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Erythropoietin

Hormone involved in the regulation of erythrocyte proliferation and differentiation and the maintenance of a physiological level of circulating erythrocyte mass. Binds to EPOR leading to EPOR dimerization and JAK2 activation thereby activating specific downstream effectors, including STAT1 and STAT3.

AlphaFold DB , UniProt , Accession A0A096MVK4, Species PAPAN (Papio anubis, Olive baboon), Gene EPO, Length 193 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	59	Low	244 Å²	244	131.9 Å²	131.9	100%	1.202	70%	0.703	S	S	*	*				0	91.1	0	-79.7	157.4	145.7	0	0	107.4
2	G	41.3	Very low	60.1	Low	72 Å²	72	130.5 Å²	130.5	74%	0.742	69%	0.694	S	S	*	*			trans	-94.3	110.5	176.6	0	0	0	0	0	108.5	H4	G2-H4 PolarHBondContact O-N 3.12Å
3	V	46	Very low	61	Low	134 Å²	134	128.7 Å²	128.7	81%	0.812	68%	0.684	S	S	*	*			trans	-76.2	105.8	174	-173.7	0	0	0	0	106.2	E5	V3-E5 PolarHBondContact O-N 2.98Å; V3-E5 VanDerWaalsContact O-N 3.13Å
4	H	50.7	Low	61.5	Low	176 Å²	176	126.3 Å²	126.3	82%	0.815	67%	0.671	S	S	*	*			trans	-68.6	106.6	171.4	-94.4	-90.7	0	0	0	108.1	G2 C6	G2-H4 PolarHBondContact O-N 3.12Å; H4-C6 PolarHBondContact O-N 3.35Å
5	E	60	Low	61.9	Low	180 Å²	180	122.8 Å²	122.8	84%	0.841	66%	0.66	S	S	*	*			trans	-66.8	100.1	167.7	-65.1	-172.8	127	0	0	107.9	V3 P7	V3-E5 PolarHBondContact O-N 2.98Å; V3-E5 VanDerWaalsContact O-N 3.13Å; E5-P7 VanDerWaalsContact O-CD 3.27Å; E5-P7 WeakPolarHBondContact O-CD 3.43Å
6	C	60.9	Low	62.1	Low	90 Å²	90	123.1 Å²	123.1	61%	0.608	66%	0.661	S	S	*	*			trans	-64.1	116.3	169.6	-92.6	0	0	0	0	108	H4 A8	H4-C6 PolarHBondContact O-N 3.35Å; C6-A8 PolarHBondContact O-N 3.01Å
7	P	72.3	Confident	62.2	Low	55 Å²	55	124.8 Å²	124.8	36%	0.357	67%	0.669	S	S	.	*			trans	-78	133.5	-167.1	34.8	-39.6	0	0	0	110	E5 W9 L10	E5-P7 VanDerWaalsContact O-CD 3.27Å; E5-P7 WeakPolarHBondContact O-CD 3.43Å; P7-W9 VanDerWaalsContact C-CD1 3.49Å; P7-W9 PolarHBondContact O-N 3.12Å; P7-L10 HydrophobicContact CG-CD1 4.01Å; P7-L10 WeakPolarHBondContact O-CB 3.46Å; P7-L10 PolarHBondContact O-N 3.14Å
8	A	67.8	Low	62	Low	72 Å²	72	122.8 Å²	122.8	60%	0.595	67%	0.666	S	S	*	*	H	α-helix	trans	-55.8	-24.5	-165.5	0	0	0	0	0	115.8	C6 L10 W11 L12	C6-A8 PolarHBondContact O-N 3.01Å; A8-L10 VanDerWaalsContact C-N 3.28Å; A8-L10 PolarHBondContact O-N 3.46Å; A8-W11 PolarHBondContact O-N 2.97Å; A8-L12 PolarHBondContact O-N 3.2Å
9	W	68.8	Low	61.8	Low	171 Å²	171	122.7 Å²	122.7	65%	0.648	67%	0.665	S	S	*	*	H	α-helix	trans	-60.6	-31.2	173.4	63.9	-58.3	0	0	0	113.8	P7 W11 L12 L13	P7-W9 VanDerWaalsContact C-CD1 3.49Å; P7-W9 PolarHBondContact O-N 3.12Å; W9-W11 VanDerWaalsContact C-N 3.34Å; W9-L12 PolarHBondContact O-N 3.24Å; W9-L13 HydrophobicContact CE3-CD1 4.15Å; W9-L13 WeakPolarHBondContact O-CB 3.26Å; W9-L13 PolarHBondContact O-N 3.44Å
10	L	72.4	Confident	61.5	Low	94 Å²	94	122.1 Å²	122.1	49%	0.492	67%	0.667	S	S	.	*	H	α-helix	trans	-65.4	-37.4	175.8	-108.1	146.6	0	0	0	111.8	P7 A8 L14	P7-L10 HydrophobicContact CG-CD1 4.01Å; P7-L10 WeakPolarHBondContact O-CB 3.46Å; P7-L10 PolarHBondContact O-N 3.14Å; A8-L10 VanDerWaalsContact C-N 3.28Å; A8-L10 PolarHBondContact O-N 3.46Å; L10-L14 WeakPolarHBondContact O-CB 3.32Å; L10-L14 PolarHBondContact O-N 3.07Å
11	W	70.9	Confident	61.2	Low	163 Å²	163	125.1 Å²	125.1	62%	0.617	68%	0.682	S	S	*	*	H	α-helix	trans	-72.4	-34.7	175.4	-68.5	106.6	0	0	0	112.6	A8 W9 S15	A8-W11 PolarHBondContact O-N 2.97Å; W9-W11 VanDerWaalsContact C-N 3.34Å; W11-S15 WeakPolarHBondContact O-CB 3.28Å; W11-S15 PolarHBondContact O-N 3.08Å; W11-S15 PolarHBondContact O-OG 2.81Å
12	L	71.8	Confident	62.1	Low	115 Å²	115	116.3 Å²	116.3	60%	0.602	65%	0.653	S	S	*	*	H	α-helix	trans	-65.3	-44.3	172	-106.6	108.6	0	0	0	111.6	A8 W9 S15 L16	A8-L12 PolarHBondContact O-N 3.2Å; W9-L12 PolarHBondContact O-N 3.24Å; L12-S15 PolarHBondContact O-N 3.21Å; L12-L16 WeakPolarHBondContact O-CD1 3.38Å; L12-L16 PolarHBondContact O-N 3.02Å
13	L	72.4	Confident	62.4	Low	107 Å²	107	120.3 Å²	120.3	56%	0.56	66%	0.657	S	S	*	*	H	α-helix	trans	-61.8	-44	175.9	-97	147	0	0	0	111.7	W9 S15 L16 L17	W9-L13 HydrophobicContact CE3-CD1 4.15Å; W9-L13 WeakPolarHBondContact O-CB 3.26Å; W9-L13 PolarHBondContact O-N 3.44Å; L13-S15 VanDerWaalsContact C-N 3.32Å; L13-S15 PolarHBondContact O-N 3.44Å; L13-L16 PolarHBondContact O-N 3.04Å; L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 PolarHBondContact O-N 3.45Å
14	L	68.7	Low	62.3	Low	95 Å²	95	119.3 Å²	119.3	50%	0.497	65%	0.653	S	S	.	*	H	α-helix	trans	-64.5	-37.4	176.1	-134.4	80.2	0	0	0	111.9	L10 L17 S18	L10-L14 WeakPolarHBondContact O-CB 3.32Å; L10-L14 PolarHBondContact O-N 3.07Å; L14-L17 PolarHBondContact O-N 3.48Å; L14-S18 WeakPolarHBondContact O-CB 3.29Å; L14-S18 PolarHBondContact O-N 3.43Å; L14-S18 PolarHBondContact O-OG 3.3Å
15	S	67.4	Low	62.2	Low	74 Å²	74	116.4 Å²	116.4	52%	0.517	65%	0.647	S	S	.	*	H	α-helix	trans	-69.9	-36.6	177.3	-61.4	0	0	0	0	112.5	W11 L12 L13 S18 L19	W11-S15 WeakPolarHBondContact O-CB 3.28Å; W11-S15 PolarHBondContact O-N 3.08Å; W11-S15 PolarHBondContact O-OG 2.81Å; L12-S15 PolarHBondContact O-N 3.21Å; L13-S15 VanDerWaalsContact C-N 3.32Å; L13-S15 PolarHBondContact O-N 3.44Å; S15-S18 PolarHBondContact O-N 3.02Å; S15-L19 PolarHBondContact O-N 2.99Å
16	L	64.9	Low	61.4	Low	128 Å²	128	114.4 Å²	114.4	67%	0.67	65%	0.65	S	S	*	*	H	α-helix	trans	-67.7	-37	171.8	-95.7	90.6	0	0	0	112.1	L12 L13 S18 L19	L12-L16 WeakPolarHBondContact O-CD1 3.38Å; L12-L16 PolarHBondContact O-N 3.02Å; L13-L16 PolarHBondContact O-N 3.04Å; L16-S18 VanDerWaalsContact C-N 3.29Å; L16-L19 PolarHBondContact O-N 2.93Å
17	L	62.7	Low	60.6	Low	152 Å²	152	112.8 Å²	112.8	80%	0.796	65%	0.649	S	S	*	*	H	α-helix	trans	-72.3	-25.7	177.8	-157.1	76.2	0	0	0	112.5	L13 L14	L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 PolarHBondContact O-N 3.45Å; L14-L17 PolarHBondContact O-N 3.48Å
18	S	60.1	Low	59.5	Low	88 Å²	88	114 Å²	114	62%	0.615	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-4	178.2	-52.8	0	0	0	0	113.3	L14 S15 L16 P20	L14-S18 WeakPolarHBondContact O-CB 3.29Å; L14-S18 PolarHBondContact O-N 3.43Å; L14-S18 PolarHBondContact O-OG 3.3Å; S15-S18 PolarHBondContact O-N 3.02Å; L16-S18 VanDerWaalsContact C-N 3.29Å; S18-P20 VanDerWaalsContact O-CD 3.28Å; S18-P20 WeakPolarHBondContact O-CD 3.45Å
19	L	57	Low	58.8	Low	122 Å²	122	114.9 Å²	114.9	64%	0.639	66%	0.663	S	S	*	*	S	Bend	trans	-69.6	114.6	176.6	-137.3	75.6	0	0	0	107.7	S15 L16 L21	S15-L19 PolarHBondContact O-N 2.99Å; L16-L19 PolarHBondContact O-N 2.93Å; L19-L21 PolarHBondContact O-N 3.18Å
20	P	56.1	Low	58.3	Low	110 Å²	110	111.5 Å²	111.5	71%	0.714	66%	0.663	S	S	*	*			trans	-61.7	117.9	175.9	26.2	-30.5	0	0	0	106.3	S18 G22	S18-P20 VanDerWaalsContact O-CD 3.28Å; S18-P20 WeakPolarHBondContact O-CD 3.45Å; P20-G22 PolarHBondContact O-N 2.98Å
21	L	55.9	Low	58.6	Low	186 Å²	186	112 Å²	112	97%	0.974	66%	0.658	S	S	*	*	S	Bend	trans	-71	47.7	172.8	-137.4	78.7	0	0	0	109.8	L19	L19-L21 PolarHBondContact O-N 3.18Å
22	G	55.3	Low	59.3	Low	58 Å²	58	108.8 Å²	108.8	60%	0.598	65%	0.653	S	S	*	*			trans	-126.2	33.1	-169.8	0	0	0	0	0	111.6	P20 P24	P20-G22 PolarHBondContact O-N 2.98Å; G22-P24 WeakPolarHBondContact O-CD 3.32Å
23	L	47.6	Very low	60.1	Low	157 Å²	157	103.5 Å²	103.5	82%	0.822	63%	0.625	S	S	*	*			trans	-64.7	119.9	159.4	-85	161.9	0	0	0	107	V25	L23-V25 PolarHBondContact O-N 3.44Å
24	P	43.8	Very low	61	Low	113 Å²	113	100.8 Å²	100.8	73%	0.734	61%	0.614	S	S	*	*			trans	-61	112	170	25	-30.1	0	0	0	106.4	G22 P26	G22-P24 WeakPolarHBondContact O-CD 3.32Å; P24-P26 WeakPolarHBondContact O-CD 3.37Å
25	V	49.9	Very low	62.1	Low	115 Å²	115	100 Å²	100	70%	0.697	61%	0.61	S	S	*	*			trans	-54.5	115.5	175.4	176.6	0	0	0	0	106.9	L23 G27	L23-V25 PolarHBondContact O-N 3.44Å; V25-G27 VanDerWaalsContact C-N 3.27Å; V25-G27 PolarHBondContact O-N 2.61Å
26	P	42.3	Very low	63	Low	137 Å²	137	100.6 Å²	100.6	89%	0.89	62%	0.615	S	S	*	*	S	Bend	trans	-69.1	93.7	172.7	-13.1	29.5	0	0	0	106.8	P24	P24-P26 WeakPolarHBondContact O-CD 3.37Å
27	G	45.7	Very low	64.3	Low	57 Å²	57	103.8 Å²	103.8	59%	0.588	62%	0.618	S	S	*	*			trans	142	45.5	-170.6	0	0	0	0	0	111.9	V25 P29	V25-G27 VanDerWaalsContact C-N 3.27Å; V25-G27 PolarHBondContact O-N 2.61Å; G27-P29 VanDerWaalsContact O-N 3.16Å
28	A	49	Very low	65.8	Low	81 Å²	81	98.3 Å²	98.3	67%	0.669	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-48.9	127.2	165.8	0	0	0	0	0	107.3
29	P	52.9	Low	67.4	Low	90 Å²	90	94.8 Å²	94.8	58%	0.584	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-52	144.3	179.4	20.5	-30.7	0	0	0	108.2	G27 R31	G27-P29 VanDerWaalsContact O-N 3.16Å; P29-R31 PolarHBondContact O-N 2.98Å
30	P	58.7	Low	69.2	Low	99 Å²	99	93.9 Å²	93.9	64%	0.643	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-47.6	127.4	-179.6	18.3	-29.9	0	0	0	107.3	L32	P30-L32 HydrophobicContact CB-CG 4.38Å; P30-L32 HydrophobicContact CG-CD2 4.39Å; P30-L32 HydrophobicContact CG-CG 4.19Å; P30-L32 WeakPolarHBondContact O-CG 3.25Å; P30-L32 PolarHBondContact O-N 3.43Å
31	R	76.6	Confident	71.1	Confident	104 Å²	104	96.2 Å²	96.2	39%	0.392	55%	0.552	S	S	.	*			trans	-66.9	74.5	174.5	-67.6	-178.4	172.4	-158.7	1.1	106.7	P29 I33 C34 L139 A187	P29-R31 PolarHBondContact O-N 2.98Å; R31-I33 PolarHBondContact O-N 3.43Å; R31-C34 HydrophobicContact CB-CB 4.15Å; R31-C34 WeakPolarHBondContact CB-SG 3.4Å; R31-C34 WeakPolarHBondContact O-CA 3.29Å; R31-C34 WeakPolarHBondContact O-CB 3.45Å; R31-C34 PolarHBondContact O-N 3.43Å; R31-L139 HydrophobicContact CB-CD1 4.47Å; R31-L139 HydrophobicContact CG-CD1 4.28Å; R31-A187 PolarHBondContact NH1-O 3.31Å; R31-A187 VanDerWaalsContact NH1-O 3.12Å
32	L	87	Confident	73.1	Confident	96 Å²	96	89 Å²	89	50%	0.503	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-56.6	-31.6	-170.6	-78	159.9	0	0	0	110.6	P30 C34 D35 V38 L135	P30-L32 HydrophobicContact CB-CG 4.38Å; P30-L32 HydrophobicContact CG-CD2 4.39Å; P30-L32 HydrophobicContact CG-CG 4.19Å; P30-L32 WeakPolarHBondContact O-CG 3.25Å; P30-L32 PolarHBondContact O-N 3.43Å; L32-C34 PolarHBondContact O-N 2.9Å; L32-D35 WeakPolarHBondContact O-CB 3.28Å; L32-D35 PolarHBondContact O-N 2.91Å; L32-D35 VanDerWaalsContact O-N 3.13Å; L32-V38 WeakPolarHBondContact O-CB 3.33Å; L32-V38 WeakPolarHBondContact O-CG2 3.26Å; L32-L135 HydrophobicContact CB-CD2 3.73Å; L32-L135 HydrophobicContact CD1-CD2 4.47Å
33	I	88.9	Confident	75	Confident	5 Å²	5	87.4 Å²	87.4	3%	0.026	49%	0.49	C	S	.	.	G	3₁₀ helix	trans	-67.2	-17.8	176.4	-151.6	-177.2	0	0	0	113.9	R31 L135 L136 L139 T184	R31-I33 PolarHBondContact O-N 3.43Å; I33-L135 HydrophobicContact CB-CB 4.01Å; I33-L135 HydrophobicContact CB-CD1 4.46Å; I33-L135 HydrophobicContact CB-CD2 4.41Å; I33-L135 HydrophobicContact CD1-CB 3.92Å; I33-L135 HydrophobicContact CG1-CB 4.12Å; I33-L135 HydrophobicContact CG1-CD1 4.32Å; I33-L136 HydrophobicContact CD1-CD2 3.71Å; I33-L136 HydrophobicContact CD1-CG 4.12Å; I33-L139 HydrophobicContact CG2-CB 4.21Å; I33-L139 HydrophobicContact CG2-CD1 4.16Å; I33-L139 HydrophobicContact CG2-CD2 3.88Å; I33-L139 HydrophobicContact CG2-CG 4.32Å; I33-T184 HydrophobicContact CB-CG2 4.42Å; I33-T184 HydrophobicContact CD1-CG2 4.16Å; I33-T184 HydrophobicContact CG1-CG2 3.99Å; I33-T184 HydrophobicContact CG2-CG2 4Å; I33-T184 WeakPolarHBondContact O-CG2 3.34Å
34	C	90.5	Very high	77.4	Confident	49 Å²	49	85 Å²	85	33%	0.331	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-80.6	-16.9	173.8	-59.6	0	0	0	0	112.8	R31 L32 S36 C188	R31-C34 HydrophobicContact CB-CB 4.15Å; R31-C34 WeakPolarHBondContact CB-SG 3.4Å; R31-C34 WeakPolarHBondContact O-CA 3.29Å; R31-C34 WeakPolarHBondContact O-CB 3.45Å; R31-C34 PolarHBondContact O-N 3.43Å; L32-C34 PolarHBondContact O-N 2.9Å; C34-S36 PolarHBondContact O-N 2.63Å; C34-C188 WeakPolarHBondContact CA-SG 3.35Å; C34-C188 HydrophobicContact CB-CB 3.69Å; C34-C188 WeakPolarHBondContact CB-SG 3.44Å; C34-C188 WeakPolarHBondContact SG-CB 3.5Å; C34-C188 CovalentContact SG-SG 2.02Å; C34-C188 PolarHBondContact SG-SG 3.34Å
35	D	91.1	Very high	79.9	Confident	78 Å²	78	82 Å²	82	42%	0.417	45%	0.453	S	S	.	.	S	Bend	trans	-70.7	117.1	163.3	-175.8	-18.2	0	0	0	108.2	L32 R37 V38	L32-D35 WeakPolarHBondContact O-CB 3.28Å; L32-D35 PolarHBondContact O-N 2.91Å; L32-D35 VanDerWaalsContact O-N 3.13Å; D35-R37 PolarHBondContact O-N 2.82Å; D35-R37 VanDerWaalsContact O-N 3.12Å; D35-R37 WeakPolarHBondContact OD1-CB 3.33Å; D35-R37 WeakPolarHBondContact OD1-CG 3.4Å; D35-R37 PolarHBondContact OD1-N 2.99Å; D35-V38 HydrophobicContact CB-CG2 4Å; D35-V38 PolarHBondContact O-N 3.36Å
