A0A087YD15_POEFO Loading...

TBC1 domain family member 23

AlphaFold DB , UniProt , Accession A0A087YD15, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 695 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.7	Very low	33.8	Very low	206 Å²	206	98.5 Å²	98.5	100%	1.015	57%	0.568	S	S	*	*				0	-31.3	0	-80.3	-168.8	-174.3	0	0	111.7	T4 V5	M1-T4 WeakPolarHBondContact CA-OG1 3.35Å; M1-T4 PolarHBondContact O-OG1 3.3Å; M1-T4 VanDerWaalsContact O-OG1 3.12Å; M1-V5 WeakPolarHBondContact O-CG2 3.19Å
2	A	27.2	Very low	34.7	Very low	72 Å²	72	102.3 Å²	102.3	60%	0.595	57%	0.566	S	S	*	*			trans	-72.3	-47.7	168.2	0	0	0	0	0	112.3	T4 V5 E6	A2-T4 PolarHBondContact O-N 2.69Å; A2-T4 VanDerWaalsContact O-N 3.16Å; A2-V5 PolarHBondContact O-N 3.21Å; A2-E6 PolarHBondContact O-N 3.4Å
3	D	27.4	Very low	35.3	Very low	118 Å²	118	99.5 Å²	99.5	63%	0.631	55%	0.549	S	S	*	.	H	α-helix	trans	-60.8	-29.5	-178.2	-54.6	-11.6	0	0	0	114.4	E7	D3-E7 PolarHBondContact O-N 3.21Å
4	T	33.1	Very low	35.9	Very low	91 Å²	91	101 Å²	101	56%	0.558	55%	0.551	S	S	*	*	H	α-helix	trans	-78.8	-17.3	179.3	42.2	0	0	0	0	114	M1 A2	M1-T4 WeakPolarHBondContact CA-OG1 3.35Å; M1-T4 PolarHBondContact O-OG1 3.3Å; M1-T4 VanDerWaalsContact O-OG1 3.12Å; A2-T4 PolarHBondContact O-N 2.69Å; A2-T4 VanDerWaalsContact O-N 3.16Å
5	V	34.9	Very low	36.6	Very low	93 Å²	93	100.4 Å²	100.4	56%	0.564	55%	0.547	S	S	*	.	H	α-helix	trans	-89.4	-38.3	176.7	178.6	0	0	0	0	109.9	M1 A2 A8 Q9	M1-V5 WeakPolarHBondContact O-CG2 3.19Å; A2-V5 PolarHBondContact O-N 3.21Å; V5-A8 PolarHBondContact O-N 3.48Å; V5-Q9 WeakPolarHBondContact O-CB 3.37Å; V5-Q9 PolarHBondContact O-N 2.78Å
6	E	33.1	Very low	37.3	Very low	146 Å²	146	97.5 Å²	97.5	68%	0.682	53%	0.53	S	S	*	.	H	α-helix	trans	-65.8	-40.2	173.2	-82.3	-176.3	149.8	0	0	112.8	A2 A8 Q9 G10	A2-E6 PolarHBondContact O-N 3.4Å; E6-A8 VanDerWaalsContact C-N 3.34Å; E6-A8 PolarHBondContact O-N 3.27Å; E6-Q9 PolarHBondContact O-N 3.07Å; E6-G10 PolarHBondContact O-N 2.89Å
7	E	32.9	Very low	37.9	Very low	150 Å²	150	93.4 Å²	93.4	70%	0.701	51%	0.512	S	S	*	.	H	α-helix	trans	-66.9	-34	176	-80.2	-177.3	159.5	0	0	112.7	D3 S11	D3-E7 PolarHBondContact O-N 3.21Å; E7-S11 PolarHBondContact O-N 3.28Å
8	A	34.4	Very low	38.7	Very low	46 Å²	46	94.7 Å²	94.7	38%	0.38	51%	0.514	S	S	.	.	H	α-helix	trans	-69	-49.4	174.1	0	0	0	0	0	110.4	V5 E6 G10 S11 W12	V5-A8 PolarHBondContact O-N 3.48Å; E6-A8 VanDerWaalsContact C-N 3.34Å; E6-A8 PolarHBondContact O-N 3.27Å; A8-G10 VanDerWaalsContact C-N 3.32Å; A8-G10 PolarHBondContact O-N 3.32Å; A8-S11 PolarHBondContact O-N 3.07Å; A8-W12 PolarHBondContact O-N 3.34Å; A8-W12 VanDerWaalsContact O-N 3.1Å
9	Q	35.9	Very low	39.4	Very low	59 Å²	59	92.4 Å²	92.4	28%	0.276	51%	0.509	S	S	.	.	H	α-helix	trans	-53.7	-47	176.8	-162.9	85.5	30.6	0	0	112.1	V5 E6 S11 W12 D13 Q37	V5-Q9 WeakPolarHBondContact O-CB 3.37Å; V5-Q9 PolarHBondContact O-N 2.78Å; E6-Q9 PolarHBondContact O-N 3.07Å; Q9-S11 PolarHBondContact O-N 2.93Å; Q9-W12 PolarHBondContact O-N 3.45Å; Q9-D13 PolarHBondContact O-N 3.04Å; Q9-Q37 VanDerWaalsContact NE2-CD 3.28Å; Q9-Q37 VanDerWaalsContact NE2-NE2 3.1Å
10	G	36.6	Very low	40	Very low	39 Å²	39	89.9 Å²	89.9	40%	0.402	50%	0.495	S	S	.	.	H	α-helix	trans	-67	-33	-179.9	0	0	0	0	0	114.3	E6 A8 Q14	E6-G10 PolarHBondContact O-N 2.89Å; A8-G10 VanDerWaalsContact C-N 3.32Å; A8-G10 PolarHBondContact O-N 3.32Å; G10-Q14 WeakPolarHBondContact O-CB 3.39Å; G10-Q14 PolarHBondContact O-N 3.25Å
11	S	37.2	Very low	40.4	Very low	63 Å²	63	91.7 Å²	91.7	44%	0.441	50%	0.504	S	S	.	.	H	α-helix	trans	-70.2	-39.6	175.1	-170.4	0	0	0	0	111.9	E7 A8 Q9 Q14 D15	E7-S11 PolarHBondContact O-N 3.28Å; A8-S11 PolarHBondContact O-N 3.07Å; Q9-S11 PolarHBondContact O-N 2.93Å; S11-Q14 PolarHBondContact O-N 2.92Å; S11-D15 PolarHBondContact O-N 3.41Å
12	W	45	Very low	40.7	Very low	144 Å²	144	86.1 Å²	86.1	55%	0.545	49%	0.485	S	S	.	.	H	α-helix	trans	-73	-40.7	179.6	-81.5	89.8	0	0	0	112.9	A8 Q9 Q14 D15 L16 I33	A8-W12 PolarHBondContact O-N 3.34Å; A8-W12 VanDerWaalsContact O-N 3.1Å; Q9-W12 PolarHBondContact O-N 3.45Å; W12-Q14 PolarHBondContact O-N 3.33Å; W12-D15 PolarHBondContact O-N 2.67Å; W12-L16 WeakPolarHBondContact O-CB 3.48Å; W12-L16 PolarHBondContact O-N 2.82Å; W12-I33 HydrophobicContact CH2-CD1 3.47Å; W12-I33 VanDerWaalsContact CH2-CD1 3.47Å; W12-I33 HydrophobicContact CZ2-CD1 4.39Å; W12-I33 HydrophobicContact CZ3-CD1 4.11Å
13	D	42.3	Very low	41.4	Very low	66 Å²	66	86.1 Å²	86.1	35%	0.353	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-33.7	173.9	-76	-24.1	0	0	0	111	Q9 A17	Q9-D13 PolarHBondContact O-N 3.04Å; D13-A17 WeakPolarHBondContact O-CB 3.35Å; D13-A17 PolarHBondContact O-N 3.34Å
14	Q	44.1	Very low	41.7	Very low	121 Å²	121	83.5 Å²	83.5	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-74.3	-44.6	176.5	-169.5	137.6	20.8	0	0	112.5	G10 S11 W12 L16 A17 E18	G10-Q14 WeakPolarHBondContact O-CB 3.39Å; G10-Q14 PolarHBondContact O-N 3.25Å; S11-Q14 PolarHBondContact O-N 2.92Å; W12-Q14 PolarHBondContact O-N 3.33Å; Q14-L16 VanDerWaalsContact C-N 3.34Å; Q14-L16 PolarHBondContact O-N 2.93Å; Q14-A17 PolarHBondContact O-N 3.23Å; Q14-E18 WeakPolarHBondContact O-CB 3.49Å; Q14-E18 WeakPolarHBondContact O-CG 3.34Å; Q14-E18 PolarHBondContact O-N 2.98Å
15	D	45.9	Very low	41.7	Very low	92 Å²	92	83.7 Å²	83.7	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-37.6	177.4	-69.5	-24.3	0	0	0	111.9	S11 W12 A19	S11-D15 PolarHBondContact O-N 3.41Å; W12-D15 PolarHBondContact O-N 2.67Å; D15-A19 WeakPolarHBondContact O-CB 3.31Å; D15-A19 PolarHBondContact O-N 3.46Å
16	L	47.6	Very low	42.2	Very low	54 Å²	54	87.9 Å²	87.9	28%	0.283	52%	0.517	S	S	.	.	H	α-helix	trans	-74.9	-37.8	176.3	-160.3	80.7	0	0	0	111.9	W12 Q14 E18 A19 L20 M29	W12-L16 WeakPolarHBondContact O-CB 3.48Å; W12-L16 PolarHBondContact O-N 2.82Å; Q14-L16 VanDerWaalsContact C-N 3.34Å; Q14-L16 PolarHBondContact O-N 2.93Å; L16-E18 VanDerWaalsContact C-N 3.33Å; L16-A19 PolarHBondContact O-N 3.15Å; L16-L20 HydrophobicContact CG-CD1 4.39Å; L16-L20 WeakPolarHBondContact O-CB 3.33Å; L16-L20 VanDerWaalsContact O-CG 3.23Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 3.04Å; L16-M29 HydrophobicContact CD1-CE 3.81Å
17	A	48.8	Very low	42.4	Very low	27 Å²	27	85.3 Å²	85.3	22%	0.223	52%	0.515	C	S	.	.	H	α-helix	trans	-62.9	-39.8	173.4	0	0	0	0	0	111.7	D13 Q14 L20 D21	D13-A17 WeakPolarHBondContact O-CB 3.35Å; D13-A17 PolarHBondContact O-N 3.34Å; Q14-A17 PolarHBondContact O-N 3.23Å; A17-L20 PolarHBondContact O-N 3.15Å; A17-D21 WeakPolarHBondContact O-CB 3.45Å; A17-D21 PolarHBondContact O-N 2.7Å
18	E	51.4	Low	42.3	Very low	117 Å²	117	86.5 Å²	86.5	55%	0.547	52%	0.521	S	S	.	.	H	α-helix	trans	-67.1	-36.2	174.1	-74.3	-176.4	-173.9	0	0	112.2	Q14 L16 S22	Q14-E18 WeakPolarHBondContact O-CB 3.49Å; Q14-E18 WeakPolarHBondContact O-CG 3.34Å; Q14-E18 PolarHBondContact O-N 2.98Å; L16-E18 VanDerWaalsContact C-N 3.33Å; E18-S22 WeakPolarHBondContact O-CB 3.23Å; E18-S22 PolarHBondContact O-N 3.19Å; E18-S22 VanDerWaalsContact O-N 3.07Å; E18-S22 PolarHBondContact O-OG 3.32Å
19	A	51.8	Low	42.4	Very low	51 Å²	51	91.6 Å²	91.6	42%	0.421	54%	0.539	S	S	.	.	H	α-helix	trans	-66.4	-37.1	172.8	0	0	0	0	0	112.5	D15 L16 S22	D15-A19 WeakPolarHBondContact O-CB 3.31Å; D15-A19 PolarHBondContact O-N 3.46Å; L16-A19 PolarHBondContact O-N 3.15Å; A19-S22 PolarHBondContact O-OG 3.28Å
20	L	51.3	Low	42.5	Very low	42 Å²	42	94.9 Å²	94.9	22%	0.22	55%	0.554	C	S	.	*	H	α-helix	trans	-74.8	-34.8	177.7	-70.5	169	0	0	0	112.9	L16 A17 I50	L16-L20 HydrophobicContact CG-CD1 4.39Å; L16-L20 WeakPolarHBondContact O-CB 3.33Å; L16-L20 VanDerWaalsContact O-CG 3.23Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 3.04Å; A17-L20 PolarHBondContact O-N 3.15Å; L20-I50 HydrophobicContact CD2-CD1 3.4Å; L20-I50 VanDerWaalsContact CD2-CD1 3.4Å
21	D	49.6	Very low	42.7	Very low	129 Å²	129	103.1 Å²	103.1	69%	0.69	57%	0.573	S	S	*	*	H	α-helix	trans	-82.8	-19.7	-179.8	-80.7	-5.8	0	0	0	113.2	A17 G23	A17-D21 WeakPolarHBondContact O-CB 3.45Å; A17-D21 PolarHBondContact O-N 2.7Å; D21-G23 PolarHBondContact O-N 2.95Å
22	S	43.6	Very low	42.3	Very low	88 Å²	88	103.3 Å²	103.3	62%	0.615	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-3.2	-176.4	56.4	0	0	0	0	115.6	E18 A19 G24	E18-S22 WeakPolarHBondContact O-CB 3.23Å; E18-S22 PolarHBondContact O-N 3.19Å; E18-S22 VanDerWaalsContact O-N 3.07Å; E18-S22 PolarHBondContact O-OG 3.32Å; A19-S22 PolarHBondContact O-OG 3.28Å; S22-G24 PolarHBondContact O-N 2.66Å
23	G	42.1	Very low	42	Very low	73 Å²	73	102.5 Å²	102.5	75%	0.753	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.9	29.8	172.3	0	0	0	0	0	114.8	D21	D21-G23 PolarHBondContact O-N 2.95Å
24	G	34.4	Very low	41.8	Very low	62 Å²	62	104.5 Å²	104.5	64%	0.639	60%	0.604	S	S	*	*			trans	-71	142.8	-178.5	0	0	0	0	0	113.6	S22	S22-G24 PolarHBondContact O-N 2.66Å
25	S	33.5	Very low	41.5	Very low	96 Å²	96	105.5 Å²	105.5	67%	0.671	61%	0.609	S	S	*	*			trans	-53.5	141.2	-172.5	54.3	0	0	0	0	116.2	S27	S25-S27 PolarHBondContact O-N 2.96Å
26	D	45.1	Very low	41.3	Very low	180 Å²	180	106.6 Å²	106.6	96%	0.963	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.4	18.4	-179.8	-81.3	-28.8	0	0	0	119.5
27	S	36.1	Very low	41.3	Very low	92 Å²	92	107.2 Å²	107.2	64%	0.643	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.5	-11.7	-170.7	-178.1	0	0	0	0	116.7	S25	S25-S27 PolarHBondContact O-N 2.96Å
28	E	31.2	Very low	41.4	Very low	175 Å²	175	114.8 Å²	114.8	82%	0.818	65%	0.646	S	S	*	*	S	Bend	trans	-109.2	2.2	-175.5	-73	-171.7	158.9	0	0	114.5	E30	E28-E30 PolarHBondContact O-N 2.9Å; E28-E30 VanDerWaalsContact O-N 3.1Å
29	M	36.2	Very low	41.9	Very low	153 Å²	153	111.9 Å²	111.9	75%	0.754	63%	0.632	S	S	*	*			trans	-84.4	34.8	172	-152.5	166.8	-176.9	0	0	112	L16	L16-M29 HydrophobicContact CD1-CE 3.81Å
30	E	38	Very low	43.2	Very low	128 Å²	128	112.2 Å²	112.2	60%	0.598	63%	0.632	S	S	*	*			trans	-90.2	127.1	176.8	-94.8	-159	157.9	0	0	111.7	E28	E28-E30 PolarHBondContact O-N 2.9Å; E28-E30 VanDerWaalsContact O-N 3.1Å
31	R	40.9	Very low	44.8	Very low	213 Å²	213	113.4 Å²	113.4	80%	0.804	64%	0.64	S	S	*	*	S	Bend	trans	73.2	51.2	141	-57.5	173.6	-156.7	-118.1	-6	118.3
32	G	30.6	Very low	46.6	Very low	66 Å²	66	114.4 Å²	114.4	68%	0.68	64%	0.641	S	S	*	*			trans	-153.5	122.5	160.9	0	0	0	0	0	112.7
33	I	37.8	Very low	48.7	Very low	128 Å²	128	112 Å²	112	66%	0.656	62%	0.62	S	S	*	*			trans	96.7	85.3	155.2	-48.8	166.4	0	0	0	114.9	W12	W12-I33 HydrophobicContact CH2-CD1 3.47Å; W12-I33 VanDerWaalsContact CH2-CD1 3.47Å; W12-I33 HydrophobicContact CZ2-CD1 4.39Å; W12-I33 HydrophobicContact CZ3-CD1 4.11Å
34	T	37.4	Very low	51.1	Low	107 Å²	107	109.5 Å²	109.5	66%	0.656	59%	0.588	S	S	*	*			trans	-59.7	121.7	151.7	-3.9	0	0	0	0	109.9
35	Q	37.9	Very low	53.9	Low	142 Å²	142	107.1 Å²	107.1	66%	0.664	56%	0.562	S	S	*	*			trans	-152.6	125.6	141.8	-106.7	172	17	0	0	106.6	Q37	Q35-Q37 PolarHBondContact O-N 3.17Å
36	I	43	Very low	56.8	Low	115 Å²	115	106.8 Å²	106.8	59%	0.59	55%	0.548	S	S	*	.			trans	-60.8	92.8	165.7	-63.6	161.4	0	0	0	105.7	E267	I36-E267 HydrophobicContact CD1-CB 4.23Å
37	Q	45.7	Very low	59.1	Low	68 Å²	68	100.4 Å²	100.4	32%	0.318	51%	0.513	S	S	.	.			trans	-116.6	134.9	-179.1	-152.7	159.6	21.5	0	0	107.4	Q9 Q35 H39	Q9-Q37 VanDerWaalsContact NE2-CD 3.28Å; Q9-Q37 VanDerWaalsContact NE2-NE2 3.1Å; Q35-Q37 PolarHBondContact O-N 3.17Å; Q37-H39 VanDerWaalsContact C-N 3.29Å; Q37-H39 PolarHBondContact O-CD2 2.91Å; Q37-H39 PolarHBondContact O-N 2.76Å
38	E	52.2	Low	61.9	Low	185 Å²	185	96.2 Å²	96.2	86%	0.864	48%	0.483	S	S	*	.			trans	-62.2	90.5	179.4	-72.4	-177.7	161.1	0	0	109.7	S40	E38-S40 PolarHBondContact O-N 2.68Å
39	H	61.9	Low	65	Low	56 Å²	56	89.6 Å²	89.6	26%	0.259	45%	0.452	S	S	.	.			trans	-63.6	130.6	173.1	-64.2	-66.5	0	0	0	108.8	Q37 R44	Q37-H39 VanDerWaalsContact C-N 3.29Å; Q37-H39 PolarHBondContact O-CD2 2.91Å; Q37-H39 PolarHBondContact O-N 2.76Å; H39-R44 HydrophobicContact CB-CB 4.4Å; H39-R44 PolarHBondContact O-NH1 3.1Å
40	S	79.3	Confident	67.8	Low	59 Å²	59	86.5 Å²	86.5	41%	0.413	44%	0.437	S	S	.	.			trans	-55.9	153.7	168.4	74.1	0	0	0	0	110.6	E38 E42 H43 R44	E38-S40 PolarHBondContact O-N 2.68Å; S40-E42 PolarHBondContact O-N 2.93Å; S40-H43 PolarHBondContact O-N 2.98Å; S40-H43 VanDerWaalsContact O-N 3.1Å; S40-H43 PolarHBondContact OG-N 3.33Å; S40-H43 PolarHBondContact OG-ND1 3.33Å; S40-R44 PolarHBondContact O-N 3.44Å
41	V	84.8	Confident	70.5	Confident	66 Å²	66	81.7 Å²	81.7	40%	0.4	42%	0.42	S	S	.	.	H	α-helix	trans	-54.5	-41.7	-176.8	180	0	0	0	0	112.1	R44 A45 G131	V41-R44 PolarHBondContact O-N 3.28Å; V41-A45 WeakPolarHBondContact O-CB 3.35Å; V41-A45 PolarHBondContact O-N 3.46Å; V41-G131 VanDerWaalsContact CG1-O 3.29Å; V41-G131 WeakPolarHBondContact CG1-O 3.41Å
42	E	86.8	Confident	73	Confident	151 Å²	151	71.9 Å²	71.9	71%	0.706	38%	0.383	S	S	*	.	H	α-helix	trans	-67.1	-40	-179.8	-63.2	-177.7	-178.9	0	0	112.4	S40 A45 K46	S40-E42 PolarHBondContact O-N 2.93Å; E42-A45 PolarHBondContact O-N 3.2Å; E42-K46 WeakPolarHBondContact O-CG 3.48Å; E42-K46 PolarHBondContact O-N 3.18Å; E42-K46 VanDerWaalsContact O-N 3.09Å
43	H	87.5	Confident	76.1	Confident	36 Å²	36	74.9 Å²	74.9	17%	0.167	38%	0.383	C	S	.	.	H	α-helix	trans	-67.2	-44.7	177.7	-74.5	84.9	0	0	0	111.1	S40 A45 K46 M47	S40-H43 PolarHBondContact O-N 2.98Å; S40-H43 VanDerWaalsContact O-N 3.1Å; S40-H43 PolarHBondContact OG-N 3.33Å; S40-H43 PolarHBondContact OG-ND1 3.33Å; H43-A45 VanDerWaalsContact C-N 3.32Å; H43-A45 PolarHBondContact O-N 2.98Å; H43-K46 PolarHBondContact O-N 2.95Å; H43-M47 WeakPolarHBondContact O-CG 3.33Å; H43-M47 PolarHBondContact O-N 2.73Å
44	R	93.3	Very high	78.8	Confident	22 Å²	22	68.8 Å²	68.8	8%	0.083	35%	0.352	C	S	.	.	H	α-helix	trans	-60.3	-42.5	175.2	-174.2	176.7	-74.4	96.1	2.7	111.8	H39 S40 V41 K46 M47 W48 L132 D213	H39-R44 HydrophobicContact CB-CB 4.4Å; H39-R44 PolarHBondContact O-NH1 3.1Å; S40-R44 PolarHBondContact O-N 3.44Å; V41-R44 PolarHBondContact O-N 3.28Å; R44-K46 PolarHBondContact O-N 2.61Å; R44-M47 PolarHBondContact O-N 3.43Å; R44-W48 HydrophobicContact CG-CD2 4.39Å; R44-W48 HydrophobicContact CG-CG 4.36Å; R44-W48 HydrophobicContact CG-CZ2 4.34Å; R44-W48 WeakPolarHBondContact O-CB 3.44Å; R44-W48 PolarHBondContact O-N 2.81Å; R44-L132 HydrophobicContact CB-CD2 4Å; R44-L132 HydrophobicContact CG-CD2 3.66Å; R44-D213 WeakPolarHBondContact CD-OD1 3.31Å; R44-D213 WeakPolarHBondContact CG-OD1 3.48Å; R44-D213 IonicContact CZ-OD2 3.9Å; R44-D213 IonicContact NE-OD1 2.97Å; R44-D213 PolarHBondContact NE-OD1 3.11Å; R44-D213 IonicContact NE-OD2 2.66Å; R44-D213 PolarHBondContact NE-OD2 2.98Å; R44-D213 IonicContact NH2-OD2 2.61Å; R44-D213 PolarHBondContact NH2-OD2 3.34Å
45	A	93.6	Very high	81.2	Confident	11 Å²	11	67.5 Å²	67.5	9%	0.091	35%	0.348	C	S	.	.	H	α-helix	trans	-57.9	-46.1	175.8	0	0	0	0	0	112	V41 E42 H43 K49 L132 L134	V41-A45 WeakPolarHBondContact O-CB 3.35Å; V41-A45 PolarHBondContact O-N 3.46Å; E42-A45 PolarHBondContact O-N 3.2Å; H43-A45 VanDerWaalsContact C-N 3.32Å; H43-A45 PolarHBondContact O-N 2.98Å; A45-K49 WeakPolarHBondContact O-CB 3.12Å; A45-K49 VanDerWaalsContact O-CG 3.24Å; A45-K49 WeakPolarHBondContact O-CG 3.37Å; A45-K49 PolarHBondContact O-N 2.87Å; A45-L132 HydrophobicContact CB-CB 4.26Å; A45-L134 HydrophobicContact CB-CD2 3.9Å
46	K	92.9	Very high	83.4	Confident	90 Å²	90	64.3 Å²	64.3	39%	0.391	35%	0.353	S	S	.	.	H	α-helix	trans	-61.3	-48.9	175	-71.3	-179.1	-178.6	-174.8	0	111.6	E42 H43 R44 W48 K49 I50	E42-K46 WeakPolarHBondContact O-CG 3.48Å; E42-K46 PolarHBondContact O-N 3.18Å; E42-K46 VanDerWaalsContact O-N 3.09Å; H43-K46 PolarHBondContact O-N 2.95Å; R44-K46 PolarHBondContact O-N 2.61Å; K46-W48 PolarHBondContact O-N 3.06Å; K46-K49 PolarHBondContact O-N 3.48Å; K46-I50 WeakPolarHBondContact O-CG1 3.49Å; K46-I50 PolarHBondContact O-N 2.94Å
47	M	93.8	Very high	85.6	Confident	46 Å²	46	64 Å²	64	23%	0.227	35%	0.347	C	S	.	.	H	α-helix	trans	-58.5	-48.3	-179.8	-72.8	173.3	63.9	0	0	112.1	H43 R44 K49 I50 A51	H43-M47 WeakPolarHBondContact O-CG 3.33Å; H43-M47 PolarHBondContact O-N 2.73Å; R44-M47 PolarHBondContact O-N 3.43Å; M47-K49 PolarHBondContact O-N 3.28Å; M47-I50 PolarHBondContact O-N 2.72Å; M47-A51 WeakPolarHBondContact O-CB 3.23Å; M47-A51 PolarHBondContact O-N 2.98Å
48	W	95.9	Very high	87.6	Confident	3 Å²	3	63.5 Å²	63.5	1%	0.011	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-40	179.9	-75.1	26.1	0	0	0	111.6	R44 K46 I50 A51 L52 P128 L129 L132 W212 D213 L216	R44-W48 HydrophobicContact CG-CD2 4.39Å; R44-W48 HydrophobicContact CG-CG 4.36Å; R44-W48 HydrophobicContact CG-CZ2 4.34Å; R44-W48 WeakPolarHBondContact O-CB 3.44Å; R44-W48 PolarHBondContact O-N 2.81Å; K46-W48 PolarHBondContact O-N 3.06Å; W48-I50 VanDerWaalsContact C-N 3.28Å; W48-I50 PolarHBondContact O-N 2.98Å; W48-A51 PolarHBondContact O-N 3.23Å; W48-L52 WeakPolarHBondContact O-CB 2.95Å; W48-L52 WeakPolarHBondContact O-CG 3.49Å; W48-L52 PolarHBondContact O-N 2.8Å; W48-P128 HydrophobicContact CH2-CB 3.91Å; W48-P128 HydrophobicContact CZ3-CB 4.13Å; W48-L129 HydrophobicContact CE3-CD2 3.73Å; W48-L129 HydrophobicContact CZ3-CD2 3.77Å; W48-L132 HydrophobicContact CB-CD1 4.47Å; W48-L132 HydrophobicContact CD2-CD1 4.04Å; W48-L132 HydrophobicContact CE3-CD1 3.52Å; W48-L132 HydrophobicContact CG-CD1 4.48Å; W48-L132 HydrophobicContact CZ3-CD1 3.99Å; W48-W212 HydrophobicContact CE3-CE3 4.1Å; W48-W212 HydrophobicContact CH2-CB 3.55Å; W48-W212 HydrophobicContact CH2-CD2 4.03Å; W48-W212 AromaticContact CH2-CE3 3.5Å; W48-W212 HydrophobicContact CH2-CE3 3.5Å; W48-W212 VanDerWaalsContact CH2-CE3 3.5Å; W48-W212 HydrophobicContact CH2-CG 4.1Å; W48-W212 HydrophobicContact CH2-CZ3 4.4Å; W48-W212 HydrophobicContact CZ2-CB 3.38Å; W48-W212 HydrophobicContact CZ2-CE3 4.37Å; W48-W212 HydrophobicContact CZ2-CG 4.4Å; W48-W212 HydrophobicContact CZ3-CB 4.44Å; W48-W212 HydrophobicContact CZ3-CD2 4.31Å; W48-W212 AromaticContact CZ3-CE3 3.33Å; W48-W212 HydrophobicContact CZ3-CE3 3.33Å; W48-W212 AromaticContact CZ3-CZ3 3.9Å; W48-W212 HydrophobicContact CZ3-CZ3 3.9Å; W48-D213 PolarHBondContact NE1-OD1 2.81Å; W48-L216 HydrophobicContact CB-CD1 4.23Å; W48-L216 HydrophobicContact CD2-CD1 3.57Å; W48-L216 HydrophobicContact CE3-CD1 3.91Å; W48-L216 HydrophobicContact CG-CD1 3.71Å
49	K	95.4	Very high	89.5	Confident	37 Å²	37	58 Å²	58	16%	0.161	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-37.2	175.4	-74.3	-179.1	72.6	172.9	0	112.4	A45 K46 M47 N53 V54 S55 L134 D138	A45-K49 WeakPolarHBondContact O-CB 3.12Å; A45-K49 VanDerWaalsContact O-CG 3.24Å; A45-K49 WeakPolarHBondContact O-CG 3.37Å; A45-K49 PolarHBondContact O-N 2.87Å; K46-K49 PolarHBondContact O-N 3.48Å; M47-K49 PolarHBondContact O-N 3.28Å; K49-N53 PolarHBondContact O-N 3.44Å; K49-V54 HydrophobicContact CB-CG2 3.99Å; K49-V54 HydrophobicContact CG-CG2 4.04Å; K49-V54 WeakPolarHBondContact O-CG2 3.26Å; K49-V54 PolarHBondContact O-N 3.47Å; K49-S55 PolarHBondContact O-N 3.33Å; K49-L134 HydrophobicContact CD-CD2 4.23Å; K49-D138 WeakPolarHBondContact CE-OD1 3.47Å; K49-D138 IonicContact NZ-OD1 3.87Å; K49-D138 PolarHBondContact NZ-OD1 3.07Å; K49-D138 IonicContact NZ-OD2 2.74Å; K49-D138 PolarHBondContact NZ-OD2 3.29Å
50	I	94.6	Very high	90.7	Very high	87 Å²	87	57.6 Å²	57.6	45%	0.446	34%	0.341	S	S	.	.	H	α-helix	trans	-69.6	-51.1	175.5	-67.8	166.2	0	0	0	110.3	L20 K46 M47 W48 L52 N53	L20-I50 HydrophobicContact CD2-CD1 3.4Å; L20-I50 VanDerWaalsContact CD2-CD1 3.4Å; K46-I50 WeakPolarHBondContact O-CG1 3.49Å; K46-I50 PolarHBondContact O-N 2.94Å; M47-I50 PolarHBondContact O-N 2.72Å; W48-I50 VanDerWaalsContact C-N 3.28Å; W48-I50 PolarHBondContact O-N 2.98Å; I50-L52 VanDerWaalsContact C-N 3.26Å; I50-L52 PolarHBondContact O-N 3.33Å; I50-N53 WeakPolarHBondContact O-CA 3.36Å; I50-N53 PolarHBondContact O-N 2.96Å
51	A	94.4	Very high	91.2	Very high	27 Å²	27	55.6 Å²	55.6	22%	0.223	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-34.8	-179.5	0	0	0	0	0	113.4	M47 W48 N53 K149 L216	M47-A51 WeakPolarHBondContact O-CB 3.23Å; M47-A51 PolarHBondContact O-N 2.98Å; W48-A51 PolarHBondContact O-N 3.23Å; A51-N53 VanDerWaalsContact C-N 3.29Å; A51-K149 PolarHBondContact O-NZ 3.19Å; A51-L216 HydrophobicContact CB-CB 3.98Å
52	L	95.2	Very high	91.4	Very high	7 Å²	7	56.7 Å²	56.7	4%	0.037	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.1	175.4	-66.9	176.5	0	0	0	113.6	W48 I50 V54 C142 A145 I146 Y150 L216	W48-L52 WeakPolarHBondContact O-CB 2.95Å; W48-L52 WeakPolarHBondContact O-CG 3.49Å; W48-L52 PolarHBondContact O-N 2.8Å; I50-L52 VanDerWaalsContact C-N 3.26Å; I50-L52 PolarHBondContact O-N 3.33Å; L52-V54 VanDerWaalsContact C-N 3.35Å; L52-V54 HydrophobicContact CB-CG1 4.31Å; L52-V54 HydrophobicContact CB-CG2 4.03Å; L52-V54 PolarHBondContact O-N 3.44Å; L52-C142 HydrophobicContact CD1-CB 3.85Å; L52-A145 HydrophobicContact CB-CB 3.99Å; L52-A145 HydrophobicContact CD2-CB 4.21Å; L52-I146 HydrophobicContact CD1-CD1 4.01Å; L52-I146 HydrophobicContact CD1-CG1 3.98Å; L52-I146 HydrophobicContact CD2-CG1 3.72Å; L52-Y150 HydrophobicContact CD2-CD2 4.37Å; L52-Y150 HydrophobicContact CD2-CE2 3.72Å; L52-L216 HydrophobicContact CD1-CD1 4.49Å; L52-L216 HydrophobicContact CD2-CD1 4.46Å; L52-L216 HydrophobicContact CD2-CD2 3.66Å; L52-L216 HydrophobicContact CG-CD1 4.38Å; L52-L216 HydrophobicContact CG-CD2 4.4Å
53	N	94.3	Very high	91.5	Very high	129 Å²	129	54.8 Å²	54.8	69%	0.69	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	49.1	-176	-166.7	17.7	0	0	0	112.6	K49 I50 A51 K57	K49-N53 PolarHBondContact O-N 3.44Å; I50-N53 WeakPolarHBondContact O-CA 3.36Å; I50-N53 PolarHBondContact O-N 2.96Å; A51-N53 VanDerWaalsContact C-N 3.29Å; N53-K57 WeakPolarHBondContact O-CE 3.25Å
54	V	94.2	Very high	91.7	Very high	0 Å²	0	55 Å²	55	0%	0	34%	0.336	C	S	.	.			trans	-125.2	4.5	177.9	-58.9	0	0	0	0	113.1	K49 L52 G56 K57 N141 A145	K49-V54 HydrophobicContact CB-CG2 3.99Å; K49-V54 HydrophobicContact CG-CG2 4.04Å; K49-V54 WeakPolarHBondContact O-CG2 3.26Å; K49-V54 PolarHBondContact O-N 3.47Å; L52-V54 VanDerWaalsContact C-N 3.35Å; L52-V54 HydrophobicContact CB-CG1 4.31Å; L52-V54 HydrophobicContact CB-CG2 4.03Å; L52-V54 PolarHBondContact O-N 3.44Å; V54-G56 PolarHBondContact O-N 2.98Å; V54-K57 HydrophobicContact CB-CD 4.24Å; V54-K57 HydrophobicContact CG1-CD 4.09Å; V54-K57 PolarHBondContact O-N 3.31Å; V54-N141 HydrophobicContact CB-CB 4.2Å; V54-N141 HydrophobicContact CG1-CB 4.24Å; V54-A145 HydrophobicContact CG1-CB 3.87Å
55	S	89.4	Confident	91.5	Very high	80 Å²	80	59.6 Å²	59.6	56%	0.559	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	125	171.7	-165.4	0	0	0	0	110.3	K49 K57	K49-S55 PolarHBondContact O-N 3.33Å; S55-K57 VanDerWaalsContact C-N 3.27Å; S55-K57 PolarHBondContact O-N 3.07Å
56	G	84.1	Confident	91.3	Very high	76 Å²	76	61 Å²	61	78%	0.784	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	10.3	-178.8	0	0	0	0	0	116	V54	V54-G56 PolarHBondContact O-N 2.98Å
57	K	89.1	Confident	91.3	Very high	107 Å²	107	59.8 Å²	59.8	47%	0.465	38%	0.378	S	S	.	.			trans	-67.2	140.9	171.9	-87.2	-167	-179.1	178.6	0	111.2	N53 V54 S55	N53-K57 WeakPolarHBondContact O-CE 3.25Å; V54-K57 HydrophobicContact CB-CD 4.24Å; V54-K57 HydrophobicContact CG1-CD 4.09Å; V54-K57 PolarHBondContact O-N 3.31Å; S55-K57 VanDerWaalsContact C-N 3.27Å; S55-K57 PolarHBondContact O-N 3.07Å
58	G	88.1	Confident	91.3	Very high	59 Å²	59	60.6 Å²	60.6	61%	0.608	38%	0.383	S	S	*	.			trans	-65.3	168.9	173.8	0	0	0	0	0	112.9	S60 N141	G58-S60 PolarHBondContact O-N 3.37Å; G58-S60 VanDerWaalsContact O-N 3.15Å; G58-N141 PolarHBondContact O-ND2 3.37Å; G58-N141 VanDerWaalsContact O-ND2 3.15Å
59	D	90.6	Very high	91.3	Very high	70 Å²	70	65 Å²	65	37%	0.374	41%	0.407	S	S	.	.			trans	-74.3	103.5	178.2	-179.7	16.1	0	0	0	111.4	L61 S62 S137	D59-L61 PolarHBondContact O-N 3.18Å; D59-L61 WeakPolarHBondContact OD1-CB 3.44Å; D59-L61 PolarHBondContact OD1-N 3.19Å; D59-S62 WeakPolarHBondContact O-CB 3.44Å; D59-S62 PolarHBondContact O-N 3.42Å; D59-S62 PolarHBondContact O-OG 3.49Å; D59-S62 PolarHBondContact OD2-N 3.44Å; D59-S137 VanDerWaalsContact OD1-CB 3.23Å; D59-S137 WeakPolarHBondContact OD1-CB 3.49Å
60	S	88.5	Confident	91.2	Very high	47 Å²	47	64.8 Å²	64.8	33%	0.329	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.8	177.1	-58.9	0	0	0	0	113.3	G58 P63 F107 N141	G58-S60 PolarHBondContact O-N 3.37Å; G58-S60 VanDerWaalsContact O-N 3.15Å; S60-P63 WeakPolarHBondContact O-CD 3.37Å; S60-F107 VanDerWaalsContact O-CZ 3.25Å; S60-F107 WeakPolarHBondContact O-CZ 3.21Å; S60-N141 PolarHBondContact OG-OD1 3.48Å
61	L	88.8	Confident	91.3	Very high	16 Å²	16	66.7 Å²	66.7	8%	0.084	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-16.9	177.3	-65	153.3	0	0	0	112	D59 W64 F107 R136 Y140	D59-L61 PolarHBondContact O-N 3.18Å; D59-L61 WeakPolarHBondContact OD1-CB 3.44Å; D59-L61 PolarHBondContact OD1-N 3.19Å; L61-W64 HydrophobicContact CD2-CE3 3.57Å; L61-W64 HydrophobicContact CD2-CZ3 3.86Å; L61-W64 VanDerWaalsContact O-CB 3.31Å; L61-W64 WeakPolarHBondContact O-CB 3.33Å; L61-W64 PolarHBondContact O-N 2.87Å; L61-F107 HydrophobicContact CD2-CB 3.71Å; L61-F107 HydrophobicContact CD2-CD1 3.35Å; L61-F107 HydrophobicContact CD2-CD2 4.37Å; L61-F107 HydrophobicContact CD2-CE1 4.04Å; L61-F107 HydrophobicContact CD2-CG 3.55Å; L61-F107 HydrophobicContact CG-CD1 4.17Å; L61-F107 HydrophobicContact CG-CE1 4.46Å; L61-R136 HydrophobicContact CD1-CG 3.77Å; L61-Y140 HydrophobicContact CG-CG 4.41Å
62	S	89.4	Confident	91.3	Very high	89 Å²	89	66.8 Å²	66.8	62%	0.622	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-34.8	-178.2	65	0	0	0	0	116.5	D59 W64	D59-S62 WeakPolarHBondContact O-CB 3.44Å; D59-S62 PolarHBondContact O-N 3.42Å; D59-S62 PolarHBondContact O-OG 3.49Å; D59-S62 PolarHBondContact OD2-N 3.44Å; S62-W64 VanDerWaalsContact C-N 3.31Å
63	P	88.4	Confident	91.4	Very high	111 Å²	111	67.4 Å²	67.4	72%	0.721	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-7.3	175.6	33.6	-35.7	0	0	0	113.6	S60	S60-P63 WeakPolarHBondContact O-CD 3.37Å
64	W	92.1	Very high	91.5	Very high	42 Å²	42	66.1 Å²	66.1	16%	0.159	42%	0.421	C	S	.	.	S	Bend	trans	-85.8	139.7	-179.2	179.9	38.3	0	0	0	111	L61 S62 G66 V67 L68 S103 T106 F107	L61-W64 HydrophobicContact CD2-CE3 3.57Å; L61-W64 HydrophobicContact CD2-CZ3 3.86Å; L61-W64 VanDerWaalsContact O-CB 3.31Å; L61-W64 WeakPolarHBondContact O-CB 3.33Å; L61-W64 PolarHBondContact O-N 2.87Å; S62-W64 VanDerWaalsContact C-N 3.31Å; W64-G66 PolarHBondContact O-N 3.36Å; W64-V67 WeakPolarHBondContact CZ2-O 3.37Å; W64-L68 HydrophobicContact CH2-CD2 3.73Å; W64-L68 HydrophobicContact CZ2-CD2 4.11Å; W64-S103 WeakPolarHBondContact CH2-O 3.24Å; W64-S103 WeakPolarHBondContact CZ3-O 3.39Å; W64-T106 HydrophobicContact CH2-CG2 4.34Å; W64-T106 HydrophobicContact CZ2-CG2 4.02Å; W64-F107 HydrophobicContact CB-CD2 3.77Å; W64-F107 HydrophobicContact CB-CE2 3.69Å; W64-F107 HydrophobicContact CD2-CB 4.07Å; W64-F107 AromaticContact CD2-CD2 3.6Å; W64-F107 HydrophobicContact CD2-CD2 3.6Å; W64-F107 HydrophobicContact CD2-CE2 4.44Å; W64-F107 HydrophobicContact CD2-CG 4.13Å; W64-F107 HydrophobicContact CE3-CB 3.72Å; W64-F107 AromaticContact CE3-CD2 3.89Å; W64-F107 HydrophobicContact CE3-CD2 3.89Å; W64-F107 AromaticContact CE3-CG 3.95Å; W64-F107 HydrophobicContact CE3-CG 3.95Å; W64-F107 AromaticContact CG-CD2 3.55Å; W64-F107 HydrophobicContact CG-CD2 3.55Å; W64-F107 AromaticContact CG-CE2 3.96Å; W64-F107 HydrophobicContact CG-CE2 3.96Å; W64-F107 HydrophobicContact CG-CG 4.48Å; W64-F107 HydrophobicContact CH2-CB 4.05Å; W64-F107 HydrophobicContact CZ2-CB 4.41Å; W64-F107 HydrophobicContact CZ3-CB 3.7Å; W64-F107 HydrophobicContact CZ3-CG 4.43Å
65	D	88.1	Confident	91.6	Very high	117 Å²	117	68.7 Å²	68.7	63%	0.626	43%	0.434	S	S	*	.			trans	-72	-6.4	179.3	59.2	10.6	0	0	0	114.4	V67	D65-V67 HydrophobicContact CB-CG2 4.09Å; D65-V67 VanDerWaalsContact CG-CG2 3.48Å; D65-V67 PolarHBondContact O-N 2.97Å; D65-V67 WeakPolarHBondContact OD1-CB 3.1Å; D65-V67 PolarHBondContact OD1-N 2.85Å
66	G	90.3	Very high	91.9	Very high	42 Å²	42	64.9 Å²	64.9	43%	0.433	41%	0.408	S	S	.	.			trans	72.1	10.3	-179.5	0	0	0	0	0	114.2	W64 L68	W64-G66 PolarHBondContact O-N 3.36Å; G66-L68 PolarHBondContact O-N 3.46Å
67	V	92.1	Very high	92.4	Very high	63 Å²	63	64.9 Å²	64.9	38%	0.382	39%	0.387	S	S	.	.			trans	-76.1	123.8	-176.7	-179.6	0	0	0	0	110.3	W64 D65 D69 K110	W64-V67 WeakPolarHBondContact CZ2-O 3.37Å; D65-V67 HydrophobicContact CB-CG2 4.09Å; D65-V67 VanDerWaalsContact CG-CG2 3.48Å; D65-V67 PolarHBondContact O-N 2.97Å; D65-V67 WeakPolarHBondContact OD1-CB 3.1Å; D65-V67 PolarHBondContact OD1-N 2.85Å; V67-D69 HydrophobicContact CG1-CB 3.73Å; V67-D69 WeakPolarHBondContact CG1-OD2 3.35Å; V67-K110 PolarHBondContact O-NZ 3.07Å
68	L	95.1	Very high	92.7	Very high	63 Å²	63	63.6 Å²	63.6	33%	0.33	39%	0.385	S	S	.	.			trans	-96.2	80.1	177.6	-57	-179.3	0	0	0	110.5	W64 G66 Q73 E102 T106	W64-L68 HydrophobicContact CH2-CD2 3.73Å; W64-L68 HydrophobicContact CZ2-CD2 4.11Å; G66-L68 PolarHBondContact O-N 3.46Å; L68-Q73 HydrophobicContact CB-CG 4.14Å; L68-E102 HydrophobicContact CD1-CG 4.05Å; L68-E102 HydrophobicContact CD2-CG 4.49Å; L68-T106 HydrophobicContact CD2-CG2 3.86Å
69	D	94.4	Very high	93	Very high	97 Å²	97	64.9 Å²	64.9	52%	0.519	37%	0.372	S	S	.	.			trans	-130.9	23.7	-168.9	64.8	-9.3	0	0	0	114.3	V67 K110	V67-D69 HydrophobicContact CG1-CB 3.73Å; V67-D69 WeakPolarHBondContact CG1-OD2 3.35Å; D69-K110 WeakPolarHBondContact OD1-CE 3.29Å; D69-K110 IonicContact OD1-NZ 2.95Å; D69-K110 PolarHBondContact OD1-NZ 2.94Å; D69-K110 IonicContact OD2-NZ 3.88Å
70	L	94.9	Very high	93.2	Very high	31 Å²	31	61.5 Å²	61.5	16%	0.162	35%	0.354	C	S	.	.			trans	-67	147.8	173.7	-71.1	174.8	0	0	0	111	E72 Q73 I76 T106 C109 K110	L70-E72 PolarHBondContact O-N 3.45Å; L70-E72 VanDerWaalsContact O-N 3.14Å; L70-Q73 WeakPolarHBondContact O-CB 3.47Å; L70-Q73 PolarHBondContact O-N 3.28Å; L70-I76 HydrophobicContact CD1-CD1 3.8Å; L70-T106 HydrophobicContact CD1-CG2 3.84Å; L70-T106 HydrophobicContact CG-CG2 4.06Å; L70-C109 HydrophobicContact CD1-CB 3.6Å; L70-K110 HydrophobicContact CD2-CG 3.95Å; L70-K110 HydrophobicContact CG-CG 4.38Å
71	P	95.6	Very high	93.4	Very high	127 Å²	127	62.6 Å²	62.6	83%	0.825	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-35.7	174.6	-26.1	33.6	0	0	0	113.2
72	E	95.5	Very high	93.6	Very high	30 Å²	30	65.8 Å²	65.8	14%	0.14	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	17.1	-179.8	67.5	-84.4	-159.1	0	0	113.9	L70 T74 L75 I76 T115 F116	L70-E72 PolarHBondContact O-N 3.45Å; L70-E72 VanDerWaalsContact O-N 3.14Å; E72-T74 VanDerWaalsContact C-N 3.28Å; E72-T74 PolarHBondContact O-N 2.88Å; E72-L75 WeakPolarHBondContact O-CA 3.23Å; E72-L75 VanDerWaalsContact O-CB 3.31Å; E72-L75 WeakPolarHBondContact O-CB 3.26Å; E72-L75 PolarHBondContact O-N 3.33Å; E72-I76 HydrophobicContact CG-CD1 4.36Å; E72-I76 PolarHBondContact O-N 3.06Å; E72-I76 VanDerWaalsContact O-N 3.13Å; E72-T115 WeakPolarHBondContact OE1-CA 3.41Å; E72-F116 HydrophobicContact CG-CB 3.75Å; E72-F116 PolarHBondContact OE1-N 2.89Å
73	Q	96.4	Very high	93.6	Very high	20 Å²	20	62.1 Å²	62.1	9%	0.093	34%	0.341	C	S	.	.	H	α-helix	trans	-55.6	-40.6	-177	-166.4	66.3	44.8	0	0	113	L68 L70 L75 I76 H77 E102 T106	L68-Q73 HydrophobicContact CB-CG 4.14Å; L70-Q73 WeakPolarHBondContact O-CB 3.47Å; L70-Q73 PolarHBondContact O-N 3.28Å; Q73-L75 PolarHBondContact O-N 3.38Å; Q73-I76 WeakPolarHBondContact O-CB 3.36Å; Q73-I76 PolarHBondContact O-N 3.3Å; Q73-I76 VanDerWaalsContact O-N 3.14Å; Q73-H77 WeakPolarHBondContact O-CB 3.39Å; Q73-H77 PolarHBondContact O-N 3.24Å; Q73-E102 VanDerWaalsContact NE2-CG 3.28Å; Q73-E102 PolarHBondContact NE2-OE1 3.26Å; Q73-T106 PolarHBondContact NE2-OG1 3.4Å; Q73-T106 PolarHBondContact OE1-OG1 2.81Å
74	T	95.9	Very high	93.8	Very high	102 Å²	102	57 Å²	57	63%	0.626	31%	0.308	S	S	*	.	H	α-helix	trans	-60.5	-35.4	177.1	-50.9	0	0	0	0	112.1	E72 N78	E72-T74 VanDerWaalsContact C-N 3.28Å; E72-T74 PolarHBondContact O-N 2.88Å; T74-N78 WeakPolarHBondContact O-CB 3.4Å; T74-N78 PolarHBondContact O-N 3.35Å; T74-N78 PolarHBondContact O-ND2 2.89Å
75	L	95.8	Very high	93.6	Very high	54 Å²	54	59.9 Å²	59.9	28%	0.283	33%	0.327	S	S	.	.	H	α-helix	trans	-69.4	-43.2	175.9	177.1	65.2	0	0	0	110.8	E72 Q73 H77 N78 R79 F116 P118	E72-L75 WeakPolarHBondContact O-CA 3.23Å; E72-L75 VanDerWaalsContact O-CB 3.31Å; E72-L75 WeakPolarHBondContact O-CB 3.26Å; E72-L75 PolarHBondContact O-N 3.33Å; Q73-L75 PolarHBondContact O-N 3.38Å; L75-H77 VanDerWaalsContact C-N 3.34Å; L75-H77 PolarHBondContact O-N 3.13Å; L75-N78 PolarHBondContact O-N 3.23Å; L75-R79 HydrophobicContact CD1-CG 4.34Å; L75-R79 WeakPolarHBondContact O-CG 3.42Å; L75-R79 PolarHBondContact O-N 3.03Å; L75-F116 HydrophobicContact CD2-CD1 3.9Å; L75-F116 HydrophobicContact CD2-CE1 4.11Å; L75-F116 HydrophobicContact CG-CD1 4.07Å; L75-F116 HydrophobicContact CG-CE1 3.95Å; L75-P118 HydrophobicContact CD1-CG 4.27Å; L75-P118 HydrophobicContact CD2-CG 3.81Å
76	I	96.3	Very high	93.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-47.3	175.5	-61.9	170.9	0	0	0	110.1	L70 E72 Q73 R79 S80 E102 I105 F116	L70-I76 HydrophobicContact CD1-CD1 3.8Å; E72-I76 HydrophobicContact CG-CD1 4.36Å; E72-I76 PolarHBondContact O-N 3.06Å; E72-I76 VanDerWaalsContact O-N 3.13Å; Q73-I76 WeakPolarHBondContact O-CB 3.36Å; Q73-I76 PolarHBondContact O-N 3.3Å; Q73-I76 VanDerWaalsContact O-N 3.14Å; I76-R79 PolarHBondContact O-N 3.48Å; I76-S80 WeakPolarHBondContact O-CB 3.22Å; I76-S80 PolarHBondContact O-N 2.94Å; I76-S80 PolarHBondContact O-OG 3.41Å; I76-E102 HydrophobicContact CG2-CG 4.03Å; I76-I105 HydrophobicContact CD1-CG2 4.1Å; I76-I105 HydrophobicContact CG1-CG2 4.13Å; I76-I105 HydrophobicContact CG2-CB 3.92Å; I76-I105 HydrophobicContact CG2-CD1 4.31Å; I76-I105 HydrophobicContact CG2-CG2 3.77Å; I76-F116 HydrophobicContact CD1-CB 4.05Å; I76-F116 HydrophobicContact CD1-CG 4.26Å; I76-F116 HydrophobicContact CG1-CB 3.95Å; I76-F116 HydrophobicContact CG1-CD1 3.56Å; I76-F116 HydrophobicContact CG1-CD2 4.29Å; I76-F116 HydrophobicContact CG1-CE1 4.09Å; I76-F116 HydrophobicContact CG1-CG 3.67Å
77	H	95.8	Very high	93.2	Very high	76 Å²	76	62.5 Å²	62.5	35%	0.352	33%	0.325	S	S	.	.	H	α-helix	trans	-57.4	-51.7	177.5	-175.4	72.8	0	0	0	111.6	Q73 L75 R79 S80 Q81 E102	Q73-H77 WeakPolarHBondContact O-CB 3.39Å; Q73-H77 PolarHBondContact O-N 3.24Å; L75-H77 VanDerWaalsContact C-N 3.34Å; L75-H77 PolarHBondContact O-N 3.13Å; H77-R79 VanDerWaalsContact C-N 3.32Å; H77-R79 PolarHBondContact O-N 2.81Å; H77-S80 WeakPolarHBondContact O-CB 3.24Å; H77-S80 PolarHBondContact O-N 3.44Å; H77-S80 VanDerWaalsContact O-N 3.14Å; H77-Q81 PolarHBondContact O-N 3.47Å; H77-E102 IonicContact CE1-OE2 3.23Å; H77-E102 IonicContact CG-OE2 3.82Å; H77-E102 IonicContact ND1-OE1 3.24Å; H77-E102 IonicContact ND1-OE2 3.7Å; H77-E102 PolarHBondContact ND1-OE2 2.99Å
78	N	95	Very high	92.6	Very high	80 Å²	80	62.9 Å²	62.9	43%	0.428	34%	0.342	S	S	.	.	H	α-helix	trans	-59.9	-40.5	179.5	-71.6	-21.2	0	0	0	112.5	T74 L75 Q82	T74-N78 WeakPolarHBondContact O-CB 3.4Å; T74-N78 PolarHBondContact O-N 3.35Å; T74-N78 PolarHBondContact O-ND2 2.89Å; L75-N78 PolarHBondContact O-N 3.23Å; N78-Q82 WeakPolarHBondContact O-CB 3.46Å; N78-Q82 VanDerWaalsContact O-CG 3.23Å; N78-Q82 WeakPolarHBondContact O-CG 3.22Å; N78-Q82 PolarHBondContact O-N 2.88Å
79	R	93.9	Very high	92	Very high	85 Å²	85	62.5 Å²	62.5	32%	0.321	34%	0.342	S	S	.	.	H	α-helix	trans	-69.6	-36.2	176.9	-72.7	-56.5	-157.2	174.9	10.4	112.4	L75 I76 H77 Q82 L83 F116 P118 P123	L75-R79 HydrophobicContact CD1-CG 4.34Å; L75-R79 WeakPolarHBondContact O-CG 3.42Å; L75-R79 PolarHBondContact O-N 3.03Å; I76-R79 PolarHBondContact O-N 3.48Å; H77-R79 VanDerWaalsContact C-N 3.32Å; H77-R79 PolarHBondContact O-N 2.81Å; R79-Q82 PolarHBondContact O-N 3.01Å; R79-L83 PolarHBondContact O-N 3.27Å; R79-F116 HydrophobicContact CB-CE1 4.48Å; R79-F116 HydrophobicContact CB-CZ 4.3Å; R79-F116 HydrophobicContact CG-CE1 4.07Å; R79-F116 HydrophobicContact CG-CZ 4.17Å; R79-P118 PolarHBondContact NH2-O 3.35Å; R79-P118 VanDerWaalsContact NH2-O 3.13Å; R79-P123 HydrophobicContact CB-CG 4.23Å
80	S	94.5	Very high	91.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-65.1	-45.5	175.8	-54.5	0	0	0	0	110.4	I76 H77 L83 I84 V101	I76-S80 WeakPolarHBondContact O-CB 3.22Å; I76-S80 PolarHBondContact O-N 2.94Å; I76-S80 PolarHBondContact O-OG 3.41Å; H77-S80 WeakPolarHBondContact O-CB 3.24Å; H77-S80 PolarHBondContact O-N 3.44Å; H77-S80 VanDerWaalsContact O-N 3.14Å; S80-L83 WeakPolarHBondContact O-CB 3.29Å; S80-L83 PolarHBondContact O-N 3.21Å; S80-I84 WeakPolarHBondContact O-CG1 3.43Å; S80-I84 PolarHBondContact O-N 3.09Å; S80-V101 WeakPolarHBondContact OG-CG1 3.42Å
81	Q	93.6	Very high	90.7	Very high	70 Å²	70	68.2 Å²	68.2	33%	0.327	37%	0.371	S	S	.	.	H	α-helix	trans	-59.9	-49.3	174.7	-169.5	63.8	59.6	0	0	111.7	H77 L83 I84 D85	H77-Q81 PolarHBondContact O-N 3.47Å; Q81-L83 VanDerWaalsContact C-N 3.25Å; Q81-L83 PolarHBondContact O-N 3.44Å; Q81-I84 PolarHBondContact O-N 2.98Å; Q81-I84 VanDerWaalsContact O-N 3.11Å; Q81-D85 PolarHBondContact NE2-OD1 3.43Å; Q81-D85 PolarHBondContact O-N 3.49Å
82	Q	91.9	Very high	89.9	Confident	83 Å²	83	70.6 Å²	70.6	39%	0.388	37%	0.371	S	S	.	.	H	α-helix	trans	-55.2	-40.4	176.5	-76.2	170.6	14	0	0	112.3	N78 R79 H86	N78-Q82 WeakPolarHBondContact O-CB 3.46Å; N78-Q82 VanDerWaalsContact O-CG 3.23Å; N78-Q82 WeakPolarHBondContact O-CG 3.22Å; N78-Q82 PolarHBondContact O-N 2.88Å; R79-Q82 PolarHBondContact O-N 3.01Å; Q82-H86 PolarHBondContact O-CE1 3.45Å; Q82-H86 PolarHBondContact O-N 3.22Å; Q82-H86 PolarHBondContact O-ND1 3.1Å
83	L	90.8	Very high	89.2	Confident	11 Å²	11	73.8 Å²	73.8	6%	0.058	39%	0.386	C	S	.	.	H	α-helix	trans	-62.3	-46.9	177.9	174.2	64.3	0	0	0	111.6	R79 S80 Q81 H86 V101 P123 L126 K127 L130	R79-L83 PolarHBondContact O-N 3.27Å; S80-L83 WeakPolarHBondContact O-CB 3.29Å; S80-L83 PolarHBondContact O-N 3.21Å; Q81-L83 VanDerWaalsContact C-N 3.25Å; Q81-L83 PolarHBondContact O-N 3.44Å; L83-H86 PolarHBondContact O-N 3.1Å; L83-V101 HydrophobicContact CD2-CG1 4.25Å; L83-V101 HydrophobicContact CD2-CG2 4.33Å; L83-P123 HydrophobicContact CD2-CB 4.31Å; L83-P123 VanDerWaalsContact CD2-O 3.31Å; L83-P123 WeakPolarHBondContact CD2-O 3.49Å; L83-L126 HydrophobicContact CD2-CB 4.39Å; L83-K127 HydrophobicContact CD1-CB 3.78Å; L83-K127 HydrophobicContact CD1-CD 4.25Å; L83-K127 HydrophobicContact CD1-CG 3.91Å; L83-L130 HydrophobicContact CD2-CD1 3.86Å; L83-L130 HydrophobicContact CG-CD1 4.36Å
84	I	91.6	Very high	88.8	Confident	4 Å²	4	73.2 Å²	73.2	2%	0.021	39%	0.385	C	S	.	.	H	α-helix	trans	-71.1	-37.2	-177.1	-60.4	-47.3	0	0	0	111.5	S80 Q81 H86 L87 G88 V89 M97 V98 V101 L130	S80-I84 WeakPolarHBondContact O-CG1 3.43Å; S80-I84 PolarHBondContact O-N 3.09Å; Q81-I84 PolarHBondContact O-N 2.98Å; Q81-I84 VanDerWaalsContact O-N 3.11Å; I84-H86 VanDerWaalsContact C-N 3.25Å; I84-H86 PolarHBondContact O-N 3.34Å; I84-L87 HydrophobicContact CD1-CD1 4.04Å; I84-L87 WeakPolarHBondContact O-CB 3.29Å; I84-L87 PolarHBondContact O-N 2.97Å; I84-G88 PolarHBondContact O-N 2.97Å; I84-V89 HydrophobicContact CG2-CG2 3.6Å; I84-M97 HydrophobicContact CD1-CB 3.67Å; I84-M97 HydrophobicContact CD1-SD 4.42Å; I84-M97 HydrophobicContact CG1-CB 4.08Å; I84-V98 HydrophobicContact CB-CG2 3.81Å; I84-V98 HydrophobicContact CG1-CB 4.49Å; I84-V98 HydrophobicContact CG1-CG2 3.51Å; I84-V98 HydrophobicContact CG2-CG2 4.21Å; I84-V101 HydrophobicContact CD1-CG2 4.41Å; I84-L130 HydrophobicContact CD1-CD1 3.61Å
85	D	89	Confident	88.5	Confident	102 Å²	102	72.3 Å²	72.3	55%	0.545	38%	0.383	S	S	.	.	H	α-helix	trans	-58.7	-38.4	175.4	-65.3	-14.5	0	0	0	111.5	Q81 L87 G88	Q81-D85 PolarHBondContact NE2-OD1 3.43Å; Q81-D85 PolarHBondContact O-N 3.49Å; D85-L87 VanDerWaalsContact C-N 3.26Å; D85-L87 PolarHBondContact O-N 3.48Å; D85-G88 PolarHBondContact O-N 3.33Å
86	H	85.2	Confident	88.2	Confident	152 Å²	152	76.3 Å²	76.3	70%	0.704	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.3	176.1	-69.2	122	0	0	0	114	Q82 L83 I84	Q82-H86 PolarHBondContact O-CE1 3.45Å; Q82-H86 PolarHBondContact O-N 3.22Å; Q82-H86 PolarHBondContact O-ND1 3.1Å; L83-H86 PolarHBondContact O-N 3.1Å; I84-H86 VanDerWaalsContact C-N 3.25Å; I84-H86 PolarHBondContact O-N 3.34Å
87	L	82.9	Confident	88	Confident	63 Å²	63	78.2 Å²	78.2	33%	0.33	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15.6	177.6	-66.5	174.6	0	0	0	112.4	I84 D85 V89 K127 L130	I84-L87 HydrophobicContact CD1-CD1 4.04Å; I84-L87 WeakPolarHBondContact O-CB 3.29Å; I84-L87 PolarHBondContact O-N 2.97Å; D85-L87 VanDerWaalsContact C-N 3.26Å; D85-L87 PolarHBondContact O-N 3.48Å; L87-V89 VanDerWaalsContact C-N 3.31Å; L87-V89 HydrophobicContact CB-CG2 4.01Å; L87-V89 PolarHBondContact O-N 3.41Å; L87-K127 HydrophobicContact CD2-CG 4.15Å; L87-L130 HydrophobicContact CD1-CB 4.42Å; L87-L130 HydrophobicContact CD1-CD1 3.92Å
88	G	80	Confident	88	Confident	70 Å²	70	74.9 Å²	74.9	72%	0.722	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	28.8	176.4	0	0	0	0	0	114.5	I84 D85	I84-G88 PolarHBondContact O-N 2.97Å; D85-G88 PolarHBondContact O-N 3.33Å
89	V	83.1	Confident	87.9	Confident	55 Å²	55	73.4 Å²	73.4	33%	0.333	39%	0.391	S	S	.	.			trans	-75.9	161.9	177.6	-103.2	0	0	0	0	112.3	I84 L87 M97	I84-V89 HydrophobicContact CG2-CG2 3.6Å; L87-V89 VanDerWaalsContact C-N 3.31Å; L87-V89 HydrophobicContact CB-CG2 4.01Å; L87-V89 PolarHBondContact O-N 3.41Å; V89-M97 HydrophobicContact CG1-CE 4.33Å; V89-M97 HydrophobicContact CG1-SD 4.44Å; V89-M97 HydrophobicContact CG2-SD 4.27Å
90	S	81.9	Confident	87.9	Confident	59 Å²	59	70.5 Å²	70.5	41%	0.413	38%	0.382	S	S	.	.			trans	-62.2	153.6	176.1	70.1	0	0	0	0	111.8	E92 E93 G94	S90-E92 VanDerWaalsContact C-N 3.32Å; S90-E92 PolarHBondContact O-N 3.21Å; S90-E93 PolarHBondContact O-N 3.06Å; S90-E93 WeakPolarHBondContact OG-CB 3.38Å; S90-E93 VanDerWaalsContact OG-CG 3.29Å; S90-E93 WeakPolarHBondContact OG-CG 3.29Å; S90-E93 PolarHBondContact OG-OE2 3.16Å; S90-G94 WeakPolarHBondContact O-CA 3.42Å; S90-G94 PolarHBondContact O-N 3Å
91	E	79.6	Confident	88	Confident	189 Å²	189	70.5 Å²	70.5	88%	0.883	38%	0.382	S	S	*	.	H	α-helix	trans	-60.1	-38.6	-176.7	-72.3	-172.8	169	0	0	113.1	S95	E91-S95 PolarHBondContact O-N 3.35Å
92	E	78.5	Confident	88.1	Confident	177 Å²	177	68 Å²	68	83%	0.827	37%	0.37	S	S	*	.	H	α-helix	trans	-69	-49.7	-179.6	-68.3	-176	173.4	0	0	111.7	S90 G94 S95	S90-E92 VanDerWaalsContact C-N 3.32Å; S90-E92 PolarHBondContact O-N 3.21Å; E92-G94 VanDerWaalsContact C-N 3.29Å; E92-G94 PolarHBondContact O-N 3.32Å; E92-S95 PolarHBondContact O-N 3.44Å
93	E	82.1	Confident	88.3	Confident	98 Å²	98	64.3 Å²	64.3	46%	0.458	35%	0.353	S	S	.	.	H	α-helix	trans	-65.4	-35.9	175.9	-66.1	171.9	144	0	0	111.3	S90 S95 E96 M97	S90-E93 PolarHBondContact O-N 3.06Å; S90-E93 WeakPolarHBondContact OG-CB 3.38Å; S90-E93 VanDerWaalsContact OG-CG 3.29Å; S90-E93 WeakPolarHBondContact OG-CG 3.29Å; S90-E93 PolarHBondContact OG-OE2 3.16Å; E93-S95 PolarHBondContact O-N 2.95Å; E93-E96 PolarHBondContact O-N 3.06Å; E93-M97 WeakPolarHBondContact O-CG 3.39Å; E93-M97 PolarHBondContact O-N 2.96Å; E93-M97 VanDerWaalsContact O-N 3.07Å
94	G	87.3	Confident	88.6	Confident	7 Å²	7	63.8 Å²	63.8	7%	0.072	35%	0.35	C	S	.	.	H	α-helix	trans	-62.2	-41.6	178.2	0	0	0	0	0	112.2	S90 E92 E96 M97 V98	S90-G94 WeakPolarHBondContact O-CA 3.42Å; S90-G94 PolarHBondContact O-N 3Å; E92-G94 VanDerWaalsContact C-N 3.29Å; E92-G94 PolarHBondContact O-N 3.32Å; G94-E96 PolarHBondContact O-N 2.99Å; G94-M97 PolarHBondContact O-N 3.35Å; G94-V98 VanDerWaalsContact O-CG2 3.29Å; G94-V98 WeakPolarHBondContact O-CG2 3.37Å; G94-V98 PolarHBondContact O-N 2.92Å
95	S	88.7	Confident	88.8	Confident	84 Å²	84	63.6 Å²	63.6	59%	0.587	35%	0.349	S	S	*	.	H	α-helix	trans	-63.2	-39.5	178.8	-174.6	0	0	0	0	112.7	E91 E92 E93 S99	E91-S95 PolarHBondContact O-N 3.35Å; E92-S95 PolarHBondContact O-N 3.44Å; E93-S95 PolarHBondContact O-N 2.95Å; S95-S99 PolarHBondContact O-N 3.37Å
96	E	90.7	Very high	89.2	Confident	137 Å²	137	58.7 Å²	58.7	64%	0.64	32%	0.323	S	S	*	.	H	α-helix	trans	-66.5	-45.3	175.5	-173.1	172.8	-164.4	0	0	111.2	E93 G94 V98 S99 D100	E93-E96 PolarHBondContact O-N 3.06Å; G94-E96 PolarHBondContact O-N 2.99Å; E96-V98 PolarHBondContact O-N 3.34Å; E96-S99 WeakPolarHBondContact O-CB 3.43Å; E96-S99 PolarHBondContact O-N 3.43Å; E96-D100 PolarHBondContact O-N 3.49Å
97	M	92.2	Very high	89.7	Confident	41 Å²	41	52.8 Å²	52.8	20%	0.202	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-39.3	177.7	-69	-174.8	-175.3	0	0	112.9	I84 V89 E93 G94 S99 D100 V101	I84-M97 HydrophobicContact CD1-CB 3.67Å; I84-M97 HydrophobicContact CD1-SD 4.42Å; I84-M97 HydrophobicContact CG1-CB 4.08Å; V89-M97 HydrophobicContact CG1-CE 4.33Å; V89-M97 HydrophobicContact CG1-SD 4.44Å; V89-M97 HydrophobicContact CG2-SD 4.27Å; E93-M97 WeakPolarHBondContact O-CG 3.39Å; E93-M97 PolarHBondContact O-N 2.96Å; E93-M97 VanDerWaalsContact O-N 3.07Å; G94-M97 PolarHBondContact O-N 3.35Å; M97-S99 VanDerWaalsContact C-N 3.34Å; M97-D100 PolarHBondContact O-N 2.96Å; M97-V101 WeakPolarHBondContact O-CB 3.35Å; M97-V101 VanDerWaalsContact O-CG2 3.27Å; M97-V101 WeakPolarHBondContact O-CG2 3.47Å; M97-V101 PolarHBondContact O-N 3.47Å
98	V	94.5	Very high	90.3	Very high	6 Å²	6	50.3 Å²	50.3	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-45.8	174.7	171	0	0	0	0	110.3	I84 G94 E96 D100 V101 E102	I84-V98 HydrophobicContact CB-CG2 3.81Å; I84-V98 HydrophobicContact CG1-CB 4.49Å; I84-V98 HydrophobicContact CG1-CG2 3.51Å; I84-V98 HydrophobicContact CG2-CG2 4.21Å; G94-V98 VanDerWaalsContact O-CG2 3.29Å; G94-V98 WeakPolarHBondContact O-CG2 3.37Å; G94-V98 PolarHBondContact O-N 2.92Å; E96-V98 PolarHBondContact O-N 3.34Å; V98-D100 VanDerWaalsContact C-N 3.33Å; V98-D100 PolarHBondContact O-N 3.45Å; V98-V101 PolarHBondContact O-N 2.95Å; V98-E102 WeakPolarHBondContact O-CB 3.22Å; V98-E102 PolarHBondContact O-N 3.21Å
99	S	94.4	Very high	90.9	Very high	49 Å²	49	47.1 Å²	47.1	34%	0.343	25%	0.249	S	C	.	.	H	α-helix	trans	-60.2	-41.6	177.5	-177.7	0	0	0	0	112.3	S95 E96 M97 S103 R136	S95-S99 PolarHBondContact O-N 3.37Å; E96-S99 WeakPolarHBondContact O-CB 3.43Å; E96-S99 PolarHBondContact O-N 3.43Å; M97-S99 VanDerWaalsContact C-N 3.34Å; S99-S103 VanDerWaalsContact O-CB 3.24Å; S99-S103 WeakPolarHBondContact O-CB 3.24Å; S99-S103 PolarHBondContact O-N 3.45Å; S99-S103 PolarHBondContact O-OG 3.38Å; S99-R136 PolarHBondContact OG-NH2 3.29Å
100	D	94.2	Very high	91.5	Very high	23 Å²	23	47.6 Å²	47.6	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-50.2	177	-80.1	0.9	0	0	0	112.1	E96 M97 V98 E102 S103 V104 R136 L139	E96-D100 PolarHBondContact O-N 3.49Å; M97-D100 PolarHBondContact O-N 2.96Å; V98-D100 VanDerWaalsContact C-N 3.33Å; V98-D100 PolarHBondContact O-N 3.45Å; D100-E102 PolarHBondContact O-N 3.37Å; D100-S103 PolarHBondContact O-N 2.63Å; D100-V104 WeakPolarHBondContact O-CB 3.21Å; D100-V104 VanDerWaalsContact O-CG2 3.26Å; D100-V104 WeakPolarHBondContact O-CG2 3.28Å; D100-V104 PolarHBondContact O-N 3.02Å; D100-R136 HydrophobicContact CB-CG 4.45Å; D100-R136 IonicContact OD1-CZ 3.09Å; D100-R136 IonicContact OD1-NE 2.7Å; D100-R136 PolarHBondContact OD1-NE 2.86Å; D100-R136 IonicContact OD1-NH2 2.67Å; D100-R136 PolarHBondContact OD1-NH2 3.03Å; D100-L139 HydrophobicContact CB-CD2 4.37Å
101	V	95.6	Very high	91.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-47.6	178.5	170.8	0	0	0	0	110.8	S80 L83 I84 M97 V98 S103 V104 I105 L126 L130	S80-V101 WeakPolarHBondContact OG-CG1 3.42Å; L83-V101 HydrophobicContact CD2-CG1 4.25Å; L83-V101 HydrophobicContact CD2-CG2 4.33Å; I84-V101 HydrophobicContact CD1-CG2 4.41Å; M97-V101 WeakPolarHBondContact O-CB 3.35Å; M97-V101 VanDerWaalsContact O-CG2 3.27Å; M97-V101 WeakPolarHBondContact O-CG2 3.47Å; M97-V101 PolarHBondContact O-N 3.47Å; V98-V101 PolarHBondContact O-N 2.95Å; V101-S103 VanDerWaalsContact C-N 3.33Å; V101-S103 PolarHBondContact O-N 2.78Å; V101-V104 PolarHBondContact O-N 2.98Å; V101-I105 HydrophobicContact CG1-CD1 3.83Å; V101-I105 WeakPolarHBondContact O-CG1 3.37Å; V101-I105 PolarHBondContact O-N 3.44Å; V101-L126 HydrophobicContact CG1-CD1 3.84Å; V101-L130 HydrophobicContact CG2-CD1 3.88Å; V101-L130 HydrophobicContact CG2-CD2 3.88Å; V101-L130 HydrophobicContact CG2-CG 4.38Å
102	E	96.1	Very high	92.4	Very high	18 Å²	18	43.2 Å²	43.2	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-43.2	179.4	-178.8	169.4	-171.9	0	0	111.1	L68 Q73 I76 H77 V98 D100 T106	L68-E102 HydrophobicContact CD1-CG 4.05Å; L68-E102 HydrophobicContact CD2-CG 4.49Å; Q73-E102 VanDerWaalsContact NE2-CG 3.28Å; Q73-E102 PolarHBondContact NE2-OE1 3.26Å; I76-E102 HydrophobicContact CG2-CG 4.03Å; H77-E102 IonicContact CE1-OE2 3.23Å; H77-E102 IonicContact CG-OE2 3.82Å; H77-E102 IonicContact ND1-OE1 3.24Å; H77-E102 IonicContact ND1-OE2 3.7Å; H77-E102 PolarHBondContact ND1-OE2 2.99Å; V98-E102 WeakPolarHBondContact O-CB 3.22Å; V98-E102 PolarHBondContact O-N 3.21Å; D100-E102 PolarHBondContact O-N 3.37Å; E102-T106 VanDerWaalsContact O-CB 3.24Å; E102-T106 WeakPolarHBondContact O-CB 3.37Å; E102-T106 PolarHBondContact O-N 2.89Å; E102-T106 PolarHBondContact O-OG1 3.2Å
