A0A3Q0KEE7_SCHMA Loading...

Kinesin-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KEE7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 743 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	51.1	Low	242 Å²	242	128.5 Å²	128.5	100%	1.192	70%	0.704	S	S	*	*				0	130	0	-74.4	175.6	169.8	0	0	107.4	Q3	M1-Q3 PolarHBondContact O-N 2.83Å
2	A	34	Very low	54.5	Low	100 Å²	100	117.8 Å²	117.8	83%	0.826	65%	0.646	S	S	*	*			trans	-65.5	119.2	-162.9	0	0	0	0	0	112.6	T4	A2-T4 PolarHBondContact O-N 3.2Å; A2-T4 VanDerWaalsContact O-N 3.1Å
3	Q	31.9	Very low	57.5	Low	192 Å²	192	113.8 Å²	113.8	90%	0.897	62%	0.619	S	S	*	*			trans	-65.8	101.8	163.8	-76	173.1	-15.3	0	0	108.4	M1 K5	M1-Q3 PolarHBondContact O-N 2.83Å; Q3-K5 PolarHBondContact O-N 2.9Å
4	T	35.6	Very low	60.2	Low	121 Å²	121	105.7 Å²	105.7	74%	0.742	57%	0.574	S	S	*	*			trans	-65	113.1	167.9	15.1	0	0	0	0	108.7	A2 F6	A2-T4 PolarHBondContact O-N 3.2Å; A2-T4 VanDerWaalsContact O-N 3.1Å; T4-F6 PolarHBondContact O-N 2.9Å
5	K	31.3	Very low	62.5	Low	188 Å²	188	98.8 Å²	98.8	82%	0.817	54%	0.537	S	S	*	.			trans	-52.4	115.7	177.2	-71.4	177.5	173	-179.5	0	111.4	Q3 D7	Q3-K5 PolarHBondContact O-N 2.9Å; K5-D7 PolarHBondContact O-N 2.97Å; K5-D7 VanDerWaalsContact O-N 3.11Å
6	F	42.6	Very low	64.6	Low	175 Å²	175	92.6 Å²	92.6	77%	0.768	50%	0.503	S	S	*	.			trans	-77.8	31.9	171.8	-94.3	-86.2	0	0	0	113.6	T4 A8	T4-F6 PolarHBondContact O-N 2.9Å; F6-A8 PolarHBondContact O-N 3.5Å
7	D	42.3	Very low	66.4	Low	143 Å²	143	88.1 Å²	88.1	77%	0.765	48%	0.477	S	S	*	.			trans	-84.6	17	-178.9	-90.1	-25.9	0	0	0	113.9	K5 S9	K5-D7 PolarHBondContact O-N 2.97Å; K5-D7 VanDerWaalsContact O-N 3.11Å; D7-S9 PolarHBondContact O-N 3.22Å; D7-S9 VanDerWaalsContact O-N 3.1Å
8	A	60.7	Low	67.9	Low	84 Å²	84	83.3 Å²	83.3	69%	0.694	45%	0.451	S	S	*	.			trans	-76.1	101.1	178.4	0	0	0	0	0	110.2	F6 E10	F6-A8 PolarHBondContact O-N 3.5Å; A8-E10 PolarHBondContact O-N 3.38Å
9	S	74.1	Confident	69.3	Low	54 Å²	54	80.5 Å²	80.5	38%	0.378	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-60.7	125.2	167.2	61	0	0	0	0	109.7	D7 N344	D7-S9 PolarHBondContact O-N 3.22Å; D7-S9 VanDerWaalsContact O-N 3.1Å; S9-N344 WeakPolarHBondContact CA-O 3.4Å
10	E	85.9	Confident	70.4	Confident	55 Å²	55	80 Å²	80	26%	0.257	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.2	176.3	-171.8	172.9	176.3	0	0	108.9	A8 K312 N344 P346	A8-E10 PolarHBondContact O-N 3.38Å; E10-K312 WeakPolarHBondContact OE2-CD 3.31Å; E10-K312 WeakPolarHBondContact OE2-CE 3.44Å; E10-K312 WeakPolarHBondContact OE2-CG 3.04Å; E10-K312 IonicContact OE2-NZ 3.08Å; E10-N344 PolarHBondContact N-O 3.2Å; E10-N344 PolarHBondContact O-N 3.39Å; E10-P346 HydrophobicContact CB-CG 4.1Å
11	S	88.8	Confident	71.3	Confident	59 Å²	59	79.1 Å²	79.1	41%	0.413	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	148.2	174	50.3	0	0	0	0	111.1	K13 I342	S11-K13 PolarHBondContact O-N 3.24Å; S11-I342 VanDerWaalsContact CA-O 3.3Å; S11-I342 WeakPolarHBondContact CA-O 3.31Å
12	V	92.5	Very high	73.8	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.006	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-61.2	123.3	171.5	175.7	0	0	0	0	109	V14 T313 I342	V12-V14 HydrophobicContact CG1-CG2 4.46Å; V12-T313 HydrophobicContact CG1-CG2 4Å; V12-I342 HydrophobicContact CB-CB 4.31Å; V12-I342 HydrophobicContact CG2-CB 3.68Å; V12-I342 HydrophobicContact CG2-CG2 3.74Å; V12-I342 PolarHBondContact N-O 3.34Å
13	K	93.5	Very high	76.3	Confident	66 Å²	66	74.1 Å²	74.1	29%	0.287	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	134.1	176.4	-64.5	-177.1	-179.5	-177.1	0	109.5	S11 D62 T313 I314 M315	S11-K13 PolarHBondContact O-N 3.24Å; K13-D62 WeakPolarHBondContact CA-OD2 3.43Å; K13-T313 PolarHBondContact N-O 3.35Å; K13-I314 HydrophobicContact CB-CG1 4.24Å; K13-I314 CarbonylContact O-C 3.6Å; K13-I314 VanDerWaalsContact O-CA 3.3Å; K13-I314 WeakPolarHBondContact O-CA 3.5Å; K13-M315 PolarHBondContact O-N 3.35Å
14	V	94.7	Very high	78.8	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	122.1	-177.2	-177.2	0	0	0	0	109.5	V12 F61 D62 M315 A336 A339 K340	V12-V14 HydrophobicContact CG1-CG2 4.46Å; V14-F61 HydrophobicContact CB-CD1 4.25Å; V14-F61 HydrophobicContact CG1-CD1 3.69Å; V14-F61 HydrophobicContact CG1-CE1 4.07Å; V14-D62 PolarHBondContact N-OD2 3.47Å; V14-D62 PolarHBondContact O-N 3.18Å; V14-D62 VanDerWaalsContact O-N 3.17Å; V14-M315 WeakPolarHBondContact CA-O 3.34Å; V14-M315 HydrophobicContact CG1-CB 4.44Å; V14-M315 HydrophobicContact CG1-CG 4.49Å; V14-M315 HydrophobicContact CG1-SD 4.42Å; V14-M315 HydrophobicContact CG2-CB 4.17Å; V14-A336 HydrophobicContact CG1-CB 3.72Å; V14-A339 HydrophobicContact CG2-CB 4.24Å; V14-K340 HydrophobicContact CB-CB 4.21Å; V14-K340 HydrophobicContact CG2-CB 3.62Å
15	V	94.9	Very high	81.2	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.012	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	139.5	176.4	-58.8	0	0	0	0	110.7	A63 Y65 T78 I314 M315 I316 A317	V15-A63 VanDerWaalsContact CA-O 3.28Å; V15-A63 WeakPolarHBondContact CA-O 3.22Å; V15-A63 HydrophobicContact CB-CB 4.5Å; V15-A63 HydrophobicContact CG1-CB 3.82Å; V15-Y65 HydrophobicContact CB-CE2 4.18Å; V15-Y65 HydrophobicContact CG1-CE2 4.43Å; V15-T78 HydrophobicContact CG1-CG2 3.61Å; V15-T78 HydrophobicContact CG2-CG2 4.31Å; V15-I314 HydrophobicContact CG2-CG2 4.37Å; V15-M315 PolarHBondContact N-O 2.92Å; V15-I316 HydrophobicContact CG2-CB 4.2Å; V15-I316 HydrophobicContact CG2-CG1 3.87Å; V15-I316 HydrophobicContact CG2-CG2 4.22Å; V15-I316 CarbonylContact O-C 3.58Å; V15-I316 WeakPolarHBondContact O-CA 3.44Å; V15-A317 PolarHBondContact O-N 2.87Å
16	V	95.8	Very high	83.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.1	176.8	178.8	0	0	0	0	109.6	V43 F61 A63 V64 Y65 A317 I319 L333	V16-V43 HydrophobicContact CB-CG2 4.23Å; V16-V43 HydrophobicContact CG1-CG2 4.09Å; V16-V43 HydrophobicContact CG2-CG2 4.46Å; V16-F61 HydrophobicContact CB-CD2 4.31Å; V16-F61 HydrophobicContact CG2-CB 4.34Å; V16-F61 HydrophobicContact CG2-CD1 3.96Å; V16-F61 HydrophobicContact CG2-CD2 3.31Å; V16-F61 HydrophobicContact CG2-CE1 4.04Å; V16-F61 HydrophobicContact CG2-CE2 3.4Å; V16-F61 VanDerWaalsContact CG2-CE2 3.4Å; V16-F61 HydrophobicContact CG2-CG 3.6Å; V16-F61 HydrophobicContact CG2-CZ 3.77Å; V16-A63 PolarHBondContact N-O 2.84Å; V16-A63 VanDerWaalsContact N-O 3.08Å; V16-V64 HydrophobicContact CB-CG1 4.33Å; V16-V64 CarbonylContact O-C 3.47Å; V16-V64 WeakPolarHBondContact O-CA 3.44Å; V16-Y65 PolarHBondContact O-N 3.05Å; V16-A317 WeakPolarHBondContact CA-O 3.44Å; V16-A317 HydrophobicContact CG2-CB 4.11Å; V16-I319 HydrophobicContact CG1-CD1 3.62Å; V16-I319 HydrophobicContact CG1-CG1 3.93Å; V16-L333 HydrophobicContact CG1-CD2 3.99Å; V16-L333 HydrophobicContact CG2-CD2 3.89Å
17	R	95.1	Very high	86	Confident	15 Å²	15	59.3 Å²	59.3	6%	0.057	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	121.3	174.1	-172.8	-177.1	-172.8	177.9	11.7	110.8	T107 A317 N318 I319	R17-T107 PolarHBondContact NH1-OG1 2.88Å; R17-A317 PolarHBondContact N-O 3.25Å; R17-N318 WeakPolarHBondContact O-CA 3.17Å; R17-I319 PolarHBondContact O-N 3.4Å
18	C	94.7	Very high	88.1	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.014	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.9	171.4	-172.7	0	0	0	0	110.5	I36 Y65 D66 I319	C18-I36 HydrophobicContact CB-CD1 3.26Å; C18-Y65 PolarHBondContact N-O 3.08Å; C18-D66 CarbonylContact O-C 3.56Å; C18-I319 WeakPolarHBondContact CA-O 3.33Å; C18-I319 HydrophobicContact CB-CD1 4.2Å; C18-I319 HydrophobicContact CB-CG1 3.84Å
19	R	93.4	Very high	89.3	Confident	30 Å²	30	54.3 Å²	54.3	11%	0.113	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-75.4	159.9	172.2	65.8	155.5	176.1	74.8	1.1	111.4	N22 E25 G101 I319 P321	R19-N22 VanDerWaalsContact CZ-ND2 3.34Å; R19-N22 VanDerWaalsContact CZ-OD1 3.31Å; R19-N22 PolarHBondContact NH1-OD1 3.32Å; R19-E25 IonicContact CZ-OE1 3.96Å; R19-E25 IonicContact CZ-OE2 3.19Å; R19-E25 IonicContact NH1-OE1 3.7Å; R19-E25 IonicContact NH1-OE2 3.89Å; R19-E25 PolarHBondContact NH1-OE2 3.32Å; R19-E25 IonicContact NH2-OE1 3.56Å; R19-E25 PolarHBondContact NH2-OE1 3.4Å; R19-E25 IonicContact NH2-OE2 2.63Å; R19-E25 PolarHBondContact NH2-OE2 2.94Å; R19-G101 WeakPolarHBondContact CD-O 3.44Å; R19-G101 PolarHBondContact NE-O 3Å; R19-I319 PolarHBondContact N-O 3.44Å; R19-P321 WeakPolarHBondContact O-CD 3.38Å; R19-P321 WeakPolarHBondContact O-CG 3.33Å
20	P	91.8	Very high	89.9	Confident	71 Å²	71	54.6 Å²	54.6	46%	0.461	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-60.4	161.3	167.7	25.8	-35.7	0	0	0	112.2	N22 E67	P20-N22 PolarHBondContact O-N 2.63Å; P20-N22 PolarHBondContact O-OD1 2.98Å; P20-E67 HydrophobicContact CB-CB 4.29Å
21	L	88.8	Confident	89.9	Confident	62 Å²	62	59.7 Å²	59.7	33%	0.325	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-64.6	127.8	174.4	-166.4	72.4	0	0	0	109.8	E25 A26 P321 A322	L21-E25 HydrophobicContact CD1-CB 3.66Å; L21-E25 HydrophobicContact CG-CB 3.96Å; L21-A26 HydrophobicContact CD2-CB 4.03Å; L21-P321 HydrophobicContact CB-CG 4.19Å; L21-P321 HydrophobicContact CD1-CG 4.03Å; L21-A322 HydrophobicContact CD1-CB 3.87Å
22	N	86.9	Confident	90	Very high	67 Å²	67	61.4 Å²	61.4	36%	0.358	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-77.4	155.3	-179	-72.2	0.1	0	0	0	110.5	R19 P20 K24 E25 A26	R19-N22 VanDerWaalsContact CZ-ND2 3.34Å; R19-N22 VanDerWaalsContact CZ-OD1 3.31Å; R19-N22 PolarHBondContact NH1-OD1 3.32Å; P20-N22 PolarHBondContact O-N 2.63Å; P20-N22 PolarHBondContact O-OD1 2.98Å; N22-K24 VanDerWaalsContact C-N 3.29Å; N22-K24 PolarHBondContact O-N 3.31Å; N22-E25 HydrophobicContact CB-CG 4.25Å; N22-E25 PolarHBondContact N-OE2 2.93Å; N22-E25 WeakPolarHBondContact O-CA 3.38Å; N22-E25 WeakPolarHBondContact O-CB 3.37Å; N22-E25 PolarHBondContact O-N 3.02Å; N22-A26 PolarHBondContact O-N 3.26Å
23	E	86.4	Confident	89.9	Confident	170 Å²	170	61.5 Å²	61.5	79%	0.794	34%	0.336	S	S	*	.	H	α-helix	trans	-53.4	-44.5	178.7	-65.2	179.6	174.6	0	0	112.4	E25 A26 S27	E23-E25 VanDerWaalsContact C-N 3.28Å; E23-E25 PolarHBondContact O-N 3.47Å; E23-A26 PolarHBondContact O-N 3.41Å; E23-S27 WeakPolarHBondContact O-CB 3.39Å; E23-S27 PolarHBondContact O-N 3.25Å; E23-S27 PolarHBondContact O-OG 2.94Å
24	K	84.2	Confident	89.8	Confident	184 Å²	184	58.3 Å²	58.3	80%	0.8	32%	0.322	S	S	*	.	H	α-helix	trans	-59.4	-37.4	176.3	-66.7	-177.1	-179.7	178.1	0	112.9	N22 A28	N22-K24 VanDerWaalsContact C-N 3.29Å; N22-K24 PolarHBondContact O-N 3.31Å; K24-A28 VanDerWaalsContact O-CB 3.29Å; K24-A28 WeakPolarHBondContact O-CB 3.48Å; K24-A28 PolarHBondContact O-N 3.02Å
25	E	87.1	Confident	89.7	Confident	16 Å²	16	62 Å²	62	8%	0.075	34%	0.338	C	S	.	.	H	α-helix	trans	-74.2	-38	-180	-62.6	171.8	143.7	0	0	111	R19 L21 N22 E23 G29 H30 A322 N325	R19-E25 IonicContact CZ-OE1 3.96Å; R19-E25 IonicContact CZ-OE2 3.19Å; R19-E25 IonicContact NH1-OE1 3.7Å; R19-E25 IonicContact NH1-OE2 3.89Å; R19-E25 PolarHBondContact NH1-OE2 3.32Å; R19-E25 IonicContact NH2-OE1 3.56Å; R19-E25 PolarHBondContact NH2-OE1 3.4Å; R19-E25 IonicContact NH2-OE2 2.63Å; R19-E25 PolarHBondContact NH2-OE2 2.94Å; L21-E25 HydrophobicContact CD1-CB 3.66Å; L21-E25 HydrophobicContact CG-CB 3.96Å; N22-E25 HydrophobicContact CB-CG 4.25Å; N22-E25 PolarHBondContact N-OE2 2.93Å; N22-E25 WeakPolarHBondContact O-CA 3.38Å; N22-E25 WeakPolarHBondContact O-CB 3.37Å; N22-E25 PolarHBondContact O-N 3.02Å; E23-E25 VanDerWaalsContact C-N 3.28Å; E23-E25 PolarHBondContact O-N 3.47Å; E25-G29 PolarHBondContact O-N 3.4Å; E25-H30 WeakPolarHBondContact O-CB 3.5Å; E25-H30 PolarHBondContact O-N 3.01Å; E25-A322 HydrophobicContact CB-CB 4.17Å; E25-A322 VanDerWaalsContact CD-CB 3.49Å; E25-A322 HydrophobicContact CG-CB 4.01Å; E25-A322 VanDerWaalsContact OE1-CB 3.31Å; E25-A322 WeakPolarHBondContact OE1-CB 3.33Å; E25-N325 PolarHBondContact OE1-ND2 3.43Å
26	A	86.9	Confident	89.5	Confident	56 Å²	56	63.8 Å²	63.8	46%	0.463	35%	0.347	S	S	.	.	H	α-helix	trans	-65.4	-46	173.6	0	0	0	0	0	111.5	L21 N22 E23 A28 G29	L21-A26 HydrophobicContact CD2-CB 4.03Å; N22-A26 PolarHBondContact O-N 3.26Å; E23-A26 PolarHBondContact O-N 3.41Å; A26-A28 VanDerWaalsContact C-N 3.3Å; A26-A28 PolarHBondContact O-N 3.11Å; A26-G29 PolarHBondContact O-N 2.92Å
27	S	88.7	Confident	89.3	Confident	109 Å²	109	66.3 Å²	66.3	76%	0.762	36%	0.361	S	S	*	.	H	α-helix	trans	-63.9	-33	177.3	-60	0	0	0	0	113	E23 G29	E23-S27 WeakPolarHBondContact O-CB 3.39Å; E23-S27 PolarHBondContact O-N 3.25Å; E23-S27 PolarHBondContact O-OG 2.94Å; S27-G29 PolarHBondContact O-N 3.21Å
28	A	86.2	Confident	88.9	Confident	62 Å²	62	68.9 Å²	68.9	51%	0.512	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-0.8	174.8	0	0	0	0	0	113.7	K24 A26 H30	K24-A28 VanDerWaalsContact O-CB 3.29Å; K24-A28 WeakPolarHBondContact O-CB 3.48Å; K24-A28 PolarHBondContact O-N 3.02Å; A26-A28 VanDerWaalsContact C-N 3.3Å; A26-A28 PolarHBondContact O-N 3.11Å; A28-H30 VanDerWaalsContact C-N 3.29Å; A28-H30 PolarHBondContact O-N 3Å
29	G	84.5	Confident	88.3	Confident	59 Å²	59	72.9 Å²	72.9	61%	0.608	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	19.4	179.1	0	0	0	0	0	114.1	E25 A26 S27 K31	E25-G29 PolarHBondContact O-N 3.4Å; A26-G29 PolarHBondContact O-N 2.92Å; S27-G29 PolarHBondContact O-N 3.21Å; G29-K31 PolarHBondContact O-N 3.5Å
30	H	86.7	Confident	87.7	Confident	60 Å²	60	75.4 Å²	75.4	28%	0.278	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-72.4	129.2	177.6	-64.6	-46.2	0	0	0	110.8	E25 A28 A322	E25-H30 WeakPolarHBondContact O-CB 3.5Å; E25-H30 PolarHBondContact O-N 3.01Å; A28-H30 VanDerWaalsContact C-N 3.29Å; A28-H30 PolarHBondContact O-N 3Å; H30-A322 HydrophobicContact CB-CB 4.25Å
31	K	86.6	Confident	87.5	Confident	163 Å²	163	72.4 Å²	72.4	71%	0.709	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-81.2	158.9	176	-63	-178.7	-178.2	177.7	0	111.2	G29 T323	G29-K31 PolarHBondContact O-N 3.5Å; K31-T323 HydrophobicContact CB-CG2 4.18Å; K31-T323 PolarHBondContact N-OG1 3.14Å; K31-T323 VanDerWaalsContact O-CG2 3.29Å; K31-T323 WeakPolarHBondContact O-CG2 3.44Å; K31-T323 PolarHBondContact O-N 2.89Å; K31-T323 PolarHBondContact O-OG1 2.94Å; K31-T323 VanDerWaalsContact O-OG1 3.13Å
32	K	90.5	Very high	87.6	Confident	94 Å²	94	71.4 Å²	71.4	41%	0.409	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-71.7	124.9	169	178.8	168.4	177.5	164.7	0	110.3	V34 E67 P321	K32-V34 WeakPolarHBondContact CE-O 3.38Å; K32-V34 WeakPolarHBondContact CG-O 3.24Å; K32-E67 WeakPolarHBondContact CD-OE1 3.49Å; K32-E67 WeakPolarHBondContact CE-OE1 3.23Å; K32-E67 IonicContact NZ-OE1 2.69Å; K32-E67 PolarHBondContact NZ-OE1 2.94Å; K32-E67 IonicContact NZ-OE2 3.43Å; K32-E67 PolarHBondContact NZ-OE2 3.5Å; K32-P321 CarbonylContact C-O 3.56Å; K32-P321 WeakPolarHBondContact CA-O 3.28Å; K32-P321 HydrophobicContact CG-CB 4.16Å
33	C	90.5	Very high	87.9	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.02	39%	0.386	C	S	.	.			trans	-111.5	-9.6	178.2	66.3	0	0	0	0	114	V45 R46 P321 T323	C33-V45 WeakPolarHBondContact O-CA 3.38Å; C33-R46 WeakPolarHBondContact CB-O 3.44Å; C33-R46 PolarHBondContact O-N 3.29Å; C33-P321 PolarHBondContact N-O 3.41Å; C33-P321 PolarHBondContact SG-O 3.39Å; C33-T323 HydrophobicContact CB-CG2 3.75Å
34	V	92.5	Very high	88.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.4	-178.1	-176.2	0	0	0	0	109.6	K32 I36 V43 V45 I319 T329	K32-V34 WeakPolarHBondContact CE-O 3.38Å; K32-V34 WeakPolarHBondContact CG-O 3.24Å; V34-I36 HydrophobicContact CG1-CD1 4.33Å; V34-I36 HydrophobicContact CG1-CG1 4.06Å; V34-V43 HydrophobicContact CG1-CG1 3.78Å; V34-V45 HydrophobicContact CG2-CG1 4.49Å; V34-V45 HydrophobicContact CG2-CG2 4.45Å; V34-I319 HydrophobicContact CG1-CD1 3.76Å; V34-I319 HydrophobicContact CG2-CD1 4.48Å; V34-T329 HydrophobicContact CG2-CG2 3.88Å
35	F	91.8	Very high	88.6	Confident	77 Å²	77	52.5 Å²	52.5	34%	0.338	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.4	175.2	-59.4	-88.5	0	0	0	108.4	E44 R46	F35-E44 HydrophobicContact CB-CB 4.31Å; F35-E44 PolarHBondContact N-O 3.27Å; F35-E44 PolarHBondContact O-N 3.46Å; F35-R46 HydrophobicContact CD2-CG 3.94Å; F35-R46 HydrophobicContact CE2-CB 4.41Å; F35-R46 VanDerWaalsContact CE2-CD 3.48Å; F35-R46 HydrophobicContact CE2-CG 3.74Å
36	I	91.4	Very high	88.7	Confident	39 Å²	39	57.6 Å²	57.6	20%	0.2	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.4	-174	-65.4	176.6	0	0	0	108.4	C18 V34 V43 V64 D66	C18-I36 HydrophobicContact CB-CD1 3.26Å; V34-I36 HydrophobicContact CG1-CD1 4.33Å; V34-I36 HydrophobicContact CG1-CG1 4.06Å; I36-V43 HydrophobicContact CG1-CG1 4.38Å; I36-V43 HydrophobicContact CG1-CG2 4.44Å; I36-V64 HydrophobicContact CG2-CB 3.94Å; I36-V64 HydrophobicContact CG2-CG2 3.52Å; I36-D66 HydrophobicContact CB-CB 4.27Å; I36-D66 HydrophobicContact CD1-CB 4.47Å; I36-D66 HydrophobicContact CG2-CB 4.23Å
37	D	90.5	Very high	88.5	Confident	53 Å²	53	57 Å²	57	28%	0.283	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	97.3	170.7	178.5	3.4	0	0	0	108.5	S39 N40 G41 T42 V64	D37-S39 PolarHBondContact O-N 2.98Å; D37-S39 WeakPolarHBondContact OD1-CB 3.32Å; D37-S39 PolarHBondContact OD1-N 3.3Å; D37-S39 PolarHBondContact OD1-OG 2.93Å; D37-N40 PolarHBondContact O-N 2.91Å; D37-N40 PolarHBondContact OD1-N 2.93Å; D37-N40 WeakPolarHBondContact OD2-CB 3.37Å; D37-N40 PolarHBondContact OD2-ND2 3.25Å; D37-G41 PolarHBondContact O-N 3.29Å; D37-G41 VanDerWaalsContact O-N 3.09Å; D37-T42 PolarHBondContact N-O 3.06Å; D37-T42 PolarHBondContact O-N 3.07Å; D37-T42 VanDerWaalsContact O-N 3.09Å; D37-V64 WeakPolarHBondContact O-CG2 3.39Å
38	C	86.3	Confident	88	Confident	69 Å²	69	55 Å²	55	47%	0.466	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-31	-178.6	-57.8	0	0	0	0	112.6
39	S	82.4	Confident	87.6	Confident	87 Å²	87	58.9 Å²	58.9	61%	0.608	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-42.9	-179	-2.3	0	0	0	0	112.2	D37	D37-S39 PolarHBondContact O-N 2.98Å; D37-S39 WeakPolarHBondContact OD1-CB 3.32Å; D37-S39 PolarHBondContact OD1-N 3.3Å; D37-S39 PolarHBondContact OD1-OG 2.93Å
40	N	81.9	Confident	86.9	Confident	82 Å²	82	58.2 Å²	58.2	44%	0.439	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-1.9	-176.6	-66.7	-41.6	0	0	0	113.4	D37 T42	D37-N40 PolarHBondContact O-N 2.91Å; D37-N40 PolarHBondContact OD1-N 2.93Å; D37-N40 WeakPolarHBondContact OD2-CB 3.37Å; D37-N40 PolarHBondContact OD2-ND2 3.25Å; N40-T42 VanDerWaalsContact C-N 3.28Å; N40-T42 HydrophobicContact CB-CG2 3.97Å; N40-T42 WeakPolarHBondContact O-CG2 3.29Å; N40-T42 PolarHBondContact O-N 3.37Å
41	G	87.6	Confident	86.2	Confident	8 Å²	8	63.4 Å²	63.4	8%	0.082	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	29	-175.9	0	0	0	0	0	113	D37 R60 F61 V64	D37-G41 PolarHBondContact O-N 3.29Å; D37-G41 VanDerWaalsContact O-N 3.09Å; G41-R60 WeakPolarHBondContact O-CA 3.43Å; G41-F61 PolarHBondContact O-N 3.08Å; G41-V64 WeakPolarHBondContact O-CG1 3.38Å
42	T	90.9	Very high	85.3	Confident	41 Å²	41	62.3 Å²	62.3	25%	0.252	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	143	-173.5	71.7	0	0	0	0	113.8	D37 N40 F59 R60	D37-T42 PolarHBondContact N-O 3.06Å; D37-T42 PolarHBondContact O-N 3.07Å; D37-T42 VanDerWaalsContact O-N 3.09Å; N40-T42 VanDerWaalsContact C-N 3.28Å; N40-T42 HydrophobicContact CB-CG2 3.97Å; N40-T42 WeakPolarHBondContact O-CG2 3.29Å; N40-T42 PolarHBondContact O-N 3.37Å; T42-F59 CarbonylContact C-O 3.56Å; T42-F59 VanDerWaalsContact CA-O 3.27Å; T42-F59 WeakPolarHBondContact CA-O 3.36Å; T42-R60 HydrophobicContact CG2-CB 4.32Å; T42-R60 HydrophobicContact CG2-CG 4.4Å
43	V	93.2	Very high	84	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.4	176.2	-174.8	0	0	0	0	108.5	V16 V34 I36 V45 R58 F59 F61 V64 I319 L333	V16-V43 HydrophobicContact CB-CG2 4.23Å; V16-V43 HydrophobicContact CG1-CG2 4.09Å; V16-V43 HydrophobicContact CG2-CG2 4.46Å; V34-V43 HydrophobicContact CG1-CG1 3.78Å; I36-V43 HydrophobicContact CG1-CG1 4.38Å; I36-V43 HydrophobicContact CG1-CG2 4.44Å; V43-V45 HydrophobicContact CG1-CG2 4.19Å; V43-R58 CarbonylContact O-C 3.42Å; V43-R58 WeakPolarHBondContact O-CA 3.47Å; V43-F59 PolarHBondContact N-O 3.46Å; V43-F59 PolarHBondContact O-N 3.2Å; V43-F61 HydrophobicContact CB-CE2 4.45Å; V43-F61 HydrophobicContact CG2-CD2 4.08Å; V43-F61 HydrophobicContact CG2-CE2 4.15Å; V43-V64 HydrophobicContact CG2-CB 4.25Å; V43-V64 HydrophobicContact CG2-CG1 3.73Å; V43-I319 HydrophobicContact CG1-CD1 4.18Å; V43-L333 HydrophobicContact CG1-CD1 4.01Å; V43-L333 HydrophobicContact CG1-CD2 4.32Å
44	E	91.7	Very high	83.1	Confident	24 Å²	24	66.4 Å²	66.4	11%	0.112	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.2	175.5	-176.8	179.6	121.2	0	0	109.7	F35 R46 P56 K57 R58	F35-E44 HydrophobicContact CB-CB 4.31Å; F35-E44 PolarHBondContact N-O 3.27Å; F35-E44 PolarHBondContact O-N 3.46Å; E44-R46 IonicContact OE1-CZ 3.18Å; E44-R46 IonicContact OE1-NE 2.7Å; E44-R46 PolarHBondContact OE1-NE 3.16Å; E44-R46 IonicContact OE1-NH2 2.71Å; E44-R46 PolarHBondContact OE1-NH2 2.97Å; E44-P56 VanDerWaalsContact CD-CG 3.41Å; E44-P56 HydrophobicContact CG-CB 3.51Å; E44-P56 HydrophobicContact CG-CG 3.8Å; E44-P56 WeakPolarHBondContact OE1-CG 3.48Å; E44-K57 CarbonylContact C-O 3.59Å; E44-K57 WeakPolarHBondContact CA-O 3.44Å; E44-R58 HydrophobicContact CB-CG 4.21Å; E44-R58 HydrophobicContact CG-CG 4.07Å; E44-R58 IonicContact OE2-CZ 3.53Å; E44-R58 IonicContact OE2-NE 2.72Å; E44-R58 PolarHBondContact OE2-NE 3.41Å; E44-R58 IonicContact OE2-NH2 3.65Å; E44-R58 PolarHBondContact OE2-NH2 2.9Å
45	V	92.2	Very high	82.2	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.3	177.6	-169.3	0	0	0	0	110	C33 V34 V43 K57 Y326 T329 I330 L333	C33-V45 WeakPolarHBondContact O-CA 3.38Å; V34-V45 HydrophobicContact CG2-CG1 4.49Å; V34-V45 HydrophobicContact CG2-CG2 4.45Å; V43-V45 HydrophobicContact CG1-CG2 4.19Å; V45-K57 PolarHBondContact N-O 3.28Å; V45-K57 PolarHBondContact O-N 2.86Å; V45-Y326 HydrophobicContact CG1-CD2 3.68Å; V45-Y326 HydrophobicContact CG1-CE2 3.62Å; V45-T329 HydrophobicContact CG1-CG2 4.48Å; V45-T329 HydrophobicContact CG2-CG2 4.26Å; V45-I330 HydrophobicContact CB-CD1 3.71Å; V45-I330 HydrophobicContact CG1-CD1 3.76Å; V45-I330 HydrophobicContact CG1-CG1 4.24Å; V45-I330 HydrophobicContact CG2-CD1 4.1Å; V45-L333 HydrophobicContact CG2-CD1 3.36Å
46	R	88.8	Confident	81.8	Confident	123 Å²	123	68.8 Å²	68.8	46%	0.464	38%	0.384	S	S	.	.			trans	-93.9	129.9	-179.5	-58.7	-164.5	-179.7	157.6	0.4	110.8	C33 F35 E44 P48 P56 Y326	C33-R46 WeakPolarHBondContact CB-O 3.44Å; C33-R46 PolarHBondContact O-N 3.29Å; F35-R46 HydrophobicContact CD2-CG 3.94Å; F35-R46 HydrophobicContact CE2-CB 4.41Å; F35-R46 VanDerWaalsContact CE2-CD 3.48Å; F35-R46 HydrophobicContact CE2-CG 3.74Å; E44-R46 IonicContact OE1-CZ 3.18Å; E44-R46 IonicContact OE1-NE 2.7Å; E44-R46 PolarHBondContact OE1-NE 3.16Å; E44-R46 IonicContact OE1-NH2 2.71Å; E44-R46 PolarHBondContact OE1-NH2 2.97Å; R46-P48 WeakPolarHBondContact O-CD 3.29Å; R46-P56 HydrophobicContact CG-CB 3.99Å; R46-Y326 WeakPolarHBondContact O-CD2 3.49Å; R46-Y326 WeakPolarHBondContact O-CE2 3.45Å
47	N	83.4	Confident	81.6	Confident	43 Å²	43	68.9 Å²	68.9	23%	0.23	38%	0.383	C	S	.	.			trans	-73.6	122.6	175.5	-177	-3.5	0	0	0	109.7	N49 A50 D54 Y326	N47-N49 PolarHBondContact O-N 3.33Å; N47-N49 PolarHBondContact OD1-N 3.5Å; N47-A50 HydrophobicContact CB-CB 4.06Å; N47-A50 VanDerWaalsContact O-CB 3.27Å; N47-A50 WeakPolarHBondContact O-CB 3.12Å; N47-A50 PolarHBondContact O-N 2.93Å; N47-D54 PolarHBondContact ND2-OD2 3Å; N47-Y326 VanDerWaalsContact CA-CE2 3.45Å; N47-Y326 HydrophobicContact CB-CE1 4.42Å; N47-Y326 HydrophobicContact CB-CE2 3.95Å
48	P	78.3	Confident	81.6	Confident	69 Å²	69	74.8 Å²	74.8	45%	0.448	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-25	176.8	24.2	-32.6	0	0	0	113.2	R46 T323	R46-P48 WeakPolarHBondContact O-CD 3.29Å; P48-T323 HydrophobicContact CB-CG2 3.88Å; P48-T323 HydrophobicContact CG-CG2 4.27Å
49	N	77.9	Confident	81.9	Confident	143 Å²	143	72.7 Å²	72.7	77%	0.765	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	20.5	179.8	-61.6	-29.7	0	0	0	112.2	N47 K51	N47-N49 PolarHBondContact O-N 3.33Å; N47-N49 PolarHBondContact OD1-N 3.5Å; N49-K51 PolarHBondContact O-N 3.33Å
50	A	69.6	Low	82.3	Confident	45 Å²	45	74.1 Å²	74.1	37%	0.372	38%	0.376	S	S	.	.			trans	-54.6	132.9	-179.8	0	0	0	0	0	111.6	N47 D54	N47-A50 HydrophobicContact CB-CB 4.06Å; N47-A50 VanDerWaalsContact O-CB 3.27Å; N47-A50 WeakPolarHBondContact O-CB 3.12Å; N47-A50 PolarHBondContact O-N 2.93Å; A50-D54 HydrophobicContact CB-CB 3.96Å
51	K	72.9	Confident	82.9	Confident	169 Å²	169	70.8 Å²	70.8	74%	0.735	36%	0.358	S	S	*	.			trans	-65.5	153.9	159.4	-67.3	175.5	-175	170.1	0	107.9	N49 N53 D54	N49-K51 PolarHBondContact O-N 3.33Å; K51-N53 PolarHBondContact O-N 3.47Å; K51-D54 WeakPolarHBondContact O-CB 3.42Å; K51-D54 PolarHBondContact O-N 3.49Å
52	P	66.3	Low	83.1	Confident	140 Å²	140	74.8 Å²	74.8	91%	0.909	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-12	-176.1	17.4	-29.5	0	0	0	115.9
53	N	63.7	Low	83.1	Confident	137 Å²	137	73.3 Å²	73.3	73%	0.733	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	8.8	175.6	-81.8	4.6	0	0	0	114.2	K51 D55	K51-N53 PolarHBondContact O-N 3.47Å; N53-D55 PolarHBondContact O-N 2.99Å
54	D	71.3	Confident	83.1	Confident	46 Å²	46	73.7 Å²	73.7	25%	0.246	37%	0.372	C	S	.	.			trans	-85.9	101.1	-178.4	-162.9	21.3	0	0	0	109.8	N47 A50 K51 Q557	N47-D54 PolarHBondContact ND2-OD2 3Å; A50-D54 HydrophobicContact CB-CB 3.96Å; K51-D54 WeakPolarHBondContact O-CB 3.42Å; K51-D54 PolarHBondContact O-N 3.49Å; D54-Q557 PolarHBondContact OD1-NE2 2.69Å
55	D	75.1	Confident	83.2	Confident	87 Å²	87	73 Å²	73	47%	0.465	37%	0.368	S	S	.	.			trans	-60.2	142.4	177.2	-73	-37	0	0	0	111.8	N53	N53-D55 PolarHBondContact O-N 2.99Å
56	P	82.9	Confident	83.2	Confident	39 Å²	39	75.1 Å²	75.1	25%	0.253	38%	0.38	S	S	.	.			trans	-69.1	144.3	-178.5	33.2	-38	0	0	0	110.8	E44 R46 R58	E44-P56 VanDerWaalsContact CD-CG 3.41Å; E44-P56 HydrophobicContact CG-CB 3.51Å; E44-P56 HydrophobicContact CG-CG 3.8Å; E44-P56 WeakPolarHBondContact OE1-CG 3.48Å; R46-P56 HydrophobicContact CG-CB 3.99Å; P56-R58 PolarHBondContact O-N 2.9Å
57	K	86.8	Confident	83.2	Confident	41 Å²	41	71.8 Å²	71.8	18%	0.178	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.5	-177	-74	172.6	174.9	151.6	0	109.6	E44 V45 F59 I330 D561	E44-K57 CarbonylContact C-O 3.59Å; E44-K57 WeakPolarHBondContact CA-O 3.44Å; V45-K57 PolarHBondContact N-O 3.28Å; V45-K57 PolarHBondContact O-N 2.86Å; K57-F59 HydrophobicContact CB-CE2 3.94Å; K57-I330 HydrophobicContact CB-CD1 4.1Å; K57-I330 HydrophobicContact CD-CD1 3.79Å; K57-D561 WeakPolarHBondContact CE-OD2 3.39Å; K57-D561 IonicContact NZ-OD2 3.39Å; K57-D561 PolarHBondContact NZ-OD2 2.64Å
58	R	90	Very high	83.4	Confident	177 Å²	177	76 Å²	76	67%	0.668	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	134	-180	-66.3	177.9	176.1	170.6	1.4	111.4	V43 E44 P56	V43-R58 CarbonylContact O-C 3.42Å; V43-R58 WeakPolarHBondContact O-CA 3.47Å; E44-R58 HydrophobicContact CB-CG 4.21Å; E44-R58 HydrophobicContact CG-CG 4.07Å; E44-R58 IonicContact OE2-CZ 3.53Å; E44-R58 IonicContact OE2-NE 2.72Å; E44-R58 PolarHBondContact OE2-NE 3.41Å; E44-R58 IonicContact OE2-NH2 3.65Å; E44-R58 PolarHBondContact OE2-NH2 2.9Å; P56-R58 PolarHBondContact O-N 2.9Å
59	F	92.6	Very high	83.9	Confident	26 Å²	26	73.8 Å²	73.8	11%	0.114	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144	176.1	-60.4	-89.7	0	0	0	109.8	T42 V43 K57 F61 I330 L333 R334 N337	T42-F59 CarbonylContact C-O 3.56Å; T42-F59 VanDerWaalsContact CA-O 3.27Å; T42-F59 WeakPolarHBondContact CA-O 3.36Å; V43-F59 PolarHBondContact N-O 3.46Å; V43-F59 PolarHBondContact O-N 3.2Å; K57-F59 HydrophobicContact CB-CE2 3.94Å; F59-F61 HydrophobicContact CB-CD2 4.28Å; F59-F61 HydrophobicContact CB-CE2 3.37Å; F59-F61 HydrophobicContact CB-CZ 3.73Å; F59-F61 HydrophobicContact CG-CE2 4.36Å; F59-F61 HydrophobicContact CG-CZ 4.37Å; F59-I330 HydrophobicContact CE2-CD1 4.14Å; F59-L333 HydrophobicContact CD1-CB 4.42Å; F59-L333 HydrophobicContact CD2-CB 3.99Å; F59-L333 HydrophobicContact CD2-CD1 3.85Å; F59-L333 HydrophobicContact CD2-CG 4.47Å; F59-L333 HydrophobicContact CE1-CB 4.4Å; F59-L333 HydrophobicContact CE2-CB 3.95Å; F59-L333 HydrophobicContact CE2-CD1 4.01Å; F59-L333 HydrophobicContact CG-CB 4.22Å; F59-L333 HydrophobicContact CZ-CB 4.16Å; F59-R334 HydrophobicContact CE1-CG 4.13Å; F59-R334 HydrophobicContact CZ-CG 4.18Å; F59-N337 HydrophobicContact CD1-CB 4.17Å
60	R	92.2	Very high	84.5	Confident	116 Å²	116	72.3 Å²	72.3	44%	0.438	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.8	176.7	-178.4	177.2	171.4	168.3	0.4	110.1	G41 T42 K340 E518	G41-R60 WeakPolarHBondContact O-CA 3.43Å; T42-R60 HydrophobicContact CG2-CB 4.32Å; T42-R60 HydrophobicContact CG2-CG 4.4Å; R60-K340 PolarHBondContact O-NZ 2.92Å; R60-K340 VanDerWaalsContact O-NZ 3.15Å; R60-E518 IonicContact CZ-OE2 2.66Å; R60-E518 IonicContact NH1-OE2 3.84Å; R60-E518 PolarHBondContact NH1-OE2 2.85Å; R60-E518 IonicContact NH2-OE2 3.67Å
61	F	93.7	Very high	85.5	Confident	13 Å²	13	70.5 Å²	70.5	6%	0.057	35%	0.349	C	S	.	.			trans	-129.3	173.2	-176.9	-61.5	-77.4	0	0	0	111.1	V14 V16 G41 V43 F59 V64 L333 A336 N337	V14-F61 HydrophobicContact CB-CD1 4.25Å; V14-F61 HydrophobicContact CG1-CD1 3.69Å; V14-F61 HydrophobicContact CG1-CE1 4.07Å; V16-F61 HydrophobicContact CB-CD2 4.31Å; V16-F61 HydrophobicContact CG2-CB 4.34Å; V16-F61 HydrophobicContact CG2-CD1 3.96Å; V16-F61 HydrophobicContact CG2-CD2 3.31Å; V16-F61 HydrophobicContact CG2-CE1 4.04Å; V16-F61 HydrophobicContact CG2-CE2 3.4Å; V16-F61 VanDerWaalsContact CG2-CE2 3.4Å; V16-F61 HydrophobicContact CG2-CG 3.6Å; V16-F61 HydrophobicContact CG2-CZ 3.77Å; G41-F61 PolarHBondContact O-N 3.08Å; V43-F61 HydrophobicContact CB-CE2 4.45Å; V43-F61 HydrophobicContact CG2-CD2 4.08Å; V43-F61 HydrophobicContact CG2-CE2 4.15Å; F59-F61 HydrophobicContact CB-CD2 4.28Å; F59-F61 HydrophobicContact CB-CE2 3.37Å; F59-F61 HydrophobicContact CB-CZ 3.73Å; F59-F61 HydrophobicContact CG-CE2 4.36Å; F59-F61 HydrophobicContact CG-CZ 4.37Å; F61-V64 HydrophobicContact CB-CG1 4.05Å; F61-V64 HydrophobicContact CD2-CG1 4.15Å; F61-L333 HydrophobicContact CE2-CD2 3.7Å; F61-L333 HydrophobicContact CZ-CB 4.43Å; F61-L333 HydrophobicContact CZ-CD2 3.76Å; F61-A336 HydrophobicContact CE1-CB 3.62Å; F61-A336 HydrophobicContact CZ-CB 4.13Å; F61-N337 HydrophobicContact CE1-CB 4.24Å; F61-N337 HydrophobicContact CZ-CB 4.47Å
62	D	91	Very high	86.1	Confident	91 Å²	91	67.9 Å²	67.9	49%	0.487	34%	0.337	S	S	.	.	S	Bend	trans	-67.7	-40.4	-179.3	-59.3	-75.4	0	0	0	111.7	K13 V14	K13-D62 WeakPolarHBondContact CA-OD2 3.43Å; V14-D62 PolarHBondContact N-OD2 3.47Å; V14-D62 PolarHBondContact O-N 3.18Å; V14-D62 VanDerWaalsContact O-N 3.17Å
63	A	91.4	Very high	87.2	Confident	11 Å²	11	65.2 Å²	65.2	9%	0.091	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	150.4	170	0	0	0	0	0	110.6	V15 V16 Y65	V15-A63 VanDerWaalsContact CA-O 3.28Å; V15-A63 WeakPolarHBondContact CA-O 3.22Å; V15-A63 HydrophobicContact CB-CB 4.5Å; V15-A63 HydrophobicContact CG1-CB 3.82Å; V16-A63 PolarHBondContact N-O 2.84Å; V16-A63 VanDerWaalsContact N-O 3.08Å; A63-Y65 HydrophobicContact CB-CE2 3.8Å
64	V	93.2	Very high	88.4	Confident	7 Å²	7	58.8 Å²	58.8	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.1	178.5	-57.1	0	0	0	0	110	V16 I36 D37 G41 V43 F61	V16-V64 HydrophobicContact CB-CG1 4.33Å; V16-V64 CarbonylContact O-C 3.47Å; V16-V64 WeakPolarHBondContact O-CA 3.44Å; I36-V64 HydrophobicContact CG2-CB 3.94Å; I36-V64 HydrophobicContact CG2-CG2 3.52Å; D37-V64 WeakPolarHBondContact O-CG2 3.39Å; G41-V64 WeakPolarHBondContact O-CG1 3.38Å; V43-V64 HydrophobicContact CG2-CB 4.25Å; V43-V64 HydrophobicContact CG2-CG1 3.73Å; F61-V64 HydrophobicContact CB-CG1 4.05Å; F61-V64 HydrophobicContact CD2-CG1 4.15Å
65	Y	94	Very high	89.4	Confident	11 Å²	11	57.1 Å²	57.1	4%	0.043	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.2	-173.6	-65.1	-80.9	0	0	0	109.6	V15 V16 C18 A63 L74 E77 T78	V15-Y65 HydrophobicContact CB-CE2 4.18Å; V15-Y65 HydrophobicContact CG1-CE2 4.43Å; V16-Y65 PolarHBondContact O-N 3.05Å; C18-Y65 PolarHBondContact N-O 3.08Å; A63-Y65 HydrophobicContact CB-CE2 3.8Å; Y65-L74 HydrophobicContact CD1-CB 4.47Å; Y65-L74 HydrophobicContact CD1-CD1 4.1Å; Y65-L74 HydrophobicContact CD2-CD1 3.3Å; Y65-L74 HydrophobicContact CE1-CB 4.21Å; Y65-L74 HydrophobicContact CE1-CD1 3.88Å; Y65-L74 HydrophobicContact CE2-CD1 3.02Å; Y65-L74 HydrophobicContact CE2-CG 4.4Å; Y65-L74 HydrophobicContact CG-CD1 3.82Å; Y65-E77 VanDerWaalsContact CE1-OE2 3.26Å; Y65-E77 WeakPolarHBondContact CE1-OE2 3.34Å; Y65-E77 VanDerWaalsContact CZ-OE2 3.29Å; Y65-E77 VanDerWaalsContact OH-CD 3.23Å; Y65-E77 PolarHBondContact OH-OE2 3.36Å; Y65-T78 PolarHBondContact OH-OG1 3.27Å
66	D	91.5	Very high	90	Very high	44 Å²	44	54.9 Å²	54.9	24%	0.235	26%	0.259	C	S	.	.			trans	-83.5	-173.4	-179.3	79.2	-17.8	0	0	0	112.4	C18 I36 N68 S69	C18-D66 CarbonylContact O-C 3.56Å; I36-D66 HydrophobicContact CB-CB 4.27Å; I36-D66 HydrophobicContact CD1-CB 4.47Å; I36-D66 HydrophobicContact CG2-CB 4.23Å; D66-N68 PolarHBondContact O-N 3.3Å; D66-N68 PolarHBondContact OD1-N 2.99Å; D66-N68 PolarHBondContact OD2-ND2 3.4Å; D66-S69 VanDerWaalsContact O-CB 3.31Å; D66-S69 WeakPolarHBondContact O-CB 3.49Å; D66-S69 PolarHBondContact O-N 2.9Å; D66-S69 PolarHBondContact O-OG 3.27Å; D66-S69 PolarHBondContact OD1-N 2.97Å; D66-S69 VanDerWaalsContact OD1-N 3.17Å
67	E	89.1	Confident	90.2	Very high	52 Å²	52	58.1 Å²	58.1	24%	0.243	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.8	-178.6	-58.3	174.6	-166.9	0	0	113.1	P20 K32	P20-E67 HydrophobicContact CB-CB 4.29Å; K32-E67 WeakPolarHBondContact CD-OE1 3.49Å; K32-E67 WeakPolarHBondContact CE-OE1 3.23Å; K32-E67 IonicContact NZ-OE1 2.69Å; K32-E67 PolarHBondContact NZ-OE1 2.94Å; K32-E67 IonicContact NZ-OE2 3.43Å; K32-E67 PolarHBondContact NZ-OE2 3.5Å
68	N	88.8	Confident	90.3	Very high	133 Å²	133	56.8 Å²	56.8	71%	0.711	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-4	-179	-55.6	-57.8	0	0	0	112.5	D66 K70	D66-N68 PolarHBondContact O-N 3.3Å; D66-N68 PolarHBondContact OD1-N 2.99Å; D66-N68 PolarHBondContact OD2-ND2 3.4Å; N68-K70 PolarHBondContact O-N 3.5Å
69	S	88.2	Confident	90.4	Very high	21 Å²	21	48.4 Å²	48.4	15%	0.147	24%	0.235	C	C	.	.			trans	-64.6	126	-176.8	61.3	0	0	0	0	113	D66	D66-S69 VanDerWaalsContact O-CB 3.31Å; D66-S69 WeakPolarHBondContact O-CB 3.49Å; D66-S69 PolarHBondContact O-N 2.9Å; D66-S69 PolarHBondContact O-OG 3.27Å; D66-S69 PolarHBondContact OD1-N 2.97Å; D66-S69 VanDerWaalsContact OD1-N 3.17Å
70	K	89.6	Confident	90.4	Very high	113 Å²	113	50.1 Å²	50.1	49%	0.491	24%	0.24	S	C	.	.			trans	-83.3	154.3	174.2	-60.1	-171.7	176	-161.9	0	111.1	N68 K72 D73 L74 E116	N68-K70 PolarHBondContact O-N 3.5Å; K70-K72 VanDerWaalsContact C-N 3.25Å; K70-K72 PolarHBondContact O-N 3.48Å; K70-D73 PolarHBondContact O-N 3.29Å; K70-L74 PolarHBondContact O-N 3.31Å; K70-E116 IonicContact NZ-OE2 2.7Å
71	Q	90.3	Very high	90.3	Very high	7 Å²	7	47.9 Å²	47.9	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-36.3	177	-60.6	-79.9	51.4	0	0	112.6	Y75 F106 L117 R118	Q71-Y75 WeakPolarHBondContact O-CB 3.3Å; Q71-Y75 PolarHBondContact O-N 3.43Å; Q71-F106 PolarHBondContact NE2-O 3.18Å; Q71-L117 PolarHBondContact NE2-O 3.46Å; Q71-R118 WeakPolarHBondContact CB-O 3.31Å
72	K	87.4	Confident	90.3	Very high	113 Å²	113	47.6 Å²	47.6	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-67.7	-41.9	-178.7	-170.2	175.9	-175.9	171.7	0	112.4	K70 Y75 D76	K70-K72 VanDerWaalsContact C-N 3.25Å; K70-K72 PolarHBondContact O-N 3.48Å; K72-Y75 WeakPolarHBondContact O-CB 3.41Å; K72-Y75 PolarHBondContact O-N 3Å; K72-D76 PolarHBondContact O-N 3.28Å
73	D	87.6	Confident	90.5	Very high	85 Å²	85	43.3 Å²	43.3	46%	0.455	21%	0.213	S	C	.	.	H	α-helix	trans	-63.9	-45.4	179.4	-57.7	-25.6	0	0	0	110.2	K70 Y75 D76 E77	K70-D73 PolarHBondContact O-N 3.29Å; D73-Y75 VanDerWaalsContact C-N 3.28Å; D73-Y75 PolarHBondContact O-N 3.5Å; D73-D76 PolarHBondContact O-N 2.87Å; D73-E77 VanDerWaalsContact O-CB 3.32Å; D73-E77 WeakPolarHBondContact O-CB 3.48Å; D73-E77 PolarHBondContact O-N 3.48Å
74	L	89.9	Confident	90.5	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-56.9	-41.5	173.3	-179.9	67.3	0	0	0	112	Y65 K70 T78 F79 T107	Y65-L74 HydrophobicContact CD1-CB 4.47Å; Y65-L74 HydrophobicContact CD1-CD1 4.1Å; Y65-L74 HydrophobicContact CD2-CD1 3.3Å; Y65-L74 HydrophobicContact CE1-CB 4.21Å; Y65-L74 HydrophobicContact CE1-CD1 3.88Å; Y65-L74 HydrophobicContact CE2-CD1 3.02Å; Y65-L74 HydrophobicContact CE2-CG 4.4Å; Y65-L74 HydrophobicContact CG-CD1 3.82Å; K70-L74 PolarHBondContact O-N 3.31Å; L74-T78 WeakPolarHBondContact O-CB 3.43Å; L74-T78 PolarHBondContact O-N 2.81Å; L74-T78 VanDerWaalsContact O-N 3.14Å; L74-F79 HydrophobicContact CD1-CE2 4.21Å; L74-F79 HydrophobicContact CD1-CZ 4.08Å; L74-F79 HydrophobicContact CD2-CE2 3.69Å; L74-F79 HydrophobicContact CD2-CZ 3.97Å; L74-F79 HydrophobicContact CG-CD2 4.31Å; L74-F79 HydrophobicContact CG-CE2 3.45Å; L74-F79 VanDerWaalsContact CG-CE2 3.45Å; L74-F79 HydrophobicContact CG-CZ 3.8Å; L74-T107 HydrophobicContact CD2-CG2 3.64Å
75	Y	91.7	Very high	90.5	Very high	11 Å²	11	45.7 Å²	45.7	4%	0.043	23%	0.225	C	C	.	.	I	π-helix	trans	-68.5	-47.9	179.3	-172.1	-88.6	0	0	0	113.1	Q71 K72 D73 F79 R80 V120 N123 S124 H127	Q71-Y75 WeakPolarHBondContact O-CB 3.3Å; Q71-Y75 PolarHBondContact O-N 3.43Å; K72-Y75 WeakPolarHBondContact O-CB 3.41Å; K72-Y75 PolarHBondContact O-N 3Å; D73-Y75 VanDerWaalsContact C-N 3.28Å; D73-Y75 PolarHBondContact O-N 3.5Å; Y75-F79 HydrophobicContact CD2-CB 3.97Å; Y75-F79 HydrophobicContact CD2-CD2 4.01Å; Y75-F79 HydrophobicContact CE2-CB 4.21Å; Y75-F79 HydrophobicContact CG-CB 4.48Å; Y75-F79 PolarHBondContact O-N 3.19Å; Y75-F79 VanDerWaalsContact O-N 3.16Å; Y75-R80 WeakPolarHBondContact O-CB 3.44Å; Y75-R80 PolarHBondContact O-N 3.33Å; Y75-V120 HydrophobicContact CD2-CG2 4.05Å; Y75-V120 HydrophobicContact CE2-CG2 4.15Å; Y75-N123 HydrophobicContact CD1-CB 4.39Å; Y75-N123 HydrophobicContact CD2-CB 3.5Å; Y75-N123 HydrophobicContact CE1-CB 4.41Å; Y75-N123 HydrophobicContact CE2-CB 3.55Å; Y75-N123 HydrophobicContact CG-CB 3.96Å; Y75-N123 PolarHBondContact OH-O 3.09Å; Y75-S124 VanDerWaalsContact OH-CA 3.31Å; Y75-S124 WeakPolarHBondContact OH-CA 3.37Å; Y75-H127 HydrophobicContact CE1-CB 4.37Å; Y75-H127 WeakPolarHBondContact OH-CB 3.19Å; Y75-H127 PolarHBondContact OH-ND1 3.13Å; Y75-H127 VanDerWaalsContact OH-ND1 3.13Å
76	D	88.8	Confident	90.5	Very high	40 Å²	40	45.3 Å²	45.3	21%	0.214	22%	0.224	C	C	.	.	I	π-helix	trans	-70	-34	-176.2	-78.7	-24.2	0	0	0	112.6	K72 D73 R80	K72-D76 PolarHBondContact O-N 3.28Å; D73-D76 PolarHBondContact O-N 2.87Å; D76-R80 IonicContact OD1-CZ 2.98Å; D76-R80 VanDerWaalsContact OD1-CZ 3.26Å; D76-R80 IonicContact OD1-NE 3.19Å; D76-R80 PolarHBondContact OD1-NE 2.94Å; D76-R80 IonicContact OD1-NH2 3.48Å; D76-R80 PolarHBondContact OD1-NH2 3.24Å
77	E	87.3	Confident	90.5	Very high	107 Å²	107	43.3 Å²	43.3	50%	0.5	21%	0.213	S	C	.	.	I	π-helix	trans	-83	-44.3	-179.1	-177.1	179.2	-163	0	0	113.3	Y65 D73	Y65-E77 VanDerWaalsContact CE1-OE2 3.26Å; Y65-E77 WeakPolarHBondContact CE1-OE2 3.34Å; Y65-E77 VanDerWaalsContact CZ-OE2 3.29Å; Y65-E77 VanDerWaalsContact OH-CD 3.23Å; Y65-E77 PolarHBondContact OH-OE2 3.36Å; D73-E77 VanDerWaalsContact O-CB 3.32Å; D73-E77 WeakPolarHBondContact O-CB 3.48Å; D73-E77 PolarHBondContact O-N 3.48Å
78	T	88.3	Confident	90.5	Very high	13 Å²	13	44.8 Å²	44.8	8%	0.08	22%	0.223	C	C	.	.	I	π-helix	trans	-105.3	-48.5	-170.4	-65.5	0	0	0	0	113	V15 Y65 L74 I314	V15-T78 HydrophobicContact CG1-CG2 3.61Å; V15-T78 HydrophobicContact CG2-CG2 4.31Å; Y65-T78 PolarHBondContact OH-OG1 3.27Å; L74-T78 WeakPolarHBondContact O-CB 3.43Å; L74-T78 PolarHBondContact O-N 2.81Å; L74-T78 VanDerWaalsContact O-N 3.14Å; T78-I314 HydrophobicContact CG2-CD1 3.92Å; T78-I314 HydrophobicContact CG2-CG2 3.87Å; T78-I314 WeakPolarHBondContact O-CD1 3.43Å
79	F	92.9	Very high	90.6	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.009	19%	0.189	C	C	.	.	I	π-helix	trans	-86.3	-30.7	-167.3	-55.6	-43.6	0	0	0	113.5	L74 Y75 D81 L82 I83 I94 V120 I314 I316	L74-F79 HydrophobicContact CD1-CE2 4.21Å; L74-F79 HydrophobicContact CD1-CZ 4.08Å; L74-F79 HydrophobicContact CD2-CE2 3.69Å; L74-F79 HydrophobicContact CD2-CZ 3.97Å; L74-F79 HydrophobicContact CG-CD2 4.31Å; L74-F79 HydrophobicContact CG-CE2 3.45Å; L74-F79 VanDerWaalsContact CG-CE2 3.45Å; L74-F79 HydrophobicContact CG-CZ 3.8Å; Y75-F79 HydrophobicContact CD2-CB 3.97Å; Y75-F79 HydrophobicContact CD2-CD2 4.01Å; Y75-F79 HydrophobicContact CE2-CB 4.21Å; Y75-F79 HydrophobicContact CG-CB 4.48Å; Y75-F79 PolarHBondContact O-N 3.19Å; Y75-F79 VanDerWaalsContact O-N 3.16Å; F79-D81 VanDerWaalsContact C-N 3.3Å; F79-D81 PolarHBondContact O-N 3.07Å; F79-L82 WeakPolarHBondContact O-CB 3.45Å; F79-L82 PolarHBondContact O-N 3.1Å; F79-I83 WeakPolarHBondContact O-CG1 3.43Å; F79-I83 PolarHBondContact O-N 3.34Å; F79-I94 HydrophobicContact CB-CD1 4.28Å; F79-I94 HydrophobicContact CD1-CD1 3.8Å; F79-I94 HydrophobicContact CD1-CG2 4.36Å; F79-I94 HydrophobicContact CE1-CD1 4.47Å; F79-I94 HydrophobicContact CE1-CG2 4.01Å; F79-I94 HydrophobicContact CG-CD1 4.13Å; F79-V120 HydrophobicContact CB-CG2 3.94Å; F79-V120 HydrophobicContact CD1-CG2 4.22Å; F79-V120 HydrophobicContact CD2-CB 3.81Å; F79-V120 HydrophobicContact CD2-CG2 3.28Å; F79-V120 HydrophobicContact CE2-CB 3.86Å; F79-V120 HydrophobicContact CE2-CG2 3.78Å; F79-V120 HydrophobicContact CG-CG2 3.56Å; F79-V120 HydrophobicContact CZ-CG2 4.48Å; F79-I314 HydrophobicContact CD1-CD1 4.2Å; F79-I314 HydrophobicContact CD1-CG2 4.37Å; F79-I314 HydrophobicContact CE1-CG2 4Å; F79-I316 HydrophobicContact CE1-CD1 3.65Å; F79-I316 HydrophobicContact CE1-CG1 3.83Å; F79-I316 HydrophobicContact CE2-CD1 4.32Å; F79-I316 HydrophobicContact CZ-CD1 3.31Å; F79-I316 HydrophobicContact CZ-CG1 3.77Å
80	R	91.3	Very high	90.7	Very high	62 Å²	62	38.5 Å²	38.5	23%	0.234	19%	0.187	C	C	.	.	H	α-helix	trans	-52.3	-45.4	-177.1	-178.9	176.1	-79.7	-95	2	112.7	Y75 D76 L82 I83 N84	Y75-R80 WeakPolarHBondContact O-CB 3.44Å; Y75-R80 PolarHBondContact O-N 3.33Å; D76-R80 IonicContact OD1-CZ 2.98Å; D76-R80 VanDerWaalsContact OD1-CZ 3.26Å; D76-R80 IonicContact OD1-NE 3.19Å; D76-R80 PolarHBondContact OD1-NE 2.94Å; D76-R80 IonicContact OD1-NH2 3.48Å; D76-R80 PolarHBondContact OD1-NH2 3.24Å; R80-L82 VanDerWaalsContact C-N 3.34Å; R80-L82 PolarHBondContact O-N 3.35Å; R80-I83 PolarHBondContact O-N 3.03Å; R80-N84 VanDerWaalsContact O-CG 3.29Å; R80-N84 PolarHBondContact O-N 3.49Å; R80-N84 PolarHBondContact O-ND2 2.9Å
81	D	91.4	Very high	90.9	Very high	68 Å²	68	34.1 Å²	34.1	36%	0.364	17%	0.169	S	C	.	.	H	α-helix	trans	-62.9	-37.7	178.5	-76.3	-1.6	0	0	0	113.1	F79 S85	F79-D81 VanDerWaalsContact C-N 3.3Å; F79-D81 PolarHBondContact O-N 3.07Å; D81-S85 PolarHBondContact O-N 2.99Å; D81-S85 PolarHBondContact O-OG 3.28Å
82	L	93.7	Very high	91.1	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-69.3	-45.2	177.2	-174.7	75.5	0	0	0	110.9	F79 R80 N84 S85 V86 I94 L243 K312 I314	F79-L82 WeakPolarHBondContact O-CB 3.45Å; F79-L82 PolarHBondContact O-N 3.1Å; R80-L82 VanDerWaalsContact C-N 3.34Å; R80-L82 PolarHBondContact O-N 3.35Å; L82-N84 VanDerWaalsContact C-N 3.31Å; L82-N84 PolarHBondContact O-N 3.49Å; L82-S85 WeakPolarHBondContact O-CB 3.24Å; L82-S85 PolarHBondContact O-N 2.81Å; L82-S85 VanDerWaalsContact O-N 3.11Å; L82-V86 PolarHBondContact O-N 3.01Å; L82-I94 HydrophobicContact CD2-CD1 3.77Å; L82-I94 HydrophobicContact CD2-CG1 3.23Å; L82-L243 HydrophobicContact CD2-CD1 4.49Å; L82-K312 HydrophobicContact CD1-CB 3.33Å; L82-K312 WeakPolarHBondContact CD1-O 3.41Å; L82-I314 HydrophobicContact CB-CD1 3.73Å; L82-I314 HydrophobicContact CD1-CG1 4.47Å; L82-I314 HydrophobicContact CD2-CD1 3.92Å; L82-I314 HydrophobicContact CD2-CG1 4.03Å; L82-I314 HydrophobicContact CG-CD1 4.27Å
83	I	93.9	Very high	91.5	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-40.4	178.7	-57.9	-55.4	0	0	0	110.8	F79 R80 S85 V86 L87 I94 H127 I128 L243	F79-I83 WeakPolarHBondContact O-CG1 3.43Å; F79-I83 PolarHBondContact O-N 3.34Å; R80-I83 PolarHBondContact O-N 3.03Å; I83-S85 VanDerWaalsContact C-N 3.33Å; I83-S85 PolarHBondContact O-N 2.77Å; I83-V86 PolarHBondContact O-N 2.96Å; I83-V86 VanDerWaalsContact O-N 3.16Å; I83-L87 HydrophobicContact CG2-CD1 4.42Å; I83-L87 WeakPolarHBondContact O-CG 3.28Å; I83-L87 PolarHBondContact O-N 2.89Å; I83-I94 HydrophobicContact CD1-CD1 4.48Å; I83-H127 HydrophobicContact CG2-CB 4.37Å; I83-H127 WeakPolarHBondContact CG2-ND1 3.24Å; I83-I128 HydrophobicContact CG2-CG1 3.93Å; I83-L243 HydrophobicContact CD1-CD1 3.73Å; I83-L243 HydrophobicContact CD1-CD2 3.49Å; I83-L243 VanDerWaalsContact CD1-CD2 3.49Å; I83-L243 HydrophobicContact CD1-CG 4.26Å
84	N	92.3	Very high	92	Very high	54 Å²	54	24.5 Å²	24.5	29%	0.289	12%	0.123	S	C	.	.	H	α-helix	trans	-58.9	-44.2	172.1	-72.4	-22.2	0	0	0	111.8	R80 L82 V86 L87 D88 H127	R80-N84 VanDerWaalsContact O-CG 3.29Å; R80-N84 PolarHBondContact O-N 3.49Å; R80-N84 PolarHBondContact O-ND2 2.9Å; L82-N84 VanDerWaalsContact C-N 3.31Å; L82-N84 PolarHBondContact O-N 3.49Å; N84-V86 VanDerWaalsContact C-N 3.27Å; N84-V86 PolarHBondContact O-N 3.11Å; N84-L87 WeakPolarHBondContact O-CB 3.49Å; N84-L87 PolarHBondContact O-N 3.27Å; N84-L87 VanDerWaalsContact O-N 3.14Å; N84-D88 PolarHBondContact O-N 2.94Å; N84-H127 PolarHBondContact OD1-CE1 3.47Å; N84-H127 PolarHBondContact OD1-NE2 3.35Å
85	S	92.7	Very high	92.2	Very high	14 Å²	14	24.5 Å²	24.5	10%	0.098	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-36	176.3	-58.2	0	0	0	0	112.2	D81 L82 I83 D88 G89 F90 K312	D81-S85 PolarHBondContact O-N 2.99Å; D81-S85 PolarHBondContact O-OG 3.28Å; L82-S85 WeakPolarHBondContact O-CB 3.24Å; L82-S85 PolarHBondContact O-N 2.81Å; L82-S85 VanDerWaalsContact O-N 3.11Å; I83-S85 VanDerWaalsContact C-N 3.33Å; I83-S85 PolarHBondContact O-N 2.77Å; S85-D88 PolarHBondContact O-N 3.46Å; S85-G89 PolarHBondContact O-N 3.46Å; S85-F90 VanDerWaalsContact O-CB 3.31Å; S85-F90 WeakPolarHBondContact O-CB 3.4Å; S85-F90 WeakPolarHBondContact O-CD2 3.27Å; S85-F90 PolarHBondContact O-N 2.93Å; S85-K312 PolarHBondContact OG-NZ 3.31Å
86	V	93.4	Very high	92.3	Very high	2 Å²	2	24 Å²	24	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-66.6	-41	175.2	176	0	0	0	0	111.4	L82 I83 N84 D88 G89 F90 G241 L243	L82-V86 PolarHBondContact O-N 3.01Å; I83-V86 PolarHBondContact O-N 2.96Å; I83-V86 VanDerWaalsContact O-N 3.16Å; N84-V86 VanDerWaalsContact C-N 3.27Å; N84-V86 PolarHBondContact O-N 3.11Å; V86-D88 PolarHBondContact O-N 3.37Å; V86-G89 PolarHBondContact O-N 3.4Å; V86-F90 WeakPolarHBondContact CA-O 3.44Å; V86-G241 WeakPolarHBondContact O-CA 3.27Å; V86-L243 HydrophobicContact CG1-CB 4.03Å; V86-L243 HydrophobicContact CG2-CB 4.15Å; V86-L243 HydrophobicContact CG2-CD1 4.22Å
87	L	91.7	Very high	92.5	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-32.7	176	-68.1	165.2	0	0	0	112	I83 N84 G89 I128 H131 V225	I83-L87 HydrophobicContact CG2-CD1 4.42Å; I83-L87 WeakPolarHBondContact O-CG 3.28Å; I83-L87 PolarHBondContact O-N 2.89Å; N84-L87 WeakPolarHBondContact O-CB 3.49Å; N84-L87 PolarHBondContact O-N 3.27Å; N84-L87 VanDerWaalsContact O-N 3.14Å; L87-G89 PolarHBondContact O-N 2.91Å; L87-I128 HydrophobicContact CD2-CB 4.45Å; L87-I128 HydrophobicContact CD2-CG1 4.24Å; L87-I128 HydrophobicContact CD2-CG2 4.15Å; L87-H131 HydrophobicContact CD1-CB 3.67Å; L87-H131 HydrophobicContact CD2-CB 4.42Å; L87-V225 HydrophobicContact CD2-CG1 4.27Å
