2.85Å; M151-F159 HydrophobicContact CE-CB 4.42Å; M151-F159 HydrophobicContact CE-CD1 4.34Å; M151-F159 HydrophobicContact CE-CD2 3.4Å; M151-F159 HydrophobicContact CE-CE2 3.68Å; M151-F159 HydrophobicContact CE-CG 3.79Å; M151-F159 HydrophobicContact CE-CZ 4.28Å; M151-L173 HydrophobicContact SD-CG 4.49Å; M151-G175 WeakPolarHBondContact SD-CA 3.45Å; M151-G175 PolarHBondContact SD-N 3.35Å
152	A	91.6	Very high	90.2	Very high	3 Å²	3	56.3 Å²	56.3	3%	0.025	32%	0.319	C	S	.	.	H	α-helix	trans	-73	-33.3	179.2	0	0	0	0	0	112	G148 I149 V150 D154 S160 E163 L170	G148-A152 WeakPolarHBondContact O-CB 3.49Å; G148-A152 PolarHBondContact O-N 2.89Å; I149-A152 PolarHBondContact O-N 2.83Å; V150-A152 VanDerWaalsContact C-N 3.35Å; A152-D154 VanDerWaalsContact C-N 3.26Å; A152-D154 PolarHBondContact O-N 3.49Å; A152-S160 WeakPolarHBondContact O-CA 3.42Å; A152-S160 WeakPolarHBondContact O-CB 3.41Å; A152-E163 HydrophobicContact CB-CB 4.41Å; A152-L170 HydrophobicContact CB-CD2 3.84Å
153	A	89.8	Confident	90.3	Very high	81 Å²	81	54.7 Å²	54.7	67%	0.669	31%	0.313	S	S	*	.	H	α-helix	trans	-68.1	-24.3	176.4	0	0	0	0	0	113.5	I149 V150 S155	I149-A153 WeakPolarHBondContact O-CB 3.46Å; I149-A153 PolarHBondContact O-N 3.29Å; V150-A153 PolarHBondContact O-N 3.35Å; A153-S155 PolarHBondContact O-N 2.81Å
154	D	87.3	Confident	90.3	Very high	57 Å²	57	58 Å²	58	31%	0.305	33%	0.325	S	S	.	.			trans	-80.2	97.7	-179.3	-173.6	0.7	0	0	0	112.2	V150 A152 A156 R157	V150-D154 PolarHBondContact O-N 3.19Å; A152-D154 VanDerWaalsContact C-N 3.26Å; A152-D154 PolarHBondContact O-N 3.49Å; D154-A156 PolarHBondContact O-N 3.1Å; D154-A156 VanDerWaalsContact O-N 3.15Å; D154-A156 VanDerWaalsContact OD1-CB 3.27Å; D154-A156 WeakPolarHBondContact OD1-CB 3.33Å; D154-A156 PolarHBondContact OD1-N 2.77Å; D154-R157 HydrophobicContact CB-CG 4.16Å; D154-R157 WeakPolarHBondContact O-CB 3.31Å; D154-R157 PolarHBondContact O-N 3.43Å; D154-R157 WeakPolarHBondContact OD2-CD 3.2Å; D154-R157 WeakPolarHBondContact OD2-CG 3.43Å; D154-R157 IonicContact OD2-CZ 3.84Å; D154-R157 IonicContact OD2-NE 2.86Å; D154-R157 PolarHBondContact OD2-NE 3.48Å
155	S	82.3	Confident	90.2	Very high	95 Å²	95	53.7 Å²	53.7	66%	0.664	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.7	176.6	66.8	0	0	0	0	115.1	A153 R157	A153-S155 PolarHBondContact O-N 2.81Å; S155-R157 PolarHBondContact O-N 2.82Å
156	A	81.9	Confident	90.2	Very high	70 Å²	70	50.7 Å²	50.7	58%	0.579	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.9	174.4	0	0	0	0	0	112.2	D154	D154-A156 PolarHBondContact O-N 3.1Å; D154-A156 VanDerWaalsContact O-N 3.15Å; D154-A156 VanDerWaalsContact OD1-CB 3.27Å; D154-A156 WeakPolarHBondContact OD1-CB 3.33Å; D154-A156 PolarHBondContact OD1-N 2.77Å
157	R	83.9	Confident	90	Very high	50 Å²	50	57 Å²	57	19%	0.189	32%	0.324	C	S	.	.	S	Bend	trans	-94.8	158.7	176.4	-60.8	176.8	-169	-142.7	-14.2	111	M138 D154 S155 F159 E177	M138-R157 PolarHBondContact SD-NH1 3.42Å; D154-R157 HydrophobicContact CB-CG 4.16Å; D154-R157 WeakPolarHBondContact O-CB 3.31Å; D154-R157 PolarHBondContact O-N 3.43Å; D154-R157 WeakPolarHBondContact OD2-CD 3.2Å; D154-R157 WeakPolarHBondContact OD2-CG 3.43Å; D154-R157 IonicContact OD2-CZ 3.84Å; D154-R157 IonicContact OD2-NE 2.86Å; D154-R157 PolarHBondContact OD2-NE 3.48Å; S155-R157 PolarHBondContact O-N 2.82Å; R157-F159 HydrophobicContact CB-CD2 3.92Å; R157-F159 PolarHBondContact O-N 3.38Å; R157-E177 IonicContact CZ-OE1 3.67Å; R157-E177 IonicContact NH1-OE1 2.75Å; R157-E177 IonicContact NH2-OE1 2.73Å; R157-E177 PolarHBondContact NH2-OE1 2.93Å
158	S	87.2	Confident	89.9	Confident	12 Å²	12	55.2 Å²	55.2	8%	0.084	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	5.6	177.1	54.9	0	0	0	0	114.2	W213	S158-W213 WeakPolarHBondContact O-CH2 3.25Å; S158-W213 WeakPolarHBondContact O-CZ2 3.44Å
159	F	91.2	Very high	89.9	Confident	9 Å²	9	55.1 Å²	55.1	4%	0.039	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-6.1	-169.4	-58.2	-63.7	0	0	0	114.5	M95 V136 M151 R157 P161 L162 W213 F214	M95-F159 HydrophobicContact CE-CE1 4.17Å; V136-F159 HydrophobicContact CB-CZ 4.44Å; V136-F159 HydrophobicContact CG1-CE1 4.18Å; V136-F159 HydrophobicContact CG1-CE2 3.95Å; V136-F159 HydrophobicContact CG1-CZ 3.46Å; V136-F159 VanDerWaalsContact CG1-CZ 3.46Å; V136-F159 HydrophobicContact CG2-CE1 4.2Å; V136-F159 HydrophobicContact CG2-CZ 4.27Å; M151-F159 HydrophobicContact CE-CB 4.42Å; M151-F159 HydrophobicContact CE-CD1 4.34Å; M151-F159 HydrophobicContact CE-CD2 3.4Å; M151-F159 HydrophobicContact CE-CE2 3.68Å; M151-F159 HydrophobicContact CE-CG 3.79Å; M151-F159 HydrophobicContact CE-CZ 4.28Å; R157-F159 HydrophobicContact CB-CD2 3.92Å; R157-F159 PolarHBondContact O-N 3.38Å; F159-P161 VanDerWaalsContact C-N 3.3Å; F159-L162 HydrophobicContact CB-CD1 4.11Å; F159-L162 HydrophobicContact CD1-CD1 3.89Å; F159-L162 HydrophobicContact CG-CD1 4.44Å; F159-L162 WeakPolarHBondContact O-CB 3.3Å; F159-L162 PolarHBondContact O-N 2.89Å; F159-W213 AromaticContact CD1-CH2 3.77Å; F159-W213 HydrophobicContact CD1-CH2 3.77Å; F159-W213 HydrophobicContact CD1-CZ3 4.14Å; F159-W213 HydrophobicContact CE1-CH2 4.3Å; F159-W213 HydrophobicContact CE1-CZ3 4.41Å; F159-F214 HydrophobicContact CE1-CE1 4.31Å
160	S	89.6	Confident	89.9	Confident	32 Å²	32	51.5 Å²	51.5	22%	0.224	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-54.8	-35.5	178.1	65.5	0	0	0	0	115.2	A152 L162 E163	A152-S160 WeakPolarHBondContact O-CA 3.42Å; A152-S160 WeakPolarHBondContact O-CB 3.41Å; S160-L162 PolarHBondContact O-N 2.94Å; S160-E163 WeakPolarHBondContact O-CB 3.47Å; S160-E163 PolarHBondContact O-N 3.33Å
161	P	90.5	Very high	89.7	Confident	30 Å²	30	54.3 Å²	54.3	20%	0.195	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-67.1	-9	177.7	-20.7	35.3	0	0	0	114.4	T86 F159 E163 K164 W213	T86-P161 HydrophobicContact CG2-CG 3.8Å; F159-P161 VanDerWaalsContact C-N 3.3Å; P161-E163 PolarHBondContact O-N 3.29Å; P161-K164 WeakPolarHBondContact O-CD 3.41Å; P161-K164 WeakPolarHBondContact O-CG 3.07Å; P161-W213 HydrophobicContact CB-CZ2 4.4Å; P161-W213 HydrophobicContact CG-CZ2 4.49Å
162	L	91.8	Very high	89.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-72.1	-17.7	175.6	-69.8	177.6	0	0	0	112.9	F159 S160 K164 F165 F169 L173 W213 F214	F159-L162 HydrophobicContact CB-CD1 4.11Å; F159-L162 HydrophobicContact CD1-CD1 3.89Å; F159-L162 HydrophobicContact CG-CD1 4.44Å; F159-L162 WeakPolarHBondContact O-CB 3.3Å; F159-L162 PolarHBondContact O-N 2.89Å; S160-L162 PolarHBondContact O-N 2.94Å; L162-K164 PolarHBondContact O-N 3.45Å; L162-K164 VanDerWaalsContact O-N 3.13Å; L162-F165 HydrophobicContact CD2-CD2 3.78Å; L162-F165 HydrophobicContact CD2-CE2 3.67Å; L162-F165 WeakPolarHBondContact O-CD2 3.39Å; L162-F165 PolarHBondContact O-N 3.38Å; L162-F169 HydrophobicContact CB-CE1 4.04Å; L162-F169 HydrophobicContact CD1-CE1 4.18Å; L162-F169 HydrophobicContact CD2-CE1 3.95Å; L162-F169 HydrophobicContact CD2-CZ 4.45Å; L162-F169 HydrophobicContact CG-CE1 4.29Å; L162-L173 HydrophobicContact CD1-CD1 4.44Å; L162-L173 HydrophobicContact CD1-CD2 3.57Å; L162-W213 HydrophobicContact CD1-CE3 4.38Å; L162-W213 HydrophobicContact CD1-CH2 4.05Å; L162-W213 HydrophobicContact CD1-CZ3 3.95Å; L162-W213 HydrophobicContact CD2-CD2 3.39Å; L162-W213 HydrophobicContact CD2-CE3 3.46Å; L162-W213 VanDerWaalsContact CD2-CE3 3.46Å; L162-W213 HydrophobicContact CD2-CG 3.89Å; L162-W213 HydrophobicContact CD2-CH2 4.15Å; L162-W213 HydrophobicContact CD2-CZ2 4.07Å; L162-W213 HydrophobicContact CD2-CZ3 3.85Å; L162-W213 HydrophobicContact CG-CD2 4.16Å; L162-W213 HydrophobicContact CG-CE3 4.13Å; L162-W213 HydrophobicContact CG-CH2 3.9Å; L162-W213 HydrophobicContact CG-CZ2 3.89Å; L162-W213 HydrophobicContact CG-CZ3 4.01Å; L162-F214 HydrophobicContact CD1-CZ 4.08Å
163	E	91.5	Very high	89.9	Confident	127 Å²	127	57.5 Å²	57.5	59%	0.593	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-56.7	-29.3	176.8	-170.2	175.7	-174.7	0	0	112.3	A152 S160 P161 F165 G166	A152-E163 HydrophobicContact CB-CB 4.41Å; S160-E163 WeakPolarHBondContact O-CB 3.47Å; S160-E163 PolarHBondContact O-N 3.33Å; P161-E163 PolarHBondContact O-N 3.29Å; E163-F165 PolarHBondContact O-N 2.94Å; E163-F165 VanDerWaalsContact O-N 3.07Å; E163-G166 PolarHBondContact O-N 3.34Å
164	K	90.9	Very high	90.1	Very high	130 Å²	130	55.4 Å²	55.4	57%	0.565	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-59.4	-21.2	177.5	79.9	-174.6	-178.4	164.1	0	114.4	P161 L162 G166	P161-K164 WeakPolarHBondContact O-CD 3.41Å; P161-K164 WeakPolarHBondContact O-CG 3.07Å; L162-K164 PolarHBondContact O-N 3.45Å; L162-K164 VanDerWaalsContact O-N 3.13Å; K164-G166 VanDerWaalsContact C-N 3.28Å
165	F	91.8	Very high	90.4	Very high	27 Å²	27	52.7 Å²	52.7	12%	0.118	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-84.2	-4.3	179	-62.4	-61.5	0	0	0	113.2	L162 E163 F169 P206 D209 V210 W213	L162-F165 HydrophobicContact CD2-CD2 3.78Å; L162-F165 HydrophobicContact CD2-CE2 3.67Å; L162-F165 WeakPolarHBondContact O-CD2 3.39Å; L162-F165 PolarHBondContact O-N 3.38Å; E163-F165 PolarHBondContact O-N 2.94Å; E163-F165 VanDerWaalsContact O-N 3.07Å; F165-F169 HydrophobicContact CB-CB 3.86Å; F165-F169 HydrophobicContact CB-CD1 3.7Å; F165-F169 HydrophobicContact CB-CG 3.92Å; F165-F169 HydrophobicContact CD2-CD1 4.21Å; F165-F169 HydrophobicContact CD2-CE1 4.33Å; F165-F169 HydrophobicContact CG-CD1 4.36Å; F165-P206 HydrophobicContact CD1-CG 3.89Å; F165-D209 HydrophobicContact CE1-CB 3.64Å; F165-D209 HydrophobicContact CZ-CB 4.31Å; F165-D209 WeakPolarHBondContact CZ-O 3.34Å; F165-V210 HydrophobicContact CB-CG2 4.18Å; F165-V210 HydrophobicContact CD1-CG2 3.86Å; F165-V210 HydrophobicContact CD2-CG2 3.79Å; F165-V210 HydrophobicContact CE1-CG2 4.13Å; F165-V210 HydrophobicContact CE2-CG2 4.04Å; F165-V210 HydrophobicContact CG-CG2 3.68Å; F165-V210 HydrophobicContact CZ-CG2 4.19Å; F165-W213 HydrophobicContact CE2-CB 3.95Å; F165-W213 HydrophobicContact CE2-CG 4.05Å; F165-W213 HydrophobicContact CZ-CB 3.98Å; F165-W213 HydrophobicContact CZ-CG 4.44Å
166	G	91.4	Very high	91	Very high	31 Å²	31	49.4 Å²	49.4	32%	0.32	26%	0.258	S	S	.	.			trans	84.3	172.2	173.2	0	0	0	0	0	114.6	E163 K164 N168 F169 L170	E163-G166 PolarHBondContact O-N 3.34Å; K164-G166 VanDerWaalsContact C-N 3.28Å; G166-N168 PolarHBondContact O-N 3.32Å; G166-F169 PolarHBondContact O-N 2.87Å; G166-L170 WeakPolarHBondContact O-CG 3.35Å; G166-L170 PolarHBondContact O-N 2.98Å
167	Q	90.4	Very high	91.6	Very high	140 Å²	140	47.3 Å²	47.3	65%	0.654	24%	0.236	S	C	*	.	H	α-helix	trans	-61.3	-41.8	-173.5	-69.6	179.3	-12	0	0	113	F169 L170 E171	Q167-F169 PolarHBondContact O-N 3.32Å; Q167-F169 VanDerWaalsContact O-N 3.14Å; Q167-L170 PolarHBondContact O-N 3.4Å; Q167-E171 PolarHBondContact O-N 3.44Å
168	N	91.3	Very high	92.1	Very high	97 Å²	97	45 Å²	45	52%	0.519	23%	0.228	S	C	.	.	H	α-helix	trans	-55.1	-35.5	178.5	-62.4	-3.6	0	0	0	112.8	G166 K172 G204	G166-N168 PolarHBondContact O-N 3.32Å; N168-K172 WeakPolarHBondContact O-CG 3.48Å; N168-G204 VanDerWaalsContact CB-O 3.25Å; N168-G204 WeakPolarHBondContact CB-O 3.28Å; N168-G204 PolarHBondContact ND2-O 3.1Å
169	F	93.3	Very high	92.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-76.2	-43.1	175	171.5	-111	0	0	0	111.9	F134 L162 F165 G166 Q167 E171 K172 L173 Y205 V210 F214	F134-F169 AromaticContact CD2-CE2 3.65Å; F134-F169 HydrophobicContact CD2-CE2 3.65Å; F134-F169 HydrophobicContact CD2-CZ 4.38Å; F134-F169 AromaticContact CE2-CE2 3.97Å; F134-F169 HydrophobicContact CE2-CE2 3.97Å; F134-F169 HydrophobicContact CG-CE2 4.28Å; L162-F169 HydrophobicContact CB-CE1 4.04Å; L162-F169 HydrophobicContact CD1-CE1 4.18Å; L162-F169 HydrophobicContact CD2-CE1 3.95Å; L162-F169 HydrophobicContact CD2-CZ 4.45Å; L162-F169 HydrophobicContact CG-CE1 4.29Å; F165-F169 HydrophobicContact CB-CB 3.86Å; F165-F169 HydrophobicContact CB-CD1 3.7Å; F165-F169 HydrophobicContact CB-CG 3.92Å; F165-F169 HydrophobicContact CD2-CD1 4.21Å; F165-F169 HydrophobicContact CD2-CE1 4.33Å; F165-F169 HydrophobicContact CG-CD1 4.36Å; G166-F169 PolarHBondContact O-N 2.87Å; Q167-F169 PolarHBondContact O-N 3.32Å; Q167-F169 VanDerWaalsContact O-N 3.14Å; F169-E171 PolarHBondContact O-N 3.49Å; F169-K172 CarbonylContact O-C 3.49Å; F169-K172 VanDerWaalsContact O-CA 3.29Å; F169-K172 WeakPolarHBondContact O-CA 3.48Å; F169-K172 WeakPolarHBondContact O-CB 3.47Å; F169-K172 PolarHBondContact O-N 3.13Å; F169-L173 HydrophobicContact CE1-CB 4.29Å; F169-L173 HydrophobicContact CE1-CD2 4.19Å; F169-L173 HydrophobicContact CZ-CB 4.09Å; F169-L173 HydrophobicContact CZ-CD1 4.3Å; F169-L173 HydrophobicContact CZ-CD2 4.45Å; F169-L173 PolarHBondContact O-N 2.87Å; F169-Y205 HydrophobicContact CB-CD2 4.35Å; F169-Y205 HydrophobicContact CB-CG 4.04Å; F169-Y205 HydrophobicContact CD2-CD1 4.44Å; F169-Y205 AromaticContact CD2-CD2 3.64Å; F169-Y205 HydrophobicContact CD2-CD2 3.64Å; F169-Y205 AromaticContact CD2-CE2 3.78Å; F169-Y205 HydrophobicContact CD2-CE2 3.78Å; F169-Y205 HydrophobicContact CD2-CG 4.01Å; F169-Y205 HydrophobicContact CE2-CD2 4.49Å; F169-Y205 HydrophobicContact CE2-CE2 4.25Å; F169-Y205 HydrophobicContact CG-CD2 4.36Å; F169-Y205 HydrophobicContact CG-CG 4.5Å; F169-V210 HydrophobicContact CD1-CG2 4.37Å; F169-V210 HydrophobicContact CD2-CG1 4.12Å; F169-V210 HydrophobicContact CD2-CG2 3.79Å; F169-V210 HydrophobicContact CE1-CG1 4.25Å; F169-V210 HydrophobicContact CE1-CG2 4.43Å; F169-V210 HydrophobicContact CE2-CB 4.24Å; F169-V210 HydrophobicContact CE2-CG1 3.36Å; F169-V210 HydrophobicContact CE2-CG2 3.9Å; F169-V210 HydrophobicContact CG-CG2 4.05Å; F169-V210 HydrophobicContact CZ-CB 4.48Å; F169-V210 HydrophobicContact CZ-CG1 3.42Å; F169-V210 VanDerWaalsContact CZ-CG1 3.42Å; F169-V210 HydrophobicContact CZ-CG2 4.2Å; F169-F214 HydrophobicContact CZ-CE2 4.39Å
170	L	93.3	Very high	92.4	Very high	11 Å²	11	48.6 Å²	48.6	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-29.8	-178.3	-65.1	175.4	0	0	0	112.6	G148 I149 A152 G166 Q167 K172 L173	G148-L170 WeakPolarHBondContact CA-O 3.36Å; I149-L170 HydrophobicContact CB-CB 4.44Å; I149-L170 HydrophobicContact CB-CD1 4.43Å; I149-L170 HydrophobicContact CG1-CD1 4.31Å; A152-L170 HydrophobicContact CB-CD2 3.84Å; G166-L170 WeakPolarHBondContact O-CG 3.35Å; G166-L170 PolarHBondContact O-N 2.98Å; Q167-L170 PolarHBondContact O-N 3.4Å; L170-K172 PolarHBondContact O-N 3.41Å; L170-L173 HydrophobicContact CD2-CD2 4.4Å; L170-L173 PolarHBondContact O-N 3.08Å
171	E	91.7	Very high	92.4	Very high	139 Å²	139	51.8 Å²	51.8	65%	0.65	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-23.2	169.7	-70.5	176.7	-176.5	0	0	113	Q167 F169	Q167-E171 PolarHBondContact O-N 3.44Å; F169-E171 PolarHBondContact O-N 3.49Å
172	K	91.9	Very high	92.5	Very high	69 Å²	69	50.4 Å²	50.4	30%	0.3	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	9.2	178.2	-59.9	-61.4	-178.2	-173.1	0	113.4	E133 F134 N168 F169 L170 Y205	E133-K172 CarbonylContact C-O 3.36Å; E133-K172 WeakPolarHBondContact CA-O 3.48Å; E133-K172 WeakPolarHBondContact CB-O 3.32Å; E133-K172 HydrophobicContact CG-CD 4.17Å; F134-K172 PolarHBondContact N-O 3.35Å; N168-K172 WeakPolarHBondContact O-CG 3.48Å; F169-K172 CarbonylContact O-C 3.49Å; F169-K172 VanDerWaalsContact O-CA 3.29Å; F169-K172 WeakPolarHBondContact O-CA 3.48Å; F169-K172 WeakPolarHBondContact O-CB 3.47Å; F169-K172 PolarHBondContact O-N 3.13Å; L170-K172 PolarHBondContact O-N 3.41Å; K172-Y205 HydrophobicContact CB-CD1 4.49Å; K172-Y205 HydrophobicContact CB-CE1 3.93Å; K172-Y205 HydrophobicContact CG-CD1 4.26Å; K172-Y205 HydrophobicContact CG-CE1 3.87Å
173	L	94.7	Very high	92.6	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.6	175.2	176.3	69.6	0	0	0	108.9	F134 V136 G148 M151 L162 F169 L170 F214	F134-L173 HydrophobicContact CB-CD1 3.86Å; V136-L173 HydrophobicContact CG2-CD1 4Å; G148-L173 WeakPolarHBondContact CA-O 3.43Å; G148-L173 PolarHBondContact N-O 3.48Å; M151-L173 HydrophobicContact SD-CG 4.49Å; L162-L173 HydrophobicContact CD1-CD1 4.44Å; L162-L173 HydrophobicContact CD1-CD2 3.57Å; F169-L173 HydrophobicContact CE1-CB 4.29Å; F169-L173 HydrophobicContact CE1-CD2 4.19Å; F169-L173 HydrophobicContact CZ-CB 4.09Å; F169-L173 HydrophobicContact CZ-CD1 4.3Å; F169-L173 HydrophobicContact CZ-CD2 4.45Å; F169-L173 PolarHBondContact O-N 2.87Å; L170-L173 HydrophobicContact CD2-CD2 4.4Å; L170-L173 PolarHBondContact O-N 3.08Å; L173-F214 HydrophobicContact CD1-CZ 4.16Å
174	I	94	Very high	92.6	Very high	36 Å²	36	49 Å²	49	19%	0.185	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.3	179.5	-59.2	-168.9	0	0	0	109.7	E133 F134 T135 V136 T145 I176	E133-I174 HydrophobicContact CB-CG1 4.48Å; E133-I174 VanDerWaalsContact CD-CD1 3.49Å; E133-I174 HydrophobicContact CG-CD1 4.31Å; E133-I174 WeakPolarHBondContact OE2-CD1 3.4Å; F134-I174 PolarHBondContact O-N 3.49Å; T135-I174 CarbonylContact C-O 3.51Å; T135-I174 WeakPolarHBondContact CA-O 2.99Å; V136-I174 PolarHBondContact N-O 3Å; T145-I174 HydrophobicContact CG2-CG2 3.47Å; T145-I174 VanDerWaalsContact CG2-CG2 3.47Å; I174-I176 HydrophobicContact CG2-CG1 4.1Å
175	G	94.6	Very high	92.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.2	168.8	0	0	0	0	0	110.4	V136 T145 I146 M151	V136-G175 CarbonylContact O-C 3.5Å; V136-G175 WeakPolarHBondContact O-CA 3.36Å; T145-G175 CarbonylContact C-O 3.52Å; T145-G175 WeakPolarHBondContact CA-O 3.5Å; I146-G175 PolarHBondContact N-O 3.2Å; I146-G175 PolarHBondContact O-N 2.84Å; M151-G175 WeakPolarHBondContact SD-CA 3.45Å; M151-G175 PolarHBondContact SD-N 3.35Å
176	I	94.1	Very high	92.8	Very high	27 Å²	27	43.1 Å²	43.1	14%	0.138	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	115.4	173.3	-53.9	179.4	0	0	0	107.7	L123 T135 V136 L137 M138 L143 I174 V178	L123-I176 HydrophobicContact CD2-CD1 3.69Å; T135-I176 HydrophobicContact CG2-CD1 3.54Å; T135-I176 HydrophobicContact CG2-CG1 3.94Å; V136-I176 PolarHBondContact O-N 2.96Å; L137-I176 WeakPolarHBondContact CA-O 3.42Å; M138-I176 PolarHBondContact N-O 3.46Å; L143-I176 HydrophobicContact CD1-CG2 3.95Å; I174-I176 HydrophobicContact CG2-CG1 4.1Å; I176-V178 HydrophobicContact CG2-CG2 3.81Å
177	E	94.6	Very high	93.1	Very high	26 Å²	26	42.5 Å²	42.5	12%	0.121	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.5	171.3	-79.3	178.3	-173.7	0	0	109.3	M138 L143 K144 I146 R157	M138-E177 HydrophobicContact CG-CG 3.67Å; M138-E177 CarbonylContact O-C 3.59Å; M138-E177 VanDerWaalsContact O-CA 3.29Å; M138-E177 WeakPolarHBondContact O-CA 3.33Å; M138-E177 HydrophobicContact SD-CG 4.15Å; L143-E177 VanDerWaalsContact CA-O 3.25Å; L143-E177 WeakPolarHBondContact CA-O 3.45Å; L143-E177 WeakPolarHBondContact CD1-O 3.47Å; K144-E177 HydrophobicContact CB-CB 4.29Å; K144-E177 PolarHBondContact N-O 3.18Å; K144-E177 PolarHBondContact O-N 3.18Å; I146-E177 VanDerWaalsContact CD1-CD 3.45Å; I146-E177 HydrophobicContact CD1-CG 3.91Å; I146-E177 WeakPolarHBondContact CD1-OE1 3.21Å; R157-E177 IonicContact CZ-OE1 3.67Å; R157-E177 IonicContact NH1-OE1 2.75Å; R157-E177 IonicContact NH2-OE1 2.73Å; R157-E177 PolarHBondContact NH2-OE1 2.93Å
178	V	93.8	Very high	93.4	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.2	177.6	-175.1	0	0	0	0	109.5	L116 Y121 M138 H139 G140 L143 I176 H180 L183	L116-V178 HydrophobicContact CD2-CG1 4.29Å; Y121-V178 HydrophobicContact CD1-CG1 4.45Å; Y121-V178 HydrophobicContact CD2-CG1 4.4Å; Y121-V178 HydrophobicContact CG-CG1 4.11Å; M138-V178 PolarHBondContact O-N 2.77Å; H139-V178 WeakPolarHBondContact CA-O 3.27Å; G140-V178 PolarHBondContact N-O 3.26Å; G140-V178 CarbonylContact O-C 3.57Å; L143-V178 HydrophobicContact CD1-CG2 4.17Å; I176-V178 HydrophobicContact CG2-CG2 3.81Å; V178-H180 VanDerWaalsContact C-N 3.29Å; V178-H180 HydrophobicContact CG1-CB 4.27Å; V178-H180 PolarHBondContact O-N 3.14Å; V178-L183 HydrophobicContact CB-CD1 3.76Å; V178-L183 HydrophobicContact CG2-CD1 4.46Å
179	P	93.1	Very high	93.7	Very high	59 Å²	59	31.3 Å²	31.3	38%	0.383	15%	0.15	S	C	.	.			trans	-75.2	82	175.8	31	-34.3	0	0	0	110.1	G140	G140-P179 WeakPolarHBondContact O-CA 3.43Å; G140-P179 WeakPolarHBondContact O-CB 3.35Å
180	H	91.9	Very high	93.8	Very high	37 Å²	37	31.4 Å²	31.4	17%	0.171	15%	0.151	C	C	.	.			trans	-132.5	135.7	-178.1	-169.6	-85.2	0	0	0	111.5	L114 H139 V178 L182 L183 E184	L114-H180 WeakPolarHBondContact CD2-ND1 3.44Å; L114-H180 PolarHBondContact O-CD2 3.43Å; L114-H180 PolarHBondContact O-NE2 3.5Å; H139-H180 PolarHBondContact ND1-O 3.35Å; V178-H180 VanDerWaalsContact C-N 3.29Å; V178-H180 HydrophobicContact CG1-CB 4.27Å; V178-H180 PolarHBondContact O-N 3.14Å; H180-L182 VanDerWaalsContact CE1-CB 3.45Å; H180-L182 WeakPolarHBondContact CE1-CB 3.19Å; H180-L182 VanDerWaalsContact ND1-CB 3.32Å; H180-L182 WeakPolarHBondContact ND1-CB 3.42Å; H180-L182 PolarHBondContact ND1-N 2.99Å; H180-L182 PolarHBondContact O-N 3.36Å; H180-L183 HydrophobicContact CB-CB 4.36Å; H180-L183 HydrophobicContact CB-CD1 3.96Å; H180-L183 HydrophobicContact CB-CG 4.08Å; H180-L183 PolarHBondContact O-N 3.26Å; H180-L183 VanDerWaalsContact O-N 3.07Å; H180-E184 PolarHBondContact O-N 3.36Å
181	K	90.8	Very high	93.8	Very high	99 Å²	99	31 Å²	31	43%	0.43	15%	0.149	S	C	.	.	H	α-helix	trans	-59.3	-41.7	-176.6	-68.6	-168.2	178.4	-175.1	0	113.1	L44 L183 E184	L44-K181 WeakPolarHBondContact O-CD 3.25Å; L44-K181 PolarHBondContact O-NZ 2.89Å; K181-L183 VanDerWaalsContact C-N 3.29Å; K181-L183 PolarHBondContact O-N 3.42Å; K181-E184 VanDerWaalsContact O-CB 3.3Å; K181-E184 WeakPolarHBondContact O-CB 3.39Å; K181-E184 PolarHBondContact O-N 3.17Å
182	L	92.1	Very high	93.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.5	-40.6	176.4	-175.6	54.5	0	0	0	111.5	L42 L44 L114 H180 E184 R185 V186 F188 I322	L42-L182 HydrophobicContact CD1-CD1 4.03Å; L42-L182 HydrophobicContact CD1-CD2 3.66Å; L42-L182 HydrophobicContact CD1-CG 4.47Å; L44-L182 HydrophobicContact CD2-CB 3.89Å; L44-L182 HydrophobicContact CD2-CD1 4.12Å; L114-L182 HydrophobicContact CD2-CB 4.2Å; L114-L182 HydrophobicContact CD2-CD2 4.05Å; L114-L182 HydrophobicContact CD2-CG 4.46Å; H180-L182 VanDerWaalsContact CE1-CB 3.45Å; H180-L182 WeakPolarHBondContact CE1-CB 3.19Å; H180-L182 VanDerWaalsContact ND1-CB 3.32Å; H180-L182 WeakPolarHBondContact ND1-CB 3.42Å; H180-L182 PolarHBondContact ND1-N 2.99Å; H180-L182 PolarHBondContact O-N 3.36Å; L182-E184 PolarHBondContact O-N 3.01Å; L182-R185 PolarHBondContact O-N 3.27Å; L182-V186 HydrophobicContact CD1-CG1 3.97Å; L182-V186 HydrophobicContact CG-CG1 3.83Å; L182-V186 WeakPolarHBondContact O-CG1 3.33Å; L182-V186 PolarHBondContact O-N 3.45Å; L182-V186 VanDerWaalsContact O-N 3.09Å; L182-F188 HydrophobicContact CD2-CE2 3.83Å; L182-F188 HydrophobicContact CD2-CZ 3.91Å; L182-F188 HydrophobicContact CG-CE2 4.21Å; L182-F188 HydrophobicContact CG-CZ 4.44Å; L182-I322 HydrophobicContact CD1-CD1 3.82Å
183	L	94	Very high	93.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-70.5	-16.3	-178.3	-63.2	177.8	0	0	0	112.6	K93 L114 L137 H139 V178 H180 K181 R185 V186 F188	K93-L183 PolarHBondContact NZ-O 3.25Å; L114-L183 HydrophobicContact CD1-CD1 4.39Å; L114-L183 HydrophobicContact CD1-CD2 4.29Å; L114-L183 HydrophobicContact CD2-CD1 4.44Å; L114-L183 HydrophobicContact CD2-CD2 4.03Å; L114-L183 HydrophobicContact CD2-CG 3.93Å; L137-L183 HydrophobicContact CB-CD2 4.45Å; H139-L183 VanDerWaalsContact CB-C 3.43Å; H139-L183 HydrophobicContact CB-CB 3.73Å; H139-L183 WeakPolarHBondContact CB-O 3.34Å; V178-L183 HydrophobicContact CB-CD1 3.76Å; V178-L183 HydrophobicContact CG2-CD1 4.46Å; H180-L183 HydrophobicContact CB-CB 4.36Å; H180-L183 HydrophobicContact CB-CD1 3.96Å; H180-L183 HydrophobicContact CB-CG 4.08Å; H180-L183 PolarHBondContact O-N 3.26Å; H180-L183 VanDerWaalsContact O-N 3.07Å; K181-L183 VanDerWaalsContact C-N 3.29Å; K181-L183 PolarHBondContact O-N 3.42Å; L183-R185 PolarHBondContact O-N 3.02Å; L183-V186 CarbonylContact C-O 3.57Å; L183-V186 VanDerWaalsContact CA-O 3.3Å; L183-V186 WeakPolarHBondContact CA-O 3.42Å; L183-V186 VanDerWaalsContact O-O 3.13Å; L183-F188 HydrophobicContact CD2-CD2 3.65Å; L183-F188 HydrophobicContact CD2-CE2 4.13Å
184	E	91.8	Very high	92.8	Very high	99 Å²	99	21.8 Å²	21.8	46%	0.463	11%	0.108	S	C	.	.	H	α-helix	trans	-63.2	-24.8	169.6	-65	176.2	-166.7	0	0	111.3	K93 H139 H180 K181 L182	K93-E184 WeakPolarHBondContact CD-O 3.34Å; K93-E184 WeakPolarHBondContact CE-O 3.37Å; K93-E184 PolarHBondContact NZ-O 2.89Å; K93-E184 VanDerWaalsContact NZ-O 3.16Å; H139-E184 HydrophobicContact CB-CG 4.48Å; H139-E184 WeakPolarHBondContact CE1-CG 3.49Å; H139-E184 IonicContact CE1-OE1 3.28Å; H139-E184 PolarHBondContact CE1-OE1 3.1Å; H139-E184 WeakPolarHBondContact ND1-CG 3.13Å; H139-E184 IonicContact ND1-OE1 3.55Å; H180-E184 PolarHBondContact O-N 3.36Å; K181-E184 VanDerWaalsContact O-CB 3.3Å; K181-E184 WeakPolarHBondContact O-CB 3.39Å; K181-E184 PolarHBondContact O-N 3.17Å; L182-E184 PolarHBondContact O-N 3.01Å
185	R	91.9	Very high	92	Very high	33 Å²	33	21.9 Å²	21.9	13%	0.125	11%	0.108	C	C	.	.	H	α-helix	trans	-110	-26	-173.5	-57.7	175.4	57.3	-165.5	-8.9	113.7	L42 P94 L182 L183 N319 I322 E323	L42-R185 PolarHBondContact O-NH1 2.99Å; P94-R185 VanDerWaalsContact CD-O 3.24Å; P94-R185 WeakPolarHBondContact CD-O 3.46Å; P94-R185 WeakPolarHBondContact CG-O 3.31Å; L182-R185 PolarHBondContact O-N 3.27Å; L183-R185 PolarHBondContact O-N 3.02Å; R185-N319 PolarHBondContact NH2-OD1 3.13Å; R185-I322 HydrophobicContact CB-CG2 3.56Å; R185-I322 HydrophobicContact CG-CG2 4.45Å; R185-E323 IonicContact CZ-OE1 2.83Å; R185-E323 IonicContact NH1-OE1 3.8Å; R185-E323 IonicContact NH2-OE1 2.77Å; R185-E323 PolarHBondContact NH2-OE1 3.4Å
186	V	94.9	Very high	90.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.			trans	-138.9	156.2	-176.4	73.8	0	0	0	0	112.2	P94 V96 L182 L183 F188 I322	P94-V186 HydrophobicContact CG-CG2 4.33Å; P94-V186 WeakPolarHBondContact O-CG2 3.31Å; V96-V186 HydrophobicContact CB-CG2 4.36Å; V96-V186 HydrophobicContact CG2-CG2 3.45Å; V96-V186 VanDerWaalsContact CG2-CG2 3.45Å; L182-V186 HydrophobicContact CD1-CG1 3.97Å; L182-V186 HydrophobicContact CG-CG1 3.83Å; L182-V186 WeakPolarHBondContact O-CG1 3.33Å; L182-V186 PolarHBondContact O-N 3.45Å; L182-V186 VanDerWaalsContact O-N 3.09Å; L183-V186 CarbonylContact C-O 3.57Å; L183-V186 VanDerWaalsContact CA-O 3.3Å; L183-V186 WeakPolarHBondContact CA-O 3.42Å; L183-V186 VanDerWaalsContact O-O 3.13Å; V186-F188 HydrophobicContact CG1-CD2 4.33Å; V186-F188 HydrophobicContact CG1-CE1 4.34Å; V186-F188 HydrophobicContact CG1-CE2 3.73Å; V186-F188 HydrophobicContact CG1-CZ 3.75Å; V186-I322 HydrophobicContact CB-CD1 4.04Å; V186-I322 HydrophobicContact CB-CG1 4.14Å; V186-I322 HydrophobicContact CG1-CD1 4.28Å; V186-I322 HydrophobicContact CG2-CD1 4.49Å; V186-I322 HydrophobicContact CG2-CG1 4.35Å
187	T	96.3	Very high	89.6	Confident	18 Å²	18	29.8 Å²	29.8	11%	0.11	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131	169.7	-60.7	0	0	0	0	108.9	P94 M95 V96 V136 L137 M138	P94-T187 PolarHBondContact O-N 3.22Å; M95-T187 WeakPolarHBondContact CA-O 3.29Å; V96-T187 PolarHBondContact N-O 2.98Å; V136-T187 HydrophobicContact CG1-CG2 3.63Å; L137-T187 WeakPolarHBondContact O-CG2 3.48Å; M138-T187 HydrophobicContact CB-CG2 4.45Å