36	S	86.8	Confident	82.1	Confident	87 Å²	87	76.5 Å²	76.5	61%	0.608	42%	0.42	S	S	*	.	H	α-helix	trans	-56	-31.9	-177.7	56.9	0	0	0	0	112.4	C34 V38 L39 E40	C34-S36 PolarHBondContact O-N 2.63Å; S36-V38 VanDerWaalsContact C-N 3.32Å; S36-V38 PolarHBondContact O-N 3.4Å; S36-L39 PolarHBondContact O-N 3.03Å; S36-E40 WeakPolarHBondContact O-CB 3.4Å; S36-E40 PolarHBondContact O-N 3.35Å
37	R	92.5	Very high	84.7	Confident	195 Å²	195	75.4 Å²	75.4	74%	0.736	40%	0.401	S	S	*	.	H	α-helix	trans	-66.1	-35	-179.1	-59.2	176.4	-178.2	-150.4	0.5	112.2	D35 R41	D35-R37 PolarHBondContact O-N 2.82Å; D35-R37 VanDerWaalsContact O-N 3.12Å; D35-R37 WeakPolarHBondContact OD1-CB 3.33Å; D35-R37 WeakPolarHBondContact OD1-CG 3.4Å; D35-R37 PolarHBondContact OD1-N 2.99Å; R37-R41 PolarHBondContact O-N 3.31Å; R37-R41 VanDerWaalsContact O-N 3.15Å
38	V	94.4	Very high	87	Confident	38 Å²	38	77.4 Å²	77.4	23%	0.23	40%	0.395	C	S	.	.	H	α-helix	trans	-66.9	-50.9	-179.6	174.9	0	0	0	0	109.8	L32 D35 S36 Y42 L135	L32-V38 WeakPolarHBondContact O-CB 3.33Å; L32-V38 WeakPolarHBondContact O-CG2 3.26Å; D35-V38 HydrophobicContact CB-CG2 4Å; D35-V38 PolarHBondContact O-N 3.36Å; S36-V38 VanDerWaalsContact C-N 3.32Å; S36-V38 PolarHBondContact O-N 3.4Å; V38-Y42 HydrophobicContact CG1-CE2 4.18Å; V38-Y42 WeakPolarHBondContact O-CD2 3.27Å; V38-Y42 WeakPolarHBondContact O-CE2 3.48Å; V38-L135 HydrophobicContact CG1-CD1 3.92Å
39	L	93.1	Very high	89.1	Confident	13 Å²	13	73.6 Å²	73.6	7%	0.068	36%	0.364	C	S	.	.	H	α-helix	trans	-68.6	-38.7	178.3	-177.1	60.7	0	0	0	111.9	S36 R41 Y42 L43 L180 K181 T184	S36-L39 PolarHBondContact O-N 3.03Å; L39-R41 VanDerWaalsContact C-N 3.29Å; L39-R41 PolarHBondContact O-N 3.36Å; L39-Y42 PolarHBondContact O-N 2.96Å; L39-Y42 VanDerWaalsContact O-N 3.15Å; L39-L43 HydrophobicContact CG-CD1 4.3Å; L39-L43 HydrophobicContact CG-CG 4.45Å; L39-L43 WeakPolarHBondContact O-CG 3.44Å; L39-L43 PolarHBondContact O-N 3.48Å; L39-L43 VanDerWaalsContact O-N 3.11Å; L39-L180 HydrophobicContact CD1-CD2 3.88Å; L39-L180 HydrophobicContact CD1-CG 4.37Å; L39-K181 HydrophobicContact CD2-CB 4.21Å; L39-K181 HydrophobicContact CD2-CG 4.13Å; L39-T184 HydrophobicContact CD2-CG2 4.42Å
40	E	95.3	Very high	91	Very high	103 Å²	103	70.5 Å²	70.5	48%	0.481	34%	0.342	S	S	.	.	H	α-helix	trans	-59.3	-38.2	179.7	-178.1	165.2	-141.7	0	0	112.8	S36 Y42 L43 L44	S36-E40 WeakPolarHBondContact O-CB 3.4Å; S36-E40 PolarHBondContact O-N 3.35Å; E40-Y42 VanDerWaalsContact C-N 3.33Å; E40-Y42 PolarHBondContact O-N 2.95Å; E40-L43 WeakPolarHBondContact O-CB 3.39Å; E40-L43 PolarHBondContact O-N 2.94Å; E40-L43 VanDerWaalsContact O-N 3.15Å; E40-L44 HydrophobicContact CG-CD1 4.11Å; E40-L44 HydrophobicContact CG-CG 4.34Å; E40-L44 WeakPolarHBondContact O-CG 3.45Å; E40-L44 PolarHBondContact O-N 3.41Å
41	R	96.4	Very high	92.6	Very high	160 Å²	160	68.9 Å²	68.9	60%	0.604	33%	0.328	S	S	*	.	H	α-helix	trans	-53.7	-49.5	173.5	-178.9	-178.4	173.3	168.2	1.1	112.1	R37 L39 L43 L44 E45	R37-R41 PolarHBondContact O-N 3.31Å; R37-R41 VanDerWaalsContact O-N 3.15Å; L39-R41 VanDerWaalsContact C-N 3.29Å; L39-R41 PolarHBondContact O-N 3.36Å; R41-L43 VanDerWaalsContact C-N 3.33Å; R41-L43 PolarHBondContact O-N 3.19Å; R41-L44 PolarHBondContact O-N 3.22Å; R41-E45 WeakPolarHBondContact CG-OE1 3.4Å; R41-E45 IonicContact CZ-OE1 3.73Å; R41-E45 IonicContact NE-OE1 2.92Å; R41-E45 PolarHBondContact NE-OE1 2.7Å; R41-E45 IonicContact NH2-OE1 3.63Å; R41-E45 WeakPolarHBondContact O-CG 3.37Å; R41-E45 PolarHBondContact O-N 2.74Å
42	Y	96.5	Very high	93.2	Very high	34 Å²	34	65.6 Å²	65.6	13%	0.133	32%	0.319	C	S	.	.	H	α-helix	trans	-68.2	-33.3	179.7	-60.1	-70.3	0	0	0	112.5	V38 L39 E40 E45 A46 S131 I132 L135	V38-Y42 HydrophobicContact CG1-CE2 4.18Å; V38-Y42 WeakPolarHBondContact O-CD2 3.27Å; V38-Y42 WeakPolarHBondContact O-CE2 3.48Å; L39-Y42 PolarHBondContact O-N 2.96Å; L39-Y42 VanDerWaalsContact O-N 3.15Å; E40-Y42 VanDerWaalsContact C-N 3.33Å; E40-Y42 PolarHBondContact O-N 2.95Å; Y42-E45 PolarHBondContact O-N 2.87Å; Y42-A46 VanDerWaalsContact O-CB 3.26Å; Y42-A46 WeakPolarHBondContact O-CB 3.39Å; Y42-A46 PolarHBondContact O-N 3.39Å; Y42-S131 WeakPolarHBondContact OH-CB 3.42Å; Y42-I132 HydrophobicContact CD1-CD1 4.25Å; Y42-I132 HydrophobicContact CD1-CG1 4.37Å; Y42-I132 HydrophobicContact CD2-CD1 4.3Å; Y42-I132 HydrophobicContact CD2-CG1 4.01Å; Y42-I132 HydrophobicContact CE2-CG1 4.28Å; Y42-I132 HydrophobicContact CG-CD1 3.9Å; Y42-I132 HydrophobicContact CG-CG1 4.06Å; Y42-L135 HydrophobicContact CE2-CD1 4.12Å
43	L	96.5	Very high	93.1	Very high	25 Å²	25	61 Å²	61	13%	0.131	30%	0.295	C	S	.	.	H	α-helix	trans	-63.4	-43.2	174.5	-67.1	173.6	0	0	0	111.8	L39 E40 R41 A46 K47 L176 R177 K181	L39-L43 HydrophobicContact CG-CD1 4.3Å; L39-L43 HydrophobicContact CG-CG 4.45Å; L39-L43 WeakPolarHBondContact O-CG 3.44Å; L39-L43 PolarHBondContact O-N 3.48Å; L39-L43 VanDerWaalsContact O-N 3.11Å; E40-L43 WeakPolarHBondContact O-CB 3.39Å; E40-L43 PolarHBondContact O-N 2.94Å; E40-L43 VanDerWaalsContact O-N 3.15Å; R41-L43 VanDerWaalsContact C-N 3.33Å; R41-L43 PolarHBondContact O-N 3.19Å; L43-A46 PolarHBondContact O-N 3Å; L43-K47 WeakPolarHBondContact O-CB 3.42Å; L43-K47 PolarHBondContact O-N 3.27Å; L43-L176 HydrophobicContact CD2-CB 3.58Å; L43-L176 WeakPolarHBondContact CD2-O 3.45Å; L43-R177 VanDerWaalsContact CD2-CA 3.46Å; L43-R177 HydrophobicContact CD2-CB 3.88Å; L43-R177 VanDerWaalsContact CD2-N 3.34Å; L43-K181 HydrophobicContact CD1-CD 3.89Å
44	L	97.4	Very high	92.8	Very high	106 Å²	106	66.8 Å²	66.8	56%	0.555	32%	0.323	S	S	*	.	H	α-helix	trans	-67.1	-44.8	177	-68.2	173	0	0	0	111.2	E40 R41 A46 K47 E48	E40-L44 HydrophobicContact CG-CD1 4.11Å; E40-L44 HydrophobicContact CG-CG 4.34Å; E40-L44 WeakPolarHBondContact O-CG 3.45Å; E40-L44 PolarHBondContact O-N 3.41Å; R41-L44 PolarHBondContact O-N 3.22Å; L44-A46 VanDerWaalsContact C-N 3.3Å; L44-A46 PolarHBondContact O-N 3.27Å; L44-K47 PolarHBondContact O-N 3Å; L44-E48 WeakPolarHBondContact O-CB 3.37Å; L44-E48 PolarHBondContact O-N 3.34Å
45	E	96.3	Very high	91.8	Very high	49 Å²	49	67.9 Å²	67.9	23%	0.229	34%	0.343	C	S	.	.	H	α-helix	trans	-60.4	-39.2	175.8	-72.9	176.1	-168.6	0	0	112.1	R41 Y42 E48 A49	R41-E45 WeakPolarHBondContact CG-OE1 3.4Å; R41-E45 IonicContact CZ-OE1 3.73Å; R41-E45 IonicContact NE-OE1 2.92Å; R41-E45 PolarHBondContact NE-OE1 2.7Å; R41-E45 IonicContact NH2-OE1 3.63Å; R41-E45 WeakPolarHBondContact O-CG 3.37Å; R41-E45 PolarHBondContact O-N 2.74Å; Y42-E45 PolarHBondContact O-N 2.87Å; E45-E48 PolarHBondContact O-N 3.44Å; E45-A49 PolarHBondContact O-N 3.2Å; E45-A49 VanDerWaalsContact O-N 3.08Å
46	A	96.6	Very high	90.7	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-69.8	-40.1	177	0	0	0	0	0	113.2	Y42 L43 L44 E48 A49 E50 Y172 L176	Y42-A46 VanDerWaalsContact O-CB 3.26Å; Y42-A46 WeakPolarHBondContact O-CB 3.39Å; Y42-A46 PolarHBondContact O-N 3.39Å; L43-A46 PolarHBondContact O-N 3Å; L44-A46 VanDerWaalsContact C-N 3.3Å; L44-A46 PolarHBondContact O-N 3.27Å; A46-E48 VanDerWaalsContact C-N 3.32Å; A46-A49 PolarHBondContact O-N 3.43Å; A46-E50 PolarHBondContact O-N 3.36Å; A46-Y172 VanDerWaalsContact CA-CE1 3.49Å; A46-Y172 HydrophobicContact CB-CD1 3.53Å; A46-Y172 HydrophobicContact CB-CE1 3.26Å; A46-Y172 HydrophobicContact CB-CG 4.32Å; A46-L176 HydrophobicContact CB-CD1 3.86Å
47	K	96.1	Very high	89.9	Confident	115 Å²	115	65.4 Å²	65.4	50%	0.5	33%	0.332	S	S	.	.	H	α-helix	trans	-63.9	-40.4	174.8	-173.2	-177.2	-179.2	-173	0	111.2	L43 L44 E50 N51	L43-K47 WeakPolarHBondContact O-CB 3.42Å; L43-K47 PolarHBondContact O-N 3.27Å; L44-K47 PolarHBondContact O-N 3Å; K47-E50 WeakPolarHBondContact O-CB 3.48Å; K47-E50 PolarHBondContact O-N 2.85Å; K47-N51 VanDerWaalsContact O-CG 3.23Å; K47-N51 PolarHBondContact O-N 3.37Å; K47-N51 PolarHBondContact O-ND2 2.93Å
48	E	94.8	Very high	88.7	Confident	98 Å²	98	64.2 Å²	64.2	46%	0.458	34%	0.335	S	S	.	.	H	α-helix	trans	-63.8	-43.1	177	-172.1	59.1	-161.8	0	0	111.6	L44 E45 A46 E50 N51 V52	L44-E48 WeakPolarHBondContact O-CB 3.37Å; L44-E48 PolarHBondContact O-N 3.34Å; E45-E48 PolarHBondContact O-N 3.44Å; A46-E48 VanDerWaalsContact C-N 3.32Å; E48-E50 VanDerWaalsContact C-N 3.34Å; E48-E50 PolarHBondContact O-N 3.46Å; E48-N51 WeakPolarHBondContact O-CB 3.46Å; E48-N51 PolarHBondContact O-N 3.25Å; E48-N51 VanDerWaalsContact O-N 3.13Å; E48-V52 WeakPolarHBondContact O-CG2 3.2Å; E48-V52 PolarHBondContact O-N 3.14Å
49	A	92.8	Very high	87.6	Confident	2 Å²	2	64.7 Å²	64.7	2%	0.017	34%	0.339	C	S	.	.	H	α-helix	trans	-62.7	-39.4	175.2	0	0	0	0	0	112.8	E45 A46 N51 T53 H121 F169	E45-A49 PolarHBondContact O-N 3.2Å; E45-A49 VanDerWaalsContact O-N 3.08Å; A46-A49 PolarHBondContact O-N 3.43Å; A49-N51 VanDerWaalsContact C-N 3.34Å; A49-T53 WeakPolarHBondContact O-CG2 3.3Å; A49-T53 PolarHBondContact O-N 3.3Å; A49-T53 PolarHBondContact O-OG1 3.23Å; A49-H121 HydrophobicContact CB-CB 3.86Å; A49-F169 HydrophobicContact CB-CD1 3.36Å; A49-F169 HydrophobicContact CB-CE1 3.59Å; A49-F169 HydrophobicContact CB-CG 4.05Å; A49-F169 HydrophobicContact CB-CZ 4.44Å
50	E	93.5	Very high	87.2	Confident	25 Å²	25	64.1 Å²	64.1	12%	0.117	34%	0.337	C	S	.	.	H	α-helix	trans	-59	-44.8	171.2	-178.8	-178.6	-162.2	0	0	111.1	A46 K47 E48 T53 M54 R170 S173 R177	A46-E50 PolarHBondContact O-N 3.36Å; K47-E50 WeakPolarHBondContact O-CB 3.48Å; K47-E50 PolarHBondContact O-N 2.85Å; E48-E50 VanDerWaalsContact C-N 3.34Å; E48-E50 PolarHBondContact O-N 3.46Å; E50-T53 PolarHBondContact O-N 3.38Å; E50-T53 PolarHBondContact O-OG1 3.06Å; E50-M54 WeakPolarHBondContact O-CG 3.49Å; E50-M54 PolarHBondContact O-N 3.04Å; E50-R170 HydrophobicContact CG-CB 4.35Å; E50-R170 WeakPolarHBondContact OE1-CG 3.21Å; E50-S173 WeakPolarHBondContact OE2-CB 2.93Å; E50-S173 PolarHBondContact OE2-OG 3.01Å; E50-R177 IonicContact OE2-NH1 2.61Å; E50-R177 PolarHBondContact OE2-NH1 3.41Å
51	N	92.3	Very high	86.8	Confident	65 Å²	65	61.1 Å²	61.1	35%	0.348	33%	0.327	S	S	.	.	H	α-helix	trans	-64.5	-45.9	-180	-67.6	-21	0	0	0	113.2	K47 E48 A49 T53 M54	K47-N51 VanDerWaalsContact O-CG 3.23Å; K47-N51 PolarHBondContact O-N 3.37Å; K47-N51 PolarHBondContact O-ND2 2.93Å; E48-N51 WeakPolarHBondContact O-CB 3.46Å; E48-N51 PolarHBondContact O-N 3.25Å; E48-N51 VanDerWaalsContact O-N 3.13Å; A49-N51 VanDerWaalsContact C-N 3.34Å; N51-T53 PolarHBondContact O-N 2.91Å; N51-M54 HydrophobicContact CB-CE 4.26Å; N51-M54 WeakPolarHBondContact O-CB 3.48Å; N51-M54 PolarHBondContact O-N 3.42Å; N51-M54 VanDerWaalsContact O-N 3.16Å; N51-M54 WeakPolarHBondContact OD1-CE 3.26Å
52	V	88.1	Confident	86.4	Confident	34 Å²	34	53.5 Å²	53.5	21%	0.206	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-35.9	-179.6	169.7	0	0	0	0	111.3	E48 M54 G55 F115 P117 H121	E48-V52 WeakPolarHBondContact O-CG2 3.2Å; E48-V52 PolarHBondContact O-N 3.14Å; V52-M54 VanDerWaalsContact C-N 3.35Å; V52-M54 PolarHBondContact O-N 2.99Å; V52-G55 PolarHBondContact O-N 3.28Å; V52-F115 HydrophobicContact CG1-CE1 4.31Å; V52-P117 HydrophobicContact CG1-CB 3.88Å; V52-H121 WeakPolarHBondContact CG2-NE2 3.19Å
53	T	85.6	Confident	85.9	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-77.7	-15.2	178.6	55.6	0	0	0	0	114.5	A49 E50 N51 G55 C56 L118 F165 F169	A49-T53 WeakPolarHBondContact O-CG2 3.3Å; A49-T53 PolarHBondContact O-N 3.3Å; A49-T53 PolarHBondContact O-OG1 3.23Å; E50-T53 PolarHBondContact O-N 3.38Å; E50-T53 PolarHBondContact O-OG1 3.06Å; N51-T53 PolarHBondContact O-N 2.91Å; T53-G55 VanDerWaalsContact C-N 3.26Å; T53-G55 PolarHBondContact O-N 3.12Å; T53-C56 PolarHBondContact O-N 3.28Å; T53-L118 HydrophobicContact CG2-CD1 3.6Å; T53-F165 HydrophobicContact CG2-CB 4.27Å; T53-F169 HydrophobicContact CG2-CB 4.44Å; T53-F169 HydrophobicContact CG2-CD2 3.45Å; T53-F169 VanDerWaalsContact CG2-CD2 3.45Å; T53-F169 HydrophobicContact CG2-CE2 4.02Å; T53-F169 HydrophobicContact CG2-CG 4.19Å
54	M	82.7	Confident	85.6	Confident	125 Å²	125	61.9 Å²	61.9	62%	0.616	34%	0.342	S	S	*	.	H	α-helix	trans	-67.9	-26	169.1	-70.3	-167.5	-74.1	0	0	112.8	E50 N51 V52 C56	E50-M54 WeakPolarHBondContact O-CG 3.49Å; E50-M54 PolarHBondContact O-N 3.04Å; N51-M54 HydrophobicContact CB-CE 4.26Å; N51-M54 WeakPolarHBondContact O-CB 3.48Å; N51-M54 PolarHBondContact O-N 3.42Å; N51-M54 VanDerWaalsContact O-N 3.16Å; N51-M54 WeakPolarHBondContact OD1-CE 3.26Å; V52-M54 VanDerWaalsContact C-N 3.35Å; V52-M54 PolarHBondContact O-N 2.99Å; M54-C56 VanDerWaalsContact C-N 3.27Å; M54-C56 PolarHBondContact O-N 3.35Å