103	S	96.1	Very high	92.9	Very high	5 Å²	5	42.1 Å²	42.1	4%	0.035	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-45.4	176.3	-64.2	0	0	0	0	112.2	W64 S99 D100 V101 T106 F107 R136	W64-S103 WeakPolarHBondContact CH2-O 3.24Å; W64-S103 WeakPolarHBondContact CZ3-O 3.39Å; S99-S103 VanDerWaalsContact O-CB 3.24Å; S99-S103 WeakPolarHBondContact O-CB 3.24Å; S99-S103 PolarHBondContact O-N 3.45Å; S99-S103 PolarHBondContact O-OG 3.38Å; D100-S103 PolarHBondContact O-N 2.63Å; V101-S103 VanDerWaalsContact C-N 3.33Å; V101-S103 PolarHBondContact O-N 2.78Å; S103-T106 PolarHBondContact O-N 2.8Å; S103-F107 WeakPolarHBondContact O-CB 3.38Å; S103-F107 PolarHBondContact O-N 3.45Å; S103-R136 PolarHBondContact OG-NH1 3.49Å
104	V	96.8	Very high	93.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-48.1	179.8	166	0	0	0	0	111.3	D100 V101 Y108 L126 R136 L139 Y140 F143	D100-V104 WeakPolarHBondContact O-CB 3.21Å; D100-V104 VanDerWaalsContact O-CG2 3.26Å; D100-V104 WeakPolarHBondContact O-CG2 3.28Å; D100-V104 PolarHBondContact O-N 3.02Å; V101-V104 PolarHBondContact O-N 2.98Å; V104-Y108 WeakPolarHBondContact O-CB 3.38Å; V104-Y108 PolarHBondContact O-N 2.91Å; V104-L126 HydrophobicContact CG1-CD1 4.18Å; V104-L126 HydrophobicContact CG1-CD2 3.89Å; V104-R136 HydrophobicContact CG2-CG 4.34Å; V104-L139 HydrophobicContact CG2-CD2 4.13Å; V104-L139 HydrophobicContact CG2-CG 4.22Å; V104-Y140 HydrophobicContact CG1-CD2 4.16Å; V104-F143 HydrophobicContact CG1-CB 4.4Å; V104-F143 HydrophobicContact CG1-CD1 3.83Å; V104-F143 HydrophobicContact CG1-CE1 4.33Å; V104-F143 HydrophobicContact CG1-CG 4.14Å
105	I	96.4	Very high	93.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-47.5	179.2	-65.9	171.8	0	0	0	110.2	I76 V101 F107 Y108 C109 F116 L122 P123 L126	I76-I105 HydrophobicContact CD1-CG2 4.1Å; I76-I105 HydrophobicContact CG1-CG2 4.13Å; I76-I105 HydrophobicContact CG2-CB 3.92Å; I76-I105 HydrophobicContact CG2-CD1 4.31Å; I76-I105 HydrophobicContact CG2-CG2 3.77Å; V101-I105 HydrophobicContact CG1-CD1 3.83Å; V101-I105 WeakPolarHBondContact O-CG1 3.37Å; V101-I105 PolarHBondContact O-N 3.44Å; I105-F107 PolarHBondContact O-N 3.14Å; I105-Y108 PolarHBondContact O-N 3.32Å; I105-C109 PolarHBondContact O-N 3.25Å; I105-C109 PolarHBondContact O-SG 3.5Å; I105-F116 HydrophobicContact CD1-CE2 4.44Å; I105-F116 HydrophobicContact CG2-CD2 3.58Å; I105-F116 HydrophobicContact CG2-CE2 3.8Å; I105-F116 HydrophobicContact CG2-CG 4.35Å; I105-L122 HydrophobicContact CG2-CD1 4.46Å; I105-P123 HydrophobicContact CD1-CG 4.16Å; I105-L126 HydrophobicContact CD1-CD1 4.11Å; I105-L126 HydrophobicContact CG1-CD1 3.84Å
106	T	96.2	Very high	93.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-48.2	-178.3	-56.2	0	0	0	0	111.3	W64 L68 L70 Q73 E102 S103 Y108 C109 K110	W64-T106 HydrophobicContact CH2-CG2 4.34Å; W64-T106 HydrophobicContact CZ2-CG2 4.02Å; L68-T106 HydrophobicContact CD2-CG2 3.86Å; L70-T106 HydrophobicContact CD1-CG2 3.84Å; L70-T106 HydrophobicContact CG-CG2 4.06Å; Q73-T106 PolarHBondContact NE2-OG1 3.4Å; Q73-T106 PolarHBondContact OE1-OG1 2.81Å; E102-T106 VanDerWaalsContact O-CB 3.24Å; E102-T106 WeakPolarHBondContact O-CB 3.37Å; E102-T106 PolarHBondContact O-N 2.89Å; E102-T106 PolarHBondContact O-OG1 3.2Å; S103-T106 PolarHBondContact O-N 2.8Å; T106-Y108 VanDerWaalsContact C-N 3.34Å; T106-Y108 PolarHBondContact O-N 3.43Å; T106-C109 PolarHBondContact O-N 2.94Å; T106-K110 HydrophobicContact CG2-CD 4.41Å; T106-K110 WeakPolarHBondContact O-CG 3.49Å; T106-K110 PolarHBondContact O-N 2.91Å
107	F	96.5	Very high	93.8	Very high	27 Å²	27	36.8 Å²	36.8	12%	0.118	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-38.6	178	-179.6	-119	0	0	0	112.3	S60 L61 W64 S103 I105 K110 S111 Y140	S60-F107 VanDerWaalsContact O-CZ 3.25Å; S60-F107 WeakPolarHBondContact O-CZ 3.21Å; L61-F107 HydrophobicContact CD2-CB 3.71Å; L61-F107 HydrophobicContact CD2-CD1 3.35Å; L61-F107 HydrophobicContact CD2-CD2 4.37Å; L61-F107 HydrophobicContact CD2-CE1 4.04Å; L61-F107 HydrophobicContact CD2-CG 3.55Å; L61-F107 HydrophobicContact CG-CD1 4.17Å; L61-F107 HydrophobicContact CG-CE1 4.46Å; W64-F107 HydrophobicContact CB-CD2 3.77Å; W64-F107 HydrophobicContact CB-CE2 3.69Å; W64-F107 HydrophobicContact CD2-CB 4.07Å; W64-F107 AromaticContact CD2-CD2 3.6Å; W64-F107 HydrophobicContact CD2-CD2 3.6Å; W64-F107 HydrophobicContact CD2-CE2 4.44Å; W64-F107 HydrophobicContact CD2-CG 4.13Å; W64-F107 HydrophobicContact CE3-CB 3.72Å; W64-F107 AromaticContact CE3-CD2 3.89Å; W64-F107 HydrophobicContact CE3-CD2 3.89Å; W64-F107 AromaticContact CE3-CG 3.95Å; W64-F107 HydrophobicContact CE3-CG 3.95Å; W64-F107 AromaticContact CG-CD2 3.55Å; W64-F107 HydrophobicContact CG-CD2 3.55Å; W64-F107 AromaticContact CG-CE2 3.96Å; W64-F107 HydrophobicContact CG-CE2 3.96Å; W64-F107 HydrophobicContact CG-CG 4.48Å; W64-F107 HydrophobicContact CH2-CB 4.05Å; W64-F107 HydrophobicContact CZ2-CB 4.41Å; W64-F107 HydrophobicContact CZ3-CB 3.7Å; W64-F107 HydrophobicContact CZ3-CG 4.43Å; S103-F107 WeakPolarHBondContact O-CB 3.38Å; S103-F107 PolarHBondContact O-N 3.45Å; I105-F107 PolarHBondContact O-N 3.14Å; F107-K110 PolarHBondContact O-N 3.5Å; F107-S111 VanDerWaalsContact O-CB 3.26Å; F107-S111 WeakPolarHBondContact O-CB 3.42Å; F107-S111 PolarHBondContact O-N 3.41Å; F107-S111 PolarHBondContact O-OG 3.04Å; F107-Y140 HydrophobicContact CD1-CD1 4.42Å; F107-Y140 AromaticContact CD1-CD2 3.75Å; F107-Y140 HydrophobicContact CD1-CD2 3.75Å; F107-Y140 HydrophobicContact CD1-CE1 4Å; F107-Y140 AromaticContact CD1-CE2 3.27Å; F107-Y140 HydrophobicContact CD1-CE2 3.27Å; F107-Y140 HydrophobicContact CD1-CG 4.3Å; F107-Y140 AromaticContact CD1-CZ 3.4Å; F107-Y140 HydrophobicContact CE1-CD1 4.28Å; F107-Y140 HydrophobicContact CE1-CD2 4.37Å; F107-Y140 AromaticContact CE1-CE1 3.63Å; F107-Y140 HydrophobicContact CE1-CE1 3.63Å; F107-Y140 AromaticContact CE1-CE2 3.76Å; F107-Y140 HydrophobicContact CE1-CE2 3.76Å; F107-Y140 AromaticContact CE1-CZ 3.32Å; F107-Y140 WeakPolarHBondContact CE1-OH 3.37Å; F107-Y140 HydrophobicContact CG-CE2 4.36Å
108	Y	94.9	Very high	93.5	Very high	12 Å²	12	37.6 Å²	37.6	5%	0.047	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-49.3	174.6	-176.7	-98.5	0	0	0	112	V104 I105 T106 K110 S111 R112 I114 L122 F143 Y144 M147	V104-Y108 WeakPolarHBondContact O-CB 3.38Å; V104-Y108 PolarHBondContact O-N 2.91Å; I105-Y108 PolarHBondContact O-N 3.32Å; T106-Y108 VanDerWaalsContact C-N 3.34Å; T106-Y108 PolarHBondContact O-N 3.43Å; Y108-K110 PolarHBondContact O-N 3.47Å; Y108-S111 PolarHBondContact O-N 2.99Å; Y108-S111 PolarHBondContact O-OG 2.79Å; Y108-S111 VanDerWaalsContact O-OG 3.06Å; Y108-R112 HydrophobicContact CD2-CG 4.03Å; Y108-R112 HydrophobicContact CE1-CG 4.27Å; Y108-R112 HydrophobicContact CE2-CG 3.75Å; Y108-R112 HydrophobicContact CG-CG 4.41Å; Y108-R112 WeakPolarHBondContact O-CB 3.2Å; Y108-R112 WeakPolarHBondContact O-CG 3.4Å; Y108-R112 PolarHBondContact O-N 3.42Å; Y108-I114 HydrophobicContact CE1-CD1 4Å; Y108-L122 HydrophobicContact CD1-CD1 4.18Å; Y108-L122 HydrophobicContact CE1-CD1 4.46Å; Y108-F143 HydrophobicContact CD1-CE1 4.14Å; Y108-F143 HydrophobicContact CD1-CZ 4.38Å; Y108-F143 HydrophobicContact CD2-CD1 4.36Å; Y108-F143 AromaticContact CD2-CE1 3.64Å; Y108-F143 HydrophobicContact CD2-CE1 3.64Å; Y108-F143 HydrophobicContact CE2-CE1 4.21Å; Y108-F143 AromaticContact CG-CE1 3.6Å; Y108-F143 HydrophobicContact CG-CE1 3.6Å; Y108-F143 HydrophobicContact CG-CZ 4.29Å; Y108-Y144 HydrophobicContact CD2-CD2 4.18Å; Y108-Y144 HydrophobicContact CE2-CD2 4.06Å; Y108-M147 HydrophobicContact CE1-CE 4.11Å; Y108-M147 HydrophobicContact CE2-CB 4.23Å; Y108-M147 HydrophobicContact CE2-CG 4.31Å; Y108-M147 WeakPolarHBondContact OH-CE 3.48Å
109	C	94.2	Very high	92.9	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.02	23%	0.233	C	C	.	.	H	α-helix	trans	-58.5	-45.4	177.2	-75.1	0	0	0	0	112	L70 I105 T106 N113 I114	L70-C109 HydrophobicContact CD1-CB 3.6Å; I105-C109 PolarHBondContact O-N 3.25Å; I105-C109 PolarHBondContact O-SG 3.5Å; T106-C109 PolarHBondContact O-N 2.94Å; C109-N113 WeakPolarHBondContact O-CA 3.45Å; C109-N113 PolarHBondContact O-N 3.08Å; C109-I114 WeakPolarHBondContact CA-O 3.27Å; C109-I114 VanDerWaalsContact CB-O 3.22Å; C109-I114 WeakPolarHBondContact CB-O 3.27Å; C109-I114 PolarHBondContact O-N 3.49Å
110	K	93.8	Very high	92.5	Very high	65 Å²	65	44.2 Å²	44.2	28%	0.283	23%	0.231	S	C	.	.	H	α-helix	trans	-61.3	-50.9	175	-76.1	-176.2	169.4	-171.7	0	112.8	V67 D69 L70 T106 F107 Y108 R112 N113	V67-K110 PolarHBondContact O-NZ 3.07Å; D69-K110 WeakPolarHBondContact OD1-CE 3.29Å; D69-K110 IonicContact OD1-NZ 2.95Å; D69-K110 PolarHBondContact OD1-NZ 2.94Å; D69-K110 IonicContact OD2-NZ 3.88Å; L70-K110 HydrophobicContact CD2-CG 3.95Å; L70-K110 HydrophobicContact CG-CG 4.38Å; T106-K110 HydrophobicContact CG2-CD 4.41Å; T106-K110 WeakPolarHBondContact O-CG 3.49Å; T106-K110 PolarHBondContact O-N 2.91Å; F107-K110 PolarHBondContact O-N 3.5Å; Y108-K110 PolarHBondContact O-N 3.47Å; K110-R112 VanDerWaalsContact C-N 3.29Å; K110-R112 PolarHBondContact O-N 3.39Å; K110-N113 PolarHBondContact O-N 3.38Å
111	S	91.6	Very high	92.3	Very high	56 Å²	56	43.7 Å²	43.7	39%	0.392	23%	0.229	S	C	.	.	H	α-helix	trans	-68.9	-26.6	-174.9	59.8	0	0	0	0	113.6	F107 Y108	F107-S111 VanDerWaalsContact O-CB 3.26Å; F107-S111 WeakPolarHBondContact O-CB 3.42Å; F107-S111 PolarHBondContact O-N 3.41Å; F107-S111 PolarHBondContact O-OG 3.04Å; Y108-S111 PolarHBondContact O-N 2.99Å; Y108-S111 PolarHBondContact O-OG 2.79Å; Y108-S111 VanDerWaalsContact O-OG 3.06Å
112	R	89.3	Confident	92	Very high	100 Å²	100	44.1 Å²	44.1	38%	0.377	23%	0.231	S	C	.	.	H	α-helix	trans	-102.5	-6	-179.4	-57.4	-59.4	-69.7	151.4	-3	113.9	Y108 K110 I114	Y108-R112 HydrophobicContact CD2-CG 4.03Å; Y108-R112 HydrophobicContact CE1-CG 4.27Å; Y108-R112 HydrophobicContact CE2-CG 3.75Å; Y108-R112 HydrophobicContact CG-CG 4.41Å; Y108-R112 WeakPolarHBondContact O-CB 3.2Å; Y108-R112 WeakPolarHBondContact O-CG 3.4Å; Y108-R112 PolarHBondContact O-N 3.42Å; K110-R112 VanDerWaalsContact C-N 3.29Å; K110-R112 PolarHBondContact O-N 3.39Å; R112-I114 VanDerWaalsContact C-N 3.31Å; R112-I114 HydrophobicContact CB-CD1 3.63Å; R112-I114 HydrophobicContact CB-CG1 3.83Å; R112-I114 HydrophobicContact CG-CD1 4.46Å
113	N	90.4	Very high	91.8	Very high	154 Å²	154	43.7 Å²	43.7	82%	0.824	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	48	-173.5	-166.5	50.8	0	0	0	111.8	C109 K110	C109-N113 WeakPolarHBondContact O-CA 3.45Å; C109-N113 PolarHBondContact O-N 3.08Å; K110-N113 PolarHBondContact O-N 3.38Å
114	I	90.1	Very high	91.7	Very high	67 Å²	67	46.9 Å²	46.9	34%	0.344	24%	0.244	S	C	.	.			trans	-113.6	132.6	178.9	-62.6	171.3	0	0	0	108.3	Y108 C109 R112 L120	Y108-I114 HydrophobicContact CE1-CD1 4Å; C109-I114 WeakPolarHBondContact CA-O 3.27Å; C109-I114 VanDerWaalsContact CB-O 3.22Å; C109-I114 WeakPolarHBondContact CB-O 3.27Å; C109-I114 PolarHBondContact O-N 3.49Å; R112-I114 VanDerWaalsContact C-N 3.31Å; R112-I114 HydrophobicContact CB-CD1 3.63Å; R112-I114 HydrophobicContact CB-CG1 3.83Å; R112-I114 HydrophobicContact CG-CD1 4.46Å; I114-L120 HydrophobicContact CG2-CD1 4.49Å
115	T	92.9	Very high	91.6	Very high	95 Å²	95	46.9 Å²	46.9	58%	0.583	25%	0.245	S	C	*	.			trans	-80.5	129.6	173.4	-51.4	0	0	0	0	109.9	E72	E72-T115 WeakPolarHBondContact OE1-CA 3.41Å
116	F	93.4	Very high	91.5	Very high	5 Å²	5	46.9 Å²	46.9	2%	0.022	25%	0.245	C	C	.	.			trans	-74.9	128.2	176.5	-176.9	-93.5	0	0	0	110.4	E72 L75 I76 R79 I105 L120 L122 P123	E72-F116 HydrophobicContact CG-CB 3.75Å; E72-F116 PolarHBondContact OE1-N 2.89Å; L75-F116 HydrophobicContact CD2-CD1 3.9Å; L75-F116 HydrophobicContact CD2-CE1 4.11Å; L75-F116 HydrophobicContact CG-CD1 4.07Å; L75-F116 HydrophobicContact CG-CE1 3.95Å; I76-F116 HydrophobicContact CD1-CB 4.05Å; I76-F116 HydrophobicContact CD1-CG 4.26Å; I76-F116 HydrophobicContact CG1-CB 3.95Å; I76-F116 HydrophobicContact CG1-CD1 3.56Å; I76-F116 HydrophobicContact CG1-CD2 4.29Å; I76-F116 HydrophobicContact CG1-CE1 4.09Å; I76-F116 HydrophobicContact CG1-CG 3.67Å; R79-F116 HydrophobicContact CB-CE1 4.48Å; R79-F116 HydrophobicContact CB-CZ 4.3Å; R79-F116 HydrophobicContact CG-CE1 4.07Å; R79-F116 HydrophobicContact CG-CZ 4.17Å; I105-F116 HydrophobicContact CD1-CE2 4.44Å; I105-F116 HydrophobicContact CG2-CD2 3.58Å; I105-F116 HydrophobicContact CG2-CE2 3.8Å; I105-F116 HydrophobicContact CG2-CG 4.35Å; F116-L120 HydrophobicContact CD2-CD1 4.27Å; F116-L122 HydrophobicContact CD2-CD1 4.09Å; F116-L122 HydrophobicContact CE2-CB 4.43Å; F116-L122 HydrophobicContact CE2-CD1 4.27Å; F116-P123 HydrophobicContact CE2-CG 4.36Å; F116-P123 HydrophobicContact CZ-CG 4.1Å
117	T	90.1	Very high	91.3	Very high	47 Å²	47	49.2 Å²	49.2	29%	0.288	26%	0.255	S	S	.	.			trans	-126	156.1	176.8	79.5	0	0	0	0	111	E119 L120	T117-E119 WeakPolarHBondContact CB-OE2 3.45Å; T117-E119 PolarHBondContact O-N 3.39Å; T117-E119 VanDerWaalsContact O-N 3.13Å; T117-E119 PolarHBondContact OG1-OE2 3.32Å; T117-L120 PolarHBondContact O-N 3.15Å; T117-L120 VanDerWaalsContact O-N 3.12Å
118	P	85.4	Confident	91.1	Very high	58 Å²	58	48.3 Å²	48.3	38%	0.377	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.9	-178.6	-22.6	32.9	0	0	0	114.9	L75 R79	L75-P118 HydrophobicContact CD1-CG 4.27Å; L75-P118 HydrophobicContact CD2-CG 3.81Å; R79-P118 PolarHBondContact NH2-O 3.35Å; R79-P118 VanDerWaalsContact NH2-O 3.13Å
119	E	83.2	Confident	91.1	Very high	135 Å²	135	47.8 Å²	47.8	63%	0.631	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-15.8	-179	-53.6	72.4	-151.5	0	0	112.5	T117 S121	T117-E119 WeakPolarHBondContact CB-OE2 3.45Å; T117-E119 PolarHBondContact O-N 3.39Å; T117-E119 VanDerWaalsContact O-N 3.13Å; T117-E119 PolarHBondContact OG1-OE2 3.32Å; E119-S121 PolarHBondContact O-N 3.42Å
120	L	85.6	Confident	91	Very high	58 Å²	58	48.5 Å²	48.5	30%	0.304	25%	0.253	S	S	.	.			trans	-72.6	126.5	178.4	-64.7	179.1	0	0	0	111.1	I114 F116 T117 L122	I114-L120 HydrophobicContact CG2-CD1 4.49Å; F116-L120 HydrophobicContact CD2-CD1 4.27Å; T117-L120 PolarHBondContact O-N 3.15Å; T117-L120 VanDerWaalsContact O-N 3.12Å; L120-L122 HydrophobicContact CB-CG 4.12Å; L120-L122 HydrophobicContact CD1-CD1 4.33Å; L120-L122 PolarHBondContact O-N 3.13Å; L120-L122 VanDerWaalsContact O-N 3.08Å
121	S	89.1	Confident	90.7	Very high	12 Å²	12	47 Å²	47	8%	0.084	26%	0.256	C	S	.	.			trans	-78.7	15.2	-179.7	-38.1	0	0	0	0	114.6	E119 P123 H124 L125 N193 G196	E119-S121 PolarHBondContact O-N 3.42Å; S121-P123 VanDerWaalsContact C-CD 3.5Å; S121-H124 WeakPolarHBondContact O-CB 3.24Å; S121-H124 PolarHBondContact O-N 3.12Å; S121-L125 PolarHBondContact O-N 2.71Å; S121-N193 PolarHBondContact OG-OD1 3Å; S121-G196 WeakPolarHBondContact CB-O 3.46Å
122	L	91	Very high	90.6	Very high	9 Å²	9	44.7 Å²	44.7	5%	0.047	24%	0.239	C	C	.	.	H	α-helix	trans	-55.1	-43.4	-176.2	-50.4	-176.3	0	0	0	113.5	I105 Y108 F116 L120 H124 L125 L126 F143 M147	I105-L122 HydrophobicContact CG2-CD1 4.46Å; Y108-L122 HydrophobicContact CD1-CD1 4.18Å; Y108-L122 HydrophobicContact CE1-CD1 4.46Å; F116-L122 HydrophobicContact CD2-CD1 4.09Å; F116-L122 HydrophobicContact CE2-CB 4.43Å; F116-L122 HydrophobicContact CE2-CD1 4.27Å; L120-L122 HydrophobicContact CB-CG 4.12Å; L120-L122 HydrophobicContact CD1-CD1 4.33Å; L120-L122 PolarHBondContact O-N 3.13Å; L120-L122 VanDerWaalsContact O-N 3.08Å; L122-H124 VanDerWaalsContact C-N 3.26Å; L122-H124 PolarHBondContact O-N 3Å; L122-L125 PolarHBondContact O-N 2.96Å; L122-L126 PolarHBondContact O-N 3.48Å; L122-F143 HydrophobicContact CB-CE2 4.21Å; L122-F143 HydrophobicContact CB-CZ 4.15Å; L122-F143 HydrophobicContact CD1-CZ 4.36Å; L122-F143 HydrophobicContact CD2-CE2 4.33Å; L122-F143 HydrophobicContact CD2-CZ 4.01Å; L122-F143 HydrophobicContact CG-CZ 4.38Å; L122-M147 HydrophobicContact CD2-CE 3.49Å; L122-M147 VanDerWaalsContact CD2-CE 3.49Å; L122-M147 HydrophobicContact CD2-SD 3.6Å
123	P	91.9	Very high	90.6	Very high	10 Å²	10	47.8 Å²	47.8	7%	0.065	26%	0.255	C	S	.	.	H	α-helix	trans	-61.6	-36.1	177.1	-23.2	35.2	0	0	0	112.4	R79 L83 I105 F116 S121 L125 L126 K127	R79-P123 HydrophobicContact CB-CG 4.23Å; L83-P123 HydrophobicContact CD2-CB 4.31Å; L83-P123 VanDerWaalsContact CD2-O 3.31Å; L83-P123 WeakPolarHBondContact CD2-O 3.49Å; I105-P123 HydrophobicContact CD1-CG 4.16Å; F116-P123 HydrophobicContact CE2-CG 4.36Å; F116-P123 HydrophobicContact CZ-CG 4.1Å; S121-P123 VanDerWaalsContact C-CD 3.5Å; P123-L125 VanDerWaalsContact C-N 3.33Å; P123-L125 PolarHBondContact O-N 2.95Å; P123-L126 PolarHBondContact O-N 2.86Å; P123-K127 PolarHBondContact O-N 2.75Å
124	H	92.4	Very high	90.7	Very high	71 Å²	71	41.5 Å²	41.5	33%	0.329	22%	0.222	S	C	.	.	H	α-helix	trans	-67.1	-34.5	178.4	-61.2	-62.7	0	0	0	111.9	S121 L122 L126 K127 P128 S200	S121-H124 WeakPolarHBondContact O-CB 3.24Å; S121-H124 PolarHBondContact O-N 3.12Å; L122-H124 VanDerWaalsContact C-N 3.26Å; L122-H124 PolarHBondContact O-N 3Å; H124-L126 VanDerWaalsContact C-N 3.28Å; H124-L126 PolarHBondContact O-N 3.06Å; H124-K127 WeakPolarHBondContact O-CB 3.29Å; H124-K127 PolarHBondContact O-N 3.18Å; H124-P128 WeakPolarHBondContact O-CD 3.43Å; H124-S200 WeakPolarHBondContact O-CB 3.33Å; H124-S200 PolarHBondContact O-OG 3.21Å
125	L	94.9	Very high	90.9	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-67.4	-27.5	174.1	-68.9	173	0	0	0	113.3	S121 L122 P123 P128 F143 I146 M147 I151 G196 S197 L198 W212	S121-L125 PolarHBondContact O-N 2.71Å; L122-L125 PolarHBondContact O-N 2.96Å; P123-L125 VanDerWaalsContact C-N 3.33Å; P123-L125 PolarHBondContact O-N 2.95Å; L125-P128 WeakPolarHBondContact O-CD 3.49Å; L125-F143 HydrophobicContact CB-CD2 4.33Å; L125-F143 HydrophobicContact CB-CE2 4.27Å; L125-F143 HydrophobicContact CD1-CE2 4.43Å; L125-I146 HydrophobicContact CD2-CG2 4.2Å; L125-M147 HydrophobicContact CD1-CG 4.39Å; L125-M147 HydrophobicContact CD1-SD 3.3Å; L125-M147 WeakPolarHBondContact CD1-SD 3.09Å; L125-I151 HydrophobicContact CD1-CD1 4.03Å; L125-I151 HydrophobicContact CD1-CG1 3.98Å; L125-I151 HydrophobicContact CD2-CD1 3.96Å; L125-G196 WeakPolarHBondContact CD1-O 3.44Å; L125-S197 VanDerWaalsContact CD2-C 3.5Å; L125-S197 WeakPolarHBondContact CD2-O 3.45Å; L125-L198 HydrophobicContact CD2-CD1 4.4Å; L125-L198 HydrophobicContact CD2-CG 4.21Å; L125-W212 HydrophobicContact CD2-CH2 4.08Å; L125-W212 HydrophobicContact CD2-CZ2 4Å; L125-W212 WeakPolarHBondContact O-CH2 3.36Å
126	L	95	Very high	90.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-77.1	-26.9	176.3	-69.7	167.7	0	0	0	112.1	L83 V101 V104 I105 L122 P123 H124 L129 L130 L139 F143	L83-L126 HydrophobicContact CD2-CB 4.39Å; V101-L126 HydrophobicContact CG1-CD1 3.84Å; V104-L126 HydrophobicContact CG1-CD1 4.18Å; V104-L126 HydrophobicContact CG1-CD2 3.89Å; I105-L126 HydrophobicContact CD1-CD1 4.11Å; I105-L126 HydrophobicContact CG1-CD1 3.84Å; L122-L126 PolarHBondContact O-N 3.48Å; P123-L126 PolarHBondContact O-N 2.86Å; H124-L126 VanDerWaalsContact C-N 3.28Å; H124-L126 PolarHBondContact O-N 3.06Å; L126-L129 HydrophobicContact CD2-CD1 4.31Å; L126-L129 WeakPolarHBondContact O-CB 3.49Å; L126-L129 PolarHBondContact O-N 2.87Å; L126-L130 WeakPolarHBondContact O-CG 3.09Å; L126-L130 PolarHBondContact O-N 3.33Å; L126-L139 HydrophobicContact CD2-CD1 3.95Å; L126-L139 HydrophobicContact CD2-CG 4.2Å; L126-F143 HydrophobicContact CD2-CB 3.82Å; L126-F143 HydrophobicContact CD2-CD2 3.7Å; L126-F143 HydrophobicContact CD2-CE2 4.5Å; L126-F143 HydrophobicContact CD2-CG 3.86Å; L126-F143 HydrophobicContact CG-CD2 3.92Å; L126-F143 HydrophobicContact CG-CE2 4.31Å
127	K	91.5	Very high	91	Very high	49 Å²	49	42.7 Å²	42.7	21%	0.213	23%	0.225	C	C	.	.	H	α-helix	trans	-49.6	-50.3	-177.3	-169.1	-177.5	175.7	-172.6	0	113.8	L83 L87 P123 H124 L129	L83-K127 HydrophobicContact CD1-CB 3.78Å; L83-K127 HydrophobicContact CD1-CD 4.25Å; L83-K127 HydrophobicContact CD1-CG 3.91Å; L87-K127 HydrophobicContact CD2-CG 4.15Å; P123-K127 PolarHBondContact O-N 2.75Å; H124-K127 WeakPolarHBondContact O-CB 3.29Å; H124-K127 PolarHBondContact O-N 3.18Å; K127-L129 VanDerWaalsContact C-N 3.33Å; K127-L129 PolarHBondContact O-N 3.14Å
128	P	93.2	Very high	91.2	Very high	8 Å²	8	41.6 Å²	41.6	5%	0.052	22%	0.217	C	C	.	.	H	α-helix	trans	-71.7	-30.5	-179	-17.5	35.1	0	0	0	112.1	W48 H124 L125 G131 T208 W212	W48-P128 HydrophobicContact CH2-CB 3.91Å; W48-P128 HydrophobicContact CZ3-CB 4.13Å; H124-P128 WeakPolarHBondContact O-CD 3.43Å; L125-P128 WeakPolarHBondContact O-CD 3.49Å; P128-G131 PolarHBondContact O-N 2.98Å; P128-T208 HydrophobicContact CB-CG2 4.16Å; P128-T208 HydrophobicContact CG-CG2 3.53Å; P128-W212 HydrophobicContact CB-CD2 4.36Å; P128-W212 HydrophobicContact CB-CE3 4.12Å; P128-W212 HydrophobicContact CB-CH2 4.41Å; P128-W212 HydrophobicContact CB-CZ3 4.12Å; P128-W212 HydrophobicContact CG-CD2 4.35Å; P128-W212 HydrophobicContact CG-CE3 4.36Å; P128-W212 HydrophobicContact CG-CH2 3.91Å; P128-W212 HydrophobicContact CG-CZ2 3.92Å; P128-W212 HydrophobicContact CG-CZ3 4.13Å
129	L	94.6	Very high	91.7	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-70.8	-32.5	179.5	-61.1	173.8	0	0	0	112.4	W48 L126 K127 G131 L132 L139 C142 F143 I146 W212	W48-L129 HydrophobicContact CE3-CD2 3.73Å; W48-L129 HydrophobicContact CZ3-CD2 3.77Å; L126-L129 HydrophobicContact CD2-CD1 4.31Å; L126-L129 WeakPolarHBondContact O-CB 3.49Å; L126-L129 PolarHBondContact O-N 2.87Å; K127-L129 VanDerWaalsContact C-N 3.33Å; K127-L129 PolarHBondContact O-N 3.14Å; L129-G131 PolarHBondContact O-N 3.22Å; L129-L132 HydrophobicContact CD2-CD1 4.21Å; L129-L132 VanDerWaalsContact O-CB 3.29Å; L129-L132 WeakPolarHBondContact O-CB 3.46Å; L129-L132 PolarHBondContact O-N 3.19Å; L129-L132 VanDerWaalsContact O-N 3.08Å; L129-L139 HydrophobicContact CB-CD1 3.52Å; L129-L139 HydrophobicContact CD1-CD1 4.21Å; L129-C142 HydrophobicContact CD1-CB 4.16Å; L129-C142 HydrophobicContact CD2-CB 3.9Å; L129-F143 HydrophobicContact CD1-CB 4.06Å; L129-I146 HydrophobicContact CD1-CD1 4.04Å; L129-I146 HydrophobicContact CD2-CD1 4.04Å; L129-I146 HydrophobicContact CG-CD1 4.39Å; L129-W212 HydrophobicContact CD2-CZ3 4.28Å; L129-W212 HydrophobicContact CG-CZ3 4.27Å
130	L	91.7	Very high	92.4	Very high	17 Å²	17	33 Å²	33	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-33	175.7	-68.9	171.6	0	0	0	112.1	L83 I84 L87 V101 L126 L132 K133 L139	L83-L130 HydrophobicContact CD2-CD1 3.86Å; L83-L130 HydrophobicContact CG-CD1 4.36Å; I84-L130 HydrophobicContact CD1-CD1 3.61Å; L87-L130 HydrophobicContact CD1-CB 4.42Å; L87-L130 HydrophobicContact CD1-CD1 3.92Å; V101-L130 HydrophobicContact CG2-CD1 3.88Å; V101-L130 HydrophobicContact CG2-CD2 3.88Å; V101-L130 HydrophobicContact CG2-CG 4.38Å; L126-L130 WeakPolarHBondContact O-CG 3.09Å; L126-L130 PolarHBondContact O-N 3.33Å; L130-L132 PolarHBondContact O-N 3.1Å; L130-L132 VanDerWaalsContact O-N 3.15Å; L130-K133 PolarHBondContact O-N 3.14Å; L130-K133 VanDerWaalsContact O-N 3.13Å; L130-L139 HydrophobicContact CD2-CD2 4.11Å
131	G	87.6	Confident	92.9	Very high	33 Å²	33	30.4 Å²	30.4	34%	0.34	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.5	174.3	0	0	0	0	0	114	V41 P128 L129	V41-G131 VanDerWaalsContact CG1-O 3.29Å; V41-G131 WeakPolarHBondContact CG1-O 3.41Å; P128-G131 PolarHBondContact O-N 2.98Å; L129-G131 PolarHBondContact O-N 3.22Å
132	L	90	Very high	93.3	Very high	8 Å²	8	29.9 Å²	29.9	4%	0.042	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-9.9	178.5	-56.7	-179.7	0	0	0	113.8	R44 A45 W48 L129 L130 L134	R44-L132 HydrophobicContact CB-CD2 4Å; R44-L132 HydrophobicContact CG-CD2 3.66Å; A45-L132 HydrophobicContact CB-CB 4.26Å; W48-L132 HydrophobicContact CB-CD1 4.47Å; W48-L132 HydrophobicContact CD2-CD1 4.04Å; W48-L132 HydrophobicContact CE3-CD1 3.52Å; W48-L132 HydrophobicContact CG-CD1 4.48Å; W48-L132 HydrophobicContact CZ3-CD1 3.99Å; L129-L132 HydrophobicContact CD2-CD1 4.21Å; L129-L132 VanDerWaalsContact O-CB 3.29Å; L129-L132 WeakPolarHBondContact O-CB 3.46Å; L129-L132 PolarHBondContact O-N 3.19Å; L129-L132 VanDerWaalsContact O-N 3.08Å; L130-L132 PolarHBondContact O-N 3.1Å; L130-L132 VanDerWaalsContact O-N 3.15Å; L132-L134 HydrophobicContact CB-CD1 4.1Å; L132-L134 HydrophobicContact CB-CD2 4.4Å; L132-L134 HydrophobicContact CB-CG 3.77Å; L132-L134 HydrophobicContact CD1-CD1 3.94Å; L132-L134 HydrophobicContact CD1-CG 4.46Å; L132-L134 PolarHBondContact O-N 3.13Å
133	K	89.4	Confident	93.5	Very high	165 Å²	165	29.4 Å²	29.4	72%	0.717	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	41.9	-178	-56.8	-173.3	178.8	-170.1	0	113.2	L130	L130-K133 PolarHBondContact O-N 3.14Å; L130-K133 VanDerWaalsContact O-N 3.13Å
134	L	92.3	Very high	93.7	Very high	22 Å²	22	32.9 Å²	32.9	12%	0.115	17%	0.165	C	C	.	.			trans	-72.9	149.2	178.8	-66.5	171.8	0	0	0	111.1	A45 K49 L132 D138 L139	A45-L134 HydrophobicContact CB-CD2 3.9Å; K49-L134 HydrophobicContact CD-CD2 4.23Å; L132-L134 HydrophobicContact CB-CD1 4.1Å; L132-L134 HydrophobicContact CB-CD2 4.4Å; L132-L134 HydrophobicContact CB-CG 3.77Å; L132-L134 HydrophobicContact CD1-CD1 3.94Å; L132-L134 HydrophobicContact CD1-CG 4.46Å; L132-L134 PolarHBondContact O-N 3.13Å; L134-D138 HydrophobicContact CB-CB 4.09Å; L134-D138 HydrophobicContact CD1-CB 4.5Å; L134-D138 HydrophobicContact CD2-CB 4.29Å; L134-L139 HydrophobicContact CB-CB 4.48Å
135	P	93.2	Very high	93.8	Very high	73 Å²	73	30.1 Å²	30.1	47%	0.474	15%	0.154	S	C	.	.			trans	-62.3	151.2	166.4	28.8	-33.9	0	0	0	110.2	S137 D138 L139	P135-S137 PolarHBondContact O-N 3.21Å; P135-D138 HydrophobicContact CG-CB 3.9Å; P135-D138 WeakPolarHBondContact CG-OD2 3.5Å; P135-D138 PolarHBondContact O-N 2.79Å; P135-L139 PolarHBondContact O-N 3.14Å
136	R	94.3	Very high	93.9	Very high	89 Å²	89	30.1 Å²	30.1	34%	0.336	15%	0.154	S	C	.	.	H	α-helix	trans	-48.2	-38.4	-177.2	-169.4	-170.5	-64.7	-164.5	-9.2	114.4	L61 S99 D100 S103 V104 L139 Y140	L61-R136 HydrophobicContact CD1-CG 3.77Å; S99-R136 PolarHBondContact OG-NH2 3.29Å; D100-R136 HydrophobicContact CB-CG 4.45Å; D100-R136 IonicContact OD1-CZ 3.09Å; D100-R136 IonicContact OD1-NE 2.7Å; D100-R136 PolarHBondContact OD1-NE 2.86Å; D100-R136 IonicContact OD1-NH2 2.67Å; D100-R136 PolarHBondContact OD1-NH2 3.03Å; S103-R136 PolarHBondContact OG-NH1 3.49Å; V104-R136 HydrophobicContact CG2-CG 4.34Å; R136-L139 PolarHBondContact O-N 2.94Å; R136-Y140 PolarHBondContact O-N 3.3Å
137	S	93.9	Very high	93.8	Very high	31 Å²	31	31.4 Å²	31.4	22%	0.217	16%	0.16	C	C	.	.	H	α-helix	trans	-63.3	-47.4	177.5	55.9	0	0	0	0	112.7	D59 P135 Y140 N141	D59-S137 VanDerWaalsContact OD1-CB 3.23Å; D59-S137 WeakPolarHBondContact OD1-CB 3.49Å; P135-S137 PolarHBondContact O-N 3.21Å; S137-Y140 PolarHBondContact O-N 2.86Å; S137-N141 WeakPolarHBondContact O-CB 3.31Å; S137-N141 PolarHBondContact O-N 3.43Å; S137-N141 PolarHBondContact O-ND2 3.3Å
138	D	95.2	Very high	93.8	Very high	23 Å²	23	30.6 Å²	30.6	12%	0.123	16%	0.158	C	C	.	.	H	α-helix	trans	-68.9	-37.9	175.9	-75.8	-31	0	0	0	111.4	K49 L134 P135 Y140 N141 C142	K49-D138 WeakPolarHBondContact CE-OD1 3.47Å; K49-D138 IonicContact NZ-OD1 3.87Å; K49-D138 PolarHBondContact NZ-OD1 3.07Å; K49-D138 IonicContact NZ-OD2 2.74Å; K49-D138 PolarHBondContact NZ-OD2 3.29Å; L134-D138 HydrophobicContact CB-CB 4.09Å; L134-D138 HydrophobicContact CD1-CB 4.5Å; L134-D138 HydrophobicContact CD2-CB 4.29Å; P135-D138 HydrophobicContact CG-CB 3.9Å; P135-D138 WeakPolarHBondContact CG-OD2 3.5Å; P135-D138 PolarHBondContact O-N 2.79Å; D138-Y140 VanDerWaalsContact C-N 3.35Å; D138-Y140 PolarHBondContact O-N 2.72Å; D138-N141 PolarHBondContact O-N 2.9Å; D138-C142 WeakPolarHBondContact O-CB 3.49Å; D138-C142 PolarHBondContact O-N 3.14Å; D138-C142 PolarHBondContact O-SG 3.2Å; D138-C142 VanDerWaalsContact O-SG 3.36Å
139	L	96.6	Very high	93.8	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-56.7	-49.1	174.1	179.6	62	0	0	0	110.8	D100 V104 L126 L129 L130 L134 P135 R136 F143	D100-L139 HydrophobicContact CB-CD2 4.37Å; V104-L139 HydrophobicContact CG2-CD2 4.13Å; V104-L139 HydrophobicContact CG2-CG 4.22Å; L126-L139 HydrophobicContact CD2-CD1 3.95Å; L126-L139 HydrophobicContact CD2-CG 4.2Å; L129-L139 HydrophobicContact CB-CD1 3.52Å; L129-L139 HydrophobicContact CD1-CD1 4.21Å; L130-L139 HydrophobicContact CD2-CD2 4.11Å; L134-L139 HydrophobicContact CB-CB 4.48Å; P135-L139 PolarHBondContact O-N 3.14Å; R136-L139 PolarHBondContact O-N 2.94Å; L139-F143 VanDerWaalsContact O-CB 3.27Å; L139-F143 WeakPolarHBondContact O-CB 3.39Å; L139-F143 PolarHBondContact O-N 2.79Å
140	Y	96.6	Very high	93.9	Very high	9 Å²	9	33.4 Å²	33.4	4%	0.035	17%	0.17	C	C	.	.	H	α-helix	trans	-61.7	-46.4	174.7	177.4	-96	0	0	0	111.9	L61 V104 F107 R136 S137 D138 C142 F143 Y144	L61-Y140 HydrophobicContact CG-CG 4.41Å; V104-Y140 HydrophobicContact CG1-CD2 4.16Å; F107-Y140 HydrophobicContact CD1-CD1 4.42Å; F107-Y140 AromaticContact CD1-CD2 3.75Å; F107-Y140 HydrophobicContact CD1-CD2 3.75Å; F107-Y140 HydrophobicContact CD1-CE1 4Å; F107-Y140 AromaticContact CD1-CE2 3.27Å; F107-Y140 HydrophobicContact CD1-CE2 3.27Å; F107-Y140 HydrophobicContact CD1-CG 4.3Å; F107-Y140 AromaticContact CD1-CZ 3.4Å; F107-Y140 HydrophobicContact CE1-CD1 4.28Å; F107-Y140 HydrophobicContact CE1-CD2 4.37Å; F107-Y140 AromaticContact CE1-CE1 3.63Å; F107-Y140 HydrophobicContact CE1-CE1 3.63Å; F107-Y140 AromaticContact CE1-CE2 3.76Å; F107-Y140 HydrophobicContact CE1-CE2 3.76Å; F107-Y140 AromaticContact CE1-CZ 3.32Å; F107-Y140 WeakPolarHBondContact CE1-OH 3.37Å; F107-Y140 HydrophobicContact CG-CE2 4.36Å; R136-Y140 PolarHBondContact O-N 3.3Å; S137-Y140 PolarHBondContact O-N 2.86Å; D138-Y140 VanDerWaalsContact C-N 3.35Å; D138-Y140 PolarHBondContact O-N 2.72Å; Y140-C142 PolarHBondContact O-N 3.14Å; Y140-F143 PolarHBondContact O-N 2.89Å; Y140-Y144 HydrophobicContact CE1-CD2 4.43Å; Y140-Y144 HydrophobicContact CE1-CG 4.41Å; Y140-Y144 VanDerWaalsContact O-CB 3.23Å; Y140-Y144 WeakPolarHBondContact O-CB 3.43Å; Y140-Y144 PolarHBondContact O-N 3.33Å
141	N	96.1	Very high	94.1	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.027	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-43.8	-178	-74.3	-23.1	0	0	0	111.6	V54 G58 S60 S137 D138 A145	V54-N141 HydrophobicContact CB-CB 4.2Å; V54-N141 HydrophobicContact CG1-CB 4.24Å; G58-N141 PolarHBondContact O-ND2 3.37Å; G58-N141 VanDerWaalsContact O-ND2 3.15Å; S60-N141 PolarHBondContact OG-OD1 3.48Å; S137-N141 WeakPolarHBondContact O-CB 3.31Å; S137-N141 PolarHBondContact O-N 3.43Å; S137-N141 PolarHBondContact O-ND2 3.3Å; D138-N141 PolarHBondContact O-N 2.9Å; N141-A145 WeakPolarHBondContact O-CB 3.44Å; N141-A145 PolarHBondContact O-N 3.32Å
142	C	97	Very high	94.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-50.5	174.8	-72.4	0	0	0	0	111.5	L52 L129 D138 Y140 Y144 A145 I146	L52-C142 HydrophobicContact CD1-CB 3.85Å; L129-C142 HydrophobicContact CD1-CB 4.16Å; L129-C142 HydrophobicContact CD2-CB 3.9Å; D138-C142 WeakPolarHBondContact O-CB 3.49Å; D138-C142 PolarHBondContact O-N 3.14Å; D138-C142 PolarHBondContact O-SG 3.2Å; D138-C142 VanDerWaalsContact O-SG 3.36Å; Y140-C142 PolarHBondContact O-N 3.14Å; C142-Y144 VanDerWaalsContact C-N 3.35Å; C142-Y144 PolarHBondContact O-N 3.22Å; C142-A145 PolarHBondContact O-N 2.95Å; C142-I146 WeakPolarHBondContact O-CG1 3.46Å; C142-I146 PolarHBondContact O-N 3.23Å
143	F	96.9	Very high	94.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.4	-47.9	177.6	168.4	-102.1	0	0	0	111.9	V104 Y108 L122 L125 L126 L129 L139 Y140 A145 I146 M147	V104-F143 HydrophobicContact CG1-CB 4.4Å; V104-F143 HydrophobicContact CG1-CD1 3.83Å; V104-F143 HydrophobicContact CG1-CE1 4.33Å; V104-F143 HydrophobicContact CG1-CG 4.14Å; Y108-F143 HydrophobicContact CD1-CE1 4.14Å; Y108-F143 HydrophobicContact CD1-CZ 4.38Å; Y108-F143 HydrophobicContact CD2-CD1 4.36Å; Y108-F143 AromaticContact CD2-CE1 3.64Å; Y108-F143 HydrophobicContact CD2-CE1 3.64Å; Y108-F143 HydrophobicContact CE2-CE1 4.21Å; Y108-F143 AromaticContact CG-CE1 3.6Å; Y108-F143 HydrophobicContact CG-CE1 3.6Å; Y108-F143 HydrophobicContact CG-CZ 4.29Å; L122-F143 HydrophobicContact CB-CE2 4.21Å; L122-F143 HydrophobicContact CB-CZ 4.15Å; L122-F143 HydrophobicContact CD1-CZ 4.36Å; L122-F143 HydrophobicContact CD2-CE2 4.33Å; L122-F143 HydrophobicContact CD2-CZ 4.01Å; L122-F143 HydrophobicContact CG-CZ 4.38Å; L125-F143 HydrophobicContact CB-CD2 4.33Å; L125-F143 HydrophobicContact CB-CE2 4.27Å; L125-F143 HydrophobicContact CD1-CE2 4.43Å; L126-F143 HydrophobicContact CD2-CB 3.82Å; L126-F143 HydrophobicContact CD2-CD2 3.7Å; L126-F143 HydrophobicContact CD2-CE2 4.5Å; L126-F143 HydrophobicContact CD2-CG 3.86Å; L126-F143 HydrophobicContact CG-CD2 3.92Å; L126-F143 HydrophobicContact CG-CE2 4.31Å; L129-F143 HydrophobicContact CD1-CB 4.06Å; L139-F143 VanDerWaalsContact O-CB 3.27Å; L139-F143 WeakPolarHBondContact O-CB 3.39Å; L139-F143 PolarHBondContact O-N 2.79Å; Y140-F143 PolarHBondContact O-N 2.89Å; F143-A145 PolarHBondContact O-N 3.31Å; F143-I146 PolarHBondContact O-N 3.39Å; F143-M147 HydrophobicContact CD1-CG 4.44Å; F143-M147 HydrophobicContact CD2-CG 4.22Å; F143-M147 HydrophobicContact CE1-CG 4.02Å; F143-M147 HydrophobicContact CE2-CG 3.77Å; F143-M147 HydrophobicContact CE2-SD 4.16Å; F143-M147 HydrophobicContact CZ-CG 3.66Å; F143-M147 HydrophobicContact CZ-SD 4.22Å; F143-M147 WeakPolarHBondContact O-CB 3.41Å; F143-M147 WeakPolarHBondContact O-CG 3.36Å; F143-M147 PolarHBondContact O-N 3.19Å
144	Y	94.9	Very high	93.9	Very high	82 Å²	82	32.6 Å²	32.6	32%	0.322	16%	0.157	S	C	.	.	H	α-helix	trans	-62.4	-41.3	178	-178.9	-91.6	0	0	0	112.1	Y108 Y140 C142 M147 N148	Y108-Y144 HydrophobicContact CD2-CD2 4.18Å; Y108-Y144 HydrophobicContact CE2-CD2 4.06Å; Y140-Y144 HydrophobicContact CE1-CD2 4.43Å; Y140-Y144 HydrophobicContact CE1-CG 4.41Å; Y140-Y144 VanDerWaalsContact O-CB 3.23Å; Y140-Y144 WeakPolarHBondContact O-CB 3.43Å; Y140-Y144 PolarHBondContact O-N 3.33Å; C142-Y144 VanDerWaalsContact C-N 3.35Å; C142-Y144 PolarHBondContact O-N 3.22Å; Y144-M147 PolarHBondContact O-N 2.96Å; Y144-N148 WeakPolarHBondContact CD1-ND2 3.3Å; Y144-N148 WeakPolarHBondContact CE1-ND2 3.45Å; Y144-N148 VanDerWaalsContact CE2-ND2 3.28Å; Y144-N148 WeakPolarHBondContact CE2-ND2 3.31Å; Y144-N148 PolarHBondContact O-N 3.35Å; Y144-N148 VanDerWaalsContact O-N 3.14Å; Y144-N148 PolarHBondContact O-ND2 3.32Å
145	A	95.3	Very high	93.9	Very high	13 Å²	13	33 Å²	33	11%	0.107	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-43.3	176.3	0	0	0	0	0	111.3	L52 V54 N141 C142 F143 N148 K149	L52-A145 HydrophobicContact CB-CB 3.99Å; L52-A145 HydrophobicContact CD2-CB 4.21Å; V54-A145 HydrophobicContact CG1-CB 3.87Å; N141-A145 WeakPolarHBondContact O-CB 3.44Å; N141-A145 PolarHBondContact O-N 3.32Å; C142-A145 PolarHBondContact O-N 2.95Å; F143-A145 PolarHBondContact O-N 3.31Å; A145-N148 PolarHBondContact O-N 3.43Å; A145-K149 WeakPolarHBondContact O-CB 3.25Å; A145-K149 PolarHBondContact O-N 3.2Å
146	I	96.4	Very high	93.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-61.6	-51.1	176.8	-69.8	159.5	0	0	0	111.1	L52 L125 L129 C142 F143 N148 K149 Y150 I151 L198 W212	L52-I146 HydrophobicContact CD1-CD1 4.01Å; L52-I146 HydrophobicContact CD1-CG1 3.98Å; L52-I146 HydrophobicContact CD2-CG1 3.72Å; L125-I146 HydrophobicContact CD2-CG2 4.2Å; L129-I146 HydrophobicContact CD1-CD1 4.04Å; L129-I146 HydrophobicContact CD2-CD1 4.04Å; L129-I146 HydrophobicContact CG-CD1 4.39Å; C142-I146 WeakPolarHBondContact O-CG1 3.46Å; C142-I146 PolarHBondContact O-N 3.23Å; F143-I146 PolarHBondContact O-N 3.39Å; I146-N148 VanDerWaalsContact C-N 3.26Å; I146-N148 PolarHBondContact O-N 3.35Å; I146-K149 PolarHBondContact O-N 3.26Å; I146-Y150 PolarHBondContact O-N 3.46Å; I146-I151 HydrophobicContact CG2-CG1 4.42Å; I146-I151 PolarHBondContact O-N 3.49Å; I146-L198 HydrophobicContact CG2-CD1 3.82Å; I146-W212 HydrophobicContact CD1-CE3 4.23Å; I146-W212 HydrophobicContact CD1-CH2 3.98Å; I146-W212 HydrophobicContact CD1-CZ3 3.42Å; I146-W212 VanDerWaalsContact CD1-CZ3 3.42Å
147	M	93.7	Very high	93.7	Very high	27 Å²	27	33.3 Å²	33.3	13%	0.133	17%	0.173	C	C	.	.	H	α-helix	trans	-55.4	-38.2	179.5	-77.7	-60.7	-63.3	0	0	113.3	Y108 L122 L125 F143 Y144 I151	Y108-M147 HydrophobicContact CE1-CE 4.11Å; Y108-M147 HydrophobicContact CE2-CB 4.23Å; Y108-M147 HydrophobicContact CE2-CG 4.31Å; Y108-M147 WeakPolarHBondContact OH-CE 3.48Å; L122-M147 HydrophobicContact CD2-CE 3.49Å; L122-M147 VanDerWaalsContact CD2-CE 3.49Å; L122-M147 HydrophobicContact CD2-SD 3.6Å; L125-M147 HydrophobicContact CD1-CG 4.39Å; L125-M147 HydrophobicContact CD1-SD 3.3Å; L125-M147 WeakPolarHBondContact CD1-SD 3.09Å; F143-M147 HydrophobicContact CD1-CG 4.44Å; F143-M147 HydrophobicContact CD2-CG 4.22Å; F143-M147 HydrophobicContact CE1-CG 4.02Å; F143-M147 HydrophobicContact CE2-CG 3.77Å; F143-M147 HydrophobicContact CE2-SD 4.16Å; F143-M147 HydrophobicContact CZ-CG 3.66Å; F143-M147 HydrophobicContact CZ-SD 4.22Å; F143-M147 WeakPolarHBondContact O-CB 3.41Å; F143-M147 WeakPolarHBondContact O-CG 3.36Å; F143-M147 PolarHBondContact O-N 3.19Å; Y144-M147 PolarHBondContact O-N 2.96Å; M147-I151 HydrophobicContact SD-CB 4.47Å; M147-I151 HydrophobicContact SD-CG1 3.94Å
148	N	91.1	Very high	93.5	Very high	32 Å²	32	39.3 Å²	39.3	17%	0.171	20%	0.196	C	C	.	.	H	α-helix	trans	-89.3	-30.5	-177.4	-69.6	-67.4	0	0	0	114	Y144 A145 I146 G293	Y144-N148 WeakPolarHBondContact CD1-ND2 3.3Å; Y144-N148 WeakPolarHBondContact CE1-ND2 3.45Å; Y144-N148 VanDerWaalsContact CE2-ND2 3.28Å; Y144-N148 WeakPolarHBondContact CE2-ND2 3.31Å; Y144-N148 PolarHBondContact O-N 3.35Å; Y144-N148 VanDerWaalsContact O-N 3.14Å; Y144-N148 PolarHBondContact O-ND2 3.32Å; A145-N148 PolarHBondContact O-N 3.43Å; I146-N148 VanDerWaalsContact C-N 3.26Å; I146-N148 PolarHBondContact O-N 3.35Å; N148-G293 WeakPolarHBondContact O-CA 3.22Å; N148-G293 PolarHBondContact O-N 2.84Å
149	K	93.8	Very high	93.4	Very high	68 Å²	68	38.5 Å²	38.5	30%	0.296	19%	0.193	S	C	.	.	H	α-helix	trans	-92.4	-38.7	-173.9	-172.1	174.4	173.8	-161.3	0	112.4	A51 A145 I146 P221	A51-K149 PolarHBondContact O-NZ 3.19Å; A145-K149 WeakPolarHBondContact O-CB 3.25Å; A145-K149 PolarHBondContact O-N 3.2Å; I146-K149 PolarHBondContact O-N 3.26Å; K149-P221 HydrophobicContact CG-CG 4.25Å; K149-P221 VanDerWaalsContact O-CB 3.25Å; K149-P221 WeakPolarHBondContact O-CB 3.44Å; K149-P221 WeakPolarHBondContact O-CG 3.33Å
150	Y	96	Very high	93.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-16.3	-168	-60.6	-81.6	0	0	0	114.6	L52 I146 Y215 L216 P221 F292	L52-Y150 HydrophobicContact CD2-CD2 4.37Å; L52-Y150 HydrophobicContact CD2-CE2 3.72Å; I146-Y150 PolarHBondContact O-N 3.46Å; Y150-Y215 HydrophobicContact CD1-CD1 4.06Å; Y150-Y215 AromaticContact CD1-CE1 3.26Å; Y150-Y215 HydrophobicContact CD1-CE1 3.26Å; Y150-Y215 AromaticContact CD1-CZ 3.79Å; Y150-Y215 HydrophobicContact CE1-CD1 4.28Å; Y150-Y215 AromaticContact CE1-CE1 3.86Å; Y150-Y215 HydrophobicContact CE1-CE1 3.86Å; Y150-Y215 AromaticContact CG-CE1 3.89Å; Y150-Y215 HydrophobicContact CG-CE1 3.89Å; Y150-L216 HydrophobicContact CD2-CD2 4.15Å; Y150-L216 HydrophobicContact CE1-CD2 4.45Å; Y150-L216 HydrophobicContact CE2-CD2 3.6Å; Y150-P221 HydrophobicContact CD1-CB 4.44Å; Y150-P221 HydrophobicContact CD1-CG 4.31Å; Y150-F292 WeakPolarHBondContact O-CE1 3.39Å
151	I	95.2	Very high	93.2	Very high	15 Å²	15	39.6 Å²	39.6	8%	0.077	20%	0.197	C	C	.	.	S	Bend	trans	-92.8	121.9	172.9	-51.1	-57.6	0	0	0	108.9	L125 I146 M147 L198	L125-I151 HydrophobicContact CD1-CD1 4.03Å; L125-I151 HydrophobicContact CD1-CG1 3.98Å; L125-I151 HydrophobicContact CD2-CD1 3.96Å; I146-I151 HydrophobicContact CG2-CG1 4.42Å; I146-I151 PolarHBondContact O-N 3.49Å; M147-I151 HydrophobicContact SD-CB 4.47Å; M147-I151 HydrophobicContact SD-CG1 3.94Å; I151-L198 HydrophobicContact CD1-CD1 4.11Å; I151-L198 HydrophobicContact CD1-CD2 3.89Å; I151-L198 HydrophobicContact CD1-CG 3.69Å
152	P	93.2	Very high	93.3	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.026	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-62.8	147.3	175.3	-20.2	31.5	0	0	0	111.8	P161 L195 F225 L291 F292	P152-P161 HydrophobicContact CB-CB 3.93Å; P152-P161 HydrophobicContact CB-CG 3.48Å; P152-P161 VanDerWaalsContact CB-CG 3.48Å; P152-P161 HydrophobicContact CG-CB 4.21Å; P152-P161 HydrophobicContact CG-CG 4.28Å; P152-L195 HydrophobicContact CG-CD1 3.72Å; P152-L195 HydrophobicContact CG-CD2 3.86Å; P152-L195 HydrophobicContact CG-CG 3.82Å; P152-F225 HydrophobicContact CG-CZ 4.46Å; P152-L291 CarbonylContact C-O 3.52Å; P152-L291 VanDerWaalsContact CA-O 3.31Å; P152-L291 WeakPolarHBondContact CA-O 3.33Å; P152-F292 HydrophobicContact CB-CE1 4.1Å; P152-F292 HydrophobicContact CB-CZ 4.43Å; P152-F292 HydrophobicContact CG-CD1 4.35Å; P152-F292 HydrophobicContact CG-CE1 3.5Å; P152-F292 HydrophobicContact CG-CZ 3.77Å
153	R	86.4	Confident	93.3	Very high	60 Å²	60	41.4 Å²	41.4	23%	0.226	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	152.7	164.1	-57.4	179.5	-154.8	166.4	12.6	109.3	C155 P161 N290 L291 F292 G293 S294	R153-C155 PolarHBondContact O-N 3.17Å; R153-P161 VanDerWaalsContact O-CG 3.27Å; R153-P161 WeakPolarHBondContact O-CG 3.42Å; R153-N290 PolarHBondContact NE-O 3.02Å; R153-N290 PolarHBondContact NH1-O 2.81Å; R153-N290 PolarHBondContact NH2-O 2.89Å; R153-L291 WeakPolarHBondContact CG-O 3.45Å; R153-L291 PolarHBondContact N-O 3.24Å; R153-F292 PolarHBondContact NH2-O 3.24Å; R153-G293 VanDerWaalsContact CZ-O 3.23Å; R153-G293 PolarHBondContact NE-O 2.9Å; R153-G293 PolarHBondContact NH2-O 3.11Å; R153-S294 VanDerWaalsContact CZ-C 3.48Å; R153-S294 PolarHBondContact NH2-O 3.19Å
154	E	84.2	Confident	93.3	Very high	127 Å²	127	41.5 Å²	41.5	59%	0.593	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	38.2	179.4	-55.3	179.4	169.6	0	0	112.3	V156 P161	E154-V156 HydrophobicContact CB-CG2 4.41Å; E154-V156 PolarHBondContact O-N 2.91Å; E154-P161 WeakPolarHBondContact O-CD 3.38Å
155	C	91	Very high	93.5	Very high	31 Å²	31	37.6 Å²	37.6	21%	0.209	19%	0.19	C	C	.	.			trans	-72.1	62.4	167	-169.6	0	0	0	0	109.9	R153	R153-C155 PolarHBondContact O-N 3.17Å
156	V	90.7	Very high	93.6	Very high	77 Å²	77	38.5 Å²	38.5	47%	0.467	19%	0.191	S	C	.	.	S	Bend	trans	-126.9	164	-178.3	-63	0	0	0	0	109.1	E154 K158 G159 F162	E154-V156 HydrophobicContact CB-CG2 4.41Å; E154-V156 PolarHBondContact O-N 2.91Å; V156-K158 PolarHBondContact O-N 2.63Å; V156-G159 WeakPolarHBondContact O-CA 3.34Å; V156-G159 PolarHBondContact O-N 2.98Å; V156-F162 WeakPolarHBondContact O-CD2 3.4Å; V156-F162 VanDerWaalsContact O-CE2 3.28Å; V156-F162 WeakPolarHBondContact O-CE2 3.37Å
157	P	92.8	Very high	93.7	Very high	91 Å²	91	38.4 Å²	38.4	59%	0.591	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	134.8	176.8	-27.8	36.4	0	0	0	112	G159 D188 I192	P157-G159 PolarHBondContact O-N 3.42Å; P157-G159 VanDerWaalsContact O-N 3.15Å; P157-D188 WeakPolarHBondContact CA-OD2 3.49Å; P157-I192 HydrophobicContact CG-CD1 4.18Å
158	K	90.9	Very high	93.9	Very high	158 Å²	158	37.2 Å²	37.2	69%	0.687	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	23.4	-173.7	-52.2	175.8	-176.8	174.1	0	114.7	V156 H163 D188	V156-K158 PolarHBondContact O-N 2.63Å; K158-H163 PolarHBondContact O-NE2 3.36Å; K158-D188 PolarHBondContact N-OD2 3.29Å
159	G	92.6	Very high	94.3	Very high	6 Å²	6	35.8 Å²	35.8	6%	0.062	18%	0.177	C	C	.	.			trans	-68.4	158.4	175.9	0	0	0	0	0	113	V156 P157 P161 F162 H163	V156-G159 WeakPolarHBondContact O-CA 3.34Å; V156-G159 PolarHBondContact O-N 2.98Å; P157-G159 PolarHBondContact O-N 3.42Å; P157-G159 VanDerWaalsContact O-N 3.15Å; G159-P161 VanDerWaalsContact C-N 3.32Å; G159-F162 PolarHBondContact O-N 3.41Å; G159-F162 VanDerWaalsContact O-N 3.09Å; G159-H163 PolarHBondContact O-N 3.3Å
160	R	93.7	Very high	94.5	Very high	34 Å²	34	33.4 Å²	33.4	13%	0.128	17%	0.167	C	C	.	.	H	α-helix	trans	-50.3	-39.7	177.3	-169.3	-176.3	172.9	91.1	10.8	114.5	F162 H163 L164 N288 L291 D303 T304 L306	R160-F162 VanDerWaalsContact C-N 3.29Å; R160-F162 PolarHBondContact O-N 3.47Å; R160-H163 PolarHBondContact O-N 2.84Å; R160-L164 PolarHBondContact O-N 3.43Å; R160-N288 PolarHBondContact NH2-OD1 3.08Å; R160-L291 HydrophobicContact CB-CD2 4.04Å; R160-L291 HydrophobicContact CG-CD2 3.8Å; R160-D303 IonicContact NH1-OD1 2.7Å; R160-T304 PolarHBondContact NH1-O 3.5Å; R160-T304 PolarHBondContact NH2-O 3.4Å; R160-L306 HydrophobicContact CG-CD1 3.74Å; R160-L306 HydrophobicContact CG-CG 4.28Å
161	P	96	Very high	94.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-37.1	178.2	-23.1	32.8	0	0	0	113.6	P152 R153 E154 G159 L164 Y165 L195 F225 L291	P152-P161 HydrophobicContact CB-CB 3.93Å; P152-P161 HydrophobicContact CB-CG 3.48Å; P152-P161 VanDerWaalsContact CB-CG 3.48Å; P152-P161 HydrophobicContact CG-CB 4.21Å; P152-P161 HydrophobicContact CG-CG 4.28Å; R153-P161 VanDerWaalsContact O-CG 3.27Å; R153-P161 WeakPolarHBondContact O-CG 3.42Å; E154-P161 WeakPolarHBondContact O-CD 3.38Å; G159-P161 VanDerWaalsContact C-N 3.32Å; P161-L164 PolarHBondContact O-N 2.8Å; P161-Y165 WeakPolarHBondContact O-CB 3.43Å; P161-Y165 PolarHBondContact O-N 3.27Å; P161-L195 HydrophobicContact CB-CD2 3.75Å; P161-F225 HydrophobicContact CB-CE1 4.31Å; P161-F225 HydrophobicContact CB-CZ 4.29Å; P161-F225 WeakPolarHBondContact O-CE1 3.23Å; P161-L291 HydrophobicContact CG-CD2 4.18Å
162	F	97.6	Very high	94.7	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-76.4	-31.7	-178.6	-58	-69.6	0	0	0	112.1	V156 G159 R160 Y165 R166 P187 D188 I192 L195	V156-F162 WeakPolarHBondContact O-CD2 3.4Å; V156-F162 VanDerWaalsContact O-CE2 3.28Å; V156-F162 WeakPolarHBondContact O-CE2 3.37Å; G159-F162 PolarHBondContact O-N 3.41Å; G159-F162 VanDerWaalsContact O-N 3.09Å; R160-F162 VanDerWaalsContact C-N 3.29Å; R160-F162 PolarHBondContact O-N 3.47Å; F162-Y165 PolarHBondContact O-N 3.04Å; F162-R166 PolarHBondContact O-N 2.91Å; F162-P187 HydrophobicContact CB-CB 4.35Å; F162-P187 HydrophobicContact CD1-CB 4.38Å; F162-D188 HydrophobicContact CB-CB 4.11Å; F162-D188 HydrophobicContact CD1-CB 4.07Å; F162-D188 HydrophobicContact CD2-CB 3.69Å; F162-D188 HydrophobicContact CE1-CB 4.49Å; F162-D188 HydrophobicContact CE2-CB 4.14Å; F162-D188 HydrophobicContact CG-CB 3.67Å; F162-I192 HydrophobicContact CE1-CB 4.34Å; F162-I192 HydrophobicContact CE2-CG1 4.29Å; F162-I192 HydrophobicContact CZ-CB 3.93Å; F162-I192 HydrophobicContact CZ-CG1 3.82Å; F162-L195 HydrophobicContact CE1-CB 4.4Å; F162-L195 HydrophobicContact CE1-CD2 3.87Å; F162-L195 HydrophobicContact CZ-CD2 4.01Å
163	H	96.9	Very high	94.9	Very high	43 Å²	43	33.7 Å²	33.7	20%	0.199	17%	0.167	C	C	.	.	H	α-helix	trans	-66.3	-41.9	169.1	-66.8	-46.1	0	0	0	111.7	K158 G159 R160 Y165 R166 L167 L306 S307	K158-H163 PolarHBondContact O-NE2 3.36Å; G159-H163 PolarHBondContact O-N 3.3Å; R160-H163 PolarHBondContact O-N 2.84Å; H163-Y165 VanDerWaalsContact C-N 3.32Å; H163-Y165 PolarHBondContact O-N 3.4Å; H163-R166 PolarHBondContact O-N 3.46Å; H163-L167 WeakPolarHBondContact O-CG 3.4Å; H163-L167 PolarHBondContact O-N 3.24Å; H163-L167 VanDerWaalsContact O-N 3.08Å; H163-L306 HydrophobicContact CB-CB 3.78Å; H163-S307 WeakPolarHBondContact NE2-CB 3.25Å
164	L	97.4	Very high	95.4	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-60.3	-44.1	173.9	-174.6	63.2	0	0	0	111.5	R160 P161 L167 L168 F222 F225 L284 N288 L291 L306	R160-L164 PolarHBondContact O-N 3.43Å; P161-L164 PolarHBondContact O-N 2.8Å; L164-L167 PolarHBondContact O-N 3.2Å; L164-L168 PolarHBondContact O-N 3.03Å; L164-F222 HydrophobicContact CD2-CE1 4.18Å; L164-F225 HydrophobicContact CD2-CE2 4.1Å; L164-F225 HydrophobicContact CD2-CZ 4.2Å; L164-L284 HydrophobicContact CD1-CD1 4.33Å; L164-L284 HydrophobicContact CD1-CG 4.11Å; L164-N288 HydrophobicContact CD2-CB 4.03Å; L164-L291 HydrophobicContact CD2-CD1 3.41Å; L164-L291 VanDerWaalsContact CD2-CD1 3.41Å; L164-L306 HydrophobicContact CB-CD1 3.83Å; L164-L306 HydrophobicContact CD1-CD1 4.05Å