188	F	97.6	Very high	87.8	Confident	1 Å²	1	36.7 Å²	36.7	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140.4	175	-67.8	-64.2	0	0	0	110.7	V96 F98 L114 V136 L137 L182 L183 V186 L318	V96-F188 HydrophobicContact CB-CD1 3.58Å; V96-F188 HydrophobicContact CB-CE1 3.75Å; V96-F188 HydrophobicContact CG1-CD1 3.82Å; V96-F188 HydrophobicContact CG1-CE1 3.82Å; V96-F188 HydrophobicContact CG2-CD1 4.27Å; V96-F188 HydrophobicContact CG2-CE1 4.02Å; V96-F188 WeakPolarHBondContact O-CA 3.43Å; F98-F188 HydrophobicContact CE2-CB 4.37Å; F98-F188 AromaticContact CE2-CD1 3.56Å; F98-F188 HydrophobicContact CE2-CD1 3.56Å; F98-F188 HydrophobicContact CE2-CE1 4.16Å; F98-F188 HydrophobicContact CE2-CG 4.25Å; F98-F188 HydrophobicContact CZ-CD1 4.25Å; F98-F188 HydrophobicContact CZ-CE1 4.45Å; L114-F188 HydrophobicContact CD1-CD2 4.15Å; L114-F188 HydrophobicContact CD2-CD2 4.28Å; L114-F188 HydrophobicContact CD2-CE2 3.9Å; L114-F188 HydrophobicContact CG-CD2 4.36Å; L114-F188 HydrophobicContact CG-CE2 4.22Å; V136-F188 CarbonylContact C-O 3.58Å; L137-F188 HydrophobicContact CB-CB 4.27Å; L137-F188 PolarHBondContact N-O 3.25Å; L137-F188 PolarHBondContact O-N 3.28Å; L182-F188 HydrophobicContact CD2-CE2 3.83Å; L182-F188 HydrophobicContact CD2-CZ 3.91Å; L182-F188 HydrophobicContact CG-CE2 4.21Å; L182-F188 HydrophobicContact CG-CZ 4.44Å; L183-F188 HydrophobicContact CD2-CD2 3.65Å; L183-F188 HydrophobicContact CD2-CE2 4.13Å; V186-F188 HydrophobicContact CG1-CD2 4.33Å; V186-F188 HydrophobicContact CG1-CE1 4.34Å; V186-F188 HydrophobicContact CG1-CE2 3.73Å; V186-F188 HydrophobicContact CG1-CZ 3.75Å; F188-L318 HydrophobicContact CE1-CD2 4.48Å; F188-L318 HydrophobicContact CZ-CD2 4.24Å
189	V	97.1	Very high	86	Confident	0 Å²	0	46 Å²	46	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	113.9	174	-179.1	0	0	0	0	108.8	M95 V96 L97 F98 T135 V136 T191 F214	M95-V189 HydrophobicContact CG-CG2 3.77Å; M95-V189 HydrophobicContact SD-CG2 3.88Å; V96-V189 PolarHBondContact O-N 3.49Å; L97-V189 HydrophobicContact CD1-CB 3.74Å; L97-V189 HydrophobicContact CD1-CG1 3.59Å; F98-V189 PolarHBondContact N-O 2.93Å; T135-V189 CarbonylContact O-C 3.48Å; T135-V189 WeakPolarHBondContact O-CA 3.27Å; V136-V189 HydrophobicContact CG1-CG2 4.42Å; V136-V189 HydrophobicContact CG2-CG2 4.29Å; V189-T191 HydrophobicContact CG1-CG2 4.38Å; V189-F214 HydrophobicContact CB-CD1 4.44Å; V189-F214 HydrophobicContact CG1-CD1 3.79Å; V189-F214 HydrophobicContact CG1-CE1 3.72Å; V189-F214 HydrophobicContact CG1-CG 4.37Å; V189-F214 HydrophobicContact CG1-CZ 4.26Å; V189-F214 HydrophobicContact CG2-CD1 4.12Å; V189-F214 HydrophobicContact CG2-CE1 4.03Å
190	D	95.1	Very high	84.2	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.011	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.4	168.8	-163.9	11.4	0	0	0	109.3	K106 S107 I110 T135	K106-D190 WeakPolarHBondContact CB-OD1 3.32Å; S107-D190 VanDerWaalsContact CB-OD2 3.25Å; S107-D190 WeakPolarHBondContact CB-OD2 3.14Å; S107-D190 PolarHBondContact OG-OD2 3.04Å; I110-D190 HydrophobicContact CD1-CB 3.57Å; T135-D190 PolarHBondContact N-O 3.44Å; T135-D190 PolarHBondContact O-N 3.23Å
191	T	93.4	Very high	82.6	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.012	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-98.9	151.5	177.6	67	0	0	0	0	111.5	L97 F98 L99 K106 F134 V189 G193	L97-T191 HydrophobicContact CD1-CG2 3.47Å; L97-T191 VanDerWaalsContact CD1-CG2 3.47Å; L97-T191 HydrophobicContact CG-CG2 4.37Å; F98-T191 WeakPolarHBondContact O-CB 3.44Å; F98-T191 WeakPolarHBondContact O-CG2 3.47Å; F98-T191 PolarHBondContact O-N 3.38Å; F98-T191 PolarHBondContact O-OG1 3.49Å; L99-T191 HydrophobicContact CD2-CG2 3.7Å; K106-T191 WeakPolarHBondContact CE-O 3.47Å; F134-T191 HydrophobicContact CD1-CG2 3.94Å; F134-T191 HydrophobicContact CE1-CG2 3.74Å; V189-T191 HydrophobicContact CG1-CG2 4.38Å; T191-G193 PolarHBondContact O-N 3.24Å
192	P	89.2	Confident	81.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-52.4	138.7	169.5	-26.3	34.1	0	0	0	111.9	T131 F134 I194 F207	T131-P192 WeakPolarHBondContact O-CA 3.46Å; T131-P192 WeakPolarHBondContact O-CB 3.46Å; F134-P192 HydrophobicContact CD2-CG 3.85Å; F134-P192 HydrophobicContact CE2-CG 3.89Å; F134-P192 HydrophobicContact CG-CG 4.39Å; F134-P192 HydrophobicContact CZ-CG 4.44Å; P192-I194 PolarHBondContact O-N 2.99Å; P192-F207 HydrophobicContact CB-CE2 4.23Å; P192-F207 HydrophobicContact CG-CE2 4.32Å
193	G	86.2	Confident	80.5	Confident	2 Å²	2	56.9 Å²	56.9	2%	0.021	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-55.8	133.9	173.1	0	0	0	0	0	112.2	T191 R203	T191-G193 PolarHBondContact O-N 3.24Å; G193-R203 PolarHBondContact O-NH2 2.84Å
194	I	83.1	Confident	79.8	Confident	15 Å²	15	59.3 Å²	59.3	8%	0.077	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-71.2	129.3	172.9	-59.1	173.7	0	0	0	108.2	G100 P101 W102 P192 F207 E235 L239	G100-I194 PolarHBondContact O-N 3.27Å; P101-I194 WeakPolarHBondContact CA-O 3.33Å; W102-I194 PolarHBondContact N-O 2.93Å; P192-I194 PolarHBondContact O-N 2.99Å; I194-F207 HydrophobicContact CG1-CZ 4.47Å; I194-E235 HydrophobicContact CG2-CB 3.35Å; I194-E235 HydrophobicContact CG2-CG 4.21Å; I194-L239 HydrophobicContact CD1-CB 4.15Å; I194-L239 HydrophobicContact CD1-CD1 4.04Å; I194-L239 HydrophobicContact CD1-CD2 3.71Å; I194-L239 HydrophobicContact CD1-CG 4.17Å
195	I	77.4	Confident	79.7	Confident	38 Å²	38	55.7 Å²	55.7	20%	0.195	27%	0.265	C	S	.	.			trans	-122	127.2	-179.4	-56.7	169.5	0	0	0	106.8	W102 N197 Q201	W102-I195 HydrophobicContact CB-CG1 4.18Å; I195-N197 VanDerWaalsContact C-N 3.3Å; I195-N197 HydrophobicContact CG2-CB 4.3Å; I195-N197 PolarHBondContact O-N 3.49Å; I195-Q201 PolarHBondContact O-NE2 3.33Å
196	E	70.2	Confident	79.5	Confident	100 Å²	100	56.7 Å²	56.7	47%	0.467	28%	0.276	S	S	.	.			trans	-75.9	-17.8	-176	-60.1	-173.1	165	0	0	113.6	R198 G233	E196-R198 PolarHBondContact O-N 3.43Å; E196-G233 WeakPolarHBondContact OE1-CA 3.47Å; E196-G233 PolarHBondContact OE1-N 3.17Å
197	N	66.6	Low	79.2	Confident	93 Å²	93	57.9 Å²	57.9	50%	0.497	28%	0.281	S	S	.	.			trans	-87	107.8	-170.9	-158.7	-8.9	0	0	0	112.9	I195 K199 Q200	I195-N197 VanDerWaalsContact C-N 3.3Å; I195-N197 HydrophobicContact CG2-CB 4.3Å; I195-N197 PolarHBondContact O-N 3.49Å; N197-K199 VanDerWaalsContact C-N 3.3Å; N197-K199 PolarHBondContact O-N 3.25Å; N197-K199 VanDerWaalsContact O-N 3.13Å; N197-Q200 PolarHBondContact O-N 2.87Å
198	R	58.1	Low	78.7	Confident	171 Å²	171	59.5 Å²	59.5	65%	0.645	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-55.9	-30.5	-172.3	-64.8	-173.4	177.9	-178.8	0.3	116.4	E196 Q200 Q201	E196-R198 PolarHBondContact O-N 3.43Å; R198-Q200 PolarHBondContact O-N 2.98Å; R198-Q201 WeakPolarHBondContact O-CB 3.26Å; R198-Q201 PolarHBondContact O-N 3.23Å
199	K	56.1	Low	78.4	Confident	198 Å²	198	64 Å²	64	86%	0.861	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-71.7	-18.9	178.7	-69.1	-174.5	178.8	-178.7	0	113.5	N197	N197-K199 VanDerWaalsContact C-N 3.3Å; N197-K199 PolarHBondContact O-N 3.25Å; N197-K199 VanDerWaalsContact O-N 3.13Å
200	Q	55.1	Low	78.1	Confident	132 Å²	132	64 Å²	64	62%	0.617	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-100.1	4.4	176.8	-68.5	172.7	-25.4	0	0	111.9	N197 R198	N197-Q200 PolarHBondContact O-N 2.87Å; R198-Q200 PolarHBondContact O-N 2.98Å
201	Q	57.7	Low	78	Confident	49 Å²	49	64 Å²	64	23%	0.229	31%	0.313	C	S	.	.			trans	-97.1	-5.9	-173.7	-75.2	177.7	-14.6	0	0	114.7	I195 R198 R203 E235	I195-Q201 PolarHBondContact O-NE2 3.33Å; R198-Q201 WeakPolarHBondContact O-CB 3.26Å; R198-Q201 PolarHBondContact O-N 3.23Å; Q201-R203 WeakPolarHBondContact O-CG 3.49Å; Q201-R203 PolarHBondContact O-N 2.85Å; Q201-E235 VanDerWaalsContact NE2-CG 3.27Å; Q201-E235 PolarHBondContact NE2-OE1 2.99Å
202	E	64.9	Low	77.9	Confident	192 Å²	192	66.3 Å²	66.3	90%	0.897	32%	0.324	S	S	*	.			trans	-69	84.5	175.4	-74.9	-173.3	178.8	0	0	110	G204	E202-G204 VanDerWaalsContact C-N 3.31Å
203	R	72.9	Confident	78	Confident	50 Å²	50	66.7 Å²	66.7	19%	0.189	33%	0.325	C	S	.	.			trans	-82.9	-10.1	-179	-65.3	179.7	-172.4	-92.4	3.7	112.8	G193 Q201 Y205	G193-R203 PolarHBondContact O-NH2 2.84Å; Q201-R203 WeakPolarHBondContact O-CG 3.49Å; Q201-R203 PolarHBondContact O-N 2.85Å; R203-Y205 VanDerWaalsContact C-N 3.29Å; R203-Y205 HydrophobicContact CB-CD1 3.96Å; R203-Y205 HydrophobicContact CB-CE1 3.57Å; R203-Y205 WeakPolarHBondContact O-CD1 3.48Å; R203-Y205 WeakPolarHBondContact O-CE1 3.43Å; R203-Y205 PolarHBondContact O-N 2.93Å
204	G	81	Confident	78.4	Confident	50 Å²	50	66.6 Å²	66.6	52%	0.515	32%	0.324	S	S	.	.	S	Bend	trans	78	7.8	-179.1	0	0	0	0	0	115	N168 E202	N168-G204 VanDerWaalsContact CB-O 3.25Å; N168-G204 WeakPolarHBondContact CB-O 3.28Å; N168-G204 PolarHBondContact ND2-O 3.1Å; E202-G204 VanDerWaalsContact C-N 3.31Å
205	Y	88.3	Confident	78.9	Confident	24 Å²	24	65.9 Å²	65.9	9%	0.094	32%	0.32	C	S	.	.	S	Bend	trans	-150.4	160.4	177.8	65.3	-93.4	0	0	0	111.4	F134 F169 K172 R203 F207 V210	F134-Y205 AromaticContact CE2-CE2 3.89Å; F134-Y205 HydrophobicContact CE2-CE2 3.89Å; F134-Y205 WeakPolarHBondContact CE2-OH 3.36Å; F169-Y205 HydrophobicContact CB-CD2 4.35Å; F169-Y205 HydrophobicContact CB-CG 4.04Å; F169-Y205 HydrophobicContact CD2-CD1 4.44Å; F169-Y205 AromaticContact CD2-CD2 3.64Å; F169-Y205 HydrophobicContact CD2-CD2 3.64Å; F169-Y205 AromaticContact CD2-CE2 3.78Å; F169-Y205 HydrophobicContact CD2-CE2 3.78Å; F169-Y205 HydrophobicContact CD2-CG 4.01Å; F169-Y205 HydrophobicContact CE2-CD2 4.49Å; F169-Y205 HydrophobicContact CE2-CE2 4.25Å; F169-Y205 HydrophobicContact CG-CD2 4.36Å; F169-Y205 HydrophobicContact CG-CG 4.5Å; K172-Y205 HydrophobicContact CB-CD1 4.49Å; K172-Y205 HydrophobicContact CB-CE1 3.93Å; K172-Y205 HydrophobicContact CG-CD1 4.26Å; K172-Y205 HydrophobicContact CG-CE1 3.87Å; R203-Y205 VanDerWaalsContact C-N 3.29Å; R203-Y205 HydrophobicContact CB-CD1 3.96Å; R203-Y205 HydrophobicContact CB-CE1 3.57Å; R203-Y205 WeakPolarHBondContact O-CD1 3.48Å; R203-Y205 WeakPolarHBondContact O-CE1 3.43Å; R203-Y205 PolarHBondContact O-N 2.93Å; Y205-F207 VanDerWaalsContact C-N 3.35Å; Y205-F207 HydrophobicContact CE2-CB 4.09Å; Y205-F207 HydrophobicContact CE2-CD2 4.02Å; Y205-F207 PolarHBondContact O-N 3.16Å; Y205-V210 HydrophobicContact CD2-CG2 4.05Å; Y205-V210 HydrophobicContact CE2-CG2 4.41Å
206	P	88.6	Confident	79.5	Confident	54 Å²	54	66.1 Å²	66.1	35%	0.351	32%	0.322	S	S	.	.			trans	-74.2	82.9	-179.1	31.1	-36.6	0	0	0	111.8	F165 N208 D209 V210	F165-P206 HydrophobicContact CD1-CG 3.89Å; P206-N208 VanDerWaalsContact C-N 3.31Å; P206-N208 PolarHBondContact O-N 2.84Å; P206-D209 HydrophobicContact CB-CB 4.19Å; P206-D209 WeakPolarHBondContact CB-OD2 3.29Å; P206-D209 PolarHBondContact O-N 2.91Å; P206-V210 WeakPolarHBondContact O-CG2 3.37Å; P206-V210 PolarHBondContact O-N 3.37Å; P206-V210 VanDerWaalsContact O-N 3.13Å
207	F	87.4	Confident	80.5	Confident	25 Å²	25	62.7 Å²	62.7	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-52.9	-45	-176.1	178.3	-100.4	0	0	0	113.5	F134 P192 I194 Y205 D209 V210 C211	F134-F207 HydrophobicContact CE2-CD2 4.03Å; F134-F207 HydrophobicContact CE2-CE2 4.01Å; F134-F207 AromaticContact CZ-CD2 3.97Å; F134-F207 HydrophobicContact CZ-CD2 3.97Å; F134-F207 AromaticContact CZ-CE2 3.7Å; F134-F207 HydrophobicContact CZ-CE2 3.7Å; P192-F207 HydrophobicContact CB-CE2 4.23Å; P192-F207 HydrophobicContact CG-CE2 4.32Å; I194-F207 HydrophobicContact CG1-CZ 4.47Å; Y205-F207 VanDerWaalsContact C-N 3.35Å; Y205-F207 HydrophobicContact CE2-CB 4.09Å; Y205-F207 HydrophobicContact CE2-CD2 4.02Å; Y205-F207 PolarHBondContact O-N 3.16Å; F207-D209 PolarHBondContact O-N 2.92Å; F207-V210 PolarHBondContact O-N 3.49Å; F207-C211 VanDerWaalsContact CE1-SG 3.52Å; F207-C211 WeakPolarHBondContact CZ-SG 3.37Å; F207-C211 WeakPolarHBondContact O-CB 3.34Å; F207-C211 PolarHBondContact O-N 3.46Å; F207-C211 PolarHBondContact O-SG 2.83Å; F207-C211 VanDerWaalsContact O-SG 3.4Å
208	N	87.6	Confident	81.9	Confident	51 Å²	51	58.3 Å²	58.3	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-43	-178.8	-69.2	-31	0	0	0	111.8	P206 V210 C211 Q212 M238 Q242	P206-N208 VanDerWaalsContact C-N 3.31Å; P206-N208 PolarHBondContact O-N 2.84Å; N208-V210 VanDerWaalsContact C-N 3.34Å; N208-V210 PolarHBondContact O-N 2.91Å; N208-C211 PolarHBondContact O-N 2.79Å; N208-Q212 WeakPolarHBondContact O-CB 3.25Å; N208-Q212 PolarHBondContact O-N 2.9Å; N208-M238 VanDerWaalsContact ND2-CE 3.26Å; N208-M238 WeakPolarHBondContact ND2-CE 3.38Å; N208-Q242 PolarHBondContact O-NE2 3.35Å
209	D	89.3	Confident	83.6	Confident	96 Å²	96	51.7 Å²	51.7	51%	0.513	26%	0.259	S	S	.	.	H	α-helix	trans	-70.1	-34.6	-178.9	-58	-29.4	0	0	0	111.7	F165 P206 F207 Q212 W213	F165-D209 HydrophobicContact CE1-CB 3.64Å; F165-D209 HydrophobicContact CZ-CB 4.31Å; F165-D209 WeakPolarHBondContact CZ-O 3.34Å; P206-D209 HydrophobicContact CB-CB 4.19Å; P206-D209 WeakPolarHBondContact CB-OD2 3.29Å; P206-D209 PolarHBondContact O-N 2.91Å; F207-D209 PolarHBondContact O-N 2.92Å; D209-Q212 PolarHBondContact O-N 3.48Å; D209-W213 PolarHBondContact O-N 2.98Å
210	V	91.9	Very high	85.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-47.8	172	173.8	0	0	0	0	110.7	F134 F165 F169 Y205 P206 F207 N208 Q212 W213 F214	F134-V210 HydrophobicContact CD1-CG1 4.48Å; F134-V210 HydrophobicContact CD2-CG1 4.33Å; F134-V210 HydrophobicContact CE1-CG1 3.98Å; F134-V210 HydrophobicContact CE2-CG1 3.79Å; F134-V210 HydrophobicContact CZ-CB 4.38Å; F134-V210 HydrophobicContact CZ-CG1 3.6Å; F165-V210 HydrophobicContact CB-CG2 4.18Å; F165-V210 HydrophobicContact CD1-CG2 3.86Å; F165-V210 HydrophobicContact CD2-CG2 3.79Å; F165-V210 HydrophobicContact CE1-CG2 4.13Å; F165-V210 HydrophobicContact CE2-CG2 4.04Å; F165-V210 HydrophobicContact CG-CG2 3.68Å; F165-V210 HydrophobicContact CZ-CG2 4.19Å; F169-V210 HydrophobicContact CD1-CG2 4.37Å; F169-V210 HydrophobicContact CD2-CG1 4.12Å; F169-V210 HydrophobicContact CD2-CG2 3.79Å; F169-V210 HydrophobicContact CE1-CG1 4.25Å; F169-V210 HydrophobicContact CE1-CG2 4.43Å; F169-V210 HydrophobicContact CE2-CB 4.24Å; F169-V210 HydrophobicContact CE2-CG1 3.36Å; F169-V210 HydrophobicContact CE2-CG2 3.9Å; F169-V210 HydrophobicContact CG-CG2 4.05Å; F169-V210 HydrophobicContact CZ-CB 4.48Å; F169-V210 HydrophobicContact CZ-CG1 3.42Å; F169-V210 VanDerWaalsContact CZ-CG1 3.42Å; F169-V210 HydrophobicContact CZ-CG2 4.2Å; Y205-V210 HydrophobicContact CD2-CG2 4.05Å; Y205-V210 HydrophobicContact CE2-CG2 4.41Å; P206-V210 WeakPolarHBondContact O-CG2 3.37Å; P206-V210 PolarHBondContact O-N 3.37Å; P206-V210 VanDerWaalsContact O-N 3.13Å; F207-V210 PolarHBondContact O-N 3.49Å; N208-V210 VanDerWaalsContact C-N 3.34Å; N208-V210 PolarHBondContact O-N 2.91Å; V210-Q212 VanDerWaalsContact C-N 3.3Å; V210-Q212 PolarHBondContact O-N 3.46Å; V210-W213 WeakPolarHBondContact O-CB 3.27Å; V210-W213 PolarHBondContact O-N 3.03Å; V210-W213 VanDerWaalsContact O-N 3.08Å; V210-F214 HydrophobicContact CG1-CD2 3.99Å; V210-F214 HydrophobicContact CG1-CE2 3.85Å; V210-F214 WeakPolarHBondContact O-CD2 3.39Å; V210-F214 PolarHBondContact O-N 3.44Å; V210-F214 VanDerWaalsContact O-N 3.14Å
211	C	91.8	Very high	87.5	Confident	1 Å²	1	36 Å²	36	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-57.9	-44.9	175.9	-77.4	0	0	0	0	111.2	F207 N208 W213 F214 I215	F207-C211 VanDerWaalsContact CE1-SG 3.52Å; F207-C211 WeakPolarHBondContact CZ-SG 3.37Å; F207-C211 WeakPolarHBondContact O-CB 3.34Å; F207-C211 PolarHBondContact O-N 3.46Å; F207-C211 PolarHBondContact O-SG 2.83Å; F207-C211 VanDerWaalsContact O-SG 3.4Å; N208-C211 PolarHBondContact O-N 2.79Å; C211-W213 VanDerWaalsContact C-N 3.27Å; C211-W213 PolarHBondContact O-N 2.94Å; C211-F214 PolarHBondContact O-N 2.88Å; C211-I215 WeakPolarHBondContact O-CB 3.27Å; C211-I215 VanDerWaalsContact O-CG1 3.25Å; C211-I215 WeakPolarHBondContact O-CG1 3.45Å; C211-I215 PolarHBondContact O-N 3.14Å
212	Q	92	Very high	89.4	Confident	52 Å²	52	33.8 Å²	33.8	24%	0.243	18%	0.179	C	C	.	.	H	α-helix	trans	-58.1	-40.6	175	-172	65.3	51.1	0	0	111.4	N208 D209 V210 F214 I215 D216 Q242	N208-Q212 WeakPolarHBondContact O-CB 3.25Å; N208-Q212 PolarHBondContact O-N 2.9Å; D209-Q212 PolarHBondContact O-N 3.48Å; V210-Q212 VanDerWaalsContact C-N 3.3Å; V210-Q212 PolarHBondContact O-N 3.46Å; Q212-F214 PolarHBondContact O-N 2.87Å; Q212-I215 PolarHBondContact O-N 3.44Å; Q212-D216 PolarHBondContact NE2-OD1 3.07Å; Q212-D216 VanDerWaalsContact O-CB 3.24Å; Q212-D216 WeakPolarHBondContact O-CB 3.44Å; Q212-D216 PolarHBondContact O-N 3.42Å; Q212-Q242 PolarHBondContact NE2-O 3.32Å; Q212-Q242 PolarHBondContact OE1-O 3.39Å
213	W	92.5	Very high	90.8	Very high	7 Å²	7	24.6 Å²	24.6	3%	0.027	14%	0.136	C	C	.	.	H	α-helix	trans	-61.2	-42.1	177.9	-176.4	98.9	0	0	0	112.9	S158 F159 P161 L162 F165 D209 V210 C211 D216 R217	S158-W213 WeakPolarHBondContact O-CH2 3.25Å; S158-W213 WeakPolarHBondContact O-CZ2 3.44Å; F159-W213 AromaticContact CD1-CH2 3.77Å; F159-W213 HydrophobicContact CD1-CH2 3.77Å; F159-W213 HydrophobicContact CD1-CZ3 4.14Å; F159-W213 HydrophobicContact CE1-CH2 4.3Å; F159-W213 HydrophobicContact CE1-CZ3 4.41Å; P161-W213 HydrophobicContact CB-CZ2 4.4Å; P161-W213 HydrophobicContact CG-CZ2 4.49Å; L162-W213 HydrophobicContact CD1-CE3 4.38Å; L162-W213 HydrophobicContact CD1-CH2 4.05Å; L162-W213 HydrophobicContact CD1-CZ3 3.95Å; L162-W213 HydrophobicContact CD2-CD2 3.39Å; L162-W213 HydrophobicContact CD2-CE3 3.46Å; L162-W213 VanDerWaalsContact CD2-CE3 3.46Å; L162-W213 HydrophobicContact CD2-CG 3.89Å; L162-W213 HydrophobicContact CD2-CH2 4.15Å; L162-W213 HydrophobicContact CD2-CZ2 4.07Å; L162-W213 HydrophobicContact CD2-CZ3 3.85Å; L162-W213 HydrophobicContact CG-CD2 4.16Å; L162-W213 HydrophobicContact CG-CE3 4.13Å; L162-W213 HydrophobicContact CG-CH2 3.9Å; L162-W213 HydrophobicContact CG-CZ2 3.89Å; L162-W213 HydrophobicContact CG-CZ3 4.01Å; F165-W213 HydrophobicContact CE2-CB 3.95Å; F165-W213 HydrophobicContact CE2-CG 4.05Å; F165-W213 HydrophobicContact CZ-CB 3.98Å; F165-W213 HydrophobicContact CZ-CG 4.44Å; D209-W213 PolarHBondContact O-N 2.98Å; V210-W213 WeakPolarHBondContact O-CB 3.27Å; V210-W213 PolarHBondContact O-N 3.03Å; V210-W213 VanDerWaalsContact O-N 3.08Å; C211-W213 VanDerWaalsContact C-N 3.27Å; C211-W213 PolarHBondContact O-N 2.94Å; W213-D216 PolarHBondContact O-N 3.48Å; W213-R217 VanDerWaalsContact CD1-NH1 3.32Å; W213-R217 VanDerWaalsContact CZ2-CD 3.43Å
214	F	94.5	Very high	91.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-71.1	-45.4	176.4	-80.1	-74.4	0	0	0	111.6	M95 L97 F134 V136 F159 L162 F169 L173 V189 V210 C211 Q212 D216 R217 A218	M95-F214 HydrophobicContact CE-CD1 4.38Å; M95-F214 HydrophobicContact SD-CD1 3.87Å; L97-F214 HydrophobicContact CD1-CB 3.84Å; L97-F214 HydrophobicContact CD1-CD1 4.5Å; L97-F214 HydrophobicContact CD1-CG 4.31Å; L97-F214 HydrophobicContact CD2-CB 3.94Å; F134-F214 HydrophobicContact CB-CE2 4.47Å; F134-F214 AromaticContact CD1-CD2 3.85Å; F134-F214 HydrophobicContact CD1-CD2 3.85Å; F134-F214 AromaticContact CD1-CE2 3.53Å; F134-F214 HydrophobicContact CD1-CE2 3.53Å; F134-F214 HydrophobicContact CD1-CZ 4.25Å; F134-F214 AromaticContact CE1-CD2 3.85Å; F134-F214 HydrophobicContact CE1-CD2 3.85Å; F134-F214 AromaticContact CE1-CE2 3.95Å; F134-F214 HydrophobicContact CE1-CE2 3.95Å; F134-F214 HydrophobicContact CG-CE2 4.12Å; V136-F214 HydrophobicContact CG2-CE1 4.38Å; F159-F214 HydrophobicContact CE1-CE1 4.31Å; L162-F214 HydrophobicContact CD1-CZ 4.08Å; F169-F214 HydrophobicContact CZ-CE2 4.39Å; L173-F214 HydrophobicContact CD1-CZ 4.16Å; V189-F214 HydrophobicContact CB-CD1 4.44Å; V189-F214 HydrophobicContact CG1-CD1 3.79Å; V189-F214 HydrophobicContact CG1-CE1 3.72Å; V189-F214 HydrophobicContact CG1-CG 4.37Å; V189-F214 HydrophobicContact CG1-CZ 4.26Å; V189-F214 HydrophobicContact CG2-CD1 4.12Å; V189-F214 HydrophobicContact CG2-CE1 4.03Å; V210-F214 HydrophobicContact CG1-CD2 3.99Å; V210-F214 HydrophobicContact CG1-CE2 3.85Å; V210-F214 WeakPolarHBondContact O-CD2 3.39Å; V210-F214 PolarHBondContact O-N 3.44Å; V210-F214 VanDerWaalsContact O-N 3.14Å; C211-F214 PolarHBondContact O-N 2.88Å; Q212-F214 PolarHBondContact O-N 2.87Å; F214-D216 PolarHBondContact O-N 3.2Å; F214-R217 CarbonylContact O-C 3.57Å; F214-R217 PolarHBondContact O-N 3.1Å; F214-R217 VanDerWaalsContact O-N 3.1Å; F214-A218 WeakPolarHBondContact O-CB 3.41Å; F214-A218 PolarHBondContact O-N 3.2Å
215	I	93.6	Very high	92.4	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-53.6	-38.3	172.9	-73.5	167.3	0	0	0	109.8	L97 L99 C211 Q212 R217 I221 L239 Q242 L243 R246	L97-I215 HydrophobicContact CD2-CB 4.49Å; L97-I215 HydrophobicContact CD2-CG1 3.78Å; L99-I215 HydrophobicContact CD1-CD1 4.16Å; L99-I215 HydrophobicContact CD1-CG1 4.02Å; C211-I215 WeakPolarHBondContact O-CB 3.27Å; C211-I215 VanDerWaalsContact O-CG1 3.25Å; C211-I215 WeakPolarHBondContact O-CG1 3.45Å; C211-I215 PolarHBondContact O-N 3.14Å; Q212-I215 PolarHBondContact O-N 3.44Å; I215-R217 PolarHBondContact O-N 3.32Å; I215-I221 HydrophobicContact CG2-CD1 4.14Å; I215-L239 HydrophobicContact CD1-CD1 4.33Å; I215-Q242 HydrophobicContact CD1-CB 3.98Å; I215-L243 HydrophobicContact CD1-CD2 3.82Å; I215-L243 HydrophobicContact CD1-CG 4.24Å; I215-L243 HydrophobicContact CG1-CD2 3.87Å; I215-L243 HydrophobicContact CG2-CD2 3.9Å; I215-R246 VanDerWaalsContact CG2-CD 3.44Å; I215-R246 WeakPolarHBondContact O-CD 3.34Å; I215-R246 PolarHBondContact O-NE 3.27Å
216	D	90.2	Very high	92.5	Very high	44 Å²	44	19.1 Å²	19.1	24%	0.235	10%	0.1	C	C	.	.	H	α-helix	trans	-68.5	-24.3	-175.7	-80.9	-22.8	0	0	0	114.7	Q212 W213 F214 R246	Q212-D216 PolarHBondContact NE2-OD1 3.07Å; Q212-D216 VanDerWaalsContact O-CB 3.24Å; Q212-D216 WeakPolarHBondContact O-CB 3.44Å; Q212-D216 PolarHBondContact O-N 3.42Å; W213-D216 PolarHBondContact O-N 3.48Å; F214-D216 PolarHBondContact O-N 3.2Å; D216-R246 PolarHBondContact O-NH1 3.15Å; D216-R246 VanDerWaalsContact O-NH1 3.15Å; D216-R246 PolarHBondContact O-NH2 2.99Å; D216-R246 IonicContact OD1-CZ 2.55Å; D216-R246 VanDerWaalsContact OD1-CZ 3.3Å; D216-R246 IonicContact OD1-NE 2.75Å; D216-R246 PolarHBondContact OD1-NE 3.1Å; D216-R246 IonicContact OD1-NH2 3.65Å; D216-R246 PolarHBondContact OD1-NH2 2.83Å
217	R	91.1	Very high	92.6	Very high	27 Å²	27	16.9 Å²	16.9	10%	0.102	9%	0.085	C	C	.	.	H	α-helix	trans	-112.9	-8.4	-174.4	-72.1	174.9	165.6	72.7	6.9	113.6	H83 E84 E89 M95 W213 F214 I215	H83-R217 PolarHBondContact CE1-NH1 3.15Å; H83-R217 PolarHBondContact CE1-NH2 3.39Å; H83-R217 PolarHBondContact ND1-NH1 2.72Å; H83-R217 PolarHBondContact ND1-NH2 3.43Å; E84-R217 PolarHBondContact O-NH2 2.99Å; E89-R217 IonicContact OE1-NE 3.39Å; E89-R217 IonicContact OE1-NH2 2.67Å; E89-R217 IonicContact OE2-CZ 3.89Å; E89-R217 VanDerWaalsContact OE2-CZ 3.28Å; E89-R217 IonicContact OE2-NE 2.73Å; E89-R217 PolarHBondContact OE2-NE 3.33Å; E89-R217 IonicContact OE2-NH2 3.67Å; E89-R217 PolarHBondContact OE2-NH2 3Å; M95-R217 HydrophobicContact CE-CB 4.2Å; M95-R217 HydrophobicContact SD-CB 4.47Å; W213-R217 VanDerWaalsContact CD1-NH1 3.32Å; W213-R217 VanDerWaalsContact CZ2-CD 3.43Å; F214-R217 CarbonylContact O-C 3.57Å; F214-R217 PolarHBondContact O-N 3.1Å; F214-R217 VanDerWaalsContact O-N 3.1Å; I215-R217 PolarHBondContact O-N 3.32Å
218	A	94.2	Very high	92.5	Very high	2 Å²	2	19.4 Å²	19.4	2%	0.017	10%	0.103	C	C	.	.			trans	-68.5	135.5	175.8	0	0	0	0	0	110.2	L97 F214 I221 Q249	L97-A218 HydrophobicContact CB-CB 3.78Å; L97-A218 HydrophobicContact CD2-CB 4.26Å; F214-A218 WeakPolarHBondContact O-CB 3.41Å; F214-A218 PolarHBondContact O-N 3.2Å; A218-I221 HydrophobicContact CB-CD1 4.17Å; A218-I221 HydrophobicContact CB-CG1 3.64Å; A218-Q249 PolarHBondContact O-NE2 3.4Å
219	D	94.5	Very high	92.1	Very high	31 Å²	31	21.9 Å²	21.9	17%	0.166	11%	0.111	C	C	.	.	S	Bend	trans	-87.2	-28.3	171.1	-64.2	-91.9	0	0	0	111	P94 M95 V321	P94-D219 WeakPolarHBondContact CA-OD2 3.37Å; P94-D219 HydrophobicContact CB-CB 4.09Å; M95-D219 PolarHBondContact N-OD2 3.5Å; M95-D219 PolarHBondContact O-N 2.94Å; D219-V321 HydrophobicContact CB-CG1 3.72Å
220	L	95.7	Very high	91.5	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.01	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	135.1	177.2	-173.5	63.5	0	0	0	109.6	M95 V96 L97 F222 R251 L318 V321	M95-L220 PolarHBondContact O-N 3.28Å; V96-L220 WeakPolarHBondContact CA-O 3.2Å; V96-L220 HydrophobicContact CG1-CB 4.49Å; V96-L220 HydrophobicContact CG1-CD2 4.4Å; V96-L220 HydrophobicContact CG2-CB 4.13Å; V96-L220 HydrophobicContact CG2-CD2 4.27Å; L97-L220 PolarHBondContact N-O 2.78Å; L220-F222 HydrophobicContact CD1-CE1 4.08Å; L220-F222 HydrophobicContact CD2-CD1 4.26Å; L220-F222 HydrophobicContact CD2-CE1 3.38Å; L220-F222 HydrophobicContact CD2-CE2 4.46Å; L220-F222 HydrophobicContact CD2-CZ 3.51Å; L220-F222 HydrophobicContact CG-CD1 4.04Å; L220-F222 HydrophobicContact CG-CE1 3.59Å; L220-F222 HydrophobicContact CG-CZ 4.19Å; L220-R251 HydrophobicContact CD1-CG 3.84Å; L220-L318 HydrophobicContact CD2-CB 4.29Å; L220-L318 HydrophobicContact CD2-CD1 3.91Å; L220-V321 HydrophobicContact CB-CG1 4.38Å; L220-V321 HydrophobicContact CB-CG2 4.27Å; L220-V321 HydrophobicContact CD1-CG2 4.25Å; L220-V321 HydrophobicContact CD2-CG2 4.32Å
221	I	97.1	Very high	90.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	113.2	-177.3	-56.7	176.3	0	0	0	108.6	L97 L99 I215 A218 V223 L243 Q249 I250 R251	L97-I221 HydrophobicContact CB-CG1 4.47Å; L97-I221 WeakPolarHBondContact O-CA 3.27Å; L99-I221 HydrophobicContact CD1-CG2 3.54Å; L99-I221 HydrophobicContact CG-CG2 4.22Å; I215-I221 HydrophobicContact CG2-CD1 4.14Å; A218-I221 HydrophobicContact CB-CD1 4.17Å; A218-I221 HydrophobicContact CB-CG1 3.64Å; I221-V223 HydrophobicContact CG2-CG2 4.08Å; I221-L243 HydrophobicContact CD1-CD2 3.61Å; I221-L243 HydrophobicContact CG2-CD2 4.04Å; I221-Q249 HydrophobicContact CG1-CB 4.47Å; I221-Q249 PolarHBondContact N-O 2.86Å; I221-I250 CarbonylContact O-C 3.53Å; I221-I250 WeakPolarHBondContact O-CA 3.36Å; I221-R251 PolarHBondContact O-N 3.39Å
222	F	97.4	Very high	89.3	Confident	1 Å²	1	26.5 Å²	26.5	0%	0.004	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.5	173.2	-69.3	-15.6	0	0	0	109.6	V96 L97 F98 L99 M109 L220 R251 I253 L314	V96-F222 HydrophobicContact CG1-CD2 3.88Å; V96-F222 HydrophobicContact CG1-CE2 3.89Å; V96-F222 HydrophobicContact CG1-CG 4.4Å; V96-F222 HydrophobicContact CG1-CZ 4.42Å; L97-F222 PolarHBondContact O-N 2.76Å; F98-F222 HydrophobicContact CD1-CB 4.07Å; F98-F222 HydrophobicContact CD1-CD2 4.15Å; F98-F222 HydrophobicContact CE1-CB 4.31Å; F98-F222 AromaticContact CE1-CD2 3.57Å; F98-F222 HydrophobicContact CE1-CD2 3.57Å; F98-F222 HydrophobicContact CE1-CE2 4.42Å; F98-F222 HydrophobicContact CE1-CG 4.44Å; F98-F222 HydrophobicContact CE2-CD2 4.29Å; F98-F222 AromaticContact CZ-CD2 3.64Å; F98-F222 HydrophobicContact CZ-CD2 3.64Å; F98-F222 HydrophobicContact CZ-CE2 4.18Å; L99-F222 PolarHBondContact N-O 2.9Å; M109-F222 HydrophobicContact CE-CD2 4.3Å; M109-F222 HydrophobicContact CE-CE2 4.33Å; L220-F222 HydrophobicContact CD1-CE1 4.08Å; L220-F222 HydrophobicContact CD2-CD1 4.26Å; L220-F222 HydrophobicContact CD2-CE1 3.38Å; L220-F222 HydrophobicContact CD2-CE2 4.46Å; L220-F222 HydrophobicContact CD2-CZ 3.51Å; L220-F222 HydrophobicContact CG-CD1 4.04Å; L220-F222 HydrophobicContact CG-CE1 3.59Å; L220-F222 HydrophobicContact CG-CZ 4.19Å; F222-R251 WeakPolarHBondContact CA-O 3.35Å; F222-R251 HydrophobicContact CD1-CB 3.83Å; F222-R251 HydrophobicContact CD1-CG 4.47Å; F222-R251 HydrophobicContact CE1-CB 3.99Å; F222-R251 HydrophobicContact CE1-CG 4.23Å; F222-I253 HydrophobicContact CB-CD1 3.9Å; F222-I253 HydrophobicContact CD1-CD1 4.17Å; F222-I253 HydrophobicContact CD2-CD1 4.08Å; F222-I253 HydrophobicContact CG-CD1 3.81Å; F222-L314 HydrophobicContact CD1-CD1 4.37Å; F222-L314 HydrophobicContact CE1-CD1 3.68Å; F222-L314 HydrophobicContact CE1-CG 4.47Å; F222-L314 HydrophobicContact CZ-CD1 3.83Å; F222-L314 HydrophobicContact CZ-CD2 4.45Å; F222-L314 HydrophobicContact CZ-CG 4.12Å