55	G	68.6	Low	85.5	Confident	72 Å²	72	62.1 Å²	62.1	74%	0.742	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-0.6	177.8	0	0	0	0	0	114.4	V52 T53	V52-G55 PolarHBondContact O-N 3.28Å; T53-G55 VanDerWaalsContact C-N 3.26Å; T53-G55 PolarHBondContact O-N 3.12Å
56	C	68.8	Low	85.5	Confident	14 Å²	14	59.8 Å²	59.8	10%	0.095	33%	0.334	C	S	.	.			trans	-107.4	112.5	-170.9	-171.3	0	0	0	0	109.2	T53 M54 S59 C60 F115	T53-C56 PolarHBondContact O-N 3.28Å; M54-C56 VanDerWaalsContact C-N 3.27Å; M54-C56 PolarHBondContact O-N 3.35Å; C56-S59 PolarHBondContact SG-OG 2.83Å; C56-C60 HydrophobicContact CB-CB 3.65Å; C56-C60 WeakPolarHBondContact CB-SG 3.44Å; C56-C60 WeakPolarHBondContact SG-CB 3.16Å; C56-C60 PolarHBondContact SG-N 2.87Å; C56-C60 VanDerWaalsContact SG-N 3.38Å; C56-C60 CovalentContact SG-SG 2.01Å; C56-C60 PolarHBondContact SG-SG 2.87Å; C56-F115 HydrophobicContact CB-CD1 4.34Å; C56-F115 HydrophobicContact CB-CE1 3.99Å; C56-F115 VanDerWaalsContact SG-CD1 3.56Å
57	S	70.1	Confident	85.5	Confident	99 Å²	99	63 Å²	63	69%	0.692	35%	0.353	S	S	*	.	S	Bend	trans	-79.4	-125.7	-178.8	56.5	0	0	0	0	110.7	S59 C60	S57-S59 PolarHBondContact O-N 2.72Å; S57-S59 VanDerWaalsContact O-N 3.08Å; S57-C60 PolarHBondContact O-N 3.47Å; S57-C60 VanDerWaalsContact O-N 3.11Å
58	E	68.1	Low	85.6	Confident	171 Å²	171	57.5 Å²	57.5	80%	0.799	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-58.3	-23.3	-179.7	-62.3	-60.7	149.8	0	0	113.3	C60 S61	E58-C60 PolarHBondContact O-N 3.44Å; E58-C60 VanDerWaalsContact O-N 3.15Å; E58-S61 PolarHBondContact O-N 3.46Å
59	S	71.1	Confident	85.7	Confident	47 Å²	47	52.8 Å²	52.8	33%	0.329	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-67.5	-8	177.3	51	0	0	0	0	114.6	C56 S57	C56-S59 PolarHBondContact SG-OG 2.83Å; S57-S59 PolarHBondContact O-N 2.72Å; S57-S59 VanDerWaalsContact O-N 3.08Å
60	C	82.9	Confident	85.9	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.014	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-110.2	17	176.1	-84.1	0	0	0	0	114.2	C56 S57 E58 T164 F165	C56-C60 HydrophobicContact CB-CB 3.65Å; C56-C60 WeakPolarHBondContact CB-SG 3.44Å; C56-C60 WeakPolarHBondContact SG-CB 3.16Å; C56-C60 PolarHBondContact SG-N 2.87Å; C56-C60 VanDerWaalsContact SG-N 3.38Å; C56-C60 CovalentContact SG-SG 2.01Å; C56-C60 PolarHBondContact SG-SG 2.87Å; S57-C60 PolarHBondContact O-N 3.47Å; S57-C60 VanDerWaalsContact O-N 3.11Å; E58-C60 PolarHBondContact O-N 3.44Å; E58-C60 VanDerWaalsContact O-N 3.15Å; C60-T164 CarbonylContact O-C 3.59Å; C60-T164 VanDerWaalsContact O-CA 3.26Å; C60-T164 WeakPolarHBondContact O-CA 3.3Å; C60-F165 HydrophobicContact CB-CB 4.09Å; C60-F165 HydrophobicContact CB-CD2 4.45Å; C60-F165 WeakPolarHBondContact O-CD2 3.21Å; C60-F165 PolarHBondContact O-N 3.41Å
61	S	88.3	Confident	86	Confident	39 Å²	39	53.5 Å²	53.5	27%	0.273	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	137	169.3	-179.4	0	0	0	0	111.1	E58 N63	E58-S61 PolarHBondContact O-N 3.46Å; S61-N63 PolarHBondContact OG-N 2.91Å; S61-N63 VanDerWaalsContact OG-N 3.09Å; S61-N63 PolarHBondContact OG-OD1 3.04Å
62	L	87.9	Confident	86.1	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-12	169.4	-71.8	165.9	0	0	0	112	E64 I66 V107 A162 D163 F165	L62-E64 PolarHBondContact O-N 3.01Å; L62-I66 HydrophobicContact CD1-CB 4.5Å; L62-I66 HydrophobicContact CD1-CD1 3.84Å; L62-I66 HydrophobicContact CD1-CG1 4.14Å; L62-I66 HydrophobicContact CD2-CD1 3.84Å; L62-I66 HydrophobicContact CG-CD1 4.3Å; L62-V107 HydrophobicContact CD2-CB 4.39Å; L62-V107 HydrophobicContact CD2-CG1 4.33Å; L62-V107 VanDerWaalsContact O-CG1 3.3Å; L62-V107 WeakPolarHBondContact O-CG1 3.22Å; L62-A162 HydrophobicContact CD1-CB 4.43Å; L62-D163 WeakPolarHBondContact CB-O 2.97Å; L62-D163 PolarHBondContact N-O 3.43Å; L62-F165 HydrophobicContact CD2-CD1 4.07Å; L62-F165 HydrophobicContact CD2-CD2 3.82Å; L62-F165 HydrophobicContact CD2-CE1 3.73Å; L62-F165 HydrophobicContact CD2-CE2 3.45Å; L62-F165 VanDerWaalsContact CD2-CE2 3.45Å; L62-F165 HydrophobicContact CD2-CG 4.11Å; L62-F165 HydrophobicContact CD2-CZ 3.4Å; L62-F165 VanDerWaalsContact CD2-CZ 3.4Å; L62-F165 HydrophobicContact CG-CD2 4.2Å; L62-F165 HydrophobicContact CG-CE2 4.24Å
63	N	85.9	Confident	86.4	Confident	146 Å²	146	58.2 Å²	58.2	78%	0.781	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	55.2	0.3	-175	-57.7	-37	0	0	0	115.5	S61	S61-N63 PolarHBondContact OG-N 2.91Å; S61-N63 VanDerWaalsContact OG-N 3.09Å; S61-N63 PolarHBondContact OG-OD1 3.04Å
64	E	89.3	Confident	86.7	Confident	88 Å²	88	63 Å²	63	41%	0.411	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	160.5	174.8	66.5	172.4	-174.4	0	0	110.1	L62 I66 V107	L62-E64 PolarHBondContact O-N 3.01Å; E64-I66 HydrophobicContact CG-CG1 3.92Å; E64-I66 PolarHBondContact O-N 3.34Å; E64-V107 HydrophobicContact CG-CG2 4.24Å; E64-V107 WeakPolarHBondContact OE1-CG2 3.29Å
65	N	95.1	Very high	87.3	Confident	111 Å²	111	64 Å²	64	59%	0.594	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	99.7	175.2	-75.3	-42.2	0	0	0	110.1	T161	N65-T161 HydrophobicContact CB-CG2 4.28Å
66	I	96.5	Very high	88.5	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.3	176.1	-58.3	-172.5	0	0	0	109.5	L62 E64 V68 A100 R103 T161 A162	L62-I66 HydrophobicContact CD1-CB 4.5Å; L62-I66 HydrophobicContact CD1-CD1 3.84Å; L62-I66 HydrophobicContact CD1-CG1 4.14Å; L62-I66 HydrophobicContact CD2-CD1 3.84Å; L62-I66 HydrophobicContact CG-CD1 4.3Å; E64-I66 HydrophobicContact CG-CG1 3.92Å; E64-I66 PolarHBondContact O-N 3.34Å; I66-V68 HydrophobicContact CG2-CG1 4.3Å; I66-A100 HydrophobicContact CG2-CB 3.6Å; I66-R103 HydrophobicContact CD1-CB 3.84Å; I66-R103 HydrophobicContact CG2-CB 4.42Å; I66-T161 CarbonylContact O-C 3.52Å; I66-T161 VanDerWaalsContact O-CA 3.3Å; I66-T161 WeakPolarHBondContact O-CA 3.29Å; I66-A162 PolarHBondContact N-O 3.04Å; I66-A162 PolarHBondContact O-N 3.08Å
67	T	97.8	Very high	89.6	Confident	66 Å²	66	69.9 Å²	69.9	41%	0.405	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	132.2	175.5	-59.1	0	0	0	0	110.3	L96 T159	T67-L96 HydrophobicContact CG2-CD1 4.35Å; T67-L96 HydrophobicContact CG2-CD2 4.35Å; T67-T159 HydrophobicContact CG2-CG2 4.05Å
68	V	98.1	Very high	90.8	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	156.1	-176.3	-57.4	0	0	0	0	110.6	I66 A100 T159 I160 A162 L168 V171	I66-V68 HydrophobicContact CG2-CG1 4.3Å; V68-A100 HydrophobicContact CG1-CB 3.69Å; V68-T159 CarbonylContact O-C 3.47Å; V68-T159 WeakPolarHBondContact O-CA 3.19Å; V68-I160 HydrophobicContact CG2-CD1 4.13Å; V68-I160 HydrophobicContact CG2-CG1 3.4Å; V68-I160 WeakPolarHBondContact CG2-O 3.29Å; V68-I160 PolarHBondContact N-O 3Å; V68-I160 PolarHBondContact O-N 3.33Å; V68-I160 VanDerWaalsContact O-O 3.1Å; V68-A162 HydrophobicContact CG1-CB 3.94Å; V68-A162 HydrophobicContact CG2-CB 4.28Å; V68-L168 HydrophobicContact CG1-CD1 3.81Å; V68-V171 HydrophobicContact CB-CG1 3.99Å; V68-V171 HydrophobicContact CG2-CB 4.38Å; V68-V171 HydrophobicContact CG2-CG1 3.98Å; V68-V171 HydrophobicContact CG2-CG2 3.95Å
69	P	97.2	Very high	91.9	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	147.1	-179.7	29.8	-38.1	0	0	0	112.2	T71 G93 L96 L97 V171 F175	P69-T71 PolarHBondContact O-N 2.92Å; P69-G93 WeakPolarHBondContact CG-O 3.3Å; P69-L96 HydrophobicContact CB-CD2 4.27Å; P69-L97 HydrophobicContact CG-CB 4.07Å; P69-L97 HydrophobicContact CG-CD1 4.44Å; P69-V171 HydrophobicContact CG-CG1 4.35Å; P69-F175 HydrophobicContact CB-CD2 4.44Å; P69-F175 HydrophobicContact CG-CD2 4.09Å; P69-F175 HydrophobicContact CG-CE2 4.43Å
70	D	95.4	Very high	92.9	Very high	22 Å²	22	73.1 Å²	73.1	12%	0.118	35%	0.353	C	S	.	.			trans	-70.7	122.8	165.8	-174.4	8.6	0	0	0	109.8	K72 R158 I160 K179	D70-K72 WeakPolarHBondContact OD1-CB 3.38Å; D70-K72 VanDerWaalsContact OD1-CG 3.32Å; D70-K72 WeakPolarHBondContact OD1-CG 3.42Å; D70-K72 PolarHBondContact OD1-N 3.23Å; D70-R158 HydrophobicContact CB-CB 3.7Å; D70-R158 VanDerWaalsContact CB-O 3.26Å; D70-R158 WeakPolarHBondContact CB-O 3.46Å; D70-R158 PolarHBondContact N-O 3.44Å; D70-I160 HydrophobicContact CB-CG2 4.48Å; D70-K179 WeakPolarHBondContact O-CE 3.42Å; D70-K179 PolarHBondContact O-NZ 2.8Å
71	T	95.9	Very high	93.3	Very high	20 Å²	20	75.3 Å²	75.3	12%	0.123	36%	0.363	C	S	.	.			trans	-96.5	-4.2	-176.2	59.9	0	0	0	0	113	P69 V73 V171 N174 F175	P69-T71 PolarHBondContact O-N 2.92Å; T71-V73 PolarHBondContact O-N 3.03Å; T71-V171 HydrophobicContact CG2-CB 4.46Å; T71-V171 HydrophobicContact CG2-CG1 3.75Å; T71-V171 WeakPolarHBondContact CG2-O 3.29Å; T71-N174 HydrophobicContact CG2-CB 4.05Å; T71-N174 WeakPolarHBondContact OG1-CB 3.45Å; T71-F175 HydrophobicContact CG2-CB 3.75Å; T71-F175 HydrophobicContact CG2-CD2 4.28Å
72	K	94.6	Very high	93.4	Very high	165 Å²	165	79.7 Å²	79.7	72%	0.717	38%	0.379	S	S	*	.			trans	-61	135.5	177.3	-70.1	176	-177.3	178	0	110.4	D70 K179	D70-K72 WeakPolarHBondContact OD1-CB 3.38Å; D70-K72 VanDerWaalsContact OD1-CG 3.32Å; D70-K72 WeakPolarHBondContact OD1-CG 3.42Å; D70-K72 PolarHBondContact OD1-N 3.23Å; K72-K179 VanDerWaalsContact O-CE 3.25Å; K72-K179 WeakPolarHBondContact O-CE 3.34Å
73	V	93.5	Very high	93.4	Very high	32 Å²	32	79.9 Å²	79.9	19%	0.194	38%	0.381	C	S	.	.			trans	-123.1	120.9	174.9	-174.4	0	0	0	0	108.7	T71 F75 W78 K179 L182	T71-V73 PolarHBondContact O-N 3.03Å; V73-F75 PolarHBondContact O-N 3.05Å; V73-W78 HydrophobicContact CG1-CB 3.85Å; V73-W78 HydrophobicContact CG1-CD2 4.02Å; V73-W78 HydrophobicContact CG1-CE3 4.08Å; V73-W78 HydrophobicContact CG1-CG 3.95Å; V73-K179 HydrophobicContact CG2-CB 4.47Å; V73-K179 HydrophobicContact CG2-CD 4.45Å; V73-K179 HydrophobicContact CG2-CG 3.41Å; V73-K179 VanDerWaalsContact CG2-CG 3.41Å; V73-L182 HydrophobicContact CB-CD1 4.4Å; V73-L182 HydrophobicContact CG1-CD1 3.75Å; V73-L182 HydrophobicContact CG2-CD1 4.32Å
74	N	93.9	Very high	93.6	Very high	103 Å²	103	73.4 Å²	73.4	55%	0.551	35%	0.348	S	S	*	.			trans	-86	104.2	163.9	-179.7	-44.3	0	0	0	107.7	Y76 A77 W78	N74-Y76 PolarHBondContact O-N 2.66Å; N74-Y76 WeakPolarHBondContact OD1-CB 3.25Å; N74-Y76 PolarHBondContact OD1-N 3.07Å; N74-Y76 VanDerWaalsContact OD1-N 3.08Å; N74-A77 HydrophobicContact CB-CB 4.04Å; N74-A77 PolarHBondContact O-N 2.96Å; N74-A77 PolarHBondContact OD1-N 3.45Å; N74-W78 VanDerWaalsContact O-CB 3.26Å; N74-W78 WeakPolarHBondContact O-CB 3.35Å; N74-W78 PolarHBondContact O-N 3.5Å
75	F	93.6	Very high	93.6	Very high	145 Å²	145	71 Å²	71	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-58.5	-34.6	-175.6	-69.9	-78.2	0	0	0	113.7	V73 K79 L182	V73-F75 PolarHBondContact O-N 3.05Å; F75-K79 WeakPolarHBondContact O-CB 3.45Å; F75-K79 PolarHBondContact O-N 3.23Å; F75-K79 VanDerWaalsContact O-N 3.07Å; F75-L182 HydrophobicContact CD1-CD1 4.27Å; F75-L182 HydrophobicContact CE1-CD1 3.83Å; F75-L182 HydrophobicContact CE1-CD2 4.18Å
76	Y	94.2	Very high	93.5	Very high	163 Å²	163	66 Å²	66	64%	0.639	31%	0.31	S	S	*	.	H	α-helix	trans	-66.9	-47.8	177.7	177	-94.2	0	0	0	111.4	N74 R80	N74-Y76 PolarHBondContact O-N 2.66Å; N74-Y76 WeakPolarHBondContact OD1-CB 3.25Å; N74-Y76 PolarHBondContact OD1-N 3.07Å; N74-Y76 VanDerWaalsContact OD1-N 3.08Å; Y76-R80 WeakPolarHBondContact O-CG 3.44Å; Y76-R80 PolarHBondContact OH-NH1 3.28Å
77	A	93.1	Very high	93.3	Very high	46 Å²	46	66 Å²	66	38%	0.38	31%	0.31	S	S	.	.	H	α-helix	trans	-66.9	-43.4	176.8	0	0	0	0	0	111.6	N74 K79 R80 M81	N74-A77 HydrophobicContact CB-CB 4.04Å; N74-A77 PolarHBondContact O-N 2.96Å; N74-A77 PolarHBondContact OD1-N 3.45Å; A77-K79 PolarHBondContact O-N 2.79Å; A77-R80 PolarHBondContact O-N 2.95Å; A77-R80 VanDerWaalsContact O-N 3.14Å; A77-M81 PolarHBondContact O-N 2.9Å
78	W	93.7	Very high	93	Very high	18 Å²	18	63.2 Å²	63.2	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-58	-47.9	-179.7	-174.6	-86.7	0	0	0	112.1	V73 N74 R80 M81 Q86 E89 V90 K179 L182	V73-W78 HydrophobicContact CG1-CB 3.85Å; V73-W78 HydrophobicContact CG1-CD2 4.02Å; V73-W78 HydrophobicContact CG1-CE3 4.08Å; V73-W78 HydrophobicContact CG1-CG 3.95Å; N74-W78 VanDerWaalsContact O-CB 3.26Å; N74-W78 WeakPolarHBondContact O-CB 3.35Å; N74-W78 PolarHBondContact O-N 3.5Å; W78-R80 PolarHBondContact O-N 2.83Å; W78-M81 HydrophobicContact CE3-SD 4.45Å; W78-M81 VanDerWaalsContact O-CB 3.28Å; W78-M81 WeakPolarHBondContact O-CB 3.23Å; W78-M81 PolarHBondContact O-N 3.33Å; W78-M81 VanDerWaalsContact O-N 3.12Å; W78-Q86 HydrophobicContact CD2-CG 4.25Å; W78-Q86 HydrophobicContact CH2-CB 3.92Å; W78-Q86 HydrophobicContact CH2-CG 4.07Å; W78-Q86 HydrophobicContact CZ2-CB 3.79Å; W78-Q86 HydrophobicContact CZ2-CG 3.75Å; W78-Q86 HydrophobicContact CZ3-CG 4.44Å; W78-Q86 PolarHBondContact O-NE2 3.05Å; W78-E89 HydrophobicContact CZ3-CB 4.5Å; W78-V90 HydrophobicContact CH2-CG2 4.06Å; W78-K179 HydrophobicContact CH2-CB 3.96Å; W78-K179 HydrophobicContact CH2-CG 4.13Å; W78-K179 HydrophobicContact CZ3-CB 4.31Å; W78-K179 HydrophobicContact CZ3-CD 4.17Å; W78-K179 HydrophobicContact CZ3-CG 3.96Å; W78-L182 HydrophobicContact CZ2-CB 4.14Å