88	D	89.5	Confident	92.7	Very high	82 Å²	82	17.8 Å²	17.8	44%	0.439	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-10.5	174.1	-68.9	-29.6	0	0	0	114	N84 S85 V86 F90 R239	N84-D88 PolarHBondContact O-N 2.94Å; S85-D88 PolarHBondContact O-N 3.46Å; V86-D88 PolarHBondContact O-N 3.37Å; D88-F90 HydrophobicContact CB-CD2 4.27Å; D88-R239 WeakPolarHBondContact O-CD 3.48Å
89	G	89.8	Confident	92.7	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.01	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.8	13.3	178.8	0	0	0	0	0	115.8	S85 V86 L87 N349	S85-G89 PolarHBondContact O-N 3.46Å; V86-G89 PolarHBondContact O-N 3.4Å; L87-G89 PolarHBondContact O-N 2.91Å; G89-N349 PolarHBondContact O-N 3.21Å; G89-N349 PolarHBondContact O-ND2 2.56Å
90	F	92.3	Very high	92.3	Very high	22 Å²	22	19.7 Å²	19.7	10%	0.096	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-83	155.2	170.6	-68.2	-88.6	0	0	0	111.6	S85 V86 D88 G241 P346 K347 I348	S85-F90 VanDerWaalsContact O-CB 3.31Å; S85-F90 WeakPolarHBondContact O-CB 3.4Å; S85-F90 WeakPolarHBondContact O-CD2 3.27Å; S85-F90 PolarHBondContact O-N 2.93Å; V86-F90 WeakPolarHBondContact CA-O 3.44Å; D88-F90 HydrophobicContact CB-CD2 4.27Å; F90-G241 WeakPolarHBondContact O-CA 3.3Å; F90-P346 HydrophobicContact CD1-CB 3.91Å; F90-P346 HydrophobicContact CE1-CB 4.24Å; F90-K347 VanDerWaalsContact CD1-C 3.47Å; F90-K347 WeakPolarHBondContact CD1-O 3.34Å; F90-I348 HydrophobicContact CD1-CG1 4.24Å; F90-I348 HydrophobicContact CD2-CG1 4.05Å; F90-I348 HydrophobicContact CE1-CG1 3.69Å; F90-I348 HydrophobicContact CE2-CD1 3.95Å; F90-I348 HydrophobicContact CE2-CG1 3.46Å; F90-I348 VanDerWaalsContact CE2-CG1 3.46Å; F90-I348 HydrophobicContact CG-CG1 4.42Å; F90-I348 HydrophobicContact CZ-CD1 3.91Å; F90-I348 HydrophobicContact CZ-CG1 3.27Å
91	N	93.4	Very high	91.9	Very high	21 Å²	21	19 Å²	19	11%	0.112	11%	0.113	C	C	.	.			trans	-75.9	136.1	162.6	-63.1	-35.4	0	0	0	109.6	K242 N310 S311 K312 N349	N91-K242 CarbonylContact C-O 3.57Å; N91-K242 WeakPolarHBondContact CA-O 3.23Å; N91-K242 WeakPolarHBondContact OD1-CB 3.29Å; N91-N310 VanDerWaalsContact CB-O 3.27Å; N91-N310 WeakPolarHBondContact CB-O 3.45Å; N91-N310 PolarHBondContact ND2-O 2.8Å; N91-S311 WeakPolarHBondContact O-CA 3.42Å; N91-S311 PolarHBondContact O-OG 3.28Å; N91-K312 PolarHBondContact O-N 3.36Å; N91-N349 VanDerWaalsContact CG-ND2 3.31Å; N91-N349 PolarHBondContact ND2-ND2 3.29Å; N91-N349 PolarHBondContact OD1-ND2 2.92Å
92	G	94.5	Very high	91.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.3	177.8	0	0	0	0	0	110.6	K242 L243 N244 K312	G92-K242 PolarHBondContact N-O 3.33Å; G92-K242 VanDerWaalsContact O-O 3.11Å; G92-L243 CarbonylContact O-C 3.51Å; G92-L243 WeakPolarHBondContact O-CA 3.43Å; G92-N244 PolarHBondContact O-N 3.14Å; G92-K312 CarbonylContact C-O 3.42Å; G92-K312 VanDerWaalsContact CA-O 3.29Å; G92-K312 WeakPolarHBondContact CA-O 3.5Å
93	T	95.9	Very high	91.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	128	174.2	-59.4	0	0	0	0	110.6	F95 N244 V246 L303 S306 S311 K312 T313 I314	T93-F95 HydrophobicContact CG2-CD1 4.32Å; T93-N244 CarbonylContact C-O 3.57Å; T93-N244 WeakPolarHBondContact CA-O 3.47Å; T93-N244 HydrophobicContact CG2-CB 4.05Å; T93-N244 PolarHBondContact OG1-ND2 3.34Å; T93-V246 HydrophobicContact CG2-CG2 4.32Å; T93-L303 HydrophobicContact CG2-CD2 4.24Å; T93-S306 WeakPolarHBondContact CB-OG 3.37Å; T93-S306 WeakPolarHBondContact CG2-OG 3.48Å; T93-S306 WeakPolarHBondContact OG1-CB 3.34Å; T93-S306 PolarHBondContact OG1-OG 3.43Å; T93-S311 PolarHBondContact OG1-OG 2.86Å; T93-K312 PolarHBondContact N-O 2.84Å; T93-T313 HydrophobicContact CG2-CG2 4.4Å; T93-T313 CarbonylContact O-C 3.56Å; T93-T313 WeakPolarHBondContact O-CA 3.15Å; T93-I314 PolarHBondContact O-N 3Å
94	I	96.3	Very high	91.4	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.01	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.9	170.1	-54.1	-180	0	0	0	106.7	F79 L82 I83 V120 N244 L245 V246 I314 I316	F79-I94 HydrophobicContact CB-CD1 4.28Å; F79-I94 HydrophobicContact CD1-CD1 3.8Å; F79-I94 HydrophobicContact CD1-CG2 4.36Å; F79-I94 HydrophobicContact CE1-CD1 4.47Å; F79-I94 HydrophobicContact CE1-CG2 4.01Å; F79-I94 HydrophobicContact CG-CD1 4.13Å; L82-I94 HydrophobicContact CD2-CD1 3.77Å; L82-I94 HydrophobicContact CD2-CG1 3.23Å; I83-I94 HydrophobicContact CD1-CD1 4.48Å; I94-V120 HydrophobicContact CD1-CG2 3.6Å; I94-N244 PolarHBondContact N-O 3.05Å; I94-L245 HydrophobicContact CB-CD2 3.97Å; I94-L245 HydrophobicContact CD1-CD2 3.84Å; I94-L245 HydrophobicContact CG1-CD2 4.14Å; I94-V246 PolarHBondContact O-N 2.96Å; I94-I314 WeakPolarHBondContact CA-O 3.42Å; I94-I316 HydrophobicContact CG2-CD1 3.52Å; I94-I316 HydrophobicContact CG2-CG1 4.16Å
95	F	94.9	Very high	91.2	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.009	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.5	175.4	69.2	-91.4	0	0	0	111.9	T93 V246 L248 L307 T313 I314 M315 I316	T93-F95 HydrophobicContact CG2-CD1 4.32Å; F95-V246 WeakPolarHBondContact CA-O 3.41Å; F95-V246 HydrophobicContact CB-CB 3.63Å; F95-V246 HydrophobicContact CB-CG1 4.04Å; F95-V246 HydrophobicContact CB-CG2 4.29Å; F95-L248 HydrophobicContact CD2-CD1 3.91Å; F95-L307 HydrophobicContact CE1-CD2 4.19Å; F95-L307 HydrophobicContact CZ-CD2 4.35Å; F95-T313 HydrophobicContact CD1-CG2 3.81Å; F95-T313 HydrophobicContact CE1-CG2 3.46Å; F95-T313 VanDerWaalsContact CE1-CG2 3.46Å; F95-I314 PolarHBondContact N-O 3.41Å; F95-M315 HydrophobicContact CD2-CB 4.49Å; F95-M315 HydrophobicContact CD2-CG 4.14Å; F95-M315 HydrophobicContact CE1-CB 3.89Å; F95-M315 HydrophobicContact CE1-CG 4.42Å; F95-M315 HydrophobicContact CE2-CB 3.78Å; F95-M315 HydrophobicContact CE2-CE 4.35Å; F95-M315 HydrophobicContact CE2-CG 3.38Å; F95-M315 HydrophobicContact CE2-SD 3.83Å; F95-M315 HydrophobicContact CZ-CB 3.44Å; F95-M315 VanDerWaalsContact CZ-CB 3.44Å; F95-M315 HydrophobicContact CZ-CG 3.55Å; F95-M315 HydrophobicContact CZ-SD 3.93Å; F95-I316 PolarHBondContact O-N 3.35Å
96	A	94.3	Very high	91.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.9	175	0	0	0	0	0	110.3	K104 V108 V246 L248	A96-K104 HydrophobicContact CB-CB 3.98Å; A96-K104 HydrophobicContact CB-CG 4.32Å; A96-V108 HydrophobicContact CB-CG2 3.6Å; A96-V246 PolarHBondContact N-O 2.92Å; A96-L248 VanDerWaalsContact O-CB 3.3Å; A96-L248 WeakPolarHBondContact O-CB 3.21Å; A96-L248 WeakPolarHBondContact O-CG 3.38Å; A96-L248 PolarHBondContact O-N 2.97Å
97	Y	93.4	Very high	91	Very high	17 Å²	17	19.8 Å²	19.8	7%	0.067	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	143.8	-175.3	177.3	-94.8	0	0	0	111	L248 S251 L274 M315 I316 A317 N318 T332 Y335	Y97-L248 HydrophobicContact CD2-CD1 3.86Å; Y97-L248 HydrophobicContact CG-CD1 4.49Å; Y97-S251 WeakPolarHBondContact OH-CB 3.46Å; Y97-L274 HydrophobicContact CD2-CD2 4.43Å; Y97-L274 HydrophobicContact CE2-CD2 4.17Å; Y97-M315 HydrophobicContact CD1-CE 3.44Å; Y97-M315 VanDerWaalsContact CD1-CE 3.44Å; Y97-M315 HydrophobicContact CE1-CE 4.31Å; Y97-M315 HydrophobicContact CG-CE 3.78Å; Y97-I316 PolarHBondContact N-O 3.49Å; Y97-A317 CarbonylContact O-C 3.47Å; Y97-A317 WeakPolarHBondContact O-CA 3.24Å; Y97-N318 PolarHBondContact O-N 2.89Å; Y97-T332 HydrophobicContact CD1-CG2 3.93Å; Y97-T332 HydrophobicContact CE1-CG2 4Å; Y97-Y335 HydrophobicContact CD1-CD1 4.08Å; Y97-Y335 HydrophobicContact CD2-CE1 4.46Å; Y97-Y335 AromaticContact CE1-CD1 3.76Å; Y97-Y335 HydrophobicContact CE1-CD1 3.76Å; Y97-Y335 HydrophobicContact CE1-CE1 4.33Å; Y97-Y335 AromaticContact CE1-CG 3.87Å; Y97-Y335 HydrophobicContact CE1-CG 3.87Å; Y97-Y335 HydrophobicContact CE2-CD1 4.48Å; Y97-Y335 HydrophobicContact CE2-CE1 4.26Å; Y97-Y335 AromaticContact CZ-CD1 3.98Å; Y97-Y335 AromaticContact CZ-CG 3.96Å
98	G	90.8	Very high	91	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	147.7	-179.9	177	0	0	0	0	0	112.9	K104 S251	G98-K104 WeakPolarHBondContact O-CE 3.42Å; G98-K104 PolarHBondContact O-NZ 3.18Å; G98-S251 PolarHBondContact O-N 3.48Å; G98-S251 VanDerWaalsContact O-N 3.15Å
99	Q	87.6	Confident	91	Very high	15 Å²	15	17 Å²	17	7%	0.07	10%	0.102	C	C	.	.	S	Bend	trans	-61.3	151.7	179.8	-172.2	-170.7	20.9	0	0	111.8	G101 T102 K104 S251 E252 N325 E328	Q99-G101 PolarHBondContact O-N 3.39Å; Q99-T102 HydrophobicContact CB-CG2 3.7Å; Q99-T102 WeakPolarHBondContact O-CG2 3.28Å; Q99-T102 PolarHBondContact O-N 3.37Å; Q99-T102 PolarHBondContact O-OG1 3.05Å; Q99-K104 VanDerWaalsContact C-NZ 3.27Å; Q99-K104 PolarHBondContact O-NZ 3.37Å; Q99-S251 PolarHBondContact N-OG 2.97Å; Q99-E252 HydrophobicContact CG-CB 4.12Å; Q99-N325 PolarHBondContact NE2-OD1 2.95Å; Q99-N325 PolarHBondContact OE1-OD1 3.01Å; Q99-E328 HydrophobicContact CB-CB 4.33Å; Q99-E328 HydrophobicContact CG-CB 4.29Å; Q99-E328 HydrophobicContact CG-CG 4.42Å
100	T	84.3	Confident	90.9	Very high	39 Å²	39	17.6 Å²	17.6	24%	0.239	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	136.5	169.3	-67	0	0	0	0	111.4	T102 S215 G250 E252	T100-T102 VanDerWaalsContact C-N 3.35Å; T100-T102 PolarHBondContact O-N 3.18Å; T100-S215 VanDerWaalsContact CG2-CB 3.49Å; T100-S215 WeakPolarHBondContact OG1-CB 3.44Å; T100-G250 VanDerWaalsContact OG1-CA 3.25Å; T100-G250 WeakPolarHBondContact OG1-CA 3.4Å; T100-E252 WeakPolarHBondContact CB-OE1 3.18Å; T100-E252 WeakPolarHBondContact CB-OE2 3.42Å; T100-E252 PolarHBondContact N-OE2 2.99Å; T100-E252 PolarHBondContact OG1-OE1 3.48Å; T100-E252 PolarHBondContact OG1-OE2 3.27Å; T100-E252 VanDerWaalsContact OG1-OE2 3.04Å
101	G	83.3	Confident	90.5	Very high	48 Å²	48	20.8 Å²	20.8	50%	0.495	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	4.6	-179.2	0	0	0	0	0	115.8	R19 Q99 G103	R19-G101 WeakPolarHBondContact CD-O 3.44Å; R19-G101 PolarHBondContact NE-O 3Å; Q99-G101 PolarHBondContact O-N 3.39Å; G101-G103 VanDerWaalsContact C-N 3.32Å
102	T	88.9	Confident	89.5	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.012	13%	0.13	C	C	.	.	S	Bend	trans	-82.5	-6	175	60.8	0	0	0	0	114.4	Q99 T100 N318	Q99-T102 HydrophobicContact CB-CG2 3.7Å; Q99-T102 WeakPolarHBondContact O-CG2 3.28Å; Q99-T102 PolarHBondContact O-N 3.37Å; Q99-T102 PolarHBondContact O-OG1 3.05Å; T100-T102 VanDerWaalsContact C-N 3.35Å; T100-T102 PolarHBondContact O-N 3.18Å; T102-N318 VanDerWaalsContact CB-O 3.29Å; T102-N318 WeakPolarHBondContact CB-O 3.32Å; T102-N318 VanDerWaalsContact OG1-CB 3.25Å; T102-N318 WeakPolarHBondContact OG1-CB 3.33Å; T102-N318 PolarHBondContact OG1-O 3.41Å
103	G	88.6	Confident	88.6	Confident	18 Å²	18	28.8 Å²	28.8	19%	0.186	17%	0.167	C	C	.	.	S	Bend	trans	104.4	23.8	176.2	0	0	0	0	0	115.8	G101 F106 T107 N318	G101-G103 VanDerWaalsContact C-N 3.32Å; G103-F106 PolarHBondContact O-N 3.24Å; G103-T107 WeakPolarHBondContact O-CB 3.35Å; G103-T107 PolarHBondContact O-N 3.33Å; G103-T107 PolarHBondContact O-OG1 2.88Å; G103-N318 PolarHBondContact O-ND2 3.38Å
104	K	90.7	Very high	88	Confident	11 Å²	11	31.7 Å²	31.7	5%	0.048	18%	0.182	C	C	.	.	H	α-helix	trans	-55.1	-62.9	173.3	-62.6	-172.8	-64.9	-75.1	0	112.2	A96 G98 Q99 F106 T107 V108 D247 L248 N318	A96-K104 HydrophobicContact CB-CB 3.98Å; A96-K104 HydrophobicContact CB-CG 4.32Å; G98-K104 WeakPolarHBondContact O-CE 3.42Å; G98-K104 PolarHBondContact O-NZ 3.18Å; Q99-K104 VanDerWaalsContact C-NZ 3.27Å; Q99-K104 PolarHBondContact O-NZ 3.37Å; K104-F106 VanDerWaalsContact C-N 3.26Å; K104-F106 PolarHBondContact O-N 3.47Å; K104-T107 WeakPolarHBondContact O-CB 3.35Å; K104-T107 PolarHBondContact O-N 2.91Å; K104-V108 WeakPolarHBondContact O-CG2 3.33Å; K104-V108 PolarHBondContact O-N 3.49Å; K104-D247 WeakPolarHBondContact CB-OD1 3.2Å; K104-L248 WeakPolarHBondContact CE-O 3.37Å; K104-N318 WeakPolarHBondContact CA-OD1 3.34Å; K104-N318 HydrophobicContact CG-CB 4.1Å
105	T	89	Confident	87.3	Confident	42 Å²	42	35.7 Å²	35.7	26%	0.258	21%	0.209	S	C	.	.	H	α-helix	trans	-61.4	-34.9	178	-46.8	0	0	0	0	112	T107 V108 Q109 G110 D247	T105-T107 VanDerWaalsContact C-N 3.33Å; T105-T107 PolarHBondContact O-N 2.87Å; T105-V108 PolarHBondContact O-N 3.29Å; T105-Q109 HydrophobicContact CG2-CB 4.43Å; T105-Q109 WeakPolarHBondContact O-CB 3.47Å; T105-Q109 PolarHBondContact O-N 3.39Å; T105-G110 PolarHBondContact O-N 2.88Å; T105-D247 PolarHBondContact N-OD1 3.05Å; T105-D247 PolarHBondContact OG1-OD1 3.46Å; T105-D247 PolarHBondContact OG1-OD2 3.44Å
106	F	90.3	Very high	86.7	Confident	90 Å²	90	41.5 Å²	41.5	40%	0.395	24%	0.236	S	C	.	.	H	α-helix	trans	-63.7	-37.8	173.3	-177.4	-100.4	0	0	0	112.1	Q71 G103 K104 G110 L117	Q71-F106 PolarHBondContact NE2-O 3.18Å; G103-F106 PolarHBondContact O-N 3.24Å; K104-F106 VanDerWaalsContact C-N 3.26Å; K104-F106 PolarHBondContact O-N 3.47Å; F106-G110 WeakPolarHBondContact O-CA 3.37Å; F106-G110 PolarHBondContact O-N 3.08Å; F106-L117 HydrophobicContact CZ-CD2 4.3Å
107	T	92.4	Very high	86.4	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-72.7	-39.1	176.3	-51.5	0	0	0	0	111.5	R17 L74 G103 K104 T105 G119 V120 I316 N318	R17-T107 PolarHBondContact NH1-OG1 2.88Å; L74-T107 HydrophobicContact CD2-CG2 3.64Å; G103-T107 WeakPolarHBondContact O-CB 3.35Å; G103-T107 PolarHBondContact O-N 3.33Å; G103-T107 PolarHBondContact O-OG1 2.88Å; K104-T107 WeakPolarHBondContact O-CB 3.35Å; K104-T107 PolarHBondContact O-N 2.91Å; T105-T107 VanDerWaalsContact C-N 3.33Å; T105-T107 PolarHBondContact O-N 2.87Å; T107-G119 VanDerWaalsContact O-CA 3.3Å; T107-G119 WeakPolarHBondContact O-CA 3.32Å; T107-V120 PolarHBondContact O-N 3.28Å; T107-I316 HydrophobicContact CG2-CD1 3.9Å; T107-I316 HydrophobicContact CG2-CG2 4.14Å; T107-N318 PolarHBondContact OG1-ND2 2.93Å
108	V	91.8	Very high	86.2	Confident	6 Å²	6	46.7 Å²	46.7	4%	0.036	26%	0.26	C	S	.	.	H	α-helix	trans	-74.5	-57.1	-177.1	175.8	0	0	0	0	111.8	A96 K104 T105 G119 V120 M121 D247	A96-V108 HydrophobicContact CB-CG2 3.6Å; K104-V108 WeakPolarHBondContact O-CG2 3.33Å; K104-V108 PolarHBondContact O-N 3.49Å; T105-V108 PolarHBondContact O-N 3.29Å; V108-G119 CarbonylContact O-C 3.55Å; V108-V120 PolarHBondContact O-N 3.19Å; V108-M121 HydrophobicContact CG1-CB 4.44Å; V108-M121 HydrophobicContact CG1-CE 3.7Å; V108-M121 WeakPolarHBondContact O-CB 3.41Å; V108-M121 PolarHBondContact O-N 2.89Å; V108-D247 HydrophobicContact CB-CB 4.48Å; V108-D247 HydrophobicContact CG1-CB 4.39Å; V108-D247 HydrophobicContact CG2-CB 4.3Å
109	Q	88.1	Confident	86.3	Confident	20 Å²	20	46.8 Å²	46.8	9%	0.093	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-45.9	-175.5	-171.6	178.8	24.4	0	0	111.9	T105 G119 P122 M196 Y200	T105-Q109 HydrophobicContact CG2-CB 4.43Å; T105-Q109 WeakPolarHBondContact O-CB 3.47Å; T105-Q109 PolarHBondContact O-N 3.39Å; Q109-G119 PolarHBondContact O-N 2.8Å; Q109-P122 WeakPolarHBondContact O-CG 3.38Å; Q109-M196 HydrophobicContact CG-SD 4.48Å; Q109-Y200 VanDerWaalsContact NE2-CD2 3.34Å; Q109-Y200 VanDerWaalsContact OE1-CE2 3.25Å
110	G	87.5	Confident	86.5	Confident	13 Å²	13	46.2 Å²	46.2	13%	0.134	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	65.4	-162.7	-172	0	0	0	0	0	113.1	T105 F106 L117	T105-G110 PolarHBondContact O-N 2.88Å; F106-G110 WeakPolarHBondContact O-CA 3.37Å; F106-G110 PolarHBondContact O-N 3.08Å; G110-L117 VanDerWaalsContact CA-O 3.25Å; G110-L117 WeakPolarHBondContact CA-O 3.44Å
111	L	83.7	Confident	86.9	Confident	89 Å²	89	44.7 Å²	44.7	47%	0.466	25%	0.248	S	C	.	.			trans	-93.2	125.3	174.7	-150.9	73.9	0	0	0	108.9	D114 L117	L111-D114 HydrophobicContact CD2-CB 4.35Å; L111-L117 HydrophobicContact CB-CB 3.82Å; L111-L117 HydrophobicContact CB-CD1 4.41Å; L111-L117 HydrophobicContact CD2-CD1 4.13Å; L111-L117 PolarHBondContact N-O 2.82Å
112	Q	74	Confident	87.4	Confident	44 Å²	44	42.5 Å²	42.5	21%	0.206	23%	0.225	C	C	.	.	S	Bend	trans	-72.9	-37.3	-172.9	-64.1	-175.8	15	0	0	112.7	D114 R118 M196	Q112-D114 VanDerWaalsContact C-N 3.33Å; Q112-D114 PolarHBondContact O-N 3.37Å; Q112-R118 PolarHBondContact O-NE 3.33Å; Q112-M196 HydrophobicContact CG-CE 4.16Å
113	D	75.7	Confident	87.5	Confident	145 Å²	145	43.8 Å²	43.8	78%	0.775	23%	0.232	S	C	*	.	S	Bend	trans	-73.3	-26.6	-171.7	-57	-42.3	0	0	0	112.4	P115	D113-P115 WeakPolarHBondContact O-CD 3.28Å
114	D	82.6	Confident	87.8	Confident	61 Å²	61	43 Å²	43	33%	0.326	22%	0.223	S	C	.	.			trans	-104.4	111.6	179.1	-172.8	-15.6	0	0	0	110.8	L111 Q112 E116 L117 R118	L111-D114 HydrophobicContact CD2-CB 4.35Å; Q112-D114 VanDerWaalsContact C-N 3.33Å; Q112-D114 PolarHBondContact O-N 3.37Å; D114-E116 PolarHBondContact O-N 3.46Å; D114-E116 VanDerWaalsContact O-N 3.14Å; D114-E116 PolarHBondContact OD1-N 2.81Å; D114-L117 HydrophobicContact CB-CB 4.09Å; D114-L117 HydrophobicContact CB-CD1 4.12Å; D114-L117 HydrophobicContact CB-CG 4.17Å; D114-L117 PolarHBondContact O-N 2.84Å; D114-L117 WeakPolarHBondContact OD2-CD1 3.4Å; D114-R118 WeakPolarHBondContact O-CG 3.43Å; D114-R118 PolarHBondContact O-N 2.91Å
115	P	81.7	Confident	87.9	Confident	86 Å²	86	42.4 Å²	42.4	56%	0.558	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-30.2	177.3	-26	35.2	0	0	0	114.8	D113	D113-P115 WeakPolarHBondContact O-CD 3.28Å
116	E	82.8	Confident	88	Confident	125 Å²	125	42.4 Å²	42.4	58%	0.584	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-25.5	179.9	-64	-160.3	174.1	0	0	112.8	K70 D114	K70-E116 IonicContact NZ-OE2 2.7Å; D114-E116 PolarHBondContact O-N 3.46Å; D114-E116 VanDerWaalsContact O-N 3.14Å; D114-E116 PolarHBondContact OD1-N 2.81Å
117	L	86.8	Confident	88.1	Confident	63 Å²	63	38.9 Å²	38.9	33%	0.33	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	2.2	-176.7	-59.5	178.6	0	0	0	113.5	Q71 F106 G110 L111 D114 G119	Q71-L117 PolarHBondContact NE2-O 3.46Å; F106-L117 HydrophobicContact CZ-CD2 4.3Å; G110-L117 VanDerWaalsContact CA-O 3.25Å; G110-L117 WeakPolarHBondContact CA-O 3.44Å; L111-L117 HydrophobicContact CB-CB 3.82Å; L111-L117 HydrophobicContact CB-CD1 4.41Å; L111-L117 HydrophobicContact CD2-CD1 4.13Å; L111-L117 PolarHBondContact N-O 2.82Å; D114-L117 HydrophobicContact CB-CB 4.09Å; D114-L117 HydrophobicContact CB-CD1 4.12Å; D114-L117 HydrophobicContact CB-CG 4.17Å; D114-L117 PolarHBondContact O-N 2.84Å; D114-L117 WeakPolarHBondContact OD2-CD1 3.4Å; L117-G119 PolarHBondContact O-N 3.49Å
118	R	89.9	Confident	88.1	Confident	63 Å²	63	39 Å²	39	24%	0.238	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-59.1	131.3	173.3	-78.7	178.4	-174	176.3	3.1	111.5	Q71 Q112 D114 P122 N123	Q71-R118 WeakPolarHBondContact CB-O 3.31Å; Q112-R118 PolarHBondContact O-NE 3.33Å; D114-R118 WeakPolarHBondContact O-CG 3.43Å; D114-R118 PolarHBondContact O-N 2.91Å; R118-P122 HydrophobicContact CB-CB 4.41Å; R118-P122 HydrophobicContact CB-CG 3.82Å; R118-P122 HydrophobicContact CG-CB 4.39Å; R118-P122 HydrophobicContact CG-CG 4.12Å; R118-N123 PolarHBondContact O-ND2 3.09Å
119	G	91.6	Very high	88.1	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.01	21%	0.207	C	C	.	.			trans	-76.9	-174.5	178.9	0	0	0	0	0	113.4	T107 V108 Q109 L117 M121 P122 N123	T107-G119 VanDerWaalsContact O-CA 3.3Å; T107-G119 WeakPolarHBondContact O-CA 3.32Å; V108-G119 CarbonylContact O-C 3.55Å; Q109-G119 PolarHBondContact O-N 2.8Å; L117-G119 PolarHBondContact O-N 3.49Å; G119-M121 VanDerWaalsContact C-N 3.25Å; G119-M121 PolarHBondContact O-N 3.38Å; G119-P122 WeakPolarHBondContact O-CD 3.41Å; G119-P122 WeakPolarHBondContact O-CG 3.29Å; G119-N123 WeakPolarHBondContact O-CB 3.23Å; G119-N123 VanDerWaalsContact O-CG 3.23Å; G119-N123 PolarHBondContact O-N 3.3Å; G119-N123 PolarHBondContact O-ND2 2.77Å; G119-N123 VanDerWaalsContact O-ND2 3.07Å
120	V	93.5	Very high	88.1	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.024	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-33.7	180	70.7	0	0	0	0	113	Y75 F79 I94 T107 V108 S124 L245	Y75-V120 HydrophobicContact CD2-CG2 4.05Å; Y75-V120 HydrophobicContact CE2-CG2 4.15Å; F79-V120 HydrophobicContact CB-CG2 3.94Å; F79-V120 HydrophobicContact CD1-CG2 4.22Å; F79-V120 HydrophobicContact CD2-CB 3.81Å; F79-V120 HydrophobicContact CD2-CG2 3.28Å; F79-V120 HydrophobicContact CE2-CB 3.86Å; F79-V120 HydrophobicContact CE2-CG2 3.78Å; F79-V120 HydrophobicContact CG-CG2 3.56Å; F79-V120 HydrophobicContact CZ-CG2 4.48Å; I94-V120 HydrophobicContact CD1-CG2 3.6Å; T107-V120 PolarHBondContact O-N 3.28Å; V108-V120 PolarHBondContact O-N 3.19Å; V120-S124 VanDerWaalsContact O-CB 3.23Å; V120-S124 WeakPolarHBondContact O-CB 3.42Å; V120-S124 PolarHBondContact O-N 2.97Å; V120-S124 PolarHBondContact O-OG 3.06Å; V120-L245 HydrophobicContact CG1-CD2 4.38Å
121	M	92.8	Very high	88.1	Confident	6 Å²	6	43 Å²	43	3%	0.03	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-61.3	-177.3	-177.8	179.8	-62.5	0	0	112.3	V108 G119 N123 S124 F125 M196 F221 L245	V108-M121 HydrophobicContact CG1-CB 4.44Å; V108-M121 HydrophobicContact CG1-CE 3.7Å; V108-M121 WeakPolarHBondContact O-CB 3.41Å; V108-M121 PolarHBondContact O-N 2.89Å; G119-M121 VanDerWaalsContact C-N 3.25Å; G119-M121 PolarHBondContact O-N 3.38Å; M121-N123 VanDerWaalsContact C-N 3.29Å; M121-N123 PolarHBondContact O-N 3.04Å; M121-S124 PolarHBondContact O-N 3.43Å; M121-S124 PolarHBondContact O-OG 2.93Å; M121-F125 HydrophobicContact CG-CE1 3.98Å; M121-F125 HydrophobicContact CG-CE2 3.76Å; M121-F125 HydrophobicContact CG-CZ 3.28Å; M121-F125 WeakPolarHBondContact O-CD1 3.29Å; M121-F125 WeakPolarHBondContact O-CG 3.43Å; M121-F125 PolarHBondContact O-N 2.9Å; M121-F125 HydrophobicContact SD-CZ 4.13Å; M121-M196 HydrophobicContact CG-SD 4.04Å; M121-M196 HydrophobicContact SD-CG 3.71Å; M121-M196 HydrophobicContact SD-SD 3.58Å; M121-F221 HydrophobicContact CE-CB 3.5Å; M121-F221 VanDerWaalsContact CE-CB 3.5Å; M121-F221 HydrophobicContact CE-CD2 4.45Å; M121-F221 HydrophobicContact CE-CG 3.96Å; M121-F221 HydrophobicContact SD-CB 4.27Å; M121-F221 HydrophobicContact SD-CD1 4.48Å; M121-F221 HydrophobicContact SD-CD2 4.2Å; M121-F221 HydrophobicContact SD-CG 4.08Å; M121-L245 HydrophobicContact CB-CD1 3.83Å; M121-L245 HydrophobicContact CE-CB 4.06Å; M121-L245 HydrophobicContact CE-CD1 4.22Å; M121-L245 HydrophobicContact CG-CD1 3.69Å
122	P	92.6	Very high	88.3	Confident	2 Å²	2	39 Å²	39	1%	0.013	20%	0.202	C	C	.	.	H	α-helix	trans	-61.4	-35.1	176.3	23.7	-34.4	0	0	0	113.2	Q109 R118 G119 S124 F125 V126	Q109-P122 WeakPolarHBondContact O-CG 3.38Å; R118-P122 HydrophobicContact CB-CB 4.41Å; R118-P122 HydrophobicContact CB-CG 3.82Å; R118-P122 HydrophobicContact CG-CB 4.39Å; R118-P122 HydrophobicContact CG-CG 4.12Å; G119-P122 WeakPolarHBondContact O-CD 3.41Å; G119-P122 WeakPolarHBondContact O-CG 3.29Å; P122-S124 VanDerWaalsContact C-N 3.34Å; P122-F125 PolarHBondContact O-N 3.21Å; P122-V126 PolarHBondContact O-N 3.38Å
123	N	92.4	Very high	88.9	Confident	30 Å²	30	39.9 Å²	39.9	16%	0.16	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-35.8	177.1	-68.4	-21.9	0	0	0	112.1	Y75 R118 G119 M121 F125 V126 H127	Y75-N123 HydrophobicContact CD1-CB 4.39Å; Y75-N123 HydrophobicContact CD2-CB 3.5Å; Y75-N123 HydrophobicContact CE1-CB 4.41Å; Y75-N123 HydrophobicContact CE2-CB 3.55Å; Y75-N123 HydrophobicContact CG-CB 3.96Å; Y75-N123 PolarHBondContact OH-O 3.09Å; R118-N123 PolarHBondContact O-ND2 3.09Å; G119-N123 WeakPolarHBondContact O-CB 3.23Å; G119-N123 VanDerWaalsContact O-CG 3.23Å; G119-N123 PolarHBondContact O-N 3.3Å; G119-N123 PolarHBondContact O-ND2 2.77Å; G119-N123 VanDerWaalsContact O-ND2 3.07Å; M121-N123 VanDerWaalsContact C-N 3.29Å; M121-N123 PolarHBondContact O-N 3.04Å; N123-F125 VanDerWaalsContact C-N 3.32Å; N123-F125 PolarHBondContact O-N 3.37Å; N123-V126 PolarHBondContact O-N 3.1Å; N123-H127 WeakPolarHBondContact O-CB 3.25Å; N123-H127 PolarHBondContact O-N 3.3Å
124	S	93.3	Very high	89.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.2	-38	174.1	74.4	0	0	0	0	112.4	Y75 V120 M121 P122 H127 I128	Y75-S124 VanDerWaalsContact OH-CA 3.31Å; Y75-S124 WeakPolarHBondContact OH-CA 3.37Å; V120-S124 VanDerWaalsContact O-CB 3.23Å; V120-S124 WeakPolarHBondContact O-CB 3.42Å; V120-S124 PolarHBondContact O-N 2.97Å; V120-S124 PolarHBondContact O-OG 3.06Å; M121-S124 PolarHBondContact O-N 3.43Å; M121-S124 PolarHBondContact O-OG 2.93Å; P122-S124 VanDerWaalsContact C-N 3.34Å; S124-H127 PolarHBondContact O-N 3.35Å; S124-I128 WeakPolarHBondContact O-CB 3.34Å; S124-I128 WeakPolarHBondContact O-CD1 3.36Å; S124-I128 WeakPolarHBondContact O-CG1 3.29Å; S124-I128 PolarHBondContact O-N 2.84Å
125	F	93.1	Very high	89.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-48.3	178.1	-56.7	-20.3	0	0	0	111.2	M121 P122 N123 H127 I128 F129 I192 Q193 M196 F221 V223 L245	M121-F125 HydrophobicContact CG-CE1 3.98Å; M121-F125 HydrophobicContact CG-CE2 3.76Å; M121-F125 HydrophobicContact CG-CZ 3.28Å; M121-F125 WeakPolarHBondContact O-CD1 3.29Å; M121-F125 WeakPolarHBondContact O-CG 3.43Å; M121-F125 PolarHBondContact O-N 2.9Å; M121-F125 HydrophobicContact SD-CZ 4.13Å; P122-F125 PolarHBondContact O-N 3.21Å; N123-F125 VanDerWaalsContact C-N 3.32Å; N123-F125 PolarHBondContact O-N 3.37Å; F125-H127 VanDerWaalsContact C-N 3.29Å; F125-H127 PolarHBondContact O-N 3.15Å; F125-I128 PolarHBondContact O-N 3.11Å; F125-F129 VanDerWaalsContact O-CD2 3.27Å; F125-F129 WeakPolarHBondContact O-CD2 3.27Å; F125-F129 PolarHBondContact O-N 2.86Å; F125-I192 HydrophobicContact CB-CG2 3.77Å; F125-I192 HydrophobicContact CD1-CD1 3.52Å; F125-I192 HydrophobicContact CD1-CG1 4.05Å; F125-I192 HydrophobicContact CD1-CG2 4.35Å; F125-I192 HydrophobicContact CD2-CB 4.45Å; F125-I192 HydrophobicContact CD2-CD1 4.44Å; F125-I192 HydrophobicContact CD2-CG1 4.09Å; F125-I192 HydrophobicContact CD2-CG2 3.66Å; F125-I192 HydrophobicContact CE1-CD1 3.6Å; F125-I192 HydrophobicContact CE1-CG1 3.95Å; F125-I192 HydrophobicContact CE2-CD1 4.49Å; F125-I192 HydrophobicContact CE2-CG1 3.98Å; F125-I192 HydrophobicContact CE2-CG2 4.33Å; F125-I192 HydrophobicContact CG-CD1 3.99Å; F125-I192 HydrophobicContact CG-CG1 4.12Å; F125-I192 HydrophobicContact CG-CG2 3.67Å; F125-I192 HydrophobicContact CZ-CD1 4.09Å; F125-I192 HydrophobicContact CZ-CG1 3.91Å; F125-Q193 HydrophobicContact CD2-CG 4.28Å; F125-M196 HydrophobicContact CE2-CB 4.34Å; F125-M196 HydrophobicContact CE2-SD 4.16Å; F125-F221 HydrophobicContact CE1-CD1 4.14Å; F125-F221 AromaticContact CE1-CE1 3.54Å; F125-F221 HydrophobicContact CE1-CE1 3.54Å; F125-F221 HydrophobicContact CE1-CZ 4.26Å; F125-F221 AromaticContact CZ-CD1 3.98Å; F125-F221 HydrophobicContact CZ-CD1 3.98Å; F125-F221 AromaticContact CZ-CE1 3.34Å; F125-F221 HydrophobicContact CZ-CE1 3.34Å; F125-F221 AromaticContact CZ-CZ 3.67Å; F125-F221 HydrophobicContact CZ-CZ 3.67Å; F125-V223 HydrophobicContact CD1-CG2 4.45Å; F125-V223 HydrophobicContact CE1-CG2 3.83Å; F125-L245 HydrophobicContact CE1-CD1 4.49Å
126	V	91.2	Very high	88.8	Confident	41 Å²	41	35.8 Å²	35.8	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-56.3	-47.9	175.9	177.1	0	0	0	0	109.9	P122 N123 I128 F129 D130 I189	P122-V126 PolarHBondContact O-N 3.38Å; N123-V126 PolarHBondContact O-N 3.1Å; V126-I128 PolarHBondContact O-N 3.41Å; V126-F129 PolarHBondContact O-N 3.45Å; V126-D130 WeakPolarHBondContact O-CB 3.47Å; V126-D130 PolarHBondContact O-N 2.68Å; V126-I189 HydrophobicContact CG2-CD1 4.39Å; V126-I189 HydrophobicContact CG2-CG2 4.29Å
127	H	91.9	Very high	88.5	Confident	17 Å²	17	34 Å²	34	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-62.5	-42.4	-179.5	-170.8	-163.6	0	0	0	113.6	Y75 I83 N84 N123 S124 F125 H131	Y75-H127 HydrophobicContact CE1-CB 4.37Å; Y75-H127 WeakPolarHBondContact OH-CB 3.19Å; Y75-H127 PolarHBondContact OH-ND1 3.13Å; Y75-H127 VanDerWaalsContact OH-ND1 3.13Å; I83-H127 HydrophobicContact CG2-CB 4.37Å; I83-H127 WeakPolarHBondContact CG2-ND1 3.24Å; N84-H127 PolarHBondContact OD1-CE1 3.47Å; N84-H127 PolarHBondContact OD1-NE2 3.35Å; N123-H127 WeakPolarHBondContact O-CB 3.25Å; N123-H127 PolarHBondContact O-N 3.3Å; S124-H127 PolarHBondContact O-N 3.35Å; F125-H127 VanDerWaalsContact C-N 3.29Å; F125-H127 PolarHBondContact O-N 3.15Å; H127-H131 WeakPolarHBondContact O-CB 3.41Å; H127-H131 PolarHBondContact O-N 3.4Å
128	I	92.5	Very high	88.3	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-63.7	-51	178.5	-70.5	164.9	0	0	0	110.3	I83 L87 S124 F125 V126 H131 I132 V142 V223 V225 L243	I83-I128 HydrophobicContact CG2-CG1 3.93Å; L87-I128 HydrophobicContact CD2-CB 4.45Å; L87-I128 HydrophobicContact CD2-CG1 4.24Å; L87-I128 HydrophobicContact CD2-CG2 4.15Å; S124-I128 WeakPolarHBondContact O-CB 3.34Å; S124-I128 WeakPolarHBondContact O-CD1 3.36Å; S124-I128 WeakPolarHBondContact O-CG1 3.29Å; S124-I128 PolarHBondContact O-N 2.84Å; F125-I128 PolarHBondContact O-N 3.11Å; V126-I128 PolarHBondContact O-N 3.41Å; I128-H131 WeakPolarHBondContact O-CB 3.45Å; I128-H131 PolarHBondContact O-N 3.15Å; I128-I132 HydrophobicContact CG2-CD1 3.74Å; I128-I132 VanDerWaalsContact O-CG1 3.24Å; I128-I132 WeakPolarHBondContact O-CG1 3.32Å; I128-I132 PolarHBondContact O-N 2.94Å; I128-V142 HydrophobicContact CG2-CG2 4.23Å; I128-V223 HydrophobicContact CD1-CG1 4.13Å; I128-V225 HydrophobicContact CD1-CG2 4.42Å; I128-V225 HydrophobicContact CG2-CG2 4.1Å; I128-L243 HydrophobicContact CD1-CD2 4.29Å
129	F	91.4	Very high	88	Confident	15 Å²	15	30.1 Å²	30.1	7%	0.066	16%	0.155	C	C	.	.	H	α-helix	trans	-70.2	-33.4	-179	-77	-75	0	0	0	112.7	F125 V126 H131 I132 S133 V142 K187 I189 I192 L479	F125-F129 VanDerWaalsContact O-CD2 3.27Å; F125-F129 WeakPolarHBondContact O-CD2 3.27Å; F125-F129 PolarHBondContact O-N 2.86Å; V126-F129 PolarHBondContact O-N 3.45Å; F129-H131 VanDerWaalsContact C-N 3.31Å; F129-H131 PolarHBondContact O-N 3.24Å; F129-I132 PolarHBondContact O-N 3.05Å; F129-S133 WeakPolarHBondContact O-CB 2.85Å; F129-S133 PolarHBondContact O-N 3.23Å; F129-S133 PolarHBondContact O-OG 3.01Å; F129-S133 VanDerWaalsContact O-OG 3.06Å; F129-V142 HydrophobicContact CZ-CB 4.38Å; F129-V142 HydrophobicContact CZ-CG1 4.38Å; F129-K187 VanDerWaalsContact CE1-C 3.49Å; F129-K187 WeakPolarHBondContact CE1-O 3.34Å; F129-I189 HydrophobicContact CB-CD1 4.05Å; F129-I189 HydrophobicContact CB-CG1 3.55Å; F129-I189 HydrophobicContact CD2-CB 4.46Å; F129-I189 HydrophobicContact CD2-CG1 3.7Å; F129-I189 HydrophobicContact CG-CG1 3.79Å; F129-I192 HydrophobicContact CD2-CG2 4.41Å; F129-I192 HydrophobicContact CE2-CB 4.25Å; F129-I192 HydrophobicContact CE2-CD1 4.45Å; F129-I192 HydrophobicContact CE2-CG2 3.69Å; F129-L479 HydrophobicContact CD1-CD1 4.3Å; F129-L479 HydrophobicContact CE1-CD1 3.77Å
130	D	89.2	Confident	87.9	Confident	56 Å²	56	30.8 Å²	30.8	30%	0.299	16%	0.157	S	C	.	.	H	α-helix	trans	-63.4	-37.1	170.9	-77.7	-0.4	0	0	0	111.7	V126 S133 R134	V126-D130 WeakPolarHBondContact O-CB 3.47Å; V126-D130 PolarHBondContact O-N 2.68Å; D130-S133 WeakPolarHBondContact CA-OG 3.13Å; D130-S133 PolarHBondContact O-OG 2.89Å; D130-R134 WeakPolarHBondContact O-CD 3.38Å; D130-R134 WeakPolarHBondContact O-CG 3.43Å; D130-R134 PolarHBondContact O-N 3.36Å; D130-R134 PolarHBondContact O-NE 3.21Å; D130-R134 IonicContact OD2-NH2 3.49Å
131	H	88.1	Confident	87.8	Confident	54 Å²	54	30.6 Å²	30.6	25%	0.25	16%	0.156	C	C	.	.	H	α-helix	trans	-68.1	-46.5	174.8	-175	93.4	0	0	0	111.4	L87 H127 I128 F129 S133 R134 S135 Y140	L87-H131 HydrophobicContact CD1-CB 3.67Å; L87-H131 HydrophobicContact CD2-CB 4.42Å; H127-H131 WeakPolarHBondContact O-CB 3.41Å; H127-H131 PolarHBondContact O-N 3.4Å; I128-H131 WeakPolarHBondContact O-CB 3.45Å; I128-H131 PolarHBondContact O-N 3.15Å; F129-H131 VanDerWaalsContact C-N 3.31Å; F129-H131 PolarHBondContact O-N 3.24Å; H131-S133 VanDerWaalsContact C-N 3.35Å; H131-S133 PolarHBondContact O-N 3Å; H131-R134 PolarHBondContact O-N 3.05Å; H131-S135 PolarHBondContact O-N 3.04Å; H131-S135 PolarHBondContact O-OG 3.32Å; H131-Y140 PolarHBondContact NE2-OH 2.87Å
132	I	87.8	Confident	87.7	Confident	5 Å²	5	30.4 Å²	30.4	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-61.7	-41.5	-180	-66.9	168.1	0	0	0	111.7	I128 F129 R134 S135 Y140 V142 L479	I128-I132 HydrophobicContact CG2-CD1 3.74Å; I128-I132 VanDerWaalsContact O-CG1 3.24Å; I128-I132 WeakPolarHBondContact O-CG1 3.32Å; I128-I132 PolarHBondContact O-N 2.94Å; F129-I132 PolarHBondContact O-N 3.05Å; I132-R134 PolarHBondContact O-N 2.94Å; I132-S135 WeakPolarHBondContact CA-OG 3.18Å; I132-S135 PolarHBondContact O-N 3.04Å; I132-S135 PolarHBondContact O-OG 3.38Å; I132-Y140 HydrophobicContact CB-CD2 4.37Å; I132-Y140 HydrophobicContact CB-CG 4.42Å; I132-Y140 HydrophobicContact CD1-CD1 4.38Å; I132-Y140 HydrophobicContact CD1-CG 4.2Å; I132-Y140 HydrophobicContact CG1-CD1 3.91Å; I132-Y140 HydrophobicContact CG1-CD2 4.03Å; I132-Y140 HydrophobicContact CG1-CE1 4.45Å; I132-Y140 HydrophobicContact CG1-CG 3.66Å; I132-Y140 HydrophobicContact CG2-CD2 4.03Å; I132-Y140 HydrophobicContact CG2-CG 4.16Å; I132-V142 HydrophobicContact CD1-CG2 3.4Å; I132-V142 VanDerWaalsContact CD1-CG2 3.4Å; I132-L479 HydrophobicContact CD1-CD1 4.34Å; I132-L479 HydrophobicContact CG2-CB 3.58Å; I132-L479 HydrophobicContact CG2-CD1 4.2Å
133	S	85.8	Confident	87.8	Confident	61 Å²	61	33 Å²	33	43%	0.427	17%	0.165	S	C	.	.	H	α-helix	trans	-67.3	-23.1	176.2	60.2	0	0	0	0	113.1	F129 D130 H131	F129-S133 WeakPolarHBondContact O-CB 2.85Å; F129-S133 PolarHBondContact O-N 3.23Å; F129-S133 PolarHBondContact O-OG 3.01Å; F129-S133 VanDerWaalsContact O-OG 3.06Å; D130-S133 WeakPolarHBondContact CA-OG 3.13Å; D130-S133 PolarHBondContact O-OG 2.89Å; H131-S133 VanDerWaalsContact C-N 3.35Å; H131-S133 PolarHBondContact O-N 3Å
134	R	83.9	Confident	87.9	Confident	99 Å²	99	31.6 Å²	31.6	37%	0.374	16%	0.157	S	C	.	.	H	α-helix	trans	-85.1	-32.2	177.3	-70.6	173.9	-154.3	161.3	8.5	113.5	D130 H131 I132 R490	D130-R134 WeakPolarHBondContact O-CD 3.38Å; D130-R134 WeakPolarHBondContact O-CG 3.43Å; D130-R134 PolarHBondContact O-N 3.36Å; D130-R134 PolarHBondContact O-NE 3.21Å; D130-R134 IonicContact OD2-NH2 3.49Å; H131-R134 PolarHBondContact O-N 3.05Å; I132-R134 PolarHBondContact O-N 2.94Å; R134-R490 VanDerWaalsContact CA-NH2 3.29Å; R134-R490 PolarHBondContact O-NH2 3.1Å
135	S	80.7	Confident	87.9	Confident	10 Å²	10	32 Å²	32	7%	0.07	16%	0.161	C	C	.	.			trans	-73.5	125.5	-179.6	51.6	0	0	0	0	112	H131 I132 Y140	H131-S135 PolarHBondContact O-N 3.04Å; H131-S135 PolarHBondContact O-OG 3.32Å; I132-S135 WeakPolarHBondContact CA-OG 3.18Å; I132-S135 PolarHBondContact O-N 3.04Å; I132-S135 PolarHBondContact O-OG 3.38Å; S135-Y140 WeakPolarHBondContact OG-CE2 3.31Å
136	M	73.1	Confident	88	Confident	97 Å²	97	32.6 Å²	32.6	48%	0.478	16%	0.163	S	C	.	.	S	Bend	trans	-104.2	-21.8	175.6	-62.2	-174.6	-179.5	0	0	112.3	Q483	M136-Q483 HydrophobicContact CE-CG 3.88Å; M136-Q483 PolarHBondContact SD-NE2 2.92Å
137	D	77.8	Confident	88.1	Confident	88 Å²	88	30.6 Å²	30.6	47%	0.471	15%	0.151	S	C	.	.	S	Bend	trans	-91.5	-8.2	-170.6	61.2	-38.9	0	0	0	114.1	K229	D137-K229 WeakPolarHBondContact OD2-CE 3.41Å; D137-K229 IonicContact OD2-NZ 3.05Å; D137-K229 PolarHBondContact OD2-NZ 3.31Å
138	A	81.5	Confident	88.1	Confident	4 Å²	4	30.1 Å²	30.1	3%	0.033	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	149.9	-179	0	0	0	0	0	112	Y140 C228 K229	A138-Y140 HydrophobicContact CB-CD2 4.35Å; A138-Y140 HydrophobicContact CB-CE2 3.58Å; A138-C228 VanDerWaalsContact CA-O 3.29Å; A138-C228 WeakPolarHBondContact CA-O 3.42Å; A138-K229 HydrophobicContact CB-CB 4.16Å
139	Q	84.5	Confident	87.9	Confident	40 Å²	40	30.1 Å²	30.1	19%	0.187	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	138	169.2	-67.9	177.5	-9.4	0	0	109.1	S227 C228	Q139-S227 CarbonylContact O-C 3.53Å; Q139-S227 WeakPolarHBondContact O-CA 3.27Å; Q139-C228 PolarHBondContact N-O 3.27Å; Q139-C228 PolarHBondContact O-N 3.43Å
140	Y	89.2	Confident	87.6	Confident	15 Å²	15	30.4 Å²	30.4	6%	0.059	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.5	-179.4	-67.3	-97.1	0	0	0	112.3	H131 I132 S135 A138 V225 E226 L479	H131-Y140 PolarHBondContact NE2-OH 2.87Å; I132-Y140 HydrophobicContact CB-CD2 4.37Å; I132-Y140 HydrophobicContact CB-CG 4.42Å; I132-Y140 HydrophobicContact CD1-CD1 4.38Å; I132-Y140 HydrophobicContact CD1-CG 4.2Å; I132-Y140 HydrophobicContact CG1-CD1 3.91Å; I132-Y140 HydrophobicContact CG1-CD2 4.03Å; I132-Y140 HydrophobicContact CG1-CE1 4.45Å; I132-Y140 HydrophobicContact CG1-CG 3.66Å; I132-Y140 HydrophobicContact CG2-CD2 4.03Å; I132-Y140 HydrophobicContact CG2-CG 4.16Å; S135-Y140 WeakPolarHBondContact OG-CE2 3.31Å; A138-Y140 HydrophobicContact CB-CD2 4.35Å; A138-Y140 HydrophobicContact CB-CE2 3.58Å; Y140-V225 HydrophobicContact CD1-CG1 3.87Å; Y140-V225 HydrophobicContact CE1-CG1 4.45Å; Y140-E226 CarbonylContact C-O 3.54Å; Y140-E226 VanDerWaalsContact CA-O 3.29Å; Y140-E226 WeakPolarHBondContact CA-O 3.44Å; Y140-L479 PolarHBondContact N-O 3.45Å; Y140-L479 VanDerWaalsContact N-O 3.1Å; Y140-L479 PolarHBondContact O-N 3.4Å
141	L	90.1	Very high	87.2	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	118.5	170.5	-171.7	74.4	0	0	0	108.5	L185 E226 L356 L357 Y360 K477	L141-L185 HydrophobicContact CD1-CD2 3.48Å; L141-L185 VanDerWaalsContact CD1-CD2 3.48Å; L141-L185 HydrophobicContact CD2-CD2 4.18Å; L141-L185 HydrophobicContact CG-CD2 3.77Å; L141-E226 HydrophobicContact CB-CB 4.22Å; L141-E226 PolarHBondContact N-O 2.81Å; L141-E226 PolarHBondContact O-N 3.4Å; L141-L356 HydrophobicContact CD2-CB 4.23Å; L141-L356 HydrophobicContact CD2-CD2 4.09Å; L141-L356 HydrophobicContact CD2-CG 4.31Å; L141-L357 HydrophobicContact CB-CD1 4.15Å; L141-Y360 HydrophobicContact CD1-CD2 4.45Å; L141-Y360 HydrophobicContact CD1-CE2 4.41Å; L141-Y360 HydrophobicContact CD2-CD2 3.83Å; L141-Y360 HydrophobicContact CD2-CE2 3.93Å; L141-K477 HydrophobicContact CD1-CB 4.5Å; L141-K477 WeakPolarHBondContact CD1-O 3.26Å
142	V	92.7	Very high	87.1	Confident	2 Å²	2	31 Å²	31	1%	0.012	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127.7	-179.9	-174.2	0	0	0	0	109.9	I128 F129 I132 T186 V223 T224 V225 L479	I128-V142 HydrophobicContact CG2-CG2 4.23Å; F129-V142 HydrophobicContact CZ-CB 4.38Å; F129-V142 HydrophobicContact CZ-CG1 4.38Å; I132-V142 HydrophobicContact CD1-CG2 3.4Å; I132-V142 VanDerWaalsContact CD1-CG2 3.4Å; V142-T186 WeakPolarHBondContact CG1-OG1 3.38Å; V142-T186 PolarHBondContact O-N 3.45Å; V142-T186 PolarHBondContact O-OG1 3.24Å; V142-V223 HydrophobicContact CG1-CG1 3.74Å; V142-T224 WeakPolarHBondContact CA-O 3.21Å; V142-V225 HydrophobicContact CG2-CG2 4.45Å; V142-L479 HydrophobicContact CG2-CD1 4.33Å
143	R	93.2	Very high	87.2	Confident	56 Å²	56	34.4 Å²	34.4	21%	0.211	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.6	177.5	-63.6	-173.8	-66.4	139.3	-9.8	110	S183 V184 L185 V223 T224 E226	R143-S183 WeakPolarHBondContact CD-OG 3.35Å; R143-V184 CarbonylContact C-O 3.57Å; R143-V184 WeakPolarHBondContact CA-O 3.25Å; R143-L185 HydrophobicContact CG-CD2 3.62Å; R143-L185 HydrophobicContact CG-CG 4.42Å; R143-V223 CarbonylContact O-C 3.59Å; R143-V223 WeakPolarHBondContact O-CA 3.18Å; R143-T224 PolarHBondContact N-O 3.27Å; R143-T224 PolarHBondContact O-N 3.22Å; R143-E226 IonicContact CZ-OE1 3.81Å; R143-E226 IonicContact NE-OE1 2.75Å; R143-E226 PolarHBondContact NE-OE1 3.07Å; R143-E226 IonicContact NH2-OE1 3.67Å; R143-E226 PolarHBondContact NH2-OE1 3.46Å
144	A	94.8	Very high	87.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.8	175.4	0	0	0	0	0	110.4	V184 T186 I192 V195 F221 I222	A144-V184 PolarHBondContact N-O 2.92Å; A144-V184 PolarHBondContact O-N 3.42Å; A144-T186 HydrophobicContact CB-CG2 4.1Å; A144-I192 HydrophobicContact CB-CD1 4.18Å; A144-I192 HydrophobicContact CB-CG1 4.15Å; A144-V195 HydrophobicContact CB-CG1 4.1Å; A144-F221 HydrophobicContact CB-CE1 4.15Å; A144-F221 HydrophobicContact CB-CZ 3.85Å; A144-I222 CarbonylContact C-O 3.22Å; A144-I222 WeakPolarHBondContact CA-O 3.29Å
145	S	94.2	Very high	87.7	Confident	10 Å²	10	29.2 Å²	29.2	7%	0.07	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146.6	170.6	-50.2	0	0	0	0	108.7	S182 I222	S145-S182 WeakPolarHBondContact CB-O 3.4Å; S145-S182 PolarHBondContact OG-O 2.97Å; S145-I222 PolarHBondContact N-O 3.01Å; S145-I222 PolarHBondContact O-N 2.85Å
146	Y	94.7	Very high	88.3	Confident	11 Å²	11	28.9 Å²	28.9	4%	0.043	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	121.9	179.4	-163.8	-172.7	0	0	0	110.5	L157 A219 I220 F221	Y146-L157 HydrophobicContact CD1-CB 4.15Å; Y146-L157 HydrophobicContact CD1-CD1 3.99Å; Y146-L157 HydrophobicContact CD2-CD1 3.8Å; Y146-L157 HydrophobicContact CE1-CD1 3.86Å; Y146-L157 HydrophobicContact CE2-CD1 3.71Å; Y146-L157 HydrophobicContact CG-CB 4.11Å; Y146-L157 HydrophobicContact CG-CD1 3.93Å; Y146-L157 PolarHBondContact O-N 3.35Å; Y146-A219 HydrophobicContact CE2-CB 3.93Å; Y146-I220 WeakPolarHBondContact CD2-O 3.14Å; Y146-F221 AromaticContact CD1-CD2 3.73Å; Y146-F221 HydrophobicContact CD1-CD2 3.73Å; Y146-F221 HydrophobicContact CD1-CE2 4.15Å; Y146-F221 HydrophobicContact CD2-CB 3.96Å; Y146-F221 AromaticContact CD2-CD2 3.78Å; Y146-F221 HydrophobicContact CD2-CD2 3.78Å; Y146-F221 HydrophobicContact CD2-CG 4.35Å; Y146-F221 HydrophobicContact CE1-CD2 4.24Å; Y146-F221 HydrophobicContact CE2-CB 4.12Å; Y146-F221 HydrophobicContact CE2-CD2 4.24Å; Y146-F221 AromaticContact CG-CD2 3.52Å; Y146-F221 HydrophobicContact CG-CD2 3.52Å; Y146-F221 HydrophobicContact CG-CE2 4.18Å; Y146-F221 HydrophobicContact CG-CG 4.47Å
147	L	93.2	Very high	89.1	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	158.1	-179.5	65.5	86.4	0	0	0	111.3	I149 I154 R155 V178 L181 I220 I222 L302	L147-I149 HydrophobicContact CD1-CG1 4.12Å; L147-I154 HydrophobicContact CB-CG2 4.24Å; L147-I154 HydrophobicContact CD1-CG2 4.29Å; L147-I154 HydrophobicContact CD2-CG2 4.48Å; L147-R155 CarbonylContact C-O 3.59Å; L147-R155 VanDerWaalsContact CA-O 3.24Å; L147-R155 WeakPolarHBondContact CA-O 3.37Å; L147-R155 WeakPolarHBondContact CB-O 3.11Å; L147-V178 HydrophobicContact CD2-CG2 4.1Å; L147-L181 HydrophobicContact CB-CD1 3.98Å; L147-L181 HydrophobicContact CD2-CD1 4.13Å; L147-L181 HydrophobicContact CD2-CD2 3.89Å; L147-I220 HydrophobicContact CD1-CB 3.75Å; L147-I220 HydrophobicContact CD1-CD1 4.09Å; L147-I220 HydrophobicContact CD1-CG1 4.02Å; L147-I220 HydrophobicContact CG-CB 4.07Å; L147-I220 PolarHBondContact N-O 2.88Å; L147-I220 PolarHBondContact O-N 2.81Å; L147-I222 HydrophobicContact CD2-CD1 4.17Å; L147-L302 HydrophobicContact CD1-CD1 4.28Å
148	E	90.9	Very high	89.7	Confident	6 Å²	6	21.4 Å²	21.4	3%	0.028	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	150	166.4	64.9	171.7	-166	0	0	111.3	I154 R155 L157 S217 H218	E148-I154 WeakPolarHBondContact O-CA 3.25Å; E148-R155 HydrophobicContact CG-CB 3.82Å; E148-R155 PolarHBondContact N-O 2.91Å; E148-R155 PolarHBondContact O-N 3.32Å; E148-R155 WeakPolarHBondContact OE1-CD 3.26Å; E148-R155 IonicContact OE1-NH1 3.26Å; E148-L157 HydrophobicContact CB-CD1 4.09Å; E148-L157 HydrophobicContact CB-CD2 4.28Å; E148-L157 HydrophobicContact CB-CG 4.19Å; E148-L157 HydrophobicContact CG-CD1 4.5Å; E148-L157 HydrophobicContact CG-CD2 3.8Å; E148-L157 HydrophobicContact CG-CG 4.1Å; E148-S217 PolarHBondContact OE2-OG 3.32Å; E148-H218 CarbonylContact C-O 3.57Å; E148-H218 VanDerWaalsContact CA-O 3.25Å; E148-H218 WeakPolarHBondContact CA-O 3.49Å
149	I	89.8	Confident	89.9	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.01	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115	169	-49.4	177.4	0	0	0	106.9	L147 E153 I154 S217 H218 I220 K298 L299 L302	L147-I149 HydrophobicContact CD1-CG1 4.12Å; I149-E153 WeakPolarHBondContact CA-O 3.4Å; I149-I154 HydrophobicContact CG1-CG1 4.43Å; I149-S217 WeakPolarHBondContact O-CA 3.47Å; I149-S217 WeakPolarHBondContact O-CB 3.24Å; I149-H218 HydrophobicContact CB-CB 4.23Å; I149-H218 PolarHBondContact N-O 2.87Å; I149-H218 PolarHBondContact O-N 3.2Å; I149-I220 HydrophobicContact CD1-CD1 4.07Å; I149-K298 HydrophobicContact CG2-CB 4.31Å; I149-L299 HydrophobicContact CD1-CB 4Å; I149-L299 HydrophobicContact CD1-CD1 3.96Å; I149-L302 HydrophobicContact CD1-CD1 3.89Å; I149-L302 HydrophobicContact CG1-CD1 4.5Å
150	Y	84.8	Confident	89.7	Confident	22 Å²	22	35.7 Å²	35.7	9%	0.086	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.8	179.3	-179	-115.5	0	0	0	109.2	E152 E153 H213 R216 E266	Y150-E152 PolarHBondContact O-N 2.85Å; Y150-E153 PolarHBondContact N-O 2.79Å; Y150-E153 WeakPolarHBondContact O-CB 3.25Å; Y150-E153 PolarHBondContact O-N 3.47Å; Y150-H213 AromaticContact CD2-CE1 3.19Å; Y150-H213 WeakPolarHBondContact CD2-CE1 3.31Å; Y150-H213 AromaticContact CD2-ND1 3.98Å; Y150-H213 AromaticContact CD2-NE2 3.95Å; Y150-H213 AromaticContact CE1-NE2 3.96Å; Y150-H213 AromaticContact CE2-CE1 3.32Å; Y150-H213 WeakPolarHBondContact CE2-CE1 3.38Å; Y150-H213 AromaticContact CE2-ND1 3.88Å; Y150-H213 AromaticContact CE2-NE2 3.86Å; Y150-H213 AromaticContact CG-CE1 3.55Å; Y150-H213 AromaticContact CZ-CE1 3.79Å; Y150-H213 AromaticContact CZ-NE2 3.85Å; Y150-R216 HydrophobicContact CE2-CB 4.49Å; Y150-E266 HydrophobicContact CE2-CG 3.96Å; Y150-E266 WeakPolarHBondContact CE2-OE1 3.38Å; Y150-E266 VanDerWaalsContact CZ-OE1 3.27Å; Y150-E266 PolarHBondContact OH-OE1 3.49Å
151	K	80.6	Confident	89.2	Confident	85 Å²	85	38 Å²	38	37%	0.37	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	38.5	-177	-62.4	178.1	174	173.7	0	113.8	E153	K151-E153 PolarHBondContact O-N 3.39Å
152	E	86.4	Confident	88.7	Confident	36 Å²	36	40.2 Å²	40.2	17%	0.168	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	18.5	-174.7	-70.8	-64	108.5	0	0	115	Y150 S273 S297 K298	Y150-E152 PolarHBondContact O-N 2.85Å; E152-S273 WeakPolarHBondContact OE1-CB 3.44Å; E152-S297 VanDerWaalsContact OE2-CA 3.27Å; E152-S297 WeakPolarHBondContact OE2-CA 3.47Å; E152-K298 VanDerWaalsContact O-CG 3.31Å; E152-K298 WeakPolarHBondContact O-CG 3.49Å; E152-K298 PolarHBondContact OE2-N 3.33Å
153	E	88.6	Confident	87.9	Confident	77 Å²	77	44 Å²	44	36%	0.36	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	142.4	171.8	-60.7	174.6	156.6	0	0	110.1	I149 Y150 K151 H165	I149-E153 WeakPolarHBondContact CA-O 3.4Å; Y150-E153 PolarHBondContact N-O 2.79Å; Y150-E153 WeakPolarHBondContact O-CB 3.25Å; Y150-E153 PolarHBondContact O-N 3.47Å; K151-E153 PolarHBondContact O-N 3.39Å; E153-H165 VanDerWaalsContact CD-CE1 3.47Å; E153-H165 IonicContact OE1-CE1 2.9Å; E153-H165 IonicContact OE2-CE1 2.8Å; E153-H165 PolarHBondContact OE2-CE1 2.78Å; E153-H165 IonicContact OE2-ND1 3.35Å; E153-H165 PolarHBondContact OE2-ND1 2.81Å; E153-H165 IonicContact OE2-NE2 3.3Å
154	I	91.3	Very high	87.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.9	178.1	-59.4	171	0	0	0	108.7	L147 E148 I149 H165 L166 I168 V178 L302	L147-I154 HydrophobicContact CB-CG2 4.24Å; L147-I154 HydrophobicContact CD1-CG2 4.29Å; L147-I154 HydrophobicContact CD2-CG2 4.48Å; E148-I154 WeakPolarHBondContact O-CA 3.25Å; I149-I154 HydrophobicContact CG1-CG1 4.43Å; I154-H165 WeakPolarHBondContact O-CA 3.13Å; I154-L166 HydrophobicContact CB-CB 4.18Å; I154-L166 HydrophobicContact CG2-CB 4.07Å; I154-L166 HydrophobicContact CG2-CD1 4.41Å; I154-L166 PolarHBondContact O-N 2.85Å; I154-I168 HydrophobicContact CD1-CD1 3.78Å; I154-I168 HydrophobicContact CD1-CG1 3.36Å; I154-V178 HydrophobicContact CD1-CG2 4.14Å; I154-V178 HydrophobicContact CG2-CG1 4.12Å; I154-L302 HydrophobicContact CD1-CD1 4.06Å