223	V	94.8	Very high	88.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	105.3	174.2	-171.4	0	0	0	0	108.2	L99 I221 F225 F240 L243 I250 R251 I252 I253	L99-V223 WeakPolarHBondContact O-CA 3.42Å; I221-V223 HydrophobicContact CG2-CG2 4.08Å; V223-F225 HydrophobicContact CB-CE2 4.32Å; V223-F225 HydrophobicContact CG1-CD2 4.41Å; V223-F225 HydrophobicContact CG1-CE2 3.49Å; V223-F225 VanDerWaalsContact CG1-CE2 3.49Å; V223-F225 HydrophobicContact CG1-CZ 3.55Å; V223-F240 HydrophobicContact CG1-CZ 4.05Å; V223-L243 HydrophobicContact CG2-CD1 4.03Å; V223-I250 HydrophobicContact CG2-CG2 3.93Å; V223-R251 PolarHBondContact N-O 2.87Å; V223-I252 WeakPolarHBondContact O-CA 3.43Å; V223-I253 PolarHBondContact O-N 3.15Å
224	V	94.7	Very high	87.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130	-171.3	-169.7	0	0	0	0	110.6	F98 L99 V104 K106 I253 N255	F98-V224 HydrophobicContact CD1-CG2 4.28Å; L99-V224 PolarHBondContact O-N 3.15Å; V104-V224 HydrophobicContact CB-CG1 4.2Å; V104-V224 HydrophobicContact CG2-CB 3.89Å; V104-V224 HydrophobicContact CG2-CG1 3.87Å; V104-V224 WeakPolarHBondContact CG2-O 3.39Å; K106-V224 HydrophobicContact CG-CB 4.24Å; K106-V224 HydrophobicContact CG-CG2 4.19Å; V224-I253 HydrophobicContact CG2-CB 4.45Å; V224-I253 HydrophobicContact CG2-CD1 4.45Å; V224-N255 HydrophobicContact CG1-CB 3.74Å
225	F	92.8	Very high	87.1	Confident	4 Å²	4	29.3 Å²	29.3	2%	0.018	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148	175.4	-66.5	-71.2	0	0	0	111	V223 L230 L236 F240 I252 I253 L254 N255 L272	V223-F225 HydrophobicContact CB-CE2 4.32Å; V223-F225 HydrophobicContact CG1-CD2 4.41Å; V223-F225 HydrophobicContact CG1-CE2 3.49Å; V223-F225 VanDerWaalsContact CG1-CE2 3.49Å; V223-F225 HydrophobicContact CG1-CZ 3.55Å; F225-L230 HydrophobicContact CB-CD2 3.99Å; F225-L230 HydrophobicContact CD1-CD2 3.71Å; F225-L230 HydrophobicContact CE1-CD2 4.46Å; F225-L230 HydrophobicContact CG-CD2 3.89Å; F225-L236 HydrophobicContact CE1-CD1 3.79Å; F225-L236 HydrophobicContact CE1-CD2 3.46Å; F225-L236 VanDerWaalsContact CE1-CD2 3.46Å; F225-L236 HydrophobicContact CE1-CG 4.24Å; F225-L236 HydrophobicContact CZ-CD1 4Å; F225-L236 HydrophobicContact CZ-CD2 4Å; F225-F240 HydrophobicContact CE2-CZ 4.21Å; F225-F240 AromaticContact CZ-CE2 3.84Å; F225-F240 HydrophobicContact CZ-CE2 3.84Å; F225-F240 AromaticContact CZ-CZ 3.87Å; F225-F240 HydrophobicContact CZ-CZ 3.87Å; F225-I252 HydrophobicContact CD2-CG2 3.74Å; F225-I252 HydrophobicContact CE2-CG2 3.87Å; F225-I253 PolarHBondContact N-O 2.79Å; F225-L254 HydrophobicContact CB-CD2 3.85Å; F225-N255 PolarHBondContact O-N 2.95Å; F225-L272 HydrophobicContact CD2-CD1 4.16Å; F225-L272 HydrophobicContact CE2-CD1 4.14Å; F225-L272 HydrophobicContact CZ-CD1 4.49Å
226	D	91.9	Very high	86.5	Confident	5 Å²	5	29.5 Å²	29.5	3%	0.027	16%	0.157	C	C	.	.			trans	-100.5	119.7	165.8	-175.7	-30.7	0	0	0	107.4	V104 T228 K229 L230 K256	V104-D226 HydrophobicContact CB-CB 4.3Å; V104-D226 HydrophobicContact CG1-CB 4.02Å; D226-T228 PolarHBondContact O-N 2.78Å; D226-T228 VanDerWaalsContact O-N 3.1Å; D226-T228 WeakPolarHBondContact OD1-CB 3.41Å; D226-T228 PolarHBondContact OD1-N 3.06Å; D226-T228 PolarHBondContact OD1-OG1 3.02Å; D226-K229 HydrophobicContact CB-CB 4.41Å; D226-K229 CarbonylContact O-C 3.53Å; D226-K229 PolarHBondContact O-N 3.1Å; D226-L230 PolarHBondContact O-N 3.37Å; D226-K256 WeakPolarHBondContact OD2-CD 3.45Å; D226-K256 WeakPolarHBondContact OD2-CE 3.33Å; D226-K256 IonicContact OD2-NZ 3.26Å; D226-K256 PolarHBondContact OD2-NZ 3.38Å
227	P	89.2	Confident	86.2	Confident	6 Å²	6	30.4 Å²	30.4	4%	0.039	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-15.4	-173.4	30.7	-37.6	0	0	0	112.7	L230 N255 L260 V268	P227-L230 HydrophobicContact CB-CD1 4.44Å; P227-N255 WeakPolarHBondContact CD-O 3.39Å; P227-L260 HydrophobicContact CB-CD1 3.56Å; P227-L260 HydrophobicContact CG-CD1 3.73Å; P227-L260 HydrophobicContact CG-CG 4.43Å; P227-V268 HydrophobicContact CB-CB 4.48Å; P227-V268 HydrophobicContact CB-CG1 3.6Å
228	T	86	Confident	85.8	Confident	78 Å²	78	32 Å²	32	48%	0.479	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-14.7	174.5	68.8	0	0	0	0	113.3	D226 N259 L260	D226-T228 PolarHBondContact O-N 2.78Å; D226-T228 VanDerWaalsContact O-N 3.1Å; D226-T228 WeakPolarHBondContact OD1-CB 3.41Å; D226-T228 PolarHBondContact OD1-N 3.06Å; D226-T228 PolarHBondContact OD1-OG1 3.02Å; T228-N259 HydrophobicContact CG2-CB 4.48Å; T228-L260 HydrophobicContact CG2-CD2 4.01Å; T228-L260 HydrophobicContact CG2-CG 4.21Å
229	K	79.9	Confident	85.5	Confident	103 Å²	103	32 Å²	32	45%	0.448	17%	0.169	S	C	.	.	S	Bend	trans	-129.5	36.6	-174.5	-58.4	-178.3	-176	-179.1	0	112	S103 D226 D231	S103-K229 PolarHBondContact OG-NZ 2.91Å; D226-K229 HydrophobicContact CB-CB 4.41Å; D226-K229 CarbonylContact O-C 3.53Å; D226-K229 PolarHBondContact O-N 3.1Å; K229-D231 PolarHBondContact O-N 3.26Å
230	L	75.3	Confident	85.1	Confident	41 Å²	41	30.7 Å²	30.7	22%	0.215	16%	0.162	C	C	.	.			trans	-79	74.2	179.4	-90.5	163.9	0	0	0	111.4	F225 D226 P227 L254 V268 L272	F225-L230 HydrophobicContact CB-CD2 3.99Å; F225-L230 HydrophobicContact CD1-CD2 3.71Å; F225-L230 HydrophobicContact CE1-CD2 4.46Å; F225-L230 HydrophobicContact CG-CD2 3.89Å; D226-L230 PolarHBondContact O-N 3.37Å; P227-L230 HydrophobicContact CB-CD1 4.44Å; L230-L254 HydrophobicContact CD1-CD2 4.09Å; L230-V268 HydrophobicContact CD1-CG1 3.1Å; L230-V268 HydrophobicContact CG-CG1 4.45Å; L230-L272 HydrophobicContact CD2-CD1 3.68Å
231	D	70.2	Confident	84.7	Confident	117 Å²	117	38.1 Å²	38.1	63%	0.626	19%	0.19	S	C	*	.			trans	-102.4	118.3	164.3	-67.6	-41.4	0	0	0	108	K229 G233	K229-D231 PolarHBondContact O-N 3.26Å; D231-G233 PolarHBondContact O-N 3.43Å
232	V	68.9	Low	84.2	Confident	36 Å²	36	39.5 Å²	39.5	22%	0.218	20%	0.196	C	C	.	.			trans	-90	81.1	173.3	-178.1	0	0	0	0	108	L236 E237 L279	V232-L236 HydrophobicContact CB-CD2 4.21Å; V232-L236 HydrophobicContact CG1-CD2 4.05Å; V232-L236 HydrophobicContact CG2-CD2 3.94Å; V232-E237 HydrophobicContact CG1-CG 4.16Å; V232-L279 HydrophobicContact CG1-CD1 4.29Å
233	G	76.1	Confident	83.9	Confident	14 Å²	14	39.6 Å²	39.6	14%	0.144	20%	0.197	C	C	.	.			trans	-79.9	178.3	172.7	0	0	0	0	0	113.6	E196 D231 E235 L236 E237	E196-G233 WeakPolarHBondContact OE1-CA 3.47Å; E196-G233 PolarHBondContact OE1-N 3.17Å; D231-G233 PolarHBondContact O-N 3.43Å; G233-E235 VanDerWaalsContact C-N 3.3Å; G233-E235 PolarHBondContact O-N 2.97Å; G233-L236 PolarHBondContact O-N 3.43Å; G233-L236 VanDerWaalsContact O-N 3.15Å; G233-E237 PolarHBondContact O-N 2.92Å; G233-E237 VanDerWaalsContact O-N 3.09Å
234	L	78.7	Confident	83.4	Confident	79 Å²	79	46 Å²	46	41%	0.414	23%	0.225	S	C	.	.	H	α-helix	trans	-55.8	-40	-175.2	-176.9	68.8	0	0	0	113.5	E237 M238	L234-E237 WeakPolarHBondContact O-CB 3.38Å; L234-E237 PolarHBondContact O-N 3.24Å; L234-M238 HydrophobicContact CG-SD 4.41Å; L234-M238 WeakPolarHBondContact O-CG 3.31Å; L234-M238 PolarHBondContact O-N 3.42Å
235	E	77.9	Confident	82.9	Confident	25 Å²	25	49 Å²	49	12%	0.117	26%	0.255	C	S	.	.	H	α-helix	trans	-68.8	-36.9	-178.4	-64.6	-61.2	147.6	0	0	112.3	I194 Q201 G233 M238 L239	I194-E235 HydrophobicContact CG2-CB 3.35Å; I194-E235 HydrophobicContact CG2-CG 4.21Å; Q201-E235 VanDerWaalsContact NE2-CG 3.27Å; Q201-E235 PolarHBondContact NE2-OE1 2.99Å; G233-E235 VanDerWaalsContact C-N 3.3Å; G233-E235 PolarHBondContact O-N 2.97Å; E235-M238 WeakPolarHBondContact O-CB 3.42Å; E235-M238 PolarHBondContact O-N 3.41Å; E235-L239 PolarHBondContact O-N 3.49Å
236	L	80.6	Confident	82.6	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-39.8	175.6	-172.7	68.2	0	0	0	110.3	F225 V232 G233 M238 L239 F240	F225-L236 HydrophobicContact CE1-CD1 3.79Å; F225-L236 HydrophobicContact CE1-CD2 3.46Å; F225-L236 VanDerWaalsContact CE1-CD2 3.46Å; F225-L236 HydrophobicContact CE1-CG 4.24Å; F225-L236 HydrophobicContact CZ-CD1 4Å; F225-L236 HydrophobicContact CZ-CD2 4Å; V232-L236 HydrophobicContact CB-CD2 4.21Å; V232-L236 HydrophobicContact CG1-CD2 4.05Å; V232-L236 HydrophobicContact CG2-CD2 3.94Å; G233-L236 PolarHBondContact O-N 3.43Å; G233-L236 VanDerWaalsContact O-N 3.15Å; L236-M238 VanDerWaalsContact C-N 3.3Å; L236-M238 PolarHBondContact O-N 2.87Å; L236-L239 HydrophobicContact CD1-CD2 4.16Å; L236-L239 WeakPolarHBondContact O-CB 3.45Å; L236-L239 PolarHBondContact O-N 3.08Å; L236-F240 HydrophobicContact CD1-CD2 4.29Å; L236-F240 HydrophobicContact CD1-CE2 3.89Å; L236-F240 HydrophobicContact CD2-CE2 4.31Å; L236-F240 HydrophobicContact CG-CD2 4.05Å; L236-F240 HydrophobicContact CG-CE2 3.86Å; L236-F240 VanDerWaalsContact O-CD2 3.29Å; L236-F240 WeakPolarHBondContact O-CD2 3.27Å; L236-F240 PolarHBondContact O-N 3.01Å
237	E	83.9	Confident	82.4	Confident	64 Å²	64	53 Å²	53	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-43.8	170.8	-65.9	-170.7	-179	0	0	111.9	V232 G233 L234 L239 F240 R241 L279	V232-E237 HydrophobicContact CG1-CG 4.16Å; G233-E237 PolarHBondContact O-N 2.92Å; G233-E237 VanDerWaalsContact O-N 3.09Å; L234-E237 WeakPolarHBondContact O-CB 3.38Å; L234-E237 PolarHBondContact O-N 3.24Å; E237-L239 VanDerWaalsContact C-N 3.32Å; E237-L239 PolarHBondContact O-N 3.23Å; E237-F240 PolarHBondContact O-N 3.32Å; E237-R241 WeakPolarHBondContact O-CG 3.39Å; E237-R241 PolarHBondContact O-N 3.08Å; E237-R241 IonicContact OE2-NH2 2.89Å; E237-R241 PolarHBondContact OE2-NH2 3.48Å; E237-L279 HydrophobicContact CB-CD1 4.44Å; E237-L279 HydrophobicContact CB-CD2 4.07Å; E237-L279 HydrophobicContact CG-CD1 4.15Å; E237-L279 HydrophobicContact CG-CD2 4.09Å
238	M	83.3	Confident	82.3	Confident	59 Å²	59	57.6 Å²	57.6	29%	0.291	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-42.2	176.5	-74.2	179.6	62.7	0	0	111.5	N208 L234 E235 L236 F240 R241 Q242	N208-M238 VanDerWaalsContact ND2-CE 3.26Å; N208-M238 WeakPolarHBondContact ND2-CE 3.38Å; L234-M238 HydrophobicContact CG-SD 4.41Å; L234-M238 WeakPolarHBondContact O-CG 3.31Å; L234-M238 PolarHBondContact O-N 3.42Å; E235-M238 WeakPolarHBondContact O-CB 3.42Å; E235-M238 PolarHBondContact O-N 3.41Å; L236-M238 VanDerWaalsContact C-N 3.3Å; L236-M238 PolarHBondContact O-N 2.87Å; M238-F240 PolarHBondContact O-N 2.91Å; M238-R241 WeakPolarHBondContact O-CB 3.37Å; M238-R241 PolarHBondContact O-N 3.44Å; M238-Q242 WeakPolarHBondContact O-CG 3.45Å; M238-Q242 PolarHBondContact O-N 3.5Å; M238-Q242 VanDerWaalsContact O-N 3.08Å
239	L	86.8	Confident	82.5	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-58.3	-48.6	173.8	-172.1	77	0	0	0	111.8	L99 I194 I215 E235 L236 E237 R241 Q242 L243	L99-L239 HydrophobicContact CB-CD2 3.98Å; L99-L239 HydrophobicContact CD1-CD1 4.02Å; L99-L239 HydrophobicContact CD1-CD2 4.25Å; L99-L239 HydrophobicContact CD1-CG 4.4Å; L99-L239 HydrophobicContact CD2-CD1 4.28Å; I194-L239 HydrophobicContact CD1-CB 4.15Å; I194-L239 HydrophobicContact CD1-CD1 4.04Å; I194-L239 HydrophobicContact CD1-CD2 3.71Å; I194-L239 HydrophobicContact CD1-CG 4.17Å; I215-L239 HydrophobicContact CD1-CD1 4.33Å; E235-L239 PolarHBondContact O-N 3.49Å; L236-L239 HydrophobicContact CD1-CD2 4.16Å; L236-L239 WeakPolarHBondContact O-CB 3.45Å; L236-L239 PolarHBondContact O-N 3.08Å; E237-L239 VanDerWaalsContact C-N 3.32Å; E237-L239 PolarHBondContact O-N 3.23Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 2.78Å; L239-Q242 WeakPolarHBondContact O-CB 3.38Å; L239-Q242 PolarHBondContact O-N 3.24Å; L239-L243 HydrophobicContact CD2-CD1 4.42Å; L239-L243 HydrophobicContact CG-CD1 4.22Å; L239-L243 WeakPolarHBondContact O-CG 3.24Å; L239-L243 PolarHBondContact O-N 3.35Å
240	F	86.4	Confident	83.2	Confident	4 Å²	4	51 Å²	51	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-65.6	-31.4	178.9	-82.2	-79.6	0	0	0	112.8	V223 F225 L236 E237 M238 Q242 L243 K244 L276 L279 I280	V223-F240 HydrophobicContact CG1-CZ 4.05Å; F225-F240 HydrophobicContact CE2-CZ 4.21Å; F225-F240 AromaticContact CZ-CE2 3.84Å; F225-F240 HydrophobicContact CZ-CE2 3.84Å; F225-F240 AromaticContact CZ-CZ 3.87Å; F225-F240 HydrophobicContact CZ-CZ 3.87Å; L236-F240 HydrophobicContact CD1-CD2 4.29Å; L236-F240 HydrophobicContact CD1-CE2 3.89Å; L236-F240 HydrophobicContact CD2-CE2 4.31Å; L236-F240 HydrophobicContact CG-CD2 4.05Å; L236-F240 HydrophobicContact CG-CE2 3.86Å; L236-F240 VanDerWaalsContact O-CD2 3.29Å; L236-F240 WeakPolarHBondContact O-CD2 3.27Å; L236-F240 PolarHBondContact O-N 3.01Å; E237-F240 PolarHBondContact O-N 3.32Å; M238-F240 PolarHBondContact O-N 2.91Å; F240-Q242 VanDerWaalsContact C-N 3.3Å; F240-Q242 PolarHBondContact O-N 3.45Å; F240-L243 HydrophobicContact CD1-CD1 4.22Å; F240-L243 HydrophobicContact CE1-CD1 4.48Å; F240-L243 PolarHBondContact O-N 3.46Å; F240-K244 PolarHBondContact O-N 3.45Å; F240-L276 HydrophobicContact CD1-CD2 4.3Å; F240-L276 HydrophobicContact CD2-CD2 3.79Å; F240-L276 HydrophobicContact CE1-CD1 4.27Å; F240-L276 HydrophobicContact CE1-CD2 3.85Å; F240-L276 HydrophobicContact CE2-CD2 3.29Å; F240-L276 HydrophobicContact CG-CD2 4.28Å; F240-L276 HydrophobicContact CZ-CD1 3.95Å; F240-L276 HydrophobicContact CZ-CD2 3.32Å; F240-L276 HydrophobicContact CZ-CG 4.29Å; F240-L279 HydrophobicContact CB-CB 3.85Å; F240-L279 HydrophobicContact CB-CD1 3.99Å; F240-L279 HydrophobicContact CB-CG 4.4Å; F240-L279 HydrophobicContact CD2-CD1 4.04Å; F240-L279 HydrophobicContact CG-CB 4.35Å; F240-L279 HydrophobicContact CG-CD1 4.17Å; F240-I280 HydrophobicContact CD1-CG1 4.46Å; F240-I280 HydrophobicContact CE1-CD1 4.49Å
241	R	86.3	Confident	84.1	Confident	157 Å²	157	51.1 Å²	51.1	59%	0.592	27%	0.267	S	S	*	.	H	α-helix	trans	-63.4	-36.5	171.2	-69.7	175	-166.9	-173	8.8	112.1	E237 M238 L239 L243 K244	E237-R241 WeakPolarHBondContact O-CG 3.39Å; E237-R241 PolarHBondContact O-N 3.08Å; E237-R241 IonicContact OE2-NH2 2.89Å; E237-R241 PolarHBondContact OE2-NH2 3.48Å; M238-R241 WeakPolarHBondContact O-CB 3.37Å; M238-R241 PolarHBondContact O-N 3.44Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 2.78Å; R241-L243 VanDerWaalsContact C-N 3.34Å; R241-K244 VanDerWaalsContact O-CB 3.24Å; R241-K244 WeakPolarHBondContact O-CB 3.25Å; R241-K244 PolarHBondContact O-N 3.21Å
242	Q	88.3	Confident	85.3	Confident	30 Å²	30	45.6 Å²	45.6	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-70.3	-30.5	174.8	-69.3	-175	-45.9	0	0	113.2	N208 Q212 I215 M238 L239 F240 K244	N208-Q242 PolarHBondContact O-NE2 3.35Å; Q212-Q242 PolarHBondContact NE2-O 3.32Å; Q212-Q242 PolarHBondContact OE1-O 3.39Å; I215-Q242 HydrophobicContact CD1-CB 3.98Å; M238-Q242 WeakPolarHBondContact O-CG 3.45Å; M238-Q242 PolarHBondContact O-N 3.5Å; M238-Q242 VanDerWaalsContact O-N 3.08Å; L239-Q242 WeakPolarHBondContact O-CB 3.38Å; L239-Q242 PolarHBondContact O-N 3.24Å; F240-Q242 VanDerWaalsContact C-N 3.3Å; F240-Q242 PolarHBondContact O-N 3.45Å; Q242-K244 PolarHBondContact O-N 2.89Å
243	L	89.3	Confident	86.6	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-6.4	176.4	-67.5	171.1	0	0	0	113.6	L99 I215 I221 V223 L239 F240 R241 G245 R246 I250	L99-L243 HydrophobicContact CD1-CD1 4.43Å; L99-L243 HydrophobicContact CD1-CD2 4.06Å; I215-L243 HydrophobicContact CD1-CD2 3.82Å; I215-L243 HydrophobicContact CD1-CG 4.24Å; I215-L243 HydrophobicContact CG1-CD2 3.87Å; I215-L243 HydrophobicContact CG2-CD2 3.9Å; I221-L243 HydrophobicContact CD1-CD2 3.61Å; I221-L243 HydrophobicContact CG2-CD2 4.04Å; V223-L243 HydrophobicContact CG2-CD1 4.03Å; L239-L243 HydrophobicContact CD2-CD1 4.42Å; L239-L243 HydrophobicContact CG-CD1 4.22Å; L239-L243 WeakPolarHBondContact O-CG 3.24Å; L239-L243 PolarHBondContact O-N 3.35Å; F240-L243 HydrophobicContact CD1-CD1 4.22Å; F240-L243 HydrophobicContact CE1-CD1 4.48Å; F240-L243 PolarHBondContact O-N 3.46Å; R241-L243 VanDerWaalsContact C-N 3.34Å; L243-G245 PolarHBondContact O-N 3.43Å; L243-R246 PolarHBondContact O-N 3.06Å; L243-I250 HydrophobicContact CB-CD1 3.83Å; L243-I250 HydrophobicContact CD1-CD1 4.18Å; L243-I250 HydrophobicContact CG-CD1 4.41Å
244	K	86	Confident	87.5	Confident	136 Å²	136	43.2 Å²	43.2	59%	0.591	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	130.2	179.5	-171.3	176.9	-178.5	175.8	0	111.2	F240 R241 Q242 R246 E247	F240-K244 PolarHBondContact O-N 3.45Å; R241-K244 VanDerWaalsContact O-CB 3.24Å; R241-K244 WeakPolarHBondContact O-CB 3.25Å; R241-K244 PolarHBondContact O-N 3.21Å; Q242-K244 PolarHBondContact O-N 2.89Å; K244-R246 VanDerWaalsContact C-N 3.34Å; K244-E247 WeakPolarHBondContact CA-OE1 3.32Å
245	G	83.1	Confident	88.3	Confident	62 Å²	62	39.7 Å²	39.7	64%	0.639	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.8	1.7	-174.5	0	0	0	0	0	114.6	L243 E247	L243-G245 PolarHBondContact O-N 3.43Å; G245-E247 WeakPolarHBondContact CA-OE2 3.42Å; G245-E247 PolarHBondContact N-OE1 3.42Å; G245-E247 PolarHBondContact N-OE2 2.92Å
246	R	87.1	Confident	89	Confident	60 Å²	60	40.6 Å²	40.6	23%	0.226	21%	0.205	C	C	.	.			trans	-123	21	176.7	-65.8	-178.9	179.5	-82.3	-2.4	112.6	I215 D216 L243 K244 S248 Q249	I215-R246 VanDerWaalsContact CG2-CD 3.44Å; I215-R246 WeakPolarHBondContact O-CD 3.34Å; I215-R246 PolarHBondContact O-NE 3.27Å; D216-R246 PolarHBondContact O-NH1 3.15Å; D216-R246 VanDerWaalsContact O-NH1 3.15Å; D216-R246 PolarHBondContact O-NH2 2.99Å; D216-R246 IonicContact OD1-CZ 2.55Å; D216-R246 VanDerWaalsContact OD1-CZ 3.3Å; D216-R246 IonicContact OD1-NE 2.75Å; D216-R246 PolarHBondContact OD1-NE 3.1Å; D216-R246 IonicContact OD1-NH2 3.65Å; D216-R246 PolarHBondContact OD1-NH2 2.83Å; L243-R246 PolarHBondContact O-N 3.06Å; K244-R246 VanDerWaalsContact C-N 3.34Å; R246-S248 PolarHBondContact O-N 3.3Å; R246-S248 VanDerWaalsContact O-N 3.15Å; R246-Q249 VanDerWaalsContact NH1-OE1 3.13Å; R246-Q249 WeakPolarHBondContact O-CB 3.34Å; R246-Q249 PolarHBondContact O-N 3.34Å
247	E	86.8	Confident	89.6	Confident	32 Å²	32	40.4 Å²	40.4	15%	0.15	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-59	-32.3	-172.7	-61.6	84.4	175.6	0	0	112.7	K244 G245 Q249 I250 V282	K244-E247 WeakPolarHBondContact CA-OE1 3.32Å; G245-E247 WeakPolarHBondContact CA-OE2 3.42Å; G245-E247 PolarHBondContact N-OE1 3.42Å; G245-E247 PolarHBondContact N-OE2 2.92Å; E247-Q249 PolarHBondContact O-N 3.16Å; E247-I250 PolarHBondContact O-N 2.84Å; E247-V282 HydrophobicContact CB-CG1 3.87Å; E247-V282 HydrophobicContact CB-CG2 4.22Å; E247-V282 HydrophobicContact CG-CG1 3.73Å; E247-V282 HydrophobicContact CG-CG2 4.2Å
248	S	87.3	Confident	90	Very high	103 Å²	103	37.6 Å²	37.6	72%	0.72	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-65.3	-23.3	177	60	0	0	0	0	114.1	R246 R251	R246-S248 PolarHBondContact O-N 3.3Å; R246-S248 VanDerWaalsContact O-N 3.15Å; S248-R251 PolarHBondContact O-NH1 3.3Å
249	Q	91.4	Very high	90.4	Very high	39 Å²	39	37.6 Å²	37.6	18%	0.182	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-89.4	-13.7	-179.4	-47.2	-174.8	-82.7	0	0	111.9	A218 I221 R246 E247	A218-Q249 PolarHBondContact O-NE2 3.4Å; I221-Q249 HydrophobicContact CG1-CB 4.47Å; I221-Q249 PolarHBondContact N-O 2.86Å; R246-Q249 VanDerWaalsContact NH1-OE1 3.13Å; R246-Q249 WeakPolarHBondContact O-CB 3.34Å; R246-Q249 PolarHBondContact O-N 3.34Å; E247-Q249 PolarHBondContact O-N 3.16Å
250	I	93.2	Very high	90.5	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.015	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	135.1	-175	-58.2	172.1	0	0	0	109.7	I221 V223 L243 E247 I252 P286	I221-I250 CarbonylContact O-C 3.53Å; I221-I250 WeakPolarHBondContact O-CA 3.36Å; V223-I250 HydrophobicContact CG2-CG2 3.93Å; L243-I250 HydrophobicContact CB-CD1 3.83Å; L243-I250 HydrophobicContact CD1-CD1 4.18Å; L243-I250 HydrophobicContact CG-CD1 4.41Å; E247-I250 PolarHBondContact O-N 2.84Å; I250-I252 HydrophobicContact CG2-CG1 4.05Å; I250-P286 HydrophobicContact CB-CB 4.37Å; I250-P286 HydrophobicContact CB-CG 4.42Å; I250-P286 HydrophobicContact CG2-CB 4.18Å; I250-P286 HydrophobicContact CG2-CG 4.35Å
251	R	95.1	Very high	90.7	Very high	45 Å²	45	42.6 Å²	42.6	17%	0.17	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.6	162	-64.8	-53.7	-178.9	-88.1	-4.4	108.8	L220 I221 F222 V223 S248 Y289 L314 D317	L220-R251 HydrophobicContact CD1-CG 3.84Å; I221-R251 PolarHBondContact O-N 3.39Å; F222-R251 WeakPolarHBondContact CA-O 3.35Å; F222-R251 HydrophobicContact CD1-CB 3.83Å; F222-R251 HydrophobicContact CD1-CG 4.47Å; F222-R251 HydrophobicContact CE1-CB 3.99Å; F222-R251 HydrophobicContact CE1-CG 4.23Å; V223-R251 PolarHBondContact N-O 2.87Å; S248-R251 PolarHBondContact O-NH1 3.3Å; R251-Y289 HydrophobicContact CB-CD2 4.35Å; R251-Y289 HydrophobicContact CB-CE2 3.81Å; R251-Y289 HydrophobicContact CG-CE2 3.93Å; R251-L314 HydrophobicContact CB-CD1 4.46Å; R251-D317 IonicContact CZ-OD2 3.81Å; R251-D317 IonicContact NE-OD2 2.94Å; R251-D317 PolarHBondContact NE-OD2 3.02Å; R251-D317 IonicContact NH2-OD2 3.66Å; R251-D317 PolarHBondContact NH2-OD2 3.11Å
252	I	94.3	Very high	90.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.2	-178.6	-62.2	173	0	0	0	108.2	V223 F225 I250 L272 L276 P286 R287 V288 Y289	V223-I252 WeakPolarHBondContact O-CA 3.43Å; F225-I252 HydrophobicContact CD2-CG2 3.74Å; F225-I252 HydrophobicContact CE2-CG2 3.87Å; I250-I252 HydrophobicContact CG2-CG1 4.05Å; I252-L272 HydrophobicContact CG2-CD2 3.99Å; I252-L276 HydrophobicContact CD1-CD1 3.59Å; I252-P286 HydrophobicContact CD1-CB 4.07Å; I252-P286 HydrophobicContact CD1-CG 4.42Å; I252-P286 HydrophobicContact CG1-CB 4.3Å; I252-R287 PolarHBondContact N-O 3.15Å; I252-V288 HydrophobicContact CB-CB 4.44Å; I252-V288 HydrophobicContact CB-CG2 3.83Å; I252-V288 HydrophobicContact CD1-CG2 4.21Å; I252-V288 HydrophobicContact CG2-CG1 4.28Å; I252-V288 HydrophobicContact CG2-CG2 3.92Å; I252-V288 CarbonylContact O-C 3.6Å; I252-V288 VanDerWaalsContact O-CA 3.29Å; I252-V288 WeakPolarHBondContact O-CA 3.48Å; I252-Y289 PolarHBondContact O-N 3.08Å
253	I	96.1	Very high	90.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.1	-177.5	-56.2	179.6	0	0	0	108.4	M109 F222 V223 V224 F225 N255 F293 L314	M109-I253 HydrophobicContact CE-CD1 3.47Å; M109-I253 VanDerWaalsContact CE-CD1 3.47Å; M109-I253 HydrophobicContact SD-CD1 3.78Å; F222-I253 HydrophobicContact CB-CD1 3.9Å; F222-I253 HydrophobicContact CD1-CD1 4.17Å; F222-I253 HydrophobicContact CD2-CD1 4.08Å; F222-I253 HydrophobicContact CG-CD1 3.81Å; V223-I253 PolarHBondContact O-N 3.15Å; V224-I253 HydrophobicContact CG2-CB 4.45Å; V224-I253 HydrophobicContact CG2-CD1 4.45Å; F225-I253 PolarHBondContact N-O 2.79Å; I253-N255 HydrophobicContact CG2-CB 4.34Å; I253-N255 PolarHBondContact O-N 3.33Å; I253-F293 HydrophobicContact CG2-CD2 3.76Å; I253-F293 HydrophobicContact CG2-CE2 3.28Å; I253-F293 HydrophobicContact CG2-CZ 4.04Å; I253-L314 HydrophobicContact CD1-CD1 4Å; I253-L314 HydrophobicContact CD1-CD2 3.84Å; I253-L314 HydrophobicContact CG1-CD1 4.26Å
254	L	94.9	Very high	90.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	90.2	165.1	-69.9	-176.2	0	0	0	107.8	F225 L230 Y269 L272 V288 Y289 V290 S291	F225-L254 HydrophobicContact CB-CD2 3.85Å; L230-L254 HydrophobicContact CD1-CD2 4.09Å; L254-Y269 HydrophobicContact CD1-CD2 3.91Å; L254-L272 HydrophobicContact CD1-CD2 4.45Å; L254-L272 HydrophobicContact CD2-CD2 3.83Å; L254-L272 HydrophobicContact CG-CD2 4.27Å; L254-V288 HydrophobicContact CD1-CG1 3.98Å; L254-V288 HydrophobicContact CG-CG1 3.83Å; L254-Y289 PolarHBondContact N-O 3.02Å; L254-V290 HydrophobicContact CB-CG1 4.27Å; L254-V290 HydrophobicContact CB-CG2 4.24Å; L254-V290 HydrophobicContact CD1-CG2 4.07Å; L254-S291 PolarHBondContact O-N 3.02Å
255	N	95.4	Very high	90.7	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.027	24%	0.239	C	C	.	.			trans	-80.3	161.3	-179.9	-169.5	24	0	0	0	110.9	V104 V224 F225 P227 I253 A257 S291 F293	V104-N255 PolarHBondContact O-ND2 3.03Å; V224-N255 HydrophobicContact CG1-CB 3.74Å; F225-N255 PolarHBondContact O-N 2.95Å; P227-N255 WeakPolarHBondContact CD-O 3.39Å; I253-N255 HydrophobicContact CG2-CB 4.34Å; I253-N255 PolarHBondContact O-N 3.33Å; N255-A257 PolarHBondContact O-N 3.02Å; N255-S291 CarbonylContact C-O 3.59Å; N255-S291 VanDerWaalsContact CA-O 3.28Å; N255-S291 WeakPolarHBondContact CA-O 3.45Å; N255-F293 PolarHBondContact OD1-N 2.93Å
256	K	93.9	Very high	91	Very high	44 Å²	44	45 Å²	45	19%	0.191	24%	0.239	C	C	.	.	S	Bend	trans	60.6	25.5	178.3	-49.8	-165.4	-157.7	159.1	0	113.9	S103 D226 D258 N259 S291 S292	S103-K256 PolarHBondContact O-NZ 3.3Å; D226-K256 WeakPolarHBondContact OD2-CD 3.45Å; D226-K256 WeakPolarHBondContact OD2-CE 3.33Å; D226-K256 IonicContact OD2-NZ 3.26Å; D226-K256 PolarHBondContact OD2-NZ 3.38Å; K256-D258 PolarHBondContact O-N 2.87Å; K256-N259 WeakPolarHBondContact CB-ND2 3.5Å; K256-N259 WeakPolarHBondContact O-CB 3.43Å; K256-N259 PolarHBondContact O-N 2.9Å; K256-N259 VanDerWaalsContact O-N 3.13Å; K256-N259 PolarHBondContact O-ND2 2.99Å; K256-S291 PolarHBondContact N-O 3.5Å; K256-S291 VanDerWaalsContact N-O 3.13Å; K256-S292 VanDerWaalsContact C-OG 3.31Å; K256-S292 VanDerWaalsContact CA-OG 3.23Å; K256-S292 WeakPolarHBondContact CA-OG 3.4Å
257	A	93.2	Very high	91.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-64.3	-21.9	-175.5	0	0	0	0	0	113.4	N255 N259 L260 L265 V290 S291 S292 F307	N255-A257 PolarHBondContact O-N 3.02Å; A257-N259 PolarHBondContact O-N 3.47Å; A257-L260 PolarHBondContact O-N 3.37Å; A257-L260 VanDerWaalsContact O-N 3.14Å; A257-L265 HydrophobicContact CB-CD1 3.9Å; A257-L265 HydrophobicContact CB-CD2 4.24Å; A257-V290 HydrophobicContact CB-CG1 3.56Å; A257-S291 PolarHBondContact N-O 3.42Å; A257-S292 PolarHBondContact N-OG 3.3Å; A257-F307 HydrophobicContact CB-CE1 4.26Å; A257-F307 HydrophobicContact CB-CE2 3.86Å; A257-F307 HydrophobicContact CB-CZ 3.49Å; A257-F307 VanDerWaalsContact CB-CZ 3.49Å
258	D	92.8	Very high	91.3	Very high	6 Å²	6	50.1 Å²	50.1	3%	0.032	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-63.8	-16.8	174.7	69.5	-39.6	0	0	0	113.4	K256 L260 S292 Y298 K299 T302 F307	K256-D258 PolarHBondContact O-N 2.87Å; D258-L260 PolarHBondContact O-N 2.97Å; D258-S292 PolarHBondContact N-OG 3.02Å; D258-S292 WeakPolarHBondContact OD1-CB 3.12Å; D258-S292 PolarHBondContact OD1-OG 3.39Å; D258-Y298 HydrophobicContact CB-CD1 4.29Å; D258-K299 HydrophobicContact CB-CB 4.38Å; D258-K299 WeakPolarHBondContact O-CD 3.38Å; D258-T302 HydrophobicContact CB-CG2 4.08Å; D258-F307 HydrophobicContact CB-CE2 4.03Å
259	N	90.8	Very high	91.3	Very high	59 Å²	59	49.1 Å²	49.1	32%	0.316	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-75.3	-8.2	174.8	-66.6	-71.9	0	0	0	113.9	T228 K256 A257 K299	T228-N259 HydrophobicContact CG2-CB 4.48Å; K256-N259 WeakPolarHBondContact CB-ND2 3.5Å; K256-N259 WeakPolarHBondContact O-CB 3.43Å; K256-N259 PolarHBondContact O-N 2.9Å; K256-N259 VanDerWaalsContact O-N 3.13Å; K256-N259 PolarHBondContact O-ND2 2.99Å; A257-N259 PolarHBondContact O-N 3.47Å; N259-K299 WeakPolarHBondContact OD1-CE 3.34Å; N259-K299 PolarHBondContact OD1-NZ 3.3Å
260	L	89.7	Confident	91.2	Very high	41 Å²	41	49.1 Å²	49.1	22%	0.215	25%	0.251	C	S	.	.	S	Bend	trans	-119.6	142.6	-177.4	-66.5	-178.8	0	0	0	111.5	P227 T228 A257 D258 M264 V268	P227-L260 HydrophobicContact CB-CD1 3.56Å; P227-L260 HydrophobicContact CG-CD1 3.73Å; P227-L260 HydrophobicContact CG-CG 4.43Å; T228-L260 HydrophobicContact CG2-CD2 4.01Å; T228-L260 HydrophobicContact CG2-CG 4.21Å; A257-L260 PolarHBondContact O-N 3.37Å; A257-L260 VanDerWaalsContact O-N 3.14Å; D258-L260 PolarHBondContact O-N 2.97Å; L260-M264 HydrophobicContact CB-CB 4.49Å; L260-V268 HydrophobicContact CD1-CG2 4.13Å
261	A	89.1	Confident	90.9	Very high	70 Å²	70	51.5 Å²	51.5	58%	0.579	27%	0.27	S	S	*	.			trans	-63.6	147	166.1	0	0	0	0	0	110.8	Q263 M264 L265	A261-Q263 PolarHBondContact O-N 3.47Å; A261-Q263 VanDerWaalsContact O-N 3.08Å; A261-M264 WeakPolarHBondContact O-CB 3.21Å; A261-M264 PolarHBondContact O-N 3.32Å; A261-L265 PolarHBondContact O-N 2.69Å