79	K	92.5	Very high	92.8	Very high	184 Å²	184	65.3 Å²	65.3	80%	0.8	30%	0.303	S	S	*	.	H	α-helix	trans	-63	-26.4	179.9	-173	176.8	179.4	-178.1	0	113.1	F75 A77	F75-K79 WeakPolarHBondContact O-CB 3.45Å; F75-K79 PolarHBondContact O-N 3.23Å; F75-K79 VanDerWaalsContact O-N 3.07Å; A77-K79 PolarHBondContact O-N 2.79Å
80	R	92.3	Very high	92.7	Very high	184 Å²	184	65.3 Å²	65.3	69%	0.694	30%	0.303	S	S	*	.	H	α-helix	trans	-92.9	-11.2	179.1	-64.6	-176.2	66.9	-162.2	-6.2	113.2	Y76 A77 W78	Y76-R80 WeakPolarHBondContact O-CG 3.44Å; Y76-R80 PolarHBondContact OH-NH1 3.28Å; A77-R80 PolarHBondContact O-N 2.95Å; A77-R80 VanDerWaalsContact O-N 3.14Å; W78-R80 PolarHBondContact O-N 2.83Å
81	M	90.4	Very high	92.7	Very high	48 Å²	48	66.3 Å²	66.3	24%	0.236	31%	0.305	C	S	.	.	S	Bend	trans	-72.3	144.3	179.1	-173.8	-177.6	-69.9	0	0	110.4	A77 W78 Q85 Q86 E89	A77-M81 PolarHBondContact O-N 2.9Å; W78-M81 HydrophobicContact CE3-SD 4.45Å; W78-M81 VanDerWaalsContact O-CB 3.28Å; W78-M81 WeakPolarHBondContact O-CB 3.23Å; W78-M81 PolarHBondContact O-N 3.33Å; W78-M81 VanDerWaalsContact O-N 3.12Å; M81-Q85 HydrophobicContact CG-CB 3.74Å; M81-Q85 HydrophobicContact CG-CG 3.75Å; M81-Q85 HydrophobicContact SD-CB 4.11Å; M81-Q85 HydrophobicContact SD-CG 3.72Å; M81-Q86 HydrophobicContact CB-CG 4.23Å; M81-Q86 HydrophobicContact CG-CG 4.06Å; M81-Q86 PolarHBondContact O-NE2 3.43Å; M81-Q86 HydrophobicContact SD-CB 4.49Å; M81-Q86 HydrophobicContact SD-CG 3.75Å; M81-E89 VanDerWaalsContact CE-OE1 3.29Å; M81-E89 WeakPolarHBondContact CE-OE1 3.32Å
82	E	90.1	Very high	92.6	Very high	130 Å²	130	69.5 Å²	69.5	61%	0.607	32%	0.318	S	S	*	.			trans	-61.8	141.1	172.3	-169	-176.8	176	0	0	110.9	G84 Q85 Q86	E82-G84 VanDerWaalsContact C-N 3.26Å; E82-G84 PolarHBondContact O-N 3.02Å; E82-Q85 HydrophobicContact CB-CB 4.36Å; E82-Q85 WeakPolarHBondContact O-CB 3.45Å; E82-Q85 PolarHBondContact O-N 3.5Å; E82-Q86 PolarHBondContact O-N 3.11Å
83	V	89.1	Confident	92.7	Very high	6 Å²	6	61.6 Å²	61.6	4%	0.036	28%	0.284	C	S	.	.	H	α-helix	trans	-59.3	-37.5	-179.9	179	0	0	0	0	111.8	Q85 Q86 A87 Y183 E186 R190	V83-Q85 VanDerWaalsContact C-N 3.32Å; V83-Q85 PolarHBondContact O-N 3.19Å; V83-Q86 WeakPolarHBondContact O-CB 3.49Å; V83-Q86 PolarHBondContact O-N 3.08Å; V83-A87 PolarHBondContact O-N 2.93Å; V83-Y183 HydrophobicContact CG1-CE2 3.97Å; V83-E186 HydrophobicContact CG2-CG 3.75Å; V83-R190 VanDerWaalsContact CG2-CZ 3.49Å
84	G	88.9	Confident	92.9	Very high	9 Å²	9	60.2 Å²	60.2	9%	0.093	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-38.5	174.5	0	0	0	0	0	112.6	E82 A87 V88 L148	E82-G84 VanDerWaalsContact C-N 3.26Å; E82-G84 PolarHBondContact O-N 3.02Å; G84-A87 VanDerWaalsContact O-CB 3.29Å; G84-A87 WeakPolarHBondContact O-CB 3.4Å; G84-A87 PolarHBondContact O-N 3.49Å; G84-V88 WeakPolarHBondContact O-CG2 3.21Å; G84-V88 PolarHBondContact O-N 3.08Å; G84-L148 VanDerWaalsContact C-CD1 3.41Å
85	Q	90.4	Very high	93	Very high	38 Å²	38	57.9 Å²	57.9	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-68.1	-36.4	173.7	-175.1	63.1	38.1	0	0	112.2	M81 E82 V83 A87 V88 E89	M81-Q85 HydrophobicContact CG-CB 3.74Å; M81-Q85 HydrophobicContact CG-CG 3.75Å; M81-Q85 HydrophobicContact SD-CB 4.11Å; M81-Q85 HydrophobicContact SD-CG 3.72Å; E82-Q85 HydrophobicContact CB-CB 4.36Å; E82-Q85 WeakPolarHBondContact O-CB 3.45Å; E82-Q85 PolarHBondContact O-N 3.5Å; V83-Q85 VanDerWaalsContact C-N 3.32Å; V83-Q85 PolarHBondContact O-N 3.19Å; Q85-A87 VanDerWaalsContact C-N 3.29Å; Q85-A87 PolarHBondContact O-N 3.43Å; Q85-V88 PolarHBondContact O-N 3.41Å; Q85-E89 PolarHBondContact O-N 3.31Å
86	Q	92.6	Very high	93.2	Very high	6 Å²	6	52.5 Å²	52.5	3%	0.028	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-40.2	170.6	-63.6	175.8	11.1	0	0	111.1	W78 M81 E82 V83 E89 V90 Y183	W78-Q86 HydrophobicContact CD2-CG 4.25Å; W78-Q86 HydrophobicContact CH2-CB 3.92Å; W78-Q86 HydrophobicContact CH2-CG 4.07Å; W78-Q86 HydrophobicContact CZ2-CB 3.79Å; W78-Q86 HydrophobicContact CZ2-CG 3.75Å; W78-Q86 HydrophobicContact CZ3-CG 4.44Å; W78-Q86 PolarHBondContact O-NE2 3.05Å; M81-Q86 HydrophobicContact CB-CG 4.23Å; M81-Q86 HydrophobicContact CG-CG 4.06Å; M81-Q86 PolarHBondContact O-NE2 3.43Å; M81-Q86 HydrophobicContact SD-CB 4.49Å; M81-Q86 HydrophobicContact SD-CG 3.75Å; E82-Q86 PolarHBondContact O-N 3.11Å; V83-Q86 WeakPolarHBondContact O-CB 3.49Å; V83-Q86 PolarHBondContact O-N 3.08Å; Q86-E89 PolarHBondContact O-N 2.65Å; Q86-V90 WeakPolarHBondContact O-CG2 3.18Å; Q86-V90 PolarHBondContact O-N 3.45Å; Q86-Y183 HydrophobicContact CB-CD2 3.78Å; Q86-Y183 HydrophobicContact CB-CE2 4.49Å
87	A	92.2	Very high	93.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-43.3	175.7	0	0	0	0	0	111.6	V83 G84 Q85 V90 W91 E144 Y183	V83-A87 PolarHBondContact O-N 2.93Å; G84-A87 VanDerWaalsContact O-CB 3.29Å; G84-A87 WeakPolarHBondContact O-CB 3.4Å; G84-A87 PolarHBondContact O-N 3.49Å; Q85-A87 VanDerWaalsContact C-N 3.29Å; Q85-A87 PolarHBondContact O-N 3.43Å; A87-V90 PolarHBondContact O-N 2.96Å; A87-W91 WeakPolarHBondContact O-CB 3.33Å; A87-W91 PolarHBondContact O-N 3.37Å; A87-E144 HydrophobicContact CB-CB 3.71Å; A87-E144 WeakPolarHBondContact CB-OE2 3.46Å; A87-Y183 HydrophobicContact CB-CD2 4.44Å; A87-Y183 HydrophobicContact CB-CE2 3.54Å; A87-Y183 WeakPolarHBondContact CB-OH 3.44Å
88	V	91.9	Very high	93.7	Very high	9 Å²	9	43.8 Å²	43.8	6%	0.055	21%	0.209	C	C	.	.	H	α-helix	trans	-57.5	-52.3	173.7	175.2	0	0	0	0	110.9	G84 Q85 V90 W91 Q92 A145 L148	G84-V88 WeakPolarHBondContact O-CG2 3.21Å; G84-V88 PolarHBondContact O-N 3.08Å; Q85-V88 PolarHBondContact O-N 3.41Å; V88-V90 VanDerWaalsContact C-N 3.32Å; V88-V90 PolarHBondContact O-N 3.29Å; V88-W91 PolarHBondContact O-N 3.3Å; V88-Q92 HydrophobicContact CG1-CG 4.26Å; V88-Q92 WeakPolarHBondContact O-CB 3.28Å; V88-Q92 WeakPolarHBondContact O-CG 3.35Å; V88-Q92 PolarHBondContact O-N 2.02Å; V88-A145 HydrophobicContact CB-CB 4.46Å; V88-A145 HydrophobicContact CG2-CB 3.94Å; V88-L148 HydrophobicContact CG2-CD1 4.32Å
89	E	93.6	Very high	93.9	Very high	44 Å²	44	47.2 Å²	47.2	21%	0.206	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-41.4	-179.3	-77.6	-158.8	-160.5	0	0	112.5	W78 M81 Q85 Q86 G93 K179	W78-E89 HydrophobicContact CZ3-CB 4.5Å; M81-E89 VanDerWaalsContact CE-OE1 3.29Å; M81-E89 WeakPolarHBondContact CE-OE1 3.32Å; Q85-E89 PolarHBondContact O-N 3.31Å; Q86-E89 PolarHBondContact O-N 2.65Å; E89-G93 PolarHBondContact O-N 3.47Å; E89-K179 WeakPolarHBondContact OE2-CE 3.37Å; E89-K179 IonicContact OE2-NZ 3.38Å; E89-K179 PolarHBondContact OE2-NZ 2.93Å
90	V	95.6	Very high	94.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-72.7	-43.1	179.4	172.9	0	0	0	0	111.4	W78 Q86 A87 V88 L94 L136 F175 K179 L180 Y183	W78-V90 HydrophobicContact CH2-CG2 4.06Å; Q86-V90 WeakPolarHBondContact O-CG2 3.18Å; Q86-V90 PolarHBondContact O-N 3.45Å; A87-V90 PolarHBondContact O-N 2.96Å; V88-V90 VanDerWaalsContact C-N 3.32Å; V88-V90 PolarHBondContact O-N 3.29Å; V90-L94 WeakPolarHBondContact O-CB 2.99Å; V90-L94 PolarHBondContact O-N 3.5Å; V90-L136 HydrophobicContact CG1-CD1 3.71Å; V90-F175 HydrophobicContact CG1-CZ 4.43Å; V90-F175 WeakPolarHBondContact O-CZ 3.01Å; V90-K179 HydrophobicContact CG2-CB 4Å; V90-L180 HydrophobicContact CG1-CD1 3.69Å; V90-Y183 HydrophobicContact CB-CD1 4.38Å; V90-Y183 HydrophobicContact CB-CG 4.48Å; V90-Y183 HydrophobicContact CG1-CD1 4.25Å; V90-Y183 HydrophobicContact CG2-CD1 4.41Å; V90-Y183 HydrophobicContact CG2-CG 4.11Å
91	W	94.9	Very high	94.4	Very high	42 Å²	42	29.8 Å²	29.8	16%	0.159	16%	0.155	C	C	.	.	H	α-helix	trans	-66.1	-49.4	-177.9	-173.9	-100.9	0	0	0	111.6	A87 V88 L94 A95 T133 L136 R137 A141 Q142 A145	A87-W91 WeakPolarHBondContact O-CB 3.33Å; A87-W91 PolarHBondContact O-N 3.37Å; V88-W91 PolarHBondContact O-N 3.3Å; W91-L94 PolarHBondContact O-N 3.21Å; W91-A95 PolarHBondContact O-N 2.99Å; W91-T133 HydrophobicContact CH2-CG2 3.91Å; W91-T133 HydrophobicContact CZ3-CG2 4.31Å; W91-L136 HydrophobicContact CE3-CB 4.35Å; W91-L136 HydrophobicContact CZ3-CB 4.12Å; W91-R137 HydrophobicContact CH2-CB 4.12Å; W91-R137 HydrophobicContact CZ3-CB 4.26Å; W91-A141 HydrophobicContact CE3-CB 4.3Å; W91-Q142 HydrophobicContact CD2-CB 4.04Å; W91-Q142 HydrophobicContact CD2-CG 4.43Å; W91-Q142 HydrophobicContact CE3-CB 4.07Å; W91-Q142 HydrophobicContact CH2-CB 3.69Å; W91-Q142 HydrophobicContact CH2-CG 4.06Å; W91-Q142 HydrophobicContact CZ2-CB 3.63Å; W91-Q142 VanDerWaalsContact CZ2-CD 3.43Å; W91-Q142 HydrophobicContact CZ2-CG 3.52Å; W91-Q142 HydrophobicContact CZ3-CB 3.91Å; W91-A145 HydrophobicContact CB-CB 4.06Å; W91-A145 HydrophobicContact CG-CB 4.26Å
92	Q	94.5	Very high	94.7	Very high	87 Å²	87	31.6 Å²	31.6	41%	0.407	17%	0.165	S	C	.	.	H	α-helix	trans	-65.6	-42	177.3	-66.3	179.2	-10.6	0	0	111.5	V88 L94 A95 L96 L157	V88-Q92 HydrophobicContact CG1-CG 4.26Å; V88-Q92 WeakPolarHBondContact O-CB 3.28Å; V88-Q92 WeakPolarHBondContact O-CG 3.35Å; V88-Q92 PolarHBondContact O-N 2.02Å; Q92-L94 PolarHBondContact O-N 2.9Å; Q92-A95 PolarHBondContact O-N 3.43Å; Q92-L96 PolarHBondContact O-N 2.86Å; Q92-L157 HydrophobicContact CB-CD2 4.12Å
93	G	96.3	Very high	95	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-42.4	176.7	0	0	0	0	0	112.6	P69 E89 L96 L97	P69-G93 WeakPolarHBondContact CG-O 3.3Å; E89-G93 PolarHBondContact O-N 3.47Å; G93-L96 PolarHBondContact O-N 2.73Å; G93-L97 VanDerWaalsContact O-CB 3.26Å; G93-L97 WeakPolarHBondContact O-CB 3.45Å; G93-L97 PolarHBondContact O-N 2.76Å
94	L	97.3	Very high	95.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-39.8	177.8	-176	67.6	0	0	0	112.1	V90 W91 Q92 L97 S98 L129 I132 T133 L136 F175	V90-L94 WeakPolarHBondContact O-CB 2.99Å; V90-L94 PolarHBondContact O-N 3.5Å; W91-L94 PolarHBondContact O-N 3.21Å; Q92-L94 PolarHBondContact O-N 2.9Å; L94-L97 PolarHBondContact O-N 3.07Å; L94-S98 WeakPolarHBondContact O-CB 3.47Å; L94-S98 PolarHBondContact O-N 2.96Å; L94-S98 PolarHBondContact O-OG 3.42Å; L94-L129 HydrophobicContact CD1-CD2 3.41Å; L94-L129 VanDerWaalsContact CD1-CD2 3.41Å; L94-I132 HydrophobicContact CD1-CG2 4.19Å; L94-I132 HydrophobicContact CD2-CG2 3.83Å; L94-T133 WeakPolarHBondContact CD2-OG1 3.34Å; L94-L136 HydrophobicContact CD2-CD1 3.59Å; L94-F175 HydrophobicContact CB-CE1 4.01Å; L94-F175 HydrophobicContact CB-CZ 4.24Å; L94-F175 HydrophobicContact CD1-CE1 4.15Å
95	A	96.5	Very high	95.5	Very high	55 Å²	55	33.7 Å²	33.7	46%	0.455	17%	0.167	S	C	.	.	H	α-helix	trans	-61	-50	175.6	0	0	0	0	0	111.1	W91 Q92 L97 S98 E99	W91-A95 PolarHBondContact O-N 2.99Å; Q92-A95 PolarHBondContact O-N 3.43Å; A95-L97 VanDerWaalsContact C-N 3.33Å; A95-L97 PolarHBondContact O-N 2.77Å; A95-S98 WeakPolarHBondContact O-CB 3.41Å; A95-S98 PolarHBondContact O-N 3.26Å; A95-E99 PolarHBondContact O-N 3.42Å; A95-E99 VanDerWaalsContact O-N 3.07Å
96	L	97.9	Very high	95.6	Very high	32 Å²	32	34.3 Å²	34.3	17%	0.168	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-40.8	177.3	-180	61	0	0	0	112.1	T67 P69 Q92 G93 S98 E99 A100 L157 T159	T67-L96 HydrophobicContact CG2-CD1 4.35Å; T67-L96 HydrophobicContact CG2-CD2 4.35Å; P69-L96 HydrophobicContact CB-CD2 4.27Å; Q92-L96 PolarHBondContact O-N 2.86Å; G93-L96 PolarHBondContact O-N 2.73Å; L96-S98 VanDerWaalsContact C-N 3.34Å; L96-S98 PolarHBondContact O-N 2.99Å; L96-E99 PolarHBondContact O-N 2.94Å; L96-A100 WeakPolarHBondContact O-CB 3.45Å; L96-A100 PolarHBondContact O-N 3.36Å; L96-L157 HydrophobicContact CB-CD2 4.33Å; L96-L157 HydrophobicContact CD2-CD2 3.83Å; L96-T159 HydrophobicContact CD2-CG2 3.53Å
97	L	98.3	Very high	95.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.8	-38.8	177	-172.5	58.9	0	0	0	112.3	P69 G93 L94 A95 A100 V101 L129 V171 Y172 F175	P69-L97 HydrophobicContact CG-CB 4.07Å; P69-L97 HydrophobicContact CG-CD1 4.44Å; G93-L97 VanDerWaalsContact O-CB 3.26Å; G93-L97 WeakPolarHBondContact O-CB 3.45Å; G93-L97 PolarHBondContact O-N 2.76Å; L94-L97 PolarHBondContact O-N 3.07Å; A95-L97 VanDerWaalsContact C-N 3.33Å; A95-L97 PolarHBondContact O-N 2.77Å; L97-A100 PolarHBondContact O-N 3.24Å; L97-V101 WeakPolarHBondContact O-CG2 3.4Å; L97-V101 PolarHBondContact O-N 3.17Å; L97-L129 HydrophobicContact CD2-CD2 4.01Å; L97-L129 HydrophobicContact CG-CD1 4.39Å; L97-L129 HydrophobicContact CG-CD2 4.22Å; L97-V171 HydrophobicContact CD1-CG1 4.04Å; L97-Y172 HydrophobicContact CD2-CD2 4.02Å; L97-F175 HydrophobicContact CD2-CB 3.84Å; L97-F175 HydrophobicContact CD2-CD1 3.63Å; L97-F175 HydrophobicContact CD2-CE1 4.42Å; L97-F175 HydrophobicContact CD2-CG 3.81Å