155	R	89.5	Confident	86.9	Confident	51 Å²	51	51.5 Å²	51.5	19%	0.192	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144.7	174.2	-60.4	176.8	-174.4	171	-3.7	110.5	L147 E148	L147-R155 CarbonylContact C-O 3.59Å; L147-R155 VanDerWaalsContact CA-O 3.24Å; L147-R155 WeakPolarHBondContact CA-O 3.37Å; L147-R155 WeakPolarHBondContact CB-O 3.11Å; E148-R155 HydrophobicContact CG-CB 3.82Å; E148-R155 PolarHBondContact N-O 2.91Å; E148-R155 PolarHBondContact O-N 3.32Å; E148-R155 WeakPolarHBondContact OE1-CD 3.26Å; E148-R155 IonicContact OE1-NH1 3.26Å
156	D	92.7	Very high	86.7	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	108.1	177.5	-171.3	-20.3	0	0	0	110.1	L158 R159 Q162 L166 L181 S182	D156-L158 PolarHBondContact O-N 3.22Å; D156-L158 VanDerWaalsContact O-N 3.14Å; D156-L158 WeakPolarHBondContact OD1-CB 3.44Å; D156-L158 PolarHBondContact OD1-N 3.06Å; D156-R159 HydrophobicContact CB-CB 4.39Å; D156-R159 HydrophobicContact CB-CG 4.14Å; D156-R159 PolarHBondContact O-N 2.8Å; D156-R159 WeakPolarHBondContact OD2-CG 3.47Å; D156-R159 IonicContact OD2-NE 3.61Å; D156-R159 PolarHBondContact OD2-NE 2.85Å; D156-Q162 PolarHBondContact O-NE2 2.85Å; D156-Q162 PolarHBondContact O-OE1 2.99Å; D156-L166 HydrophobicContact CB-CD1 3.87Å; D156-L181 HydrophobicContact CB-CD1 4.46Å; D156-S182 WeakPolarHBondContact OD2-CB 3.3Å; D156-S182 PolarHBondContact OD2-N 3.3Å; D156-S182 PolarHBondContact OD2-OG 3.34Å
157	L	90.2	Very high	86.5	Confident	0 Å²	0	57 Å²	57	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-6.9	-178.2	-67.4	178.1	0	0	0	112.8	Y146 E148 G199 N202 R203	Y146-L157 HydrophobicContact CD1-CB 4.15Å; Y146-L157 HydrophobicContact CD1-CD1 3.99Å; Y146-L157 HydrophobicContact CD2-CD1 3.8Å; Y146-L157 HydrophobicContact CE1-CD1 3.86Å; Y146-L157 HydrophobicContact CE2-CD1 3.71Å; Y146-L157 HydrophobicContact CG-CB 4.11Å; Y146-L157 HydrophobicContact CG-CD1 3.93Å; Y146-L157 PolarHBondContact O-N 3.35Å; E148-L157 HydrophobicContact CB-CD1 4.09Å; E148-L157 HydrophobicContact CB-CD2 4.28Å; E148-L157 HydrophobicContact CB-CG 4.19Å; E148-L157 HydrophobicContact CG-CD1 4.5Å; E148-L157 HydrophobicContact CG-CD2 3.8Å; E148-L157 HydrophobicContact CG-CG 4.1Å; L157-G199 WeakPolarHBondContact O-CA 3.49Å; L157-N202 HydrophobicContact CD2-CB 4.39Å; L157-N202 PolarHBondContact O-ND2 3.35Å; L157-R203 HydrophobicContact CD1-CB 4.31Å; L157-R203 HydrophobicContact CD2-CB 4.06Å
158	L	90.4	Very high	86.4	Confident	29 Å²	29	57.6 Å²	57.6	15%	0.152	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-13.5	179.6	-54.8	-175.4	0	0	0	113.5	D156 V184 V195	D156-L158 PolarHBondContact O-N 3.22Å; D156-L158 VanDerWaalsContact O-N 3.14Å; D156-L158 WeakPolarHBondContact OD1-CB 3.44Å; D156-L158 PolarHBondContact OD1-N 3.06Å; L158-V184 HydrophobicContact CD1-CG2 3.9Å; L158-V195 HydrophobicContact CD1-CG1 3.79Å; L158-V195 HydrophobicContact CD2-CG1 3.55Å; L158-V195 HydrophobicContact CG-CG1 4.35Å
159	R	85.8	Confident	86.4	Confident	92 Å²	92	63 Å²	63	35%	0.347	28%	0.281	S	S	.	.	S	Bend	trans	-82	152.2	175.8	-72.8	-179.3	-177.9	-109.9	4.4	111.3	D156 D161 Q162 D180 S182	D156-R159 HydrophobicContact CB-CB 4.39Å; D156-R159 HydrophobicContact CB-CG 4.14Å; D156-R159 PolarHBondContact O-N 2.8Å; D156-R159 WeakPolarHBondContact OD2-CG 3.47Å; D156-R159 IonicContact OD2-NE 3.61Å; D156-R159 PolarHBondContact OD2-NE 2.85Å; R159-D161 VanDerWaalsContact C-N 3.31Å; R159-Q162 PolarHBondContact O-NE2 2.99Å; R159-D180 PolarHBondContact NH2-O 3.07Å; R159-S182 VanDerWaalsContact CG-OG 3.27Å; R159-S182 WeakPolarHBondContact CG-OG 3.32Å; R159-S182 PolarHBondContact NE-OG 3.19Å; R159-S182 VanDerWaalsContact NE-OG 3.12Å
160	R	79.8	Confident	86.3	Confident	251 Å²	251	67.8 Å²	67.8	95%	0.947	30%	0.304	S	S	*	.	S	Bend	trans	-70.3	-34.4	169.6	-64.4	-174.7	-179	-170.2	-0.2	111.8	Q162	R160-Q162 PolarHBondContact O-N 3.25Å
161	D	79.8	Confident	86.2	Confident	64 Å²	64	71.4 Å²	71.4	34%	0.342	32%	0.32	S	S	.	.			trans	-88.6	98.6	179.6	-175.7	8.4	0	0	0	109.9	R159 S163 K164	R159-D161 VanDerWaalsContact C-N 3.31Å; D161-S163 VanDerWaalsContact C-N 3.3Å; D161-S163 WeakPolarHBondContact OD1-CB 3.16Å; D161-S163 PolarHBondContact OD1-N 2.83Å; D161-S163 PolarHBondContact OD1-OG 2.93Å; D161-K164 VanDerWaalsContact OD2-CD 3.29Å; D161-K164 WeakPolarHBondContact OD2-CD 3.35Å; D161-K164 WeakPolarHBondContact OD2-CE 3.3Å; D161-K164 WeakPolarHBondContact OD2-CG 3.42Å; D161-K164 IonicContact OD2-NZ 3.89Å; D161-K164 PolarHBondContact OD2-NZ 2.78Å
162	Q	78.7	Confident	86.1	Confident	47 Å²	47	73.6 Å²	73.6	22%	0.22	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	0.4	178.7	-65.2	-63	-37.6	0	0	113	D156 R159 R160	D156-Q162 PolarHBondContact O-NE2 2.85Å; D156-Q162 PolarHBondContact O-OE1 2.99Å; R159-Q162 PolarHBondContact O-NE2 2.99Å; R160-Q162 PolarHBondContact O-N 3.25Å
163	S	76.1	Confident	85.5	Confident	83 Å²	83	78.5 Å²	78.5	58%	0.58	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-17.6	179.8	72.6	0	0	0	0	113.3	D161 H165	D161-S163 VanDerWaalsContact C-N 3.3Å; D161-S163 WeakPolarHBondContact OD1-CB 3.16Å; D161-S163 PolarHBondContact OD1-N 2.83Å; D161-S163 PolarHBondContact OD1-OG 2.93Å; S163-H165 PolarHBondContact O-NE2 2.97Å
164	K	82	Confident	84.6	Confident	120 Å²	120	78 Å²	78	52%	0.522	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-84.5	124.1	-177.4	-73.5	178.3	179.3	166.1	0	111.3	D161	D161-K164 VanDerWaalsContact OD2-CD 3.29Å; D161-K164 WeakPolarHBondContact OD2-CD 3.35Å; D161-K164 WeakPolarHBondContact OD2-CE 3.3Å; D161-K164 WeakPolarHBondContact OD2-CG 3.42Å; D161-K164 IonicContact OD2-NZ 3.89Å; D161-K164 PolarHBondContact OD2-NZ 2.78Å
165	H	85.1	Confident	84.1	Confident	92 Å²	92	78.9 Å²	78.9	43%	0.426	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	138.9	172.7	-52.6	-72	0	0	0	110.4	E153 I154 S163	E153-H165 VanDerWaalsContact CD-CE1 3.47Å; E153-H165 IonicContact OE1-CE1 2.9Å; E153-H165 IonicContact OE2-CE1 2.8Å; E153-H165 PolarHBondContact OE2-CE1 2.78Å; E153-H165 IonicContact OE2-ND1 3.35Å; E153-H165 PolarHBondContact OE2-ND1 2.81Å; E153-H165 IonicContact OE2-NE2 3.3Å; I154-H165 WeakPolarHBondContact O-CA 3.13Å; S163-H165 PolarHBondContact O-NE2 2.97Å
166	L	90.6	Very high	84	Confident	18 Å²	18	77.1 Å²	77.1	9%	0.094	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	149.9	179.1	-58.5	-179.2	0	0	0	111.5	I154 D156 V178 D180 L181	I154-L166 HydrophobicContact CB-CB 4.18Å; I154-L166 HydrophobicContact CG2-CB 4.07Å; I154-L166 HydrophobicContact CG2-CD1 4.41Å; I154-L166 PolarHBondContact O-N 2.85Å; D156-L166 HydrophobicContact CB-CD1 3.87Å; L166-V178 HydrophobicContact CB-CG1 3.54Å; L166-V178 HydrophobicContact CD1-CG1 3.7Å; L166-V178 HydrophobicContact CG-CG1 4.27Å; L166-D180 HydrophobicContact CD2-CB 4.22Å; L166-L181 HydrophobicContact CD1-CB 4.29Å; L166-L181 HydrophobicContact CD1-CD1 3.98Å
167	E	90.4	Very high	83.8	Confident	118 Å²	118	79.9 Å²	79.9	55%	0.551	39%	0.39	S	S	*	.			trans	-105.3	144.4	178.5	-66.8	-177.7	166.9	0	0	111.7	K179	E167-K179 PolarHBondContact O-N 3.27Å
168	I	91.7	Very high	83.8	Confident	14 Å²	14	80.6 Å²	80.6	7%	0.072	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	130	171.3	-56.7	-179.5	0	0	0	108.8	I154 I176 K298 R301 L302	I154-I168 HydrophobicContact CD1-CD1 3.78Å; I154-I168 HydrophobicContact CD1-CG1 3.36Å; I168-I176 HydrophobicContact CG2-CG2 3.28Å; I168-K298 HydrophobicContact CD1-CB 3.98Å; I168-K298 HydrophobicContact CD1-CD 3.63Å; I168-K298 HydrophobicContact CD1-CG 4.37Å; I168-K298 HydrophobicContact CG1-CD 4.21Å; I168-R301 HydrophobicContact CD1-CB 3.84Å; I168-L302 HydrophobicContact CD1-CD2 4.11Å; I168-L302 HydrophobicContact CD1-CG 3.92Å; I168-L302 HydrophobicContact CG1-CD2 4.3Å
169	R	89.9	Confident	83.8	Confident	118 Å²	118	82.6 Å²	82.6	45%	0.445	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	163.9	170.6	-68.8	-167.4	174.9	-168.3	-2.5	110.5	F177 K179	R169-F177 HydrophobicContact CB-CD1 4.35Å; R169-F177 HydrophobicContact CB-CE1 3.65Å; R169-F177 HydrophobicContact CB-CE2 4.12Å; R169-F177 HydrophobicContact CB-CZ 3.54Å; R169-F177 PolarHBondContact N-O 3.25Å; R169-F177 WeakPolarHBondContact O-CD1 3.41Å; R169-F177 PolarHBondContact O-N 3.1Å; R169-K179 HydrophobicContact CG-CB 4.36Å
170	E	87	Confident	83.9	Confident	104 Å²	104	82.7 Å²	82.7	49%	0.486	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	129.6	-179.2	-169.9	172.4	173	0	0	108.5	G175 I176	E170-G175 WeakPolarHBondContact CA-O 3.29Å; E170-I176 HydrophobicContact CG-CG1 4.12Å
171	K	83.4	Confident	84.5	Confident	97 Å²	97	72.4 Å²	72.4	42%	0.422	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	139.2	170.9	-89.5	170.5	-179.3	-165.6	0	107.9	D173 G175 F177	K171-D173 PolarHBondContact O-N 2.69Å; K171-G175 PolarHBondContact N-O 3.11Å; K171-G175 WeakPolarHBondContact O-CA 3.17Å; K171-G175 PolarHBondContact O-N 3.48Å; K171-F177 HydrophobicContact CB-CD1 4.45Å; K171-F177 HydrophobicContact CB-CE1 4.16Å; K171-F177 HydrophobicContact CD-CD1 4.23Å; K171-F177 HydrophobicContact CD-CE1 3.84Å; K171-F177 HydrophobicContact CD-CZ 4.3Å; K171-F177 HydrophobicContact CG-CD1 4.21Å; K171-F177 HydrophobicContact CG-CE1 3.56Å; K171-F177 HydrophobicContact CG-CZ 4.22Å
172	P	78.9	Confident	85	Confident	132 Å²	132	70.7 Å²	70.7	86%	0.857	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-37.1	176.6	-25.6	34.3	0	0	0	113.6
173	D	73.4	Confident	85.6	Confident	139 Å²	139	71 Å²	71	74%	0.743	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-42.9	-173.2	-58	-26.8	0	0	0	112.8	K171	K171-D173 PolarHBondContact O-N 2.69Å
174	S	70.6	Confident	86.4	Confident	66 Å²	66	69.7 Å²	69.7	46%	0.462	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-10.5	-173.8	174.7	0	0	0	0	113.9
175	G	80.4	Confident	86.9	Confident	19 Å²	19	66.3 Å²	66.3	20%	0.196	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	78.2	-144.5	-176.3	0	0	0	0	0	113.2	E170 K171	E170-G175 WeakPolarHBondContact CA-O 3.29Å; K171-G175 PolarHBondContact N-O 3.11Å; K171-G175 WeakPolarHBondContact O-CA 3.17Å; K171-G175 PolarHBondContact O-N 3.48Å
176	I	87.1	Confident	87.2	Confident	13 Å²	13	62.1 Å²	62.1	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	128.7	-169.7	-62.4	173.8	0	0	0	111	I168 E170 R301 L302 Q304	I168-I176 HydrophobicContact CG2-CG2 3.28Å; E170-I176 HydrophobicContact CG-CG1 4.12Å; I176-R301 WeakPolarHBondContact CD1-O 3.44Å; I176-L302 HydrophobicContact CG2-CD2 4.37Å; I176-Q304 HydrophobicContact CD1-CB 3.99Å; I176-Q304 HydrophobicContact CD1-CG 4.37Å; I176-Q304 VanDerWaalsContact CD1-OE1 3.22Å
177	F	88.3	Confident	87	Confident	61 Å²	61	64.7 Å²	64.7	27%	0.268	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.5	178.2	71.3	-77	0	0	0	112.3	R169 K171	R169-F177 HydrophobicContact CB-CD1 4.35Å; R169-F177 HydrophobicContact CB-CE1 3.65Å; R169-F177 HydrophobicContact CB-CE2 4.12Å; R169-F177 HydrophobicContact CB-CZ 3.54Å; R169-F177 PolarHBondContact N-O 3.25Å; R169-F177 WeakPolarHBondContact O-CD1 3.41Å; R169-F177 PolarHBondContact O-N 3.1Å; K171-F177 HydrophobicContact CB-CD1 4.45Å; K171-F177 HydrophobicContact CB-CE1 4.16Å; K171-F177 HydrophobicContact CD-CD1 4.23Å; K171-F177 HydrophobicContact CD-CE1 3.84Å; K171-F177 HydrophobicContact CD-CZ 4.3Å; K171-F177 HydrophobicContact CG-CD1 4.21Å; K171-F177 HydrophobicContact CG-CE1 3.56Å; K171-F177 HydrophobicContact CG-CZ 4.22Å
178	V	91.3	Very high	86.9	Confident	16 Å²	16	61 Å²	61	10%	0.097	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	120.3	174.2	-176.8	0	0	0	0	108.4	L147 I154 L166 L181 L302	L147-V178 HydrophobicContact CD2-CG2 4.1Å; I154-V178 HydrophobicContact CD1-CG2 4.14Å; I154-V178 HydrophobicContact CG2-CG1 4.12Å; L166-V178 HydrophobicContact CB-CG1 3.54Å; L166-V178 HydrophobicContact CD1-CG1 3.7Å; L166-V178 HydrophobicContact CG-CG1 4.27Å; V178-L181 HydrophobicContact CB-CB 4.08Å; V178-L181 HydrophobicContact CB-CD2 4.31Å; V178-L181 HydrophobicContact CG1-CB 4.13Å; V178-L302 HydrophobicContact CG2-CD1 4.3Å; V178-L302 HydrophobicContact CG2-CD2 3.53Å
179	K	89.8	Confident	86.8	Confident	70 Å²	70	62.5 Å²	62.5	30%	0.304	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	138.8	178.7	-165.8	-156.3	174.8	-165	0	109.6	E167 R169 L181	E167-K179 PolarHBondContact O-N 3.27Å; R169-K179 HydrophobicContact CG-CB 4.36Å; K179-L181 PolarHBondContact O-N 3.08Å
180	D	88.6	Confident	86.8	Confident	95 Å²	95	61.8 Å²	61.8	51%	0.508	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	16.2	175.1	-52.1	-41.9	0	0	0	115.1	R159 L166 S182	R159-D180 PolarHBondContact NH2-O 3.07Å; L166-D180 HydrophobicContact CD2-CB 4.22Å; D180-S182 PolarHBondContact O-N 3.03Å
181	L	91.1	Very high	87.1	Confident	35 Å²	35	60.1 Å²	60.1	18%	0.183	33%	0.333	C	S	.	.			trans	-65.1	129.6	172.6	-177.7	66.5	0	0	0	110.8	L147 D156 L166 V178 K179 S183 I222	L147-L181 HydrophobicContact CB-CD1 3.98Å; L147-L181 HydrophobicContact CD2-CD1 4.13Å; L147-L181 HydrophobicContact CD2-CD2 3.89Å; D156-L181 HydrophobicContact CB-CD1 4.46Å; L166-L181 HydrophobicContact CD1-CB 4.29Å; L166-L181 HydrophobicContact CD1-CD1 3.98Å; V178-L181 HydrophobicContact CB-CB 4.08Å; V178-L181 HydrophobicContact CB-CD2 4.31Å; V178-L181 HydrophobicContact CG1-CB 4.13Å; K179-L181 PolarHBondContact O-N 3.08Å; L181-S183 PolarHBondContact O-N 3.27Å; L181-I222 HydrophobicContact CD2-CD1 4.39Å
182	S	91.6	Very high	87.5	Confident	28 Å²	28	55.6 Å²	55.6	20%	0.196	31%	0.313	C	S	.	.			trans	-71.4	127.2	178.7	-53.5	0	0	0	0	110.9	S145 D156 R159 D180	S145-S182 WeakPolarHBondContact CB-O 3.4Å; S145-S182 PolarHBondContact OG-O 2.97Å; D156-S182 WeakPolarHBondContact OD2-CB 3.3Å; D156-S182 PolarHBondContact OD2-N 3.3Å; D156-S182 PolarHBondContact OD2-OG 3.34Å; R159-S182 VanDerWaalsContact CG-OG 3.27Å; R159-S182 WeakPolarHBondContact CG-OG 3.32Å; R159-S182 PolarHBondContact NE-OG 3.19Å; R159-S182 VanDerWaalsContact NE-OG 3.12Å; D180-S182 PolarHBondContact O-N 3.03Å
183	S	91.1	Very high	88.1	Confident	53 Å²	53	50.7 Å²	50.7	37%	0.371	28%	0.279	S	S	.	.			trans	-115.2	114.7	175.2	166.6	0	0	0	0	108.9	R143 L181	R143-S183 WeakPolarHBondContact CD-OG 3.35Å; L181-S183 PolarHBondContact O-N 3.27Å
184	V	92.7	Very high	89	Confident	56 Å²	56	50.2 Å²	50.2	34%	0.339	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.8	179.3	-178.8	0	0	0	0	109.5	R143 A144 L158 V195	R143-V184 CarbonylContact C-O 3.57Å; R143-V184 WeakPolarHBondContact CA-O 3.25Å; A144-V184 PolarHBondContact N-O 2.92Å; A144-V184 PolarHBondContact O-N 3.42Å; L158-V184 HydrophobicContact CD1-CG2 3.9Å; V184-V195 HydrophobicContact CB-CG2 4.09Å; V184-V195 HydrophobicContact CG1-CG2 3.77Å; V184-V195 HydrophobicContact CG2-CG2 4.5Å
185	L	91.8	Very high	90.1	Very high	49 Å²	49	47.6 Å²	47.6	26%	0.257	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.8	172.1	-76	164.7	0	0	0	109.8	L141 R143 Y360 K477	L141-L185 HydrophobicContact CD1-CD2 3.48Å; L141-L185 VanDerWaalsContact CD1-CD2 3.48Å; L141-L185 HydrophobicContact CD2-CD2 4.18Å; L141-L185 HydrophobicContact CG-CD2 3.77Å; R143-L185 HydrophobicContact CG-CD2 3.62Å; R143-L185 HydrophobicContact CG-CG 4.42Å; L185-Y360 HydrophobicContact CD1-CE2 4.48Å; L185-K477 HydrophobicContact CD1-CD 4.02Å; L185-K477 HydrophobicContact CD1-CG 4.49Å
186	T	91	Very high	90.6	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.018	24%	0.243	C	C	.	.			trans	-122.4	119.7	-177.5	56.2	0	0	0	0	110.3	V142 A144 E191 I192 V195	V142-T186 WeakPolarHBondContact CG1-OG1 3.38Å; V142-T186 PolarHBondContact O-N 3.45Å; V142-T186 PolarHBondContact O-OG1 3.24Å; A144-T186 HydrophobicContact CB-CG2 4.1Å; T186-E191 HydrophobicContact CG2-CB 4.48Å; T186-I192 HydrophobicContact CG2-CB 3.8Å; T186-I192 HydrophobicContact CG2-CG1 4.17Å; T186-V195 HydrophobicContact CG2-CG2 4.18Å
187	K	87	Confident	90.7	Very high	72 Å²	72	50.6 Å²	50.6	31%	0.313	26%	0.259	S	S	.	.			trans	-96.9	-21.4	-177.4	-57.4	179.8	-178.2	-161.1	0	113.3	F129 E191 S476 L479	F129-K187 VanDerWaalsContact CE1-C 3.49Å; F129-K187 WeakPolarHBondContact CE1-O 3.34Å; K187-E191 WeakPolarHBondContact CB-OE2 3.49Å; K187-E191 PolarHBondContact N-OE2 3.47Å; K187-S476 VanDerWaalsContact CD-O 3.3Å; K187-S476 WeakPolarHBondContact CD-O 3.31Å; K187-S476 WeakPolarHBondContact CE-O 3.36Å; K187-S476 VanDerWaalsContact NZ-C 3.34Å; K187-S476 PolarHBondContact NZ-O 2.86Å; K187-S476 PolarHBondContact NZ-OG 2.95Å; K187-L479 HydrophobicContact CB-CD2 4.1Å; K187-L479 VanDerWaalsContact O-CD2 3.27Å; K187-L479 WeakPolarHBondContact O-CD2 3.41Å
188	S	87.8	Confident	90.8	Very high	41 Å²	41	51.4 Å²	51.4	29%	0.287	27%	0.265	S	S	.	.	S	Bend	trans	-139.9	164.9	-178.7	72.3	0	0	0	0	112.2	D190 E191 I192	S188-D190 PolarHBondContact O-N 3.28Å; S188-E191 PolarHBondContact O-N 2.92Å; S188-E191 PolarHBondContact OG-N 2.67Å; S188-I192 PolarHBondContact O-N 2.89Å
189	I	90.2	Very high	90.7	Very high	46 Å²	46	50.7 Å²	50.7	24%	0.236	26%	0.261	C	S	.	.	H	α-helix	trans	-57.1	-39.3	174.6	-60.4	167.5	0	0	0	110.5	V126 F129 E191 I192 Q193	V126-I189 HydrophobicContact CG2-CD1 4.39Å; V126-I189 HydrophobicContact CG2-CG2 4.29Å; F129-I189 HydrophobicContact CB-CD1 4.05Å; F129-I189 HydrophobicContact CB-CG1 3.55Å; F129-I189 HydrophobicContact CD2-CB 4.46Å; F129-I189 HydrophobicContact CD2-CG1 3.7Å; F129-I189 HydrophobicContact CG-CG1 3.79Å; I189-E191 PolarHBondContact O-N 3.09Å; I189-I192 WeakPolarHBondContact O-CG2 3.44Å; I189-I192 PolarHBondContact O-N 3.14Å; I189-Q193 HydrophobicContact CG2-CG 4.31Å; I189-Q193 WeakPolarHBondContact O-CB 3.4Å; I189-Q193 VanDerWaalsContact O-CG 3.24Å; I189-Q193 WeakPolarHBondContact O-CG 3.12Å; I189-Q193 PolarHBondContact O-N 2.92Å
190	D	90.4	Very high	90.5	Very high	102 Å²	102	51.8 Å²	51.8	55%	0.545	26%	0.264	S	S	.	.	H	α-helix	trans	-66.4	-37.4	179.5	-66.8	-34.3	0	0	0	112.5	S188 K194	S188-D190 PolarHBondContact O-N 3.28Å; D190-K194 WeakPolarHBondContact O-CB 3.37Å; D190-K194 WeakPolarHBondContact O-CG 3.17Å; D190-K194 PolarHBondContact O-N 2.98Å
191	E	92.4	Very high	90.3	Very high	70 Å²	70	53.1 Å²	53.1	33%	0.327	27%	0.267	S	S	.	.	H	α-helix	trans	-66	-46.6	178.2	-73.7	-178.9	-175.4	0	0	111.5	T186 K187 S188 I189 Q193 K194 V195	T186-E191 HydrophobicContact CG2-CB 4.48Å; K187-E191 WeakPolarHBondContact CB-OE2 3.49Å; K187-E191 PolarHBondContact N-OE2 3.47Å; S188-E191 PolarHBondContact O-N 2.92Å; S188-E191 PolarHBondContact OG-N 2.67Å; I189-E191 PolarHBondContact O-N 3.09Å; E191-Q193 VanDerWaalsContact C-N 3.34Å; E191-Q193 PolarHBondContact O-N 3.04Å; E191-K194 WeakPolarHBondContact O-CB 3.16Å; E191-K194 PolarHBondContact O-N 3.49Å; E191-V195 WeakPolarHBondContact O-CG2 3.35Å; E191-V195 PolarHBondContact O-N 2.91Å
192	I	92.9	Very high	90	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-68.2	-34.3	178	-166.1	162.2	0	0	0	112.1	F125 F129 A144 T186 S188 I189 V195 M196 F221 V223	F125-I192 HydrophobicContact CB-CG2 3.77Å; F125-I192 HydrophobicContact CD1-CD1 3.52Å; F125-I192 HydrophobicContact CD1-CG1 4.05Å; F125-I192 HydrophobicContact CD1-CG2 4.35Å; F125-I192 HydrophobicContact CD2-CB 4.45Å; F125-I192 HydrophobicContact CD2-CD1 4.44Å; F125-I192 HydrophobicContact CD2-CG1 4.09Å; F125-I192 HydrophobicContact CD2-CG2 3.66Å; F125-I192 HydrophobicContact CE1-CD1 3.6Å; F125-I192 HydrophobicContact CE1-CG1 3.95Å; F125-I192 HydrophobicContact CE2-CD1 4.49Å; F125-I192 HydrophobicContact CE2-CG1 3.98Å; F125-I192 HydrophobicContact CE2-CG2 4.33Å; F125-I192 HydrophobicContact CG-CD1 3.99Å; F125-I192 HydrophobicContact CG-CG1 4.12Å; F125-I192 HydrophobicContact CG-CG2 3.67Å; F125-I192 HydrophobicContact CZ-CD1 4.09Å; F125-I192 HydrophobicContact CZ-CG1 3.91Å; F129-I192 HydrophobicContact CD2-CG2 4.41Å; F129-I192 HydrophobicContact CE2-CB 4.25Å; F129-I192 HydrophobicContact CE2-CD1 4.45Å; F129-I192 HydrophobicContact CE2-CG2 3.69Å; A144-I192 HydrophobicContact CB-CD1 4.18Å; A144-I192 HydrophobicContact CB-CG1 4.15Å; T186-I192 HydrophobicContact CG2-CB 3.8Å; T186-I192 HydrophobicContact CG2-CG1 4.17Å; S188-I192 PolarHBondContact O-N 2.89Å; I189-I192 WeakPolarHBondContact O-CG2 3.44Å; I189-I192 PolarHBondContact O-N 3.14Å; I192-V195 WeakPolarHBondContact O-CB 3.43Å; I192-V195 PolarHBondContact O-N 2.88Å; I192-M196 PolarHBondContact O-N 3.33Å; I192-F221 HydrophobicContact CD1-CE1 4.3Å; I192-F221 HydrophobicContact CG1-CE1 4.31Å; I192-F221 HydrophobicContact CG1-CZ 4.04Å; I192-V223 HydrophobicContact CD1-CG1 4.45Å; I192-V223 HydrophobicContact CD1-CG2 4.11Å
193	Q	91.1	Very high	89.6	Confident	30 Å²	30	52.4 Å²	52.4	14%	0.14	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-36	173.3	-75.5	-178.5	0.6	0	0	112.1	F125 I189 E191 M196 K197	F125-Q193 HydrophobicContact CD2-CG 4.28Å; I189-Q193 HydrophobicContact CG2-CG 4.31Å; I189-Q193 WeakPolarHBondContact O-CB 3.4Å; I189-Q193 VanDerWaalsContact O-CG 3.24Å; I189-Q193 WeakPolarHBondContact O-CG 3.12Å; I189-Q193 PolarHBondContact O-N 2.92Å; E191-Q193 VanDerWaalsContact C-N 3.34Å; E191-Q193 PolarHBondContact O-N 3.04Å; Q193-M196 PolarHBondContact O-N 2.74Å; Q193-K197 WeakPolarHBondContact O-CG 3.37Å; Q193-K197 PolarHBondContact O-N 3.42Å
194	K	91.7	Very high	88.5	Confident	129 Å²	129	51.9 Å²	51.9	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-62.4	-43.8	171	-74.7	166.8	-172.9	173.7	0	111.2	D190 E191 M196 K197 I198	D190-K194 WeakPolarHBondContact O-CB 3.37Å; D190-K194 WeakPolarHBondContact O-CG 3.17Å; D190-K194 PolarHBondContact O-N 2.98Å; E191-K194 WeakPolarHBondContact O-CB 3.16Å; E191-K194 PolarHBondContact O-N 3.49Å; K194-M196 VanDerWaalsContact C-N 3.33Å; K194-M196 PolarHBondContact O-N 3.01Å; K194-K197 PolarHBondContact O-N 3.34Å; K194-I198 VanDerWaalsContact O-CG1 3.27Å; K194-I198 WeakPolarHBondContact O-CG1 3.46Å; K194-I198 PolarHBondContact O-N 2.84Å
195	V	92.9	Very high	87.1	Confident	11 Å²	11	54 Å²	54	7%	0.067	27%	0.272	C	S	.	.	H	α-helix	trans	-58.3	-45	175.1	174.5	0	0	0	0	110.9	A144 L158 V184 T186 E191 I192 I198 G199 F221	A144-V195 HydrophobicContact CB-CG1 4.1Å; L158-V195 HydrophobicContact CD1-CG1 3.79Å; L158-V195 HydrophobicContact CD2-CG1 3.55Å; L158-V195 HydrophobicContact CG-CG1 4.35Å; V184-V195 HydrophobicContact CB-CG2 4.09Å; V184-V195 HydrophobicContact CG1-CG2 3.77Å; V184-V195 HydrophobicContact CG2-CG2 4.5Å; T186-V195 HydrophobicContact CG2-CG2 4.18Å; E191-V195 WeakPolarHBondContact O-CG2 3.35Å; E191-V195 PolarHBondContact O-N 2.91Å; I192-V195 WeakPolarHBondContact O-CB 3.43Å; I192-V195 PolarHBondContact O-N 2.88Å; V195-I198 PolarHBondContact O-N 2.88Å; V195-G199 PolarHBondContact O-N 2.99Å; V195-G199 VanDerWaalsContact O-N 3.08Å; V195-F221 HydrophobicContact CG1-CE2 4.18Å; V195-F221 HydrophobicContact CG1-CZ 4.32Å
196	M	91.5	Very high	85.5	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-46.5	174.5	-178.6	-170.4	63.7	0	0	112.2	Q109 Q112 M121 F125 I192 Q193 K194 G199 Y200 F221	Q109-M196 HydrophobicContact CG-SD 4.48Å; Q112-M196 HydrophobicContact CG-CE 4.16Å; M121-M196 HydrophobicContact CG-SD 4.04Å; M121-M196 HydrophobicContact SD-CG 3.71Å; M121-M196 HydrophobicContact SD-SD 3.58Å; F125-M196 HydrophobicContact CE2-CB 4.34Å; F125-M196 HydrophobicContact CE2-SD 4.16Å; I192-M196 PolarHBondContact O-N 3.33Å; Q193-M196 PolarHBondContact O-N 2.74Å; K194-M196 VanDerWaalsContact C-N 3.33Å; K194-M196 PolarHBondContact O-N 3.01Å; M196-G199 PolarHBondContact O-N 2.94Å; M196-Y200 WeakPolarHBondContact O-CB 3.29Å; M196-Y200 PolarHBondContact O-N 2.94Å; M196-F221 HydrophobicContact CB-CE2 4.25Å
197	K	89.9	Confident	83.7	Confident	92 Å²	92	55 Å²	55	40%	0.4	29%	0.291	S	S	.	.	H	α-helix	trans	-61.3	-45.5	178.7	-76.9	175.7	176.2	179.9	0	112	Q193 K194 Y200 Q201	Q193-K197 WeakPolarHBondContact O-CG 3.37Å; Q193-K197 PolarHBondContact O-N 3.42Å; K194-K197 PolarHBondContact O-N 3.34Å; K197-Y200 PolarHBondContact O-N 2.99Å; K197-Q201 VanDerWaalsContact O-CG 3.32Å; K197-Q201 WeakPolarHBondContact O-CG 3.32Å; K197-Q201 PolarHBondContact O-N 3.37Å
198	I	90.4	Very high	82	Confident	78 Å²	78	57 Å²	57	40%	0.4	31%	0.31	S	S	.	.	H	α-helix	trans	-59.9	-49.7	178.4	-69.3	164.2	0	0	0	110.3	K194 V195 Y200 Q201 N202	K194-I198 VanDerWaalsContact O-CG1 3.27Å; K194-I198 WeakPolarHBondContact O-CG1 3.46Å; K194-I198 PolarHBondContact O-N 2.84Å; V195-I198 PolarHBondContact O-N 2.88Å; I198-Y200 VanDerWaalsContact C-N 3.33Å; I198-Y200 PolarHBondContact O-N 2.86Å; I198-Q201 PolarHBondContact O-N 2.88Å; I198-N202 PolarHBondContact O-N 3.1Å
199	G	89	Confident	80	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-68.2	-32.8	-179.3	0	0	0	0	0	113.5	L157 V195 M196 N202 R203	L157-G199 WeakPolarHBondContact O-CA 3.49Å; V195-G199 PolarHBondContact O-N 2.99Å; V195-G199 VanDerWaalsContact O-N 3.08Å; M196-G199 PolarHBondContact O-N 2.94Å; G199-N202 PolarHBondContact O-N 3.46Å; G199-R203 WeakPolarHBondContact O-CB 3.31Å; G199-R203 PolarHBondContact O-N 3.04Å
200	Y	84.7	Confident	77.6	Confident	94 Å²	94	67.2 Å²	67.2	37%	0.369	36%	0.359	S	S	.	.	H	α-helix	trans	-65.4	-41.7	172	-175.4	-97.2	0	0	0	112.2	Q109 M196 K197 I198 R203 A204	Q109-Y200 VanDerWaalsContact NE2-CD2 3.34Å; Q109-Y200 VanDerWaalsContact OE1-CE2 3.25Å; M196-Y200 WeakPolarHBondContact O-CB 3.29Å; M196-Y200 PolarHBondContact O-N 2.94Å; K197-Y200 PolarHBondContact O-N 2.99Å; I198-Y200 VanDerWaalsContact C-N 3.33Å; I198-Y200 PolarHBondContact O-N 2.86Å; Y200-R203 PolarHBondContact O-N 3.5Å; Y200-A204 WeakPolarHBondContact O-CB 3.36Å; Y200-A204 PolarHBondContact O-N 3.05Å
201	Q	84.5	Confident	75.7	Confident	122 Å²	122	64.6 Å²	64.6	57%	0.57	35%	0.345	S	S	*	.	H	α-helix	trans	-61.8	-45.2	174.8	-74.8	173	-10.9	0	0	111.2	K197 I198 R203 A204 V205	K197-Q201 VanDerWaalsContact O-CG 3.32Å; K197-Q201 WeakPolarHBondContact O-CG 3.32Å; K197-Q201 PolarHBondContact O-N 3.37Å; I198-Q201 PolarHBondContact O-N 2.88Å; Q201-R203 VanDerWaalsContact C-N 3.32Å; Q201-R203 PolarHBondContact O-N 2.82Å; Q201-A204 CarbonylContact O-C 3.57Å; Q201-A204 PolarHBondContact O-N 3Å; Q201-A204 VanDerWaalsContact O-N 3.08Å; Q201-V205 VanDerWaalsContact O-CG2 3.31Å; Q201-V205 WeakPolarHBondContact O-CG2 3.04Å; Q201-V205 PolarHBondContact O-N 3.39Å
202	N	85.4	Confident	74.2	Confident	41 Å²	41	67.9 Å²	67.9	22%	0.219	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-38.7	177.1	-71.7	-20.4	0	0	0	112.1	L157 I198 G199 A204	L157-N202 HydrophobicContact CD2-CB 4.39Å; L157-N202 PolarHBondContact O-ND2 3.35Å; I198-N202 PolarHBondContact O-N 3.1Å; G199-N202 PolarHBondContact O-N 3.46Å; N202-A204 VanDerWaalsContact C-N 3.34Å; N202-A204 PolarHBondContact O-N 3.05Å
203	R	82.3	Confident	72.8	Confident	8 Å²	8	68.5 Å²	68.5	3%	0.03	36%	0.363	C	S	.	.	H	α-helix	trans	-62.5	-39.8	171.5	-170	178.9	-175.3	-163	1.8	111.8	L157 G199 Y200 Q201 G206 S214 S217 A219 D247	L157-R203 HydrophobicContact CD1-CB 4.31Å; L157-R203 HydrophobicContact CD2-CB 4.06Å; G199-R203 WeakPolarHBondContact O-CB 3.31Å; G199-R203 PolarHBondContact O-N 3.04Å; Y200-R203 PolarHBondContact O-N 3.5Å; Q201-R203 VanDerWaalsContact C-N 3.32Å; Q201-R203 PolarHBondContact O-N 2.82Å; R203-G206 PolarHBondContact O-N 3.3Å; R203-S214 PolarHBondContact NH2-O 3.45Å; R203-S217 PolarHBondContact NE-OG 2.83Å; R203-S217 PolarHBondContact NH2-O 3.14Å; R203-A219 VanDerWaalsContact CZ-CB 3.48Å; R203-D247 IonicContact CZ-OD2 3.84Å; R203-D247 IonicContact NH1-OD2 3.29Å; R203-D247 PolarHBondContact NH1-OD2 3.35Å; R203-D247 VanDerWaalsContact NH1-OD2 3.09Å; R203-D247 IonicContact NH2-OD2 3.44Å
204	A	68.1	Low	71.6	Confident	42 Å²	42	69.5 Å²	69.5	35%	0.347	37%	0.373	S	S	.	.	H	α-helix	trans	-75.2	-31.3	-179.7	0	0	0	0	0	113.7	Y200 Q201 N202 G206 A207	Y200-A204 WeakPolarHBondContact O-CB 3.36Å; Y200-A204 PolarHBondContact O-N 3.05Å; Q201-A204 CarbonylContact O-C 3.57Å; Q201-A204 PolarHBondContact O-N 3Å; Q201-A204 VanDerWaalsContact O-N 3.08Å; N202-A204 VanDerWaalsContact C-N 3.34Å; N202-A204 PolarHBondContact O-N 3.05Å; A204-G206 PolarHBondContact O-N 2.91Å; A204-A207 WeakPolarHBondContact O-CA 3.44Å; A204-A207 WeakPolarHBondContact O-CB 3.15Å; A204-A207 PolarHBondContact O-N 3.12Å
205	V	63.9	Low	70.5	Confident	99 Å²	99	64.1 Å²	64.1	60%	0.6	35%	0.352	S	S	*	.	H	α-helix	trans	-62.1	-30.6	174.5	170.9	0	0	0	0	110.8	Q201 A207 T208	Q201-V205 VanDerWaalsContact O-CG2 3.31Å; Q201-V205 WeakPolarHBondContact O-CG2 3.04Å; Q201-V205 PolarHBondContact O-N 3.39Å; V205-A207 PolarHBondContact O-N 3.4Å; V205-T208 PolarHBondContact O-OG1 3.49Å
206	G	57.6	Low	69.7	Low	38 Å²	38	65.4 Å²	65.4	39%	0.392	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-64.3	-22	169.3	0	0	0	0	0	114.2	R203 A204	R203-G206 PolarHBondContact O-N 3.3Å; A204-G206 PolarHBondContact O-N 2.91Å
207	A	55	Low	69.4	Low	35 Å²	35	65.3 Å²	65.3	29%	0.289	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-81.6	-15.8	-176	0	0	0	0	0	114.2	A204 V205 N209 H213	A204-A207 WeakPolarHBondContact O-CA 3.44Å; A204-A207 WeakPolarHBondContact O-CB 3.15Å; A204-A207 PolarHBondContact O-N 3.12Å; V205-A207 PolarHBondContact O-N 3.4Å; A207-N209 PolarHBondContact O-N 3.42Å; A207-H213 HydrophobicContact CB-CB 4.01Å
208	T	49.7	Very low	69.4	Low	115 Å²	115	61 Å²	61	71%	0.706	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-70.3	-13.6	-176.1	54.8	0	0	0	0	113.7	V205 M210	V205-T208 PolarHBondContact O-OG1 3.49Å; T208-M210 PolarHBondContact O-N 3.32Å
209	N	45.5	Very low	69.4	Low	149 Å²	149	57.4 Å²	57.4	80%	0.797	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	47.8	178.3	-96.7	-2.5	0	0	0	114.5	A207	A207-N209 PolarHBondContact O-N 3.42Å
210	M	41.4	Very low	69.7	Low	153 Å²	153	57.6 Å²	57.6	75%	0.754	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.1	11.5	164.1	-49.4	-172.1	-171.2	0	0	120.9	T208 R263	T208-M210 PolarHBondContact O-N 3.32Å; M210-R263 PolarHBondContact O-NH2 2.66Å
211	N	50.4	Low	70.2	Confident	47 Å²	47	53.1 Å²	53.1	25%	0.251	30%	0.301	S	S	.	.	S	Bend	trans	-158.3	160.1	173.8	-77.9	-56.7	0	0	0	114.3	H213 R216 R263	N211-H213 PolarHBondContact O-N 2.91Å; N211-R216 PolarHBondContact ND2-NH1 3.05Å; N211-R216 PolarHBondContact OD1-NH2 2.81Å; N211-R263 WeakPolarHBondContact ND2-CD 3.19Å; N211-R263 VanDerWaalsContact ND2-CZ 3.3Å; N211-R263 PolarHBondContact ND2-NE 2.98Å; N211-R263 PolarHBondContact OD1-NH1 3.42Å; N211-R263 VanDerWaalsContact OD1-NH1 3.07Å; N211-R263 PolarHBondContact OD1-NH2 2.75Å
212	E	61.1	Low	70.7	Confident	139 Å²	139	48 Å²	48	65%	0.65	28%	0.278	S	S	*	.			trans	-60	75.8	166.1	-70.8	-179.7	160.3	0	0	111.4	S214 S215	E212-S214 PolarHBondContact O-N 3.04Å; E212-S215 PolarHBondContact O-N 3.39Å; E212-S215 PolarHBondContact O-OG 2.94Å
213	H	62.1	Low	71.1	Confident	13 Å²	13	46 Å²	46	6%	0.06	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-64.1	-27.5	-174.7	-167.3	-23	0	0	0	112.8	Y150 A207 N211 S215 R216 S217	Y150-H213 AromaticContact CD2-CE1 3.19Å; Y150-H213 WeakPolarHBondContact CD2-CE1 3.31Å; Y150-H213 AromaticContact CD2-ND1 3.98Å; Y150-H213 AromaticContact CD2-NE2 3.95Å; Y150-H213 AromaticContact CE1-NE2 3.96Å; Y150-H213 AromaticContact CE2-CE1 3.32Å; Y150-H213 WeakPolarHBondContact CE2-CE1 3.38Å; Y150-H213 AromaticContact CE2-ND1 3.88Å; Y150-H213 AromaticContact CE2-NE2 3.86Å; Y150-H213 AromaticContact CG-CE1 3.55Å; Y150-H213 AromaticContact CZ-CE1 3.79Å; Y150-H213 AromaticContact CZ-NE2 3.85Å; A207-H213 HydrophobicContact CB-CB 4.01Å; N211-H213 PolarHBondContact O-N 2.91Å; H213-S215 PolarHBondContact O-N 3.19Å; H213-R216 WeakPolarHBondContact O-CA 3.48Å; H213-R216 PolarHBondContact O-N 3.05Å; H213-S217 PolarHBondContact O-N 3.19Å
214	S	65.4	Low	71.7	Confident	51 Å²	51	46.4 Å²	46.4	36%	0.357	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-61.9	-24.8	178	57.2	0	0	0	0	113.3	R203 E212 R216	R203-S214 PolarHBondContact NH2-O 3.45Å; E212-S214 PolarHBondContact O-N 3.04Å; S214-R216 VanDerWaalsContact C-N 3.3Å
215	S	70.3	Confident	72.8	Confident	16 Å²	16	44.5 Å²	44.5	11%	0.112	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-80.2	-13.6	174.2	65	0	0	0	0	113.5	T100 E212 H213 A249 G250	T100-S215 VanDerWaalsContact CG2-CB 3.49Å; T100-S215 WeakPolarHBondContact OG1-CB 3.44Å; E212-S215 PolarHBondContact O-N 3.39Å; E212-S215 PolarHBondContact O-OG 2.94Å; H213-S215 PolarHBondContact O-N 3.19Å; S215-A249 WeakPolarHBondContact O-CA 3.45Å; S215-A249 WeakPolarHBondContact O-CB 3.48Å; S215-G250 PolarHBondContact O-N 3.21Å
216	R	75	Confident	74.1	Confident	39 Å²	39	39.8 Å²	39.8	15%	0.147	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-1.3	-167.9	-69.8	-161.6	-170.9	158.8	13.2	115	Y150 N211 H213 S214 E266 I270	Y150-R216 HydrophobicContact CE2-CB 4.49Å; N211-R216 PolarHBondContact ND2-NH1 3.05Å; N211-R216 PolarHBondContact OD1-NH2 2.81Å; H213-R216 WeakPolarHBondContact O-CA 3.48Å; H213-R216 PolarHBondContact O-N 3.05Å; S214-R216 VanDerWaalsContact C-N 3.3Å; R216-E266 WeakPolarHBondContact CD-OE1 3.33Å; R216-E266 IonicContact CZ-OE2 2.91Å; R216-E266 IonicContact NH1-OE1 2.93Å; R216-E266 IonicContact NH1-OE2 3.35Å; R216-E266 PolarHBondContact NH1-OE2 2.91Å; R216-I270 HydrophobicContact CB-CD1 3.45Å; R216-I270 VanDerWaalsContact CB-CD1 3.45Å; R216-I270 HydrophobicContact CG-CD1 3.65Å; R216-I270 VanDerWaalsContact O-CD1 3.26Å; R216-I270 WeakPolarHBondContact O-CD1 3.17Å; R216-I270 VanDerWaalsContact O-CG1 3.27Å; R216-I270 WeakPolarHBondContact O-CG1 3.42Å
217	S	85.2	Confident	75.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	-127	147.5	171.9	63	0	0	0	0	111.2	E148 I149 R203 H213	E148-S217 PolarHBondContact OE2-OG 3.32Å; I149-S217 WeakPolarHBondContact O-CA 3.47Å; I149-S217 WeakPolarHBondContact O-CB 3.24Å; R203-S217 PolarHBondContact NE-OG 2.83Å; R203-S217 PolarHBondContact NH2-O 3.14Å; H213-S217 PolarHBondContact O-N 3.19Å
218	H	89.3	Confident	77	Confident	3 Å²	3	37.3 Å²	37.3	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	124.3	171.1	-50.8	-75.4	0	0	0	108.5	E148 I149 D247 L248 A249 S273 L299	E148-H218 CarbonylContact C-O 3.57Å; E148-H218 VanDerWaalsContact CA-O 3.25Å; E148-H218 WeakPolarHBondContact CA-O 3.49Å; I149-H218 HydrophobicContact CB-CB 4.23Å; I149-H218 PolarHBondContact N-O 2.87Å; I149-H218 PolarHBondContact O-N 3.2Å; H218-D247 CarbonylContact C-O 3.55Å; H218-D247 WeakPolarHBondContact CA-O 3.32Å; H218-L248 HydrophobicContact CB-CD2 4.37Å; H218-L248 WeakPolarHBondContact ND1-CA 3.24Å; H218-L248 WeakPolarHBondContact ND1-CD2 3.43Å; H218-A249 VanDerWaalsContact CE1-CB 3.45Å; H218-A249 WeakPolarHBondContact CE1-CB 3.33Å; H218-A249 PolarHBondContact CE1-N 3.38Å; H218-A249 PolarHBondContact ND1-N 3.38Å; H218-S273 PolarHBondContact NE2-OG 2.83Å; H218-L299 HydrophobicContact CB-CD1 4.35Å
219	A	91.7	Very high	78.6	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.4	177.6	0	0	0	0	0	110.1	Y146 R203 V246 D247	Y146-A219 HydrophobicContact CE2-CB 3.93Å; R203-A219 VanDerWaalsContact CZ-CB 3.48Å; A219-V246 WeakPolarHBondContact O-CA 3.36Å; A219-D247 HydrophobicContact CB-CB 4.41Å; A219-D247 PolarHBondContact N-O 3.11Å; A219-D247 PolarHBondContact O-N 3.34Å
220	I	94.5	Very high	80.3	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	110	-178.1	-53	-175.6	0	0	0	108.8	Y146 L147 I149 I222 V246 L299 L302	Y146-I220 WeakPolarHBondContact CD2-O 3.14Å; L147-I220 HydrophobicContact CD1-CB 3.75Å; L147-I220 HydrophobicContact CD1-CD1 4.09Å; L147-I220 HydrophobicContact CD1-CG1 4.02Å; L147-I220 HydrophobicContact CG-CB 4.07Å; L147-I220 PolarHBondContact N-O 2.88Å; L147-I220 PolarHBondContact O-N 2.81Å; I149-I220 HydrophobicContact CD1-CD1 4.07Å; I220-I222 HydrophobicContact CG2-CD1 4.31Å; I220-I222 HydrophobicContact CG2-CG1 3.83Å; I220-V246 HydrophobicContact CG1-CG1 4.14Å; I220-V246 HydrophobicContact CG1-CG2 4.18Å; I220-V246 HydrophobicContact CG2-CG2 4.07Å; I220-L299 HydrophobicContact CD1-CD1 4.31Å; I220-L302 HydrophobicContact CD1-CD1 4.27Å
221	F	95.3	Very high	81.9	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	121.8	172.6	-165.7	-85.2	0	0	0	109.2	M121 F125 A144 Y146 I192 V195 M196 V223 L245	M121-F221 HydrophobicContact CE-CB 3.5Å; M121-F221 VanDerWaalsContact CE-CB 3.5Å; M121-F221 HydrophobicContact CE-CD2 4.45Å; M121-F221 HydrophobicContact CE-CG 3.96Å; M121-F221 HydrophobicContact SD-CB 4.27Å; M121-F221 HydrophobicContact SD-CD1 4.48Å; M121-F221 HydrophobicContact SD-CD2 4.2Å; M121-F221 HydrophobicContact SD-CG 4.08Å; F125-F221 HydrophobicContact CE1-CD1 4.14Å; F125-F221 AromaticContact CE1-CE1 3.54Å; F125-F221 HydrophobicContact CE1-CE1 3.54Å; F125-F221 HydrophobicContact CE1-CZ 4.26Å; F125-F221 AromaticContact CZ-CD1 3.98Å; F125-F221 HydrophobicContact CZ-CD1 3.98Å; F125-F221 AromaticContact CZ-CE1 3.34Å; F125-F221 HydrophobicContact CZ-CE1 3.34Å; F125-F221 AromaticContact CZ-CZ 3.67Å; F125-F221 HydrophobicContact CZ-CZ 3.67Å; A144-F221 HydrophobicContact CB-CE1 4.15Å; A144-F221 HydrophobicContact CB-CZ 3.85Å; Y146-F221 AromaticContact CD1-CD2 3.73Å; Y146-F221 HydrophobicContact CD1-CD2 3.73Å; Y146-F221 HydrophobicContact CD1-CE2 4.15Å; Y146-F221 HydrophobicContact CD2-CB 3.96Å; Y146-F221 AromaticContact CD2-CD2 3.78Å; Y146-F221 HydrophobicContact CD2-CD2 3.78Å; Y146-F221 HydrophobicContact CD2-CG 4.35Å; Y146-F221 HydrophobicContact CE1-CD2 4.24Å; Y146-F221 HydrophobicContact CE2-CB 4.12Å; Y146-F221 HydrophobicContact CE2-CD2 4.24Å; Y146-F221 AromaticContact CG-CD2 3.52Å; Y146-F221 HydrophobicContact CG-CD2 3.52Å; Y146-F221 HydrophobicContact CG-CE2 4.18Å; Y146-F221 HydrophobicContact CG-CG 4.47Å; I192-F221 HydrophobicContact CD1-CE1 4.3Å; I192-F221 HydrophobicContact CG1-CE1 4.31Å; I192-F221 HydrophobicContact CG1-CZ 4.04Å; V195-F221 HydrophobicContact CG1-CE2 4.18Å; V195-F221 HydrophobicContact CG1-CZ 4.32Å; M196-F221 HydrophobicContact CB-CE2 4.25Å; F221-V223 HydrophobicContact CD1-CG2 3.78Å; F221-V223 HydrophobicContact CE1-CG2 3.51Å; F221-L245 HydrophobicContact CB-CB 4.29Å; F221-L245 HydrophobicContact CD1-CD1 4.47Å; F221-L245 PolarHBondContact N-O 3.36Å; F221-L245 PolarHBondContact O-N 2.91Å
222	I	95.1	Very high	83	Confident	15 Å²	15	34.6 Å²	34.6	8%	0.077	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.2	-174.6	-54.4	178.6	0	0	0	108.3	A144 S145 L147 L181 I220 K242 L243	A144-I222 CarbonylContact C-O 3.22Å; A144-I222 WeakPolarHBondContact CA-O 3.29Å; S145-I222 PolarHBondContact N-O 3.01Å; S145-I222 PolarHBondContact O-N 2.85Å; L147-I222 HydrophobicContact CD2-CD1 4.17Å; L181-I222 HydrophobicContact CD2-CD1 4.39Å; I220-I222 HydrophobicContact CG2-CD1 4.31Å; I220-I222 HydrophobicContact CG2-CG1 3.83Å; I222-K242 HydrophobicContact CG2-CD 4.22Å; I222-K242 VanDerWaalsContact CG2-CE 3.47Å; I222-K242 HydrophobicContact CG2-CG 3.79Å; I222-L243 CarbonylContact C-O 3.58Å; I222-L243 WeakPolarHBondContact CA-O 3.31Å
223	V	95	Very high	83.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.6	169.1	-174.1	0	0	0	0	108.5	F125 I128 V142 R143 I192 F221 V225 L243	F125-V223 HydrophobicContact CD1-CG2 4.45Å; F125-V223 HydrophobicContact CE1-CG2 3.83Å; I128-V223 HydrophobicContact CD1-CG1 4.13Å; V142-V223 HydrophobicContact CG1-CG1 3.74Å; R143-V223 CarbonylContact O-C 3.59Å; R143-V223 WeakPolarHBondContact O-CA 3.18Å; I192-V223 HydrophobicContact CD1-CG1 4.45Å; I192-V223 HydrophobicContact CD1-CG2 4.11Å; F221-V223 HydrophobicContact CD1-CG2 3.78Å; F221-V223 HydrophobicContact CE1-CG2 3.51Å; V223-V225 HydrophobicContact CG1-CG2 4.05Å; V223-L243 HydrophobicContact CB-CB 4.23Å; V223-L243 PolarHBondContact N-O 3.33Å; V223-L243 PolarHBondContact O-N 3.16Å
224	T	93.6	Very high	84.2	Confident	15 Å²	15	36.4 Å²	36.4	9%	0.092	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119	172.6	-50.9	0	0	0	0	108.1	V142 R143 E226 V240 G241	V142-T224 WeakPolarHBondContact CA-O 3.21Å; R143-T224 PolarHBondContact N-O 3.27Å; R143-T224 PolarHBondContact O-N 3.22Å; T224-E226 HydrophobicContact CG2-CG 4.39Å; T224-V240 HydrophobicContact CG2-CG1 3.75Å; T224-G241 CarbonylContact C-O 3.58Å; T224-G241 WeakPolarHBondContact CA-O 3.42Å
225	V	92	Very high	84.7	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	115.4	175.7	-176.1	0	0	0	0	107.5	L87 I128 Y140 V142 V223 G241	L87-V225 HydrophobicContact CD2-CG1 4.27Å; I128-V225 HydrophobicContact CD1-CG2 4.42Å; I128-V225 HydrophobicContact CG2-CG2 4.1Å; Y140-V225 HydrophobicContact CD1-CG1 3.87Å; Y140-V225 HydrophobicContact CE1-CG1 4.45Å; V142-V225 HydrophobicContact CG2-CG2 4.45Å; V223-V225 HydrophobicContact CG1-CG2 4.05Å; V225-G241 PolarHBondContact N-O 2.99Å; V225-G241 PolarHBondContact O-N 2.83Å
226	E	90.6	Very high	85	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.3	171.2	-56.2	175.3	-153.5	0	0	108	Y140 L141 R143 T224 R239 V240 L356 L357	Y140-E226 CarbonylContact C-O 3.54Å; Y140-E226 VanDerWaalsContact CA-O 3.29Å; Y140-E226 WeakPolarHBondContact CA-O 3.44Å; L141-E226 HydrophobicContact CB-CB 4.22Å; L141-E226 PolarHBondContact N-O 2.81Å; L141-E226 PolarHBondContact O-N 3.4Å; R143-E226 IonicContact CZ-OE1 3.81Å; R143-E226 IonicContact NE-OE1 2.75Å; R143-E226 PolarHBondContact NE-OE1 3.07Å; R143-E226 IonicContact NH2-OE1 3.67Å; R143-E226 PolarHBondContact NH2-OE1 3.46Å; T224-E226 HydrophobicContact CG2-CG 4.39Å; E226-R239 CarbonylContact C-O 3.59Å; E226-R239 WeakPolarHBondContact CA-O 3.44Å; E226-V240 HydrophobicContact CG-CG1 4.13Å; E226-V240 HydrophobicContact CG-CG2 4.08Å; E226-L356 PolarHBondContact OE2-N 3.31Å; E226-L357 HydrophobicContact CB-CB 4.23Å; E226-L357 HydrophobicContact CB-CD1 4.05Å; E226-L357 WeakPolarHBondContact OE2-CB 3.49Å; E226-L357 PolarHBondContact OE2-N 3.06Å
227	S	87.9	Confident	85.3	Confident	10 Å²	10	45.5 Å²	45.5	7%	0.07	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.8	176.5	65.9	0	0	0	0	109.9	Q139 I238 R239	Q139-S227 CarbonylContact O-C 3.53Å; Q139-S227 WeakPolarHBondContact O-CA 3.27Å; S227-I238 CarbonylContact O-C 3.49Å; S227-I238 VanDerWaalsContact O-CA 3.3Å; S227-I238 WeakPolarHBondContact O-CA 3.47Å; S227-R239 PolarHBondContact N-O 2.82Å; S227-R239 PolarHBondContact O-N 3.46Å
228	C	85	Confident	85.3	Confident	10 Å²	10	46 Å²	46	7%	0.068	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	113.6	173	177.6	0	0	0	0	108.6	A138 Q139 H237 I238 L357	A138-C228 VanDerWaalsContact CA-O 3.29Å; A138-C228 WeakPolarHBondContact CA-O 3.42Å; Q139-C228 PolarHBondContact N-O 3.27Å; Q139-C228 PolarHBondContact O-N 3.43Å; C228-H237 WeakPolarHBondContact CA-O 3.36Å; C228-I238 HydrophobicContact CB-CG1 4.26Å; C228-L357 HydrophobicContact CB-CD1 3.91Å; C228-L357 HydrophobicContact CB-CD2 3.36Å; C228-L357 HydrophobicContact CB-CG 4.29Å
229	K	84.3	Confident	85.3	Confident	100 Å²	100	49.5 Å²	49.5	44%	0.435	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	134.9	177.1	-177.9	165.1	173.4	159.5	0	109.3	D137 A138 G231 H237	D137-K229 WeakPolarHBondContact OD2-CE 3.41Å; D137-K229 IonicContact OD2-NZ 3.05Å; D137-K229 PolarHBondContact OD2-NZ 3.31Å; A138-K229 HydrophobicContact CB-CB 4.16Å; K229-G231 PolarHBondContact O-N 3.41Å; K229-H237 PolarHBondContact N-O 2.78Å; K229-H237 PolarHBondContact O-N 2.98Å
230	T	80.1	Confident	85.3	Confident	81 Å²	81	51 Å²	51	50%	0.497	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.1	169.6	-49.5	0	0	0	0	107.6
231	G	75.9	Confident	85.1	Confident	21 Å²	21	50.8 Å²	50.8	22%	0.216	27%	0.267	C	S	.	.			trans	-70	170.3	176.6	0	0	0	0	0	112.1	K229 D233 G234 E235	K229-G231 PolarHBondContact O-N 3.41Å; G231-D233 PolarHBondContact O-N 2.97Å; G231-G234 PolarHBondContact O-N 3.34Å; G231-E235 PolarHBondContact N-O 2.79Å
232	E	74.1	Confident	85	Confident	206 Å²	206	53.8 Å²	53.8	96%	0.963	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.7	171.5	-63.8	-177.7	171.8	0	0	111.6	G234	E232-G234 PolarHBondContact O-N 2.94Å
233	D	75.7	Confident	85	Confident	134 Å²	134	53 Å²	53	72%	0.717	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-4.5	175.9	-58.6	-21.6	0	0	0	113.3	G231 E235	G231-D233 PolarHBondContact O-N 2.97Å; D233-E235 PolarHBondContact O-N 3.34Å
234	G	71.7	Confident	85.1	Confident	56 Å²	56	53.7 Å²	53.7	58%	0.577	28%	0.28	S	S	*	.	S	Bend	trans	77.4	-7.2	-175.2	0	0	0	0	0	114.3	G231 E232	G231-G234 PolarHBondContact O-N 3.34Å; E232-G234 PolarHBondContact O-N 2.94Å
235	E	75.8	Confident	85.1	Confident	134 Å²	134	53 Å²	53	63%	0.626	28%	0.276	S	S	*	.			trans	-79.4	148.7	175.3	-63.8	-162.5	163.9	0	0	112.2	G231 D233 H237	G231-E235 PolarHBondContact N-O 2.79Å; D233-E235 PolarHBondContact O-N 3.34Å; E235-H237 PolarHBondContact O-N 2.8Å
236	K	76.3	Confident	85.3	Confident	104 Å²	104	53 Å²	53	45%	0.452	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	107.4	176.7	-67.6	-175.3	-179.6	-174	0	109.8
237	H	82.3	Confident	85.4	Confident	58 Å²	58	53.2 Å²	53.2	27%	0.269	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	121.7	172.5	-61	-76.1	0	0	0	109.4	C228 K229 E235	C228-H237 WeakPolarHBondContact CA-O 3.36Å; K229-H237 PolarHBondContact N-O 2.78Å; K229-H237 PolarHBondContact O-N 2.98Å; E235-H237 PolarHBondContact O-N 2.8Å
238	I	85.5	Confident	85.5	Confident	11 Å²	11	52.8 Å²	52.8	6%	0.056	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.9	175.3	-53	174.9	0	0	0	108	S227 C228 E350 A355 R358	S227-I238 CarbonylContact O-C 3.49Å; S227-I238 VanDerWaalsContact O-CA 3.3Å; S227-I238 WeakPolarHBondContact O-CA 3.47Å; C228-I238 HydrophobicContact CB-CG1 4.26Å; I238-E350 WeakPolarHBondContact O-CA 3.32Å; I238-A355 HydrophobicContact CB-CB 4.26Å; I238-A355 HydrophobicContact CD1-CB 4.24Å; I238-A355 HydrophobicContact CG2-CB 3.38Å; I238-R358 HydrophobicContact CD1-CB 3.64Å; I238-R358 HydrophobicContact CD1-CG 4.31Å
239	R	89.3	Confident	85.7	Confident	77 Å²	77	52.3 Å²	52.3	29%	0.291	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	143.4	177.9	-53.6	-168.4	171.7	162.1	-2	110	D88 E226 S227 I348 N349 E350	D88-R239 WeakPolarHBondContact O-CD 3.48Å; E226-R239 CarbonylContact C-O 3.59Å; E226-R239 WeakPolarHBondContact CA-O 3.44Å; S227-R239 PolarHBondContact N-O 2.82Å; S227-R239 PolarHBondContact O-N 3.46Å; R239-I348 HydrophobicContact CG-CG2 4.44Å; R239-N349 WeakPolarHBondContact CA-O 3.28Å; R239-E350 HydrophobicContact CG-CG 4.18Å; R239-E350 IonicContact CZ-OE1 3.95Å; R239-E350 VanDerWaalsContact CZ-OE1 3.25Å; R239-E350 IonicContact NE-OE1 3.79Å; R239-E350 PolarHBondContact NE-OE1 2.69Å; R239-E350 IonicContact NH2-OE1 3.09Å; R239-E350 PolarHBondContact NH2-OE1 3.35Å
240	V	90.3	Very high	85.6	Confident	31 Å²	31	47.6 Å²	47.6	19%	0.188	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	107.7	-179.6	-174.3	0	0	0	0	110	T224 E226 N349 A355	T224-V240 HydrophobicContact CG2-CG1 3.75Å; E226-V240 HydrophobicContact CG-CG1 4.13Å; E226-V240 HydrophobicContact CG-CG2 4.08Å; V240-N349 PolarHBondContact N-O 2.79Å; V240-N349 WeakPolarHBondContact O-CB 3.38Å; V240-N349 PolarHBondContact O-ND2 3.12Å; V240-A355 HydrophobicContact CG2-CB 4.31Å
241	G	91.2	Very high	85.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.3	172.7	0	0	0	0	0	111.3	V86 F90 T224 V225	V86-G241 WeakPolarHBondContact O-CA 3.27Å; F90-G241 WeakPolarHBondContact O-CA 3.3Å; T224-G241 CarbonylContact C-O 3.58Å; T224-G241 WeakPolarHBondContact CA-O 3.42Å; V225-G241 PolarHBondContact N-O 2.99Å; V225-G241 PolarHBondContact O-N 2.83Å
242	K	93.1	Very high	85.8	Confident	63 Å²	63	45 Å²	45	27%	0.274	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	115.5	175.1	-172.2	-178.1	179.2	-175	0	110.3	N91 G92 I222 N244	N91-K242 CarbonylContact C-O 3.57Å; N91-K242 WeakPolarHBondContact CA-O 3.23Å; N91-K242 WeakPolarHBondContact OD1-CB 3.29Å; G92-K242 PolarHBondContact N-O 3.33Å; G92-K242 VanDerWaalsContact O-O 3.11Å; I222-K242 HydrophobicContact CG2-CD 4.22Å; I222-K242 VanDerWaalsContact CG2-CE 3.47Å; I222-K242 HydrophobicContact CG2-CG 3.79Å; K242-N244 WeakPolarHBondContact CE-OD1 3.47Å