165	Y	98.4	Very high	95.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.3	-38.7	177.9	-178.8	-114.2	0	0	0	112.7	P161 F162 H163 L167 L168 L169 P187 Y190 F225 M228 L229 L232	P161-Y165 WeakPolarHBondContact O-CB 3.43Å; P161-Y165 PolarHBondContact O-N 3.27Å; F162-Y165 PolarHBondContact O-N 3.04Å; H163-Y165 VanDerWaalsContact C-N 3.32Å; H163-Y165 PolarHBondContact O-N 3.4Å; Y165-L167 VanDerWaalsContact C-N 3.32Å; Y165-L167 PolarHBondContact O-N 2.91Å; Y165-L168 HydrophobicContact CD2-CD2 4.39Å; Y165-L168 WeakPolarHBondContact O-CB 3.38Å; Y165-L168 PolarHBondContact O-N 3.48Å; Y165-L169 PolarHBondContact O-N 3.37Å; Y165-P187 HydrophobicContact CD1-CB 3.54Å; Y165-P187 HydrophobicContact CD1-CG 3.95Å; Y165-P187 HydrophobicContact CE1-CB 4.06Å; Y165-Y190 HydrophobicContact CE1-CE2 4.33Å; Y165-F225 HydrophobicContact CD2-CB 4.33Å; Y165-F225 HydrophobicContact CD2-CD1 4.13Å; Y165-F225 VanDerWaalsContact CE2-O 3.3Å; Y165-F225 WeakPolarHBondContact CE2-O 3.16Å; Y165-F225 HydrophobicContact CG-CD1 4.38Å; Y165-M228 HydrophobicContact CD1-CE 3.68Å; Y165-M228 HydrophobicContact CD2-CB 4.33Å; Y165-M228 HydrophobicContact CD2-CE 3.91Å; Y165-M228 HydrophobicContact CE1-CE 3.76Å; Y165-M228 HydrophobicContact CE2-CB 3.57Å; Y165-M228 HydrophobicContact CE2-CE 3.99Å; Y165-M228 HydrophobicContact CG-CE 3.76Å; Y165-M228 PolarHBondContact OH-O 3.29Å; Y165-L229 HydrophobicContact CE2-CB 4.22Å; Y165-L229 WeakPolarHBondContact OH-CA 3.47Å; Y165-L229 PolarHBondContact OH-N 2.68Å; Y165-L232 HydrophobicContact CE1-CD2 4.34Å; Y165-L232 WeakPolarHBondContact OH-CD2 3.39Å
166	R	98.1	Very high	96.1	Very high	31 Å²	31	27.5 Å²	27.5	12%	0.117	14%	0.138	C	C	.	.	H	α-helix	trans	-57.7	-43.8	171.3	-172	-169.8	60.7	72.8	2.5	111.6	F162 H163 L168 L169 Q170 P187 A309	F162-R166 PolarHBondContact O-N 2.91Å; H163-R166 PolarHBondContact O-N 3.46Å; R166-L168 VanDerWaalsContact C-N 3.34Å; R166-L169 PolarHBondContact O-N 3.38Å; R166-Q170 WeakPolarHBondContact O-CB 3.42Å; R166-Q170 PolarHBondContact O-N 2.92Å; R166-P187 HydrophobicContact CB-CG 4Å; R166-A309 PolarHBondContact NH2-O 3.01Å
167	L	98.3	Very high	96.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.2	-37.9	177.6	-65.4	175.4	0	0	0	112.2	H163 L164 Y165 Q170 Y171 L306 A309 L312	H163-L167 WeakPolarHBondContact O-CG 3.4Å; H163-L167 PolarHBondContact O-N 3.24Å; H163-L167 VanDerWaalsContact O-N 3.08Å; L164-L167 PolarHBondContact O-N 3.2Å; Y165-L167 VanDerWaalsContact C-N 3.32Å; Y165-L167 PolarHBondContact O-N 2.91Å; L167-Q170 PolarHBondContact O-N 3.49Å; L167-Y171 WeakPolarHBondContact O-CB 3.34Å; L167-Y171 PolarHBondContact O-N 3.44Å; L167-L306 HydrophobicContact CD1-CD2 4.1Å; L167-A309 HydrophobicContact CD1-CB 3.86Å; L167-A309 HydrophobicContact CD2-CB 4.06Å; L167-A309 WeakPolarHBondContact CD2-O 3.18Å; L167-L312 HydrophobicContact CB-CD1 4.14Å
168	L	98.5	Very high	96.5	Very high	1 Å²	1	22 Å²	22	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-63.3	-45.2	173.5	179.6	66.5	0	0	0	111	L164 Y165 R166 Y171 H172 F225 F226 L229 T280 L284	L164-L168 PolarHBondContact O-N 3.03Å; Y165-L168 HydrophobicContact CD2-CD2 4.39Å; Y165-L168 WeakPolarHBondContact O-CB 3.38Å; Y165-L168 PolarHBondContact O-N 3.48Å; R166-L168 VanDerWaalsContact C-N 3.34Å; L168-Y171 WeakPolarHBondContact O-CB 3.34Å; L168-Y171 PolarHBondContact O-N 3.29Å; L168-H172 VanDerWaalsContact CD1-CD2 3.47Å; L168-H172 WeakPolarHBondContact CD1-CD2 3.46Å; L168-H172 PolarHBondContact O-CD2 3.17Å; L168-H172 PolarHBondContact O-N 3.46Å; L168-F225 HydrophobicContact CD2-CB 3.76Å; L168-F226 HydrophobicContact CD1-CD1 4.37Å; L168-F226 HydrophobicContact CD1-CE1 3.65Å; L168-F226 HydrophobicContact CD1-CZ 4.13Å; L168-F226 HydrophobicContact CD2-CD1 4.09Å; L168-F226 HydrophobicContact CD2-CE1 4.01Å; L168-F226 HydrophobicContact CD2-CZ 4.41Å; L168-F226 HydrophobicContact CG-CE1 4.47Å; L168-L229 HydrophobicContact CD2-CD2 4.44Å; L168-L229 HydrophobicContact CG-CD2 4.29Å; L168-T280 HydrophobicContact CD1-CG2 3.96Å; L168-L284 HydrophobicContact CB-CD1 4.13Å; L168-L284 HydrophobicContact CD1-CD1 3.81Å; L168-L284 HydrophobicContact CG-CD1 4.45Å
169	L	98	Very high	96.7	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-60.3	-46.2	176.5	-177.8	65	0	0	0	111.3	Y165 R166 Y171 H172 E173 L176 C177 L180 L229 L232	Y165-L169 PolarHBondContact O-N 3.37Å; R166-L169 PolarHBondContact O-N 3.38Å; L169-Y171 VanDerWaalsContact C-N 3.25Å; L169-Y171 PolarHBondContact O-N 2.82Å; L169-H172 PolarHBondContact O-N 3.14Å; L169-E173 HydrophobicContact CD1-CB 3.91Å; L169-E173 CarbonylContact O-C 3.5Å; L169-E173 VanDerWaalsContact O-C 3.25Å; L169-E173 VanDerWaalsContact O-CA 3.32Å; L169-E173 WeakPolarHBondContact O-CA 3.48Å; L169-E173 PolarHBondContact O-N 3.15Å; L169-L176 HydrophobicContact CD1-CD2 4.29Å; L169-C177 HydrophobicContact CD2-CB 4.16Å; L169-C177 HydrophobicContact CG-CB 4Å; L169-L180 HydrophobicContact CD2-CD1 3.83Å; L169-L229 HydrophobicContact CD1-CD1 3.58Å; L169-L232 HydrophobicContact CD1-CD2 3.72Å; L169-L232 HydrophobicContact CD1-CG 4.48Å; L169-L232 HydrophobicContact CD2-CD2 3.68Å; L169-L232 HydrophobicContact CG-CD2 4.32Å
170	Q	97.8	Very high	96.9	Very high	18 Å²	18	15.6 Å²	15.6	8%	0.084	8%	0.076	C	C	.	.	H	α-helix	trans	-61.1	-35	176.3	-171.4	-177	29.3	0	0	113.1	R166 L167 C177 L310 L414	R166-Q170 WeakPolarHBondContact O-CB 3.42Å; R166-Q170 PolarHBondContact O-N 2.92Å; L167-Q170 PolarHBondContact O-N 3.49Å; Q170-C177 HydrophobicContact CB-CB 4.16Å; Q170-L310 PolarHBondContact NE2-O 3.39Å; Q170-L310 PolarHBondContact OE1-O 3.09Å; Q170-L414 HydrophobicContact CG-CD2 3.82Å
171	Y	98.4	Very high	96.9	Very high	2 Å²	2	17 Å²	17	1%	0.008	9%	0.087	C	C	.	.	H	α-helix	trans	-68.8	-36.9	-178.5	-166.9	-101.8	0	0	0	112.4	L167 L168 L169 P281 L312 H391 Y420 V421	L167-Y171 WeakPolarHBondContact O-CB 3.34Å; L167-Y171 PolarHBondContact O-N 3.44Å; L168-Y171 WeakPolarHBondContact O-CB 3.34Å; L168-Y171 PolarHBondContact O-N 3.29Å; L169-Y171 VanDerWaalsContact C-N 3.25Å; L169-Y171 PolarHBondContact O-N 2.82Å; Y171-P281 VanDerWaalsContact CE1-CD 3.49Å; Y171-P281 HydrophobicContact CE1-CG 4.26Å; Y171-P281 HydrophobicContact CE2-CG 4.35Å; Y171-P281 VanDerWaalsContact CZ-CD 3.48Å; Y171-P281 VanDerWaalsContact OH-CD 3.3Å; Y171-P281 WeakPolarHBondContact OH-CD 3.48Å; Y171-P281 WeakPolarHBondContact OH-CG 3.5Å; Y171-L312 HydrophobicContact CD2-CB 3.99Å; Y171-L312 HydrophobicContact CD2-CD2 4.09Å; Y171-L312 HydrophobicContact CE2-CD2 4.3Å; Y171-L312 HydrophobicContact CG-CD2 4.26Å; Y171-H391 AromaticContact CE1-ND1 3.73Å; Y171-H391 AromaticContact CZ-ND1 3.53Å; Y171-H391 WeakPolarHBondContact OH-CB 3.49Å; Y171-H391 PolarHBondContact OH-ND1 3.2Å; Y171-Y420 AromaticContact CD1-CD1 3.74Å; Y171-Y420 HydrophobicContact CD1-CD1 3.74Å; Y171-Y420 HydrophobicContact CD1-CE1 4.41Å; Y171-Y420 AromaticContact CE1-CD1 3.43Å; Y171-Y420 HydrophobicContact CE1-CD1 3.43Å; Y171-Y420 VanDerWaalsContact CE1-CD1 3.43Å; Y171-Y420 HydrophobicContact CE1-CE1 4.24Å; Y171-Y420 HydrophobicContact CE1-CG 4.27Å; Y171-Y420 VanDerWaalsContact CE2-C 3.49Å; Y171-Y420 PolarHBondContact O-N 3.31Å; Y171-V421 WeakPolarHBondContact CD2-O 3.18Å
172	H	98.1	Very high	96.8	Very high	3 Å²	3	22.3 Å²	22.3	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-102.8	-34.8	-176.4	-70.4	-73.9	0	0	0	114	L168 L169 L229 Y276 T280 Y420	L168-H172 VanDerWaalsContact CD1-CD2 3.47Å; L168-H172 WeakPolarHBondContact CD1-CD2 3.46Å; L168-H172 PolarHBondContact O-CD2 3.17Å; L168-H172 PolarHBondContact O-N 3.46Å; L169-H172 PolarHBondContact O-N 3.14Å; H172-L229 HydrophobicContact CB-CD2 4.13Å; H172-Y276 HydrophobicContact CB-CD1 3.99Å; H172-Y276 HydrophobicContact CB-CE1 3.92Å; H172-Y276 AromaticContact CE1-CD1 3.89Å; H172-Y276 AromaticContact CG-CD1 3.62Å; H172-Y276 AromaticContact ND1-CD1 3.46Å; H172-Y276 WeakPolarHBondContact ND1-CD1 3.3Å; H172-Y276 AromaticContact ND1-CE1 3.97Å; H172-T280 PolarHBondContact CE1-OG1 3.36Å; H172-T280 VanDerWaalsContact CE1-OG1 3.3Å; H172-T280 PolarHBondContact NE2-OG1 2.87Å; H172-Y420 AromaticContact CE1-CE1 3.92Å; H172-Y420 AromaticContact ND1-CE1 3.52Å
173	E	97.3	Very high	96.6	Very high	20 Å²	20	25.5 Å²	25.5	9%	0.093	13%	0.133	C	C	.	.			trans	-132.8	66.9	-175.1	-68.2	-67	162.7	0	0	110.9	L169 E175 L176 C177 V233 K236	L169-E173 HydrophobicContact CD1-CB 3.91Å; L169-E173 CarbonylContact O-C 3.5Å; L169-E173 VanDerWaalsContact O-C 3.25Å; L169-E173 VanDerWaalsContact O-CA 3.32Å; L169-E173 WeakPolarHBondContact O-CA 3.48Å; L169-E173 PolarHBondContact O-N 3.15Å; E173-E175 VanDerWaalsContact C-N 3.29Å; E173-E175 PolarHBondContact O-N 3.2Å; E173-L176 HydrophobicContact CB-CB 4.1Å; E173-L176 PolarHBondContact O-N 3.32Å; E173-C177 WeakPolarHBondContact O-CB 3.49Å; E173-C177 PolarHBondContact O-N 2.97Å; E173-V233 HydrophobicContact CG-CG2 3.74Å; E173-K236 WeakPolarHBondContact OE2-CE 3.46Å; E173-K236 IonicContact OE2-NZ 3.81Å; E173-K236 PolarHBondContact OE2-NZ 2.79Å
174	P	96.5	Very high	96.5	Very high	8 Å²	8	31 Å²	31	5%	0.052	16%	0.156	C	C	.	.	H	α-helix	trans	-63.2	-33.1	-173.9	26.2	-36.5	0	0	0	113	S178 N417 E419	P174-S178 VanDerWaalsContact O-CB 3.24Å; P174-S178 WeakPolarHBondContact O-CB 3.47Å; P174-S178 PolarHBondContact O-N 3.44Å; P174-N417 HydrophobicContact CB-CB 4.46Å; P174-N417 HydrophobicContact CG-CB 4.15Å; P174-N417 VanDerWaalsContact CG-O 3.28Å; P174-N417 WeakPolarHBondContact CG-O 3.17Å; P174-E419 HydrophobicContact CG-CG 3.98Å
175	E	95.4	Very high	96.5	Very high	80 Å²	80	31 Å²	31	37%	0.374	16%	0.156	S	C	.	.	H	α-helix	trans	-63.9	-48.8	176.1	-179.9	176.5	-138.8	0	0	111.6	E173 S178 F179 K236 L240 N417	E173-E175 VanDerWaalsContact C-N 3.29Å; E173-E175 PolarHBondContact O-N 3.2Å; E175-S178 PolarHBondContact O-N 2.88Å; E175-F179 PolarHBondContact O-N 2.83Å; E175-K236 IonicContact OE2-NZ 3.42Å; E175-L240 HydrophobicContact CG-CD1 4.37Å; E175-N417 HydrophobicContact CB-CB 4.26Å
176	L	95.5	Very high	96.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-42.7	178.2	-178.1	57.2	0	0	0	111.1	L169 E173 S178 F179 L180 L232 K236 I239	L169-L176 HydrophobicContact CD1-CD2 4.29Å; E173-L176 HydrophobicContact CB-CB 4.1Å; E173-L176 PolarHBondContact O-N 3.32Å; L176-S178 VanDerWaalsContact C-N 3.35Å; L176-S178 PolarHBondContact O-N 2.83Å; L176-F179 PolarHBondContact O-N 3.33Å; L176-L180 HydrophobicContact CD1-CD1 4.47Å; L176-L180 HydrophobicContact CD1-CG 4.38Å; L176-L180 HydrophobicContact CG-CD1 4.36Å; L176-L180 WeakPolarHBondContact O-CG 3.4Å; L176-L180 PolarHBondContact O-N 3.11Å; L176-L232 HydrophobicContact CD2-CD1 4.43Å; L176-L232 HydrophobicContact CD2-CD2 4.49Å; L176-L232 HydrophobicContact CD2-CG 3.95Å; L176-K236 HydrophobicContact CD1-CG 4.47Å; L176-K236 HydrophobicContact CD2-CB 4.06Å; L176-K236 HydrophobicContact CD2-CG 4.18Å; L176-I239 HydrophobicContact CD1-CD1 4.26Å; L176-I239 HydrophobicContact CD1-CG2 4.27Å
177	C	96.8	Very high	96.4	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-57.6	-48.2	174.3	-167.8	0	0	0	0	111.3	L169 Q170 E173 F179 L180 D181	L169-C177 HydrophobicContact CD2-CB 4.16Å; L169-C177 HydrophobicContact CG-CB 4Å; Q170-C177 HydrophobicContact CB-CB 4.16Å; E173-C177 WeakPolarHBondContact O-CB 3.49Å; E173-C177 PolarHBondContact O-N 2.97Å; C177-F179 VanDerWaalsContact C-N 3.32Å; C177-F179 PolarHBondContact O-N 3.38Å; C177-L180 PolarHBondContact O-N 3.11Å; C177-D181 WeakPolarHBondContact O-CB 3.42Å; C177-D181 PolarHBondContact O-N 3.09Å; C177-D181 PolarHBondContact SG-OD2 3.29Å
178	S	95.3	Very high	96.3	Very high	51 Å²	51	33.5 Å²	33.5	36%	0.357	17%	0.174	S	C	.	.	H	α-helix	trans	-62.1	-39	179.6	-176.5	0	0	0	0	112.1	P174 E175 L176 T182	P174-S178 VanDerWaalsContact O-CB 3.24Å; P174-S178 WeakPolarHBondContact O-CB 3.47Å; P174-S178 PolarHBondContact O-N 3.44Å; E175-S178 PolarHBondContact O-N 2.88Å; L176-S178 VanDerWaalsContact C-N 3.35Å; L176-S178 PolarHBondContact O-N 2.83Å; S178-T182 VanDerWaalsContact O-CB 3.31Å; S178-T182 WeakPolarHBondContact O-CB 3.47Å; S178-T182 PolarHBondContact O-N 2.82Å; S178-T182 PolarHBondContact O-OG1 3.17Å
179	F	94.9	Very high	96.2	Very high	26 Å²	26	35.3 Å²	35.3	11%	0.114	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-50.8	174.9	175.6	-89.5	0	0	0	111.5	E175 L176 C177 T182 K183 I239 L240 E243 I250	E175-F179 PolarHBondContact O-N 2.83Å; L176-F179 PolarHBondContact O-N 3.33Å; C177-F179 VanDerWaalsContact C-N 3.32Å; C177-F179 PolarHBondContact O-N 3.38Å; F179-T182 PolarHBondContact O-N 2.98Å; F179-K183 HydrophobicContact CE1-CG 4.24Å; F179-K183 HydrophobicContact CZ-CG 4.23Å; F179-K183 PolarHBondContact O-N 2.82Å; F179-I239 HydrophobicContact CD1-CG2 3.74Å; F179-I239 HydrophobicContact CE1-CG2 3.3Å; F179-I239 HydrophobicContact CZ-CG2 4.06Å; F179-L240 HydrophobicContact CB-CD2 3.92Å; F179-L240 HydrophobicContact CD1-CD2 4.42Å; F179-L240 HydrophobicContact CD2-CD2 3.94Å; F179-L240 HydrophobicContact CG-CD2 3.84Å; F179-E243 HydrophobicContact CE2-CG 4.39Å; F179-I250 HydrophobicContact CE1-CD1 4.27Å; F179-I250 HydrophobicContact CZ-CD1 4.26Å
180	L	95.3	Very high	96.1	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-62.8	-44.1	179.7	-66.6	176.2	0	0	0	111.7	L169 L176 C177 T182 K183 K184 I185 Y190 L232 L254	L169-L180 HydrophobicContact CD2-CD1 3.83Å; L176-L180 HydrophobicContact CD1-CD1 4.47Å; L176-L180 HydrophobicContact CD1-CG 4.38Å; L176-L180 HydrophobicContact CG-CD1 4.36Å; L176-L180 WeakPolarHBondContact O-CG 3.4Å; L176-L180 PolarHBondContact O-N 3.11Å; C177-L180 PolarHBondContact O-N 3.11Å; L180-T182 VanDerWaalsContact C-N 3.33Å; L180-T182 PolarHBondContact O-N 3.27Å; L180-K183 CarbonylContact O-C 3.54Å; L180-K183 PolarHBondContact O-N 2.85Å; L180-K184 PolarHBondContact O-N 2.91Å; L180-I185 HydrophobicContact CB-CB 4.41Å; L180-I185 HydrophobicContact CD2-CB 4.11Å; L180-I185 HydrophobicContact CD2-CD1 4.29Å; L180-I185 HydrophobicContact CD2-CG2 4.04Å; L180-I185 PolarHBondContact O-N 3.13Å; L180-Y190 HydrophobicContact CD1-CE1 4.48Å; L180-L232 HydrophobicContact CD1-CD2 4.31Å; L180-L254 HydrophobicContact CD2-CD1 4.19Å
181	D	94.2	Very high	96.1	Very high	65 Å²	65	34.4 Å²	34.4	35%	0.348	18%	0.183	S	C	.	.	H	α-helix	trans	-61.2	-41.6	176.9	-75.3	-24.1	0	0	0	111.2	C177 K183 K184	C177-D181 WeakPolarHBondContact O-CB 3.42Å; C177-D181 PolarHBondContact O-N 3.09Å; C177-D181 PolarHBondContact SG-OD2 3.29Å; D181-K183 VanDerWaalsContact C-N 3.35Å; D181-K183 PolarHBondContact O-N 2.84Å; D181-K184 PolarHBondContact O-N 3.25Å
182	T	93.8	Very high	96	Very high	110 Å²	110	36.3 Å²	36.3	68%	0.675	19%	0.192	S	C	*	.	H	α-helix	trans	-63.1	-39.6	177	-60.5	0	0	0	0	112	S178 F179 L180 K184	S178-T182 VanDerWaalsContact O-CB 3.31Å; S178-T182 WeakPolarHBondContact O-CB 3.47Å; S178-T182 PolarHBondContact O-N 2.82Å; S178-T182 PolarHBondContact O-OG1 3.17Å; F179-T182 PolarHBondContact O-N 2.98Å; L180-T182 VanDerWaalsContact C-N 3.33Å; L180-T182 PolarHBondContact O-N 3.27Å; T182-K184 PolarHBondContact O-N 3.04Å
183	K	93.4	Very high	95.9	Very high	68 Å²	68	38 Å²	38	30%	0.296	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-0.2	175	-66.4	-84.8	-171.7	159.7	0	112.8	F179 L180 D181 I185 E243	F179-K183 HydrophobicContact CE1-CG 4.24Å; F179-K183 HydrophobicContact CZ-CG 4.23Å; F179-K183 PolarHBondContact O-N 2.82Å; L180-K183 CarbonylContact O-C 3.54Å; L180-K183 PolarHBondContact O-N 2.85Å; D181-K183 VanDerWaalsContact C-N 3.35Å; D181-K183 PolarHBondContact O-N 2.84Å; K183-I185 VanDerWaalsContact C-N 3.25Å; K183-I185 HydrophobicContact CB-CD1 3.92Å; K183-I185 HydrophobicContact CB-CG1 3.99Å; K183-I185 PolarHBondContact O-N 3.12Å; K183-E243 PolarHBondContact NZ-O 2.92Å
184	K	95.3	Very high	95.9	Very high	160 Å²	160	37 Å²	37	70%	0.696	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	38.2	-175.5	-54.6	-179.8	179.9	179.2	0	112.8	L180 D181 T182 K247	L180-K184 PolarHBondContact O-N 2.91Å; D181-K184 PolarHBondContact O-N 3.25Å; T182-K184 PolarHBondContact O-N 3.04Å; K184-K247 WeakPolarHBondContact O-CE 3.06Å; K184-K247 PolarHBondContact O-NZ 3.25Å
185	I	96.4	Very high	95.8	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	20%	0.195	C	C	.	.			trans	-96.6	103	174.2	-61.9	174.9	0	0	0	107.1	L180 K183 Y190 K247 I250 I251 L254	L180-I185 HydrophobicContact CB-CB 4.41Å; L180-I185 HydrophobicContact CD2-CB 4.11Å; L180-I185 HydrophobicContact CD2-CD1 4.29Å; L180-I185 HydrophobicContact CD2-CG2 4.04Å; L180-I185 PolarHBondContact O-N 3.13Å; K183-I185 VanDerWaalsContact C-N 3.25Å; K183-I185 HydrophobicContact CB-CD1 3.92Å; K183-I185 HydrophobicContact CB-CG1 3.99Å; K183-I185 PolarHBondContact O-N 3.12Å; I185-Y190 HydrophobicContact CG2-CD1 3.77Å; I185-Y190 HydrophobicContact CG2-CE1 3.95Å; I185-K247 HydrophobicContact CD1-CG 4.11Å; I185-K247 HydrophobicContact CG1-CD 4.45Å; I185-K247 HydrophobicContact CG1-CG 3.7Å; I185-I250 HydrophobicContact CD1-CB 3.89Å; I185-I250 HydrophobicContact CD1-CD1 4.29Å; I185-I250 HydrophobicContact CD1-CG2 3.63Å; I185-I251 HydrophobicContact CD1-CG1 4.37Å; I185-I251 HydrophobicContact CG1-CD1 4.36Å; I185-I251 HydrophobicContact CG1-CG1 4.19Å; I185-I251 HydrophobicContact CG2-CD1 4.49Å; I185-I251 HydrophobicContact CG2-CG1 3.86Å; I185-L254 HydrophobicContact CG2-CD1 4.46Å
186	T	96.7	Very high	95.8	Very high	56 Å²	56	33.2 Å²	33.2	34%	0.344	18%	0.181	S	C	.	.			trans	-93.2	150.8	-179.3	53	0	0	0	0	110.6	D188 S189	T186-D188 WeakPolarHBondContact CB-OD1 3.23Å; T186-D188 PolarHBondContact O-N 2.78Å; T186-D188 VanDerWaalsContact O-N 3.11Å; T186-D188 PolarHBondContact OG1-OD1 3Å; T186-S189 WeakPolarHBondContact O-CB 3.4Å; T186-S189 PolarHBondContact O-N 2.98Å; T186-S189 PolarHBondContact O-OG 3.38Å
187	P	98	Very high	95.9	Very high	7 Å²	7	33.2 Å²	33.2	5%	0.045	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.2	-172	-24.8	33.4	0	0	0	116.5	F162 Y165 R166 S189 Y190 A191	F162-P187 HydrophobicContact CB-CB 4.35Å; F162-P187 HydrophobicContact CD1-CB 4.38Å; Y165-P187 HydrophobicContact CD1-CB 3.54Å; Y165-P187 HydrophobicContact CD1-CG 3.95Å; Y165-P187 HydrophobicContact CE1-CB 4.06Å; R166-P187 HydrophobicContact CB-CG 4Å; P187-S189 PolarHBondContact O-N 3.49Å; P187-Y190 HydrophobicContact CB-CE1 4.33Å; P187-Y190 PolarHBondContact O-N 3.36Å; P187-A191 WeakPolarHBondContact O-CA 3.48Å; P187-A191 VanDerWaalsContact O-CB 3.3Å; P187-A191 WeakPolarHBondContact O-CB 3.27Å; P187-A191 PolarHBondContact O-N 3.22Å
188	D	96.8	Very high	95.9	Very high	20 Å²	20	33.2 Å²	33.2	11%	0.107	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-25.2	173	57.9	-49.3	0	0	0	112.9	P157 K158 F162 T186 Y190 I192	P157-D188 WeakPolarHBondContact CA-OD2 3.49Å; K158-D188 PolarHBondContact N-OD2 3.29Å; F162-D188 HydrophobicContact CB-CB 4.11Å; F162-D188 HydrophobicContact CD1-CB 4.07Å; F162-D188 HydrophobicContact CD2-CB 3.69Å; F162-D188 HydrophobicContact CE1-CB 4.49Å; F162-D188 HydrophobicContact CE2-CB 4.14Å; F162-D188 HydrophobicContact CG-CB 3.67Å; T186-D188 WeakPolarHBondContact CB-OD1 3.23Å; T186-D188 PolarHBondContact O-N 2.78Å; T186-D188 VanDerWaalsContact O-N 3.11Å; T186-D188 PolarHBondContact OG1-OD1 3Å; D188-Y190 VanDerWaalsContact C-N 3.32Å; D188-Y190 PolarHBondContact O-N 3.08Å; D188-I192 VanDerWaalsContact O-CB 3.32Å; D188-I192 WeakPolarHBondContact O-CB 3.25Å; D188-I192 WeakPolarHBondContact O-CG2 3.34Å
189	S	96.6	Very high	96	Very high	40 Å²	40	30.9 Å²	30.9	28%	0.28	16%	0.164	S	C	.	.	H	α-helix	trans	-73	-22.7	-178.7	76.9	0	0	0	0	113.8	T186 P187 I251	T186-S189 WeakPolarHBondContact O-CB 3.4Å; T186-S189 PolarHBondContact O-N 2.98Å; T186-S189 PolarHBondContact O-OG 3.38Å; P187-S189 PolarHBondContact O-N 3.49Å; S189-I251 WeakPolarHBondContact O-CG2 3.47Å
190	Y	96.3	Very high	96	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-124.4	-23.9	-178.3	61.7	-99.9	0	0	0	113.9	Y165 L180 I185 P187 D188 W194 L232 L254	Y165-Y190 HydrophobicContact CE1-CE2 4.33Å; L180-Y190 HydrophobicContact CD1-CE1 4.48Å; I185-Y190 HydrophobicContact CG2-CD1 3.77Å; I185-Y190 HydrophobicContact CG2-CE1 3.95Å; P187-Y190 HydrophobicContact CB-CE1 4.33Å; P187-Y190 PolarHBondContact O-N 3.36Å; D188-Y190 VanDerWaalsContact C-N 3.32Å; D188-Y190 PolarHBondContact O-N 3.08Å; Y190-W194 HydrophobicContact CD2-CH2 4.05Å; Y190-W194 HydrophobicContact CD2-CZ2 4.32Å; Y190-W194 HydrophobicContact CD2-CZ3 4.22Å; Y190-W194 HydrophobicContact CE2-CH2 4.27Å; Y190-W194 HydrophobicContact CE2-CZ3 4.14Å; Y190-W194 PolarHBondContact O-NE1 3.25Å; Y190-L232 HydrophobicContact CE2-CD1 4.45Å; Y190-L232 HydrophobicContact CE2-CD2 4.32Å; Y190-L232 WeakPolarHBondContact OH-CD2 3.4Å; Y190-L254 HydrophobicContact CD1-CD1 3.79Å; Y190-L254 HydrophobicContact CD2-CB 4.23Å; Y190-L254 HydrophobicContact CD2-CD1 4.42Å; Y190-L254 HydrophobicContact CE1-CD1 4.09Å; Y190-L254 HydrophobicContact CG-CB 3.95Å; Y190-L254 HydrophobicContact CG-CD1 3.97Å
191	A	97.3	Very high	95.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-112.4	5.1	-173.3	0	0	0	0	0	114.7	P187 N193 W194 L195 M228	P187-A191 WeakPolarHBondContact O-CA 3.48Å; P187-A191 VanDerWaalsContact O-CB 3.3Å; P187-A191 WeakPolarHBondContact O-CB 3.27Å; P187-A191 PolarHBondContact O-N 3.22Å; A191-N193 VanDerWaalsContact C-N 3.28Å; A191-N193 PolarHBondContact O-N 3.19Å; A191-W194 HydrophobicContact CB-CB 4.2Å; A191-W194 HydrophobicContact CB-CD2 3.72Å; A191-W194 HydrophobicContact CB-CE3 3.48Å; A191-W194 VanDerWaalsContact CB-CE3 3.48Å; A191-W194 HydrophobicContact CB-CG 4.06Å; A191-W194 HydrophobicContact CB-CZ3 4.16Å; A191-W194 WeakPolarHBondContact O-CB 3.35Å; A191-W194 PolarHBondContact O-N 3.35Å; A191-W194 VanDerWaalsContact O-N 3.12Å; A191-L195 PolarHBondContact O-N 2.95Å; A191-L195 VanDerWaalsContact O-N 3.1Å; A191-M228 HydrophobicContact CB-CE 3.65Å
192	I	96.1	Very high	95.8	Very high	41 Å²	41	29.8 Å²	29.8	21%	0.21	16%	0.16	C	C	.	.	H	α-helix	trans	-58.3	-43	178.9	-169.6	164	0	0	0	112.1	P157 F162 D188 G196	P157-I192 HydrophobicContact CG-CD1 4.18Å; F162-I192 HydrophobicContact CE1-CB 4.34Å; F162-I192 HydrophobicContact CE2-CG1 4.29Å; F162-I192 HydrophobicContact CZ-CB 3.93Å; F162-I192 HydrophobicContact CZ-CG1 3.82Å; D188-I192 VanDerWaalsContact O-CB 3.32Å; D188-I192 WeakPolarHBondContact O-CB 3.25Å; D188-I192 WeakPolarHBondContact O-CG2 3.34Å; I192-G196 PolarHBondContact O-N 3.01Å
193	N	95.4	Very high	95.8	Very high	39 Å²	39	24.7 Å²	24.7	21%	0.209	13%	0.129	C	C	.	.	H	α-helix	trans	-76.5	-26.1	177.2	-73.5	-40.4	0	0	0	112.6	S121 A191 L195 S197 E255	S121-N193 PolarHBondContact OG-OD1 3Å; A191-N193 VanDerWaalsContact C-N 3.28Å; A191-N193 PolarHBondContact O-N 3.19Å; N193-L195 VanDerWaalsContact C-N 3.34Å; N193-S197 VanDerWaalsContact O-CB 3.3Å; N193-S197 WeakPolarHBondContact O-CB 3.41Å; N193-S197 PolarHBondContact O-N 3.21Å; N193-S197 PolarHBondContact O-OG 3.45Å; N193-E255 PolarHBondContact ND2-OE1 2.6Å
194	W	97.3	Very high	95.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-48.8	173.2	-61.8	2.5	0	0	0	110.3	Y190 A191 L198 F199 H202 M228 I231 L254 E255 P258	Y190-W194 HydrophobicContact CD2-CH2 4.05Å; Y190-W194 HydrophobicContact CD2-CZ2 4.32Å; Y190-W194 HydrophobicContact CD2-CZ3 4.22Å; Y190-W194 HydrophobicContact CE2-CH2 4.27Å; Y190-W194 HydrophobicContact CE2-CZ3 4.14Å; Y190-W194 PolarHBondContact O-NE1 3.25Å; A191-W194 HydrophobicContact CB-CB 4.2Å; A191-W194 HydrophobicContact CB-CD2 3.72Å; A191-W194 HydrophobicContact CB-CE3 3.48Å; A191-W194 VanDerWaalsContact CB-CE3 3.48Å; A191-W194 HydrophobicContact CB-CG 4.06Å; A191-W194 HydrophobicContact CB-CZ3 4.16Å; A191-W194 WeakPolarHBondContact O-CB 3.35Å; A191-W194 PolarHBondContact O-N 3.35Å; A191-W194 VanDerWaalsContact O-N 3.12Å; W194-L198 CarbonylContact O-C 3.58Å; W194-L198 VanDerWaalsContact O-CA 3.26Å; W194-L198 WeakPolarHBondContact O-CA 3.31Å; W194-L198 PolarHBondContact O-N 2.96Å; W194-F199 HydrophobicContact CB-CD1 3.8Å; W194-F199 HydrophobicContact CB-CE1 3.61Å; W194-F199 HydrophobicContact CD2-CE1 4.1Å; W194-F199 HydrophobicContact CE3-CE1 4.19Å; W194-F199 HydrophobicContact CG-CD1 4.05Å; W194-F199 AromaticContact CG-CE1 3.91Å; W194-F199 HydrophobicContact CG-CE1 3.91Å; W194-F199 PolarHBondContact O-N 2.94Å; W194-H202 AromaticContact CD1-ND1 3.91Å; W194-M228 HydrophobicContact CB-CG 4.48Å; W194-M228 HydrophobicContact CE3-CB 4.13Å; W194-M228 HydrophobicContact CE3-CE 4.44Å; W194-M228 HydrophobicContact CE3-CG 3.99Å; W194-M228 HydrophobicContact CZ3-CB 4.4Å; W194-I231 HydrophobicContact CH2-CB 4.45Å; W194-I231 HydrophobicContact CH2-CG2 3.74Å; W194-I231 HydrophobicContact CZ2-CG2 4.12Å; W194-I231 HydrophobicContact CZ3-CB 4.48Å; W194-I231 HydrophobicContact CZ3-CG2 4.22Å; W194-L254 WeakPolarHBondContact CZ2-O 3.31Å; W194-E255 PolarHBondContact NE1-O 3.15Å; W194-P258 HydrophobicContact CD2-CG 4.05Å; W194-P258 VanDerWaalsContact CE2-CG 3.46Å; W194-P258 HydrophobicContact CG-CG 4.18Å; W194-P258 HydrophobicContact CZ2-CG 3.84Å; W194-P258 VanDerWaalsContact NE1-CG 3.29Å
195	L	96.3	Very high	95.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-75.8	-44.5	-178.9	-168.4	54.7	0	0	0	111.9	P152 P161 F162 A191 N193 S197 I224 F225 M228	P152-L195 HydrophobicContact CG-CD1 3.72Å; P152-L195 HydrophobicContact CG-CD2 3.86Å; P152-L195 HydrophobicContact CG-CG 3.82Å; P161-L195 HydrophobicContact CB-CD2 3.75Å; F162-L195 HydrophobicContact CE1-CB 4.4Å; F162-L195 HydrophobicContact CE1-CD2 3.87Å; F162-L195 HydrophobicContact CZ-CD2 4.01Å; A191-L195 PolarHBondContact O-N 2.95Å; A191-L195 VanDerWaalsContact O-N 3.1Å; N193-L195 VanDerWaalsContact C-N 3.34Å; L195-S197 VanDerWaalsContact C-N 3.32Å; L195-S197 PolarHBondContact O-N 3.11Å; L195-I224 HydrophobicContact CD1-CB 4.32Å; L195-I224 HydrophobicContact CD1-CG1 3.67Å; L195-I224 HydrophobicContact CD1-CG2 3.61Å; L195-F225 HydrophobicContact CD2-CE1 4.31Å; L195-M228 HydrophobicContact CB-SD 4.22Å; L195-M228 HydrophobicContact CD1-SD 4.06Å
196	G	95.1	Very high	95.3	Very high	8 Å²	8	28.8 Å²	28.8	8%	0.082	15%	0.151	C	C	.	.	H	α-helix	trans	-68.6	-25.4	-178.1	0	0	0	0	0	114.5	S121 L125 I192	S121-G196 WeakPolarHBondContact CB-O 3.46Å; L125-G196 WeakPolarHBondContact CD1-O 3.44Å; I192-G196 PolarHBondContact O-N 3.01Å
197	S	96.1	Very high	95.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-111.9	-0.9	178.5	76.3	0	0	0	0	114.4	L125 N193 L195 F199 S200 S201	L125-S197 VanDerWaalsContact CD2-C 3.5Å; L125-S197 WeakPolarHBondContact CD2-O 3.45Å; N193-S197 VanDerWaalsContact O-CB 3.3Å; N193-S197 WeakPolarHBondContact O-CB 3.41Å; N193-S197 PolarHBondContact O-N 3.21Å; N193-S197 PolarHBondContact O-OG 3.45Å; L195-S197 VanDerWaalsContact C-N 3.32Å; L195-S197 PolarHBondContact O-N 3.11Å; S197-F199 PolarHBondContact O-N 3.45Å; S197-F199 PolarHBondContact OG-N 3.18Å; S197-S200 WeakPolarHBondContact O-CB 3.09Å; S197-S200 PolarHBondContact O-N 2.72Å; S197-S200 VanDerWaalsContact O-N 3.13Å; S197-S200 PolarHBondContact O-OG 3.32Å; S197-S200 PolarHBondContact OG-N 3.28Å; S197-S201 WeakPolarHBondContact OG-CB 3.44Å; S197-S201 PolarHBondContact OG-N 2.85Å; S197-S201 VanDerWaalsContact OG-N 3.14Å; S197-S201 PolarHBondContact OG-OG 2.98Å; S197-S201 VanDerWaalsContact OG-OG 3.12Å
198	L	97.1	Very high	95.1	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	49.2	-168.6	-54.5	175.9	0	0	0	111	L125 I146 I151 W194 S200 W212 Y215 I224	L125-L198 HydrophobicContact CD2-CD1 4.4Å; L125-L198 HydrophobicContact CD2-CG 4.21Å; I146-L198 HydrophobicContact CG2-CD1 3.82Å; I151-L198 HydrophobicContact CD1-CD1 4.11Å; I151-L198 HydrophobicContact CD1-CD2 3.89Å; I151-L198 HydrophobicContact CD1-CG 3.69Å; W194-L198 CarbonylContact O-C 3.58Å; W194-L198 VanDerWaalsContact O-CA 3.26Å; W194-L198 WeakPolarHBondContact O-CA 3.31Å; W194-L198 PolarHBondContact O-N 2.96Å; L198-S200 PolarHBondContact O-N 3.43Å; L198-S200 VanDerWaalsContact O-N 3.11Å; L198-W212 HydrophobicContact CB-CZ2 3.94Å; L198-W212 HydrophobicContact CD1-CZ2 4.14Å; L198-W212 PolarHBondContact O-NE1 3.26Å; L198-Y215 HydrophobicContact CD1-CE1 4.32Å; L198-Y215 HydrophobicContact CD2-CE1 4.29Å; L198-I224 HydrophobicContact CD2-CD1 4.03Å; L198-I224 HydrophobicContact CD2-CG1 4.14Å
199	F	97.3	Very high	94.9	Very high	1 Å²	1	27.9 Å²	27.9	0%	0.004	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	-5.3	-176.3	-50.6	-73.4	0	0	0	117.8	W194 S197 S201 H202 C203 L211 I224 L227 M228 I231 P258	W194-F199 HydrophobicContact CB-CD1 3.8Å; W194-F199 HydrophobicContact CB-CE1 3.61Å; W194-F199 HydrophobicContact CD2-CE1 4.1Å; W194-F199 HydrophobicContact CE3-CE1 4.19Å; W194-F199 HydrophobicContact CG-CD1 4.05Å; W194-F199 AromaticContact CG-CE1 3.91Å; W194-F199 HydrophobicContact CG-CE1 3.91Å; W194-F199 PolarHBondContact O-N 2.94Å; S197-F199 PolarHBondContact O-N 3.45Å; S197-F199 PolarHBondContact OG-N 3.18Å; F199-S201 PolarHBondContact O-N 3.44Å; F199-S201 VanDerWaalsContact O-N 3.08Å; F199-H202 PolarHBondContact O-N 3.39Å; F199-C203 WeakPolarHBondContact O-CB 3.21Å; F199-C203 PolarHBondContact O-N 3.06Å; F199-L211 HydrophobicContact CD2-CD1 3.7Å; F199-L211 HydrophobicContact CD2-CD2 4.14Å; F199-L211 HydrophobicContact CE2-CD1 4.29Å; F199-L211 HydrophobicContact CG-CD1 4.41Å; F199-I224 HydrophobicContact CD2-CD1 3.96Å; F199-I224 HydrophobicContact CE2-CD1 3.28Å; F199-I224 HydrophobicContact CZ-CD1 3.81Å; F199-L227 HydrophobicContact CE2-CB 3.86Å; F199-L227 HydrophobicContact CE2-CD1 4.29Å; F199-L227 HydrophobicContact CZ-CB 4.05Å; F199-M228 HydrophobicContact CE1-CG 4.06Å; F199-M228 HydrophobicContact CZ-CG 3.67Å; F199-I231 HydrophobicContact CD1-CD1 3.98Å; F199-I231 HydrophobicContact CE1-CD1 3.38Å; F199-I231 HydrophobicContact CE2-CD1 4.36Å; F199-I231 HydrophobicContact CZ-CD1 3.61Å; F199-P258 HydrophobicContact CD1-CB 4.06Å; F199-P258 HydrophobicContact CD1-CG 3.98Å; F199-P258 HydrophobicContact CE1-CG 4.39Å
200	S	95	Very high	94.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.9	-174.4	73.2	0	0	0	0	114.7	H124 S197 L198	H124-S200 WeakPolarHBondContact O-CB 3.33Å; H124-S200 PolarHBondContact O-OG 3.21Å; S197-S200 WeakPolarHBondContact O-CB 3.09Å; S197-S200 PolarHBondContact O-N 2.72Å; S197-S200 VanDerWaalsContact O-N 3.13Å; S197-S200 PolarHBondContact O-OG 3.32Å; S197-S200 PolarHBondContact OG-N 3.28Å; L198-S200 PolarHBondContact O-N 3.43Å; L198-S200 VanDerWaalsContact O-N 3.11Å
201	S	92.9	Very high	94.9	Very high	30 Å²	30	26.8 Å²	26.8	21%	0.21	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-29.6	174.7	69.9	0	0	0	0	113.2	S197 F199	S197-S201 WeakPolarHBondContact OG-CB 3.44Å; S197-S201 PolarHBondContact OG-N 2.85Å; S197-S201 VanDerWaalsContact OG-N 3.14Å; S197-S201 PolarHBondContact OG-OG 2.98Å; S197-S201 VanDerWaalsContact OG-OG 3.12Å; F199-S201 PolarHBondContact O-N 3.44Å; F199-S201 VanDerWaalsContact O-N 3.08Å
202	H	92.6	Very high	94.9	Very high	41 Å²	41	26.8 Å²	26.8	19%	0.19	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-36.1	-173.6	-67	97.2	0	0	0	113.1	W194 F199 E255 P258 S259	W194-H202 AromaticContact CD1-ND1 3.91Å; F199-H202 PolarHBondContact O-N 3.39Å; H202-E255 PolarHBondContact CD2-O 2.96Å; H202-E255 WeakPolarHBondContact NE2-CG 3.37Å; H202-E255 PolarHBondContact NE2-O 3.12Å; H202-P258 HydrophobicContact CB-CB 4.11Å; H202-P258 HydrophobicContact CB-CG 4.4Å; H202-S259 WeakPolarHBondContact O-CB 3.42Å
203	C	94.8	Very high	94.8	Very high	4 Å²	4	25.8 Å²	25.8	3%	0.027	13%	0.131	C	C	.	.	S	Bend	trans	-72.6	151.6	-179.1	-69.6	0	0	0	0	111.9	F199 V207 T208 P258	F199-C203 WeakPolarHBondContact O-CB 3.21Å; F199-C203 PolarHBondContact O-N 3.06Å; C203-V207 HydrophobicContact CB-CB 4.29Å; C203-V207 HydrophobicContact CB-CG1 4.16Å; C203-T208 VanDerWaalsContact CB-OG1 3.31Å; C203-T208 WeakPolarHBondContact CB-OG1 3.38Å; C203-P258 PolarHBondContact SG-O 3.34Å; C203-P258 VanDerWaalsContact SG-O 3.35Å
204	R	92.1	Very high	94.8	Very high	139 Å²	139	25.7 Å²	25.7	53%	0.525	13%	0.133	S	C	.	.			trans	-64.9	156	170	-60.8	-178.4	-172.1	153	7.6	110.3	E206 V207 T208	R204-E206 VanDerWaalsContact C-N 3.29Å; R204-E206 WeakPolarHBondContact CB-OE2 3.46Å; R204-E206 PolarHBondContact O-N 3.13Å; R204-V207 HydrophobicContact CB-CG2 4.13Å; R204-V207 PolarHBondContact O-N 2.9Å; R204-T208 WeakPolarHBondContact O-CB 3.26Å; R204-T208 PolarHBondContact O-N 3.04Å; R204-T208 PolarHBondContact O-OG1 3.3Å
205	P	90.1	Very high	94.8	Very high	59 Å²	59	25.7 Å²	25.7	38%	0.383	13%	0.133	S	C	.	.	H	α-helix	trans	-54.7	-41.9	-178.5	-26.9	36.1	0	0	0	113.8	T208 Q209	P205-T208 PolarHBondContact O-N 3.14Å; P205-Q209 WeakPolarHBondContact O-CG 3.3Å; P205-Q209 PolarHBondContact O-N 2.72Å
206	E	91.8	Very high	94.8	Very high	116 Å²	116	25.8 Å²	25.8	54%	0.542	13%	0.134	S	C	.	.	H	α-helix	trans	-65.8	-45.1	-177.4	-55.3	72.4	-154.5	0	0	110.8	R204 Q209 A210	R204-E206 VanDerWaalsContact C-N 3.29Å; R204-E206 WeakPolarHBondContact CB-OE2 3.46Å; R204-E206 PolarHBondContact O-N 3.13Å; E206-Q209 PolarHBondContact O-N 2.68Å; E206-A210 PolarHBondContact O-N 2.8Å
207	V	95.1	Very high	94.7	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.024	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-43.1	176.7	-177	0	0	0	0	110.5	C203 R204 Q209 A210 L211 L261 I266	C203-V207 HydrophobicContact CB-CB 4.29Å; C203-V207 HydrophobicContact CB-CG1 4.16Å; R204-V207 HydrophobicContact CB-CG2 4.13Å; R204-V207 PolarHBondContact O-N 2.9Å; V207-Q209 VanDerWaalsContact C-N 3.35Å; V207-Q209 PolarHBondContact O-N 3.08Å; V207-A210 PolarHBondContact O-N 2.96Å; V207-L211 VanDerWaalsContact O-CB 3.23Å; V207-L211 WeakPolarHBondContact O-CB 3.24Å; V207-L211 PolarHBondContact O-N 3.16Å; V207-L261 HydrophobicContact CG1-CB 3.94Å; V207-L261 WeakPolarHBondContact CG2-O 3.18Å; V207-I266 HydrophobicContact CG1-CD1 3.82Å; V207-I266 HydrophobicContact CG1-CG1 4.47Å
208	T	95.4	Very high	94.5	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-41.2	179	-53.8	0	0	0	0	111.3	P128 C203 R204 P205 L211 W212	P128-T208 HydrophobicContact CB-CG2 4.16Å; P128-T208 HydrophobicContact CG-CG2 3.53Å; C203-T208 VanDerWaalsContact CB-OG1 3.31Å; C203-T208 WeakPolarHBondContact CB-OG1 3.38Å; R204-T208 WeakPolarHBondContact O-CB 3.26Å; R204-T208 PolarHBondContact O-N 3.04Å; R204-T208 PolarHBondContact O-OG1 3.3Å; P205-T208 PolarHBondContact O-N 3.14Å; T208-L211 PolarHBondContact O-N 3.08Å; T208-W212 WeakPolarHBondContact O-CB 3.19Å; T208-W212 VanDerWaalsContact O-CD1 3.25Å; T208-W212 PolarHBondContact O-N 3.25Å
209	Q	93.3	Very high	94.4	Very high	55 Å²	55	37.6 Å²	37.6	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-63.4	-50.6	176.1	-75.9	177.1	-2.5	0	0	111.4	P205 E206 V207 L211 W212 D213	P205-Q209 WeakPolarHBondContact O-CG 3.3Å; P205-Q209 PolarHBondContact O-N 2.72Å; E206-Q209 PolarHBondContact O-N 2.68Å; V207-Q209 VanDerWaalsContact C-N 3.35Å; V207-Q209 PolarHBondContact O-N 3.08Å; Q209-L211 VanDerWaalsContact C-N 3.3Å; Q209-L211 PolarHBondContact O-N 2.65Å; Q209-W212 PolarHBondContact O-N 3.28Å; Q209-D213 WeakPolarHBondContact O-CB 3.35Å; Q209-D213 PolarHBondContact O-N 3.07Å
210	A	94.7	Very high	94.2	Very high	17 Å²	17	38.3 Å²	38.3	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-40.3	177.6	0	0	0	0	0	112.4	E206 V207 S214 I266	E206-A210 PolarHBondContact O-N 2.8Å; V207-A210 PolarHBondContact O-N 2.96Å; A210-S214 PolarHBondContact O-N 2.89Å; A210-S214 PolarHBondContact O-OG 3.3Å; A210-I266 HydrophobicContact CB-CB 4.46Å; A210-I266 HydrophobicContact CB-CG1 4.04Å; A210-I266 HydrophobicContact CB-CG2 4.41Å
211	L	96.9	Very high	94.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-47	175.7	-171.8	150.3	0	0	0	111.1	F199 V207 T208 Q209 S214 Y215 I266 L269 F270	F199-L211 HydrophobicContact CD2-CD1 3.7Å; F199-L211 HydrophobicContact CD2-CD2 4.14Å; F199-L211 HydrophobicContact CE2-CD1 4.29Å; F199-L211 HydrophobicContact CG-CD1 4.41Å; V207-L211 VanDerWaalsContact O-CB 3.23Å; V207-L211 WeakPolarHBondContact O-CB 3.24Å; V207-L211 PolarHBondContact O-N 3.16Å; T208-L211 PolarHBondContact O-N 3.08Å; Q209-L211 VanDerWaalsContact C-N 3.3Å; Q209-L211 PolarHBondContact O-N 2.65Å; L211-S214 PolarHBondContact O-N 3.34Å; L211-Y215 WeakPolarHBondContact O-CB 3.45Å; L211-Y215 PolarHBondContact O-N 3.3Å; L211-I266 HydrophobicContact CB-CD1 4.17Å; L211-I266 HydrophobicContact CD1-CD1 4.4Å; L211-L269 HydrophobicContact CD1-CD2 4.36Å; L211-F270 HydrophobicContact CG-CE2 4.24Å
212	W	97.1	Very high	94.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-72.4	-34.5	-179.1	-78.6	39	0	0	0	112.8	W48 L125 P128 L129 I146 L198 T208 Q209 S214 Y215 L216	W48-W212 HydrophobicContact CE3-CE3 4.1Å; W48-W212 HydrophobicContact CH2-CB 3.55Å; W48-W212 HydrophobicContact CH2-CD2 4.03Å; W48-W212 AromaticContact CH2-CE3 3.5Å; W48-W212 HydrophobicContact CH2-CE3 3.5Å; W48-W212 VanDerWaalsContact CH2-CE3 3.5Å; W48-W212 HydrophobicContact CH2-CG 4.1Å; W48-W212 HydrophobicContact CH2-CZ3 4.4Å; W48-W212 HydrophobicContact CZ2-CB 3.38Å; W48-W212 HydrophobicContact CZ2-CE3 4.37Å; W48-W212 HydrophobicContact CZ2-CG 4.4Å; W48-W212 HydrophobicContact CZ3-CB 4.44Å; W48-W212 HydrophobicContact CZ3-CD2 4.31Å; W48-W212 AromaticContact CZ3-CE3 3.33Å; W48-W212 HydrophobicContact CZ3-CE3 3.33Å; W48-W212 AromaticContact CZ3-CZ3 3.9Å; W48-W212 HydrophobicContact CZ3-CZ3 3.9Å; L125-W212 HydrophobicContact CD2-CH2 4.08Å; L125-W212 HydrophobicContact CD2-CZ2 4Å; L125-W212 WeakPolarHBondContact O-CH2 3.36Å; P128-W212 HydrophobicContact CB-CD2 4.36Å; P128-W212 HydrophobicContact CB-CE3 4.12Å; P128-W212 HydrophobicContact CB-CH2 4.41Å; P128-W212 HydrophobicContact CB-CZ3 4.12Å; P128-W212 HydrophobicContact CG-CD2 4.35Å; P128-W212 HydrophobicContact CG-CE3 4.36Å; P128-W212 HydrophobicContact CG-CH2 3.91Å; P128-W212 HydrophobicContact CG-CZ2 3.92Å; P128-W212 HydrophobicContact CG-CZ3 4.13Å; L129-W212 HydrophobicContact CD2-CZ3 4.28Å; L129-W212 HydrophobicContact CG-CZ3 4.27Å; I146-W212 HydrophobicContact CD1-CE3 4.23Å; I146-W212 HydrophobicContact CD1-CH2 3.98Å; I146-W212 HydrophobicContact CD1-CZ3 3.42Å; I146-W212 VanDerWaalsContact CD1-CZ3 3.42Å; L198-W212 HydrophobicContact CB-CZ2 3.94Å; L198-W212 HydrophobicContact CD1-CZ2 4.14Å; L198-W212 PolarHBondContact O-NE1 3.26Å; T208-W212 WeakPolarHBondContact O-CB 3.19Å; T208-W212 VanDerWaalsContact O-CD1 3.25Å; T208-W212 PolarHBondContact O-N 3.25Å; Q209-W212 PolarHBondContact O-N 3.28Å; W212-S214 VanDerWaalsContact C-N 3.3Å; W212-S214 PolarHBondContact O-N 2.9Å; W212-Y215 PolarHBondContact O-N 3.05Å; W212-L216 HydrophobicContact CE3-CD1 4.45Å; W212-L216 VanDerWaalsContact O-CB 3.24Å; W212-L216 WeakPolarHBondContact O-CB 3.23Å; W212-L216 VanDerWaalsContact O-CG 3.23Å; W212-L216 WeakPolarHBondContact O-CG 3.5Å; W212-L216 PolarHBondContact O-N 3.33Å
213	D	94.8	Very high	94.7	Very high	20 Å²	20	36.4 Å²	36.4	11%	0.107	19%	0.188	C	C	.	.	H	α-helix	trans	-53.3	-51.6	171.9	-73.2	-17	0	0	0	109.5	R44 W48 Q209 Q217	R44-D213 WeakPolarHBondContact CD-OD1 3.31Å; R44-D213 WeakPolarHBondContact CG-OD1 3.48Å; R44-D213 IonicContact CZ-OD2 3.9Å; R44-D213 IonicContact NE-OD1 2.97Å; R44-D213 PolarHBondContact NE-OD1 3.11Å; R44-D213 IonicContact NE-OD2 2.66Å; R44-D213 PolarHBondContact NE-OD2 2.98Å; R44-D213 IonicContact NH2-OD2 2.61Å; R44-D213 PolarHBondContact NH2-OD2 3.34Å; W48-D213 PolarHBondContact NE1-OD1 2.81Å; Q209-D213 WeakPolarHBondContact O-CB 3.35Å; Q209-D213 PolarHBondContact O-N 3.07Å; D213-Q217 VanDerWaalsContact O-CB 3.29Å; D213-Q217 WeakPolarHBondContact O-CB 3.29Å; D213-Q217 PolarHBondContact O-N 3.45Å
214	S	95	Very high	94.8	Very high	37 Å²	37	36.3 Å²	36.3	26%	0.259	19%	0.187	S	C	.	.	H	α-helix	trans	-70.8	-44.4	178.8	-59.9	0	0	0	0	112.9	A210 L211 W212 Q217 Q218	A210-S214 PolarHBondContact O-N 2.89Å; A210-S214 PolarHBondContact O-OG 3.3Å; L211-S214 PolarHBondContact O-N 3.34Å; W212-S214 VanDerWaalsContact C-N 3.3Å; W212-S214 PolarHBondContact O-N 2.9Å; S214-Q217 PolarHBondContact O-N 2.85Å; S214-Q218 WeakPolarHBondContact O-CG 3.3Å; S214-Q218 PolarHBondContact O-N 3.17Å
215	Y	97.4	Very high	95.1	Very high	1 Å²	1	29.7 Å²	29.7	0%	0.004	16%	0.162	C	C	.	.	H	α-helix	trans	-65.5	-44.2	-175.2	-168.8	-114.2	0	0	0	112.5	Y150 L198 L211 W212 Q218 A219 D220 P221 L223 I224 L227 F270	Y150-Y215 HydrophobicContact CD1-CD1 4.06Å; Y150-Y215 AromaticContact CD1-CE1 3.26Å; Y150-Y215 HydrophobicContact CD1-CE1 3.26Å; Y150-Y215 AromaticContact CD1-CZ 3.79Å; Y150-Y215 HydrophobicContact CE1-CD1 4.28Å; Y150-Y215 AromaticContact CE1-CE1 3.86Å; Y150-Y215 HydrophobicContact CE1-CE1 3.86Å; Y150-Y215 AromaticContact CG-CE1 3.89Å; Y150-Y215 HydrophobicContact CG-CE1 3.89Å; L198-Y215 HydrophobicContact CD1-CE1 4.32Å; L198-Y215 HydrophobicContact CD2-CE1 4.29Å; L211-Y215 WeakPolarHBondContact O-CB 3.45Å; L211-Y215 PolarHBondContact O-N 3.3Å; W212-Y215 PolarHBondContact O-N 3.05Å; Y215-Q218 PolarHBondContact O-N 3.34Å; Y215-A219 PolarHBondContact O-N 3.19Å; Y215-D220 PolarHBondContact OH-O 3.41Å; Y215-P221 WeakPolarHBondContact OH-CA 3.48Å; Y215-P221 PolarHBondContact OH-O 3.05Å; Y215-L223 HydrophobicContact CD2-CB 4.47Å; Y215-L223 HydrophobicContact CD2-CD2 4.08Å; Y215-L223 HydrophobicContact CD2-CG 4.43Å; Y215-L223 HydrophobicContact CE2-CB 3.85Å; Y215-L223 HydrophobicContact CE2-CD2 4.27Å; Y215-L223 HydrophobicContact CE2-CG 4.23Å; Y215-I224 HydrophobicContact CE2-CB 4.28Å; Y215-I224 WeakPolarHBondContact OH-CB 3.28Å; Y215-L227 HydrophobicContact CD2-CD1 3.78Å; Y215-L227 HydrophobicContact CE2-CD1 4.05Å; Y215-F270 HydrophobicContact CD2-CE1 4.25Å; Y215-F270 HydrophobicContact CD2-CZ 4.3Å
216	L	96.4	Very high	95.5	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-69.5	-38.4	179.4	-65.3	-179.6	0	0	0	111	W48 A51 L52 Y150 W212 A219	W48-L216 HydrophobicContact CB-CD1 4.23Å; W48-L216 HydrophobicContact CD2-CD1 3.57Å; W48-L216 HydrophobicContact CE3-CD1 3.91Å; W48-L216 HydrophobicContact CG-CD1 3.71Å; A51-L216 HydrophobicContact CB-CB 3.98Å; L52-L216 HydrophobicContact CD1-CD1 4.49Å; L52-L216 HydrophobicContact CD2-CD1 4.46Å; L52-L216 HydrophobicContact CD2-CD2 3.66Å; L52-L216 HydrophobicContact CG-CD1 4.38Å; L52-L216 HydrophobicContact CG-CD2 4.4Å; Y150-L216 HydrophobicContact CD2-CD2 4.15Å; Y150-L216 HydrophobicContact CE1-CD2 4.45Å; Y150-L216 HydrophobicContact CE2-CD2 3.6Å; W212-L216 HydrophobicContact CE3-CD1 4.45Å; W212-L216 VanDerWaalsContact O-CB 3.24Å; W212-L216 WeakPolarHBondContact O-CB 3.23Å; W212-L216 VanDerWaalsContact O-CG 3.23Å; W212-L216 WeakPolarHBondContact O-CG 3.5Å; W212-L216 PolarHBondContact O-N 3.33Å; L216-A219 PolarHBondContact O-N 3.46Å; L216-A219 VanDerWaalsContact O-N 3.13Å
217	Q	92.3	Very high	95.9	Very high	145 Å²	145	21.6 Å²	21.6	68%	0.678	12%	0.119	S	C	*	.	H	α-helix	trans	-63.1	-40.2	176	-171.9	179.1	16.7	0	0	112.4	D213 S214 A219	D213-Q217 VanDerWaalsContact O-CB 3.29Å; D213-Q217 WeakPolarHBondContact O-CB 3.29Å; D213-Q217 PolarHBondContact O-N 3.45Å; S214-Q217 PolarHBondContact O-N 2.85Å; Q217-A219 PolarHBondContact O-N 3.4Å
218	Q	92.8	Very high	96	Very high	68 Å²	68	21.4 Å²	21.4	32%	0.318	12%	0.118	S	C	.	.	H	α-helix	trans	-69.1	-20.3	175.5	-69.8	-167.7	34.2	0	0	113.4	S214 Y215 D220 L223	S214-Q218 WeakPolarHBondContact O-CG 3.3Å; S214-Q218 PolarHBondContact O-N 3.17Å; Y215-Q218 PolarHBondContact O-N 3.34Å; Q218-D220 PolarHBondContact O-N 3.27Å; Q218-D220 VanDerWaalsContact O-N 3.08Å; Q218-L223 HydrophobicContact CB-CD2 4.25Å
219	A	94.3	Very high	96.2	Very high	46 Å²	46	21.1 Å²	21.1	38%	0.38	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	29.4	174.9	0	0	0	0	0	115.1	Y215 L216 Q217	Y215-A219 PolarHBondContact O-N 3.19Å; L216-A219 PolarHBondContact O-N 3.46Å; L216-A219 VanDerWaalsContact O-N 3.13Å; Q217-A219 PolarHBondContact O-N 3.4Å
220	D	94.6	Very high	96.4	Very high	16 Å²	16	18.7 Å²	18.7	9%	0.086	11%	0.105	C	C	.	.			trans	-113.6	104.3	-176.7	179.5	10.3	0	0	0	112.9	Y215 Q218 F222 L223 Q277 R285	Y215-D220 PolarHBondContact OH-O 3.41Å; Q218-D220 PolarHBondContact O-N 3.27Å; Q218-D220 VanDerWaalsContact O-N 3.08Å; D220-F222 VanDerWaalsContact C-N 3.29Å; D220-F222 PolarHBondContact O-N 3.17Å; D220-F222 PolarHBondContact OD1-N 3.2Å; D220-L223 HydrophobicContact CB-CB 4.02Å; D220-L223 WeakPolarHBondContact O-CB 3.29Å; D220-L223 PolarHBondContact O-N 2.95Å; D220-Q277 PolarHBondContact OD2-NE2 2.96Å; D220-R285 IonicContact OD1-CZ 2.96Å; D220-R285 VanDerWaalsContact OD1-CZ 3.29Å; D220-R285 IonicContact OD1-NH1 3.72Å; D220-R285 PolarHBondContact OD1-NH1 2.87Å; D220-R285 IonicContact OD1-NH2 2.95Å; D220-R285 PolarHBondContact OD1-NH2 3.41Å; D220-R285 VanDerWaalsContact OD1-NH2 3.08Å; D220-R285 IonicContact OD2-CZ 3Å; D220-R285 IonicContact OD2-NH1 3.7Å; D220-R285 IonicContact OD2-NH2 3.41Å; D220-R285 PolarHBondContact OD2-NH2 3.33Å
221	P	95.4	Very high	96.5	Very high	22 Å²	22	18.2 Å²	18.2	14%	0.143	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.8	177.6	-25.9	36.5	0	0	0	114.8	K149 Y150 Y215 L223 I224 F292	K149-P221 HydrophobicContact CG-CG 4.25Å; K149-P221 VanDerWaalsContact O-CB 3.25Å; K149-P221 WeakPolarHBondContact O-CB 3.44Å; K149-P221 WeakPolarHBondContact O-CG 3.33Å; Y150-P221 HydrophobicContact CD1-CB 4.44Å; Y150-P221 HydrophobicContact CD1-CG 4.31Å; Y215-P221 WeakPolarHBondContact OH-CA 3.48Å; Y215-P221 PolarHBondContact OH-O 3.05Å; P221-L223 VanDerWaalsContact C-N 3.28Å; P221-L223 PolarHBondContact O-N 3Å; P221-I224 WeakPolarHBondContact O-CG2 3.49Å; P221-F292 HydrophobicContact CB-CD1 3.81Å; P221-F292 HydrophobicContact CB-CD2 3.94Å; P221-F292 HydrophobicContact CB-CE1 3.82Å; P221-F292 HydrophobicContact CB-CE2 3.98Å; P221-F292 HydrophobicContact CB-CG 3.85Å; P221-F292 HydrophobicContact CB-CZ 3.91Å; P221-F292 WeakPolarHBondContact O-CZ 3.08Å
222	F	96.8	Very high	96.5	Very high	9 Å²	9	18.1 Å²	18.1	4%	0.039	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-15.8	-176.9	-79.1	-96.8	0	0	0	113	L164 D220 I224 F225 F226 L284 R285 N288 F292	L164-F222 HydrophobicContact CD2-CE1 4.18Å; D220-F222 VanDerWaalsContact C-N 3.29Å; D220-F222 PolarHBondContact O-N 3.17Å; D220-F222 PolarHBondContact OD1-N 3.2Å; F222-I224 PolarHBondContact O-N 3.31Å; F222-I224 VanDerWaalsContact O-N 3.16Å; F222-F225 HydrophobicContact CD1-CD2 4.01Å; F222-F225 AromaticContact CD1-CE2 3.96Å; F222-F225 HydrophobicContact CD1-CE2 3.96Å; F222-F225 HydrophobicContact CE1-CE2 4.36Å; F222-F225 WeakPolarHBondContact O-CD2 3.38Å; F222-F225 PolarHBondContact O-N 3.46Å; F222-F226 WeakPolarHBondContact O-CD2 2.97Å; F222-L284 HydrophobicContact CD1-CD2 4.01Å; F222-R285 HydrophobicContact CD1-CB 4.45Å; F222-R285 HydrophobicContact CD2-CG 3.84Å; F222-R285 HydrophobicContact CE2-CG 3.93Å; F222-R285 HydrophobicContact CG-CB 4.41Å; F222-R285 HydrophobicContact CG-CG 4.18Å; F222-R285 HydrophobicContact CZ-CG 4.35Å; F222-N288 HydrophobicContact CE1-CB 4.1Å; F222-N288 HydrophobicContact CZ-CB 4.23Å; F222-N288 WeakPolarHBondContact CZ-O 3.44Å; F222-F292 HydrophobicContact CD1-CE2 4.23Å; F222-F292 HydrophobicContact CD2-CD2 4.12Å; F222-F292 AromaticContact CD2-CE2 3.84Å; F222-F292 HydrophobicContact CD2-CE2 3.84Å; F222-F292 HydrophobicContact CE1-CE2 4.1Å; F222-F292 AromaticContact CE2-CD2 3.64Å; F222-F292 HydrophobicContact CE2-CD2 3.64Å; F222-F292 AromaticContact CE2-CE2 3.7Å; F222-F292 HydrophobicContact CE2-CE2 3.7Å; F222-F292 HydrophobicContact CG-CE2 4.11Å; F222-F292 AromaticContact CZ-CD2 3.95Å; F222-F292 HydrophobicContact CZ-CD2 3.95Å; F222-F292 AromaticContact CZ-CE2 3.85Å; F222-F292 HydrophobicContact CZ-CE2 3.85Å
223	L	97.5	Very high	96.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60	-25.7	179.2	-177.7	65.3	0	0	0	112.2	Y215 Q218 D220 P221 F225 F226 L227 F270 A273	Y215-L223 HydrophobicContact CD2-CB 4.47Å; Y215-L223 HydrophobicContact CD2-CD2 4.08Å; Y215-L223 HydrophobicContact CD2-CG 4.43Å; Y215-L223 HydrophobicContact CE2-CB 3.85Å; Y215-L223 HydrophobicContact CE2-CD2 4.27Å; Y215-L223 HydrophobicContact CE2-CG 4.23Å; Q218-L223 HydrophobicContact CB-CD2 4.25Å; D220-L223 HydrophobicContact CB-CB 4.02Å; D220-L223 WeakPolarHBondContact O-CB 3.29Å; D220-L223 PolarHBondContact O-N 2.95Å; P221-L223 VanDerWaalsContact C-N 3.28Å; P221-L223 PolarHBondContact O-N 3Å; L223-F225 VanDerWaalsContact C-N 3.25Å; L223-F225 PolarHBondContact O-N 3.46Å; L223-F226 HydrophobicContact CD1-CB 4.43Å; L223-F226 PolarHBondContact O-N 3.27Å; L223-L227 HydrophobicContact CG-CG 4.4Å; L223-L227 PolarHBondContact O-N 2.92Å; L223-F270 HydrophobicContact CD2-CD1 3.82Å; L223-F270 HydrophobicContact CD2-CE1 3.59Å; L223-A273 HydrophobicContact CD1-CB 3.99Å
224	I	97.9	Very high	96.3	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-57.5	-38.2	177.6	-168.9	58.2	0	0	0	112.3	L195 L198 F199 Y215 P221 F222 F226 L227 M228	L195-I224 HydrophobicContact CD1-CB 4.32Å; L195-I224 HydrophobicContact CD1-CG1 3.67Å; L195-I224 HydrophobicContact CD1-CG2 3.61Å; L198-I224 HydrophobicContact CD2-CD1 4.03Å; L198-I224 HydrophobicContact CD2-CG1 4.14Å; F199-I224 HydrophobicContact CD2-CD1 3.96Å; F199-I224 HydrophobicContact CE2-CD1 3.28Å; F199-I224 HydrophobicContact CZ-CD1 3.81Å; Y215-I224 HydrophobicContact CE2-CB 4.28Å; Y215-I224 WeakPolarHBondContact OH-CB 3.28Å; P221-I224 WeakPolarHBondContact O-CG2 3.49Å; F222-I224 PolarHBondContact O-N 3.31Å; F222-I224 VanDerWaalsContact O-N 3.16Å; I224-F226 PolarHBondContact O-N 2.9Å; I224-L227 HydrophobicContact CD1-CD1 4.42Å; I224-L227 PolarHBondContact O-N 3.48Å; I224-M228 HydrophobicContact CG1-CG 4.45Å; I224-M228 HydrophobicContact CG1-SD 4.15Å; I224-M228 WeakPolarHBondContact O-CB 3.3Å; I224-M228 WeakPolarHBondContact O-CG 3.3Å; I224-M228 PolarHBondContact O-N 3.28Å