98	S	98.1	Very high	95.4	Very high	26 Å²	26	36.1 Å²	36.1	18%	0.182	19%	0.189	C	C	.	.	H	α-helix	trans	-62.7	-44	175.9	-58.4	0	0	0	0	111.2	L94 A95 L96 V101 L102	L94-S98 WeakPolarHBondContact O-CB 3.47Å; L94-S98 PolarHBondContact O-N 2.96Å; L94-S98 PolarHBondContact O-OG 3.42Å; A95-S98 WeakPolarHBondContact O-CB 3.41Å; A95-S98 PolarHBondContact O-N 3.26Å; L96-S98 VanDerWaalsContact C-N 3.34Å; L96-S98 PolarHBondContact O-N 2.99Å; S98-V101 PolarHBondContact O-N 3.41Å; S98-L102 VanDerWaalsContact O-CG 3.3Å; S98-L102 WeakPolarHBondContact O-CG 3.33Å; S98-L102 PolarHBondContact O-N 3.13Å; S98-L102 VanDerWaalsContact O-N 3.12Å
99	E	98	Very high	95.2	Very high	89 Å²	89	39.6 Å²	39.6	42%	0.416	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-45	174.3	-171.6	-176	163.1	0	0	111.8	A95 L96 V101 L102 R103	A95-E99 PolarHBondContact O-N 3.42Å; A95-E99 VanDerWaalsContact O-N 3.07Å; L96-E99 PolarHBondContact O-N 2.94Å; E99-V101 VanDerWaalsContact C-N 3.35Å; E99-V101 PolarHBondContact O-N 3.38Å; E99-L102 PolarHBondContact O-N 2.86Å; E99-R103 WeakPolarHBondContact O-CG 3.1Å; E99-R103 PolarHBondContact O-N 2.96Å; E99-R103 IonicContact OE1-CZ 2.74Å; E99-R103 VanDerWaalsContact OE1-CZ 3.28Å; E99-R103 IonicContact OE1-NE 3.41Å; E99-R103 PolarHBondContact OE1-NE 3.43Å; E99-R103 IonicContact OE1-NH2 3.72Å; E99-R103 PolarHBondContact OE1-NH2 2.81Å
100	A	97.9	Very high	94.9	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-41.2	179.7	0	0	0	0	0	113.1	I66 V68 L96 L97 R103 G104 L168	I66-A100 HydrophobicContact CG2-CB 3.6Å; V68-A100 HydrophobicContact CG1-CB 3.69Å; L96-A100 WeakPolarHBondContact O-CB 3.45Å; L96-A100 PolarHBondContact O-N 3.36Å; L97-A100 PolarHBondContact O-N 3.24Å; A100-R103 PolarHBondContact O-N 3.21Å; A100-G104 PolarHBondContact O-N 2.97Å; A100-L168 HydrophobicContact CB-CD1 3.96Å
101	V	97.5	Very high	94.2	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-68.2	-38.3	176.7	174.7	0	0	0	0	111.4	L97 S98 E99 G104 Q105 V122 A125 I126 L129 L168	L97-V101 WeakPolarHBondContact O-CG2 3.4Å; L97-V101 PolarHBondContact O-N 3.17Å; S98-V101 PolarHBondContact O-N 3.41Å; E99-V101 VanDerWaalsContact C-N 3.35Å; E99-V101 PolarHBondContact O-N 3.38Å; V101-G104 PolarHBondContact O-N 3.36Å; V101-Q105 PolarHBondContact O-N 3.17Å; V101-V122 HydrophobicContact CG1-CG1 4.45Å; V101-A125 HydrophobicContact CG1-CB 3.99Å; V101-I126 HydrophobicContact CG1-CD1 4.47Å; V101-I126 HydrophobicContact CG1-CG1 3.66Å; V101-L129 HydrophobicContact CB-CD1 4.03Å; V101-L129 HydrophobicContact CG1-CD1 4.46Å; V101-L129 HydrophobicContact CG2-CD1 3.74Å; V101-L168 HydrophobicContact CG2-CD1 4.36Å
102	L	97.3	Very high	93.1	Very high	85 Å²	85	50.7 Å²	50.7	45%	0.445	30%	0.297	S	S	.	.	H	α-helix	trans	-64.4	-41	174.4	-71.2	168.8	0	0	0	112.1	S98 E99 Q105 A106 I126	S98-L102 VanDerWaalsContact O-CG 3.3Å; S98-L102 WeakPolarHBondContact O-CG 3.33Å; S98-L102 PolarHBondContact O-N 3.13Å; S98-L102 VanDerWaalsContact O-N 3.12Å; E99-L102 PolarHBondContact O-N 2.86Å; L102-Q105 WeakPolarHBondContact O-CB 3.34Å; L102-Q105 PolarHBondContact O-N 3.5Å; L102-A106 PolarHBondContact O-N 3.38Å; L102-A106 VanDerWaalsContact O-N 3.07Å; L102-I126 HydrophobicContact CD2-CD1 4.01Å; L102-I126 HydrophobicContact CD2-CG1 4.15Å; L102-I126 HydrophobicContact CD2-CG2 4.18Å
103	R	96.1	Very high	91.9	Very high	121 Å²	121	53.6 Å²	53.6	46%	0.457	31%	0.31	S	S	.	.	H	α-helix	trans	-61.9	-44.8	172.5	-71.4	179.1	-178.1	-131.4	6.3	111.3	I66 E99 A100 Q105 A106 V107	I66-R103 HydrophobicContact CD1-CB 3.84Å; I66-R103 HydrophobicContact CG2-CB 4.42Å; E99-R103 WeakPolarHBondContact O-CG 3.1Å; E99-R103 PolarHBondContact O-N 2.96Å; E99-R103 IonicContact OE1-CZ 2.74Å; E99-R103 VanDerWaalsContact OE1-CZ 3.28Å; E99-R103 IonicContact OE1-NE 3.41Å; E99-R103 PolarHBondContact OE1-NE 3.43Å; E99-R103 IonicContact OE1-NH2 3.72Å; E99-R103 PolarHBondContact OE1-NH2 2.81Å; A100-R103 PolarHBondContact O-N 3.21Å; R103-Q105 VanDerWaalsContact C-N 3.31Å; R103-Q105 PolarHBondContact O-N 3.01Å; R103-A106 WeakPolarHBondContact O-CB 3.42Å; R103-A106 PolarHBondContact O-N 3.02Å; R103-A106 VanDerWaalsContact O-N 3.11Å; R103-V107 PolarHBondContact O-N 2.86Å
104	G	93.6	Very high	90.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-41.9	173.2	0	0	0	0	0	112.7	A100 V101 A106 V107 L108 F165	A100-G104 PolarHBondContact O-N 2.97Å; V101-G104 PolarHBondContact O-N 3.36Å; G104-A106 VanDerWaalsContact C-N 3.34Å; G104-A106 PolarHBondContact O-N 2.84Å; G104-V107 PolarHBondContact O-N 3.31Å; G104-L108 PolarHBondContact O-N 2.64Å; G104-F165 VanDerWaalsContact O-CZ 3.22Å; G104-F165 WeakPolarHBondContact O-CZ 3.2Å
105	Q	94.1	Very high	89.5	Confident	69 Å²	69	60.2 Å²	60.2	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-60.1	-43.3	174.6	-168.7	-173.7	38.8	0	0	112.1	V101 L102 R103 V107 L108 A109 V122 D123 I126	V101-Q105 PolarHBondContact O-N 3.17Å; L102-Q105 WeakPolarHBondContact O-CB 3.34Å; L102-Q105 PolarHBondContact O-N 3.5Å; R103-Q105 VanDerWaalsContact C-N 3.31Å; R103-Q105 PolarHBondContact O-N 3.01Å; Q105-V107 VanDerWaalsContact C-N 3.34Å; Q105-V107 PolarHBondContact O-N 2.82Å; Q105-L108 PolarHBondContact O-N 3.05Å; Q105-A109 WeakPolarHBondContact O-CB 3.46Å; Q105-A109 PolarHBondContact O-N 2.63Å; Q105-V122 HydrophobicContact CB-CG1 3.6Å; Q105-V122 HydrophobicContact CG-CG1 3.8Å; Q105-D123 PolarHBondContact NE2-OD1 3.36Å; Q105-I126 HydrophobicContact CB-CD1 4Å; Q105-I126 HydrophobicContact CG-CD1 4.02Å; Q105-I126 VanDerWaalsContact NE2-CD1 3.32Å
106	A	93.3	Very high	88.7	Confident	51 Å²	51	65 Å²	65	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-40.6	177.9	0	0	0	0	0	112	L102 R103 G104 A109 N110	L102-A106 PolarHBondContact O-N 3.38Å; L102-A106 VanDerWaalsContact O-N 3.07Å; R103-A106 WeakPolarHBondContact O-CB 3.42Å; R103-A106 PolarHBondContact O-N 3.02Å; R103-A106 VanDerWaalsContact O-N 3.11Å; G104-A106 VanDerWaalsContact C-N 3.34Å; G104-A106 PolarHBondContact O-N 2.84Å; A106-A109 PolarHBondContact O-N 2.94Å; A106-N110 PolarHBondContact O-N 3.48Å; A106-N110 PolarHBondContact O-ND2 3.33Å; A106-N110 VanDerWaalsContact O-ND2 3.1Å
107	V	90.9	Very high	88.1	Confident	28 Å²	28	66.2 Å²	66.2	17%	0.17	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-46.2	173.4	172.2	0	0	0	0	111	L62 E64 R103 G104 Q105 A109 N110 S111	L62-V107 HydrophobicContact CD2-CB 4.39Å; L62-V107 HydrophobicContact CD2-CG1 4.33Å; L62-V107 VanDerWaalsContact O-CG1 3.3Å; L62-V107 WeakPolarHBondContact O-CG1 3.22Å; E64-V107 HydrophobicContact CG-CG2 4.24Å; E64-V107 WeakPolarHBondContact OE1-CG2 3.29Å; R103-V107 PolarHBondContact O-N 2.86Å; G104-V107 PolarHBondContact O-N 3.31Å; Q105-V107 VanDerWaalsContact C-N 3.34Å; Q105-V107 PolarHBondContact O-N 2.82Å; V107-A109 VanDerWaalsContact C-N 3.35Å; V107-A109 PolarHBondContact O-N 2.99Å; V107-N110 PolarHBondContact O-N 3.3Å; V107-S111 PolarHBondContact O-N 2.93Å
108	L	89	Confident	87.6	Confident	16 Å²	16	66.2 Å²	66.2	8%	0.084	37%	0.37	C	S	.	.	H	α-helix	trans	-62.2	-41.9	-179.9	-173.6	59.3	0	0	0	112.1	G104 Q105 N110 S111 L118 Q119 V122 F165	G104-L108 PolarHBondContact O-N 2.64Å; Q105-L108 PolarHBondContact O-N 3.05Å; L108-N110 PolarHBondContact O-N 3.48Å; L108-S111 WeakPolarHBondContact O-CB 3.49Å; L108-S111 PolarHBondContact O-N 3.47Å; L108-S111 VanDerWaalsContact O-N 3.14Å; L108-L118 HydrophobicContact CD1-CD2 3.72Å; L108-L118 HydrophobicContact CD1-CG 4.44Å; L108-L118 HydrophobicContact CD2-CD2 4.14Å; L108-L118 HydrophobicContact CD2-CG 3.99Å; L108-Q119 HydrophobicContact CD2-CB 3.97Å; L108-Q119 HydrophobicContact CD2-CG 4.45Å; L108-V122 HydrophobicContact CD2-CG2 4.19Å; L108-F165 HydrophobicContact CB-CZ 3.89Å
109	A	88.4	Confident	87.2	Confident	82 Å²	82	69.5 Å²	69.5	68%	0.678	38%	0.383	S	S	*	.	H	α-helix	trans	-64.1	-26.9	178.8	0	0	0	0	0	113.1	Q105 A106 V107	Q105-A109 WeakPolarHBondContact O-CB 3.46Å; Q105-A109 PolarHBondContact O-N 2.63Å; A106-A109 PolarHBondContact O-N 2.94Å; V107-A109 VanDerWaalsContact C-N 3.35Å; V107-A109 PolarHBondContact O-N 2.99Å
110	N	86.9	Confident	87	Confident	140 Å²	140	69.6 Å²	69.6	75%	0.749	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-0.2	178.1	-66.9	-30.5	0	0	0	113.3	A106 V107 L108	A106-N110 PolarHBondContact O-N 3.48Å; A106-N110 PolarHBondContact O-ND2 3.33Å; A106-N110 VanDerWaalsContact O-ND2 3.1Å; V107-N110 PolarHBondContact O-N 3.3Å; L108-N110 PolarHBondContact O-N 3.48Å
111	S	80.6	Confident	86.8	Confident	54 Å²	54	70.4 Å²	70.4	38%	0.378	39%	0.389	S	S	.	.			trans	-78.8	133.3	179.4	-178.6	0	0	0	0	111.6	V107 L108 Q113	V107-S111 PolarHBondContact O-N 2.93Å; L108-S111 WeakPolarHBondContact O-CB 3.49Å; L108-S111 PolarHBondContact O-N 3.47Å; L108-S111 VanDerWaalsContact O-N 3.14Å; S111-Q113 PolarHBondContact O-N 3.15Å; S111-Q113 PolarHBondContact OG-N 3.11Å; S111-Q113 PolarHBondContact OG-O 2.89Å
112	S	72.6	Confident	86.6	Confident	125 Å²	125	70.4 Å²	70.4	87%	0.874	39%	0.389	S	S	*	.	S	Bend	trans	-69.8	-15	173.3	-33.4	0	0	0	0	113.3
113	Q	68.9	Low	86.6	Confident	147 Å²	147	69.8 Å²	69.8	69%	0.687	39%	0.386	S	S	*	.	S	Bend	trans	-123.4	89.2	178.5	-69.5	-173.3	-39	0	0	109.2	S111 F115	S111-Q113 PolarHBondContact O-N 3.15Å; S111-Q113 PolarHBondContact OG-N 3.11Å; S111-Q113 PolarHBondContact OG-O 2.89Å; Q113-F115 PolarHBondContact O-N 3.35Å
114	P	66.6	Low	86.6	Confident	84 Å²	84	68.2 Å²	68.2	55%	0.545	38%	0.383	S	S	.	.			trans	-72	120.8	177.4	27.2	-31.5	0	0	0	109.9	E116	P114-E116 PolarHBondContact O-N 3.15Å
115	F	77.4	Confident	86.8	Confident	57 Å²	57	68.2 Å²	68.2	25%	0.25	38%	0.383	C	S	.	.			trans	-87.2	94.9	167.9	-176.7	-127.7	0	0	0	108.2	V52 C56 Q113 P117 L118 Q119	V52-F115 HydrophobicContact CG1-CE1 4.31Å; C56-F115 HydrophobicContact CB-CD1 4.34Å; C56-F115 HydrophobicContact CB-CE1 3.99Å; C56-F115 VanDerWaalsContact SG-CD1 3.56Å; Q113-F115 PolarHBondContact O-N 3.35Å; F115-P117 VanDerWaalsContact C-CD 3.43Å; F115-P117 HydrophobicContact CD2-CG 4.32Å; F115-P117 HydrophobicContact CE1-CB 4.04Å; F115-P117 HydrophobicContact CE1-CG 4.29Å; F115-P117 HydrophobicContact CE2-CB 4.43Å; F115-P117 HydrophobicContact CE2-CG 3.81Å; F115-P117 HydrophobicContact CZ-CB 3.92Å; F115-P117 HydrophobicContact CZ-CG 3.76Å; F115-L118 HydrophobicContact CB-CB 4.24Å; F115-L118 HydrophobicContact CD1-CB 3.39Å; F115-L118 HydrophobicContact CD1-CD2 4.38Å; F115-L118 HydrophobicContact CD1-CG 4.48Å; F115-L118 HydrophobicContact CE1-CB 4.09Å; F115-L118 HydrophobicContact CG-CB 4.21Å; F115-L118 WeakPolarHBondContact O-CB 3.46Å; F115-L118 PolarHBondContact O-N 3.12Å; F115-Q119 PolarHBondContact O-N 3.49Å
116	E	79.6	Confident	87	Confident	157 Å²	157	66 Å²	66	73%	0.734	37%	0.373	S	S	*	.	H	α-helix	trans	-50.4	-42.3	-173.8	-71.2	178.4	151.3	0	0	114.7	P114 L118 Q119 L120	P114-E116 PolarHBondContact O-N 3.15Å; E116-L118 VanDerWaalsContact C-N 3.25Å; E116-L118 PolarHBondContact O-N 3.13Å; E116-Q119 PolarHBondContact O-N 2.79Å; E116-L120 PolarHBondContact O-N 3.07Å
117	P	84.3	Confident	87.2	Confident	56 Å²	56	66.4 Å²	66.4	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-59.2	-37	177	-25.1	35.8	0	0	0	112.8	V52 F115 H121	V52-P117 HydrophobicContact CG1-CB 3.88Å; F115-P117 VanDerWaalsContact C-CD 3.43Å; F115-P117 HydrophobicContact CD2-CG 4.32Å; F115-P117 HydrophobicContact CE1-CB 4.04Å; F115-P117 HydrophobicContact CE1-CG 4.29Å; F115-P117 HydrophobicContact CE2-CB 4.43Å; F115-P117 HydrophobicContact CE2-CG 3.81Å; F115-P117 HydrophobicContact CZ-CB 3.92Å; F115-P117 HydrophobicContact CZ-CG 3.76Å; P117-H121 PolarHBondContact O-CD2 3.07Å; P117-H121 PolarHBondContact O-N 3.43Å