243	L	95.6	Very high	85.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	114.6	172.3	176.6	66.8	0	0	0	110.2	L82 I83 V86 G92 I128 I222 V223 L245	L82-L243 HydrophobicContact CD2-CD1 4.49Å; I83-L243 HydrophobicContact CD1-CD1 3.73Å; I83-L243 HydrophobicContact CD1-CD2 3.49Å; I83-L243 VanDerWaalsContact CD1-CD2 3.49Å; I83-L243 HydrophobicContact CD1-CG 4.26Å; V86-L243 HydrophobicContact CG1-CB 4.03Å; V86-L243 HydrophobicContact CG2-CB 4.15Å; V86-L243 HydrophobicContact CG2-CD1 4.22Å; G92-L243 CarbonylContact O-C 3.51Å; G92-L243 WeakPolarHBondContact O-CA 3.43Å; I128-L243 HydrophobicContact CD1-CD2 4.29Å; I222-L243 CarbonylContact C-O 3.58Å; I222-L243 WeakPolarHBondContact CA-O 3.31Å; V223-L243 HydrophobicContact CB-CB 4.23Å; V223-L243 PolarHBondContact N-O 3.33Å; V223-L243 PolarHBondContact O-N 3.16Å; L243-L245 HydrophobicContact CD1-CD2 4.05Å; L243-L245 HydrophobicContact CD2-CD1 4.27Å; L243-L245 HydrophobicContact CD2-CD2 4.13Å; L243-L245 HydrophobicContact CD2-CG 4.15Å; L243-L245 HydrophobicContact CG-CD2 4.05Å; L243-L245 HydrophobicContact CG-CG 4.04Å
244	N	95.8	Very high	84.5	Confident	13 Å²	13	36.2 Å²	36.2	7%	0.07	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.1	171.2	-59.4	-43.4	0	0	0	109.5	G92 T93 I94 K242 V246	G92-N244 PolarHBondContact O-N 3.14Å; T93-N244 CarbonylContact C-O 3.57Å; T93-N244 WeakPolarHBondContact CA-O 3.47Å; T93-N244 HydrophobicContact CG2-CB 4.05Å; T93-N244 PolarHBondContact OG1-ND2 3.34Å; I94-N244 PolarHBondContact N-O 3.05Å; K242-N244 WeakPolarHBondContact CE-OD1 3.47Å; N244-V246 HydrophobicContact CB-CG2 4.38Å
245	L	95.5	Very high	84	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	111.4	172.7	-60.2	172.9	0	0	0	108.5	I94 V120 M121 F125 F221 L243	I94-L245 HydrophobicContact CB-CD2 3.97Å; I94-L245 HydrophobicContact CD1-CD2 3.84Å; I94-L245 HydrophobicContact CG1-CD2 4.14Å; V120-L245 HydrophobicContact CG1-CD2 4.38Å; M121-L245 HydrophobicContact CB-CD1 3.83Å; M121-L245 HydrophobicContact CE-CB 4.06Å; M121-L245 HydrophobicContact CE-CD1 4.22Å; M121-L245 HydrophobicContact CG-CD1 3.69Å; F125-L245 HydrophobicContact CE1-CD1 4.49Å; F221-L245 HydrophobicContact CB-CB 4.29Å; F221-L245 HydrophobicContact CD1-CD1 4.47Å; F221-L245 PolarHBondContact N-O 3.36Å; F221-L245 PolarHBondContact O-N 2.91Å; L243-L245 HydrophobicContact CD1-CD2 4.05Å; L243-L245 HydrophobicContact CD2-CD1 4.27Å; L243-L245 HydrophobicContact CD2-CD2 4.13Å; L243-L245 HydrophobicContact CD2-CG 4.15Å; L243-L245 HydrophobicContact CG-CD2 4.05Å; L243-L245 HydrophobicContact CG-CG 4.04Å
246	V	94.6	Very high	83.2	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	121.7	-168.6	-178.3	0	0	0	0	110.1	T93 I94 F95 A96 A219 I220 N244 L248 L303	T93-V246 HydrophobicContact CG2-CG2 4.32Å; I94-V246 PolarHBondContact O-N 2.96Å; F95-V246 WeakPolarHBondContact CA-O 3.41Å; F95-V246 HydrophobicContact CB-CB 3.63Å; F95-V246 HydrophobicContact CB-CG1 4.04Å; F95-V246 HydrophobicContact CB-CG2 4.29Å; A96-V246 PolarHBondContact N-O 2.92Å; A219-V246 WeakPolarHBondContact O-CA 3.36Å; I220-V246 HydrophobicContact CG1-CG1 4.14Å; I220-V246 HydrophobicContact CG1-CG2 4.18Å; I220-V246 HydrophobicContact CG2-CG2 4.07Å; N244-V246 HydrophobicContact CB-CG2 4.38Å; V246-L248 HydrophobicContact CG1-CD2 3.47Å; V246-L248 VanDerWaalsContact CG1-CD2 3.47Å; V246-L248 HydrophobicContact CG1-CG 3.91Å; V246-L303 HydrophobicContact CG2-CD2 3.99Å
247	D	92.7	Very high	82.4	Confident	6 Å²	6	32.7 Å²	32.7	3%	0.032	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	99	169.6	-177.3	32.2	0	0	0	107.9	K104 T105 V108 R203 H218 A219	K104-D247 WeakPolarHBondContact CB-OD1 3.2Å; T105-D247 PolarHBondContact N-OD1 3.05Å; T105-D247 PolarHBondContact OG1-OD1 3.46Å; T105-D247 PolarHBondContact OG1-OD2 3.44Å; V108-D247 HydrophobicContact CB-CB 4.48Å; V108-D247 HydrophobicContact CG1-CB 4.39Å; V108-D247 HydrophobicContact CG2-CB 4.3Å; R203-D247 IonicContact CZ-OD2 3.84Å; R203-D247 IonicContact NH1-OD2 3.29Å; R203-D247 PolarHBondContact NH1-OD2 3.35Å; R203-D247 VanDerWaalsContact NH1-OD2 3.09Å; R203-D247 IonicContact NH2-OD2 3.44Å; H218-D247 CarbonylContact C-O 3.55Å; H218-D247 WeakPolarHBondContact CA-O 3.32Å; A219-D247 HydrophobicContact CB-CB 4.41Å; A219-D247 PolarHBondContact N-O 3.11Å; A219-D247 PolarHBondContact O-N 3.34Å
248	L	91.6	Very high	81.3	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-74.4	156.9	-178.7	-61.9	176.3	0	0	0	111.2	F95 A96 Y97 K104 H218 V246 L274 L277 L299	F95-L248 HydrophobicContact CD2-CD1 3.91Å; A96-L248 VanDerWaalsContact O-CB 3.3Å; A96-L248 WeakPolarHBondContact O-CB 3.21Å; A96-L248 WeakPolarHBondContact O-CG 3.38Å; A96-L248 PolarHBondContact O-N 2.97Å; Y97-L248 HydrophobicContact CD2-CD1 3.86Å; Y97-L248 HydrophobicContact CG-CD1 4.49Å; K104-L248 WeakPolarHBondContact CE-O 3.37Å; H218-L248 HydrophobicContact CB-CD2 4.37Å; H218-L248 WeakPolarHBondContact ND1-CA 3.24Å; H218-L248 WeakPolarHBondContact ND1-CD2 3.43Å; V246-L248 HydrophobicContact CG1-CD2 3.47Å; V246-L248 VanDerWaalsContact CG1-CD2 3.47Å; V246-L248 HydrophobicContact CG1-CG 3.91Å; L248-L274 HydrophobicContact CB-CD2 4.45Å; L248-L274 HydrophobicContact CD1-CD2 4.4Å; L248-L277 HydrophobicContact CD1-CD2 3.94Å; L248-L299 HydrophobicContact CD2-CD1 3.82Å; L248-L299 HydrophobicContact CD2-CD2 3.81Å; L248-L299 HydrophobicContact CD2-CG 4.43Å
249	A	87.6	Confident	80	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-61.1	166.5	169.1	0	0	0	0	0	112	S215 H218 I270	S215-A249 WeakPolarHBondContact O-CA 3.45Å; S215-A249 WeakPolarHBondContact O-CB 3.48Å; H218-A249 VanDerWaalsContact CE1-CB 3.45Å; H218-A249 WeakPolarHBondContact CE1-CB 3.33Å; H218-A249 PolarHBondContact CE1-N 3.38Å; H218-A249 PolarHBondContact ND1-N 3.38Å; A249-I270 HydrophobicContact CB-CG2 3.57Å
250	G	83.4	Confident	78.9	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.01	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-60.3	135.3	173.8	0	0	0	0	0	113.5	T100 S215 E252 L274	T100-G250 VanDerWaalsContact OG1-CA 3.25Å; T100-G250 WeakPolarHBondContact OG1-CA 3.4Å; S215-G250 PolarHBondContact O-N 3.21Å; G250-E252 VanDerWaalsContact C-N 3.3Å; G250-E252 WeakPolarHBondContact CA-OE2 3.44Å; G250-L274 WeakPolarHBondContact O-CD1 3.39Å
251	S	83.2	Confident	78	Confident	17 Å²	17	44.7 Å²	44.7	12%	0.119	24%	0.242	C	C	.	.			trans	-85	4.1	176.8	70.3	0	0	0	0	114.7	Y97 G98 Q99	Y97-S251 WeakPolarHBondContact OH-CB 3.46Å; G98-S251 PolarHBondContact O-N 3.48Å; G98-S251 VanDerWaalsContact O-N 3.15Å; Q99-S251 PolarHBondContact N-OG 2.97Å
252	E	75.8	Confident	76.9	Confident	32 Å²	32	52.1 Å²	52.1	15%	0.15	28%	0.277	C	S	.	.			trans	-63.2	144.9	-175.7	57	-83.4	-165.7	0	0	113.7	Q99 T100 G250 N271	Q99-E252 HydrophobicContact CG-CB 4.12Å; T100-E252 WeakPolarHBondContact CB-OE1 3.18Å; T100-E252 WeakPolarHBondContact CB-OE2 3.42Å; T100-E252 PolarHBondContact N-OE2 2.99Å; T100-E252 PolarHBondContact OG1-OE1 3.48Å; T100-E252 PolarHBondContact OG1-OE2 3.27Å; T100-E252 VanDerWaalsContact OG1-OE2 3.04Å; G250-E252 VanDerWaalsContact C-N 3.3Å; G250-E252 WeakPolarHBondContact CA-OE2 3.44Å; E252-N271 PolarHBondContact O-OD1 2.93Å
253	R	63.8	Low	75.7	Confident	95 Å²	95	53.5 Å²	53.5	36%	0.358	28%	0.28	S	S	.	.			trans	-71.8	143.2	173.7	-63.2	-176.2	179.5	-153.7	-1.7	111.3	S255 K256 E328 E572	R253-S255 PolarHBondContact O-N 2.96Å; R253-K256 PolarHBondContact O-N 3.06Å; R253-E328 PolarHBondContact N-OE1 3.34Å; R253-E572 IonicContact NH1-OE1 3.55Å; R253-E572 IonicContact NH1-OE2 3.92Å
254	Q	60.1	Low	74.5	Confident	59 Å²	59	57.2 Å²	57.2	28%	0.276	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-51.7	-29.3	174.9	-82.5	173	10.5	0	0	113.4	K256 T257 A267 T268	Q254-K256 PolarHBondContact O-N 3.04Å; Q254-K256 VanDerWaalsContact O-N 3.07Å; Q254-T257 CarbonylContact O-C 3.57Å; Q254-T257 PolarHBondContact O-N 3.33Å; Q254-T257 PolarHBondContact O-OG1 3.43Å; Q254-A267 HydrophobicContact CG-CB 3.89Å; Q254-A267 PolarHBondContact NE2-O 2.96Å; Q254-T268 PolarHBondContact NE2-OG1 2.92Å
255	S	60	Low	73.3	Confident	103 Å²	103	64.2 Å²	64.2	72%	0.72	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-57.8	-24.3	178.6	54.2	0	0	0	0	113.8	R253	R253-S255 PolarHBondContact O-N 2.96Å
256	K	59.4	Low	72.1	Confident	67 Å²	67	64.8 Å²	64.8	29%	0.291	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-84.9	-19.2	174.1	-70.3	-168.9	174.4	-170.4	0	113.4	R253 Q254 Y324 N325 E328	R253-K256 PolarHBondContact O-N 3.06Å; Q254-K256 PolarHBondContact O-N 3.04Å; Q254-K256 VanDerWaalsContact O-N 3.07Å; K256-Y324 PolarHBondContact NZ-O 3.43Å; K256-N325 PolarHBondContact NZ-OD1 2.91Å; K256-E328 HydrophobicContact CD-CG 4.48Å
257	T	59.2	Low	70.9	Confident	50 Å²	50	65.3 Å²	65.3	31%	0.307	34%	0.336	S	S	.	.			trans	-103.2	98.8	-179	57	0	0	0	0	109	Q254 S259	Q254-T257 CarbonylContact O-C 3.57Å; Q254-T257 PolarHBondContact O-N 3.33Å; Q254-T257 PolarHBondContact O-OG1 3.43Å; T257-S259 PolarHBondContact O-N 3.38Å; T257-S259 PolarHBondContact O-OG 3.29Å; T257-S259 PolarHBondContact OG1-OG 3.04Å
258	L	59.8	Low	70	Confident	180 Å²	180	68 Å²	68	94%	0.942	35%	0.353	S	S	*	.			trans	-66.5	61.3	172.7	-69.1	165.4	0	0	0	110.8
259	S	58.4	Low	69.2	Low	17 Å²	17	71.3 Å²	71.3	12%	0.119	37%	0.369	C	S	.	.			trans	-108.1	121	-168.9	53.4	0	0	0	0	110.4	T257	T257-S259 PolarHBondContact O-N 3.38Å; T257-S259 PolarHBondContact O-OG 3.29Å; T257-S259 PolarHBondContact OG1-OG 3.04Å
260	E	65.1	Low	68.5	Low	177 Å²	177	72 Å²	72	83%	0.827	37%	0.372	S	S	*	.			trans	-101.3	156.3	179.6	-64.2	-175.4	168	0	0	111.7
261	G	72.5	Confident	68.1	Low	55 Å²	55	73.6 Å²	73.6	57%	0.567	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	-130.9	170.7	0	0	0	0	0	115	R263 L264 K265	G261-R263 PolarHBondContact O-N 3.09Å; G261-L264 WeakPolarHBondContact O-CB 3.14Å; G261-L264 PolarHBondContact O-N 3.35Å; G261-L264 VanDerWaalsContact O-N 3.13Å; G261-K265 PolarHBondContact O-N 2.85Å
262	E	68.7	Low	68.1	Low	156 Å²	156	76.6 Å²	76.6	73%	0.729	40%	0.395	S	S	*	.	H	α-helix	trans	-61.4	-29.5	-178.3	-64.8	-167.3	155	0	0	113.2	L264 K265 E266	E262-L264 VanDerWaalsContact C-N 3.28Å; E262-L264 PolarHBondContact O-N 3.2Å; E262-K265 PolarHBondContact O-N 2.74Å; E262-E266 WeakPolarHBondContact O-CB 3.49Å; E262-E266 PolarHBondContact O-N 3Å
263	R	66.4	Low	68.6	Low	92 Å²	92	75.1 Å²	75.1	35%	0.347	39%	0.388	S	S	.	.	H	α-helix	trans	-64.8	-34.3	177.1	-60.7	-178.6	-179.1	-158.4	-7.9	111.6	M210 N211 G261 A267	M210-R263 PolarHBondContact O-NH2 2.66Å; N211-R263 WeakPolarHBondContact ND2-CD 3.19Å; N211-R263 VanDerWaalsContact ND2-CZ 3.3Å; N211-R263 PolarHBondContact ND2-NE 2.98Å; N211-R263 PolarHBondContact OD1-NH1 3.42Å; N211-R263 VanDerWaalsContact OD1-NH1 3.07Å; N211-R263 PolarHBondContact OD1-NH2 2.75Å; G261-R263 PolarHBondContact O-N 3.09Å; R263-A267 VanDerWaalsContact O-CB 3.3Å; R263-A267 WeakPolarHBondContact O-CB 3.34Å; R263-A267 PolarHBondContact O-N 3.26Å
264	L	70.5	Confident	69.6	Low	78 Å²	78	71.1 Å²	71.1	41%	0.408	37%	0.374	S	S	.	.	H	α-helix	trans	-68.5	-44.6	176.3	-173.2	69.3	0	0	0	111	G261 E262 E266 A267 T268	G261-L264 WeakPolarHBondContact O-CB 3.14Å; G261-L264 PolarHBondContact O-N 3.35Å; G261-L264 VanDerWaalsContact O-N 3.13Å; E262-L264 VanDerWaalsContact C-N 3.28Å; E262-L264 PolarHBondContact O-N 3.2Å; L264-E266 VanDerWaalsContact C-N 3.32Å; L264-E266 PolarHBondContact O-N 2.85Å; L264-A267 PolarHBondContact O-N 3.3Å; L264-T268 WeakPolarHBondContact O-CB 3.49Å; L264-T268 PolarHBondContact O-N 3.29Å; L264-T268 PolarHBondContact O-OG1 2.77Å
265	K	71.9	Confident	70.8	Confident	160 Å²	160	71.5 Å²	71.5	70%	0.696	38%	0.383	S	S	*	.	H	α-helix	trans	-60.8	-43.3	175.5	-68.3	-175.4	178.6	179.9	0	111.2	G261 E262 T268 Q269	G261-K265 PolarHBondContact O-N 2.85Å; E262-K265 PolarHBondContact O-N 2.74Å; K265-T268 WeakPolarHBondContact O-CB 3.31Å; K265-T268 PolarHBondContact O-N 2.82Å; K265-Q269 WeakPolarHBondContact O-CG 3.3Å; K265-Q269 PolarHBondContact O-N 2.76Å; K265-Q269 VanDerWaalsContact O-N 3.1Å
266	E	68.5	Low	72.2	Confident	13 Å²	13	66.9 Å²	66.9	6%	0.061	35%	0.35	C	S	.	.	H	α-helix	trans	-61.4	-50.6	175.6	-177.7	-171	-171.8	0	0	112.1	Y150 R216 E262 L264 T268 Q269 I270	Y150-E266 HydrophobicContact CE2-CG 3.96Å; Y150-E266 WeakPolarHBondContact CE2-OE1 3.38Å; Y150-E266 VanDerWaalsContact CZ-OE1 3.27Å; Y150-E266 PolarHBondContact OH-OE1 3.49Å; R216-E266 WeakPolarHBondContact CD-OE1 3.33Å; R216-E266 IonicContact CZ-OE2 2.91Å; R216-E266 IonicContact NH1-OE1 2.93Å; R216-E266 IonicContact NH1-OE2 3.35Å; R216-E266 PolarHBondContact NH1-OE2 2.91Å; E262-E266 WeakPolarHBondContact O-CB 3.49Å; E262-E266 PolarHBondContact O-N 3Å; L264-E266 VanDerWaalsContact C-N 3.32Å; L264-E266 PolarHBondContact O-N 2.85Å; E266-T268 PolarHBondContact O-N 3.18Å; E266-Q269 PolarHBondContact O-N 3.08Å; E266-Q269 VanDerWaalsContact O-N 3.12Å; E266-I270 HydrophobicContact CG-CD1 3.94Å; E266-I270 WeakPolarHBondContact O-CD1 3.36Å; E266-I270 WeakPolarHBondContact O-CG1 3.37Å; E266-I270 PolarHBondContact O-N 3.27Å
267	A	69.4	Low	73.7	Confident	12 Å²	12	63.7 Å²	63.7	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-59.8	-29.9	175.9	0	0	0	0	0	112.1	Q254 R263 L264 N271	Q254-A267 HydrophobicContact CG-CB 3.89Å; Q254-A267 PolarHBondContact NE2-O 2.96Å; R263-A267 VanDerWaalsContact O-CB 3.3Å; R263-A267 WeakPolarHBondContact O-CB 3.34Å; R263-A267 PolarHBondContact O-N 3.26Å; L264-A267 PolarHBondContact O-N 3.3Å; A267-N271 WeakPolarHBondContact O-CB 3.48Å; A267-N271 VanDerWaalsContact O-CG 3.27Å; A267-N271 PolarHBondContact O-N 2.88Å; A267-N271 VanDerWaalsContact O-N 3.09Å
268	T	74.4	Confident	75.1	Confident	63 Å²	63	61.8 Å²	61.8	39%	0.387	33%	0.327	S	S	.	.	H	α-helix	trans	-68.5	-44.4	175.7	-53.9	0	0	0	0	111.2	Q254 L264 K265 E266 N271 L272	Q254-T268 PolarHBondContact NE2-OG1 2.92Å; L264-T268 WeakPolarHBondContact O-CB 3.49Å; L264-T268 PolarHBondContact O-N 3.29Å; L264-T268 PolarHBondContact O-OG1 2.77Å; K265-T268 WeakPolarHBondContact O-CB 3.31Å; K265-T268 PolarHBondContact O-N 2.82Å; E266-T268 PolarHBondContact O-N 3.18Å; T268-N271 PolarHBondContact O-N 3.06Å; T268-L272 WeakPolarHBondContact O-CB 3.35Å; T268-L272 PolarHBondContact O-N 3.15Å
269	Q	75.7	Confident	76.5	Confident	70 Å²	70	57.5 Å²	57.5	33%	0.327	31%	0.305	S	S	.	.	H	α-helix	trans	-68.9	-37	178.5	-63.7	-61.1	76.4	0	0	112.8	K265 E266 L272 S273	K265-Q269 WeakPolarHBondContact O-CG 3.3Å; K265-Q269 PolarHBondContact O-N 2.76Å; K265-Q269 VanDerWaalsContact O-N 3.1Å; E266-Q269 PolarHBondContact O-N 3.08Å; E266-Q269 VanDerWaalsContact O-N 3.12Å; Q269-L272 WeakPolarHBondContact O-CB 3.48Å; Q269-L272 PolarHBondContact O-N 2.65Å; Q269-S273 PolarHBondContact O-N 3.17Å; Q269-S273 VanDerWaalsContact O-N 3.09Å
270	I	73.2	Confident	78.1	Confident	14 Å²	14	56.7 Å²	56.7	7%	0.072	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-48.7	175.3	-65.7	156.6	0	0	0	109.9	R216 A249 E266 L272 S273 L274	R216-I270 HydrophobicContact CB-CD1 3.45Å; R216-I270 VanDerWaalsContact CB-CD1 3.45Å; R216-I270 HydrophobicContact CG-CD1 3.65Å; R216-I270 VanDerWaalsContact O-CD1 3.26Å; R216-I270 WeakPolarHBondContact O-CD1 3.17Å; R216-I270 VanDerWaalsContact O-CG1 3.27Å; R216-I270 WeakPolarHBondContact O-CG1 3.42Å; A249-I270 HydrophobicContact CB-CG2 3.57Å; E266-I270 HydrophobicContact CG-CD1 3.94Å; E266-I270 WeakPolarHBondContact O-CD1 3.36Å; E266-I270 WeakPolarHBondContact O-CG1 3.37Å; E266-I270 PolarHBondContact O-N 3.27Å; I270-L272 VanDerWaalsContact C-N 3.27Å; I270-L272 PolarHBondContact O-N 3.35Å; I270-S273 PolarHBondContact O-N 3.48Å; I270-S273 PolarHBondContact O-OG 3.44Å; I270-L274 HydrophobicContact CG2-CD1 4.46Å; I270-L274 PolarHBondContact O-N 3.47Å; I270-L274 VanDerWaalsContact O-N 3.16Å
271	N	74.9	Confident	79.3	Confident	35 Å²	35	48.3 Å²	48.3	19%	0.187	26%	0.26	C	S	.	.	H	α-helix	trans	-65.6	-32.2	178.6	-74	-4.5	0	0	0	112.1	E252 A267 T268 S275	E252-N271 PolarHBondContact O-OD1 2.93Å; A267-N271 WeakPolarHBondContact O-CB 3.48Å; A267-N271 VanDerWaalsContact O-CG 3.27Å; A267-N271 PolarHBondContact O-N 2.88Å; A267-N271 VanDerWaalsContact O-N 3.09Å; T268-N271 PolarHBondContact O-N 3.06Å; N271-S275 WeakPolarHBondContact O-CB 3.43Å; N271-S275 PolarHBondContact O-N 3.16Å; N271-S275 PolarHBondContact O-OG 2.77Å
272	L	82.7	Confident	80.1	Confident	80 Å²	80	46.9 Å²	46.9	42%	0.419	24%	0.241	S	C	.	.	H	α-helix	trans	-59.4	-54	172.6	-177.8	63.4	0	0	0	110.6	T268 Q269 I270 L274 S275 T276	T268-L272 WeakPolarHBondContact O-CB 3.35Å; T268-L272 PolarHBondContact O-N 3.15Å; Q269-L272 WeakPolarHBondContact O-CB 3.48Å; Q269-L272 PolarHBondContact O-N 2.65Å; I270-L272 VanDerWaalsContact C-N 3.27Å; I270-L272 PolarHBondContact O-N 3.35Å; L272-L274 VanDerWaalsContact C-N 3.34Å; L272-L274 PolarHBondContact O-N 2.77Å; L272-S275 PolarHBondContact O-N 2.9Å; L272-T276 WeakPolarHBondContact O-CB 3.46Å; L272-T276 PolarHBondContact O-N 2.68Å; L272-T276 PolarHBondContact O-OG1 3.19Å
273	S	85.3	Confident	81.1	Confident	2 Å²	2	40 Å²	40	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-40.4	-179.2	66.6	0	0	0	0	113.5	E152 H218 Q269 I270 L277	E152-S273 WeakPolarHBondContact OE1-CB 3.44Å; H218-S273 PolarHBondContact NE2-OG 2.83Å; Q269-S273 PolarHBondContact O-N 3.17Å; Q269-S273 VanDerWaalsContact O-N 3.09Å; I270-S273 PolarHBondContact O-N 3.48Å; I270-S273 PolarHBondContact O-OG 3.44Å; S273-L277 PolarHBondContact O-N 3.48Å
274	L	85.8	Confident	82.2	Confident	10 Å²	10	37.4 Å²	37.4	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-74	-35.5	176.9	-70.3	179.4	0	0	0	113	Y97 L248 G250 I270 L272 L277 G278	Y97-L274 HydrophobicContact CD2-CD2 4.43Å; Y97-L274 HydrophobicContact CE2-CD2 4.17Å; L248-L274 HydrophobicContact CB-CD2 4.45Å; L248-L274 HydrophobicContact CD1-CD2 4.4Å; G250-L274 WeakPolarHBondContact O-CD1 3.39Å; I270-L274 HydrophobicContact CG2-CD1 4.46Å; I270-L274 PolarHBondContact O-N 3.47Å; I270-L274 VanDerWaalsContact O-N 3.16Å; L272-L274 VanDerWaalsContact C-N 3.34Å; L272-L274 PolarHBondContact O-N 2.77Å; L274-L277 WeakPolarHBondContact O-CB 3.46Å; L274-L277 PolarHBondContact O-N 3.02Å; L274-G278 PolarHBondContact O-N 2.59Å
275	S	85	Confident	83.1	Confident	68 Å²	68	35.7 Å²	35.7	48%	0.476	20%	0.197	S	C	.	.	H	α-helix	trans	-65.9	-43.5	174.7	-60.8	0	0	0	0	110.5	N271 L272 L277 G278 N279	N271-S275 WeakPolarHBondContact O-CB 3.43Å; N271-S275 PolarHBondContact O-N 3.16Å; N271-S275 PolarHBondContact O-OG 2.77Å; L272-S275 PolarHBondContact O-N 2.9Å; S275-L277 PolarHBondContact O-N 2.83Å; S275-G278 CarbonylContact O-C 3.58Å; S275-G278 WeakPolarHBondContact O-CA 3.49Å; S275-G278 PolarHBondContact O-N 3.35Å; S275-N279 PolarHBondContact O-N 3.02Å; S275-N279 PolarHBondContact O-OD1 2.85Å
276	T	89	Confident	83.7	Confident	5 Å²	5	33 Å²	33	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-60.1	-44.1	173.8	-58.9	0	0	0	0	111.6	L272 G278 N279 V280 D296 T300	L272-T276 WeakPolarHBondContact O-CB 3.46Å; L272-T276 PolarHBondContact O-N 2.68Å; L272-T276 PolarHBondContact O-OG1 3.19Å; T276-G278 PolarHBondContact O-N 3.15Å; T276-N279 WeakPolarHBondContact O-CB 3.4Å; T276-N279 PolarHBondContact O-N 3.05Å; T276-N279 VanDerWaalsContact O-N 3.1Å; T276-V280 WeakPolarHBondContact O-CG2 3.25Å; T276-V280 PolarHBondContact O-N 2.8Å; T276-D296 HydrophobicContact CG2-CB 3.34Å; T276-T300 HydrophobicContact CG2-CG2 3.99Å
277	L	90.8	Very high	84	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-56.3	-42.8	172.4	-167	71.5	0	0	0	110.9	L248 S273 L274 S275 N279 V280 I281 L299 T300 L303 L307 Y335	L248-L277 HydrophobicContact CD1-CD2 3.94Å; S273-L277 PolarHBondContact O-N 3.48Å; L274-L277 WeakPolarHBondContact O-CB 3.46Å; L274-L277 PolarHBondContact O-N 3.02Å; S275-L277 PolarHBondContact O-N 2.83Å; L277-N279 PolarHBondContact O-N 3.4Å; L277-V280 PolarHBondContact O-N 2.73Å; L277-I281 WeakPolarHBondContact O-CG1 3.4Å; L277-I281 PolarHBondContact O-N 3.25Å; L277-L299 HydrophobicContact CD2-CD2 4.34Å; L277-T300 HydrophobicContact CB-CG2 4.17Å; L277-T300 HydrophobicContact CD1-CG2 3.78Å; L277-L303 HydrophobicContact CD1-CD1 4.42Å; L277-L307 HydrophobicContact CD1-CD1 3.46Å; L277-L307 VanDerWaalsContact CD1-CD1 3.46Å; L277-L307 HydrophobicContact CG-CD1 4.48Å; L277-Y335 WeakPolarHBondContact CB-OH 3.08Å; L277-Y335 WeakPolarHBondContact CD2-OH 3.33Å; L277-Y335 WeakPolarHBondContact CG-OH 3.12Å; L277-Y335 PolarHBondContact O-OH 2.87Å
278	G	88.7	Confident	84.5	Confident	9 Å²	9	44.3 Å²	44.3	9%	0.093	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-35.3	174.5	0	0	0	0	0	115.2	L274 S275 T276 S282 Y335	L274-G278 PolarHBondContact O-N 2.59Å; S275-G278 CarbonylContact O-C 3.58Å; S275-G278 WeakPolarHBondContact O-CA 3.49Å; S275-G278 PolarHBondContact O-N 3.35Å; T276-G278 PolarHBondContact O-N 3.15Å; G278-S282 WeakPolarHBondContact O-CB 3.36Å; G278-S282 PolarHBondContact O-N 3.26Å; G278-S282 PolarHBondContact O-OG 2.92Å; G278-Y335 WeakPolarHBondContact CA-OH 3.4Å; G278-Y335 PolarHBondContact N-OH 3.06Å; G278-Y335 VanDerWaalsContact N-OH 3.16Å
279	N	89.7	Confident	84.6	Confident	90 Å²	90	44 Å²	44	48%	0.481	26%	0.257	S	S	.	.	H	α-helix	trans	-67.9	-42.7	174.5	-66.8	-14.9	0	0	0	111	S275 T276 L277 I281 S282 A283 P293	S275-N279 PolarHBondContact O-N 3.02Å; S275-N279 PolarHBondContact O-OD1 2.85Å; T276-N279 WeakPolarHBondContact O-CB 3.4Å; T276-N279 PolarHBondContact O-N 3.05Å; T276-N279 VanDerWaalsContact O-N 3.1Å; L277-N279 PolarHBondContact O-N 3.4Å; N279-I281 PolarHBondContact O-N 3.02Å; N279-S282 PolarHBondContact O-N 2.98Å; N279-A283 VanDerWaalsContact O-CB 3.3Å; N279-A283 WeakPolarHBondContact O-CB 3.45Å; N279-A283 PolarHBondContact O-N 2.86Å; N279-P293 HydrophobicContact CB-CG 4.44Å
280	V	91.7	Very high	84.8	Confident	0 Å²	0	46 Å²	46	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-46.6	174.7	167.7	0	0	0	0	111	T276 L277 A283 L284 I292 P293 Y294 T300	T276-V280 WeakPolarHBondContact O-CG2 3.25Å; T276-V280 PolarHBondContact O-N 2.8Å; L277-V280 PolarHBondContact O-N 2.73Å; V280-A283 PolarHBondContact O-N 2.91Å; V280-L284 HydrophobicContact CG1-CD1 3.83Å; V280-L284 WeakPolarHBondContact O-CB 3.37Å; V280-L284 WeakPolarHBondContact O-CG 3.4Å; V280-L284 PolarHBondContact O-N 3.15Å; V280-I292 HydrophobicContact CB-CG2 4.34Å; V280-I292 HydrophobicContact CG1-CG2 3.8Å; V280-I292 HydrophobicContact CG2-CG2 4.26Å; V280-P293 HydrophobicContact CG2-CG 3.99Å; V280-P293 WeakPolarHBondContact CG2-O 3.45Å; V280-Y294 HydrophobicContact CG1-CD1 3.89Å; V280-Y294 HydrophobicContact CG1-CE1 3.53Å; V280-Y294 HydrophobicContact CG2-CD1 4.34Å; V280-T300 HydrophobicContact CB-CG2 4.42Å; V280-T300 HydrophobicContact CG2-CG2 3.83Å
281	I	90.8	Very high	85.4	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-64.2	-44.4	178.1	-66.3	-173.2	0	0	0	111.6	L277 N279 L284 V285 Y335 R338 A339 I342	L277-I281 WeakPolarHBondContact O-CG1 3.4Å; L277-I281 PolarHBondContact O-N 3.25Å; N279-I281 PolarHBondContact O-N 3.02Å; I281-L284 PolarHBondContact O-N 3.21Å; I281-V285 HydrophobicContact CG2-CG2 4.43Å; I281-V285 VanDerWaalsContact O-CG2 3.22Å; I281-V285 WeakPolarHBondContact O-CG2 3.3Å; I281-V285 PolarHBondContact O-N 3.35Å; I281-V285 VanDerWaalsContact O-N 3.15Å; I281-Y335 HydrophobicContact CD1-CD1 4.26Å; I281-Y335 HydrophobicContact CD1-CE1 3.34Å; I281-Y335 VanDerWaalsContact CD1-CZ 3.48Å; I281-Y335 VanDerWaalsContact CD1-OH 3.29Å; I281-Y335 WeakPolarHBondContact CD1-OH 3.45Å; I281-R338 HydrophobicContact CG2-CB 3.92Å; I281-A339 HydrophobicContact CD1-CB 4.06Å; I281-A339 HydrophobicContact CG2-CB 4.34Å; I281-I342 HydrophobicContact CB-CD1 4.22Å; I281-I342 HydrophobicContact CD1-CD1 4.13Å; I281-I342 HydrophobicContact CG1-CD1 3.74Å; I281-I342 HydrophobicContact CG2-CD1 3.94Å; I281-I342 HydrophobicContact CG2-CG1 4.37Å
282	S	88.7	Confident	86.1	Confident	26 Å²	26	52.2 Å²	52.2	18%	0.182	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-45.8	177.7	-54.5	0	0	0	0	111	G278 N279 L284 V285 D286	G278-S282 WeakPolarHBondContact O-CB 3.36Å; G278-S282 PolarHBondContact O-N 3.26Å; G278-S282 PolarHBondContact O-OG 2.92Å; N279-S282 PolarHBondContact O-N 2.98Å; S282-L284 VanDerWaalsContact C-N 3.34Å; S282-L284 PolarHBondContact O-N 2.97Å; S282-V285 PolarHBondContact O-N 3.38Å; S282-D286 WeakPolarHBondContact O-CB 3.38Å; S282-D286 PolarHBondContact O-N 3.41Å
283	A	90.8	Very high	86.5	Confident	10 Å²	10	49.5 Å²	49.5	8%	0.083	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-39.2	177.7	0	0	0	0	0	113.1	N279 V280 V285	N279-A283 VanDerWaalsContact O-CB 3.3Å; N279-A283 WeakPolarHBondContact O-CB 3.45Å; N279-A283 PolarHBondContact O-N 2.86Å; V280-A283 PolarHBondContact O-N 2.91Å; A283-V285 VanDerWaalsContact C-N 3.34Å
284	L	89.6	Confident	86.8	Confident	38 Å²	38	50.7 Å²	50.7	20%	0.199	31%	0.305	C	S	.	.	H	α-helix	trans	-65.6	-34.5	177.1	-82.5	164.9	0	0	0	113.2	V280 I281 S282 I292 L307 I342	V280-L284 HydrophobicContact CG1-CD1 3.83Å; V280-L284 WeakPolarHBondContact O-CB 3.37Å; V280-L284 WeakPolarHBondContact O-CG 3.4Å; V280-L284 PolarHBondContact O-N 3.15Å; I281-L284 PolarHBondContact O-N 3.21Å; S282-L284 VanDerWaalsContact C-N 3.34Å; S282-L284 PolarHBondContact O-N 2.97Å; L284-I292 HydrophobicContact CD2-CD1 3.44Å; L284-I292 VanDerWaalsContact CD2-CD1 3.44Å; L284-I292 HydrophobicContact CD2-CG1 4.44Å; L284-I292 HydrophobicContact CG-CD1 4.04Å; L284-I292 HydrophobicContact CG-CG2 4.35Å; L284-L307 HydrophobicContact CD1-CB 4.09Å; L284-L307 WeakPolarHBondContact CD1-O 3.21Å; L284-I342 HydrophobicContact CB-CG1 4.26Å; L284-I342 HydrophobicContact CD1-CD1 4.32Å; L284-I342 HydrophobicContact CD1-CG1 4.38Å; L284-I342 HydrophobicContact CD1-CG2 4.07Å
285	V	88.6	Confident	87	Confident	43 Å²	43	58.8 Å²	58.8	26%	0.261	34%	0.335	S	S	.	.	H	α-helix	trans	-90.5	-33.2	-174	176.5	0	0	0	0	111.9	I281 S282 A283 G287 R338 N341 I342	I281-V285 HydrophobicContact CG2-CG2 4.43Å; I281-V285 VanDerWaalsContact O-CG2 3.22Å; I281-V285 WeakPolarHBondContact O-CG2 3.3Å; I281-V285 PolarHBondContact O-N 3.35Å; I281-V285 VanDerWaalsContact O-N 3.15Å; S282-V285 PolarHBondContact O-N 3.38Å; A283-V285 VanDerWaalsContact C-N 3.34Å; V285-G287 PolarHBondContact O-N 2.8Å; V285-R338 VanDerWaalsContact CG2-O 3.23Å; V285-R338 WeakPolarHBondContact CG2-O 3.42Å; V285-N341 HydrophobicContact CB-CB 4.46Å; V285-N341 HydrophobicContact CG1-CB 3.7Å; V285-N341 HydrophobicContact CG2-CB 3.97Å; V285-I342 HydrophobicContact CG2-CG1 3.95Å
286	D	83.7	Confident	87.2	Confident	103 Å²	103	59.8 Å²	59.8	55%	0.551	34%	0.335	S	S	*	.	H	α-helix	trans	-66.1	-24.1	-177.8	-73.7	-13.6	0	0	0	112.4	S282 K288	S282-D286 WeakPolarHBondContact O-CB 3.38Å; S282-D286 PolarHBondContact O-N 3.41Å; D286-K288 PolarHBondContact O-N 2.94Å
287	G	76.3	Confident	87.3	Confident	70 Å²	70	59.6 Å²	59.6	72%	0.722	33%	0.334	S	S	*	.	S	Bend	trans	64.8	-3	178.6	0	0	0	0	0	115.1	V285	V285-G287 PolarHBondContact O-N 2.8Å
288	K	79.8	Confident	87.3	Confident	193 Å²	193	62.4 Å²	62.4	84%	0.839	35%	0.346	S	S	*	.			trans	-92	-25.7	179.6	-66.4	173.4	-173.7	175.6	0	112.7	D286 A290	D286-K288 PolarHBondContact O-N 2.94Å; K288-A290 PolarHBondContact O-N 2.64Å
289	S	76.3	Confident	87.4	Confident	57 Å²	57	62 Å²	62	40%	0.399	34%	0.342	S	S	.	.			trans	-78.7	114	-176.2	-59.6	0	0	0	0	110.1	H291	S289-H291 VanDerWaalsContact C-N 3.34Å
290	A	78.8	Confident	87.5	Confident	112 Å²	112	57.7 Å²	57.7	93%	0.926	32%	0.319	S	S	*	.	S	Bend	trans	-71.3	-31.5	175.1	0	0	0	0	0	112.4	K288	K288-A290 PolarHBondContact O-N 2.64Å
291	H	87.2	Confident	87.5	Confident	136 Å²	136	60.4 Å²	60.4	63%	0.63	33%	0.329	S	S	*	.	S	Bend	trans	-111.9	134.2	178.9	-179.5	-101.2	0	0	0	110.2	S289	S289-H291 VanDerWaalsContact C-N 3.34Å
292	I	89.4	Confident	87.6	Confident	43 Å²	43	61.8 Å²	61.8	22%	0.221	34%	0.336	C	S	.	.			trans	-107.3	123.9	176.5	-57	163.8	0	0	0	107.9	V280 L284 Y294	V280-I292 HydrophobicContact CB-CG2 4.34Å; V280-I292 HydrophobicContact CG1-CG2 3.8Å; V280-I292 HydrophobicContact CG2-CG2 4.26Å; L284-I292 HydrophobicContact CD2-CD1 3.44Å; L284-I292 VanDerWaalsContact CD2-CD1 3.44Å; L284-I292 HydrophobicContact CD2-CG1 4.44Å; L284-I292 HydrophobicContact CG-CD1 4.04Å; L284-I292 HydrophobicContact CG-CG2 4.35Å; I292-Y294 HydrophobicContact CB-CD2 3.88Å; I292-Y294 HydrophobicContact CB-CE2 3.47Å; I292-Y294 VanDerWaalsContact CB-CE2 3.47Å; I292-Y294 HydrophobicContact CD1-CE2 3.94Å; I292-Y294 HydrophobicContact CG1-CE2 4.33Å; I292-Y294 HydrophobicContact CG2-CD1 4.26Å; I292-Y294 HydrophobicContact CG2-CD2 3.76Å; I292-Y294 HydrophobicContact CG2-CE1 3.9Å; I292-Y294 HydrophobicContact CG2-CE2 3.34Å; I292-Y294 HydrophobicContact CG2-CG 4.2Å; I292-Y294 VanDerWaalsContact CG2-CZ 3.42Å; I292-Y294 PolarHBondContact O-N 2.71Å
293	P	90.5	Very high	87.8	Confident	22 Å²	22	60.8 Å²	60.8	14%	0.143	33%	0.328	C	S	.	.			trans	-78.6	57.9	-171.4	32.7	-36.6	0	0	0	112.9	N279 V280 R295 D296	N279-P293 HydrophobicContact CB-CG 4.44Å; V280-P293 HydrophobicContact CG2-CG 3.99Å; V280-P293 WeakPolarHBondContact CG2-O 3.45Å; P293-R295 PolarHBondContact O-N 2.77Å; P293-D296 WeakPolarHBondContact CB-OD2 3.42Å
294	Y	91.1	Very high	87.8	Confident	28 Å²	28	62.9 Å²	62.9	11%	0.11	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-65.8	-28.4	177.9	-65.1	-71.9	0	0	0	112.5	V280 I292 D296 T300 R301 Q304 L307	V280-Y294 HydrophobicContact CG1-CD1 3.89Å; V280-Y294 HydrophobicContact CG1-CE1 3.53Å; V280-Y294 HydrophobicContact CG2-CD1 4.34Å; I292-Y294 HydrophobicContact CB-CD2 3.88Å; I292-Y294 HydrophobicContact CB-CE2 3.47Å; I292-Y294 VanDerWaalsContact CB-CE2 3.47Å; I292-Y294 HydrophobicContact CD1-CE2 3.94Å; I292-Y294 HydrophobicContact CG1-CE2 4.33Å; I292-Y294 HydrophobicContact CG2-CD1 4.26Å; I292-Y294 HydrophobicContact CG2-CD2 3.76Å; I292-Y294 HydrophobicContact CG2-CE1 3.9Å; I292-Y294 HydrophobicContact CG2-CE2 3.34Å; I292-Y294 HydrophobicContact CG2-CG 4.2Å; I292-Y294 VanDerWaalsContact CG2-CZ 3.42Å; I292-Y294 PolarHBondContact O-N 2.71Å; Y294-D296 VanDerWaalsContact C-N 3.34Å; Y294-D296 PolarHBondContact O-N 3.19Å; Y294-T300 CarbonylContact O-C 3.55Å; Y294-T300 WeakPolarHBondContact O-CB 3.35Å; Y294-T300 PolarHBondContact O-OG1 3.38Å; Y294-R301 WeakPolarHBondContact O-CG 3.33Å; Y294-R301 PolarHBondContact O-N 2.83Å; Y294-R301 VanDerWaalsContact O-N 3.15Å; Y294-Q304 HydrophobicContact CD1-CB 3.93Å; Y294-Q304 HydrophobicContact CD1-CG 3.84Å; Y294-Q304 HydrophobicContact CD2-CG 3.85Å; Y294-Q304 HydrophobicContact CE1-CB 4.29Å; Y294-Q304 HydrophobicContact CE1-CG 4.03Å; Y294-Q304 HydrophobicContact CE2-CG 4.02Å; Y294-Q304 HydrophobicContact CG-CB 4.17Å; Y294-Q304 HydrophobicContact CG-CG 3.75Å; Y294-L307 HydrophobicContact CE1-CB 4.49Å; Y294-L307 WeakPolarHBondContact CE1-O 3.4Å; Y294-L307 PolarHBondContact OH-O 2.85Å
295	R	90.7	Very high	87.8	Confident	180 Å²	180	63.6 Å²	63.6	68%	0.679	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-74.7	-21.5	-172.4	-70.8	-174.1	173.2	-174.1	-0.9	114.4	P293 S297	P293-R295 PolarHBondContact O-N 2.77Å; R295-S297 PolarHBondContact O-N 3.24Å
296	D	88.9	Confident	87.9	Confident	89 Å²	89	61.6 Å²	61.6	48%	0.476	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-63.4	-22.5	-174	-67.7	27.2	0	0	0	113.8	T276 P293 Y294	T276-D296 HydrophobicContact CG2-CB 3.34Å; P293-D296 WeakPolarHBondContact CB-OD2 3.42Å; Y294-D296 VanDerWaalsContact C-N 3.34Å; Y294-D296 PolarHBondContact O-N 3.19Å
297	S	90.3	Very high	88.2	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.007	30%	0.302	C	S	.	.			trans	-140.8	150	173.4	78.8	0	0	0	0	112.6	E152 R295 L299 T300 R301	E152-S297 VanDerWaalsContact OE2-CA 3.27Å; E152-S297 WeakPolarHBondContact OE2-CA 3.47Å; R295-S297 PolarHBondContact O-N 3.24Å; S297-L299 PolarHBondContact O-N 3.04Å; S297-T300 PolarHBondContact N-OG1 3.29Å; S297-T300 PolarHBondContact O-N 2.98Å; S297-T300 PolarHBondContact O-OG1 3.05Å; S297-T300 WeakPolarHBondContact OG-CB 3.5Å; S297-T300 WeakPolarHBondContact OG-CG2 3.37Å; S297-T300 PolarHBondContact OG-N 3.34Å; S297-T300 PolarHBondContact OG-OG1 2.82Å; S297-R301 WeakPolarHBondContact O-CG 3.34Å; S297-R301 PolarHBondContact O-N 2.83Å
298	K	91.1	Very high	88.7	Confident	60 Å²	60	54.7 Å²	54.7	26%	0.261	28%	0.282	S	S	.	.	H	α-helix	trans	-60	-34.6	173.9	-60.5	-60	178.5	128.1	0	111.7	I149 E152 I168 R301 L302	I149-K298 HydrophobicContact CG2-CB 4.31Å; E152-K298 VanDerWaalsContact O-CG 3.31Å; E152-K298 WeakPolarHBondContact O-CG 3.49Å; E152-K298 PolarHBondContact OE2-N 3.33Å; I168-K298 HydrophobicContact CD1-CB 3.98Å; I168-K298 HydrophobicContact CD1-CD 3.63Å; I168-K298 HydrophobicContact CD1-CG 4.37Å; I168-K298 HydrophobicContact CG1-CD 4.21Å; K298-R301 PolarHBondContact O-N 3.01Å; K298-L302 WeakPolarHBondContact O-CG 3.34Å; K298-L302 PolarHBondContact O-N 3.3Å
299	L	91.5	Very high	89.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-52.2	176.8	178.9	65.5	0	0	0	111.5	I149 H218 I220 L248 L277 S297 R301 L302 L303	I149-L299 HydrophobicContact CD1-CB 4Å; I149-L299 HydrophobicContact CD1-CD1 3.96Å; H218-L299 HydrophobicContact CB-CD1 4.35Å; I220-L299 HydrophobicContact CD1-CD1 4.31Å; L248-L299 HydrophobicContact CD2-CD1 3.82Å; L248-L299 HydrophobicContact CD2-CD2 3.81Å; L248-L299 HydrophobicContact CD2-CG 4.43Å; L277-L299 HydrophobicContact CD2-CD2 4.34Å; S297-L299 PolarHBondContact O-N 3.04Å; L299-R301 VanDerWaalsContact C-N 3.28Å; L299-R301 PolarHBondContact O-N 3.44Å; L299-L302 PolarHBondContact O-N 3.39Å; L299-L303 HydrophobicContact CD1-CD1 3.71Å; L299-L303 HydrophobicContact CD1-CG 4.27Å; L299-L303 HydrophobicContact CG-CD1 4.12Å; L299-L303 WeakPolarHBondContact O-CB 3.43Å; L299-L303 WeakPolarHBondContact O-CG 3.3Å; L299-L303 PolarHBondContact O-N 2.91Å
300	T	92.1	Very high	89.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-29.7	179.6	49.3	0	0	0	0	112.6	T276 L277 V280 Y294 S297 Q304	T276-T300 HydrophobicContact CG2-CG2 3.99Å; L277-T300 HydrophobicContact CB-CG2 4.17Å; L277-T300 HydrophobicContact CD1-CG2 3.78Å; V280-T300 HydrophobicContact CB-CG2 4.42Å; V280-T300 HydrophobicContact CG2-CG2 3.83Å; Y294-T300 CarbonylContact O-C 3.55Å; Y294-T300 WeakPolarHBondContact O-CB 3.35Å; Y294-T300 PolarHBondContact O-OG1 3.38Å; S297-T300 PolarHBondContact N-OG1 3.29Å; S297-T300 PolarHBondContact O-N 2.98Å; S297-T300 PolarHBondContact O-OG1 3.05Å; S297-T300 WeakPolarHBondContact OG-CB 3.5Å; S297-T300 WeakPolarHBondContact OG-CG2 3.37Å; S297-T300 PolarHBondContact OG-N 3.34Å; S297-T300 PolarHBondContact OG-OG1 2.82Å; T300-Q304 PolarHBondContact O-N 3.02Å
301	R	91.8	Very high	90.4	Very high	57 Å²	57	40.4 Å²	40.4	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-43.8	171	-71.2	-173.8	70.7	-178.2	-1	112.2	I168 I176 Y294 S297 K298 L299 L303 Q304	I168-R301 HydrophobicContact CD1-CB 3.84Å; I176-R301 WeakPolarHBondContact CD1-O 3.44Å; Y294-R301 WeakPolarHBondContact O-CG 3.33Å; Y294-R301 PolarHBondContact O-N 2.83Å; Y294-R301 VanDerWaalsContact O-N 3.15Å; S297-R301 WeakPolarHBondContact O-CG 3.34Å; S297-R301 PolarHBondContact O-N 2.83Å; K298-R301 PolarHBondContact O-N 3.01Å; L299-R301 VanDerWaalsContact C-N 3.28Å; L299-R301 PolarHBondContact O-N 3.44Å; R301-L303 VanDerWaalsContact C-N 3.35Å; R301-Q304 WeakPolarHBondContact O-CB 3.45Å
302	L	92.2	Very high	90.7	Very high	30 Å²	30	35.7 Å²	35.7	16%	0.157	18%	0.177	C	C	.	.	H	α-helix	trans	-72.2	-29	179	-70.2	175.9	0	0	0	113.2	L147 I149 I154 I168 I176 V178 I220 K298 L299	L147-L302 HydrophobicContact CD1-CD1 4.28Å; I149-L302 HydrophobicContact CD1-CD1 3.89Å; I149-L302 HydrophobicContact CG1-CD1 4.5Å; I154-L302 HydrophobicContact CD1-CD1 4.06Å; I168-L302 HydrophobicContact CD1-CD2 4.11Å; I168-L302 HydrophobicContact CD1-CG 3.92Å; I168-L302 HydrophobicContact CG1-CD2 4.3Å; I176-L302 HydrophobicContact CG2-CD2 4.37Å; V178-L302 HydrophobicContact CG2-CD1 4.3Å; V178-L302 HydrophobicContact CG2-CD2 3.53Å; I220-L302 HydrophobicContact CD1-CD1 4.27Å; K298-L302 WeakPolarHBondContact O-CG 3.34Å; K298-L302 PolarHBondContact O-N 3.3Å; L299-L302 PolarHBondContact O-N 3.39Å
303	L	92.1	Very high	91	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	11.7	179.3	-62.3	-178.9	0	0	0	113.7	T93 V246 L277 L299 R301 D305 S306 L307	T93-L303 HydrophobicContact CG2-CD2 4.24Å; V246-L303 HydrophobicContact CG2-CD2 3.99Å; L277-L303 HydrophobicContact CD1-CD1 4.42Å; L299-L303 HydrophobicContact CD1-CD1 3.71Å; L299-L303 HydrophobicContact CD1-CG 4.27Å; L299-L303 HydrophobicContact CG-CD1 4.12Å; L299-L303 WeakPolarHBondContact O-CB 3.43Å; L299-L303 WeakPolarHBondContact O-CG 3.3Å; L299-L303 PolarHBondContact O-N 2.91Å; R301-L303 VanDerWaalsContact C-N 3.35Å; L303-D305 VanDerWaalsContact C-N 3.31Å; L303-D305 PolarHBondContact O-N 3.44Å; L303-S306 WeakPolarHBondContact O-CA 3.44Å; L303-S306 WeakPolarHBondContact O-CB 3.27Å; L303-S306 PolarHBondContact O-N 3.34Å; L303-L307 HydrophobicContact CB-CD1 4.31Å; L303-L307 PolarHBondContact O-N 3.25Å
304	Q	91.8	Very high	91.2	Very high	54 Å²	54	33 Å²	33	25%	0.252	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-45.3	179.7	-179.4	174.4	-47	0	0	111.4	I176 Y294 T300 R301 S306 L307	I176-Q304 HydrophobicContact CD1-CB 3.99Å; I176-Q304 HydrophobicContact CD1-CG 4.37Å; I176-Q304 VanDerWaalsContact CD1-OE1 3.22Å; Y294-Q304 HydrophobicContact CD1-CB 3.93Å; Y294-Q304 HydrophobicContact CD1-CG 3.84Å; Y294-Q304 HydrophobicContact CD2-CG 3.85Å; Y294-Q304 HydrophobicContact CE1-CB 4.29Å; Y294-Q304 HydrophobicContact CE1-CG 4.03Å; Y294-Q304 HydrophobicContact CE2-CG 4.02Å; Y294-Q304 HydrophobicContact CG-CB 4.17Å; Y294-Q304 HydrophobicContact CG-CG 3.75Å; T300-Q304 PolarHBondContact O-N 3.02Å; R301-Q304 WeakPolarHBondContact O-CB 3.45Å; Q304-S306 PolarHBondContact O-N 3.33Å; Q304-L307 PolarHBondContact O-N 3.03Å
305	D	89.4	Confident	91.4	Very high	53 Å²	53	31.7 Å²	31.7	28%	0.283	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-30.2	177	-66.1	-30.5	0	0	0	112.3	L303 G309 N310 S311	L303-D305 VanDerWaalsContact C-N 3.31Å; L303-D305 PolarHBondContact O-N 3.44Å; D305-G309 CarbonylContact O-C 3.59Å; D305-G309 VanDerWaalsContact O-CA 3.29Å; D305-G309 WeakPolarHBondContact O-CA 3.27Å; D305-G309 PolarHBondContact O-N 2.82Å; D305-N310 PolarHBondContact O-N 2.97Å; D305-S311 WeakPolarHBondContact O-CB 3.34Å; D305-S311 PolarHBondContact O-N 3.4Å
306	S	91.6	Very high	91.6	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.007	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-26.2	179.9	-50.8	0	0	0	0	113.4	T93 L303 Q304 T313 N344	T93-S306 WeakPolarHBondContact CB-OG 3.37Å; T93-S306 WeakPolarHBondContact CG2-OG 3.48Å; T93-S306 WeakPolarHBondContact OG1-CB 3.34Å; T93-S306 PolarHBondContact OG1-OG 3.43Å; L303-S306 WeakPolarHBondContact O-CA 3.44Å; L303-S306 WeakPolarHBondContact O-CB 3.27Å; L303-S306 PolarHBondContact O-N 3.34Å; Q304-S306 PolarHBondContact O-N 3.33Å; S306-T313 WeakPolarHBondContact O-CB 3.29Å; S306-T313 PolarHBondContact O-OG1 3.26Å; S306-N344 PolarHBondContact O-ND2 3.13Å
307	L	89.9	Confident	92	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.6	86.5	-172.3	-62.2	175.3	0	0	0	109.9	F95 L277 L284 Y294 L303 Q304 I342	F95-L307 HydrophobicContact CE1-CD2 4.19Å; F95-L307 HydrophobicContact CZ-CD2 4.35Å; L277-L307 HydrophobicContact CD1-CD1 3.46Å; L277-L307 VanDerWaalsContact CD1-CD1 3.46Å; L277-L307 HydrophobicContact CG-CD1 4.48Å; L284-L307 HydrophobicContact CD1-CB 4.09Å; L284-L307 WeakPolarHBondContact CD1-O 3.21Å; Y294-L307 HydrophobicContact CE1-CB 4.49Å; Y294-L307 WeakPolarHBondContact CE1-O 3.4Å; Y294-L307 PolarHBondContact OH-O 2.85Å; L303-L307 HydrophobicContact CB-CD1 4.31Å; L303-L307 PolarHBondContact O-N 3.25Å; Q304-L307 PolarHBondContact O-N 3.03Å; L307-I342 HydrophobicContact CD2-CD1 4.09Å
308	G	85.1	Confident	92.2	Very high	28 Å²	28	18.9 Å²	18.9	29%	0.289	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	1	-178.4	0	0	0	0	0	115.1	N344	G308-N344 VanDerWaalsContact CA-OD1 3.31Å; G308-N344 WeakPolarHBondContact CA-OD1 3.46Å; G308-N344 PolarHBondContact N-OD1 3.04Å
309	G	88.5	Confident	92.3	Very high	21 Å²	21	16.1 Å²	16.1	22%	0.216	9%	0.09	C	C	.	.	S	Bend	trans	-110.8	-149.8	-174.8	0	0	0	0	0	115.2	D305 S311 K345	D305-G309 CarbonylContact O-C 3.59Å; D305-G309 VanDerWaalsContact O-CA 3.29Å; D305-G309 WeakPolarHBondContact O-CA 3.27Å; D305-G309 PolarHBondContact O-N 2.82Å; G309-S311 PolarHBondContact O-N 3Å; G309-K345 PolarHBondContact O-N 2.89Å
310	N	90.4	Very high	92.3	Very high	39 Å²	39	16.1 Å²	16.1	21%	0.209	9%	0.09	C	C	.	.	S	Bend	trans	-88.2	73.6	179	178.9	21.5	0	0	0	111.1	N91 D305 K347 N349	N91-N310 VanDerWaalsContact CB-O 3.27Å; N91-N310 WeakPolarHBondContact CB-O 3.45Å; N91-N310 PolarHBondContact ND2-O 2.8Å; D305-N310 PolarHBondContact O-N 2.97Å; N310-K347 PolarHBondContact OD1-N 3.38Å; N310-K347 PolarHBondContact OD1-O 3.28Å; N310-N349 PolarHBondContact ND2-OD1 3.36Å
311	S	91.9	Very high	92.3	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.007	9%	0.09	C	C	.	.	S	Bend	trans	-161.4	145.8	174.4	-172.5	0	0	0	0	111.5	N91 T93 D305 G309 N344	N91-S311 WeakPolarHBondContact O-CA 3.42Å; N91-S311 PolarHBondContact O-OG 3.28Å; T93-S311 PolarHBondContact OG1-OG 2.86Å; D305-S311 WeakPolarHBondContact O-CB 3.34Å; D305-S311 PolarHBondContact O-N 3.4Å; G309-S311 PolarHBondContact O-N 3Å; S311-N344 VanDerWaalsContact O-CB 3.29Å; S311-N344 WeakPolarHBondContact O-CB 3.44Å; S311-N344 PolarHBondContact O-ND2 3.5Å
312	K	94	Very high	92.3	Very high	37 Å²	37	13.4 Å²	13.4	16%	0.161	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.5	162.3	-65.3	-166.9	-176.4	-176.8	0	108.3	E10 L82 S85 N91 G92 T93 P346	E10-K312 WeakPolarHBondContact OE2-CD 3.31Å; E10-K312 WeakPolarHBondContact OE2-CE 3.44Å; E10-K312 WeakPolarHBondContact OE2-CG 3.04Å; E10-K312 IonicContact OE2-NZ 3.08Å; L82-K312 HydrophobicContact CD1-CB 3.33Å; L82-K312 WeakPolarHBondContact CD1-O 3.41Å; S85-K312 PolarHBondContact OG-NZ 3.31Å; N91-K312 PolarHBondContact O-N 3.36Å; G92-K312 CarbonylContact C-O 3.42Å; G92-K312 VanDerWaalsContact CA-O 3.29Å; G92-K312 WeakPolarHBondContact CA-O 3.5Å; T93-K312 PolarHBondContact N-O 2.84Å; K312-P346 HydrophobicContact CG-CB 3.6Å; K312-P346 HydrophobicContact CG-CG 3.88Å
313	T	95.2	Very high	92.1	Very high	6 Å²	6	13.4 Å²	13.4	4%	0.037	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134.7	-171.5	-59.1	0	0	0	0	111.2	V12 K13 T93 F95 S306 N344	V12-T313 HydrophobicContact CG1-CG2 4Å; K13-T313 PolarHBondContact N-O 3.35Å; T93-T313 HydrophobicContact CG2-CG2 4.4Å; T93-T313 CarbonylContact O-C 3.56Å; T93-T313 WeakPolarHBondContact O-CA 3.15Å; F95-T313 HydrophobicContact CD1-CG2 3.81Å; F95-T313 HydrophobicContact CE1-CG2 3.46Å; F95-T313 VanDerWaalsContact CE1-CG2 3.46Å; S306-T313 WeakPolarHBondContact O-CB 3.29Å; S306-T313 PolarHBondContact O-OG1 3.26Å; T313-N344 PolarHBondContact OG1-ND2 3.44Å
314	I	95.4	Very high	91.8	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.021	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.2	173.1	-57.2	-176.1	0	0	0	108.8	K13 V15 T78 F79 L82 T93 I94 F95	K13-I314 HydrophobicContact CB-CG1 4.24Å; K13-I314 CarbonylContact O-C 3.6Å; K13-I314 VanDerWaalsContact O-CA 3.3Å; K13-I314 WeakPolarHBondContact O-CA 3.5Å; V15-I314 HydrophobicContact CG2-CG2 4.37Å; T78-I314 HydrophobicContact CG2-CD1 3.92Å; T78-I314 HydrophobicContact CG2-CG2 3.87Å; T78-I314 WeakPolarHBondContact O-CD1 3.43Å; F79-I314 HydrophobicContact CD1-CD1 4.2Å; F79-I314 HydrophobicContact CD1-CG2 4.37Å; F79-I314 HydrophobicContact CE1-CG2 4Å; L82-I314 HydrophobicContact CB-CD1 3.73Å; L82-I314 HydrophobicContact CD1-CG1 4.47Å; L82-I314 HydrophobicContact CD2-CD1 3.92Å; L82-I314 HydrophobicContact CD2-CG1 4.03Å; L82-I314 HydrophobicContact CG-CD1 4.27Å; T93-I314 PolarHBondContact O-N 3Å; I94-I314 WeakPolarHBondContact CA-O 3.42Å; F95-I314 PolarHBondContact N-O 3.41Å
315	M	95.4	Very high	91.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.6	170.2	177.9	177.1	175.9	0	0	109.7	K13 V14 V15 F95 Y97 A317 Y335 A336 A339	K13-M315 PolarHBondContact O-N 3.35Å; V14-M315 WeakPolarHBondContact CA-O 3.34Å; V14-M315 HydrophobicContact CG1-CB 4.44Å; V14-M315 HydrophobicContact CG1-CG 4.49Å; V14-M315 HydrophobicContact CG1-SD 4.42Å; V14-M315 HydrophobicContact CG2-CB 4.17Å; V15-M315 PolarHBondContact N-O 2.92Å; F95-M315 HydrophobicContact CD2-CB 4.49Å; F95-M315 HydrophobicContact CD2-CG 4.14Å; F95-M315 HydrophobicContact CE1-CB 3.89Å; F95-M315 HydrophobicContact CE1-CG 4.42Å; F95-M315 HydrophobicContact CE2-CB 3.78Å; F95-M315 HydrophobicContact CE2-CE 4.35Å; F95-M315 HydrophobicContact CE2-CG 3.38Å; F95-M315 HydrophobicContact CE2-SD 3.83Å; F95-M315 HydrophobicContact CZ-CB 3.44Å; F95-M315 VanDerWaalsContact CZ-CB 3.44Å; F95-M315 HydrophobicContact CZ-CG 3.55Å; F95-M315 HydrophobicContact CZ-SD 3.93Å; Y97-M315 HydrophobicContact CD1-CE 3.44Å; Y97-M315 VanDerWaalsContact CD1-CE 3.44Å; Y97-M315 HydrophobicContact CE1-CE 4.31Å; Y97-M315 HydrophobicContact CG-CE 3.78Å; M315-A317 HydrophobicContact CE-CB 4.24Å; M315-Y335 HydrophobicContact CE-CD1 3.62Å; M315-Y335 HydrophobicContact CE-CE1 4.1Å; M315-Y335 HydrophobicContact SD-CD1 4.35Å; M315-A336 HydrophobicContact CE-CB 3.96Å; M315-A336 HydrophobicContact SD-CB 4.33Å; M315-A339 HydrophobicContact SD-CB 3.53Å; M315-A339 VanDerWaalsContact SD-CB 3.53Å
316	I	95.4	Very high	91.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	110.3	170.7	-51.1	163	0	0	0	108.1	V15 F79 I94 F95 Y97 T107	V15-I316 HydrophobicContact CG2-CB 4.2Å; V15-I316 HydrophobicContact CG2-CG1 3.87Å; V15-I316 HydrophobicContact CG2-CG2 4.22Å; V15-I316 CarbonylContact O-C 3.58Å; V15-I316 WeakPolarHBondContact O-CA 3.44Å; F79-I316 HydrophobicContact CE1-CD1 3.65Å; F79-I316 HydrophobicContact CE1-CG1 3.83Å; F79-I316 HydrophobicContact CE2-CD1 4.32Å; F79-I316 HydrophobicContact CZ-CD1 3.31Å; F79-I316 HydrophobicContact CZ-CG1 3.77Å; I94-I316 HydrophobicContact CG2-CD1 3.52Å; I94-I316 HydrophobicContact CG2-CG1 4.16Å; F95-I316 PolarHBondContact O-N 3.35Å; Y97-I316 PolarHBondContact N-O 3.49Å; T107-I316 HydrophobicContact CG2-CD1 3.9Å; T107-I316 HydrophobicContact CG2-CG2 4.14Å
317	A	95.7	Very high	91.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	101.3	175.4	0	0	0	0	0	110.1	V15 V16 R17 Y97 M315 T332 A336	V15-A317 PolarHBondContact O-N 2.87Å; V16-A317 WeakPolarHBondContact CA-O 3.44Å; V16-A317 HydrophobicContact CG2-CB 4.11Å; R17-A317 PolarHBondContact N-O 3.25Å; Y97-A317 CarbonylContact O-C 3.47Å; Y97-A317 WeakPolarHBondContact O-CA 3.24Å; M315-A317 HydrophobicContact CE-CB 4.24Å; A317-T332 HydrophobicContact CB-CG2 4.13Å; A317-A336 HydrophobicContact CB-CB 3.76Å
318	N	94.8	Very high	91.3	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	121.3	178.9	-68.1	103.4	0	0	0	111.2	R17 Y97 T102 G103 K104 T107	R17-N318 WeakPolarHBondContact O-CA 3.17Å; Y97-N318 PolarHBondContact O-N 2.89Å; T102-N318 VanDerWaalsContact CB-O 3.29Å; T102-N318 WeakPolarHBondContact CB-O 3.32Å; T102-N318 VanDerWaalsContact OG1-CB 3.25Å; T102-N318 WeakPolarHBondContact OG1-CB 3.33Å; T102-N318 PolarHBondContact OG1-O 3.41Å; G103-N318 PolarHBondContact O-ND2 3.38Å; K104-N318 WeakPolarHBondContact CA-OD1 3.34Å; K104-N318 HydrophobicContact CG-CB 4.1Å; T107-N318 PolarHBondContact OG1-ND2 2.93Å