225	F	98.6	Very high	96.2	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-31.8	178.9	-64.5	-66.6	0	0	0	111.9	P152 P161 L164 Y165 L168 L195 F222 L223 L229 L291 F292	P152-F225 HydrophobicContact CG-CZ 4.46Å; P161-F225 HydrophobicContact CB-CE1 4.31Å; P161-F225 HydrophobicContact CB-CZ 4.29Å; P161-F225 WeakPolarHBondContact O-CE1 3.23Å; L164-F225 HydrophobicContact CD2-CE2 4.1Å; L164-F225 HydrophobicContact CD2-CZ 4.2Å; Y165-F225 HydrophobicContact CD2-CB 4.33Å; Y165-F225 HydrophobicContact CD2-CD1 4.13Å; Y165-F225 VanDerWaalsContact CE2-O 3.3Å; Y165-F225 WeakPolarHBondContact CE2-O 3.16Å; Y165-F225 HydrophobicContact CG-CD1 4.38Å; L168-F225 HydrophobicContact CD2-CB 3.76Å; L195-F225 HydrophobicContact CD2-CE1 4.31Å; F222-F225 HydrophobicContact CD1-CD2 4.01Å; F222-F225 AromaticContact CD1-CE2 3.96Å; F222-F225 HydrophobicContact CD1-CE2 3.96Å; F222-F225 HydrophobicContact CE1-CE2 4.36Å; F222-F225 WeakPolarHBondContact O-CD2 3.38Å; F222-F225 PolarHBondContact O-N 3.46Å; L223-F225 VanDerWaalsContact C-N 3.25Å; L223-F225 PolarHBondContact O-N 3.46Å; F225-L229 WeakPolarHBondContact O-CB 3.49Å; F225-L229 PolarHBondContact O-N 2.94Å; F225-L229 VanDerWaalsContact O-N 3.08Å; F225-L291 HydrophobicContact CZ-CD1 4.3Å; F225-F292 HydrophobicContact CE2-CE2 4.07Å; F225-F292 AromaticContact CE2-CZ 3.93Å; F225-F292 HydrophobicContact CE2-CZ 3.93Å; F225-F292 HydrophobicContact CZ-CZ 4.41Å
226	F	98.6	Very high	96	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.018	13%	0.129	C	C	.	.	H	α-helix	trans	-79.2	-38.9	177	-61.9	-80	0	0	0	111.6	L168 F222 L223 I224 M228 L229 I230 A273 Q277 T280 L284	L168-F226 HydrophobicContact CD1-CD1 4.37Å; L168-F226 HydrophobicContact CD1-CE1 3.65Å; L168-F226 HydrophobicContact CD1-CZ 4.13Å; L168-F226 HydrophobicContact CD2-CD1 4.09Å; L168-F226 HydrophobicContact CD2-CE1 4.01Å; L168-F226 HydrophobicContact CD2-CZ 4.41Å; L168-F226 HydrophobicContact CG-CE1 4.47Å; F222-F226 WeakPolarHBondContact O-CD2 2.97Å; L223-F226 HydrophobicContact CD1-CB 4.43Å; L223-F226 PolarHBondContact O-N 3.27Å; I224-F226 PolarHBondContact O-N 2.9Å; F226-M228 VanDerWaalsContact C-N 3.31Å; F226-M228 PolarHBondContact O-N 3.15Å; F226-L229 WeakPolarHBondContact O-CB 3.25Å; F226-L229 PolarHBondContact O-N 3.1Å; F226-L229 VanDerWaalsContact O-N 3.14Å; F226-I230 WeakPolarHBondContact O-CG1 3.34Å; F226-I230 PolarHBondContact O-N 3.38Å; F226-A273 HydrophobicContact CB-CB 3.8Å; F226-Q277 HydrophobicContact CD1-CB 4.1Å; F226-Q277 HydrophobicContact CD2-CB 4.05Å; F226-Q277 HydrophobicContact CD2-CG 4.23Å; F226-Q277 VanDerWaalsContact CE1-CA 3.49Å; F226-Q277 HydrophobicContact CE1-CB 4.03Å; F226-Q277 HydrophobicContact CE2-CB 3.97Å; F226-Q277 HydrophobicContact CE2-CG 3.8Å; F226-Q277 HydrophobicContact CG-CB 4.1Å; F226-Q277 HydrophobicContact CZ-CB 3.95Å; F226-Q277 HydrophobicContact CZ-CG 3.98Å; F226-T280 HydrophobicContact CE1-CG2 4.23Å; F226-T280 VanDerWaalsContact CE1-OG1 3.31Å; F226-T280 WeakPolarHBondContact CE1-OG1 3.46Å; F226-T280 HydrophobicContact CZ-CG2 4Å; F226-L284 HydrophobicContact CZ-CD2 4.49Å
227	L	98.5	Very high	95.6	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.5	-45	171.7	-63.6	172.7	0	0	0	111.1	F199 Y215 L223 I224 L229 I230 I231 L269 F270 A273	F199-L227 HydrophobicContact CE2-CB 3.86Å; F199-L227 HydrophobicContact CE2-CD1 4.29Å; F199-L227 HydrophobicContact CZ-CB 4.05Å; Y215-L227 HydrophobicContact CD2-CD1 3.78Å; Y215-L227 HydrophobicContact CE2-CD1 4.05Å; L223-L227 HydrophobicContact CG-CG 4.4Å; L223-L227 PolarHBondContact O-N 2.92Å; I224-L227 HydrophobicContact CD1-CD1 4.42Å; I224-L227 PolarHBondContact O-N 3.48Å; L227-L229 VanDerWaalsContact C-N 3.32Å; L227-L229 PolarHBondContact O-N 3.21Å; L227-I230 PolarHBondContact O-N 2.83Å; L227-I231 WeakPolarHBondContact O-CG1 3.2Å; L227-I231 PolarHBondContact O-N 2.81Å; L227-L269 HydrophobicContact CD2-CD1 4.32Å; L227-L269 HydrophobicContact CD2-CD2 4.07Å; L227-L269 HydrophobicContact CD2-CG 3.73Å; L227-F270 HydrophobicContact CD1-CE1 4.37Å; L227-F270 HydrophobicContact CD1-CZ 4.1Å; L227-F270 HydrophobicContact CD2-CD1 4.31Å; L227-F270 HydrophobicContact CD2-CD2 4.18Å; L227-F270 HydrophobicContact CD2-CE1 4.35Å; L227-F270 HydrophobicContact CD2-CE2 4.17Å; L227-F270 HydrophobicContact CD2-CG 4.27Å; L227-F270 HydrophobicContact CD2-CZ 4.27Å; L227-A273 HydrophobicContact CD2-CB 3.84Å; L227-A273 HydrophobicContact CG-CB 4.37Å
228	M	98.5	Very high	95.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.3	-42.9	174	-68.5	170	49.7	0	0	111.8	Y165 A191 W194 L195 F199 I224 F226 I231 L232	Y165-M228 HydrophobicContact CD1-CE 3.68Å; Y165-M228 HydrophobicContact CD2-CB 4.33Å; Y165-M228 HydrophobicContact CD2-CE 3.91Å; Y165-M228 HydrophobicContact CE1-CE 3.76Å; Y165-M228 HydrophobicContact CE2-CB 3.57Å; Y165-M228 HydrophobicContact CE2-CE 3.99Å; Y165-M228 HydrophobicContact CG-CE 3.76Å; Y165-M228 PolarHBondContact OH-O 3.29Å; A191-M228 HydrophobicContact CB-CE 3.65Å; W194-M228 HydrophobicContact CB-CG 4.48Å; W194-M228 HydrophobicContact CE3-CB 4.13Å; W194-M228 HydrophobicContact CE3-CE 4.44Å; W194-M228 HydrophobicContact CE3-CG 3.99Å; W194-M228 HydrophobicContact CZ3-CB 4.4Å; L195-M228 HydrophobicContact CB-SD 4.22Å; L195-M228 HydrophobicContact CD1-SD 4.06Å; F199-M228 HydrophobicContact CE1-CG 4.06Å; F199-M228 HydrophobicContact CZ-CG 3.67Å; I224-M228 HydrophobicContact CG1-CG 4.45Å; I224-M228 HydrophobicContact CG1-SD 4.15Å; I224-M228 WeakPolarHBondContact O-CB 3.3Å; I224-M228 WeakPolarHBondContact O-CG 3.3Å; I224-M228 PolarHBondContact O-N 3.28Å; F226-M228 VanDerWaalsContact C-N 3.31Å; F226-M228 PolarHBondContact O-N 3.15Å; M228-I231 PolarHBondContact O-N 2.84Å; M228-L232 WeakPolarHBondContact O-CB 3.27Å; M228-L232 PolarHBondContact O-N 2.86Å
229	L	98.5	Very high	95.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.1	-46.9	178.8	178.5	64.6	0	0	0	111.3	Y165 L168 L169 H172 F225 F226 L227 I231 L232 V233 Y276	Y165-L229 HydrophobicContact CE2-CB 4.22Å; Y165-L229 WeakPolarHBondContact OH-CA 3.47Å; Y165-L229 PolarHBondContact OH-N 2.68Å; L168-L229 HydrophobicContact CD2-CD2 4.44Å; L168-L229 HydrophobicContact CG-CD2 4.29Å; L169-L229 HydrophobicContact CD1-CD1 3.58Å; H172-L229 HydrophobicContact CB-CD2 4.13Å; F225-L229 WeakPolarHBondContact O-CB 3.49Å; F225-L229 PolarHBondContact O-N 2.94Å; F225-L229 VanDerWaalsContact O-N 3.08Å; F226-L229 WeakPolarHBondContact O-CB 3.25Å; F226-L229 PolarHBondContact O-N 3.1Å; F226-L229 VanDerWaalsContact O-N 3.14Å; L227-L229 VanDerWaalsContact C-N 3.32Å; L227-L229 PolarHBondContact O-N 3.21Å; L229-I231 PolarHBondContact O-N 2.9Å; L229-L232 PolarHBondContact O-N 2.92Å; L229-V233 HydrophobicContact CD1-CG2 4.04Å; L229-V233 HydrophobicContact CG-CG2 4.17Å; L229-V233 WeakPolarHBondContact O-CB 3.4Å; L229-V233 WeakPolarHBondContact O-CG2 3.49Å; L229-V233 PolarHBondContact O-N 3.22Å; L229-Y276 HydrophobicContact CD2-CD1 3.57Å; L229-Y276 HydrophobicContact CD2-CE1 4.11Å; L229-Y276 HydrophobicContact CD2-CG 4.08Å
230	I	97.9	Very high	95	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.015	12%	0.12	C	C	.	.	H	α-helix	trans	-63	-43.5	-179.9	-57.9	-47.6	0	0	0	111.4	F226 L227 L232 V233 N234 L269 L272 A273 Y276	F226-I230 WeakPolarHBondContact O-CG1 3.34Å; F226-I230 PolarHBondContact O-N 3.38Å; L227-I230 PolarHBondContact O-N 2.83Å; I230-L232 VanDerWaalsContact C-N 3.26Å; I230-L232 PolarHBondContact O-N 2.87Å; I230-V233 PolarHBondContact O-N 2.82Å; I230-N234 WeakPolarHBondContact O-CB 3.29Å; I230-N234 VanDerWaalsContact O-CG 3.24Å; I230-N234 PolarHBondContact O-N 3.38Å; I230-L269 HydrophobicContact CB-CD1 3.65Å; I230-L269 HydrophobicContact CG1-CD1 4.36Å; I230-L269 HydrophobicContact CG2-CD1 3.61Å; I230-L272 HydrophobicContact CD1-CB 3.85Å; I230-L272 HydrophobicContact CG1-CB 3.94Å; I230-L272 HydrophobicContact CG2-CB 4.26Å; I230-L272 HydrophobicContact CG2-CD1 4Å; I230-A273 HydrophobicContact CG1-CB 4.3Å; I230-Y276 HydrophobicContact CD1-CD2 3.36Å; I230-Y276 HydrophobicContact CD1-CE2 3.47Å; I230-Y276 VanDerWaalsContact CD1-CE2 3.47Å; I230-Y276 HydrophobicContact CD1-CG 4.12Å
231	I	96.8	Very high	94.6	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.036	15%	0.149	C	C	.	.	H	α-helix	trans	-58.7	-42.1	176.9	-67	167.6	0	0	0	110.5	W194 F199 L227 M228 L229 A235 P258 L261 L269	W194-I231 HydrophobicContact CH2-CB 4.45Å; W194-I231 HydrophobicContact CH2-CG2 3.74Å; W194-I231 HydrophobicContact CZ2-CG2 4.12Å; W194-I231 HydrophobicContact CZ3-CB 4.48Å; W194-I231 HydrophobicContact CZ3-CG2 4.22Å; F199-I231 HydrophobicContact CD1-CD1 3.98Å; F199-I231 HydrophobicContact CE1-CD1 3.38Å; F199-I231 HydrophobicContact CE2-CD1 4.36Å; F199-I231 HydrophobicContact CZ-CD1 3.61Å; L227-I231 WeakPolarHBondContact O-CG1 3.2Å; L227-I231 PolarHBondContact O-N 2.81Å; M228-I231 PolarHBondContact O-N 2.84Å; L229-I231 PolarHBondContact O-N 2.9Å; I231-A235 PolarHBondContact O-N 2.86Å; I231-P258 HydrophobicContact CD1-CB 4.33Å; I231-P258 HydrophobicContact CD1-CG 4.34Å; I231-P258 HydrophobicContact CG2-CG 4.21Å; I231-L261 HydrophobicContact CD1-CD1 4Å; I231-L261 HydrophobicContact CG1-CD1 4.21Å; I231-L269 HydrophobicContact CG1-CD1 4.33Å
232	L	96.5	Very high	93.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-70.6	-41	178.7	-177.7	59.6	0	0	0	112.7	Y165 L169 L176 L180 Y190 M228 L229 I230 N234 A235 K236 I239 L254	Y165-L232 HydrophobicContact CE1-CD2 4.34Å; Y165-L232 WeakPolarHBondContact OH-CD2 3.39Å; L169-L232 HydrophobicContact CD1-CD2 3.72Å; L169-L232 HydrophobicContact CD1-CG 4.48Å; L169-L232 HydrophobicContact CD2-CD2 3.68Å; L169-L232 HydrophobicContact CG-CD2 4.32Å; L176-L232 HydrophobicContact CD2-CD1 4.43Å; L176-L232 HydrophobicContact CD2-CD2 4.49Å; L176-L232 HydrophobicContact CD2-CG 3.95Å; L180-L232 HydrophobicContact CD1-CD2 4.31Å; Y190-L232 HydrophobicContact CE2-CD1 4.45Å; Y190-L232 HydrophobicContact CE2-CD2 4.32Å; Y190-L232 WeakPolarHBondContact OH-CD2 3.4Å; M228-L232 WeakPolarHBondContact O-CB 3.27Å; M228-L232 PolarHBondContact O-N 2.86Å; L229-L232 PolarHBondContact O-N 2.92Å; I230-L232 VanDerWaalsContact C-N 3.26Å; I230-L232 PolarHBondContact O-N 2.87Å; L232-N234 VanDerWaalsContact C-N 3.29Å; L232-N234 PolarHBondContact O-N 2.78Å; L232-A235 PolarHBondContact O-N 3.28Å; L232-A235 VanDerWaalsContact O-N 3.12Å; L232-K236 PolarHBondContact O-N 2.93Å; L232-I239 HydrophobicContact CD1-CD1 4.24Å; L232-L254 HydrophobicContact CD1-CD1 4.36Å; L232-L254 HydrophobicContact CD1-CD2 3.39Å
233	V	95.1	Very high	91.9	Very high	28 Å²	28	35.2 Å²	35.2	17%	0.17	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-40	175.4	169.6	0	0	0	0	110.8	E173 L229 I230 A235 K236	E173-V233 HydrophobicContact CG-CG2 3.74Å; L229-V233 HydrophobicContact CD1-CG2 4.04Å; L229-V233 HydrophobicContact CG-CG2 4.17Å; L229-V233 WeakPolarHBondContact O-CB 3.4Å; L229-V233 WeakPolarHBondContact O-CG2 3.49Å; L229-V233 PolarHBondContact O-N 3.22Å; I230-V233 PolarHBondContact O-N 2.82Å; V233-A235 PolarHBondContact O-N 3.12Å; V233-K236 WeakPolarHBondContact O-CB 3.38Å; V233-K236 PolarHBondContact O-N 2.67Å
234	N	93.8	Very high	90.1	Very high	107 Å²	107	40.3 Å²	40.3	57%	0.572	23%	0.227	S	C	*	.	H	α-helix	trans	-62.8	-27.6	177.1	-72.5	-10.7	0	0	0	112.6	I230 L232	I230-N234 WeakPolarHBondContact O-CB 3.29Å; I230-N234 VanDerWaalsContact O-CG 3.24Å; I230-N234 PolarHBondContact O-N 3.38Å; L232-N234 VanDerWaalsContact C-N 3.29Å; L232-N234 PolarHBondContact O-N 2.78Å
235	A	92.1	Very high	89	Confident	10 Å²	10	43.6 Å²	43.6	8%	0.083	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-8	175.2	0	0	0	0	0	113.7	I231 L232 V233 E237 T238 I239 L254	I231-A235 PolarHBondContact O-N 2.86Å; L232-A235 PolarHBondContact O-N 3.28Å; L232-A235 VanDerWaalsContact O-N 3.12Å; V233-A235 PolarHBondContact O-N 3.12Å; A235-E237 PolarHBondContact O-N 3.43Å; A235-T238 PolarHBondContact O-N 3.13Å; A235-I239 HydrophobicContact CB-CD1 3.81Å; A235-I239 HydrophobicContact CB-CG1 4.39Å; A235-I239 WeakPolarHBondContact O-CD1 3.47Å; A235-I239 VanDerWaalsContact O-CG1 3.23Å; A235-I239 WeakPolarHBondContact O-CG1 3.37Å; A235-I239 PolarHBondContact O-N 3.4Å; A235-I239 VanDerWaalsContact O-N 3.07Å; A235-L254 HydrophobicContact CB-CD2 4.31Å
236	K	92.1	Very high	88.5	Confident	34 Å²	34	45.8 Å²	45.8	15%	0.148	26%	0.258	C	S	.	.	H	α-helix	trans	-52	-53.5	-171.8	177.9	-179.1	173.6	175.9	0	113.7	E173 E175 L176 L232 V233 T238 I239 L240	E173-K236 WeakPolarHBondContact OE2-CE 3.46Å; E173-K236 IonicContact OE2-NZ 3.81Å; E173-K236 PolarHBondContact OE2-NZ 2.79Å; E175-K236 IonicContact OE2-NZ 3.42Å; L176-K236 HydrophobicContact CD1-CG 4.47Å; L176-K236 HydrophobicContact CD2-CB 4.06Å; L176-K236 HydrophobicContact CD2-CG 4.18Å; L232-K236 PolarHBondContact O-N 2.93Å; V233-K236 WeakPolarHBondContact O-CB 3.38Å; V233-K236 PolarHBondContact O-N 2.67Å; K236-T238 VanDerWaalsContact C-N 3.29Å; K236-T238 PolarHBondContact O-N 2.91Å; K236-I239 PolarHBondContact O-N 2.75Å; K236-L240 HydrophobicContact CD-CD1 4.34Å; K236-L240 HydrophobicContact CG-CD1 3.71Å; K236-L240 HydrophobicContact CG-CG 4.27Å; K236-L240 WeakPolarHBondContact O-CB 3.38Å; K236-L240 WeakPolarHBondContact O-CG 3.31Å; K236-L240 PolarHBondContact O-N 3.28Å
237	E	89.9	Confident	88.2	Confident	131 Å²	131	49.3 Å²	49.3	61%	0.612	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-38.2	-174.3	-67.9	-68.9	152.3	0	0	111.4	A235 T241	A235-E237 PolarHBondContact O-N 3.43Å; E237-T241 VanDerWaalsContact O-CB 3.31Å; E237-T241 WeakPolarHBondContact O-CB 3.36Å; E237-T241 PolarHBondContact O-N 3.03Å; E237-T241 VanDerWaalsContact O-N 3.09Å; E237-T241 PolarHBondContact O-OG1 3.4Å
238	T	89.4	Confident	87.9	Confident	64 Å²	64	55.1 Å²	55.1	39%	0.393	30%	0.3	S	S	.	.	H	α-helix	trans	-62.9	-50.8	174.9	-50.9	0	0	0	0	110.7	A235 K236 L240 T241 E242	A235-T238 PolarHBondContact O-N 3.13Å; K236-T238 VanDerWaalsContact C-N 3.29Å; K236-T238 PolarHBondContact O-N 2.91Å; T238-L240 PolarHBondContact O-N 3.19Å; T238-T241 PolarHBondContact O-N 3.39Å; T238-E242 WeakPolarHBondContact CG2-OE2 3.25Å; T238-E242 WeakPolarHBondContact O-CB 3.33Å; T238-E242 WeakPolarHBondContact O-CG 3.48Å; T238-E242 PolarHBondContact O-N 3.05Å
239	I	89.4	Confident	87.6	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-60.8	-44.1	-178.4	-62.2	160.3	0	0	0	112	L176 F179 L232 A235 K236 T241 I250 M253 L254	L176-I239 HydrophobicContact CD1-CD1 4.26Å; L176-I239 HydrophobicContact CD1-CG2 4.27Å; F179-I239 HydrophobicContact CD1-CG2 3.74Å; F179-I239 HydrophobicContact CE1-CG2 3.3Å; F179-I239 HydrophobicContact CZ-CG2 4.06Å; L232-I239 HydrophobicContact CD1-CD1 4.24Å; A235-I239 HydrophobicContact CB-CD1 3.81Å; A235-I239 HydrophobicContact CB-CG1 4.39Å; A235-I239 WeakPolarHBondContact O-CD1 3.47Å; A235-I239 VanDerWaalsContact O-CG1 3.23Å; A235-I239 WeakPolarHBondContact O-CG1 3.37Å; A235-I239 PolarHBondContact O-N 3.4Å; A235-I239 VanDerWaalsContact O-N 3.07Å; K236-I239 PolarHBondContact O-N 2.75Å; I239-T241 VanDerWaalsContact C-N 3.32Å; I239-I250 HydrophobicContact CG2-CG2 4.38Å; I239-M253 HydrophobicContact CD1-CE 4.3Å; I239-M253 HydrophobicContact CG1-CE 3.45Å; I239-M253 VanDerWaalsContact CG1-CE 3.45Å; I239-L254 HydrophobicContact CD1-CD2 3.49Å; I239-L254 VanDerWaalsContact CD1-CD2 3.49Å; I239-L254 HydrophobicContact CD1-CG 4.32Å; I239-L254 HydrophobicContact CG1-CD2 4.35Å
240	L	87.8	Confident	87.4	Confident	35 Å²	35	59.2 Å²	59.2	18%	0.183	32%	0.322	C	S	.	.	H	α-helix	trans	-74.6	-23.7	-177.9	-66.9	-179.9	0	0	0	112.5	E175 F179 K236 T238 E243	E175-L240 HydrophobicContact CG-CD1 4.37Å; F179-L240 HydrophobicContact CB-CD2 3.92Å; F179-L240 HydrophobicContact CD1-CD2 4.42Å; F179-L240 HydrophobicContact CD2-CD2 3.94Å; F179-L240 HydrophobicContact CG-CD2 3.84Å; K236-L240 HydrophobicContact CD-CD1 4.34Å; K236-L240 HydrophobicContact CG-CD1 3.71Å; K236-L240 HydrophobicContact CG-CG 4.27Å; K236-L240 WeakPolarHBondContact O-CB 3.38Å; K236-L240 WeakPolarHBondContact O-CG 3.31Å; K236-L240 PolarHBondContact O-N 3.28Å; T238-L240 PolarHBondContact O-N 3.19Å; L240-E243 VanDerWaalsContact O-CG 3.27Å; L240-E243 WeakPolarHBondContact O-CG 3.43Å
241	T	85.5	Confident	87.3	Confident	113 Å²	113	60.5 Å²	60.5	69%	0.693	33%	0.328	S	S	*	.	H	α-helix	trans	-80.9	-33.4	176	-56.3	0	0	0	0	111.6	E237 T238 I239 E243	E237-T241 VanDerWaalsContact O-CB 3.31Å; E237-T241 WeakPolarHBondContact O-CB 3.36Å; E237-T241 PolarHBondContact O-N 3.03Å; E237-T241 VanDerWaalsContact O-N 3.09Å; E237-T241 PolarHBondContact O-OG1 3.4Å; T238-T241 PolarHBondContact O-N 3.39Å; I239-T241 VanDerWaalsContact C-N 3.32Å; T241-E243 VanDerWaalsContact C-N 3.25Å; T241-E243 PolarHBondContact O-N 3.37Å; T241-E243 VanDerWaalsContact O-N 3.17Å
242	E	71.4	Confident	87.2	Confident	68 Å²	68	67 Å²	67	32%	0.318	36%	0.356	S	S	.	.			trans	-86.4	35.8	-175.7	-71.1	175.3	172.9	0	0	113.2	T238 A244 E245	T238-E242 WeakPolarHBondContact CG2-OE2 3.25Å; T238-E242 WeakPolarHBondContact O-CB 3.33Å; T238-E242 WeakPolarHBondContact O-CG 3.48Å; T238-E242 PolarHBondContact O-N 3.05Å; E242-A244 PolarHBondContact O-N 3.46Å; E242-E245 HydrophobicContact CB-CG 3.99Å; E242-E245 PolarHBondContact O-N 3.44Å
243	E	64	Low	87.1	Confident	132 Å²	132	69.2 Å²	69.2	62%	0.617	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-21.8	-174	-62.7	-169.2	147	0	0	115	F179 K183 L240 T241	F179-E243 HydrophobicContact CE2-CG 4.39Å; K183-E243 PolarHBondContact NZ-O 2.92Å; L240-E243 VanDerWaalsContact O-CG 3.27Å; L240-E243 WeakPolarHBondContact O-CG 3.43Å; T241-E243 VanDerWaalsContact C-N 3.25Å; T241-E243 PolarHBondContact O-N 3.37Å; T241-E243 VanDerWaalsContact O-N 3.17Å
244	A	60.2	Low	87.1	Confident	107 Å²	107	67.9 Å²	67.9	88%	0.884	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.1	-179.5	0	0	0	0	0	115.2	E242	E242-A244 PolarHBondContact O-N 3.46Å
245	E	74.6	Confident	87.2	Confident	69 Å²	69	65.7 Å²	65.7	32%	0.322	35%	0.346	S	S	.	.	S	Bend	trans	-75.1	153.3	-179.8	-68.7	-165.5	169.8	0	0	113.3	E242 D249 I250	E242-E245 HydrophobicContact CB-CG 3.99Å; E242-E245 PolarHBondContact O-N 3.44Å; E245-D249 HydrophobicContact CB-CB 4.47Å; E245-I250 HydrophobicContact CB-CG1 4.14Å
246	S	87.8	Confident	87.3	Confident	48 Å²	48	68.2 Å²	68.2	34%	0.336	36%	0.36	S	S	.	.			trans	-67.5	155.2	177.2	80.3	0	0	0	0	110.4	E248 D249 I250	S246-E248 PolarHBondContact O-N 3.09Å; S246-D249 WeakPolarHBondContact CB-OD2 3.42Å; S246-D249 PolarHBondContact O-N 3.12Å; S246-D249 PolarHBondContact OG-N 2.83Å; S246-D249 PolarHBondContact OG-OD2 2.87Å; S246-I250 WeakPolarHBondContact O-CG1 3.14Å; S246-I250 PolarHBondContact O-N 2.96Å
247	K	91.6	Very high	87.4	Confident	77 Å²	77	67.2 Å²	67.2	34%	0.335	36%	0.357	S	S	.	.	H	α-helix	trans	-56.6	-40	179	178	-171	169.2	178.3	0	110.8	K184 I185 I251	K184-K247 WeakPolarHBondContact O-CE 3.06Å; K184-K247 PolarHBondContact O-NZ 3.25Å; I185-K247 HydrophobicContact CD1-CG 4.11Å; I185-K247 HydrophobicContact CG1-CD 4.45Å; I185-K247 HydrophobicContact CG1-CG 3.7Å; K247-I251 HydrophobicContact CG-CD1 4.03Å; K247-I251 VanDerWaalsContact O-CG1 3.32Å; K247-I251 WeakPolarHBondContact O-CG1 3.4Å; K247-I251 PolarHBondContact O-N 3.34Å; K247-I251 VanDerWaalsContact O-N 3.09Å
248	E	94	Very high	87.7	Confident	123 Å²	123	61 Å²	61	58%	0.575	33%	0.328	S	S	*	.	H	α-helix	trans	-69.7	-37.4	-177	-66.8	66.4	-146.5	0	0	112.1	S246 I251 K252	S246-E248 PolarHBondContact O-N 3.09Å; E248-I251 PolarHBondContact O-N 3.11Å; E248-K252 WeakPolarHBondContact O-CB 3.48Å; E248-K252 PolarHBondContact O-N 3.22Å
249	D	92.3	Very high	88	Confident	84 Å²	84	60 Å²	60	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-44.7	176.8	-64.2	-40.5	0	0	0	110.9	E245 S246 I251 K252 M253	E245-D249 HydrophobicContact CB-CB 4.47Å; S246-D249 WeakPolarHBondContact CB-OD2 3.42Å; S246-D249 PolarHBondContact O-N 3.12Å; S246-D249 PolarHBondContact OG-N 2.83Å; S246-D249 PolarHBondContact OG-OD2 2.87Å; D249-I251 VanDerWaalsContact C-N 3.35Å; D249-I251 PolarHBondContact O-N 2.85Å; D249-K252 PolarHBondContact O-N 2.72Å; D249-M253 WeakPolarHBondContact O-CB 3.43Å; D249-M253 PolarHBondContact O-N 3.07Å
250	I	93.8	Very high	88.2	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-45.4	175.6	-61.9	170.5	0	0	0	110.4	F179 I185 I239 E245 S246 K252 M253 L254	F179-I250 HydrophobicContact CE1-CD1 4.27Å; F179-I250 HydrophobicContact CZ-CD1 4.26Å; I185-I250 HydrophobicContact CD1-CB 3.89Å; I185-I250 HydrophobicContact CD1-CD1 4.29Å; I185-I250 HydrophobicContact CD1-CG2 3.63Å; I239-I250 HydrophobicContact CG2-CG2 4.38Å; E245-I250 HydrophobicContact CB-CG1 4.14Å; S246-I250 WeakPolarHBondContact O-CG1 3.14Å; S246-I250 PolarHBondContact O-N 2.96Å; I250-K252 VanDerWaalsContact C-N 3.33Å; I250-K252 PolarHBondContact O-N 3.11Å; I250-M253 PolarHBondContact O-N 3.31Å; I250-L254 HydrophobicContact CG2-CD1 4.04Å; I250-L254 HydrophobicContact CG2-CG 4.37Å; I250-L254 WeakPolarHBondContact O-CB 3.48Å; I250-L254 VanDerWaalsContact O-CG 3.28Å; I250-L254 WeakPolarHBondContact O-CG 3.34Å; I250-L254 PolarHBondContact O-N 3.17Å
251	I	95.7	Very high	88.6	Confident	29 Å²	29	65.4 Å²	65.4	15%	0.149	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-45.5	178	-73.1	168.3	0	0	0	110.9	I185 S189 K247 E248 D249 L254 E255	I185-I251 HydrophobicContact CD1-CG1 4.37Å; I185-I251 HydrophobicContact CG1-CD1 4.36Å; I185-I251 HydrophobicContact CG1-CG1 4.19Å; I185-I251 HydrophobicContact CG2-CD1 4.49Å; I185-I251 HydrophobicContact CG2-CG1 3.86Å; S189-I251 WeakPolarHBondContact O-CG2 3.47Å; K247-I251 HydrophobicContact CG-CD1 4.03Å; K247-I251 VanDerWaalsContact O-CG1 3.32Å; K247-I251 WeakPolarHBondContact O-CG1 3.4Å; K247-I251 PolarHBondContact O-N 3.34Å; K247-I251 VanDerWaalsContact O-N 3.09Å; E248-I251 PolarHBondContact O-N 3.11Å; D249-I251 VanDerWaalsContact C-N 3.35Å; D249-I251 PolarHBondContact O-N 2.85Å; I251-L254 PolarHBondContact O-N 2.48Å; I251-E255 WeakPolarHBondContact O-CB 3.43Å; I251-E255 PolarHBondContact O-N 3.05Å
252	K	94.1	Very high	89	Confident	143 Å²	143	64.4 Å²	64.4	62%	0.622	34%	0.34	S	S	*	.	H	α-helix	trans	-65.9	-42.8	-179	-175	-179.7	179.4	-176.3	0	111.8	E248 D249 I250 E255 T256	E248-K252 WeakPolarHBondContact O-CB 3.48Å; E248-K252 PolarHBondContact O-N 3.22Å; D249-K252 PolarHBondContact O-N 2.72Å; I250-K252 VanDerWaalsContact C-N 3.33Å; I250-K252 PolarHBondContact O-N 3.11Å; K252-E255 PolarHBondContact O-N 3.1Å; K252-T256 WeakPolarHBondContact O-CG2 3.39Å; K252-T256 PolarHBondContact O-N 3.06Å; K252-T256 PolarHBondContact O-OG1 3.25Å
253	M	93.9	Very high	90	Very high	47 Å²	47	63 Å²	63	23%	0.232	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-48.9	175.6	-178	-83.8	-70.4	0	0	110.5	I239 D249 I250 T256 S257	I239-M253 HydrophobicContact CD1-CE 4.3Å; I239-M253 HydrophobicContact CG1-CE 3.45Å; I239-M253 VanDerWaalsContact CG1-CE 3.45Å; D249-M253 WeakPolarHBondContact O-CB 3.43Å; D249-M253 PolarHBondContact O-N 3.07Å; I250-M253 PolarHBondContact O-N 3.31Å; M253-T256 PolarHBondContact O-N 3.12Å; M253-T256 PolarHBondContact O-OG1 3.21Å; M253-S257 PolarHBondContact O-N 3.23Å; M253-S257 PolarHBondContact O-OG 3.1Å; M253-S257 VanDerWaalsContact O-OG 3.07Å
254	L	95.2	Very high	91.4	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-56	-56.7	175	-75.7	177.9	0	0	0	111	L180 I185 Y190 W194 L232 A235 I239 I250 I251 T256 S257	L180-L254 HydrophobicContact CD2-CD1 4.19Å; I185-L254 HydrophobicContact CG2-CD1 4.46Å; Y190-L254 HydrophobicContact CD1-CD1 3.79Å; Y190-L254 HydrophobicContact CD2-CB 4.23Å; Y190-L254 HydrophobicContact CD2-CD1 4.42Å; Y190-L254 HydrophobicContact CE1-CD1 4.09Å; Y190-L254 HydrophobicContact CG-CB 3.95Å; Y190-L254 HydrophobicContact CG-CD1 3.97Å; W194-L254 WeakPolarHBondContact CZ2-O 3.31Å; L232-L254 HydrophobicContact CD1-CD1 4.36Å; L232-L254 HydrophobicContact CD1-CD2 3.39Å; A235-L254 HydrophobicContact CB-CD2 4.31Å; I239-L254 HydrophobicContact CD1-CD2 3.49Å; I239-L254 VanDerWaalsContact CD1-CD2 3.49Å; I239-L254 HydrophobicContact CD1-CG 4.32Å; I239-L254 HydrophobicContact CG1-CD2 4.35Å; I250-L254 HydrophobicContact CG2-CD1 4.04Å; I250-L254 HydrophobicContact CG2-CG 4.37Å; I250-L254 WeakPolarHBondContact O-CB 3.48Å; I250-L254 VanDerWaalsContact O-CG 3.28Å; I250-L254 WeakPolarHBondContact O-CG 3.34Å; I250-L254 PolarHBondContact O-N 3.17Å; I251-L254 PolarHBondContact O-N 2.48Å; L254-T256 PolarHBondContact O-N 3.31Å; L254-S257 WeakPolarHBondContact O-CB 3.21Å; L254-S257 PolarHBondContact O-N 3.35Å; L254-S257 PolarHBondContact O-OG 3.28Å; L254-S257 VanDerWaalsContact O-OG 3.06Å
255	E	95.6	Very high	93.1	Very high	62 Å²	62	61 Å²	61	29%	0.29	31%	0.314	S	S	.	.	H	α-helix	trans	-48.8	-40.9	-177.8	-178.6	172.5	-152	0	0	112.5	N193 W194 H202 I251 K252 P258	N193-E255 PolarHBondContact ND2-OE1 2.6Å; W194-E255 PolarHBondContact NE1-O 3.15Å; H202-E255 PolarHBondContact CD2-O 2.96Å; H202-E255 WeakPolarHBondContact NE2-CG 3.37Å; H202-E255 PolarHBondContact NE2-O 3.12Å; I251-E255 WeakPolarHBondContact O-CB 3.43Å; I251-E255 PolarHBondContact O-N 3.05Å; K252-E255 PolarHBondContact O-N 3.1Å; E255-P258 WeakPolarHBondContact O-CD 3.41Å
256	T	94.9	Very high	94.1	Very high	63 Å²	63	57.9 Å²	57.9	39%	0.387	30%	0.3	S	S	.	.	H	α-helix	trans	-81.7	-8.4	-179.9	62.1	0	0	0	0	115.8	K252 M253 L254 S259	K252-T256 WeakPolarHBondContact O-CG2 3.39Å; K252-T256 PolarHBondContact O-N 3.06Å; K252-T256 PolarHBondContact O-OG1 3.25Å; M253-T256 PolarHBondContact O-N 3.12Å; M253-T256 PolarHBondContact O-OG1 3.21Å; L254-T256 PolarHBondContact O-N 3.31Å; T256-S259 VanDerWaalsContact O-CB 3.3Å; T256-S259 WeakPolarHBondContact O-CB 3.08Å; T256-S259 PolarHBondContact O-N 3.18Å; T256-S259 PolarHBondContact O-OG 3.48Å
257	S	94.9	Very high	94.4	Very high	12 Å²	12	60.4 Å²	60.4	8%	0.084	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-54.3	-38.8	-175.1	-65.5	0	0	0	0	115.1	M253 L254 S259 L260	M253-S257 PolarHBondContact O-N 3.23Å; M253-S257 PolarHBondContact O-OG 3.1Å; M253-S257 VanDerWaalsContact O-OG 3.07Å; L254-S257 WeakPolarHBondContact O-CB 3.21Å; L254-S257 PolarHBondContact O-N 3.35Å; L254-S257 PolarHBondContact O-OG 3.28Å; L254-S257 VanDerWaalsContact O-OG 3.06Å; S257-S259 PolarHBondContact O-N 3.03Å; S257-S259 VanDerWaalsContact O-N 3.17Å; S257-L260 WeakPolarHBondContact O-CB 3.31Å; S257-L260 PolarHBondContact O-N 2.76Å; S257-L260 VanDerWaalsContact O-N 3.17Å
258	P	96.4	Very high	94.6	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-63.3	-22.1	177.1	-19.6	30.7	0	0	0	113.9	W194 F199 H202 C203 I231 E255 L260 L261	W194-P258 HydrophobicContact CD2-CG 4.05Å; W194-P258 VanDerWaalsContact CE2-CG 3.46Å; W194-P258 HydrophobicContact CG-CG 4.18Å; W194-P258 HydrophobicContact CZ2-CG 3.84Å; W194-P258 VanDerWaalsContact NE1-CG 3.29Å; F199-P258 HydrophobicContact CD1-CB 4.06Å; F199-P258 HydrophobicContact CD1-CG 3.98Å; F199-P258 HydrophobicContact CE1-CG 4.39Å; H202-P258 HydrophobicContact CB-CB 4.11Å; H202-P258 HydrophobicContact CB-CG 4.4Å; C203-P258 PolarHBondContact SG-O 3.34Å; C203-P258 VanDerWaalsContact SG-O 3.35Å; I231-P258 HydrophobicContact CD1-CB 4.33Å; I231-P258 HydrophobicContact CD1-CG 4.34Å; I231-P258 HydrophobicContact CG2-CG 4.21Å; E255-P258 WeakPolarHBondContact O-CD 3.41Å; P258-L260 PolarHBondContact O-N 3.22Å; P258-L261 WeakPolarHBondContact O-CB 3.47Å; P258-L261 PolarHBondContact O-N 2.8Å
259	S	94.8	Very high	94.7	Very high	44 Å²	44	56.1 Å²	56.1	31%	0.308	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-70.1	-12.5	178.8	73.6	0	0	0	0	113.8	H202 T256 S257	H202-S259 WeakPolarHBondContact O-CB 3.42Å; T256-S259 VanDerWaalsContact O-CB 3.3Å; T256-S259 WeakPolarHBondContact O-CB 3.08Å; T256-S259 PolarHBondContact O-N 3.18Å; T256-S259 PolarHBondContact O-OG 3.48Å; S257-S259 PolarHBondContact O-N 3.03Å; S257-S259 VanDerWaalsContact O-N 3.17Å
260	L	94	Very high	94.9	Very high	135 Å²	135	52.5 Å²	52.5	71%	0.707	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-83.7	-12.5	177	-58	177	0	0	0	113	S257 P258	S257-L260 WeakPolarHBondContact O-CB 3.31Å; S257-L260 PolarHBondContact O-N 2.76Å; S257-L260 VanDerWaalsContact O-N 3.17Å; P258-L260 PolarHBondContact O-N 3.22Å
261	L	95.6	Very high	95.1	Very high	16 Å²	16	55.1 Å²	55.1	8%	0.084	29%	0.289	C	S	.	.			trans	-69.9	141.1	179.3	-68.6	169.7	0	0	0	111.4	V207 I231 P258 D265 L269	V207-L261 HydrophobicContact CG1-CB 3.94Å; V207-L261 WeakPolarHBondContact CG2-O 3.18Å; I231-L261 HydrophobicContact CD1-CD1 4Å; I231-L261 HydrophobicContact CG1-CD1 4.21Å; P258-L261 WeakPolarHBondContact O-CB 3.47Å; P258-L261 PolarHBondContact O-N 2.8Å; L261-D265 HydrophobicContact CD2-CB 4.24Å; L261-L269 HydrophobicContact CD1-CD2 4.14Å
262	E	95.2	Very high	95.1	Very high	91 Å²	91	57.1 Å²	57.1	43%	0.425	30%	0.3	S	S	.	.			trans	-106.9	164.2	170	-55.5	-159.8	151.7	0	0	110.9	E264 D265	E262-E264 HydrophobicContact CB-CG 4.14Å; E262-E264 PolarHBondContact O-N 2.71Å; E262-D265 PolarHBondContact N-OD2 3.42Å; E262-D265 WeakPolarHBondContact O-CB 3.46Å; E262-D265 PolarHBondContact O-N 3.38Å
263	A	92.3	Very high	95.3	Very high	39 Å²	39	50.3 Å²	50.3	32%	0.322	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-27.4	-175.8	0	0	0	0	0	112.4	D265 I266	A263-D265 VanDerWaalsContact C-N 3.34Å; A263-I266 WeakPolarHBondContact O-CG1 3.49Å
264	E	93.4	Very high	95.4	Very high	139 Å²	139	52 Å²	52	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.8	175.3	56.2	-177.3	-155.9	0	0	113.2	E262 I266	E262-E264 HydrophobicContact CB-CG 4.14Å; E262-E264 PolarHBondContact O-N 2.71Å; E264-I266 PolarHBondContact O-N 3.29Å
265	D	94.9	Very high	95.4	Very high	58 Å²	58	56.1 Å²	56.1	31%	0.31	30%	0.297	S	S	.	.	H	α-helix	trans	-72.6	-14.8	179.7	-59.5	-40.1	0	0	0	112.9	L261 E262 A263 E267 D268 L269	L261-D265 HydrophobicContact CD2-CB 4.24Å; E262-D265 PolarHBondContact N-OD2 3.42Å; E262-D265 WeakPolarHBondContact O-CB 3.46Å; E262-D265 PolarHBondContact O-N 3.38Å; A263-D265 VanDerWaalsContact C-N 3.34Å; D265-E267 PolarHBondContact O-N 3.18Å; D265-D268 PolarHBondContact O-N 3.01Å; D265-L269 VanDerWaalsContact O-CB 3.3Å; D265-L269 WeakPolarHBondContact O-CB 3.48Å; D265-L269 PolarHBondContact O-N 3.44Å
266	I	95.4	Very high	95.4	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-65.5	-41	-170.6	-62.2	-55.8	0	0	0	111.7	V207 A210 L211 A263 E264 D268 L269 F270	V207-I266 HydrophobicContact CG1-CD1 3.82Å; V207-I266 HydrophobicContact CG1-CG1 4.47Å; A210-I266 HydrophobicContact CB-CB 4.46Å; A210-I266 HydrophobicContact CB-CG1 4.04Å; A210-I266 HydrophobicContact CB-CG2 4.41Å; L211-I266 HydrophobicContact CB-CD1 4.17Å; L211-I266 HydrophobicContact CD1-CD1 4.4Å; A263-I266 WeakPolarHBondContact O-CG1 3.49Å; E264-I266 PolarHBondContact O-N 3.29Å; I266-D268 PolarHBondContact O-N 3.01Å; I266-L269 HydrophobicContact CD1-CD2 4.3Å; I266-L269 PolarHBondContact O-N 3.32Å; I266-F270 HydrophobicContact CG2-CD2 3.81Å; I266-F270 HydrophobicContact CG2-CE2 3.84Å; I266-F270 VanDerWaalsContact O-CD2 3.3Å; I266-F270 WeakPolarHBondContact O-CD2 3.33Å; I266-F270 PolarHBondContact O-N 3.26Å
267	E	94.2	Very high	95.5	Very high	101 Å²	101	54.7 Å²	54.7	47%	0.472	28%	0.284	S	S	.	.	H	α-helix	trans	-61.9	-45.3	178.9	-174.7	173.1	178.9	0	0	111.4	I36 D265 F270 S271	I36-E267 HydrophobicContact CD1-CB 4.23Å; D265-E267 PolarHBondContact O-N 3.18Å; E267-F270 PolarHBondContact O-N 3.35Å; E267-S271 PolarHBondContact O-N 3.45Å
268	D	95.4	Very high	95.4	Very high	104 Å²	104	57.6 Å²	57.6	56%	0.556	30%	0.304	S	S	*	.	H	α-helix	trans	-64.9	-43	177.1	-76.3	-17.2	0	0	0	111.4	D265 I266 F270 S271 L272	D265-D268 PolarHBondContact O-N 3.01Å; I266-D268 PolarHBondContact O-N 3.01Å; D268-F270 VanDerWaalsContact C-N 3.31Å; D268-F270 PolarHBondContact O-N 2.95Å; D268-S271 PolarHBondContact O-N 3.01Å; D268-S271 PolarHBondContact O-OG 2.92Å; D268-L272 WeakPolarHBondContact O-CB 3.33Å; D268-L272 VanDerWaalsContact O-CG 3.3Å; D268-L272 WeakPolarHBondContact O-CG 3.4Å; D268-L272 PolarHBondContact O-N 3.26Å
269	L	97.2	Very high	95.3	Very high	5 Å²	5	60.6 Å²	60.6	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-55.8	-45.3	176.3	177.4	63.4	0	0	0	111.6	L211 L227 I230 I231 L261 D265 I266 A273	L211-L269 HydrophobicContact CD1-CD2 4.36Å; L227-L269 HydrophobicContact CD2-CD1 4.32Å; L227-L269 HydrophobicContact CD2-CD2 4.07Å; L227-L269 HydrophobicContact CD2-CG 3.73Å; I230-L269 HydrophobicContact CB-CD1 3.65Å; I230-L269 HydrophobicContact CG1-CD1 4.36Å; I230-L269 HydrophobicContact CG2-CD1 3.61Å; I231-L269 HydrophobicContact CG1-CD1 4.33Å; L261-L269 HydrophobicContact CD1-CD2 4.14Å; D265-L269 VanDerWaalsContact O-CB 3.3Å; D265-L269 WeakPolarHBondContact O-CB 3.48Å; D265-L269 PolarHBondContact O-N 3.44Å; I266-L269 HydrophobicContact CD1-CD2 4.3Å; I266-L269 PolarHBondContact O-N 3.32Å; L269-A273 VanDerWaalsContact O-CB 3.27Å; L269-A273 WeakPolarHBondContact O-CB 3.27Å; L269-A273 PolarHBondContact O-N 3.03Å
270	F	97	Very high	95.4	Very high	8 Å²	8	59 Å²	59	4%	0.035	31%	0.306	C	S	.	.	H	α-helix	trans	-71.3	-40.6	178.7	-87.9	-93.3	0	0	0	112.7	L211 Y215 L223 L227 I266 E267 D268 L272 A273 Q274	L211-F270 HydrophobicContact CG-CE2 4.24Å; Y215-F270 HydrophobicContact CD2-CE1 4.25Å; Y215-F270 HydrophobicContact CD2-CZ 4.3Å; L223-F270 HydrophobicContact CD2-CD1 3.82Å; L223-F270 HydrophobicContact CD2-CE1 3.59Å; L227-F270 HydrophobicContact CD1-CE1 4.37Å; L227-F270 HydrophobicContact CD1-CZ 4.1Å; L227-F270 HydrophobicContact CD2-CD1 4.31Å; L227-F270 HydrophobicContact CD2-CD2 4.18Å; L227-F270 HydrophobicContact CD2-CE1 4.35Å; L227-F270 HydrophobicContact CD2-CE2 4.17Å; L227-F270 HydrophobicContact CD2-CG 4.27Å; L227-F270 HydrophobicContact CD2-CZ 4.27Å; I266-F270 HydrophobicContact CG2-CD2 3.81Å; I266-F270 HydrophobicContact CG2-CE2 3.84Å; I266-F270 VanDerWaalsContact O-CD2 3.3Å; I266-F270 WeakPolarHBondContact O-CD2 3.33Å; I266-F270 PolarHBondContact O-N 3.26Å; E267-F270 PolarHBondContact O-N 3.35Å; D268-F270 VanDerWaalsContact C-N 3.31Å; D268-F270 PolarHBondContact O-N 2.95Å; F270-L272 VanDerWaalsContact C-N 3.33Å; F270-L272 PolarHBondContact O-N 3.27Å; F270-A273 PolarHBondContact O-N 3.24Å; F270-Q274 WeakPolarHBondContact O-CB 3.38Å; F270-Q274 VanDerWaalsContact O-CG 3.29Å; F270-Q274 WeakPolarHBondContact O-CG 3.46Å; F270-Q274 PolarHBondContact O-N 3.22Å
271	S	96.3	Very high	95.5	Very high	57 Å²	57	52.6 Å²	52.6	40%	0.399	27%	0.273	S	S	.	.	H	α-helix	trans	-63	-41.4	177.6	74.8	0	0	0	0	111.6	E267 D268 Q274 H275	E267-S271 PolarHBondContact O-N 3.45Å; D268-S271 PolarHBondContact O-N 3.01Å; D268-S271 PolarHBondContact O-OG 2.92Å; S271-Q274 PolarHBondContact O-N 2.86Å; S271-H275 PolarHBondContact O-N 3.31Å
272	L	97.4	Very high	95.4	Very high	71 Å²	71	56.4 Å²	56.4	37%	0.372	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-47	173.7	-70.7	172.1	0	0	0	111.2	I230 D268 F270 Q274 H275 Y276	I230-L272 HydrophobicContact CD1-CB 3.85Å; I230-L272 HydrophobicContact CG1-CB 3.94Å; I230-L272 HydrophobicContact CG2-CB 4.26Å; I230-L272 HydrophobicContact CG2-CD1 4Å; D268-L272 WeakPolarHBondContact O-CB 3.33Å; D268-L272 VanDerWaalsContact O-CG 3.3Å; D268-L272 WeakPolarHBondContact O-CG 3.4Å; D268-L272 PolarHBondContact O-N 3.26Å; F270-L272 VanDerWaalsContact C-N 3.33Å; F270-L272 PolarHBondContact O-N 3.27Å; L272-Q274 VanDerWaalsContact C-N 3.28Å; L272-Q274 PolarHBondContact O-N 3.42Å; L272-H275 WeakPolarHBondContact O-CA 3.49Å; L272-H275 WeakPolarHBondContact O-CB 3.43Å; L272-H275 PolarHBondContact O-N 2.93Å; L272-Y276 WeakPolarHBondContact O-CD2 3.3Å; L272-Y276 PolarHBondContact O-N 2.68Å
273	A	97.4	Very high	95.4	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-41.9	177.8	0	0	0	0	0	112	L223 F226 L227 I230 L269 F270 Y276 Q277	L223-A273 HydrophobicContact CD1-CB 3.99Å; F226-A273 HydrophobicContact CB-CB 3.8Å; L227-A273 HydrophobicContact CD2-CB 3.84Å; L227-A273 HydrophobicContact CG-CB 4.37Å; I230-A273 HydrophobicContact CG1-CB 4.3Å; L269-A273 VanDerWaalsContact O-CB 3.27Å; L269-A273 WeakPolarHBondContact O-CB 3.27Å; L269-A273 PolarHBondContact O-N 3.03Å; F270-A273 PolarHBondContact O-N 3.24Å; A273-Y276 PolarHBondContact O-N 3.47Å; A273-Q277 WeakPolarHBondContact O-CB 3.38Å; A273-Q277 PolarHBondContact O-N 3.05Å
274	Q	95.3	Very high	95.5	Very high	82 Å²	82	50.4 Å²	50.4	38%	0.383	26%	0.258	S	S	.	.	H	α-helix	trans	-66.4	-37.3	174.5	-72.8	175.7	-10	0	0	112.5	F270 S271 L272 Q277 S278	F270-Q274 WeakPolarHBondContact O-CB 3.38Å; F270-Q274 VanDerWaalsContact O-CG 3.29Å; F270-Q274 WeakPolarHBondContact O-CG 3.46Å; F270-Q274 PolarHBondContact O-N 3.22Å; S271-Q274 PolarHBondContact O-N 2.86Å; L272-Q274 VanDerWaalsContact C-N 3.28Å; L272-Q274 PolarHBondContact O-N 3.42Å; Q274-Q277 PolarHBondContact O-N 2.95Å; Q274-S278 PolarHBondContact O-N 3.32Å
275	H	95.4	Very high	95.4	Very high	88 Å²	88	47.2 Å²	47.2	41%	0.407	24%	0.24	S	C	.	.	H	α-helix	trans	-59.1	-51	173.7	-177.6	72.5	0	0	0	111.5	S271 L272 Q277 S278 K279	S271-H275 PolarHBondContact O-N 3.31Å; L272-H275 WeakPolarHBondContact O-CA 3.49Å; L272-H275 WeakPolarHBondContact O-CB 3.43Å; L272-H275 PolarHBondContact O-N 2.93Å; H275-Q277 VanDerWaalsContact C-N 3.31Å; H275-Q277 PolarHBondContact O-N 3.48Å; H275-S278 PolarHBondContact O-N 2.95Å; H275-S278 PolarHBondContact O-OG 2.9Å; H275-K279 PolarHBondContact CE1-NZ 3.46Å; H275-K279 WeakPolarHBondContact NE2-CE 3.34Å; H275-K279 PolarHBondContact NE2-NZ 2.88Å; H275-K279 PolarHBondContact O-N 3.26Å
276	Y	96.4	Very high	95.2	Very high	46 Å²	46	49.3 Å²	49.3	18%	0.18	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-38.6	176.7	-82.8	-97.9	0	0	0	111.8	H172 L229 I230 L272 A273 S278 K279 T280	H172-Y276 HydrophobicContact CB-CD1 3.99Å; H172-Y276 HydrophobicContact CB-CE1 3.92Å; H172-Y276 AromaticContact CE1-CD1 3.89Å; H172-Y276 AromaticContact CG-CD1 3.62Å; H172-Y276 AromaticContact ND1-CD1 3.46Å; H172-Y276 WeakPolarHBondContact ND1-CD1 3.3Å; H172-Y276 AromaticContact ND1-CE1 3.97Å; L229-Y276 HydrophobicContact CD2-CD1 3.57Å; L229-Y276 HydrophobicContact CD2-CE1 4.11Å; L229-Y276 HydrophobicContact CD2-CG 4.08Å; I230-Y276 HydrophobicContact CD1-CD2 3.36Å; I230-Y276 HydrophobicContact CD1-CE2 3.47Å; I230-Y276 VanDerWaalsContact CD1-CE2 3.47Å; I230-Y276 HydrophobicContact CD1-CG 4.12Å; L272-Y276 WeakPolarHBondContact O-CD2 3.3Å; L272-Y276 PolarHBondContact O-N 2.68Å; A273-Y276 PolarHBondContact O-N 3.47Å; Y276-S278 PolarHBondContact O-N 3.48Å; Y276-K279 CarbonylContact O-C 3.55Å; Y276-K279 PolarHBondContact O-N 2.97Å; Y276-T280 PolarHBondContact O-N 3.34Å; Y276-T280 PolarHBondContact O-OG1 2.92Å
277	Q	95.9	Very high	95	Very high	48 Å²	48	50.5 Å²	50.5	22%	0.224	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-43.3	174.7	-175.3	179.7	68.4	0	0	112.1	D220 F226 A273 Q274 H275 K279 T280	D220-Q277 PolarHBondContact OD2-NE2 2.96Å; F226-Q277 HydrophobicContact CD1-CB 4.1Å; F226-Q277 HydrophobicContact CD2-CB 4.05Å; F226-Q277 HydrophobicContact CD2-CG 4.23Å; F226-Q277 VanDerWaalsContact CE1-CA 3.49Å; F226-Q277 HydrophobicContact CE1-CB 4.03Å; F226-Q277 HydrophobicContact CE2-CB 3.97Å; F226-Q277 HydrophobicContact CE2-CG 3.8Å; F226-Q277 HydrophobicContact CG-CB 4.1Å; F226-Q277 HydrophobicContact CZ-CB 3.95Å; F226-Q277 HydrophobicContact CZ-CG 3.98Å; A273-Q277 WeakPolarHBondContact O-CB 3.38Å; A273-Q277 PolarHBondContact O-N 3.05Å; Q274-Q277 PolarHBondContact O-N 2.95Å; H275-Q277 VanDerWaalsContact C-N 3.31Å; H275-Q277 PolarHBondContact O-N 3.48Å; Q277-K279 PolarHBondContact O-N 2.92Å; Q277-T280 WeakPolarHBondContact O-CB 3.31Å; Q277-T280 PolarHBondContact O-N 3.32Å
278	S	93.8	Very high	94.8	Very high	73 Å²	73	45.9 Å²	45.9	51%	0.51	23%	0.23	S	C	.	.	H	α-helix	trans	-63.4	-24.8	178.4	76.6	0	0	0	0	113.6	Q274 H275 Y276 V330	Q274-S278 PolarHBondContact O-N 3.32Å; H275-S278 PolarHBondContact O-N 2.95Å; H275-S278 PolarHBondContact O-OG 2.9Å; Y276-S278 PolarHBondContact O-N 3.48Å; S278-V330 WeakPolarHBondContact O-CG2 3.48Å
279	K	94.6	Very high	94.5	Very high	64 Å²	64	46.7 Å²	46.7	28%	0.278	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	11.3	175.5	-68.8	-178.3	169.1	175.1	0	113.6	H275 Y276 Q277 H391	H275-K279 PolarHBondContact CE1-NZ 3.46Å; H275-K279 WeakPolarHBondContact NE2-CE 3.34Å; H275-K279 PolarHBondContact NE2-NZ 2.88Å; H275-K279 PolarHBondContact O-N 3.26Å; Y276-K279 CarbonylContact O-C 3.55Å; Y276-K279 PolarHBondContact O-N 2.97Å; Q277-K279 PolarHBondContact O-N 2.92Å; K279-H391 PolarHBondContact O-CE1 2.8Å
280	T	96.8	Very high	94	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	24%	0.236	C	C	.	.	S	Bend	trans	-112	134.6	-178.5	-58.1	0	0	0	0	111.2	L168 H172 F226 Y276 Q277 L282 L284	L168-T280 HydrophobicContact CD1-CG2 3.96Å; H172-T280 PolarHBondContact CE1-OG1 3.36Å; H172-T280 VanDerWaalsContact CE1-OG1 3.3Å; H172-T280 PolarHBondContact NE2-OG1 2.87Å; F226-T280 HydrophobicContact CE1-CG2 4.23Å; F226-T280 VanDerWaalsContact CE1-OG1 3.31Å; F226-T280 WeakPolarHBondContact CE1-OG1 3.46Å; F226-T280 HydrophobicContact CZ-CG2 4Å; Y276-T280 PolarHBondContact O-N 3.34Å; Y276-T280 PolarHBondContact O-OG1 2.92Å; Q277-T280 WeakPolarHBondContact O-CB 3.31Å; Q277-T280 PolarHBondContact O-N 3.32Å; T280-L282 PolarHBondContact O-N 3.28Å; T280-L284 HydrophobicContact CG2-CB 4.14Å; T280-L284 HydrophobicContact CG2-CD1 3.94Å
281	P	95.7	Very high	93.7	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.013	24%	0.236	C	C	.	.			trans	-52.5	133.8	175.1	-29.3	36.3	0	0	0	112.7	Y171 S283 L284 L312 V314 E318 V330 F332	Y171-P281 VanDerWaalsContact CE1-CD 3.49Å; Y171-P281 HydrophobicContact CE1-CG 4.26Å; Y171-P281 HydrophobicContact CE2-CG 4.35Å; Y171-P281 VanDerWaalsContact CZ-CD 3.48Å; Y171-P281 VanDerWaalsContact OH-CD 3.3Å; Y171-P281 WeakPolarHBondContact OH-CD 3.48Å; Y171-P281 WeakPolarHBondContact OH-CG 3.5Å; P281-S283 PolarHBondContact O-N 3.38Å; P281-S283 VanDerWaalsContact O-N 3.11Å; P281-L284 WeakPolarHBondContact O-CB 3.26Å; P281-L284 PolarHBondContact O-N 2.81Å; P281-L312 HydrophobicContact CB-CD2 4.44Å; P281-L312 HydrophobicContact CG-CD2 4.11Å; P281-V314 HydrophobicContact CB-CG2 3.95Å; P281-V314 HydrophobicContact CG-CG2 3.98Å; P281-E318 WeakPolarHBondContact CA-OE1 3.42Å; P281-V330 HydrophobicContact CG-CG1 4.22Å; P281-F332 HydrophobicContact CB-CE1 4.45Å; P281-F332 HydrophobicContact CB-CZ 3.98Å; P281-F332 HydrophobicContact CG-CE1 3.88Å; P281-F332 HydrophobicContact CG-CZ 3.86Å
282	L	93.4	Very high	93.4	Very high	95 Å²	95	45.6 Å²	45.6	50%	0.497	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.9	176	-65.1	178.1	0	0	0	112.1	T280 L284 R285 K286 E318	T280-L282 PolarHBondContact O-N 3.28Å; L282-L284 PolarHBondContact O-N 3.48Å; L282-R285 PolarHBondContact O-N 3.01Å; L282-R285 VanDerWaalsContact O-N 3.07Å; L282-K286 HydrophobicContact CB-CD 4.48Å; L282-K286 PolarHBondContact O-N 3.06Å; L282-E318 PolarHBondContact N-OE1 3.34Å; L282-E318 PolarHBondContact N-OE2 3.49Å
283	S	94.5	Very high	92.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.1	-34.1	173.8	-71.2	0	0	0	0	112.4	P281 R285 K286 M287 S315 E318	P281-S283 PolarHBondContact O-N 3.38Å; P281-S283 VanDerWaalsContact O-N 3.11Å; S283-R285 PolarHBondContact O-N 3.18Å; S283-K286 PolarHBondContact O-N 3Å; S283-M287 VanDerWaalsContact O-CB 3.25Å; S283-M287 WeakPolarHBondContact O-CB 3.44Å; S283-M287 WeakPolarHBondContact O-CG 3.3Å; S283-M287 PolarHBondContact O-N 3.48Å; S283-S315 WeakPolarHBondContact OG-CB 3.34Å; S283-S315 PolarHBondContact OG-N 3.22Å; S283-S315 PolarHBondContact OG-OG 2.84Å; S283-E318 WeakPolarHBondContact CA-OE2 3.13Å; S283-E318 WeakPolarHBondContact CB-OE2 3.39Å; S283-E318 PolarHBondContact N-OE2 3.32Å; S283-E318 PolarHBondContact OG-OE2 3.17Å
284	L	94.6	Very high	91	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-54.7	-42.5	175.1	-179.6	141.9	0	0	0	111.1	L164 L168 F222 F226 T280 P281 L282 N288 L312	L164-L284 HydrophobicContact CD1-CD1 4.33Å; L164-L284 HydrophobicContact CD1-CG 4.11Å; L168-L284 HydrophobicContact CB-CD1 4.13Å; L168-L284 HydrophobicContact CD1-CD1 3.81Å; L168-L284 HydrophobicContact CG-CD1 4.45Å; F222-L284 HydrophobicContact CD1-CD2 4.01Å; F226-L284 HydrophobicContact CZ-CD2 4.49Å; T280-L284 HydrophobicContact CG2-CB 4.14Å; T280-L284 HydrophobicContact CG2-CD1 3.94Å; P281-L284 WeakPolarHBondContact O-CB 3.26Å; P281-L284 PolarHBondContact O-N 2.81Å; L282-L284 PolarHBondContact O-N 3.48Å; L284-N288 WeakPolarHBondContact O-CB 3.4Å; L284-N288 PolarHBondContact O-ND2 2.98Å; L284-L312 HydrophobicContact CB-CD1 4.31Å; L284-L312 HydrophobicContact CB-CD2 4.34Å; L284-L312 HydrophobicContact CD1-CD1 3.83Å; L284-L312 HydrophobicContact CD1-CD2 4.23Å; L284-L312 HydrophobicContact CG-CD1 4.36Å
285	R	92.4	Very high	89.1	Confident	71 Å²	71	46.6 Å²	46.6	27%	0.268	25%	0.248	S	C	.	.	H	α-helix	trans	-79.5	-55.7	176.5	178.4	-167.1	-64.3	-84.6	-4.2	111.7	D220 F222 L282 S283 M287 N288 Q289	D220-R285 IonicContact OD1-CZ 2.96Å; D220-R285 VanDerWaalsContact OD1-CZ 3.29Å; D220-R285 IonicContact OD1-NH1 3.72Å; D220-R285 PolarHBondContact OD1-NH1 2.87Å; D220-R285 IonicContact OD1-NH2 2.95Å; D220-R285 PolarHBondContact OD1-NH2 3.41Å; D220-R285 VanDerWaalsContact OD1-NH2 3.08Å; D220-R285 IonicContact OD2-CZ 3Å; D220-R285 IonicContact OD2-NH1 3.7Å; D220-R285 IonicContact OD2-NH2 3.41Å; D220-R285 PolarHBondContact OD2-NH2 3.33Å; F222-R285 HydrophobicContact CD1-CB 4.45Å; F222-R285 HydrophobicContact CD2-CG 3.84Å; F222-R285 HydrophobicContact CE2-CG 3.93Å; F222-R285 HydrophobicContact CG-CB 4.41Å; F222-R285 HydrophobicContact CG-CG 4.18Å; F222-R285 HydrophobicContact CZ-CG 4.35Å; L282-R285 PolarHBondContact O-N 3.01Å; L282-R285 VanDerWaalsContact O-N 3.07Å; S283-R285 PolarHBondContact O-N 3.18Å; R285-M287 VanDerWaalsContact C-N 3.29Å; R285-M287 PolarHBondContact O-N 3.24Å; R285-N288 PolarHBondContact O-N 3.27Å; R285-N288 VanDerWaalsContact O-N 3.15Å; R285-Q289 VanDerWaalsContact O-CG 3.31Å; R285-Q289 WeakPolarHBondContact O-CG 3.49Å; R285-Q289 PolarHBondContact O-N 3.36Å
286	K	91.3	Very high	87.1	Confident	103 Å²	103	49.2 Å²	49.2	45%	0.448	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-36.2	-169.9	-73.6	-176.1	177.9	178.1	0	112.5	L282 S283	L282-K286 HydrophobicContact CB-CD 4.48Å; L282-K286 PolarHBondContact O-N 3.06Å; S283-K286 PolarHBondContact O-N 3Å
287	M	90.1	Very high	84.9	Confident	28 Å²	28	52.9 Å²	52.9	14%	0.138	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.5	-178.2	-62	175.3	28.2	0	0	114.1	S283 R285 P313 K425	S283-M287 VanDerWaalsContact O-CB 3.25Å; S283-M287 WeakPolarHBondContact O-CB 3.44Å; S283-M287 WeakPolarHBondContact O-CG 3.3Å; S283-M287 PolarHBondContact O-N 3.48Å; R285-M287 VanDerWaalsContact C-N 3.29Å; R285-M287 PolarHBondContact O-N 3.24Å; M287-P313 HydrophobicContact CE-CB 4.03Å; M287-P313 HydrophobicContact CE-CG 3.91Å; M287-K425 HydrophobicContact CE-CB 4.43Å; M287-K425 HydrophobicContact CE-CD 3.23Å; M287-K425 HydrophobicContact CE-CG 4.4Å; M287-K425 HydrophobicContact SD-CD 4.04Å
288	N	90.9	Very high	82.8	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	19.2	-177.7	-62	-72.3	0	0	0	112.2	R160 L164 F222 L284 R285 N290 L291	R160-N288 PolarHBondContact NH2-OD1 3.08Å; L164-N288 HydrophobicContact CD2-CB 4.03Å; F222-N288 HydrophobicContact CE1-CB 4.1Å; F222-N288 HydrophobicContact CZ-CB 4.23Å; F222-N288 WeakPolarHBondContact CZ-O 3.44Å; L284-N288 WeakPolarHBondContact O-CB 3.4Å; L284-N288 PolarHBondContact O-ND2 2.98Å; R285-N288 PolarHBondContact O-N 3.27Å; R285-N288 VanDerWaalsContact O-N 3.15Å; N288-N290 PolarHBondContact O-N 2.89Å; N288-N290 VanDerWaalsContact O-N 3.11Å; N288-N290 PolarHBondContact O-OD1 3.13Å; N288-L291 HydrophobicContact CB-CD1 3.88Å; N288-L291 HydrophobicContact CB-CG 4.13Å; N288-L291 VanDerWaalsContact O-CB 3.25Å; N288-L291 WeakPolarHBondContact O-CB 3.48Å; N288-L291 WeakPolarHBondContact O-CG 3.4Å; N288-L291 PolarHBondContact O-N 2.9Å
289	Q	88.8	Confident	80.5	Confident	121 Å²	121	55.5 Å²	55.5	57%	0.565	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-58	-26.9	179.4	-65.5	-174.9	-2.1	0	0	112.3	R285 L291 F292	R285-Q289 VanDerWaalsContact O-CG 3.31Å; R285-Q289 WeakPolarHBondContact O-CG 3.49Å; R285-Q289 PolarHBondContact O-N 3.36Å; Q289-L291 PolarHBondContact O-N 2.92Å; Q289-F292 PolarHBondContact O-N 2.77Å
290	N	86.3	Confident	78.5	Confident	26 Å²	26	62 Å²	62	14%	0.139	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-64.9	-13.6	175.3	67.5	-18.3	0	0	0	114.2	R153 N288 F292 A298	R153-N290 PolarHBondContact NE-O 3.02Å; R153-N290 PolarHBondContact NH1-O 2.81Å; R153-N290 PolarHBondContact NH2-O 2.89Å; N288-N290 PolarHBondContact O-N 2.89Å; N288-N290 VanDerWaalsContact O-N 3.11Å; N288-N290 PolarHBondContact O-OD1 3.13Å; N290-F292 PolarHBondContact O-N 3.1Å; N290-A298 HydrophobicContact CB-CB 4.06Å