118	L	88.1	Confident	87.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-69.2	-38.5	-179.4	171.6	73	0	0	0	112.3	T53 L108 F115 E116 L120 H121 V122 F165 F169	T53-L118 HydrophobicContact CG2-CD1 3.6Å; L108-L118 HydrophobicContact CD1-CD2 3.72Å; L108-L118 HydrophobicContact CD1-CG 4.44Å; L108-L118 HydrophobicContact CD2-CD2 4.14Å; L108-L118 HydrophobicContact CD2-CG 3.99Å; F115-L118 HydrophobicContact CB-CB 4.24Å; F115-L118 HydrophobicContact CD1-CB 3.39Å; F115-L118 HydrophobicContact CD1-CD2 4.38Å; F115-L118 HydrophobicContact CD1-CG 4.48Å; F115-L118 HydrophobicContact CE1-CB 4.09Å; F115-L118 HydrophobicContact CG-CB 4.21Å; F115-L118 WeakPolarHBondContact O-CB 3.46Å; F115-L118 PolarHBondContact O-N 3.12Å; E116-L118 VanDerWaalsContact C-N 3.25Å; E116-L118 PolarHBondContact O-N 3.13Å; L118-L120 VanDerWaalsContact C-N 3.34Å; L118-L120 PolarHBondContact O-N 3.29Å; L118-H121 PolarHBondContact O-N 2.95Å; L118-H121 VanDerWaalsContact O-N 3.15Å; L118-V122 HydrophobicContact CD1-CG2 4.29Å; L118-V122 HydrophobicContact CG-CG2 4.37Å; L118-V122 WeakPolarHBondContact O-CG2 3.47Å; L118-V122 PolarHBondContact O-N 3.13Å; L118-F165 HydrophobicContact CD1-CB 3.8Å; L118-F165 HydrophobicContact CD1-CD1 3.81Å; L118-F165 HydrophobicContact CD1-CD2 4.5Å; L118-F165 HydrophobicContact CD1-CG 3.79Å; L118-F165 HydrophobicContact CD2-CB 4.31Å; L118-F165 HydrophobicContact CD2-CD1 4.18Å; L118-F165 HydrophobicContact CD2-CD2 3.64Å; L118-F165 HydrophobicContact CD2-CE1 4.4Å; L118-F165 HydrophobicContact CD2-CE2 3.9Å; L118-F165 HydrophobicContact CD2-CG 3.79Å; L118-F165 HydrophobicContact CD2-CZ 4.26Å; L118-F165 HydrophobicContact CG-CD1 4.37Å; L118-F165 HydrophobicContact CG-CG 4.35Å; L118-F169 HydrophobicContact CD1-CD2 4.2Å; L118-F169 HydrophobicContact CD1-CE2 3.53Å; L118-F169 HydrophobicContact CD1-CZ 4.45Å
119	Q	90.5	Very high	87.9	Confident	96 Å²	96	64.6 Å²	64.6	45%	0.449	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-46.2	178.5	-174.6	172.8	-5.6	0	0	111.6	L108 F115 E116 H121 V122 D123	L108-Q119 HydrophobicContact CD2-CB 3.97Å; L108-Q119 HydrophobicContact CD2-CG 4.45Å; F115-Q119 PolarHBondContact O-N 3.49Å; E116-Q119 PolarHBondContact O-N 2.79Å; Q119-H121 VanDerWaalsContact C-N 3.28Å; Q119-H121 PolarHBondContact O-N 3.23Å; Q119-V122 PolarHBondContact O-N 3.01Å; Q119-D123 PolarHBondContact O-N 3.49Å
120	L	92.4	Very high	88.3	Confident	91 Å²	91	68 Å²	68	48%	0.476	36%	0.358	S	S	.	.	H	α-helix	trans	-57	-41.9	176	177.5	64.4	0	0	0	112.3	E116 L118 K124	E116-L120 PolarHBondContact O-N 3.07Å; L118-L120 VanDerWaalsContact C-N 3.34Å; L118-L120 PolarHBondContact O-N 3.29Å; L120-K124 HydrophobicContact CD1-CD 4.48Å; L120-K124 HydrophobicContact CG-CD 4.34Å; L120-K124 WeakPolarHBondContact O-CB 3.43Å; L120-K124 VanDerWaalsContact O-CG 3.31Å; L120-K124 WeakPolarHBondContact O-CG 3.44Å; L120-K124 PolarHBondContact O-N 3.33Å
121	H	93.7	Very high	88.8	Confident	18 Å²	18	63.3 Å²	63.3	8%	0.083	34%	0.336	C	S	.	.	H	α-helix	trans	-72.8	-33.1	179.9	-76.8	-67.5	0	0	0	113.1	A49 V52 P117 L118 Q119 A125 F169	A49-H121 HydrophobicContact CB-CB 3.86Å; V52-H121 WeakPolarHBondContact CG2-NE2 3.19Å; P117-H121 PolarHBondContact O-CD2 3.07Å; P117-H121 PolarHBondContact O-N 3.43Å; L118-H121 PolarHBondContact O-N 2.95Å; L118-H121 VanDerWaalsContact O-N 3.15Å; Q119-H121 VanDerWaalsContact C-N 3.28Å; Q119-H121 PolarHBondContact O-N 3.23Å; H121-A125 WeakPolarHBondContact O-CB 3.44Å; H121-A125 PolarHBondContact O-N 3.19Å; H121-F169 HydrophobicContact CB-CE1 4.36Å; H121-F169 HydrophobicContact CB-CZ 4.11Å
122	V	95.1	Very high	89.6	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-48.3	172	171.1	0	0	0	0	110.4	V101 Q105 L108 L118 Q119 K124 A125 I126 F165 F169	V101-V122 HydrophobicContact CG1-CG1 4.45Å; Q105-V122 HydrophobicContact CB-CG1 3.6Å; Q105-V122 HydrophobicContact CG-CG1 3.8Å; L108-V122 HydrophobicContact CD2-CG2 4.19Å; L118-V122 HydrophobicContact CD1-CG2 4.29Å; L118-V122 HydrophobicContact CG-CG2 4.37Å; L118-V122 WeakPolarHBondContact O-CG2 3.47Å; L118-V122 PolarHBondContact O-N 3.13Å; Q119-V122 PolarHBondContact O-N 3.01Å; V122-K124 VanDerWaalsContact C-N 3.34Å; V122-K124 PolarHBondContact O-N 2.97Å; V122-A125 PolarHBondContact O-N 2.95Å; V122-A125 VanDerWaalsContact O-N 3.11Å; V122-I126 HydrophobicContact CG1-CD1 3.93Å; V122-I126 WeakPolarHBondContact O-CG1 3.34Å; V122-I126 PolarHBondContact O-N 2.95Å; V122-F165 HydrophobicContact CG2-CD1 4.4Å; V122-F165 HydrophobicContact CG2-CE1 4.07Å; V122-F169 HydrophobicContact CB-CZ 4.47Å; V122-F169 HydrophobicContact CG2-CE2 3.98Å; V122-F169 HydrophobicContact CG2-CZ 3.72Å
123	D	95.6	Very high	90.7	Very high	71 Å²	71	56.2 Å²	56.2	38%	0.38	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-41.1	179.8	-68.4	-23.9	0	0	0	112	Q105 Q119 I126 S127	Q105-D123 PolarHBondContact NE2-OD1 3.36Å; Q119-D123 PolarHBondContact O-N 3.49Å; D123-I126 PolarHBondContact O-N 3.23Å; D123-S127 WeakPolarHBondContact O-CB 3.26Å; D123-S127 PolarHBondContact O-N 2.99Å
124	K	96.6	Very high	91.9	Very high	88 Å²	88	53 Å²	53	38%	0.383	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-44.2	171.9	-76.8	176.2	178.8	175.5	0	112	L120 V122 S127 G128	L120-K124 HydrophobicContact CD1-CD 4.48Å; L120-K124 HydrophobicContact CG-CD 4.34Å; L120-K124 WeakPolarHBondContact O-CB 3.43Å; L120-K124 VanDerWaalsContact O-CG 3.31Å; L120-K124 WeakPolarHBondContact O-CG 3.44Å; L120-K124 PolarHBondContact O-N 3.33Å; V122-K124 VanDerWaalsContact C-N 3.34Å; V122-K124 PolarHBondContact O-N 2.97Å; K124-S127 PolarHBondContact O-N 3.38Å; K124-G128 PolarHBondContact O-N 3.37Å
125	A	97.4	Very high	93.2	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-41.6	178.3	0	0	0	0	0	111.9	V101 H121 V122 G128 L129 F169 Y172	V101-A125 HydrophobicContact CG1-CB 3.99Å; H121-A125 WeakPolarHBondContact O-CB 3.44Å; H121-A125 PolarHBondContact O-N 3.19Å; V122-A125 PolarHBondContact O-N 2.95Å; V122-A125 VanDerWaalsContact O-N 3.11Å; A125-G128 PolarHBondContact O-N 2.81Å; A125-L129 VanDerWaalsContact O-CB 3.29Å; A125-L129 WeakPolarHBondContact O-CB 3.37Å; A125-L129 WeakPolarHBondContact O-CG 3.39Å; A125-L129 PolarHBondContact O-N 2.91Å; A125-F169 HydrophobicContact CB-CE1 3.96Å; A125-Y172 HydrophobicContact CB-CD1 4.44Å; A125-Y172 HydrophobicContact CB-CE1 3.99Å
126	I	98.1	Very high	93.9	Very high	21 Å²	21	47.5 Å²	47.5	11%	0.108	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-48	175.4	-67.5	166.4	0	0	0	110.8	V101 L102 Q105 V122 D123 R130	V101-I126 HydrophobicContact CG1-CD1 4.47Å; V101-I126 HydrophobicContact CG1-CG1 3.66Å; L102-I126 HydrophobicContact CD2-CD1 4.01Å; L102-I126 HydrophobicContact CD2-CG1 4.15Å; L102-I126 HydrophobicContact CD2-CG2 4.18Å; Q105-I126 HydrophobicContact CB-CD1 4Å; Q105-I126 HydrophobicContact CG-CD1 4.02Å; Q105-I126 VanDerWaalsContact NE2-CD1 3.32Å; V122-I126 HydrophobicContact CG1-CD1 3.93Å; V122-I126 WeakPolarHBondContact O-CG1 3.34Å; V122-I126 PolarHBondContact O-N 2.95Å; D123-I126 PolarHBondContact O-N 3.23Å; I126-R130 WeakPolarHBondContact O-CB 3.44Å; I126-R130 PolarHBondContact O-N 3.47Å
127	S	97.8	Very high	94.4	Very high	61 Å²	61	45.9 Å²	45.9	43%	0.427	23%	0.232	S	C	.	.	H	α-helix	trans	-62.7	-43.1	178	-171.9	0	0	0	0	112.1	D123 K124 R130 S131	D123-S127 WeakPolarHBondContact O-CB 3.26Å; D123-S127 PolarHBondContact O-N 2.99Å; K124-S127 PolarHBondContact O-N 3.38Å; S127-R130 PolarHBondContact O-N 3.27Å; S127-S131 WeakPolarHBondContact O-CB 3.36Å; S127-S131 PolarHBondContact O-N 2.78Å; S127-S131 PolarHBondContact O-OG 2.97Å
128	G	97.3	Very high	94.7	Very high	2 Å²	2	46.1 Å²	46.1	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-50.3	178	0	0	0	0	0	112.4	K124 A125 R130 S131 I132	K124-G128 PolarHBondContact O-N 3.37Å; A125-G128 PolarHBondContact O-N 2.81Å; G128-R130 VanDerWaalsContact C-N 3.32Å; G128-R130 PolarHBondContact O-N 2.69Å; G128-S131 WeakPolarHBondContact O-CB 3.43Å; G128-S131 PolarHBondContact O-N 2.88Å; G128-S131 VanDerWaalsContact O-N 3.1Å; G128-I132 WeakPolarHBondContact O-CB 3.35Å; G128-I132 VanDerWaalsContact O-CG1 3.26Å; G128-I132 WeakPolarHBondContact O-CG1 3.44Å; G128-I132 PolarHBondContact O-N 3.09Å
129	L	98.1	Very high	94.7	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-60.7	-39.5	178	-71.8	168.8	0	0	0	112.1	L94 L97 V101 A125 I132 T133 Y172	L94-L129 HydrophobicContact CD1-CD2 3.41Å; L94-L129 VanDerWaalsContact CD1-CD2 3.41Å; L97-L129 HydrophobicContact CD2-CD2 4.01Å; L97-L129 HydrophobicContact CG-CD1 4.39Å; L97-L129 HydrophobicContact CG-CD2 4.22Å; V101-L129 HydrophobicContact CB-CD1 4.03Å; V101-L129 HydrophobicContact CG1-CD1 4.46Å; V101-L129 HydrophobicContact CG2-CD1 3.74Å; A125-L129 VanDerWaalsContact O-CB 3.29Å; A125-L129 WeakPolarHBondContact O-CB 3.37Å; A125-L129 WeakPolarHBondContact O-CG 3.39Å; A125-L129 PolarHBondContact O-N 2.91Å; L129-I132 PolarHBondContact O-N 2.92Å; L129-T133 WeakPolarHBondContact O-CB 3.48Å; L129-T133 PolarHBondContact O-N 3.21Å; L129-T133 PolarHBondContact O-OG1 3.5Å; L129-Y172 HydrophobicContact CD1-CD2 4.42Å; L129-Y172 HydrophobicContact CD1-CE2 4.3Å; L129-Y172 HydrophobicContact CD2-CD2 4.02Å; L129-Y172 HydrophobicContact CD2-CE2 3.67Å; L129-Y172 HydrophobicContact CG-CD2 4.35Å; L129-Y172 HydrophobicContact CG-CE2 3.82Å
130	R	97.6	Very high	94.4	Very high	155 Å²	155	43 Å²	43	59%	0.585	23%	0.23	S	C	*	.	H	α-helix	trans	-62	-44.9	173.2	-172.4	-175.6	-61.7	127.2	0.5	111.7	I126 S127 G128 T133 T134	I126-R130 WeakPolarHBondContact O-CB 3.44Å; I126-R130 PolarHBondContact O-N 3.47Å; S127-R130 PolarHBondContact O-N 3.27Å; G128-R130 VanDerWaalsContact C-N 3.32Å; G128-R130 PolarHBondContact O-N 2.69Å; R130-T133 PolarHBondContact O-N 3.12Å; R130-T134 PolarHBondContact O-N 2.81Å; R130-T134 VanDerWaalsContact O-N 3.15Å; R130-T134 PolarHBondContact O-OG1 3.04Å
131	S	96.7	Very high	93.9	Very high	41 Å²	41	38.6 Å²	38.6	29%	0.287	21%	0.207	S	C	.	.	H	α-helix	trans	-64.7	-46.3	179	-58	0	0	0	0	111.4	Y42 S127 G128 T133 T134 L135	Y42-S131 WeakPolarHBondContact OH-CB 3.42Å; S127-S131 WeakPolarHBondContact O-CB 3.36Å; S127-S131 PolarHBondContact O-N 2.78Å; S127-S131 PolarHBondContact O-OG 2.97Å; G128-S131 WeakPolarHBondContact O-CB 3.43Å; G128-S131 PolarHBondContact O-N 2.88Å; G128-S131 VanDerWaalsContact O-N 3.1Å; S131-T133 VanDerWaalsContact C-N 3.32Å; S131-T133 PolarHBondContact O-N 3.4Å; S131-T134 PolarHBondContact O-N 3.01Å; S131-L135 WeakPolarHBondContact O-CB 3.09Å; S131-L135 VanDerWaalsContact O-CG 3.29Å; S131-L135 WeakPolarHBondContact O-CG 3.4Å; S131-L135 PolarHBondContact O-N 3.33Å
132	I	96.4	Very high	93.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-41.1	175.7	-66.9	167.8	0	0	0	111.1	Y42 L94 G128 L129 T134 L135 L136 L176 L180	Y42-I132 HydrophobicContact CD1-CD1 4.25Å; Y42-I132 HydrophobicContact CD1-CG1 4.37Å; Y42-I132 HydrophobicContact CD2-CD1 4.3Å; Y42-I132 HydrophobicContact CD2-CG1 4.01Å; Y42-I132 HydrophobicContact CE2-CG1 4.28Å; Y42-I132 HydrophobicContact CG-CD1 3.9Å; Y42-I132 HydrophobicContact CG-CG1 4.06Å; L94-I132 HydrophobicContact CD1-CG2 4.19Å; L94-I132 HydrophobicContact CD2-CG2 3.83Å; G128-I132 WeakPolarHBondContact O-CB 3.35Å; G128-I132 VanDerWaalsContact O-CG1 3.26Å; G128-I132 WeakPolarHBondContact O-CG1 3.44Å; G128-I132 PolarHBondContact O-N 3.09Å; L129-I132 PolarHBondContact O-N 2.92Å; I132-T134 VanDerWaalsContact C-N 3.33Å; I132-T134 PolarHBondContact O-N 3.3Å; I132-L135 PolarHBondContact O-N 3.43Å; I132-L136 HydrophobicContact CG2-CD1 4.28Å; I132-L136 HydrophobicContact CG2-CG 4.26Å; I132-L136 WeakPolarHBondContact O-CB 3.27Å; I132-L136 PolarHBondContact O-N 2.89Å; I132-L176 HydrophobicContact CD1-CD1 3.96Å; I132-L176 HydrophobicContact CD1-CD2 3.8Å; I132-L180 HydrophobicContact CD1-CD2 4.26Å; I132-L180 HydrophobicContact CG2-CD1 4.13Å; I132-L180 HydrophobicContact CG2-CD2 3.76Å
133	T	95.6	Very high	92.7	Very high	29 Å²	29	46.3 Å²	46.3	18%	0.178	24%	0.243	C	C	.	.	H	α-helix	trans	-58.6	-46.2	176.7	-61.3	0	0	0	0	111.2	W91 L94 L129 R130 S131 L136 R137	W91-T133 HydrophobicContact CH2-CG2 3.91Å; W91-T133 HydrophobicContact CZ3-CG2 4.31Å; L94-T133 WeakPolarHBondContact CD2-OG1 3.34Å; L129-T133 WeakPolarHBondContact O-CB 3.48Å; L129-T133 PolarHBondContact O-N 3.21Å; L129-T133 PolarHBondContact O-OG1 3.5Å; R130-T133 PolarHBondContact O-N 3.12Å; S131-T133 VanDerWaalsContact C-N 3.32Å; S131-T133 PolarHBondContact O-N 3.4Å; T133-L136 PolarHBondContact O-N 2.84Å; T133-R137 WeakPolarHBondContact O-CB 3.42Å; T133-R137 PolarHBondContact O-N 3.37Å
134	T	94.5	Very high	92	Very high	81 Å²	81	46.1 Å²	46.1	50%	0.497	24%	0.24	S	C	.	.	H	α-helix	trans	-63.5	-43.3	176.5	-59.7	0	0	0	0	111.6	R130 S131 I132 R137 A138	R130-T134 PolarHBondContact O-N 2.81Å; R130-T134 VanDerWaalsContact O-N 3.15Å; R130-T134 PolarHBondContact O-OG1 3.04Å; S131-T134 PolarHBondContact O-N 3.01Å; I132-T134 VanDerWaalsContact C-N 3.33Å; I132-T134 PolarHBondContact O-N 3.3Å; T134-R137 PolarHBondContact O-N 3.38Å; T134-A138 PolarHBondContact O-N 2.88Å