319	I	94.2	Very high	91.6	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	157.3	-178.6	62.3	172.7	0	0	0	112.1	V16 R17 C18 R19 V34 V43 T329 T332 L333	V16-I319 HydrophobicContact CG1-CD1 3.62Å; V16-I319 HydrophobicContact CG1-CG1 3.93Å; R17-I319 PolarHBondContact O-N 3.4Å; C18-I319 WeakPolarHBondContact CA-O 3.33Å; C18-I319 HydrophobicContact CB-CD1 4.2Å; C18-I319 HydrophobicContact CB-CG1 3.84Å; R19-I319 PolarHBondContact N-O 3.44Å; V34-I319 HydrophobicContact CG1-CD1 3.76Å; V34-I319 HydrophobicContact CG2-CD1 4.48Å; V43-I319 HydrophobicContact CG1-CD1 4.18Å; I319-T329 HydrophobicContact CB-CG2 4.05Å; I319-T329 HydrophobicContact CD1-CG2 4.17Å; I319-T329 HydrophobicContact CG2-CG2 4.13Å; I319-T332 HydrophobicContact CG2-CG2 3.85Å; I319-L333 HydrophobicContact CD1-CD2 4.32Å; I319-L333 HydrophobicContact CG2-CD2 4.38Å; I319-L333 HydrophobicContact CG2-CG 4.41Å
320	G	91.6	Very high	91.7	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.087	C	C	.	.			trans	-104.4	147.7	173.2	0	0	0	0	0	111.6	T329	G320-T329 PolarHBondContact O-OG1 2.89Å
321	P	92	Very high	91.7	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.087	C	C	.	.			trans	-80.2	-16.4	-177.2	29.8	-32.5	0	0	0	113.3	R19 L21 K32 C33	R19-P321 WeakPolarHBondContact O-CD 3.38Å; R19-P321 WeakPolarHBondContact O-CG 3.33Å; L21-P321 HydrophobicContact CB-CG 4.19Å; L21-P321 HydrophobicContact CD1-CG 4.03Å; K32-P321 CarbonylContact C-O 3.56Å; K32-P321 WeakPolarHBondContact CA-O 3.28Å; K32-P321 HydrophobicContact CG-CB 4.16Å; C33-P321 PolarHBondContact N-O 3.41Å; C33-P321 PolarHBondContact SG-O 3.39Å
322	A	90.8	Very high	91.7	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.087	C	C	.	.	B	Isolated β-bridge	trans	-71.4	137.1	-170.4	0	0	0	0	0	114	L21 E25 H30 Y324 N325	L21-A322 HydrophobicContact CD1-CB 3.87Å; E25-A322 HydrophobicContact CB-CB 4.17Å; E25-A322 VanDerWaalsContact CD-CB 3.49Å; E25-A322 HydrophobicContact CG-CB 4.01Å; E25-A322 VanDerWaalsContact OE1-CB 3.31Å; E25-A322 WeakPolarHBondContact OE1-CB 3.33Å; H30-A322 HydrophobicContact CB-CB 4.25Å; A322-Y324 PolarHBondContact O-N 3.32Å; A322-N325 PolarHBondContact O-N 3.34Å
323	T	89.2	Confident	91.7	Very high	31 Å²	31	17.1 Å²	17.1	19%	0.19	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-51.8	-35.8	172.7	36.1	0	0	0	0	114.3	K31 C33 P48 N325 Y326	K31-T323 HydrophobicContact CB-CG2 4.18Å; K31-T323 PolarHBondContact N-OG1 3.14Å; K31-T323 VanDerWaalsContact O-CG2 3.29Å; K31-T323 WeakPolarHBondContact O-CG2 3.44Å; K31-T323 PolarHBondContact O-N 2.89Å; K31-T323 PolarHBondContact O-OG1 2.94Å; K31-T323 VanDerWaalsContact O-OG1 3.13Å; C33-T323 HydrophobicContact CB-CG2 3.75Å; P48-T323 HydrophobicContact CB-CG2 3.88Å; P48-T323 HydrophobicContact CG-CG2 4.27Å; T323-N325 PolarHBondContact O-N 2.94Å; T323-Y326 VanDerWaalsContact O-CB 3.29Å; T323-Y326 WeakPolarHBondContact O-CB 3.45Å; T323-Y326 PolarHBondContact O-N 2.85Å; T323-Y326 VanDerWaalsContact O-N 3.12Å
324	Y	85.5	Confident	91.5	Very high	135 Å²	135	19.4 Å²	19.4	53%	0.529	9%	0.087	S	C	.	.	G	3₁₀ helix	trans	-58.9	-27.6	176.1	176.5	-104.1	0	0	0	113.6	K256 A322	K256-Y324 PolarHBondContact NZ-O 3.43Å; A322-Y324 PolarHBondContact O-N 3.32Å
325	N	87.2	Confident	91.3	Very high	11 Å²	11	20.1 Å²	20.1	6%	0.059	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-100.1	12.9	-178.9	-67.1	-42.1	0	0	0	113.1	E25 Q99 K256 A322 T323 E327 E328 T329	E25-N325 PolarHBondContact OE1-ND2 3.43Å; Q99-N325 PolarHBondContact NE2-OD1 2.95Å; Q99-N325 PolarHBondContact OE1-OD1 3.01Å; K256-N325 PolarHBondContact NZ-OD1 2.91Å; A322-N325 PolarHBondContact O-N 3.34Å; T323-N325 PolarHBondContact O-N 2.94Å; N325-E327 PolarHBondContact O-N 2.9Å; N325-E328 PolarHBondContact O-N 3.39Å; N325-E328 VanDerWaalsContact O-N 3.12Å; N325-T329 WeakPolarHBondContact O-CB 3.19Å; N325-T329 PolarHBondContact O-N 2.93Å; N325-T329 PolarHBondContact O-OG1 3.33Å
326	Y	89.4	Confident	91.2	Very high	12 Å²	12	20.1 Å²	20.1	5%	0.047	9%	0.09	C	C	.	.	H	α-helix	trans	-48	-52.5	-177.9	173.6	-96.1	0	0	0	113.3	V45 R46 N47 T323 E328 T329 I330	V45-Y326 HydrophobicContact CG1-CD2 3.68Å; V45-Y326 HydrophobicContact CG1-CE2 3.62Å; R46-Y326 WeakPolarHBondContact O-CD2 3.49Å; R46-Y326 WeakPolarHBondContact O-CE2 3.45Å; N47-Y326 VanDerWaalsContact CA-CE2 3.45Å; N47-Y326 HydrophobicContact CB-CE1 4.42Å; N47-Y326 HydrophobicContact CB-CE2 3.95Å; T323-Y326 VanDerWaalsContact O-CB 3.29Å; T323-Y326 WeakPolarHBondContact O-CB 3.45Å; T323-Y326 PolarHBondContact O-N 2.85Å; T323-Y326 VanDerWaalsContact O-N 3.12Å; Y326-E328 PolarHBondContact O-N 3.38Å; Y326-T329 PolarHBondContact O-N 3.38Å; Y326-I330 HydrophobicContact CD2-CG1 4.36Å; Y326-I330 HydrophobicContact CE1-CG1 4.11Å; Y326-I330 HydrophobicContact CE2-CD1 4.25Å; Y326-I330 HydrophobicContact CE2-CG1 3.95Å; Y326-I330 WeakPolarHBondContact O-CG1 3.37Å; Y326-I330 PolarHBondContact O-N 3.33Å
327	E	87.4	Confident	91.1	Very high	111 Å²	111	22.5 Å²	22.5	52%	0.519	10%	0.102	S	C	.	.	H	α-helix	trans	-61.1	-43	-178.5	-67	-58.7	149.7	0	0	112.7	N325 I330 N331	N325-E327 PolarHBondContact O-N 2.9Å; E327-I330 PolarHBondContact O-N 2.9Å; E327-N331 PolarHBondContact O-N 3.44Å; E327-N331 PolarHBondContact O-ND2 3.45Å
328	E	87.8	Confident	90.9	Very high	6 Å²	6	28.2 Å²	28.2	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-71.8	-37.4	-178.8	-62.3	-61.7	171.4	0	0	111.9	Q99 R253 K256 N325 Y326 N331 T332	Q99-E328 HydrophobicContact CB-CB 4.33Å; Q99-E328 HydrophobicContact CG-CB 4.29Å; Q99-E328 HydrophobicContact CG-CG 4.42Å; R253-E328 PolarHBondContact N-OE1 3.34Å; K256-E328 HydrophobicContact CD-CG 4.48Å; N325-E328 PolarHBondContact O-N 3.39Å; N325-E328 VanDerWaalsContact O-N 3.12Å; Y326-E328 PolarHBondContact O-N 3.38Å; E328-N331 PolarHBondContact O-N 3.25Å; E328-T332 WeakPolarHBondContact O-CB 3.45Å; E328-T332 PolarHBondContact O-N 2.95Å; E328-T332 PolarHBondContact O-OG1 2.92Å
329	T	91.4	Very high	90.8	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-45.4	172.5	-68.7	0	0	0	0	110.6	V34 V45 I319 G320 N325 Y326 T332 L333	V34-T329 HydrophobicContact CG2-CG2 3.88Å; V45-T329 HydrophobicContact CG1-CG2 4.48Å; V45-T329 HydrophobicContact CG2-CG2 4.26Å; I319-T329 HydrophobicContact CB-CG2 4.05Å; I319-T329 HydrophobicContact CD1-CG2 4.17Å; I319-T329 HydrophobicContact CG2-CG2 4.13Å; G320-T329 PolarHBondContact O-OG1 2.89Å; N325-T329 WeakPolarHBondContact O-CB 3.19Å; N325-T329 PolarHBondContact O-N 2.93Å; N325-T329 PolarHBondContact O-OG1 3.33Å; Y326-T329 PolarHBondContact O-N 3.38Å; T329-T332 PolarHBondContact O-N 3.36Å; T329-L333 HydrophobicContact CG2-CD1 3.95Å; T329-L333 HydrophobicContact CG2-CG 4.46Å; T329-L333 WeakPolarHBondContact O-CB 3.29Å; T329-L333 VanDerWaalsContact O-CG 3.26Å; T329-L333 WeakPolarHBondContact O-CG 3.38Å; T329-L333 PolarHBondContact O-N 3.3Å
330	I	91	Very high	90.6	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-63.8	-42.5	177	-70.9	-63.4	0	0	0	111.8	V45 K57 F59 Y326 E327 T332 L333 R334	V45-I330 HydrophobicContact CB-CD1 3.71Å; V45-I330 HydrophobicContact CG1-CD1 3.76Å; V45-I330 HydrophobicContact CG1-CG1 4.24Å; V45-I330 HydrophobicContact CG2-CD1 4.1Å; K57-I330 HydrophobicContact CB-CD1 4.1Å; K57-I330 HydrophobicContact CD-CD1 3.79Å; F59-I330 HydrophobicContact CE2-CD1 4.14Å; Y326-I330 HydrophobicContact CD2-CG1 4.36Å; Y326-I330 HydrophobicContact CE1-CG1 4.11Å; Y326-I330 HydrophobicContact CE2-CD1 4.25Å; Y326-I330 HydrophobicContact CE2-CG1 3.95Å; Y326-I330 WeakPolarHBondContact O-CG1 3.37Å; Y326-I330 PolarHBondContact O-N 3.33Å; E327-I330 PolarHBondContact O-N 2.9Å; I330-T332 VanDerWaalsContact C-N 3.33Å; I330-T332 PolarHBondContact O-N 3.28Å; I330-L333 PolarHBondContact O-N 2.89Å; I330-R334 WeakPolarHBondContact O-CG 3.34Å; I330-R334 PolarHBondContact O-N 3.5Å
331	N	90.3	Very high	90.6	Very high	38 Å²	38	34.8 Å²	34.8	20%	0.203	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-45.2	176.6	-70.2	-21.3	0	0	0	111	E327 E328 L333 R334 Y335	E327-N331 PolarHBondContact O-N 3.44Å; E327-N331 PolarHBondContact O-ND2 3.45Å; E328-N331 PolarHBondContact O-N 3.25Å; N331-L333 PolarHBondContact O-N 2.93Å; N331-R334 PolarHBondContact O-N 3.09Å; N331-Y335 WeakPolarHBondContact O-CB 3.5Å; N331-Y335 PolarHBondContact O-N 3.08Å
332	T	92.3	Very high	90.6	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-45.8	177.3	-57.1	0	0	0	0	111.7	Y97 A317 I319 E328 T329 I330 Y335 A336	Y97-T332 HydrophobicContact CD1-CG2 3.93Å; Y97-T332 HydrophobicContact CE1-CG2 4Å; A317-T332 HydrophobicContact CB-CG2 4.13Å; I319-T332 HydrophobicContact CG2-CG2 3.85Å; E328-T332 WeakPolarHBondContact O-CB 3.45Å; E328-T332 PolarHBondContact O-N 2.95Å; E328-T332 PolarHBondContact O-OG1 2.92Å; T329-T332 PolarHBondContact O-N 3.36Å; I330-T332 VanDerWaalsContact C-N 3.33Å; I330-T332 PolarHBondContact O-N 3.28Å; T332-Y335 WeakPolarHBondContact O-CB 3.39Å; T332-Y335 PolarHBondContact O-N 2.93Å; T332-A336 VanDerWaalsContact O-CB 3.32Å; T332-A336 WeakPolarHBondContact O-CB 3.23Å; T332-A336 PolarHBondContact O-N 3Å
333	L	93.7	Very high	90.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.7	-38.2	179.5	-69.3	172.9	0	0	0	113	V16 V43 V45 F59 F61 I319 T329 I330 N331 Y335 N337	V16-L333 HydrophobicContact CG1-CD2 3.99Å; V16-L333 HydrophobicContact CG2-CD2 3.89Å; V43-L333 HydrophobicContact CG1-CD1 4.01Å; V43-L333 HydrophobicContact CG1-CD2 4.32Å; V45-L333 HydrophobicContact CG2-CD1 3.36Å; F59-L333 HydrophobicContact CD1-CB 4.42Å; F59-L333 HydrophobicContact CD2-CB 3.99Å; F59-L333 HydrophobicContact CD2-CD1 3.85Å; F59-L333 HydrophobicContact CD2-CG 4.47Å; F59-L333 HydrophobicContact CE1-CB 4.4Å; F59-L333 HydrophobicContact CE2-CB 3.95Å; F59-L333 HydrophobicContact CE2-CD1 4.01Å; F59-L333 HydrophobicContact CG-CB 4.22Å; F59-L333 HydrophobicContact CZ-CB 4.16Å; F61-L333 HydrophobicContact CE2-CD2 3.7Å; F61-L333 HydrophobicContact CZ-CB 4.43Å; F61-L333 HydrophobicContact CZ-CD2 3.76Å; I319-L333 HydrophobicContact CD1-CD2 4.32Å; I319-L333 HydrophobicContact CG2-CD2 4.38Å; I319-L333 HydrophobicContact CG2-CG 4.41Å; T329-L333 HydrophobicContact CG2-CD1 3.95Å; T329-L333 HydrophobicContact CG2-CG 4.46Å; T329-L333 WeakPolarHBondContact O-CB 3.29Å; T329-L333 VanDerWaalsContact O-CG 3.26Å; T329-L333 WeakPolarHBondContact O-CG 3.38Å; T329-L333 PolarHBondContact O-N 3.3Å; I330-L333 PolarHBondContact O-N 2.89Å; N331-L333 PolarHBondContact O-N 2.93Å; L333-Y335 VanDerWaalsContact C-N 3.34Å; L333-N337 VanDerWaalsContact O-CB 3.23Å; L333-N337 WeakPolarHBondContact O-CB 3.37Å; L333-N337 PolarHBondContact O-N 2.67Å
334	R	91.6	Very high	90.6	Very high	53 Å²	53	42.1 Å²	42.1	20%	0.2	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-42.6	173.6	-76.1	-166.9	-171.1	115.5	18.5	111.9	F59 I330 N331 N337 R338	F59-R334 HydrophobicContact CE1-CG 4.13Å; F59-R334 HydrophobicContact CZ-CG 4.18Å; I330-R334 WeakPolarHBondContact O-CG 3.34Å; I330-R334 PolarHBondContact O-N 3.5Å; N331-R334 PolarHBondContact O-N 3.09Å; R334-N337 PolarHBondContact O-N 3.27Å; R334-R338 WeakPolarHBondContact O-CG 3.24Å; R334-R338 PolarHBondContact O-N 2.8Å
335	Y	90.8	Very high	90.9	Very high	20 Å²	20	42.5 Å²	42.5	8%	0.078	19%	0.185	C	C	.	.	H	α-helix	trans	-60.7	-50.1	177.5	-167.5	-82.5	0	0	0	111	Y97 L277 G278 I281 M315 N331 T332 L333 N337 R338 A339	Y97-Y335 HydrophobicContact CD1-CD1 4.08Å; Y97-Y335 HydrophobicContact CD2-CE1 4.46Å; Y97-Y335 AromaticContact CE1-CD1 3.76Å; Y97-Y335 HydrophobicContact CE1-CD1 3.76Å; Y97-Y335 HydrophobicContact CE1-CE1 4.33Å; Y97-Y335 AromaticContact CE1-CG 3.87Å; Y97-Y335 HydrophobicContact CE1-CG 3.87Å; Y97-Y335 HydrophobicContact CE2-CD1 4.48Å; Y97-Y335 HydrophobicContact CE2-CE1 4.26Å; Y97-Y335 AromaticContact CZ-CD1 3.98Å; Y97-Y335 AromaticContact CZ-CG 3.96Å; L277-Y335 WeakPolarHBondContact CB-OH 3.08Å; L277-Y335 WeakPolarHBondContact CD2-OH 3.33Å; L277-Y335 WeakPolarHBondContact CG-OH 3.12Å; L277-Y335 PolarHBondContact O-OH 2.87Å; G278-Y335 WeakPolarHBondContact CA-OH 3.4Å; G278-Y335 PolarHBondContact N-OH 3.06Å; G278-Y335 VanDerWaalsContact N-OH 3.16Å; I281-Y335 HydrophobicContact CD1-CD1 4.26Å; I281-Y335 HydrophobicContact CD1-CE1 3.34Å; I281-Y335 VanDerWaalsContact CD1-CZ 3.48Å; I281-Y335 VanDerWaalsContact CD1-OH 3.29Å; I281-Y335 WeakPolarHBondContact CD1-OH 3.45Å; M315-Y335 HydrophobicContact CE-CD1 3.62Å; M315-Y335 HydrophobicContact CE-CE1 4.1Å; M315-Y335 HydrophobicContact SD-CD1 4.35Å; N331-Y335 WeakPolarHBondContact O-CB 3.5Å; N331-Y335 PolarHBondContact O-N 3.08Å; T332-Y335 WeakPolarHBondContact O-CB 3.39Å; T332-Y335 PolarHBondContact O-N 2.93Å; L333-Y335 VanDerWaalsContact C-N 3.34Å; Y335-N337 VanDerWaalsContact C-N 3.3Å; Y335-N337 PolarHBondContact O-N 3.41Å; Y335-R338 PolarHBondContact O-N 2.87Å; Y335-R338 VanDerWaalsContact O-N 3.12Å; Y335-A339 PolarHBondContact O-N 3.33Å
336	A	93.5	Very high	91	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-57.3	-42.2	174.7	0	0	0	0	0	112	V14 F61 M315 A317 T332 R338 A339 K340	V14-A336 HydrophobicContact CG1-CB 3.72Å; F61-A336 HydrophobicContact CE1-CB 3.62Å; F61-A336 HydrophobicContact CZ-CB 4.13Å; M315-A336 HydrophobicContact CE-CB 3.96Å; M315-A336 HydrophobicContact SD-CB 4.33Å; A317-A336 HydrophobicContact CB-CB 3.76Å; T332-A336 VanDerWaalsContact O-CB 3.32Å; T332-A336 WeakPolarHBondContact O-CB 3.23Å; T332-A336 PolarHBondContact O-N 3Å; A336-R338 VanDerWaalsContact C-N 3.3Å; A336-R338 PolarHBondContact O-N 2.85Å; A336-A339 PolarHBondContact O-N 3.28Å; A336-K340 PolarHBondContact O-N 3.27Å
337	N	92.5	Very high	91	Very high	49 Å²	49	49.1 Å²	49.1	26%	0.262	22%	0.215	S	C	.	.	H	α-helix	trans	-69.7	-25	179	-174.5	70.4	0	0	0	113.4	F59 F61 L333 R334 Y335 K340	F59-N337 HydrophobicContact CD1-CB 4.17Å; F61-N337 HydrophobicContact CE1-CB 4.24Å; F61-N337 HydrophobicContact CZ-CB 4.47Å; L333-N337 VanDerWaalsContact O-CB 3.23Å; L333-N337 WeakPolarHBondContact O-CB 3.37Å; L333-N337 PolarHBondContact O-N 2.67Å; R334-N337 PolarHBondContact O-N 3.27Å; Y335-N337 VanDerWaalsContact C-N 3.3Å; Y335-N337 PolarHBondContact O-N 3.41Å; N337-K340 WeakPolarHBondContact O-CG 3.11Å; N337-K340 WeakPolarHBondContact OD1-CE 3.44Å; N337-K340 PolarHBondContact OD1-NZ 2.75Å
338	R	91.5	Very high	91	Very high	121 Å²	121	46.5 Å²	46.5	46%	0.457	20%	0.204	S	C	.	.	H	α-helix	trans	-74.9	-46.7	168.4	-69.2	177.4	-174.6	160.3	1.4	110.1	I281 V285 R334 Y335 A336 K340 N341	I281-R338 HydrophobicContact CG2-CB 3.92Å; V285-R338 VanDerWaalsContact CG2-O 3.23Å; V285-R338 WeakPolarHBondContact CG2-O 3.42Å; R334-R338 WeakPolarHBondContact O-CG 3.24Å; R334-R338 PolarHBondContact O-N 2.8Å; Y335-R338 PolarHBondContact O-N 2.87Å; Y335-R338 VanDerWaalsContact O-N 3.12Å; A336-R338 VanDerWaalsContact C-N 3.3Å; A336-R338 PolarHBondContact O-N 2.85Å; R338-K340 PolarHBondContact O-N 2.95Å; R338-N341 PolarHBondContact O-N 3.17Å
339	A	92.2	Very high	91	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.5	-34.8	-176.4	0	0	0	0	0	113.9	V14 I281 M315 Y335 A336 N341 I342	V14-A339 HydrophobicContact CG2-CB 4.24Å; I281-A339 HydrophobicContact CD1-CB 4.06Å; I281-A339 HydrophobicContact CG2-CB 4.34Å; M315-A339 HydrophobicContact SD-CB 3.53Å; M315-A339 VanDerWaalsContact SD-CB 3.53Å; Y335-A339 PolarHBondContact O-N 3.33Å; A336-A339 PolarHBondContact O-N 3.28Å; A339-N341 PolarHBondContact O-N 3.15Å; A339-N341 VanDerWaalsContact O-N 3.08Å; A339-I342 HydrophobicContact CB-CD1 4.29Å; A339-I342 WeakPolarHBondContact O-CB 3.2Å; A339-I342 VanDerWaalsContact O-CG1 3.27Å; A339-I342 WeakPolarHBondContact O-CG1 3.36Å; A339-I342 PolarHBondContact O-N 3.47Å
340	K	91.7	Very high	90.4	Very high	57 Å²	57	51.7 Å²	51.7	25%	0.248	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.8	178.5	83.3	-170.6	-171.4	-179.3	0	114.4	V14 R60 A336 N337 R338	V14-K340 HydrophobicContact CB-CB 4.21Å; V14-K340 HydrophobicContact CG2-CB 3.62Å; R60-K340 PolarHBondContact O-NZ 2.92Å; R60-K340 VanDerWaalsContact O-NZ 3.15Å; A336-K340 PolarHBondContact O-N 3.27Å; N337-K340 WeakPolarHBondContact O-CG 3.11Å; N337-K340 WeakPolarHBondContact OD1-CE 3.44Å; N337-K340 PolarHBondContact OD1-NZ 2.75Å; R338-K340 PolarHBondContact O-N 2.95Å
341	N	91.2	Very high	89.2	Confident	82 Å²	82	56.2 Å²	56.2	44%	0.439	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-4	-178.8	-62.7	-31	0	0	0	112.8	V285 R338 A339 R343	V285-N341 HydrophobicContact CB-CB 4.46Å; V285-N341 HydrophobicContact CG1-CB 3.7Å; V285-N341 HydrophobicContact CG2-CB 3.97Å; R338-N341 PolarHBondContact O-N 3.17Å; A339-N341 PolarHBondContact O-N 3.15Å; A339-N341 VanDerWaalsContact O-N 3.08Å; N341-R343 PolarHBondContact O-N 2.96Å
342	I	90.7	Very high	87.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.259	C	S	.	.			trans	-67.3	131	174.5	-60.6	169.3	0	0	0	108.2	S11 V12 I281 L284 V285 L307 A339	S11-I342 VanDerWaalsContact CA-O 3.3Å; S11-I342 WeakPolarHBondContact CA-O 3.31Å; V12-I342 HydrophobicContact CB-CB 4.31Å; V12-I342 HydrophobicContact CG2-CB 3.68Å; V12-I342 HydrophobicContact CG2-CG2 3.74Å; V12-I342 PolarHBondContact N-O 3.34Å; I281-I342 HydrophobicContact CB-CD1 4.22Å; I281-I342 HydrophobicContact CD1-CD1 4.13Å; I281-I342 HydrophobicContact CG1-CD1 3.74Å; I281-I342 HydrophobicContact CG2-CD1 3.94Å; I281-I342 HydrophobicContact CG2-CG1 4.37Å; L284-I342 HydrophobicContact CB-CG1 4.26Å; L284-I342 HydrophobicContact CD1-CD1 4.32Å; L284-I342 HydrophobicContact CD1-CG1 4.38Å; L284-I342 HydrophobicContact CD1-CG2 4.07Å; V285-I342 HydrophobicContact CG2-CG1 3.95Å; L307-I342 HydrophobicContact CD2-CD1 4.09Å; A339-I342 HydrophobicContact CB-CD1 4.29Å; A339-I342 WeakPolarHBondContact O-CB 3.2Å; A339-I342 VanDerWaalsContact O-CG1 3.27Å; A339-I342 WeakPolarHBondContact O-CG1 3.36Å; A339-I342 PolarHBondContact O-N 3.47Å
343	R	90.3	Very high	86.1	Confident	183 Å²	183	65 Å²	65	69%	0.691	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.9	178.1	-58.4	-173.2	-167.5	-142.4	3.2	110.1	N341	N341-R343 PolarHBondContact O-N 2.96Å
344	N	91.4	Very high	84.5	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.011	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	160.7	174.3	-70	4.8	0	0	0	110.7	S9 E10 S306 G308 S311 T313 P346	S9-N344 WeakPolarHBondContact CA-O 3.4Å; E10-N344 PolarHBondContact N-O 3.2Å; E10-N344 PolarHBondContact O-N 3.39Å; S306-N344 PolarHBondContact O-ND2 3.13Å; G308-N344 VanDerWaalsContact CA-OD1 3.31Å; G308-N344 WeakPolarHBondContact CA-OD1 3.46Å; G308-N344 PolarHBondContact N-OD1 3.04Å; S311-N344 VanDerWaalsContact O-CB 3.29Å; S311-N344 WeakPolarHBondContact O-CB 3.44Å; S311-N344 PolarHBondContact O-ND2 3.5Å; T313-N344 PolarHBondContact OG1-ND2 3.44Å; N344-P346 VanDerWaalsContact C-CD 3.49Å; N344-P346 WeakPolarHBondContact O-CD 3.32Å
345	K	90.2	Very high	83.4	Confident	144 Å²	144	66.9 Å²	66.9	63%	0.626	31%	0.309	S	S	*	.			trans	-124.8	72	175.9	-65.7	-175.8	-177.4	-178.8	0	109.6	G309 K347	G309-K345 PolarHBondContact O-N 2.89Å; K345-K347 PolarHBondContact O-N 2.86Å
346	P	90	Very high	82.6	Confident	19 Å²	19	68 Å²	68	12%	0.123	32%	0.316	C	S	.	.			trans	-65.8	132	-179.3	29.3	-35	0	0	0	110.6	E10 F90 K312 N344	E10-P346 HydrophobicContact CB-CG 4.1Å; F90-P346 HydrophobicContact CD1-CB 3.91Å; F90-P346 HydrophobicContact CE1-CB 4.24Å; K312-P346 HydrophobicContact CG-CB 3.6Å; K312-P346 HydrophobicContact CG-CG 3.88Å; N344-P346 VanDerWaalsContact C-CD 3.49Å; N344-P346 WeakPolarHBondContact O-CD 3.32Å
347	K	88.9	Confident	81.6	Confident	142 Å²	142	68 Å²	68	62%	0.617	32%	0.317	S	S	*	.			trans	-125.5	151.9	175.8	-64.4	-178.6	179.9	-178.8	0	109	F90 N310 K345	F90-K347 VanDerWaalsContact CD1-C 3.47Å; F90-K347 WeakPolarHBondContact CD1-O 3.34Å; N310-K347 PolarHBondContact OD1-N 3.38Å; N310-K347 PolarHBondContact OD1-O 3.28Å; K345-K347 PolarHBondContact O-N 2.86Å
348	I	88.8	Confident	80.8	Confident	56 Å²	56	69.3 Å²	69.3	29%	0.287	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-74.9	126.4	171.7	-57.3	177	0	0	0	107.2	F90 R239 E350	F90-I348 HydrophobicContact CD1-CG1 4.24Å; F90-I348 HydrophobicContact CD2-CG1 4.05Å; F90-I348 HydrophobicContact CE1-CG1 3.69Å; F90-I348 HydrophobicContact CE2-CD1 3.95Å; F90-I348 HydrophobicContact CE2-CG1 3.46Å; F90-I348 VanDerWaalsContact CE2-CG1 3.46Å; F90-I348 HydrophobicContact CG-CG1 4.42Å; F90-I348 HydrophobicContact CZ-CD1 3.91Å; F90-I348 HydrophobicContact CZ-CG1 3.27Å; R239-I348 HydrophobicContact CG-CG2 4.44Å; I348-E350 HydrophobicContact CB-CG 4.32Å; I348-E350 HydrophobicContact CG2-CG 3.59Å; I348-E350 PolarHBondContact O-N 3.47Å
349	N	86.3	Confident	80.2	Confident	29 Å²	29	69.4 Å²	69.4	16%	0.155	32%	0.323	C	S	.	.			trans	-87	93.6	177.8	-47.7	-52.8	0	0	0	108.9	G89 N91 R239 V240 N310 D351	G89-N349 PolarHBondContact O-N 3.21Å; G89-N349 PolarHBondContact O-ND2 2.56Å; N91-N349 VanDerWaalsContact CG-ND2 3.31Å; N91-N349 PolarHBondContact ND2-ND2 3.29Å; N91-N349 PolarHBondContact OD1-ND2 2.92Å; R239-N349 WeakPolarHBondContact CA-O 3.28Å; V240-N349 PolarHBondContact N-O 2.79Å; V240-N349 WeakPolarHBondContact O-CB 3.38Å; V240-N349 PolarHBondContact O-ND2 3.12Å; N310-N349 PolarHBondContact ND2-OD1 3.36Å; N349-D351 VanDerWaalsContact C-N 3.34Å
350	E	79.1	Confident	79.5	Confident	88 Å²	88	71 Å²	71	41%	0.411	33%	0.33	S	S	.	.			trans	-100.3	37.9	176.5	-54.2	-163.6	142.6	0	0	111.2	I238 R239 I348 P352	I238-E350 WeakPolarHBondContact O-CA 3.32Å; R239-E350 HydrophobicContact CG-CG 4.18Å; R239-E350 IonicContact CZ-OE1 3.95Å; R239-E350 VanDerWaalsContact CZ-OE1 3.25Å; R239-E350 IonicContact NE-OE1 3.79Å; R239-E350 PolarHBondContact NE-OE1 2.69Å; R239-E350 IonicContact NH2-OE1 3.09Å; R239-E350 PolarHBondContact NH2-OE1 3.35Å; I348-E350 HydrophobicContact CB-CG 4.32Å; I348-E350 HydrophobicContact CG2-CG 3.59Å; I348-E350 PolarHBondContact O-N 3.47Å; E350-P352 WeakPolarHBondContact O-CD 3.48Å
351	D	67.1	Low	78.7	Confident	96 Å²	96	69.4 Å²	69.4	51%	0.513	32%	0.323	S	S	.	.			trans	-77.5	115.9	-174.2	-97.2	-45	0	0	0	111.7	N349 K353	N349-D351 VanDerWaalsContact C-N 3.34Å; D351-K353 VanDerWaalsContact C-N 3.31Å; D351-K353 PolarHBondContact O-N 3.01Å
352	P	58.6	Low	78.2	Confident	50 Å²	50	71.1 Å²	71.1	33%	0.325	33%	0.328	S	S	.	.	S	Bend	trans	-72.3	-26.3	-172.9	27.3	-32.5	0	0	0	112.5	E350 R358	E350-P352 WeakPolarHBondContact O-CD 3.48Å; P352-R358 VanDerWaalsContact CA-NH2 3.32Å; P352-R358 VanDerWaalsContact CB-CZ 3.4Å; P352-R358 VanDerWaalsContact CB-NH1 3.27Å; P352-R358 PolarHBondContact O-NE 3.03Å; P352-R358 VanDerWaalsContact O-NE 3.09Å; P352-R358 PolarHBondContact O-NH1 3.49Å; P352-R358 PolarHBondContact O-NH2 2.88Å
353	K	58.1	Low	77.6	Confident	175 Å²	175	74.2 Å²	74.2	76%	0.761	34%	0.343	S	S	*	.	S	Bend	trans	-84.4	-29.2	-163.3	-64.2	-178.3	-176	174	0	114.9	D351	D351-K353 VanDerWaalsContact C-N 3.31Å; D351-K353 PolarHBondContact O-N 3.01Å
354	D	61	Low	77	Confident	89 Å²	89	65.6 Å²	65.6	48%	0.476	31%	0.311	S	S	.	.	S	Bend	trans	-104.4	-0.6	-171.5	-79.5	0.2	0	0	0	113.6	L356	D354-L356 PolarHBondContact O-N 3.33Å
355	A	67	Low	76.6	Confident	2 Å²	2	68.9 Å²	68.9	2%	0.017	33%	0.328	C	S	.	.			trans	-75.3	115.8	-177.7	0	0	0	0	0	111.4	I238 V240 L357 R358	I238-A355 HydrophobicContact CB-CB 4.26Å; I238-A355 HydrophobicContact CD1-CB 4.24Å; I238-A355 HydrophobicContact CG2-CB 3.38Å; V240-A355 HydrophobicContact CG2-CB 4.31Å; A355-L357 PolarHBondContact O-N 2.93Å; A355-R358 VanDerWaalsContact O-CB 3.25Å; A355-R358 WeakPolarHBondContact O-CB 3.45Å; A355-R358 PolarHBondContact O-N 2.93Å
356	L	74.9	Confident	76.2	Confident	43 Å²	43	69.2 Å²	69.2	23%	0.225	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-30	175.4	-170.7	69	0	0	0	111.2	L141 E226 D354 R358 E359 Y360	L141-L356 HydrophobicContact CD2-CB 4.23Å; L141-L356 HydrophobicContact CD2-CD2 4.09Å; L141-L356 HydrophobicContact CD2-CG 4.31Å; E226-L356 PolarHBondContact OE2-N 3.31Å; D354-L356 PolarHBondContact O-N 3.33Å; L356-R358 PolarHBondContact O-N 3.35Å; L356-E359 WeakPolarHBondContact CD1-OE2 3.23Å; L356-E359 PolarHBondContact O-N 3.1Å; L356-Y360 HydrophobicContact CD1-CE2 4.29Å; L356-Y360 HydrophobicContact CD2-CD2 4.28Å; L356-Y360 HydrophobicContact CD2-CE2 3.55Å; L356-Y360 HydrophobicContact CG-CD2 3.8Å; L356-Y360 HydrophobicContact CG-CE2 3.51Å; L356-Y360 VanDerWaalsContact O-CD2 3.25Å; L356-Y360 WeakPolarHBondContact O-CD2 3.26Å; L356-Y360 PolarHBondContact O-N 3.34Å
357	L	72.6	Confident	75.7	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-57.1	-35.6	172.4	-159.7	160.7	0	0	0	111.8	L141 E226 C228 A355 Y360 Q361 L478	L141-L357 HydrophobicContact CB-CD1 4.15Å; E226-L357 HydrophobicContact CB-CB 4.23Å; E226-L357 HydrophobicContact CB-CD1 4.05Å; E226-L357 WeakPolarHBondContact OE2-CB 3.49Å; E226-L357 PolarHBondContact OE2-N 3.06Å; C228-L357 HydrophobicContact CB-CD1 3.91Å; C228-L357 HydrophobicContact CB-CD2 3.36Å; C228-L357 HydrophobicContact CB-CG 4.29Å; A355-L357 PolarHBondContact O-N 2.93Å; L357-Y360 PolarHBondContact O-N 3.34Å; L357-Q361 WeakPolarHBondContact O-CB 3.48Å; L357-Q361 PolarHBondContact O-N 3.03Å; L357-L478 HydrophobicContact CG-CD2 4.23Å
358	R	75.4	Confident	75.1	Confident	76 Å²	76	65.3 Å²	65.3	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-66.3	-49.4	174.4	-175.5	170.6	-66.9	-172.7	-2.4	112	I238 P352 A355 L356 Y360 Q361 E362	I238-R358 HydrophobicContact CD1-CB 3.64Å; I238-R358 HydrophobicContact CD1-CG 4.31Å; P352-R358 VanDerWaalsContact CA-NH2 3.32Å; P352-R358 VanDerWaalsContact CB-CZ 3.4Å; P352-R358 VanDerWaalsContact CB-NH1 3.27Å; P352-R358 PolarHBondContact O-NE 3.03Å; P352-R358 VanDerWaalsContact O-NE 3.09Å; P352-R358 PolarHBondContact O-NH1 3.49Å; P352-R358 PolarHBondContact O-NH2 2.88Å; A355-R358 VanDerWaalsContact O-CB 3.25Å; A355-R358 WeakPolarHBondContact O-CB 3.45Å; A355-R358 PolarHBondContact O-N 2.93Å; L356-R358 PolarHBondContact O-N 3.35Å; R358-Y360 PolarHBondContact O-N 3.5Å; R358-Q361 CarbonylContact O-C 3.59Å; R358-Q361 PolarHBondContact O-N 3.35Å; R358-E362 WeakPolarHBondContact CD-OE1 3.27Å; R358-E362 HydrophobicContact CG-CG 4.15Å; R358-E362 VanDerWaalsContact CG-OE1 3.29Å; R358-E362 WeakPolarHBondContact CG-OE1 3.42Å; R358-E362 WeakPolarHBondContact O-CB 3.31Å; R358-E362 WeakPolarHBondContact O-CG 3.45Å; R358-E362 PolarHBondContact O-N 3.02Å
359	E	79.5	Confident	74.7	Confident	123 Å²	123	65.1 Å²	65.1	58%	0.575	31%	0.311	S	S	*	.	H	α-helix	trans	-58.6	-40.7	177.3	-63.4	-174.9	167.3	0	0	110.6	L356 E363	L356-E359 WeakPolarHBondContact CD1-OE2 3.23Å; L356-E359 PolarHBondContact O-N 3.1Å; E359-E363 VanDerWaalsContact O-CB 3.24Å; E359-E363 WeakPolarHBondContact O-CB 3.44Å; E359-E363 PolarHBondContact O-N 3.47Å
360	Y	77.5	Confident	74.3	Confident	33 Å²	33	67.2 Å²	67.2	13%	0.129	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-45.2	173	-82	-54.5	0	0	0	112.1	L141 L185 L356 L357 R358 E363 I364 M474 K477	L141-Y360 HydrophobicContact CD1-CD2 4.45Å; L141-Y360 HydrophobicContact CD1-CE2 4.41Å; L141-Y360 HydrophobicContact CD2-CD2 3.83Å; L141-Y360 HydrophobicContact CD2-CE2 3.93Å; L185-Y360 HydrophobicContact CD1-CE2 4.48Å; L356-Y360 HydrophobicContact CD1-CE2 4.29Å; L356-Y360 HydrophobicContact CD2-CD2 4.28Å; L356-Y360 HydrophobicContact CD2-CE2 3.55Å; L356-Y360 HydrophobicContact CG-CD2 3.8Å; L356-Y360 HydrophobicContact CG-CE2 3.51Å; L356-Y360 VanDerWaalsContact O-CD2 3.25Å; L356-Y360 WeakPolarHBondContact O-CD2 3.26Å; L356-Y360 PolarHBondContact O-N 3.34Å; L357-Y360 PolarHBondContact O-N 3.34Å; R358-Y360 PolarHBondContact O-N 3.5Å; Y360-E363 PolarHBondContact O-N 2.79Å; Y360-I364 VanDerWaalsContact O-CB 3.26Å; Y360-I364 WeakPolarHBondContact O-CB 3.45Å; Y360-I364 WeakPolarHBondContact O-CD1 3.06Å; Y360-I364 WeakPolarHBondContact O-CG1 3.42Å; Y360-I364 PolarHBondContact O-N 2.96Å; Y360-M474 HydrophobicContact CD1-CE 3.34Å; Y360-M474 HydrophobicContact CD1-SD 3.59Å; Y360-M474 VanDerWaalsContact CD1-SD 3.59Å; Y360-M474 HydrophobicContact CE1-CE 3.58Å; Y360-M474 HydrophobicContact CE1-SD 3.4Å; Y360-M474 WeakPolarHBondContact CE1-SD 3.29Å; Y360-K477 HydrophobicContact CE1-CD 4.12Å
361	Q	74	Confident	74	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.117	31%	0.305	C	S	.	.	H	α-helix	trans	-68.3	-39	179.9	-172.8	61.6	57.9	0	0	112.2	L357 R358 N365	L357-Q361 WeakPolarHBondContact O-CB 3.48Å; L357-Q361 PolarHBondContact O-N 3.03Å; R358-Q361 CarbonylContact O-C 3.59Å; R358-Q361 PolarHBondContact O-N 3.35Å; Q361-N365 PolarHBondContact NE2-OD1 2.81Å; Q361-N365 VanDerWaalsContact O-CB 3.24Å; Q361-N365 WeakPolarHBondContact O-CB 3.4Å; Q361-N365 PolarHBondContact O-N 2.86Å; Q361-N365 PolarHBondContact O-ND2 2.81Å; Q361-N365 PolarHBondContact O-OD1 2.82Å
362	E	81.4	Confident	74.2	Confident	117 Å²	117	65.8 Å²	65.8	55%	0.547	31%	0.306	S	S	.	.	H	α-helix	trans	-65.6	-45	175.5	-75	177.9	-171.8	0	0	110.9	R358 N365 R366	R358-E362 WeakPolarHBondContact CD-OE1 3.27Å; R358-E362 HydrophobicContact CG-CG 4.15Å; R358-E362 VanDerWaalsContact CG-OE1 3.29Å; R358-E362 WeakPolarHBondContact CG-OE1 3.42Å; R358-E362 WeakPolarHBondContact O-CB 3.31Å; R358-E362 WeakPolarHBondContact O-CG 3.45Å; R358-E362 PolarHBondContact O-N 3.02Å; E362-N365 PolarHBondContact O-N 3.27Å; E362-R366 VanDerWaalsContact O-CB 3.29Å; E362-R366 WeakPolarHBondContact O-CB 3.38Å; E362-R366 PolarHBondContact O-N 3.23Å
363	E	78.1	Confident	74.9	Confident	65 Å²	65	68.1 Å²	68.1	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-69.4	-38	177.3	-171.3	62.3	-168	0	0	111.4	E359 Y360 R366 L367 M474	E359-E363 VanDerWaalsContact O-CB 3.24Å; E359-E363 WeakPolarHBondContact O-CB 3.44Å; E359-E363 PolarHBondContact O-N 3.47Å; Y360-E363 PolarHBondContact O-N 2.79Å; E363-R366 PolarHBondContact O-N 2.84Å; E363-R366 IonicContact OE1-NH1 3.93Å; E363-R366 VanDerWaalsContact OE2-CD 3.32Å; E363-R366 WeakPolarHBondContact OE2-CD 3.49Å; E363-R366 IonicContact OE2-NH1 3.18Å; E363-R366 PolarHBondContact OE2-NH1 3.5Å; E363-L367 HydrophobicContact CG-CD1 4.29Å; E363-L367 WeakPolarHBondContact O-CB 3.43Å; E363-L367 VanDerWaalsContact O-CG 3.23Å; E363-L367 WeakPolarHBondContact O-CG 3.41Å; E363-L367 PolarHBondContact O-N 3.48Å; E363-M474 HydrophobicContact CB-CE 3.92Å; E363-M474 HydrophobicContact CG-CE 3.69Å
364	I	78.1	Confident	75.2	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.015	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-45.2	171.1	-72.5	164.4	0	0	0	110.2	Y360 R366 L367 K368 M474 E475 L478	Y360-I364 VanDerWaalsContact O-CB 3.26Å; Y360-I364 WeakPolarHBondContact O-CB 3.45Å; Y360-I364 WeakPolarHBondContact O-CD1 3.06Å; Y360-I364 WeakPolarHBondContact O-CG1 3.42Å; Y360-I364 PolarHBondContact O-N 2.96Å; I364-R366 VanDerWaalsContact C-N 3.33Å; I364-R366 PolarHBondContact O-N 2.99Å; I364-L367 PolarHBondContact O-N 2.92Å; I364-K368 HydrophobicContact CG2-CD 4.09Å; I364-K368 HydrophobicContact CG2-CG 4.42Å; I364-K368 WeakPolarHBondContact O-CB 3.4Å; I364-K368 VanDerWaalsContact O-CG 3.29Å; I364-K368 WeakPolarHBondContact O-CG 3.47Å; I364-K368 PolarHBondContact O-N 2.95Å; I364-M474 HydrophobicContact CD1-CB 4.13Å; I364-M474 HydrophobicContact CG1-CB 3.79Å; I364-E475 HydrophobicContact CD1-CG 4.24Å; I364-E475 HydrophobicContact CG1-CG 4.46Å; I364-E475 HydrophobicContact CG2-CG 4.27Å; I364-L478 HydrophobicContact CD1-CD1 3.45Å; I364-L478 VanDerWaalsContact CD1-CD1 3.45Å; I364-L478 HydrophobicContact CD1-CG 4.3Å
365	N	81.5	Confident	75.1	Confident	71 Å²	71	59 Å²	59	38%	0.38	28%	0.279	S	S	.	.	H	α-helix	trans	-63	-40.4	177.4	-73.3	-12.8	0	0	0	111.6	Q361 E362 K368 S369	Q361-N365 PolarHBondContact NE2-OD1 2.81Å; Q361-N365 VanDerWaalsContact O-CB 3.24Å; Q361-N365 WeakPolarHBondContact O-CB 3.4Å; Q361-N365 PolarHBondContact O-N 2.86Å; Q361-N365 PolarHBondContact O-ND2 2.81Å; Q361-N365 PolarHBondContact O-OD1 2.82Å; E362-N365 PolarHBondContact O-N 3.27Å; N365-K368 PolarHBondContact O-N 3.22Å; N365-S369 WeakPolarHBondContact O-CB 3.5Å; N365-S369 PolarHBondContact O-N 3.18Å
366	R	83	Confident	74.8	Confident	150 Å²	150	62.7 Å²	62.7	57%	0.566	31%	0.31	S	S	*	.	H	α-helix	trans	-64.2	-47.3	175.8	-175.7	-169.5	179.5	-171.6	2.4	111.4	E362 E363 I364 S369 L370	E362-R366 VanDerWaalsContact O-CB 3.29Å; E362-R366 WeakPolarHBondContact O-CB 3.38Å; E362-R366 PolarHBondContact O-N 3.23Å; E363-R366 PolarHBondContact O-N 2.84Å; E363-R366 IonicContact OE1-NH1 3.93Å; E363-R366 VanDerWaalsContact OE2-CD 3.32Å; E363-R366 WeakPolarHBondContact OE2-CD 3.49Å; E363-R366 IonicContact OE2-NH1 3.18Å; E363-R366 PolarHBondContact OE2-NH1 3.5Å; I364-R366 VanDerWaalsContact C-N 3.33Å; I364-R366 PolarHBondContact O-N 2.99Å; R366-S369 PolarHBondContact O-N 3.08Å; R366-L370 HydrophobicContact CG-CD1 4.42Å; R366-L370 WeakPolarHBondContact O-CG 3.41Å; R366-L370 PolarHBondContact O-N 3.38Å
367	L	78.4	Confident	74	Confident	7 Å²	7	64.4 Å²	64.4	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-62.1	-42.9	176.1	-71.1	171	0	0	0	111.2	E363 I364 S369 L370 L371 L467 K470 L471	E363-L367 HydrophobicContact CG-CD1 4.29Å; E363-L367 WeakPolarHBondContact O-CB 3.43Å; E363-L367 VanDerWaalsContact O-CG 3.23Å; E363-L367 WeakPolarHBondContact O-CG 3.41Å; E363-L367 PolarHBondContact O-N 3.48Å; I364-L367 PolarHBondContact O-N 2.92Å; L367-S369 VanDerWaalsContact C-N 3.33Å; L367-S369 PolarHBondContact O-N 2.86Å; L367-L370 PolarHBondContact O-N 3.18Å; L367-L371 WeakPolarHBondContact O-CG 3.11Å; L367-L371 PolarHBondContact O-N 3.33Å; L367-L467 HydrophobicContact CD2-CD2 3.62Å; L367-K470 HydrophobicContact CD1-CB 4.38Å; L367-L471 HydrophobicContact CB-CB 4.49Å; L367-L471 HydrophobicContact CB-CD1 4.14Å; L367-L471 HydrophobicContact CD1-CB 4.45Å
368	K	76.5	Confident	73.3	Confident	73 Å²	73	65.9 Å²	65.9	32%	0.317	34%	0.338	S	S	.	.	H	α-helix	trans	-60.6	-40.8	172.7	-76.2	-176.2	179.8	-173.7	0	112.2	I364 N365 L371 R372 L471 E475	I364-K368 HydrophobicContact CG2-CD 4.09Å; I364-K368 HydrophobicContact CG2-CG 4.42Å; I364-K368 WeakPolarHBondContact O-CB 3.4Å; I364-K368 VanDerWaalsContact O-CG 3.29Å; I364-K368 WeakPolarHBondContact O-CG 3.47Å; I364-K368 PolarHBondContact O-N 2.95Å; N365-K368 PolarHBondContact O-N 3.22Å; K368-L371 PolarHBondContact O-N 3.25Å; K368-R372 WeakPolarHBondContact O-CB 3.37Å; K368-R372 PolarHBondContact O-N 3.29Å; K368-L471 HydrophobicContact CG-CD1 3.56Å; K368-E475 WeakPolarHBondContact CE-OE1 3.47Å; K368-E475 IonicContact NZ-OE1 2.68Å; K368-E475 PolarHBondContact NZ-OE1 3.05Å
369	S	80	Confident	72.2	Confident	52 Å²	52	67 Å²	67	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-68.3	-39	176.8	-173.9	0	0	0	0	111.9	N365 R366 L367 R372 N373	N365-S369 WeakPolarHBondContact O-CB 3.5Å; N365-S369 PolarHBondContact O-N 3.18Å; R366-S369 PolarHBondContact O-N 3.08Å; L367-S369 VanDerWaalsContact C-N 3.33Å; L367-S369 PolarHBondContact O-N 2.86Å; S369-R372 PolarHBondContact O-N 3.04Å; S369-N373 WeakPolarHBondContact O-CB 3.4Å; S369-N373 PolarHBondContact O-N 2.66Å; S369-N373 PolarHBondContact O-ND2 3.45Å; S369-N373 PolarHBondContact O-OD1 3.15Å
370	L	78.6	Confident	70.7	Confident	73 Å²	73	70.9 Å²	70.9	38%	0.382	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-43.8	175.1	-73.5	170.7	0	0	0	110.9	R366 L367 N373 C374	R366-L370 HydrophobicContact CG-CD1 4.42Å; R366-L370 WeakPolarHBondContact O-CG 3.41Å; R366-L370 PolarHBondContact O-N 3.38Å; L367-L370 PolarHBondContact O-N 3.18Å; L370-N373 PolarHBondContact O-N 3.17Å; L370-C374 PolarHBondContact O-N 2.89Å; L370-C374 PolarHBondContact O-SG 3.14Å
371	L	72.2	Confident	69.1	Low	14 Å²	14	77.7 Å²	77.7	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-62.9	-45.5	174.6	-73.3	164.3	0	0	0	111.7	L367 K368 N373 C374 V375 L467 E468 L471	L367-L371 WeakPolarHBondContact O-CG 3.11Å; L367-L371 PolarHBondContact O-N 3.33Å; K368-L371 PolarHBondContact O-N 3.25Å; L371-N373 VanDerWaalsContact C-N 3.3Å; L371-N373 PolarHBondContact O-N 3.17Å; L371-C374 WeakPolarHBondContact O-CA 3.43Å; L371-C374 WeakPolarHBondContact O-CB 3.43Å; L371-C374 PolarHBondContact O-N 3.16Å; L371-C374 VanDerWaalsContact O-N 3.08Å; L371-V375 VanDerWaalsContact O-CG2 3.23Å; L371-V375 WeakPolarHBondContact O-CG2 3.46Å; L371-V375 PolarHBondContact O-N 2.83Å; L371-L467 HydrophobicContact CD2-CB 4.13Å; L371-L467 HydrophobicContact CG-CB 4.48Å; L371-E468 HydrophobicContact CD1-CG 4.42Å; L371-E468 HydrophobicContact CD2-CG 3.97Å; L371-L471 HydrophobicContact CD1-CD1 3.57Å
372	R	71.6	Confident	67.4	Low	139 Å²	139	81.2 Å²	81.2	53%	0.525	43%	0.43	S	S	.	.	H	α-helix	trans	-59.3	-38.2	174.4	-85.1	-173.3	-90.7	166.2	-12	112.9	K368 S369 C374 V375 A376	K368-R372 WeakPolarHBondContact O-CB 3.37Å; K368-R372 PolarHBondContact O-N 3.29Å; S369-R372 PolarHBondContact O-N 3.04Å; R372-C374 VanDerWaalsContact C-N 3.33Å; R372-V375 PolarHBondContact O-N 3.48Å; R372-A376 WeakPolarHBondContact O-CB 3.35Å; R372-A376 PolarHBondContact O-N 3.24Å
373	N	73.2	Confident	65.4	Low	100 Å²	100	84.7 Å²	84.7	54%	0.535	45%	0.446	S	S	.	.	H	α-helix	trans	-67.6	-34	175.8	-70.8	-15.9	0	0	0	112	S369 L370 L371 A376 A377	S369-N373 WeakPolarHBondContact O-CB 3.4Å; S369-N373 PolarHBondContact O-N 2.66Å; S369-N373 PolarHBondContact O-ND2 3.45Å; S369-N373 PolarHBondContact O-OD1 3.15Å; L370-N373 PolarHBondContact O-N 3.17Å; L371-N373 VanDerWaalsContact C-N 3.3Å; L371-N373 PolarHBondContact O-N 3.17Å; N373-A376 PolarHBondContact O-N 2.75Å; N373-A377 PolarHBondContact O-N 3.28Å
374	C	65.7	Low	63.3	Low	43 Å²	43	90.8 Å²	90.8	29%	0.291	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-40.4	169.6	-62.6	0	0	0	0	111.4	L370 L371 R372 A377	L370-C374 PolarHBondContact O-N 2.89Å; L370-C374 PolarHBondContact O-SG 3.14Å; L371-C374 WeakPolarHBondContact O-CA 3.43Å; L371-C374 WeakPolarHBondContact O-CB 3.43Å; L371-C374 PolarHBondContact O-N 3.16Å; L371-C374 VanDerWaalsContact O-N 3.08Å; R372-C374 VanDerWaalsContact C-N 3.33Å; C374-A377 PolarHBondContact O-N 3.03Å
375	V	59.1	Low	61.6	Low	29 Å²	29	100.1 Å²	100.1	18%	0.176	51%	0.512	C	S	.	.	H	α-helix	trans	-65.7	-40.5	175.6	-171.3	0	0	0	0	111.7	L371 R372 A377 I378 I414	L371-V375 VanDerWaalsContact O-CG2 3.23Å; L371-V375 WeakPolarHBondContact O-CG2 3.46Å; L371-V375 PolarHBondContact O-N 2.83Å; R372-V375 PolarHBondContact O-N 3.48Å; V375-A377 PolarHBondContact O-N 3.38Å; V375-I378 HydrophobicContact CG1-CD1 4.28Å; V375-I378 VanDerWaalsContact O-CB 3.22Å; V375-I378 WeakPolarHBondContact O-CB 3.22Å; V375-I378 WeakPolarHBondContact O-CG1 3.29Å; V375-I378 PolarHBondContact O-N 2.89Å; V375-I378 VanDerWaalsContact O-N 3.08Å; V375-I414 HydrophobicContact CG2-CD1 3.43Å; V375-I414 VanDerWaalsContact CG2-CD1 3.43Å; V375-I414 HydrophobicContact CG2-CG1 3.42Å; V375-I414 VanDerWaalsContact CG2-CG1 3.42Å
376	A	59.5	Low	59.3	Low	80 Å²	80	105.1 Å²	105.1	66%	0.661	54%	0.539	S	S	*	.	H	α-helix	trans	-68.4	-22	-179.4	0	0	0	0	0	113.4	R372 N373 I378	R372-A376 WeakPolarHBondContact O-CB 3.35Å; R372-A376 PolarHBondContact O-N 3.24Å; N373-A376 PolarHBondContact O-N 2.75Å; A376-I378 PolarHBondContact O-N 2.7Å
377	A	58.4	Low	57.2	Low	78 Å²	78	101.5 Å²	101.5	65%	0.645	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.2	172.9	0	0	0	0	0	113.1	N373 C374 V375 P379	N373-A377 PolarHBondContact O-N 3.28Å; C374-A377 PolarHBondContact O-N 3.03Å; V375-A377 PolarHBondContact O-N 3.38Å; A377-P379 VanDerWaalsContact O-CD 3.31Å; A377-P379 WeakPolarHBondContact O-CD 3.16Å
378	I	58	Low	55.3	Low	33 Å²	33	110.9 Å²	110.9	17%	0.169	59%	0.589	C	S	.	*	S	Bend	trans	-75.4	117	175.6	-58.2	170.5	0	0	0	108.9	V375 A376 K380 Y417	V375-I378 HydrophobicContact CG1-CD1 4.28Å; V375-I378 VanDerWaalsContact O-CB 3.22Å; V375-I378 WeakPolarHBondContact O-CB 3.22Å; V375-I378 WeakPolarHBondContact O-CG1 3.29Å; V375-I378 PolarHBondContact O-N 2.89Å; V375-I378 VanDerWaalsContact O-N 3.08Å; A376-I378 PolarHBondContact O-N 2.7Å; I378-K380 PolarHBondContact O-N 2.72Å; I378-Y417 HydrophobicContact CB-CE2 4.41Å; I378-Y417 HydrophobicContact CD1-CD1 3.72Å; I378-Y417 HydrophobicContact CD1-CD2 4.29Å; I378-Y417 HydrophobicContact CD1-CE1 4.28Å; I378-Y417 HydrophobicContact CD1-CG 3.71Å; I378-Y417 HydrophobicContact CG1-CD1 3.82Å; I378-Y417 HydrophobicContact CG1-CD2 4.3Å; I378-Y417 HydrophobicContact CG1-CE1 3.85Å; I378-Y417 HydrophobicContact CG1-CE2 4.34Å; I378-Y417 HydrophobicContact CG1-CG 4.04Å; I378-Y417 HydrophobicContact CG2-CD2 3.5Å; I378-Y417 HydrophobicContact CG2-CE2 3.48Å; I378-Y417 VanDerWaalsContact CG2-CE2 3.48Å; I378-Y417 HydrophobicContact CG2-CG 4.06Å
379	P	51.5	Low	53.6	Low	100 Å²	100	115.6 Å²	115.6	65%	0.649	61%	0.612	S	S	*	*			trans	-65.2	106	176.3	23.6	-30	0	0	0	109.7	A377 Q381	A377-P379 VanDerWaalsContact O-CD 3.31Å; A377-P379 WeakPolarHBondContact O-CD 3.16Å; P379-Q381 PolarHBondContact O-N 2.91Å
380	K	49.5	Very low	51.6	Low	204 Å²	204	124.2 Å²	124.2	89%	0.887	64%	0.637	S	S	*	*			trans	-59.7	99.9	170	-68.5	-175.6	178.7	-176.7	0	108.3	I378 S382	I378-K380 PolarHBondContact O-N 2.72Å; K380-S382 PolarHBondContact O-N 3.49Å
381	Q	43.2	Very low	49.8	Very low	176 Å²	176	125.2 Å²	125.2	82%	0.822	65%	0.65	S	S	*	*			trans	-62.5	104	167.6	-81.7	-169	-1.3	0	0	107.9	P379 Q383	P379-Q381 PolarHBondContact O-N 2.91Å; Q381-Q383 PolarHBondContact O-N 2.88Å
382	S	37.7	Very low	48.4	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	68%	0.684	S	S	*	*			trans	-54.1	105.2	172.7	53.7	0	0	0	0	109.6	K380 K384	K380-S382 PolarHBondContact O-N 3.49Å; S382-K384 PolarHBondContact O-N 3.19Å
383	Q	39.2	Very low	46.8	Very low	191 Å²	191	133.2 Å²	133.2	89%	0.893	69%	0.693	S	S	*	*			trans	-68.5	81.6	163.4	-74.3	-164.8	-3.7	0	0	108.9	Q381 K385	Q381-Q383 PolarHBondContact O-N 2.88Å; Q383-K385 PolarHBondContact O-N 2.88Å
384	K	34.9	Very low	45	Very low	192 Å²	192	136.5 Å²	136.5	84%	0.835	70%	0.702	S	S	*	*			trans	-74.4	92.3	157.1	-87.8	-179.4	174.5	173.6	0	107.5	S382	S382-K384 PolarHBondContact O-N 3.19Å
385	K	41.4	Very low	43.4	Very low	200 Å²	200	142 Å²	142	87%	0.87	72%	0.724	S	S	*	*			trans	-114.1	107	158.1	-91.5	-172.3	176.7	177.1	0	110.2	Q383	Q383-K385 PolarHBondContact O-N 2.88Å
386	N	34.2	Very low	42.1	Very low	175 Å²	175	145.5 Å²	145.5	94%	0.936	75%	0.745	S	S	*	*			trans	-51.2	126.5	165.5	-74.3	-39.8	0	0	0	111.1
387	G	38.1	Very low	40.7	Very low	75 Å²	75	149.7 Å²	149.7	77%	0.773	76%	0.755	S	S	*	*			trans	-154.6	93.6	170.5	0	0	0	0	0	110.5
388	K	38.3	Very low	39.3	Very low	203 Å²	203	151 Å²	151	88%	0.883	76%	0.76	S	S	*	*			trans	-56.4	135.2	170.2	-75.5	166.3	167.2	169.4	0	110.5
389	Q	42.2	Very low	37.9	Very low	173 Å²	173	157.3 Å²	157.3	81%	0.808	79%	0.794	S	S	*	*				162.6	131.4	116.2	-86.5	178.8	23.3	0	0	111.8
390	R	38	Very low	36.9	Very low	232 Å²	232	155.4 Å²	155.4	88%	0.875	79%	0.792	S	S	*	*			trans	31.6	137.1	137.5	-79.1	171.9	145.7	171	-8.2	118
391	S	39.1	Very low	35.9	Very low	94 Å²	94	150.5 Å²	150.5	66%	0.657	78%	0.783	S	S	*	*			cis	173.7	153.8	15.2	37.2	0	0	0	0	108.1
392	Q	42.9	Very low	35.2	Very low	167 Å²	167	151.4 Å²	151.4	78%	0.78	79%	0.788	S	S	*	*			trans	76.6	111.2	151	-74.4	175.3	6.3	0	0	121.1
393	Q	38.1	Very low	34.8	Very low	154 Å²	154	152.1 Å²	152.1	72%	0.72	79%	0.788	S	S	*	*				76.5	118	124.6	-75.4	-174.3	11.6	0	0	121
394	K	35.3	Very low	34.5	Very low	169 Å²	169	151.1 Å²	151.1	74%	0.735	79%	0.789	S	S	*	*				108.6	122.5	119	-95.3	178.3	173.1	177	0	118.3
395	H	32.9	Very low	34.5	Very low	160 Å²	160	145.7 Å²	145.7	74%	0.741	78%	0.775	S	S	*	*			trans	68.1	109.2	143.3	-101.8	-104.3	0	0	0	117.6
396	V	32.1	Very low	34.4	Very low	101 Å²	101	142.5 Å²	142.5	61%	0.612	77%	0.768	S	S	*	*				82.1	117.2	70.7	167.3	0	0	0	0	112.1
397	L	29.8	Very low	35	Very low	168 Å²	168	136.7 Å²	136.7	88%	0.88	75%	0.75	S	S	*	*			trans	81.6	147.8	157.9	-65.2	160.3	0	0	0	119.8
398	S	29.6	Very low	35.3	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	75%	0.749	S	S	*	*			trans	95.8	92.5	173.8	-149.6	0	0	0	0	113.3
399	D	28.4	Very low	35.6	Very low	165 Å²	165	136.2 Å²	136.2	88%	0.882	73%	0.734	S	S	*	*				63	102.5	85.2	-165.9	22.4	0	0	0	110.4
400	G	29.1	Very low	36	Very low	60 Å²	60	131 Å²	131	62%	0.619	71%	0.712	S	S	*	*			trans	-167.5	82.7	-166.1	0	0	0	0	0	112.6
401	S	29.7	Very low	36.8	Very low	100 Å²	100	122.1 Å²	122.1	70%	0.699	68%	0.683	S	S	*	*			trans	41.2	88.8	138.3	61.3	0	0	0	0	117.3	T403	S401-T403 PolarHBondContact O-N 3.04Å
402	E	28.9	Very low	37.6	Very low	196 Å²	196	121 Å²	121	92%	0.916	67%	0.672	S	S	*	*			trans	-71.2	77.5	156.6	-69.6	-173.5	169.3	0	0	109.1	N404	E402-N404 PolarHBondContact O-N 3.46Å
403	T	29.6	Very low	38.4	Very low	113 Å²	113	115.8 Å²	115.8	69%	0.693	65%	0.654	S	S	*	*			trans	-82.3	105.1	172.8	-43.4	0	0	0	0	108.1	S401 S405	S401-T403 PolarHBondContact O-N 3.04Å; T403-S405 PolarHBondContact O-N 3.42Å
404	N	32.1	Very low	39.6	Very low	169 Å²	169	108.9 Å²	108.9	90%	0.904	62%	0.622	S	S	*	*			trans	-47.9	84.1	175.5	-70.3	-69.9	0	0	0	113.9	E402	E402-N404 PolarHBondContact O-N 3.46Å
405	S	34.1	Very low	41	Very low	79 Å²	79	105 Å²	105	55%	0.552	61%	0.606	S	S	*	*			trans	-122.5	12.6	175.3	-165	0	0	0	0	113.4	T403 G407	T403-S405 PolarHBondContact O-N 3.42Å; S405-G407 VanDerWaalsContact C-N 3.3Å; S405-G407 PolarHBondContact O-N 3.5Å
406	D	40.7	Very low	42.8	Very low	132 Å²	132	102.1 Å²	102.1	71%	0.706	60%	0.596	S	S	*	*	H	α-helix	trans	-83	3.8	-172.3	-69.2	-17.6	0	0	0	114.7
407	G	45.1	Very low	44.7	Very low	54 Å²	54	100 Å²	100	56%	0.557	58%	0.578	S	S	*	*	H	α-helix	trans	-86.5	-32.6	-174.7	0	0	0	0	0	115.2	S405	S405-G407 VanDerWaalsContact C-N 3.3Å; S405-G407 PolarHBondContact O-N 3.5Å
408	E	44.7	Very low	46.5	Very low	161 Å²	161	92.7 Å²	92.7	75%	0.752	54%	0.539	S	S	*	.	H	α-helix	trans	-87.6	-29.4	-175.9	-66.6	-170.9	160.9	0	0	112.3	D410 T412	E408-D410 VanDerWaalsContact C-N 3.34Å; E408-D410 PolarHBondContact O-N 3.37Å; E408-T412 PolarHBondContact O-N 2.72Å; E408-T412 PolarHBondContact O-OG1 2.94Å; E408-T412 VanDerWaalsContact O-OG1 3.13Å
409	D	44.5	Very low	48.7	Very low	106 Å²	106	93 Å²	93	57%	0.567	53%	0.527	S	S	*	.	H	α-helix	trans	-69.8	-30.1	177.8	-73.2	-22.7	0	0	0	112.6	T412 S413	D409-T412 PolarHBondContact O-OG1 3.45Å; D409-T412 VanDerWaalsContact O-OG1 3.09Å; D409-S413 WeakPolarHBondContact O-CB 3.24Å; D409-S413 PolarHBondContact O-N 3.13Å
410	D	51.4	Low	51.1	Low	65 Å²	65	89.3 Å²	89.3	35%	0.348	51%	0.505	S	S	.	.	H	α-helix	trans	-73	-37.4	179.3	-88.8	-10.4	0	0	0	112.5	E408 S413 I414	E408-D410 VanDerWaalsContact C-N 3.34Å; E408-D410 PolarHBondContact O-N 3.37Å; D410-S413 WeakPolarHBondContact O-CB 3.23Å; D410-S413 PolarHBondContact O-N 2.92Å; D410-I414 WeakPolarHBondContact O-CG1 3.37Å; D410-I414 PolarHBondContact O-N 3.19Å
411	V	54	Low	53.2	Low	44 Å²	44	89 Å²	89	27%	0.267	49%	0.487	S	S	.	.	H	α-helix	trans	-73.8	-41.1	-177.6	-178.6	0	0	0	0	111.2	S413 I414 E415	V411-S413 PolarHBondContact O-N 3.01Å; V411-I414 PolarHBondContact O-N 3.14Å; V411-E415 PolarHBondContact O-N 3.21Å; V411-E415 VanDerWaalsContact O-N 3.15Å
412	T	56.3	Low	55.3	Low	70 Å²	70	88 Å²	88	43%	0.429	47%	0.471	S	S	.	.	H	α-helix	trans	-64.4	-31.8	175.1	50.8	0	0	0	0	111.8	E408 D409 N416	E408-T412 PolarHBondContact O-N 2.72Å; E408-T412 PolarHBondContact O-OG1 2.94Å; E408-T412 VanDerWaalsContact O-OG1 3.13Å; D409-T412 PolarHBondContact O-OG1 3.45Å; D409-T412 VanDerWaalsContact O-OG1 3.09Å; T412-N416 WeakPolarHBondContact O-CB 3.3Å; T412-N416 PolarHBondContact O-N 2.88Å; T412-N416 VanDerWaalsContact O-N 3.11Å; T412-N416 PolarHBondContact O-ND2 3.47Å; T412-N416 VanDerWaalsContact O-ND2 3.1Å
413	S	60.4	Low	57.8	Low	58 Å²	58	84.9 Å²	84.9	41%	0.406	46%	0.457	S	S	.	.	H	α-helix	trans	-64.5	-40.3	173.8	-156.6	0	0	0	0	112.8	D409 D410 V411 Y417	D409-S413 WeakPolarHBondContact O-CB 3.24Å; D409-S413 PolarHBondContact O-N 3.13Å; D410-S413 WeakPolarHBondContact O-CB 3.23Å; D410-S413 PolarHBondContact O-N 2.92Å; V411-S413 PolarHBondContact O-N 3.01Å; S413-Y417 WeakPolarHBondContact O-CB 3.23Å; S413-Y417 PolarHBondContact O-N 3.41Å