291	L	89.8	Confident	76.4	Confident	5 Å²	5	67.3 Å²	67.3	3%	0.026	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-62.6	-27.6	171.2	-72.4	-178.6	0	0	0	112.5	P152 R153 R160 P161 L164 F225 N288 Q289	P152-L291 CarbonylContact C-O 3.52Å; P152-L291 VanDerWaalsContact CA-O 3.31Å; P152-L291 WeakPolarHBondContact CA-O 3.33Å; R153-L291 WeakPolarHBondContact CG-O 3.45Å; R153-L291 PolarHBondContact N-O 3.24Å; R160-L291 HydrophobicContact CB-CD2 4.04Å; R160-L291 HydrophobicContact CG-CD2 3.8Å; P161-L291 HydrophobicContact CG-CD2 4.18Å; L164-L291 HydrophobicContact CD2-CD1 3.41Å; L164-L291 VanDerWaalsContact CD2-CD1 3.41Å; F225-L291 HydrophobicContact CZ-CD1 4.3Å; N288-L291 HydrophobicContact CB-CD1 3.88Å; N288-L291 HydrophobicContact CB-CG 4.13Å; N288-L291 VanDerWaalsContact O-CB 3.25Å; N288-L291 WeakPolarHBondContact O-CB 3.48Å; N288-L291 WeakPolarHBondContact O-CG 3.4Å; N288-L291 PolarHBondContact O-N 2.9Å; Q289-L291 PolarHBondContact O-N 2.92Å
292	F	90.3	Very high	74.4	Confident	16 Å²	16	75.9 Å²	75.9	7%	0.07	40%	0.396	C	S	.	.	S	Bend	trans	-117.5	163.5	-178.8	-58.4	-83.6	0	0	0	110.8	Y150 P152 R153 P221 F222 F225 Q289 N290	Y150-F292 WeakPolarHBondContact O-CE1 3.39Å; P152-F292 HydrophobicContact CB-CE1 4.1Å; P152-F292 HydrophobicContact CB-CZ 4.43Å; P152-F292 HydrophobicContact CG-CD1 4.35Å; P152-F292 HydrophobicContact CG-CE1 3.5Å; P152-F292 HydrophobicContact CG-CZ 3.77Å; R153-F292 PolarHBondContact NH2-O 3.24Å; P221-F292 HydrophobicContact CB-CD1 3.81Å; P221-F292 HydrophobicContact CB-CD2 3.94Å; P221-F292 HydrophobicContact CB-CE1 3.82Å; P221-F292 HydrophobicContact CB-CE2 3.98Å; P221-F292 HydrophobicContact CB-CG 3.85Å; P221-F292 HydrophobicContact CB-CZ 3.91Å; P221-F292 WeakPolarHBondContact O-CZ 3.08Å; F222-F292 HydrophobicContact CD1-CE2 4.23Å; F222-F292 HydrophobicContact CD2-CD2 4.12Å; F222-F292 AromaticContact CD2-CE2 3.84Å; F222-F292 HydrophobicContact CD2-CE2 3.84Å; F222-F292 HydrophobicContact CE1-CE2 4.1Å; F222-F292 AromaticContact CE2-CD2 3.64Å; F222-F292 HydrophobicContact CE2-CD2 3.64Å; F222-F292 AromaticContact CE2-CE2 3.7Å; F222-F292 HydrophobicContact CE2-CE2 3.7Å; F222-F292 HydrophobicContact CG-CE2 4.11Å; F222-F292 AromaticContact CZ-CD2 3.95Å; F222-F292 HydrophobicContact CZ-CD2 3.95Å; F222-F292 AromaticContact CZ-CE2 3.85Å; F222-F292 HydrophobicContact CZ-CE2 3.85Å; F225-F292 HydrophobicContact CE2-CE2 4.07Å; F225-F292 AromaticContact CE2-CZ 3.93Å; F225-F292 HydrophobicContact CE2-CZ 3.93Å; F225-F292 HydrophobicContact CZ-CZ 4.41Å; Q289-F292 PolarHBondContact O-N 2.77Å; N290-F292 PolarHBondContact O-N 3.1Å
293	G	81.2	Confident	72.7	Confident	34 Å²	34	77 Å²	77	35%	0.351	40%	0.403	S	S	.	.	S	Bend	trans	79.7	-159.6	177.8	0	0	0	0	0	115.2	N148 R153	N148-G293 WeakPolarHBondContact O-CA 3.22Å; N148-G293 PolarHBondContact O-N 2.84Å; R153-G293 VanDerWaalsContact CZ-O 3.23Å; R153-G293 PolarHBondContact NE-O 2.9Å; R153-G293 PolarHBondContact NH2-O 3.11Å
294	S	64.7	Low	71.4	Confident	64 Å²	64	78.9 Å²	78.9	45%	0.448	41%	0.414	S	S	.	.			trans	-91.3	142.1	-172	-174.7	0	0	0	0	114.8	R153 L296 V297	R153-S294 VanDerWaalsContact CZ-C 3.48Å; R153-S294 PolarHBondContact NH2-O 3.19Å; S294-L296 PolarHBondContact O-N 2.83Å; S294-V297 PolarHBondContact O-N 2.89Å
295	S	53.9	Low	70.8	Confident	77 Å²	77	83 Å²	83	54%	0.538	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-49.8	-32.8	-174.6	-178.9	0	0	0	0	115.1	V297 A298	S295-V297 PolarHBondContact O-N 3.2Å; S295-V297 VanDerWaalsContact O-N 3.14Å; S295-A298 PolarHBondContact O-N 2.82Å; S295-A298 VanDerWaalsContact O-N 3.1Å
296	L	53.8	Low	70.6	Confident	143 Å²	143	79.8 Å²	79.8	75%	0.749	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-65.6	-21.1	-172.4	-63.6	173.9	0	0	0	114.9	S294	S294-L296 PolarHBondContact O-N 2.83Å
297	V	51.2	Low	70.4	Confident	122 Å²	122	76.9 Å²	76.9	74%	0.739	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-82	-20.6	178.6	-178.8	0	0	0	0	112	S294 S295 L299	S294-V297 PolarHBondContact O-N 2.89Å; S295-V297 PolarHBondContact O-N 3.2Å; S295-V297 VanDerWaalsContact O-N 3.14Å; V297-L299 VanDerWaalsContact C-N 3.32Å; V297-L299 PolarHBondContact O-N 2.68Å
298	A	50.4	Low	70.3	Confident	28 Å²	28	82.6 Å²	82.6	23%	0.231	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-78.5	-7.5	-172.1	0	0	0	0	0	115	N290 S295 K300	N290-A298 HydrophobicContact CB-CB 4.06Å; S295-A298 PolarHBondContact O-N 2.82Å; S295-A298 VanDerWaalsContact O-N 3.1Å; A298-K300 VanDerWaalsContact C-N 3.26Å; A298-K300 PolarHBondContact O-N 3.11Å
299	L	47.1	Very low	70.3	Confident	148 Å²	148	83.3 Å²	83.3	78%	0.775	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-78.6	3.6	-171	-66.7	171.4	0	0	0	115.4	V297	V297-L299 VanDerWaalsContact C-N 3.32Å; V297-L299 PolarHBondContact O-N 2.68Å
300	K	50.8	Low	70.5	Confident	202 Å²	202	81.1 Å²	81.1	88%	0.878	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-115.1	-9.9	-171.9	-77.8	-170.1	177.5	-178.5	0	116.1	A298	A298-K300 VanDerWaalsContact C-N 3.26Å; A298-K300 PolarHBondContact O-N 3.11Å
301	E	52.8	Low	71	Confident	120 Å²	120	80 Å²	80	56%	0.561	44%	0.436	S	S	*	.	S	Bend	trans	-109.2	130.6	-177.9	-66.3	-171	163.5	0	0	110.3	D303	E301-D303 PolarHBondContact O-N 2.93Å
302	E	54	Low	71.3	Confident	181 Å²	181	79.9 Å²	79.9	85%	0.846	44%	0.435	S	S	*	.			trans	-55	112.3	171.2	-73.2	173.8	166.2	0	0	108.6	T304	E302-T304 PolarHBondContact O-N 3.2Å
303	D	57.4	Low	71.5	Confident	119 Å²	119	79.6 Å²	79.6	64%	0.636	44%	0.435	S	S	*	.			trans	-59.5	100	-179	-89.4	-40.7	0	0	0	109.3	R160 E301 D305	R160-D303 IonicContact NH1-OD1 2.7Å; E301-D303 PolarHBondContact O-N 2.93Å; D303-D305 PolarHBondContact O-N 2.91Å; D303-D305 VanDerWaalsContact O-N 3.12Å
304	T	67.1	Low	72.2	Confident	40 Å²	40	78 Å²	78	25%	0.245	42%	0.418	C	S	.	.			trans	-66.8	111.5	167.9	-52.7	0	0	0	0	106.6	R160 E302 L306 K425	R160-T304 PolarHBondContact NH1-O 3.5Å; R160-T304 PolarHBondContact NH2-O 3.4Å; E302-T304 PolarHBondContact O-N 3.2Å; T304-L306 PolarHBondContact O-N 2.64Å; T304-K425 WeakPolarHBondContact OG1-CE 3.5Å; T304-K425 PolarHBondContact OG1-NZ 3.27Å
305	D	82.6	Confident	73.6	Confident	92 Å²	92	76.1 Å²	76.1	49%	0.492	41%	0.405	S	S	.	.			trans	-68.7	100.9	178.8	-174.5	0.6	0	0	0	110	D303 S307 Q308	D303-D305 PolarHBondContact O-N 2.91Å; D303-D305 VanDerWaalsContact O-N 3.12Å; D305-S307 PolarHBondContact O-N 2.92Å; D305-S307 WeakPolarHBondContact OD1-CB 3.43Å; D305-S307 PolarHBondContact OD1-N 3.47Å; D305-S307 PolarHBondContact OD1-OG 3.37Å; D305-S307 PolarHBondContact OD2-OG 3Å; D305-Q308 PolarHBondContact O-N 3.15Å; D305-Q308 WeakPolarHBondContact OD2-CG 3.26Å
306	L	88.9	Confident	75.5	Confident	3 Å²	3	73 Å²	73	2%	0.016	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.5	178.5	-60.1	-175.3	0	0	0	112.3	R160 H163 L164 L167 T304 Q308 A309	R160-L306 HydrophobicContact CG-CD1 3.74Å; R160-L306 HydrophobicContact CG-CG 4.28Å; H163-L306 HydrophobicContact CB-CB 3.78Å; L164-L306 HydrophobicContact CB-CD1 3.83Å; L164-L306 HydrophobicContact CD1-CD1 4.05Å; L167-L306 HydrophobicContact CD1-CD2 4.1Å; T304-L306 PolarHBondContact O-N 2.64Å; L306-Q308 VanDerWaalsContact C-N 3.26Å; L306-Q308 PolarHBondContact O-N 2.97Å; L306-A309 PolarHBondContact O-N 3.31Å
307	S	87.4	Confident	77.2	Confident	42 Å²	42	68.3 Å²	68.3	29%	0.294	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-31.2	178.6	79	0	0	0	0	112	H163 D305	H163-S307 WeakPolarHBondContact NE2-CB 3.25Å; D305-S307 PolarHBondContact O-N 2.92Å; D305-S307 WeakPolarHBondContact OD1-CB 3.43Å; D305-S307 PolarHBondContact OD1-N 3.47Å; D305-S307 PolarHBondContact OD1-OG 3.37Å; D305-S307 PolarHBondContact OD2-OG 3Å
308	Q	87	Confident	79.2	Confident	147 Å²	147	63.3 Å²	63.3	69%	0.687	33%	0.33	S	S	*	.	S	Bend	trans	-95.2	-6.4	179.2	-56.7	-53.7	-46.1	0	0	113.6	D305 L306 L310	D305-Q308 PolarHBondContact O-N 3.15Å; D305-Q308 WeakPolarHBondContact OD2-CG 3.26Å; L306-Q308 VanDerWaalsContact C-N 3.26Å; L306-Q308 PolarHBondContact O-N 2.97Å; Q308-L310 PolarHBondContact O-N 3.41Å
309	A	92	Very high	81.1	Confident	19 Å²	19	62.5 Å²	62.5	16%	0.157	32%	0.321	C	S	.	.			trans	-69.6	124	-176.4	0	0	0	0	0	111.5	R166 L167 L306	R166-A309 PolarHBondContact NH2-O 3.01Å; L167-A309 HydrophobicContact CD1-CB 3.86Å; L167-A309 HydrophobicContact CD2-CB 4.06Å; L167-A309 WeakPolarHBondContact CD2-O 3.18Å; L306-A309 PolarHBondContact O-N 3.31Å
310	L	92.6	Very high	83	Confident	76 Å²	76	56 Å²	56	40%	0.398	29%	0.288	S	S	.	.	S	Bend	trans	-77.3	-28.7	177.7	-72.2	174.3	0	0	0	113.7	Q170 Q308 N407 L414	Q170-L310 PolarHBondContact NE2-O 3.39Å; Q170-L310 PolarHBondContact OE1-O 3.09Å; Q308-L310 PolarHBondContact O-N 3.41Å; L310-N407 HydrophobicContact CD1-CB 3.74Å; L310-L414 WeakPolarHBondContact O-CD1 3.27Å
311	C	95.7	Very high	84.6	Confident	2 Å²	2	51 Å²	51	1%	0.014	27%	0.267	C	S	.	.	S	Bend	trans	-156.1	175.8	177.8	65.4	0	0	0	0	109.9	P313 L414 V421	C311-P313 WeakPolarHBondContact O-CD 3.25Å; C311-L414 HydrophobicContact CB-CD1 4.49Å; C311-V421 HydrophobicContact CB-CG1 4.39Å
312	L	96.6	Very high	86	Confident	2 Å²	2	46 Å²	46	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	124	-173.2	-169.3	69.4	0	0	0	111.6	L167 Y171 P281 L284 S422 I423	L167-L312 HydrophobicContact CB-CD1 4.14Å; Y171-L312 HydrophobicContact CD2-CB 3.99Å; Y171-L312 HydrophobicContact CD2-CD2 4.09Å; Y171-L312 HydrophobicContact CE2-CD2 4.3Å; Y171-L312 HydrophobicContact CG-CD2 4.26Å; P281-L312 HydrophobicContact CB-CD2 4.44Å; P281-L312 HydrophobicContact CG-CD2 4.11Å; L284-L312 HydrophobicContact CB-CD1 4.31Å; L284-L312 HydrophobicContact CB-CD2 4.34Å; L284-L312 HydrophobicContact CD1-CD1 3.83Å; L284-L312 HydrophobicContact CD1-CD2 4.23Å; L284-L312 HydrophobicContact CG-CD1 4.36Å; L312-S422 VanDerWaalsContact O-CA 3.3Å; L312-S422 WeakPolarHBondContact O-CA 3.34Å; L312-S422 WeakPolarHBondContact O-CB 3.37Å; L312-I423 PolarHBondContact O-N 3.3Å
313	P	95.4	Very high	86.7	Confident	10 Å²	10	38.3 Å²	38.3	7%	0.065	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134	175.4	31.4	-34	0	0	0	111.4	M287 C311 I423 K425	M287-P313 HydrophobicContact CE-CB 4.03Å; M287-P313 HydrophobicContact CE-CG 3.91Å; C311-P313 WeakPolarHBondContact O-CD 3.25Å; P313-I423 CarbonylContact C-O 3.25Å; P313-I423 WeakPolarHBondContact CA-O 3.44Å; P313-I423 HydrophobicContact CB-CG2 4.19Å; P313-K425 HydrophobicContact CB-CB 4.35Å
314	V	95.6	Very high	87.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.5	179.1	-179	0	0	0	0	109.8	P281 E318 I319 F332 I423 K425	P281-V314 HydrophobicContact CB-CG2 3.95Å; P281-V314 HydrophobicContact CG-CG2 3.98Å; V314-E318 HydrophobicContact CG1-CB 4.35Å; V314-I319 HydrophobicContact CB-CG1 4.49Å; V314-I319 HydrophobicContact CG1-CD1 4.29Å; V314-I319 HydrophobicContact CG1-CG1 3.73Å; V314-F332 HydrophobicContact CG1-CE1 4.03Å; V314-F332 HydrophobicContact CG1-CE2 4.18Å; V314-F332 HydrophobicContact CG1-CZ 3.66Å; V314-F332 HydrophobicContact CG2-CE1 4.04Å; V314-F332 HydrophobicContact CG2-CZ 4.3Å; V314-I423 PolarHBondContact N-O 2.89Å; V314-K425 PolarHBondContact O-N 3.15Å
315	S	94.1	Very high	87	Confident	26 Å²	26	41.6 Å²	41.6	18%	0.182	22%	0.223	C	C	.	.			trans	-72.4	140.6	178.8	71.5	0	0	0	0	111.6	S283 P317 E318 I319	S283-S315 WeakPolarHBondContact OG-CB 3.34Å; S283-S315 PolarHBondContact OG-N 3.22Å; S283-S315 PolarHBondContact OG-OG 2.84Å; S315-P317 VanDerWaalsContact C-CD 3.42Å; S315-E318 WeakPolarHBondContact O-CB 3.45Å; S315-E318 PolarHBondContact O-N 3.23Å; S315-E318 VanDerWaalsContact O-N 3.12Å; S315-I319 PolarHBondContact O-N 3.36Å
316	V	92.3	Very high	85.6	Confident	11 Å²	11	46.1 Å²	46.1	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-53	-45.3	175.3	175.7	0	0	0	0	113.2	E318 I319 L320 A430 L431 H434	V316-E318 PolarHBondContact O-N 3.31Å; V316-I319 PolarHBondContact O-N 2.93Å; V316-I319 VanDerWaalsContact O-N 3.11Å; V316-L320 HydrophobicContact CG1-CD1 3.93Å; V316-L320 HydrophobicContact CG1-CG 4.28Å; V316-L320 WeakPolarHBondContact O-CG 3.41Å; V316-L320 PolarHBondContact O-N 3.22Å; V316-L320 VanDerWaalsContact O-N 3.09Å; V316-A430 HydrophobicContact CG2-CB 3.87Å; V316-L431 HydrophobicContact CG1-CB 3.96Å; V316-L431 HydrophobicContact CG1-CD1 3.53Å; V316-L431 HydrophobicContact CG1-CG 4.36Å; V316-L431 HydrophobicContact CG2-CB 4.4Å; V316-H434 HydrophobicContact CG1-CB 4.2Å
317	P	90.8	Very high	84.1	Confident	45 Å²	45	54.7 Å²	54.7	29%	0.292	28%	0.281	S	S	.	.	H	α-helix	trans	-56.6	-37.7	179.3	-23	32.8	0	0	0	112.5	S315 Q321	S315-P317 VanDerWaalsContact C-CD 3.42Å; P317-Q321 WeakPolarHBondContact O-CB 3.45Å; P317-Q321 WeakPolarHBondContact O-CG 3.39Å; P317-Q321 PolarHBondContact O-N 2.82Å
318	E	92.1	Very high	82.8	Confident	16 Å²	16	61 Å²	61	8%	0.075	31%	0.311	C	S	.	.	H	α-helix	trans	-68.3	-45.3	176.4	-171	-178.4	176.7	0	0	111.9	P281 L282 S283 V314 S315 V316 L320 Q321 A322 F332	P281-E318 WeakPolarHBondContact CA-OE1 3.42Å; L282-E318 PolarHBondContact N-OE1 3.34Å; L282-E318 PolarHBondContact N-OE2 3.49Å; S283-E318 WeakPolarHBondContact CA-OE2 3.13Å; S283-E318 WeakPolarHBondContact CB-OE2 3.39Å; S283-E318 PolarHBondContact N-OE2 3.32Å; S283-E318 PolarHBondContact OG-OE2 3.17Å; V314-E318 HydrophobicContact CG1-CB 4.35Å; S315-E318 WeakPolarHBondContact O-CB 3.45Å; S315-E318 PolarHBondContact O-N 3.23Å; S315-E318 VanDerWaalsContact O-N 3.12Å; V316-E318 PolarHBondContact O-N 3.31Å; E318-L320 PolarHBondContact O-N 2.99Å; E318-Q321 PolarHBondContact O-N 3.27Å; E318-A322 WeakPolarHBondContact O-CB 3.28Å; E318-A322 PolarHBondContact O-N 3.26Å; E318-F332 HydrophobicContact CG-CE2 4.08Å
319	I	91.1	Very high	82.3	Confident	11 Å²	11	56.1 Å²	56.1	6%	0.056	30%	0.301	C	S	.	.	H	α-helix	trans	-54.5	-42.2	177.9	-62.8	169.5	0	0	0	110.7	V314 S315 V316 F332 V334 C393 A424	V314-I319 HydrophobicContact CB-CG1 4.49Å; V314-I319 HydrophobicContact CG1-CD1 4.29Å; V314-I319 HydrophobicContact CG1-CG1 3.73Å; S315-I319 PolarHBondContact O-N 3.36Å; V316-I319 PolarHBondContact O-N 2.93Å; V316-I319 VanDerWaalsContact O-N 3.11Å; I319-F332 HydrophobicContact CG1-CD2 4.47Å; I319-V334 HydrophobicContact CG2-CG2 3.62Å; I319-C393 VanDerWaalsContact CD1-SG 3.58Å; I319-A424 HydrophobicContact CD1-CB 3.65Å
320	L	87	Confident	82.2	Confident	13 Å²	13	56.2 Å²	56.2	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-73	-41.4	-179.3	-62.5	178	0	0	0	112.4	V316 E318 Q324 L348 L431 L435 W450	V316-L320 HydrophobicContact CG1-CD1 3.93Å; V316-L320 HydrophobicContact CG1-CG 4.28Å; V316-L320 WeakPolarHBondContact O-CG 3.41Å; V316-L320 PolarHBondContact O-N 3.22Å; V316-L320 VanDerWaalsContact O-N 3.09Å; E318-L320 PolarHBondContact O-N 2.99Å; L320-Q324 PolarHBondContact O-NE2 3.18Å; L320-L348 HydrophobicContact CD2-CD1 4.06Å; L320-L431 HydrophobicContact CD1-CD1 3.71Å; L320-L431 HydrophobicContact CD2-CD1 3.85Å; L320-L431 HydrophobicContact CG-CD1 4.15Å; L320-L435 HydrophobicContact CD1-CD2 4.1Å; L320-W450 HydrophobicContact CB-CH2 4.09Å; L320-W450 HydrophobicContact CB-CZ3 3.66Å; L320-W450 HydrophobicContact CD1-CE3 4.19Å; L320-W450 HydrophobicContact CD1-CZ3 3.71Å; L320-W450 HydrophobicContact CD2-CE3 3.69Å; L320-W450 HydrophobicContact CD2-CZ3 3.69Å; L320-W450 HydrophobicContact CG-CE3 4.33Å; L320-W450 HydrophobicContact CG-CZ3 3.86Å
321	Q	84.9	Confident	82	Confident	96 Å²	96	55.2 Å²	55.2	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-75.7	-39.7	-177.9	-71.3	171.8	12.1	0	0	112.9	P317 E318 N323 Q324 L325	P317-Q321 WeakPolarHBondContact O-CB 3.45Å; P317-Q321 WeakPolarHBondContact O-CG 3.39Å; P317-Q321 PolarHBondContact O-N 2.82Å; E318-Q321 PolarHBondContact O-N 3.27Å; Q321-N323 PolarHBondContact O-N 3Å; Q321-Q324 PolarHBondContact O-N 3.46Å; Q321-L325 PolarHBondContact O-N 3.39Å
322	A	80.9	Confident	81.9	Confident	15 Å²	15	55.2 Å²	55.2	12%	0.124	29%	0.29	C	S	.	.	H	α-helix	trans	-57.7	-36.9	-176.8	0	0	0	0	0	112.6	E318 Q324 V330 F332	E318-A322 WeakPolarHBondContact O-CB 3.28Å; E318-A322 PolarHBondContact O-N 3.26Å; A322-Q324 VanDerWaalsContact C-N 3.31Å; A322-Q324 PolarHBondContact O-N 3.29Å; A322-V330 WeakPolarHBondContact CB-O 3.44Å; A322-F332 HydrophobicContact CB-CD2 3.69Å; A322-F332 HydrophobicContact CB-CE2 3.69Å
323	N	68.9	Low	81.8	Confident	19 Å²	19	55.5 Å²	55.5	10%	0.102	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.1	-179.5	-69.7	-13.6	0	0	0	113.6	Q321 F332	Q321-N323 PolarHBondContact O-N 3Å; N323-F332 PolarHBondContact ND2-O 3.08Å; N323-F332 PolarHBondContact OD1-N 2.81Å; N323-F332 PolarHBondContact OD1-O 3.31Å
324	Q	68.4	Low	81.8	Confident	103 Å²	103	55.2 Å²	55.2	48%	0.481	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-29	177	-72.7	171.7	72.3	0	0	113.7	L320 Q321 A322 W450	L320-Q324 PolarHBondContact O-NE2 3.18Å; Q321-Q324 PolarHBondContact O-N 3.46Å; A322-Q324 VanDerWaalsContact C-N 3.31Å; A322-Q324 PolarHBondContact O-N 3.29Å; Q324-W450 HydrophobicContact CG-CZ2 4.31Å
325	L	63.2	Low	81.8	Confident	125 Å²	125	55.2 Å²	55.2	65%	0.654	29%	0.289	S	S	*	.	S	Bend	trans	-80.5	148.7	-178.4	-68.2	163.2	0	0	0	110.7	Q321	Q321-L325 PolarHBondContact O-N 3.39Å
326	Q	53.1	Low	81.9	Confident	188 Å²	188	54 Å²	54	88%	0.879	28%	0.281	S	S	*	.			trans	-63	168.9	-172.5	-74.4	-174.7	-26.2	0	0	114.4	D328	Q326-D328 VanDerWaalsContact C-N 3.3Å; Q326-D328 PolarHBondContact O-N 2.91Å
327	Q	56.3	Low	82.1	Confident	182 Å²	182	53.5 Å²	53.5	85%	0.85	28%	0.278	S	S	*	.	S	Bend	trans	-50.7	-9.9	-152.8	-65.8	-172.9	-27.9	0	0	120.9
328	D	60.6	Low	82.3	Confident	174 Å²	174	52 Å²	52	93%	0.93	27%	0.267	S	S	*	.	S	Bend	trans	-114	40.4	-161.3	-138.9	12.8	0	0	0	114.2	Q326	Q326-D328 VanDerWaalsContact C-N 3.3Å; Q326-D328 PolarHBondContact O-N 2.91Å
329	G	75.9	Confident	82.3	Confident	46 Å²	46	53 Å²	53	47%	0.474	27%	0.274	S	S	.	.	S	Bend	trans	-152.5	177.7	179.7	0	0	0	0	0	114	R331	G329-R331 PolarHBondContact O-N 3.45Å
330	V	89.6	Confident	82.2	Confident	20 Å²	20	54.2 Å²	54.2	12%	0.121	29%	0.286	C	S	.	.			trans	-57.5	121.9	177.5	176.8	0	0	0	0	110	S278 P281 A322 F332 H391	S278-V330 WeakPolarHBondContact O-CG2 3.48Å; P281-V330 HydrophobicContact CG-CG1 4.22Å; A322-V330 WeakPolarHBondContact CB-O 3.44Å; V330-F332 HydrophobicContact CG1-CE1 3.89Å; V330-F332 HydrophobicContact CG1-CE2 3.95Å; V330-F332 HydrophobicContact CG1-CZ 3.52Å; V330-H391 HydrophobicContact CG1-CB 4.49Å
331	R	90.1	Very high	82.4	Confident	56 Å²	56	61.7 Å²	61.7	21%	0.211	32%	0.32	C	S	.	.			trans	-123	140.6	174.6	-64.4	-167.7	-60.1	148	7.4	111	G329 S385 S388 G389 E390 H391	G329-R331 PolarHBondContact O-N 3.45Å; R331-S385 PolarHBondContact NH1-O 3.29Å; R331-S388 VanDerWaalsContact CZ-O 3.23Å; R331-S388 PolarHBondContact NH1-O 2.85Å; R331-S388 PolarHBondContact NH1-OG 3.42Å; R331-S388 PolarHBondContact NH2-OG 3.45Å; R331-G389 CarbonylContact O-C 3.54Å; R331-G389 WeakPolarHBondContact O-CA 3.39Å; R331-E390 PolarHBondContact O-N 3.33Å; R331-H391 PolarHBondContact O-CD2 3.38Å; R331-H391 PolarHBondContact O-N 2.96Å
332	F	92.8	Very high	82.7	Confident	1 Å²	1	60 Å²	60	0%	0.004	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.9	-172.9	-60.3	-78.3	0	0	0	111.9	P281 V314 E318 I319 A322 N323 V330 V334 H391 C393	P281-F332 HydrophobicContact CB-CE1 4.45Å; P281-F332 HydrophobicContact CB-CZ 3.98Å; P281-F332 HydrophobicContact CG-CE1 3.88Å; P281-F332 HydrophobicContact CG-CZ 3.86Å; V314-F332 HydrophobicContact CG1-CE1 4.03Å; V314-F332 HydrophobicContact CG1-CE2 4.18Å; V314-F332 HydrophobicContact CG1-CZ 3.66Å; V314-F332 HydrophobicContact CG2-CE1 4.04Å; V314-F332 HydrophobicContact CG2-CZ 4.3Å; E318-F332 HydrophobicContact CG-CE2 4.08Å; I319-F332 HydrophobicContact CG1-CD2 4.47Å; A322-F332 HydrophobicContact CB-CD2 3.69Å; A322-F332 HydrophobicContact CB-CE2 3.69Å; N323-F332 PolarHBondContact ND2-O 3.08Å; N323-F332 PolarHBondContact OD1-N 2.81Å; N323-F332 PolarHBondContact OD1-O 3.31Å; V330-F332 HydrophobicContact CG1-CE1 3.89Å; V330-F332 HydrophobicContact CG1-CE2 3.95Å; V330-F332 HydrophobicContact CG1-CZ 3.52Å; F332-V334 HydrophobicContact CB-CG2 4.14Å; F332-H391 CarbonylContact C-O 3.47Å; F332-H391 WeakPolarHBondContact CA-O 3.46Å; F332-H391 HydrophobicContact CD1-CB 3.89Å; F332-H391 HydrophobicContact CE1-CB 4.16Å; F332-C393 HydrophobicContact CB-CB 4.15Å; F332-C393 HydrophobicContact CD1-CB 3.87Å; F332-C393 HydrophobicContact CG-CB 4.31Å
333	F	94.5	Very high	83.3	Confident	9 Å²	9	60.9 Å²	60.9	4%	0.039	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	104.9	160.5	-171.5	-91.2	0	0	0	108.3	V335 F352 L373 A376 Q377 A387 G389 H391 L392 C393	F333-V335 HydrophobicContact CD1-CG2 3.97Å; F333-V335 HydrophobicContact CE1-CG2 4.16Å; F333-F352 HydrophobicContact CE1-CB 3.67Å; F333-F352 HydrophobicContact CE1-CG 4.25Å; F333-F352 HydrophobicContact CZ-CB 3.7Å; F333-F352 HydrophobicContact CZ-CD2 4.25Å; F333-F352 HydrophobicContact CZ-CG 4.2Å; F333-L373 HydrophobicContact CE1-CD2 4.15Å; F333-L373 HydrophobicContact CE1-CG 4.05Å; F333-A376 HydrophobicContact CZ-CB 4.28Å; F333-Q377 HydrophobicContact CB-CG 4.13Å; F333-Q377 HydrophobicContact CD1-CB 4.3Å; F333-Q377 HydrophobicContact CD1-CG 4.37Å; F333-Q377 HydrophobicContact CD2-CB 4.08Å; F333-Q377 HydrophobicContact CD2-CG 4.02Å; F333-Q377 HydrophobicContact CE1-CB 4.33Å; F333-Q377 HydrophobicContact CE2-CB 4.11Å; F333-Q377 HydrophobicContact CG-CB 4.17Å; F333-Q377 HydrophobicContact CG-CG 3.91Å; F333-Q377 HydrophobicContact CZ-CB 4.22Å; F333-A387 WeakPolarHBondContact CD2-O 3.39Å; F333-G389 WeakPolarHBondContact CB-O 3.48Å; F333-H391 PolarHBondContact N-O 2.86Å; F333-L392 HydrophobicContact CB-CD2 4.29Å; F333-L392 HydrophobicContact CD1-CD2 3.82Å; F333-L392 HydrophobicContact CG-CD2 4.45Å; F333-C393 PolarHBondContact O-N 2.94Å
334	V	94.8	Very high	84.4	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.018	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	130.6	-171.1	-174.3	0	0	0	0	110.1	I319 F332 L348 A351 F352 C393 M395	I319-V334 HydrophobicContact CG2-CG2 3.62Å; F332-V334 HydrophobicContact CB-CG2 4.14Å; V334-L348 HydrophobicContact CB-CD2 4.31Å; V334-L348 HydrophobicContact CG1-CD2 4.18Å; V334-L348 HydrophobicContact CG2-CD2 4.22Å; V334-A351 HydrophobicContact CB-CB 4.31Å; V334-A351 HydrophobicContact CG1-CB 4.13Å; V334-A351 CarbonylContact O-C 3.56Å; V334-A351 VanDerWaalsContact O-CA 3.28Å; V334-A351 WeakPolarHBondContact O-CA 3.35Å; V334-F352 PolarHBondContact O-N 3.35Å; V334-C393 CarbonylContact C-O 3.49Å; V334-C393 WeakPolarHBondContact CA-O 3.4Å; V334-M395 HydrophobicContact CB-CE 4.45Å; V334-M395 HydrophobicContact CG1-CE 3.11Å
335	V	96.1	Very high	85.4	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	111.9	-178.4	-174.4	0	0	0	0	108.7	F333 C337 F352 L354 L373 L392 C393 F394 M395	F333-V335 HydrophobicContact CD1-CG2 3.97Å; F333-V335 HydrophobicContact CE1-CG2 4.16Å; V335-C337 PolarHBondContact O-N 2.88Å; V335-F352 CarbonylContact C-O 3.59Å; V335-F352 WeakPolarHBondContact CA-O 3.21Å; V335-L354 HydrophobicContact CG1-CB 3.61Å; V335-L354 HydrophobicContact CG1-CD2 4.15Å; V335-L373 HydrophobicContact CB-CD1 4.42Å; V335-L373 HydrophobicContact CG1-CD1 3.66Å; V335-L373 HydrophobicContact CG2-CD1 3.81Å; V335-L373 HydrophobicContact CG2-CG 4.38Å; V335-L392 HydrophobicContact CG2-CD2 4.37Å; V335-C393 PolarHBondContact N-O 3.06Å; V335-F394 HydrophobicContact CB-CD1 3.83Å; V335-F394 HydrophobicContact CB-CE1 4.07Å; V335-F394 HydrophobicContact CB-CG 4.41Å; V335-F394 HydrophobicContact CG1-CD1 3.89Å; V335-F394 HydrophobicContact CG1-CE1 3.92Å; V335-F394 HydrophobicContact CG2-CD1 4.43Å; V335-F394 HydrophobicContact CG2-CE1 4.26Å; V335-F394 CarbonylContact O-C 3.41Å; V335-F394 WeakPolarHBondContact O-CA 3.39Å; V335-M395 PolarHBondContact O-N 3.48Å
336	D	96.3	Very high	86.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	113.1	174.8	-166.1	-30.2	0	0	0	109.6	R338 Y343 A351 F352 H353 L354 M395	D336-R338 VanDerWaalsContact OD1-CB 3.3Å; D336-R338 WeakPolarHBondContact OD1-CB 3.5Å; D336-R338 VanDerWaalsContact OD1-CG 3.28Å; D336-R338 WeakPolarHBondContact OD1-CG 3.3Å; D336-R338 IonicContact OD1-CZ 2.68Å; D336-R338 PolarHBondContact OD1-N 3.42Å; D336-R338 IonicContact OD1-NE 2.77Å; D336-R338 PolarHBondContact OD1-NE 3.04Å; D336-R338 IonicContact OD1-NH2 3.92Å; D336-R338 IonicContact OD2-CZ 3.14Å; D336-R338 IonicContact OD2-NE 3.67Å; D336-R338 PolarHBondContact OD2-NE 3.45Å; D336-R338 IonicContact OD2-NH2 2.82Å; D336-R338 PolarHBondContact OD2-NH2 2.77Å; D336-Y343 HydrophobicContact CB-CD2 3.76Å; D336-Y343 HydrophobicContact CB-CE2 3.92Å; D336-Y343 WeakPolarHBondContact OD2-CD2 3.4Å; D336-A351 HydrophobicContact CB-CB 4.18Å; D336-F352 PolarHBondContact N-O 3Å; D336-H353 PolarHBondContact O-CD2 3.21Å; D336-L354 PolarHBondContact O-N 3.23Å; D336-M395 HydrophobicContact CB-CG 3.89Å; D336-M395 HydrophobicContact CB-SD 4.18Å
337	C	96.1	Very high	88.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.007	26%	0.258	C	S	.	.			trans	-96	4.2	-176	-79.9	0	0	0	0	114.5	V335 L354 S356 M395 M406	V335-C337 PolarHBondContact O-N 2.88Å; C337-L354 VanDerWaalsContact CA-O 3.25Å; C337-L354 WeakPolarHBondContact CA-O 3.49Å; C337-S356 VanDerWaalsContact O-CB 3.3Å; C337-S356 WeakPolarHBondContact O-CB 3.48Å; C337-S356 PolarHBondContact O-N 3.26Å; C337-S356 PolarHBondContact O-OG 3.29Å; C337-M395 PolarHBondContact N-O 2.88Å; C337-M406 HydrophobicContact CB-CB 4.02Å; C337-M406 HydrophobicContact CB-CG 3.77Å; C337-M406 HydrophobicContact CB-SD 4.36Å
338	R	94.7	Very high	89.9	Confident	15 Å²	15	38.8 Å²	38.8	6%	0.057	22%	0.219	C	C	.	.	S	Bend	trans	-72.4	156.7	-179.3	-60.2	177.2	-60.5	147.9	-1.8	111.2	D336 Q342 G346 H353 F428	D336-R338 VanDerWaalsContact OD1-CB 3.3Å; D336-R338 WeakPolarHBondContact OD1-CB 3.5Å; D336-R338 VanDerWaalsContact OD1-CG 3.28Å; D336-R338 WeakPolarHBondContact OD1-CG 3.3Å; D336-R338 IonicContact OD1-CZ 2.68Å; D336-R338 PolarHBondContact OD1-N 3.42Å; D336-R338 IonicContact OD1-NE 2.77Å; D336-R338 PolarHBondContact OD1-NE 3.04Å; D336-R338 IonicContact OD1-NH2 3.92Å; D336-R338 IonicContact OD2-CZ 3.14Å; D336-R338 IonicContact OD2-NE 3.67Å; D336-R338 PolarHBondContact OD2-NE 3.45Å; D336-R338 IonicContact OD2-NH2 2.82Å; D336-R338 PolarHBondContact OD2-NH2 2.77Å; R338-Q342 HydrophobicContact CB-CB 4Å; R338-Q342 PolarHBondContact NH1-O 3.39Å; R338-G346 PolarHBondContact NH2-O 3.17Å; R338-H353 PolarHBondContact O-NE2 3.38Å; R338-F428 VanDerWaalsContact CZ-CG 3.47Å
339	P	92.3	Very high	91.1	Very high	36 Å²	36	33.2 Å²	33.2	23%	0.234	19%	0.194	C	C	.	.			trans	-54.3	149.4	174	-26.7	35	0	0	0	112.2	E341 Q342 Y343	P339-E341 PolarHBondContact O-N 3.3Å; P339-Q342 PolarHBondContact O-N 3.39Å; P339-Y343 PolarHBondContact O-N 3.33Å
340	A	90.5	Very high	91.5	Very high	36 Å²	36	32.8 Å²	32.8	30%	0.298	18%	0.182	S	C	.	.	H	α-helix	trans	-50.9	-35.1	-178.2	0	0	0	0	0	113.7	N344 D355	A340-N344 VanDerWaalsContact O-CB 3.24Å; A340-N344 WeakPolarHBondContact O-CB 3.47Å; A340-N344 PolarHBondContact O-N 2.69Å; A340-N344 PolarHBondContact O-ND2 2.78Å; A340-D355 PolarHBondContact N-OD2 3.34Å
341	E	90.8	Very high	91.6	Very high	170 Å²	170	32.3 Å²	32.3	79%	0.794	18%	0.18	S	C	*	.	H	α-helix	trans	-62	-45.9	176.8	-63.5	-173	173.8	0	0	112.4	P339 A345	P339-E341 PolarHBondContact O-N 3.3Å; E341-A345 WeakPolarHBondContact O-CB 3.3Å; E341-A345 PolarHBondContact O-N 3.45Å; E341-A345 VanDerWaalsContact O-N 3.09Å
342	Q	91.6	Very high	91.8	Very high	61 Å²	61	32 Å²	32	29%	0.285	18%	0.18	S	C	.	.	H	α-helix	trans	-70.2	-41.1	179.5	-61.7	-168	11.2	0	0	111.6	R338 P339 A345 G346 E402	R338-Q342 HydrophobicContact CB-CB 4Å; R338-Q342 PolarHBondContact NH1-O 3.39Å; P339-Q342 PolarHBondContact O-N 3.39Å; Q342-A345 WeakPolarHBondContact O-CB 3.48Å; Q342-A345 PolarHBondContact O-N 3.14Å; Q342-G346 PolarHBondContact O-N 3.39Å; Q342-E402 PolarHBondContact NE2-OE2 3.08Å
343	Y	92.9	Very high	91.9	Very high	33 Å²	33	34.4 Å²	34.4	13%	0.129	19%	0.192	C	C	.	.	H	α-helix	trans	-58.9	-48	175.3	179.3	-92.5	0	0	0	111.2	D336 P339 A345 G346 H347 H353	D336-Y343 HydrophobicContact CB-CD2 3.76Å; D336-Y343 HydrophobicContact CB-CE2 3.92Å; D336-Y343 WeakPolarHBondContact OD2-CD2 3.4Å; P339-Y343 PolarHBondContact O-N 3.33Å; Y343-A345 VanDerWaalsContact C-N 3.31Å; Y343-A345 PolarHBondContact O-N 3.02Å; Y343-G346 CarbonylContact O-C 3.58Å; Y343-G346 VanDerWaalsContact O-C 3.28Å; Y343-G346 PolarHBondContact O-N 2.97Å; Y343-H347 AromaticContact CD1-ND1 3.79Å; Y343-H347 HydrophobicContact CD2-CB 3.49Å; Y343-H347 VanDerWaalsContact CD2-CB 3.49Å; Y343-H347 AromaticContact CD2-CG 3.8Å; Y343-H347 HydrophobicContact CE1-CB 4.47Å; Y343-H347 AromaticContact CE1-CD2 3.8Å; Y343-H347 AromaticContact CE1-CE1 3.51Å; Y343-H347 AromaticContact CE1-CG 3.72Å; Y343-H347 AromaticContact CE1-ND1 3.54Å; Y343-H347 AromaticContact CE1-NE2 3.69Å; Y343-H347 HydrophobicContact CE2-CB 3.43Å; Y343-H347 VanDerWaalsContact CE2-CB 3.43Å; Y343-H347 AromaticContact CE2-CD2 3.53Å; Y343-H347 AromaticContact CE2-CG 3.4Å; Y343-H347 VanDerWaalsContact CE2-CG 3.4Å; Y343-H347 HydrophobicContact CG-CB 4.08Å; Y343-H347 AromaticContact CZ-CD2 3.18Å; Y343-H347 AromaticContact CZ-CE1 3.74Å; Y343-H347 AromaticContact CZ-CG 3.35Å; Y343-H347 AromaticContact CZ-ND1 3.69Å; Y343-H347 AromaticContact CZ-NE2 3.47Å; Y343-H347 WeakPolarHBondContact O-CB 3.48Å; Y343-H347 PolarHBondContact O-ND1 3.03Å; Y343-H347 PolarHBondContact OH-CD2 3.36Å; Y343-H347 PolarHBondContact OH-NE2 3.06Å; Y343-H353 HydrophobicContact CD1-CB 4.22Å; Y343-H353 AromaticContact CD1-CG 3.92Å; Y343-H353 HydrophobicContact CD2-CB 3.91Å; Y343-H353 AromaticContact CD2-CD2 3.45Å; Y343-H353 VanDerWaalsContact CD2-CD2 3.45Å; Y343-H353 WeakPolarHBondContact CD2-CD2 3.32Å; Y343-H353 AromaticContact CD2-CG 3.76Å; Y343-H353 HydrophobicContact CE1-CB 3.97Å; Y343-H353 HydrophobicContact CE2-CB 3.62Å; Y343-H353 HydrophobicContact CG-CB 4.2Å; Y343-H353 AromaticContact CG-CD2 3.5Å; Y343-H353 VanDerWaalsContact CG-CD2 3.5Å; Y343-H353 AromaticContact CG-CG 3.7Å; Y343-H353 AromaticContact CG-NE2 3.95Å
344	N	91.8	Very high	91.9	Very high	69 Å²	69	34 Å²	34	37%	0.369	19%	0.19	S	C	.	.	H	α-helix	trans	-69	-27.9	-178.7	-74.6	-46.8	0	0	0	113.2	A340 G346 T454	A340-N344 VanDerWaalsContact O-CB 3.24Å; A340-N344 WeakPolarHBondContact O-CB 3.47Å; A340-N344 PolarHBondContact O-N 2.69Å; A340-N344 PolarHBondContact O-ND2 2.78Å; N344-G346 VanDerWaalsContact C-N 3.29Å; N344-T454 PolarHBondContact O-N 3.39Å; N344-T454 VanDerWaalsContact O-N 3.12Å; N344-T454 PolarHBondContact O-OG1 3.01Å
345	A	90.1	Very high	91.8	Very high	57 Å²	57	35 Å²	35	47%	0.471	20%	0.195	S	C	.	.	H	α-helix	trans	-64.4	-34.3	173.6	0	0	0	0	0	112.2	E341 Q342 Y343 S453	E341-A345 WeakPolarHBondContact O-CB 3.3Å; E341-A345 PolarHBondContact O-N 3.45Å; E341-A345 VanDerWaalsContact O-N 3.09Å; Q342-A345 WeakPolarHBondContact O-CB 3.48Å; Q342-A345 PolarHBondContact O-N 3.14Å; Y343-A345 VanDerWaalsContact C-N 3.31Å; Y343-A345 PolarHBondContact O-N 3.02Å; A345-S453 PolarHBondContact O-OG 3.05Å
346	G	88.1	Confident	91.5	Very high	5 Å²	5	35.3 Å²	35.3	5%	0.052	20%	0.197	C	C	.	.	S	Bend	trans	175.5	131	173.8	0	0	0	0	0	110.9	R338 Q342 Y343 N344 F428 V452	R338-G346 PolarHBondContact NH2-O 3.17Å; Q342-G346 PolarHBondContact O-N 3.39Å; Y343-G346 CarbonylContact O-C 3.58Å; Y343-G346 VanDerWaalsContact O-C 3.28Å; Y343-G346 PolarHBondContact O-N 2.97Å; N344-G346 VanDerWaalsContact C-N 3.29Å; G346-F428 WeakPolarHBondContact O-CZ 3.3Å; G346-V452 WeakPolarHBondContact CA-O 3.43Å
347	H	90.4	Very high	91.1	Very high	17 Å²	17	37.2 Å²	37.2	8%	0.079	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	163.7	179.4	59.4	-84.6	0	0	0	111.7	Y343 S349 I451 V452	Y343-H347 AromaticContact CD1-ND1 3.79Å; Y343-H347 HydrophobicContact CD2-CB 3.49Å; Y343-H347 VanDerWaalsContact CD2-CB 3.49Å; Y343-H347 AromaticContact CD2-CG 3.8Å; Y343-H347 HydrophobicContact CE1-CB 4.47Å; Y343-H347 AromaticContact CE1-CD2 3.8Å; Y343-H347 AromaticContact CE1-CE1 3.51Å; Y343-H347 AromaticContact CE1-CG 3.72Å; Y343-H347 AromaticContact CE1-ND1 3.54Å; Y343-H347 AromaticContact CE1-NE2 3.69Å; Y343-H347 HydrophobicContact CE2-CB 3.43Å; Y343-H347 VanDerWaalsContact CE2-CB 3.43Å; Y343-H347 AromaticContact CE2-CD2 3.53Å; Y343-H347 AromaticContact CE2-CG 3.4Å; Y343-H347 VanDerWaalsContact CE2-CG 3.4Å; Y343-H347 HydrophobicContact CG-CB 4.08Å; Y343-H347 AromaticContact CZ-CD2 3.18Å; Y343-H347 AromaticContact CZ-CE1 3.74Å; Y343-H347 AromaticContact CZ-CG 3.35Å; Y343-H347 AromaticContact CZ-ND1 3.69Å; Y343-H347 AromaticContact CZ-NE2 3.47Å; Y343-H347 WeakPolarHBondContact O-CB 3.48Å; Y343-H347 PolarHBondContact O-ND1 3.03Å; Y343-H347 PolarHBondContact OH-CD2 3.36Å; Y343-H347 PolarHBondContact OH-NE2 3.06Å; H347-S349 PolarHBondContact O-N 2.61Å; H347-I451 CarbonylContact O-C 3.59Å; H347-I451 VanDerWaalsContact O-CA 3.3Å; H347-I451 WeakPolarHBondContact O-CA 3.44Å; H347-V452 PolarHBondContact N-O 2.87Å; H347-V452 VanDerWaalsContact N-O 3.1Å; H347-V452 PolarHBondContact ND1-O 2.89Å; H347-V452 PolarHBondContact O-N 3.47Å
348	L	88.7	Confident	90.7	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	128	173.5	-175.2	70.7	0	0	0	110.1	L320 V334 T350 A351 M395 L431 W450	L320-L348 HydrophobicContact CD2-CD1 4.06Å; V334-L348 HydrophobicContact CB-CD2 4.31Å; V334-L348 HydrophobicContact CG1-CD2 4.18Å; V334-L348 HydrophobicContact CG2-CD2 4.22Å; L348-T350 PolarHBondContact O-N 3.17Å; L348-A351 HydrophobicContact CB-CB 4.04Å; L348-A351 WeakPolarHBondContact O-CB 3.39Å; L348-A351 PolarHBondContact O-N 3.31Å; L348-M395 HydrophobicContact CB-CE 3.92Å; L348-M395 HydrophobicContact CD2-CE 4.11Å; L348-L431 HydrophobicContact CB-CD2 4.31Å; L348-L431 HydrophobicContact CD1-CD2 4.4Å; L348-W450 CarbonylContact C-O 3.55Å; L348-W450 WeakPolarHBondContact CA-O 3.41Å; L348-W450 HydrophobicContact CD1-CB 4.1Å
349	S	84.6	Confident	90.3	Very high	57 Å²	57	40 Å²	40	40%	0.399	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.7	-173.2	61.4	0	0	0	0	114.7	H347 W450	H347-S349 PolarHBondContact O-N 2.61Å; S349-W450 PolarHBondContact N-O 2.73Å
350	T	85.5	Confident	90	Very high	37 Å²	37	43 Å²	43	23%	0.227	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-0.8	-179.7	57.1	0	0	0	0	113.1	L348 I386 A387	L348-T350 PolarHBondContact O-N 3.17Å; T350-I386 HydrophobicContact CG2-CG2 4.49Å; T350-A387 HydrophobicContact CG2-CB 3.94Å
351	A	91.4	Very high	89.9	Confident	10 Å²	10	48.3 Å²	48.3	8%	0.083	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-81.1	141.5	-178.2	0	0	0	0	0	111.8	V334 D336 L348 M395	V334-A351 HydrophobicContact CB-CB 4.31Å; V334-A351 HydrophobicContact CG1-CB 4.13Å; V334-A351 CarbonylContact O-C 3.56Å; V334-A351 VanDerWaalsContact O-CA 3.28Å; V334-A351 WeakPolarHBondContact O-CA 3.35Å; D336-A351 HydrophobicContact CB-CB 4.18Å; L348-A351 HydrophobicContact CB-CB 4.04Å; L348-A351 WeakPolarHBondContact O-CB 3.39Å; L348-A351 PolarHBondContact O-N 3.31Å; A351-M395 HydrophobicContact CB-CE 4.06Å
352	F	94.1	Very high	89.8	Confident	49 Å²	49	43 Å²	43	22%	0.215	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	131	167.5	-175.4	-83.1	0	0	0	109.2	F333 V334 V335 D336 L354 L373 A376	F333-F352 HydrophobicContact CE1-CB 3.67Å; F333-F352 HydrophobicContact CE1-CG 4.25Å; F333-F352 HydrophobicContact CZ-CB 3.7Å; F333-F352 HydrophobicContact CZ-CD2 4.25Å; F333-F352 HydrophobicContact CZ-CG 4.2Å; V334-F352 PolarHBondContact O-N 3.35Å; V335-F352 CarbonylContact C-O 3.59Å; V335-F352 WeakPolarHBondContact CA-O 3.21Å; D336-F352 PolarHBondContact N-O 3Å; F352-L354 HydrophobicContact CD1-CB 4.45Å; F352-L354 HydrophobicContact CE1-CB 4.49Å; F352-L373 HydrophobicContact CD1-CB 3.95Å; F352-L373 HydrophobicContact CD1-CD1 3.87Å; F352-L373 HydrophobicContact CD1-CG 3.87Å; F352-L373 HydrophobicContact CE1-CB 3.6Å; F352-L373 HydrophobicContact CE1-CD1 4.12Å; F352-L373 HydrophobicContact CE1-CG 4.06Å; F352-L373 HydrophobicContact CE2-CB 4.45Å; F352-L373 HydrophobicContact CG-CG 4.34Å; F352-L373 HydrophobicContact CZ-CB 3.88Å; F352-A376 HydrophobicContact CD2-CB 4.07Å; F352-A376 HydrophobicContact CE2-CB 4.06Å
353	H	95.5	Very high	89.8	Confident	51 Å²	51	44 Å²	44	24%	0.236	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	121.9	177.5	-173.9	-133.1	0	0	0	111.2	D336 R338 Y343	D336-H353 PolarHBondContact O-CD2 3.21Å; R338-H353 PolarHBondContact O-NE2 3.38Å; Y343-H353 HydrophobicContact CD1-CB 4.22Å; Y343-H353 AromaticContact CD1-CG 3.92Å; Y343-H353 HydrophobicContact CD2-CB 3.91Å; Y343-H353 AromaticContact CD2-CD2 3.45Å; Y343-H353 VanDerWaalsContact CD2-CD2 3.45Å; Y343-H353 WeakPolarHBondContact CD2-CD2 3.32Å; Y343-H353 AromaticContact CD2-CG 3.76Å; Y343-H353 HydrophobicContact CE1-CB 3.97Å; Y343-H353 HydrophobicContact CE2-CB 3.62Å; Y343-H353 HydrophobicContact CG-CB 4.2Å; Y343-H353 AromaticContact CG-CD2 3.5Å; Y343-H353 VanDerWaalsContact CG-CD2 3.5Å; Y343-H353 AromaticContact CG-CG 3.7Å; Y343-H353 AromaticContact CG-NE2 3.95Å
354	L	94.8	Very high	89.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.264	C	S	.	.			trans	-128	90.2	172.2	178.8	66.9	0	0	0	109	V335 D336 C337 F352 S356 F366 V370 L373 F394 V409 F413	V335-L354 HydrophobicContact CG1-CB 3.61Å; V335-L354 HydrophobicContact CG1-CD2 4.15Å; D336-L354 PolarHBondContact O-N 3.23Å; C337-L354 VanDerWaalsContact CA-O 3.25Å; C337-L354 WeakPolarHBondContact CA-O 3.49Å; F352-L354 HydrophobicContact CD1-CB 4.45Å; F352-L354 HydrophobicContact CE1-CB 4.49Å; L354-S356 PolarHBondContact O-N 3.02Å; L354-S356 VanDerWaalsContact O-N 3.08Å; L354-F366 HydrophobicContact CD1-CD2 4.16Å; L354-F366 HydrophobicContact CD1-CE2 3.99Å; L354-F366 HydrophobicContact CD2-CE2 4.1Å; L354-F366 HydrophobicContact CG-CE2 4.13Å; L354-V370 HydrophobicContact CD1-CG2 4.24Å; L354-V370 HydrophobicContact CD2-CG2 4.38Å; L354-L373 HydrophobicContact CB-CD1 4.32Å; L354-L373 HydrophobicContact CD2-CD1 3.89Å; L354-F394 HydrophobicContact CD2-CE1 4.39Å; L354-V409 HydrophobicContact CD2-CG1 3.81Å; L354-F413 HydrophobicContact CD2-CE2 4.22Å
355	D	92.7	Very high	89.6	Confident	26 Å²	26	47.2 Å²	47.2	14%	0.139	27%	0.266	C	S	.	.			trans	-58.8	115.1	-179.5	-163.9	-31.1	0	0	0	111.5	A340 D357 L358	A340-D355 PolarHBondContact N-OD2 3.34Å; D355-D357 VanDerWaalsContact C-N 3.27Å; D355-D357 PolarHBondContact O-N 3.31Å; D355-D357 WeakPolarHBondContact OD1-CB 3.3Å; D355-D357 PolarHBondContact OD1-N 3.45Å; D355-L358 HydrophobicContact CB-CD1 3.92Å; D355-L358 HydrophobicContact CB-CG 4Å; D355-L358 WeakPolarHBondContact O-CB 3.45Å; D355-L358 PolarHBondContact O-N 3.48Å
356	S	89.4	Confident	89.6	Confident	5 Å²	5	45 Å²	45	4%	0.035	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-22.1	-176.5	54.5	0	0	0	0	113.1	C337 L354 L358 M359	C337-S356 VanDerWaalsContact O-CB 3.3Å; C337-S356 WeakPolarHBondContact O-CB 3.48Å; C337-S356 PolarHBondContact O-N 3.26Å; C337-S356 PolarHBondContact O-OG 3.29Å; L354-S356 PolarHBondContact O-N 3.02Å; L354-S356 VanDerWaalsContact O-N 3.08Å; S356-L358 PolarHBondContact O-N 2.92Å; S356-M359 WeakPolarHBondContact O-CB 3.39Å; S356-M359 PolarHBondContact O-N 3.37Å
357	D	87.4	Confident	89.7	Confident	41 Å²	41	46.5 Å²	46.5	22%	0.219	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-27.9	177.1	-72.6	-19.3	0	0	0	111.8	D355 M359 L360 Q361 Y405	D355-D357 VanDerWaalsContact C-N 3.27Å; D355-D357 PolarHBondContact O-N 3.31Å; D355-D357 WeakPolarHBondContact OD1-CB 3.3Å; D355-D357 PolarHBondContact OD1-N 3.45Å; D357-M359 PolarHBondContact O-N 3.21Å; D357-L360 PolarHBondContact O-N 3.01Å; D357-Q361 WeakPolarHBondContact O-CB 3.47Å; D357-Q361 WeakPolarHBondContact O-CG 3.44Å; D357-Q361 PolarHBondContact O-N 3.18Å; D357-Q361 VanDerWaalsContact O-N 3.07Å; D357-Y405 WeakPolarHBondContact OD1-CD2 3.42Å
358	L	87.6	Confident	89.8	Confident	29 Å²	29	51.1 Å²	51.1	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-28.1	178.4	-66.2	175	0	0	0	112.4	D355 S356 L360 N362 E365 F366	D355-L358 HydrophobicContact CB-CD1 3.92Å; D355-L358 HydrophobicContact CB-CG 4Å; D355-L358 WeakPolarHBondContact O-CB 3.45Å; D355-L358 PolarHBondContact O-N 3.48Å; S356-L358 PolarHBondContact O-N 2.92Å; L358-L360 PolarHBondContact O-N 3.27Å; L358-N362 HydrophobicContact CD2-CB 4.47Å; L358-N362 CarbonylContact O-C 3.52Å; L358-N362 WeakPolarHBondContact O-CA 3.49Å; L358-N362 PolarHBondContact O-N 3.27Å; L358-N362 VanDerWaalsContact O-O 3.1Å; L358-E365 HydrophobicContact CD1-CG 4.24Å; L358-E365 HydrophobicContact CD2-CG 4.32Å; L358-F366 HydrophobicContact CB-CB 4.02Å; L358-F366 HydrophobicContact CB-CD2 4.37Å
359	M	86.6	Confident	89.9	Confident	44 Å²	44	52.2 Å²	52.2	22%	0.217	29%	0.291	C	S	.	.	H	α-helix	trans	-59.8	-35.4	-178.4	-173.6	176.4	174	0	0	112.2	S356 D357 F366 M408 V409 H412	S356-M359 WeakPolarHBondContact O-CB 3.39Å; S356-M359 PolarHBondContact O-N 3.37Å; D357-M359 PolarHBondContact O-N 3.21Å; M359-F366 HydrophobicContact CB-CD1 4.46Å; M359-F366 HydrophobicContact CB-CD2 4Å; M359-F366 HydrophobicContact CB-CE2 4.11Å; M359-F366 HydrophobicContact CB-CG 4.18Å; M359-F366 HydrophobicContact CB-CZ 4.39Å; M359-F366 HydrophobicContact CG-CD1 4.37Å; M359-F366 HydrophobicContact CG-CE1 4.26Å; M359-F366 HydrophobicContact CG-CZ 4.36Å; M359-F366 HydrophobicContact SD-CZ 4.41Å; M359-M408 HydrophobicContact CE-CB 3.93Å; M359-M408 HydrophobicContact CE-CE 4.12Å; M359-M408 HydrophobicContact SD-CB 3.64Å; M359-M408 HydrophobicContact SD-CE 4.5Å; M359-V409 HydrophobicContact SD-CG2 4.05Å; M359-H412 HydrophobicContact CE-CB 4.28Å
360	L	85.3	Confident	90.3	Very high	99 Å²	99	49.9 Å²	49.9	52%	0.518	27%	0.274	S	S	.	.	H	α-helix	trans	-97.9	-37.2	178.9	-65.3	177.6	0	0	0	112.5	D357 L358 Y405 M408	D357-L360 PolarHBondContact O-N 3.01Å; L358-L360 PolarHBondContact O-N 3.27Å; L360-Y405 HydrophobicContact CD1-CD1 3.72Å; L360-Y405 HydrophobicContact CD1-CE1 3.41Å; L360-Y405 VanDerWaalsContact CD1-CE1 3.41Å; L360-M408 HydrophobicContact CD1-SD 4.5Å; L360-M408 HydrophobicContact CD2-CE 3.91Å
361	Q	88.1	Confident	90.5	Very high	149 Å²	149	52.8 Å²	52.8	70%	0.696	28%	0.284	S	S	*	.	H	α-helix	trans	-80.3	-40.8	-174	-63.7	-178.5	17.5	0	0	112.7	D357	D357-Q361 WeakPolarHBondContact O-CB 3.47Å; D357-Q361 WeakPolarHBondContact O-CG 3.44Å; D357-Q361 PolarHBondContact O-N 3.18Å; D357-Q361 VanDerWaalsContact O-N 3.07Å
362	N	90.1	Very high	90.6	Very high	58 Å²	58	55.1 Å²	55.1	31%	0.31	30%	0.3	S	S	.	.			trans	-146.6	77.9	-176.4	-166.5	-6.5	0	0	0	112	L358 S364 E365 F366	L358-N362 HydrophobicContact CD2-CB 4.47Å; L358-N362 CarbonylContact O-C 3.52Å; L358-N362 WeakPolarHBondContact O-CA 3.49Å; L358-N362 PolarHBondContact O-N 3.27Å; L358-N362 VanDerWaalsContact O-O 3.1Å; N362-S364 PolarHBondContact O-N 3.25Å; N362-S364 VanDerWaalsContact O-N 3.13Å; N362-S364 PolarHBondContact OD1-OG 3.17Å; N362-E365 HydrophobicContact CB-CB 4.06Å; N362-E365 WeakPolarHBondContact ND2-CB 3.18Å; N362-E365 PolarHBondContact ND2-OE2 2.98Å; N362-E365 PolarHBondContact O-N 2.8Å; N362-F366 PolarHBondContact O-N 3.47Å
363	P	90.3	Very high	90.5	Very high	81 Å²	81	52.8 Å²	52.8	53%	0.526	29%	0.29	S	S	.	.	H	α-helix	trans	-58.3	-30.7	-174.8	-26.1	34.3	0	0	0	114.6	A367	P363-A367 WeakPolarHBondContact O-CB 3.43Å; P363-A367 PolarHBondContact O-N 3.17Å
364	S	89.7	Confident	90.3	Very high	82 Å²	82	51.9 Å²	51.9	57%	0.573	29%	0.286	S	S	*	.	H	α-helix	trans	-66.2	-40.3	176	35	0	0	0	0	112.6	N362 L368	N362-S364 PolarHBondContact O-N 3.25Å; N362-S364 VanDerWaalsContact O-N 3.13Å; N362-S364 PolarHBondContact OD1-OG 3.17Å; S364-L368 WeakPolarHBondContact O-CG 3.15Å; S364-L368 PolarHBondContact O-N 3.21Å
365	E	90.7	Very high	90.2	Very high	89 Å²	89	56.7 Å²	56.7	42%	0.416	31%	0.309	S	S	.	.	H	α-helix	trans	-71	-42	177.1	-173.5	173.8	-175.1	0	0	110.4	L358 N362 A367 L368 S369	L358-E365 HydrophobicContact CD1-CG 4.24Å; L358-E365 HydrophobicContact CD2-CG 4.32Å; N362-E365 HydrophobicContact CB-CB 4.06Å; N362-E365 WeakPolarHBondContact ND2-CB 3.18Å; N362-E365 PolarHBondContact ND2-OE2 2.98Å; N362-E365 PolarHBondContact O-N 2.8Å; E365-A367 VanDerWaalsContact C-N 3.33Å; E365-A367 PolarHBondContact O-N 3.49Å; E365-L368 PolarHBondContact O-N 2.99Å; E365-L368 VanDerWaalsContact O-N 3.16Å; E365-S369 PolarHBondContact O-N 3.42Å; E365-S369 PolarHBondContact O-OG 2.85Å; E365-S369 VanDerWaalsContact O-OG 3.13Å
366	F	91.3	Very high	90	Very high	9 Å²	9	56.9 Å²	56.9	4%	0.039	31%	0.314	C	S	.	.	H	α-helix	trans	-55.1	-46.5	172.5	179.5	-100.1	0	0	0	112.2	L354 L358 M359 N362 L368 S369 V370 V409	L354-F366 HydrophobicContact CD1-CD2 4.16Å; L354-F366 HydrophobicContact CD1-CE2 3.99Å; L354-F366 HydrophobicContact CD2-CE2 4.1Å; L354-F366 HydrophobicContact CG-CE2 4.13Å; L358-F366 HydrophobicContact CB-CB 4.02Å; L358-F366 HydrophobicContact CB-CD2 4.37Å; M359-F366 HydrophobicContact CB-CD1 4.46Å; M359-F366 HydrophobicContact CB-CD2 4Å; M359-F366 HydrophobicContact CB-CE2 4.11Å; M359-F366 HydrophobicContact CB-CG 4.18Å; M359-F366 HydrophobicContact CB-CZ 4.39Å; M359-F366 HydrophobicContact CG-CD1 4.37Å; M359-F366 HydrophobicContact CG-CE1 4.26Å; M359-F366 HydrophobicContact CG-CZ 4.36Å; M359-F366 HydrophobicContact SD-CZ 4.41Å; N362-F366 PolarHBondContact O-N 3.47Å; F366-L368 VanDerWaalsContact C-N 3.33Å; F366-L368 PolarHBondContact O-N 3.09Å; F366-S369 WeakPolarHBondContact O-CB 3.46Å; F366-S369 PolarHBondContact O-N 2.96Å; F366-V370 HydrophobicContact CD1-CG2 4.15Å; F366-V370 HydrophobicContact CE1-CG2 3.71Å; F366-V370 HydrophobicContact CE2-CG2 4.16Å; F366-V370 HydrophobicContact CZ-CG2 3.71Å; F366-V370 WeakPolarHBondContact O-CG2 3.36Å; F366-V370 PolarHBondContact O-N 3.17Å; F366-V409 HydrophobicContact CE2-CG1 4.4Å; F366-V409 HydrophobicContact CE2-CG2 3.82Å; F366-V409 HydrophobicContact CZ-CG1 4.19Å; F366-V409 HydrophobicContact CZ-CG2 3.99Å
367	A	89.8	Confident	90	Very high	38 Å²	38	57.8 Å²	57.8	31%	0.314	32%	0.318	S	S	.	.	H	α-helix	trans	-62.5	-37.6	178.3	0	0	0	0	0	113	P363 E365 K371	P363-A367 WeakPolarHBondContact O-CB 3.43Å; P363-A367 PolarHBondContact O-N 3.17Å; E365-A367 VanDerWaalsContact C-N 3.33Å; E365-A367 PolarHBondContact O-N 3.49Å; A367-K371 PolarHBondContact O-N 3.26Å
368	L	91.4	Very high	90.1	Very high	114 Å²	114	62.1 Å²	62.1	60%	0.597	33%	0.334	S	S	*	.	H	α-helix	trans	-65.8	-43.8	173.5	-71.2	172.1	0	0	0	111.1	S364 E365 F366 V370 K371 S372	S364-L368 WeakPolarHBondContact O-CG 3.15Å; S364-L368 PolarHBondContact O-N 3.21Å; E365-L368 PolarHBondContact O-N 2.99Å; E365-L368 VanDerWaalsContact O-N 3.16Å; F366-L368 VanDerWaalsContact C-N 3.33Å; F366-L368 PolarHBondContact O-N 3.09Å; L368-V370 PolarHBondContact O-N 2.88Å; L368-K371 WeakPolarHBondContact O-CB 3.3Å; L368-K371 PolarHBondContact O-N 2.82Å; L368-S372 PolarHBondContact O-N 3.16Å; L368-S372 PolarHBondContact O-OG 2.95Å
369	S	91.6	Very high	90.1	Very high	29 Å²	29	65.9 Å²	65.9	20%	0.203	35%	0.351	C	S	.	.	H	α-helix	trans	-61.6	-41.3	176.9	-62.1	0	0	0	0	112.2	E365 F366 S372 L373	E365-S369 PolarHBondContact O-N 3.42Å; E365-S369 PolarHBondContact O-OG 2.85Å; E365-S369 VanDerWaalsContact O-OG 3.13Å; F366-S369 WeakPolarHBondContact O-CB 3.46Å; F366-S369 PolarHBondContact O-N 2.96Å; S369-S372 PolarHBondContact O-N 3.22Å; S369-L373 WeakPolarHBondContact O-CB 3.48Å; S369-L373 PolarHBondContact O-N 2.88Å
370	V	92.3	Very high	90	Very high	8 Å²	8	64.5 Å²	64.5	5%	0.048	35%	0.346	C	S	.	.	H	α-helix	trans	-63.2	-41.2	173.8	171.4	0	0	0	0	111.4	L354 F366 L368 L373 L374 F413	L354-V370 HydrophobicContact CD1-CG2 4.24Å; L354-V370 HydrophobicContact CD2-CG2 4.38Å; F366-V370 HydrophobicContact CD1-CG2 4.15Å; F366-V370 HydrophobicContact CE1-CG2 3.71Å; F366-V370 HydrophobicContact CE2-CG2 4.16Å; F366-V370 HydrophobicContact CZ-CG2 3.71Å; F366-V370 WeakPolarHBondContact O-CG2 3.36Å; F366-V370 PolarHBondContact O-N 3.17Å; L368-V370 PolarHBondContact O-N 2.88Å; V370-L373 WeakPolarHBondContact O-CB 3.4Å; V370-L373 PolarHBondContact O-N 2.85Å; V370-L374 HydrophobicContact CG1-CD1 4.12Å; V370-L374 WeakPolarHBondContact O-CD1 3.36Å; V370-L374 WeakPolarHBondContact O-CG 3.41Å; V370-L374 PolarHBondContact O-N 2.8Å; V370-F413 HydrophobicContact CG1-CE1 4.42Å; V370-F413 HydrophobicContact CG1-CZ 3.95Å; V370-F413 HydrophobicContact CG2-CE2 4.33Å; V370-F413 HydrophobicContact CG2-CZ 4.25Å
371	K	91.3	Very high	89.9	Confident	97 Å²	97	62.8 Å²	62.8	42%	0.422	34%	0.337	S	S	.	.	H	α-helix	trans	-61.8	-46.5	174.6	-175.8	-175.2	175.2	-174.3	0	111.2	A367 L368 L373 L374 E375 L518	A367-K371 PolarHBondContact O-N 3.26Å; L368-K371 WeakPolarHBondContact O-CB 3.3Å; L368-K371 PolarHBondContact O-N 2.82Å; K371-L373 VanDerWaalsContact C-N 3.31Å; K371-L373 PolarHBondContact O-N 2.86Å; K371-L374 PolarHBondContact O-N 3.23Å; K371-E375 WeakPolarHBondContact O-CB 3.39Å; K371-E375 PolarHBondContact O-N 2.88Å; K371-L518 HydrophobicContact CD-CD2 4.45Å
372	S	92.6	Very high	89.8	Confident	60 Å²	60	62.6 Å²	62.6	42%	0.42	34%	0.336	S	S	.	.	H	α-helix	trans	-63.3	-35.7	177.1	-67.6	0	0	0	0	112.7	L368 S369 E375 A376	L368-S372 PolarHBondContact O-N 3.16Å; L368-S372 PolarHBondContact O-OG 2.95Å; S369-S372 PolarHBondContact O-N 3.22Å; S372-E375 PolarHBondContact O-N 2.9Å; S372-A376 WeakPolarHBondContact O-CB 3.34Å; S372-A376 PolarHBondContact O-N 2.61Å