135	L	93.7	Very high	91.1	Very high	25 Å²	25	42.9 Å²	42.9	13%	0.131	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-43.4	178.5	-74.9	173.9	0	0	0	112.6	L32 I33 V38 Y42 S131 I132 A138 L139	L32-L135 HydrophobicContact CB-CD2 3.73Å; L32-L135 HydrophobicContact CD1-CD2 4.47Å; I33-L135 HydrophobicContact CB-CB 4.01Å; I33-L135 HydrophobicContact CB-CD1 4.46Å; I33-L135 HydrophobicContact CB-CD2 4.41Å; I33-L135 HydrophobicContact CD1-CB 3.92Å; I33-L135 HydrophobicContact CG1-CB 4.12Å; I33-L135 HydrophobicContact CG1-CD1 4.32Å; V38-L135 HydrophobicContact CG1-CD1 3.92Å; Y42-L135 HydrophobicContact CE2-CD1 4.12Å; S131-L135 WeakPolarHBondContact O-CB 3.09Å; S131-L135 VanDerWaalsContact O-CG 3.29Å; S131-L135 WeakPolarHBondContact O-CG 3.4Å; S131-L135 PolarHBondContact O-N 3.33Å; I132-L135 PolarHBondContact O-N 3.43Å; L135-A138 PolarHBondContact O-N 2.73Å; L135-L139 PolarHBondContact O-N 3.24Å
136	L	92.3	Very high	90.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.9	-36.7	175.7	-78.2	-174.2	0	0	0	112.8	I33 V90 W91 L94 I132 T133 A138 L139 G140 A141 L180 Y183	I33-L136 HydrophobicContact CD1-CD2 3.71Å; I33-L136 HydrophobicContact CD1-CG 4.12Å; V90-L136 HydrophobicContact CG1-CD1 3.71Å; W91-L136 HydrophobicContact CE3-CB 4.35Å; W91-L136 HydrophobicContact CZ3-CB 4.12Å; L94-L136 HydrophobicContact CD2-CD1 3.59Å; I132-L136 HydrophobicContact CG2-CD1 4.28Å; I132-L136 HydrophobicContact CG2-CG 4.26Å; I132-L136 WeakPolarHBondContact O-CB 3.27Å; I132-L136 PolarHBondContact O-N 2.89Å; T133-L136 PolarHBondContact O-N 2.84Å; L136-A138 VanDerWaalsContact C-N 3.32Å; L136-L139 HydrophobicContact CD2-CD2 4.18Å; L136-L139 WeakPolarHBondContact O-CB 3.22Å; L136-L139 PolarHBondContact O-N 2.83Å; L136-G140 PolarHBondContact O-N 3.49Å; L136-A141 HydrophobicContact CB-CB 4.09Å; L136-A141 HydrophobicContact CD2-CB 4.43Å; L136-A141 WeakPolarHBondContact O-CB 3.43Å; L136-A141 PolarHBondContact O-N 3.1Å; L136-L180 HydrophobicContact CD1-CD1 3.6Å; L136-L180 HydrophobicContact CD2-CD1 3.78Å; L136-L180 HydrophobicContact CG-CD1 3.97Å; L136-Y183 HydrophobicContact CD2-CD1 4.17Å; L136-Y183 HydrophobicContact CD2-CE1 4.08Å
137	R	91.1	Very high	89.1	Confident	122 Å²	122	50.4 Å²	50.4	46%	0.46	27%	0.274	S	S	.	.	H	α-helix	trans	-60.1	-45.5	173.2	-175.5	-177.7	-62.5	130.1	3.1	110.6	W91 T133 T134 L139 G140 Q142	W91-R137 HydrophobicContact CH2-CB 4.12Å; W91-R137 HydrophobicContact CZ3-CB 4.26Å; T133-R137 WeakPolarHBondContact O-CB 3.42Å; T133-R137 PolarHBondContact O-N 3.37Å; T134-R137 PolarHBondContact O-N 3.38Å; R137-L139 VanDerWaalsContact C-N 3.25Å; R137-L139 PolarHBondContact O-N 3.42Å; R137-G140 PolarHBondContact O-N 2.81Å; R137-Q142 HydrophobicContact CG-CB 4.42Å
138	A	89.6	Confident	87.8	Confident	61 Å²	61	50 Å²	50	50%	0.504	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-27.9	175.9	0	0	0	0	0	113.1	T134 L135 L136 G140	T134-A138 PolarHBondContact O-N 2.88Å; L135-A138 PolarHBondContact O-N 2.73Å; L136-A138 VanDerWaalsContact C-N 3.32Å; A138-G140 PolarHBondContact O-N 3Å
139	L	87.9	Confident	85.7	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-72.8	-14.7	173.2	-170.2	61.8	0	0	0	113.2	R31 I33 L135 L136 R137 Y183 T184 A187	R31-L139 HydrophobicContact CB-CD1 4.47Å; R31-L139 HydrophobicContact CG-CD1 4.28Å; I33-L139 HydrophobicContact CG2-CB 4.21Å; I33-L139 HydrophobicContact CG2-CD1 4.16Å; I33-L139 HydrophobicContact CG2-CD2 3.88Å; I33-L139 HydrophobicContact CG2-CG 4.32Å; L135-L139 PolarHBondContact O-N 3.24Å; L136-L139 HydrophobicContact CD2-CD2 4.18Å; L136-L139 WeakPolarHBondContact O-CB 3.22Å; L136-L139 PolarHBondContact O-N 2.83Å; R137-L139 VanDerWaalsContact C-N 3.25Å; R137-L139 PolarHBondContact O-N 3.42Å; L139-Y183 HydrophobicContact CD2-CE1 4.08Å; L139-T184 HydrophobicContact CD2-CG2 4.29Å; L139-A187 HydrophobicContact CD1-CB 4.42Å; L139-A187 HydrophobicContact CD2-CB 3.86Å; L139-A187 HydrophobicContact CG-CB 4.17Å
140	G	85.6	Confident	83.4	Confident	23 Å²	23	60.8 Å²	60.8	24%	0.237	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.7	1.3	-178.3	0	0	0	0	0	114.6	L136 R137 A138 Q142 Q143 E144	L136-G140 PolarHBondContact O-N 3.49Å; R137-G140 PolarHBondContact O-N 2.81Å; A138-G140 PolarHBondContact O-N 3Å; G140-Q142 VanDerWaalsContact C-N 3.28Å; G140-Q142 PolarHBondContact O-N 3.25Å; G140-Q143 PolarHBondContact O-N 3.48Å; G140-E144 PolarHBondContact O-N 3.07Å
141	A	82.2	Confident	81.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.7	-38	-175	0	0	0	0	0	113.3	W91 L136 A145 Y183	W91-A141 HydrophobicContact CE3-CB 4.3Å; L136-A141 HydrophobicContact CB-CB 4.09Å; L136-A141 HydrophobicContact CD2-CB 4.43Å; L136-A141 WeakPolarHBondContact O-CB 3.43Å; L136-A141 PolarHBondContact O-N 3.1Å; A141-A145 VanDerWaalsContact O-CB 3.22Å; A141-A145 WeakPolarHBondContact O-CB 3.42Å; A141-A145 PolarHBondContact O-N 3.47Å; A141-Y183 VanDerWaalsContact CA-OH 3.29Å; A141-Y183 WeakPolarHBondContact CA-OH 3.47Å; A141-Y183 HydrophobicContact CB-CE1 3.68Å; A141-Y183 WeakPolarHBondContact CB-OH 3.46Å
142	Q	80.8	Confident	78.9	Confident	58 Å²	58	60.4 Å²	60.4	27%	0.271	36%	0.363	S	S	.	.	H	α-helix	trans	-65.4	-44	176	-176.9	174.7	7.1	0	0	111.7	W91 R137 G140 A145 I146	W91-Q142 HydrophobicContact CD2-CB 4.04Å; W91-Q142 HydrophobicContact CD2-CG 4.43Å; W91-Q142 HydrophobicContact CE3-CB 4.07Å; W91-Q142 HydrophobicContact CH2-CB 3.69Å; W91-Q142 HydrophobicContact CH2-CG 4.06Å; W91-Q142 HydrophobicContact CZ2-CB 3.63Å; W91-Q142 VanDerWaalsContact CZ2-CD 3.43Å; W91-Q142 HydrophobicContact CZ2-CG 3.52Å; W91-Q142 HydrophobicContact CZ3-CB 3.91Å; R137-Q142 HydrophobicContact CG-CB 4.42Å; G140-Q142 VanDerWaalsContact C-N 3.28Å; G140-Q142 PolarHBondContact O-N 3.25Å; Q142-A145 PolarHBondContact O-N 3.15Å; Q142-I146 HydrophobicContact CG-CD1 3.63Å; Q142-I146 HydrophobicContact CG-CG1 4.45Å; Q142-I146 WeakPolarHBondContact O-CB 3.3Å; Q142-I146 WeakPolarHBondContact O-CD1 3.4Å; Q142-I146 WeakPolarHBondContact O-CG1 3.3Å; Q142-I146 PolarHBondContact O-N 2.99Å
143	Q	82.1	Confident	76.7	Confident	124 Å²	124	65 Å²	65	58%	0.579	40%	0.395	S	S	*	.	H	α-helix	trans	-68	-43.4	-179	-173.7	61.4	47.7	0	0	110.4	G140 A145 I146 S147	G140-Q143 PolarHBondContact O-N 3.48Å; Q143-A145 VanDerWaalsContact C-N 3.3Å; Q143-A145 PolarHBondContact O-N 3.38Å; Q143-I146 PolarHBondContact O-N 2.97Å; Q143-S147 PolarHBondContact NE2-OG 3.5Å; Q143-S147 VanDerWaalsContact O-CB 3.28Å; Q143-S147 WeakPolarHBondContact O-CB 3.47Å; Q143-S147 PolarHBondContact O-N 3.49Å; Q143-S147 PolarHBondContact O-OG 3.34Å
144	E	80.3	Confident	75	Confident	67 Å²	67	64.8 Å²	64.8	31%	0.313	40%	0.396	S	S	.	.	H	α-helix	trans	-58.2	-44.3	173.6	-72.1	-179.1	169.9	0	0	111	A87 G140 I146 S147 L148 Y183	A87-E144 HydrophobicContact CB-CB 3.71Å; A87-E144 WeakPolarHBondContact CB-OE2 3.46Å; G140-E144 PolarHBondContact O-N 3.07Å; E144-I146 VanDerWaalsContact C-N 3.35Å; E144-I146 PolarHBondContact O-N 2.94Å; E144-S147 PolarHBondContact O-N 3.23Å; E144-L148 WeakPolarHBondContact O-CD1 3.36Å; E144-Y183 PolarHBondContact OE2-OH 3.39Å
145	A	78	Confident	73.5	Confident	19 Å²	19	64.6 Å²	64.6	16%	0.157	40%	0.403	C	S	.	.	H	α-helix	trans	-66.3	-33.2	179.2	0	0	0	0	0	114	V88 W91 A141 Q142 Q143	V88-A145 HydrophobicContact CB-CB 4.46Å; V88-A145 HydrophobicContact CG2-CB 3.94Å; W91-A145 HydrophobicContact CB-CB 4.06Å; W91-A145 HydrophobicContact CG-CB 4.26Å; A141-A145 VanDerWaalsContact O-CB 3.22Å; A141-A145 WeakPolarHBondContact O-CB 3.42Å; A141-A145 PolarHBondContact O-N 3.47Å; Q142-A145 PolarHBondContact O-N 3.15Å; Q143-A145 VanDerWaalsContact C-N 3.3Å; Q143-A145 PolarHBondContact O-N 3.38Å
146	I	78	Confident	72.5	Confident	109 Å²	109	69 Å²	69	56%	0.559	43%	0.433	S	S	*	.	H	α-helix	trans	-82.6	-29.6	179.7	-66.7	167.3	0	0	0	111.7	Q142 Q143 E144	Q142-I146 HydrophobicContact CG-CD1 3.63Å; Q142-I146 HydrophobicContact CG-CG1 4.45Å; Q142-I146 WeakPolarHBondContact O-CB 3.3Å; Q142-I146 WeakPolarHBondContact O-CD1 3.4Å; Q142-I146 WeakPolarHBondContact O-CG1 3.3Å; Q142-I146 PolarHBondContact O-N 2.99Å; Q143-I146 PolarHBondContact O-N 2.97Å; E144-I146 VanDerWaalsContact C-N 3.35Å; E144-I146 PolarHBondContact O-N 2.94Å
147	S	75.8	Confident	72.1	Confident	71 Å²	71	70.9 Å²	70.9	50%	0.497	44%	0.443	S	S	.	.	H	α-helix	trans	-82.1	-14.3	-172.7	-52.4	0	0	0	0	113.9	Q143 E144 P149	Q143-S147 PolarHBondContact NE2-OG 3.5Å; Q143-S147 VanDerWaalsContact O-CB 3.28Å; Q143-S147 WeakPolarHBondContact O-CB 3.47Å; Q143-S147 PolarHBondContact O-N 3.49Å; Q143-S147 PolarHBondContact O-OG 3.34Å; E144-S147 PolarHBondContact O-N 3.23Å; S147-P149 VanDerWaalsContact O-CD 3.32Å; S147-P149 WeakPolarHBondContact O-CD 3.26Å
148	L	71.3	Confident	72.1	Confident	53 Å²	53	73.9 Å²	73.9	28%	0.277	45%	0.454	S	S	.	.	S	Bend	trans	-69.2	116.7	173.6	-100.2	109.6	0	0	0	110	G84 V88 E144	G84-L148 VanDerWaalsContact C-CD1 3.41Å; V88-L148 HydrophobicContact CG2-CD1 4.32Å; E144-L148 WeakPolarHBondContact O-CD1 3.36Å
149	P	51.7	Low	72.4	Confident	115 Å²	115	74.5 Å²	74.5	75%	0.747	45%	0.452	S	S	*	.	S	Bend	trans	-70.6	135.9	177.4	20.9	-15.7	0	0	0	109.9	S147	S147-P149 VanDerWaalsContact O-CD 3.32Å; S147-P149 WeakPolarHBondContact O-CD 3.26Å
150	D	51	Low	72.8	Confident	117 Å²	117	77.2 Å²	77.2	63%	0.626	47%	0.465	S	S	*	.			trans	70.3	88.6	-179.8	-76.1	-28.3	0	0	0	118.1	A152 S153 A154	D150-A152 HydrophobicContact CB-CB 4.31Å; D150-A152 PolarHBondContact O-N 3.16Å; D150-S153 PolarHBondContact O-N 3.25Å; D150-S153 PolarHBondContact O-OG 3.42Å; D150-S153 VanDerWaalsContact O-OG 3.12Å; D150-A154 PolarHBondContact O-N 3.21Å
151	A	50.8	Low	73.3	Confident	93 Å²	93	79 Å²	79	77%	0.769	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-12.4	150.7	0	0	0	0	0	113.9
152	A	47.7	Very low	73.9	Confident	95 Å²	95	79 Å²	79	79%	0.785	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-20.5	173	0	0	0	0	0	113.9	D150	D150-A152 HydrophobicContact CB-CB 4.31Å; D150-A152 PolarHBondContact O-N 3.16Å
153	S	51.9	Low	74.6	Confident	96 Å²	96	79.6 Å²	79.6	67%	0.671	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-22.2	179.6	74.5	0	0	0	0	113.7	D150 A155	D150-S153 PolarHBondContact O-N 3.25Å; D150-S153 PolarHBondContact O-OG 3.42Å; D150-S153 VanDerWaalsContact O-OG 3.12Å; S153-A155 PolarHBondContact O-N 3.34Å
154	A	58.3	Low	75.1	Confident	25 Å²	25	75.8 Å²	75.8	21%	0.207	46%	0.463	C	S	.	.	S	Bend	trans	-68.9	121.4	170.9	0	0	0	0	0	109.3	D150	D150-A154 PolarHBondContact O-N 3.21Å
155	A	64.6	Low	75.7	Confident	77 Å²	77	72.8 Å²	72.8	64%	0.636	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-53.1	133.1	174.7	0	0	0	0	0	109.7	S153 L157	S153-A155 PolarHBondContact O-N 3.34Å; A155-L157 PolarHBondContact O-N 2.96Å
156	P	71.8	Confident	76.4	Confident	118 Å²	118	73.6 Å²	73.6	77%	0.766	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-52	140.8	-179.8	-26.5	32.5	0	0	0	111.5	R158	P156-R158 PolarHBondContact O-N 3.13Å
157	L	84.4	Confident	77.1	Confident	38 Å²	38	70.8 Å²	70.8	20%	0.199	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-51.2	119.5	173.1	179.4	70.5	0	0	0	108.3	Q92 L96 A155 T159	Q92-L157 HydrophobicContact CB-CD2 4.12Å; L96-L157 HydrophobicContact CB-CD2 4.33Å; L96-L157 HydrophobicContact CD2-CD2 3.83Å; A155-L157 PolarHBondContact O-N 2.96Å; L157-T159 HydrophobicContact CD2-CG2 4.5Å; L157-T159 HydrophobicContact CG-CG2 4.5Å; L157-T159 PolarHBondContact O-N 2.97Å
158	R	91.1	Very high	78.1	Confident	186 Å²	186	67.5 Å²	67.5	70%	0.702	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-69.6	131.2	175	-68.2	-175.9	-178.7	166.3	1.3	108.8	D70 P156	D70-R158 HydrophobicContact CB-CB 3.7Å; D70-R158 VanDerWaalsContact CB-O 3.26Å; D70-R158 WeakPolarHBondContact CB-O 3.46Å; D70-R158 PolarHBondContact N-O 3.44Å; P156-R158 PolarHBondContact O-N 3.13Å
159	T	95.6	Very high	79.3	Confident	74 Å²	74	65 Å²	65	45%	0.454	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	155	-178.9	59.6	0	0	0	0	110.6	T67 V68 L96 L157	T67-T159 HydrophobicContact CG2-CG2 4.05Å; V68-T159 CarbonylContact O-C 3.47Å; V68-T159 WeakPolarHBondContact O-CA 3.19Å; L96-T159 HydrophobicContact CD2-CG2 3.53Å; L157-T159 HydrophobicContact CD2-CG2 4.5Å; L157-T159 HydrophobicContact CG-CG2 4.5Å; L157-T159 PolarHBondContact O-N 2.97Å