414	I	63	Low	60.3	Low	10 Å²	10	84 Å²	84	5%	0.051	44%	0.444	C	S	.	.	H	α-helix	trans	-65.2	-49.7	176	-61.9	166.6	0	0	0	110.5	V375 D410 V411 N416 Y417 M418	V375-I414 HydrophobicContact CG2-CD1 3.43Å; V375-I414 VanDerWaalsContact CG2-CD1 3.43Å; V375-I414 HydrophobicContact CG2-CG1 3.42Å; V375-I414 VanDerWaalsContact CG2-CG1 3.42Å; D410-I414 WeakPolarHBondContact O-CG1 3.37Å; D410-I414 PolarHBondContact O-N 3.19Å; V411-I414 PolarHBondContact O-N 3.14Å; I414-N416 VanDerWaalsContact C-N 3.25Å; I414-N416 PolarHBondContact O-N 2.98Å; I414-Y417 PolarHBondContact O-N 3.32Å; I414-M418 HydrophobicContact CG2-CG 4.14Å; I414-M418 VanDerWaalsContact O-CG 3.27Å; I414-M418 WeakPolarHBondContact O-CG 3.31Å; I414-M418 PolarHBondContact O-N 2.95Å
415	E	65.4	Low	62.4	Low	86 Å²	86	77.2 Å²	77.2	40%	0.402	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-40	-179.9	-73.7	-172.4	179.7	0	0	111.9	V411 K419	V411-E415 PolarHBondContact O-N 3.21Å; V411-E415 VanDerWaalsContact O-N 3.15Å; E415-K419 WeakPolarHBondContact O-CG 3.4Å; E415-K419 PolarHBondContact O-N 2.85Å
416	N	70.6	Confident	64.6	Low	100 Å²	100	77.9 Å²	77.9	54%	0.535	40%	0.404	S	S	.	.	H	α-helix	trans	-67.9	-43.3	177.2	-71.2	-25.8	0	0	0	112.2	T412 I414 M418 K419 E420	T412-N416 WeakPolarHBondContact O-CB 3.3Å; T412-N416 PolarHBondContact O-N 2.88Å; T412-N416 VanDerWaalsContact O-N 3.11Å; T412-N416 PolarHBondContact O-ND2 3.47Å; T412-N416 VanDerWaalsContact O-ND2 3.1Å; I414-N416 VanDerWaalsContact C-N 3.25Å; I414-N416 PolarHBondContact O-N 2.98Å; N416-M418 PolarHBondContact O-N 2.59Å; N416-K419 PolarHBondContact O-N 3.19Å; N416-E420 WeakPolarHBondContact O-CB 3.4Å; N416-E420 PolarHBondContact O-N 3.18Å
417	Y	71.5	Confident	66.6	Low	56 Å²	56	74.2 Å²	74.2	22%	0.22	39%	0.392	C	S	.	.	H	α-helix	trans	-61.8	-43.1	175.5	176.8	-104.5	0	0	0	112.1	I378 S413 I414 K419 E420 Q421	I378-Y417 HydrophobicContact CB-CE2 4.41Å; I378-Y417 HydrophobicContact CD1-CD1 3.72Å; I378-Y417 HydrophobicContact CD1-CD2 4.29Å; I378-Y417 HydrophobicContact CD1-CE1 4.28Å; I378-Y417 HydrophobicContact CD1-CG 3.71Å; I378-Y417 HydrophobicContact CG1-CD1 3.82Å; I378-Y417 HydrophobicContact CG1-CD2 4.3Å; I378-Y417 HydrophobicContact CG1-CE1 3.85Å; I378-Y417 HydrophobicContact CG1-CE2 4.34Å; I378-Y417 HydrophobicContact CG1-CG 4.04Å; I378-Y417 HydrophobicContact CG2-CD2 3.5Å; I378-Y417 HydrophobicContact CG2-CE2 3.48Å; I378-Y417 VanDerWaalsContact CG2-CE2 3.48Å; I378-Y417 HydrophobicContact CG2-CG 4.06Å; S413-Y417 WeakPolarHBondContact O-CB 3.23Å; S413-Y417 PolarHBondContact O-N 3.41Å; I414-Y417 PolarHBondContact O-N 3.32Å; Y417-K419 PolarHBondContact O-N 3.34Å; Y417-E420 PolarHBondContact O-N 3.18Å; Y417-Q421 HydrophobicContact CD1-CG 4.39Å; Y417-Q421 HydrophobicContact CE1-CG 3.95Å; Y417-Q421 HydrophobicContact CE2-CG 4.1Å; Y417-Q421 WeakPolarHBondContact O-CG 3.21Å; Y417-Q421 PolarHBondContact O-N 3.24Å
418	M	67.7	Low	68.3	Low	15 Å²	15	74.6 Å²	74.6	7%	0.074	38%	0.38	C	S	.	.	H	α-helix	trans	-66.8	-37.5	179.7	-63.9	-50.7	-80.5	0	0	112	I414 N416 Q422 L457 E460 Q461	I414-M418 HydrophobicContact CG2-CG 4.14Å; I414-M418 VanDerWaalsContact O-CG 3.27Å; I414-M418 WeakPolarHBondContact O-CG 3.31Å; I414-M418 PolarHBondContact O-N 2.95Å; N416-M418 PolarHBondContact O-N 2.59Å; M418-Q422 WeakPolarHBondContact O-CG 3.48Å; M418-Q422 PolarHBondContact O-N 2.94Å; M418-Q422 VanDerWaalsContact O-N 3.08Å; M418-L457 HydrophobicContact CE-CD1 3.59Å; M418-L457 HydrophobicContact CE-CG 4.26Å; M418-L457 HydrophobicContact SD-CD1 4.36Å; M418-E460 HydrophobicContact CE-CB 4.41Å; M418-E460 HydrophobicContact CE-CG 4.35Å; M418-Q461 HydrophobicContact CE-CB 4.26Å; M418-Q461 HydrophobicContact CE-CG 3.15Å
419	K	75.6	Confident	69.8	Low	113 Å²	113	70 Å²	70	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-63.3	-44.6	171.7	-78.9	175.6	-178.2	168.1	0	111.7	E415 N416 Y417 Q421 Q422 E423	E415-K419 WeakPolarHBondContact O-CG 3.4Å; E415-K419 PolarHBondContact O-N 2.85Å; N416-K419 PolarHBondContact O-N 3.19Å; Y417-K419 PolarHBondContact O-N 3.34Å; K419-Q421 VanDerWaalsContact C-N 3.33Å; K419-Q421 PolarHBondContact O-N 3.24Å; K419-Q422 PolarHBondContact O-N 2.94Å; K419-E423 WeakPolarHBondContact O-CG 3.39Å; K419-E423 PolarHBondContact O-N 3.47Å
420	E	78.1	Confident	71.5	Confident	89 Å²	89	69.2 Å²	69.2	42%	0.416	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-39.7	179.1	-163.2	-169.2	155.5	0	0	112	N416 Y417 E423 K424	N416-E420 WeakPolarHBondContact O-CB 3.4Å; N416-E420 PolarHBondContact O-N 3.18Å; Y417-E420 PolarHBondContact O-N 3.18Å; E420-E423 PolarHBondContact O-N 3.4Å; E420-K424 HydrophobicContact CG-CD 4.47Å; E420-K424 WeakPolarHBondContact O-CB 3.5Å; E420-K424 VanDerWaalsContact O-CG 3.3Å; E420-K424 WeakPolarHBondContact O-CG 3.41Å; E420-K424 PolarHBondContact O-N 2.9Å; E420-K424 WeakPolarHBondContact OE1-CE 3.44Å; E420-K424 IonicContact OE1-NZ 2.63Å; E420-K424 PolarHBondContact OE1-NZ 2.84Å
421	Q	73.4	Confident	72.9	Confident	53 Å²	53	72.1 Å²	72.1	25%	0.248	36%	0.364	C	S	.	.	H	α-helix	trans	-67.2	-38.6	174.8	-68.7	-59.9	-40.7	0	0	112.5	Y417 K419 K424 L425 L457	Y417-Q421 HydrophobicContact CD1-CG 4.39Å; Y417-Q421 HydrophobicContact CE1-CG 3.95Å; Y417-Q421 HydrophobicContact CE2-CG 4.1Å; Y417-Q421 WeakPolarHBondContact O-CG 3.21Å; Y417-Q421 PolarHBondContact O-N 3.24Å; K419-Q421 VanDerWaalsContact C-N 3.33Å; K419-Q421 PolarHBondContact O-N 3.24Å; Q421-K424 PolarHBondContact O-N 3.34Å; Q421-L425 WeakPolarHBondContact O-CG 3.4Å; Q421-L425 PolarHBondContact O-N 3.25Å; Q421-L457 HydrophobicContact CB-CD1 4.01Å; Q421-L457 HydrophobicContact CB-CD2 3.94Å
422	Q	74.9	Confident	74	Confident	78 Å²	78	70.4 Å²	70.4	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-64.4	-44.1	174.3	-77.3	-179.7	-27.3	0	0	111.8	M418 K419 K424 L425 L426 L457 Q461	M418-Q422 WeakPolarHBondContact O-CG 3.48Å; M418-Q422 PolarHBondContact O-N 2.94Å; M418-Q422 VanDerWaalsContact O-N 3.08Å; K419-Q422 PolarHBondContact O-N 2.94Å; Q422-K424 VanDerWaalsContact C-N 3.35Å; Q422-K424 PolarHBondContact O-N 3.14Å; Q422-L425 PolarHBondContact O-N 3.09Å; Q422-L426 WeakPolarHBondContact O-CB 3.39Å; Q422-L426 VanDerWaalsContact O-CG 3.31Å; Q422-L426 WeakPolarHBondContact O-CG 3.49Å; Q422-L426 PolarHBondContact O-N 3.31Å; Q422-L457 HydrophobicContact CG-CD2 3.82Å; Q422-Q461 VanDerWaalsContact NE2-CD 3.32Å
423	E	81.1	Confident	74.8	Confident	132 Å²	132	70.9 Å²	70.9	62%	0.617	35%	0.353	S	S	*	.	H	α-helix	trans	-62.9	-41.2	177	-75	-179.3	177.8	0	0	111.7	K419 E420 L426 A427	K419-E423 WeakPolarHBondContact O-CG 3.39Å; K419-E423 PolarHBondContact O-N 3.47Å; E420-E423 PolarHBondContact O-N 3.4Å; E423-L426 PolarHBondContact O-N 2.81Å; E423-A427 WeakPolarHBondContact O-CB 3.45Å; E423-A427 PolarHBondContact O-N 2.94Å
424	K	81.2	Confident	75.5	Confident	94 Å²	94	74 Å²	74	41%	0.409	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-45.6	174.3	-77.9	168.2	172.5	165.9	0	112.4	E420 Q421 Q422 L426 A427 E428	E420-K424 HydrophobicContact CG-CD 4.47Å; E420-K424 WeakPolarHBondContact O-CB 3.5Å; E420-K424 VanDerWaalsContact O-CG 3.3Å; E420-K424 WeakPolarHBondContact O-CG 3.41Å; E420-K424 PolarHBondContact O-N 2.9Å; E420-K424 WeakPolarHBondContact OE1-CE 3.44Å; E420-K424 IonicContact OE1-NZ 2.63Å; E420-K424 PolarHBondContact OE1-NZ 2.84Å; Q421-K424 PolarHBondContact O-N 3.34Å; Q422-K424 VanDerWaalsContact C-N 3.35Å; Q422-K424 PolarHBondContact O-N 3.14Å; K424-L426 VanDerWaalsContact C-N 3.34Å; K424-L426 PolarHBondContact O-N 2.81Å; K424-A427 PolarHBondContact O-N 2.74Å; K424-E428 WeakPolarHBondContact O-CB 3.43Å; K424-E428 PolarHBondContact O-N 2.96Å
425	L	77.5	Confident	76	Confident	26 Å²	26	77.2 Å²	77.2	14%	0.136	38%	0.383	C	S	.	.	H	α-helix	trans	-65.1	-37.6	176.5	-77.4	175.8	0	0	0	112.3	Q421 Q422 K429 L450 K453 L457	Q421-L425 WeakPolarHBondContact O-CG 3.4Å; Q421-L425 PolarHBondContact O-N 3.25Å; Q422-L425 PolarHBondContact O-N 3.09Å; L425-K429 WeakPolarHBondContact O-CB 3.43Å; L425-K429 PolarHBondContact O-N 3.19Å; L425-L450 HydrophobicContact CD2-CD2 3.91Å; L425-K453 HydrophobicContact CD2-CB 3.85Å; L425-K453 HydrophobicContact CD2-CD 3.96Å; L425-L457 HydrophobicContact CD1-CB 4.33Å; L425-L457 HydrophobicContact CD1-CD2 3.63Å
426	L	80.3	Confident	76	Confident	93 Å²	93	80.6 Å²	80.6	49%	0.487	40%	0.403	S	S	.	.	H	α-helix	trans	-66.6	-40.4	175.2	-75.9	168	0	0	0	111.7	Q422 E423 K424 K429 N430	Q422-L426 WeakPolarHBondContact O-CB 3.39Å; Q422-L426 VanDerWaalsContact O-CG 3.31Å; Q422-L426 WeakPolarHBondContact O-CG 3.49Å; Q422-L426 PolarHBondContact O-N 3.31Å; E423-L426 PolarHBondContact O-N 2.81Å; K424-L426 VanDerWaalsContact C-N 3.34Å; K424-L426 PolarHBondContact O-N 2.81Å; L426-K429 PolarHBondContact O-N 2.87Å; L426-N430 WeakPolarHBondContact O-CB 3.29Å; L426-N430 VanDerWaalsContact O-CG 3.25Å; L426-N430 PolarHBondContact O-N 3.45Å; L426-N430 PolarHBondContact O-ND2 2.72Å
427	A	82.4	Confident	75.8	Confident	56 Å²	56	81.4 Å²	81.4	46%	0.463	42%	0.417	S	S	.	.	H	α-helix	trans	-63.3	-48.8	174.7	0	0	0	0	0	111.5	E423 K424 K429 N430 E431	E423-A427 WeakPolarHBondContact O-CB 3.45Å; E423-A427 PolarHBondContact O-N 2.94Å; K424-A427 PolarHBondContact O-N 2.74Å; A427-K429 VanDerWaalsContact C-N 3.31Å; A427-K429 PolarHBondContact O-N 2.77Å; A427-N430 PolarHBondContact O-N 3.08Å; A427-E431 WeakPolarHBondContact O-CB 3.33Å; A427-E431 PolarHBondContact O-N 3.04Å
428	E	80.3	Confident	75.4	Confident	62 Å²	62	81.2 Å²	81.2	29%	0.29	42%	0.42	S	S	.	.	H	α-helix	trans	-61.5	-38.9	178.2	-159.1	-177.9	170	0	0	111	K424 E431 V432 L450 K453	K424-E428 WeakPolarHBondContact O-CB 3.43Å; K424-E428 PolarHBondContact O-N 2.96Å; E428-E431 PolarHBondContact O-N 2.79Å; E428-V432 VanDerWaalsContact O-CG2 3.29Å; E428-V432 WeakPolarHBondContact O-CG2 3.49Å; E428-V432 PolarHBondContact O-N 3.01Å; E428-L450 HydrophobicContact CB-CD2 3.97Å; E428-L450 VanDerWaalsContact CD-CD2 3.49Å; E428-L450 HydrophobicContact CG-CD1 4.46Å; E428-L450 HydrophobicContact CG-CD2 3.83Å; E428-L450 WeakPolarHBondContact OE2-CD2 3.43Å; E428-K453 IonicContact OE1-NZ 3.22Å; E428-K453 PolarHBondContact OE1-NZ 3.07Å; E428-K453 IonicContact OE2-NZ 3.52Å
429	K	77	Confident	75.4	Confident	65 Å²	65	84.8 Å²	84.8	28%	0.283	44%	0.442	S	S	.	.	H	α-helix	trans	-64.6	-42.9	174.7	-173.8	172.8	-174.5	167.6	0	112.5	L425 L426 A427 L433 L450 E454	L425-K429 WeakPolarHBondContact O-CB 3.43Å; L425-K429 PolarHBondContact O-N 3.19Å; L426-K429 PolarHBondContact O-N 2.87Å; A427-K429 VanDerWaalsContact C-N 3.31Å; A427-K429 PolarHBondContact O-N 2.77Å; K429-L433 HydrophobicContact CG-CD1 4.1Å; K429-L433 WeakPolarHBondContact O-CB 3.5Å; K429-L433 WeakPolarHBondContact O-CD1 3.07Å; K429-L433 WeakPolarHBondContact O-CG 3.49Å; K429-L433 PolarHBondContact O-N 3.05Å; K429-L450 HydrophobicContact CB-CD1 4.16Å; K429-E454 IonicContact NZ-OE1 3.77Å; K429-E454 IonicContact NZ-OE2 3.93Å; K429-E454 PolarHBondContact NZ-OE2 3Å
430	N	79.5	Confident	75.3	Confident	88 Å²	88	83.3 Å²	83.3	47%	0.471	45%	0.451	S	S	.	.	H	α-helix	trans	-68.5	-37	177.5	-75.3	-24.1	0	0	0	112.2	L426 A427 L433 N434	L426-N430 WeakPolarHBondContact O-CB 3.29Å; L426-N430 VanDerWaalsContact O-CG 3.25Å; L426-N430 PolarHBondContact O-N 3.45Å; L426-N430 PolarHBondContact O-ND2 2.72Å; A427-N430 PolarHBondContact O-N 3.08Å; N430-L433 PolarHBondContact O-N 3.47Å; N430-N434 WeakPolarHBondContact O-CB 3.39Å; N430-N434 VanDerWaalsContact O-CG 3.27Å; N430-N434 PolarHBondContact O-N 3.47Å; N430-N434 PolarHBondContact O-ND2 2.87Å
431	E	80.4	Confident	74.9	Confident	126 Å²	126	85.4 Å²	85.4	59%	0.589	46%	0.461	S	S	*	.	H	α-helix	trans	-63.5	-50.5	176.2	-168.7	171.5	-168	0	0	110.9	A427 E428 L433 N434 D435	A427-E431 WeakPolarHBondContact O-CB 3.33Å; A427-E431 PolarHBondContact O-N 3.04Å; E428-E431 PolarHBondContact O-N 2.79Å; E431-L433 VanDerWaalsContact C-N 3.26Å; E431-L433 PolarHBondContact O-N 3.48Å; E431-N434 PolarHBondContact O-N 3Å; E431-N434 VanDerWaalsContact O-N 3.16Å; E431-D435 PolarHBondContact O-N 3.16Å
432	V	76.9	Confident	74.9	Confident	8 Å²	8	87.9 Å²	87.9	5%	0.048	47%	0.472	C	S	.	.	H	α-helix	trans	-62.1	-32.8	176.2	174.1	0	0	0	0	112.2	E428 K443 M446 L447 L450	E428-V432 VanDerWaalsContact O-CG2 3.29Å; E428-V432 WeakPolarHBondContact O-CG2 3.49Å; E428-V432 PolarHBondContact O-N 3.01Å; V432-K443 HydrophobicContact CG1-CG 4.09Å; V432-K443 WeakPolarHBondContact O-CE 3.38Å; V432-K443 PolarHBondContact O-NZ 3.4Å; V432-M446 HydrophobicContact CG1-CB 3.89Å; V432-M446 HydrophobicContact CG2-CB 4.16Å; V432-M446 HydrophobicContact CG2-CE 4.24Å; V432-L447 HydrophobicContact CG1-CD2 4.19Å; V432-L447 HydrophobicContact CG1-CG 4.04Å; V432-L450 HydrophobicContact CG2-CD1 4.2Å
433	L	74.4	Confident	74.9	Confident	81 Å²	81	86.3 Å²	86.3	42%	0.424	46%	0.464	S	S	.	.	H	α-helix	trans	-70.5	-40.5	175.8	-88.5	158.3	0	0	0	112.7	K429 N430 E431 K443	K429-L433 HydrophobicContact CG-CD1 4.1Å; K429-L433 WeakPolarHBondContact O-CB 3.5Å; K429-L433 WeakPolarHBondContact O-CD1 3.07Å; K429-L433 WeakPolarHBondContact O-CG 3.49Å; K429-L433 PolarHBondContact O-N 3.05Å; N430-L433 PolarHBondContact O-N 3.47Å; E431-L433 VanDerWaalsContact C-N 3.26Å; E431-L433 PolarHBondContact O-N 3.48Å; L433-K443 PolarHBondContact O-NZ 3.3Å
434	N	74.3	Confident	74.7	Confident	124 Å²	124	83 Å²	83	66%	0.663	46%	0.456	S	S	*	.	H	α-helix	trans	-82.9	-19.9	-176.3	-72.4	-19.4	0	0	0	113.7	N430 E431 N436	N430-N434 WeakPolarHBondContact O-CB 3.39Å; N430-N434 VanDerWaalsContact O-CG 3.27Å; N430-N434 PolarHBondContact O-N 3.47Å; N430-N434 PolarHBondContact O-ND2 2.87Å; E431-N434 PolarHBondContact O-N 3Å; E431-N434 VanDerWaalsContact O-N 3.16Å; N434-N436 PolarHBondContact O-N 2.94Å
435	D	73.9	Confident	74.7	Confident	76 Å²	76	86.4 Å²	86.4	41%	0.406	47%	0.466	S	S	.	.			trans	-71.1	103.8	174.8	-83.9	-14.3	0	0	0	111.3	E431 S437 L438 K443	E431-D435 PolarHBondContact O-N 3.16Å; D435-S437 VanDerWaalsContact C-N 3.29Å; D435-L438 HydrophobicContact CB-CD1 3.69Å; D435-L438 HydrophobicContact CB-CG 4.25Å; D435-K443 PolarHBondContact O-NZ 2.87Å
436	N	64.5	Low	74.6	Confident	157 Å²	157	88.9 Å²	88.9	84%	0.84	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.8	174.5	-72.2	-27	0	0	0	113.1	N434	N434-N436 PolarHBondContact O-N 2.94Å
437	S	68	Low	74.6	Confident	118 Å²	118	86.5 Å²	86.5	83%	0.825	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-9.5	-179.2	-168.9	0	0	0	0	113.8	D435	D435-S437 VanDerWaalsContact C-N 3.29Å
438	L	62.2	Low	74.6	Confident	52 Å²	52	87.5 Å²	87.5	27%	0.272	46%	0.463	S	S	.	.	S	Bend	trans	-79.6	134.5	179.8	-78.3	161.2	0	0	0	110.8	D435 A440 E442 K443	D435-L438 HydrophobicContact CB-CD1 3.69Å; D435-L438 HydrophobicContact CB-CG 4.25Å; L438-A440 PolarHBondContact O-N 2.84Å; L438-E442 HydrophobicContact CD2-CB 4.26Å; L438-K443 HydrophobicContact CB-CB 4.25Å
439	V	68.2	Low	74.7	Confident	90 Å²	90	88.8 Å²	88.8	55%	0.545	47%	0.472	S	S	.	.			trans	-58.9	137.5	170.4	179.7	0	0	0	0	108.3	E441 E442 K443	V439-E441 HydrophobicContact CG1-CB 4.37Å; V439-E441 PolarHBondContact O-N 2.9Å; V439-E442 HydrophobicContact CB-CG 4.47Å; V439-E442 PolarHBondContact O-N 2.96Å; V439-K443 PolarHBondContact O-N 3.37Å
440	A	71.9	Confident	74.9	Confident	82 Å²	82	86 Å²	86	68%	0.678	46%	0.46	S	S	*	.	H	α-helix	trans	-52.4	-32.9	-176.1	0	0	0	0	0	113.3	L438 S444	L438-A440 PolarHBondContact O-N 2.84Å; A440-S444 WeakPolarHBondContact O-CB 3.43Å; A440-S444 PolarHBondContact O-N 3.46Å
441	E	70.8	Confident	74.9	Confident	133 Å²	133	87.1 Å²	87.1	62%	0.621	46%	0.461	S	S	*	.	H	α-helix	trans	-67.5	-44.4	174.2	-67.8	-169.8	177.2	0	0	113.4	V439 S444 R445	V439-E441 HydrophobicContact CG1-CB 4.37Å; V439-E441 PolarHBondContact O-N 2.9Å; E441-S444 PolarHBondContact O-N 2.91Å; E441-R445 WeakPolarHBondContact O-CG 3.38Å; E441-R445 PolarHBondContact O-N 3.2Å
442	E	74.2	Confident	75.1	Confident	105 Å²	105	85.3 Å²	85.3	49%	0.491	45%	0.454	S	S	.	.	H	α-helix	trans	-67.1	-41.9	177.6	-70.9	-175.2	154.3	0	0	111.1	L438 V439 S444 R445 M446	L438-E442 HydrophobicContact CD2-CB 4.26Å; V439-E442 HydrophobicContact CB-CG 4.47Å; V439-E442 PolarHBondContact O-N 2.96Å; E442-S444 VanDerWaalsContact C-N 3.29Å; E442-S444 PolarHBondContact O-N 2.96Å; E442-R445 PolarHBondContact O-N 3.4Å; E442-M446 WeakPolarHBondContact O-CG 3.41Å; E442-M446 PolarHBondContact O-N 3.34Å
443	K	74.3	Confident	75.2	Confident	44 Å²	44	89.4 Å²	89.4	19%	0.191	47%	0.471	C	S	.	.	H	α-helix	trans	-58.4	-41.9	173.1	-171.7	168.5	-174.3	148.9	0	111.6	V432 L433 D435 L438 V439 L447	V432-K443 HydrophobicContact CG1-CG 4.09Å; V432-K443 WeakPolarHBondContact O-CE 3.38Å; V432-K443 PolarHBondContact O-NZ 3.4Å; L433-K443 PolarHBondContact O-NZ 3.3Å; D435-K443 PolarHBondContact O-NZ 2.87Å; L438-K443 HydrophobicContact CB-CB 4.25Å; V439-K443 PolarHBondContact O-N 3.37Å; K443-L447 HydrophobicContact CG-CD1 4.23Å; K443-L447 WeakPolarHBondContact O-CB 3.27Å; K443-L447 VanDerWaalsContact O-CG 3.24Å; K443-L447 WeakPolarHBondContact O-CG 3.44Å; K443-L447 PolarHBondContact O-N 3.44Å
444	S	76.8	Confident	75.4	Confident	62 Å²	62	88.5 Å²	88.5	43%	0.434	47%	0.465	S	S	.	.	H	α-helix	trans	-66.2	-40.8	176.5	-172.1	0	0	0	0	112.7	A440 E441 E442 L447 N448	A440-S444 WeakPolarHBondContact O-CB 3.43Å; A440-S444 PolarHBondContact O-N 3.46Å; E441-S444 PolarHBondContact O-N 2.91Å; E442-S444 VanDerWaalsContact C-N 3.29Å; E442-S444 PolarHBondContact O-N 2.96Å; S444-L447 PolarHBondContact O-N 2.93Å; S444-N448 WeakPolarHBondContact O-CB 3.36Å; S444-N448 VanDerWaalsContact O-CG 3.3Å; S444-N448 PolarHBondContact O-N 3Å; S444-N448 PolarHBondContact O-ND2 2.79Å
445	R	81.7	Confident	75.9	Confident	166 Å²	166	86.9 Å²	86.9	63%	0.626	46%	0.455	S	S	*	.	H	α-helix	trans	-62.9	-49.3	175.2	-71.1	177.1	-172	-169.2	5.4	111.8	E441 E442 L447 N448 D449	E441-R445 WeakPolarHBondContact O-CG 3.38Å; E441-R445 PolarHBondContact O-N 3.2Å; E442-R445 PolarHBondContact O-N 3.4Å; R445-L447 VanDerWaalsContact C-N 3.33Å; R445-L447 PolarHBondContact O-N 3.12Å; R445-N448 PolarHBondContact O-N 2.99Å; R445-N448 VanDerWaalsContact O-N 3.11Å; R445-D449 PolarHBondContact O-N 2.82Å
446	M	75	Confident	76.2	Confident	78 Å²	78	89.8 Å²	89.8	38%	0.384	46%	0.464	S	S	.	.	H	α-helix	trans	-60.4	-41.6	178.2	-68.7	-67.3	-75.4	0	0	112	V432 E442 N448 D449 L450	V432-M446 HydrophobicContact CG1-CB 3.89Å; V432-M446 HydrophobicContact CG2-CB 4.16Å; V432-M446 HydrophobicContact CG2-CE 4.24Å; E442-M446 WeakPolarHBondContact O-CG 3.41Å; E442-M446 PolarHBondContact O-N 3.34Å; M446-N448 PolarHBondContact O-N 3.3Å; M446-D449 PolarHBondContact O-N 2.86Å; M446-L450 WeakPolarHBondContact O-CB 3.43Å; M446-L450 VanDerWaalsContact O-CG 3.29Å; M446-L450 WeakPolarHBondContact O-CG 3.46Å; M446-L450 PolarHBondContact O-N 2.87Å
447	L	80.7	Confident	76.8	Confident	43 Å²	43	83.3 Å²	83.3	23%	0.225	43%	0.429	C	S	.	.	H	α-helix	trans	-65.7	-35.3	175.1	-74.5	172.4	0	0	0	112.9	V432 K443 S444 R445 K451	V432-L447 HydrophobicContact CG1-CD2 4.19Å; V432-L447 HydrophobicContact CG1-CG 4.04Å; K443-L447 HydrophobicContact CG-CD1 4.23Å; K443-L447 WeakPolarHBondContact O-CB 3.27Å; K443-L447 VanDerWaalsContact O-CG 3.24Å; K443-L447 WeakPolarHBondContact O-CG 3.44Å; K443-L447 PolarHBondContact O-N 3.44Å; S444-L447 PolarHBondContact O-N 2.93Å; R445-L447 VanDerWaalsContact C-N 3.33Å; R445-L447 PolarHBondContact O-N 3.12Å; L447-K451 WeakPolarHBondContact O-CB 3.35Å; L447-K451 VanDerWaalsContact O-CG 3.27Å; L447-K451 WeakPolarHBondContact O-CG 3.27Å; L447-K451 PolarHBondContact O-N 3.21Å
448	N	81.7	Confident	77.3	Confident	78 Å²	78	82.4 Å²	82.4	42%	0.417	41%	0.412	S	S	.	.	H	α-helix	trans	-70.6	-41	175.6	-74.1	-22.4	0	0	0	111.7	S444 R445 M446 K451 I452	S444-N448 WeakPolarHBondContact O-CB 3.36Å; S444-N448 VanDerWaalsContact O-CG 3.3Å; S444-N448 PolarHBondContact O-N 3Å; S444-N448 PolarHBondContact O-ND2 2.79Å; R445-N448 PolarHBondContact O-N 2.99Å; R445-N448 VanDerWaalsContact O-N 3.11Å; M446-N448 PolarHBondContact O-N 3.3Å; N448-K451 WeakPolarHBondContact O-CB 3.41Å; N448-K451 PolarHBondContact O-N 2.92Å; N448-I452 WeakPolarHBondContact O-CG1 3.37Å; N448-I452 PolarHBondContact O-N 3.36Å
449	D	82.1	Confident	78.1	Confident	88 Å²	88	84.6 Å²	84.6	47%	0.471	42%	0.421	S	S	.	.	H	α-helix	trans	-64.1	-41.2	175.3	-72.5	-16.9	0	0	0	111.7	R445 M446 I452 K453	R445-D449 PolarHBondContact O-N 2.82Å; M446-D449 PolarHBondContact O-N 2.86Å; D449-I452 PolarHBondContact O-N 2.95Å; D449-K453 WeakPolarHBondContact O-CG 3.24Å; D449-K453 PolarHBondContact O-N 2.88Å
450	L	81.6	Confident	78.5	Confident	7 Å²	7	84.5 Å²	84.5	4%	0.037	42%	0.415	C	S	.	.	H	α-helix	trans	-61.8	-42.1	172.6	-76.9	174.9	0	0	0	112.3	L425 E428 K429 V432 M446 I452 K453 E454	L425-L450 HydrophobicContact CD2-CD2 3.91Å; E428-L450 HydrophobicContact CB-CD2 3.97Å; E428-L450 VanDerWaalsContact CD-CD2 3.49Å; E428-L450 HydrophobicContact CG-CD1 4.46Å; E428-L450 HydrophobicContact CG-CD2 3.83Å; E428-L450 WeakPolarHBondContact OE2-CD2 3.43Å; K429-L450 HydrophobicContact CB-CD1 4.16Å; V432-L450 HydrophobicContact CG2-CD1 4.2Å; M446-L450 WeakPolarHBondContact O-CB 3.43Å; M446-L450 VanDerWaalsContact O-CG 3.29Å; M446-L450 WeakPolarHBondContact O-CG 3.46Å; M446-L450 PolarHBondContact O-N 2.87Å; L450-I452 VanDerWaalsContact C-N 3.33Å; L450-I452 PolarHBondContact O-N 2.88Å; L450-K453 PolarHBondContact O-N 3.08Å; L450-E454 VanDerWaalsContact O-CB 3.28Å; L450-E454 WeakPolarHBondContact O-CB 3.25Å; L450-E454 PolarHBondContact O-N 3.27Å
451	K	80.4	Confident	78.7	Confident	112 Å²	112	81.7 Å²	81.7	49%	0.487	39%	0.388	S	S	.	.	H	α-helix	trans	-61.7	-40.5	173.7	-77.8	172.5	-176	175.1	0	112	L447 N448 E454 I455	L447-K451 WeakPolarHBondContact O-CB 3.35Å; L447-K451 VanDerWaalsContact O-CG 3.27Å; L447-K451 WeakPolarHBondContact O-CG 3.27Å; L447-K451 PolarHBondContact O-N 3.21Å; N448-K451 WeakPolarHBondContact O-CB 3.41Å; N448-K451 PolarHBondContact O-N 2.92Å; K451-E454 PolarHBondContact O-N 2.77Å; K451-I455 VanDerWaalsContact O-CG1 3.24Å; K451-I455 WeakPolarHBondContact O-CG1 3.44Å; K451-I455 PolarHBondContact O-N 3.27Å
452	I	84.6	Confident	79.1	Confident	87 Å²	87	78.5 Å²	78.5	45%	0.446	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-42.9	176.8	-67.7	164.8	0	0	0	110.6	N448 D449 L450 I455 K456	N448-I452 WeakPolarHBondContact O-CG1 3.37Å; N448-I452 PolarHBondContact O-N 3.36Å; D449-I452 PolarHBondContact O-N 2.95Å; L450-I452 VanDerWaalsContact C-N 3.33Å; L450-I452 PolarHBondContact O-N 2.88Å; I452-I455 PolarHBondContact O-N 2.63Å; I452-K456 HydrophobicContact CG2-CD 4.34Å; I452-K456 WeakPolarHBondContact O-CG 3.35Å; I452-K456 PolarHBondContact O-N 2.98Å
453	K	78.6	Confident	79.3	Confident	95 Å²	95	79.3 Å²	79.3	41%	0.413	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-42.8	174	-70.2	176.9	-175.3	172.1	0	111.6	L425 E428 D449 L450 K456 L457	L425-K453 HydrophobicContact CD2-CB 3.85Å; L425-K453 HydrophobicContact CD2-CD 3.96Å; E428-K453 IonicContact OE1-NZ 3.22Å; E428-K453 PolarHBondContact OE1-NZ 3.07Å; E428-K453 IonicContact OE2-NZ 3.52Å; D449-K453 WeakPolarHBondContact O-CG 3.24Å; D449-K453 PolarHBondContact O-N 2.88Å; L450-K453 PolarHBondContact O-N 3.08Å; K453-K456 PolarHBondContact O-N 2.66Å; K453-L457 WeakPolarHBondContact O-CB 3.46Å; K453-L457 PolarHBondContact O-N 3.35Å
454	E	78.6	Confident	79.4	Confident	61 Å²	61	77.7 Å²	77.7	29%	0.285	37%	0.373	S	S	.	.	H	α-helix	trans	-60.8	-45.9	177.4	-174.1	172	-168	0	0	111.1	K429 L450 K451 L457 Q458	K429-E454 IonicContact NZ-OE1 3.77Å; K429-E454 IonicContact NZ-OE2 3.93Å; K429-E454 PolarHBondContact NZ-OE2 3Å; L450-E454 VanDerWaalsContact O-CB 3.28Å; L450-E454 WeakPolarHBondContact O-CB 3.25Å; L450-E454 PolarHBondContact O-N 3.27Å; K451-E454 PolarHBondContact O-N 2.77Å; E454-L457 PolarHBondContact O-N 3.17Å; E454-Q458 WeakPolarHBondContact O-CB 3.5Å; E454-Q458 VanDerWaalsContact O-CG 3.28Å; E454-Q458 WeakPolarHBondContact O-CG 3.46Å; E454-Q458 PolarHBondContact O-N 3.34Å
455	I	84	Confident	79.5	Confident	91 Å²	91	80.1 Å²	80.1	47%	0.467	38%	0.377	S	S	.	.	H	α-helix	trans	-62	-46.2	175.6	-68.7	164.6	0	0	0	111.1	K451 I452 L457 Q458 E459	K451-I455 VanDerWaalsContact O-CG1 3.24Å; K451-I455 WeakPolarHBondContact O-CG1 3.44Å; K451-I455 PolarHBondContact O-N 3.27Å; I452-I455 PolarHBondContact O-N 2.63Å; I455-L457 PolarHBondContact O-N 3.05Å; I455-Q458 PolarHBondContact O-N 3.4Å; I455-E459 WeakPolarHBondContact O-CG 3.44Å; I455-E459 PolarHBondContact O-N 3.25Å
456	K	81	Confident	79.5	Confident	136 Å²	136	77.5 Å²	77.5	59%	0.591	37%	0.372	S	S	*	.	H	α-helix	trans	-62	-42.8	178.4	-74.7	178	-179.4	179.9	0	112.3	I452 K453 E459 E460	I452-K456 HydrophobicContact CG2-CD 4.34Å; I452-K456 WeakPolarHBondContact O-CG 3.35Å; I452-K456 PolarHBondContact O-N 2.98Å; K453-K456 PolarHBondContact O-N 2.66Å; K456-E459 PolarHBondContact O-N 2.89Å; K456-E460 PolarHBondContact O-N 3.09Å
457	L	77.2	Confident	79.5	Confident	21 Å²	21	75.6 Å²	75.6	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-64.8	-41	176.9	-171.7	70.1	0	0	0	110.9	M418 Q421 Q422 L425 K453 E454 I455 E460 Q461	M418-L457 HydrophobicContact CE-CD1 3.59Å; M418-L457 HydrophobicContact CE-CG 4.26Å; M418-L457 HydrophobicContact SD-CD1 4.36Å; Q421-L457 HydrophobicContact CB-CD1 4.01Å; Q421-L457 HydrophobicContact CB-CD2 3.94Å; Q422-L457 HydrophobicContact CG-CD2 3.82Å; L425-L457 HydrophobicContact CD1-CB 4.33Å; L425-L457 HydrophobicContact CD1-CD2 3.63Å; K453-L457 WeakPolarHBondContact O-CB 3.46Å; K453-L457 PolarHBondContact O-N 3.35Å; E454-L457 PolarHBondContact O-N 3.17Å; I455-L457 PolarHBondContact O-N 3.05Å; L457-E460 PolarHBondContact O-N 3.09Å; L457-Q461 VanDerWaalsContact O-CG 3.28Å; L457-Q461 WeakPolarHBondContact O-CG 3.42Å; L457-Q461 PolarHBondContact O-N 3.38Å
458	Q	77	Confident	79.3	Confident	99 Å²	99	74.5 Å²	74.5	46%	0.463	36%	0.357	S	S	.	.	H	α-helix	trans	-64.4	-41	175.2	-75.1	176.7	-0.6	0	0	112.5	E454 I455 E460 Q461 T462	E454-Q458 WeakPolarHBondContact O-CB 3.5Å; E454-Q458 VanDerWaalsContact O-CG 3.28Å; E454-Q458 WeakPolarHBondContact O-CG 3.46Å; E454-Q458 PolarHBondContact O-N 3.34Å; I455-Q458 PolarHBondContact O-N 3.4Å; Q458-E460 VanDerWaalsContact C-N 3.3Å; Q458-E460 PolarHBondContact O-N 3.45Å; Q458-Q461 PolarHBondContact O-N 3.35Å; Q458-T462 VanDerWaalsContact O-CG2 3.32Å; Q458-T462 WeakPolarHBondContact O-CG2 3.38Å; Q458-T462 PolarHBondContact O-N 3.35Å; Q458-T462 PolarHBondContact O-OG1 3.08Å
459	E	80.7	Confident	79.2	Confident	99 Å²	99	74 Å²	74	46%	0.463	36%	0.36	S	S	.	.	H	α-helix	trans	-62.2	-38.3	173.6	-75.7	-176.7	-174.7	0	0	112.2	I455 K456 T462 K463	I455-E459 WeakPolarHBondContact O-CG 3.44Å; I455-E459 PolarHBondContact O-N 3.25Å; K456-E459 PolarHBondContact O-N 2.89Å; E459-T462 WeakPolarHBondContact CA-OG1 3.45Å; E459-T462 PolarHBondContact O-OG1 3.47Å; E459-K463 WeakPolarHBondContact O-CB 3.46Å; E459-K463 WeakPolarHBondContact O-CD 3.47Å; E459-K463 VanDerWaalsContact O-CG 3.23Å; E459-K463 WeakPolarHBondContact O-CG 3.2Å; E459-K463 PolarHBondContact O-N 3.41Å; E459-K463 VanDerWaalsContact O-N 3.11Å
460	E	76.5	Confident	79	Confident	88 Å²	88	75.4 Å²	75.4	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-68.2	-44	175.7	-168.2	170.6	-169.5	0	0	111.5	M418 K456 L457 Q458 T462 K463 T464	M418-E460 HydrophobicContact CE-CB 4.41Å; M418-E460 HydrophobicContact CE-CG 4.35Å; K456-E460 PolarHBondContact O-N 3.09Å; L457-E460 PolarHBondContact O-N 3.09Å; Q458-E460 VanDerWaalsContact C-N 3.3Å; Q458-E460 PolarHBondContact O-N 3.45Å; E460-T462 PolarHBondContact O-N 3.41Å; E460-K463 PolarHBondContact O-N 2.87Å; E460-T464 WeakPolarHBondContact O-CG2 3.3Å; E460-T464 PolarHBondContact O-N 3.49Å; E460-T464 PolarHBondContact O-OG1 2.8Å
461	Q	75.1	Confident	78.6	Confident	23 Å²	23	76 Å²	76	11%	0.107	37%	0.365	C	S	.	.	H	α-helix	trans	-59.6	-45.1	174.7	-73.9	-179.9	-11.8	0	0	112.7	M418 Q422 L457 Q458 K463 T464 Q465	M418-Q461 HydrophobicContact CE-CB 4.26Å; M418-Q461 HydrophobicContact CE-CG 3.15Å; Q422-Q461 VanDerWaalsContact NE2-CD 3.32Å; L457-Q461 VanDerWaalsContact O-CG 3.28Å; L457-Q461 WeakPolarHBondContact O-CG 3.42Å; L457-Q461 PolarHBondContact O-N 3.38Å; Q458-Q461 PolarHBondContact O-N 3.35Å; Q461-K463 VanDerWaalsContact C-N 3.3Å; Q461-K463 PolarHBondContact O-N 2.73Å; Q461-T464 WeakPolarHBondContact CA-OG1 3.37Å; Q461-T464 PolarHBondContact O-N 3.5Å; Q461-T464 PolarHBondContact O-OG1 3.32Å; Q461-Q465 VanDerWaalsContact O-CB 3.25Å; Q461-Q465 WeakPolarHBondContact O-CB 3.48Å; Q461-Q465 WeakPolarHBondContact O-CG 3.42Å; Q461-Q465 PolarHBondContact O-N 3.04Å
462	T	80.5	Confident	78.5	Confident	65 Å²	65	77.4 Å²	77.4	40%	0.399	37%	0.367	S	S	.	.	H	α-helix	trans	-65.9	-36.8	179.1	51.5	0	0	0	0	111.2	Q458 E459 E460 Q466	Q458-T462 VanDerWaalsContact O-CG2 3.32Å; Q458-T462 WeakPolarHBondContact O-CG2 3.38Å; Q458-T462 PolarHBondContact O-N 3.35Å; Q458-T462 PolarHBondContact O-OG1 3.08Å; E459-T462 WeakPolarHBondContact CA-OG1 3.45Å; E459-T462 PolarHBondContact O-OG1 3.47Å; E460-T462 PolarHBondContact O-N 3.41Å; T462-Q466 VanDerWaalsContact O-CB 3.26Å; T462-Q466 WeakPolarHBondContact O-CB 3.45Å; T462-Q466 WeakPolarHBondContact O-CG 3.36Å; T462-Q466 PolarHBondContact O-N 2.85Å
463	K	78.2	Confident	78.3	Confident	122 Å²	122	75.6 Å²	75.6	53%	0.53	37%	0.365	S	S	.	.	H	α-helix	trans	-66.2	-46.6	173.8	-73.8	168.1	-173.3	164	0	112.1	E459 E460 Q461 Q466 L467	E459-K463 WeakPolarHBondContact O-CB 3.46Å; E459-K463 WeakPolarHBondContact O-CD 3.47Å; E459-K463 VanDerWaalsContact O-CG 3.23Å; E459-K463 WeakPolarHBondContact O-CG 3.2Å; E459-K463 PolarHBondContact O-N 3.41Å; E459-K463 VanDerWaalsContact O-N 3.11Å; E460-K463 PolarHBondContact O-N 2.87Å; Q461-K463 VanDerWaalsContact C-N 3.3Å; Q461-K463 PolarHBondContact O-N 2.73Å; K463-Q466 PolarHBondContact O-N 3.39Å; K463-L467 WeakPolarHBondContact O-CG 3.46Å; K463-L467 PolarHBondContact O-N 3.43Å
464	T	75.6	Confident	78	Confident	10 Å²	10	72.6 Å²	72.6	6%	0.061	35%	0.353	C	S	.	.	H	α-helix	trans	-64.7	-44.7	178.4	56.1	0	0	0	0	111.2	E460 Q461 Q466 L467 E468	E460-T464 WeakPolarHBondContact O-CG2 3.3Å; E460-T464 PolarHBondContact O-N 3.49Å; E460-T464 PolarHBondContact O-OG1 2.8Å; Q461-T464 WeakPolarHBondContact CA-OG1 3.37Å; Q461-T464 PolarHBondContact O-N 3.5Å; Q461-T464 PolarHBondContact O-OG1 3.32Å; T464-Q466 VanDerWaalsContact C-N 3.33Å; T464-Q466 PolarHBondContact O-N 3.35Å; T464-L467 PolarHBondContact O-N 2.82Å; T464-L467 VanDerWaalsContact O-N 3.1Å; T464-E468 WeakPolarHBondContact O-CB 3.42Å; T464-E468 WeakPolarHBondContact O-CG 3.4Å; T464-E468 PolarHBondContact O-N 3.17Å
465	Q	78.9	Confident	77.8	Confident	113 Å²	113	72.9 Å²	72.9	53%	0.528	35%	0.354	S	S	.	.	H	α-helix	trans	-62.3	-36.7	174.8	-71.9	173.7	3.7	0	0	112.7	Q461 S469	Q461-Q465 VanDerWaalsContact O-CB 3.25Å; Q461-Q465 WeakPolarHBondContact O-CB 3.48Å; Q461-Q465 WeakPolarHBondContact O-CG 3.42Å; Q461-Q465 PolarHBondContact O-N 3.04Å; Q465-S469 VanDerWaalsContact O-CB 3.25Å; Q465-S469 WeakPolarHBondContact O-CB 3.44Å; Q465-S469 PolarHBondContact O-N 3.44Å; Q465-S469 PolarHBondContact O-OG 3.5Å
466	Q	82	Confident	77.4	Confident	111 Å²	111	71.4 Å²	71.4	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-66.5	-39	173	-79.5	175.7	18.4	0	0	112.1	T462 K463 T464 S469 K470	T462-Q466 VanDerWaalsContact O-CB 3.26Å; T462-Q466 WeakPolarHBondContact O-CB 3.45Å; T462-Q466 WeakPolarHBondContact O-CG 3.36Å; T462-Q466 PolarHBondContact O-N 2.85Å; K463-Q466 PolarHBondContact O-N 3.39Å; T464-Q466 VanDerWaalsContact C-N 3.33Å; T464-Q466 PolarHBondContact O-N 3.35Å; Q466-S469 WeakPolarHBondContact CA-OG 3.33Å; Q466-S469 PolarHBondContact O-OG 2.84Å; Q466-K470 VanDerWaalsContact O-CB 3.31Å; Q466-K470 WeakPolarHBondContact O-CB 3.49Å; Q466-K470 WeakPolarHBondContact O-CG 3.3Å; Q466-K470 PolarHBondContact O-N 3.39Å
467	L	74.9	Confident	77.3	Confident	39 Å²	39	67.7 Å²	67.7	20%	0.204	34%	0.336	C	S	.	.	H	α-helix	trans	-68.6	-43.2	175.7	-71.2	172.2	0	0	0	111.5	L367 L371 K463 T464 K470 L471	L367-L467 HydrophobicContact CD2-CD2 3.62Å; L371-L467 HydrophobicContact CD2-CB 4.13Å; L371-L467 HydrophobicContact CG-CB 4.48Å; K463-L467 WeakPolarHBondContact O-CG 3.46Å; K463-L467 PolarHBondContact O-N 3.43Å; T464-L467 PolarHBondContact O-N 2.82Å; T464-L467 VanDerWaalsContact O-N 3.1Å; L467-K470 PolarHBondContact O-N 2.62Å; L467-L471 VanDerWaalsContact O-CB 3.31Å; L467-L471 WeakPolarHBondContact O-CB 3.15Å; L467-L471 PolarHBondContact O-N 3.17Å
468	E	75.8	Confident	77	Confident	19 Å²	19	67.9 Å²	67.9	9%	0.089	34%	0.337	C	S	.	.	H	α-helix	trans	-65.4	-44.9	176.9	-74.8	175.5	-170.7	0	0	112.1	L371 T464 K470 L471 R472	L371-E468 HydrophobicContact CD1-CG 4.42Å; L371-E468 HydrophobicContact CD2-CG 3.97Å; T464-E468 WeakPolarHBondContact O-CB 3.42Å; T464-E468 WeakPolarHBondContact O-CG 3.4Å; T464-E468 PolarHBondContact O-N 3.17Å; E468-K470 VanDerWaalsContact C-N 3.32Å; E468-K470 PolarHBondContact O-N 3.04Å; E468-L471 PolarHBondContact O-N 3.12Å; E468-R472 WeakPolarHBondContact O-CB 3.23Å; E468-R472 WeakPolarHBondContact O-CG 3.28Å; E468-R472 PolarHBondContact O-N 3.05Å
469	S	80.1	Confident	76.7	Confident	68 Å²	68	64.5 Å²	64.5	48%	0.476	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-39.6	175.7	56.9	0	0	0	0	111.6	Q465 Q466 A473	Q465-S469 VanDerWaalsContact O-CB 3.25Å; Q465-S469 WeakPolarHBondContact O-CB 3.44Å; Q465-S469 PolarHBondContact O-N 3.44Å; Q465-S469 PolarHBondContact O-OG 3.5Å; Q466-S469 WeakPolarHBondContact CA-OG 3.33Å; Q466-S469 PolarHBondContact O-OG 2.84Å; S469-A473 WeakPolarHBondContact O-CB 3.44Å; S469-A473 PolarHBondContact O-N 3.14Å
470	K	77.2	Confident	76	Confident	118 Å²	118	67.3 Å²	67.3	51%	0.513	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-45.7	171.1	-77.9	174.6	-177	178.4	0	111.5	L367 Q466 L467 E468 A473 M474	L367-K470 HydrophobicContact CD1-CB 4.38Å; Q466-K470 VanDerWaalsContact O-CB 3.31Å; Q466-K470 WeakPolarHBondContact O-CB 3.49Å; Q466-K470 WeakPolarHBondContact O-CG 3.3Å; Q466-K470 PolarHBondContact O-N 3.39Å; L467-K470 PolarHBondContact O-N 2.62Å; E468-K470 VanDerWaalsContact C-N 3.32Å; E468-K470 PolarHBondContact O-N 3.04Å; K470-A473 PolarHBondContact O-N 3.08Å; K470-M474 WeakPolarHBondContact O-CB 3.29Å; K470-M474 WeakPolarHBondContact O-CG 3.32Å; K470-M474 PolarHBondContact O-N 3.45Å
471	L	73.9	Confident	75.1	Confident	18 Å²	18	63.9 Å²	63.9	9%	0.094	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-49.6	179.4	-177.3	150.3	0	0	0	111.2	L367 K368 L371 L467 E468 A473 M474 E475	L367-L471 HydrophobicContact CB-CB 4.49Å; L367-L471 HydrophobicContact CB-CD1 4.14Å; L367-L471 HydrophobicContact CD1-CB 4.45Å; K368-L471 HydrophobicContact CG-CD1 3.56Å; L371-L471 HydrophobicContact CD1-CD1 3.57Å; L467-L471 VanDerWaalsContact O-CB 3.31Å; L467-L471 WeakPolarHBondContact O-CB 3.15Å; L467-L471 PolarHBondContact O-N 3.17Å; E468-L471 PolarHBondContact O-N 3.12Å; L471-A473 VanDerWaalsContact C-N 3.28Å; L471-A473 PolarHBondContact O-N 3.1Å; L471-M474 PolarHBondContact O-N 2.86Å; L471-E475 HydrophobicContact CD2-CG 4.02Å; L471-E475 WeakPolarHBondContact CD2-OE2 3.43Å; L471-E475 HydrophobicContact CG-CG 4.4Å; L471-E475 WeakPolarHBondContact O-CB 3.5Å; L471-E475 WeakPolarHBondContact O-CG 3.46Å; L471-E475 PolarHBondContact O-N 3.41Å
472	R	77.8	Confident	73.9	Confident	142 Å²	142	70 Å²	70	54%	0.536	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-38.8	174.7	-69.8	-177.4	-164.5	178.4	7.9	111.6	E468 M474 S476	E468-R472 WeakPolarHBondContact O-CB 3.23Å; E468-R472 WeakPolarHBondContact O-CG 3.28Å; E468-R472 PolarHBondContact O-N 3.05Å; R472-M474 VanDerWaalsContact C-N 3.32Å; R472-M474 PolarHBondContact O-N 3.33Å; R472-S476 WeakPolarHBondContact O-CB 3.39Å; R472-S476 PolarHBondContact O-N 2.64Å; R472-S476 PolarHBondContact O-OG 3.03Å
473	A	79.9	Confident	72	Confident	49 Å²	49	74.6 Å²	74.6	41%	0.405	37%	0.367	S	S	.	.	H	α-helix	trans	-67.1	-31.6	176.3	0	0	0	0	0	113	S469 K470 L471 S476 K477	S469-A473 WeakPolarHBondContact O-CB 3.44Å; S469-A473 PolarHBondContact O-N 3.14Å; K470-A473 PolarHBondContact O-N 3.08Å; L471-A473 VanDerWaalsContact C-N 3.28Å; L471-A473 PolarHBondContact O-N 3.1Å; A473-S476 PolarHBondContact O-OG 3.37Å; A473-S476 VanDerWaalsContact O-OG 3.14Å; A473-K477 WeakPolarHBondContact O-CG 3.26Å
474	M	74	Confident	70.1	Confident	32 Å²	32	73 Å²	73	16%	0.158	37%	0.371	C	S	.	.	H	α-helix	trans	-80.4	-45.1	177	-65.2	-76.3	-93.1	0	0	111.4	Y360 E363 I364 K470 L471 R472 S476 K477	Y360-M474 HydrophobicContact CD1-CE 3.34Å; Y360-M474 HydrophobicContact CD1-SD 3.59Å; Y360-M474 VanDerWaalsContact CD1-SD 3.59Å; Y360-M474 HydrophobicContact CE1-CE 3.58Å; Y360-M474 HydrophobicContact CE1-SD 3.4Å; Y360-M474 WeakPolarHBondContact CE1-SD 3.29Å; E363-M474 HydrophobicContact CB-CE 3.92Å; E363-M474 HydrophobicContact CG-CE 3.69Å; I364-M474 HydrophobicContact CD1-CB 4.13Å; I364-M474 HydrophobicContact CG1-CB 3.79Å; K470-M474 WeakPolarHBondContact O-CB 3.29Å; K470-M474 WeakPolarHBondContact O-CG 3.32Å; K470-M474 PolarHBondContact O-N 3.45Å; L471-M474 PolarHBondContact O-N 2.86Å; R472-M474 VanDerWaalsContact C-N 3.32Å; R472-M474 PolarHBondContact O-N 3.33Å; M474-S476 PolarHBondContact O-N 2.83Å; M474-K477 WeakPolarHBondContact O-CB 3.48Å; M474-K477 PolarHBondContact O-N 3.09Å; M474-K477 VanDerWaalsContact O-N 3.09Å
475	E	73.3	Confident	68.6	Low	68 Å²	68	79.9 Å²	79.9	32%	0.318	41%	0.406	S	S	.	.	H	α-helix	trans	-63.5	-40.7	176.9	-72.7	-172.6	152	0	0	111.9	I364 K368 L471 K477 L478	I364-E475 HydrophobicContact CD1-CG 4.24Å; I364-E475 HydrophobicContact CG1-CG 4.46Å; I364-E475 HydrophobicContact CG2-CG 4.27Å; K368-E475 WeakPolarHBondContact CE-OE1 3.47Å; K368-E475 IonicContact NZ-OE1 2.68Å; K368-E475 PolarHBondContact NZ-OE1 3.05Å; L471-E475 HydrophobicContact CD2-CG 4.02Å; L471-E475 WeakPolarHBondContact CD2-OE2 3.43Å; L471-E475 HydrophobicContact CG-CG 4.4Å; L471-E475 WeakPolarHBondContact O-CB 3.5Å; L471-E475 WeakPolarHBondContact O-CG 3.46Å; L471-E475 PolarHBondContact O-N 3.41Å; E475-K477 PolarHBondContact O-N 3.16Å; E475-L478 WeakPolarHBondContact O-CB 3.34Å; E475-L478 PolarHBondContact O-N 3.25Å
476	S	76.7	Confident	67	Low	59 Å²	59	78.8 Å²	78.8	41%	0.413	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-9.1	175.5	67.1	0	0	0	0	114.2	K187 R472 A473 M474	K187-S476 VanDerWaalsContact CD-O 3.3Å; K187-S476 WeakPolarHBondContact CD-O 3.31Å; K187-S476 WeakPolarHBondContact CE-O 3.36Å; K187-S476 VanDerWaalsContact NZ-C 3.34Å; K187-S476 PolarHBondContact NZ-O 2.86Å; K187-S476 PolarHBondContact NZ-OG 2.95Å; R472-S476 WeakPolarHBondContact O-CB 3.39Å; R472-S476 PolarHBondContact O-N 2.64Å; R472-S476 PolarHBondContact O-OG 3.03Å; A473-S476 PolarHBondContact O-OG 3.37Å; A473-S476 VanDerWaalsContact O-OG 3.14Å; M474-S476 PolarHBondContact O-N 2.83Å
477	K	77.5	Confident	65.5	Low	59 Å²	59	81.5 Å²	81.5	26%	0.257	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-19.6	171.6	-66.9	167.1	-179.4	-179	0	112.3	L141 L185 Y360 A473 M474 E475	L141-K477 HydrophobicContact CD1-CB 4.5Å; L141-K477 WeakPolarHBondContact CD1-O 3.26Å; L185-K477 HydrophobicContact CD1-CD 4.02Å; L185-K477 HydrophobicContact CD1-CG 4.49Å; Y360-K477 HydrophobicContact CE1-CD 4.12Å; A473-K477 WeakPolarHBondContact O-CG 3.26Å; M474-K477 WeakPolarHBondContact O-CB 3.48Å; M474-K477 PolarHBondContact O-N 3.09Å; M474-K477 VanDerWaalsContact O-N 3.09Å; E475-K477 PolarHBondContact O-N 3.16Å
478	L	71.8	Confident	64	Low	24 Å²	24	87 Å²	87	13%	0.126	44%	0.443	C	S	.	.	S	Bend	trans	-83.4	123.4	174.2	-65.6	173.6	0	0	0	108.4	L357 I364 E475	L357-L478 HydrophobicContact CG-CD2 4.23Å; I364-L478 HydrophobicContact CD1-CD1 3.45Å; I364-L478 VanDerWaalsContact CD1-CD1 3.45Å; I364-L478 HydrophobicContact CD1-CG 4.3Å; E475-L478 WeakPolarHBondContact O-CB 3.34Å; E475-L478 PolarHBondContact O-N 3.25Å
479	L	70.6	Confident	63.1	Low	29 Å²	29	89.4 Å²	89.4	15%	0.152	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-88.6	120.6	176.5	-61.4	169.3	0	0	0	108.6	F129 I132 Y140 V142 K187	F129-L479 HydrophobicContact CD1-CD1 4.3Å; F129-L479 HydrophobicContact CE1-CD1 3.77Å; I132-L479 HydrophobicContact CD1-CD1 4.34Å; I132-L479 HydrophobicContact CG2-CB 3.58Å; I132-L479 HydrophobicContact CG2-CD1 4.2Å; Y140-L479 PolarHBondContact N-O 3.45Å; Y140-L479 VanDerWaalsContact N-O 3.1Å; Y140-L479 PolarHBondContact O-N 3.4Å; V142-L479 HydrophobicContact CG2-CD1 4.33Å; K187-L479 HydrophobicContact CB-CD2 4.1Å; K187-L479 VanDerWaalsContact O-CD2 3.27Å; K187-L479 WeakPolarHBondContact O-CD2 3.41Å
480	R	66.5	Low	62.2	Low	157 Å²	157	90.7 Å²	90.7	59%	0.592	45%	0.454	S	S	*	.			trans	-128.4	140	170.7	-145.3	177.1	-163.4	-170.6	1.9	107.4	D482	R480-D482 PolarHBondContact O-N 2.96Å
481	G	56.6	Low	61.3	Low	16 Å²	16	91 Å²	91	17%	0.165	46%	0.459	C	S	.	.			trans	-68.4	103.2	179.3	0	0	0	0	0	111.3
482	D	50.5	Low	60.4	Low	153 Å²	153	96.3 Å²	96.3	82%	0.818	48%	0.483	S	S	*	.			trans	-75.6	129.1	173.9	-77.6	-19.4	0	0	0	110.9	R480 S484	R480-D482 PolarHBondContact O-N 2.96Å; D482-S484 PolarHBondContact O-N 3.33Å
483	Q	39.8	Very low	59.7	Low	161 Å²	161	95 Å²	95	75%	0.752	48%	0.483	S	S	*	.			trans	-77.6	82.8	179.9	-65.9	175.6	6.9	0	0	109.8	M136	M136-Q483 HydrophobicContact CE-CG 3.88Å; M136-Q483 PolarHBondContact SD-NE2 2.92Å
484	S	38.5	Very low	59.2	Low	88 Å²	88	95 Å²	95	62%	0.615	48%	0.478	S	S	*	.			trans	-149.1	106.5	172.7	-168.7	0	0	0	0	112.4	D482	D482-S484 PolarHBondContact O-N 3.33Å
485	I	43.4	Very low	59	Low	155 Å²	155	96.8 Å²	96.8	80%	0.795	49%	0.491	S	S	*	.	S	Bend	trans	83.9	120.1	154.1	-50.5	155.1	0	0	0	116.1
486	V	46.9	Very low	58.8	Low	90 Å²	90	97.8 Å²	97.8	55%	0.545	50%	0.498	S	S	.	.			trans	94.3	59.3	175.1	-152.3	0	0	0	0	117.6	T489 R490	V486-T489 WeakPolarHBondContact CG1-OG1 3.41Å; V486-R490 WeakPolarHBondContact O-CB 3.5Å
487	E	50.6	Low	58.6	Low	168 Å²	168	96.6 Å²	96.6	79%	0.785	49%	0.492	S	S	*	.	H	α-helix	trans	-73.3	-27.9	176.7	-155.7	169	-163.1	0	0	114	M491	E487-M491 WeakPolarHBondContact O-CG 3.24Å; E487-M491 PolarHBondContact O-N 3.08Å
488	H	42.7	Very low	58.5	Low	153 Å²	153	98.9 Å²	98.9	71%	0.708	50%	0.503	S	S	*	.	H	α-helix	trans	-81.1	-37.9	-174.2	-145.2	54.4	0	0	0	113.8	R490 M491 Q492	H488-R490 VanDerWaalsContact C-N 3.35Å; H488-M491 PolarHBondContact O-N 3.23Å; H488-Q492 PolarHBondContact O-N 2.97Å
489	T	57.6	Low	58.5	Low	70 Å²	70	102.9 Å²	102.9	43%	0.429	52%	0.521	S	S	.	.	H	α-helix	trans	-68.4	-37.6	173.5	-49.2	0	0	0	0	110.9	V486 M491 Q492 E493	V486-T489 WeakPolarHBondContact CG1-OG1 3.41Å; T489-M491 VanDerWaalsContact C-N 3.33Å; T489-M491 PolarHBondContact O-N 3.42Å; T489-Q492 PolarHBondContact O-N 3.5Å; T489-E493 WeakPolarHBondContact O-CG 3.24Å; T489-E493 PolarHBondContact O-N 3.45Å
490	R	60.8	Low	58.6	Low	96 Å²	96	108 Å²	108	36%	0.362	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-39	177.4	-173.6	173.2	169.3	173.2	-7.9	112.2	R134 V486 H488 E493 V494	R134-R490 VanDerWaalsContact CA-NH2 3.29Å; R134-R490 PolarHBondContact O-NH2 3.1Å; V486-R490 WeakPolarHBondContact O-CB 3.5Å; H488-R490 VanDerWaalsContact C-N 3.35Å; R490-E493 PolarHBondContact O-N 2.96Å; R490-V494 HydrophobicContact CG-CG2 4.34Å; R490-V494 WeakPolarHBondContact O-CB 3.37Å; R490-V494 WeakPolarHBondContact O-CG2 3.38Å; R490-V494 PolarHBondContact O-N 2.83Å
491	M	57.7	Low	59	Low	125 Å²	125	103.9 Å²	103.9	62%	0.616	53%	0.531	S	S	*	.	H	α-helix	trans	-64.2	-42.3	177	-77.1	-87.8	-79.4	0	0	112.6	E487 H488 T489 T495	E487-M491 WeakPolarHBondContact O-CG 3.24Å; E487-M491 PolarHBondContact O-N 3.08Å; H488-M491 PolarHBondContact O-N 3.23Å; T489-M491 VanDerWaalsContact C-N 3.33Å; T489-M491 PolarHBondContact O-N 3.42Å; M491-T495 WeakPolarHBondContact O-CB 3.41Å; M491-T495 PolarHBondContact O-N 3.42Å; M491-T495 PolarHBondContact O-OG1 3.19Å
492	Q	54.2	Low	59.9	Low	128 Å²	128	108.3 Å²	108.3	60%	0.598	55%	0.547	S	S	*	.	H	α-helix	trans	-67.2	-41.9	176.1	-72.3	-175.7	-9.2	0	0	111.7	H488 T489 T495 L496	H488-Q492 PolarHBondContact O-N 2.97Å; T489-Q492 PolarHBondContact O-N 3.5Å; Q492-T495 PolarHBondContact O-N 3.35Å; Q492-L496 WeakPolarHBondContact O-CG 3.19Å; Q492-L496 PolarHBondContact O-N 2.98Å
493	E	65	Low	60.9	Low	116 Å²	116	106.2 Å²	106.2	54%	0.542	53%	0.534	S	S	.	.	H	α-helix	trans	-65.5	-39.3	176.3	-73.5	-178.2	169.5	0	0	112.9	T489 R490 T495 L496 A497	T489-E493 WeakPolarHBondContact O-CG 3.24Å; T489-E493 PolarHBondContact O-N 3.45Å; R490-E493 PolarHBondContact O-N 2.96Å; E493-T495 VanDerWaalsContact C-N 3.34Å; E493-L496 PolarHBondContact O-N 2.94Å; E493-A497 VanDerWaalsContact O-CB 3.24Å; E493-A497 WeakPolarHBondContact O-CB 3.45Å; E493-A497 PolarHBondContact O-N 2.94Å
494	V	69.1	Low	62.5	Low	49 Å²	49	100.9 Å²	100.9	30%	0.297	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-42.1	174.3	169	0	0	0	0	110.4	R490 A497 Q498	R490-V494 HydrophobicContact CG-CG2 4.34Å; R490-V494 WeakPolarHBondContact O-CB 3.37Å; R490-V494 WeakPolarHBondContact O-CG2 3.38Å; R490-V494 PolarHBondContact O-N 2.83Å; V494-A497 PolarHBondContact O-N 3.09Å; V494-Q498 HydrophobicContact CG1-CG 4.46Å; V494-Q498 WeakPolarHBondContact O-CB 3.47Å; V494-Q498 VanDerWaalsContact O-CG 3.3Å; V494-Q498 WeakPolarHBondContact O-CG 3.07Å; V494-Q498 PolarHBondContact O-N 2.91Å
495	T	69.5	Low	64.4	Low	69 Å²	69	101.3 Å²	101.3	42%	0.423	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-43.9	176.9	-51.4	0	0	0	0	111	M491 Q492 E493 Q498 Q499	M491-T495 WeakPolarHBondContact O-CB 3.41Å; M491-T495 PolarHBondContact O-N 3.42Å; M491-T495 PolarHBondContact O-OG1 3.19Å; Q492-T495 PolarHBondContact O-N 3.35Å; E493-T495 VanDerWaalsContact C-N 3.34Å; T495-Q498 PolarHBondContact O-N 3.38Å; T495-Q499 WeakPolarHBondContact O-CG 3.29Å; T495-Q499 PolarHBondContact O-N 3.15Å
496	L	69.7	Low	65.9	Low	89 Å²	89	98.8 Å²	98.8	47%	0.466	50%	0.495	S	S	.	.	H	α-helix	trans	-65.7	-38.7	175.7	-72.7	172.4	0	0	0	112.1	Q492 E493 Q499 R500	Q492-L496 WeakPolarHBondContact O-CG 3.19Å; Q492-L496 PolarHBondContact O-N 2.98Å; E493-L496 PolarHBondContact O-N 2.94Å; L496-Q499 PolarHBondContact O-N 2.77Å; L496-R500 WeakPolarHBondContact O-CB 3.29Å; L496-R500 WeakPolarHBondContact O-CG 3.38Å; L496-R500 PolarHBondContact O-N 2.91Å
497	A	71.4	Confident	67.2	Low	34 Å²	34	100.6 Å²	100.6	28%	0.281	50%	0.495	S	S	.	.	H	α-helix	trans	-64.6	-43.2	175.6	0	0	0	0	0	111.2	E493 V494 R500 T501	E493-A497 VanDerWaalsContact O-CB 3.24Å; E493-A497 WeakPolarHBondContact O-CB 3.45Å; E493-A497 PolarHBondContact O-N 2.94Å; V494-A497 PolarHBondContact O-N 3.09Å; A497-R500 PolarHBondContact O-N 3.39Å; A497-T501 WeakPolarHBondContact O-CG2 3.13Å; A497-T501 PolarHBondContact O-N 2.98Å; A497-T501 PolarHBondContact O-OG1 3.21Å
498	Q	74.9	Confident	68.3	Low	106 Å²	106	99.9 Å²	99.9	50%	0.495	49%	0.485	S	S	.	.	H	α-helix	trans	-61.4	-45.5	175.2	-76.8	176.5	-5.6	0	0	111.7	V494 T495 R500 T501 Q502	V494-Q498 HydrophobicContact CG1-CG 4.46Å; V494-Q498 WeakPolarHBondContact O-CB 3.47Å; V494-Q498 VanDerWaalsContact O-CG 3.3Å; V494-Q498 WeakPolarHBondContact O-CG 3.07Å; V494-Q498 PolarHBondContact O-N 2.91Å; T495-Q498 PolarHBondContact O-N 3.38Å; Q498-R500 VanDerWaalsContact C-N 3.33Å; Q498-R500 PolarHBondContact O-N 3.4Å; Q498-T501 VanDerWaalsContact CA-OG1 3.31Å; Q498-T501 WeakPolarHBondContact CA-OG1 3.33Å; Q498-T501 PolarHBondContact O-N 3.21Å; Q498-T501 PolarHBondContact O-OG1 3.33Å; Q498-Q502 WeakPolarHBondContact O-CB 3.27Å; Q498-Q502 WeakPolarHBondContact O-CG 3.13Å; Q498-Q502 PolarHBondContact O-N 3.05Å