373	L	93	Very high	89.3	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.9	-49.9	175.2	-179	160.1	0	0	0	111.1	F333 V335 F352 L354 S369 V370 K371 A376 Q377 L392 F413	F333-L373 HydrophobicContact CE1-CD2 4.15Å; F333-L373 HydrophobicContact CE1-CG 4.05Å; V335-L373 HydrophobicContact CB-CD1 4.42Å; V335-L373 HydrophobicContact CG1-CD1 3.66Å; V335-L373 HydrophobicContact CG2-CD1 3.81Å; V335-L373 HydrophobicContact CG2-CG 4.38Å; F352-L373 HydrophobicContact CD1-CB 3.95Å; F352-L373 HydrophobicContact CD1-CD1 3.87Å; F352-L373 HydrophobicContact CD1-CG 3.87Å; F352-L373 HydrophobicContact CE1-CB 3.6Å; F352-L373 HydrophobicContact CE1-CD1 4.12Å; F352-L373 HydrophobicContact CE1-CG 4.06Å; F352-L373 HydrophobicContact CE2-CB 4.45Å; F352-L373 HydrophobicContact CG-CG 4.34Å; F352-L373 HydrophobicContact CZ-CB 3.88Å; L354-L373 HydrophobicContact CB-CD1 4.32Å; L354-L373 HydrophobicContact CD2-CD1 3.89Å; S369-L373 WeakPolarHBondContact O-CB 3.48Å; S369-L373 PolarHBondContact O-N 2.88Å; V370-L373 WeakPolarHBondContact O-CB 3.4Å; V370-L373 PolarHBondContact O-N 2.85Å; K371-L373 VanDerWaalsContact C-N 3.31Å; K371-L373 PolarHBondContact O-N 2.86Å; L373-A376 PolarHBondContact O-N 3.46Å; L373-Q377 WeakPolarHBondContact O-CB 3.49Å; L373-Q377 PolarHBondContact O-N 2.88Å; L373-L392 HydrophobicContact CD2-CD2 4.06Å; L373-F413 HydrophobicContact CD1-CZ 4.28Å; L373-F413 HydrophobicContact CD2-CE1 4.5Å
374	L	91.6	Very high	88.5	Confident	32 Å²	32	62.3 Å²	62.3	17%	0.168	35%	0.348	C	S	.	.	H	α-helix	trans	-71.3	-34.9	-177	-62.9	161.9	0	0	0	112.1	V370 K371 Q377 K378 F413 W520	V370-L374 HydrophobicContact CG1-CD1 4.12Å; V370-L374 WeakPolarHBondContact O-CD1 3.36Å; V370-L374 WeakPolarHBondContact O-CG 3.41Å; V370-L374 PolarHBondContact O-N 2.8Å; K371-L374 PolarHBondContact O-N 3.23Å; L374-Q377 PolarHBondContact O-N 2.89Å; L374-K378 WeakPolarHBondContact O-CB 3.36Å; L374-K378 PolarHBondContact O-N 3.19Å; L374-F413 HydrophobicContact CD2-CE1 4.46Å; L374-W520 HydrophobicContact CD1-CH2 3.1Å; L374-W520 HydrophobicContact CD1-CZ2 3.89Å; L374-W520 HydrophobicContact CD1-CZ3 3.59Å; L374-W520 HydrophobicContact CG-CH2 4.43Å
375	E	90.7	Very high	87.6	Confident	101 Å²	101	60.8 Å²	60.8	47%	0.472	34%	0.338	S	S	.	.	H	α-helix	trans	-66.5	-42.1	172.7	-171.4	169.5	-174.9	0	0	111.2	K371 S372 K378 Q379	K371-E375 WeakPolarHBondContact O-CB 3.39Å; K371-E375 PolarHBondContact O-N 2.88Å; S372-E375 PolarHBondContact O-N 2.9Å; E375-K378 PolarHBondContact O-N 2.68Å; E375-Q379 WeakPolarHBondContact O-CB 3.34Å; E375-Q379 VanDerWaalsContact O-CG 3.29Å; E375-Q379 WeakPolarHBondContact O-CG 3.42Å; E375-Q379 PolarHBondContact O-N 2.82Å
376	A	89.2	Confident	86.5	Confident	30 Å²	30	61.8 Å²	61.8	25%	0.248	35%	0.345	C	S	.	.	H	α-helix	trans	-63.4	-41.7	174.3	0	0	0	0	0	111.7	F333 F352 S372 L373 Q379 S380	F333-A376 HydrophobicContact CZ-CB 4.28Å; F352-A376 HydrophobicContact CD2-CB 4.07Å; F352-A376 HydrophobicContact CE2-CB 4.06Å; S372-A376 WeakPolarHBondContact O-CB 3.34Å; S372-A376 PolarHBondContact O-N 2.61Å; L373-A376 PolarHBondContact O-N 3.46Å; A376-Q379 PolarHBondContact O-N 2.88Å; A376-S380 WeakPolarHBondContact O-CB 3.34Å; A376-S380 PolarHBondContact O-N 3Å; A376-S380 PolarHBondContact O-OG 3.4Å
377	Q	90.5	Very high	85.2	Confident	24 Å²	24	62.4 Å²	62.4	11%	0.112	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-51.8	173.9	-172.9	-172.4	24.2	0	0	110.4	F333 L373 L374 Q379 S380 L381 G389 E390	F333-Q377 HydrophobicContact CB-CG 4.13Å; F333-Q377 HydrophobicContact CD1-CB 4.3Å; F333-Q377 HydrophobicContact CD1-CG 4.37Å; F333-Q377 HydrophobicContact CD2-CB 4.08Å; F333-Q377 HydrophobicContact CD2-CG 4.02Å; F333-Q377 HydrophobicContact CE1-CB 4.33Å; F333-Q377 HydrophobicContact CE2-CB 4.11Å; F333-Q377 HydrophobicContact CG-CB 4.17Å; F333-Q377 HydrophobicContact CG-CG 3.91Å; F333-Q377 HydrophobicContact CZ-CB 4.22Å; L373-Q377 WeakPolarHBondContact O-CB 3.49Å; L373-Q377 PolarHBondContact O-N 2.88Å; L374-Q377 PolarHBondContact O-N 2.89Å; Q377-Q379 PolarHBondContact O-N 2.77Å; Q377-S380 PolarHBondContact O-N 2.96Å; Q377-S380 PolarHBondContact O-OG 3Å; Q377-L381 HydrophobicContact CG-CD1 4.21Å; Q377-L381 WeakPolarHBondContact O-CG 3.38Å; Q377-L381 PolarHBondContact O-N 3.37Å; Q377-G389 PolarHBondContact NE2-O 2.9Å; Q377-E390 PolarHBondContact NE2-O 3.48Å
378	K	88.8	Confident	84.4	Confident	131 Å²	131	60.6 Å²	60.6	57%	0.57	34%	0.336	S	S	*	.	H	α-helix	trans	-57.6	-49.3	178.8	-177	179.1	175.6	-179.4	0	112.4	L374 E375 S380 L381 E382	L374-K378 WeakPolarHBondContact O-CB 3.36Å; L374-K378 PolarHBondContact O-N 3.19Å; E375-K378 PolarHBondContact O-N 2.68Å; K378-S380 VanDerWaalsContact C-N 3.31Å; K378-S380 PolarHBondContact O-N 3.45Å; K378-L381 PolarHBondContact O-N 3.34Å; K378-E382 WeakPolarHBondContact CE-OE1 3.38Å; K378-E382 WeakPolarHBondContact O-CG 3.5Å; K378-E382 PolarHBondContact O-N 3.06Å
379	Q	87	Confident	84	Confident	109 Å²	109	55.1 Å²	55.1	51%	0.509	31%	0.308	S	S	.	.	H	α-helix	trans	-62.9	-39.1	178.1	-71.5	177.1	6.8	0	0	111.8	E375 A376 Q377 L381 E382 S383	E375-Q379 WeakPolarHBondContact O-CB 3.34Å; E375-Q379 VanDerWaalsContact O-CG 3.29Å; E375-Q379 WeakPolarHBondContact O-CG 3.42Å; E375-Q379 PolarHBondContact O-N 2.82Å; A376-Q379 PolarHBondContact O-N 2.88Å; Q377-Q379 PolarHBondContact O-N 2.77Å; Q379-L381 VanDerWaalsContact C-N 3.34Å; Q379-L381 PolarHBondContact O-N 3.43Å; Q379-E382 PolarHBondContact O-N 3.39Å; Q379-S383 WeakPolarHBondContact O-CB 3.12Å; Q379-S383 PolarHBondContact O-N 2.77Å; Q379-S383 PolarHBondContact O-OG 3.38Å
380	S	84.3	Confident	83.8	Confident	14 Å²	14	58.4 Å²	58.4	10%	0.098	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-42.1	177.9	78	0	0	0	0	111.3	A376 Q377 K378 S383 G384 S385 S388	A376-S380 WeakPolarHBondContact O-CB 3.34Å; A376-S380 PolarHBondContact O-N 3Å; A376-S380 PolarHBondContact O-OG 3.4Å; Q377-S380 PolarHBondContact O-N 2.96Å; Q377-S380 PolarHBondContact O-OG 3Å; K378-S380 VanDerWaalsContact C-N 3.31Å; K378-S380 PolarHBondContact O-N 3.45Å; S380-S383 WeakPolarHBondContact CA-OG 3.4Å; S380-S383 PolarHBondContact O-N 2.91Å; S380-S383 PolarHBondContact O-OG 3.2Å; S380-G384 PolarHBondContact O-N 3.32Å; S380-G384 VanDerWaalsContact O-N 3.13Å; S380-S385 PolarHBondContact O-N 3.45Å; S380-S388 WeakPolarHBondContact O-CB 3.43Å; S380-S388 PolarHBondContact O-OG 2.89Å; S380-S388 WeakPolarHBondContact OG-CA 3.26Å; S380-S388 WeakPolarHBondContact OG-CB 3.47Å
381	L	84.9	Confident	84	Confident	64 Å²	64	58.3 Å²	58.3	34%	0.335	32%	0.319	S	S	.	.	H	α-helix	trans	-63.2	-47.5	176.9	-73.7	169.4	0	0	0	111.4	Q377 K378 Q379 S383 G384	Q377-L381 HydrophobicContact CG-CD1 4.21Å; Q377-L381 WeakPolarHBondContact O-CG 3.38Å; Q377-L381 PolarHBondContact O-N 3.37Å; K378-L381 PolarHBondContact O-N 3.34Å; Q379-L381 VanDerWaalsContact C-N 3.34Å; Q379-L381 PolarHBondContact O-N 3.43Å; L381-S383 PolarHBondContact O-N 2.58Å; L381-G384 PolarHBondContact O-N 2.74Å
382	E	84.2	Confident	84.2	Confident	145 Å²	145	53.9 Å²	53.9	68%	0.678	30%	0.3	S	S	*	.	H	α-helix	trans	-61	-33.4	176.6	-71.4	174.1	-174.2	0	0	112.3	K378 Q379	K378-E382 WeakPolarHBondContact CE-OE1 3.38Å; K378-E382 WeakPolarHBondContact O-CG 3.5Å; K378-E382 PolarHBondContact O-N 3.06Å; Q379-E382 PolarHBondContact O-N 3.39Å
383	S	79.4	Confident	84.4	Confident	83 Å²	83	51 Å²	51	58%	0.58	28%	0.28	S	S	*	.	H	α-helix	trans	-83.7	-10	179.5	72.5	0	0	0	0	115	Q379 S380 L381 S385	Q379-S383 WeakPolarHBondContact O-CB 3.12Å; Q379-S383 PolarHBondContact O-N 2.77Å; Q379-S383 PolarHBondContact O-OG 3.38Å; S380-S383 WeakPolarHBondContact CA-OG 3.4Å; S380-S383 PolarHBondContact O-N 2.91Å; S380-S383 PolarHBondContact O-OG 3.2Å; L381-S383 PolarHBondContact O-N 2.58Å; S383-S385 PolarHBondContact O-N 2.86Å
384	G	74.5	Confident	84.6	Confident	49 Å²	49	51 Å²	51	51%	0.505	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	28.7	-175.3	0	0	0	0	0	114.1	S380 L381	S380-G384 PolarHBondContact O-N 3.32Å; S380-G384 VanDerWaalsContact O-N 3.13Å; L381-G384 PolarHBondContact O-N 2.74Å
385	S	71.2	Confident	84.9	Confident	51 Å²	51	49.9 Å²	49.9	36%	0.357	27%	0.273	S	S	.	.			trans	-65.4	156.3	-178.1	179.7	0	0	0	0	112.4	R331 S380 S383 A387 S388	R331-S385 PolarHBondContact NH1-O 3.29Å; S380-S385 PolarHBondContact O-N 3.45Å; S383-S385 PolarHBondContact O-N 2.86Å; S385-A387 PolarHBondContact O-N 3.11Å; S385-A387 PolarHBondContact OG-N 3.18Å; S385-S388 PolarHBondContact N-OG 3.1Å; S385-S388 VanDerWaalsContact O-CB 3.28Å; S385-S388 WeakPolarHBondContact O-CB 3.12Å; S385-S388 PolarHBondContact O-N 2.89Å; S385-S388 PolarHBondContact O-OG 3.36Å
386	I	67.1	Low	85.1	Confident	110 Å²	110	45.1 Å²	45.1	56%	0.564	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.5	172.2	-68.9	163.3	0	0	0	111.4	T350 S388	T350-I386 HydrophobicContact CG2-CG2 4.49Å; I386-S388 PolarHBondContact O-N 2.74Å
387	A	64.7	Low	85.3	Confident	21 Å²	21	44 Å²	44	17%	0.174	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	6.1	175.9	0	0	0	0	0	113.5	F333 T350 S385	F333-A387 WeakPolarHBondContact CD2-O 3.39Å; T350-A387 HydrophobicContact CG2-CB 3.94Å; S385-A387 PolarHBondContact O-N 3.11Å; S385-A387 PolarHBondContact OG-N 3.18Å
388	S	72.4	Confident	85.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.251	C	S	.	.			trans	-94.3	130.7	-176.6	68.8	0	0	0	0	112.1	R331 S380 S385 I386	R331-S388 VanDerWaalsContact CZ-O 3.23Å; R331-S388 PolarHBondContact NH1-O 2.85Å; R331-S388 PolarHBondContact NH1-OG 3.42Å; R331-S388 PolarHBondContact NH2-OG 3.45Å; S380-S388 WeakPolarHBondContact O-CB 3.43Å; S380-S388 PolarHBondContact O-OG 2.89Å; S380-S388 WeakPolarHBondContact OG-CA 3.26Å; S380-S388 WeakPolarHBondContact OG-CB 3.47Å; S385-S388 PolarHBondContact N-OG 3.1Å; S385-S388 VanDerWaalsContact O-CB 3.28Å; S385-S388 WeakPolarHBondContact O-CB 3.12Å; S385-S388 PolarHBondContact O-N 2.89Å; S385-S388 PolarHBondContact O-OG 3.36Å; I386-S388 PolarHBondContact O-N 2.74Å
389	G	81.9	Confident	85.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.246	C	C	.	.			trans	-154.5	142.1	176.4	0	0	0	0	0	111.2	R331 F333 Q377 H391	R331-G389 CarbonylContact O-C 3.54Å; R331-G389 WeakPolarHBondContact O-CA 3.39Å; F333-G389 WeakPolarHBondContact CB-O 3.48Å; Q377-G389 PolarHBondContact NE2-O 2.9Å; G389-H391 VanDerWaalsContact C-N 3.3Å
390	E	89.4	Confident	84.9	Confident	97 Å²	97	47.2 Å²	47.2	45%	0.453	26%	0.262	S	S	.	.	S	Bend	trans	-72.3	-32.6	174.8	-173	175.7	-174.8	0	0	110.4	R331 Q377 Y420	R331-E390 PolarHBondContact O-N 3.33Å; Q377-E390 PolarHBondContact NE2-O 3.48Å; E390-Y420 HydrophobicContact CG-CD2 3.91Å; E390-Y420 HydrophobicContact CG-CE2 4.05Å; E390-Y420 WeakPolarHBondContact OE1-CE2 3.32Å
391	H	94.8	Very high	84.7	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.028	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.1	-174.5	-54	-92.5	0	0	0	111.1	Y171 K279 V330 R331 F332 F333 G389 Y420	Y171-H391 AromaticContact CE1-ND1 3.73Å; Y171-H391 AromaticContact CZ-ND1 3.53Å; Y171-H391 WeakPolarHBondContact OH-CB 3.49Å; Y171-H391 PolarHBondContact OH-ND1 3.2Å; K279-H391 PolarHBondContact O-CE1 2.8Å; V330-H391 HydrophobicContact CG1-CB 4.49Å; R331-H391 PolarHBondContact O-CD2 3.38Å; R331-H391 PolarHBondContact O-N 2.96Å; F332-H391 CarbonylContact C-O 3.47Å; F332-H391 WeakPolarHBondContact CA-O 3.46Å; F332-H391 HydrophobicContact CD1-CB 3.89Å; F332-H391 HydrophobicContact CE1-CB 4.16Å; F333-H391 PolarHBondContact N-O 2.86Å; G389-H391 VanDerWaalsContact C-N 3.3Å; H391-Y420 AromaticContact CE1-CD1 3.66Å; H391-Y420 AromaticContact CE1-CE1 3.96Å; H391-Y420 AromaticContact CE1-CG 3.68Å; H391-Y420 VanDerWaalsContact ND1-CB 3.32Å; H391-Y420 WeakPolarHBondContact ND1-CB 3.4Å; H391-Y420 AromaticContact ND1-CD1 3.5Å; H391-Y420 WeakPolarHBondContact ND1-CD1 3.46Å; H391-Y420 AromaticContact ND1-CD2 3.89Å; H391-Y420 AromaticContact ND1-CG 3.27Å; H391-Y420 VanDerWaalsContact ND1-CG 3.27Å
392	L	96.7	Very high	84.7	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	123.3	177.6	-69.3	172.9	0	0	0	109.6	F333 V335 L373 F394 F413 Y420 S422	F333-L392 HydrophobicContact CB-CD2 4.29Å; F333-L392 HydrophobicContact CD1-CD2 3.82Å; F333-L392 HydrophobicContact CG-CD2 4.45Å; V335-L392 HydrophobicContact CG2-CD2 4.37Å; L373-L392 HydrophobicContact CD2-CD2 4.06Å; L392-F394 HydrophobicContact CB-CE2 3.92Å; L392-F413 HydrophobicContact CD1-CD1 4.01Å; L392-F413 HydrophobicContact CD1-CE1 4.07Å; L392-Y420 PolarHBondContact N-O 3.13Å; L392-Y420 VanDerWaalsContact O-O 3.11Å; L392-S422 PolarHBondContact O-N 2.82Å; L392-S422 PolarHBondContact O-OG 3.19Å
393	C	97	Very high	84.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	108.1	176.2	-167.1	0	0	0	0	110.4	I319 F332 F333 V334 V335 S422	I319-C393 VanDerWaalsContact CD1-SG 3.58Å; F332-C393 HydrophobicContact CB-CB 4.15Å; F332-C393 HydrophobicContact CD1-CB 3.87Å; F332-C393 HydrophobicContact CG-CB 4.31Å; F333-C393 PolarHBondContact O-N 2.94Å; V334-C393 CarbonylContact C-O 3.49Å; V334-C393 WeakPolarHBondContact CA-O 3.4Å; V335-C393 PolarHBondContact N-O 3.06Å; C393-S422 WeakPolarHBondContact CA-OG 3.46Å; C393-S422 WeakPolarHBondContact CB-OG 3.04Å
394	F	97.2	Very high	85.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.8	179.9	-65.2	-95.7	0	0	0	110	V335 L354 L392 M406 V409 L410 F413 V421 S422 I423 A424	V335-F394 HydrophobicContact CB-CD1 3.83Å; V335-F394 HydrophobicContact CB-CE1 4.07Å; V335-F394 HydrophobicContact CB-CG 4.41Å; V335-F394 HydrophobicContact CG1-CD1 3.89Å; V335-F394 HydrophobicContact CG1-CE1 3.92Å; V335-F394 HydrophobicContact CG2-CD1 4.43Å; V335-F394 HydrophobicContact CG2-CE1 4.26Å; V335-F394 CarbonylContact O-C 3.41Å; V335-F394 WeakPolarHBondContact O-CA 3.39Å; L354-F394 HydrophobicContact CD2-CE1 4.39Å; L392-F394 HydrophobicContact CB-CE2 3.92Å; F394-M406 HydrophobicContact CB-SD 4.44Å; F394-V409 HydrophobicContact CD1-CG1 4.25Å; F394-V409 HydrophobicContact CE1-CG1 3.9Å; F394-L410 HydrophobicContact CB-CD2 3.87Å; F394-L410 HydrophobicContact CB-CG 4.42Å; F394-L410 HydrophobicContact CD2-CD2 3.35Å; F394-L410 HydrophobicContact CE2-CD2 4.01Å; F394-L410 HydrophobicContact CG-CD2 3.66Å; F394-L410 HydrophobicContact CG-CG 4.41Å; F394-F413 AromaticContact CE1-CD2 3.99Å; F394-F413 HydrophobicContact CE1-CD2 3.99Å; F394-F413 AromaticContact CE1-CE2 3.74Å; F394-F413 HydrophobicContact CE1-CE2 3.74Å; F394-F413 HydrophobicContact CE1-CZ 4.14Å; F394-F413 HydrophobicContact CE2-CD2 4.47Å; F394-F413 HydrophobicContact CE2-CG 4.37Å; F394-F413 AromaticContact CZ-CD1 3.93Å; F394-F413 HydrophobicContact CZ-CD1 3.93Å; F394-F413 AromaticContact CZ-CD2 3.54Å; F394-F413 HydrophobicContact CZ-CD2 3.54Å; F394-F413 AromaticContact CZ-CE1 3.96Å; F394-F413 HydrophobicContact CZ-CE1 3.96Å; F394-F413 AromaticContact CZ-CE2 3.58Å; F394-F413 HydrophobicContact CZ-CE2 3.58Å; F394-F413 AromaticContact CZ-CG 3.74Å; F394-F413 HydrophobicContact CZ-CG 3.74Å; F394-F413 AromaticContact CZ-CZ 3.8Å; F394-F413 HydrophobicContact CZ-CZ 3.8Å; F394-V421 HydrophobicContact CD2-CG1 4.23Å; F394-V421 HydrophobicContact CE2-CG1 4Å; F394-S422 PolarHBondContact N-O 2.85Å; F394-I423 WeakPolarHBondContact O-CA 3.07Å; F394-A424 PolarHBondContact O-N 3.31Å
395	M	96.3	Very high	85.7	Confident	7 Å²	7	52.2 Å²	52.2	3%	0.034	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.3	173.4	80.4	164.4	84.9	0	0	110.8	V334 V335 D336 C337 L348 A351 M406 A424 F428	V334-M395 HydrophobicContact CB-CE 4.45Å; V334-M395 HydrophobicContact CG1-CE 3.11Å; V335-M395 PolarHBondContact O-N 3.48Å; D336-M395 HydrophobicContact CB-CG 3.89Å; D336-M395 HydrophobicContact CB-SD 4.18Å; C337-M395 PolarHBondContact N-O 2.88Å; L348-M395 HydrophobicContact CB-CE 3.92Å; L348-M395 HydrophobicContact CD2-CE 4.11Å; A351-M395 HydrophobicContact CB-CE 4.06Å; M395-M406 VanDerWaalsContact C-SD 3.53Å; M395-A424 HydrophobicContact CB-CB 3.92Å; M395-F428 HydrophobicContact SD-CB 4.41Å; M395-F428 HydrophobicContact SD-CD2 4Å
396	G	95.3	Very high	86.6	Confident	1 Å²	1	50 Å²	50	1%	0.01	24%	0.242	C	C	.	.			trans	-101.4	-164.1	169.6	0	0	0	0	0	111.2	G398 D403 M406 G427 F428	G396-G398 VanDerWaalsContact C-N 3.29Å; G396-D403 WeakPolarHBondContact CA-OD1 3.3Å; G396-M406 WeakPolarHBondContact CA-SD 3.5Å; G396-M406 PolarHBondContact N-SD 3.3Å; G396-G427 WeakPolarHBondContact O-CA 3.18Å; G396-F428 PolarHBondContact O-N 2.88Å
397	S	92.7	Very high	87.7	Confident	6 Å²	6	47.6 Å²	47.6	4%	0.042	23%	0.23	C	C	.	.			trans	-64.3	-35.8	170.4	67.3	0	0	0	0	111.7	R399 E402 D403 F428 M429	S397-R399 WeakPolarHBondContact OG-CB 3.34Å; S397-R399 PolarHBondContact OG-N 3.47Å; S397-R399 PolarHBondContact OG-O 3.02Å; S397-E402 WeakPolarHBondContact OG-CB 3.5Å; S397-D403 WeakPolarHBondContact CB-OD1 3.48Å; S397-D403 PolarHBondContact N-OD1 2.73Å; S397-D403 PolarHBondContact OG-OD1 3.37Å; S397-F428 PolarHBondContact O-N 3.01Å; S397-M429 WeakPolarHBondContact O-CB 3.45Å; S397-M429 VanDerWaalsContact O-CG 3.27Å; S397-M429 WeakPolarHBondContact O-CG 3.28Å; S397-M429 PolarHBondContact O-N 3.22Å
398	G	89.6	Confident	88.9	Confident	29 Å²	29	50 Å²	50	30%	0.299	24%	0.239	S	C	.	.	S	Bend	trans	95.6	6	-165.5	0	0	0	0	0	113.5	G396 D403 G426	G396-G398 VanDerWaalsContact C-N 3.29Å; G398-D403 WeakPolarHBondContact CA-OD2 3.42Å; G398-D403 PolarHBondContact N-OD2 3.32Å; G398-G426 VanDerWaalsContact CA-O 3.25Å; G398-G426 WeakPolarHBondContact CA-O 3.32Å
399	R	86.8	Confident	89.9	Confident	123 Å²	123	50 Å²	50	46%	0.464	24%	0.239	S	C	.	.			trans	-112.4	121.9	175.8	-59.7	172.2	178.3	-179.1	0.1	108.7	S397 E401 E402 D403 M429	S397-R399 WeakPolarHBondContact OG-CB 3.34Å; S397-R399 PolarHBondContact OG-N 3.47Å; S397-R399 PolarHBondContact OG-O 3.02Å; R399-E401 PolarHBondContact O-N 2.95Å; R399-E401 VanDerWaalsContact O-N 3.17Å; R399-E402 HydrophobicContact CB-CB 4.36Å; R399-E402 HydrophobicContact CB-CG 4.36Å; R399-E402 WeakPolarHBondContact CD-OE1 3.33Å; R399-E402 IonicContact CZ-OE1 2.61Å; R399-E402 IonicContact NE-OE1 3.83Å; R399-E402 IonicContact NH1-OE1 3.5Å; R399-E402 PolarHBondContact NH1-OE1 3.39Å; R399-E402 PolarHBondContact O-N 3.01Å; R399-D403 PolarHBondContact N-OD2 2.83Å; R399-D403 WeakPolarHBondContact O-CB 3.44Å; R399-D403 VanDerWaalsContact O-CG 3.25Å; R399-D403 PolarHBondContact O-N 2.86Å; R399-M429 HydrophobicContact CG-SD 3.54Å; R399-M429 VanDerWaalsContact CG-SD 3.54Å; R399-M429 PolarHBondContact NE-SD 3.17Å; R399-M429 VanDerWaalsContact NE-SD 3.39Å
400	E	81.8	Confident	90.4	Very high	181 Å²	181	50 Å²	50	85%	0.846	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.7	-177.1	-67.5	-176.9	168.6	0	0	113.3	E402 D403	E400-E402 VanDerWaalsContact C-N 3.33Å; E400-E402 PolarHBondContact O-N 2.86Å; E400-D403 PolarHBondContact O-N 3.06Å
401	E	81.6	Confident	90.6	Very high	188 Å²	188	47.7 Å²	47.7	88%	0.879	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-36.7	178.6	-63.2	178.8	-170.4	0	0	113	R399	R399-E401 PolarHBondContact O-N 2.95Å; R399-E401 VanDerWaalsContact O-N 3.17Å
402	E	83.9	Confident	90.4	Very high	67 Å²	67	50 Å²	50	31%	0.313	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-26.9	-177.9	-63.5	178.7	-152.1	0	0	111.3	Q342 S397 R399 E400 M404	Q342-E402 PolarHBondContact NE2-OE2 3.08Å; S397-E402 WeakPolarHBondContact OG-CB 3.5Å; R399-E402 HydrophobicContact CB-CB 4.36Å; R399-E402 HydrophobicContact CB-CG 4.36Å; R399-E402 WeakPolarHBondContact CD-OE1 3.33Å; R399-E402 IonicContact CZ-OE1 2.61Å; R399-E402 IonicContact NE-OE1 3.83Å; R399-E402 IonicContact NH1-OE1 3.5Å; R399-E402 PolarHBondContact NH1-OE1 3.39Å; R399-E402 PolarHBondContact O-N 3.01Å; E400-E402 VanDerWaalsContact C-N 3.33Å; E400-E402 PolarHBondContact O-N 2.86Å; E402-M404 VanDerWaalsContact C-N 3.29Å; E402-M404 PolarHBondContact O-N 3.02Å
403	D	87.9	Confident	90.3	Very high	20 Å²	20	49.9 Å²	49.9	11%	0.107	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	0.9	-173.3	-71.5	-4.2	0	0	0	113.4	G396 S397 G398 R399 E400 Y405 M406 N407	G396-D403 WeakPolarHBondContact CA-OD1 3.3Å; S397-D403 WeakPolarHBondContact CB-OD1 3.48Å; S397-D403 PolarHBondContact N-OD1 2.73Å; S397-D403 PolarHBondContact OG-OD1 3.37Å; G398-D403 WeakPolarHBondContact CA-OD2 3.42Å; G398-D403 PolarHBondContact N-OD2 3.32Å; R399-D403 PolarHBondContact N-OD2 2.83Å; R399-D403 WeakPolarHBondContact O-CB 3.44Å; R399-D403 VanDerWaalsContact O-CG 3.25Å; R399-D403 PolarHBondContact O-N 2.86Å; E400-D403 PolarHBondContact O-N 3.06Å; D403-Y405 VanDerWaalsContact C-N 3.33Å; D403-Y405 PolarHBondContact O-N 2.93Å; D403-M406 HydrophobicContact CB-CE 3.92Å; D403-M406 WeakPolarHBondContact O-CB 3.21Å; D403-M406 PolarHBondContact O-N 2.79Å; D403-M406 VanDerWaalsContact O-N 3.16Å; D403-N407 PolarHBondContact O-N 2.78Å
404	M	86.9	Confident	90.2	Very high	103 Å²	103	51 Å²	51	51%	0.507	25%	0.252	S	S	.	.	H	α-helix	trans	-56.8	-41.7	177.5	-174.9	-178.8	64.7	0	0	112.9	E402 N407 M408	E402-M404 VanDerWaalsContact C-N 3.29Å; E402-M404 PolarHBondContact O-N 3.02Å; M404-N407 WeakPolarHBondContact O-CB 3.28Å; M404-N407 PolarHBondContact O-N 3.22Å; M404-M408 PolarHBondContact O-N 3.34Å
405	Y	84.5	Confident	89.9	Confident	82 Å²	82	57.4 Å²	57.4	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-71.5	-33.8	178.6	-58.8	-51.2	0	0	0	112.2	D357 L360 D403 N407 M408 V409	D357-Y405 WeakPolarHBondContact OD1-CD2 3.42Å; L360-Y405 HydrophobicContact CD1-CD1 3.72Å; L360-Y405 HydrophobicContact CD1-CE1 3.41Å; L360-Y405 VanDerWaalsContact CD1-CE1 3.41Å; D403-Y405 VanDerWaalsContact C-N 3.33Å; D403-Y405 PolarHBondContact O-N 2.93Å; Y405-N407 VanDerWaalsContact C-N 3.29Å; Y405-N407 PolarHBondContact O-N 3.2Å; Y405-M408 HydrophobicContact CD1-SD 4.34Å; Y405-M408 WeakPolarHBondContact O-CB 3.43Å; Y405-M408 PolarHBondContact O-N 3.21Å; Y405-M408 VanDerWaalsContact O-N 3.13Å; Y405-V409 WeakPolarHBondContact O-CG2 3.28Å; Y405-V409 PolarHBondContact O-N 3.34Å
406	M	90.1	Very high	89.8	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.02	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-37.9	171.5	177.7	-167.3	69.8	0	0	111.2	C337 F394 M395 G396 D403 M408 V409 L410 I423	C337-M406 HydrophobicContact CB-CB 4.02Å; C337-M406 HydrophobicContact CB-CG 3.77Å; C337-M406 HydrophobicContact CB-SD 4.36Å; F394-M406 HydrophobicContact CB-SD 4.44Å; M395-M406 VanDerWaalsContact C-SD 3.53Å; G396-M406 WeakPolarHBondContact CA-SD 3.5Å; G396-M406 PolarHBondContact N-SD 3.3Å; D403-M406 HydrophobicContact CB-CE 3.92Å; D403-M406 WeakPolarHBondContact O-CB 3.21Å; D403-M406 PolarHBondContact O-N 2.79Å; D403-M406 VanDerWaalsContact O-N 3.16Å; M406-M408 VanDerWaalsContact C-N 3.26Å; M406-M408 PolarHBondContact O-N 2.85Å; M406-V409 CarbonylContact O-C 3.51Å; M406-V409 WeakPolarHBondContact O-CA 3.35Å; M406-V409 WeakPolarHBondContact O-CB 3.38Å; M406-V409 PolarHBondContact O-N 2.97Å; M406-V409 VanDerWaalsContact O-N 3.08Å; M406-L410 HydrophobicContact CE-CD1 4.48Å; M406-L410 PolarHBondContact O-N 3.06Å; M406-I423 HydrophobicContact CE-CD1 3.37Å; M406-I423 HydrophobicContact CE-CG1 3.95Å
407	N	90.3	Very high	89.7	Confident	59 Å²	59	65 Å²	65	32%	0.316	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-34.6	174.4	-70.8	-25.6	0	0	0	112.3	L310 D403 M404 Y405 L410 A411	L310-N407 HydrophobicContact CD1-CB 3.74Å; D403-N407 PolarHBondContact O-N 2.78Å; M404-N407 WeakPolarHBondContact O-CB 3.28Å; M404-N407 PolarHBondContact O-N 3.22Å; Y405-N407 VanDerWaalsContact C-N 3.29Å; Y405-N407 PolarHBondContact O-N 3.2Å; N407-L410 PolarHBondContact O-N 3.07Å; N407-A411 WeakPolarHBondContact O-CB 3.36Å; N407-A411 PolarHBondContact O-N 2.8Å
408	M	90.7	Very high	89.8	Confident	72 Å²	72	67.4 Å²	67.4	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-67.6	-39	172.1	-62.3	-175.8	60.7	0	0	112.2	M359 L360 M404 Y405 M406 A411 H412	M359-M408 HydrophobicContact CE-CB 3.93Å; M359-M408 HydrophobicContact CE-CE 4.12Å; M359-M408 HydrophobicContact SD-CB 3.64Å; M359-M408 HydrophobicContact SD-CE 4.5Å; L360-M408 HydrophobicContact CD1-SD 4.5Å; L360-M408 HydrophobicContact CD2-CE 3.91Å; M404-M408 PolarHBondContact O-N 3.34Å; Y405-M408 HydrophobicContact CD1-SD 4.34Å; Y405-M408 WeakPolarHBondContact O-CB 3.43Å; Y405-M408 PolarHBondContact O-N 3.21Å; Y405-M408 VanDerWaalsContact O-N 3.13Å; M406-M408 VanDerWaalsContact C-N 3.26Å; M406-M408 PolarHBondContact O-N 2.85Å; M408-A411 PolarHBondContact O-N 2.99Å; M408-H412 PolarHBondContact O-N 3.21Å
409	V	92.1	Very high	90.2	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.3	-48.2	173	175.1	0	0	0	0	110.1	L354 M359 F366 F394 Y405 M406 A411 H412 F413	L354-V409 HydrophobicContact CD2-CG1 3.81Å; M359-V409 HydrophobicContact SD-CG2 4.05Å; F366-V409 HydrophobicContact CE2-CG1 4.4Å; F366-V409 HydrophobicContact CE2-CG2 3.82Å; F366-V409 HydrophobicContact CZ-CG1 4.19Å; F366-V409 HydrophobicContact CZ-CG2 3.99Å; F394-V409 HydrophobicContact CD1-CG1 4.25Å; F394-V409 HydrophobicContact CE1-CG1 3.9Å; Y405-V409 WeakPolarHBondContact O-CG2 3.28Å; Y405-V409 PolarHBondContact O-N 3.34Å; M406-V409 CarbonylContact O-C 3.51Å; M406-V409 WeakPolarHBondContact O-CA 3.35Å; M406-V409 WeakPolarHBondContact O-CB 3.38Å; M406-V409 PolarHBondContact O-N 2.97Å; M406-V409 VanDerWaalsContact O-N 3.08Å; V409-A411 VanDerWaalsContact C-N 3.33Å; V409-A411 PolarHBondContact O-N 2.96Å; V409-H412 WeakPolarHBondContact O-CA 3.39Å; V409-H412 VanDerWaalsContact O-CB 3.27Å; V409-H412 WeakPolarHBondContact O-CB 3.44Å; V409-H412 PolarHBondContact O-N 3.44Å; V409-F413 HydrophobicContact CG1-CD2 4.05Å; V409-F413 HydrophobicContact CG1-CE2 3.86Å; V409-F413 WeakPolarHBondContact O-CD2 3.41Å; V409-F413 PolarHBondContact O-N 2.82Å; V409-F413 VanDerWaalsContact O-N 3.16Å
410	L	93.8	Very high	90.7	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-55.6	-47.8	175.5	-76.7	170.6	0	0	0	111.6	F394 M406 N407 H412 F413 L414 V421 I423	F394-L410 HydrophobicContact CB-CD2 3.87Å; F394-L410 HydrophobicContact CB-CG 4.42Å; F394-L410 HydrophobicContact CD2-CD2 3.35Å; F394-L410 HydrophobicContact CE2-CD2 4.01Å; F394-L410 HydrophobicContact CG-CD2 3.66Å; F394-L410 HydrophobicContact CG-CG 4.41Å; M406-L410 HydrophobicContact CE-CD1 4.48Å; M406-L410 PolarHBondContact O-N 3.06Å; N407-L410 PolarHBondContact O-N 3.07Å; L410-H412 PolarHBondContact O-N 3Å; L410-F413 PolarHBondContact O-N 3.27Å; L410-F413 VanDerWaalsContact O-N 3.14Å; L410-L414 VanDerWaalsContact O-CG 3.31Å; L410-L414 WeakPolarHBondContact O-CG 3.46Å; L410-L414 PolarHBondContact O-N 3.48Å; L410-V421 HydrophobicContact CD2-CG1 3.69Å; L410-I423 HydrophobicContact CD1-CB 4.26Å; L410-I423 HydrophobicContact CD1-CD1 4Å; L410-I423 HydrophobicContact CD1-CG1 4.33Å
411	A	91.7	Very high	91.4	Very high	48 Å²	48	57.1 Å²	57.1	40%	0.397	28%	0.276	S	S	.	.	H	α-helix	trans	-58.3	-36.7	176.2	0	0	0	0	0	112.3	N407 M408 V409 L414 Q415	N407-A411 WeakPolarHBondContact O-CB 3.36Å; N407-A411 PolarHBondContact O-N 2.8Å; M408-A411 PolarHBondContact O-N 2.99Å; V409-A411 VanDerWaalsContact C-N 3.33Å; V409-A411 PolarHBondContact O-N 2.96Å; A411-L414 PolarHBondContact O-N 3.35Å; A411-Q415 VanDerWaalsContact O-CB 3.29Å; A411-Q415 WeakPolarHBondContact O-CB 3.37Å; A411-Q415 PolarHBondContact O-N 3.46Å
412	H	91.5	Very high	92.2	Very high	53 Å²	53	48.2 Å²	48.2	25%	0.245	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-43.9	175.2	-178.1	79.2	0	0	0	112.6	M359 M408 V409 L410 K416	M359-H412 HydrophobicContact CE-CB 4.28Å; M408-H412 PolarHBondContact O-N 3.21Å; V409-H412 WeakPolarHBondContact O-CA 3.39Å; V409-H412 VanDerWaalsContact O-CB 3.27Å; V409-H412 WeakPolarHBondContact O-CB 3.44Å; V409-H412 PolarHBondContact O-N 3.44Å; L410-H412 PolarHBondContact O-N 3Å; H412-K416 WeakPolarHBondContact O-CG 3.48Å; H412-K416 PolarHBondContact O-N 3.25Å
413	F	94.9	Very high	92.8	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-68.4	-40.4	177.6	-80.9	-99.3	0	0	0	111.9	L354 V370 L373 L374 L392 F394 V409 L410 K416 K418 V421	L354-F413 HydrophobicContact CD2-CE2 4.22Å; V370-F413 HydrophobicContact CG1-CE1 4.42Å; V370-F413 HydrophobicContact CG1-CZ 3.95Å; V370-F413 HydrophobicContact CG2-CE2 4.33Å; V370-F413 HydrophobicContact CG2-CZ 4.25Å; L373-F413 HydrophobicContact CD1-CZ 4.28Å; L373-F413 HydrophobicContact CD2-CE1 4.5Å; L374-F413 HydrophobicContact CD2-CE1 4.46Å; L392-F413 HydrophobicContact CD1-CD1 4.01Å; L392-F413 HydrophobicContact CD1-CE1 4.07Å; F394-F413 AromaticContact CE1-CD2 3.99Å; F394-F413 HydrophobicContact CE1-CD2 3.99Å; F394-F413 AromaticContact CE1-CE2 3.74Å; F394-F413 HydrophobicContact CE1-CE2 3.74Å; F394-F413 HydrophobicContact CE1-CZ 4.14Å; F394-F413 HydrophobicContact CE2-CD2 4.47Å; F394-F413 HydrophobicContact CE2-CG 4.37Å; F394-F413 AromaticContact CZ-CD1 3.93Å; F394-F413 HydrophobicContact CZ-CD1 3.93Å; F394-F413 AromaticContact CZ-CD2 3.54Å; F394-F413 HydrophobicContact CZ-CD2 3.54Å; F394-F413 AromaticContact CZ-CE1 3.96Å; F394-F413 HydrophobicContact CZ-CE1 3.96Å; F394-F413 AromaticContact CZ-CE2 3.58Å; F394-F413 HydrophobicContact CZ-CE2 3.58Å; F394-F413 AromaticContact CZ-CG 3.74Å; F394-F413 HydrophobicContact CZ-CG 3.74Å; F394-F413 AromaticContact CZ-CZ 3.8Å; F394-F413 HydrophobicContact CZ-CZ 3.8Å; V409-F413 HydrophobicContact CG1-CD2 4.05Å; V409-F413 HydrophobicContact CG1-CE2 3.86Å; V409-F413 WeakPolarHBondContact O-CD2 3.41Å; V409-F413 PolarHBondContact O-N 2.82Å; V409-F413 VanDerWaalsContact O-N 3.16Å; L410-F413 PolarHBondContact O-N 3.27Å; L410-F413 VanDerWaalsContact O-N 3.14Å; F413-K416 CarbonylContact O-C 3.37Å; F413-K416 PolarHBondContact O-N 3.12Å; F413-K416 VanDerWaalsContact O-N 3.14Å; F413-K418 HydrophobicContact CB-CB 4.44Å; F413-K418 HydrophobicContact CD1-CG 4.17Å; F413-K418 WeakPolarHBondContact O-CB 3.44Å; F413-K418 PolarHBondContact O-N 3.01Å; F413-V421 HydrophobicContact CB-CG2 4.2Å
414	L	93.9	Very high	93.2	Very high	22 Å²	22	46.2 Å²	46.2	12%	0.115	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-41.4	177.4	-68	168.3	0	0	0	112.2	Q170 L310 C311 L410 A411 K416 N417 V421	Q170-L414 HydrophobicContact CG-CD2 3.82Å; L310-L414 WeakPolarHBondContact O-CD1 3.27Å; C311-L414 HydrophobicContact CB-CD1 4.49Å; L410-L414 VanDerWaalsContact O-CG 3.31Å; L410-L414 WeakPolarHBondContact O-CG 3.46Å; L410-L414 PolarHBondContact O-N 3.48Å; A411-L414 PolarHBondContact O-N 3.35Å; L414-K416 PolarHBondContact O-N 2.54Å; L414-N417 WeakPolarHBondContact O-CA 3.4Å; L414-N417 PolarHBondContact O-N 3.41Å; L414-V421 HydrophobicContact CD2-CB 4.12Å; L414-V421 HydrophobicContact CD2-CG1 4.18Å; L414-V421 HydrophobicContact CG-CG1 4.41Å
415	Q	92.7	Very high	93.5	Very high	136 Å²	136	45 Å²	45	64%	0.636	22%	0.219	S	C	*	.	H	α-helix	trans	-60.2	-25.4	174	-167	-158.3	2	0	0	112.4	A411 N417	A411-Q415 VanDerWaalsContact O-CB 3.29Å; A411-Q415 WeakPolarHBondContact O-CB 3.37Å; A411-Q415 PolarHBondContact O-N 3.46Å; Q415-N417 VanDerWaalsContact C-N 3.25Å
416	K	92.4	Very high	93.9	Very high	107 Å²	107	42.9 Å²	42.9	47%	0.465	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	16.6	176	-64.5	-62.5	-176.3	-174.6	0	112.9	H412 F413 L414 K418	H412-K416 WeakPolarHBondContact O-CG 3.48Å; H412-K416 PolarHBondContact O-N 3.25Å; F413-K416 CarbonylContact O-C 3.37Å; F413-K416 PolarHBondContact O-N 3.12Å; F413-K416 VanDerWaalsContact O-N 3.14Å; L414-K416 PolarHBondContact O-N 2.54Å; K416-K418 HydrophobicContact CB-CG 4.41Å; K416-K418 PolarHBondContact O-N 3.29Å
417	N	94	Very high	94.1	Very high	60 Å²	60	42.8 Å²	42.8	32%	0.321	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	42	178.9	-59.2	-23.3	0	0	0	112.1	P174 E175 L414 Q415 E419	P174-N417 HydrophobicContact CB-CB 4.46Å; P174-N417 HydrophobicContact CG-CB 4.15Å; P174-N417 VanDerWaalsContact CG-O 3.28Å; P174-N417 WeakPolarHBondContact CG-O 3.17Å; E175-N417 HydrophobicContact CB-CB 4.26Å; L414-N417 WeakPolarHBondContact O-CA 3.4Å; L414-N417 PolarHBondContact O-N 3.41Å; Q415-N417 VanDerWaalsContact C-N 3.25Å; N417-E419 PolarHBondContact O-N 3.32Å
418	K	95.4	Very high	94.3	Very high	57 Å²	57	40.4 Å²	40.4	25%	0.248	21%	0.209	C	C	.	.			trans	-79.7	119.7	176.9	-70.8	-71.1	160.7	-154.3	0	110.7	F413 K416 V421 W520	F413-K418 HydrophobicContact CB-CB 4.44Å; F413-K418 HydrophobicContact CD1-CG 4.17Å; F413-K418 WeakPolarHBondContact O-CB 3.44Å; F413-K418 PolarHBondContact O-N 3.01Å; K416-K418 HydrophobicContact CB-CG 4.41Å; K416-K418 PolarHBondContact O-N 3.29Å; K418-V421 HydrophobicContact CB-CG2 3.8Å; K418-V421 WeakPolarHBondContact O-CG2 3.43Å; K418-W520 VanDerWaalsContact CE-CH2 3.4Å
419	E	96.6	Very high	94.4	Very high	96 Å²	96	41 Å²	41	45%	0.449	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	159.1	171.9	-66.4	168.5	-147.5	0	0	110.8	P174 N417 V421	P174-E419 HydrophobicContact CG-CG 3.98Å; N417-E419 PolarHBondContact O-N 3.32Å; E419-V421 PolarHBondContact O-N 3.19Å
420	Y	97.3	Very high	94.4	Very high	18 Å²	18	42.4 Å²	42.4	7%	0.071	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	31.6	172.8	-50.2	-41.4	0	0	0	115.3	Y171 H172 E390 H391 L392	Y171-Y420 AromaticContact CD1-CD1 3.74Å; Y171-Y420 HydrophobicContact CD1-CD1 3.74Å; Y171-Y420 HydrophobicContact CD1-CE1 4.41Å; Y171-Y420 AromaticContact CE1-CD1 3.43Å; Y171-Y420 HydrophobicContact CE1-CD1 3.43Å; Y171-Y420 VanDerWaalsContact CE1-CD1 3.43Å; Y171-Y420 HydrophobicContact CE1-CE1 4.24Å; Y171-Y420 HydrophobicContact CE1-CG 4.27Å; Y171-Y420 VanDerWaalsContact CE2-C 3.49Å; Y171-Y420 PolarHBondContact O-N 3.31Å; H172-Y420 AromaticContact CE1-CE1 3.92Å; H172-Y420 AromaticContact ND1-CE1 3.52Å; E390-Y420 HydrophobicContact CG-CD2 3.91Å; E390-Y420 HydrophobicContact CG-CE2 4.05Å; E390-Y420 WeakPolarHBondContact OE1-CE2 3.32Å; H391-Y420 AromaticContact CE1-CD1 3.66Å; H391-Y420 AromaticContact CE1-CE1 3.96Å; H391-Y420 AromaticContact CE1-CG 3.68Å; H391-Y420 VanDerWaalsContact ND1-CB 3.32Å; H391-Y420 WeakPolarHBondContact ND1-CB 3.4Å; H391-Y420 AromaticContact ND1-CD1 3.5Å; H391-Y420 WeakPolarHBondContact ND1-CD1 3.46Å; H391-Y420 AromaticContact ND1-CD2 3.89Å; H391-Y420 AromaticContact ND1-CG 3.27Å; H391-Y420 VanDerWaalsContact ND1-CG 3.27Å; L392-Y420 PolarHBondContact N-O 3.13Å; L392-Y420 VanDerWaalsContact O-O 3.11Å
421	V	97.9	Very high	94.3	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	123.4	174.3	174.6	0	0	0	0	109.8	Y171 C311 F394 L410 F413 L414 K418 E419	Y171-V421 WeakPolarHBondContact CD2-O 3.18Å; C311-V421 HydrophobicContact CB-CG1 4.39Å; F394-V421 HydrophobicContact CD2-CG1 4.23Å; F394-V421 HydrophobicContact CE2-CG1 4Å; L410-V421 HydrophobicContact CD2-CG1 3.69Å; F413-V421 HydrophobicContact CB-CG2 4.2Å; L414-V421 HydrophobicContact CD2-CB 4.12Å; L414-V421 HydrophobicContact CD2-CG1 4.18Å; L414-V421 HydrophobicContact CG-CG1 4.41Å; K418-V421 HydrophobicContact CB-CG2 3.8Å; K418-V421 WeakPolarHBondContact O-CG2 3.43Å; E419-V421 PolarHBondContact O-N 3.19Å
422	S	97.7	Very high	94.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	166.4	178.7	60.7	0	0	0	0	112.6	L312 L392 C393 F394	L312-S422 VanDerWaalsContact O-CA 3.3Å; L312-S422 WeakPolarHBondContact O-CA 3.34Å; L312-S422 WeakPolarHBondContact O-CB 3.37Å; L392-S422 PolarHBondContact O-N 2.82Å; L392-S422 PolarHBondContact O-OG 3.19Å; C393-S422 WeakPolarHBondContact CA-OG 3.46Å; C393-S422 WeakPolarHBondContact CB-OG 3.04Å; F394-S422 PolarHBondContact N-O 2.85Å
423	I	96.6	Very high	94.1	Very high	38 Å²	38	49.1 Å²	49.1	20%	0.195	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.8	176.3	-173.3	176.9	0	0	0	110.6	L312 P313 V314 F394 M406 L410 K425	L312-I423 PolarHBondContact O-N 3.3Å; P313-I423 CarbonylContact C-O 3.25Å; P313-I423 WeakPolarHBondContact CA-O 3.44Å; P313-I423 HydrophobicContact CB-CG2 4.19Å; V314-I423 PolarHBondContact N-O 2.89Å; F394-I423 WeakPolarHBondContact O-CA 3.07Å; M406-I423 HydrophobicContact CE-CD1 3.37Å; M406-I423 HydrophobicContact CE-CG1 3.95Å; L410-I423 HydrophobicContact CD1-CB 4.26Å; L410-I423 HydrophobicContact CD1-CD1 4Å; L410-I423 HydrophobicContact CD1-CG1 4.33Å; I423-K425 PolarHBondContact O-N 3.12Å
424	A	95.8	Very high	93.8	Very high	7 Å²	7	51.1 Å²	51.1	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	112.8	174.1	0	0	0	0	0	110.4	I319 F394 M395 G426 G427	I319-A424 HydrophobicContact CD1-CB 3.65Å; F394-A424 PolarHBondContact O-N 3.31Å; M395-A424 HydrophobicContact CB-CB 3.92Å; A424-G426 PolarHBondContact O-N 3.33Å; A424-G427 PolarHBondContact O-N 3.24Å
425	K	93.9	Very high	93.3	Very high	78 Å²	78	50.4 Å²	50.4	34%	0.339	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	119.3	-178.6	177.5	168.1	170	175.7	0	110.7	M287 T304 P313 V314 I423 G427 A430	M287-K425 HydrophobicContact CE-CB 4.43Å; M287-K425 HydrophobicContact CE-CD 3.23Å; M287-K425 HydrophobicContact CE-CG 4.4Å; M287-K425 HydrophobicContact SD-CD 4.04Å; T304-K425 WeakPolarHBondContact OG1-CE 3.5Å; T304-K425 PolarHBondContact OG1-NZ 3.27Å; P313-K425 HydrophobicContact CB-CB 4.35Å; V314-K425 PolarHBondContact O-N 3.15Å; I423-K425 PolarHBondContact O-N 3.12Å; K425-G427 VanDerWaalsContact C-N 3.27Å; K425-G427 PolarHBondContact O-N 2.76Å; K425-A430 WeakPolarHBondContact O-CB 3.36Å
426	G	92	Very high	92.9	Very high	37 Å²	37	47.8 Å²	47.8	38%	0.381	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	9.1	-178.6	0	0	0	0	0	114.8	G398 A424 A430	G398-G426 VanDerWaalsContact CA-O 3.25Å; G398-G426 WeakPolarHBondContact CA-O 3.32Å; A424-G426 PolarHBondContact O-N 3.33Å; G426-A430 WeakPolarHBondContact O-CB 3.39Å; G426-A430 PolarHBondContact O-N 3.07Å
427	G	94.1	Very high	92.4	Very high	3 Å²	3	46.4 Å²	46.4	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	55	-153.5	171.2	0	0	0	0	0	115.3	G396 A424 K425 M429 A430 L431	G396-G427 WeakPolarHBondContact O-CA 3.18Å; A424-G427 PolarHBondContact O-N 3.24Å; K425-G427 VanDerWaalsContact C-N 3.27Å; K425-G427 PolarHBondContact O-N 2.76Å; G427-M429 PolarHBondContact O-N 2.86Å; G427-A430 PolarHBondContact O-N 3.45Å; G427-L431 PolarHBondContact O-N 3.31Å
428	F	94.4	Very high	91.5	Very high	8 Å²	8	45 Å²	45	4%	0.035	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-30.7	179.5	-170.8	-104.6	0	0	0	112.7	R338 G346 M395 G396 S397 L431 Q432	R338-F428 VanDerWaalsContact CZ-CG 3.47Å; G346-F428 WeakPolarHBondContact O-CZ 3.3Å; M395-F428 HydrophobicContact SD-CB 4.41Å; M395-F428 HydrophobicContact SD-CD2 4Å; G396-F428 PolarHBondContact O-N 2.88Å; S397-F428 PolarHBondContact O-N 3.01Å; F428-L431 HydrophobicContact CD2-CD2 3.84Å; F428-L431 HydrophobicContact CE2-CD2 3.91Å; F428-L431 WeakPolarHBondContact O-CB 3.06Å; F428-L431 PolarHBondContact O-N 3.11Å; F428-Q432 HydrophobicContact CD1-CG 3.96Å; F428-Q432 HydrophobicContact CE1-CG 3.61Å; F428-Q432 HydrophobicContact CZ-CG 4.01Å; F428-Q432 WeakPolarHBondContact O-CG 3.43Å; F428-Q432 PolarHBondContact O-N 2.91Å
429	M	92.9	Very high	90.1	Very high	85 Å²	85	44.9 Å²	44.9	42%	0.419	24%	0.235	S	C	.	.	H	α-helix	trans	-60.9	-45.3	174.4	-80.6	-177.5	58	0	0	112.6	S397 R399 G427 L431 Q432 K433	S397-M429 WeakPolarHBondContact O-CB 3.45Å; S397-M429 VanDerWaalsContact O-CG 3.27Å; S397-M429 WeakPolarHBondContact O-CG 3.28Å; S397-M429 PolarHBondContact O-N 3.22Å; R399-M429 HydrophobicContact CG-SD 3.54Å; R399-M429 VanDerWaalsContact CG-SD 3.54Å; R399-M429 PolarHBondContact NE-SD 3.17Å; R399-M429 VanDerWaalsContact NE-SD 3.39Å; G427-M429 PolarHBondContact O-N 2.86Å; M429-L431 VanDerWaalsContact C-N 3.29Å; M429-L431 PolarHBondContact O-N 3.1Å; M429-Q432 PolarHBondContact O-N 2.95Å; M429-K433 PolarHBondContact O-N 2.83Å
430	A	92.8	Very high	88.2	Confident	30 Å²	30	46 Å²	46	25%	0.248	25%	0.248	C	C	.	.	H	α-helix	trans	-65.2	-35.2	175.5	0	0	0	0	0	111.7	V316 K425 G426 G427 K433 H434	V316-A430 HydrophobicContact CG2-CB 3.87Å; K425-A430 WeakPolarHBondContact O-CB 3.36Å; G426-A430 WeakPolarHBondContact O-CB 3.39Å; G426-A430 PolarHBondContact O-N 3.07Å; G427-A430 PolarHBondContact O-N 3.45Å; A430-K433 PolarHBondContact O-N 3.14Å; A430-H434 WeakPolarHBondContact O-CB 3.4Å; A430-H434 PolarHBondContact O-N 3.32Å
431	L	91.8	Very high	86.2	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-50.3	173.5	173.9	63.9	0	0	0	111.9	V316 L320 L348 G427 F428 M429 K433 H434 L435	V316-L431 HydrophobicContact CG1-CB 3.96Å; V316-L431 HydrophobicContact CG1-CD1 3.53Å; V316-L431 HydrophobicContact CG1-CG 4.36Å; V316-L431 HydrophobicContact CG2-CB 4.4Å; L320-L431 HydrophobicContact CD1-CD1 3.71Å; L320-L431 HydrophobicContact CD2-CD1 3.85Å; L320-L431 HydrophobicContact CG-CD1 4.15Å; L348-L431 HydrophobicContact CB-CD2 4.31Å; L348-L431 HydrophobicContact CD1-CD2 4.4Å; G427-L431 PolarHBondContact O-N 3.31Å; F428-L431 HydrophobicContact CD2-CD2 3.84Å; F428-L431 HydrophobicContact CE2-CD2 3.91Å; F428-L431 WeakPolarHBondContact O-CB 3.06Å; F428-L431 PolarHBondContact O-N 3.11Å; M429-L431 VanDerWaalsContact C-N 3.29Å; M429-L431 PolarHBondContact O-N 3.1Å; L431-K433 VanDerWaalsContact C-N 3.35Å; L431-K433 PolarHBondContact O-N 2.65Å; L431-H434 PolarHBondContact O-N 3.11Å; L431-L435 HydrophobicContact CD1-CD1 3.84Å; L431-L435 HydrophobicContact CD1-CG 4.15Å; L431-L435 HydrophobicContact CG-CD1 4.08Å; L431-L435 WeakPolarHBondContact O-CG 3.09Å; L431-L435 PolarHBondContact O-N 3.04Å
432	Q	89.6	Confident	83.6	Confident	91 Å²	91	55.6 Å²	55.6	43%	0.425	31%	0.312	S	S	.	.	H	α-helix	trans	-60.4	-45	177.7	-70.7	-176.3	-52.3	0	0	111.7	F428 M429 L435 V436	F428-Q432 HydrophobicContact CD1-CG 3.96Å; F428-Q432 HydrophobicContact CE1-CG 3.61Å; F428-Q432 HydrophobicContact CZ-CG 4.01Å; F428-Q432 WeakPolarHBondContact O-CG 3.43Å; F428-Q432 PolarHBondContact O-N 2.91Å; M429-Q432 PolarHBondContact O-N 2.95Å; Q432-L435 PolarHBondContact O-N 3.43Å; Q432-V436 VanDerWaalsContact O-CG2 3.31Å; Q432-V436 WeakPolarHBondContact O-CG2 3Å; Q432-V436 PolarHBondContact O-N 3.46Å
433	K	89.7	Confident	81	Confident	143 Å²	143	60 Å²	60	62%	0.622	34%	0.335	S	S	*	.	H	α-helix	trans	-59.1	-49.3	177.9	-176.5	179.8	176.2	-175.7	0	111.3	M429 A430 L431 L435 V436 D437	M429-K433 PolarHBondContact O-N 2.83Å; A430-K433 PolarHBondContact O-N 3.14Å; L431-K433 VanDerWaalsContact C-N 3.35Å; L431-K433 PolarHBondContact O-N 2.65Å; K433-L435 VanDerWaalsContact C-N 3.34Å; K433-L435 PolarHBondContact O-N 3.17Å; K433-V436 PolarHBondContact O-N 2.83Å; K433-D437 VanDerWaalsContact O-CG 3.28Å; K433-D437 PolarHBondContact O-N 3.37Å
434	H	88.6	Confident	78.5	Confident	46 Å²	46	64.6 Å²	64.6	21%	0.213	36%	0.36	C	S	.	.	H	α-helix	trans	-61.1	-41.8	-179.2	-175.8	54.6	0	0	0	112.5	V316 A430 L431 D437 M438	V316-H434 HydrophobicContact CG1-CB 4.2Å; A430-H434 WeakPolarHBondContact O-CB 3.4Å; A430-H434 PolarHBondContact O-N 3.32Å; L431-H434 PolarHBondContact O-N 3.11Å; H434-D437 PolarHBondContact O-N 3.46Å; H434-M438 WeakPolarHBondContact O-CG 3.36Å; H434-M438 PolarHBondContact O-N 3.16Å
435	L	84.4	Confident	76.1	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.037	39%	0.391	C	S	.	.	H	α-helix	trans	-67.3	-35.3	177.2	-70.4	171.9	0	0	0	112.8	L320 L431 Q432 K433 N439 W450 I451	L320-L435 HydrophobicContact CD1-CD2 4.1Å; L431-L435 HydrophobicContact CD1-CD1 3.84Å; L431-L435 HydrophobicContact CD1-CG 4.15Å; L431-L435 HydrophobicContact CG-CD1 4.08Å; L431-L435 WeakPolarHBondContact O-CG 3.09Å; L431-L435 PolarHBondContact O-N 3.04Å; Q432-L435 PolarHBondContact O-N 3.43Å; K433-L435 VanDerWaalsContact C-N 3.34Å; K433-L435 PolarHBondContact O-N 3.17Å; L435-N439 PolarHBondContact O-N 3.03Å; L435-W450 HydrophobicContact CD2-CE3 4.04Å; L435-W450 HydrophobicContact CD2-CZ3 4.28Å; L435-I451 HydrophobicContact CD1-CD1 3.61Å; L435-I451 HydrophobicContact CD1-CG1 3.95Å
436	V	83.3	Confident	74.1	Confident	81 Å²	81	68.5 Å²	68.5	49%	0.491	40%	0.397	S	S	.	.	H	α-helix	trans	-65.6	-45.6	173.5	170.6	0	0	0	0	110.5	Q432 K433 M438 N439 V440	Q432-V436 VanDerWaalsContact O-CG2 3.31Å; Q432-V436 WeakPolarHBondContact O-CG2 3Å; Q432-V436 PolarHBondContact O-N 3.46Å; K433-V436 PolarHBondContact O-N 2.83Å; V436-M438 VanDerWaalsContact C-N 3.35Å; V436-M438 PolarHBondContact O-N 2.7Å; V436-N439 PolarHBondContact O-N 2.74Å; V436-V440 WeakPolarHBondContact O-CG2 3.5Å; V436-V440 PolarHBondContact O-N 2.95Å; V436-V440 VanDerWaalsContact O-N 3.14Å
437	D	81.8	Confident	72.3	Confident	78 Å²	78	69 Å²	69	42%	0.417	39%	0.387	S	S	.	.	H	α-helix	trans	-61.6	-42.8	179.6	-66.5	-20.8	0	0	0	111.1	K433 H434 N439 V440 E441	K433-D437 VanDerWaalsContact O-CG 3.28Å; K433-D437 PolarHBondContact O-N 3.37Å; H434-D437 PolarHBondContact O-N 3.46Å; D437-N439 VanDerWaalsContact C-N 3.34Å; D437-N439 PolarHBondContact O-N 3.33Å; D437-V440 PolarHBondContact O-N 2.9Å; D437-E441 PolarHBondContact O-N 3.09Å
438	M	75.2	Confident	70.3	Confident	30 Å²	30	73.8 Å²	73.8	15%	0.148	41%	0.41	C	S	.	.	H	α-helix	trans	-61.4	-37.9	175	-73.9	-172.6	69.9	0	0	113.4	H434 V436 V440 E441 Y447	H434-M438 WeakPolarHBondContact O-CG 3.36Å; H434-M438 PolarHBondContact O-N 3.16Å; V436-M438 VanDerWaalsContact C-N 3.35Å; V436-M438 PolarHBondContact O-N 2.7Å; M438-V440 VanDerWaalsContact C-N 3.32Å; M438-E441 PolarHBondContact O-N 3.39Å; M438-Y447 HydrophobicContact CE-CD2 4.06Å; M438-Y447 HydrophobicContact CE-CE1 4.39Å; M438-Y447 HydrophobicContact CE-CE2 3.67Å
439	N	65.7	Low	68.7	Low	55 Å²	55	79.3 Å²	79.3	29%	0.294	44%	0.44	S	S	.	.	H	α-helix	trans	-70.1	-28.5	178	-81.3	-12	0	0	0	112.8	L435 V436 D437 E441 M448	L435-N439 PolarHBondContact O-N 3.03Å; V436-N439 PolarHBondContact O-N 2.74Å; D437-N439 VanDerWaalsContact C-N 3.34Å; D437-N439 PolarHBondContact O-N 3.33Å; N439-E441 VanDerWaalsContact C-N 3.34Å; N439-M448 WeakPolarHBondContact ND2-CE 3.22Å
440	V	57.2	Low	67.5	Low	120 Å²	120	77.5 Å²	77.5	73%	0.727	43%	0.429	S	S	*	.	H	α-helix	trans	-73.9	-28.5	176.7	174.3	0	0	0	0	111.2	V436 D437 M438 G442	V436-V440 WeakPolarHBondContact O-CG2 3.5Å; V436-V440 PolarHBondContact O-N 2.95Å; V436-V440 VanDerWaalsContact O-N 3.14Å; D437-V440 PolarHBondContact O-N 2.9Å; M438-V440 VanDerWaalsContact C-N 3.32Å; V440-G442 VanDerWaalsContact C-N 3.31Å; V440-G442 PolarHBondContact O-N 3.34Å
441	E	54.7	Low	66.7	Low	154 Å²	154	78.1 Å²	78.1	72%	0.72	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-0.2	179	-68.1	-176.9	169	0	0	114.3	D437 M438 N439	D437-E441 PolarHBondContact O-N 3.09Å; M438-E441 PolarHBondContact O-N 3.39Å; N439-E441 VanDerWaalsContact C-N 3.34Å
442	G	44.1	Very low	66	Low	69 Å²	69	80.7 Å²	80.7	71%	0.711	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	17.7	171	0	0	0	0	0	115.6	V440	V440-G442 VanDerWaalsContact C-N 3.31Å; V440-G442 PolarHBondContact O-N 3.34Å
443	L	42.9	Very low	65	Low	91 Å²	91	79.8 Å²	79.8	48%	0.476	45%	0.447	S	S	.	.			trans	-75	141.4	168.3	-80.7	144.6	0	0	0	110.2	Y447	L443-Y447 HydrophobicContact CB-CE2 4.45Å
444	D	43.8	Very low	63.1	Low	135 Å²	135	77.1 Å²	77.1	72%	0.722	44%	0.443	S	S	*	.			trans	-37	135.2	-169.2	-94	-32.8	0	0	0	115.3	S446 Y447	D444-S446 PolarHBondContact O-N 2.94Å; D444-Y447 VanDerWaalsContact O-CD2 3.24Å; D444-Y447 WeakPolarHBondContact O-CD2 3.49Å
445	S	46.4	Very low	60.8	Low	102 Å²	102	79 Å²	79	71%	0.713	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	12.7	176.2	-174.8	0	0	0	0	115.4
446	S	51.7	Low	58.7	Low	65 Å²	65	82.1 Å²	82.1	46%	0.455	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-31	179.2	173.5	0	0	0	0	113.3	D444 M448 N449	D444-S446 PolarHBondContact O-N 2.94Å; S446-M448 VanDerWaalsContact C-N 3.33Å; S446-M448 PolarHBondContact O-N 2.97Å; S446-N449 WeakPolarHBondContact O-CB 3.07Å; S446-N449 PolarHBondContact O-N 2.87Å; S446-N449 PolarHBondContact O-ND2 3.05Å
447	Y	53.8	Low	56.2	Low	48 Å²	48	83.5 Å²	83.5	19%	0.188	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-72.9	-19.5	-171.2	-61	-66	0	0	0	114.8	M438 L443 D444 N449 W450	M438-Y447 HydrophobicContact CE-CD2 4.06Å; M438-Y447 HydrophobicContact CE-CE1 4.39Å; M438-Y447 HydrophobicContact CE-CE2 3.67Å; L443-Y447 HydrophobicContact CB-CE2 4.45Å; D444-Y447 VanDerWaalsContact O-CD2 3.24Å; D444-Y447 WeakPolarHBondContact O-CD2 3.49Å; Y447-N449 PolarHBondContact O-N 3.06Å; Y447-W450 HydrophobicContact CD1-CD2 4.06Å; Y447-W450 AromaticContact CD1-CE2 3.76Å; Y447-W450 AromaticContact CD1-CE3 3.88Å; Y447-W450 HydrophobicContact CD1-CE3 3.88Å; Y447-W450 AromaticContact CD1-CH2 3.11Å; Y447-W450 HydrophobicContact CD1-CH2 3.11Å; Y447-W450 AromaticContact CD1-CZ2 3.32Å; Y447-W450 HydrophobicContact CD1-CZ2 3.32Å; Y447-W450 AromaticContact CD1-CZ3 3.39Å; Y447-W450 HydrophobicContact CD1-CZ3 3.39Å; Y447-W450 AromaticContact CE1-CH2 3.2Å; Y447-W450 HydrophobicContact CE1-CH2 3.2Å; Y447-W450 AromaticContact CE1-CZ2 3.45Å; Y447-W450 HydrophobicContact CE1-CZ2 3.45Å; Y447-W450 VanDerWaalsContact CE1-CZ2 3.45Å; Y447-W450 AromaticContact CE1-CZ3 3.91Å; Y447-W450 HydrophobicContact CE1-CZ3 3.91Å; Y447-W450 HydrophobicContact CG-CH2 4.39Å; Y447-W450 HydrophobicContact CG-CZ3 4.38Å; Y447-W450 WeakPolarHBondContact O-CB 3.18Å; Y447-W450 PolarHBondContact O-N 3.23Å; Y447-W450 VanDerWaalsContact O-N 3.1Å