262	T	86.6	Confident	90.5	Very high	56 Å²	56	49.4 Å²	49.4	34%	0.344	26%	0.263	S	S	.	.	H	α-helix	trans	-50.2	-40.5	-176.5	-48.9	0	0	0	0	113.6	M264 L265 M266 H303	T262-M264 PolarHBondContact O-N 3.17Å; T262-L265 WeakPolarHBondContact O-CB 3.33Å; T262-L265 PolarHBondContact O-N 2.95Å; T262-M266 WeakPolarHBondContact O-CG 3.35Å; T262-M266 PolarHBondContact O-N 2.79Å; T262-M266 VanDerWaalsContact O-N 3.09Å; T262-H303 WeakPolarHBondContact CG2-NE2 3.07Å; T262-H303 PolarHBondContact OG1-CD2 3.01Å; T262-H303 PolarHBondContact OG1-NE2 3.47Å
263	Q	87	Confident	90.2	Very high	155 Å²	155	51.8 Å²	51.8	72%	0.724	27%	0.273	S	S	*	.	H	α-helix	trans	-64.2	-39.9	178.7	-66.4	-175	-9.1	0	0	112.8	A261 R267	A261-Q263 PolarHBondContact O-N 3.47Å; A261-Q263 VanDerWaalsContact O-N 3.08Å; Q263-R267 WeakPolarHBondContact O-CG 3.23Å; Q263-R267 PolarHBondContact O-N 3.3Å
264	M	88.1	Confident	89.7	Confident	85 Å²	85	62.1 Å²	62.1	42%	0.419	31%	0.312	S	S	.	.	H	α-helix	trans	-70.9	-39.4	177.2	-71.2	-59.8	-65.2	0	0	110.7	L260 A261 T262 M266 R267 V268	L260-M264 HydrophobicContact CB-CB 4.49Å; A261-M264 WeakPolarHBondContact O-CB 3.21Å; A261-M264 PolarHBondContact O-N 3.32Å; T262-M264 PolarHBondContact O-N 3.17Å; M264-M266 VanDerWaalsContact C-N 3.32Å; M264-M266 PolarHBondContact O-N 2.88Å; M264-R267 WeakPolarHBondContact O-CB 3.18Å; M264-R267 PolarHBondContact O-N 2.84Å; M264-R267 VanDerWaalsContact O-N 3.13Å; M264-V268 WeakPolarHBondContact O-CB 2.97Å; M264-V268 VanDerWaalsContact O-CG2 3.29Å; M264-V268 WeakPolarHBondContact O-CG2 3.43Å; M264-V268 PolarHBondContact O-N 2.9Å
265	L	89.4	Confident	89.1	Confident	15 Å²	15	64.2 Å²	64.2	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-57.4	-43.6	175.8	-174	59.4	0	0	0	112.1	A257 A261 T262 R267 V268 Y269 V290 F307	A257-L265 HydrophobicContact CB-CD1 3.9Å; A257-L265 HydrophobicContact CB-CD2 4.24Å; A261-L265 PolarHBondContact O-N 2.69Å; T262-L265 WeakPolarHBondContact O-CB 3.33Å; T262-L265 PolarHBondContact O-N 2.95Å; L265-R267 PolarHBondContact O-N 2.86Å; L265-V268 PolarHBondContact O-N 2.88Å; L265-Y269 WeakPolarHBondContact O-CB 3.48Å; L265-Y269 PolarHBondContact O-N 3.44Å; L265-V290 HydrophobicContact CD1-CG1 3.77Å; L265-V290 HydrophobicContact CD2-CG1 3.71Å; L265-V290 HydrophobicContact CG-CG1 4.06Å; L265-F307 HydrophobicContact CD2-CE1 4.06Å; L265-F307 HydrophobicContact CD2-CZ 4.04Å
266	M	88.9	Confident	88.5	Confident	127 Å²	127	64 Å²	64	63%	0.626	33%	0.326	S	S	*	.	H	α-helix	trans	-64.5	-37.5	176.1	-68.1	-59	-70.6	0	0	113.1	T262 M264 G270	T262-M266 WeakPolarHBondContact O-CG 3.35Å; T262-M266 PolarHBondContact O-N 2.79Å; T262-M266 VanDerWaalsContact O-N 3.09Å; M264-M266 VanDerWaalsContact C-N 3.32Å; M264-M266 PolarHBondContact O-N 2.88Å; M266-G270 PolarHBondContact O-N 3.37Å; M266-G270 VanDerWaalsContact O-N 3.08Å
267	R	89.9	Confident	88	Confident	177 Å²	177	65 Å²	65	67%	0.668	34%	0.343	S	S	*	.	H	α-helix	trans	-65.1	-44.8	175.1	-71.5	176.3	176.1	176.9	-0.8	111.2	Q263 M264 L265 G270 A271	Q263-R267 WeakPolarHBondContact O-CG 3.23Å; Q263-R267 PolarHBondContact O-N 3.3Å; M264-R267 WeakPolarHBondContact O-CB 3.18Å; M264-R267 PolarHBondContact O-N 2.84Å; M264-R267 VanDerWaalsContact O-N 3.13Å; L265-R267 PolarHBondContact O-N 2.86Å; R267-G270 PolarHBondContact O-N 2.87Å; R267-A271 WeakPolarHBondContact O-CB 3.43Å; R267-A271 PolarHBondContact O-N 3.32Å
268	V	89.3	Confident	87.6	Confident	23 Å²	23	70.2 Å²	70.2	14%	0.139	38%	0.376	C	S	.	.	H	α-helix	trans	-63.8	-43.5	178.7	170	0	0	0	0	111.3	P227 L230 L260 M264 L265 G270 A271 L272	P227-V268 HydrophobicContact CB-CB 4.48Å; P227-V268 HydrophobicContact CB-CG1 3.6Å; L230-V268 HydrophobicContact CD1-CG1 3.1Å; L230-V268 HydrophobicContact CG-CG1 4.45Å; L260-V268 HydrophobicContact CD1-CG2 4.13Å; M264-V268 WeakPolarHBondContact O-CB 2.97Å; M264-V268 VanDerWaalsContact O-CG2 3.29Å; M264-V268 WeakPolarHBondContact O-CG2 3.43Å; M264-V268 PolarHBondContact O-N 2.9Å; L265-V268 PolarHBondContact O-N 2.88Å; V268-G270 VanDerWaalsContact C-N 3.33Å; V268-G270 PolarHBondContact O-N 2.89Å; V268-A271 PolarHBondContact O-N 2.9Å; V268-L272 PolarHBondContact O-N 2.55Å
269	Y	88.6	Confident	87	Confident	82 Å²	82	71.1 Å²	71.1	32%	0.322	38%	0.381	S	S	.	.	H	α-helix	trans	-56.5	-46.6	173.5	-174.3	-86.9	0	0	0	111.6	L254 L265 L272 F273 V288 V290	L254-Y269 HydrophobicContact CD1-CD2 3.91Å; L265-Y269 WeakPolarHBondContact O-CB 3.48Å; L265-Y269 PolarHBondContact O-N 3.44Å; Y269-L272 PolarHBondContact O-N 2.97Å; Y269-F273 AromaticContact CD1-CD2 3.9Å; Y269-F273 HydrophobicContact CD1-CD2 3.9Å; Y269-F273 AromaticContact CD1-CE2 3.93Å; Y269-F273 HydrophobicContact CD1-CE2 3.93Å; Y269-F273 HydrophobicContact CD2-CE2 4.43Å; Y269-F273 AromaticContact CE1-CD2 3.64Å; Y269-F273 HydrophobicContact CE1-CD2 3.64Å; Y269-F273 AromaticContact CE1-CE2 3.31Å; Y269-F273 HydrophobicContact CE1-CE2 3.31Å; Y269-F273 HydrophobicContact CE1-CZ 4.44Å; Y269-F273 AromaticContact CE2-CE2 3.9Å; Y269-F273 HydrophobicContact CE2-CE2 3.9Å; Y269-F273 HydrophobicContact CG-CE2 4.45Å; Y269-F273 AromaticContact CZ-CE2 3.3Å; Y269-F273 WeakPolarHBondContact O-CD2 3.41Å; Y269-F273 PolarHBondContact O-N 3.23Å; Y269-F273 WeakPolarHBondContact OH-CE2 3.45Å; Y269-V288 HydrophobicContact CD2-CG1 4.05Å; Y269-V288 HydrophobicContact CE2-CB 3.74Å; Y269-V288 HydrophobicContact CE2-CG1 3.65Å; Y269-V288 HydrophobicContact CE2-CG2 4.35Å; Y269-V290 HydrophobicContact CD2-CG2 4.22Å; Y269-V290 HydrophobicContact CE2-CG2 4.32Å
270	G	88.6	Confident	86.4	Confident	39 Å²	39	69.5 Å²	69.5	40%	0.402	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-42.2	175.3	0	0	0	0	0	113.4	M266 R267 V268 L272 F273 W274	M266-G270 PolarHBondContact O-N 3.37Å; M266-G270 VanDerWaalsContact O-N 3.08Å; R267-G270 PolarHBondContact O-N 2.87Å; V268-G270 VanDerWaalsContact C-N 3.33Å; V268-G270 PolarHBondContact O-N 2.89Å; G270-L272 VanDerWaalsContact C-N 3.35Å; G270-L272 PolarHBondContact O-N 3.44Å; G270-F273 PolarHBondContact O-N 2.92Å; G270-W274 PolarHBondContact O-N 3.25Å
271	A	88.1	Confident	85.7	Confident	52 Å²	52	73.4 Å²	73.4	43%	0.43	39%	0.393	S	S	.	.	H	α-helix	trans	-64.6	-37.2	177.9	0	0	0	0	0	112.6	R267 V268 W274 S275	R267-A271 WeakPolarHBondContact O-CB 3.43Å; R267-A271 PolarHBondContact O-N 3.32Å; V268-A271 PolarHBondContact O-N 2.9Å; A271-W274 PolarHBondContact O-N 3.01Å; A271-S275 WeakPolarHBondContact O-CB 3.42Å; A271-S275 PolarHBondContact O-N 3.26Å; A271-S275 PolarHBondContact O-OG 3.5Å
272	L	86.4	Confident	85.1	Confident	2 Å²	2	73 Å²	73	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-59	-52.8	173.5	176	68.9	0	0	0	110.6	F225 L230 I252 L254 V268 Y269 G270 W274 S275 L276 V288	F225-L272 HydrophobicContact CD2-CD1 4.16Å; F225-L272 HydrophobicContact CE2-CD1 4.14Å; F225-L272 HydrophobicContact CZ-CD1 4.49Å; L230-L272 HydrophobicContact CD2-CD1 3.68Å; I252-L272 HydrophobicContact CG2-CD2 3.99Å; L254-L272 HydrophobicContact CD1-CD2 4.45Å; L254-L272 HydrophobicContact CD2-CD2 3.83Å; L254-L272 HydrophobicContact CG-CD2 4.27Å; V268-L272 PolarHBondContact O-N 2.55Å; Y269-L272 PolarHBondContact O-N 2.97Å; G270-L272 VanDerWaalsContact C-N 3.35Å; G270-L272 PolarHBondContact O-N 3.44Å; L272-W274 VanDerWaalsContact C-N 3.31Å; L272-W274 PolarHBondContact O-N 2.89Å; L272-S275 PolarHBondContact O-N 3Å; L272-S275 VanDerWaalsContact O-N 3.11Å; L272-L276 HydrophobicContact CD1-CD1 3.68Å; L272-L276 HydrophobicContact CD1-CG 3.91Å; L272-L276 HydrophobicContact CD2-CD1 4.5Å; L272-L276 HydrophobicContact CG-CD1 3.85Å; L272-L276 HydrophobicContact CG-CG 4.27Å; L272-L276 WeakPolarHBondContact O-CB 3.28Å; L272-L276 VanDerWaalsContact O-CG 3.31Å; L272-L276 WeakPolarHBondContact O-CG 3.32Å; L272-L276 PolarHBondContact O-N 3.02Å; L272-V288 HydrophobicContact CD2-CG2 4.37Å
273	F	86.3	Confident	84.5	Confident	50 Å²	50	77.2 Å²	77.2	22%	0.219	41%	0.409	C	S	.	.	H	α-helix	trans	-62	-39.2	179.2	-83.7	-67.9	0	0	0	112.9	Y269 G270 S275 L276 A277 P285 V288	Y269-F273 AromaticContact CD1-CD2 3.9Å; Y269-F273 HydrophobicContact CD1-CD2 3.9Å; Y269-F273 AromaticContact CD1-CE2 3.93Å; Y269-F273 HydrophobicContact CD1-CE2 3.93Å; Y269-F273 HydrophobicContact CD2-CE2 4.43Å; Y269-F273 AromaticContact CE1-CD2 3.64Å; Y269-F273 HydrophobicContact CE1-CD2 3.64Å; Y269-F273 AromaticContact CE1-CE2 3.31Å; Y269-F273 HydrophobicContact CE1-CE2 3.31Å; Y269-F273 HydrophobicContact CE1-CZ 4.44Å; Y269-F273 AromaticContact CE2-CE2 3.9Å; Y269-F273 HydrophobicContact CE2-CE2 3.9Å; Y269-F273 HydrophobicContact CG-CE2 4.45Å; Y269-F273 AromaticContact CZ-CE2 3.3Å; Y269-F273 WeakPolarHBondContact O-CD2 3.41Å; Y269-F273 PolarHBondContact O-N 3.23Å; Y269-F273 WeakPolarHBondContact OH-CE2 3.45Å; G270-F273 PolarHBondContact O-N 2.92Å; F273-S275 VanDerWaalsContact C-N 3.27Å; F273-S275 PolarHBondContact O-N 3.12Å; F273-L276 PolarHBondContact O-N 3.03Å; F273-A277 VanDerWaalsContact O-CB 3.28Å; F273-A277 WeakPolarHBondContact O-CB 3.3Å; F273-A277 PolarHBondContact O-N 2.73Å; F273-P285 HydrophobicContact CD1-CB 4.27Å; F273-P285 HydrophobicContact CE1-CB 3.67Å; F273-P285 HydrophobicContact CE1-CG 4.19Å; F273-V288 HydrophobicContact CE1-CG2 4.29Å; F273-V288 HydrophobicContact CE2-CG2 3.73Å; F273-V288 HydrophobicContact CZ-CB 4.38Å; F273-V288 HydrophobicContact CZ-CG2 3.37Å
274	W	86.6	Confident	83.9	Confident	217 Å²	217	77.4 Å²	77.4	82%	0.822	41%	0.41	S	S	*	.	H	α-helix	trans	-58.4	-42.6	174.6	-175.2	-92	0	0	0	111.9	G270 A271 L272 P278	G270-W274 PolarHBondContact O-N 3.25Å; A271-W274 PolarHBondContact O-N 3.01Å; L272-W274 VanDerWaalsContact C-N 3.31Å; L272-W274 PolarHBondContact O-N 2.89Å; W274-P278 WeakPolarHBondContact O-CD 3.41Å
275	S	83.2	Confident	83.5	Confident	43 Å²	43	77.2 Å²	77.2	30%	0.301	42%	0.415	S	S	.	.	H	α-helix	trans	-75.6	-31.5	-178.9	-51.5	0	0	0	0	112.8	A271 L272 F273 P278	A271-S275 WeakPolarHBondContact O-CB 3.42Å; A271-S275 PolarHBondContact O-N 3.26Å; A271-S275 PolarHBondContact O-OG 3.5Å; L272-S275 PolarHBondContact O-N 3Å; L272-S275 VanDerWaalsContact O-N 3.11Å; F273-S275 VanDerWaalsContact C-N 3.27Å; F273-S275 PolarHBondContact O-N 3.12Å; S275-P278 WeakPolarHBondContact O-CD 3.31Å
276	L	81.8	Confident	83.3	Confident	1 Å²	1	77 Å²	77	1%	0.005	42%	0.415	C	S	.	.	H	α-helix	trans	-84.6	-23.4	178.3	-65.5	-173.5	0	0	0	113.8	F240 I252 L272 F273 P278 L279 I280	F240-L276 HydrophobicContact CD1-CD2 4.3Å; F240-L276 HydrophobicContact CD2-CD2 3.79Å; F240-L276 HydrophobicContact CE1-CD1 4.27Å; F240-L276 HydrophobicContact CE1-CD2 3.85Å; F240-L276 HydrophobicContact CE2-CD2 3.29Å; F240-L276 HydrophobicContact CG-CD2 4.28Å; F240-L276 HydrophobicContact CZ-CD1 3.95Å; F240-L276 HydrophobicContact CZ-CD2 3.32Å; F240-L276 HydrophobicContact CZ-CG 4.29Å; I252-L276 HydrophobicContact CD1-CD1 3.59Å; L272-L276 HydrophobicContact CD1-CD1 3.68Å; L272-L276 HydrophobicContact CD1-CG 3.91Å; L272-L276 HydrophobicContact CD2-CD1 4.5Å; L272-L276 HydrophobicContact CG-CD1 3.85Å; L272-L276 HydrophobicContact CG-CG 4.27Å; L272-L276 WeakPolarHBondContact O-CB 3.28Å; L272-L276 VanDerWaalsContact O-CG 3.31Å; L272-L276 WeakPolarHBondContact O-CG 3.32Å; L272-L276 PolarHBondContact O-N 3.02Å; F273-L276 PolarHBondContact O-N 3.03Å; L276-P278 VanDerWaalsContact C-CD 3.46Å; L276-P278 VanDerWaalsContact C-N 3.35Å; L276-L279 HydrophobicContact CD2-CD1 4.2Å; L276-L279 WeakPolarHBondContact O-CA 3.39Å; L276-L279 WeakPolarHBondContact O-CB 3.49Å; L276-L279 PolarHBondContact O-N 2.64Å; L276-I280 HydrophobicContact CB-CD1 3.84Å; L276-I280 HydrophobicContact CB-CG1 4.34Å; L276-I280 HydrophobicContact CD1-CD1 4.15Å; L276-I280 PolarHBondContact O-N 3.5Å
277	A	83.6	Confident	83.4	Confident	66 Å²	66	76 Å²	76	55%	0.545	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-44.9	179.6	0	0	0	0	0	114.5	F273 L279	F273-A277 VanDerWaalsContact O-CB 3.28Å; F273-A277 WeakPolarHBondContact O-CB 3.3Å; F273-A277 PolarHBondContact O-N 2.73Å; A277-L279 VanDerWaalsContact C-N 3.26Å; A277-L279 PolarHBondContact O-N 2.83Å
278	P	84.2	Confident	83.5	Confident	109 Å²	109	68 Å²	68	71%	0.708	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-17.8	177.2	27.3	-34.2	0	0	0	113.9	W274 S275 L276	W274-P278 WeakPolarHBondContact O-CD 3.41Å; S275-P278 WeakPolarHBondContact O-CD 3.31Å; L276-P278 VanDerWaalsContact C-CD 3.46Å; L276-P278 VanDerWaalsContact C-N 3.35Å
279	L	80.4	Confident	83.9	Confident	25 Å²	25	67 Å²	67	13%	0.131	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-24.5	-174.8	-57.4	173.8	0	0	0	112.5	V232 E237 F240 L276 A277	V232-L279 HydrophobicContact CG1-CD1 4.29Å; E237-L279 HydrophobicContact CB-CD1 4.44Å; E237-L279 HydrophobicContact CB-CD2 4.07Å; E237-L279 HydrophobicContact CG-CD1 4.15Å; E237-L279 HydrophobicContact CG-CD2 4.09Å; F240-L279 HydrophobicContact CB-CB 3.85Å; F240-L279 HydrophobicContact CB-CD1 3.99Å; F240-L279 HydrophobicContact CB-CG 4.4Å; F240-L279 HydrophobicContact CD2-CD1 4.04Å; F240-L279 HydrophobicContact CG-CB 4.35Å; F240-L279 HydrophobicContact CG-CD1 4.17Å; L276-L279 HydrophobicContact CD2-CD1 4.2Å; L276-L279 WeakPolarHBondContact O-CA 3.39Å; L276-L279 WeakPolarHBondContact O-CB 3.49Å; L276-L279 PolarHBondContact O-N 2.64Å; A277-L279 VanDerWaalsContact C-N 3.26Å; A277-L279 PolarHBondContact O-N 2.83Å
280	I	78.1	Confident	84.2	Confident	24 Å²	24	63.8 Å²	63.8	12%	0.123	36%	0.358	C	S	.	.			trans	-102.8	109.4	-176	-63.7	-178.1	0	0	0	109.3	F240 L276 V282 P286	F240-I280 HydrophobicContact CD1-CG1 4.46Å; F240-I280 HydrophobicContact CE1-CD1 4.49Å; L276-I280 HydrophobicContact CB-CD1 3.84Å; L276-I280 HydrophobicContact CB-CG1 4.34Å; L276-I280 HydrophobicContact CD1-CD1 4.15Å; L276-I280 PolarHBondContact O-N 3.5Å; I280-V282 VanDerWaalsContact C-N 3.35Å; I280-V282 HydrophobicContact CG2-CG2 3.3Å; I280-V282 PolarHBondContact O-N 3.4Å; I280-P286 HydrophobicContact CD1-CG 4.02Å
281	N	74.8	Confident	84.5	Confident	124 Å²	124	62 Å²	62	66%	0.663	34%	0.339	S	S	*	.			trans	-97.3	50.4	-177.2	-170.1	50.1	0	0	0	112.1
282	V	76.5	Confident	84.8	Confident	60 Å²	60	59.5 Å²	59.5	36%	0.364	32%	0.318	S	S	.	.	S	Bend	trans	-130.9	152.5	176.7	-69	0	0	0	0	111.5	E247 I280 E284	E247-V282 HydrophobicContact CB-CG1 3.87Å; E247-V282 HydrophobicContact CB-CG2 4.22Å; E247-V282 HydrophobicContact CG-CG1 3.73Å; E247-V282 HydrophobicContact CG-CG2 4.2Å; I280-V282 VanDerWaalsContact C-N 3.35Å; I280-V282 HydrophobicContact CG2-CG2 3.3Å; I280-V282 PolarHBondContact O-N 3.4Å; V282-E284 VanDerWaalsContact C-N 3.34Å; V282-E284 WeakPolarHBondContact CG2-O 3.37Å
283	T	73.8	Confident	85.1	Confident	146 Å²	146	59.4 Å²	59.4	90%	0.896	32%	0.318	S	S	*	.	S	Bend	trans	-70.6	-31.8	179.9	49.3	0	0	0	0	112.6
284	E	75.8	Confident	85.3	Confident	159 Å²	159	60 Å²	60	74%	0.743	32%	0.319	S	S	*	.	S	Bend	trans	-113.1	117	178.1	-67.4	-178.2	-179.4	0	0	108.8	V282	V282-E284 VanDerWaalsContact C-N 3.34Å; V282-E284 WeakPolarHBondContact CG2-O 3.37Å
285	P	78.7	Confident	85.5	Confident	80 Å²	80	50.3 Å²	50.3	52%	0.519	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-67	152.7	-179.6	25.3	-32	0	0	0	111.9	F273	F273-P285 HydrophobicContact CD1-CB 4.27Å; F273-P285 HydrophobicContact CE1-CB 3.67Å; F273-P285 HydrophobicContact CE1-CG 4.19Å
286	P	85.8	Confident	85.8	Confident	12 Å²	12	52.8 Å²	52.8	8%	0.078	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-57	145.8	172.6	-23.1	33.1	0	0	0	112.4	I250 I252 I280 V288	I250-P286 HydrophobicContact CB-CB 4.37Å; I250-P286 HydrophobicContact CB-CG 4.42Å; I250-P286 HydrophobicContact CG2-CB 4.18Å; I250-P286 HydrophobicContact CG2-CG 4.35Å; I252-P286 HydrophobicContact CD1-CB 4.07Å; I252-P286 HydrophobicContact CD1-CG 4.42Å; I252-P286 HydrophobicContact CG1-CB 4.3Å; I280-P286 HydrophobicContact CD1-CG 4.02Å; P286-V288 PolarHBondContact O-N 3.27Å
287	R	90.3	Very high	86.2	Confident	105 Å²	105	58 Å²	58	40%	0.396	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-63.8	134.8	175.3	-175.3	166.9	-179.4	176.5	3.5	110.5	I252 Y289 E310 S313	I252-R287 PolarHBondContact N-O 3.15Å; R287-Y289 HydrophobicContact CB-CE2 4.38Å; R287-Y289 WeakPolarHBondContact CD-OH 3.34Å; R287-Y289 HydrophobicContact CG-CE1 4.22Å; R287-Y289 HydrophobicContact CG-CE2 4.02Å; R287-E310 IonicContact NH2-OE1 3.91Å; R287-S313 PolarHBondContact NH2-OG 3.42Å; R287-S313 VanDerWaalsContact NH2-OG 3.08Å
288	V	93.4	Very high	86.5	Confident	10 Å²	10	55.8 Å²	55.8	6%	0.061	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.3	174.9	177.3	0	0	0	0	108.5	I252 L254 Y269 L272 F273 P286 V290	I252-V288 HydrophobicContact CB-CB 4.44Å; I252-V288 HydrophobicContact CB-CG2 3.83Å; I252-V288 HydrophobicContact CD1-CG2 4.21Å; I252-V288 HydrophobicContact CG2-CG1 4.28Å; I252-V288 HydrophobicContact CG2-CG2 3.92Å; I252-V288 CarbonylContact O-C 3.6Å; I252-V288 VanDerWaalsContact O-CA 3.29Å; I252-V288 WeakPolarHBondContact O-CA 3.48Å; L254-V288 HydrophobicContact CD1-CG1 3.98Å; L254-V288 HydrophobicContact CG-CG1 3.83Å; Y269-V288 HydrophobicContact CD2-CG1 4.05Å; Y269-V288 HydrophobicContact CE2-CB 3.74Å; Y269-V288 HydrophobicContact CE2-CG1 3.65Å; Y269-V288 HydrophobicContact CE2-CG2 4.35Å; L272-V288 HydrophobicContact CD2-CG2 4.37Å; F273-V288 HydrophobicContact CE1-CG2 4.29Å; F273-V288 HydrophobicContact CE2-CG2 3.73Å; F273-V288 HydrophobicContact CZ-CB 4.38Å; F273-V288 HydrophobicContact CZ-CG2 3.37Å; P286-V288 PolarHBondContact O-N 3.27Å; V288-V290 HydrophobicContact CG1-CG2 4.13Å
289	Y	96	Very high	86.8	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	138.6	172.9	-56.2	-90.7	0	0	0	109.9	R251 I252 L254 R287 E310 L314 D317	R251-Y289 HydrophobicContact CB-CD2 4.35Å; R251-Y289 HydrophobicContact CB-CE2 3.81Å; R251-Y289 HydrophobicContact CG-CE2 3.93Å; I252-Y289 PolarHBondContact O-N 3.08Å; L254-Y289 PolarHBondContact N-O 3.02Å; R287-Y289 HydrophobicContact CB-CE2 4.38Å; R287-Y289 WeakPolarHBondContact CD-OH 3.34Å; R287-Y289 HydrophobicContact CG-CE1 4.22Å; R287-Y289 HydrophobicContact CG-CE2 4.02Å; Y289-E310 WeakPolarHBondContact CA-OE2 3.48Å; Y289-E310 WeakPolarHBondContact CD1-O 3.49Å; Y289-E310 WeakPolarHBondContact CD1-OE2 3.47Å; Y289-L314 HydrophobicContact CD1-CB 3.84Å; Y289-L314 HydrophobicContact CD1-CD1 4.36Å; Y289-L314 HydrophobicContact CD2-CB 4.44Å; Y289-L314 HydrophobicContact CD2-CD1 3.44Å; Y289-L314 VanDerWaalsContact CD2-CD1 3.44Å; Y289-L314 HydrophobicContact CE1-CB 3.96Å; Y289-L314 HydrophobicContact CE1-CD1 4.38Å; Y289-L314 HydrophobicContact CE2-CD1 3.47Å; Y289-L314 VanDerWaalsContact CE2-CD1 3.47Å; Y289-L314 HydrophobicContact CG-CB 4.07Å; Y289-L314 HydrophobicContact CG-CD1 3.89Å; Y289-D317 PolarHBondContact OH-OD1 3.06Å; Y289-D317 PolarHBondContact OH-OD2 3.36Å
290	V	95.1	Very high	86.8	Confident	16 Å²	16	59.3 Å²	59.3	10%	0.097	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	109	-174	-170.1	0	0	0	0	109.7	L254 A257 L265 Y269 V288 F307	L254-V290 HydrophobicContact CB-CG1 4.27Å; L254-V290 HydrophobicContact CB-CG2 4.24Å; L254-V290 HydrophobicContact CD1-CG2 4.07Å; A257-V290 HydrophobicContact CB-CG1 3.56Å; L265-V290 HydrophobicContact CD1-CG1 3.77Å; L265-V290 HydrophobicContact CD2-CG1 3.71Å; L265-V290 HydrophobicContact CG-CG1 4.06Å; Y269-V290 HydrophobicContact CD2-CG2 4.22Å; Y269-V290 HydrophobicContact CE2-CG2 4.32Å; V288-V290 HydrophobicContact CG1-CG2 4.13Å; V290-F307 HydrophobicContact CG1-CE1 4.13Å; V290-F307 WeakPolarHBondContact O-CD1 3.04Å
291	S	95.1	Very high	87.1	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	-167.5	-173.8	-178.9	-169.3	0	0	0	0	111.1	L254 N255 K256 A257 Y298 F307	L254-S291 PolarHBondContact O-N 3.02Å; N255-S291 CarbonylContact C-O 3.59Å; N255-S291 VanDerWaalsContact CA-O 3.28Å; N255-S291 WeakPolarHBondContact CA-O 3.45Å; K256-S291 PolarHBondContact N-O 3.5Å; K256-S291 VanDerWaalsContact N-O 3.13Å; A257-S291 PolarHBondContact N-O 3.42Å; S291-Y298 PolarHBondContact OG-OH 3.33Å; S291-F307 PolarHBondContact OG-O 3.03Å
292	S	94.3	Very high	87.6	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.			trans	-123.2	106.9	172.2	-60.6	0	0	0	0	109.9	R33 K256 A257 D258 W294	R33-S292 PolarHBondContact NH2-O 3.4Å; K256-S292 VanDerWaalsContact C-OG 3.31Å; K256-S292 VanDerWaalsContact CA-OG 3.23Å; K256-S292 WeakPolarHBondContact CA-OG 3.4Å; A257-S292 PolarHBondContact N-OG 3.3Å; D258-S292 PolarHBondContact N-OG 3.02Å; D258-S292 WeakPolarHBondContact OD1-CB 3.12Å; D258-S292 PolarHBondContact OD1-OG 3.39Å; S292-W294 PolarHBondContact O-N 3.25Å; S292-W294 VanDerWaalsContact O-N 3.11Å
293	F	93.8	Very high	88.2	Confident	1 Å²	1	63 Å²	63	0%	0.004	32%	0.323	C	S	.	.			trans	-91.2	67.9	-169.7	-62.8	-92.8	0	0	0	112	M109 Y112 I253 N255 E311 L314	M109-F293 HydrophobicContact CB-CB 4.08Å; M109-F293 HydrophobicContact CE-CB 4.48Å; M109-F293 HydrophobicContact CE-CD1 3.72Å; M109-F293 HydrophobicContact CE-CD2 4.46Å; M109-F293 HydrophobicContact CE-CE1 4.02Å; M109-F293 HydrophobicContact CE-CG 3.97Å; M109-F293 HydrophobicContact CG-CB 3.72Å; M109-F293 HydrophobicContact CG-CG 4.2Å; M109-F293 HydrophobicContact SD-CB 4.08Å; M109-F293 HydrophobicContact SD-CD1 4.36Å; M109-F293 HydrophobicContact SD-CD2 4.31Å; M109-F293 HydrophobicContact SD-CG 3.99Å; Y112-F293 HydrophobicContact CD1-CB 4.12Å; I253-F293 HydrophobicContact CG2-CD2 3.76Å; I253-F293 HydrophobicContact CG2-CE2 3.28Å; I253-F293 HydrophobicContact CG2-CZ 4.04Å; N255-F293 PolarHBondContact OD1-N 2.93Å; F293-E311 HydrophobicContact CD1-CG 4.3Å; F293-E311 HydrophobicContact CE1-CB 4.28Å; F293-E311 HydrophobicContact CE1-CG 3.92Å; F293-L314 HydrophobicContact CD1-CD2 4.25Å; F293-L314 HydrophobicContact CE1-CD2 3.41Å; F293-L314 VanDerWaalsContact CE1-CD2 3.41Å; F293-L314 HydrophobicContact CZ-CD2 3.7Å
294	W	90.7	Very high	89	Confident	62 Å²	62	61.3 Å²	61.3	24%	0.235	31%	0.305	C	S	.	.	S	Bend	trans	-148.7	161.2	179.3	67.1	-9.2	0	0	0	111	R33 T108 Y112 S292 Q296	R33-W294 PolarHBondContact NE-O 3.02Å; R33-W294 PolarHBondContact NH2-O 2.86Å; T108-W294 HydrophobicContact CG2-CB 3.98Å; Y112-W294 VanDerWaalsContact CD2-C 3.41Å; Y112-W294 WeakPolarHBondContact CE2-O 3.49Å; S292-W294 PolarHBondContact O-N 3.25Å; S292-W294 VanDerWaalsContact O-N 3.11Å; W294-Q296 HydrophobicContact CD2-CB 4.19Å; W294-Q296 HydrophobicContact CD2-CG 4.45Å; W294-Q296 HydrophobicContact CG-CB 4.41Å; W294-Q296 VanDerWaalsContact CH2-OE1 3.23Å; W294-Q296 HydrophobicContact CZ2-CB 4.38Å; W294-Q296 PolarHBondContact O-N 3.22Å
295	P	89.5	Confident	89.7	Confident	13 Å²	13	60.6 Å²	60.6	8%	0.084	30%	0.301	C	S	.	.	S	Bend	trans	-76.7	-8.9	-172	35.4	-42.1	0	0	0	113.9	L32 R33 Y112 E117	L32-P295 CarbonylContact C-O 3.59Å; L32-P295 WeakPolarHBondContact CA-O 3.34Å; L32-P295 HydrophobicContact CD2-CB 4.05Å; L32-P295 HydrophobicContact CD2-CG 4.3Å; R33-P295 PolarHBondContact N-O 3.45Å; Y112-P295 HydrophobicContact CD2-CB 4.24Å; E117-P295 HydrophobicContact CG-CB 4.37Å; E117-P295 HydrophobicContact CG-CG 3.76Å; E117-P295 VanDerWaalsContact OE1-CD 3.31Å; E117-P295 WeakPolarHBondContact OE1-CD 3.22Å
296	Q	89.9	Confident	90.3	Very high	95 Å²	95	60.6 Å²	60.6	44%	0.444	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-72.4	149.4	-179.6	-62.4	179.6	-1.6	0	0	111.6	R33 W294	R33-Q296 VanDerWaalsContact CD-O 3.22Å; R33-Q296 WeakPolarHBondContact CD-O 3.33Å; R33-Q296 WeakPolarHBondContact CG-O 3.27Å; R33-Q296 PolarHBondContact NE-O 3.26Å; W294-Q296 HydrophobicContact CD2-CB 4.19Å; W294-Q296 HydrophobicContact CD2-CG 4.45Å; W294-Q296 HydrophobicContact CG-CB 4.41Å; W294-Q296 VanDerWaalsContact CH2-OE1 3.23Å; W294-Q296 HydrophobicContact CZ2-CB 4.38Å; W294-Q296 PolarHBondContact O-N 3.22Å
297	E	90.1	Very high	90.7	Very high	111 Å²	111	60.3 Å²	60.3	52%	0.519	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-56.9	148.3	171.2	-83.1	-172.3	178.2	0	0	112.1	P31 R33	P31-E297 HydrophobicContact CG-CG 4.47Å; P31-E297 WeakPolarHBondContact CG-OE1 3.34Å; R33-E297 HydrophobicContact CG-CG 4.21Å
298	Y	90.9	Very high	90.8	Very high	19 Å²	19	58.6 Å²	58.6	8%	0.075	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-66.2	145.2	174	-63.4	-54.9	0	0	0	110.3	R33 D258 S291 Q304 F307 E311	R33-Y298 VanDerWaalsContact NH1-CZ 3.32Å; R33-Y298 PolarHBondContact NH1-OH 3.44Å; D258-Y298 HydrophobicContact CB-CD1 4.29Å; S291-Y298 PolarHBondContact OG-OH 3.33Å; Y298-Q304 HydrophobicContact CD2-CB 3.96Å; Y298-Q304 HydrophobicContact CD2-CG 3.86Å; Y298-Q304 HydrophobicContact CE2-CB 4.46Å; Y298-Q304 HydrophobicContact CG-CG 4.46Å; Y298-F307 AromaticContact CD1-CD2 3.96Å; Y298-F307 HydrophobicContact CD1-CD2 3.96Å; Y298-F307 HydrophobicContact CE1-CB 4.14Å; Y298-F307 AromaticContact CE1-CD2 3.78Å; Y298-F307 HydrophobicContact CE1-CD2 3.78Å; Y298-F307 HydrophobicContact CE1-CG 4.49Å; Y298-F307 HydrophobicContact CE2-CB 4Å; Y298-E311 PolarHBondContact OH-OE2 3.37Å
299	K	89.1	Confident	90.9	Very high	94 Å²	94	62.8 Å²	62.8	41%	0.409	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-55	147.9	173.8	-73.5	-178.1	170.3	-171.5	0	112.4	D258 N259 T302	D258-K299 HydrophobicContact CB-CB 4.38Å; D258-K299 WeakPolarHBondContact O-CD 3.38Å; N259-K299 WeakPolarHBondContact OD1-CE 3.34Å; N259-K299 PolarHBondContact OD1-NZ 3.3Å; K299-T302 VanDerWaalsContact O-CB 3.26Å; K299-T302 WeakPolarHBondContact O-CB 3.25Å; K299-T302 PolarHBondContact O-N 3.15Å; K299-T302 PolarHBondContact O-OG1 2.93Å
300	P	82	Confident	90.8	Very high	114 Å²	114	64.5 Å²	64.5	74%	0.74	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	147	172	25.2	-33.5	0	0	0	109.8	T302	P300-T302 VanDerWaalsContact C-N 3.3Å; P300-T302 PolarHBondContact O-N 3.26Å
301	D	83.2	Confident	90.8	Very high	162 Å²	162	63.8 Å²	63.8	87%	0.866	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	7.3	-175.5	-49.2	-41.4	0	0	0	116.7
302	T	86.8	Confident	90.9	Very high	23 Å²	23	66 Å²	66	14%	0.141	33%	0.326	C	S	.	.	S	Bend	trans	-81.3	144.1	172.8	-51.9	0	0	0	0	111.6	D258 K299 P300 Q304 F307	D258-T302 HydrophobicContact CB-CG2 4.08Å; K299-T302 VanDerWaalsContact O-CB 3.26Å; K299-T302 WeakPolarHBondContact O-CB 3.25Å; K299-T302 PolarHBondContact O-N 3.15Å; K299-T302 PolarHBondContact O-OG1 2.93Å; P300-T302 VanDerWaalsContact C-N 3.3Å; P300-T302 PolarHBondContact O-N 3.26Å; T302-Q304 VanDerWaalsContact C-N 3.26Å; T302-Q304 PolarHBondContact O-N 3.21Å; T302-F307 HydrophobicContact CG2-CD2 3.45Å; T302-F307 VanDerWaalsContact CG2-CD2 3.45Å; T302-F307 HydrophobicContact CG2-CE1 4.41Å; T302-F307 HydrophobicContact CG2-CE2 3.13Å; T302-F307 HydrophobicContact CG2-CG 4.23Å; T302-F307 HydrophobicContact CG2-CZ 3.67Å
303	H	87.4	Confident	91	Very high	102 Å²	102	67 Å²	67	47%	0.472	33%	0.333	S	S	.	.			trans	-73.5	77.3	169.8	-66.1	-66.1	0	0	0	111.2	T262 E305 L306 F307	T262-H303 WeakPolarHBondContact CG2-NE2 3.07Å; T262-H303 PolarHBondContact OG1-CD2 3.01Å; T262-H303 PolarHBondContact OG1-NE2 3.47Å; H303-E305 VanDerWaalsContact C-N 3.31Å; H303-E305 PolarHBondContact O-N 2.92Å; H303-L306 HydrophobicContact CB-CB 4Å; H303-L306 HydrophobicContact CB-CD2 4.49Å; H303-L306 PolarHBondContact O-N 3.35Å; H303-F307 PolarHBondContact O-N 3.47Å; H303-F307 VanDerWaalsContact O-N 3.13Å
304	Q	90.4	Very high	91.1	Very high	110 Å²	110	67 Å²	67	51%	0.514	33%	0.333	S	S	.	.	H	α-helix	trans	-57.1	-40.6	-173.5	-58.5	-174.5	-8.6	0	0	113.2	Y298 T302 F307 L308	Y298-Q304 HydrophobicContact CD2-CB 3.96Å; Y298-Q304 HydrophobicContact CD2-CG 3.86Å; Y298-Q304 HydrophobicContact CE2-CB 4.46Å; Y298-Q304 HydrophobicContact CG-CG 4.46Å; T302-Q304 VanDerWaalsContact C-N 3.26Å; T302-Q304 PolarHBondContact O-N 3.21Å; Q304-F307 PolarHBondContact O-N 3.43Å; Q304-L308 WeakPolarHBondContact O-CB 3.21Å; Q304-L308 PolarHBondContact O-N 3.32Å