499	Q	71.5	Confident	69.8	Low	108 Å²	108	99 Å²	99	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-60.2	-42.9	174.7	-74.2	178.8	-3.3	0	0	111.6	T495 L496 Q502 M503	T495-Q499 WeakPolarHBondContact O-CG 3.29Å; T495-Q499 PolarHBondContact O-N 3.15Å; L496-Q499 PolarHBondContact O-N 2.77Å; Q499-Q502 PolarHBondContact O-N 3.28Å; Q499-M503 WeakPolarHBondContact O-CB 3.32Å; Q499-M503 VanDerWaalsContact O-CG 3.23Å; Q499-M503 WeakPolarHBondContact O-CG 3.19Å; Q499-M503 PolarHBondContact O-N 3.39Å
500	R	73	Confident	70.5	Confident	136 Å²	136	101.4 Å²	101.4	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-63.2	-42.3	176.1	-75.8	-179.5	-178.2	164.5	9	112.5	L496 A497 Q498 M503 A504	L496-R500 WeakPolarHBondContact O-CB 3.29Å; L496-R500 WeakPolarHBondContact O-CG 3.38Å; L496-R500 PolarHBondContact O-N 2.91Å; A497-R500 PolarHBondContact O-N 3.39Å; Q498-R500 VanDerWaalsContact C-N 3.33Å; Q498-R500 PolarHBondContact O-N 3.4Å; R500-M503 PolarHBondContact O-N 2.92Å; R500-A504 WeakPolarHBondContact O-CB 3.38Å; R500-A504 PolarHBondContact O-N 3.49Å
501	T	75.3	Confident	71	Confident	71 Å²	71	101 Å²	101	44%	0.436	49%	0.487	S	S	.	.	H	α-helix	trans	-65	-39.7	176.1	51	0	0	0	0	111.9	A497 Q498 A504 E505	A497-T501 WeakPolarHBondContact O-CG2 3.13Å; A497-T501 PolarHBondContact O-N 2.98Å; A497-T501 PolarHBondContact O-OG1 3.21Å; Q498-T501 VanDerWaalsContact CA-OG1 3.31Å; Q498-T501 WeakPolarHBondContact CA-OG1 3.33Å; Q498-T501 PolarHBondContact O-N 3.21Å; Q498-T501 PolarHBondContact O-OG1 3.33Å; T501-A504 PolarHBondContact O-N 3.37Å; T501-E505 WeakPolarHBondContact O-CB 3.11Å; T501-E505 PolarHBondContact O-N 3.49Å
502	Q	75.3	Confident	71.9	Confident	110 Å²	110	101 Å²	101	51%	0.514	49%	0.485	S	S	.	.	H	α-helix	trans	-65.5	-41.7	175.7	-73.7	176.8	4.2	0	0	111.7	Q498 Q499 E505 Q506	Q498-Q502 WeakPolarHBondContact O-CB 3.27Å; Q498-Q502 WeakPolarHBondContact O-CG 3.13Å; Q498-Q502 PolarHBondContact O-N 3.05Å; Q499-Q502 PolarHBondContact O-N 3.28Å; Q502-E505 PolarHBondContact O-N 2.94Å; Q502-Q506 WeakPolarHBondContact O-CB 3.26Å; Q502-Q506 VanDerWaalsContact O-CG 3.29Å; Q502-Q506 WeakPolarHBondContact O-CG 3.4Å; Q502-Q506 PolarHBondContact O-N 2.82Å
503	M	72.2	Confident	72.8	Confident	108 Å²	108	99.8 Å²	99.8	53%	0.532	48%	0.482	S	S	.	.	H	α-helix	trans	-64	-41.2	175.7	-72.2	-66.9	-65.1	0	0	112	Q499 R500 K507	Q499-M503 WeakPolarHBondContact O-CB 3.32Å; Q499-M503 VanDerWaalsContact O-CG 3.23Å; Q499-M503 WeakPolarHBondContact O-CG 3.19Å; Q499-M503 PolarHBondContact O-N 3.39Å; R500-M503 PolarHBondContact O-N 2.92Å; M503-K507 WeakPolarHBondContact O-CG 3.41Å; M503-K507 PolarHBondContact O-N 3.33Å
504	A	73.9	Confident	73.3	Confident	50 Å²	50	97.4 Å²	97.4	41%	0.413	48%	0.475	S	S	.	.	H	α-helix	trans	-65.7	-42.2	175.7	0	0	0	0	0	111.6	R500 T501 K507 R508	R500-A504 WeakPolarHBondContact O-CB 3.38Å; R500-A504 PolarHBondContact O-N 3.49Å; T501-A504 PolarHBondContact O-N 3.37Å; A504-K507 PolarHBondContact O-N 2.92Å; A504-R508 WeakPolarHBondContact O-CB 3.32Å; A504-R508 PolarHBondContact O-N 2.99Å
505	E	76.8	Confident	73.3	Confident	97 Å²	97	96.4 Å²	96.4	45%	0.453	47%	0.472	S	S	.	.	H	α-helix	trans	-66.2	-40	176.7	-166.1	-177.6	-179.6	0	0	112	T501 Q502 R508 R509	T501-E505 WeakPolarHBondContact O-CB 3.11Å; T501-E505 PolarHBondContact O-N 3.49Å; Q502-E505 PolarHBondContact O-N 2.94Å; E505-R508 PolarHBondContact O-N 3.45Å; E505-R509 VanDerWaalsContact CD-NH2 3.32Å; E505-R509 WeakPolarHBondContact O-CG 3.46Å; E505-R509 PolarHBondContact O-N 2.92Å; E505-R509 IonicContact OE1-CZ 3.25Å; E505-R509 IonicContact OE1-NE 2.67Å; E505-R509 IonicContact OE1-NH2 2.78Å; E505-R509 PolarHBondContact OE1-NH2 2.97Å; E505-R509 IonicContact OE2-NH2 2.69Å
506	Q	74.9	Confident	73.4	Confident	102 Å²	102	100.9 Å²	100.9	48%	0.477	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-50.4	173.2	-78.8	177.8	-1.4	0	0	111.3	Q502 R508 R509 E510	Q502-Q506 WeakPolarHBondContact O-CB 3.26Å; Q502-Q506 VanDerWaalsContact O-CG 3.29Å; Q502-Q506 WeakPolarHBondContact O-CG 3.4Å; Q502-Q506 PolarHBondContact O-N 2.82Å; Q506-R508 VanDerWaalsContact C-N 3.28Å; Q506-R508 PolarHBondContact O-N 3.36Å; Q506-R509 PolarHBondContact O-N 3.46Å; Q506-R509 VanDerWaalsContact O-N 3.14Å; Q506-E510 WeakPolarHBondContact O-CG 3.44Å; Q506-E510 PolarHBondContact O-N 2.85Å
507	K	74.6	Confident	73.1	Confident	128 Å²	128	101.6 Å²	101.6	56%	0.557	48%	0.483	S	S	*	.	H	α-helix	trans	-58.2	-40.2	176	-78.1	-174.8	175.3	-172.4	0	112.4	M503 A504 E510 L511	M503-K507 WeakPolarHBondContact O-CG 3.41Å; M503-K507 PolarHBondContact O-N 3.33Å; A504-K507 PolarHBondContact O-N 2.92Å; K507-E510 PolarHBondContact O-N 2.81Å; K507-L511 WeakPolarHBondContact O-CB 3.38Å; K507-L511 WeakPolarHBondContact O-CG 3.42Å; K507-L511 PolarHBondContact O-N 2.78Å
508	R	74.1	Confident	72.9	Confident	152 Å²	152	103.9 Å²	103.9	57%	0.574	49%	0.488	S	S	*	.	H	α-helix	trans	-63.9	-43.2	176.8	-174.7	-179.3	137.9	-170	-6.7	111.6	A504 E505 Q506 L511 E512	A504-R508 WeakPolarHBondContact O-CB 3.32Å; A504-R508 PolarHBondContact O-N 2.99Å; E505-R508 PolarHBondContact O-N 3.45Å; Q506-R508 VanDerWaalsContact C-N 3.28Å; Q506-R508 PolarHBondContact O-N 3.36Å; R508-L511 PolarHBondContact O-N 3.03Å; R508-E512 WeakPolarHBondContact O-CB 3.37Å; R508-E512 PolarHBondContact O-N 3.44Å
509	R	74.2	Confident	72.4	Confident	136 Å²	136	106 Å²	106	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-39.2	174.7	-70.8	177.6	-169.5	170.5	3.1	111.7	E505 Q506 E512 I513	E505-R509 VanDerWaalsContact CD-NH2 3.32Å; E505-R509 WeakPolarHBondContact O-CG 3.46Å; E505-R509 PolarHBondContact O-N 2.92Å; E505-R509 IonicContact OE1-CZ 3.25Å; E505-R509 IonicContact OE1-NE 2.67Å; E505-R509 IonicContact OE1-NH2 2.78Å; E505-R509 PolarHBondContact OE1-NH2 2.97Å; E505-R509 IonicContact OE2-NH2 2.69Å; Q506-R509 PolarHBondContact O-N 3.46Å; Q506-R509 VanDerWaalsContact O-N 3.14Å; R509-E512 PolarHBondContact O-N 3.31Å; R509-I513 WeakPolarHBondContact O-CB 3.49Å; R509-I513 WeakPolarHBondContact O-CD1 2.95Å; R509-I513 WeakPolarHBondContact O-CG1 3.5Å; R509-I513 PolarHBondContact O-N 2.74Å
510	E	73	Confident	71.8	Confident	119 Å²	119	105.3 Å²	105.3	56%	0.556	50%	0.495	S	S	*	.	H	α-helix	trans	-61.4	-47.7	174.5	-73.9	174.8	175.6	0	0	111.3	Q506 K507 E512 I513 V514	Q506-E510 WeakPolarHBondContact O-CG 3.44Å; Q506-E510 PolarHBondContact O-N 2.85Å; K507-E510 PolarHBondContact O-N 2.81Å; E510-E512 VanDerWaalsContact C-N 3.33Å; E510-E512 PolarHBondContact O-N 2.8Å; E510-I513 PolarHBondContact O-N 3Å; E510-V514 VanDerWaalsContact O-CG2 3.32Å; E510-V514 WeakPolarHBondContact O-CG2 3.4Å; E510-V514 PolarHBondContact O-N 2.97Å
511	L	71.6	Confident	71.2	Confident	89 Å²	89	105.5 Å²	105.5	47%	0.466	50%	0.501	S	S	.	.	H	α-helix	trans	-62.3	-38.9	176.1	-73.5	170.3	0	0	0	112.4	K507 R508 V514 A515	K507-L511 WeakPolarHBondContact O-CB 3.38Å; K507-L511 WeakPolarHBondContact O-CG 3.42Å; K507-L511 PolarHBondContact O-N 2.78Å; R508-L511 PolarHBondContact O-N 3.03Å; L511-V514 PolarHBondContact O-N 3.29Å; L511-A515 WeakPolarHBondContact O-CB 3.42Å; L511-A515 PolarHBondContact O-N 2.97Å
512	E	75.8	Confident	70.4	Confident	125 Å²	125	103.8 Å²	103.8	58%	0.584	50%	0.498	S	S	*	.	H	α-helix	trans	-65.8	-41	175.5	-171.3	174.7	178.4	0	0	111.7	R508 R509 E510 A515 R516	R508-E512 WeakPolarHBondContact O-CB 3.37Å; R508-E512 PolarHBondContact O-N 3.44Å; R509-E512 PolarHBondContact O-N 3.31Å; E510-E512 VanDerWaalsContact C-N 3.33Å; E510-E512 PolarHBondContact O-N 2.8Å; E512-A515 PolarHBondContact O-N 3.2Å; E512-R516 VanDerWaalsContact O-CB 3.28Å; E512-R516 WeakPolarHBondContact O-CB 3.32Å; E512-R516 PolarHBondContact O-N 3.26Å
513	I	73.4	Confident	69.6	Low	102 Å²	102	101.8 Å²	101.8	52%	0.523	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-44.7	174.1	-69.8	163.4	0	0	0	110.5	R509 E510 R516 M517	R509-I513 WeakPolarHBondContact O-CB 3.49Å; R509-I513 WeakPolarHBondContact O-CD1 2.95Å; R509-I513 WeakPolarHBondContact O-CG1 3.5Å; R509-I513 PolarHBondContact O-N 2.74Å; E510-I513 PolarHBondContact O-N 3Å; I513-R516 PolarHBondContact O-N 2.92Å; I513-M517 HydrophobicContact CG2-CG 4.28Å; I513-M517 WeakPolarHBondContact O-CB 3.46Å; I513-M517 WeakPolarHBondContact O-CG 3.48Å; I513-M517 PolarHBondContact O-N 2.91Å
514	V	74.4	Confident	68.6	Low	65 Å²	65	102 Å²	102	39%	0.394	50%	0.497	S	S	.	.	H	α-helix	trans	-62.8	-46.4	177.6	171.7	0	0	0	0	110.7	E510 L511 R516 M517 E518	E510-V514 VanDerWaalsContact O-CG2 3.32Å; E510-V514 WeakPolarHBondContact O-CG2 3.4Å; E510-V514 PolarHBondContact O-N 2.97Å; L511-V514 PolarHBondContact O-N 3.29Å; V514-R516 VanDerWaalsContact C-N 3.32Å; V514-R516 PolarHBondContact O-N 3.27Å; V514-M517 PolarHBondContact O-N 3.49Å; V514-E518 WeakPolarHBondContact O-CG 3.43Å; V514-E518 PolarHBondContact O-N 3.25Å
515	A	69.5	Low	67.6	Low	28 Å²	28	101.5 Å²	101.5	23%	0.231	49%	0.493	C	S	.	.	H	α-helix	trans	-61.1	-41.6	177.2	0	0	0	0	0	112	L511 E512 E518 E519	L511-A515 WeakPolarHBondContact O-CB 3.42Å; L511-A515 PolarHBondContact O-N 2.97Å; E512-A515 PolarHBondContact O-N 3.2Å; A515-E518 PolarHBondContact O-N 2.77Å; A515-E519 PolarHBondContact O-N 3.21Å
516	R	71.8	Confident	66.6	Low	163 Å²	163	103.1 Å²	103.1	62%	0.615	51%	0.505	S	S	*	.	H	α-helix	trans	-66.4	-39.4	175	-173.7	178.9	171.7	173.3	3.1	112.1	E512 I513 V514 E518 E519 E520	E512-R516 VanDerWaalsContact O-CB 3.28Å; E512-R516 WeakPolarHBondContact O-CB 3.32Å; E512-R516 PolarHBondContact O-N 3.26Å; I513-R516 PolarHBondContact O-N 2.92Å; V514-R516 VanDerWaalsContact C-N 3.32Å; V514-R516 PolarHBondContact O-N 3.27Å; R516-E518 VanDerWaalsContact C-N 3.34Å; R516-E519 PolarHBondContact O-N 3.24Å; R516-E520 HydrophobicContact CG-CG 4.45Å; R516-E520 IonicContact CZ-OE1 3.93Å; R516-E520 IonicContact NE-OE1 3.64Å; R516-E520 PolarHBondContact NE-OE1 3.45Å; R516-E520 IonicContact NH2-OE1 2.93Å; R516-E520 PolarHBondContact NH2-OE1 2.91Å; R516-E520 WeakPolarHBondContact O-CB 3.4Å; R516-E520 WeakPolarHBondContact O-CG 3.42Å; R516-E520 PolarHBondContact O-N 3.14Å
517	M	64.6	Low	65.6	Low	104 Å²	104	103.8 Å²	103.8	51%	0.512	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-39.9	174.1	-70.6	-132.1	-57.8	0	0	111.4	I513 V514 E520 E521	I513-M517 HydrophobicContact CG2-CG 4.28Å; I513-M517 WeakPolarHBondContact O-CB 3.46Å; I513-M517 WeakPolarHBondContact O-CG 3.48Å; I513-M517 PolarHBondContact O-N 2.91Å; V514-M517 PolarHBondContact O-N 3.49Å; M517-E520 CarbonylContact O-C 3.55Å; M517-E520 PolarHBondContact O-N 2.93Å; M517-E521 WeakPolarHBondContact O-CB 3.5Å; M517-E521 VanDerWaalsContact O-CG 3.31Å; M517-E521 WeakPolarHBondContact O-CG 3.25Å; M517-E521 PolarHBondContact O-N 3.27Å
518	E	65.8	Low	64.6	Low	83 Å²	83	106.8 Å²	106.8	39%	0.388	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-40.2	175.1	-71.9	-178.4	153	0	0	112.5	R60 V514 A515 R516 E521 G522	R60-E518 IonicContact CZ-OE2 2.66Å; R60-E518 IonicContact NH1-OE2 3.84Å; R60-E518 PolarHBondContact NH1-OE2 2.85Å; R60-E518 IonicContact NH2-OE2 3.67Å; V514-E518 WeakPolarHBondContact O-CG 3.43Å; V514-E518 PolarHBondContact O-N 3.25Å; A515-E518 PolarHBondContact O-N 2.77Å; R516-E518 VanDerWaalsContact C-N 3.34Å; E518-E521 PolarHBondContact O-N 2.86Å; E518-G522 PolarHBondContact O-N 3.48Å
519	E	65	Low	63.8	Low	151 Å²	151	104 Å²	104	71%	0.706	52%	0.52	S	S	*	.	H	α-helix	trans	-64.2	-44.1	173.2	-77	-172.7	169.6	0	0	111.5	A515 R516 G522 S523	A515-E519 PolarHBondContact O-N 3.21Å; R516-E519 PolarHBondContact O-N 3.24Å; E519-G522 PolarHBondContact O-N 3.05Å; E519-S523 VanDerWaalsContact O-CB 3.32Å; E519-S523 WeakPolarHBondContact O-CB 3.08Å; E519-S523 PolarHBondContact O-N 2.96Å
520	E	59.4	Low	62.9	Low	93 Å²	93	101.2 Å²	101.2	44%	0.435	53%	0.534	S	S	.	.	H	α-helix	trans	-66	-38.8	176.5	-75	178.9	-170.8	0	0	111.2	R516 M517 S523 M524	R516-E520 HydrophobicContact CG-CG 4.45Å; R516-E520 IonicContact CZ-OE1 3.93Å; R516-E520 IonicContact NE-OE1 3.64Å; R516-E520 PolarHBondContact NE-OE1 3.45Å; R516-E520 IonicContact NH2-OE1 2.93Å; R516-E520 PolarHBondContact NH2-OE1 2.91Å; R516-E520 WeakPolarHBondContact O-CB 3.4Å; R516-E520 WeakPolarHBondContact O-CG 3.42Å; R516-E520 PolarHBondContact O-N 3.14Å; M517-E520 CarbonylContact O-C 3.55Å; M517-E520 PolarHBondContact O-N 2.93Å; E520-S523 CarbonylContact O-C 3.59Å; E520-S523 PolarHBondContact O-N 3.41Å; E520-M524 WeakPolarHBondContact O-CA 3.25Å; E520-M524 WeakPolarHBondContact O-CB 3.46Å; E520-M524 VanDerWaalsContact O-CG 3.24Å; E520-M524 WeakPolarHBondContact O-CG 3.43Å; E520-M524 PolarHBondContact O-N 3.47Å
521	E	59.2	Low	62.4	Low	139 Å²	139	98.6 Å²	98.6	65%	0.65	52%	0.521	S	S	*	.	H	α-helix	trans	-65.1	-40.1	172.6	-78.8	-173.4	176.1	0	0	111.9	M517 E518 S523 A525	M517-E521 WeakPolarHBondContact O-CB 3.5Å; M517-E521 VanDerWaalsContact O-CG 3.31Å; M517-E521 WeakPolarHBondContact O-CG 3.25Å; M517-E521 PolarHBondContact O-N 3.27Å; E518-E521 PolarHBondContact O-N 2.86Å; E521-S523 VanDerWaalsContact C-N 3.31Å; E521-S523 PolarHBondContact O-N 3.47Å; E521-A525 WeakPolarHBondContact O-CB 3.4Å; E521-A525 PolarHBondContact O-N 3.01Å
522	G	58.5	Low	62.3	Low	35 Å²	35	100.7 Å²	100.7	36%	0.361	54%	0.538	S	S	.	.	H	α-helix	trans	-63.3	-37	173.7	0	0	0	0	0	112.8	E518 E519	E518-G522 PolarHBondContact O-N 3.48Å; E519-G522 PolarHBondContact O-N 3.05Å
523	S	58	Low	62.2	Low	69 Å²	69	97.8 Å²	97.8	48%	0.483	53%	0.531	S	S	.	.	H	α-helix	trans	-78.6	-39.5	176.5	-174.8	0	0	0	0	112.5	E519 E520 E521 A525 N526 L527	E519-S523 VanDerWaalsContact O-CB 3.32Å; E519-S523 WeakPolarHBondContact O-CB 3.08Å; E519-S523 PolarHBondContact O-N 2.96Å; E520-S523 CarbonylContact O-C 3.59Å; E520-S523 PolarHBondContact O-N 3.41Å; E521-S523 VanDerWaalsContact C-N 3.31Å; E521-S523 PolarHBondContact O-N 3.47Å; S523-A525 VanDerWaalsContact C-N 3.29Å; S523-A525 PolarHBondContact O-N 2.94Å; S523-N526 WeakPolarHBondContact O-CA 3.5Å; S523-N526 WeakPolarHBondContact O-CB 3.5Å; S523-N526 PolarHBondContact O-N 2.9Å; S523-L527 PolarHBondContact O-N 2.8Å
524	M	51.2	Low	62.3	Low	112 Å²	112	99.1 Å²	99.1	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-66.3	-31.3	177.4	-85.3	-145.6	56.7	0	0	112	E520 N526 L527	E520-M524 WeakPolarHBondContact O-CA 3.25Å; E520-M524 WeakPolarHBondContact O-CB 3.46Å; E520-M524 VanDerWaalsContact O-CG 3.24Å; E520-M524 WeakPolarHBondContact O-CG 3.43Å; E520-M524 PolarHBondContact O-N 3.47Å; M524-N526 PolarHBondContact O-N 3.28Å; M524-N526 VanDerWaalsContact O-N 3.08Å; M524-L527 PolarHBondContact O-N 2.64Å; M524-L527 VanDerWaalsContact O-N 3.09Å
525	A	54.5	Low	62.5	Low	39 Å²	39	103.1 Å²	103.1	32%	0.322	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.5	-25.7	169.3	0	0	0	0	0	112.6	E521 S523 K544	E521-A525 WeakPolarHBondContact O-CB 3.4Å; E521-A525 PolarHBondContact O-N 3.01Å; S523-A525 VanDerWaalsContact C-N 3.29Å; S523-A525 PolarHBondContact O-N 2.94Å; A525-K544 VanDerWaalsContact O-CE 3.29Å; A525-K544 WeakPolarHBondContact O-CE 3.2Å; A525-K544 PolarHBondContact O-NZ 2.84Å
526	N	54.9	Low	62.8	Low	131 Å²	131	106.2 Å²	106.2	70%	0.701	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-15.2	178.1	-63	-27.4	0	0	0	114.3	S523 M524	S523-N526 WeakPolarHBondContact O-CA 3.5Å; S523-N526 WeakPolarHBondContact O-CB 3.5Å; S523-N526 PolarHBondContact O-N 2.9Å; M524-N526 PolarHBondContact O-N 3.28Å; M524-N526 VanDerWaalsContact O-N 3.08Å
527	L	53.7	Low	62.9	Low	116 Å²	116	102 Å²	102	61%	0.607	55%	0.548	S	S	*	.	S	Bend	trans	-76	136.8	173.7	-117.3	88.6	0	0	0	110.2	S523 M524 E529	S523-L527 PolarHBondContact O-N 2.8Å; M524-L527 PolarHBondContact O-N 2.64Å; M524-L527 VanDerWaalsContact O-N 3.09Å; L527-E529 PolarHBondContact O-N 2.95Å
528	Q	53.7	Low	63.7	Low	192 Å²	192	101.1 Å²	101.1	90%	0.897	55%	0.548	S	S	*	.			trans	-64.2	97.6	-179.5	-76.5	172.9	-34.8	0	0	110.5	G530	Q528-G530 PolarHBondContact O-N 3.41Å
529	E	57.3	Low	64.3	Low	93 Å²	93	101.6 Å²	101.6	44%	0.435	55%	0.55	S	S	.	*			trans	-62.5	118.4	162.7	-70.3	-179.3	167.8	0	0	108.1	L527 F531	L527-E529 PolarHBondContact O-N 2.95Å; E529-F531 HydrophobicContact CB-CE1 3.92Å; E529-F531 HydrophobicContact CB-CZ 4.12Å; E529-F531 WeakPolarHBondContact O-CD2 3.37Å; E529-F531 WeakPolarHBondContact O-CE2 3.44Å; E529-F531 PolarHBondContact O-N 2.94Å
530	G	55.2	Low	64.9	Low	78 Å²	78	95.5 Å²	95.5	80%	0.804	52%	0.523	S	S	*	.			trans	-67.4	110.7	172.6	0	0	0	0	0	109.6	Q528	Q528-G530 PolarHBondContact O-N 3.41Å
531	F	63.2	Low	65.8	Low	63 Å²	63	94.5 Å²	94.5	28%	0.276	52%	0.521	S	S	.	.			trans	-83	131	179.8	-54.7	-66.5	0	0	0	110.8	E529 E537 V540	E529-F531 HydrophobicContact CB-CE1 3.92Å; E529-F531 HydrophobicContact CB-CZ 4.12Å; E529-F531 WeakPolarHBondContact O-CD2 3.37Å; E529-F531 WeakPolarHBondContact O-CE2 3.44Å; E529-F531 PolarHBondContact O-N 2.94Å; F531-E537 HydrophobicContact CB-CB 4.03Å; F531-E537 HydrophobicContact CD1-CB 4.3Å; F531-E537 HydrophobicContact CD2-CB 3.71Å; F531-E537 HydrophobicContact CD2-CG 3.65Å; F531-E537 HydrophobicContact CE2-CB 4.26Å; F531-E537 HydrophobicContact CE2-CG 3.87Å; F531-E537 HydrophobicContact CG-CB 3.74Å; F531-E537 HydrophobicContact CG-CG 4.21Å; F531-V540 HydrophobicContact CE1-CB 3.59Å; F531-V540 HydrophobicContact CE1-CG1 3.66Å; F531-V540 HydrophobicContact CE1-CG2 3.83Å; F531-V540 HydrophobicContact CZ-CB 4.02Å; F531-V540 HydrophobicContact CZ-CG1 3.77Å
532	T	68.3	Low	67	Low	133 Å²	133	91 Å²	91	82%	0.816	51%	0.509	S	S	*	.	S	Bend	trans	-89.3	-5.8	175.2	53.6	0	0	0	0	112.9	Q536	T532-Q536 PolarHBondContact OG1-OE1 3.23Å
533	S	74.5	Confident	68	Low	64 Å²	64	97.2 Å²	97.2	45%	0.448	52%	0.522	S	S	.	.	S	Bend	trans	-153	141	177.7	-175.3	0	0	0	0	112.2	K535 Q536 E537	S533-K535 PolarHBondContact O-N 3.38Å; S533-Q536 WeakPolarHBondContact O-CB 3.29Å; S533-Q536 PolarHBondContact O-N 3.45Å; S533-E537 PolarHBondContact O-N 2.82Å; S533-E537 VanDerWaalsContact O-N 3.13Å
534	L	75.9	Confident	68.9	Low	130 Å²	130	96.2 Å²	96.2	68%	0.681	51%	0.509	S	S	*	.	H	α-helix	trans	-57.2	-32.2	177.2	-160.9	79.6	0	0	0	112.6	Q536 E537 V538	L534-Q536 VanDerWaalsContact C-N 3.35Å; L534-E537 PolarHBondContact O-N 2.89Å; L534-V538 WeakPolarHBondContact O-CG2 3.23Å; L534-V538 PolarHBondContact O-N 2.93Å
535	K	78.5	Confident	70.3	Confident	150 Å²	150	96.6 Å²	96.6	65%	0.652	51%	0.512	S	S	*	.	H	α-helix	trans	-66.8	-38.6	177.1	-169.5	178.9	177.7	-175.7	0	111.7	S533 V538 E539	S533-K535 PolarHBondContact O-N 3.38Å; K535-V538 PolarHBondContact O-N 3.01Å; K535-E539 PolarHBondContact O-N 2.99Å
536	Q	75.5	Confident	71.7	Confident	93 Å²	93	101.2 Å²	101.2	44%	0.435	53%	0.525	S	S	.	.	H	α-helix	trans	-69.7	-38.2	177.6	-165	177.4	2.3	0	0	111	T532 S533 L534 E539 V540	T532-Q536 PolarHBondContact OG1-OE1 3.23Å; S533-Q536 WeakPolarHBondContact O-CB 3.29Å; S533-Q536 PolarHBondContact O-N 3.45Å; L534-Q536 VanDerWaalsContact C-N 3.35Å; Q536-E539 PolarHBondContact O-N 2.94Å; Q536-V540 WeakPolarHBondContact O-CB 3.31Å; Q536-V540 WeakPolarHBondContact O-CG2 3.27Å; Q536-V540 PolarHBondContact O-N 3.22Å
537	E	74.6	Confident	72.8	Confident	75 Å²	75	101.5 Å²	101.5	35%	0.35	52%	0.52	S	S	.	.	H	α-helix	trans	-60	-46.5	172.8	-179.2	176.4	-174.2	0	0	111.8	F531 S533 L534 E539 V540 N541	F531-E537 HydrophobicContact CB-CB 4.03Å; F531-E537 HydrophobicContact CD1-CB 4.3Å; F531-E537 HydrophobicContact CD2-CB 3.71Å; F531-E537 HydrophobicContact CD2-CG 3.65Å; F531-E537 HydrophobicContact CE2-CB 4.26Å; F531-E537 HydrophobicContact CE2-CG 3.87Å; F531-E537 HydrophobicContact CG-CB 3.74Å; F531-E537 HydrophobicContact CG-CG 4.21Å; S533-E537 PolarHBondContact O-N 2.82Å; S533-E537 VanDerWaalsContact O-N 3.13Å; L534-E537 PolarHBondContact O-N 2.89Å; E537-E539 PolarHBondContact O-N 2.64Å; E537-V540 PolarHBondContact O-N 3.2Å; E537-N541 WeakPolarHBondContact CG-ND2 3.37Å; E537-N541 WeakPolarHBondContact O-CB 3.46Å; E537-N541 VanDerWaalsContact O-CG 3.32Å; E537-N541 PolarHBondContact O-N 3.4Å; E537-N541 PolarHBondContact O-ND2 3.21Å
538	V	80.6	Confident	74.1	Confident	85 Å²	85	101 Å²	101	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-44.2	177.3	173.3	0	0	0	0	111.2	L534 K535 T542	L534-V538 WeakPolarHBondContact O-CG2 3.23Å; L534-V538 PolarHBondContact O-N 2.93Å; K535-V538 PolarHBondContact O-N 3.01Å; V538-T542 VanDerWaalsContact O-CB 3.24Å; V538-T542 WeakPolarHBondContact O-CB 3.39Å; V538-T542 PolarHBondContact O-N 3.46Å; V538-T542 PolarHBondContact O-OG1 3.09Å
539	E	79.6	Confident	75.5	Confident	93 Å²	93	97.8 Å²	97.8	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-63.7	-44.8	178.8	-77	-179	-163.9	0	0	112.3	K535 Q536 E537 T542 R543	K535-E539 PolarHBondContact O-N 2.99Å; Q536-E539 PolarHBondContact O-N 2.94Å; E537-E539 PolarHBondContact O-N 2.64Å; E539-T542 PolarHBondContact O-N 2.85Å; E539-R543 WeakPolarHBondContact O-CG 3.23Å; E539-R543 PolarHBondContact O-N 2.87Å
540	V	77	Confident	76.6	Confident	22 Å²	22	99.4 Å²	99.4	13%	0.133	51%	0.508	C	S	.	.	H	α-helix	trans	-67.6	-45.9	178.3	171.9	0	0	0	0	110.9	F531 Q536 E537 T542 R543 K544	F531-V540 HydrophobicContact CE1-CB 3.59Å; F531-V540 HydrophobicContact CE1-CG1 3.66Å; F531-V540 HydrophobicContact CE1-CG2 3.83Å; F531-V540 HydrophobicContact CZ-CB 4.02Å; F531-V540 HydrophobicContact CZ-CG1 3.77Å; Q536-V540 WeakPolarHBondContact O-CB 3.31Å; Q536-V540 WeakPolarHBondContact O-CG2 3.27Å; Q536-V540 PolarHBondContact O-N 3.22Å; E537-V540 PolarHBondContact O-N 3.2Å; V540-T542 VanDerWaalsContact C-N 3.31Å; V540-T542 PolarHBondContact O-N 3.16Å; V540-R543 PolarHBondContact O-N 3.46Å; V540-K544 HydrophobicContact CG1-CD 4.19Å; V540-K544 HydrophobicContact CG1-CG 4.34Å; V540-K544 WeakPolarHBondContact O-CG 3.44Å; V540-K544 PolarHBondContact O-N 2.94Å
541	N	78.9	Confident	77.7	Confident	72 Å²	72	101.3 Å²	101.3	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-63.3	-36.1	176.3	-76.4	-20.7	0	0	0	112	E537 K544 L545	E537-N541 WeakPolarHBondContact CG-ND2 3.37Å; E537-N541 WeakPolarHBondContact O-CB 3.46Å; E537-N541 VanDerWaalsContact O-CG 3.32Å; E537-N541 PolarHBondContact O-N 3.4Å; E537-N541 PolarHBondContact O-ND2 3.21Å; N541-K544 PolarHBondContact O-N 3.45Å; N541-L545 VanDerWaalsContact O-CB 3.24Å; N541-L545 WeakPolarHBondContact O-CB 3.42Å; N541-L545 PolarHBondContact O-N 3.5Å
542	T	83	Confident	78.6	Confident	66 Å²	66	102.4 Å²	102.4	41%	0.405	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-40.1	174.9	-55.8	0	0	0	0	111.3	V538 E539 V540 L545 K546	V538-T542 VanDerWaalsContact O-CB 3.24Å; V538-T542 WeakPolarHBondContact O-CB 3.39Å; V538-T542 PolarHBondContact O-N 3.46Å; V538-T542 PolarHBondContact O-OG1 3.09Å; E539-T542 PolarHBondContact O-N 2.85Å; V540-T542 VanDerWaalsContact C-N 3.31Å; V540-T542 PolarHBondContact O-N 3.16Å; T542-L545 PolarHBondContact O-N 2.82Å; T542-K546 WeakPolarHBondContact O-CG 3.38Å; T542-K546 PolarHBondContact O-N 3.25Å
543	R	80.5	Confident	79.3	Confident	166 Å²	166	100.2 Å²	100.2	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-67	-43.7	174.3	-71.1	176.9	-171.4	177.5	5.3	111.9	E539 V540 L545 K546 K547	E539-R543 WeakPolarHBondContact O-CG 3.23Å; E539-R543 PolarHBondContact O-N 2.87Å; V540-R543 PolarHBondContact O-N 3.46Å; R543-L545 VanDerWaalsContact C-N 3.34Å; R543-K546 PolarHBondContact O-N 3.31Å; R543-K547 PolarHBondContact O-N 2.87Å
544	K	77.3	Confident	79.6	Confident	48 Å²	48	101.3 Å²	101.3	21%	0.209	48%	0.481	C	S	.	.	H	α-helix	trans	-60.4	-43.7	174.7	-71.2	-175	-177.5	-164.2	0	111	A525 V540 N541 K546 K547 L548	A525-K544 VanDerWaalsContact O-CE 3.29Å; A525-K544 WeakPolarHBondContact O-CE 3.2Å; A525-K544 PolarHBondContact O-NZ 2.84Å; V540-K544 HydrophobicContact CG1-CD 4.19Å; V540-K544 HydrophobicContact CG1-CG 4.34Å; V540-K544 WeakPolarHBondContact O-CG 3.44Å; V540-K544 PolarHBondContact O-N 2.94Å; N541-K544 PolarHBondContact O-N 3.45Å; K544-K546 PolarHBondContact O-N 3.2Å; K544-K547 PolarHBondContact O-N 3.44Å; K544-L548 WeakPolarHBondContact O-CB 3.4Å; K544-L548 WeakPolarHBondContact O-CG 3.5Å; K544-L548 PolarHBondContact O-N 3.39Å
545	L	80	Confident	79.9	Confident	119 Å²	119	100 Å²	100	62%	0.623	47%	0.474	S	S	*	.	H	α-helix	trans	-62.3	-43.3	177.4	-174.1	67	0	0	0	111.8	N541 T542 R543 L548 F549	N541-L545 VanDerWaalsContact O-CB 3.24Å; N541-L545 WeakPolarHBondContact O-CB 3.42Å; N541-L545 PolarHBondContact O-N 3.5Å; T542-L545 PolarHBondContact O-N 2.82Å; R543-L545 VanDerWaalsContact C-N 3.34Å; L545-L548 PolarHBondContact O-N 3.47Å; L545-F549 VanDerWaalsContact O-CB 3.23Å; L545-F549 WeakPolarHBondContact O-CB 3.5Å; L545-F549 PolarHBondContact O-N 2.94Å
546	K	83.1	Confident	80.2	Confident	136 Å²	136	99.3 Å²	99.3	59%	0.591	47%	0.471	S	S	*	.	H	α-helix	trans	-59.8	-49.1	174.2	-75.7	-177.5	179	-173.3	0	111.9	T542 R543 K544 L548 F549 E550	T542-K546 WeakPolarHBondContact O-CG 3.38Å; T542-K546 PolarHBondContact O-N 3.25Å; R543-K546 PolarHBondContact O-N 3.31Å; K544-K546 PolarHBondContact O-N 3.2Å; K546-L548 VanDerWaalsContact C-N 3.35Å; K546-L548 PolarHBondContact O-N 2.84Å; K546-F549 PolarHBondContact O-N 3.44Å; K546-E550 WeakPolarHBondContact O-CG 3.49Å; K546-E550 PolarHBondContact O-N 2.94Å
547	K	78.7	Confident	80.6	Confident	138 Å²	138	97 Å²	97	60%	0.6	46%	0.46	S	S	*	.	H	α-helix	trans	-60.1	-41.7	176.9	-71.8	-174.9	176.5	-171.9	0	112.5	R543 K544 K551	R543-K547 PolarHBondContact O-N 2.87Å; K544-K547 PolarHBondContact O-N 3.44Å; K547-K551 WeakPolarHBondContact O-CG 3.41Å; K547-K551 PolarHBondContact O-N 2.95Å; K547-K551 VanDerWaalsContact O-N 3.08Å
548	L	80.3	Confident	80.9	Confident	105 Å²	105	99 Å²	99	55%	0.55	47%	0.467	S	S	.	.	H	α-helix	trans	-69.1	-37	177.2	-74.2	171.9	0	0	0	112.1	K544 L545 K546 K551 L552	K544-L548 WeakPolarHBondContact O-CB 3.4Å; K544-L548 WeakPolarHBondContact O-CG 3.5Å; K544-L548 PolarHBondContact O-N 3.39Å; L545-L548 PolarHBondContact O-N 3.47Å; K546-L548 VanDerWaalsContact C-N 3.35Å; K546-L548 PolarHBondContact O-N 2.84Å; L548-K551 PolarHBondContact O-N 3.26Å; L548-L552 VanDerWaalsContact O-CB 3.31Å; L548-L552 WeakPolarHBondContact O-CB 3.34Å; L548-L552 PolarHBondContact O-N 2.67Å
549	F	82.9	Confident	81	Confident	125 Å²	125	98.2 Å²	98.2	55%	0.548	46%	0.463	S	S	.	.	H	α-helix	trans	-65.7	-43.5	176.3	-173.8	-93.1	0	0	0	111.5	L545 K546 L552 Q553	L545-F549 VanDerWaalsContact O-CB 3.23Å; L545-F549 WeakPolarHBondContact O-CB 3.5Å; L545-F549 PolarHBondContact O-N 2.94Å; K546-F549 PolarHBondContact O-N 3.44Å; F549-L552 PolarHBondContact O-N 3.39Å; F549-Q553 WeakPolarHBondContact O-CB 3.43Å; F549-Q553 PolarHBondContact O-N 3.46Å
550	E	81.5	Confident	81.4	Confident	127 Å²	127	97 Å²	97	59%	0.593	47%	0.465	S	S	*	.	H	α-helix	trans	-59.1	-48.7	172.9	-74.1	168.3	-171.3	0	0	111.3	K546 L552 Q553 E554	K546-E550 WeakPolarHBondContact O-CG 3.49Å; K546-E550 PolarHBondContact O-N 2.94Å; E550-L552 VanDerWaalsContact C-N 3.31Å; E550-L552 PolarHBondContact O-N 2.83Å; E550-Q553 PolarHBondContact O-N 3.48Å; E550-E554 PolarHBondContact O-N 2.88Å
551	K	78.6	Confident	81.7	Confident	118 Å²	118	97.3 Å²	97.3	51%	0.513	47%	0.466	S	S	.	.	H	α-helix	trans	-59.2	-39.8	175	-75.1	-176.5	179	-174.3	0	112.6	K547 L548 E554 I555	K547-K551 WeakPolarHBondContact O-CG 3.41Å; K547-K551 PolarHBondContact O-N 2.95Å; K547-K551 VanDerWaalsContact O-N 3.08Å; L548-K551 PolarHBondContact O-N 3.26Å; K551-E554 PolarHBondContact O-N 3.11Å; K551-I555 VanDerWaalsContact O-CG1 3.29Å; K551-I555 WeakPolarHBondContact O-CG1 3.39Å; K551-I555 PolarHBondContact O-N 3.41Å
552	L	81.7	Confident	81.7	Confident	85 Å²	85	99.6 Å²	99.6	45%	0.445	48%	0.476	S	S	.	.	H	α-helix	trans	-68.6	-39.2	178.7	-179.4	130.3	0	0	0	111.7	L548 F549 E550 I555 K556	L548-L552 VanDerWaalsContact O-CB 3.31Å; L548-L552 WeakPolarHBondContact O-CB 3.34Å; L548-L552 PolarHBondContact O-N 2.67Å; F549-L552 PolarHBondContact O-N 3.39Å; E550-L552 VanDerWaalsContact C-N 3.31Å; E550-L552 PolarHBondContact O-N 2.83Å; L552-I555 PolarHBondContact O-N 2.89Å; L552-K556 HydrophobicContact CD2-CD 3.98Å; L552-K556 WeakPolarHBondContact O-CB 3.22Å; L552-K556 WeakPolarHBondContact O-CG 3.34Å; L552-K556 PolarHBondContact O-N 2.85Å
553	Q	83.7	Confident	81.8	Confident	87 Å²	87	102.4 Å²	102.4	41%	0.407	48%	0.484	S	S	.	.	H	α-helix	trans	-64.2	-43.7	174.7	-173.8	170.1	-13.8	0	0	111	F549 E550 I555 K556 Q557	F549-Q553 WeakPolarHBondContact O-CB 3.43Å; F549-Q553 PolarHBondContact O-N 3.46Å; E550-Q553 PolarHBondContact O-N 3.48Å; Q553-I555 PolarHBondContact O-N 3.41Å; Q553-K556 PolarHBondContact O-N 3.27Å; Q553-Q557 PolarHBondContact O-N 3.04Å
554	E	80.1	Confident	82	Confident	87 Å²	87	100.8 Å²	100.8	41%	0.407	48%	0.484	S	S	.	.	H	α-helix	trans	-59.7	-45.3	175.5	-168.6	-169.7	168.7	0	0	111.8	E550 K551 Q557 K558	E550-E554 PolarHBondContact O-N 2.88Å; K551-E554 PolarHBondContact O-N 3.11Å; E554-Q557 PolarHBondContact O-N 3.47Å; E554-K558 HydrophobicContact CG-CD 4.42Å; E554-K558 WeakPolarHBondContact O-CB 3.46Å; E554-K558 VanDerWaalsContact O-CG 3.29Å; E554-K558 WeakPolarHBondContact O-CG 3.24Å; E554-K558 PolarHBondContact O-N 2.95Å; E554-K558 VanDerWaalsContact OE1-CE 3.23Å; E554-K558 WeakPolarHBondContact OE1-CE 3.42Å; E554-K558 IonicContact OE1-NZ 2.91Å; E554-K558 PolarHBondContact OE1-NZ 2.9Å
555	I	82.1	Confident	82.2	Confident	103 Å²	103	101 Å²	101	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-66.1	-40.1	177.6	-68.6	168.3	0	0	0	111.4	K551 L552 Q553 K558 T559	K551-I555 VanDerWaalsContact O-CG1 3.29Å; K551-I555 WeakPolarHBondContact O-CG1 3.39Å; K551-I555 PolarHBondContact O-N 3.41Å; L552-I555 PolarHBondContact O-N 2.89Å; Q553-I555 PolarHBondContact O-N 3.41Å; I555-K558 PolarHBondContact O-N 3.36Å; I555-T559 WeakPolarHBondContact O-CB 3.38Å; I555-T559 PolarHBondContact O-N 3.22Å; I555-T559 PolarHBondContact O-OG1 2.88Å
556	K	85.4	Confident	82.3	Confident	135 Å²	135	101 Å²	101	59%	0.587	48%	0.482	S	S	*	.	H	α-helix	trans	-62.6	-45.5	176.3	-81.4	-178	174.6	-178.4	0	111.7	L552 Q553 T559 S560	L552-K556 HydrophobicContact CD2-CD 3.98Å; L552-K556 WeakPolarHBondContact O-CB 3.22Å; L552-K556 WeakPolarHBondContact O-CG 3.34Å; L552-K556 PolarHBondContact O-N 2.85Å; Q553-K556 PolarHBondContact O-N 3.27Å; K556-T559 PolarHBondContact O-N 3.25Å; K556-S560 PolarHBondContact O-N 3.02Å
557	Q	83.4	Confident	82.4	Confident	44 Å²	44	98.1 Å²	98.1	21%	0.206	48%	0.475	C	S	.	.	H	α-helix	trans	-62.6	-46.6	176.3	-168.4	-178.8	4.4	0	0	110.6	D54 Q553 E554 T559 S560 D561	D54-Q557 PolarHBondContact OD1-NE2 2.69Å; Q553-Q557 PolarHBondContact O-N 3.04Å; E554-Q557 PolarHBondContact O-N 3.47Å; Q557-T559 VanDerWaalsContact C-N 3.26Å; Q557-T559 PolarHBondContact O-N 3.37Å; Q557-S560 PolarHBondContact O-N 2.95Å; Q557-D561 WeakPolarHBondContact O-CB 3.48Å; Q557-D561 PolarHBondContact O-N 3.31Å
558	K	79.8	Confident	82.8	Confident	117 Å²	117	94.9 Å²	94.9	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-55.5	-39.4	174.3	-76.3	174.2	-176.5	170	0	113	E554 I555 M562	E554-K558 HydrophobicContact CG-CD 4.42Å; E554-K558 WeakPolarHBondContact O-CB 3.46Å; E554-K558 VanDerWaalsContact O-CG 3.29Å; E554-K558 WeakPolarHBondContact O-CG 3.24Å; E554-K558 PolarHBondContact O-N 2.95Å; E554-K558 VanDerWaalsContact OE1-CE 3.23Å; E554-K558 WeakPolarHBondContact OE1-CE 3.42Å; E554-K558 IonicContact OE1-NZ 2.91Å; E554-K558 PolarHBondContact OE1-NZ 2.9Å; I555-K558 PolarHBondContact O-N 3.36Å; K558-M562 WeakPolarHBondContact O-CB 3.44Å; K558-M562 PolarHBondContact O-N 3.3Å
559	T	83.7	Confident	82.7	Confident	70 Å²	70	93.7 Å²	93.7	43%	0.429	46%	0.458	S	S	.	.	H	α-helix	trans	-69.7	-45	178.9	-54	0	0	0	0	111.4	I555 K556 Q557 M562 Q563	I555-T559 WeakPolarHBondContact O-CB 3.38Å; I555-T559 PolarHBondContact O-N 3.22Å; I555-T559 PolarHBondContact O-OG1 2.88Å; K556-T559 PolarHBondContact O-N 3.25Å; Q557-T559 VanDerWaalsContact C-N 3.26Å; Q557-T559 PolarHBondContact O-N 3.37Å; T559-M562 PolarHBondContact O-N 3.46Å; T559-Q563 WeakPolarHBondContact O-CG 3.4Å; T559-Q563 PolarHBondContact O-N 3.32Å
560	S	86.9	Confident	82.8	Confident	68 Å²	68	95.8 Å²	95.8	48%	0.476	46%	0.463	S	S	.	.	H	α-helix	trans	-60.2	-47	175.1	-172.8	0	0	0	0	111.3	K556 Q557 M562 Q563 E564	K556-S560 PolarHBondContact O-N 3.02Å; Q557-S560 PolarHBondContact O-N 2.95Å; S560-M562 PolarHBondContact O-N 3.49Å; S560-Q563 PolarHBondContact O-N 3.08Å; S560-E564 PolarHBondContact O-N 3.05Å
561	D	83.1	Confident	83	Confident	28 Å²	28	94.6 Å²	94.6	15%	0.15	46%	0.457	C	S	.	.	H	α-helix	trans	-58.7	-34	175.9	-106.1	50.2	0	0	0	113	K57 Q557 K565	K57-D561 WeakPolarHBondContact CE-OD2 3.39Å; K57-D561 IonicContact NZ-OD2 3.39Å; K57-D561 PolarHBondContact NZ-OD2 2.64Å; Q557-D561 WeakPolarHBondContact O-CB 3.48Å; Q557-D561 PolarHBondContact O-N 3.31Å; D561-K565 VanDerWaalsContact O-CG 3.3Å; D561-K565 WeakPolarHBondContact O-CG 3.36Å; D561-K565 PolarHBondContact O-N 2.87Å; D561-K565 PolarHBondContact O-NZ 2.75Å; D561-K565 IonicContact OD2-NZ 2.72Å; D561-K565 PolarHBondContact OD2-NZ 3.36Å
562	M	79.9	Confident	83.2	Confident	119 Å²	119	93 Å²	93	59%	0.586	45%	0.451	S	S	*	.	H	α-helix	trans	-75.7	-42	178.3	-170.6	170	-71.2	0	0	110.7	K558 T559 S560 K565 H566	K558-M562 WeakPolarHBondContact O-CB 3.44Å; K558-M562 PolarHBondContact O-N 3.3Å; T559-M562 PolarHBondContact O-N 3.46Å; S560-M562 PolarHBondContact O-N 3.49Å; M562-K565 PolarHBondContact O-N 3Å; M562-H566 PolarHBondContact O-CD2 3.33Å; M562-H566 PolarHBondContact O-N 2.9Å
563	Q	84.4	Confident	83.2	Confident	126 Å²	126	94.9 Å²	94.9	59%	0.589	46%	0.458	S	S	*	.	H	α-helix	trans	-62.5	-42.7	175.9	-74.1	176.9	-16.2	0	0	112.5	T559 S560 K565 H566 T567	T559-Q563 WeakPolarHBondContact O-CG 3.4Å; T559-Q563 PolarHBondContact O-N 3.32Å; S560-Q563 PolarHBondContact O-N 3.08Å; Q563-K565 VanDerWaalsContact C-N 3.31Å; Q563-K565 PolarHBondContact O-N 3.27Å; Q563-H566 PolarHBondContact O-N 3.22Å; Q563-T567 PolarHBondContact O-N 2.91Å; Q563-T567 PolarHBondContact O-OG1 3.22Å
564	E	86.3	Confident	83.3	Confident	132 Å²	132	94.9 Å²	94.9	62%	0.617	46%	0.458	S	S	*	.	H	α-helix	trans	-61.2	-41.7	177.3	-171.3	172.4	-168.2	0	0	111.2	S560 T567 V568	S560-E564 PolarHBondContact O-N 3.05Å; E564-T567 WeakPolarHBondContact O-CB 3.05Å; E564-T567 PolarHBondContact O-N 3.18Å; E564-T567 VanDerWaalsContact O-N 3.16Å; E564-V568 WeakPolarHBondContact O-CG2 3.42Å; E564-V568 PolarHBondContact O-N 2.84Å
565	K	79.6	Confident	83.7	Confident	52 Å²	52	97 Å²	97	23%	0.226	47%	0.466	C	S	.	.	H	α-helix	trans	-66.5	-45.4	176.9	-70.4	-179.9	-159.5	102.6	0	113	D561 M562 Q563 T567 V568 E569	D561-K565 VanDerWaalsContact O-CG 3.3Å; D561-K565 WeakPolarHBondContact O-CG 3.36Å; D561-K565 PolarHBondContact O-N 2.87Å; D561-K565 PolarHBondContact O-NZ 2.75Å; D561-K565 IonicContact OD2-NZ 2.72Å; D561-K565 PolarHBondContact OD2-NZ 3.36Å; M562-K565 PolarHBondContact O-N 3Å; Q563-K565 VanDerWaalsContact C-N 3.31Å; Q563-K565 PolarHBondContact O-N 3.27Å; K565-T567 PolarHBondContact O-N 2.78Å; K565-V568 PolarHBondContact O-N 2.88Å; K565-V568 VanDerWaalsContact O-N 3.15Å; K565-E569 WeakPolarHBondContact O-CB 3.44Å; K565-E569 WeakPolarHBondContact O-CG 3.32Å; K565-E569 PolarHBondContact O-N 3.01Å
566	H	82.6	Confident	83.8	Confident	120 Å²	120	96.2 Å²	96.2	56%	0.556	46%	0.461	S	S	*	.	H	α-helix	trans	-57.6	-34.4	173.3	-85.8	-116.4	0	0	0	111.4	M562 Q563 R570	M562-H566 PolarHBondContact O-CD2 3.33Å; M562-H566 PolarHBondContact O-N 2.9Å; Q563-H566 PolarHBondContact O-N 3.22Å; H566-R570 WeakPolarHBondContact O-CB 3.39Å; H566-R570 PolarHBondContact O-N 2.92Å
567	T	86.2	Confident	83.9	Confident	75 Å²	75	95.7 Å²	95.7	46%	0.46	46%	0.461	S	S	.	.	H	α-helix	trans	-69.9	-44.1	177	-50.5	0	0	0	0	111.5	Q563 E564 K565 R570 Q571	Q563-T567 PolarHBondContact O-N 2.91Å; Q563-T567 PolarHBondContact O-OG1 3.22Å; E564-T567 WeakPolarHBondContact O-CB 3.05Å; E564-T567 PolarHBondContact O-N 3.18Å; E564-T567 VanDerWaalsContact O-N 3.16Å; K565-T567 PolarHBondContact O-N 2.78Å; T567-R570 PolarHBondContact O-N 3.24Å; T567-Q571 WeakPolarHBondContact O-CG 3.31Å; T567-Q571 PolarHBondContact O-N 2.78Å
568	V	86.3	Confident	84.1	Confident	69 Å²	69	98 Å²	98	42%	0.418	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-47.6	176.7	174.1	0	0	0	0	111.4	E564 K565 R570 Q571 E572	E564-V568 WeakPolarHBondContact O-CG2 3.42Å; E564-V568 PolarHBondContact O-N 2.84Å; K565-V568 PolarHBondContact O-N 2.88Å; K565-V568 VanDerWaalsContact O-N 3.15Å; V568-R570 VanDerWaalsContact C-N 3.31Å; V568-R570 PolarHBondContact O-N 3.48Å; V568-Q571 WeakPolarHBondContact O-CB 3.33Å; V568-Q571 PolarHBondContact O-N 3.44Å; V568-Q571 VanDerWaalsContact O-N 3.13Å; V568-E572 PolarHBondContact O-N 3.41Å
569	E	78.2	Confident	84.5	Confident	81 Å²	81	98.1 Å²	98.1	38%	0.379	48%	0.477	S	S	.	.	H	α-helix	trans	-59.6	-43	177	-72.9	173.3	178.7	0	0	110.8	K565 Q571 E572 H573	K565-E569 WeakPolarHBondContact O-CB 3.44Å; K565-E569 WeakPolarHBondContact O-CG 3.32Å; K565-E569 PolarHBondContact O-N 3.01Å; E569-Q571 PolarHBondContact O-N 3.13Å; E569-E572 PolarHBondContact O-N 2.83Å; E569-H573 PolarHBondContact O-CD2 2.93Å; E569-H573 PolarHBondContact O-N 3.47Å
570	R	85.1	Confident	84.6	Confident	169 Å²	169	99.1 Å²	99.1	64%	0.638	48%	0.479	S	S	*	.	H	α-helix	trans	-60.3	-42.6	174.4	-178.2	177.6	174.6	163.8	5.2	112.4	H566 T567 V568 H573 E574	H566-R570 WeakPolarHBondContact O-CB 3.39Å; H566-R570 PolarHBondContact O-N 2.92Å; T567-R570 PolarHBondContact O-N 3.24Å; V568-R570 VanDerWaalsContact C-N 3.31Å; V568-R570 PolarHBondContact O-N 3.48Å; R570-H573 PolarHBondContact O-N 3.25Å; R570-E574 IonicContact CZ-OE1 2.85Å; R570-E574 IonicContact NE-OE1 2.86Å; R570-E574 PolarHBondContact NE-OE1 2.73Å; R570-E574 VanDerWaalsContact NE-OE1 3.08Å; R570-E574 IonicContact NH2-OE1 2.97Å; R570-E574 WeakPolarHBondContact O-CB 3.16Å; R570-E574 WeakPolarHBondContact O-CG 3.36Å; R570-E574 PolarHBondContact O-N 3.04Å
571	Q	85.9	Confident	84.7	Confident	101 Å²	101	98.3 Å²	98.3	47%	0.472	47%	0.472	S	S	.	.	H	α-helix	trans	-65.6	-36.7	175.9	-73.5	175.9	5.7	0	0	112.5	T567 V568 E569 K575	T567-Q571 WeakPolarHBondContact O-CG 3.31Å; T567-Q571 PolarHBondContact O-N 2.78Å; V568-Q571 WeakPolarHBondContact O-CB 3.33Å; V568-Q571 PolarHBondContact O-N 3.44Å; V568-Q571 VanDerWaalsContact O-N 3.13Å; E569-Q571 PolarHBondContact O-N 3.13Å; Q571-K575 WeakPolarHBondContact O-CG 3.5Å; Q571-K575 PolarHBondContact O-N 2.94Å
572	E	82.3	Confident	84.9	Confident	84 Å²	84	105.5 Å²	105.5	39%	0.393	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-45.6	173.6	-72.7	-177.1	163.2	0	0	110.9	R253 V568 E569 K575 I576	R253-E572 IonicContact NH1-OE1 3.55Å; R253-E572 IonicContact NH1-OE2 3.92Å; V568-E572 PolarHBondContact O-N 3.41Å; E569-E572 PolarHBondContact O-N 2.83Å; E572-K575 PolarHBondContact O-N 3.24Å; E572-I576 WeakPolarHBondContact O-CG1 3.48Å; E572-I576 PolarHBondContact O-N 3.16Å
573	H	81.8	Confident	85.3	Confident	126 Å²	126	105.2 Å²	105.2	58%	0.583	49%	0.494	S	S	*	.	H	α-helix	trans	-62.4	-41.7	175.1	-72	-56.9	0	0	0	112.8	E569 R570 K575 I576 Q577	E569-H573 PolarHBondContact O-CD2 2.93Å; E569-H573 PolarHBondContact O-N 3.47Å; R570-H573 PolarHBondContact O-N 3.25Å; H573-K575 VanDerWaalsContact C-N 3.34Å; H573-K575 PolarHBondContact O-N 2.59Å; H573-I576 PolarHBondContact O-N 3.42Å; H573-Q577 WeakPolarHBondContact O-CB 3.18Å; H573-Q577 PolarHBondContact O-N 3.15Å
574	E	86.3	Confident	85.5	Confident	87 Å²	87	103.6 Å²	103.6	41%	0.407	49%	0.488	S	S	.	.	H	α-helix	trans	-61.2	-41.4	175.3	-77.5	171.8	-174.1	0	0	111.3	R570 Q577 D578	R570-E574 IonicContact CZ-OE1 2.85Å; R570-E574 IonicContact NE-OE1 2.86Å; R570-E574 PolarHBondContact NE-OE1 2.73Å; R570-E574 VanDerWaalsContact NE-OE1 3.08Å; R570-E574 IonicContact NH2-OE1 2.97Å; R570-E574 WeakPolarHBondContact O-CB 3.16Å; R570-E574 WeakPolarHBondContact O-CG 3.36Å; R570-E574 PolarHBondContact O-N 3.04Å; E574-Q577 PolarHBondContact O-N 2.95Å; E574-D578 WeakPolarHBondContact O-CB 3.42Å; E574-D578 PolarHBondContact O-N 3.27Å
575	K	88.1	Confident	85.7	Confident	131 Å²	131	103.9 Å²	103.9	57%	0.57	49%	0.488	S	S	*	.	H	α-helix	trans	-63.5	-41.6	174.9	-74.3	171.4	-176.2	172.9	0	112.8	Q571 E572 H573 D578 Q579	Q571-K575 WeakPolarHBondContact O-CG 3.5Å; Q571-K575 PolarHBondContact O-N 2.94Å; E572-K575 PolarHBondContact O-N 3.24Å; H573-K575 VanDerWaalsContact C-N 3.34Å; H573-K575 PolarHBondContact O-N 2.59Å; K575-D578 PolarHBondContact O-N 3.23Å; K575-Q579 WeakPolarHBondContact O-CG 3.34Å; K575-Q579 PolarHBondContact O-N 2.87Å
576	I	85.2	Confident	86.2	Confident	86 Å²	86	106.5 Å²	106.5	44%	0.441	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-44.3	176.8	-67.2	166.3	0	0	0	109.9	E572 H573 D578 Q579 L580	E572-I576 WeakPolarHBondContact O-CG1 3.48Å; E572-I576 PolarHBondContact O-N 3.16Å; H573-I576 PolarHBondContact O-N 3.42Å; I576-D578 VanDerWaalsContact C-N 3.31Å; I576-D578 PolarHBondContact O-N 2.81Å; I576-Q579 PolarHBondContact O-N 3.29Å; I576-Q579 VanDerWaalsContact O-N 3.17Å; I576-L580 HydrophobicContact CG2-CD1 3.96Å; I576-L580 HydrophobicContact CG2-CG 4.35Å; I576-L580 WeakPolarHBondContact O-CG 3.13Å; I576-L580 PolarHBondContact O-N 2.9Å
577	Q	86.3	Confident	86.4	Confident	124 Å²	124	106.6 Å²	106.6	58%	0.579	50%	0.504	S	S	*	.	H	α-helix	trans	-59.6	-42	175.9	-176.3	178.8	-13.8	0	0	111.3	H573 E574 L580 T581	H573-Q577 WeakPolarHBondContact O-CB 3.18Å; H573-Q577 PolarHBondContact O-N 3.15Å; E574-Q577 PolarHBondContact O-N 2.95Å; Q577-L580 PolarHBondContact O-N 3.43Å; Q577-T581 VanDerWaalsContact O-CB 3.24Å; Q577-T581 WeakPolarHBondContact O-CB 3.25Å; Q577-T581 PolarHBondContact O-N 2.96Å; Q577-T581 PolarHBondContact O-OG1 3.3Å
578	D	88.7	Confident	86.4	Confident	92 Å²	92	106.6 Å²	106.6	49%	0.492	50%	0.501	S	S	.	.	H	α-helix	trans	-62.8	-41.6	174.7	-84.1	-12.2	0	0	0	112.3	E574 K575 I576 T581 R582	E574-D578 WeakPolarHBondContact O-CB 3.42Å; E574-D578 PolarHBondContact O-N 3.27Å; K575-D578 PolarHBondContact O-N 3.23Å; I576-D578 VanDerWaalsContact C-N 3.31Å; I576-D578 PolarHBondContact O-N 2.81Å; D578-T581 PolarHBondContact O-N 3.45Å; D578-R582 VanDerWaalsContact O-CG 3.26Å; D578-R582 WeakPolarHBondContact O-CG 3.37Å; D578-R582 PolarHBondContact O-N 2.95Å
579	Q	87.2	Confident	86.5	Confident	121 Å²	121	108 Å²	108	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-49.6	175.8	-74.6	175.5	-2.3	0	0	111.6	K575 I576 T581 R582 E583	K575-Q579 WeakPolarHBondContact O-CG 3.34Å; K575-Q579 PolarHBondContact O-N 2.87Å; I576-Q579 PolarHBondContact O-N 3.29Å; I576-Q579 VanDerWaalsContact O-N 3.17Å; Q579-T581 VanDerWaalsContact C-N 3.3Å; Q579-T581 PolarHBondContact O-N 2.81Å; Q579-R582 WeakPolarHBondContact O-CB 3.4Å; Q579-R582 PolarHBondContact O-N 3.38Å; Q579-R582 VanDerWaalsContact O-N 3.11Å; Q579-E583 PolarHBondContact O-N 2.95Å
580	L	86.1	Confident	86.9	Confident	90 Å²	90	108.2 Å²	108.2	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-40.2	176.1	-70.4	172.2	0	0	0	111.6	I576 Q577 R582 E583 I584	I576-L580 HydrophobicContact CG2-CD1 3.96Å; I576-L580 HydrophobicContact CG2-CG 4.35Å; I576-L580 WeakPolarHBondContact O-CG 3.13Å; I576-L580 PolarHBondContact O-N 2.9Å; Q577-L580 PolarHBondContact O-N 3.43Å; L580-R582 VanDerWaalsContact C-N 3.32Å; L580-R582 PolarHBondContact O-N 3.38Å; L580-E583 PolarHBondContact O-N 2.9Å; L580-I584 WeakPolarHBondContact O-CB 3.44Å; L580-I584 VanDerWaalsContact O-CG1 3.29Å; L580-I584 WeakPolarHBondContact O-CG1 3.41Å; L580-I584 PolarHBondContact O-N 3.37Å
581	T	88.9	Confident	86.9	Confident	52 Å²	52	103.5 Å²	103.5	32%	0.319	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-37.1	176.3	-57	0	0	0	0	111.3	Q577 D578 Q579 K585	Q577-T581 VanDerWaalsContact O-CB 3.24Å; Q577-T581 WeakPolarHBondContact O-CB 3.25Å; Q577-T581 PolarHBondContact O-N 2.96Å; Q577-T581 PolarHBondContact O-OG1 3.3Å; D578-T581 PolarHBondContact O-N 3.45Å; Q579-T581 VanDerWaalsContact C-N 3.3Å; Q579-T581 PolarHBondContact O-N 2.81Å; T581-K585 HydrophobicContact CG2-CD 4.27Å; T581-K585 WeakPolarHBondContact O-CB 3.49Å; T581-K585 VanDerWaalsContact O-CG 3.22Å; T581-K585 WeakPolarHBondContact O-CG 3.3Å; T581-K585 PolarHBondContact O-N 2.86Å
582	R	88.6	Confident	86.7	Confident	178 Å²	178	105.2 Å²	105.2	67%	0.672	50%	0.504	S	S	*	.	H	α-helix	trans	-65.7	-43.2	173.2	-73.4	171.9	-165	-175	5.5	111.6	D578 Q579 L580 K585 L586	D578-R582 VanDerWaalsContact O-CG 3.26Å; D578-R582 WeakPolarHBondContact O-CG 3.37Å; D578-R582 PolarHBondContact O-N 2.95Å; Q579-R582 WeakPolarHBondContact O-CB 3.4Å; Q579-R582 PolarHBondContact O-N 3.38Å; Q579-R582 VanDerWaalsContact O-N 3.11Å; L580-R582 VanDerWaalsContact C-N 3.32Å; L580-R582 PolarHBondContact O-N 3.38Å; R582-K585 PolarHBondContact O-N 2.8Å; R582-L586 WeakPolarHBondContact O-CB 3.26Å; R582-L586 PolarHBondContact O-N 3.24Å
583	E	88.2	Confident	86.8	Confident	113 Å²	113	106.6 Å²	106.6	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-63.9	-45.1	176.4	-72.8	-173.5	168.5	0	0	112	Q579 L580 K585 L586 Q587	Q579-E583 PolarHBondContact O-N 2.95Å; L580-E583 PolarHBondContact O-N 2.9Å; E583-K585 VanDerWaalsContact C-N 3.35Å; E583-K585 PolarHBondContact O-N 3.24Å; E583-L586 WeakPolarHBondContact O-CB 3.49Å; E583-L586 PolarHBondContact O-N 2.93Å; E583-Q587 WeakPolarHBondContact O-CG 2.97Å; E583-Q587 PolarHBondContact O-N 2.73Å
584	I	88.6	Confident	87.1	Confident	92 Å²	92	108.5 Å²	108.5	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-60.9	-44.7	175.3	-69.9	167.8	0	0	0	110.4	L580 L586 Q587 L588	L580-I584 WeakPolarHBondContact O-CB 3.44Å; L580-I584 VanDerWaalsContact O-CG1 3.29Å; L580-I584 WeakPolarHBondContact O-CG1 3.41Å; L580-I584 PolarHBondContact O-N 3.37Å; I584-L586 VanDerWaalsContact C-N 3.32Å; I584-L586 PolarHBondContact O-N 2.91Å; I584-Q587 PolarHBondContact O-N 2.99Å; I584-L588 HydrophobicContact CG2-CD1 3.85Å; I584-L588 HydrophobicContact CG2-CG 4.29Å; I584-L588 WeakPolarHBondContact O-CB 3.33Å; I584-L588 WeakPolarHBondContact O-CG 3.45Å; I584-L588 PolarHBondContact O-N 2.8Å
585	K	89.5	Confident	86.8	Confident	139 Å²	139	107.3 Å²	107.3	60%	0.604	52%	0.516	S	S	*	.	H	α-helix	trans	-61	-40.6	175.7	-78.1	174.6	179.2	178.4	0	112.1	T581 R582 E583 L588 L589	T581-K585 HydrophobicContact CG2-CD 4.27Å; T581-K585 WeakPolarHBondContact O-CB 3.49Å; T581-K585 VanDerWaalsContact O-CG 3.22Å; T581-K585 WeakPolarHBondContact O-CG 3.3Å; T581-K585 PolarHBondContact O-N 2.86Å; R582-K585 PolarHBondContact O-N 2.8Å; E583-K585 VanDerWaalsContact C-N 3.35Å; E583-K585 PolarHBondContact O-N 3.24Å; K585-L588 PolarHBondContact O-N 2.81Å; K585-L589 VanDerWaalsContact O-CB 3.29Å; K585-L589 WeakPolarHBondContact O-CB 3.39Å; K585-L589 PolarHBondContact O-N 3.21Å
586	L	90.1	Very high	86.6	Confident	107 Å²	107	105.1 Å²	105.1	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-46.2	175.1	179.6	66.8	0	0	0	111	R582 E583 I584 L589 I590	R582-L586 WeakPolarHBondContact O-CB 3.26Å; R582-L586 PolarHBondContact O-N 3.24Å; E583-L586 WeakPolarHBondContact O-CB 3.49Å; E583-L586 PolarHBondContact O-N 2.93Å; I584-L586 VanDerWaalsContact C-N 3.32Å; I584-L586 PolarHBondContact O-N 2.91Å; L586-L589 PolarHBondContact O-N 2.9Å; L586-I590 HydrophobicContact CG-CD1 4.22Å; L586-I590 VanDerWaalsContact O-CG1 3.31Å; L586-I590 WeakPolarHBondContact O-CG1 3.42Å; L586-I590 PolarHBondContact O-N 2.93Å
587	Q	87.5	Confident	86.4	Confident	121 Å²	121	107.2 Å²	107.2	57%	0.565	53%	0.527	S	S	*	.	H	α-helix	trans	-63.5	-43.5	177.3	-71.4	178.1	4.4	0	0	112.1	E583 I584 L589 I590 L591	E583-Q587 WeakPolarHBondContact O-CG 2.97Å; E583-Q587 PolarHBondContact O-N 2.73Å; I584-Q587 PolarHBondContact O-N 2.99Å; Q587-L589 VanDerWaalsContact C-N 3.33Å; Q587-L589 PolarHBondContact O-N 2.91Å; Q587-I590 WeakPolarHBondContact O-CB 3.29Å; Q587-I590 PolarHBondContact O-N 2.83Å; Q587-L591 VanDerWaalsContact O-CG 3.29Å; Q587-L591 WeakPolarHBondContact O-CG 3.35Å; Q587-L591 PolarHBondContact O-N 3.02Å