448	M	52.8	Low	54.1	Low	103 Å²	103	89.1 Å²	89.1	51%	0.507	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-64.8	-17.7	172.9	-82.3	-74.9	162.3	0	0	113	N439 S446 W450	N439-M448 WeakPolarHBondContact ND2-CE 3.22Å; S446-M448 VanDerWaalsContact C-N 3.33Å; S446-M448 PolarHBondContact O-N 2.97Å; M448-W450 PolarHBondContact O-N 2.78Å
449	N	60.5	Low	51.7	Low	124 Å²	124	93.3 Å²	93.3	66%	0.663	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-74	-9.3	174.4	-63.9	-37.5	0	0	0	113.4	S446 Y447	S446-N449 WeakPolarHBondContact O-CB 3.07Å; S446-N449 PolarHBondContact O-N 2.87Å; S446-N449 PolarHBondContact O-ND2 3.05Å; Y447-N449 PolarHBondContact O-N 3.06Å
450	W	66.2	Low	50.3	Low	48 Å²	48	95.7 Å²	95.7	18%	0.182	59%	0.585	C	S	.	*	G	3₁₀ helix	trans	-84.9	-18.9	-179.8	-63.2	-8	0	0	0	113.3	L320 Q324 L348 S349 L435 Y447 M448	L320-W450 HydrophobicContact CB-CH2 4.09Å; L320-W450 HydrophobicContact CB-CZ3 3.66Å; L320-W450 HydrophobicContact CD1-CE3 4.19Å; L320-W450 HydrophobicContact CD1-CZ3 3.71Å; L320-W450 HydrophobicContact CD2-CE3 3.69Å; L320-W450 HydrophobicContact CD2-CZ3 3.69Å; L320-W450 HydrophobicContact CG-CE3 4.33Å; L320-W450 HydrophobicContact CG-CZ3 3.86Å; Q324-W450 HydrophobicContact CG-CZ2 4.31Å; L348-W450 CarbonylContact C-O 3.55Å; L348-W450 WeakPolarHBondContact CA-O 3.41Å; L348-W450 HydrophobicContact CD1-CB 4.1Å; S349-W450 PolarHBondContact N-O 2.73Å; L435-W450 HydrophobicContact CD2-CE3 4.04Å; L435-W450 HydrophobicContact CD2-CZ3 4.28Å; Y447-W450 HydrophobicContact CD1-CD2 4.06Å; Y447-W450 AromaticContact CD1-CE2 3.76Å; Y447-W450 AromaticContact CD1-CE3 3.88Å; Y447-W450 HydrophobicContact CD1-CE3 3.88Å; Y447-W450 AromaticContact CD1-CH2 3.11Å; Y447-W450 HydrophobicContact CD1-CH2 3.11Å; Y447-W450 AromaticContact CD1-CZ2 3.32Å; Y447-W450 HydrophobicContact CD1-CZ2 3.32Å; Y447-W450 AromaticContact CD1-CZ3 3.39Å; Y447-W450 HydrophobicContact CD1-CZ3 3.39Å; Y447-W450 AromaticContact CE1-CH2 3.2Å; Y447-W450 HydrophobicContact CE1-CH2 3.2Å; Y447-W450 AromaticContact CE1-CZ2 3.45Å; Y447-W450 HydrophobicContact CE1-CZ2 3.45Å; Y447-W450 VanDerWaalsContact CE1-CZ2 3.45Å; Y447-W450 AromaticContact CE1-CZ3 3.91Å; Y447-W450 HydrophobicContact CE1-CZ3 3.91Å; Y447-W450 HydrophobicContact CG-CH2 4.39Å; Y447-W450 HydrophobicContact CG-CZ3 4.38Å; Y447-W450 WeakPolarHBondContact O-CB 3.18Å; Y447-W450 PolarHBondContact O-N 3.23Å; Y447-W450 VanDerWaalsContact O-N 3.1Å; M448-W450 PolarHBondContact O-N 2.78Å
451	I	76.8	Confident	48.9	Very low	42 Å²	42	97.7 Å²	97.7	22%	0.215	59%	0.591	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.6	120.1	173.2	-61.8	-179.1	0	0	0	109	H347 L435	H347-I451 CarbonylContact O-C 3.59Å; H347-I451 VanDerWaalsContact O-CA 3.3Å; H347-I451 WeakPolarHBondContact O-CA 3.44Å; L435-I451 HydrophobicContact CD1-CD1 3.61Å; L435-I451 HydrophobicContact CD1-CG1 3.95Å
452	V	77.3	Confident	47.6	Very low	62 Å²	62	95.8 Å²	95.8	38%	0.376	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	125.5	171.8	-179.8	0	0	0	0	108.5	G346 H347	G346-V452 WeakPolarHBondContact CA-O 3.43Å; H347-V452 PolarHBondContact N-O 2.87Å; H347-V452 VanDerWaalsContact N-O 3.1Å; H347-V452 PolarHBondContact ND1-O 2.89Å; H347-V452 PolarHBondContact O-N 3.47Å
453	S	67.5	Low	46.6	Very low	73 Å²	73	97.7 Å²	97.7	51%	0.51	60%	0.597	S	S	.	*			trans	-116.9	126.4	173.5	-58.2	0	0	0	0	109.5	A345 S455	A345-S453 PolarHBondContact O-OG 3.05Å; S453-S455 VanDerWaalsContact C-N 3.34Å
454	T	50.3	Low	45.9	Very low	86 Å²	86	99.8 Å²	99.8	53%	0.528	61%	0.613	S	S	.	*			trans	-88.5	-6.9	177.5	64.3	0	0	0	0	112.9	N344 G456	N344-T454 PolarHBondContact O-N 3.39Å; N344-T454 VanDerWaalsContact O-N 3.12Å; N344-T454 PolarHBondContact O-OG1 3.01Å; T454-G456 PolarHBondContact O-N 3.23Å
455	S	41.3	Very low	45.2	Very low	85 Å²	85	100.6 Å²	100.6	59%	0.594	62%	0.617	S	S	*	*			trans	-77	84.7	176.8	-62.5	0	0	0	0	110.6	S453 S457	S453-S455 VanDerWaalsContact C-N 3.34Å; S455-S457 PolarHBondContact O-N 3.43Å
456	G	39.9	Very low	44.2	Very low	73 Å²	73	99.4 Å²	99.4	75%	0.753	62%	0.621	S	S	*	*			trans	-64.1	103.5	166.3	0	0	0	0	0	110.4	T454	T454-G456 PolarHBondContact O-N 3.23Å
457	S	29.9	Very low	43.1	Very low	110 Å²	110	105 Å²	105	77%	0.769	64%	0.64	S	S	*	*			trans	-157.7	122.7	158.5	-72.7	0	0	0	0	109	S455 S459	S455-S457 PolarHBondContact O-N 3.43Å; S457-S459 PolarHBondContact O-N 2.98Å
458	H	37.3	Very low	41.8	Very low	196 Å²	196	107.6 Å²	107.6	91%	0.907	67%	0.665	S	S	*	*			trans	-41.4	121.5	179.8	-65.8	-97.9	0	0	0	113.5
459	S	26.2	Very low	40.5	Very low	118 Å²	118	110.8 Å²	110.8	83%	0.825	68%	0.683	S	S	*	*			trans	-115.7	93.8	148.1	54.5	0	0	0	0	107.8	S457 L461	S457-S459 PolarHBondContact O-N 2.98Å; S459-L461 PolarHBondContact O-N 3.39Å
460	S	36.4	Very low	38.9	Very low	106 Å²	106	109.7 Å²	109.7	74%	0.741	69%	0.685	S	S	*	*			trans	-65.9	107.4	168.8	47.6	0	0	0	0	109.8
461	L	28.1	Very low	37.1	Very low	162 Å²	162	113 Å²	113	85%	0.848	72%	0.716	S	S	*	*			trans	-139.1	121.6	157.6	-73.6	175.5	0	0	0	110.2	S459	S459-L461 PolarHBondContact O-N 3.39Å
462	S	25.7	Very low	35.1	Very low	113 Å²	113	117 Å²	117	79%	0.79	75%	0.745	S	S	*	*			trans	64	78.8	176	60.1	0	0	0	0	118.8
463	S	23.8	Very low	32.6	Very low	109 Å²	109	117.9 Å²	117.9	76%	0.762	77%	0.766	S	S	*	*			trans	-78.1	105.1	141.2	53	0	0	0	0	108.3
464	V	28.3	Very low	30.8	Very low	135 Å²	135	122.9 Å²	122.9	82%	0.818	79%	0.787	S	S	*	*			trans	-92	104.2	156.3	179.3	0	0	0	0	105.6
465	D	28.4	Very low	29.7	Very low	152 Å²	152	122.4 Å²	122.4	81%	0.813	80%	0.8	S	S	*	*			trans	-61.9	129.6	169.9	-78.3	-40	0	0	0	109.9
466	G	26.7	Very low	29.5	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	82%	0.816	S	S	*	*			trans	-157.1	91.1	169.5	0	0	0	0	0	108.9
467	E	28.4	Very low	28.8	Very low	184 Å²	184	128.6 Å²	128.6	86%	0.86	82%	0.815	S	S	*	*			trans	-67.6	141.6	-177.7	-79.2	-177.2	134	0	0	114.2
468	S	25.3	Very low	29.3	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	82%	0.818	S	S	*	*			trans	78.4	119.3	143	73.3	0	0	0	0	120.2
469	L	26.1	Very low	29.2	Very low	169 Å²	169	130 Å²	130	89%	0.885	82%	0.816	S	S	*	*				-173.2	150	97.1	-88.9	163.9	0	0	0	111.9
470	S	26.9	Very low	29.7	Very low	101 Å²	101	127 Å²	127	71%	0.706	80%	0.795	S	S	*	*			trans	-75.3	143.5	-169	48.2	0	0	0	0	117.3
471	S	28.1	Very low	29.8	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	80%	0.798	S	S	*	*				176.1	157.5	116.8	-98.7	0	0	0	0	114.1
472	P	34.9	Very low	30.4	Very low	126 Å²	126	127.4 Å²	127.4	82%	0.818	79%	0.793	S	S	*	*			trans	-102.3	154.3	-165.2	38.3	-30.1	0	0	0	114.1
473	G	26.1	Very low	31	Very low	79 Å²	79	128.2 Å²	128.2	81%	0.814	79%	0.789	S	S	*	*			trans	-169.5	111.6	170.2	0	0	0	0	0	112.6
474	D	28.4	Very low	31.5	Very low	178 Å²	178	130.8 Å²	130.8	95%	0.952	79%	0.786	S	S	*	*			trans	-55.4	144.9	-179.1	-90.8	-48.5	0	0	0	115.7
475	G	27.3	Very low	31.8	Very low	77 Å²	77	132.8 Å²	132.8	79%	0.794	79%	0.789	S	S	*	*			trans	-169.5	89.4	166.7	0	0	0	0	0	112
476	K	36.3	Very low	32.1	Very low	215 Å²	215	131.6 Å²	131.6	94%	0.935	79%	0.787	S	S	*	*			trans	-52.5	130.5	178.5	-76.2	172	172.8	172.9	0	113.2
477	G	26.5	Very low	32.3	Very low	72 Å²	72	137.5 Å²	137.5	74%	0.742	79%	0.792	S	S	*	*			trans	-138.9	111.6	164.3	0	0	0	0	0	110.8	K479	G477-K479 PolarHBondContact O-N 3.09Å; G477-K479 VanDerWaalsContact O-N 3.09Å
478	V	39.5	Very low	32.4	Very low	138 Å²	138	132.5 Å²	132.5	84%	0.836	78%	0.782	S	S	*	*			trans	-73	93.7	-176.6	-179.8	0	0	0	0	110.1
479	K	35.8	Very low	32.8	Very low	197 Å²	197	135.6 Å²	135.6	86%	0.857	79%	0.789	S	S	*	*			trans	-146.5	85.4	164.4	-71	-170.3	-179.2	-179	0	110	G477	G477-K479 PolarHBondContact O-N 3.09Å; G477-K479 VanDerWaalsContact O-N 3.09Å
480	S	37.1	Very low	33.1	Very low	55 Å²	55	137.6 Å²	137.6	39%	0.385	79%	0.791	S	S	.	*			trans	178.1	77.4	159.9	169.5	0	0	0	0	110.3
481	L	38.8	Very low	33.3	Very low	154 Å²	154	138 Å²	138	81%	0.806	79%	0.794	S	S	*	*	S	Bend	trans	-113.5	-19.7	163.6	-73.1	173.8	0	0	0	113.1
482	V	40.8	Very low	33.3	Very low	123 Å²	123	142.2 Å²	142.2	75%	0.745	80%	0.797	S	S	*	*	G	3₁₀ helix	trans	-81.9	-28.6	176	-165.1	0	0	0	0	112	K484	V482-K484 VanDerWaalsContact C-N 3.31Å; V482-K484 PolarHBondContact O-N 2.98Å
483	N	37.2	Very low	33	Very low	131 Å²	131	141.9 Å²	141.9	70%	0.701	80%	0.798	S	S	*	*	G	3₁₀ helix	trans	-79	-1.9	-177.5	-70.9	-4.7	0	0	0	115.3
484	K	35.5	Very low	32.9	Very low	162 Å²	162	144 Å²	144	70%	0.704	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-103.2	-8.1	-177.6	-78.8	-173.8	177.3	-179	0	115.3	V482	V482-K484 VanDerWaalsContact C-N 3.31Å; V482-K484 PolarHBondContact O-N 2.98Å
485	M	34.2	Very low	32.8	Very low	177 Å²	177	142.4 Å²	142.4	87%	0.872	79%	0.786	S	S	*	*	S	Bend	trans	-87.4	-20.9	177.3	-107.8	175.5	175.7	0	0	113.9
486	T	35.1	Very low	32.9	Very low	128 Å²	128	145.6 Å²	145.6	79%	0.785	79%	0.79	S	S	*	*	S	Bend	trans	-93.5	-10.1	-173.1	-38.2	0	0	0	0	114.3
487	F	29.4	Very low	32.6	Very low	201 Å²	201	144 Å²	144	88%	0.882	78%	0.783	S	S	*	*	S	Bend	trans	-106.5	10.8	-170.5	-131.3	-89.5	0	0	0	116.5
488	A	31.2	Very low	32.6	Very low	79 Å²	79	147.8 Å²	147.8	65%	0.653	78%	0.781	S	S	*	*			trans	-130.6	40.1	-173.9	0	0	0	0	0	115.8
489	L	33.2	Very low	32	Very low	166 Å²	166	149.5 Å²	149.5	87%	0.869	78%	0.778	S	S	*	*			trans	-136.7	50	173.7	-71.3	176.6	0	0	0	114.4
490	K	33.4	Very low	31.5	Very low	211 Å²	211	149.3 Å²	149.3	92%	0.917	78%	0.782	S	S	*	*			trans	-135.7	73.8	154.8	-85.4	-171	178.4	173.8	0	111.3
491	S	30.1	Very low	31.1	Very low	110 Å²	110	154.9 Å²	154.9	77%	0.769	81%	0.806	S	S	*	*	S	Bend	trans	-171	113.6	145.7	54.1	0	0	0	0	112.2
492	K	29.3	Very low	30.4	Very low	207 Å²	207	152 Å²	152	90%	0.9	80%	0.798	S	S	*	*			trans	61.1	113.5	149.4	-60.7	-177.6	178.7	-180	0	118.5
493	S	27.1	Very low	29.7	Very low	120 Å²	120	154.9 Å²	154.9	84%	0.839	80%	0.801	S	S	*	*			trans	-40.6	136	159.3	-179.7	0	0	0	0	114
494	V	26	Very low	29.6	Very low	123 Å²	123	155.3 Å²	155.3	75%	0.745	80%	0.802	S	S	*	*				177.1	123.5	129	154.9	0	0	0	0	110
495	N	26.1	Very low	29.2	Very low	144 Å²	144	156 Å²	156	77%	0.77	81%	0.808	S	S	*	*			trans	39.5	118.9	155.9	-76.4	-35.3	0	0	0	120.7
496	V	28.5	Very low	28.9	Very low	144 Å²	144	155.5 Å²	155.5	87%	0.873	81%	0.809	S	S	*	*				-165.8	129.3	101.5	164.8	0	0	0	0	109
497	K	29.4	Very low	28.5	Very low	183 Å²	183	155.6 Å²	155.6	80%	0.796	81%	0.809	S	S	*	*			trans	-67.4	136.7	170.5	-68.8	168.3	167.9	177.2	0	110.8
498	E	27	Very low	28.7	Very low	151 Å²	151	151.3 Å²	151.3	71%	0.706	80%	0.804	S	S	*	*				173.4	126.3	104.7	-101.8	-170.1	120.6	0	0	112.6
499	K	27.3	Very low	28.3	Very low	174 Å²	174	154.1 Å²	154.1	76%	0.757	81%	0.814	S	S	*	*	S	Bend	trans	76.2	74.2	145.2	-68.3	168	170.6	148.8	0	119.5
500	M	25.8	Very low	28.2	Very low	193 Å²	193	151.8 Å²	151.8	95%	0.951	81%	0.808	S	S	*	*				-174.1	79.9	107.2	-116	176.8	-177.7	0	0	109.6
501	I	28.7	Very low	28.3	Very low	172 Å²	172	148 Å²	148	88%	0.882	80%	0.802	S	S	*	*			trans	-131.2	117.6	161.6	-63.4	175.6	0	0	0	106.1
502	S	24.2	Very low	28.1	Very low	93 Å²	93	149.9 Å²	149.9	65%	0.65	80%	0.804	S	S	*	*			trans	-173.6	103.3	153.4	60.6	0	0	0	0	104.1
503	F	26.4	Very low	28.2	Very low	183 Å²	183	151.8 Å²	151.8	80%	0.803	81%	0.805	S	S	*	*	S	Bend		175.8	139.7	75.8	-89	-85.7	0	0	0	103.6
504	I	33.6	Very low	28.2	Very low	141 Å²	141	151.7 Å²	151.7	72%	0.723	80%	0.795	S	S	*	*			cis	-158.5	141.9	13.7	-91	151.5	0	0	0	107.8
505	E	26.8	Very low	28.2	Very low	176 Å²	176	151.4 Å²	151.4	82%	0.822	80%	0.798	S	S	*	*			trans	-85.4	149.2	168.5	-166.9	174.5	-158.1	0	0	110.1	T507	E505-T507 PolarHBondContact O-N 2.75Å
506	N	29.5	Very low	28.4	Very low	166 Å²	166	152.9 Å²	152.9	89%	0.888	80%	0.798	S	S	*	*			trans	-24.2	122.1	173.6	-81	-32.4	0	0	0	116.5
507	T	25.5	Very low	28.5	Very low	130 Å²	130	152.5 Å²	152.5	80%	0.798	79%	0.791	S	S	*	*			trans	-130.4	123.4	152	49.9	0	0	0	0	110.5	E505	E505-T507 PolarHBondContact O-N 2.75Å
508	S	33.5	Very low	28.8	Very low	111 Å²	111	147.2 Å²	147.2	78%	0.776	77%	0.771	S	S	*	*			trans	-73.1	122.2	169.9	47.1	0	0	0	0	111.3
509	T	24	Very low	28.9	Very low	139 Å²	139	145.4 Å²	145.4	85%	0.853	77%	0.772	S	S	*	*			trans	171.7	163.3	146.4	30.3	0	0	0	0	110.8
510	P	29.6	Very low	29.4	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	75%	0.752	S	S	*	*			trans	-88.9	152.4	-135.4	34.7	-35.3	0	0	0	117.3
511	V	37	Very low	29.8	Very low	130 Å²	130	138.3 Å²	138.3	79%	0.788	75%	0.747	S	S	*	*			trans	11.3	114.9	156.7	-165.2	0	0	0	0	118.4
512	D	24.3	Very low	30	Very low	151 Å²	151	136.3 Å²	136.3	81%	0.807	73%	0.734	S	S	*	*			trans	-130.5	136.2	141.4	-99.5	-32.8	0	0	0	108.9	I514	D512-I514 PolarHBondContact O-N 3.12Å
513	R	32.2	Very low	30.5	Very low	246 Å²	246	141.5 Å²	141.5	93%	0.928	75%	0.745	S	S	*	*			trans	-65.3	112.2	-178.2	-77.6	-179.9	177.6	179.1	-2	110.2
514	I	26.3	Very low	30.5	Very low	119 Å²	119	138.7 Å²	138.7	61%	0.61	74%	0.742	S	S	*	*			trans	-116.2	117.9	168.6	-60.2	172.6	0	0	0	108	D512 F516	D512-I514 PolarHBondContact O-N 3.12Å; I514-F516 HydrophobicContact CB-CE2 4.1Å; I514-F516 HydrophobicContact CG2-CD2 4.27Å; I514-F516 HydrophobicContact CG2-CE2 3.98Å; I514-F516 HydrophobicContact CG2-CZ 4.15Å; I514-F516 WeakPolarHBondContact O-CD2 3.49Å
515	S	27.3	Very low	30.5	Very low	116 Å²	116	138.6 Å²	138.6	81%	0.811	74%	0.742	S	S	*	*			trans	-71.6	126.2	167.6	-46.7	0	0	0	0	108.8
516	F	29.9	Very low	30.8	Very low	175 Å²	175	135.9 Å²	135.9	77%	0.768	74%	0.739	S	S	*	*			trans	-103.6	106.8	180	-80.2	-86.8	0	0	0	110.9	I514	I514-F516 HydrophobicContact CB-CE2 4.1Å; I514-F516 HydrophobicContact CG2-CD2 4.27Å; I514-F516 HydrophobicContact CG2-CE2 3.98Å; I514-F516 HydrophobicContact CG2-CZ 4.15Å; I514-F516 WeakPolarHBondContact O-CD2 3.49Å
517	N	30.3	Very low	30.8	Very low	136 Å²	136	134.9 Å²	134.9	73%	0.727	73%	0.734	S	S	*	*			trans	-85.2	118.7	163.4	-77.4	10.9	0	0	0	108.9
518	L	35.8	Very low	31.1	Very low	73 Å²	73	139.8 Å²	139.8	38%	0.382	74%	0.738	S	S	.	*			trans	-84.5	148.7	168	-72.7	167.6	0	0	0	109.4	K371 W520	K371-L518 HydrophobicContact CD-CD2 4.45Å; L518-W520 VanDerWaalsContact C-N 3.33Å; L518-W520 PolarHBondContact O-N 2.83Å
519	P	29.8	Very low	31.2	Very low	112 Å²	112	142.4 Å²	142.4	73%	0.727	74%	0.738	S	S	*	*			trans	-78.4	84.3	-178.3	32.9	-31.9	0	0	0	109.9
520	W	36.4	Very low	31.6	Very low	88 Å²	88	141.9 Å²	141.9	33%	0.333	73%	0.734	S	S	.	*			trans	-91.6	155.4	159.3	-60.3	97.2	0	0	0	108.1	L374 K418 L518 E522	L374-W520 HydrophobicContact CD1-CH2 3.1Å; L374-W520 HydrophobicContact CD1-CZ2 3.89Å; L374-W520 HydrophobicContact CD1-CZ3 3.59Å; L374-W520 HydrophobicContact CG-CH2 4.43Å; K418-W520 VanDerWaalsContact CE-CH2 3.4Å; L518-W520 VanDerWaalsContact C-N 3.33Å; L518-W520 PolarHBondContact O-N 2.83Å; W520-E522 PolarHBondContact O-N 3.49Å
521	P	34.6	Very low	32	Very low	131 Å²	131	139.4 Å²	139.4	85%	0.851	72%	0.72	S	S	*	*			trans	-63.5	99.8	166.4	24.8	-29	0	0	0	108.7
522	E	33.8	Very low	31.9	Very low	130 Å²	130	139.5 Å²	139.5	61%	0.607	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-73.6	121.3	-179.2	-78.5	176.3	162.9	0	0	111	W520	W520-E522 PolarHBondContact O-N 3.49Å
523	K	33.2	Very low	32.5	Very low	201 Å²	201	136.3 Å²	136.3	87%	0.874	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-92.6	123.5	140.7	-89.2	-175.9	177.5	179.4	0	106.5
524	V	27.8	Very low	32.9	Very low	125 Å²	125	130.5 Å²	130.5	76%	0.758	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-77.7	121.9	-169.4	178.3	0	0	0	0	110.7
525	I	33.4	Very low	33.3	Very low	139 Å²	139	136.3 Å²	136.3	71%	0.713	72%	0.717	S	S	*	*			trans	-119.6	132.5	162.6	-58.9	170.6	0	0	0	106.7	D527	I525-D527 PolarHBondContact O-N 2.88Å
526	P	32.9	Very low	33.8	Very low	118 Å²	118	137.8 Å²	137.8	77%	0.766	72%	0.721	S	S	*	*			trans	-79.4	109.4	-175.5	28.9	-31	0	0	0	112.3	R528	P526-R528 PolarHBondContact O-N 3.4Å
527	D	28.8	Very low	34	Very low	145 Å²	145	133.3 Å²	133.3	78%	0.775	72%	0.724	S	S	*	*			trans	-62.7	114.9	166.9	-83	-34.1	0	0	0	111.1	I525	I525-D527 PolarHBondContact O-N 2.88Å
528	R	32	Very low	34	Very low	233 Å²	233	136 Å²	136	88%	0.879	73%	0.729	S	S	*	*			trans	-112.2	95.1	168.3	-172.4	179.2	160.1	174.1	-5.9	110	P526	P526-R528 PolarHBondContact O-N 3.4Å
529	H	36	Very low	34.2	Very low	167 Å²	167	138.4 Å²	138.4	77%	0.773	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-85.2	141.2	167.3	-73.7	-78.1	0	0	0	111.5
530	V	32.1	Very low	34.3	Very low	127 Å²	127	144 Å²	144	77%	0.77	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-72.7	133	178.2	-177.4	0	0	0	0	110.6
531	S	38	Very low	34.2	Very low	66 Å²	66	152 Å²	152	46%	0.462	79%	0.787	S	S	.	*	P	Polyproline II helix	trans	-88.4	148.1	179.8	168.9	0	0	0	0	112	S533 D534	S531-S533 PolarHBondContact O-N 2.82Å; S531-S533 PolarHBondContact OG-N 3.3Å; S531-S533 PolarHBondContact OG-OG 3.28Å; S531-D534 PolarHBondContact O-N 3.41Å
532	S	35.4	Very low	34.4	Very low	132 Å²	132	149.2 Å²	149.2	92%	0.923	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	2.2	174.8	56	0	0	0	0	115.3
533	S	36.8	Very low	34.1	Very low	83 Å²	83	150.2 Å²	150.2	58%	0.58	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-8.9	178.3	53.7	0	0	0	0	114.5	S531 R535	S531-S533 PolarHBondContact O-N 2.82Å; S531-S533 PolarHBondContact OG-N 3.3Å; S531-S533 PolarHBondContact OG-OG 3.28Å; S533-R535 PolarHBondContact O-N 3.46Å
534	D	40.3	Very low	34	Very low	124 Å²	124	150 Å²	150	66%	0.663	80%	0.795	S	S	*	*			trans	-77.1	92.5	176.9	-80	-17.4	0	0	0	110.5	S531 V536	S531-D534 PolarHBondContact O-N 3.41Å; D534-V536 PolarHBondContact O-N 3.02Å
535	R	35.7	Very low	34.2	Very low	241 Å²	241	149.6 Å²	149.6	91%	0.909	80%	0.796	S	S	*	*			trans	-84.8	105.8	175.4	-79.4	-177.1	169.9	-179.1	-1	110.9	S533	S533-R535 PolarHBondContact O-N 3.46Å
536	V	35.8	Very low	34.3	Very low	148 Å²	148	150 Å²	150	90%	0.897	80%	0.804	S	S	*	*			trans	-137	120.7	151.7	-164.3	0	0	0	0	109.2	D534	D534-V536 PolarHBondContact O-N 3.02Å
537	G	34.3	Very low	34	Very low	80 Å²	80	153.4 Å²	153.4	83%	0.825	81%	0.807	S	S	*	*			trans	106.1	127	163.3	0	0	0	0	0	117
538	K	32.2	Very low	34.1	Very low	194 Å²	194	151.7 Å²	151.7	84%	0.843	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-91.6	167.6	-176.4	-91.6	-177.4	-177.1	178.5	0	112.5
539	P	38.3	Very low	34	Very low	123 Å²	123	148.3 Å²	148.3	80%	0.799	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-88.6	138.3	-149.3	34.2	-32.7	0	0	0	114
540	Y	31.8	Very low	33.9	Very low	230 Å²	230	143.6 Å²	143.6	90%	0.902	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-100.7	118.9	169.1	-78.5	-82.3	0	0	0	111.1
541	R	34.6	Very low	34.2	Very low	256 Å²	256	145.4 Å²	145.4	97%	0.966	81%	0.807	S	S	*	*			trans	-94.8	109.9	167.9	-165.6	-179.2	-168.3	174.4	3	106.2
542	G	38.4	Very low	34	Very low	71 Å²	71	151.5 Å²	151.5	73%	0.732	83%	0.828	S	S	*	*			trans	124.1	54.7	162.8	0	0	0	0	0	119.3
543	V	28.1	Very low	33.8	Very low	152 Å²	152	154.3 Å²	154.3	92%	0.921	83%	0.826	S	S	*	*			trans	-142.8	150.8	160.1	-164.5	0	0	0	0	111.5
544	K	30.8	Very low	33.5	Very low	195 Å²	195	157.2 Å²	157.2	85%	0.848	83%	0.831	S	S	*	*			trans	-82.8	168.5	-168.3	-99.1	179.8	177.4	178.3	0	115.6
545	P	32.7	Very low	32.9	Very low	118 Å²	118	159.9 Å²	159.9	77%	0.766	83%	0.833	S	S	*	*			trans	-80.4	153.5	-169.6	26.9	-22.6	0	0	0	115.4	F547	P545-F547 PolarHBondContact O-N 3.4Å
546	V	34.4	Very low	32.6	Very low	146 Å²	146	155 Å²	155	89%	0.885	83%	0.825	S	S	*	*	S	Bend	trans	-65.6	80.8	-169.9	-176.2	0	0	0	0	112.9
547	F	26.7	Very low	32.3	Very low	191 Å²	191	153.3 Å²	153.3	84%	0.838	82%	0.815	S	S	*	*			trans	-137.2	120.8	142.7	-90.6	-82.8	0	0	0	106	P545	P545-F547 PolarHBondContact O-N 3.4Å
548	S	30.8	Very low	32.3	Very low	108 Å²	108	156.4 Å²	156.4	76%	0.755	81%	0.813	S	S	*	*			trans	64.8	141.8	169.8	26.9	0	0	0	0	117.3
549	I	30.9	Very low	32.5	Very low	162 Å²	162	156.3 Å²	156.3	83%	0.831	82%	0.815	S	S	*	*			cis	-168.7	151.4	8.8	-104.3	154.2	0	0	0	107.8
550	G	33.9	Very low	32.2	Very low	69 Å²	69	158.6 Å²	158.6	71%	0.711	82%	0.819	S	S	*	*				61.8	139.9	127.2	0	0	0	0	0	123
551	D	39.5	Very low	32	Very low	165 Å²	165	154.4 Å²	154.4	88%	0.882	81%	0.812	S	S	*	*			trans	-45	157.2	160.7	-63.4	-48	0	0	0	114.3
552	E	33.8	Very low	31.9	Very low	193 Å²	193	147.6 Å²	147.6	90%	0.902	80%	0.803	S	S	*	*			trans	-138.1	120.8	148.1	-78.4	-166.6	171	0	0	110.8
553	E	29.6	Very low	31.7	Very low	191 Å²	191	149.3 Å²	149.3	89%	0.893	80%	0.804	S	S	*	*				-171.2	90.6	126.2	-96.2	179.9	-157.7	0	0	106.6
554	E	31.6	Very low	32.1	Very low	145 Å²	145	147.2 Å²	147.2	68%	0.678	80%	0.797	S	S	*	*				82.8	100.8	93	-134.2	-174.8	-175	0	0	115.2
555	Y	27.3	Very low	32	Very low	180 Å²	180	144.2 Å²	144.2	71%	0.706	79%	0.787	S	S	*	*				153.2	132.3	119.2	-86.4	-75.3	0	0	0	114.3
556	D	28.3	Very low	32.1	Very low	138 Å²	138	141.5 Å²	141.5	74%	0.738	77%	0.771	S	S	*	*			trans	86.2	102.6	148.7	-74.4	-7.7	0	0	0	123.1
557	T	30.8	Very low	32.4	Very low	112 Å²	112	140 Å²	140	69%	0.687	76%	0.758	S	S	*	*			trans	78.6	116.4	132.7	29.1	0	0	0	0	121.9
558	D	34.2	Very low	33.1	Very low	146 Å²	146	134.8 Å²	134.8	78%	0.781	74%	0.739	S	S	*	*			trans	71.6	133	138.6	-57.3	-25.2	0	0	0	121.2
559	E	35.7	Very low	33.7	Very low	192 Å²	192	134.9 Å²	134.9	90%	0.897	73%	0.731	S	S	*	*			trans	87.3	85	166.5	-53.1	-168.5	174.4	0	0	117.6
560	I	31.4	Very low	34.5	Very low	171 Å²	171	135.4 Å²	135.4	88%	0.877	72%	0.722	S	S	*	*			trans	-90.3	110.4	163.9	-65.1	173.9	0	0	0	109.3
561	D	28.3	Very low	36	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	71%	0.706	S	S	*	*			trans	-76.5	134.6	166.6	-163.7	4.5	0	0	0	110.4
562	S	32.7	Very low	38	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	69%	0.685	S	S	*	*			trans	-114.6	94.8	-170.4	48	0	0	0	0	110.7
563	S	33.5	Very low	40.7	Very low	108 Å²	108	127.6 Å²	127.6	76%	0.755	66%	0.663	S	S	*	*			trans	-152.5	50.4	177.6	72.2	0	0	0	0	115.7
564	S	38	Very low	43.5	Very low	108 Å²	108	118.9 Å²	118.9	76%	0.755	62%	0.623	S	S	*	*			trans	-149.1	87.9	164.4	-174.8	0	0	0	0	111.3
565	M	28.4	Very low	46.4	Very low	131 Å²	131	114.4 Å²	114.4	65%	0.645	60%	0.603	S	S	*	*			trans	-149.3	134.8	167.9	-77.1	-71.7	115	0	0	108.8	D569	M565-D569 HydrophobicContact CB-CB 4.28Å; M565-D569 HydrophobicContact SD-CB 3.95Å
566	S	35.4	Very low	49.5	Very low	62 Å²	62	106.6 Å²	106.6	43%	0.434	57%	0.573	S	S	.	*			trans	-61.6	155.4	175.3	76.4	0	0	0	0	111.4	D568 D569	S566-D568 PolarHBondContact O-N 2.89Å; S566-D568 VanDerWaalsContact O-N 3.14Å; S566-D569 PolarHBondContact O-N 3.44Å; S566-D569 VanDerWaalsContact O-N 3.11Å; S566-D569 VanDerWaalsContact OG-CG 3.25Å; S566-D569 PolarHBondContact OG-N 3.24Å; S566-D569 PolarHBondContact OG-OD2 3.44Å
567	D	39.3	Very low	52.4	Low	115 Å²	115	105.1 Å²	105.1	62%	0.615	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-13.9	-179.8	-108.5	2.4	0	0	0	113.6	R570	D567-R570 WeakPolarHBondContact OD1-CD 3.43Å; D567-R570 IonicContact OD1-CZ 3.2Å; D567-R570 IonicContact OD1-NE 3.6Å; D567-R570 IonicContact OD1-NH1 3.29Å; D567-R570 PolarHBondContact OD1-NH1 3.24Å
568	D	41.1	Very low	55.3	Low	80 Å²	80	104 Å²	104	43%	0.428	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.1	-26.1	174.3	-133.3	38.1	0	0	0	112.6	S566 R570 K571 Y626	S566-D568 PolarHBondContact O-N 2.89Å; S566-D568 VanDerWaalsContact O-N 3.14Å; D568-R570 PolarHBondContact O-N 2.91Å; D568-K571 PolarHBondContact O-N 3.25Å; D568-K571 IonicContact OD1-NZ 3.11Å; D568-Y626 PolarHBondContact OD2-OH 3.45Å
569	D	43.5	Very low	58	Low	111 Å²	111	98.3 Å²	98.3	59%	0.594	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.5	170.9	-66.3	-48.3	0	0	0	113.1	M565 S566	M565-D569 HydrophobicContact CB-CB 4.28Å; M565-D569 HydrophobicContact SD-CB 3.95Å; S566-D569 PolarHBondContact O-N 3.44Å; S566-D569 VanDerWaalsContact O-N 3.11Å; S566-D569 VanDerWaalsContact OG-CG 3.25Å; S566-D569 PolarHBondContact OG-N 3.24Å; S566-D569 PolarHBondContact OG-OD2 3.44Å
570	R	47.9	Very low	60.6	Low	172 Å²	172	90.8 Å²	90.8	65%	0.649	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-9.4	177.5	-64.2	178.5	-171.7	-174.2	-5.4	113.8	D567 D568	D567-R570 WeakPolarHBondContact OD1-CD 3.43Å; D567-R570 IonicContact OD1-CZ 3.2Å; D567-R570 IonicContact OD1-NE 3.6Å; D567-R570 IonicContact OD1-NH1 3.29Å; D567-R570 PolarHBondContact OD1-NH1 3.24Å; D568-R570 PolarHBondContact O-N 2.91Å
571	K	65.1	Low	63.4	Low	85 Å²	85	87.9 Å²	87.9	37%	0.37	48%	0.475	S	S	.	.	S	Bend	trans	-101.3	119.3	-176.8	-67.7	176	-167.1	147.1	0	110.9	D568 I573 Y626	D568-K571 PolarHBondContact O-N 3.25Å; D568-K571 IonicContact OD1-NZ 3.11Å; K571-I573 PolarHBondContact O-N 3.2Å; K571-I573 VanDerWaalsContact O-N 3.1Å; K571-Y626 HydrophobicContact CB-CD1 3.78Å; K571-Y626 HydrophobicContact CB-CE1 4.42Å
572	E	82.4	Confident	66.3	Low	94 Å²	94	84.3 Å²	84.3	44%	0.439	45%	0.452	S	S	.	.			trans	-60.5	114.2	-180	-169.6	-179.3	140	0	0	111.2	V574 I627 R630	E572-V574 HydrophobicContact CG-CG1 4.07Å; E572-I627 HydrophobicContact CB-CD1 4.02Å; E572-I627 HydrophobicContact CB-CG1 4.43Å; E572-I627 HydrophobicContact CG-CD1 4.01Å; E572-I627 PolarHBondContact O-N 2.83Å; E572-I627 VanDerWaalsContact O-N 3.11Å; E572-I627 WeakPolarHBondContact OE1-CD1 3.48Å; E572-R630 VanDerWaalsContact CD-NH2 3.3Å; E572-R630 IonicContact OE1-NH2 3.7Å; E572-R630 IonicContact OE2-CZ 2.68Å; E572-R630 IonicContact OE2-NH1 2.65Å; E572-R630 IonicContact OE2-NH2 3.08Å; E572-R630 PolarHBondContact OE2-NH2 3.28Å
573	I	89.3	Confident	68.7	Low	84 Å²	84	85.6 Å²	85.6	43%	0.431	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	127.6	175.9	-62.4	173.7	0	0	0	109.3	K571 I618 F624 Y626	K571-I573 PolarHBondContact O-N 3.2Å; K571-I573 VanDerWaalsContact O-N 3.1Å; I573-I618 HydrophobicContact CD1-CD1 4.35Å; I573-I618 HydrophobicContact CG1-CD1 4.13Å; I573-I618 HydrophobicContact CG2-CD1 3.78Å; I573-F624 HydrophobicContact CG2-CB 4.29Å; I573-F624 HydrophobicContact CG2-CD1 4Å; I573-Y626 HydrophobicContact CD1-CE1 4.03Å; I573-Y626 HydrophobicContact CG1-CD1 3.81Å; I573-Y626 HydrophobicContact CG1-CE1 3.69Å
574	V	89.9	Confident	71.3	Confident	9 Å²	9	84.2 Å²	84.2	6%	0.055	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	149	-177.4	-60.5	0	0	0	0	112.6	E572 I576 W579 L615 F624 A625 I627	E572-V574 HydrophobicContact CG-CG1 4.07Å; V574-I576 PolarHBondContact O-N 3.21Å; V574-W579 VanDerWaalsContact CB-CD1 3.49Å; V574-W579 HydrophobicContact CB-CG 4.27Å; V574-W579 HydrophobicContact CG1-CZ2 4.1Å; V574-W579 HydrophobicContact CG2-CD2 4.41Å; V574-W579 HydrophobicContact CG2-CG 4.14Å; V574-L615 HydrophobicContact CG2-CD1 4.24Å; V574-L615 HydrophobicContact CG2-CD2 3.98Å; V574-F624 CarbonylContact O-C 3.45Å; V574-F624 VanDerWaalsContact O-CA 3.3Å; V574-F624 WeakPolarHBondContact O-CA 3.49Å; V574-A625 WeakPolarHBondContact CG2-O 3.21Å; V574-A625 PolarHBondContact N-O 3.35Å; V574-A625 PolarHBondContact O-N 2.98Å; V574-I627 HydrophobicContact CG1-CD1 3.8Å; V574-I627 HydrophobicContact CG1-CG1 3.99Å; V574-I627 HydrophobicContact CG2-CG1 3.97Å
575	N	92.8	Very high	73.8	Confident	51 Å²	51	80.3 Å²	80.3	27%	0.273	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.4	168.6	-175.8	-79.6	0	0	0	109.5	Q577 T578 W579 G623 F624	N575-Q577 PolarHBondContact O-N 3.26Å; N575-Q577 WeakPolarHBondContact OD1-CB 3.34Å; N575-Q577 PolarHBondContact OD1-N 3.29Å; N575-T578 PolarHBondContact O-N 3.46Å; N575-T578 PolarHBondContact OD1-N 2.7Å; N575-T578 VanDerWaalsContact OD1-N 3.11Å; N575-T578 PolarHBondContact OD1-OG1 2.88Å; N575-W579 PolarHBondContact O-N 3.23Å; N575-G623 PolarHBondContact ND2-O 2.96Å; N575-F624 HydrophobicContact CB-CD1 4.4Å; N575-F624 HydrophobicContact CB-CE1 4.14Å
576	I	91.1	Very high	76.8	Confident	15 Å²	15	78.8 Å²	78.8	8%	0.077	40%	0.402	C	S	.	.	H	α-helix	trans	-60.7	-46.3	-174.6	-64.8	167.5	0	0	0	110.7	V574 T578 W579 I580 E617 G623 A625	V574-I576 PolarHBondContact O-N 3.21Å; I576-T578 PolarHBondContact O-N 3.35Å; I576-W579 PolarHBondContact O-N 3.37Å; I576-I580 HydrophobicContact CG2-CD1 3.54Å; I576-I580 HydrophobicContact CG2-CG1 4.31Å; I576-I580 VanDerWaalsContact O-CG1 3.3Å; I576-I580 WeakPolarHBondContact O-CG1 3.49Å; I576-I580 PolarHBondContact O-N 3.34Å; I576-E617 HydrophobicContact CD1-CG 3.83Å; I576-G623 PolarHBondContact N-O 2.94Å; I576-A625 HydrophobicContact CD1-CB 3.98Å; I576-A625 HydrophobicContact CG1-CB 3.53Å
577	Q	90.6	Very high	79.4	Confident	107 Å²	107	79.4 Å²	79.4	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-67.8	-38.3	-176.4	-165.8	63	45.2	0	0	112	N575 W579 N581	N575-Q577 PolarHBondContact O-N 3.26Å; N575-Q577 WeakPolarHBondContact OD1-CB 3.34Å; N575-Q577 PolarHBondContact OD1-N 3.29Å; Q577-W579 VanDerWaalsContact C-N 3.31Å; Q577-W579 PolarHBondContact O-N 3.25Å; Q577-N581 PolarHBondContact NE2-ND2 3.43Å; Q577-N581 PolarHBondContact NE2-OD1 3.19Å; Q577-N581 VanDerWaalsContact NE2-OD1 3.11Å; Q577-N581 VanDerWaalsContact O-CB 3.32Å; Q577-N581 WeakPolarHBondContact O-CB 3.49Å; Q577-N581 PolarHBondContact O-N 2.7Å; Q577-N581 VanDerWaalsContact O-N 3.09Å; Q577-N581 PolarHBondContact O-ND2 2.85Å
578	T	90.2	Very high	82	Confident	89 Å²	89	77.3 Å²	77.3	55%	0.546	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-41.3	175.1	-56.4	0	0	0	0	111.4	N575 I576 K582	N575-T578 PolarHBondContact O-N 3.46Å; N575-T578 PolarHBondContact OD1-N 2.7Å; N575-T578 VanDerWaalsContact OD1-N 3.11Å; N575-T578 PolarHBondContact OD1-OG1 2.88Å; I576-T578 PolarHBondContact O-N 3.35Å; T578-K582 WeakPolarHBondContact O-CG 3.44Å; T578-K582 PolarHBondContact O-N 3.48Å
579	W	91.1	Very high	84.5	Confident	26 Å²	26	74.4 Å²	74.4	10%	0.098	37%	0.369	C	S	.	.	H	α-helix	trans	-73	-41.1	179.5	-92.4	69.2	0	0	0	113.4	V574 N575 I576 Q577 N581 K582 I585 L606 Y613 L615 I627	V574-W579 VanDerWaalsContact CB-CD1 3.49Å; V574-W579 HydrophobicContact CB-CG 4.27Å; V574-W579 HydrophobicContact CG1-CZ2 4.1Å; V574-W579 HydrophobicContact CG2-CD2 4.41Å; V574-W579 HydrophobicContact CG2-CG 4.14Å; N575-W579 PolarHBondContact O-N 3.23Å; I576-W579 PolarHBondContact O-N 3.37Å; Q577-W579 VanDerWaalsContact C-N 3.31Å; Q577-W579 PolarHBondContact O-N 3.25Å; W579-N581 PolarHBondContact O-N 3.07Å; W579-K582 HydrophobicContact CD2-CD 4.38Å; W579-K582 PolarHBondContact O-N 3.28Å; W579-I585 VanDerWaalsContact O-CG1 3.22Å; W579-I585 WeakPolarHBondContact O-CG1 3.45Å; W579-L606 HydrophobicContact CB-CD1 4Å; W579-L606 HydrophobicContact CE3-CD1 3.98Å; W579-Y613 HydrophobicContact CH2-CD1 4.27Å; W579-Y613 HydrophobicContact CH2-CE1 4.21Å; W579-Y613 AromaticContact CZ3-CD1 3.82Å; W579-Y613 HydrophobicContact CZ3-CD1 3.82Å; W579-Y613 HydrophobicContact CZ3-CE1 4.04Å; W579-Y613 HydrophobicContact CZ3-CG 4.11Å; W579-L615 HydrophobicContact CB-CD1 3.89Å; W579-L615 HydrophobicContact CG-CD1 4.33Å; W579-I627 HydrophobicContact CH2-CD1 3.58Å; W579-I627 HydrophobicContact CZ2-CD1 3.43Å; W579-I627 VanDerWaalsContact CZ2-CD1 3.43Å; W579-I627 HydrophobicContact CZ2-CG1 4.48Å; W579-I627 HydrophobicContact CZ3-CD1 4.43Å
580	I	90.6	Very high	86.9	Confident	34 Å²	34	72.7 Å²	72.7	17%	0.174	36%	0.364	C	S	.	.	H	α-helix	trans	-59.7	-36.7	175	-68.9	167.1	0	0	0	111	I576 K582 H588 L606	I576-I580 HydrophobicContact CG2-CD1 3.54Å; I576-I580 HydrophobicContact CG2-CG1 4.31Å; I576-I580 VanDerWaalsContact O-CG1 3.3Å; I576-I580 WeakPolarHBondContact O-CG1 3.49Å; I576-I580 PolarHBondContact O-N 3.34Å; I580-K582 VanDerWaalsContact C-N 3.34Å; I580-K582 PolarHBondContact O-N 2.96Å; I580-H588 WeakPolarHBondContact CD1-NE2 3.46Å; I580-H588 HydrophobicContact CG2-CB 4.34Å; I580-L606 HydrophobicContact CG1-CD2 4.01Å
581	N	90.2	Very high	89.1	Confident	110 Å²	110	64.9 Å²	64.9	59%	0.588	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	3.1	-176.5	-68.2	-12.5	0	0	0	114.3	Q577 W579	Q577-N581 PolarHBondContact NE2-ND2 3.43Å; Q577-N581 PolarHBondContact NE2-OD1 3.19Å; Q577-N581 VanDerWaalsContact NE2-OD1 3.11Å; Q577-N581 VanDerWaalsContact O-CB 3.32Å; Q577-N581 WeakPolarHBondContact O-CB 3.49Å; Q577-N581 PolarHBondContact O-N 2.7Å; Q577-N581 VanDerWaalsContact O-N 3.09Å; Q577-N581 PolarHBondContact O-ND2 2.85Å; W579-N581 PolarHBondContact O-N 3.07Å
582	K	89.3	Confident	90.5	Very high	67 Å²	67	63.4 Å²	63.4	29%	0.291	33%	0.332	S	S	.	.			trans	-66.9	141.8	177.8	-66.2	179.6	171.7	179	0	110.4	T578 W579 I580 D584 I585	T578-K582 WeakPolarHBondContact O-CG 3.44Å; T578-K582 PolarHBondContact O-N 3.48Å; W579-K582 HydrophobicContact CD2-CD 4.38Å; W579-K582 PolarHBondContact O-N 3.28Å; I580-K582 VanDerWaalsContact C-N 3.34Å; I580-K582 PolarHBondContact O-N 2.96Å; K582-D584 WeakPolarHBondContact CB-OD1 3.3Å; K582-D584 PolarHBondContact O-N 3.28Å; K582-D584 VanDerWaalsContact O-N 3.12Å; K582-I585 HydrophobicContact CB-CG1 4.16Å; K582-I585 PolarHBondContact O-N 3.49Å; K582-I585 VanDerWaalsContact O-N 3.15Å
583	P	82.5	Confident	91.1	Very high	140 Å²	140	59.6 Å²	59.6	91%	0.909	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-15	-174.2	28.1	-36.2	0	0	0	114
584	D	88.7	Confident	91.2	Very high	78 Å²	78	56.6 Å²	56.6	42%	0.417	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-10.4	178.5	64.8	-36.6	0	0	0	113.8	K582 K586 T608	K582-D584 WeakPolarHBondContact CB-OD1 3.3Å; K582-D584 PolarHBondContact O-N 3.28Å; K582-D584 VanDerWaalsContact O-N 3.12Å; D584-K586 PolarHBondContact O-N 3.45Å; D584-T608 WeakPolarHBondContact O-CA 3.43Å; D584-T608 WeakPolarHBondContact O-CB 3.36Å
585	I	91.4	Very high	91.1	Very high	27 Å²	27	59.9 Å²	59.9	14%	0.138	31%	0.313	C	S	.	.			trans	-77.1	117.4	173.4	-55.6	-45.5	0	0	0	109.5	W579 K582 H587 L606 T608	W579-I585 VanDerWaalsContact O-CG1 3.22Å; W579-I585 WeakPolarHBondContact O-CG1 3.45Å; K582-I585 HydrophobicContact CB-CG1 4.16Å; K582-I585 PolarHBondContact O-N 3.49Å; K582-I585 VanDerWaalsContact O-N 3.15Å; I585-H587 WeakPolarHBondContact CG2-O 3.28Å; I585-L606 HydrophobicContact CD1-CB 4.01Å; I585-L606 HydrophobicContact CD1-CD1 4.25Å; I585-L606 HydrophobicContact CG2-CB 4.43Å; I585-L606 HydrophobicContact CG2-CD2 4.29Å; I585-T608 HydrophobicContact CD1-CG2 3.58Å
586	K	89.4	Confident	90.3	Very high	98 Å²	98	65.1 Å²	65.1	43%	0.426	34%	0.336	S	S	.	.			trans	-86.5	-39.3	174.7	-66.4	-176.9	174.7	179.1	0	111.9	D584 I607 Q684	D584-K586 PolarHBondContact O-N 3.45Å; K586-I607 PolarHBondContact N-O 2.9Å; K586-Q684 HydrophobicContact CD-CG 4.46Å; K586-Q684 VanDerWaalsContact NZ-CD 3.33Å
587	H	91.2	Very high	89.5	Confident	75 Å²	75	69.5 Å²	69.5	35%	0.347	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	138.9	-177.3	-57.1	-73.2	0	0	0	111.5	I585 I607 V680	I585-H587 WeakPolarHBondContact CG2-O 3.28Å; H587-I607 HydrophobicContact CB-CB 4.16Å; H587-I607 HydrophobicContact CB-CG1 4.32Å; H587-I607 PolarHBondContact N-O 2.95Å; H587-I607 PolarHBondContact O-N 3.34Å; H587-V680 HydrophobicContact CB-CG1 4.01Å; H587-V680 WeakPolarHBondContact CD2-CG1 3.31Å; H587-V680 VanDerWaalsContact CE1-CG1 3.5Å; H587-V680 WeakPolarHBondContact CE1-CG1 3.44Å; H587-V680 WeakPolarHBondContact ND1-CG1 3.29Å; H587-V680 VanDerWaalsContact NE2-CG1 3.31Å; H587-V680 WeakPolarHBondContact NE2-CG1 3.41Å
588	H	93.9	Very high	88.7	Confident	72 Å²	72	66.8 Å²	66.8	33%	0.333	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.3	173	162.6	-125.5	0	0	0	108.9	I580 H604 L606	I580-H588 WeakPolarHBondContact CD1-NE2 3.46Å; I580-H588 HydrophobicContact CG2-CB 4.34Å; H588-H604 AromaticContact CE1-ND1 3.96Å; H588-H604 AromaticContact NE2-CE1 3.9Å; H588-H604 AromaticContact NE2-CG 3.58Å; H588-H604 AromaticContact NE2-ND1 3.07Å; H588-H604 PolarHBondContact NE2-ND1 3.47Å; H588-L606 HydrophobicContact CB-CD2 3.91Å
589	I	94.3	Very high	88.3	Confident	19 Å²	19	67.4 Å²	67.4	10%	0.097	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	109.8	-177.5	-60.4	158.7	0	0	0	108.2	L605 I671 A677 I681	I589-L605 HydrophobicContact CB-CB 4.25Å; I589-L605 PolarHBondContact N-O 3.5Å; I589-L605 PolarHBondContact O-N 2.96Å; I589-I671 HydrophobicContact CG2-CG2 3.68Å; I589-A677 HydrophobicContact CD1-CB 3.87Å; I589-A677 HydrophobicContact CG1-CB 4.38Å; I589-A677 HydrophobicContact CG2-CB 4.16Å; I589-I681 HydrophobicContact CD1-CD1 3.85Å; I589-I681 HydrophobicContact CD1-CG1 4.14Å
590	P	93.2	Very high	88.3	Confident	75 Å²	75	71.4 Å²	71.4	49%	0.487	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	135.6	169.6	29.3	-32.7	0	0	0	110
591	C	94.3	Very high	88.3	Confident	8 Å²	8	73.3 Å²	73.3	5%	0.054	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	177.4	-174.3	65.7	0	0	0	0	111.2	S603 L670 I671	C591-S603 CarbonylContact C-O 3.4Å; C591-S603 PolarHBondContact N-O 3Å; C591-S603 CarbonylContact O-C 3.58Å; C591-S603 WeakPolarHBondContact O-CA 3.37Å; C591-S603 PolarHBondContact O-N 3.44Å; C591-S603 PolarHBondContact SG-O 3.03Å; C591-L670 WeakPolarHBondContact CA-O 3.49Å; C591-L670 WeakPolarHBondContact CB-O 3.4Å; C591-I671 HydrophobicContact CB-CG1 3.98Å
592	N	94.6	Very high	88.6	Confident	53 Å²	53	71.2 Å²	71.2	28%	0.283	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.6	165	-61.7	-48.8	0	0	0	109.9	M600 F601 P602 Y669 L670	N592-M600 HydrophobicContact CB-CB 4.24Å; N592-F601 CarbonylContact C-O 3.57Å; N592-F601 VanDerWaalsContact CA-O 3.26Å; N592-F601 WeakPolarHBondContact CA-O 3.15Å; N592-P602 WeakPolarHBondContact OD1-CA 3.32Å; N592-Y669 CarbonylContact O-C 3.58Å; N592-Y669 WeakPolarHBondContact O-CA 3.48Å; N592-L670 HydrophobicContact CB-CB 4.28Å; N592-L670 PolarHBondContact N-O 3.33Å; N592-L670 PolarHBondContact O-N 3.36Å
593	E	94.1	Very high	88.9	Confident	14 Å²	14	68 Å²	68	7%	0.065	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.5	169.8	-176.1	-171.1	176.4	0	0	109.2	K595 M600 F601 S603 R616 Y669	E593-K595 VanDerWaalsContact OE1-CE 3.26Å; E593-K595 WeakPolarHBondContact OE1-CE 3.45Å; E593-K595 IonicContact OE1-NZ 3.62Å; E593-K595 PolarHBondContact OE1-NZ 2.96Å; E593-M600 CarbonylContact O-C 3.52Å; E593-M600 VanDerWaalsContact O-CA 3.25Å; E593-M600 WeakPolarHBondContact O-CA 3.43Å; E593-F601 PolarHBondContact N-O 3.47Å; E593-F601 PolarHBondContact O-N 3.11Å; E593-S603 WeakPolarHBondContact CB-OG 3.49Å; E593-R616 IonicContact OE1-NH2 3.76Å; E593-R616 PolarHBondContact OE1-NH2 3.48Å; E593-R616 VanDerWaalsContact OE1-NH2 3.11Å; E593-R616 IonicContact OE2-CZ 2.87Å; E593-R616 IonicContact OE2-NE 2.68Å; E593-R616 PolarHBondContact OE2-NE 3.08Å; E593-R616 IonicContact OE2-NH2 3.98Å; E593-R616 PolarHBondContact OE2-NH2 3.04Å; E593-Y669 HydrophobicContact CB-CD1 4.13Å; E593-Y669 HydrophobicContact CB-CE1 3.93Å; E593-Y669 HydrophobicContact CG-CD1 4.39Å; E593-Y669 HydrophobicContact CG-CE1 3.88Å
594	V	91.3	Very high	89.5	Confident	22 Å²	22	62.4 Å²	62.4	13%	0.133	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	113.4	-178.6	-171.2	0	0	0	0	109.3	H599 M600 L648 R668 L670	V594-H599 WeakPolarHBondContact CA-O 3.45Å; V594-M600 HydrophobicContact CG2-CG 4.13Å; V594-L648 HydrophobicContact CB-CD1 4.28Å; V594-L648 HydrophobicContact CG2-CD1 3.77Å; V594-R668 HydrophobicContact CB-CB 4.13Å; V594-R668 PolarHBondContact N-O 3.22Å; V594-L670 HydrophobicContact CG2-CB 4.18Å
595	K	88.7	Confident	89.8	Confident	77 Å²	77	58.7 Å²	58.7	34%	0.335	31%	0.309	S	S	.	.			trans	-76.4	166.3	175.7	-68.7	-56.7	-164	-170.3	0	111.8	E593 T597 G598 H599 F601	E593-K595 VanDerWaalsContact OE1-CE 3.26Å; E593-K595 WeakPolarHBondContact OE1-CE 3.45Å; E593-K595 IonicContact OE1-NZ 3.62Å; E593-K595 PolarHBondContact OE1-NZ 2.96Å; K595-T597 PolarHBondContact O-N 3.46Å; K595-G598 PolarHBondContact O-N 3.09Å; K595-H599 PolarHBondContact N-O 3.25Å; K595-F601 HydrophobicContact CG-CD2 4.22Å; K595-F601 HydrophobicContact CG-CE2 3.78Å
596	E	75.6	Confident	90	Very high	161 Å²	161	57.4 Å²	57.4	75%	0.752	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.8	178.3	-53.2	-136	117.6	0	0	112.5	G598 R668	E596-G598 PolarHBondContact O-N 3.46Å; E596-R668 IonicContact OE1-CZ 2.8Å; E596-R668 IonicContact OE1-NH1 3.57Å; E596-R668 PolarHBondContact OE1-NH1 3.09Å; E596-R668 IonicContact OE1-NH2 3.82Å
597	T	74.3	Confident	90.2	Very high	108 Å²	108	52.7 Å²	52.7	66%	0.663	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-6.2	174.5	54.8	0	0	0	0	113.9	K595 H599	K595-T597 PolarHBondContact O-N 3.46Å; T597-H599 VanDerWaalsContact C-N 3.31Å; T597-H599 WeakPolarHBondContact CB-ND1 3.25Å; T597-H599 PolarHBondContact OG1-ND1 3.18Å
598	G	74.3	Confident	90.3	Very high	49 Å²	49	49.4 Å²	49.4	51%	0.505	27%	0.267	S	S	.	.	S	Bend	trans	86	-6.4	-177.9	0	0	0	0	0	114.8	K595 E596	K595-G598 PolarHBondContact O-N 3.09Å; E596-G598 PolarHBondContact O-N 3.46Å
599	H	81.5	Confident	90.1	Very high	102 Å²	102	48.1 Å²	48.1	47%	0.472	27%	0.269	S	S	.	.			trans	-64.5	140.5	174.8	-65.8	100.8	0	0	0	111.7	V594 K595 T597 F601	V594-H599 WeakPolarHBondContact CA-O 3.45Å; K595-H599 PolarHBondContact N-O 3.25Å; T597-H599 VanDerWaalsContact C-N 3.31Å; T597-H599 WeakPolarHBondContact CB-ND1 3.25Å; T597-H599 PolarHBondContact OG1-ND1 3.18Å; H599-F601 HydrophobicContact CB-CE2 4.03Å; H599-F601 HydrophobicContact CB-CZ 4.35Å
600	M	90.1	Very high	89.8	Confident	111 Å²	111	50.7 Å²	50.7	55%	0.547	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.1	-178.1	-63	-168	-67.1	0	0	110.7	N592 E593 V594 L670	N592-M600 HydrophobicContact CB-CB 4.24Å; E593-M600 CarbonylContact O-C 3.52Å; E593-M600 VanDerWaalsContact O-CA 3.25Å; E593-M600 WeakPolarHBondContact O-CA 3.43Å; V594-M600 HydrophobicContact CG2-CG 4.13Å; M600-L670 HydrophobicContact SD-CD2 3.99Å
601	F	92.4	Very high	89.9	Confident	73 Å²	73	50.2 Å²	50.2	32%	0.32	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.8	178	-61.6	-86.3	0	0	0	111.1	N592 E593 K595 H599 S603 R616	N592-F601 CarbonylContact C-O 3.57Å; N592-F601 VanDerWaalsContact CA-O 3.26Å; N592-F601 WeakPolarHBondContact CA-O 3.15Å; E593-F601 PolarHBondContact N-O 3.47Å; E593-F601 PolarHBondContact O-N 3.11Å; K595-F601 HydrophobicContact CG-CD2 4.22Å; K595-F601 HydrophobicContact CG-CE2 3.78Å; H599-F601 HydrophobicContact CB-CE2 4.03Å; H599-F601 HydrophobicContact CB-CZ 4.35Å; F601-S603 PolarHBondContact O-N 3.38Å; F601-S603 PolarHBondContact O-OG 3.44Å; F601-R616 HydrophobicContact CB-CG 3.7Å; F601-R616 HydrophobicContact CG-CG 4.33Å
602	P	95.7	Very high	89.8	Confident	66 Å²	66	49.9 Å²	49.9	43%	0.429	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	122.4	170.8	-25.6	35	0	0	0	110.8	N592 E617	N592-P602 WeakPolarHBondContact OD1-CA 3.32Å; P602-E617 HydrophobicContact CB-CB 4.32Å; P602-E617 HydrophobicContact CB-CG 4.25Å; P602-E617 PolarHBondContact O-N 3.11Å
603	S	95.9	Very high	89.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.007	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	161.1	-170.6	-59.8	0	0	0	0	112.6	C591 E593 F601 L615	C591-S603 CarbonylContact C-O 3.4Å; C591-S603 PolarHBondContact N-O 3Å; C591-S603 CarbonylContact O-C 3.58Å; C591-S603 WeakPolarHBondContact O-CA 3.37Å; C591-S603 PolarHBondContact O-N 3.44Å; C591-S603 PolarHBondContact SG-O 3.03Å; E593-S603 WeakPolarHBondContact CB-OG 3.49Å; F601-S603 PolarHBondContact O-N 3.38Å; F601-S603 PolarHBondContact O-OG 3.44Å; S603-L615 CarbonylContact C-O 3.51Å; S603-L615 WeakPolarHBondContact CA-O 3.45Å; S603-L615 WeakPolarHBondContact CB-O 3.31Å
604	H	95.2	Very high	89.8	Confident	21 Å²	21	48.5 Å²	48.5	10%	0.097	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.3	174.7	-57	-72.1	0	0	0	110.2	H588 L615 E617	H588-H604 AromaticContact CE1-ND1 3.96Å; H588-H604 AromaticContact NE2-CE1 3.9Å; H588-H604 AromaticContact NE2-CG 3.58Å; H588-H604 AromaticContact NE2-ND1 3.07Å; H588-H604 PolarHBondContact NE2-ND1 3.47Å; H604-L615 HydrophobicContact CB-CB 4.34Å; H604-L615 PolarHBondContact N-O 3.06Å; H604-L615 PolarHBondContact O-N 2.86Å; H604-E617 IonicContact CE1-OE1 3.66Å; H604-E617 IonicContact NE2-OE1 3.6Å; H604-E617 PolarHBondContact NE2-OE1 2.86Å
605	L	94.9	Very high	90	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	123.3	167.8	-75.3	173.1	0	0	0	109.4	I589 M612 Y613 C614 Y669 I671	I589-L605 HydrophobicContact CB-CB 4.25Å; I589-L605 PolarHBondContact N-O 3.5Å; I589-L605 PolarHBondContact O-N 2.96Å; L605-M612 HydrophobicContact CD2-CE 4.23Å; L605-M612 HydrophobicContact CD2-CG 4.06Å; L605-M612 HydrophobicContact CD2-SD 4.04Å; L605-Y613 WeakPolarHBondContact CA-O 3.37Å; L605-C614 HydrophobicContact CD2-CB 4.18Å; L605-Y669 HydrophobicContact CD1-CD1 4.23Å; L605-Y669 HydrophobicContact CD1-CD2 3.95Å; L605-Y669 HydrophobicContact CD1-CE2 4.34Å; L605-Y669 HydrophobicContact CD1-CG 3.88Å; L605-Y669 HydrophobicContact CD2-CD1 4.41Å; L605-Y669 HydrophobicContact CD2-CD2 4.41Å; L605-Y669 HydrophobicContact CD2-CE1 4Å; L605-Y669 HydrophobicContact CD2-CE2 3.98Å; L605-Y669 HydrophobicContact CG-CD1 4.36Å; L605-Y669 HydrophobicContact CG-CE1 4.41Å; L605-Y669 HydrophobicContact CG-CG 4.5Å; L605-I671 HydrophobicContact CD1-CD1 4.08Å
606	L	95.2	Very high	90.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.7	174.5	-54.1	179	0	0	0	109.6	W579 I580 I585 H588 M612 Y613 L615	W579-L606 HydrophobicContact CB-CD1 4Å; W579-L606 HydrophobicContact CE3-CD1 3.98Å; I580-L606 HydrophobicContact CG1-CD2 4.01Å; I585-L606 HydrophobicContact CD1-CB 4.01Å; I585-L606 HydrophobicContact CD1-CD1 4.25Å; I585-L606 HydrophobicContact CG2-CB 4.43Å; I585-L606 HydrophobicContact CG2-CD2 4.29Å; H588-L606 HydrophobicContact CB-CD2 3.91Å; L606-M612 WeakPolarHBondContact O-CA 3.32Å; L606-Y613 PolarHBondContact N-O 2.78Å; L606-Y613 PolarHBondContact O-N 2.91Å; L606-L615 HydrophobicContact CD1-CD1 3.48Å; L606-L615 VanDerWaalsContact CD1-CD1 3.48Å; L606-L615 HydrophobicContact CD1-CG 4.02Å; L606-L615 HydrophobicContact CG-CD1 4.27Å; L606-L615 HydrophobicContact CG-CG 4.47Å
607	I	93.9	Very high	91.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.8	-179.3	-49.6	-60.6	0	0	0	108.8	K586 H587 M612 L633 I681 Q684	K586-I607 PolarHBondContact N-O 2.9Å; H587-I607 HydrophobicContact CB-CB 4.16Å; H587-I607 HydrophobicContact CB-CG1 4.32Å; H587-I607 PolarHBondContact N-O 2.95Å; H587-I607 PolarHBondContact O-N 3.34Å; I607-M612 HydrophobicContact CD1-CB 3.91Å; I607-M612 HydrophobicContact CD1-CG 3.51Å; I607-M612 HydrophobicContact CD1-SD 3.76Å; I607-L633 HydrophobicContact CG2-CD1 4.11Å; I607-I681 HydrophobicContact CD1-CD1 4.23Å; I607-I681 HydrophobicContact CD1-CG1 3.86Å; I607-I681 HydrophobicContact CG1-CG1 3.97Å; I607-Q684 HydrophobicContact CG2-CB 4.22Å; I607-Q684 HydrophobicContact CG2-CG 3.87Å
608	T	93.5	Very high	92	Very high	5 Å²	5	37 Å²	37	3%	0.031	20%	0.203	C	C	.	.			trans	-98.5	-169.5	173.9	70.2	0	0	0	0	111.1	D584 I585 T610 H611 Y613	D584-T608 WeakPolarHBondContact O-CA 3.43Å; D584-T608 WeakPolarHBondContact O-CB 3.36Å; I585-T608 HydrophobicContact CD1-CG2 3.58Å; T608-T610 PolarHBondContact O-N 3.48Å; T608-T610 PolarHBondContact OG1-N 3.06Å; T608-H611 PolarHBondContact N-O 3.32Å; T608-H611 PolarHBondContact OG1-N 3.15Å; T608-H611 PolarHBondContact OG1-O 3.28Å; T608-Y613 HydrophobicContact CG2-CD2 4.03Å; T608-Y613 HydrophobicContact CG2-CE2 3.64Å
609	A	89.7	Confident	92.5	Very high	45 Å²	45	39.8 Å²	39.8	37%	0.372	22%	0.221	S	C	.	.	S	Bend	trans	-60.4	-34.1	171.4	0	0	0	0	0	112.6	Q684 V688	A609-Q684 PolarHBondContact O-NE2 3.18Å; A609-V688 WeakPolarHBondContact O-CG2 3.5Å
610	T	88.5	Confident	92.6	Very high	74 Å²	74	40.5 Å²	40.5	45%	0.454	24%	0.237	S	C	.	.	S	Bend	trans	-128.1	-19.7	-168.1	52.6	0	0	0	0	114.6	T608 L633	T608-T610 PolarHBondContact O-N 3.48Å; T608-T610 PolarHBondContact OG1-N 3.06Å; T610-L633 WeakPolarHBondContact O-CB 3.3Å; T610-L633 PolarHBondContact O-N 3.41Å
611	H	93.3	Very high	92.4	Very high	65 Å²	65	41.2 Å²	41.2	30%	0.301	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	157.8	-172.3	-68.9	77.9	0	0	0	112.7	T608 Y613 Q631	T608-H611 PolarHBondContact N-O 3.32Å; T608-H611 PolarHBondContact OG1-N 3.15Å; T608-H611 PolarHBondContact OG1-O 3.28Å; H611-Y613 HydrophobicContact CB-CD2 4.31Å; H611-Y613 HydrophobicContact CB-CE2 3.62Å; H611-Q631 CarbonylContact C-O 3.28Å; H611-Q631 VanDerWaalsContact CA-O 3.3Å; H611-Q631 WeakPolarHBondContact CA-O 3.32Å
612	M	93.6	Very high	92	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128	165.8	-179.5	168.4	88.4	0	0	109.3	L605 L606 I607 Q631 L633 F651 F653 Y669	L605-M612 HydrophobicContact CD2-CE 4.23Å; L605-M612 HydrophobicContact CD2-CG 4.06Å; L605-M612 HydrophobicContact CD2-SD 4.04Å; L606-M612 WeakPolarHBondContact O-CA 3.32Å; I607-M612 HydrophobicContact CD1-CB 3.91Å; I607-M612 HydrophobicContact CD1-CG 3.51Å; I607-M612 HydrophobicContact CD1-SD 3.76Å; M612-Q631 PolarHBondContact N-O 3.29Å; M612-Q631 PolarHBondContact O-N 3.03Å; M612-L633 HydrophobicContact CB-CD2 3.94Å; M612-F651 HydrophobicContact CE-CD1 4.47Å; M612-F651 HydrophobicContact CE-CD2 4.4Å; M612-F651 HydrophobicContact CE-CG 4.27Å; M612-F653 HydrophobicContact CE-CE1 4.08Å; M612-F653 HydrophobicContact CE-CE2 4.46Å; M612-F653 HydrophobicContact CE-CZ 3.44Å; M612-F653 VanDerWaalsContact CE-CZ 3.44Å; M612-Y669 HydrophobicContact CE-CE2 4.39Å