305	E	91.3	Very high	91.4	Very high	143 Å²	143	64.1 Å²	64.1	67%	0.668	32%	0.323	S	S	*	.	H	α-helix	trans	-63.2	-44.1	179	-175.5	175.2	-172.6	0	0	111.9	H303 F307 L308 Q309	H303-E305 VanDerWaalsContact C-N 3.31Å; H303-E305 PolarHBondContact O-N 2.92Å; E305-F307 PolarHBondContact O-N 2.95Å; E305-L308 PolarHBondContact O-N 3.01Å; E305-Q309 WeakPolarHBondContact O-CB 3.41Å; E305-Q309 WeakPolarHBondContact O-CG 3.32Å; E305-Q309 PolarHBondContact O-N 3.09Å
306	L	91.3	Very high	91.6	Very high	81 Å²	81	66.8 Å²	66.8	42%	0.424	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-47	176.2	176.7	66.7	0	0	0	110.8	H303 L308 Q309 E310	H303-L306 HydrophobicContact CB-CB 4Å; H303-L306 HydrophobicContact CB-CD2 4.49Å; H303-L306 PolarHBondContact O-N 3.35Å; L306-L308 VanDerWaalsContact C-N 3.31Å; L306-L308 PolarHBondContact O-N 3.44Å; L306-Q309 PolarHBondContact O-N 2.74Å; L306-E310 HydrophobicContact CD1-CG 4.38Å; L306-E310 WeakPolarHBondContact O-CG 3.36Å; L306-E310 PolarHBondContact O-N 3.08Å
307	F	93.8	Very high	91.9	Very high	5 Å²	5	63.2 Å²	63.2	2%	0.022	32%	0.318	C	S	.	.	H	α-helix	trans	-65.7	-36.2	-178.1	-77.5	14.4	0	0	0	112.2	A257 D258 L265 V290 S291 Y298 T302 H303 Q304 E305 E311	A257-F307 HydrophobicContact CB-CE1 4.26Å; A257-F307 HydrophobicContact CB-CE2 3.86Å; A257-F307 HydrophobicContact CB-CZ 3.49Å; A257-F307 VanDerWaalsContact CB-CZ 3.49Å; D258-F307 HydrophobicContact CB-CE2 4.03Å; L265-F307 HydrophobicContact CD2-CE1 4.06Å; L265-F307 HydrophobicContact CD2-CZ 4.04Å; V290-F307 HydrophobicContact CG1-CE1 4.13Å; V290-F307 WeakPolarHBondContact O-CD1 3.04Å; S291-F307 PolarHBondContact OG-O 3.03Å; Y298-F307 AromaticContact CD1-CD2 3.96Å; Y298-F307 HydrophobicContact CD1-CD2 3.96Å; Y298-F307 HydrophobicContact CE1-CB 4.14Å; Y298-F307 AromaticContact CE1-CD2 3.78Å; Y298-F307 HydrophobicContact CE1-CD2 3.78Å; Y298-F307 HydrophobicContact CE1-CG 4.49Å; Y298-F307 HydrophobicContact CE2-CB 4Å; T302-F307 HydrophobicContact CG2-CD2 3.45Å; T302-F307 VanDerWaalsContact CG2-CD2 3.45Å; T302-F307 HydrophobicContact CG2-CE1 4.41Å; T302-F307 HydrophobicContact CG2-CE2 3.13Å; T302-F307 HydrophobicContact CG2-CG 4.23Å; T302-F307 HydrophobicContact CG2-CZ 3.67Å; H303-F307 PolarHBondContact O-N 3.47Å; H303-F307 VanDerWaalsContact O-N 3.13Å; Q304-F307 PolarHBondContact O-N 3.43Å; E305-F307 PolarHBondContact O-N 2.95Å; F307-E311 VanDerWaalsContact O-CB 3.3Å; F307-E311 WeakPolarHBondContact O-CB 3.37Å; F307-E311 PolarHBondContact O-N 3.29Å
308	L	93	Very high	92.1	Very high	70 Å²	70	58 Å²	58	37%	0.366	29%	0.293	S	S	.	.	H	α-helix	trans	-67.2	-42.7	173.5	-177.4	62.9	0	0	0	111.6	Q304 E305 L306 E311 I312	Q304-L308 WeakPolarHBondContact O-CB 3.21Å; Q304-L308 PolarHBondContact O-N 3.32Å; E305-L308 PolarHBondContact O-N 3.01Å; L306-L308 VanDerWaalsContact C-N 3.31Å; L306-L308 PolarHBondContact O-N 3.44Å; L308-E311 PolarHBondContact O-N 3.39Å; L308-I312 HydrophobicContact CD1-CD1 4.4Å; L308-I312 HydrophobicContact CG-CD1 4.08Å; L308-I312 VanDerWaalsContact O-CG1 3.29Å; L308-I312 WeakPolarHBondContact O-CG1 3.48Å; L308-I312 PolarHBondContact O-N 3.07Å
309	Q	94.5	Very high	92.3	Very high	98 Å²	98	57.7 Å²	57.7	46%	0.458	29%	0.293	S	S	.	.	H	α-helix	trans	-64.4	-39.2	176.7	-74	178.6	0.8	0	0	112.4	E305 L306 I312 S313	E305-Q309 WeakPolarHBondContact O-CB 3.41Å; E305-Q309 WeakPolarHBondContact O-CG 3.32Å; E305-Q309 PolarHBondContact O-N 3.09Å; L306-Q309 PolarHBondContact O-N 2.74Å; Q309-I312 PolarHBondContact O-N 3.38Å; Q309-S313 WeakPolarHBondContact O-CB 3.21Å; Q309-S313 PolarHBondContact O-N 3.11Å; Q309-S313 PolarHBondContact O-OG 3.41Å
310	E	95.7	Very high	92.4	Very high	36 Å²	36	58.3 Å²	58.3	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-39.6	174	-73.9	-59.6	124.1	0	0	111.7	R287 Y289 L306 S313 L314	R287-E310 IonicContact NH2-OE1 3.91Å; Y289-E310 WeakPolarHBondContact CA-OE2 3.48Å; Y289-E310 WeakPolarHBondContact CD1-O 3.49Å; Y289-E310 WeakPolarHBondContact CD1-OE2 3.47Å; L306-E310 HydrophobicContact CD1-CG 4.38Å; L306-E310 WeakPolarHBondContact O-CG 3.36Å; L306-E310 PolarHBondContact O-N 3.08Å; E310-S313 PolarHBondContact O-N 3.43Å; E310-L314 PolarHBondContact O-N 3.29Å
311	E	95.1	Very high	92.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-46.6	173.7	-173.1	179.6	158.1	0	0	111.5	R33 H37 Y112 F293 Y298 F307 L308 S313 L314 L315	R33-E311 IonicContact CZ-OE2 3.27Å; R33-E311 IonicContact NH1-OE2 3.79Å; R33-E311 PolarHBondContact NH1-OE2 3.21Å; R33-E311 IonicContact NH2-OE2 3.17Å; H37-E311 IonicContact CD2-OE1 3.89Å; H37-E311 IonicContact CE1-OE1 2.66Å; H37-E311 VanDerWaalsContact NE2-CD 3.31Å; H37-E311 IonicContact NE2-OE1 3.19Å; H37-E311 PolarHBondContact NE2-OE1 3.23Å; H37-E311 IonicContact NE2-OE2 3.01Å; Y112-E311 WeakPolarHBondContact CE1-OE1 3.1Å; Y112-E311 VanDerWaalsContact CZ-OE1 3.26Å; Y112-E311 PolarHBondContact OH-OE1 2.86Å; Y112-E311 PolarHBondContact OH-OE2 3.15Å; F293-E311 HydrophobicContact CD1-CG 4.3Å; F293-E311 HydrophobicContact CE1-CB 4.28Å; F293-E311 HydrophobicContact CE1-CG 3.92Å; Y298-E311 PolarHBondContact OH-OE2 3.37Å; F307-E311 VanDerWaalsContact O-CB 3.3Å; F307-E311 WeakPolarHBondContact O-CB 3.37Å; F307-E311 PolarHBondContact O-N 3.29Å; L308-E311 PolarHBondContact O-N 3.39Å; E311-S313 VanDerWaalsContact C-N 3.35Å; E311-S313 PolarHBondContact O-N 3.18Å; E311-L314 PolarHBondContact O-N 3.33Å; E311-L315 HydrophobicContact CG-CD1 4.31Å; E311-L315 VanDerWaalsContact O-CG 3.27Å; E311-L315 WeakPolarHBondContact O-CG 3.29Å; E311-L315 PolarHBondContact O-N 3.38Å; E311-L315 VanDerWaalsContact O-N 3.1Å
312	I	95.6	Very high	93.3	Very high	47 Å²	47	46.1 Å²	46.1	24%	0.241	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-46.2	175.3	-69.5	165.6	0	0	0	110.6	L308 Q309 L314 L315 E316	L308-I312 HydrophobicContact CD1-CD1 4.4Å; L308-I312 HydrophobicContact CG-CD1 4.08Å; L308-I312 VanDerWaalsContact O-CG1 3.29Å; L308-I312 WeakPolarHBondContact O-CG1 3.48Å; L308-I312 PolarHBondContact O-N 3.07Å; Q309-I312 PolarHBondContact O-N 3.38Å; I312-L314 VanDerWaalsContact C-N 3.29Å; I312-L314 PolarHBondContact O-N 2.95Å; I312-L315 WeakPolarHBondContact O-CB 3.33Å; I312-L315 PolarHBondContact O-N 3.23Å; I312-L315 VanDerWaalsContact O-N 3.1Å; I312-E316 HydrophobicContact CG2-CG 4.39Å; I312-E316 WeakPolarHBondContact O-CG 3.15Å; I312-E316 PolarHBondContact O-N 3.11Å
313	S	96.7	Very high	93.4	Very high	20 Å²	20	46.9 Å²	46.9	14%	0.14	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-37.1	179	-64.3	0	0	0	0	112.6	R287 Q309 E310 E311 D317	R287-S313 PolarHBondContact NH2-OG 3.42Å; R287-S313 VanDerWaalsContact NH2-OG 3.08Å; Q309-S313 WeakPolarHBondContact O-CB 3.21Å; Q309-S313 PolarHBondContact O-N 3.11Å; Q309-S313 PolarHBondContact O-OG 3.41Å; E310-S313 PolarHBondContact O-N 3.43Å; E311-S313 VanDerWaalsContact C-N 3.35Å; E311-S313 PolarHBondContact O-N 3.18Å; S313-D317 PolarHBondContact O-N 2.88Å
314	L	96.4	Very high	93.5	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-65.9	-41.5	175.3	-177.9	76.7	0	0	0	111.3	M109 F222 R251 I253 Y289 F293 E310 E311 I312 E316 D317 L318	M109-L314 HydrophobicContact CE-CD2 3.32Å; F222-L314 HydrophobicContact CD1-CD1 4.37Å; F222-L314 HydrophobicContact CE1-CD1 3.68Å; F222-L314 HydrophobicContact CE1-CG 4.47Å; F222-L314 HydrophobicContact CZ-CD1 3.83Å; F222-L314 HydrophobicContact CZ-CD2 4.45Å; F222-L314 HydrophobicContact CZ-CG 4.12Å; R251-L314 HydrophobicContact CB-CD1 4.46Å; I253-L314 HydrophobicContact CD1-CD1 4Å; I253-L314 HydrophobicContact CD1-CD2 3.84Å; I253-L314 HydrophobicContact CG1-CD1 4.26Å; Y289-L314 HydrophobicContact CD1-CB 3.84Å; Y289-L314 HydrophobicContact CD1-CD1 4.36Å; Y289-L314 HydrophobicContact CD2-CB 4.44Å; Y289-L314 HydrophobicContact CD2-CD1 3.44Å; Y289-L314 VanDerWaalsContact CD2-CD1 3.44Å; Y289-L314 HydrophobicContact CE1-CB 3.96Å; Y289-L314 HydrophobicContact CE1-CD1 4.38Å; Y289-L314 HydrophobicContact CE2-CD1 3.47Å; Y289-L314 VanDerWaalsContact CE2-CD1 3.47Å; Y289-L314 HydrophobicContact CG-CB 4.07Å; Y289-L314 HydrophobicContact CG-CD1 3.89Å; F293-L314 HydrophobicContact CD1-CD2 4.25Å; F293-L314 HydrophobicContact CE1-CD2 3.41Å; F293-L314 VanDerWaalsContact CE1-CD2 3.41Å; F293-L314 HydrophobicContact CZ-CD2 3.7Å; E310-L314 PolarHBondContact O-N 3.29Å; E311-L314 PolarHBondContact O-N 3.33Å; I312-L314 VanDerWaalsContact C-N 3.29Å; I312-L314 PolarHBondContact O-N 2.95Å; L314-E316 VanDerWaalsContact C-N 3.34Å; L314-D317 PolarHBondContact O-N 3.4Å; L314-L318 PolarHBondContact O-N 3.03Å
315	L	96.1	Very high	93.4	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-67.5	-35.1	179	-66.4	165.3	0	0	0	112	I38 T41 L42 L113 E311 I312 L318 N319	I38-L315 HydrophobicContact CB-CD1 4.41Å; I38-L315 HydrophobicContact CG1-CD1 3.99Å; I38-L315 HydrophobicContact CG2-CD2 4.21Å; T41-L315 HydrophobicContact CG2-CB 3.59Å; L42-L315 HydrophobicContact CD1-CD2 4.04Å; L42-L315 HydrophobicContact CD2-CB 4.29Å; L42-L315 HydrophobicContact CD2-CD2 4.17Å; L42-L315 WeakPolarHBondContact CD2-O 3.5Å; L42-L315 HydrophobicContact CG-CD2 4.14Å; L113-L315 HydrophobicContact CD2-CD2 3.61Å; E311-L315 HydrophobicContact CG-CD1 4.31Å; E311-L315 VanDerWaalsContact O-CG 3.27Å; E311-L315 WeakPolarHBondContact O-CG 3.29Å; E311-L315 PolarHBondContact O-N 3.38Å; E311-L315 VanDerWaalsContact O-N 3.1Å; I312-L315 WeakPolarHBondContact O-CB 3.33Å; I312-L315 PolarHBondContact O-N 3.23Å; I312-L315 VanDerWaalsContact O-N 3.1Å; L315-L318 PolarHBondContact O-N 3.43Å; L315-N319 WeakPolarHBondContact O-CB 3.4Å; L315-N319 PolarHBondContact O-N 3.5Å
316	E	95.1	Very high	93.3	Very high	69 Å²	69	34.4 Å²	34.4	32%	0.322	17%	0.17	S	C	.	.	H	α-helix	trans	-63	-45.4	173.4	-73.5	-179.5	158.7	0	0	111.5	T41 I312 L314 L318 N319 Q320	T41-E316 HydrophobicContact CG2-CG 3.71Å; I312-E316 HydrophobicContact CG2-CG 4.39Å; I312-E316 WeakPolarHBondContact O-CG 3.15Å; I312-E316 PolarHBondContact O-N 3.11Å; L314-E316 VanDerWaalsContact C-N 3.34Å; E316-L318 PolarHBondContact O-N 2.92Å; E316-N319 PolarHBondContact O-N 3.3Å; E316-Q320 WeakPolarHBondContact O-CB 3.24Å; E316-Q320 PolarHBondContact O-N 3.31Å
317	D	94.5	Very high	93.3	Very high	20 Å²	20	33.6 Å²	33.6	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-42.7	175.1	-89.3	48.3	0	0	0	111.9	R251 Y289 S313 L314 Q320 V321	R251-D317 IonicContact CZ-OD2 3.81Å; R251-D317 IonicContact NE-OD2 2.94Å; R251-D317 PolarHBondContact NE-OD2 3.02Å; R251-D317 IonicContact NH2-OD2 3.66Å; R251-D317 PolarHBondContact NH2-OD2 3.11Å; Y289-D317 PolarHBondContact OH-OD1 3.06Å; Y289-D317 PolarHBondContact OH-OD2 3.36Å; S313-D317 PolarHBondContact O-N 2.88Å; L314-D317 PolarHBondContact O-N 3.4Å; D317-Q320 PolarHBondContact O-N 2.65Å; D317-V321 PolarHBondContact O-N 2.87Å
318	L	95.5	Very high	93.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-48	173	174.1	58.7	0	0	0	111.1	L42 V96 F188 L220 L314 L315 E316 Q320 V321 I322	L42-L318 HydrophobicContact CD1-CD2 4.46Å; L42-L318 HydrophobicContact CD2-CB 4.48Å; L42-L318 HydrophobicContact CD2-CD2 4.06Å; L42-L318 HydrophobicContact CD2-CG 4.2Å; V96-L318 HydrophobicContact CG2-CD1 3.59Å; F188-L318 HydrophobicContact CE1-CD2 4.48Å; F188-L318 HydrophobicContact CZ-CD2 4.24Å; L220-L318 HydrophobicContact CD2-CB 4.29Å; L220-L318 HydrophobicContact CD2-CD1 3.91Å; L314-L318 PolarHBondContact O-N 3.03Å; L315-L318 PolarHBondContact O-N 3.43Å; E316-L318 PolarHBondContact O-N 2.92Å; L318-Q320 VanDerWaalsContact C-N 3.31Å; L318-Q320 PolarHBondContact O-N 3.09Å; L318-V321 PolarHBondContact O-N 2.98Å; L318-I322 HydrophobicContact CD1-CD1 4.04Å; L318-I322 HydrophobicContact CD1-CG1 4.37Å; L318-I322 HydrophobicContact CG-CD1 4.04Å; L318-I322 WeakPolarHBondContact O-CG1 3.36Å; L318-I322 PolarHBondContact O-N 3.03Å; L318-I322 VanDerWaalsContact O-N 3.15Å
319	N	93.8	Very high	93.1	Very high	12 Å²	12	34 Å²	34	6%	0.064	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-40.8	179.5	-167.6	38.6	0	0	0	111.2	T41 L42 R185 L315 E316 V321 I322 E323	T41-N319 PolarHBondContact O-ND2 3.36Å; L42-N319 HydrophobicContact CD2-CB 4.14Å; R185-N319 PolarHBondContact NH2-OD1 3.13Å; L315-N319 WeakPolarHBondContact O-CB 3.4Å; L315-N319 PolarHBondContact O-N 3.5Å; E316-N319 PolarHBondContact O-N 3.3Å; N319-V321 VanDerWaalsContact C-N 3.32Å; N319-V321 PolarHBondContact O-N 3.13Å; N319-I322 CarbonylContact O-C 3.35Å; N319-I322 WeakPolarHBondContact O-CA 3.32Å; N319-I322 WeakPolarHBondContact O-CB 3.3Å; N319-I322 PolarHBondContact O-N 3.5Å; N319-E323 WeakPolarHBondContact O-CG 3.44Å; N319-E323 PolarHBondContact O-N 3.25Å; N319-E323 PolarHBondContact OD1-OE1 3.45Å
320	Q	92.1	Very high	93	Very high	107 Å²	107	29.4 Å²	29.4	50%	0.5	14%	0.144	S	C	.	.	H	α-helix	trans	-58.1	-43	177.3	-173.2	-178.1	10	0	0	112.1	E316 D317 L318 I322 E323 N324	E316-Q320 WeakPolarHBondContact O-CB 3.24Å; E316-Q320 PolarHBondContact O-N 3.31Å; D317-Q320 PolarHBondContact O-N 2.65Å; L318-Q320 VanDerWaalsContact C-N 3.31Å; L318-Q320 PolarHBondContact O-N 3.09Å; Q320-I322 VanDerWaalsContact C-N 3.3Å; Q320-I322 PolarHBondContact O-N 3.49Å; Q320-E323 PolarHBondContact O-N 2.95Å; Q320-N324 WeakPolarHBondContact CG-ND2 3.49Å; Q320-N324 WeakPolarHBondContact O-CB 3.49Å; Q320-N324 PolarHBondContact O-N 3.34Å; Q320-N324 PolarHBondContact O-ND2 3.22Å
321	V	92.3	Very high	92.9	Very high	19 Å²	19	29.6 Å²	29.6	12%	0.115	15%	0.152	C	C	.	.	H	α-helix	trans	-62.6	-40.8	175.4	172.5	0	0	0	0	111	P94 D219 L220 D317 L318 N319 R325	P94-V321 HydrophobicContact CB-CG1 4.23Å; D219-V321 HydrophobicContact CB-CG1 3.72Å; L220-V321 HydrophobicContact CB-CG1 4.38Å; L220-V321 HydrophobicContact CB-CG2 4.27Å; L220-V321 HydrophobicContact CD1-CG2 4.25Å; L220-V321 HydrophobicContact CD2-CG2 4.32Å; D317-V321 PolarHBondContact O-N 2.87Å; L318-V321 PolarHBondContact O-N 2.98Å; N319-V321 VanDerWaalsContact C-N 3.32Å; N319-V321 PolarHBondContact O-N 3.13Å; V321-R325 PolarHBondContact O-N 3.49Å
322	I	91.7	Very high	92.7	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-67.6	-43.3	178.5	-61.3	169.4	0	0	0	111.3	L182 R185 V186 L318 N319 Q320 R325	L182-I322 HydrophobicContact CD1-CD1 3.82Å; R185-I322 HydrophobicContact CB-CG2 3.56Å; R185-I322 HydrophobicContact CG-CG2 4.45Å; V186-I322 HydrophobicContact CB-CD1 4.04Å; V186-I322 HydrophobicContact CB-CG1 4.14Å; V186-I322 HydrophobicContact CG1-CD1 4.28Å; V186-I322 HydrophobicContact CG2-CD1 4.49Å; V186-I322 HydrophobicContact CG2-CG1 4.35Å; L318-I322 HydrophobicContact CD1-CD1 4.04Å; L318-I322 HydrophobicContact CD1-CG1 4.37Å; L318-I322 HydrophobicContact CG-CD1 4.04Å; L318-I322 WeakPolarHBondContact O-CG1 3.36Å; L318-I322 PolarHBondContact O-N 3.03Å; L318-I322 VanDerWaalsContact O-N 3.15Å; N319-I322 CarbonylContact O-C 3.35Å; N319-I322 WeakPolarHBondContact O-CA 3.32Å; N319-I322 WeakPolarHBondContact O-CB 3.3Å; N319-I322 PolarHBondContact O-N 3.5Å; Q320-I322 VanDerWaalsContact C-N 3.3Å; Q320-I322 PolarHBondContact O-N 3.49Å; I322-R325 WeakPolarHBondContact O-CB 3.44Å; I322-R325 VanDerWaalsContact O-CG 3.31Å; I322-R325 WeakPolarHBondContact O-CG 3.34Å; I322-R325 PolarHBondContact O-N 2.93Å
323	E	88.7	Confident	92.6	Very high	40 Å²	40	30 Å²	30	19%	0.187	15%	0.152	C	C	.	.	H	α-helix	trans	-63.6	-42.6	177.8	-68.3	-47.5	143.3	0	0	112.1	K48 R185 N319 Q320 R325	K48-E323 IonicContact NZ-OE1 3.6Å; K48-E323 PolarHBondContact NZ-OE1 3.27Å; K48-E323 IonicContact NZ-OE2 3.69Å; K48-E323 PolarHBondContact NZ-OE2 2.99Å; R185-E323 IonicContact CZ-OE1 2.83Å; R185-E323 IonicContact NH1-OE1 3.8Å; R185-E323 IonicContact NH2-OE1 2.77Å; R185-E323 PolarHBondContact NH2-OE1 3.4Å; N319-E323 WeakPolarHBondContact O-CG 3.44Å; N319-E323 PolarHBondContact O-N 3.25Å; N319-E323 PolarHBondContact OD1-OE1 3.45Å; Q320-E323 PolarHBondContact O-N 2.95Å; E323-R325 PolarHBondContact O-N 3.19Å
324	N	89.6	Confident	92.5	Very high	32 Å²	32	33.7 Å²	33.7	17%	0.171	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	11.3	-175.6	-62.5	-23.2	0	0	0	112.8	Q320 L326 E327 N328 K450	Q320-N324 WeakPolarHBondContact CG-ND2 3.49Å; Q320-N324 WeakPolarHBondContact O-CB 3.49Å; Q320-N324 PolarHBondContact O-N 3.34Å; Q320-N324 PolarHBondContact O-ND2 3.22Å; N324-L326 VanDerWaalsContact C-N 3.27Å; N324-L326 PolarHBondContact O-N 3.42Å; N324-L326 VanDerWaalsContact O-N 3.13Å; N324-E327 PolarHBondContact O-N 3.37Å; N324-N328 WeakPolarHBondContact O-CB 3.45Å; N324-N328 PolarHBondContact O-N 3.33Å; N324-K450 PolarHBondContact OD1-NZ 2.89Å
325	R	88.9	Confident	92.3	Very high	50 Å²	50	38.2 Å²	38.2	19%	0.189	18%	0.184	C	C	.	.	H	α-helix	trans	-51.9	-40.5	-175.8	69.9	-178	-175.6	171.6	-1	114.1	Y53 P94 V321 I322 E323 K329	Y53-R325 VanDerWaalsContact CD1-NE 3.34Å; Y53-R325 HydrophobicContact CE1-CG 4.28Å; Y53-R325 VanDerWaalsContact CE1-NE 3.3Å; P94-R325 HydrophobicContact CG-CB 4.05Å; V321-R325 PolarHBondContact O-N 3.49Å; I322-R325 WeakPolarHBondContact O-CB 3.44Å; I322-R325 VanDerWaalsContact O-CG 3.31Å; I322-R325 WeakPolarHBondContact O-CG 3.34Å; I322-R325 PolarHBondContact O-N 2.93Å; E323-R325 PolarHBondContact O-N 3.19Å; R325-K329 VanDerWaalsContact O-CB 3.31Å; R325-K329 WeakPolarHBondContact O-CB 3.35Å; R325-K329 PolarHBondContact O-N 3.06Å
326	L	89.6	Confident	92.1	Very high	11 Å²	11	38.6 Å²	38.6	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-72.9	-41.7	179.5	-70.1	-175.9	0	0	0	111.6	Y53 V56 L57 N324 N328 K329 I330 L446	Y53-L326 HydrophobicContact CD1-CD1 3.29Å; Y53-L326 HydrophobicContact CD1-CD2 3.92Å; Y53-L326 HydrophobicContact CD1-CG 3.5Å; Y53-L326 VanDerWaalsContact CD1-CG 3.5Å; Y53-L326 HydrophobicContact CE1-CD1 3.57Å; Y53-L326 HydrophobicContact CE1-CG 3.71Å; Y53-L326 HydrophobicContact CG-CD1 4.22Å; V56-L326 HydrophobicContact CB-CD1 4.24Å; V56-L326 HydrophobicContact CG1-CD1 4.15Å; V56-L326 HydrophobicContact CG1-CD2 4.44Å; L57-L326 HydrophobicContact CD2-CD2 3.8Å; L57-L326 HydrophobicContact CG-CD2 3.99Å; N324-L326 VanDerWaalsContact C-N 3.27Å; N324-L326 PolarHBondContact O-N 3.42Å; N324-L326 VanDerWaalsContact O-N 3.13Å; L326-N328 VanDerWaalsContact C-N 3.34Å; L326-K329 PolarHBondContact O-N 3.44Å; L326-I330 WeakPolarHBondContact O-CB 3.34Å; L326-I330 WeakPolarHBondContact O-CD1 3.24Å; L326-I330 VanDerWaalsContact O-CG1 3.24Å; L326-I330 WeakPolarHBondContact O-CG1 3.48Å; L326-I330 PolarHBondContact O-N 2.92Å; L326-L446 HydrophobicContact CB-CD1 3.68Å; L326-L446 HydrophobicContact CD1-CD1 4.09Å; L326-L446 HydrophobicContact CD1-CD2 3.49Å; L326-L446 VanDerWaalsContact CD1-CD2 3.49Å; L326-L446 HydrophobicContact CD1-CG 4.45Å
327	E	90.8	Very high	92.1	Very high	63 Å²	63	35.3 Å²	35.3	29%	0.294	17%	0.17	S	C	.	.	H	α-helix	trans	-61.6	-46.1	177.6	-62.3	173.8	-160	0	0	110.2	N324 K329 I330 A331 L443 L446 K450	N324-E327 PolarHBondContact O-N 3.37Å; E327-K329 PolarHBondContact O-N 2.81Å; E327-I330 PolarHBondContact O-N 2.83Å; E327-A331 WeakPolarHBondContact O-CB 3.34Å; E327-A331 PolarHBondContact O-N 3.22Å; E327-L443 HydrophobicContact CB-CD2 3.96Å; E327-L443 HydrophobicContact CG-CD2 3.94Å; E327-L446 HydrophobicContact CG-CD1 4.44Å; E327-K450 IonicContact OE1-NZ 3.85Å; E327-K450 PolarHBondContact OE1-NZ 3.26Å
328	N	90.4	Very high	92.1	Very high	64 Å²	64	35.5 Å²	35.5	34%	0.342	17%	0.171	S	C	.	.	H	α-helix	trans	-60.8	-44.7	175.4	-68.4	-14.1	0	0	0	111.6	N324 L326 A331 F332	N324-N328 WeakPolarHBondContact O-CB 3.45Å; N324-N328 PolarHBondContact O-N 3.33Å; L326-N328 VanDerWaalsContact C-N 3.34Å; N328-A331 PolarHBondContact O-N 2.96Å; N328-F332 WeakPolarHBondContact O-CB 3.39Å; N328-F332 PolarHBondContact O-N 3.24Å
329	K	91.7	Very high	91.9	Very high	20 Å²	20	39 Å²	39	9%	0.087	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-41.9	178.6	-165.1	68.1	62	171.6	0	112.2	L60 E89 S92 R325 L326 E327 F332 I333	L60-K329 HydrophobicContact CD2-CB 4.37Å; L60-K329 HydrophobicContact CD2-CG 3.76Å; E89-K329 PolarHBondContact O-NZ 3.27Å; S92-K329 PolarHBondContact OG-NZ 3.01Å; S92-K329 VanDerWaalsContact OG-NZ 3.1Å; R325-K329 VanDerWaalsContact O-CB 3.31Å; R325-K329 WeakPolarHBondContact O-CB 3.35Å; R325-K329 PolarHBondContact O-N 3.06Å; L326-K329 PolarHBondContact O-N 3.44Å; E327-K329 PolarHBondContact O-N 2.81Å; K329-F332 PolarHBondContact O-N 2.85Å; K329-I333 WeakPolarHBondContact O-CG1 3.48Å; K329-I333 PolarHBondContact O-N 3.48Å
330	I	93.4	Very high	92	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-43.3	175.3	-68.1	161.6	0	0	0	110.3	V56 L60 L326 E327 I333 R334 L439 L442 L443 L446	V56-I330 HydrophobicContact CG1-CD1 4.47Å; L60-I330 HydrophobicContact CD1-CG1 4.28Å; L60-I330 HydrophobicContact CD2-CG1 4.29Å; L326-I330 WeakPolarHBondContact O-CB 3.34Å; L326-I330 WeakPolarHBondContact O-CD1 3.24Å; L326-I330 VanDerWaalsContact O-CG1 3.24Å; L326-I330 WeakPolarHBondContact O-CG1 3.48Å; L326-I330 PolarHBondContact O-N 2.92Å; E327-I330 PolarHBondContact O-N 2.83Å; I330-I333 PolarHBondContact O-N 2.99Å; I330-R334 VanDerWaalsContact O-CB 3.27Å; I330-R334 WeakPolarHBondContact O-CB 3.39Å; I330-R334 PolarHBondContact O-N 2.83Å; I330-L439 HydrophobicContact CG2-CB 4.11Å; I330-L439 HydrophobicContact CG2-CD2 4.41Å; I330-L439 WeakPolarHBondContact CG2-O 3.34Å; I330-L442 HydrophobicContact CD1-CB 3.73Å; I330-L442 HydrophobicContact CG1-CB 4.46Å; I330-L443 HydrophobicContact CB-CD2 3.97Å; I330-L443 HydrophobicContact CB-CG 4.39Å; I330-L443 HydrophobicContact CD1-CD2 3.74Å; I330-L443 HydrophobicContact CD1-CG 4.22Å; I330-L443 HydrophobicContact CG1-CD2 4.47Å; I330-L443 HydrophobicContact CG2-CD1 4.2Å; I330-L443 HydrophobicContact CG2-CD2 3.99Å; I330-L443 HydrophobicContact CG2-CG 3.85Å; I330-L446 HydrophobicContact CD1-CD1 3.75Å
331	A	92.1	Very high	92.1	Very high	40 Å²	40	34 Å²	34	33%	0.331	16%	0.16	S	C	.	.	H	α-helix	trans	-61.1	-43.8	176.3	0	0	0	0	0	111.8	E327 N328 R334 Q335	E327-A331 WeakPolarHBondContact O-CB 3.34Å; E327-A331 PolarHBondContact O-N 3.22Å; N328-A331 PolarHBondContact O-N 2.96Å; A331-R334 PolarHBondContact O-N 3.28Å; A331-Q335 WeakPolarHBondContact O-CG 3.31Å; A331-Q335 PolarHBondContact O-N 3.15Å
332	F	91.3	Very high	92.2	Very high	56 Å²	56	33.1 Å²	33.1	25%	0.246	15%	0.154	C	C	.	.	H	α-helix	trans	-57.9	-52.6	175.4	171.5	-102.5	0	0	0	112.1	H83 I85 N328 K329 R334 Q335 H336	H83-F332 AromaticContact NE2-CZ 3.89Å; I85-F332 HydrophobicContact CD1-CE1 3.61Å; I85-F332 HydrophobicContact CD1-CZ 3.82Å; I85-F332 HydrophobicContact CG1-CE1 4.13Å; I85-F332 HydrophobicContact CG1-CZ 4.13Å; I85-F332 HydrophobicContact CG2-CE1 4.47Å; N328-F332 WeakPolarHBondContact O-CB 3.39Å; N328-F332 PolarHBondContact O-N 3.24Å; K329-F332 PolarHBondContact O-N 2.85Å; F332-R334 VanDerWaalsContact C-N 3.3Å; F332-R334 PolarHBondContact O-N 3.19Å; F332-Q335 PolarHBondContact O-N 2.76Å; F332-H336 PolarHBondContact O-N 2.92Å
333	I	94.3	Very high	92.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-37.3	178.5	-63.9	-61.1	0	0	0	111.5	L60 I68 I85 I90 K329 I330 H336 A337 L439	L60-I333 HydrophobicContact CD1-CB 4.13Å; L60-I333 HydrophobicContact CD1-CG1 4.2Å; L60-I333 HydrophobicContact CD1-CG2 4.06Å; L60-I333 HydrophobicContact CD2-CG1 4.14Å; L60-I333 HydrophobicContact CG-CG1 4.28Å; I68-I333 HydrophobicContact CD1-CG2 3.56Å; I85-I333 HydrophobicContact CD1-CD1 4.15Å; I85-I333 HydrophobicContact CG2-CD1 4.16Å; I90-I333 HydrophobicContact CG1-CD1 4.06Å; K329-I333 WeakPolarHBondContact O-CG1 3.48Å; K329-I333 PolarHBondContact O-N 3.48Å; I330-I333 PolarHBondContact O-N 2.99Å; I333-H336 PolarHBondContact O-N 3.4Å; I333-A337 WeakPolarHBondContact O-CB 3.46Å; I333-A337 PolarHBondContact O-N 3.36Å; I333-L439 HydrophobicContact CG2-CD1 4.38Å; I333-L439 HydrophobicContact CG2-CD2 4.29Å
334	R	94.3	Very high	92.6	Very high	97 Å²	97	31.3 Å²	31.3	37%	0.366	15%	0.146	S	C	.	.	H	α-helix	trans	-64.3	-44.4	175.6	-176.4	174.7	170.5	-91.2	0.5	112.1	I330 A331 F332 H336 A337 I338 I435 L439	I330-R334 VanDerWaalsContact O-CB 3.27Å; I330-R334 WeakPolarHBondContact O-CB 3.39Å; I330-R334 PolarHBondContact O-N 2.83Å; A331-R334 PolarHBondContact O-N 3.28Å; F332-R334 VanDerWaalsContact C-N 3.3Å; F332-R334 PolarHBondContact O-N 3.19Å; R334-H336 VanDerWaalsContact C-N 3.34Å; R334-A337 PolarHBondContact O-N 2.62Å; R334-I338 HydrophobicContact CG-CD1 4.26Å; R334-I338 WeakPolarHBondContact O-CG1 3.45Å; R334-I338 PolarHBondContact O-N 2.87Å; R334-I435 HydrophobicContact CG-CG2 4.48Å; R334-I435 PolarHBondContact NE-O 3.37Å; R334-L439 HydrophobicContact CB-CD1 3.77Å; R334-L439 HydrophobicContact CG-CD1 4.21Å
335	Q	91.7	Very high	92.8	Very high	99 Å²	99	30.1 Å²	30.1	46%	0.463	14%	0.139	S	C	.	.	H	α-helix	trans	-62.7	-41.9	176	-73.3	179	12.8	0	0	111.4	A331 F332 I338 R339	A331-Q335 WeakPolarHBondContact O-CG 3.31Å; A331-Q335 PolarHBondContact O-N 3.15Å; F332-Q335 PolarHBondContact O-N 2.76Å; Q335-I338 PolarHBondContact O-N 3.17Å; Q335-R339 WeakPolarHBondContact O-CG 3.48Å; Q335-R339 PolarHBondContact O-N 3.46Å; Q335-R339 VanDerWaalsContact O-N 3.1Å
336	H	93.2	Very high	93.1	Very high	9 Å²	9	27.7 Å²	27.7	4%	0.042	13%	0.131	C	C	.	.	H	α-helix	trans	-59.5	-47.7	173.6	-176.5	72	0	0	0	111.9	E72 Y77 I85 F332 I333 R334 I338 R339 V340	E72-H336 IonicContact OE2-CD2 3.33Å; E72-H336 IonicContact OE2-CE1 2.62Å; E72-H336 IonicContact OE2-NE2 3.29Å; E72-H336 PolarHBondContact OE2-NE2 3.06Å; Y77-H336 AromaticContact CD1-CE1 3.76Å; Y77-H336 AromaticContact CE1-CE1 3.51Å; Y77-H336 AromaticContact CE1-ND1 3.82Å; I85-H336 HydrophobicContact CD1-CB 3.77Å; I85-H336 VanDerWaalsContact CD1-CD2 3.45Å; I85-H336 WeakPolarHBondContact CD1-CD2 3.24Å; F332-H336 PolarHBondContact O-N 2.92Å; I333-H336 PolarHBondContact O-N 3.4Å; R334-H336 VanDerWaalsContact C-N 3.34Å; H336-I338 VanDerWaalsContact C-N 3.3Å; H336-I338 PolarHBondContact O-N 3.21Å; H336-R339 PolarHBondContact O-N 3.11Å; H336-R339 VanDerWaalsContact O-N 3.07Å; H336-V340 WeakPolarHBondContact O-CG2 3.47Å; H336-V340 PolarHBondContact O-N 3.21Å
337	A	94.8	Very high	93.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57.4	-42.1	177	0	0	0	0	0	112.6	I68 I333 R334 R339 V340 R341 I431 I435	I68-A337 HydrophobicContact CD1-CB 3.65Å; I68-A337 HydrophobicContact CG1-CB 3.86Å; I68-A337 HydrophobicContact CG2-CB 4.47Å; I333-A337 WeakPolarHBondContact O-CB 3.46Å; I333-A337 PolarHBondContact O-N 3.36Å; R334-A337 PolarHBondContact O-N 2.62Å; A337-R339 VanDerWaalsContact C-N 3.34Å; A337-R339 PolarHBondContact O-N 3.03Å; A337-V340 PolarHBondContact O-N 3.31Å; A337-R341 WeakPolarHBondContact O-CB 3.39Å; A337-R341 PolarHBondContact O-N 2.98Å; A337-I431 HydrophobicContact CB-CD1 4.28Å; A337-I431 HydrophobicContact CB-CG1 4.12Å; A337-I431 WeakPolarHBondContact O-CD1 3.36Å; A337-I435 HydrophobicContact CB-CD1 3.96Å; A337-I435 HydrophobicContact CB-CG1 3.64Å
338	I	93.4	Very high	93.6	Very high	23 Å²	23	24.9 Å²	24.9	12%	0.118	12%	0.117	C	C	.	.	H	α-helix	trans	-60.1	-45.1	176	-70.2	164.6	0	0	0	110.5	R334 Q335 H336 R341 I342 I435	R334-I338 HydrophobicContact CG-CD1 4.26Å; R334-I338 WeakPolarHBondContact O-CG1 3.45Å; R334-I338 PolarHBondContact O-N 2.87Å; Q335-I338 PolarHBondContact O-N 3.17Å; H336-I338 VanDerWaalsContact C-N 3.3Å; H336-I338 PolarHBondContact O-N 3.21Å; I338-R341 PolarHBondContact O-N 3.44Å; I338-I342 HydrophobicContact CG2-CD1 3.8Å; I338-I342 VanDerWaalsContact O-CG1 3.31Å; I338-I342 WeakPolarHBondContact O-CG1 3.44Å; I338-I342 PolarHBondContact O-N 3.46Å; I338-I435 HydrophobicContact CD1-CG2 4.17Å; I338-I435 HydrophobicContact CG1-CD1 3.91Å; I338-I435 HydrophobicContact CG1-CG1 4.15Å; I338-I435 HydrophobicContact CG1-CG2 3.77Å