588	L	85.9	Confident	86	Confident	76 Å²	76	108 Å²	108	40%	0.398	53%	0.53	S	S	.	.	H	α-helix	trans	-60.9	-41.5	174.6	-74.4	170.3	0	0	0	111.7	I584 K585 I590 L591 E592	I584-L588 HydrophobicContact CG2-CD1 3.85Å; I584-L588 HydrophobicContact CG2-CG 4.29Å; I584-L588 WeakPolarHBondContact O-CB 3.33Å; I584-L588 WeakPolarHBondContact O-CG 3.45Å; I584-L588 PolarHBondContact O-N 2.8Å; K585-L588 PolarHBondContact O-N 2.81Å; L588-I590 VanDerWaalsContact C-N 3.31Å; L588-I590 PolarHBondContact O-N 3.24Å; L588-L591 HydrophobicContact CD2-CD1 4.41Å; L588-L591 WeakPolarHBondContact O-CB 3.41Å; L588-L591 PolarHBondContact O-N 3.06Å; L588-L591 VanDerWaalsContact O-N 3.16Å; L588-E592 WeakPolarHBondContact O-CB 3.29Å; L588-E592 WeakPolarHBondContact O-CG 3.31Å; L588-E592 PolarHBondContact O-N 3.17Å
589	L	88.1	Confident	85.6	Confident	98 Å²	98	107.7 Å²	107.7	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-66.3	-33.5	176.7	-167.7	142.1	0	0	0	112	K585 L586 Q587 N593	K585-L589 VanDerWaalsContact O-CB 3.29Å; K585-L589 WeakPolarHBondContact O-CB 3.39Å; K585-L589 PolarHBondContact O-N 3.21Å; L586-L589 PolarHBondContact O-N 2.9Å; Q587-L589 VanDerWaalsContact C-N 3.33Å; Q587-L589 PolarHBondContact O-N 2.91Å; L589-N593 WeakPolarHBondContact CD2-ND2 3.43Å; L589-N593 WeakPolarHBondContact O-CB 3.43Å; L589-N593 PolarHBondContact O-N 2.85Å; L589-N593 PolarHBondContact O-ND2 2.97Å
590	I	87.5	Confident	85.2	Confident	85 Å²	85	105.2 Å²	105.2	44%	0.436	51%	0.513	S	S	.	.	H	α-helix	trans	-67.4	-44.8	170.6	-66.6	164.5	0	0	0	110.2	L586 Q587 L588 E592 N593 F594	L586-I590 HydrophobicContact CG-CD1 4.22Å; L586-I590 VanDerWaalsContact O-CG1 3.31Å; L586-I590 WeakPolarHBondContact O-CG1 3.42Å; L586-I590 PolarHBondContact O-N 2.93Å; Q587-I590 WeakPolarHBondContact O-CB 3.29Å; Q587-I590 PolarHBondContact O-N 2.83Å; L588-I590 VanDerWaalsContact C-N 3.31Å; L588-I590 PolarHBondContact O-N 3.24Å; I590-E592 PolarHBondContact O-N 2.86Å; I590-N593 PolarHBondContact O-N 2.8Å; I590-F594 HydrophobicContact CG2-CD2 4.03Å; I590-F594 WeakPolarHBondContact O-CB 3.43Å; I590-F594 WeakPolarHBondContact O-CD2 3.44Å; I590-F594 PolarHBondContact O-N 2.9Å
591	L	83.6	Confident	85	Confident	70 Å²	70	105.6 Å²	105.6	37%	0.366	51%	0.513	S	S	.	.	H	α-helix	trans	-61.5	-42.6	178.5	-69	170.1	0	0	0	111.9	Q587 L588 I595	Q587-L591 VanDerWaalsContact O-CG 3.29Å; Q587-L591 WeakPolarHBondContact O-CG 3.35Å; Q587-L591 PolarHBondContact O-N 3.02Å; L588-L591 HydrophobicContact CD2-CD1 4.41Å; L588-L591 WeakPolarHBondContact O-CB 3.41Å; L588-L591 PolarHBondContact O-N 3.06Å; L588-L591 VanDerWaalsContact O-N 3.16Å; L591-I595 HydrophobicContact CD2-CD1 3.33Å; L591-I595 HydrophobicContact CD2-CG1 4.19Å; L591-I595 WeakPolarHBondContact O-CB 3.41Å; L591-I595 PolarHBondContact O-N 3.2Å; L591-I595 VanDerWaalsContact O-N 3.09Å
592	E	83.2	Confident	84.6	Confident	137 Å²	137	107.9 Å²	107.9	64%	0.64	52%	0.518	S	S	*	.	H	α-helix	trans	-69.9	-32.7	-179.9	-74.2	177.3	176.5	0	0	113.5	L588 I590	L588-E592 WeakPolarHBondContact O-CB 3.29Å; L588-E592 WeakPolarHBondContact O-CG 3.31Å; L588-E592 PolarHBondContact O-N 3.17Å; I590-E592 PolarHBondContact O-N 2.86Å
593	N	84.4	Confident	84.2	Confident	114 Å²	114	102.6 Å²	102.6	61%	0.61	50%	0.503	S	S	*	.	H	α-helix	trans	-87.7	-29.2	-179	-73.8	-54.9	0	0	0	113.9	L589 I590	L589-N593 WeakPolarHBondContact CD2-ND2 3.43Å; L589-N593 WeakPolarHBondContact O-CB 3.43Å; L589-N593 PolarHBondContact O-N 2.85Å; L589-N593 PolarHBondContact O-ND2 2.97Å; I590-N593 PolarHBondContact O-N 2.8Å
594	F	87.1	Confident	83.9	Confident	165 Å²	165	102.7 Å²	102.7	72%	0.724	50%	0.503	S	S	*	.	H	α-helix	trans	-113.8	-15	-170.6	-67.7	-84.6	0	0	0	115.1	I590	I590-F594 HydrophobicContact CG2-CD2 4.03Å; I590-F594 WeakPolarHBondContact O-CB 3.43Å; I590-F594 WeakPolarHBondContact O-CD2 3.44Å; I590-F594 PolarHBondContact O-N 2.9Å
595	I	80.3	Confident	83.6	Confident	62 Å²	62	105.7 Å²	105.7	32%	0.318	51%	0.513	S	S	.	.	S	Bend	trans	-111.7	122.8	-178.8	-54.5	-165.1	0	0	0	110.5	L591 I597 E599	L591-I595 HydrophobicContact CD2-CD1 3.33Å; L591-I595 HydrophobicContact CD2-CG1 4.19Å; L591-I595 WeakPolarHBondContact O-CB 3.41Å; L591-I595 PolarHBondContact O-N 3.2Å; L591-I595 VanDerWaalsContact O-N 3.09Å; I595-I597 PolarHBondContact O-N 3.17Å; I595-E599 HydrophobicContact CG2-CB 4Å
596	P	84.5	Confident	83.2	Confident	86 Å²	86	102.3 Å²	102.3	56%	0.558	50%	0.496	S	S	*	.			trans	-54.5	137.4	172.5	-25.2	34.1	0	0	0	111.8	E598 E599 K600	P596-E598 PolarHBondContact O-N 3.47Å; P596-E598 VanDerWaalsContact O-N 3.08Å; P596-E599 PolarHBondContact O-N 3.04Å; P596-K600 PolarHBondContact O-N 3Å; P596-K600 VanDerWaalsContact O-N 3.17Å
597	I	80.3	Confident	83.1	Confident	130 Å²	130	100.1 Å²	100.1	67%	0.667	49%	0.485	S	S	*	.	H	α-helix	trans	-53.7	-35.6	-176.9	-60.4	167.4	0	0	0	111.3	I595 E599 K600 E601	I595-I597 PolarHBondContact O-N 3.17Å; I597-E599 PolarHBondContact O-N 2.98Å; I597-K600 WeakPolarHBondContact O-CB 3.26Å; I597-K600 PolarHBondContact O-N 3.13Å; I597-E601 PolarHBondContact O-N 3.27Å
598	E	78.5	Confident	83	Confident	139 Å²	139	98.3 Å²	98.3	65%	0.65	47%	0.473	S	S	*	.	H	α-helix	trans	-62.9	-39.6	177.5	-60.8	178.6	-173	0	0	113.4	P596 K602	P596-E598 PolarHBondContact O-N 3.47Å; P596-E598 VanDerWaalsContact O-N 3.08Å; E598-K602 VanDerWaalsContact O-CG 3.28Å; E598-K602 WeakPolarHBondContact O-CG 3.3Å; E598-K602 PolarHBondContact O-N 3.43Å; E598-K602 VanDerWaalsContact O-N 3.14Å
599	E	79.3	Confident	82.9	Confident	86 Å²	86	99.2 Å²	99.2	40%	0.402	47%	0.474	S	S	.	.	H	α-helix	trans	-74.2	-35.2	177.9	-70.9	-58.3	130.9	0	0	111.1	I595 P596 I597 K602 L603	I595-E599 HydrophobicContact CG2-CB 4Å; P596-E599 PolarHBondContact O-N 3.04Å; I597-E599 PolarHBondContact O-N 2.98Å; E599-K602 PolarHBondContact O-N 3.14Å; E599-K602 IonicContact OE1-NZ 3.62Å; E599-K602 PolarHBondContact OE1-NZ 2.86Å; E599-L603 WeakPolarHBondContact O-CB 3.42Å; E599-L603 PolarHBondContact O-N 3.4Å
600	K	79.3	Confident	82.6	Confident	69 Å²	69	96 Å²	96	30%	0.3	46%	0.457	S	S	.	.	H	α-helix	trans	-59.7	-48.8	172.3	-177.7	-177.8	172.6	-178	0	111.2	P596 I597 K602 L603 E604	P596-K600 PolarHBondContact O-N 3Å; P596-K600 VanDerWaalsContact O-N 3.17Å; I597-K600 WeakPolarHBondContact O-CB 3.26Å; I597-K600 PolarHBondContact O-N 3.13Å; K600-K602 VanDerWaalsContact C-N 3.33Å; K600-K602 PolarHBondContact O-N 3.47Å; K600-L603 PolarHBondContact O-N 3.21Å; K600-E604 WeakPolarHBondContact CE-OE1 3.49Å; K600-E604 WeakPolarHBondContact O-CG 3.37Å; K600-E604 PolarHBondContact O-N 3.17Å
601	E	81.9	Confident	82.4	Confident	99 Å²	99	99.9 Å²	99.9	46%	0.463	47%	0.474	S	S	.	.	H	α-helix	trans	-63.6	-36.6	177.8	-74.3	-170.6	-177.2	0	0	112.9	I597 K605	I597-E601 PolarHBondContact O-N 3.27Å; E601-K605 WeakPolarHBondContact O-CG 3.4Å; E601-K605 PolarHBondContact O-N 3.3Å; E601-K605 VanDerWaalsContact O-N 3.15Å
602	K	80.9	Confident	82	Confident	99 Å²	99	105.4 Å²	105.4	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-40.3	174.3	-73.8	172.8	-163.3	167.6	0	111.6	E598 E599 K600 R606	E598-K602 VanDerWaalsContact O-CG 3.28Å; E598-K602 WeakPolarHBondContact O-CG 3.3Å; E598-K602 PolarHBondContact O-N 3.43Å; E598-K602 VanDerWaalsContact O-N 3.14Å; E599-K602 PolarHBondContact O-N 3.14Å; E599-K602 IonicContact OE1-NZ 3.62Å; E599-K602 PolarHBondContact OE1-NZ 2.86Å; K600-K602 VanDerWaalsContact C-N 3.33Å; K600-K602 PolarHBondContact O-N 3.47Å; K602-R606 WeakPolarHBondContact O-CD 3.29Å; K602-R606 VanDerWaalsContact O-CG 3.26Å; K602-R606 WeakPolarHBondContact O-CG 3.46Å; K602-R606 PolarHBondContact O-N 3.03Å
603	L	80.4	Confident	81.8	Confident	67 Å²	67	102 Å²	102	35%	0.351	49%	0.486	S	S	.	.	H	α-helix	trans	-67.7	-48	176.3	-103.9	136.3	0	0	0	111.5	E599 K600 K605 R606 I607 L618	E599-L603 WeakPolarHBondContact O-CB 3.42Å; E599-L603 PolarHBondContact O-N 3.4Å; K600-L603 PolarHBondContact O-N 3.21Å; L603-K605 VanDerWaalsContact C-N 3.27Å; L603-K605 PolarHBondContact O-N 3.03Å; L603-R606 WeakPolarHBondContact O-CA 3.48Å; L603-R606 PolarHBondContact O-N 3.35Å; L603-I607 HydrophobicContact CB-CD1 4.3Å; L603-I607 HydrophobicContact CD2-CD1 3.93Å; L603-I607 HydrophobicContact CD2-CG1 4.4Å; L603-I607 WeakPolarHBondContact O-CD1 3.33Å; L603-I607 VanDerWaalsContact O-CG1 3.23Å; L603-I607 WeakPolarHBondContact O-CG1 3.49Å; L603-I607 PolarHBondContact O-N 3.07Å; L603-L618 HydrophobicContact CD2-CD1 4.2Å; L603-L618 HydrophobicContact CD2-CD2 4.03Å
604	E	81	Confident	81.5	Confident	116 Å²	116	104 Å²	104	54%	0.542	49%	0.492	S	S	.	.	H	α-helix	trans	-57.8	-38.1	179	-76.9	180	177.4	0	0	112.3	K600 R606	K600-E604 WeakPolarHBondContact CE-OE1 3.49Å; K600-E604 WeakPolarHBondContact O-CG 3.37Å; K600-E604 PolarHBondContact O-N 3.17Å; E604-R606 VanDerWaalsContact C-N 3.25Å; E604-R606 PolarHBondContact O-N 3.36Å
605	K	82.8	Confident	81.1	Confident	154 Å²	154	104.9 Å²	104.9	67%	0.67	49%	0.49	S	S	*	.	H	α-helix	trans	-68.7	-21.7	175.5	-72.3	171	-174.1	164.5	0	113.8	E601 L603	E601-K605 WeakPolarHBondContact O-CG 3.4Å; E601-K605 PolarHBondContact O-N 3.3Å; E601-K605 VanDerWaalsContact O-N 3.15Å; L603-K605 VanDerWaalsContact C-N 3.27Å; L603-K605 PolarHBondContact O-N 3.03Å
606	R	81.9	Confident	81.1	Confident	69 Å²	69	110.5 Å²	110.5	26%	0.26	51%	0.508	S	S	.	.	H	α-helix	trans	-96.2	-26.4	-177.4	-70.9	175.9	67.4	-158.4	-2.6	112.8	K602 L603 E604 L618 K619 F621	K602-R606 WeakPolarHBondContact O-CD 3.29Å; K602-R606 VanDerWaalsContact O-CG 3.26Å; K602-R606 WeakPolarHBondContact O-CG 3.46Å; K602-R606 PolarHBondContact O-N 3.03Å; L603-R606 WeakPolarHBondContact O-CA 3.48Å; L603-R606 PolarHBondContact O-N 3.35Å; E604-R606 VanDerWaalsContact C-N 3.25Å; E604-R606 PolarHBondContact O-N 3.36Å; R606-L618 HydrophobicContact CB-CD2 4.08Å; R606-L618 HydrophobicContact CB-CG 4.36Å; R606-K619 PolarHBondContact NE-O 3.28Å; R606-K619 VanDerWaalsContact NE-O 3.15Å; R606-K619 PolarHBondContact NH2-O 2.83Å; R606-K619 WeakPolarHBondContact O-CG 3.4Å; R606-K619 PolarHBondContact O-N 2.95Å; R606-F621 VanDerWaalsContact CZ-CD2 3.44Å
607	I	86.7	Confident	81	Confident	61 Å²	61	109.5 Å²	109.5	31%	0.313	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	127.6	-178.8	-67.5	161.6	0	0	0	108.7	L603 W616 Q617 L618	L603-I607 HydrophobicContact CB-CD1 4.3Å; L603-I607 HydrophobicContact CD2-CD1 3.93Å; L603-I607 HydrophobicContact CD2-CG1 4.4Å; L603-I607 WeakPolarHBondContact O-CD1 3.33Å; L603-I607 VanDerWaalsContact O-CG1 3.23Å; L603-I607 WeakPolarHBondContact O-CG1 3.49Å; L603-I607 PolarHBondContact O-N 3.07Å; I607-W616 HydrophobicContact CG2-CB 4.37Å; I607-W616 HydrophobicContact CG2-CD2 4Å; I607-W616 HydrophobicContact CG2-CE3 3.16Å; I607-W616 HydrophobicContact CG2-CZ3 3.66Å; I607-Q617 WeakPolarHBondContact CA-O 3.44Å; I607-L618 HydrophobicContact CG1-CD1 3.98Å; I607-L618 HydrophobicContact CG1-CG 4.06Å
608	Y	86.3	Confident	81	Confident	82 Å²	82	107.2 Å²	107.2	32%	0.322	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	150	166	68.1	-79	0	0	0	109.1	D610 Q617 K619	Y608-D610 HydrophobicContact CE2-CB 4.15Å; Y608-Q617 HydrophobicContact CD1-CB 4.43Å; Y608-Q617 WeakPolarHBondContact CD1-O 3.21Å; Y608-Q617 HydrophobicContact CE1-CB 3.85Å; Y608-Q617 HydrophobicContact CE2-CB 4.14Å; Y608-Q617 PolarHBondContact N-O 3.45Å; Y608-Q617 PolarHBondContact O-N 3.26Å; Y608-Q617 PolarHBondContact OH-OE1 3.42Å; Y608-K619 HydrophobicContact CD1-CD 4.36Å; Y608-K619 HydrophobicContact CD1-CG 3.54Å; Y608-K619 HydrophobicContact CE1-CG 3.68Å
609	F	84.1	Confident	81	Confident	95 Å²	95	105.4 Å²	105.4	42%	0.417	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119.4	173.9	-171.2	-105.6	0	0	0	108.1	E611 E614 W616	F609-E611 HydrophobicContact CD1-CG 4.15Å; F609-E611 HydrophobicContact CE1-CG 4.44Å; F609-E611 PolarHBondContact O-N 3.12Å; F609-E614 HydrophobicContact CZ-CB 4.31Å; F609-W616 HydrophobicContact CB-CD2 4.29Å; F609-W616 HydrophobicContact CB-CE3 3.86Å; F609-W616 HydrophobicContact CB-CH2 4.17Å; F609-W616 HydrophobicContact CB-CZ2 4.5Å; F609-W616 HydrophobicContact CB-CZ3 3.83Å; F609-W616 AromaticContact CD2-CD2 3.84Å; F609-W616 HydrophobicContact CD2-CD2 3.84Å; F609-W616 AromaticContact CD2-CE2 3.78Å; F609-W616 HydrophobicContact CD2-CE3 4.29Å; F609-W616 HydrophobicContact CD2-CG 4.12Å; F609-W616 HydrophobicContact CD2-CZ2 4.25Å; F609-W616 AromaticContact CD2-NE1 3.89Å
610	D	81.8	Confident	80.7	Confident	31 Å²	31	106 Å²	106	17%	0.166	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	106	172.6	178	11.3	0	0	0	108.6	Y608 E612 T613 E614 R615 Q617	Y608-D610 HydrophobicContact CE2-CB 4.15Å; D610-E612 PolarHBondContact O-N 3.27Å; D610-E612 PolarHBondContact OD1-N 3.2Å; D610-E612 VanDerWaalsContact OD1-N 3.14Å; D610-T613 WeakPolarHBondContact CB-OG1 3.35Å; D610-T613 PolarHBondContact O-N 2.98Å; D610-T613 WeakPolarHBondContact OD2-CB 3.5Å; D610-T613 VanDerWaalsContact OD2-CG2 3.25Å; D610-T613 WeakPolarHBondContact OD2-CG2 3.43Å; D610-T613 PolarHBondContact OD2-OG1 3.21Å; D610-E614 WeakPolarHBondContact O-CA 3.37Å; D610-E614 PolarHBondContact O-N 3.31Å; D610-R615 PolarHBondContact N-O 3.12Å; D610-R615 VanDerWaalsContact N-O 3.08Å; D610-Q617 HydrophobicContact CB-CG 4.17Å; D610-Q617 PolarHBondContact OD2-NE2 2.71Å
611	E	83.4	Confident	79.8	Confident	167 Å²	167	110.6 Å²	110.6	78%	0.78	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.7	-179.4	-69.9	-173.2	169.9	0	0	112.7	F609	F609-E611 HydrophobicContact CD1-CG 4.15Å; F609-E611 HydrophobicContact CE1-CG 4.44Å; F609-E611 PolarHBondContact O-N 3.12Å
612	E	75	Confident	78.7	Confident	186 Å²	186	113 Å²	113	87%	0.869	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-32.1	-180	-68.4	-170.1	167.2	0	0	112.6	D610	D610-E612 PolarHBondContact O-N 3.27Å; D610-E612 PolarHBondContact OD1-N 3.2Å; D610-E612 VanDerWaalsContact OD1-N 3.14Å
613	T	78.8	Confident	77.2	Confident	66 Å²	66	116.7 Å²	116.7	41%	0.405	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-5.7	-179.3	62.2	0	0	0	0	114.1	D610 R615 Q617	D610-T613 WeakPolarHBondContact CB-OG1 3.35Å; D610-T613 PolarHBondContact O-N 2.98Å; D610-T613 WeakPolarHBondContact OD2-CB 3.5Å; D610-T613 VanDerWaalsContact OD2-CG2 3.25Å; D610-T613 WeakPolarHBondContact OD2-CG2 3.43Å; D610-T613 PolarHBondContact OD2-OG1 3.21Å; T613-R615 WeakPolarHBondContact O-CG 2.91Å; T613-R615 PolarHBondContact O-N 2.76Å; T613-Q617 PolarHBondContact OG1-NE2 3.41Å; T613-Q617 VanDerWaalsContact OG1-NE2 3.16Å
614	E	77.2	Confident	75.5	Confident	155 Å²	155	118.5 Å²	118.5	72%	0.724	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	51	33.1	-173.2	-61.8	-173.6	161.4	0	0	113	F609 D610	F609-E614 HydrophobicContact CZ-CB 4.31Å; D610-E614 WeakPolarHBondContact O-CA 3.37Å; D610-E614 PolarHBondContact O-N 3.31Å
615	R	78.4	Confident	73.7	Confident	184 Å²	184	118.1 Å²	118.1	69%	0.694	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.2	141	-177.8	-71.9	174.6	-175.2	-161.2	0.3	110.5	D610 T613 Q617	D610-R615 PolarHBondContact N-O 3.12Å; D610-R615 VanDerWaalsContact N-O 3.08Å; T613-R615 WeakPolarHBondContact O-CG 2.91Å; T613-R615 PolarHBondContact O-N 2.76Å; R615-Q617 PolarHBondContact O-N 3.18Å
616	W	81.6	Confident	71.7	Confident	179 Å²	179	115.4 Å²	115.4	68%	0.678	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.2	123.3	167.4	-68.7	98.7	0	0	0	109.5	I607 F609	I607-W616 HydrophobicContact CG2-CB 4.37Å; I607-W616 HydrophobicContact CG2-CD2 4Å; I607-W616 HydrophobicContact CG2-CE3 3.16Å; I607-W616 HydrophobicContact CG2-CZ3 3.66Å; F609-W616 HydrophobicContact CB-CD2 4.29Å; F609-W616 HydrophobicContact CB-CE3 3.86Å; F609-W616 HydrophobicContact CB-CH2 4.17Å; F609-W616 HydrophobicContact CB-CZ2 4.5Å; F609-W616 HydrophobicContact CB-CZ3 3.83Å; F609-W616 AromaticContact CD2-CD2 3.84Å; F609-W616 HydrophobicContact CD2-CD2 3.84Å; F609-W616 AromaticContact CD2-CE2 3.78Å; F609-W616 HydrophobicContact CD2-CE3 4.29Å; F609-W616 HydrophobicContact CD2-CG 4.12Å; F609-W616 HydrophobicContact CD2-CZ2 4.25Å; F609-W616 AromaticContact CD2-NE1 3.89Å
617	Q	81.9	Confident	69.9	Low	65 Å²	65	119.1 Å²	119.1	30%	0.304	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.4	146.9	176.8	-65.9	-177.7	9.4	0	0	109.9	I607 Y608 D610 T613 R615	I607-Q617 WeakPolarHBondContact CA-O 3.44Å; Y608-Q617 HydrophobicContact CD1-CB 4.43Å; Y608-Q617 WeakPolarHBondContact CD1-O 3.21Å; Y608-Q617 HydrophobicContact CE1-CB 3.85Å; Y608-Q617 HydrophobicContact CE2-CB 4.14Å; Y608-Q617 PolarHBondContact N-O 3.45Å; Y608-Q617 PolarHBondContact O-N 3.26Å; Y608-Q617 PolarHBondContact OH-OE1 3.42Å; D610-Q617 HydrophobicContact CB-CG 4.17Å; D610-Q617 PolarHBondContact OD2-NE2 2.71Å; T613-Q617 PolarHBondContact OG1-NE2 3.41Å; T613-Q617 VanDerWaalsContact OG1-NE2 3.16Å; R615-Q617 PolarHBondContact O-N 3.18Å
618	L	80.6	Confident	67.9	Low	83 Å²	83	124.2 Å²	124.2	44%	0.435	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94	129.1	171.5	-100	100.5	0	0	0	110.1	L603 R606 I607	L603-L618 HydrophobicContact CD2-CD1 4.2Å; L603-L618 HydrophobicContact CD2-CD2 4.03Å; R606-L618 HydrophobicContact CB-CD2 4.08Å; R606-L618 HydrophobicContact CB-CG 4.36Å; I607-L618 HydrophobicContact CG1-CD1 3.98Å; I607-L618 HydrophobicContact CG1-CG 4.06Å
619	K	78.2	Confident	65.9	Low	101 Å²	101	127 Å²	127	44%	0.439	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-56.6	129.9	167.8	-70.9	178	-176.3	170.1	0	109.6	R606 Y608	R606-K619 PolarHBondContact NE-O 3.28Å; R606-K619 VanDerWaalsContact NE-O 3.15Å; R606-K619 PolarHBondContact NH2-O 2.83Å; R606-K619 WeakPolarHBondContact O-CG 3.4Å; R606-K619 PolarHBondContact O-N 2.95Å; Y608-K619 HydrophobicContact CD1-CD 4.36Å; Y608-K619 HydrophobicContact CD1-CG 3.54Å; Y608-K619 HydrophobicContact CE1-CG 3.68Å
620	P	72.4	Confident	63.7	Low	99 Å²	99	129.7 Å²	129.7	64%	0.643	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-54.5	146.6	170.9	-22.3	31.6	0	0	0	110.7	L622	P620-L622 PolarHBondContact O-N 3.5Å
621	F	61.8	Low	61.9	Low	165 Å²	165	136.1 Å²	136.1	72%	0.724	69%	0.692	S	S	*	*	S	Bend	trans	-63.3	-20.5	-179.5	-121.1	-81	0	0	0	113.3	R606	R606-F621 VanDerWaalsContact CZ-CD2 3.44Å
622	L	57.3	Low	60	Low	148 Å²	148	134.9 Å²	134.9	78%	0.775	69%	0.691	S	S	*	*			trans	-113.9	110.2	176	-78.3	96.7	0	0	0	109.9	P620 S624	P620-L622 PolarHBondContact O-N 3.5Å; L622-S624 PolarHBondContact O-N 2.95Å
623	Q	50.6	Low	58.7	Low	177 Å²	177	130.2 Å²	130.2	83%	0.827	67%	0.671	S	S	*	*			trans	-70	103	154.3	-84.9	177.7	-26.1	0	0	107.1	S625	Q623-S625 PolarHBondContact O-N 3.44Å
624	S	44	Very low	57.6	Low	106 Å²	106	132.8 Å²	132.8	74%	0.741	69%	0.689	S	S	*	*			trans	-72.5	77.8	165.2	51.6	0	0	0	0	108.6	L622 S626	L622-S624 PolarHBondContact O-N 2.95Å; S624-S626 PolarHBondContact O-N 2.7Å
625	S	42.7	Very low	56.6	Low	107 Å²	107	134.2 Å²	134.2	75%	0.748	69%	0.693	S	S	*	*			trans	-71.3	86.5	161.8	54.5	0	0	0	0	107.6	Q623 D627	Q623-S625 PolarHBondContact O-N 3.44Å; S625-D627 PolarHBondContact O-N 3.32Å
626	S	41.4	Very low	55.5	Low	98 Å²	98	127.7 Å²	127.7	69%	0.685	67%	0.672	S	S	*	*			trans	-67.9	103.7	158	-34.8	0	0	0	0	105.1	S624	S624-S626 PolarHBondContact O-N 2.7Å
627	D	44.7	Very low	54.6	Low	147 Å²	147	129.3 Å²	129.3	79%	0.786	68%	0.684	S	S	*	*	S	Bend	trans	178.4	-12.1	137.6	-86.4	-13.5	0	0	0	115.8	S625	S625-D627 PolarHBondContact O-N 3.32Å
628	D	43.6	Very low	53.9	Low	167 Å²	167	133.5 Å²	133.5	89%	0.893	70%	0.697	S	S	*	*			trans	-122	130.1	178.4	-80.4	-44.3	0	0	0	115.9
629	I	45.3	Very low	53.3	Low	141 Å²	141	134.6 Å²	134.6	72%	0.723	71%	0.712	S	S	*	*			trans	-79.8	144	-169.5	-68.3	157.6	0	0	0	110.1
630	N	36.9	Very low	52.9	Low	151 Å²	151	131.1 Å²	131.1	81%	0.807	70%	0.699	S	S	*	*			trans	69.5	71.5	165.1	-70.4	-20.7	0	0	0	119.4
631	I	44.6	Very low	53.1	Low	166 Å²	166	130.1 Å²	130.1	85%	0.851	69%	0.693	S	S	*	*			trans	-142.7	133.2	155.1	-50.6	177.1	0	0	0	110.4	I633	I631-I633 PolarHBondContact O-N 2.88Å
632	N	43.1	Very low	53.8	Low	142 Å²	142	131.7 Å²	131.7	76%	0.759	69%	0.694	S	S	*	*			trans	-38.9	123.9	-177.7	-76.2	-32.9	0	0	0	114.6	P634	N632-P634 WeakPolarHBondContact O-CD 3.06Å
633	I	48	Very low	54.9	Low	87 Å²	87	132.4 Å²	132.4	45%	0.446	69%	0.688	S	S	.	*			trans	-69.1	119	164.7	-58.9	168.2	0	0	0	106.9	I631 F635 N636	I631-I633 PolarHBondContact O-N 2.88Å; I633-F635 PolarHBondContact O-N 2.86Å; I633-N636 PolarHBondContact O-N 2.69Å
634	P	54.8	Low	56.3	Low	121 Å²	121	124.6 Å²	124.6	79%	0.786	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-5.6	-172	-21.4	32.5	0	0	0	115.8	N632	N632-P634 WeakPolarHBondContact O-CD 3.06Å
635	F	56.5	Low	57.8	Low	185 Å²	185	125.6 Å²	125.6	81%	0.811	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	-5.4	-174.7	-75.5	-81.4	0	0	0	115.3	I633	I633-F635 PolarHBondContact O-N 2.86Å
636	N	56.7	Low	59.6	Low	46 Å²	46	125.9 Å²	125.9	25%	0.246	63%	0.632	C	S	.	*			trans	-100.5	114.4	176	-82.6	-24.4	0	0	0	110.4	I633 R638 N658	I633-N636 PolarHBondContact O-N 2.69Å; N636-R638 PolarHBondContact O-N 3.43Å; N636-R638 VanDerWaalsContact O-N 3.12Å; N636-N658 WeakPolarHBondContact OD1-CB 3.44Å; N636-N658 PolarHBondContact OD1-ND2 3.42Å
637	K	62	Low	61.5	Low	214 Å²	214	122.5 Å²	122.5	93%	0.93	61%	0.607	S	S	*	*	S	Bend	trans	-61.2	-18	177.7	-74	180	178.4	174.3	0	113.8
638	R	67.8	Low	63	Low	152 Å²	152	117 Å²	117	57%	0.574	58%	0.582	S	S	*	*	S	Bend	trans	-125.4	136	177.5	-171.4	179.4	-175.2	177.6	3.7	110.1	N636 V640	N636-R638 PolarHBondContact O-N 3.43Å; N636-R638 VanDerWaalsContact O-N 3.12Å; R638-V640 VanDerWaalsContact O-CG2 3.3Å; R638-V640 WeakPolarHBondContact O-CG2 3.31Å; R638-V640 PolarHBondContact O-N 3.13Å
639	S	67.1	Low	64.6	Low	107 Å²	107	115.5 Å²	115.5	75%	0.748	57%	0.574	S	S	*	*			trans	-65.6	114.7	167.7	54	0	0	0	0	109.9
640	V	68.8	Low	66.2	Low	27 Å²	27	118.5 Å²	118.5	16%	0.164	58%	0.578	C	S	.	*			trans	-111.2	127.3	-178.4	-164.7	0	0	0	0	109.6	R638 A644	R638-V640 VanDerWaalsContact O-CG2 3.3Å; R638-V640 WeakPolarHBondContact O-CG2 3.31Å; R638-V640 PolarHBondContact O-N 3.13Å; V640-A644 HydrophobicContact CG1-CB 3.35Å
641	C	77.6	Confident	68	Low	78 Å²	78	114.3 Å²	114.3	53%	0.527	56%	0.555	S	S	.	*			trans	-67.7	159.4	175.8	78.6	0	0	0	0	111.1	Y643 A644 R645	C641-Y643 PolarHBondContact O-N 3.35Å; C641-A644 PolarHBondContact O-N 3.07Å; C641-A644 VanDerWaalsContact O-N 3.15Å; C641-A644 PolarHBondContact SG-N 2.69Å; C641-A644 VanDerWaalsContact SG-N 3.4Å; C641-R645 PolarHBondContact O-N 3.42Å; C641-R645 VanDerWaalsContact O-N 3.08Å
642	R	76.4	Confident	69.3	Low	198 Å²	198	110.9 Å²	110.9	75%	0.747	54%	0.544	S	S	*	.	H	α-helix	trans	-54.5	-40.1	-180	-176.2	177.6	176.6	162.7	0.2	112.8	R645 M646	R642-R645 WeakPolarHBondContact O-CB 3.49Å; R642-R645 PolarHBondContact O-N 2.96Å; R642-M646 PolarHBondContact O-N 3.37Å
643	Y	80	Confident	70.8	Confident	164 Å²	164	107.4 Å²	107.4	64%	0.643	53%	0.525	S	S	*	.	H	α-helix	trans	-60.9	-49.1	177.4	177.6	-100.7	0	0	0	111.9	C641 R645 M646 V647 F656	C641-Y643 PolarHBondContact O-N 3.35Å; Y643-R645 PolarHBondContact O-N 3.28Å; Y643-M646 PolarHBondContact O-N 2.89Å; Y643-V647 HydrophobicContact CD1-CG2 4.24Å; Y643-V647 HydrophobicContact CD2-CG2 4.34Å; Y643-V647 HydrophobicContact CE1-CG2 3.86Å; Y643-V647 HydrophobicContact CE2-CG2 3.97Å; Y643-V647 HydrophobicContact CG-CG2 4.47Å; Y643-V647 WeakPolarHBondContact O-CG2 3.5Å; Y643-V647 PolarHBondContact O-N 3.21Å; Y643-F656 HydrophobicContact CE1-CE1 4.42Å
644	A	79.5	Confident	72.1	Confident	13 Å²	13	107.1 Å²	107.1	11%	0.107	53%	0.529	C	S	.	.	H	α-helix	trans	-64.5	-29.7	178.2	0	0	0	0	0	112.5	V640 C641 A648 F656	V640-A644 HydrophobicContact CG1-CB 3.35Å; C641-A644 PolarHBondContact O-N 3.07Å; C641-A644 VanDerWaalsContact O-N 3.15Å; C641-A644 PolarHBondContact SG-N 2.69Å; C641-A644 VanDerWaalsContact SG-N 3.4Å; A644-A648 WeakPolarHBondContact O-CB 3.29Å; A644-A648 PolarHBondContact O-N 3.21Å; A644-F656 HydrophobicContact CB-CD1 3.84Å
645	R	76.1	Confident	73.1	Confident	127 Å²	127	110.3 Å²	110.3	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-67.4	-43.5	173.3	-134	-175.8	-61.9	162.8	-0.6	112.5	C641 R642 Y643	C641-R645 PolarHBondContact O-N 3.42Å; C641-R645 VanDerWaalsContact O-N 3.08Å; R642-R645 WeakPolarHBondContact O-CB 3.49Å; R642-R645 PolarHBondContact O-N 2.96Å; Y643-R645 PolarHBondContact O-N 3.28Å
646	M	80.4	Confident	74.1	Confident	113 Å²	113	102.6 Å²	102.6	56%	0.557	49%	0.492	S	S	*	.	H	α-helix	trans	-66.4	-37.6	175.2	-75.3	-179.1	62.6	0	0	112.3	R642 Y643 Y650	R642-M646 PolarHBondContact O-N 3.37Å; Y643-M646 PolarHBondContact O-N 2.89Å; M646-Y650 WeakPolarHBondContact O-CD2 3.44Å
647	V	81.2	Confident	74.7	Confident	26 Å²	26	104.6 Å²	104.6	16%	0.158	50%	0.496	C	S	.	.	H	α-helix	trans	-73.5	-30.7	-179.1	178.3	0	0	0	0	111.5	Y643 D649 Y650 D651 F656	Y643-V647 HydrophobicContact CD1-CG2 4.24Å; Y643-V647 HydrophobicContact CD2-CG2 4.34Å; Y643-V647 HydrophobicContact CE1-CG2 3.86Å; Y643-V647 HydrophobicContact CE2-CG2 3.97Å; Y643-V647 HydrophobicContact CG-CG2 4.47Å; Y643-V647 WeakPolarHBondContact O-CG2 3.5Å; Y643-V647 PolarHBondContact O-N 3.21Å; V647-D649 PolarHBondContact O-N 3.13Å; V647-Y650 PolarHBondContact O-N 2.91Å; V647-D651 HydrophobicContact CG1-CB 3.67Å; V647-D651 PolarHBondContact O-N 2.9Å; V647-F656 HydrophobicContact CB-CD1 4.09Å; V647-F656 HydrophobicContact CB-CD2 4.28Å; V647-F656 HydrophobicContact CB-CE1 4.26Å; V647-F656 HydrophobicContact CB-CE2 4.45Å; V647-F656 HydrophobicContact CB-CG 4.1Å; V647-F656 HydrophobicContact CB-CZ 4.43Å; V647-F656 HydrophobicContact CG1-CD1 4.03Å; V647-F656 HydrophobicContact CG1-CD2 3.44Å; V647-F656 VanDerWaalsContact CG1-CD2 3.44Å; V647-F656 HydrophobicContact CG1-CE1 4Å; V647-F656 HydrophobicContact CG1-CE2 3.4Å; V647-F656 VanDerWaalsContact CG1-CE2 3.4Å; V647-F656 HydrophobicContact CG1-CG 3.76Å; V647-F656 HydrophobicContact CG1-CZ 3.69Å
648	A	77.1	Confident	75.1	Confident	33 Å²	33	97.1 Å²	97.1	27%	0.273	47%	0.466	S	S	.	.	H	α-helix	trans	-61.3	-23.9	177.8	0	0	0	0	0	114.1	A644 Y650 F656	A644-A648 WeakPolarHBondContact O-CB 3.29Å; A644-A648 PolarHBondContact O-N 3.21Å; A648-Y650 VanDerWaalsContact C-N 3.3Å; A648-F656 HydrophobicContact CB-CB 4.12Å
649	D	76.5	Confident	75.1	Confident	135 Å²	135	95.6 Å²	95.6	72%	0.722	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.8	176.4	-70.2	-21.4	0	0	0	113	V647	V647-D649 PolarHBondContact O-N 3.13Å
650	Y	79.6	Confident	75	Confident	204 Å²	204	100.3 Å²	100.3	80%	0.8	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	-30.4	-173.5	-60	-79.3	0	0	0	114.2	M646 V647 A648	M646-Y650 WeakPolarHBondContact O-CD2 3.44Å; V647-Y650 PolarHBondContact O-N 2.91Å; A648-Y650 VanDerWaalsContact C-N 3.3Å
651	D	74.9	Confident	74.8	Confident	62 Å²	62	103.9 Å²	103.9	33%	0.332	49%	0.493	S	S	.	.			trans	-109.2	115.1	-179.2	-171.1	-4.6	0	0	0	109.8	V647 N653 F656	V647-D651 HydrophobicContact CG1-CB 3.67Å; V647-D651 PolarHBondContact O-N 2.9Å; D651-N653 VanDerWaalsContact CG-CB 3.45Å; D651-N653 PolarHBondContact O-N 2.97Å; D651-N653 WeakPolarHBondContact OD1-CB 3.29Å; D651-N653 PolarHBondContact OD1-N 2.86Å; D651-N653 WeakPolarHBondContact OD2-CB 3.27Å; D651-F656 HydrophobicContact CB-CD2 4.29Å; D651-F656 HydrophobicContact CB-CE2 4.44Å; D651-F656 WeakPolarHBondContact OD2-CE2 3.47Å
652	P	71.9	Confident	74.3	Confident	95 Å²	95	107 Å²	107	62%	0.617	50%	0.503	S	S	*	.			trans	-68.1	-1.5	176.8	28.8	-34.1	0	0	0	113.1
653	N	74.3	Confident	73.7	Confident	68 Å²	68	101.1 Å²	101.1	36%	0.364	49%	0.493	S	S	.	.			trans	-53.9	121.8	-178.9	-169.5	-20.2	0	0	0	112	D651 R655 F656	D651-N653 VanDerWaalsContact CG-CB 3.45Å; D651-N653 PolarHBondContact O-N 2.97Å; D651-N653 WeakPolarHBondContact OD1-CB 3.29Å; D651-N653 PolarHBondContact OD1-N 2.86Å; D651-N653 WeakPolarHBondContact OD2-CB 3.27Å; N653-R655 PolarHBondContact O-N 3.31Å; N653-R655 PolarHBondContact OD1-N 2.94Å; N653-F656 HydrophobicContact CB-CD2 3.99Å; N653-F656 HydrophobicContact CB-CE2 4.13Å; N653-F656 PolarHBondContact O-N 3.06Å
654	P	74	Confident	72.9	Confident	81 Å²	81	100.2 Å²	100.2	53%	0.526	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15	-175.8	20.4	-31.8	0	0	0	114	F656 R657	P654-F656 PolarHBondContact O-N 3.23Å; P654-R657 PolarHBondContact O-N 3.24Å
655	R	76.2	Confident	72.3	Confident	188 Å²	188	107.3 Å²	107.3	71%	0.709	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.9	171.7	174.3	175.4	-173	161.7	3.5	113.6	N653	N653-R655 PolarHBondContact O-N 3.31Å; N653-R655 PolarHBondContact OD1-N 2.94Å
656	F	78	Confident	71.5	Confident	24 Å²	24	108.7 Å²	108.7	11%	0.105	55%	0.548	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-10.6	-173.4	-55.1	-66.4	0	0	0	113.2	Y643 A644 V647 A648 D651 N653 P654	Y643-F656 HydrophobicContact CE1-CE1 4.42Å; A644-F656 HydrophobicContact CB-CD1 3.84Å; V647-F656 HydrophobicContact CB-CD1 4.09Å; V647-F656 HydrophobicContact CB-CD2 4.28Å; V647-F656 HydrophobicContact CB-CE1 4.26Å; V647-F656 HydrophobicContact CB-CE2 4.45Å; V647-F656 HydrophobicContact CB-CG 4.1Å; V647-F656 HydrophobicContact CB-CZ 4.43Å; V647-F656 HydrophobicContact CG1-CD1 4.03Å; V647-F656 HydrophobicContact CG1-CD2 3.44Å; V647-F656 VanDerWaalsContact CG1-CD2 3.44Å; V647-F656 HydrophobicContact CG1-CE1 4Å; V647-F656 HydrophobicContact CG1-CE2 3.4Å; V647-F656 VanDerWaalsContact CG1-CE2 3.4Å; V647-F656 HydrophobicContact CG1-CG 3.76Å; V647-F656 HydrophobicContact CG1-CZ 3.69Å; A648-F656 HydrophobicContact CB-CB 4.12Å; D651-F656 HydrophobicContact CB-CD2 4.29Å; D651-F656 HydrophobicContact CB-CE2 4.44Å; D651-F656 WeakPolarHBondContact OD2-CE2 3.47Å; N653-F656 HydrophobicContact CB-CD2 3.99Å; N653-F656 HydrophobicContact CB-CE2 4.13Å; N653-F656 PolarHBondContact O-N 3.06Å; P654-F656 PolarHBondContact O-N 3.23Å
657	R	69.4	Low	70.9	Confident	87 Å²	87	111.5 Å²	111.5	33%	0.328	57%	0.565	S	S	.	*			trans	-72	145	179.4	-67.6	-163.1	178.7	-159.4	0.5	112.2	P654 E659 S663	P654-R657 PolarHBondContact O-N 3.24Å; R657-E659 VanDerWaalsContact C-N 3.27Å; R657-S663 PolarHBondContact NH1-OG 3.48Å
658	N	69.4	Low	70	Confident	58 Å²	58	117.3 Å²	117.3	31%	0.31	60%	0.595	S	S	.	*	S	Bend	trans	-77.5	-20.1	-179.3	-12.3	-5.4	0	0	0	111.2	N636	N636-N658 WeakPolarHBondContact OD1-CB 3.44Å; N636-N658 PolarHBondContact OD1-ND2 3.42Å
659	E	68.5	Low	69.7	Low	119 Å²	119	121.6 Å²	121.6	56%	0.556	62%	0.62	S	S	*	*	S	Bend	trans	-116.6	139	-174.6	-57.9	-173.9	169.6	0	0	110.6	R657 I661	R657-E659 VanDerWaalsContact C-N 3.27Å; E659-I661 HydrophobicContact CB-CB 4.47Å; E659-I661 HydrophobicContact CB-CD1 4.43Å; E659-I661 HydrophobicContact CB-CG1 4.22Å; E659-I661 PolarHBondContact O-N 3.07Å
660	Q	65.7	Low	69.5	Low	207 Å²	207	118.3 Å²	118.3	97%	0.967	62%	0.618	S	S	*	*	S	Bend	trans	-79.5	53	171.1	-68.1	178.8	-5.8	0	0	110.5
661	I	64.8	Low	69.2	Low	102 Å²	102	117 Å²	117	52%	0.523	61%	0.611	S	S	.	*			trans	-123.8	117.2	178.9	-56.4	-180	0	0	0	107.9	E659 S663	E659-I661 HydrophobicContact CB-CB 4.47Å; E659-I661 HydrophobicContact CB-CD1 4.43Å; E659-I661 HydrophobicContact CB-CG1 4.22Å; E659-I661 PolarHBondContact O-N 3.07Å; I661-S663 PolarHBondContact O-N 3.44Å
662	L	66.4	Low	69.1	Low	142 Å²	142	120.7 Å²	120.7	74%	0.743	64%	0.637	S	S	*	*			trans	-73.7	105.5	166	-94.3	136.8	0	0	0	107.8	L664	L662-L664 PolarHBondContact O-N 3.36Å
663	S	64.4	Low	69.3	Low	75 Å²	75	120.8 Å²	120.8	52%	0.524	64%	0.636	S	S	.	*			trans	-74.5	107.2	165.9	-62.2	0	0	0	0	108.3	R657 I661	R657-S663 PolarHBondContact NH1-OG 3.48Å; I661-S663 PolarHBondContact O-N 3.44Å
664	L	63.6	Low	69.4	Low	145 Å²	145	128.9 Å²	128.9	76%	0.759	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-95.2	121.3	164.9	-69.4	162.8	0	0	0	106.7	L662 M666	L662-L664 PolarHBondContact O-N 3.36Å; L664-M666 PolarHBondContact O-N 3.04Å
665	D	65.1	Low	69.6	Low	163 Å²	163	131 Å²	131	87%	0.872	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-63.8	117.4	172.3	-72.5	-28.2	0	0	0	108.4
666	M	59.1	Low	69.5	Low	156 Å²	156	131.4 Å²	131.4	77%	0.768	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-85.9	119.5	170.4	-70	-165.2	-13.5	0	0	109.4	L664 L668	L664-M666 PolarHBondContact O-N 3.04Å; M666-L668 PolarHBondContact O-N 3.39Å; M666-L668 VanDerWaalsContact O-N 3.14Å
667	D	68.6	Low	69.2	Low	171 Å²	171	138.2 Å²	138.2	91%	0.914	70%	0.703	S	S	*	*			trans	-64	106.4	169.4	-85.5	-27.9	0	0	0	110.6
668	L	62.1	Low	69.1	Low	148 Å²	148	138.7 Å²	138.7	78%	0.775	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-86.5	134.3	169	-82	134.1	0	0	0	110.2	M666	M666-L668 PolarHBondContact O-N 3.39Å; M666-L668 VanDerWaalsContact O-N 3.14Å
669	P	70.4	Confident	69	Low	124 Å²	124	141.3 Å²	141.3	81%	0.805	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-66.5	148.1	-178.9	26.1	-33	0	0	0	112.7
670	G	72.8	Confident	69	Low	66 Å²	66	144.9 Å²	144.9	68%	0.68	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-65	157	-174.8	0	0	0	0	0	116
671	R	73.8	Confident	69.1	Low	175 Å²	175	141 Å²	141	66%	0.66	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-53.4	130.3	-178.3	-179.4	-179.8	171.5	-166.5	-4.6	112.7	T673 D675	R671-T673 PolarHBondContact NE-O 2.82Å; R671-T673 PolarHBondContact NE-OG1 3.22Å; R671-T673 VanDerWaalsContact NE-OG1 3.13Å; R671-D675 IonicContact NH2-OD1 3.64Å; R671-D675 PolarHBondContact NH2-OD1 3.02Å; R671-D675 IonicContact NH2-OD2 2.85Å
672	T	72.8	Confident	69.4	Low	141 Å²	141	138.8 Å²	138.8	87%	0.865	74%	0.736	S	S	*	*			trans	-104.4	13	-178.1	49.2	0	0	0	0	114.9
673	T	77	Confident	69.7	Low	96 Å²	96	137.3 Å²	137.3	59%	0.589	74%	0.735	S	S	*	*			trans	-118	139.4	-178	57.4	0	0	0	0	112.9	R671	R671-T673 PolarHBondContact NE-O 2.82Å; R671-T673 PolarHBondContact NE-OG1 3.22Å; R671-T673 VanDerWaalsContact NE-OG1 3.13Å
674	R	75.4	Confident	70.1	Confident	238 Å²	238	141.7 Å²	141.7	90%	0.898	75%	0.747	S	S	*	*			trans	-113.1	141.9	176.8	-168.7	177.9	177.3	172.6	-1.1	109.9
675	D	78.1	Confident	70.4	Confident	127 Å²	127	138.2 Å²	138.2	68%	0.679	73%	0.732	S	S	*	*			trans	-75.9	150.6	-178.4	-55.4	-34.7	0	0	0	111.7	R671	R671-D675 IonicContact NH2-OD1 3.64Å; R671-D675 PolarHBondContact NH2-OD1 3.02Å; R671-D675 IonicContact NH2-OD2 2.85Å
676	Y	73.4	Confident	70.7	Confident	195 Å²	195	133.7 Å²	133.7	77%	0.765	71%	0.71	S	S	*	*			trans	-84.1	132.4	-171.9	174	-95.9	0	0	0	113.3	P678	Y676-P678 HydrophobicContact CE1-CB 4.21Å
677	E	73.2	Confident	71.6	Confident	168 Å²	168	128.9 Å²	128.9	79%	0.785	70%	0.695	S	S	*	*			trans	-115.8	127.4	170.9	-75	-179.5	165.1	0	0	110.7
678	P	67.2	Low	71.8	Confident	96 Å²	96	123.8 Å²	123.8	62%	0.623	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-73.5	150.2	179.1	28.8	-33.2	0	0	0	112.8	Y676	Y676-P678 HydrophobicContact CE1-CB 4.21Å
679	P	66.4	Low	72.3	Confident	113 Å²	113	121.6 Å²	121.6	73%	0.734	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-69.9	133.5	-177	26.9	-33	0	0	0	112.7	L681	P679-L681 PolarHBondContact O-N 3.47Å
680	Q	69	Low	72.5	Confident	194 Å²	194	121.8 Å²	121.8	91%	0.907	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-67.8	124.4	173	-65.8	176.6	-2.5	0	0	110
681	L	68.2	Low	72.4	Confident	127 Å²	127	122 Å²	122	67%	0.665	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-65.3	143	173.1	-83.3	105.8	0	0	0	110.9	P679 V685	P679-L681 PolarHBondContact O-N 3.47Å; L681-V685 HydrophobicContact CD2-CB 4.44Å; L681-V685 HydrophobicContact CD2-CG1 3.99Å
682	A	71.6	Confident	72.2	Confident	54 Å²	54	117.9 Å²	117.9	45%	0.446	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-63	142.1	-179.7	0	0	0	0	0	111.8	Q684 V685	A682-Q684 PolarHBondContact O-N 2.97Å; A682-V685 PolarHBondContact O-N 3.05Å
683	P	71.7	Confident	72.1	Confident	111 Å²	111	117.5 Å²	117.5	72%	0.721	65%	0.646	S	S	*	*	H	α-helix	trans	-54.7	-31	-176.4	-25.8	32.3	0	0	0	114.6	V685 V686 A687	P683-V685 VanDerWaalsContact C-N 3.32Å; P683-V685 PolarHBondContact O-N 3.44Å; P683-V686 PolarHBondContact O-N 2.95Å; P683-A687 WeakPolarHBondContact O-CB 3.44Å; P683-A687 PolarHBondContact O-N 3.38Å
684	Q	71.8	Confident	71.7	Confident	168 Å²	168	120.8 Å²	120.8	79%	0.785	65%	0.654	S	S	*	*	H	α-helix	trans	-65.2	-33.6	178.5	-73.3	178.2	-8.7	0	0	113.1	A682 A688	A682-Q684 PolarHBondContact O-N 2.97Å; Q684-A688 WeakPolarHBondContact O-CB 3.49Å; Q684-A688 PolarHBondContact O-N 3.5Å
685	V	70.6	Confident	70.4	Confident	71 Å²	71	117.3 Å²	117.3	43%	0.43	65%	0.654	S	S	.	*	H	α-helix	trans	-75.9	-35.9	179.6	-175.6	0	0	0	0	110.3	L681 A682 P683 L689	L681-V685 HydrophobicContact CD2-CB 4.44Å; L681-V685 HydrophobicContact CD2-CG1 3.99Å; A682-V685 PolarHBondContact O-N 3.05Å; P683-V685 VanDerWaalsContact C-N 3.32Å; P683-V685 PolarHBondContact O-N 3.44Å; V685-L689 HydrophobicContact CG1-CD1 4.26Å; V685-L689 WeakPolarHBondContact O-CB 3.44Å; V685-L689 PolarHBondContact O-N 3.26Å; V685-L689 VanDerWaalsContact O-N 3.09Å
686	V	72.8	Confident	69	Low	68 Å²	68	120 Å²	120	41%	0.412	66%	0.662	S	S	.	*	H	α-helix	trans	-65.6	-45.3	173.8	-178.8	0	0	0	0	110.5	P683 A688 L689 E690	P683-V686 PolarHBondContact O-N 2.95Å; V686-A688 PolarHBondContact O-N 3.28Å; V686-L689 PolarHBondContact O-N 3.46Å; V686-E690 PolarHBondContact O-N 2.94Å
687	A	76	Confident	67.9	Low	56 Å²	56	119.1 Å²	119.1	46%	0.463	67%	0.665	S	S	.	*	H	α-helix	trans	-65.2	-36.8	177.9	0	0	0	0	0	113.2	P683 E690 A691	P683-A687 WeakPolarHBondContact O-CB 3.44Å; P683-A687 PolarHBondContact O-N 3.38Å; A687-E690 PolarHBondContact O-N 3.04Å; A687-A691 WeakPolarHBondContact O-CB 3.38Å; A687-A691 PolarHBondContact O-N 3.15Å
688	A	74	Confident	66.5	Low	63 Å²	63	119.3 Å²	119.3	52%	0.521	67%	0.671	S	S	.	*	H	α-helix	trans	-68.9	-35.8	175.8	0	0	0	0	0	112.5	Q684 V686 A692	Q684-A688 WeakPolarHBondContact O-CB 3.49Å; Q684-A688 PolarHBondContact O-N 3.5Å; V686-A688 PolarHBondContact O-N 3.28Å; A688-A692 WeakPolarHBondContact O-CB 3.42Å; A688-A692 PolarHBondContact O-N 2.97Å; A688-A692 VanDerWaalsContact O-N 3.15Å
689	L	71.6	Confident	65.5	Low	102 Å²	102	122 Å²	122	53%	0.534	68%	0.68	S	S	.	*	H	α-helix	trans	-68.9	-41.8	173.8	-87.1	157.9	0	0	0	111.7	V685 V686 A692 L693	V685-L689 HydrophobicContact CG1-CD1 4.26Å; V685-L689 WeakPolarHBondContact O-CB 3.44Å; V685-L689 PolarHBondContact O-N 3.26Å; V685-L689 VanDerWaalsContact O-N 3.09Å; V686-L689 PolarHBondContact O-N 3.46Å; L689-A692 PolarHBondContact O-N 3.5Å; L689-L693 WeakPolarHBondContact O-CD1 3.34Å; L689-L693 PolarHBondContact O-N 3.09Å
690	E	75.1	Confident	64.2	Low	129 Å²	129	125.9 Å²	125.9	60%	0.603	69%	0.688	S	S	*	*	H	α-helix	trans	-66	-37.8	176.1	-76.7	179.8	162.7	0	0	112.6	V686 A687 A692 L693	V686-E690 PolarHBondContact O-N 2.94Å; A687-E690 PolarHBondContact O-N 3.04Å; E690-A692 VanDerWaalsContact C-N 3.33Å; E690-A692 PolarHBondContact O-N 3.36Å; E690-L693 PolarHBondContact O-N 3.33Å
691	A	71.7	Confident	63	Low	71 Å²	71	124 Å²	124	59%	0.587	68%	0.684	S	S	*	*	H	α-helix	trans	-69.2	-29.1	175.5	0	0	0	0	0	113.1	A687 L693	A687-A691 WeakPolarHBondContact O-CB 3.38Å; A687-A691 PolarHBondContact O-N 3.15Å; A691-L693 VanDerWaalsContact C-N 3.26Å; A691-L693 PolarHBondContact O-N 3.48Å
692	A	67.9	Low	61.7	Low	87 Å²	87	126.1 Å²	126.1	72%	0.719	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-6	175.1	0	0	0	0	0	113.7	A688 L689 E690	A688-A692 WeakPolarHBondContact O-CB 3.42Å; A688-A692 PolarHBondContact O-N 2.97Å; A688-A692 VanDerWaalsContact O-N 3.15Å; L689-A692 PolarHBondContact O-N 3.5Å; E690-A692 VanDerWaalsContact C-N 3.33Å; E690-A692 PolarHBondContact O-N 3.36Å
693	L	71.1	Confident	60	Low	133 Å²	133	126.5 Å²	126.5	70%	0.696	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	7.3	-176.3	-95.8	153.8	0	0	0	113.4	L689 E690 A691	L689-L693 WeakPolarHBondContact O-CD1 3.34Å; L689-L693 PolarHBondContact O-N 3.09Å; E690-L693 PolarHBondContact O-N 3.33Å; A691-L693 VanDerWaalsContact C-N 3.26Å; A691-L693 PolarHBondContact O-N 3.48Å
694	Q	68.2	Low	58.7	Low	165 Å²	165	126.1 Å²	126.1	77%	0.771	71%	0.705	S	S	*	*	S	Bend	trans	-100.3	116.5	173.7	-73.5	-176.1	-13.7	0	0	110.9	E696	Q694-E696 PolarHBondContact O-N 3.23Å
695	D	48.4	Very low	57	Low	165 Å²	165	124.7 Å²	124.7	88%	0.882	71%	0.71	S	S	*	*			trans	-73.9	92.5	-177.9	-68.9	-44.2	0	0	0	112.3
696	E	49	Very low	55.3	Low	184 Å²	184	125.7 Å²	125.7	86%	0.86	72%	0.72	S	S	*	*			trans	-145.4	124.1	157.8	-73.2	-164.5	166.1	0	0	112.3	Q694	Q694-E696 PolarHBondContact O-N 3.23Å
697	E	49.7	Very low	53.8	Low	177 Å²	177	130 Å²	130	83%	0.827	74%	0.74	S	S	*	*	S	Bend	trans	40.9	108.6	152.6	-57	-173.9	171.5	0	0	120.7	L699	E697-L699 PolarHBondContact O-N 3.28Å
698	D	43.8	Very low	52.1	Low	171 Å²	171	137 Å²	137	91%	0.914	76%	0.76	S	S	*	*			trans	24	86.4	150.6	-64.7	-22.9	0	0	0	117.9
699	L	47.2	Very low	50.3	Low	152 Å²	152	143.2 Å²	143.2	80%	0.796	78%	0.778	S	S	*	*			trans	-114.1	97.9	163.5	-89.3	156.9	0	0	0	110.6	E697 L701	E697-L699 PolarHBondContact O-N 3.28Å; L699-L701 PolarHBondContact O-N 3.33Å
700	E	38.7	Very low	48.8	Very low	195 Å²	195	143.9 Å²	143.9	91%	0.911	79%	0.792	S	S	*	*			trans	-70.3	109.7	164.5	-66.8	-174.2	163.7	0	0	109.4
701	L	44.6	Very low	46.9	Very low	156 Å²	156	143 Å²	143	82%	0.817	80%	0.799	S	S	*	*			trans	-127.8	104.3	170.9	-89.2	163.7	0	0	0	110.8	L699	L699-L701 PolarHBondContact O-N 3.33Å
702	D	39.9	Very low	45.3	Very low	171 Å²	171	148.1 Å²	148.1	91%	0.914	82%	0.816	S	S	*	*			trans	-77.4	141.7	177.6	-141	-2.2	0	0	0	111
703	G	36.2	Very low	44	Very low	61 Å²	61	150.5 Å²	150.5	63%	0.629	82%	0.822	S	S	*	*			trans	105.7	97.5	152.1	0	0	0	0	0	120.2
704	S	43.8	Very low	42.5	Very low	104 Å²	104	152.3 Å²	152.3	73%	0.727	82%	0.824	S	S	*	*			trans	90.5	123.8	133.9	73.9	0	0	0	0	120.9	S706	S704-S706 PolarHBondContact O-N 3.42Å
705	P	35.9	Very low	41.1	Very low	137 Å²	137	153.1 Å²	153.1	89%	0.89	83%	0.833	S	S	*	*			trans	-92.8	98.4	175.2	35.3	-27.1	0	0	0	109.9
706	S	36.3	Very low	40.5	Very low	92 Å²	92	153.4 Å²	153.4	64%	0.643	83%	0.826	S	S	*	*			trans	-156.9	96.9	169	52.7	0	0	0	0	110.4	S704	S704-S706 PolarHBondContact O-N 3.42Å
707	L	41.1	Very low	40	Very low	158 Å²	158	153.6 Å²	153.6	83%	0.827	82%	0.824	S	S	*	*			trans	167.2	90.8	162.3	-88.2	148.9	0	0	0	103.4
708	F	39.6	Very low	39.5	Very low	204 Å²	204	149.3 Å²	149.3	90%	0.895	81%	0.814	S	S	*	*				-160.5	112.2	85.3	-87.2	-86.1	0	0	0	110
709	Q	35.9	Very low	39.3	Very low	193 Å²	193	147.8 Å²	147.8	90%	0.902	80%	0.802	S	S	*	*			trans	-100.8	130.2	162.4	-88	-179.4	-15.7	0	0	109.2
710	S	40.2	Very low	38.9	Very low	117 Å²	117	147.4 Å²	147.4	82%	0.818	79%	0.793	S	S	*	*			trans	161.6	137.2	140.7	51	0	0	0	0	108
711	S	36.3	Very low	38.8	Very low	109 Å²	109	147.9 Å²	147.9	76%	0.762	79%	0.787	S	S	*	*			cis	-166.5	119	-14.5	53.3	0	0	0	0	104.4
712	L	38.4	Very low	38.6	Very low	180 Å²	180	146.1 Å²	146.1	94%	0.942	78%	0.777	S	S	*	*			trans	-113.6	114.6	169.7	-88.6	163.5	0	0	0	109.2	K714	L712-K714 PolarHBondContact O-N 3.47Å
713	T	40	Very low	38.7	Very low	137 Å²	137	146.1 Å²	146.1	84%	0.84	77%	0.771	S	S	*	*			trans	-74	106.5	172.9	27	0	0	0	0	110.7
714	K	38.2	Very low	38.8	Very low	170 Å²	170	148.1 Å²	148.1	74%	0.739	78%	0.776	S	S	*	*			trans	25.3	129.8	138	-68.6	173.7	179.9	168.6	0	118.4	L712	L712-K714 PolarHBondContact O-N 3.47Å
715	L	38.8	Very low	38.5	Very low	182 Å²	182	147.2 Å²	147.2	95%	0.953	78%	0.775	S	S	*	*				-150	120.1	110.5	-102.2	155	0	0	0	111.2
716	K	37.1	Very low	38.6	Very low	172 Å²	172	146.5 Å²	146.5	75%	0.748	77%	0.768	S	S	*	*			trans	-75.4	155.4	177.4	-68.7	168.5	164.5	-176.3	0	110
717	K	39.1	Very low	38.9	Very low	187 Å²	187	149.8 Å²	149.8	81%	0.813	77%	0.773	S	S	*	*				-176.1	126.9	75.5	-95.5	-178.2	157.9	171.6	0	107.4
718	S	39.2	Very low	38.8	Very low	88 Å²	88	150.5 Å²	150.5	62%	0.615	77%	0.769	S	S	*	*				62.9	132.8	72.9	84.8	0	0	0	0	112.4
719	E	38.4	Very low	38.8	Very low	139 Å²	139	147.2 Å²	147.2	65%	0.65	76%	0.761	S	S	*	*			cis	175	158.7	10.7	-119.5	-175.8	159.7	0	0	107.1
720	K	39.2	Very low	39.1	Very low	144 Å²	144	145.6 Å²	145.6	63%	0.626	76%	0.759	S	S	*	*			trans	68.4	142.4	141.5	-74	170.2	-176.3	152.4	0	118.2
721	R	35.6	Very low	39.3	Very low	204 Å²	204	146.4 Å²	146.4	77%	0.77	76%	0.759	S	S	*	*			cis	179.6	159.9	-5	-128.8	178.2	179.9	-173.7	0.4	105.7
722	I	40.9	Very low	39.7	Very low	119 Å²	119	150.1 Å²	150.1	61%	0.61	76%	0.764	S	S	*	*			trans	95.1	121.8	139.7	-74.9	164.1	0	0	0	120.7
723	H	42.5	Very low	40.3	Very low	171 Å²	171	149.2 Å²	149.2	79%	0.792	76%	0.759	S	S	*	*			trans	52.9	146.3	149.4	-61.8	-33	0	0	0	119.5
724	S	37.3	Very low	40.4	Very low	104 Å²	104	151.5 Å²	151.5	73%	0.727	76%	0.757	S	S	*	*			cis	-177	151.2	-1.9	42.6	0	0	0	0	107.6
725	A	37.4	Very low	41.5	Very low	85 Å²	85	149.2 Å²	149.2	70%	0.702	76%	0.76	S	S	*	*			trans	75.6	127	149	0	0	0	0	0	122.7
726	T	38.2	Very low	41.9	Very low	121 Å²	121	149.8 Å²	149.8	74%	0.742	76%	0.758	S	S	*	*			trans	85.1	103.2	138.8	39.3	0	0	0	0	122.4
727	Q	42.9	Very low	42.5	Very low	162 Å²	162	147.3 Å²	147.3	76%	0.757	76%	0.762	S	S	*	*				96	128.3	118.1	-84.6	-176.5	13.5	0	0	121.7
728	K	40.1	Very low	43.2	Very low	172 Å²	172	148.3 Å²	148.3	75%	0.748	77%	0.766	S	S	*	*			trans	77.4	140.6	156.8	-62.3	177.6	-178.5	-175.4	0	116.9
729	D	40	Very low	43.9	Very low	136 Å²	136	147.6 Å²	147.6	73%	0.727	77%	0.772	S	S	*	*			cis	-167	177.4	-7.1	-106.8	-31.3	0	0	0	105.7
730	D	42.3	Very low	44.4	Very low	159 Å²	159	149.3 Å²	149.3	85%	0.85	79%	0.785	S	S	*	*			trans	101.1	70.9	170.7	-60.7	-12.7	0	0	0	117.3
731	T	43.6	Very low	45.1	Very low	134 Å²	134	148.7 Å²	148.7	82%	0.822	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-80.8	122.4	158	36.8	0	0	0	0	111.4
732	Q	45.6	Very low	45.8	Very low	187 Å²	187	144.7 Å²	144.7	87%	0.874	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-69.6	129.9	164.6	-70.7	176.7	-6.8	0	0	110.2
733	I	49.3	Very low	46.1	Very low	161 Å²	161	152.6 Å²	152.6	83%	0.826	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-86	118.7	-173.6	-64.6	162.4	0	0	0	109.6
734	F	43.6	Very low	46.3	Very low	184 Å²	184	151.7 Å²	151.7	81%	0.807	83%	0.825	S	S	*	*			trans	-114.9	134.4	155.9	-84.5	-84.9	0	0	0	108.9
735	P	60.5	Low	46.8	Very low	123 Å²	123	154.2 Å²	154.2	80%	0.799	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-79.6	127.9	-176.8	29.4	-31.3	0	0	0	112.5
736	Q	46.9	Very low	47.3	Very low	194 Å²	194	158 Å²	158	91%	0.907	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-76	136.8	169.6	-79.7	-177.7	-22.6	0	0	111.9
737	S	50.7	Low	47.8	Very low	119 Å²	119	160.2 Å²	160.2	83%	0.832	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-69.5	124.6	174.2	50.1	0	0	0	0	112.2
738	K	52.5	Low	48.1	Very low	209 Å²	209	160.1 Å²	160.1	91%	0.909	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-68.9	136	172.8	-74.2	-178.8	175.4	178.3	0	111.1
739	G	53.6	Low	48.7	Very low	72 Å²	72	159.3 Å²	159.3	74%	0.742	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-71.5	168.4	-172.9	0	0	0	0	0	116.6
740	L	49.1	Very low	49.3	Very low	176 Å²	176	160.9 Å²	160.9	92%	0.921	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-57.6	138.5	173.2	-77	119.1	0	0	0	112.5
741	V	53.7	Low	49.8	Very low	131 Å²	131	161.1 Å²	161.1	79%	0.794	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-88.8	126.7	160.6	-179.7	0	0	0	0	107.7
742	P	51.4	Low	50.4	Low	120 Å²	120	163.3 Å²	163.3	78%	0.779	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-85.9	125.8	168.1	29.3	-22.9	0	0	0	110.2
743	K	47.3	Very low	50.8	Low	284 Å²	284	161.2 Å²	161.2	100%	1.235	87%	0.868	S	S	*	*			trans	-144	0	151.8	-97	-166.7	178.7	-178.5	0	109.2

Retrieved 743 of 743 residues in 976 ms (Link to these results)

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