613	Y	94.2	Very high	91.7	Very high	37 Å²	37	45.8 Å²	45.8	15%	0.145	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.2	176.8	-61.9	-94.9	0	0	0	110.3	W579 L605 L606 T608 H611 I627 S629 R630	W579-Y613 HydrophobicContact CH2-CD1 4.27Å; W579-Y613 HydrophobicContact CH2-CE1 4.21Å; W579-Y613 AromaticContact CZ3-CD1 3.82Å; W579-Y613 HydrophobicContact CZ3-CD1 3.82Å; W579-Y613 HydrophobicContact CZ3-CE1 4.04Å; W579-Y613 HydrophobicContact CZ3-CG 4.11Å; L605-Y613 WeakPolarHBondContact CA-O 3.37Å; L606-Y613 PolarHBondContact N-O 2.78Å; L606-Y613 PolarHBondContact O-N 2.91Å; T608-Y613 HydrophobicContact CG2-CD2 4.03Å; T608-Y613 HydrophobicContact CG2-CE2 3.64Å; H611-Y613 HydrophobicContact CB-CD2 4.31Å; H611-Y613 HydrophobicContact CB-CE2 3.62Å; Y613-I627 HydrophobicContact CD1-CG2 4.49Å; Y613-S629 WeakPolarHBondContact CA-O 3.28Å; Y613-R630 HydrophobicContact CD1-CB 4.34Å; Y613-R630 HydrophobicContact CD1-CG 3.73Å; Y613-R630 HydrophobicContact CE1-CB 4.18Å; Y613-R630 HydrophobicContact CE1-CG 3.68Å
614	C	95.1	Very high	91.5	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	115	168.4	-177.8	0	0	0	0	109.9	L605 Q628 S629 Y669	L605-C614 HydrophobicContact CD2-CB 4.18Å; C614-Q628 HydrophobicContact CB-CB 4.34Å; C614-Q628 PolarHBondContact O-N 2.99Å; C614-S629 WeakPolarHBondContact CB-OG 3.45Å; C614-S629 PolarHBondContact N-O 2.95Å; C614-S629 VanDerWaalsContact N-O 3.16Å; C614-Y669 HydrophobicContact CB-CE1 4.36Å; C614-Y669 WeakPolarHBondContact CB-OH 3.24Å; C614-Y669 VanDerWaalsContact SG-CE1 3.55Å
615	L	95.4	Very high	91.4	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	117.9	172.8	-56.9	-170.9	0	0	0	109.3	V574 W579 S603 H604 L606 A625 Y626 I627	V574-L615 HydrophobicContact CG2-CD1 4.24Å; V574-L615 HydrophobicContact CG2-CD2 3.98Å; W579-L615 HydrophobicContact CB-CD1 3.89Å; W579-L615 HydrophobicContact CG-CD1 4.33Å; S603-L615 CarbonylContact C-O 3.51Å; S603-L615 WeakPolarHBondContact CA-O 3.45Å; S603-L615 WeakPolarHBondContact CB-O 3.31Å; H604-L615 HydrophobicContact CB-CB 4.34Å; H604-L615 PolarHBondContact N-O 3.06Å; H604-L615 PolarHBondContact O-N 2.86Å; L606-L615 HydrophobicContact CD1-CD1 3.48Å; L606-L615 VanDerWaalsContact CD1-CD1 3.48Å; L606-L615 HydrophobicContact CD1-CG 4.02Å; L606-L615 HydrophobicContact CG-CD1 4.27Å; L606-L615 HydrophobicContact CG-CG 4.47Å; L615-A625 HydrophobicContact CB-CB 3.85Å; L615-Y626 CarbonylContact C-O 3.56Å; L615-Y626 WeakPolarHBondContact CA-O 3.39Å; L615-I627 HydrophobicContact CD2-CB 4.22Å; L615-I627 HydrophobicContact CD2-CG1 3.66Å; L615-I627 HydrophobicContact CD2-CG2 4.38Å
616	R	94.9	Very high	91.3	Very high	32 Å²	32	49 Å²	49	12%	0.121	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.2	175.7	-176	-172.2	-60.2	157.7	16.9	110.1	E593 F601 A625 Y626 Q628	E593-R616 IonicContact OE1-NH2 3.76Å; E593-R616 PolarHBondContact OE1-NH2 3.48Å; E593-R616 VanDerWaalsContact OE1-NH2 3.11Å; E593-R616 IonicContact OE2-CZ 2.87Å; E593-R616 IonicContact OE2-NE 2.68Å; E593-R616 PolarHBondContact OE2-NE 3.08Å; E593-R616 IonicContact OE2-NH2 3.98Å; E593-R616 PolarHBondContact OE2-NH2 3.04Å; F601-R616 HydrophobicContact CB-CG 3.7Å; F601-R616 HydrophobicContact CG-CG 4.33Å; R616-A625 CarbonylContact O-C 3.56Å; R616-A625 WeakPolarHBondContact O-CA 3.49Å; R616-A625 WeakPolarHBondContact O-CB 3.49Å; R616-Y626 PolarHBondContact N-O 2.71Å; R616-Y626 PolarHBondContact O-N 3.34Å; R616-Q628 HydrophobicContact CB-CG 3.41Å; R616-Q628 VanDerWaalsContact CB-CG 3.41Å; R616-Q628 HydrophobicContact CG-CG 4.49Å; R616-Q628 VanDerWaalsContact CZ-CD 3.41Å
617	E	94.4	Very high	91.2	Very high	82 Å²	82	49.8 Å²	49.8	38%	0.383	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	142.4	-179.3	-61.8	-170.1	-145.5	0	0	112	I576 P602 H604	I576-E617 HydrophobicContact CD1-CG 3.83Å; P602-E617 HydrophobicContact CB-CB 4.32Å; P602-E617 HydrophobicContact CB-CG 4.25Å; P602-E617 PolarHBondContact O-N 3.11Å; H604-E617 IonicContact CE1-OE1 3.66Å; H604-E617 IonicContact NE2-OE1 3.6Å; H604-E617 PolarHBondContact NE2-OE1 2.86Å
618	I	91.3	Very high	91	Very high	14 Å²	14	52.1 Å²	52.1	7%	0.072	29%	0.285	C	S	.	.			trans	-89.4	113.3	175.5	-53.9	-175.7	0	0	0	108.5	I573 S620 R621 F624 Y626	I573-I618 HydrophobicContact CD1-CD1 4.35Å; I573-I618 HydrophobicContact CG1-CD1 4.13Å; I573-I618 HydrophobicContact CG2-CD1 3.78Å; I618-S620 VanDerWaalsContact C-N 3.27Å; I618-S620 VanDerWaalsContact CG2-OG 3.27Å; I618-S620 WeakPolarHBondContact CG2-OG 3.23Å; I618-S620 PolarHBondContact O-N 3.44Å; I618-R621 HydrophobicContact CB-CB 4.24Å; I618-R621 HydrophobicContact CG2-CB 3.99Å; I618-R621 CarbonylContact O-C 3.03Å; I618-R621 PolarHBondContact O-N 3.04Å; I618-F624 HydrophobicContact CD1-CB 4.08Å; I618-F624 PolarHBondContact N-O 3.08Å; I618-Y626 HydrophobicContact CB-CE2 4.38Å; I618-Y626 HydrophobicContact CD1-CD1 4.3Å; I618-Y626 HydrophobicContact CD1-CD2 4.06Å; I618-Y626 HydrophobicContact CD1-CE1 4.13Å; I618-Y626 HydrophobicContact CD1-CE2 3.84Å; I618-Y626 HydrophobicContact CD1-CG 4.28Å; I618-Y626 HydrophobicContact CG1-CD2 3.64Å; I618-Y626 HydrophobicContact CG1-CE2 3.57Å; I618-Y626 HydrophobicContact CG1-CG 4.24Å; I618-Y626 HydrophobicContact CG2-CE2 4.23Å
619	A	84	Confident	90.9	Very high	107 Å²	107	52.5 Å²	52.5	88%	0.884	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-37.8	-178.2	0	0	0	0	0	112.8	R621	A619-R621 VanDerWaalsContact C-N 3.33Å; A619-R621 PolarHBondContact O-N 3.13Å
620	S	82.6	Confident	91	Very high	117 Å²	117	56.5 Å²	56.5	82%	0.818	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.3	178.6	60.4	0	0	0	0	114	I618	I618-S620 VanDerWaalsContact C-N 3.27Å; I618-S620 VanDerWaalsContact CG2-OG 3.27Å; I618-S620 WeakPolarHBondContact CG2-OG 3.23Å; I618-S620 PolarHBondContact O-N 3.44Å
621	R	86.1	Confident	91.2	Very high	126 Å²	126	54.6 Å²	54.6	48%	0.475	28%	0.279	S	S	.	.	S	Bend	trans	-138.7	89.9	-172.7	-164.2	-177.1	176.9	169.3	0.7	112.3	I618 A619 G623 F624	I618-R621 HydrophobicContact CB-CB 4.24Å; I618-R621 HydrophobicContact CG2-CB 3.99Å; I618-R621 CarbonylContact O-C 3.03Å; I618-R621 PolarHBondContact O-N 3.04Å; A619-R621 VanDerWaalsContact C-N 3.33Å; A619-R621 PolarHBondContact O-N 3.13Å; R621-G623 PolarHBondContact O-N 3.37Å; R621-F624 HydrophobicContact CB-CB 4.38Å; R621-F624 HydrophobicContact CG-CB 4.1Å; R621-F624 HydrophobicContact CG-CD2 3.55Å; R621-F624 HydrophobicContact CG-CE2 4.24Å; R621-F624 HydrophobicContact CG-CG 3.99Å; R621-F624 PolarHBondContact O-N 3.38Å; R621-F624 VanDerWaalsContact O-N 3.15Å
622	K	85.4	Confident	91.1	Very high	198 Å²	198	52.8 Å²	52.8	86%	0.861	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	130.3	177.9	-66.7	-172.6	179.1	-178.6	0	112
623	G	87.9	Confident	91	Very high	36 Å²	36	52.8 Å²	52.8	37%	0.371	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	1.3	179.2	0	0	0	0	0	115.4	N575 I576 R621	N575-G623 PolarHBondContact ND2-O 2.96Å; I576-G623 PolarHBondContact N-O 2.94Å; R621-G623 PolarHBondContact O-N 3.37Å
624	F	91.7	Very high	90.7	Very high	48 Å²	48	53.9 Å²	53.9	21%	0.211	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	149.4	175.2	-68.9	-99.6	0	0	0	111	I573 V574 N575 I618 R621	I573-F624 HydrophobicContact CG2-CB 4.29Å; I573-F624 HydrophobicContact CG2-CD1 4Å; V574-F624 CarbonylContact O-C 3.45Å; V574-F624 VanDerWaalsContact O-CA 3.3Å; V574-F624 WeakPolarHBondContact O-CA 3.49Å; N575-F624 HydrophobicContact CB-CD1 4.4Å; N575-F624 HydrophobicContact CB-CE1 4.14Å; I618-F624 HydrophobicContact CD1-CB 4.08Å; I618-F624 PolarHBondContact N-O 3.08Å; R621-F624 HydrophobicContact CB-CB 4.38Å; R621-F624 HydrophobicContact CG-CB 4.1Å; R621-F624 HydrophobicContact CG-CD2 3.55Å; R621-F624 HydrophobicContact CG-CE2 4.24Å; R621-F624 HydrophobicContact CG-CG 3.99Å; R621-F624 PolarHBondContact O-N 3.38Å; R621-F624 VanDerWaalsContact O-N 3.15Å
625	A	93.8	Very high	90.5	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.5	179.8	0	0	0	0	0	111.2	V574 I576 L615 R616	V574-A625 WeakPolarHBondContact CG2-O 3.21Å; V574-A625 PolarHBondContact N-O 3.35Å; V574-A625 PolarHBondContact O-N 2.98Å; I576-A625 HydrophobicContact CD1-CB 3.98Å; I576-A625 HydrophobicContact CG1-CB 3.53Å; L615-A625 HydrophobicContact CB-CB 3.85Å; R616-A625 CarbonylContact O-C 3.56Å; R616-A625 WeakPolarHBondContact O-CA 3.49Å; R616-A625 WeakPolarHBondContact O-CB 3.49Å
626	Y	93.6	Very high	90.3	Very high	41 Å²	41	56.1 Å²	56.1	16%	0.161	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	138.5	165.1	-63.5	-74.7	0	0	0	109.8	D568 K571 I573 L615 R616 I618 Q628	D568-Y626 PolarHBondContact OD2-OH 3.45Å; K571-Y626 HydrophobicContact CB-CD1 3.78Å; K571-Y626 HydrophobicContact CB-CE1 4.42Å; I573-Y626 HydrophobicContact CD1-CE1 4.03Å; I573-Y626 HydrophobicContact CG1-CD1 3.81Å; I573-Y626 HydrophobicContact CG1-CE1 3.69Å; L615-Y626 CarbonylContact C-O 3.56Å; L615-Y626 WeakPolarHBondContact CA-O 3.39Å; R616-Y626 PolarHBondContact N-O 2.71Å; R616-Y626 PolarHBondContact O-N 3.34Å; I618-Y626 HydrophobicContact CB-CE2 4.38Å; I618-Y626 HydrophobicContact CD1-CD1 4.3Å; I618-Y626 HydrophobicContact CD1-CD2 4.06Å; I618-Y626 HydrophobicContact CD1-CE1 4.13Å; I618-Y626 HydrophobicContact CD1-CE2 3.84Å; I618-Y626 HydrophobicContact CD1-CG 4.28Å; I618-Y626 HydrophobicContact CG1-CD2 3.64Å; I618-Y626 HydrophobicContact CG1-CE2 3.57Å; I618-Y626 HydrophobicContact CG1-CG 4.24Å; I618-Y626 HydrophobicContact CG2-CE2 4.23Å; Y626-Q628 PolarHBondContact O-N 2.97Å
627	I	92.3	Very high	90	Very high	18 Å²	18	57 Å²	57	9%	0.092	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	106.7	166.7	-53.4	177.8	0	0	0	108.5	E572 V574 W579 Y613 L615 R630	E572-I627 HydrophobicContact CB-CD1 4.02Å; E572-I627 HydrophobicContact CB-CG1 4.43Å; E572-I627 HydrophobicContact CG-CD1 4.01Å; E572-I627 PolarHBondContact O-N 2.83Å; E572-I627 VanDerWaalsContact O-N 3.11Å; E572-I627 WeakPolarHBondContact OE1-CD1 3.48Å; V574-I627 HydrophobicContact CG1-CD1 3.8Å; V574-I627 HydrophobicContact CG1-CG1 3.99Å; V574-I627 HydrophobicContact CG2-CG1 3.97Å; W579-I627 HydrophobicContact CH2-CD1 3.58Å; W579-I627 HydrophobicContact CZ2-CD1 3.43Å; W579-I627 VanDerWaalsContact CZ2-CD1 3.43Å; W579-I627 HydrophobicContact CZ2-CG1 4.48Å; W579-I627 HydrophobicContact CZ3-CD1 4.43Å; Y613-I627 HydrophobicContact CD1-CG2 4.49Å; L615-I627 HydrophobicContact CD2-CB 4.22Å; L615-I627 HydrophobicContact CD2-CG1 3.66Å; L615-I627 HydrophobicContact CD2-CG2 4.38Å; I627-R630 HydrophobicContact CG2-CG 3.94Å
628	Q	89.9	Confident	89.7	Confident	48 Å²	48	58.9 Å²	58.9	22%	0.224	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-35.6	-177.5	-68.3	-63.8	-43.2	0	0	113.4	C614 R616 Y626	C614-Q628 HydrophobicContact CB-CB 4.34Å; C614-Q628 PolarHBondContact O-N 2.99Å; R616-Q628 HydrophobicContact CB-CG 3.41Å; R616-Q628 VanDerWaalsContact CB-CG 3.41Å; R616-Q628 HydrophobicContact CG-CG 4.49Å; R616-Q628 VanDerWaalsContact CZ-CD 3.41Å; Y626-Q628 PolarHBondContact O-N 2.97Å
629	S	90.6	Very high	89.6	Confident	13 Å²	13	60 Å²	60	9%	0.091	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	151.8	179.1	70.7	0	0	0	0	112.4	Y613 C614 E667	Y613-S629 WeakPolarHBondContact CA-O 3.28Å; C614-S629 WeakPolarHBondContact CB-OG 3.45Å; C614-S629 PolarHBondContact N-O 2.95Å; C614-S629 VanDerWaalsContact N-O 3.16Å; S629-E667 WeakPolarHBondContact CB-OE1 3.29Å; S629-E667 PolarHBondContact OG-OE1 3.31Å; S629-E667 PolarHBondContact OG-OE2 2.69Å
630	R	93.2	Very high	89.8	Confident	129 Å²	129	57.2 Å²	57.2	49%	0.487	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	86.8	176.2	-60.4	-174.9	168.4	165.3	-2.8	108.4	E572 Y613 I627	E572-R630 VanDerWaalsContact CD-NH2 3.3Å; E572-R630 IonicContact OE1-NH2 3.7Å; E572-R630 IonicContact OE2-CZ 2.68Å; E572-R630 IonicContact OE2-NH1 2.65Å; E572-R630 IonicContact OE2-NH2 3.08Å; E572-R630 PolarHBondContact OE2-NH2 3.28Å; Y613-R630 HydrophobicContact CD1-CB 4.34Å; Y613-R630 HydrophobicContact CD1-CG 3.73Å; Y613-R630 HydrophobicContact CE1-CB 4.18Å; Y613-R630 HydrophobicContact CE1-CG 3.68Å; I627-R630 HydrophobicContact CG2-CG 3.94Å
631	Q	92.6	Very high	90	Very high	35 Å²	35	55.1 Å²	55.1	16%	0.164	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.4	-176	-60.4	-65.9	-8.6	0	0	110.6	H611 M612 F653 E667	H611-Q631 CarbonylContact C-O 3.28Å; H611-Q631 VanDerWaalsContact CA-O 3.3Å; H611-Q631 WeakPolarHBondContact CA-O 3.32Å; M612-Q631 PolarHBondContact N-O 3.29Å; M612-Q631 PolarHBondContact O-N 3.03Å; Q631-F653 HydrophobicContact CB-CD1 3.63Å; Q631-F653 HydrophobicContact CB-CE1 3.37Å; Q631-F653 HydrophobicContact CB-CE2 4.45Å; Q631-F653 HydrophobicContact CB-CG 4.25Å; Q631-F653 HydrophobicContact CB-CZ 3.86Å; Q631-F653 HydrophobicContact CG-CD1 3.9Å; Q631-F653 HydrophobicContact CG-CD2 3.98Å; Q631-F653 HydrophobicContact CG-CE1 3.71Å; Q631-F653 HydrophobicContact CG-CE2 3.85Å; Q631-F653 HydrophobicContact CG-CG 4.02Å; Q631-F653 HydrophobicContact CG-CZ 3.72Å; Q631-E667 WeakPolarHBondContact CG-OE1 3.47Å; Q631-E667 PolarHBondContact NE2-OE1 3.02Å
632	A	91.3	Very high	89.6	Confident	27 Å²	27	55.5 Å²	55.5	22%	0.223	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	137.5	170.4	0	0	0	0	0	109.8	S634 S635	A632-S634 PolarHBondContact O-N 3.06Å; A632-S635 PolarHBondContact O-N 3.26Å; A632-S635 VanDerWaalsContact O-N 3.11Å; A632-S635 PolarHBondContact O-OG 3.45Å
633	L	90.9	Very high	89.2	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-65.4	-27.6	177.7	-70.7	175	0	0	0	112.1	I607 T610 M612 S635 V636 Q684 I685 V688	I607-L633 HydrophobicContact CG2-CD1 4.11Å; T610-L633 WeakPolarHBondContact O-CB 3.3Å; T610-L633 PolarHBondContact O-N 3.41Å; M612-L633 HydrophobicContact CB-CD2 3.94Å; L633-S635 VanDerWaalsContact C-N 3.27Å; L633-S635 PolarHBondContact O-N 3.24Å; L633-V636 WeakPolarHBondContact O-CG2 3.3Å; L633-V636 PolarHBondContact O-N 3.16Å; L633-Q684 HydrophobicContact CD1-CB 4.39Å; L633-Q684 HydrophobicContact CD1-CG 3.66Å; L633-I685 HydrophobicContact CB-CG1 4.07Å; L633-I685 HydrophobicContact CD2-CG1 3.92Å; L633-I685 HydrophobicContact CG-CG1 4.49Å; L633-V688 HydrophobicContact CB-CG2 4.3Å; L633-V688 HydrophobicContact CD1-CG2 4.22Å
634	S	88.6	Confident	88.6	Confident	60 Å²	60	63.8 Å²	63.8	42%	0.42	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-68.8	-21.1	174.7	53.4	0	0	0	0	113.7	A632 V636	A632-S634 PolarHBondContact O-N 3.06Å; S634-V636 VanDerWaalsContact C-N 3.31Å
635	S	90.3	Very high	88	Confident	24 Å²	24	67 Å²	67	17%	0.168	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-85.1	-2.6	177.7	72.3	0	0	0	0	113	A632 L633 V637 F653 G654	A632-S635 PolarHBondContact O-N 3.26Å; A632-S635 VanDerWaalsContact O-N 3.11Å; A632-S635 PolarHBondContact O-OG 3.45Å; L633-S635 VanDerWaalsContact C-N 3.27Å; L633-S635 PolarHBondContact O-N 3.24Å; S635-V637 WeakPolarHBondContact O-CG2 3.27Å; S635-V637 PolarHBondContact O-N 3.14Å; S635-V637 VanDerWaalsContact O-N 3.09Å; S635-F653 CarbonylContact O-C 3.45Å; S635-F653 WeakPolarHBondContact O-CA 3.38Å; S635-G654 PolarHBondContact O-N 2.58Å
636	V	90.4	Very high	87.5	Confident	23 Å²	23	71 Å²	71	14%	0.139	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	104.5	178.7	-178.4	0	0	0	0	110	L633 S634 I639 F651 F653 I685	L633-V636 WeakPolarHBondContact O-CG2 3.3Å; L633-V636 PolarHBondContact O-N 3.16Å; S634-V636 VanDerWaalsContact C-N 3.31Å; V636-I639 HydrophobicContact CG1-CD1 4.05Å; V636-I639 HydrophobicContact CG1-CG1 3.67Å; V636-F651 HydrophobicContact CG1-CD1 4.45Å; V636-F653 HydrophobicContact CG2-CD1 3.75Å; V636-F653 HydrophobicContact CG2-CE1 3.46Å; V636-F653 VanDerWaalsContact CG2-CE1 3.46Å; V636-F653 HydrophobicContact CG2-CZ 4.5Å; V636-I685 HydrophobicContact CB-CD1 3.95Å; V636-I685 HydrophobicContact CG1-CD1 3.91Å; V636-I685 HydrophobicContact CG2-CD1 3.95Å; V636-I685 HydrophobicContact CG2-CG1 4.49Å
637	V	88.3	Confident	87.3	Confident	49 Å²	49	73.4 Å²	73.4	30%	0.297	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-31.6	-179.9	-166.8	0	0	0	0	112.1	S635 K652 G654 V661	S635-V637 WeakPolarHBondContact O-CG2 3.27Å; S635-V637 PolarHBondContact O-N 3.14Å; S635-V637 VanDerWaalsContact O-N 3.09Å; V637-K652 PolarHBondContact N-O 3.25Å; V637-G654 WeakPolarHBondContact CG2-O 3.43Å; V637-V661 HydrophobicContact CB-CG1 4.03Å; V637-V661 HydrophobicContact CG1-CB 4.23Å; V637-V661 HydrophobicContact CG1-CG1 3.41Å; V637-V661 VanDerWaalsContact CG1-CG1 3.41Å; V637-V661 HydrophobicContact CG1-CG2 3.74Å; V637-V661 HydrophobicContact CG2-CG1 4.22Å
638	K	88.2	Confident	87.2	Confident	122 Å²	122	73.9 Å²	73.9	53%	0.53	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	136.7	-179.2	-158.2	178.2	-176	168.8	0	112.7	T640 K652	K638-T640 HydrophobicContact CD-CG2 3.83Å; K638-T640 HydrophobicContact CG-CG2 3.86Å; K638-K652 HydrophobicContact CB-CB 4.15Å; K638-K652 HydrophobicContact CB-CD 4.37Å; K638-K652 HydrophobicContact CB-CG 4.48Å; K638-K652 PolarHBondContact N-O 3.03Å; K638-K652 PolarHBondContact O-N 3.29Å
639	I	90.1	Very high	87.3	Confident	38 Å²	38	71.8 Å²	71.8	20%	0.195	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.1	169.5	-52.1	174.7	0	0	0	107.7	V636 I649 T650 F651 K682 I685	V636-I639 HydrophobicContact CG1-CD1 4.05Å; V636-I639 HydrophobicContact CG1-CG1 3.67Å; I639-I649 HydrophobicContact CG2-CG2 3.71Å; I639-T650 WeakPolarHBondContact CA-O 3.24Å; I639-F651 HydrophobicContact CD1-CD1 4.04Å; I639-F651 HydrophobicContact CD1-CE1 3.75Å; I639-F651 HydrophobicContact CG1-CD1 3.74Å; I639-F651 HydrophobicContact CG1-CE1 3.91Å; I639-F651 HydrophobicContact CG2-CD1 4.25Å; I639-F651 HydrophobicContact CG2-CE1 4Å; I639-F651 HydrophobicContact CG2-CZ 4.42Å; I639-K682 HydrophobicContact CD1-CG 3.91Å; I639-I685 HydrophobicContact CD1-CD1 3.9Å
640	T	87.9	Confident	87.4	Confident	48 Å²	48	71.9 Å²	71.9	29%	0.294	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.8	-179.3	57.3	0	0	0	0	111.6	K638 T650	K638-T640 HydrophobicContact CD-CG2 3.83Å; K638-T640 HydrophobicContact CG-CG2 3.86Å; T640-T650 PolarHBondContact N-O 2.89Å; T640-T650 PolarHBondContact O-N 3.46Å; T640-T650 WeakPolarHBondContact OG1-CB 3.3Å
641	S	87.6	Confident	87.4	Confident	74 Å²	74	65.7 Å²	65.7	52%	0.517	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.2	170.9	64.8	0	0	0	0	109.8	L648	S641-L648 WeakPolarHBondContact CA-O 3.4Å
642	K	77.9	Confident	87.3	Confident	133 Å²	133	67 Å²	67	58%	0.578	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	133.5	176.7	-72.2	-170.5	178	179.5	0	109.8	K644 H645 L648	K642-K644 PolarHBondContact O-N 2.98Å; K642-K644 VanDerWaalsContact O-N 3.17Å; K642-H645 HydrophobicContact CB-CB 4.43Å; K642-H645 CarbonylContact O-C 3.02Å; K642-H645 PolarHBondContact O-N 2.93Å; K642-H645 VanDerWaalsContact O-O 3.08Å; K642-L648 HydrophobicContact CD-CD2 4.35Å
643	K	75.6	Confident	87.3	Confident	218 Å²	218	65.8 Å²	65.8	95%	0.948	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-35.6	178.1	-74.2	-173.8	178.6	-179.6	0	113.8
644	K	75.8	Confident	87.1	Confident	190 Å²	190	66 Å²	66	83%	0.826	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-21.2	178	-66.6	-171.1	176.5	-176.5	0	113.6	K642	K642-K644 PolarHBondContact O-N 2.98Å; K642-K644 VanDerWaalsContact O-N 3.17Å
645	H	80.1	Confident	86.6	Confident	117 Å²	117	66.8 Å²	66.8	54%	0.542	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	77.5	-179.2	-64.2	-70.6	0	0	0	109.1	K642 E647 L648	K642-H645 HydrophobicContact CB-CB 4.43Å; K642-H645 CarbonylContact O-C 3.02Å; K642-H645 PolarHBondContact O-N 2.93Å; K642-H645 VanDerWaalsContact O-O 3.08Å; H645-E647 PolarHBondContact O-N 3.17Å; H645-L648 HydrophobicContact CB-CB 4.2Å; H645-L648 PolarHBondContact O-N 2.96Å; H645-L648 VanDerWaalsContact O-N 3.1Å
646	P	83.1	Confident	85.6	Confident	83 Å²	83	71.6 Å²	71.6	54%	0.539	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	-21.3	-176.5	26.2	-34.5	0	0	0	112.9	L648 I649 A674	P646-L648 VanDerWaalsContact C-N 3.33Å; P646-I649 WeakPolarHBondContact O-CD1 3.5Å; P646-A674 WeakPolarHBondContact O-CB 3.38Å
647	E	88.1	Confident	84.6	Confident	92 Å²	92	75.2 Å²	75.2	43%	0.43	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-19.8	175.9	-65.7	-176.5	-162	0	0	113.7	H645 I649 L670 I671	H645-E647 PolarHBondContact O-N 3.17Å; E647-I649 PolarHBondContact O-N 3.33Å; E647-L670 HydrophobicContact CB-CD1 3.91Å; E647-L670 WeakPolarHBondContact O-CA 3.39Å; E647-I671 WeakPolarHBondContact CB-O 3.34Å; E647-I671 PolarHBondContact O-N 2.71Å
648	L	90.7	Very high	83.1	Confident	27 Å²	27	79.6 Å²	79.6	14%	0.141	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	103.8	176.8	-175.6	68.4	0	0	0	109.9	V594 S641 K642 H645 P646 Y669 L670	V594-L648 HydrophobicContact CB-CD1 4.28Å; V594-L648 HydrophobicContact CG2-CD1 3.77Å; S641-L648 WeakPolarHBondContact CA-O 3.4Å; K642-L648 HydrophobicContact CD-CD2 4.35Å; H645-L648 HydrophobicContact CB-CB 4.2Å; H645-L648 PolarHBondContact O-N 2.96Å; H645-L648 VanDerWaalsContact O-N 3.1Å; P646-L648 VanDerWaalsContact C-N 3.33Å; L648-Y669 WeakPolarHBondContact CA-O 3.46Å; L648-L670 HydrophobicContact CB-CD1 4.33Å
649	I	93.2	Very high	81.5	Confident	5 Å²	5	78.8 Å²	78.8	3%	0.026	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.6	179.7	-54.8	-54	0	0	0	109.7	I639 P646 E647 F651 R668 Y669 I671 A674 T678	I639-I649 HydrophobicContact CG2-CG2 3.71Å; P646-I649 WeakPolarHBondContact O-CD1 3.5Å; E647-I649 PolarHBondContact O-N 3.33Å; I649-F651 HydrophobicContact CB-CE2 4.2Å; I649-F651 HydrophobicContact CG2-CD2 4Å; I649-F651 HydrophobicContact CG2-CE1 4.45Å; I649-F651 HydrophobicContact CG2-CE2 3.42Å; I649-F651 VanDerWaalsContact CG2-CE2 3.42Å; I649-F651 HydrophobicContact CG2-CZ 3.68Å; I649-R668 CarbonylContact O-C 3.58Å; I649-R668 WeakPolarHBondContact O-CA 3.48Å; I649-Y669 PolarHBondContact N-O 2.88Å; I649-Y669 PolarHBondContact O-N 3.23Å; I649-I671 HydrophobicContact CB-CD1 4.23Å; I649-I671 HydrophobicContact CG1-CD1 4.11Å; I649-A674 HydrophobicContact CD1-CB 3.92Å; I649-A674 HydrophobicContact CG1-CB 3.85Å; I649-T678 HydrophobicContact CB-CG2 4.44Å; I649-T678 HydrophobicContact CD1-CG2 3.83Å; I649-T678 HydrophobicContact CG1-CG2 3.76Å; I649-T678 HydrophobicContact CG2-CG2 3.86Å
650	T	92.1	Very high	80.4	Confident	14 Å²	14	78.9 Å²	78.9	9%	0.086	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	120.6	174.9	-56.4	0	0	0	0	109.5	I639 T640 V666 E667 R668	I639-T650 WeakPolarHBondContact CA-O 3.24Å; T640-T650 PolarHBondContact N-O 2.89Å; T640-T650 PolarHBondContact O-N 3.46Å; T640-T650 WeakPolarHBondContact OG1-CB 3.3Å; T650-V666 HydrophobicContact CG2-CG1 3.6Å; T650-E667 CarbonylContact C-O 3.56Å; T650-E667 WeakPolarHBondContact CA-O 3.35Å; T650-R668 HydrophobicContact CG2-CG 3.91Å
651	F	93.1	Very high	79.8	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134.6	172	-62.8	-93.8	0	0	0	109.3	M612 V636 I639 I649 F653 V666 E667 Y669 I681	M612-F651 HydrophobicContact CE-CD1 4.47Å; M612-F651 HydrophobicContact CE-CD2 4.4Å; M612-F651 HydrophobicContact CE-CG 4.27Å; V636-F651 HydrophobicContact CG1-CD1 4.45Å; I639-F651 HydrophobicContact CD1-CD1 4.04Å; I639-F651 HydrophobicContact CD1-CE1 3.75Å; I639-F651 HydrophobicContact CG1-CD1 3.74Å; I639-F651 HydrophobicContact CG1-CE1 3.91Å; I639-F651 HydrophobicContact CG2-CD1 4.25Å; I639-F651 HydrophobicContact CG2-CE1 4Å; I639-F651 HydrophobicContact CG2-CZ 4.42Å; I649-F651 HydrophobicContact CB-CE2 4.2Å; I649-F651 HydrophobicContact CG2-CD2 4Å; I649-F651 HydrophobicContact CG2-CE1 4.45Å; I649-F651 HydrophobicContact CG2-CE2 3.42Å; I649-F651 VanDerWaalsContact CG2-CE2 3.42Å; I649-F651 HydrophobicContact CG2-CZ 3.68Å; F651-F653 HydrophobicContact CB-CE1 4.46Å; F651-F653 HydrophobicContact CB-CE2 3.65Å; F651-F653 HydrophobicContact CB-CZ 3.55Å; F651-F653 HydrophobicContact CG-CZ 4.31Å; F651-V666 WeakPolarHBondContact O-CA 3.49Å; F651-E667 PolarHBondContact N-O 2.85Å; F651-E667 PolarHBondContact O-N 3.18Å; F651-Y669 AromaticContact CD2-CD2 3.75Å; F651-Y669 HydrophobicContact CD2-CD2 3.75Å; F651-Y669 HydrophobicContact CD2-CE2 4.08Å; F651-Y669 AromaticContact CE2-CD2 3.91Å; F651-Y669 HydrophobicContact CE2-CD2 3.91Å; F651-I681 HydrophobicContact CE1-CD1 4.35Å; F651-I681 HydrophobicContact CE1-CG2 3.92Å; F651-I681 HydrophobicContact CZ-CD1 3.82Å; F651-I681 HydrophobicContact CZ-CG2 4.47Å
652	K	90.4	Very high	79.5	Confident	63 Å²	63	83.2 Å²	83.2	27%	0.274	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.4	172.6	-60.5	-169.7	167	-158.7	0	108.6	V637 K638 I663 A665 V666	V637-K652 PolarHBondContact N-O 3.25Å; K638-K652 HydrophobicContact CB-CB 4.15Å; K638-K652 HydrophobicContact CB-CD 4.37Å; K638-K652 HydrophobicContact CB-CG 4.48Å; K638-K652 PolarHBondContact N-O 3.03Å; K638-K652 PolarHBondContact O-N 3.29Å; K652-I663 HydrophobicContact CB-CG2 4.39Å; K652-I663 HydrophobicContact CD-CD1 3.91Å; K652-A665 WeakPolarHBondContact CA-O 3.27Å; K652-V666 HydrophobicContact CG-CG1 4.35Å; K652-V666 HydrophobicContact CG-CG2 4.18Å
653	F	90.7	Very high	79.9	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	149.8	178.5	-51.2	-88.4	0	0	0	110.1	M612 Q631 S635 V636 F651 I663 S664 A665 E667	M612-F653 HydrophobicContact CE-CE1 4.08Å; M612-F653 HydrophobicContact CE-CE2 4.46Å; M612-F653 HydrophobicContact CE-CZ 3.44Å; M612-F653 VanDerWaalsContact CE-CZ 3.44Å; Q631-F653 HydrophobicContact CB-CD1 3.63Å; Q631-F653 HydrophobicContact CB-CE1 3.37Å; Q631-F653 HydrophobicContact CB-CE2 4.45Å; Q631-F653 HydrophobicContact CB-CG 4.25Å; Q631-F653 HydrophobicContact CB-CZ 3.86Å; Q631-F653 HydrophobicContact CG-CD1 3.9Å; Q631-F653 HydrophobicContact CG-CD2 3.98Å; Q631-F653 HydrophobicContact CG-CE1 3.71Å; Q631-F653 HydrophobicContact CG-CE2 3.85Å; Q631-F653 HydrophobicContact CG-CG 4.02Å; Q631-F653 HydrophobicContact CG-CZ 3.72Å; S635-F653 CarbonylContact O-C 3.45Å; S635-F653 WeakPolarHBondContact O-CA 3.38Å; V636-F653 HydrophobicContact CG2-CD1 3.75Å; V636-F653 HydrophobicContact CG2-CE1 3.46Å; V636-F653 VanDerWaalsContact CG2-CE1 3.46Å; V636-F653 HydrophobicContact CG2-CZ 4.5Å; F651-F653 HydrophobicContact CB-CE1 4.46Å; F651-F653 HydrophobicContact CB-CE2 3.65Å; F651-F653 HydrophobicContact CB-CZ 3.55Å; F651-F653 HydrophobicContact CG-CZ 4.31Å; F653-I663 CarbonylContact O-C 3.51Å; F653-I663 WeakPolarHBondContact O-CA 3.31Å; F653-S664 PolarHBondContact O-N 3.05Å; F653-S664 PolarHBondContact O-OG 3.36Å; F653-A665 HydrophobicContact CB-CB 4.31Å; F653-A665 HydrophobicContact CD2-CB 4.08Å; F653-A665 PolarHBondContact N-O 3.14Å; F653-A665 PolarHBondContact O-N 3.4Å; F653-E667 HydrophobicContact CD2-CG 4.38Å; F653-E667 HydrophobicContact CE2-CB 3.99Å; F653-E667 HydrophobicContact CE2-CG 3.78Å
654	G	86.6	Confident	80.3	Confident	5 Å²	5	74.8 Å²	74.8	5%	0.052	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-174.7	-174.9	0	0	0	0	0	113.2	S635 V637 E662	S635-G654 PolarHBondContact O-N 2.58Å; V637-G654 WeakPolarHBondContact CG2-O 3.43Å; G654-E662 WeakPolarHBondContact CA-O 3.41Å
655	T	79.1	Confident	80.7	Confident	77 Å²	77	67 Å²	67	47%	0.472	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.2	174.1	51.1	0	0	0	0	109.4	E662	T655-E662 PolarHBondContact N-O 3.49Å; T655-E662 PolarHBondContact O-N 2.85Å
656	N	69.8	Low	81.2	Confident	125 Å²	125	64 Å²	64	67%	0.668	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	97.5	177.9	-169.1	16.7	0	0	0	108.6
657	N	67.9	Low	81.7	Confident	99 Å²	99	61.1 Å²	61.1	53%	0.529	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	161.3	178.2	-75.5	-6.9	0	0	0	110.6	A659 G660	N657-A659 PolarHBondContact O-N 3.34Å; N657-G660 PolarHBondContact N-O 2.93Å; N657-G660 PolarHBondContact O-N 3.45Å
658	S	57.6	Low	82	Confident	141 Å²	141	60.4 Å²	60.4	99%	0.986	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-12	-178.6	53	0	0	0	0	115.2
659	A	55.1	Low	82.1	Confident	105 Å²	105	59.1 Å²	59.1	87%	0.868	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-6.3	177.3	0	0	0	0	0	114.3	N657	N657-A659 PolarHBondContact O-N 3.34Å
660	G	65.6	Low	82.1	Confident	41 Å²	41	61.1 Å²	61.1	42%	0.423	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	139.2	173.1	-178.2	0	0	0	0	0	113.7	N657	N657-G660 PolarHBondContact N-O 2.93Å; N657-G660 PolarHBondContact O-N 3.45Å
661	V	75.8	Confident	82.2	Confident	77 Å²	77	60.5 Å²	60.5	47%	0.467	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	116.6	176.4	171.1	0	0	0	0	109.8	V637 I663	V637-V661 HydrophobicContact CB-CG1 4.03Å; V637-V661 HydrophobicContact CG1-CB 4.23Å; V637-V661 HydrophobicContact CG1-CG1 3.41Å; V637-V661 VanDerWaalsContact CG1-CG1 3.41Å; V637-V661 HydrophobicContact CG1-CG2 3.74Å; V637-V661 HydrophobicContact CG2-CG1 4.22Å; V661-I663 HydrophobicContact CG1-CG1 4.21Å
662	E	81.2	Confident	81.7	Confident	136 Å²	136	64.1 Å²	64.1	64%	0.636	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.1	172.2	-169.4	173.8	-175.2	0	0	109.3	G654 T655	G654-E662 WeakPolarHBondContact CA-O 3.41Å; T655-E662 PolarHBondContact N-O 3.49Å; T655-E662 PolarHBondContact O-N 2.85Å
663	I	86	Confident	81.4	Confident	79 Å²	79	66.8 Å²	66.8	41%	0.405	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	116.7	-176.8	-61.1	164	0	0	0	108.5	K652 F653 V661 V666	K652-I663 HydrophobicContact CB-CG2 4.39Å; K652-I663 HydrophobicContact CD-CD1 3.91Å; F653-I663 CarbonylContact O-C 3.51Å; F653-I663 WeakPolarHBondContact O-CA 3.31Å; V661-I663 HydrophobicContact CG1-CG1 4.21Å; I663-V666 HydrophobicContact CG2-CG2 3.69Å
664	S	83.6	Confident	81.2	Confident	95 Å²	95	67.2 Å²	67.2	66%	0.664	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	-31.4	176.7	59.4	0	0	0	0	113.2	F653	F653-S664 PolarHBondContact O-N 3.05Å; F653-S664 PolarHBondContact O-OG 3.36Å
665	A	85.8	Confident	81	Confident	26 Å²	26	69.6 Å²	69.6	22%	0.215	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	150	-179.7	0	0	0	0	0	112.7	K652 F653	K652-A665 WeakPolarHBondContact CA-O 3.27Å; F653-A665 HydrophobicContact CB-CB 4.31Å; F653-A665 HydrophobicContact CD2-CB 4.08Å; F653-A665 PolarHBondContact N-O 3.14Å; F653-A665 PolarHBondContact O-N 3.4Å
666	V	90.6	Very high	81.3	Confident	54 Å²	54	71.2 Å²	71.2	33%	0.327	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	117.4	174.4	-176.9	0	0	0	0	109.3	T650 F651 K652 I663	T650-V666 HydrophobicContact CG2-CG1 3.6Å; F651-V666 WeakPolarHBondContact O-CA 3.49Å; K652-V666 HydrophobicContact CG-CG1 4.35Å; K652-V666 HydrophobicContact CG-CG2 4.18Å; I663-V666 HydrophobicContact CG2-CG2 3.69Å
667	E	92.6	Very high	82.1	Confident	23 Å²	23	65.7 Å²	65.7	11%	0.107	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.9	-178.9	-59.9	176.6	-178.2	0	0	109.8	S629 Q631 T650 F651 F653 Y669	S629-E667 WeakPolarHBondContact CB-OE1 3.29Å; S629-E667 PolarHBondContact OG-OE1 3.31Å; S629-E667 PolarHBondContact OG-OE2 2.69Å; Q631-E667 WeakPolarHBondContact CG-OE1 3.47Å; Q631-E667 PolarHBondContact NE2-OE1 3.02Å; T650-E667 CarbonylContact C-O 3.56Å; T650-E667 WeakPolarHBondContact CA-O 3.35Å; F651-E667 PolarHBondContact N-O 2.85Å; F651-E667 PolarHBondContact O-N 3.18Å; F653-E667 HydrophobicContact CD2-CG 4.38Å; F653-E667 HydrophobicContact CE2-CB 3.99Å; F653-E667 HydrophobicContact CE2-CG 3.78Å; E667-Y669 HydrophobicContact CB-CE2 3.57Å; E667-Y669 PolarHBondContact OE2-OH 3.35Å
668	R	93.7	Very high	83	Confident	76 Å²	76	62 Å²	62	29%	0.287	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.7	-176.2	-57.2	-179.4	179.5	97.7	-3.7	109.9	V594 E596 I649 T650	V594-R668 HydrophobicContact CB-CB 4.13Å; V594-R668 PolarHBondContact N-O 3.22Å; E596-R668 IonicContact OE1-CZ 2.8Å; E596-R668 IonicContact OE1-NH1 3.57Å; E596-R668 PolarHBondContact OE1-NH1 3.09Å; E596-R668 IonicContact OE1-NH2 3.82Å; I649-R668 CarbonylContact O-C 3.58Å; I649-R668 WeakPolarHBondContact O-CA 3.48Å; T650-R668 HydrophobicContact CG2-CG 3.91Å
669	Y	94.4	Very high	84.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.6	-176.9	-59.4	-75.8	0	0	0	111.1	N592 E593 L605 M612 C614 L648 I649 F651 E667	N592-Y669 CarbonylContact O-C 3.58Å; N592-Y669 WeakPolarHBondContact O-CA 3.48Å; E593-Y669 HydrophobicContact CB-CD1 4.13Å; E593-Y669 HydrophobicContact CB-CE1 3.93Å; E593-Y669 HydrophobicContact CG-CD1 4.39Å; E593-Y669 HydrophobicContact CG-CE1 3.88Å; L605-Y669 HydrophobicContact CD1-CD1 4.23Å; L605-Y669 HydrophobicContact CD1-CD2 3.95Å; L605-Y669 HydrophobicContact CD1-CE2 4.34Å; L605-Y669 HydrophobicContact CD1-CG 3.88Å; L605-Y669 HydrophobicContact CD2-CD1 4.41Å; L605-Y669 HydrophobicContact CD2-CD2 4.41Å; L605-Y669 HydrophobicContact CD2-CE1 4Å; L605-Y669 HydrophobicContact CD2-CE2 3.98Å; L605-Y669 HydrophobicContact CG-CD1 4.36Å; L605-Y669 HydrophobicContact CG-CE1 4.41Å; L605-Y669 HydrophobicContact CG-CG 4.5Å; M612-Y669 HydrophobicContact CE-CE2 4.39Å; C614-Y669 HydrophobicContact CB-CE1 4.36Å; C614-Y669 WeakPolarHBondContact CB-OH 3.24Å; C614-Y669 VanDerWaalsContact SG-CE1 3.55Å; L648-Y669 WeakPolarHBondContact CA-O 3.46Å; I649-Y669 PolarHBondContact N-O 2.88Å; I649-Y669 PolarHBondContact O-N 3.23Å; F651-Y669 AromaticContact CD2-CD2 3.75Å; F651-Y669 HydrophobicContact CD2-CD2 3.75Å; F651-Y669 HydrophobicContact CD2-CE2 4.08Å; F651-Y669 AromaticContact CE2-CD2 3.91Å; F651-Y669 HydrophobicContact CE2-CD2 3.91Å; E667-Y669 HydrophobicContact CB-CE2 3.57Å; E667-Y669 PolarHBondContact OE2-OH 3.35Å
670	L	92.5	Very high	86.2	Confident	47 Å²	47	57.9 Å²	57.9	25%	0.246	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	111.9	166.1	-169.2	73.8	0	0	0	108.4	C591 N592 V594 M600 E647 L648	C591-L670 WeakPolarHBondContact CA-O 3.49Å; C591-L670 WeakPolarHBondContact CB-O 3.4Å; N592-L670 HydrophobicContact CB-CB 4.28Å; N592-L670 PolarHBondContact N-O 3.33Å; N592-L670 PolarHBondContact O-N 3.36Å; V594-L670 HydrophobicContact CG2-CB 4.18Å; M600-L670 HydrophobicContact SD-CD2 3.99Å; E647-L670 HydrophobicContact CB-CD1 3.91Å; E647-L670 WeakPolarHBondContact O-CA 3.39Å; L648-L670 HydrophobicContact CB-CD1 4.33Å
671	I	93.6	Very high	87.3	Confident	1 Å²	1	56 Å²	56	1%	0.005	32%	0.318	C	S	.	.			trans	-117.2	113.7	-173.9	-55.1	176.9	0	0	0	108.9	I589 C591 L605 E647 I649 N673 A674 A677	I589-I671 HydrophobicContact CG2-CG2 3.68Å; C591-I671 HydrophobicContact CB-CG1 3.98Å; L605-I671 HydrophobicContact CD1-CD1 4.08Å; E647-I671 WeakPolarHBondContact CB-O 3.34Å; E647-I671 PolarHBondContact O-N 2.71Å; I649-I671 HydrophobicContact CB-CD1 4.23Å; I649-I671 HydrophobicContact CG1-CD1 4.11Å; I671-N673 VanDerWaalsContact C-N 3.27Å; I671-N673 PolarHBondContact O-N 3.48Å; I671-A674 HydrophobicContact CB-CB 4.14Å; I671-A674 PolarHBondContact O-N 3.35Å; I671-A674 WeakPolarHBondContact O-CB 3.5Å; I671-A674 VanDerWaalsContact O-N 3.13Å; I671-A677 HydrophobicContact CG2-CB 3.66Å
672	P	82.4	Confident	88	Confident	77 Å²	77	57.3 Å²	57.3	50%	0.5	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.6	-175.7	-27.9	34.9	0	0	0	114.7
673	N	84.6	Confident	88.4	Confident	119 Å²	119	55.7 Å²	55.7	64%	0.636	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	52.6	175.3	-69.4	-33.7	0	0	0	111.3	I671 G675 D676 A677	I671-N673 VanDerWaalsContact C-N 3.27Å; I671-N673 PolarHBondContact O-N 3.48Å; N673-G675 VanDerWaalsContact O-N 3.1Å; N673-G675 PolarHBondContact O-N 3.34Å; N673-D676 PolarHBondContact O-N 3.07Å; N673-A677 WeakPolarHBondContact O-CB 3.42Å; N673-A677 PolarHBondContact O-N 3.4Å
674	A	85.9	Confident	88.7	Confident	8 Å²	8	52.3 Å²	52.3	7%	0.066	29%	0.293	C	S	.	.	H	α-helix	trans	-55.9	-31.3	-171.5	0	0	0	0	0	114.7	P646 I649 I671 T678	P646-A674 WeakPolarHBondContact O-CB 3.38Å; I649-A674 HydrophobicContact CD1-CB 3.92Å; I649-A674 HydrophobicContact CG1-CB 3.85Å; I671-A674 HydrophobicContact CB-CB 4.14Å; I671-A674 PolarHBondContact O-N 3.35Å; I671-A674 WeakPolarHBondContact O-CB 3.5Å; I671-A674 VanDerWaalsContact O-N 3.13Å; A674-T678 VanDerWaalsContact O-CB 3.29Å; A674-T678 WeakPolarHBondContact O-CB 3.42Å; A674-T678 VanDerWaalsContact O-CG2 3.25Å; A674-T678 WeakPolarHBondContact O-CG2 3.22Å; A674-T678 PolarHBondContact O-N 3.24Å; A674-T678 PolarHBondContact O-OG1 3.37Å
675	G	82.8	Confident	88.9	Confident	55 Å²	55	48.4 Å²	48.4	57%	0.567	27%	0.265	S	S	*	.	H	α-helix	trans	-61.8	-52	177.8	0	0	0	0	0	113	N673 T678 K679	N673-G675 VanDerWaalsContact O-N 3.1Å; N673-G675 PolarHBondContact O-N 3.34Å; G675-T678 PolarHBondContact O-OG1 3.31Å; G675-K679 WeakPolarHBondContact O-CB 3.35Å; G675-K679 PolarHBondContact O-N 2.88Å; G675-K679 VanDerWaalsContact O-N 3.15Å
676	D	85.3	Confident	89.1	Confident	112 Å²	112	52.1 Å²	52.1	60%	0.599	28%	0.279	S	S	*	.	H	α-helix	trans	-72.1	-41.7	179.8	-68.1	-31	0	0	0	111.4	N673 T678 K679 V680	N673-D676 PolarHBondContact O-N 3.07Å; D676-T678 PolarHBondContact O-N 3.3Å; D676-K679 PolarHBondContact O-N 2.92Å; D676-V680 WeakPolarHBondContact O-CG2 3.09Å; D676-V680 PolarHBondContact O-N 3.22Å
677	A	86.7	Confident	89	Confident	9 Å²	9	55.6 Å²	55.6	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-58.5	-49	177.1	0	0	0	0	0	112.1	I589 I671 N673 K679 V680 I681	I589-A677 HydrophobicContact CD1-CB 3.87Å; I589-A677 HydrophobicContact CG1-CB 4.38Å; I589-A677 HydrophobicContact CG2-CB 4.16Å; I671-A677 HydrophobicContact CG2-CB 3.66Å; N673-A677 WeakPolarHBondContact O-CB 3.42Å; N673-A677 PolarHBondContact O-N 3.4Å; A677-K679 VanDerWaalsContact C-N 3.35Å; A677-K679 PolarHBondContact O-N 3.13Å; A677-V680 PolarHBondContact O-N 2.83Å; A677-I681 WeakPolarHBondContact O-CG1 3.43Å; A677-I681 PolarHBondContact O-N 2.88Å; A677-I681 VanDerWaalsContact O-CG1 3.26Å
678	T	87.9	Confident	88.8	Confident	21 Å²	21	55.2 Å²	55.2	13%	0.129	29%	0.288	C	S	.	.	H	α-helix	trans	-69.9	-31.6	179.2	55.3	0	0	0	0	112.7	I649 A674 G675 D676 K682	I649-T678 HydrophobicContact CB-CG2 4.44Å; I649-T678 HydrophobicContact CD1-CG2 3.83Å; I649-T678 HydrophobicContact CG1-CG2 3.76Å; I649-T678 HydrophobicContact CG2-CG2 3.86Å; A674-T678 VanDerWaalsContact O-CB 3.29Å; A674-T678 WeakPolarHBondContact O-CB 3.42Å; A674-T678 VanDerWaalsContact O-CG2 3.25Å; A674-T678 WeakPolarHBondContact O-CG2 3.22Å; A674-T678 PolarHBondContact O-N 3.24Å; A674-T678 PolarHBondContact O-OG1 3.37Å; G675-T678 PolarHBondContact O-OG1 3.31Å; D676-T678 PolarHBondContact O-N 3.3Å; T678-K682 VanDerWaalsContact O-CB 3.27Å; T678-K682 WeakPolarHBondContact O-CB 3.5Å; T678-K682 WeakPolarHBondContact O-CG 3.45Å; T678-K682 PolarHBondContact O-N 3.47Å
679	K	88.5	Confident	88.3	Confident	125 Å²	125	54.6 Å²	54.6	54%	0.543	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-46.6	173.4	-176.9	-179.9	179	-176.7	0	111.1	G675 D676 A677 K682 Q683	G675-K679 WeakPolarHBondContact O-CB 3.35Å; G675-K679 PolarHBondContact O-N 2.88Å; G675-K679 VanDerWaalsContact O-N 3.15Å; D676-K679 PolarHBondContact O-N 2.92Å; A677-K679 VanDerWaalsContact C-N 3.35Å; A677-K679 PolarHBondContact O-N 3.13Å; K679-K682 PolarHBondContact O-N 3.31Å; K679-Q683 PolarHBondContact O-N 2.8Å; K679-Q683 WeakPolarHBondContact O-CG 3.41Å; K679-Q683 VanDerWaalsContact O-CG 3.3Å; K679-Q683 WeakPolarHBondContact O-CB 3.46Å
680	V	89.8	Confident	87.9	Confident	35 Å²	35	58.8 Å²	58.8	21%	0.212	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-47	178.5	167.3	0	0	0	0	111.5	H587 D676 A677 K682 Q683 Q684	H587-V680 HydrophobicContact CB-CG1 4.01Å; H587-V680 WeakPolarHBondContact CD2-CG1 3.31Å; H587-V680 VanDerWaalsContact CE1-CG1 3.5Å; H587-V680 WeakPolarHBondContact CE1-CG1 3.44Å; H587-V680 WeakPolarHBondContact ND1-CG1 3.29Å; H587-V680 VanDerWaalsContact NE2-CG1 3.31Å; H587-V680 WeakPolarHBondContact NE2-CG1 3.41Å; D676-V680 WeakPolarHBondContact O-CG2 3.09Å; D676-V680 PolarHBondContact O-N 3.22Å; A677-V680 PolarHBondContact O-N 2.83Å; V680-K682 PolarHBondContact O-N 2.9Å; V680-Q683 PolarHBondContact O-N 3.17Å; V680-Q684 PolarHBondContact O-N 3.17Å
681	I	90.6	Very high	87.3	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-45.4	177.9	-66.5	165.4	0	0	0	110.6	I589 I607 F651 A677 Q683 Q684 I685	I589-I681 HydrophobicContact CD1-CD1 3.85Å; I589-I681 HydrophobicContact CD1-CG1 4.14Å; I607-I681 HydrophobicContact CD1-CD1 4.23Å; I607-I681 HydrophobicContact CD1-CG1 3.86Å; I607-I681 HydrophobicContact CG1-CG1 3.97Å; F651-I681 HydrophobicContact CE1-CD1 4.35Å; F651-I681 HydrophobicContact CE1-CG2 3.92Å; F651-I681 HydrophobicContact CZ-CD1 3.82Å; F651-I681 HydrophobicContact CZ-CG2 4.47Å; A677-I681 WeakPolarHBondContact O-CG1 3.43Å; A677-I681 PolarHBondContact O-N 2.88Å; A677-I681 VanDerWaalsContact O-CG1 3.26Å; I681-Q683 PolarHBondContact O-N 3.29Å; I681-Q684 PolarHBondContact O-N 2.9Å; I681-I685 HydrophobicContact CG2-CD1 3.73Å; I681-I685 HydrophobicContact CG2-CG1 4.36Å; I681-I685 VanDerWaalsContact O-CG1 3.3Å; I681-I685 WeakPolarHBondContact O-CG1 3.4Å; I681-I685 PolarHBondContact O-N 3.05Å
682	K	89.3	Confident	86.6	Confident	105 Å²	105	63.6 Å²	63.6	46%	0.457	35%	0.346	S	S	.	.	H	α-helix	trans	-60.5	-44.5	176.4	-77.1	175.3	179.6	-178.4	0	112.5	I639 T678 K679 V680 Q684 I685 M686	I639-K682 HydrophobicContact CD1-CG 3.91Å; T678-K682 VanDerWaalsContact O-CB 3.27Å; T678-K682 WeakPolarHBondContact O-CB 3.5Å; T678-K682 WeakPolarHBondContact O-CG 3.45Å; T678-K682 PolarHBondContact O-N 3.47Å; K679-K682 PolarHBondContact O-N 3.31Å; V680-K682 PolarHBondContact O-N 2.9Å; K682-Q684 PolarHBondContact O-N 3.4Å; K682-Q684 VanDerWaalsContact C-N 3.26Å; K682-I685 PolarHBondContact O-N 2.94Å; K682-M686 WeakPolarHBondContact O-CG 3.48Å; K682-M686 PolarHBondContact O-N 2.9Å
683	Q	90.4	Very high	86.2	Confident	103 Å²	103	67.8 Å²	67.8	48%	0.481	36%	0.359	S	S	.	.	H	α-helix	trans	-60.5	-38.4	176.4	-76.6	178.2	-7	0	0	111.8	K679 V680 I681 K687	K679-Q683 PolarHBondContact O-N 2.8Å; K679-Q683 WeakPolarHBondContact O-CG 3.41Å; K679-Q683 VanDerWaalsContact O-CG 3.3Å; K679-Q683 WeakPolarHBondContact O-CB 3.46Å; V680-Q683 PolarHBondContact O-N 3.17Å; I681-Q683 PolarHBondContact O-N 3.29Å; Q683-K687 WeakPolarHBondContact O-CG 3.39Å; Q683-K687 PolarHBondContact O-N 3.04Å; Q683-K687 VanDerWaalsContact O-N 3.17Å
684	Q	90.9	Very high	85.2	Confident	8 Å²	8	67.1 Å²	67.1	4%	0.037	36%	0.363	C	S	.	.	H	α-helix	trans	-72.4	-36.8	177.7	-169.6	51	42.7	0	0	112.2	K586 I607 A609 L633 V680 I681 K682 K687 V688	K586-Q684 HydrophobicContact CD-CG 4.46Å; K586-Q684 VanDerWaalsContact NZ-CD 3.33Å; I607-Q684 HydrophobicContact CG2-CB 4.22Å; I607-Q684 HydrophobicContact CG2-CG 3.87Å; A609-Q684 PolarHBondContact O-NE2 3.18Å; L633-Q684 HydrophobicContact CD1-CB 4.39Å; L633-Q684 HydrophobicContact CD1-CG 3.66Å; V680-Q684 PolarHBondContact O-N 3.17Å; I681-Q684 PolarHBondContact O-N 2.9Å; K682-Q684 PolarHBondContact O-N 3.4Å; K682-Q684 VanDerWaalsContact C-N 3.26Å; Q684-K687 PolarHBondContact O-N 3.01Å; Q684-V688 WeakPolarHBondContact O-CG2 3.41Å; Q684-V688 PolarHBondContact O-N 2.97Å; Q684-V688 VanDerWaalsContact O-N 3.17Å
685	I	89.6	Confident	83.4	Confident	13 Å²	13	73.3 Å²	73.3	7%	0.067	41%	0.406	C	S	.	.	H	α-helix	trans	-61.2	-48.4	172.7	-67.3	163	0	0	0	110.7	L633 V636 I639 I681 K682 K687 V688 L689	L633-I685 HydrophobicContact CB-CG1 4.07Å; L633-I685 HydrophobicContact CD2-CG1 3.92Å; L633-I685 HydrophobicContact CG-CG1 4.49Å; V636-I685 HydrophobicContact CB-CD1 3.95Å; V636-I685 HydrophobicContact CG1-CD1 3.91Å; V636-I685 HydrophobicContact CG2-CD1 3.95Å; V636-I685 HydrophobicContact CG2-CG1 4.49Å; I639-I685 HydrophobicContact CD1-CD1 3.9Å; I681-I685 HydrophobicContact CG2-CD1 3.73Å; I681-I685 HydrophobicContact CG2-CG1 4.36Å; I681-I685 VanDerWaalsContact O-CG1 3.3Å; I681-I685 WeakPolarHBondContact O-CG1 3.4Å; I681-I685 PolarHBondContact O-N 3.05Å; K682-I685 PolarHBondContact O-N 2.94Å; I685-K687 VanDerWaalsContact C-N 3.3Å; I685-K687 PolarHBondContact O-N 3.13Å; I685-V688 WeakPolarHBondContact O-CB 3.27Å; I685-V688 PolarHBondContact O-N 3.16Å; I685-L689 HydrophobicContact CG2-CD1 3.96Å; I685-L689 HydrophobicContact CG2-CG 4.32Å; I685-L689 WeakPolarHBondContact O-CG 3.34Å; I685-L689 PolarHBondContact O-N 3.19Å
686	M	88.1	Confident	83.5	Confident	104 Å²	104	74.2 Å²	74.2	51%	0.512	40%	0.398	S	S	.	.	H	α-helix	trans	-57.8	-43.7	178.2	-67.7	-59	-61	0	0	111.5	K682 V688 L689 D690	K682-M686 WeakPolarHBondContact O-CG 3.48Å; K682-M686 PolarHBondContact O-N 2.9Å; M686-V688 VanDerWaalsContact C-N 3.25Å; M686-V688 PolarHBondContact O-N 3.26Å; M686-L689 PolarHBondContact O-N 2.79Å; M686-D690 WeakPolarHBondContact O-CB 3.46Å; M686-D690 PolarHBondContact O-N 2.83Å
687	K	88.8	Confident	83.4	Confident	127 Å²	127	72.2 Å²	72.2	55%	0.552	39%	0.387	S	S	*	.	H	α-helix	trans	-60.1	-33	175.4	-73.3	174.2	-177.6	178.5	0	113.5	Q683 Q684 I685 A691	Q683-K687 WeakPolarHBondContact O-CG 3.39Å; Q683-K687 PolarHBondContact O-N 3.04Å; Q683-K687 VanDerWaalsContact O-N 3.17Å; Q684-K687 PolarHBondContact O-N 3.01Å; I685-K687 VanDerWaalsContact C-N 3.3Å; I685-K687 PolarHBondContact O-N 3.13Å; K687-A691 VanDerWaalsContact O-CB 3.29Å; K687-A691 PolarHBondContact O-N 3.5Å; K687-A691 WeakPolarHBondContact O-CB 3.44Å
688	V	88.6	Confident	83.2	Confident	14 Å²	14	75.7 Å²	75.7	9%	0.085	41%	0.405	C	S	.	.	H	α-helix	trans	-74.4	-41.8	177.2	172.9	0	0	0	0	110.6	A609 L633 Q684 I685 M686 A691 L692	A609-V688 WeakPolarHBondContact O-CG2 3.5Å; L633-V688 HydrophobicContact CB-CG2 4.3Å; L633-V688 HydrophobicContact CD1-CG2 4.22Å; Q684-V688 WeakPolarHBondContact O-CG2 3.41Å; Q684-V688 PolarHBondContact O-N 2.97Å; Q684-V688 VanDerWaalsContact O-N 3.17Å; I685-V688 WeakPolarHBondContact O-CB 3.27Å; I685-V688 PolarHBondContact O-N 3.16Å; M686-V688 VanDerWaalsContact C-N 3.25Å; M686-V688 PolarHBondContact O-N 3.26Å; V688-A691 PolarHBondContact O-N 3.33Å; V688-L692 HydrophobicContact CG1-CD1 4.04Å; V688-L692 VanDerWaalsContact O-CG 3.28Å; V688-L692 WeakPolarHBondContact O-CG 3.43Å; V688-L692 PolarHBondContact O-N 3.37Å
689	L	83.8	Confident	82.9	Confident	64 Å²	64	78.9 Å²	78.9	34%	0.335	42%	0.421	S	S	.	.	H	α-helix	trans	-66.1	-45.8	177	-65	175.8	0	0	0	111.5	I685 M686 A691 L692 E693	I685-L689 HydrophobicContact CG2-CD1 3.96Å; I685-L689 HydrophobicContact CG2-CG 4.32Å; I685-L689 WeakPolarHBondContact O-CG 3.34Å; I685-L689 PolarHBondContact O-N 3.19Å; M686-L689 PolarHBondContact O-N 2.79Å; L689-A691 VanDerWaalsContact C-N 3.26Å; L689-A691 PolarHBondContact O-N 3.07Å; L689-L692 PolarHBondContact O-N 2.91Å; L689-L692 VanDerWaalsContact O-N 3.11Å; L689-E693 PolarHBondContact O-N 2.9Å
690	D	85	Confident	82.6	Confident	88 Å²	88	76.1 Å²	76.1	47%	0.471	41%	0.413	S	S	.	.	H	α-helix	trans	-59.3	-39.5	175.8	-65	-16.2	0	0	0	111.2	M686 E693 S694	M686-D690 WeakPolarHBondContact O-CB 3.46Å; M686-D690 PolarHBondContact O-N 2.83Å; D690-E693 PolarHBondContact O-N 3.29Å; D690-S694 WeakPolarHBondContact O-CB 3.46Å; D690-S694 PolarHBondContact O-N 3.28Å; D690-S694 VanDerWaalsContact O-N 3.14Å; D690-S694 PolarHBondContact O-OG 3.45Å
691	A	81.5	Confident	82.1	Confident	52 Å²	52	78.8 Å²	78.8	43%	0.43	43%	0.426	S	S	.	.	H	α-helix	trans	-65.5	-40.2	176.5	0	0	0	0	0	112.1	K687 V688 L689 S694 S695	K687-A691 VanDerWaalsContact O-CB 3.29Å; K687-A691 PolarHBondContact O-N 3.5Å; K687-A691 WeakPolarHBondContact O-CB 3.44Å; V688-A691 PolarHBondContact O-N 3.33Å; L689-A691 VanDerWaalsContact C-N 3.26Å; L689-A691 PolarHBondContact O-N 3.07Å; A691-S694 WeakPolarHBondContact CA-OG 3.42Å; A691-S694 PolarHBondContact O-N 2.94Å; A691-S694 PolarHBondContact O-OG 2.85Å; A691-S695 PolarHBondContact O-N 3.2Å; A691-S695 PolarHBondContact O-OG 3.02Å
692	L	78.3	Confident	81.5	Confident	96 Å²	96	84.4 Å²	84.4	50%	0.503	46%	0.457	S	S	.	.	H	α-helix	trans	-70.3	-29.4	177.8	-72.5	167.4	0	0	0	113.3	V688 L689 S695	V688-L692 HydrophobicContact CG1-CD1 4.04Å; V688-L692 VanDerWaalsContact O-CG 3.28Å; V688-L692 WeakPolarHBondContact O-CG 3.43Å; V688-L692 PolarHBondContact O-N 3.37Å; L689-L692 PolarHBondContact O-N 2.91Å; L689-L692 VanDerWaalsContact O-N 3.11Å; L692-S695 WeakPolarHBondContact CA-OG 3.4Å; L692-S695 PolarHBondContact O-OG 3.35Å
693	E	73	Confident	80.9	Confident	166 Å²	166	82.8 Å²	82.8	78%	0.776	46%	0.457	S	S	*	.	H	α-helix	trans	-79.1	-21.5	173.8	-70.7	-176.5	-179.8	0	0	112.6	L689 D690	L689-E693 PolarHBondContact O-N 2.9Å; D690-E693 PolarHBondContact O-N 3.29Å
694	S	63.8	Low	80.1	Confident	104 Å²	104	81.2 Å²	81.2	73%	0.727	46%	0.455	S	S	*	.	H	α-helix	trans	-92.2	-11.1	179.4	70.8	0	0	0	0	115	D690 A691	D690-S694 WeakPolarHBondContact O-CB 3.46Å; D690-S694 PolarHBondContact O-N 3.28Å; D690-S694 VanDerWaalsContact O-N 3.14Å; D690-S694 PolarHBondContact O-OG 3.45Å; A691-S694 WeakPolarHBondContact CA-OG 3.42Å; A691-S694 PolarHBondContact O-N 2.94Å; A691-S694 PolarHBondContact O-OG 2.85Å
695	S	49.8	Very low	79.1	Confident	138 Å²	138	87.8 Å²	87.8	97%	0.965	49%	0.493	S	S	*	.			trans	-100.5	0	175.8	58.1	0	0	0	0	111	A691 L692	A691-S695 PolarHBondContact O-N 3.2Å; A691-S695 PolarHBondContact O-OG 3.02Å; L692-S695 WeakPolarHBondContact CA-OG 3.4Å; L692-S695 PolarHBondContact O-OG 3.35Å

Retrieved 695 of 695 residues in 1221.7 ms (Link to these results)

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