339	R	92.9	Very high	93.8	Very high	74 Å²	74	24.5 Å²	24.5	28%	0.279	11%	0.111	S	C	.	.	H	α-helix	trans	-66.4	-43.4	179.2	-66.1	170.7	-178.3	155	4.1	112.3	Y77 Q335 H336 A337 R341 I342 H343	Y77-R339 HydrophobicContact CE2-CB 4.31Å; Y77-R339 VanDerWaalsContact OH-CB 3.25Å; Y77-R339 WeakPolarHBondContact OH-CB 3.06Å; Q335-R339 WeakPolarHBondContact O-CG 3.48Å; Q335-R339 PolarHBondContact O-N 3.46Å; Q335-R339 VanDerWaalsContact O-N 3.1Å; H336-R339 PolarHBondContact O-N 3.11Å; H336-R339 VanDerWaalsContact O-N 3.07Å; A337-R339 VanDerWaalsContact C-N 3.34Å; A337-R339 PolarHBondContact O-N 3.03Å; R339-R341 VanDerWaalsContact C-N 3.32Å; R339-R341 PolarHBondContact O-N 2.78Å; R339-I342 PolarHBondContact O-N 2.8Å; R339-H343 WeakPolarHBondContact O-CB 3.48Å; R339-H343 PolarHBondContact O-N 3.41Å
340	V	94.6	Very high	94	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-58.6	-45.3	174.8	171.7	0	0	0	0	110.5	I68 L71 E72 Y77 H336 A337 H343 A344 I431	I68-V340 HydrophobicContact CG2-CG2 4.36Å; L71-V340 HydrophobicContact CB-CG1 4.14Å; L71-V340 HydrophobicContact CD2-CG1 4.24Å; L71-V340 HydrophobicContact CG-CG1 4.21Å; E72-V340 HydrophobicContact CB-CG1 4.12Å; E72-V340 HydrophobicContact CB-CG2 4.27Å; E72-V340 HydrophobicContact CG-CG2 4.24Å; Y77-V340 HydrophobicContact CD1-CG2 3.62Å; Y77-V340 HydrophobicContact CE1-CG2 3.98Å; Y77-V340 HydrophobicContact CG-CG2 3.91Å; H336-V340 WeakPolarHBondContact O-CG2 3.47Å; H336-V340 PolarHBondContact O-N 3.21Å; A337-V340 PolarHBondContact O-N 3.31Å; V340-H343 PolarHBondContact O-N 3.05Å; V340-A344 WeakPolarHBondContact O-CB 3.46Å; V340-A344 PolarHBondContact O-N 3.26Å; V340-I431 HydrophobicContact CB-CD1 4.01Å; V340-I431 HydrophobicContact CG1-CD1 3.83Å
341	R	94.4	Very high	94.1	Very high	13 Å²	13	23.7 Å²	23.7	5%	0.049	11%	0.108	C	C	.	.	H	α-helix	trans	-60.3	-48.9	176.2	-178.3	-175.6	65.1	-167.4	0.9	111.7	A337 I338 R339 H343 A344 L345 N389 L428 I431 I435	A337-R341 WeakPolarHBondContact O-CB 3.39Å; A337-R341 PolarHBondContact O-N 2.98Å; I338-R341 PolarHBondContact O-N 3.44Å; R339-R341 VanDerWaalsContact C-N 3.32Å; R339-R341 PolarHBondContact O-N 2.78Å; R341-H343 VanDerWaalsContact C-N 3.3Å; R341-H343 PolarHBondContact O-N 2.84Å; R341-A344 PolarHBondContact O-N 2.97Å; R341-L345 HydrophobicContact CG-CD1 4.33Å; R341-L345 VanDerWaalsContact O-CG 3.31Å; R341-L345 WeakPolarHBondContact O-CG 3.5Å; R341-L345 PolarHBondContact O-N 2.86Å; R341-N389 PolarHBondContact NH2-O 2.68Å; R341-L428 HydrophobicContact CG-CD1 3.95Å; R341-I431 HydrophobicContact CB-CD1 4.27Å; R341-I431 HydrophobicContact CB-CG2 4.09Å; R341-I431 HydrophobicContact CG-CG2 4.1Å; R341-I435 HydrophobicContact CB-CD1 4.36Å
342	I	93.8	Very high	94.2	Very high	1 Å²	1	25 Å²	25	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-59.5	-44	178.4	-72.7	168.6	0	0	0	110.5	I338 R339 L345 L346 V390 D394 L395	I338-I342 HydrophobicContact CG2-CD1 3.8Å; I338-I342 VanDerWaalsContact O-CG1 3.31Å; I338-I342 WeakPolarHBondContact O-CG1 3.44Å; I338-I342 PolarHBondContact O-N 3.46Å; R339-I342 PolarHBondContact O-N 2.8Å; I342-L345 PolarHBondContact O-N 3.31Å; I342-L346 HydrophobicContact CG2-CD1 3.91Å; I342-L346 WeakPolarHBondContact O-CG 3.34Å; I342-L346 PolarHBondContact O-N 3.41Å; I342-V390 HydrophobicContact CD1-CG1 4.09Å; I342-V390 HydrophobicContact CG1-CG1 4.2Å; I342-V390 HydrophobicContact CG1-CG2 4.34Å; I342-D394 HydrophobicContact CD1-CB 3.5Å; I342-L395 HydrophobicContact CG2-CD2 3.7Å
343	H	94.8	Very high	94.3	Very high	3 Å²	3	22.7 Å²	22.7	1%	0.014	10%	0.098	C	C	.	.	H	α-helix	trans	-61.5	-47.5	178	173	75.3	0	0	0	112.2	Y75 Y77 L80 R339 V340 R341 L345 L346 V347 Y401 F404	Y75-H343 PolarHBondContact O-NE2 3.36Å; Y77-H343 HydrophobicContact CD2-CB 3.55Å; Y77-H343 AromaticContact CD2-CD2 3.76Å; Y77-H343 AromaticContact CD2-CG 3.58Å; Y77-H343 HydrophobicContact CE2-CB 3.89Å; L80-H343 WeakPolarHBondContact CD2-ND1 3.39Å; R339-H343 WeakPolarHBondContact O-CB 3.48Å; R339-H343 PolarHBondContact O-N 3.41Å; V340-H343 PolarHBondContact O-N 3.05Å; R341-H343 VanDerWaalsContact C-N 3.3Å; R341-H343 PolarHBondContact O-N 2.84Å; H343-L345 VanDerWaalsContact C-N 3.31Å; H343-L345 PolarHBondContact O-N 2.9Å; H343-L346 PolarHBondContact O-N 3.05Å; H343-L346 VanDerWaalsContact O-N 3.15Å; H343-V347 WeakPolarHBondContact O-CG2 3.42Å; H343-V347 PolarHBondContact O-N 3.47Å; H343-Y401 WeakPolarHBondContact CA-OH 3.38Å; H343-Y401 AromaticContact CE1-CE1 3.84Å; H343-Y401 AromaticContact ND1-CE1 3.66Å; H343-Y401 AromaticContact ND1-CZ 3.58Å; H343-Y401 PolarHBondContact ND1-OH 3.15Å; H343-F404 AromaticContact CE1-CE2 3.85Å; H343-F404 AromaticContact CE1-CZ 3.67Å; H343-F404 AromaticContact NE2-CZ 3.77Å
344	A	94.7	Very high	94.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.6	-40.8	177.4	0	0	0	0	0	111.9	L71 Y75 V340 R341 L346 D348 L416	L71-A344 HydrophobicContact CD1-CB 3.95Å; L71-A344 HydrophobicContact CD2-CB 3.84Å; L71-A344 HydrophobicContact CG-CB 3.86Å; Y75-A344 HydrophobicContact CD1-CB 4.37Å; Y75-A344 HydrophobicContact CD2-CB 3.68Å; Y75-A344 HydrophobicContact CE2-CB 4.06Å; Y75-A344 HydrophobicContact CG-CB 3.86Å; V340-A344 WeakPolarHBondContact O-CB 3.46Å; V340-A344 PolarHBondContact O-N 3.26Å; R341-A344 PolarHBondContact O-N 2.97Å; A344-L346 PolarHBondContact O-N 2.75Å; A344-D348 VanDerWaalsContact O-CB 3.27Å; A344-D348 WeakPolarHBondContact O-CB 3.48Å; A344-D348 PolarHBondContact O-N 3.48Å; A344-L416 HydrophobicContact CB-CD2 4.3Å
345	L	94.3	Very high	94.2	Very high	7 Å²	7	24.7 Å²	24.7	4%	0.037	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-39.9	174.5	-73.4	177.8	0	0	0	112.7	R341 I342 H343 R349 I384 K387 L416 L428	R341-L345 HydrophobicContact CG-CD1 4.33Å; R341-L345 VanDerWaalsContact O-CG 3.31Å; R341-L345 WeakPolarHBondContact O-CG 3.5Å; R341-L345 PolarHBondContact O-N 2.86Å; I342-L345 PolarHBondContact O-N 3.31Å; H343-L345 VanDerWaalsContact C-N 3.31Å; H343-L345 PolarHBondContact O-N 2.9Å; L345-R349 WeakPolarHBondContact O-CB 3.41Å; L345-R349 PolarHBondContact O-N 3.27Å; L345-I384 HydrophobicContact CB-CD1 4.04Å; L345-K387 HydrophobicContact CD1-CD 4.3Å; L345-L416 HydrophobicContact CD2-CD1 3.77Å; L345-L428 HydrophobicContact CD2-CD1 4.21Å; L345-L428 HydrophobicContact CD2-CD2 4.31Å
346	L	94.7	Very high	94.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-67.4	-49.6	177.3	-77.5	165	0	0	0	111.1	I342 H343 A344 D348 R349 Y350 I380 F381 I384 L395 P396 Y401	I342-L346 HydrophobicContact CG2-CD1 3.91Å; I342-L346 WeakPolarHBondContact O-CG 3.34Å; I342-L346 PolarHBondContact O-N 3.41Å; H343-L346 PolarHBondContact O-N 3.05Å; H343-L346 VanDerWaalsContact O-N 3.15Å; A344-L346 PolarHBondContact O-N 2.75Å; L346-D348 VanDerWaalsContact C-N 3.31Å; L346-D348 PolarHBondContact O-N 3.42Å; L346-R349 WeakPolarHBondContact O-CA 3.34Å; L346-R349 WeakPolarHBondContact O-CB 3.45Å; L346-R349 PolarHBondContact O-N 3.23Å; L346-Y350 WeakPolarHBondContact O-CD2 3.44Å; L346-Y350 PolarHBondContact O-N 3.01Å; L346-I380 HydrophobicContact CD2-CG2 4.13Å; L346-F381 HydrophobicContact CD1-CE1 4.1Å; L346-F381 HydrophobicContact CD2-CD1 3.95Å; L346-F381 HydrophobicContact CD2-CE1 3.99Å; L346-F381 HydrophobicContact CD2-CG 4.24Å; L346-F381 HydrophobicContact CD2-CZ 4.28Å; L346-I384 HydrophobicContact CD2-CB 4.3Å; L346-I384 HydrophobicContact CD2-CG1 3.76Å; L346-I384 HydrophobicContact CG-CG1 4.24Å; L346-L395 HydrophobicContact CD1-CD2 3.9Å; L346-P396 HydrophobicContact CD1-CG 4.18Å; L346-Y401 HydrophobicContact CB-CE1 4.36Å; L346-Y401 HydrophobicContact CB-CE2 4.3Å; L346-Y401 WeakPolarHBondContact CB-OH 3.39Å; L346-Y401 HydrophobicContact CD1-CE2 3.7Å; L346-Y401 VanDerWaalsContact CD1-OH 3.29Å; L346-Y401 WeakPolarHBondContact CD1-OH 3.48Å
347	V	95.4	Very high	94.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61	-41.3	178.4	177.1	0	0	0	0	111.1	Y75 H343 R349 Y350 L351 Y401 F404 F405 F413	Y75-V347 HydrophobicContact CD1-CB 3.69Å; Y75-V347 HydrophobicContact CD1-CG1 3.65Å; Y75-V347 HydrophobicContact CD1-CG2 4.39Å; Y75-V347 HydrophobicContact CE1-CB 4.14Å; Y75-V347 HydrophobicContact CE1-CG1 3.98Å; H343-V347 WeakPolarHBondContact O-CG2 3.42Å; H343-V347 PolarHBondContact O-N 3.47Å; V347-R349 VanDerWaalsContact C-N 3.3Å; V347-R349 PolarHBondContact O-N 2.85Å; V347-Y350 WeakPolarHBondContact O-CB 3.47Å; V347-Y350 PolarHBondContact O-N 3.18Å; V347-L351 WeakPolarHBondContact O-CB 3.5Å; V347-L351 PolarHBondContact O-N 3.37Å; V347-Y401 HydrophobicContact CG2-CE1 3.89Å; V347-F404 HydrophobicContact CG2-CE1 3.98Å; V347-F404 HydrophobicContact CG2-CZ 4.41Å; V347-F405 HydrophobicContact CG1-CE1 4.37Å; V347-F405 HydrophobicContact CG1-CZ 4.42Å; V347-F405 HydrophobicContact CG2-CZ 4.34Å; V347-F413 HydrophobicContact CG1-CB 4.2Å; V347-F413 HydrophobicContact CG1-CD1 3.89Å; V347-F413 HydrophobicContact CG1-CD2 4.09Å; V347-F413 HydrophobicContact CG1-CE1 4.27Å; V347-F413 HydrophobicContact CG1-CE2 4.45Å; V347-F413 HydrophobicContact CG1-CG 3.78Å
348	D	95.1	Very high	93.9	Very high	14 Å²	14	33.6 Å²	33.6	8%	0.075	15%	0.153	C	C	.	.	H	α-helix	trans	-59.3	-41.4	173.1	-174.3	68.1	0	0	0	111.8	A344 L346 L351 Q352 L415 L416	A344-D348 VanDerWaalsContact O-CB 3.27Å; A344-D348 WeakPolarHBondContact O-CB 3.48Å; A344-D348 PolarHBondContact O-N 3.48Å; L346-D348 VanDerWaalsContact C-N 3.31Å; L346-D348 PolarHBondContact O-N 3.42Å; D348-L351 PolarHBondContact O-N 3.37Å; D348-Q352 VanDerWaalsContact O-CG 3.28Å; D348-Q352 WeakPolarHBondContact O-CG 3.44Å; D348-Q352 PolarHBondContact O-N 2.91Å; D348-Q352 PolarHBondContact OD2-NE2 2.99Å; D348-L415 VanDerWaalsContact OD1-CA 3.3Å; D348-L415 WeakPolarHBondContact OD1-CA 3.47Å; D348-L415 WeakPolarHBondContact OD1-CD2 3.21Å; D348-L416 HydrophobicContact CB-CB 4.44Å; D348-L416 HydrophobicContact CB-CD1 3.52Å; D348-L416 HydrophobicContact CB-CG 3.74Å; D348-L416 PolarHBondContact OD1-N 3.49Å
349	R	95.1	Very high	93.6	Very high	56 Å²	56	36.6 Å²	36.6	21%	0.211	17%	0.172	C	C	.	.	H	α-helix	trans	-67.1	-39.2	177.5	-173.9	57.8	178.5	166.1	5.4	113	L345 L346 V347 L351 T353 I380 I384	L345-R349 WeakPolarHBondContact O-CB 3.41Å; L345-R349 PolarHBondContact O-N 3.27Å; L346-R349 WeakPolarHBondContact O-CA 3.34Å; L346-R349 WeakPolarHBondContact O-CB 3.45Å; L346-R349 PolarHBondContact O-N 3.23Å; V347-R349 VanDerWaalsContact C-N 3.3Å; V347-R349 PolarHBondContact O-N 2.85Å; R349-L351 VanDerWaalsContact C-N 3.34Å; R349-T353 WeakPolarHBondContact O-CB 3.47Å; R349-T353 PolarHBondContact O-N 3.49Å; R349-T353 PolarHBondContact O-OG1 3.42Å; R349-I380 HydrophobicContact CB-CG2 4.3Å; R349-I380 HydrophobicContact CG-CB 4.48Å; R349-I380 HydrophobicContact CG-CD1 3.95Å; R349-I380 HydrophobicContact CG-CG2 3.99Å; R349-I384 HydrophobicContact CB-CD1 4.23Å
350	Y	95.5	Very high	93.1	Very high	1 Å²	1	42.4 Å²	42.4	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-59	-46.8	170.4	-84.5	-78.7	0	0	0	110.8	L346 V347 T353 Y354 I371 V372 P375 I380 Y401 F405	L346-Y350 WeakPolarHBondContact O-CD2 3.44Å; L346-Y350 PolarHBondContact O-N 3.01Å; V347-Y350 WeakPolarHBondContact O-CB 3.47Å; V347-Y350 PolarHBondContact O-N 3.18Å; Y350-T353 PolarHBondContact O-N 2.9Å; Y350-Y354 WeakPolarHBondContact O-CB 3.32Å; Y350-Y354 PolarHBondContact O-N 2.84Å; Y350-I371 HydrophobicContact CD1-CG2 3.73Å; Y350-I371 HydrophobicContact CE1-CG2 4.03Å; Y350-V372 HydrophobicContact CE1-CG2 4.34Å; Y350-P375 HydrophobicContact CE1-CB 4.22Å; Y350-P375 WeakPolarHBondContact OH-CB 3.46Å; Y350-I380 HydrophobicContact CD1-CG1 4.49Å; Y350-I380 HydrophobicContact CD2-CG2 3.94Å; Y350-I380 HydrophobicContact CE1-CG1 4.28Å; Y350-I380 HydrophobicContact CE1-CG2 4.48Å; Y350-I380 HydrophobicContact CE2-CG2 3.7Å; Y350-I380 HydrophobicContact CG-CG2 4.41Å; Y350-Y401 HydrophobicContact CD2-CD1 4.5Å; Y350-Y401 HydrophobicContact CE2-CD1 4.06Å; Y350-Y401 HydrophobicContact CE2-CD2 4.49Å; Y350-Y401 HydrophobicContact CE2-CG 4.02Å; Y350-F405 AromaticContact CD1-CE2 3.87Å; Y350-F405 HydrophobicContact CD1-CE2 3.87Å; Y350-F405 HydrophobicContact CD1-CZ 4.43Å; Y350-F405 AromaticContact CD2-CE2 3.64Å; Y350-F405 HydrophobicContact CD2-CE2 3.64Å; Y350-F405 AromaticContact CD2-CZ 3.88Å; Y350-F405 HydrophobicContact CD2-CZ 3.88Å; Y350-F405 HydrophobicContact CE1-CE2 4.13Å; Y350-F405 AromaticContact CE2-CE2 3.93Å; Y350-F405 HydrophobicContact CE2-CE2 3.93Å; Y350-F405 AromaticContact CG-CE2 3.63Å; Y350-F405 HydrophobicContact CG-CE2 3.63Å; Y350-F405 AromaticContact CG-CZ 3.82Å; Y350-F405 HydrophobicContact CG-CZ 3.82Å
351	L	95.1	Very high	92.6	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-65.7	-40.9	-179.4	-176.7	62.4	0	0	0	112.7	V347 D348 R349 Y354 K355 I410 F413 L415	V347-L351 WeakPolarHBondContact O-CB 3.5Å; V347-L351 PolarHBondContact O-N 3.37Å; D348-L351 PolarHBondContact O-N 3.37Å; R349-L351 VanDerWaalsContact C-N 3.34Å; L351-Y354 HydrophobicContact CD1-CD1 4.44Å; L351-Y354 PolarHBondContact O-N 2.82Å; L351-K355 WeakPolarHBondContact O-CG 3.37Å; L351-K355 PolarHBondContact O-N 2.86Å; L351-I410 HydrophobicContact CB-CD1 4.08Å; L351-I410 HydrophobicContact CD1-CD1 4.17Å; L351-I410 HydrophobicContact CD1-CG1 3.86Å; L351-F413 HydrophobicContact CD2-CB 4.33Å; L351-F413 WeakPolarHBondContact CD2-O 3.41Å; L351-L415 HydrophobicContact CB-CD2 4.33Å; L351-L415 HydrophobicContact CD2-CD2 3.86Å; L351-L415 HydrophobicContact CD2-CG 3.94Å; L351-L415 HydrophobicContact CG-CD2 3.95Å; L351-L415 HydrophobicContact CG-CG 4.4Å
352	Q	94.3	Very high	92.2	Very high	67 Å²	67	52.6 Å²	52.6	31%	0.313	25%	0.25	S	C	.	.	H	α-helix	trans	-59.7	-50.9	173.4	-73.9	175.5	8.3	0	0	110.6	D348 Y354 K355 D356 L415	D348-Q352 VanDerWaalsContact O-CG 3.28Å; D348-Q352 WeakPolarHBondContact O-CG 3.44Å; D348-Q352 PolarHBondContact O-N 2.91Å; D348-Q352 PolarHBondContact OD2-NE2 2.99Å; Q352-Y354 VanDerWaalsContact C-N 3.3Å; Q352-Y354 PolarHBondContact O-N 2.95Å; Q352-K355 PolarHBondContact O-N 3.21Å; Q352-K355 VanDerWaalsContact O-N 3.15Å; Q352-D356 WeakPolarHBondContact O-CB 3.06Å; Q352-D356 PolarHBondContact O-N 2.83Å; Q352-L415 HydrophobicContact CG-CD2 3.62Å
353	T	94.3	Very high	91.9	Very high	8 Å²	8	56.8 Å²	56.8	5%	0.049	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-41.1	-178.7	-55	0	0	0	0	111.1	R349 Y350 D356 K357 I371 F378 I380	R349-T353 WeakPolarHBondContact O-CB 3.47Å; R349-T353 PolarHBondContact O-N 3.49Å; R349-T353 PolarHBondContact O-OG1 3.42Å; Y350-T353 PolarHBondContact O-N 2.9Å; T353-D356 PolarHBondContact O-N 2.81Å; T353-K357 HydrophobicContact CG2-CG 4.28Å; T353-K357 WeakPolarHBondContact O-CB 3.33Å; T353-K357 VanDerWaalsContact O-CG 3.25Å; T353-K357 WeakPolarHBondContact O-CG 3.45Å; T353-K357 PolarHBondContact O-N 3.3Å; T353-I371 HydrophobicContact CG2-CD1 3.94Å; T353-I371 HydrophobicContact CG2-CG1 4.21Å; T353-I371 HydrophobicContact CG2-CG2 4.27Å; T353-F378 HydrophobicContact CG2-CB 3.85Å; T353-F378 HydrophobicContact CG2-CD1 3.67Å; T353-F378 HydrophobicContact CG2-CG 3.94Å; T353-I380 HydrophobicContact CG2-CD1 4.15Å; T353-I380 WeakPolarHBondContact OG1-CD1 3.44Å
354	Y	94.1	Very high	91.6	Very high	44 Å²	44	57.3 Å²	57.3	17%	0.173	28%	0.278	C	S	.	.	H	α-helix	trans	-59.1	-47.6	174.7	172.6	-111.6	0	0	0	111.8	Y350 L351 Q352 K357 M358 G364 V367 F368 I410	Y350-Y354 WeakPolarHBondContact O-CB 3.32Å; Y350-Y354 PolarHBondContact O-N 2.84Å; L351-Y354 HydrophobicContact CD1-CD1 4.44Å; L351-Y354 PolarHBondContact O-N 2.82Å; Q352-Y354 VanDerWaalsContact C-N 3.3Å; Q352-Y354 PolarHBondContact O-N 2.95Å; Y354-K357 PolarHBondContact O-N 3.34Å; Y354-M358 HydrophobicContact CD2-CG 4.25Å; Y354-M358 HydrophobicContact CE1-CE 4.34Å; Y354-M358 HydrophobicContact CE1-CG 4.45Å; Y354-M358 HydrophobicContact CE2-CE 3.66Å; Y354-M358 HydrophobicContact CE2-CG 3.97Å; Y354-M358 HydrophobicContact CE2-SD 4.39Å; Y354-M358 VanDerWaalsContact CZ-CE 3.44Å; Y354-M358 WeakPolarHBondContact O-CB 3.48Å; Y354-M358 WeakPolarHBondContact O-CG 3.31Å; Y354-M358 PolarHBondContact O-N 2.79Å; Y354-M358 WeakPolarHBondContact OH-CE 3.49Å; Y354-G364 WeakPolarHBondContact CE2-O 3.49Å; Y354-V367 HydrophobicContact CD2-CG1 4.36Å; Y354-F368 HydrophobicContact CD2-CB 3.76Å; Y354-F368 AromaticContact CD2-CD2 3.94Å; Y354-F368 HydrophobicContact CD2-CD2 3.94Å; Y354-F368 HydrophobicContact CD2-CG 4.23Å; Y354-F368 HydrophobicContact CE2-CB 3.81Å; Y354-F368 HydrophobicContact CG-CD2 4.22Å; Y354-I410 HydrophobicContact CD1-CG1 4.26Å; Y354-I410 HydrophobicContact CD1-CG2 4.02Å; Y354-I410 HydrophobicContact CD2-CG2 4.46Å; Y354-I410 HydrophobicContact CE1-CG2 3.85Å; Y354-I410 HydrophobicContact CE2-CG2 4.31Å; Y354-I410 HydrophobicContact CG-CG1 4.42Å; Y354-I410 HydrophobicContact CG-CG2 4.29Å
355	K	92.8	Very high	91.3	Very high	94 Å²	94	64.8 Å²	64.8	41%	0.409	31%	0.313	S	S	.	.	H	α-helix	trans	-65.2	-39.1	177	-72	179.3	179.2	-176.8	0	112.8	L351 Q352 K357 M358 L415	L351-K355 WeakPolarHBondContact O-CG 3.37Å; L351-K355 PolarHBondContact O-N 2.86Å; Q352-K355 PolarHBondContact O-N 3.21Å; Q352-K355 VanDerWaalsContact O-N 3.15Å; K355-K357 VanDerWaalsContact C-N 3.32Å; K355-K357 PolarHBondContact O-N 2.97Å; K355-M358 PolarHBondContact O-N 2.61Å; K355-L415 HydrophobicContact CD-CD1 4.26Å
356	D	92.5	Very high	91.1	Very high	119 Å²	119	69.8 Å²	69.8	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-69	-30.8	179.9	-67.9	-15.2	0	0	0	112.5	Q352 T353	Q352-D356 WeakPolarHBondContact O-CB 3.06Å; Q352-D356 PolarHBondContact O-N 2.83Å; T353-D356 PolarHBondContact O-N 2.81Å
357	K	91	Very high	91	Very high	112 Å²	112	71.1 Å²	71.1	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-91.6	-13.1	179.6	-64.4	-61.8	178.6	-175	0	113.7	T353 Y354 K355 T359 V367 F378	T353-K357 HydrophobicContact CG2-CG 4.28Å; T353-K357 WeakPolarHBondContact O-CB 3.33Å; T353-K357 VanDerWaalsContact O-CG 3.25Å; T353-K357 WeakPolarHBondContact O-CG 3.45Å; T353-K357 PolarHBondContact O-N 3.3Å; Y354-K357 PolarHBondContact O-N 3.34Å; K355-K357 VanDerWaalsContact C-N 3.32Å; K355-K357 PolarHBondContact O-N 2.97Å; K357-T359 PolarHBondContact O-N 3Å; K357-V367 HydrophobicContact CB-CG1 3.79Å; K357-F378 HydrophobicContact CD-CE1 4.27Å; K357-F378 HydrophobicContact CG-CD1 4.47Å; K357-F378 HydrophobicContact CG-CE1 4.09Å
358	M	89.9	Confident	90.9	Very high	65 Å²	65	72.3 Å²	72.3	32%	0.32	35%	0.353	S	S	.	.			trans	-71.7	119.3	175.1	-89.7	-67.2	-138.6	0	0	111.4	Y354 K355	Y354-M358 HydrophobicContact CD2-CG 4.25Å; Y354-M358 HydrophobicContact CE1-CE 4.34Å; Y354-M358 HydrophobicContact CE1-CG 4.45Å; Y354-M358 HydrophobicContact CE2-CE 3.66Å; Y354-M358 HydrophobicContact CE2-CG 3.97Å; Y354-M358 HydrophobicContact CE2-SD 4.39Å; Y354-M358 VanDerWaalsContact CZ-CE 3.44Å; Y354-M358 WeakPolarHBondContact O-CB 3.48Å; Y354-M358 WeakPolarHBondContact O-CG 3.31Å; Y354-M358 PolarHBondContact O-N 2.79Å; Y354-M358 WeakPolarHBondContact OH-CE 3.49Å; K355-M358 PolarHBondContact O-N 2.61Å
359	T	87.1	Confident	90.7	Very high	86 Å²	86	77.1 Å²	77.1	53%	0.528	37%	0.373	S	S	.	.			trans	-113.2	165.6	170.1	75.9	0	0	0	0	110.3	K357 F361 S362	K357-T359 PolarHBondContact O-N 3Å; T359-F361 PolarHBondContact O-N 3.49Å; T359-S362 PolarHBondContact N-OG 3.1Å; T359-S362 WeakPolarHBondContact O-CB 3.36Å; T359-S362 PolarHBondContact O-N 3.33Å; T359-S362 PolarHBondContact OG1-OG 2.79Å
360	F	81.3	Confident	90.7	Very high	195 Å²	195	77.5 Å²	77.5	86%	0.855	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.3	-177.6	-174.3	-96.4	0	0	0	114.1
361	F	84.6	Confident	90.6	Very high	188 Å²	188	77.5 Å²	77.5	83%	0.825	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	2.4	-179.7	-58.4	-77.7	0	0	0	113.5	T359	T359-F361 PolarHBondContact O-N 3.49Å
362	S	85.6	Confident	90.5	Very high	40 Å²	40	78.1 Å²	78.1	28%	0.28	38%	0.383	S	S	.	.			trans	-80.3	136.6	-178.4	-66.3	0	0	0	0	111.3	T359 G364	T359-S362 PolarHBondContact N-OG 3.1Å; T359-S362 WeakPolarHBondContact O-CB 3.36Å; T359-S362 PolarHBondContact O-N 3.33Å; T359-S362 PolarHBondContact OG1-OG 2.79Å; S362-G364 PolarHBondContact O-N 2.99Å
363	D	88.3	Confident	90.4	Very high	89 Å²	89	80.2 Å²	80.2	48%	0.476	39%	0.393	S	S	.	.			trans	-75.3	117.6	164	-173.5	-27.3	0	0	0	109.3	E365 L366 V367	D363-E365 VanDerWaalsContact C-N 3.3Å; D363-E365 PolarHBondContact O-N 2.86Å; D363-E365 PolarHBondContact OD1-N 3.4Å; D363-L366 HydrophobicContact CB-CB 4.15Å; D363-L366 HydrophobicContact CB-CD1 3.94Å; D363-L366 HydrophobicContact CB-CG 4.05Å; D363-L366 PolarHBondContact O-N 3.11Å; D363-V367 WeakPolarHBondContact O-CG2 3.28Å; D363-V367 PolarHBondContact O-N 3.41Å
364	G	87.6	Confident	90.3	Very high	14 Å²	14	83.3 Å²	83.3	14%	0.144	41%	0.409	C	S	.	.	H	α-helix	trans	-64	-33.4	-177.5	0	0	0	0	0	114.8	Y354 S362 F368	Y354-G364 WeakPolarHBondContact CE2-O 3.49Å; S362-G364 PolarHBondContact O-N 2.99Å; G364-F368 WeakPolarHBondContact O-CB 3.34Å; G364-F368 PolarHBondContact O-N 3.36Å
365	E	88.6	Confident	90.2	Very high	157 Å²	157	81.6 Å²	81.6	73%	0.734	40%	0.403	S	S	*	.	H	α-helix	trans	-68.8	-43.7	179.6	-168	174.5	167.2	0	0	110.2	D363 F368 K369	D363-E365 VanDerWaalsContact C-N 3.3Å; D363-E365 PolarHBondContact O-N 2.86Å; D363-E365 PolarHBondContact OD1-N 3.4Å; E365-F368 PolarHBondContact O-N 3.38Å; E365-K369 WeakPolarHBondContact O-CB 3.28Å; E365-K369 PolarHBondContact O-N 3.44Å
366	L	90.4	Very high	90.2	Very high	113 Å²	113	79.5 Å²	79.5	59%	0.592	40%	0.397	S	S	*	.	H	α-helix	trans	-66	-43	177.2	-64.5	-179.4	0	0	0	112.5	D363 K369 D370	D363-L366 HydrophobicContact CB-CB 4.15Å; D363-L366 HydrophobicContact CB-CD1 3.94Å; D363-L366 HydrophobicContact CB-CG 4.05Å; D363-L366 PolarHBondContact O-N 3.11Å; L366-K369 PolarHBondContact O-N 3.3Å; L366-D370 PolarHBondContact O-N 3.01Å
367	V	91.9	Very high	90.2	Very high	28 Å²	28	79 Å²	79	17%	0.17	39%	0.389	C	S	.	.	H	α-helix	trans	-62.1	-47.4	177.6	170.6	0	0	0	0	110.6	Y354 K357 D363 K369 D370 I371	Y354-V367 HydrophobicContact CD2-CG1 4.36Å; K357-V367 HydrophobicContact CB-CG1 3.79Å; D363-V367 WeakPolarHBondContact O-CG2 3.28Å; D363-V367 PolarHBondContact O-N 3.41Å; V367-K369 VanDerWaalsContact C-N 3.34Å; V367-D370 PolarHBondContact O-N 3.32Å; V367-I371 HydrophobicContact CG1-CD1 4Å; V367-I371 VanDerWaalsContact O-CG1 3.32Å; V367-I371 WeakPolarHBondContact O-CG1 3.48Å; V367-I371 PolarHBondContact O-N 2.84Å
368	F	93	Very high	90.2	Very high	24 Å²	24	74.9 Å²	74.9	11%	0.105	37%	0.371	C	S	.	.	H	α-helix	trans	-67.8	-38.1	-178.9	-171.1	-117.5	0	0	0	112	Y354 G364 E365 D370 I371 V372 F405 I410	Y354-F368 HydrophobicContact CD2-CB 3.76Å; Y354-F368 AromaticContact CD2-CD2 3.94Å; Y354-F368 HydrophobicContact CD2-CD2 3.94Å; Y354-F368 HydrophobicContact CD2-CG 4.23Å; Y354-F368 HydrophobicContact CE2-CB 3.81Å; Y354-F368 HydrophobicContact CG-CD2 4.22Å; G364-F368 WeakPolarHBondContact O-CB 3.34Å; G364-F368 PolarHBondContact O-N 3.36Å; E365-F368 PolarHBondContact O-N 3.38Å; F368-D370 PolarHBondContact O-N 3.14Å; F368-I371 PolarHBondContact O-N 3.46Å; F368-V372 HydrophobicContact CD1-CG2 4.13Å; F368-V372 HydrophobicContact CD2-CG2 4.32Å; F368-V372 HydrophobicContact CE1-CG2 3.64Å; F368-V372 HydrophobicContact CE2-CG2 3.83Å; F368-V372 HydrophobicContact CG-CG2 4.44Å; F368-V372 HydrophobicContact CZ-CG2 3.44Å; F368-V372 VanDerWaalsContact CZ-CG2 3.44Å; F368-V372 WeakPolarHBondContact O-CG2 3.31Å; F368-V372 PolarHBondContact O-N 3.21Å; F368-F405 HydrophobicContact CE1-CB 3.85Å; F368-F405 HydrophobicContact CE1-CD1 4.15Å; F368-F405 HydrophobicContact CE1-CD2 4.45Å; F368-F405 AromaticContact CE1-CG 3.93Å; F368-F405 HydrophobicContact CE1-CG 3.93Å; F368-F405 HydrophobicContact CZ-CB 4.03Å; F368-F405 AromaticContact CZ-CD1 3.67Å; F368-F405 HydrophobicContact CZ-CD1 3.67Å; F368-F405 AromaticContact CZ-CD2 3.8Å; F368-F405 HydrophobicContact CZ-CD2 3.8Å; F368-F405 HydrophobicContact CZ-CE1 4.01Å; F368-F405 HydrophobicContact CZ-CE2 4.14Å; F368-F405 AromaticContact CZ-CG 3.57Å; F368-F405 HydrophobicContact CZ-CG 3.57Å; F368-F405 HydrophobicContact CZ-CZ 4.25Å; F368-I410 HydrophobicContact CD1-CB 4.16Å; F368-I410 HydrophobicContact CD1-CG2 3.99Å; F368-I410 HydrophobicContact CD2-CB 3.98Å; F368-I410 HydrophobicContact CD2-CG1 4Å; F368-I410 HydrophobicContact CD2-CG2 3.91Å; F368-I410 HydrophobicContact CE1-CB 3.79Å; F368-I410 HydrophobicContact CE1-CG2 4.15Å; F368-I410 HydrophobicContact CE2-CB 3.62Å; F368-I410 HydrophobicContact CE2-CD1 3.74Å; F368-I410 HydrophobicContact CE2-CG1 3.51Å; F368-I410 HydrophobicContact CE2-CG2 4.1Å; F368-I410 HydrophobicContact CG-CB 4.25Å; F368-I410 HydrophobicContact CG-CG2 3.87Å; F368-I410 HydrophobicContact CZ-CB 3.53Å; F368-I410 HydrophobicContact CZ-CD1 3.91Å; F368-I410 HydrophobicContact CZ-CG1 3.86Å; F368-I410 HydrophobicContact CZ-CG2 4.23Å
369	K	92.7	Very high	90.4	Very high	115 Å²	115	78.4 Å²	78.4	50%	0.5	38%	0.382	S	S	.	.	H	α-helix	trans	-59.1	-45.2	174.4	-173.4	176	176.3	179.8	0	112.2	E365 L366 V367 I371 V372 E373	E365-K369 WeakPolarHBondContact O-CB 3.28Å; E365-K369 PolarHBondContact O-N 3.44Å; L366-K369 PolarHBondContact O-N 3.3Å; V367-K369 VanDerWaalsContact C-N 3.34Å; K369-I371 VanDerWaalsContact C-N 3.29Å; K369-I371 PolarHBondContact O-N 3.23Å; K369-V372 PolarHBondContact O-N 2.67Å; K369-E373 WeakPolarHBondContact CE-OE1 3.44Å; K369-E373 HydrophobicContact CG-CG 4.27Å; K369-E373 WeakPolarHBondContact O-CB 3.29Å; K369-E373 WeakPolarHBondContact O-CG 3.46Å; K369-E373 PolarHBondContact O-N 2.55Å
370	D	93.2	Very high	90.6	Very high	65 Å²	65	74.3 Å²	74.3	35%	0.348	36%	0.357	S	S	.	.	H	α-helix	trans	-59.6	-39.1	175.2	-175.6	46	0	0	0	111.7	L366 V367 F368 D374 K377 F378	L366-D370 PolarHBondContact O-N 3.01Å; V367-D370 PolarHBondContact O-N 3.32Å; F368-D370 PolarHBondContact O-N 3.14Å; D370-D374 PolarHBondContact O-N 3.47Å; D370-K377 VanDerWaalsContact CG-NZ 3.27Å; D370-K377 IonicContact OD1-NZ 2.94Å; D370-K377 PolarHBondContact OD1-NZ 3.26Å; D370-K377 IonicContact OD2-NZ 2.74Å; D370-K377 PolarHBondContact OD2-NZ 3.28Å; D370-F378 VanDerWaalsContact OD2-CZ 3.31Å; D370-F378 WeakPolarHBondContact OD2-CZ 3.42Å
371	I	93.7	Very high	91.1	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.1	-40.9	177.7	-62.8	164.4	0	0	0	112.2	Y350 T353 V367 F368 K369 D374 P375 F378 I380	Y350-I371 HydrophobicContact CD1-CG2 3.73Å; Y350-I371 HydrophobicContact CE1-CG2 4.03Å; T353-I371 HydrophobicContact CG2-CD1 3.94Å; T353-I371 HydrophobicContact CG2-CG1 4.21Å; T353-I371 HydrophobicContact CG2-CG2 4.27Å; V367-I371 HydrophobicContact CG1-CD1 4Å; V367-I371 VanDerWaalsContact O-CG1 3.32Å; V367-I371 WeakPolarHBondContact O-CG1 3.48Å; V367-I371 PolarHBondContact O-N 2.84Å; F368-I371 PolarHBondContact O-N 3.46Å; K369-I371 VanDerWaalsContact C-N 3.29Å; K369-I371 PolarHBondContact O-N 3.23Å; I371-D374 CarbonylContact O-C 3.51Å; I371-P375 WeakPolarHBondContact O-CA 3.41Å; I371-F378 HydrophobicContact CB-CD2 4.16Å; I371-F378 HydrophobicContact CB-CE2 4.15Å; I371-F378 HydrophobicContact CG1-CD1 4.25Å; I371-F378 HydrophobicContact CG1-CD2 3.97Å; I371-F378 HydrophobicContact CG1-CE1 4.02Å; I371-F378 HydrophobicContact CG1-CE2 3.75Å; I371-F378 HydrophobicContact CG1-CG 4.22Å; I371-F378 HydrophobicContact CG1-CZ 3.75Å; I371-F378 HydrophobicContact CG2-CD2 4.23Å; I371-F378 HydrophobicContact CG2-CG 4.47Å; I371-I380 HydrophobicContact CG2-CD1 4.42Å
372	V	93.4	Very high	91.4	Very high	18 Å²	18	62.2 Å²	62.2	11%	0.109	30%	0.303	C	S	.	.	H	α-helix	trans	-76.7	-34.5	-178.3	173.9	0	0	0	0	111.8	Y350 F368 K369 K402 F405	Y350-V372 HydrophobicContact CE1-CG2 4.34Å; F368-V372 HydrophobicContact CD1-CG2 4.13Å; F368-V372 HydrophobicContact CD2-CG2 4.32Å; F368-V372 HydrophobicContact CE1-CG2 3.64Å; F368-V372 HydrophobicContact CE2-CG2 3.83Å; F368-V372 HydrophobicContact CG-CG2 4.44Å; F368-V372 HydrophobicContact CZ-CG2 3.44Å; F368-V372 VanDerWaalsContact CZ-CG2 3.44Å; F368-V372 WeakPolarHBondContact O-CG2 3.31Å; F368-V372 PolarHBondContact O-N 3.21Å; K369-V372 PolarHBondContact O-N 2.67Å; V372-K402 HydrophobicContact CG1-CB 3.99Å; V372-K402 HydrophobicContact CG1-CG 4.08Å; V372-F405 HydrophobicContact CG2-CB 4.42Å; V372-F405 HydrophobicContact CG2-CD2 3.83Å; V372-F405 HydrophobicContact CG2-CG 4.39Å
373	E	92.9	Very high	91.6	Very high	111 Å²	111	62.6 Å²	62.6	52%	0.519	30%	0.304	S	S	.	.	H	α-helix	trans	-69.7	-38.1	177.5	-74.9	-177.5	170	0	0	112.5	K369	K369-E373 WeakPolarHBondContact CE-OE1 3.44Å; K369-E373 HydrophobicContact CG-CG 4.27Å; K369-E373 WeakPolarHBondContact O-CB 3.29Å; K369-E373 WeakPolarHBondContact O-CG 3.46Å; K369-E373 PolarHBondContact O-N 2.55Å
374	D	92.4	Very high	91.6	Very high	72 Å²	72	58.5 Å²	58.5	39%	0.385	28%	0.282	S	S	.	.			trans	-132.7	78.5	176.1	-170.6	-8.4	0	0	0	112.3	D370 I371 D376 K377 F378	D370-D374 PolarHBondContact O-N 3.47Å; I371-D374 CarbonylContact O-C 3.51Å; D374-D376 PolarHBondContact O-N 2.99Å; D374-D376 PolarHBondContact OD1-N 3.49Å; D374-K377 HydrophobicContact CB-CB 4.16Å; D374-K377 WeakPolarHBondContact O-CB 2.8Å; D374-K377 PolarHBondContact O-N 3.04Å; D374-K377 PolarHBondContact OD1-N 3.11Å; D374-K377 WeakPolarHBondContact OD2-CB 3.12Å; D374-F378 VanDerWaalsContact O-CD2 3.3Å; D374-F378 WeakPolarHBondContact O-CD2 3.45Å
375	P	92.4	Very high	91.7	Very high	8 Å²	8	60.9 Å²	60.9	5%	0.052	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.9	179.1	28.1	-35.2	0	0	0	113.5	Y350 I371 F378 Y379 I380 F381 R398	Y350-P375 HydrophobicContact CE1-CB 4.22Å; Y350-P375 WeakPolarHBondContact OH-CB 3.46Å; I371-P375 WeakPolarHBondContact O-CA 3.41Å; P375-F378 PolarHBondContact O-N 3.39Å; P375-Y379 PolarHBondContact O-N 2.96Å; P375-I380 HydrophobicContact CB-CB 4.15Å; P375-I380 HydrophobicContact CB-CG1 4Å; P375-I380 WeakPolarHBondContact O-CG1 3.45Å; P375-I380 PolarHBondContact O-N 3.19Å; P375-F381 HydrophobicContact CB-CD2 4.2Å; P375-F381 HydrophobicContact CB-CE2 4.09Å; P375-F381 HydrophobicContact CG-CD2 4.42Å; P375-F381 HydrophobicContact CG-CE2 4.13Å; P375-R398 HydrophobicContact CG-CB 4.36Å; P375-R398 HydrophobicContact CG-CG 4.42Å
376	D	91	Very high	91.7	Very high	51 Å²	51	57.4 Å²	57.4	27%	0.273	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-35.6	179.5	-77.3	-11.3	0	0	0	111.1	D374 F378 Y379 R398	D374-D376 PolarHBondContact O-N 2.99Å; D374-D376 PolarHBondContact OD1-N 3.49Å; D376-F378 PolarHBondContact O-N 2.69Å; D376-Y379 PolarHBondContact O-N 2.82Å; D376-R398 IonicContact OD1-CZ 3.87Å; D376-R398 IonicContact OD1-NE 2.67Å; D376-R398 PolarHBondContact OD1-NE 3.27Å; D376-R398 IonicContact OD1-NH2 3.99Å; D376-R398 PolarHBondContact OD1-NH2 3.42Å; D376-R398 IonicContact OD2-CZ 3.79Å; D376-R398 VanDerWaalsContact OD2-CZ 3.26Å; D376-R398 IonicContact OD2-NE 2.93Å; D376-R398 PolarHBondContact OD2-NE 2.99Å; D376-R398 IonicContact OD2-NH2 3.59Å; D376-R398 PolarHBondContact OD2-NH2 2.98Å
377	K	92.8	Very high	91.3	Very high	108 Å²	108	56.6 Å²	56.6	47%	0.47	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-34.3	169.1	177.9	-174.6	178.2	-167.4	0	112.5	D370 D374 Y379	D370-K377 VanDerWaalsContact CG-NZ 3.27Å; D370-K377 IonicContact OD1-NZ 2.94Å; D370-K377 PolarHBondContact OD1-NZ 3.26Å; D370-K377 IonicContact OD2-NZ 2.74Å; D370-K377 PolarHBondContact OD2-NZ 3.28Å; D374-K377 HydrophobicContact CB-CB 4.16Å; D374-K377 WeakPolarHBondContact O-CB 2.8Å; D374-K377 PolarHBondContact O-N 3.04Å; D374-K377 PolarHBondContact OD1-N 3.11Å; D374-K377 WeakPolarHBondContact OD2-CB 3.12Å; K377-Y379 WeakPolarHBondContact O-CE2 3.31Å
378	F	92.2	Very high	90	Very high	25 Å²	25	61.8 Å²	61.8	11%	0.11	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	7.2	178.6	-60.5	-82.4	0	0	0	113.9	T353 K357 D370 I371 D374 P375 D376 I380	T353-F378 HydrophobicContact CG2-CB 3.85Å; T353-F378 HydrophobicContact CG2-CD1 3.67Å; T353-F378 HydrophobicContact CG2-CG 3.94Å; K357-F378 HydrophobicContact CD-CE1 4.27Å; K357-F378 HydrophobicContact CG-CD1 4.47Å; K357-F378 HydrophobicContact CG-CE1 4.09Å; D370-F378 VanDerWaalsContact OD2-CZ 3.31Å; D370-F378 WeakPolarHBondContact OD2-CZ 3.42Å; I371-F378 HydrophobicContact CB-CD2 4.16Å; I371-F378 HydrophobicContact CB-CE2 4.15Å; I371-F378 HydrophobicContact CG1-CD1 4.25Å; I371-F378 HydrophobicContact CG1-CD2 3.97Å; I371-F378 HydrophobicContact CG1-CE1 4.02Å; I371-F378 HydrophobicContact CG1-CE2 3.75Å; I371-F378 HydrophobicContact CG1-CG 4.22Å; I371-F378 HydrophobicContact CG1-CZ 3.75Å; I371-F378 HydrophobicContact CG2-CD2 4.23Å; I371-F378 HydrophobicContact CG2-CG 4.47Å; D374-F378 VanDerWaalsContact O-CD2 3.3Å; D374-F378 WeakPolarHBondContact O-CD2 3.45Å; P375-F378 PolarHBondContact O-N 3.39Å; D376-F378 PolarHBondContact O-N 2.69Å; F378-I380 HydrophobicContact CB-CD1 4.04Å; F378-I380 HydrophobicContact CB-CG1 4.04Å; F378-I380 PolarHBondContact O-N 2.92Å; F378-I380 VanDerWaalsContact O-N 3.14Å
379	Y	92.6	Very high	89.2	Confident	140 Å²	140	65.5 Å²	65.5	55%	0.549	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	24.9	177.8	-57	-95.2	0	0	0	114.1	P375 D376 K377 F381 K382 T383	P375-Y379 PolarHBondContact O-N 2.96Å; D376-Y379 PolarHBondContact O-N 2.82Å; K377-Y379 WeakPolarHBondContact O-CE2 3.31Å; Y379-F381 PolarHBondContact O-N 3.21Å; Y379-K382 HydrophobicContact CD1-CB 4.46Å; Y379-K382 HydrophobicContact CD1-CD 3.67Å; Y379-K382 HydrophobicContact CE1-CD 4.27Å; Y379-K382 PolarHBondContact O-N 3.15Å; Y379-T383 PolarHBondContact O-N 3.42Å; Y379-T383 PolarHBondContact O-OG1 3.1Å
380	I	92.8	Very high	88.8	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-55.7	-57.6	-172.4	-58.3	-63.9	0	0	0	111	L346 R349 Y350 T353 I371 P375 F378 T383 I384	L346-I380 HydrophobicContact CD2-CG2 4.13Å; R349-I380 HydrophobicContact CB-CG2 4.3Å; R349-I380 HydrophobicContact CG-CB 4.48Å; R349-I380 HydrophobicContact CG-CD1 3.95Å; R349-I380 HydrophobicContact CG-CG2 3.99Å; Y350-I380 HydrophobicContact CD1-CG1 4.49Å; Y350-I380 HydrophobicContact CD2-CG2 3.94Å; Y350-I380 HydrophobicContact CE1-CG1 4.28Å; Y350-I380 HydrophobicContact CE1-CG2 4.48Å; Y350-I380 HydrophobicContact CE2-CG2 3.7Å; Y350-I380 HydrophobicContact CG-CG2 4.41Å; T353-I380 HydrophobicContact CG2-CD1 4.15Å; T353-I380 WeakPolarHBondContact OG1-CD1 3.44Å; I371-I380 HydrophobicContact CG2-CD1 4.42Å; P375-I380 HydrophobicContact CB-CB 4.15Å; P375-I380 HydrophobicContact CB-CG1 4Å; P375-I380 WeakPolarHBondContact O-CG1 3.45Å; P375-I380 PolarHBondContact O-N 3.19Å; F378-I380 HydrophobicContact CB-CD1 4.04Å; F378-I380 HydrophobicContact CB-CG1 4.04Å; F378-I380 PolarHBondContact O-N 2.92Å; F378-I380 VanDerWaalsContact O-N 3.14Å; I380-T383 PolarHBondContact O-N 2.58Å; I380-I384 PolarHBondContact O-N 2.81Å
381	F	91.8	Very high	88.5	Confident	11 Å²	11	60.1 Å²	60.1	5%	0.048	32%	0.315	C	S	.	.	H	α-helix	trans	-70.3	-35.6	-179.1	-72.4	-100.1	0	0	0	112.1	L346 P375 Y379 T383 I384 L385 L395 R398 Y401	L346-F381 HydrophobicContact CD1-CE1 4.1Å; L346-F381 HydrophobicContact CD2-CD1 3.95Å; L346-F381 HydrophobicContact CD2-CE1 3.99Å; L346-F381 HydrophobicContact CD2-CG 4.24Å; L346-F381 HydrophobicContact CD2-CZ 4.28Å; P375-F381 HydrophobicContact CB-CD2 4.2Å; P375-F381 HydrophobicContact CB-CE2 4.09Å; P375-F381 HydrophobicContact CG-CD2 4.42Å; P375-F381 HydrophobicContact CG-CE2 4.13Å; Y379-F381 PolarHBondContact O-N 3.21Å; F381-T383 VanDerWaalsContact C-N 3.35Å; F381-T383 PolarHBondContact O-N 2.75Å; F381-I384 PolarHBondContact O-N 2.79Å; F381-L385 WeakPolarHBondContact O-CB 3.28Å; F381-L385 WeakPolarHBondContact O-CG 3.35Å; F381-L385 PolarHBondContact O-N 3.47Å; F381-L395 HydrophobicContact CD1-CB 4.4Å; F381-L395 HydrophobicContact CD1-CD1 4.19Å; F381-L395 HydrophobicContact CD1-CD2 4.17Å; F381-R398 HydrophobicContact CD2-CG 4.32Å; F381-R398 HydrophobicContact CE2-CB 4.46Å; F381-R398 HydrophobicContact CE2-CG 3.93Å; F381-R398 HydrophobicContact CZ-CG 4.07Å; F381-Y401 AromaticContact CZ-CD2 3.93Å; F381-Y401 HydrophobicContact CZ-CD2 3.93Å; F381-Y401 HydrophobicContact CZ-CE2 4.2Å
382	K	89.9	Confident	88	Confident	117 Å²	117	67.5 Å²	67.5	51%	0.509	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-39.5	178.2	-71.4	178.5	179.4	175	0	111.9	Y379 L385 A386	Y379-K382 HydrophobicContact CD1-CB 4.46Å; Y379-K382 HydrophobicContact CD1-CD 3.67Å; Y379-K382 HydrophobicContact CE1-CD 4.27Å; Y379-K382 PolarHBondContact O-N 3.15Å; K382-L385 PolarHBondContact O-N 3.22Å; K382-A386 PolarHBondContact O-N 2.83Å; K382-A386 VanDerWaalsContact O-N 3.08Å
383	T	89.6	Confident	87.6	Confident	48 Å²	48	75.7 Å²	75.7	29%	0.294	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-39.3	175.8	-58	0	0	0	0	111.8	Y379 I380 F381 A386	Y379-T383 PolarHBondContact O-N 3.42Å; Y379-T383 PolarHBondContact O-OG1 3.1Å; I380-T383 PolarHBondContact O-N 2.58Å; F381-T383 VanDerWaalsContact C-N 3.35Å; F381-T383 PolarHBondContact O-N 2.75Å; T383-A386 PolarHBondContact O-N 3.1Å
384	I	89.6	Confident	87.1	Confident	3 Å²	3	73.9 Å²	73.9	2%	0.015	38%	0.376	C	S	.	.	H	α-helix	trans	-70.8	-38.4	177.8	-60.7	-47.7	0	0	0	111.4	L345 L346 R349 I380 F381 A386 K387 V390 L395	L345-I384 HydrophobicContact CB-CD1 4.04Å; L346-I384 HydrophobicContact CD2-CB 4.3Å; L346-I384 HydrophobicContact CD2-CG1 3.76Å; L346-I384 HydrophobicContact CG-CG1 4.24Å; R349-I384 HydrophobicContact CB-CD1 4.23Å; I380-I384 PolarHBondContact O-N 2.81Å; F381-I384 PolarHBondContact O-N 2.79Å; I384-A386 VanDerWaalsContact C-N 3.26Å; I384-A386 PolarHBondContact O-N 3.39Å; I384-K387 WeakPolarHBondContact O-CB 3.49Å; I384-K387 PolarHBondContact O-N 2.91Å; I384-K387 VanDerWaalsContact O-N 3.1Å; I384-V390 HydrophobicContact CG2-CB 4.48Å; I384-V390 HydrophobicContact CG2-CG1 4.11Å; I384-V390 HydrophobicContact CG2-CG2 4.07Å; I384-L395 HydrophobicContact CG2-CD2 4.33Å
385	L	88.9	Confident	86.8	Confident	65 Å²	65	71.7 Å²	71.7	34%	0.34	36%	0.364	S	S	.	.	H	α-helix	trans	-63.3	-28.9	174.2	-76.9	171.9	0	0	0	113.8	F381 K382 K387 K392 L395	F381-L385 WeakPolarHBondContact O-CB 3.28Å; F381-L385 WeakPolarHBondContact O-CG 3.35Å; F381-L385 PolarHBondContact O-N 3.47Å; K382-L385 PolarHBondContact O-N 3.22Å; L385-K387 PolarHBondContact O-N 2.83Å; L385-K392 HydrophobicContact CD2-CB 3.92Å; L385-K392 HydrophobicContact CD2-CG 4.5Å; L385-L395 HydrophobicContact CD1-CD1 4.02Å; L385-L395 HydrophobicContact CD2-CD1 3.41Å; L385-L395 VanDerWaalsContact CD2-CD1 3.41Å; L385-L395 HydrophobicContact CG-CD1 3.58Å
386	A	88.1	Confident	86.5	Confident	84 Å²	84	73.3 Å²	73.3	69%	0.694	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.6	175.8	0	0	0	0	0	112.8	K382 T383 I384	K382-A386 PolarHBondContact O-N 2.83Å; K382-A386 VanDerWaalsContact O-N 3.08Å; T383-A386 PolarHBondContact O-N 3.1Å; I384-A386 VanDerWaalsContact C-N 3.26Å; I384-A386 PolarHBondContact O-N 3.39Å
387	K	83.3	Confident	86.3	Confident	95 Å²	95	76.8 Å²	76.8	41%	0.413	39%	0.393	S	S	.	.	S	Bend	trans	-78.5	135.5	174.1	-60.8	-171.1	175.8	-169	0	110	L345 I384 L385 N389 V390	L345-K387 HydrophobicContact CD1-CD 4.3Å; I384-K387 WeakPolarHBondContact O-CB 3.49Å; I384-K387 PolarHBondContact O-N 2.91Å; I384-K387 VanDerWaalsContact O-N 3.1Å; L385-K387 PolarHBondContact O-N 2.83Å; K387-N389 PolarHBondContact O-N 2.78Å; K387-V390 HydrophobicContact CB-CG2 4.4Å; K387-V390 PolarHBondContact O-N 2.83Å
388	T	63.5	Low	86.1	Confident	137 Å²	137	77.9 Å²	77.9	84%	0.84	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.4	-172.3	50.2	0	0	0	0	115.5
389	N	77.5	Confident	85.9	Confident	102 Å²	102	83.9 Å²	83.9	55%	0.545	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	28.3	-173.4	-67.8	-29.2	0	0	0	113.8	R341 K387	R341-N389 PolarHBondContact NH2-O 2.68Å; K387-N389 PolarHBondContact O-N 2.78Å
390	V	83.8	Confident	85.8	Confident	20 Å²	20	78.7 Å²	78.7	12%	0.121	41%	0.409	C	S	.	.			trans	-130.3	124.5	177.7	-175.8	0	0	0	0	111.1	I342 I384 K387 L395	I342-V390 HydrophobicContact CD1-CG1 4.09Å; I342-V390 HydrophobicContact CG1-CG1 4.2Å; I342-V390 HydrophobicContact CG1-CG2 4.34Å; I384-V390 HydrophobicContact CG2-CB 4.48Å; I384-V390 HydrophobicContact CG2-CG1 4.11Å; I384-V390 HydrophobicContact CG2-CG2 4.07Å; K387-V390 HydrophobicContact CB-CG2 4.4Å; K387-V390 PolarHBondContact O-N 2.83Å; V390-L395 HydrophobicContact CG1-CD2 4.21Å; V390-L395 HydrophobicContact CG1-CG 4.36Å
391	S	85.9	Confident	85.8	Confident	47 Å²	47	78.7 Å²	78.7	33%	0.329	41%	0.409	S	S	.	.			trans	-87.8	147.6	170.6	-178.9	0	0	0	0	111.1	F393 D394	S391-F393 PolarHBondContact O-N 3.02Å; S391-F393 PolarHBondContact OG-N 3.27Å; S391-D394 VanDerWaalsContact CB-OD2 3.32Å; S391-D394 WeakPolarHBondContact CB-OD2 3.38Å; S391-D394 PolarHBondContact O-N 2.7Å
392	K	84.8	Confident	85.7	Confident	155 Å²	155	83.8 Å²	83.8	67%	0.674	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-60.5	-32.5	170.7	-174.9	-177.6	175.6	-173.4	0	112.5	L385 D394 L395	L385-K392 HydrophobicContact CD2-CB 3.92Å; L385-K392 HydrophobicContact CD2-CG 4.5Å; K392-D394 VanDerWaalsContact C-N 3.27Å; K392-D394 PolarHBondContact O-N 3.29Å; K392-L395 PolarHBondContact O-N 3.11Å
393	F	83.1	Confident	85.8	Confident	190 Å²	190	83.7 Å²	83.7	83%	0.833	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-76.3	-15	-178.7	-59.4	-74	0	0	0	113.3	S391	S391-F393 PolarHBondContact O-N 3.02Å; S391-F393 PolarHBondContact OG-N 3.27Å
394	D	83.3	Confident	86	Confident	73 Å²	73	81.7 Å²	81.7	39%	0.39	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-89.4	-9.6	177.2	-63.1	-31.1	0	0	0	112.7	I342 S391 K392	I342-D394 HydrophobicContact CD1-CB 3.5Å; S391-D394 VanDerWaalsContact CB-OD2 3.32Å; S391-D394 WeakPolarHBondContact CB-OD2 3.38Å; S391-D394 PolarHBondContact O-N 2.7Å; K392-D394 VanDerWaalsContact C-N 3.27Å; K392-D394 PolarHBondContact O-N 3.29Å
395	L	85.8	Confident	86.3	Confident	27 Å²	27	82.2 Å²	82.2	14%	0.141	43%	0.425	C	S	.	.	S	Bend	trans	-78.3	132.9	-179.1	-70	167.1	0	0	0	110.5	I342 L346 F381 I384 L385 V390 K392	I342-L395 HydrophobicContact CG2-CD2 3.7Å; L346-L395 HydrophobicContact CD1-CD2 3.9Å; F381-L395 HydrophobicContact CD1-CB 4.4Å; F381-L395 HydrophobicContact CD1-CD1 4.19Å; F381-L395 HydrophobicContact CD1-CD2 4.17Å; I384-L395 HydrophobicContact CG2-CD2 4.33Å; L385-L395 HydrophobicContact CD1-CD1 4.02Å; L385-L395 HydrophobicContact CD2-CD1 3.41Å; L385-L395 VanDerWaalsContact CD2-CD1 3.41Å; L385-L395 HydrophobicContact CG-CD1 3.58Å; V390-L395 HydrophobicContact CG1-CD2 4.21Å; V390-L395 HydrophobicContact CG1-CG 4.36Å; K392-L395 PolarHBondContact O-N 3.11Å
396	P	86.6	Confident	86.4	Confident	41 Å²	41	82.5 Å²	82.5	27%	0.266	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-68.3	163.4	172.9	32.8	-38.7	0	0	0	111.2	L80 L346 Y401	L80-P396 HydrophobicContact CD2-CG 4.5Å; L346-P396 HydrophobicContact CD1-CG 4.18Å; P396-Y401 HydrophobicContact CG-CD2 4.3Å; P396-Y401 HydrophobicContact CG-CE2 3.48Å; P396-Y401 VanDerWaalsContact CG-CE2 3.48Å
397	N	86.7	Confident	86.6	Confident	125 Å²	125	84.4 Å²	84.4	67%	0.668	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-62.1	143.6	174.6	-69.4	-24.5	0	0	0	110.9	E399 A400	N397-E399 VanDerWaalsContact C-N 3.28Å; N397-E399 PolarHBondContact O-N 2.91Å; N397-A400 VanDerWaalsContact O-CB 3.31Å; N397-A400 WeakPolarHBondContact O-CB 3.3Å; N397-A400 PolarHBondContact O-N 3.47Å; N397-A400 VanDerWaalsContact O-N 3.14Å
398	R	87.8	Confident	87.1	Confident	130 Å²	130	79.9 Å²	79.9	49%	0.491	42%	0.421	S	S	.	.	H	α-helix	trans	-59.5	-41	-179.8	-60.8	179.6	-179.8	92.2	-15.1	112	P375 D376 F381 A400 Y401	P375-R398 HydrophobicContact CG-CB 4.36Å; P375-R398 HydrophobicContact CG-CG 4.42Å; D376-R398 IonicContact OD1-CZ 3.87Å; D376-R398 IonicContact OD1-NE 2.67Å; D376-R398 PolarHBondContact OD1-NE 3.27Å; D376-R398 IonicContact OD1-NH2 3.99Å; D376-R398 PolarHBondContact OD1-NH2 3.42Å; D376-R398 IonicContact OD2-CZ 3.79Å; D376-R398 VanDerWaalsContact OD2-CZ 3.26Å; D376-R398 IonicContact OD2-NE 2.93Å; D376-R398 PolarHBondContact OD2-NE 2.99Å; D376-R398 IonicContact OD2-NH2 3.59Å; D376-R398 PolarHBondContact OD2-NH2 2.98Å; F381-R398 HydrophobicContact CD2-CG 4.32Å; F381-R398 HydrophobicContact CE2-CB 4.46Å; F381-R398 HydrophobicContact CE2-CG 3.93Å; F381-R398 HydrophobicContact CZ-CG 4.07Å; R398-A400 PolarHBondContact O-N 3.44Å; R398-Y401 PolarHBondContact O-N 2.66Å; R398-Y401 VanDerWaalsContact O-N 3.09Å
399	E	88.5	Confident	88.5	Confident	152 Å²	152	76.8 Å²	76.8	71%	0.71	40%	0.403	S	S	*	.	H	α-helix	trans	-58	-33.4	178.6	-67.8	166.9	-172.4	0	0	112.2	N397 Y401 K402 D403	N397-E399 VanDerWaalsContact C-N 3.28Å; N397-E399 PolarHBondContact O-N 2.91Å; E399-Y401 PolarHBondContact O-N 2.99Å; E399-K402 VanDerWaalsContact O-CB 3.27Å; E399-K402 WeakPolarHBondContact O-CB 3.14Å; E399-K402 PolarHBondContact O-N 2.93Å; E399-D403 PolarHBondContact O-N 2.89Å
400	A	90.5	Very high	89.2	Confident	31 Å²	31	72.3 Å²	72.3	26%	0.256	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-29.9	178.7	0	0	0	0	0	112.7	L80 N397 R398 F404	L80-A400 HydrophobicContact CD1-CB 3.92Å; N397-A400 VanDerWaalsContact O-CB 3.31Å; N397-A400 WeakPolarHBondContact O-CB 3.3Å; N397-A400 PolarHBondContact O-N 3.47Å; N397-A400 VanDerWaalsContact O-N 3.14Å; R398-A400 PolarHBondContact O-N 3.44Å; A400-F404 VanDerWaalsContact O-CB 3.27Å; A400-F404 WeakPolarHBondContact O-CB 3.27Å; A400-F404 PolarHBondContact O-N 2.53Å
401	Y	92.5	Very high	89.5	Confident	0 Å²	0	76 Å²	76	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-75.8	-24.9	175.6	-83.4	-79.2	0	0	0	113.1	H343 L346 V347 Y350 F381 P396 R398 E399 F404 F405	H343-Y401 WeakPolarHBondContact CA-OH 3.38Å; H343-Y401 AromaticContact CE1-CE1 3.84Å; H343-Y401 AromaticContact ND1-CE1 3.66Å; H343-Y401 AromaticContact ND1-CZ 3.58Å; H343-Y401 PolarHBondContact ND1-OH 3.15Å; L346-Y401 HydrophobicContact CB-CE1 4.36Å; L346-Y401 HydrophobicContact CB-CE2 4.3Å; L346-Y401 WeakPolarHBondContact CB-OH 3.39Å; L346-Y401 HydrophobicContact CD1-CE2 3.7Å; L346-Y401 VanDerWaalsContact CD1-OH 3.29Å; L346-Y401 WeakPolarHBondContact CD1-OH 3.48Å; V347-Y401 HydrophobicContact CG2-CE1 3.89Å; Y350-Y401 HydrophobicContact CD2-CD1 4.5Å; Y350-Y401 HydrophobicContact CE2-CD1 4.06Å; Y350-Y401 HydrophobicContact CE2-CD2 4.49Å; Y350-Y401 HydrophobicContact CE2-CG 4.02Å; F381-Y401 AromaticContact CZ-CD2 3.93Å; F381-Y401 HydrophobicContact CZ-CD2 3.93Å; F381-Y401 HydrophobicContact CZ-CE2 4.2Å; P396-Y401 HydrophobicContact CG-CD2 4.3Å; P396-Y401 HydrophobicContact CG-CE2 3.48Å; P396-Y401 VanDerWaalsContact CG-CE2 3.48Å; R398-Y401 PolarHBondContact O-N 2.66Å; R398-Y401 VanDerWaalsContact O-N 3.09Å; E399-Y401 PolarHBondContact O-N 2.99Å; Y401-F404 HydrophobicContact CD1-CD1 4.09Å; Y401-F404 HydrophobicContact CE1-CD1 4.43Å; Y401-F405 HydrophobicContact CD1-CD2 4.3Å; Y401-F405 AromaticContact CD1-CE2 3.68Å; Y401-F405 HydrophobicContact CD1-CE2 3.68Å; Y401-F405 HydrophobicContact CD1-CZ 4.16Å; Y401-F405 HydrophobicContact CG-CE2 4.36Å; Y401-F405 WeakPolarHBondContact O-CB 3.46Å; Y401-F405 WeakPolarHBondContact O-CD2 3.45Å; Y401-F405 PolarHBondContact O-N 3.27Å
402	K	91.3	Very high	89.8	Confident	118 Å²	118	76.6 Å²	76.6	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-64.2	-47.6	172.6	-172.9	178.4	179.5	177.1	0	110.6	V372 E399 G406	V372-K402 HydrophobicContact CG1-CB 3.99Å; V372-K402 HydrophobicContact CG1-CG 4.08Å; E399-K402 VanDerWaalsContact O-CB 3.27Å; E399-K402 WeakPolarHBondContact O-CB 3.14Å; E399-K402 PolarHBondContact O-N 2.93Å; K402-G406 PolarHBondContact O-N 3.13Å
403	D	91.3	Very high	90.3	Very high	115 Å²	115	69.7 Å²	69.7	62%	0.615	38%	0.38	S	S	*	.	H	α-helix	trans	-67.5	-44.3	177.9	-60.6	-26.3	0	0	0	111.3	E399 F405 G406 I407	E399-D403 PolarHBondContact O-N 2.89Å; D403-F405 PolarHBondContact O-N 3.17Å; D403-G406 PolarHBondContact O-N 3.37Å; D403-G406 VanDerWaalsContact O-N 3.13Å; D403-I407 PolarHBondContact O-N 3.21Å
404	F	94.3	Very high	90.8	Very high	5 Å²	5	66.6 Å²	66.6	2%	0.022	37%	0.366	C	S	.	.	H	α-helix	trans	-55.7	-48.9	177.5	174.2	-99.4	0	0	0	112.4	Y75 K76 E79 L80 H343 V347 A400 Y401 G406 I407 N408 F413	Y75-F404 WeakPolarHBondContact O-CZ 3.45Å; K76-F404 HydrophobicContact CB-CE2 4.24Å; K76-F404 HydrophobicContact CB-CZ 4.39Å; E79-F404 HydrophobicContact CB-CD2 4.4Å; E79-F404 HydrophobicContact CB-CE2 4.31Å; L80-F404 HydrophobicContact CB-CD2 4.12Å; L80-F404 HydrophobicContact CD1-CB 3.93Å; L80-F404 HydrophobicContact CD1-CD2 4.35Å; L80-F404 HydrophobicContact CD1-CG 4.31Å; H343-F404 AromaticContact CE1-CE2 3.85Å; H343-F404 AromaticContact CE1-CZ 3.67Å; H343-F404 AromaticContact NE2-CZ 3.77Å; V347-F404 HydrophobicContact CG2-CE1 3.98Å; V347-F404 HydrophobicContact CG2-CZ 4.41Å; A400-F404 VanDerWaalsContact O-CB 3.27Å; A400-F404 WeakPolarHBondContact O-CB 3.27Å; A400-F404 PolarHBondContact O-N 2.53Å; Y401-F404 HydrophobicContact CD1-CD1 4.09Å; Y401-F404 HydrophobicContact CE1-CD1 4.43Å; F404-G406 VanDerWaalsContact C-N 3.32Å; F404-I407 PolarHBondContact O-N 2.81Å; F404-N408 HydrophobicContact CE1-CB 4.29Å; F404-N408 HydrophobicContact CZ-CB 4.29Å; F404-N408 VanDerWaalsContact O-CB 3.27Å; F404-N408 WeakPolarHBondContact O-CB 3.22Å; F404-N408 PolarHBondContact O-N 2.66Å; F404-N408 PolarHBondContact O-ND2 2.98Å; F404-F413 HydrophobicContact CE1-CE1 4.48Å; F404-F413 HydrophobicContact CE1-CE2 4.14Å; F404-F413 AromaticContact CE1-CZ 3.67Å; F404-F413 HydrophobicContact CE1-CZ 3.67Å; F404-F413 HydrophobicContact CZ-CE1 4.08Å; F404-F413 HydrophobicContact CZ-CE2 4.41Å; F404-F413 AromaticContact CZ-CZ 3.51Å; F404-F413 HydrophobicContact CZ-CZ 3.51Å
405	F	94.6	Very high	91.3	Very high	15 Å²	15	64.5 Å²	64.5	7%	0.066	36%	0.355	C	S	.	.	H	α-helix	trans	-76.6	-18.2	179.8	-72.5	-55.3	0	0	0	113.6	V347 Y350 F368 V372 Y401 D403 I407 N408 I410 F413	V347-F405 HydrophobicContact CG1-CE1 4.37Å; V347-F405 HydrophobicContact CG1-CZ 4.42Å; V347-F405 HydrophobicContact CG2-CZ 4.34Å; Y350-F405 AromaticContact CD1-CE2 3.87Å; Y350-F405 HydrophobicContact CD1-CE2 3.87Å; Y350-F405 HydrophobicContact CD1-CZ 4.43Å; Y350-F405 AromaticContact CD2-CE2 3.64Å; Y350-F405 HydrophobicContact CD2-CE2 3.64Å; Y350-F405 AromaticContact CD2-CZ 3.88Å; Y350-F405 HydrophobicContact CD2-CZ 3.88Å; Y350-F405 HydrophobicContact CE1-CE2 4.13Å; Y350-F405 AromaticContact CE2-CE2 3.93Å; Y350-F405 HydrophobicContact CE2-CE2 3.93Å; Y350-F405 AromaticContact CG-CE2 3.63Å; Y350-F405 HydrophobicContact CG-CE2 3.63Å; Y350-F405 AromaticContact CG-CZ 3.82Å; Y350-F405 HydrophobicContact CG-CZ 3.82Å; F368-F405 HydrophobicContact CE1-CB 3.85Å; F368-F405 HydrophobicContact CE1-CD1 4.15Å; F368-F405 HydrophobicContact CE1-CD2 4.45Å; F368-F405 AromaticContact CE1-CG 3.93Å; F368-F405 HydrophobicContact CE1-CG 3.93Å; F368-F405 HydrophobicContact CZ-CB 4.03Å; F368-F405 AromaticContact CZ-CD1 3.67Å; F368-F405 HydrophobicContact CZ-CD1 3.67Å; F368-F405 AromaticContact CZ-CD2 3.8Å; F368-F405 HydrophobicContact CZ-CD2 3.8Å; F368-F405 HydrophobicContact CZ-CE1 4.01Å; F368-F405 HydrophobicContact CZ-CE2 4.14Å; F368-F405 AromaticContact CZ-CG 3.57Å; F368-F405 HydrophobicContact CZ-CG 3.57Å; F368-F405 HydrophobicContact CZ-CZ 4.25Å; V372-F405 HydrophobicContact CG2-CB 4.42Å; V372-F405 HydrophobicContact CG2-CD2 3.83Å; V372-F405 HydrophobicContact CG2-CG 4.39Å; Y401-F405 HydrophobicContact CD1-CD2 4.3Å; Y401-F405 AromaticContact CD1-CE2 3.68Å; Y401-F405 HydrophobicContact CD1-CE2 3.68Å; Y401-F405 HydrophobicContact CD1-CZ 4.16Å; Y401-F405 HydrophobicContact CG-CE2 4.36Å; Y401-F405 WeakPolarHBondContact O-CB 3.46Å; Y401-F405 WeakPolarHBondContact O-CD2 3.45Å; Y401-F405 PolarHBondContact O-N 3.27Å; D403-F405 PolarHBondContact O-N 3.17Å; F405-I407 PolarHBondContact O-N 2.94Å; F405-N408 WeakPolarHBondContact CA-O 3.36Å; F405-N408 WeakPolarHBondContact CD1-O 3.49Å; F405-N408 CarbonylContact O-C 3.57Å; F405-I410 HydrophobicContact CD1-CD1 4.48Å; F405-I410 HydrophobicContact CE1-CD1 3.77Å; F405-I410 HydrophobicContact CZ-CD1 4.2Å; F405-F413 HydrophobicContact CD1-CE2 4.35Å; F405-F413 HydrophobicContact CE1-CD2 4.48Å; F405-F413 HydrophobicContact CE1-CE2 4.07Å
406	G	91.5	Very high	91.5	Very high	71 Å²	71	64 Å²	64	73%	0.732	35%	0.352	S	S	*	.	H	α-helix	trans	-63.9	-31.9	169.2	0	0	0	0	0	112.6	K402 D403 F404	K402-G406 PolarHBondContact O-N 3.13Å; D403-G406 PolarHBondContact O-N 3.37Å; D403-G406 VanDerWaalsContact O-N 3.13Å; F404-G406 VanDerWaalsContact C-N 3.32Å
407	I	92.1	Very high	91.6	Very high	124 Å²	124	66.4 Å²	66.4	64%	0.636	37%	0.37	S	S	*	.	H	α-helix	trans	-92.9	-34.9	175.9	-56.9	169.8	0	0	0	110.8	D403 F404 F405 P409	D403-I407 PolarHBondContact O-N 3.21Å; F404-I407 PolarHBondContact O-N 2.81Å; F405-I407 PolarHBondContact O-N 2.94Å; I407-P409 WeakPolarHBondContact O-CD 3.23Å
408	N	93.6	Very high	91.7	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.362	C	S	.	.	S	Bend	trans	-111.5	102.3	-173.7	-66.3	-69.1	0	0	0	112.6	K76 E79 F404 F405 I410 F413	K76-N408 WeakPolarHBondContact CD-OD1 3.25Å; K76-N408 WeakPolarHBondContact CE-OD1 3.45Å; K76-N408 PolarHBondContact NZ-OD1 2.99Å; E79-N408 PolarHBondContact OE2-ND2 3.17Å; E79-N408 PolarHBondContact OE2-OD1 3.13Å; F404-N408 HydrophobicContact CE1-CB 4.29Å; F404-N408 HydrophobicContact CZ-CB 4.29Å; F404-N408 VanDerWaalsContact O-CB 3.27Å; F404-N408 WeakPolarHBondContact O-CB 3.22Å; F404-N408 PolarHBondContact O-N 2.66Å; F404-N408 PolarHBondContact O-ND2 2.98Å; F405-N408 WeakPolarHBondContact CA-O 3.36Å; F405-N408 WeakPolarHBondContact CD1-O 3.49Å; F405-N408 CarbonylContact O-C 3.57Å; N408-I410 PolarHBondContact O-N 3.24Å; N408-F413 HydrophobicContact CB-CE2 3.84Å; N408-F413 HydrophobicContact CB-CZ 3.73Å
409	P	92.3	Very high	91.6	Very high	71 Å²	71	60.8 Å²	60.8	46%	0.461	35%	0.346	S	S	.	.			trans	-64.6	138.7	179.4	26.8	-33.7	0	0	0	110.8	I407 S411 S412	I407-P409 WeakPolarHBondContact O-CD 3.23Å; P409-S411 PolarHBondContact O-N 3.21Å; P409-S411 VanDerWaalsContact O-N 3.1Å; P409-S412 WeakPolarHBondContact O-CB 3.42Å; P409-S412 PolarHBondContact O-N 3.21Å; P409-S412 PolarHBondContact O-OG 3.4Å
410	I	92.8	Very high	91.5	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.041	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-57.8	-29.4	-177.2	-167.4	59.1	0	0	0	113.2	L351 Y354 F368 F405 N408 S412 F413	L351-I410 HydrophobicContact CB-CD1 4.08Å; L351-I410 HydrophobicContact CD1-CD1 4.17Å; L351-I410 HydrophobicContact CD1-CG1 3.86Å; Y354-I410 HydrophobicContact CD1-CG1 4.26Å; Y354-I410 HydrophobicContact CD1-CG2 4.02Å; Y354-I410 HydrophobicContact CD2-CG2 4.46Å; Y354-I410 HydrophobicContact CE1-CG2 3.85Å; Y354-I410 HydrophobicContact CE2-CG2 4.31Å; Y354-I410 HydrophobicContact CG-CG1 4.42Å; Y354-I410 HydrophobicContact CG-CG2 4.29Å; F368-I410 HydrophobicContact CD1-CB 4.16Å; F368-I410 HydrophobicContact CD1-CG2 3.99Å; F368-I410 HydrophobicContact CD2-CB 3.98Å; F368-I410 HydrophobicContact CD2-CG1 4Å; F368-I410 HydrophobicContact CD2-CG2 3.91Å; F368-I410 HydrophobicContact CE1-CB 3.79Å; F368-I410 HydrophobicContact CE1-CG2 4.15Å; F368-I410 HydrophobicContact CE2-CB 3.62Å; F368-I410 HydrophobicContact CE2-CD1 3.74Å; F368-I410 HydrophobicContact CE2-CG1 3.51Å; F368-I410 HydrophobicContact CE2-CG2 4.1Å; F368-I410 HydrophobicContact CG-CB 4.25Å; F368-I410 HydrophobicContact CG-CG2 3.87Å; F368-I410 HydrophobicContact CZ-CB 3.53Å; F368-I410 HydrophobicContact CZ-CD1 3.91Å; F368-I410 HydrophobicContact CZ-CG1 3.86Å; F368-I410 HydrophobicContact CZ-CG2 4.23Å; F405-I410 HydrophobicContact CD1-CD1 4.48Å; F405-I410 HydrophobicContact CE1-CD1 3.77Å; F405-I410 HydrophobicContact CZ-CD1 4.2Å; N408-I410 PolarHBondContact O-N 3.24Å; I410-S412 PolarHBondContact O-N 3.5Å; I410-F413 HydrophobicContact CD1-CD2 4.36Å; I410-F413 PolarHBondContact O-N 3.26Å
411	S	90.1	Very high	90.9	Very high	98 Å²	98	57.5 Å²	57.5	69%	0.685	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-64.9	-19.3	176.8	55.4	0	0	0	0	113.8	P409 F413	P409-S411 PolarHBondContact O-N 3.21Å; P409-S411 VanDerWaalsContact O-N 3.1Å; S411-F413 PolarHBondContact O-N 2.85Å
412	S	92.6	Very high	89.7	Confident	59 Å²	59	68.8 Å²	68.8	41%	0.413	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-74.9	-13.5	176.6	69.6	0	0	0	0	113.5	P409 I410	P409-S412 WeakPolarHBondContact O-CB 3.42Å; P409-S412 PolarHBondContact O-N 3.21Å; P409-S412 PolarHBondContact O-OG 3.4Å; I410-S412 PolarHBondContact O-N 3.5Å
413	F	94.6	Very high	88.7	Confident	11 Å²	11	72.1 Å²	72.1	5%	0.048	40%	0.401	C	S	.	.			trans	-100	149.7	-177.3	-58.2	-78.9	0	0	0	112.4	Y75 K76 V347 L351 F404 F405 N408 I410 S411	Y75-F413 HydrophobicContact CD1-CD1 4.17Å; K76-F413 HydrophobicContact CB-CE1 4.5Å; K76-F413 HydrophobicContact CD-CE1 4.16Å; K76-F413 HydrophobicContact CD-CZ 4.15Å; K76-F413 HydrophobicContact CG-CE1 4.24Å; V347-F413 HydrophobicContact CG1-CB 4.2Å; V347-F413 HydrophobicContact CG1-CD1 3.89Å; V347-F413 HydrophobicContact CG1-CD2 4.09Å; V347-F413 HydrophobicContact CG1-CE1 4.27Å; V347-F413 HydrophobicContact CG1-CE2 4.45Å; V347-F413 HydrophobicContact CG1-CG 3.78Å; L351-F413 HydrophobicContact CD2-CB 4.33Å; L351-F413 WeakPolarHBondContact CD2-O 3.41Å; F404-F413 HydrophobicContact CE1-CE1 4.48Å; F404-F413 HydrophobicContact CE1-CE2 4.14Å; F404-F413 AromaticContact CE1-CZ 3.67Å; F404-F413 HydrophobicContact CE1-CZ 3.67Å; F404-F413 HydrophobicContact CZ-CE1 4.08Å; F404-F413 HydrophobicContact CZ-CE2 4.41Å; F404-F413 AromaticContact CZ-CZ 3.51Å; F404-F413 HydrophobicContact CZ-CZ 3.51Å; F405-F413 HydrophobicContact CD1-CE2 4.35Å; F405-F413 HydrophobicContact CE1-CD2 4.48Å; F405-F413 HydrophobicContact CE1-CE2 4.07Å; N408-F413 HydrophobicContact CB-CE2 3.84Å; N408-F413 HydrophobicContact CB-CZ 3.73Å; I410-F413 HydrophobicContact CD1-CD2 4.36Å; I410-F413 PolarHBondContact O-N 3.26Å; S411-F413 PolarHBondContact O-N 2.85Å
414	K	93.6	Very high	87.6	Confident	124 Å²	124	68 Å²	68	54%	0.539	39%	0.385	S	S	.	.			trans	-108.5	157.5	171.9	-60.7	179.1	-178.4	175.9	0	110	Y75 Q418	Y75-K414 PolarHBondContact OH-O 2.91Å; K414-Q418 HydrophobicContact CB-CB 4.33Å
415	L	94	Very high	87.1	Confident	29 Å²	29	69.3 Å²	69.3	15%	0.152	40%	0.401	C	S	.	.			trans	-66.5	148.9	174.3	-69.7	167	0	0	0	109.9	D348 L351 Q352 K355 S417 Q418 Q419	D348-L415 VanDerWaalsContact OD1-CA 3.3Å; D348-L415 WeakPolarHBondContact OD1-CA 3.47Å; D348-L415 WeakPolarHBondContact OD1-CD2 3.21Å; L351-L415 HydrophobicContact CB-CD2 4.33Å; L351-L415 HydrophobicContact CD2-CD2 3.86Å; L351-L415 HydrophobicContact CD2-CG 3.94Å; L351-L415 HydrophobicContact CG-CD2 3.95Å; L351-L415 HydrophobicContact CG-CG 4.4Å; Q352-L415 HydrophobicContact CG-CD2 3.62Å; K355-L415 HydrophobicContact CD-CD1 4.26Å; L415-S417 PolarHBondContact O-N 2.9Å; L415-Q418 HydrophobicContact CB-CG 4.19Å; L415-Q418 WeakPolarHBondContact O-CA 3.29Å; L415-Q418 WeakPolarHBondContact O-CB 3.49Å; L415-Q418 PolarHBondContact O-N 3.21Å; L415-Q419 PolarHBondContact O-N 3.29Å
416	L	91.4	Very high	86.9	Confident	16 Å²	16	70 Å²	70	8%	0.084	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-57.8	-34.7	178.7	-81.6	169.2	0	0	0	112.2	L71 Y75 A344 L345 D348 Q418 Q419 L428	L71-L416 HydrophobicContact CD1-CD2 4Å; Y75-L416 HydrophobicContact CE2-CD2 3.56Å; Y75-L416 HydrophobicContact CE2-CG 4.37Å; Y75-L416 WeakPolarHBondContact OH-CA 3.41Å; Y75-L416 WeakPolarHBondContact OH-CD2 3.36Å; Y75-L416 WeakPolarHBondContact OH-CG 3.46Å; Y75-L416 PolarHBondContact OH-N 3.05Å; A344-L416 HydrophobicContact CB-CD2 4.3Å; L345-L416 HydrophobicContact CD2-CD1 3.77Å; D348-L416 HydrophobicContact CB-CB 4.44Å; D348-L416 HydrophobicContact CB-CD1 3.52Å; D348-L416 HydrophobicContact CB-CG 3.74Å; D348-L416 PolarHBondContact OD1-N 3.49Å; L416-Q418 PolarHBondContact O-N 2.93Å; L416-Q419 WeakPolarHBondContact O-CB 3.41Å; L416-Q419 PolarHBondContact O-N 3.08Å; L416-L428 HydrophobicContact CD1-CD2 4.39Å
417	S	87.9	Confident	86.9	Confident	92 Å²	92	68.4 Å²	68.4	64%	0.643	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-62.6	-23.9	174.6	57.4	0	0	0	0	113.6	L415	L415-S417 PolarHBondContact O-N 2.9Å
418	Q	87.5	Confident	86.9	Confident	107 Å²	107	64.4 Å²	64.4	50%	0.5	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-89.4	-6	177.5	-59.5	174.9	-32.4	0	0	112.4	K414 L415 L416 C420	K414-Q418 HydrophobicContact CB-CB 4.33Å; L415-Q418 HydrophobicContact CB-CG 4.19Å; L415-Q418 WeakPolarHBondContact O-CA 3.29Å; L415-Q418 WeakPolarHBondContact O-CB 3.49Å; L415-Q418 PolarHBondContact O-N 3.21Å; L416-Q418 PolarHBondContact O-N 2.93Å; Q418-C420 VanDerWaalsContact C-N 3.26Å; Q418-C420 PolarHBondContact O-N 3.43Å
419	Q	86.1	Confident	86.8	Confident	30 Å²	30	69.6 Å²	69.6	14%	0.14	38%	0.384	C	S	.	.	S	Bend	trans	-94.7	30.1	179	-62.4	-68.8	2.5	0	0	112.2	S74 Y75 L415 L416 F427	S74-Q419 PolarHBondContact OG-NE2 3.42Å; Y75-Q419 HydrophobicContact CE2-CG 4.33Å; L415-Q419 PolarHBondContact O-N 3.29Å; L416-Q419 WeakPolarHBondContact O-CB 3.41Å; L416-Q419 PolarHBondContact O-N 3.08Å; Q419-F427 HydrophobicContact CB-CD2 3.89Å; Q419-F427 HydrophobicContact CB-CE2 4.44Å; Q419-F427 PolarHBondContact O-N 3.44Å
420	C	86.4	Confident	86.9	Confident	54 Å²	54	69.1 Å²	69.1	37%	0.365	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.2	177.5	-59.2	0	0	0	0	110	Q418 C426	Q418-C420 VanDerWaalsContact C-N 3.26Å; Q418-C420 PolarHBondContact O-N 3.43Å; C420-C426 HydrophobicContact CB-CB 4.06Å; C420-C426 WeakPolarHBondContact CB-SG 3.35Å; C420-C426 WeakPolarHBondContact SG-CB 3.36Å; C420-C426 CovalentContact SG-SG 2.04Å; C420-C426 PolarHBondContact SG-SG 2.97Å
421	S	77.9	Confident	87	Confident	61 Å²	61	68.8 Å²	68.8	43%	0.427	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.7	176.1	-67.2	0	0	0	0	110.5	M423 G424 G425	S421-M423 VanDerWaalsContact C-N 3.3Å; S421-M423 PolarHBondContact O-N 2.99Å; S421-G424 PolarHBondContact O-N 3.36Å; S421-G424 VanDerWaalsContact O-N 3.07Å; S421-G425 PolarHBondContact N-O 2.86Å; S421-G425 PolarHBondContact O-N 3.4Å
422	Y	68.8	Low	87.2	Confident	237 Å²	237	67.6 Å²	67.6	93%	0.929	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-40.7	-178.4	-174.7	-101.6	0	0	0	113.5
423	M	68.4	Low	87.3	Confident	187 Å²	187	71.1 Å²	71.1	92%	0.921	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-11.5	177	-68.4	-173.5	-89	0	0	113.7	S421	S421-M423 VanDerWaalsContact C-N 3.3Å; S421-M423 PolarHBondContact O-N 2.99Å
424	G	68.7	Low	87.3	Confident	28 Å²	28	70.6 Å²	70.6	29%	0.289	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-7	-164.9	0	0	0	0	0	115	S421 K430	S421-G424 PolarHBondContact O-N 3.36Å; S421-G424 VanDerWaalsContact O-N 3.07Å; G424-K430 WeakPolarHBondContact O-CE 3.37Å; G424-K430 PolarHBondContact O-NZ 3.48Å
425	G	83.4	Confident	87.3	Confident	34 Å²	34	64.9 Å²	64.9	35%	0.351	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	70.7	-178.8	-172.4	0	0	0	0	0	113.5	S421	S421-G425 PolarHBondContact N-O 2.86Å; S421-G425 PolarHBondContact O-N 3.4Å
426	C	90.9	Very high	87.3	Confident	28 Å²	28	67.3 Å²	67.3	19%	0.189	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	139.8	-179.6	-61.9	0	0	0	0	112.3	C420 L428 E429 K430	C420-C426 HydrophobicContact CB-CB 4.06Å; C420-C426 WeakPolarHBondContact CB-SG 3.35Å; C420-C426 WeakPolarHBondContact SG-CB 3.36Å; C420-C426 CovalentContact SG-SG 2.04Å; C420-C426 PolarHBondContact SG-SG 2.97Å; C426-L428 VanDerWaalsContact C-N 3.29Å; C426-L428 PolarHBondContact O-N 3.49Å; C426-E429 HydrophobicContact CB-CB 4.36Å; C426-E429 HydrophobicContact CB-CG 4.02Å; C426-E429 PolarHBondContact O-N 3.03Å; C426-K430 PolarHBondContact O-N 2.93Å; C426-K430 VanDerWaalsContact O-N 3.15Å
427	F	91.7	Very high	87.4	Confident	39 Å²	39	72.6 Å²	72.6	17%	0.171	37%	0.374	C	S	.	.	H	α-helix	trans	-60.8	-37	177.3	-66.3	-26.9	0	0	0	113	P70 L71 Q419 K430 I431	P70-F427 HydrophobicContact CB-CD1 4.09Å; P70-F427 HydrophobicContact CB-CE1 3.8Å; P70-F427 HydrophobicContact CB-CE2 4.26Å; P70-F427 HydrophobicContact CB-CG 4.45Å; P70-F427 HydrophobicContact CB-CZ 3.9Å; L71-F427 HydrophobicContact CB-CB 4.41Å; L71-F427 HydrophobicContact CD1-CB 3.88Å; Q419-F427 HydrophobicContact CB-CD2 3.89Å; Q419-F427 HydrophobicContact CB-CE2 4.44Å; Q419-F427 PolarHBondContact O-N 3.44Å; F427-K430 PolarHBondContact O-N 2.85Å; F427-I431 PolarHBondContact O-N 2.58Å; F427-I431 VanDerWaalsContact O-N 3.07Å
428	L	92.2	Very high	87.7	Confident	40 Å²	40	70.9 Å²	70.9	21%	0.209	36%	0.356	C	S	.	.	H	α-helix	trans	-62.5	-43.6	177.7	-175.3	64.6	0	0	0	112.1	R341 L345 L416 C426 K430 I431 E432	R341-L428 HydrophobicContact CG-CD1 3.95Å; L345-L428 HydrophobicContact CD2-CD1 4.21Å; L345-L428 HydrophobicContact CD2-CD2 4.31Å; L416-L428 HydrophobicContact CD1-CD2 4.39Å; C426-L428 VanDerWaalsContact C-N 3.29Å; C426-L428 PolarHBondContact O-N 3.49Å; L428-K430 VanDerWaalsContact C-N 3.34Å; L428-K430 PolarHBondContact O-N 3.46Å; L428-I431 HydrophobicContact CD1-CG2 4.44Å; L428-I431 VanDerWaalsContact O-CG2 3.27Å; L428-I431 WeakPolarHBondContact O-CG2 3.3Å; L428-I431 PolarHBondContact O-N 3.33Å; L428-E432 WeakPolarHBondContact O-CB 3.28Å; L428-E432 WeakPolarHBondContact O-CG 3.45Å; L428-E432 PolarHBondContact O-N 2.97Å
429	E	92.3	Very high	88	Confident	108 Å²	108	65.8 Å²	65.8	51%	0.505	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-37.9	178.4	-65.6	177.3	171.6	0	0	111.8	C426 E432 R433	C426-E429 HydrophobicContact CB-CB 4.36Å; C426-E429 HydrophobicContact CB-CG 4.02Å; C426-E429 PolarHBondContact O-N 3.03Å; E429-E432 PolarHBondContact O-N 3.42Å; E429-R433 WeakPolarHBondContact O-CB 3.35Å; E429-R433 PolarHBondContact O-N 3.38Å
430	K	93.8	Very high	88.3	Confident	62 Å²	62	66.6 Å²	66.6	27%	0.27	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-48.5	176.3	-74.2	-175.8	178.5	172.3	0	112.2	G424 C426 F427 L428 E432 R433 A434	G424-K430 WeakPolarHBondContact O-CE 3.37Å; G424-K430 PolarHBondContact O-NZ 3.48Å; C426-K430 PolarHBondContact O-N 2.93Å; C426-K430 VanDerWaalsContact O-N 3.15Å; F427-K430 PolarHBondContact O-N 2.85Å; L428-K430 VanDerWaalsContact C-N 3.34Å; L428-K430 PolarHBondContact O-N 3.46Å; K430-E432 VanDerWaalsContact C-N 3.31Å; K430-E432 PolarHBondContact O-N 3.33Å; K430-R433 PolarHBondContact O-N 3.32Å; K430-A434 WeakPolarHBondContact O-CB 3.43Å; K430-A434 PolarHBondContact O-N 2.94Å
431	I	94.9	Very high	88.5	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-67.9	-35.5	-179.3	-158.9	168	0	0	0	110.9	S67 I68 L71 A337 V340 R341 F427 L428 A434 I435	S67-I431 WeakPolarHBondContact O-CB 3.47Å; I68-I431 HydrophobicContact CG1-CD1 4.49Å; I68-I431 HydrophobicContact CG1-CG1 4.32Å; I68-I431 HydrophobicContact CG2-CD1 4.34Å; L71-I431 HydrophobicContact CD2-CB 4.35Å; L71-I431 HydrophobicContact CD2-CD1 3.91Å; L71-I431 HydrophobicContact CD2-CG2 3.75Å; A337-I431 HydrophobicContact CB-CD1 4.28Å; A337-I431 HydrophobicContact CB-CG1 4.12Å; A337-I431 WeakPolarHBondContact O-CD1 3.36Å; V340-I431 HydrophobicContact CB-CD1 4.01Å; V340-I431 HydrophobicContact CG1-CD1 3.83Å; R341-I431 HydrophobicContact CB-CD1 4.27Å; R341-I431 HydrophobicContact CB-CG2 4.09Å; R341-I431 HydrophobicContact CG-CG2 4.1Å; F427-I431 PolarHBondContact O-N 2.58Å; F427-I431 VanDerWaalsContact O-N 3.07Å; L428-I431 HydrophobicContact CD1-CG2 4.44Å; L428-I431 VanDerWaalsContact O-CG2 3.27Å; L428-I431 WeakPolarHBondContact O-CG2 3.3Å; L428-I431 PolarHBondContact O-N 3.33Å; I431-A434 PolarHBondContact O-N 3.42Å; I431-I435 HydrophobicContact CG1-CD1 4.11Å; I431-I435 WeakPolarHBondContact O-CD1 3.44Å; I431-I435 WeakPolarHBondContact O-CG1 3.29Å; I431-I435 PolarHBondContact O-N 2.94Å
432	E	93.4	Very high	89	Confident	74 Å²	74	63.1 Å²	63.1	35%	0.346	32%	0.322	S	S	.	.	H	α-helix	trans	-64.5	-44.3	174.1	-76.9	-176.4	172.2	0	0	112.4	L428 E429 K430 A434 I435 T436	L428-E432 WeakPolarHBondContact O-CB 3.28Å; L428-E432 WeakPolarHBondContact O-CG 3.45Å; L428-E432 PolarHBondContact O-N 2.97Å; E429-E432 PolarHBondContact O-N 3.42Å; K430-E432 VanDerWaalsContact C-N 3.31Å; K430-E432 PolarHBondContact O-N 3.33Å; E432-A434 VanDerWaalsContact C-N 3.33Å; E432-A434 PolarHBondContact O-N 3.21Å; E432-I435 PolarHBondContact O-N 2.96Å; E432-T436 WeakPolarHBondContact O-CB 3.36Å; E432-T436 WeakPolarHBondContact O-CG2 3.42Å; E432-T436 PolarHBondContact O-N 2.91Å; E432-T436 PolarHBondContact O-OG1 2.89Å
433	R	94.6	Very high	89.7	Confident	132 Å²	132	54.8 Å²	54.8	50%	0.498	29%	0.294	S	S	.	.	H	α-helix	trans	-61	-42.2	173.5	-172.1	-176.8	-61.4	169.8	1.8	111.6	E429 K430 I435 T436 Q437 E438	E429-R433 WeakPolarHBondContact O-CB 3.35Å; E429-R433 PolarHBondContact O-N 3.38Å; K430-R433 PolarHBondContact O-N 3.32Å; R433-I435 PolarHBondContact O-N 3.01Å; R433-T436 PolarHBondContact O-N 3.46Å; R433-Q437 HydrophobicContact CG-CB 4.45Å; R433-Q437 WeakPolarHBondContact O-CB 3.41Å; R433-Q437 PolarHBondContact O-N 3.3Å; R433-E438 HydrophobicContact CG-CG 4.33Å; R433-E438 PolarHBondContact O-N 2.91Å; R433-E438 VanDerWaalsContact O-N 3.15Å
434	A	95.2	Very high	90	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.27	C	S	.	.	I	π-helix	trans	-60.3	-45.8	176.8	0	0	0	0	0	111.8	I63 K430 I431 E432 L439	I63-A434 HydrophobicContact CG2-CB 3.88Å; K430-A434 WeakPolarHBondContact O-CB 3.43Å; K430-A434 PolarHBondContact O-N 2.94Å; I431-A434 PolarHBondContact O-N 3.42Å; E432-A434 VanDerWaalsContact C-N 3.33Å; E432-A434 PolarHBondContact O-N 3.21Å; A434-L439 VanDerWaalsContact O-CB 3.32Å; A434-L439 WeakPolarHBondContact O-CB 3.49Å; A434-L439 VanDerWaalsContact O-CG 3.28Å; A434-L439 WeakPolarHBondContact O-CG 3.48Å; A434-L439 PolarHBondContact O-N 3.36Å
435	I	94.2	Very high	90.3	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.026	28%	0.275	C	S	.	.	I	π-helix	trans	-68.2	-38.6	-178.7	-68.8	162.6	0	0	0	112.7	R334 A337 I338 R341 I431 E432 R433 P440	R334-I435 HydrophobicContact CG-CG2 4.48Å; R334-I435 PolarHBondContact NE-O 3.37Å; A337-I435 HydrophobicContact CB-CD1 3.96Å; A337-I435 HydrophobicContact CB-CG1 3.64Å; I338-I435 HydrophobicContact CD1-CG2 4.17Å; I338-I435 HydrophobicContact CG1-CD1 3.91Å; I338-I435 HydrophobicContact CG1-CG1 4.15Å; I338-I435 HydrophobicContact CG1-CG2 3.77Å; R341-I435 HydrophobicContact CB-CD1 4.36Å; I431-I435 HydrophobicContact CG1-CD1 4.11Å; I431-I435 WeakPolarHBondContact O-CD1 3.44Å; I431-I435 WeakPolarHBondContact O-CG1 3.29Å; I431-I435 PolarHBondContact O-N 2.94Å; E432-I435 PolarHBondContact O-N 2.96Å; R433-I435 PolarHBondContact O-N 3.01Å; I435-P440 WeakPolarHBondContact O-CG 3.46Å
436	T	93.4	Very high	89.8	Confident	79 Å²	79	48.8 Å²	48.8	49%	0.485	27%	0.265	S	S	.	.	I	π-helix	trans	-95.4	-28.5	-169.8	55.8	0	0	0	0	114	E432 R433	E432-T436 WeakPolarHBondContact O-CB 3.36Å; E432-T436 WeakPolarHBondContact O-CG2 3.42Å; E432-T436 PolarHBondContact O-N 2.91Å; E432-T436 PolarHBondContact O-OG1 2.89Å; R433-T436 PolarHBondContact O-N 3.46Å
437	Q	93.4	Very high	88.2	Confident	127 Å²	127	49.2 Å²	49.2	59%	0.593	27%	0.273	S	S	*	.	I	π-helix	trans	-125.5	-56.4	-172	-62.6	178.8	-4.1	0	0	112.5	R433 G441	R433-Q437 HydrophobicContact CG-CB 4.45Å; R433-Q437 WeakPolarHBondContact O-CB 3.41Å; R433-Q437 PolarHBondContact O-N 3.3Å; Q437-G441 WeakPolarHBondContact O-CA 3.4Å; Q437-G441 PolarHBondContact O-N 3.14Å
438	E	94.5	Very high	86.2	Confident	56 Å²	56	55 Å²	55	26%	0.262	31%	0.305	S	S	.	.	I	π-helix	trans	-70.1	-49.7	-168.5	-56	-179.9	-178.4	0	0	112.5	I63 R433 G441 L442	I63-E438 HydrophobicContact CD1-CB 3.91Å; R433-E438 HydrophobicContact CG-CG 4.33Å; R433-E438 PolarHBondContact O-N 2.91Å; R433-E438 VanDerWaalsContact O-N 3.15Å; E438-G441 PolarHBondContact O-N 2.91Å; E438-L442 PolarHBondContact O-N 3.08Å; E438-L442 VanDerWaalsContact O-N 3.11Å
439	L	93.8	Very high	84	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-66.7	-46.1	179.9	-65	170	0	0	0	112.1	L60 I63 I330 I333 R334 A434 G441 L442 L443	L60-L439 HydrophobicContact CD1-CD2 3.42Å; L60-L439 VanDerWaalsContact CD1-CD2 3.42Å; I63-L439 HydrophobicContact CD1-CD2 4.16Å; I63-L439 HydrophobicContact CG2-CD2 4.05Å; I63-L439 HydrophobicContact CG2-CG 4.3Å; I330-L439 HydrophobicContact CG2-CB 4.11Å; I330-L439 HydrophobicContact CG2-CD2 4.41Å; I330-L439 WeakPolarHBondContact CG2-O 3.34Å; I333-L439 HydrophobicContact CG2-CD1 4.38Å; I333-L439 HydrophobicContact CG2-CD2 4.29Å; R334-L439 HydrophobicContact CB-CD1 3.77Å; R334-L439 HydrophobicContact CG-CD1 4.21Å; A434-L439 VanDerWaalsContact O-CB 3.32Å; A434-L439 WeakPolarHBondContact O-CB 3.49Å; A434-L439 VanDerWaalsContact O-CG 3.28Å; A434-L439 WeakPolarHBondContact O-CG 3.48Å; A434-L439 PolarHBondContact O-N 3.36Å; L439-G441 VanDerWaalsContact C-N 3.29Å; L439-G441 PolarHBondContact O-N 2.91Å; L439-L442 HydrophobicContact CD2-CD1 4.45Å; L439-L442 WeakPolarHBondContact O-CB 3.32Å; L439-L442 PolarHBondContact O-N 3.09Å; L439-L443 PolarHBondContact O-N 3.34Å
440	P	92.3	Very high	81.9	Confident	48 Å²	48	56.1 Å²	56.1	31%	0.312	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-35.1	171.5	-24.9	36.5	0	0	0	113.5	I435 L442 L443 G444	I435-P440 WeakPolarHBondContact O-CG 3.46Å; P440-L442 VanDerWaalsContact C-N 3.28Å; P440-L442 PolarHBondContact O-N 3.38Å; P440-L443 WeakPolarHBondContact O-CB 3.49Å; P440-L443 PolarHBondContact O-N 3.13Å; P440-L443 VanDerWaalsContact O-N 3.11Å; P440-G444 PolarHBondContact O-N 3.33Å
441	G	90.1	Very high	79	Confident	39 Å²	39	59.9 Å²	59.9	40%	0.402	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-34.1	175.8	0	0	0	0	0	113.1	Q437 E438 L439 G444 S445	Q437-G441 WeakPolarHBondContact O-CA 3.4Å; Q437-G441 PolarHBondContact O-N 3.14Å; E438-G441 PolarHBondContact O-N 2.91Å; L439-G441 VanDerWaalsContact C-N 3.29Å; L439-G441 PolarHBondContact O-N 2.91Å; G441-G444 PolarHBondContact O-N 3.08Å; G441-S445 PolarHBondContact O-N 3Å; G441-S445 VanDerWaalsContact O-N 3.11Å; G441-S445 PolarHBondContact O-OG 3.47Å
442	L	88.8	Confident	76.1	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	39%	0.394	C	S	.	.	H	α-helix	trans	-64.5	-38.2	172.3	-68.1	179.8	0	0	0	112.4	R59 L60 I63 I330 E438 L439 P440 G444 S445 L446	R59-L442 HydrophobicContact CB-CD2 4.36Å; R59-L442 HydrophobicContact CG-CD2 3.9Å; L60-L442 HydrophobicContact CB-CD1 4.42Å; L60-L442 HydrophobicContact CD1-CD1 4.23Å; I63-L442 HydrophobicContact CD1-CD1 3.7Å; I63-L442 HydrophobicContact CD1-CG 4.37Å; I330-L442 HydrophobicContact CD1-CB 3.73Å; I330-L442 HydrophobicContact CG1-CB 4.46Å; E438-L442 PolarHBondContact O-N 3.08Å; E438-L442 VanDerWaalsContact O-N 3.11Å; L439-L442 HydrophobicContact CD2-CD1 4.45Å; L439-L442 WeakPolarHBondContact O-CB 3.32Å; L439-L442 PolarHBondContact O-N 3.09Å; P440-L442 VanDerWaalsContact C-N 3.28Å; P440-L442 PolarHBondContact O-N 3.38Å; L442-G444 VanDerWaalsContact C-N 3.35Å; L442-S445 WeakPolarHBondContact CA-OG 3.26Å; L442-S445 PolarHBondContact O-N 3.47Å; L442-S445 PolarHBondContact O-OG 2.77Å; L442-L446 WeakPolarHBondContact O-CG 3.49Å; L442-L446 PolarHBondContact O-N 3.32Å
443	L	83.6	Confident	73.3	Confident	63 Å²	63	66.4 Å²	66.4	33%	0.33	41%	0.412	S	S	.	.	H	α-helix	trans	-65	-41.3	174.2	-63.9	170.8	0	0	0	111.1	E327 I330 L439 P440 S445 L446 G447	E327-L443 HydrophobicContact CB-CD2 3.96Å; E327-L443 HydrophobicContact CG-CD2 3.94Å; I330-L443 HydrophobicContact CB-CD2 3.97Å; I330-L443 HydrophobicContact CB-CG 4.39Å; I330-L443 HydrophobicContact CD1-CD2 3.74Å; I330-L443 HydrophobicContact CD1-CG 4.22Å; I330-L443 HydrophobicContact CG1-CD2 4.47Å; I330-L443 HydrophobicContact CG2-CD1 4.2Å; I330-L443 HydrophobicContact CG2-CD2 3.99Å; I330-L443 HydrophobicContact CG2-CG 3.85Å; L439-L443 PolarHBondContact O-N 3.34Å; P440-L443 WeakPolarHBondContact O-CB 3.49Å; P440-L443 PolarHBondContact O-N 3.13Å; P440-L443 VanDerWaalsContact O-N 3.11Å; L443-S445 VanDerWaalsContact C-N 3.32Å; L443-S445 PolarHBondContact O-N 3.46Å; L443-L446 WeakPolarHBondContact O-CB 3.44Å; L443-L446 PolarHBondContact O-N 3.49Å; L443-L446 VanDerWaalsContact O-N 3.11Å; L443-G447 PolarHBondContact O-N 3.35Å
444	G	75.5	Confident	70.3	Confident	41 Å²	41	63.4 Å²	63.4	42%	0.423	42%	0.415	S	S	.	.	H	α-helix	trans	-59.9	-39.4	176.6	0	0	0	0	0	113.2	P440 G441 L442 L446 G447 L448	P440-G444 PolarHBondContact O-N 3.33Å; G441-G444 PolarHBondContact O-N 3.08Å; L442-G444 VanDerWaalsContact C-N 3.35Å; G444-L446 VanDerWaalsContact C-N 3.31Å; G444-L446 PolarHBondContact O-N 2.94Å; G444-G447 PolarHBondContact O-N 3.23Å; G444-L448 PolarHBondContact O-N 3.27Å
445	S	74.2	Confident	67.4	Low	56 Å²	56	70.4 Å²	70.4	39%	0.392	45%	0.452	S	S	.	.	H	α-helix	trans	-66.2	-31.6	174.3	46	0	0	0	0	113.4	G441 L442 L443	G441-S445 PolarHBondContact O-N 3Å; G441-S445 VanDerWaalsContact O-N 3.11Å; G441-S445 PolarHBondContact O-OG 3.47Å; L442-S445 WeakPolarHBondContact CA-OG 3.26Å; L442-S445 PolarHBondContact O-N 3.47Å; L442-S445 PolarHBondContact O-OG 2.77Å; L443-S445 VanDerWaalsContact C-N 3.32Å; L443-S445 PolarHBondContact O-N 3.46Å
446	L	72.9	Confident	64.8	Low	26 Å²	26	74.9 Å²	74.9	14%	0.136	48%	0.476	C	S	.	.	H	α-helix	trans	-72.9	-35.3	174.9	-64.3	169.9	0	0	0	111.8	V56 L326 E327 I330 L442 L443 G444 G449	V56-L446 HydrophobicContact CG2-CD2 4.16Å; L326-L446 HydrophobicContact CB-CD1 3.68Å; L326-L446 HydrophobicContact CD1-CD1 4.09Å; L326-L446 HydrophobicContact CD1-CD2 3.49Å; L326-L446 VanDerWaalsContact CD1-CD2 3.49Å; L326-L446 HydrophobicContact CD1-CG 4.45Å; E327-L446 HydrophobicContact CG-CD1 4.44Å; I330-L446 HydrophobicContact CD1-CD1 3.75Å; L442-L446 WeakPolarHBondContact O-CG 3.49Å; L442-L446 PolarHBondContact O-N 3.32Å; L443-L446 WeakPolarHBondContact O-CB 3.44Å; L443-L446 PolarHBondContact O-N 3.49Å; L443-L446 VanDerWaalsContact O-N 3.11Å; G444-L446 VanDerWaalsContact C-N 3.31Å; G444-L446 PolarHBondContact O-N 2.94Å; L446-G449 PolarHBondContact O-N 3.28Å
447	G	57.6	Low	62.2	Low	36 Å²	36	74 Å²	74	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-71.4	-26.9	179.2	0	0	0	0	0	114.5	L443 G444 G449 K450	L443-G447 PolarHBondContact O-N 3.35Å; G444-G447 PolarHBondContact O-N 3.23Å; G447-G449 PolarHBondContact O-N 2.73Å; G447-K450 PolarHBondContact O-N 2.87Å; G447-K450 VanDerWaalsContact O-O 3.09Å
448	L	49.1	Very low	59.5	Low	161 Å²	161	75.1 Å²	75.1	84%	0.843	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-14.4	176	-76	164.3	0	0	0	113.4	G444	G444-L448 PolarHBondContact O-N 3.27Å
449	G	45.9	Very low	57.1	Low	73 Å²	73	80.4 Å²	80.4	75%	0.753	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-12.8	170.1	0	0	0	0	0	114.7	L446 G447	L446-G449 PolarHBondContact O-N 3.28Å; G447-G449 PolarHBondContact O-N 2.73Å
450	K	48	Very low	54.6	Low	98 Å²	98	83.8 Å²	83.8	43%	0.426	53%	0.526	S	S	.	.	S	Bend	trans	-101.8	105.3	177.6	-73	-179.2	178.1	174.4	0	108.8	N324 E327 G447 P452	N324-K450 PolarHBondContact OD1-NZ 2.89Å; E327-K450 IonicContact OE1-NZ 3.85Å; E327-K450 PolarHBondContact OE1-NZ 3.26Å; G447-K450 PolarHBondContact O-N 2.87Å; G447-K450 VanDerWaalsContact O-O 3.09Å; K450-P452 WeakPolarHBondContact O-CD 3.47Å
451	N	34.8	Very low	51.9	Low	141 Å²	141	84.7 Å²	84.7	75%	0.754	54%	0.543	S	S	*	.			trans	-50.3	121.9	170.6	-87.2	-29.8	0	0	0	109.8	G453 A454	N451-G453 PolarHBondContact O-N 3.13Å; N451-A454 PolarHBondContact O-N 3.18Å
452	P	33	Very low	49.5	Very low	142 Å²	142	86.6 Å²	86.6	92%	0.922	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	2.7	-174.8	-20.2	31	0	0	0	115.5	K450	K450-P452 WeakPolarHBondContact O-CD 3.47Å
453	G	34.2	Very low	47.1	Very low	70 Å²	70	91.8 Å²	91.8	72%	0.722	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-3.4	-175.1	0	0	0	0	0	115.7	N451	N451-G453 PolarHBondContact O-N 3.13Å
454	A	32.8	Very low	44.7	Very low	68 Å²	68	97.6 Å²	97.6	56%	0.562	61%	0.611	S	S	*	*			trans	-105.4	81.8	179.5	0	0	0	0	0	110.3	N451 N456	N451-A454 PolarHBondContact O-N 3.18Å; A454-N456 PolarHBondContact O-N 3.29Å
455	L	34.5	Very low	42.7	Very low	147 Å²	147	101.7 Å²	101.7	77%	0.77	63%	0.629	S	S	*	*			trans	-57.9	125.6	147	-85.7	126.3	0	0	0	106.1	C457	L455-C457 PolarHBondContact O-N 3.43Å
456	N	38.4	Very low	40.8	Very low	99 Å²	99	105 Å²	105	53%	0.529	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-60.7	10.3	179.3	-100	-11.5	0	0	0	114.6	A454 D458	A454-N456 PolarHBondContact O-N 3.29Å; N456-D458 VanDerWaalsContact C-N 3.3Å; N456-D458 PolarHBondContact O-N 3.47Å
457	C	38.9	Very low	39.1	Very low	61 Å²	61	113.3 Å²	113.3	41%	0.412	68%	0.684	S	S	.	*	G	3₁₀ helix	trans	-66.2	-26.9	172.9	-83.4	0	0	0	0	113.6	L455 K459 G461	L455-C457 PolarHBondContact O-N 3.43Å; C457-K459 PolarHBondContact O-N 3.08Å; C457-G461 PolarHBondContact O-N 3.09Å
458	D	37.2	Very low	38	Very low	150 Å²	150	118.6 Å²	118.6	80%	0.802	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-74.1	-13.8	-173.9	-73.4	-14.9	0	0	0	113.4	N456	N456-D458 VanDerWaalsContact C-N 3.3Å; N456-D458 PolarHBondContact O-N 3.47Å
459	K	43.6	Very low	37.7	Very low	167 Å²	167	122.1 Å²	122.1	73%	0.726	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-102	-11.4	179.1	-72.4	-172.9	177.4	-177.8	0	114.7	C457	C457-K459 PolarHBondContact O-N 3.08Å
460	T	41.1	Very low	37.5	Very low	72 Å²	72	128.9 Å²	128.9	44%	0.442	71%	0.71	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.6	3.6	-179.4	49.9	0	0	0	0	115.2
461	G	36.1	Very low	37	Very low	66 Å²	66	135.6 Å²	135.6	68%	0.68	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.3	41.6	168.8	0	0	0	0	0	113.6	C457 S463	C457-G461 PolarHBondContact O-N 3.09Å; G461-S463 PolarHBondContact O-N 3.2Å; G461-S463 VanDerWaalsContact O-N 3.08Å
462	C	38.8	Very low	37.4	Very low	80 Å²	80	138.6 Å²	138.6	54%	0.541	74%	0.739	S	S	.	*			trans	-71.1	100.5	169.9	-64.7	0	0	0	0	109.7
463	S	37.9	Very low	38	Very low	111 Å²	111	144.3 Å²	144.3	78%	0.776	75%	0.753	S	S	*	*			trans	-70.2	135.5	164.2	50.8	0	0	0	0	110.4	G461	G461-S463 PolarHBondContact O-N 3.2Å; G461-S463 VanDerWaalsContact O-N 3.08Å
464	E	34.5	Very low	38.2	Very low	184 Å²	184	148.1 Å²	148.1	86%	0.86	75%	0.754	S	S	*	*			trans	92.7	92.2	172	-53.7	-162	160.6	0	0	117.3
465	T	33.9	Very low	38.5	Very low	128 Å²	128	152.3 Å²	152.3	79%	0.785	77%	0.765	S	S	*	*			trans	-64.2	129.3	158.1	51.7	0	0	0	0	110.4	K467	T465-K467 PolarHBondContact O-N 3.21Å
466	P	33.7	Very low	38.7	Very low	124 Å²	124	152.6 Å²	152.6	81%	0.805	76%	0.764	S	S	*	*			trans	-67.9	118.1	175	24.2	-30.3	0	0	0	110.6	N468	P466-N468 PolarHBondContact O-N 3.01Å
467	K	36	Very low	38.7	Very low	201 Å²	201	155.7 Å²	155.7	87%	0.874	78%	0.778	S	S	*	*			trans	-67.1	114	171.2	-82.7	179.7	179	172.2	0	109.6	T465 R469	T465-K467 PolarHBondContact O-N 3.21Å; K467-R469 PolarHBondContact O-N 3.13Å; K467-R469 VanDerWaalsContact O-N 3.13Å
468	N	35.1	Very low	38.7	Very low	148 Å²	148	161.6 Å²	161.6	79%	0.791	80%	0.801	S	S	*	*			trans	-64.7	108.3	178.5	-143.6	-18.3	0	0	0	110.5	P466 Y470	P466-N468 PolarHBondContact O-N 3.01Å; N468-Y470 PolarHBondContact O-N 3.21Å
469	R	43.6	Very low	38.8	Very low	235 Å²	235	162.4 Å²	162.4	89%	0.887	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	10.8	-169.5	-152.7	177.4	-178.9	176.5	0.9	114.8	K467	K467-R469 PolarHBondContact O-N 3.13Å; K467-R469 VanDerWaalsContact O-N 3.13Å
470	Y	42	Very low	38.4	Very low	214 Å²	214	162.1 Å²	162.1	84%	0.839	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.3	34.3	-175	-68.6	-77.5	0	0	0	114.8	N468	N468-Y470 PolarHBondContact O-N 3.21Å
471	R	36.7	Very low	38.2	Very low	239 Å²	239	169 Å²	169	90%	0.902	83%	0.834	S	S	*	*			trans	-90.2	101.5	158.3	-106.1	-177.9	173.2	173.8	-1.7	108.8
472	K	42.5	Very low	38.4	Very low	205 Å²	205	177.6 Å²	177.6	89%	0.891	85%	0.847	S	S	*	*			trans	-74.1	133.2	162.4	-79.2	-176.3	174.7	-179.6	0	108.4
473	H	46	Very low	38.4	Very low	262 Å²	262	186.5 Å²	186.5	100%	1.213	88%	0.875	S	S	*	*			trans	-70.5	0	167.5	-79.4	-68.4	0	0	0	111.4

Retrieved 473 of 473 residues in 137.7 ms (Link to these results)

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