160	I	96.2	Very high	81.4	Confident	63 Å²	63	65.1 Å²	65.1	32%	0.323	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	174.1	170	65.2	-179.8	0	0	0	108.4	V68 D70 V171	V68-I160 HydrophobicContact CG2-CD1 4.13Å; V68-I160 HydrophobicContact CG2-CG1 3.4Å; V68-I160 WeakPolarHBondContact CG2-O 3.29Å; V68-I160 PolarHBondContact N-O 3Å; V68-I160 PolarHBondContact O-N 3.33Å; V68-I160 VanDerWaalsContact O-O 3.1Å; D70-I160 HydrophobicContact CB-CG2 4.48Å; I160-V171 HydrophobicContact CD1-CG2 3.98Å
161	T	96.7	Very high	83.6	Confident	62 Å²	62	59.8 Å²	59.8	38%	0.38	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	146.8	175.2	55.4	0	0	0	0	111.3	N65 I66 K167	N65-T161 HydrophobicContact CB-CG2 4.28Å; I66-T161 CarbonylContact O-C 3.52Å; I66-T161 VanDerWaalsContact O-CA 3.3Å; I66-T161 WeakPolarHBondContact O-CA 3.29Å; T161-K167 WeakPolarHBondContact O-CE 3.47Å; T161-K167 PolarHBondContact O-NZ 3.39Å
162	A	95.2	Very high	85.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.1	169.4	0	0	0	0	0	109.6	L62 I66 V68 K167 L168	L62-A162 HydrophobicContact CD1-CB 4.43Å; I66-A162 PolarHBondContact N-O 3.04Å; I66-A162 PolarHBondContact O-N 3.08Å; V68-A162 HydrophobicContact CG1-CB 3.94Å; V68-A162 HydrophobicContact CG2-CB 4.28Å; A162-K167 HydrophobicContact CB-CB 4.2Å; A162-K167 HydrophobicContact CB-CD 4.44Å; A162-K167 HydrophobicContact CB-CG 4.08Å; A162-L168 HydrophobicContact CB-CB 4.29Å
163	D	93.5	Very high	88.2	Confident	69 Å²	69	51.1 Å²	51.1	37%	0.369	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-9.3	-179.9	47.3	8.8	0	0	0	112.4	L62	L62-D163 WeakPolarHBondContact CB-O 2.97Å; L62-D163 PolarHBondContact N-O 3.43Å
164	T	92.5	Very high	90.4	Very high	45 Å²	45	48.4 Å²	48.4	28%	0.276	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	152.3	-178.3	54.8	0	0	0	0	110.8	C60 C166 K167 L168	C60-T164 CarbonylContact O-C 3.59Å; C60-T164 VanDerWaalsContact O-CA 3.26Å; C60-T164 WeakPolarHBondContact O-CA 3.3Å; T164-C166 PolarHBondContact O-N 3.5Å; T164-K167 PolarHBondContact O-N 2.91Å; T164-K167 WeakPolarHBondContact OG1-CB 3.48Å; T164-K167 PolarHBondContact OG1-N 2.94Å; T164-L168 PolarHBondContact O-N 3.37Å
165	F	93	Very high	92.3	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-33.9	171.6	-76	-81.2	0	0	0	112	T53 C60 L62 G104 L108 L118 V122 K167 L168 F169	T53-F165 HydrophobicContact CG2-CB 4.27Å; C60-F165 HydrophobicContact CB-CB 4.09Å; C60-F165 HydrophobicContact CB-CD2 4.45Å; C60-F165 WeakPolarHBondContact O-CD2 3.21Å; C60-F165 PolarHBondContact O-N 3.41Å; L62-F165 HydrophobicContact CD2-CD1 4.07Å; L62-F165 HydrophobicContact CD2-CD2 3.82Å; L62-F165 HydrophobicContact CD2-CE1 3.73Å; L62-F165 HydrophobicContact CD2-CE2 3.45Å; L62-F165 VanDerWaalsContact CD2-CE2 3.45Å; L62-F165 HydrophobicContact CD2-CG 4.11Å; L62-F165 HydrophobicContact CD2-CZ 3.4Å; L62-F165 VanDerWaalsContact CD2-CZ 3.4Å; L62-F165 HydrophobicContact CG-CD2 4.2Å; L62-F165 HydrophobicContact CG-CE2 4.24Å; G104-F165 VanDerWaalsContact O-CZ 3.22Å; G104-F165 WeakPolarHBondContact O-CZ 3.2Å; L108-F165 HydrophobicContact CB-CZ 3.89Å; L118-F165 HydrophobicContact CD1-CB 3.8Å; L118-F165 HydrophobicContact CD1-CD1 3.81Å; L118-F165 HydrophobicContact CD1-CD2 4.5Å; L118-F165 HydrophobicContact CD1-CG 3.79Å; L118-F165 HydrophobicContact CD2-CB 4.31Å; L118-F165 HydrophobicContact CD2-CD1 4.18Å; L118-F165 HydrophobicContact CD2-CD2 3.64Å; L118-F165 HydrophobicContact CD2-CE1 4.4Å; L118-F165 HydrophobicContact CD2-CE2 3.9Å; L118-F165 HydrophobicContact CD2-CG 3.79Å; L118-F165 HydrophobicContact CD2-CZ 4.26Å; L118-F165 HydrophobicContact CG-CD1 4.37Å; L118-F165 HydrophobicContact CG-CG 4.35Å; V122-F165 HydrophobicContact CG2-CD1 4.4Å; V122-F165 HydrophobicContact CG2-CE1 4.07Å; F165-K167 VanDerWaalsContact C-N 3.32Å; F165-K167 PolarHBondContact O-N 3.49Å; F165-L168 HydrophobicContact CD1-CD2 4.22Å; F165-L168 PolarHBondContact O-N 3.15Å; F165-F169 HydrophobicContact CB-CD2 4.27Å; F165-F169 HydrophobicContact CB-CE2 4.48Å; F165-F169 HydrophobicContact CD1-CE2 4.03Å; F165-F169 WeakPolarHBondContact O-CB 3.41Å; F165-F169 VanDerWaalsContact O-CD2 3.3Å; F165-F169 WeakPolarHBondContact O-CD2 3.33Å; F165-F169 PolarHBondContact O-N 2.94Å
166	C	92.6	Very high	93.9	Very high	35 Å²	35	43.6 Å²	43.6	24%	0.236	22%	0.223	C	C	.	.	H	α-helix	trans	-56.4	-47.5	173.3	-178.5	0	0	0	0	111.3	T164 R170	T164-C166 PolarHBondContact O-N 3.5Å; C166-R170 WeakPolarHBondContact O-CB 3.26Å; C166-R170 PolarHBondContact O-N 3.4Å
167	K	94.3	Very high	95.1	Very high	50 Å²	50	43.7 Å²	43.7	22%	0.217	21%	0.208	C	C	.	.	H	α-helix	trans	-67.4	-40	177.8	-168.9	166.7	179.2	-160.9	0	112	T161 A162 T164 F165 V171	T161-K167 WeakPolarHBondContact O-CE 3.47Å; T161-K167 PolarHBondContact O-NZ 3.39Å; A162-K167 HydrophobicContact CB-CB 4.2Å; A162-K167 HydrophobicContact CB-CD 4.44Å; A162-K167 HydrophobicContact CB-CG 4.08Å; T164-K167 PolarHBondContact O-N 2.91Å; T164-K167 WeakPolarHBondContact OG1-CB 3.48Å; T164-K167 PolarHBondContact OG1-N 2.94Å; F165-K167 VanDerWaalsContact C-N 3.32Å; F165-K167 PolarHBondContact O-N 3.49Å; K167-V171 VanDerWaalsContact O-CG2 3.3Å; K167-V171 WeakPolarHBondContact O-CG2 3.48Å; K167-V171 PolarHBondContact O-N 2.97Å
168	L	96.3	Very high	95.7	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-49.6	176.5	178.9	61	0	0	0	112.1	V68 A100 V101 A162 T164 F165 V171 Y172	V68-L168 HydrophobicContact CG1-CD1 3.81Å; A100-L168 HydrophobicContact CB-CD1 3.96Å; V101-L168 HydrophobicContact CG2-CD1 4.36Å; A162-L168 HydrophobicContact CB-CB 4.29Å; T164-L168 PolarHBondContact O-N 3.37Å; F165-L168 HydrophobicContact CD1-CD2 4.22Å; F165-L168 PolarHBondContact O-N 3.15Å; L168-V171 WeakPolarHBondContact O-CB 3.41Å; L168-V171 PolarHBondContact O-N 2.91Å; L168-V171 VanDerWaalsContact O-N 3.13Å; L168-Y172 PolarHBondContact O-N 3.25Å
169	F	95.9	Very high	95.9	Very high	1 Å²	1	34.2 Å²	34.2	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-70.6	-32.3	179.6	-80.9	-70.1	0	0	0	112.9	A49 T53 L118 H121 V122 A125 F165 V171 Y172 S173	A49-F169 HydrophobicContact CB-CD1 3.36Å; A49-F169 HydrophobicContact CB-CE1 3.59Å; A49-F169 HydrophobicContact CB-CG 4.05Å; A49-F169 HydrophobicContact CB-CZ 4.44Å; T53-F169 HydrophobicContact CG2-CB 4.44Å; T53-F169 HydrophobicContact CG2-CD2 3.45Å; T53-F169 VanDerWaalsContact CG2-CD2 3.45Å; T53-F169 HydrophobicContact CG2-CE2 4.02Å; T53-F169 HydrophobicContact CG2-CG 4.19Å; L118-F169 HydrophobicContact CD1-CD2 4.2Å; L118-F169 HydrophobicContact CD1-CE2 3.53Å; L118-F169 HydrophobicContact CD1-CZ 4.45Å; H121-F169 HydrophobicContact CB-CE1 4.36Å; H121-F169 HydrophobicContact CB-CZ 4.11Å; V122-F169 HydrophobicContact CB-CZ 4.47Å; V122-F169 HydrophobicContact CG2-CE2 3.98Å; V122-F169 HydrophobicContact CG2-CZ 3.72Å; A125-F169 HydrophobicContact CB-CE1 3.96Å; F165-F169 HydrophobicContact CB-CD2 4.27Å; F165-F169 HydrophobicContact CB-CE2 4.48Å; F165-F169 HydrophobicContact CD1-CE2 4.03Å; F165-F169 WeakPolarHBondContact O-CB 3.41Å; F165-F169 VanDerWaalsContact O-CD2 3.3Å; F165-F169 WeakPolarHBondContact O-CD2 3.33Å; F165-F169 PolarHBondContact O-N 2.94Å; F169-V171 VanDerWaalsContact C-N 3.31Å; F169-V171 PolarHBondContact O-N 3.44Å; F169-Y172 AromaticContact CD1-CD1 3.98Å; F169-Y172 HydrophobicContact CD1-CD1 3.98Å; F169-Y172 HydrophobicContact CE1-CD1 4.42Å; F169-Y172 PolarHBondContact O-N 3.49Å; F169-S173 WeakPolarHBondContact O-CB 3.48Å; F169-S173 PolarHBondContact O-N 3.29Å
170	R	95.8	Very high	95.9	Very high	117 Å²	117	30.7 Å²	30.7	44%	0.442	15%	0.152	S	C	.	.	H	α-helix	trans	-60.8	-41.3	167.6	-179.7	170.9	69.7	-166	-1	111.6	E50 C166 N174	E50-R170 HydrophobicContact CG-CB 4.35Å; E50-R170 WeakPolarHBondContact OE1-CG 3.21Å; C166-R170 WeakPolarHBondContact O-CB 3.26Å; C166-R170 PolarHBondContact O-N 3.4Å; R170-N174 WeakPolarHBondContact CG-ND2 3.47Å; R170-N174 VanDerWaalsContact O-CB 3.25Å; R170-N174 WeakPolarHBondContact O-CB 3.47Å; R170-N174 PolarHBondContact O-N 3Å; R170-N174 PolarHBondContact O-ND2 3.15Å
171	V	97.6	Very high	95.9	Very high	5 Å²	5	33 Å²	33	3%	0.03	16%	0.16	C	C	.	.	H	α-helix	trans	-65.7	-44.9	174.4	167.8	0	0	0	0	110.8	V68 P69 T71 L97 I160 K167 L168 F169 S173 N174 F175	V68-V171 HydrophobicContact CB-CG1 3.99Å; V68-V171 HydrophobicContact CG2-CB 4.38Å; V68-V171 HydrophobicContact CG2-CG1 3.98Å; V68-V171 HydrophobicContact CG2-CG2 3.95Å; P69-V171 HydrophobicContact CG-CG1 4.35Å; T71-V171 HydrophobicContact CG2-CB 4.46Å; T71-V171 HydrophobicContact CG2-CG1 3.75Å; T71-V171 WeakPolarHBondContact CG2-O 3.29Å; L97-V171 HydrophobicContact CD1-CG1 4.04Å; I160-V171 HydrophobicContact CD1-CG2 3.98Å; K167-V171 VanDerWaalsContact O-CG2 3.3Å; K167-V171 WeakPolarHBondContact O-CG2 3.48Å; K167-V171 PolarHBondContact O-N 2.97Å; L168-V171 WeakPolarHBondContact O-CB 3.41Å; L168-V171 PolarHBondContact O-N 2.91Å; L168-V171 VanDerWaalsContact O-N 3.13Å; F169-V171 VanDerWaalsContact C-N 3.31Å; F169-V171 PolarHBondContact O-N 3.44Å; V171-S173 PolarHBondContact O-N 3.11Å; V171-N174 PolarHBondContact O-N 3.26Å; V171-F175 VanDerWaalsContact O-CB 3.29Å; V171-F175 WeakPolarHBondContact O-CB 3.48Å; V171-F175 PolarHBondContact O-N 3.42Å
172	Y	98	Very high	95.9	Very high	3 Å²	3	32.6 Å²	32.6	1%	0.012	16%	0.156	C	C	.	.	H	α-helix	trans	-54.8	-54.8	174.7	173.5	-125.7	0	0	0	112.2	A46 L97 A125 L129 L168 F169 N174 F175 L176	A46-Y172 VanDerWaalsContact CA-CE1 3.49Å; A46-Y172 HydrophobicContact CB-CD1 3.53Å; A46-Y172 HydrophobicContact CB-CE1 3.26Å; A46-Y172 HydrophobicContact CB-CG 4.32Å; L97-Y172 HydrophobicContact CD2-CD2 4.02Å; A125-Y172 HydrophobicContact CB-CD1 4.44Å; A125-Y172 HydrophobicContact CB-CE1 3.99Å; L129-Y172 HydrophobicContact CD1-CD2 4.42Å; L129-Y172 HydrophobicContact CD1-CE2 4.3Å; L129-Y172 HydrophobicContact CD2-CD2 4.02Å; L129-Y172 HydrophobicContact CD2-CE2 3.67Å; L129-Y172 HydrophobicContact CG-CD2 4.35Å; L129-Y172 HydrophobicContact CG-CE2 3.82Å; L168-Y172 PolarHBondContact O-N 3.25Å; F169-Y172 AromaticContact CD1-CD1 3.98Å; F169-Y172 HydrophobicContact CD1-CD1 3.98Å; F169-Y172 HydrophobicContact CE1-CD1 4.42Å; F169-Y172 PolarHBondContact O-N 3.49Å; Y172-N174 PolarHBondContact O-N 2.88Å; Y172-F175 PolarHBondContact O-N 2.92Å; Y172-L176 HydrophobicContact CD2-CD1 4.29Å; Y172-L176 HydrophobicContact CD2-CD2 4.4Å; Y172-L176 HydrophobicContact CD2-CG 4.11Å; Y172-L176 HydrophobicContact CE2-CD1 3.57Å; Y172-L176 HydrophobicContact CE2-CD2 4.04Å; Y172-L176 HydrophobicContact CE2-CG 3.83Å; Y172-L176 WeakPolarHBondContact O-CG 3.48Å; Y172-L176 PolarHBondContact O-N 2.98Å; Y172-L176 VanDerWaalsContact O-N 3.08Å
173	S	97.9	Very high	95.9	Very high	4 Å²	4	32.6 Å²	32.6	3%	0.028	16%	0.156	C	C	.	.	H	α-helix	trans	-56.1	-48.2	176.3	171.6	0	0	0	0	112.4	E50 F169 V171 F175 L176 R177	E50-S173 WeakPolarHBondContact OE2-CB 2.93Å; E50-S173 PolarHBondContact OE2-OG 3.01Å; F169-S173 WeakPolarHBondContact O-CB 3.48Å; F169-S173 PolarHBondContact O-N 3.29Å; V171-S173 PolarHBondContact O-N 3.11Å; S173-F175 PolarHBondContact O-N 3.02Å; S173-L176 PolarHBondContact O-N 3.07Å; S173-R177 WeakPolarHBondContact O-CB 3.48Å; S173-R177 WeakPolarHBondContact O-CD 3.13Å; S173-R177 VanDerWaalsContact O-CG 3.23Å; S173-R177 WeakPolarHBondContact O-CG 3.37Å; S173-R177 PolarHBondContact O-N 3.37Å; S173-R177 PolarHBondContact OG-NH1 3.35Å
174	N	98.1	Very high	95.9	Very high	39 Å²	39	29.6 Å²	29.6	21%	0.209	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-40.7	178.7	-82.5	-58.3	0	0	0	113.3	T71 R170 V171 Y172 R177 G178	T71-N174 HydrophobicContact CG2-CB 4.05Å; T71-N174 WeakPolarHBondContact OG1-CB 3.45Å; R170-N174 WeakPolarHBondContact CG-ND2 3.47Å; R170-N174 VanDerWaalsContact O-CB 3.25Å; R170-N174 WeakPolarHBondContact O-CB 3.47Å; R170-N174 PolarHBondContact O-N 3Å; R170-N174 PolarHBondContact O-ND2 3.15Å; V171-N174 PolarHBondContact O-N 3.26Å; Y172-N174 PolarHBondContact O-N 2.88Å; N174-R177 PolarHBondContact OD1-NE 3.38Å; N174-R177 PolarHBondContact OD1-NH2 3.11Å; N174-G178 WeakPolarHBondContact O-CA 3.42Å; N174-G178 PolarHBondContact O-N 3.08Å
175	F	98.2	Very high	96	Very high	1 Å²	1	29.1 Å²	29.1	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-47.8	179.6	-174	-95.8	0	0	0	111	P69 T71 V90 L94 L97 V171 Y172 S173 K179 L180	P69-F175 HydrophobicContact CB-CD2 4.44Å; P69-F175 HydrophobicContact CG-CD2 4.09Å; P69-F175 HydrophobicContact CG-CE2 4.43Å; T71-F175 HydrophobicContact CG2-CB 3.75Å; T71-F175 HydrophobicContact CG2-CD2 4.28Å; V90-F175 HydrophobicContact CG1-CZ 4.43Å; V90-F175 WeakPolarHBondContact O-CZ 3.01Å; L94-F175 HydrophobicContact CB-CE1 4.01Å; L94-F175 HydrophobicContact CB-CZ 4.24Å; L94-F175 HydrophobicContact CD1-CE1 4.15Å; L97-F175 HydrophobicContact CD2-CB 3.84Å; L97-F175 HydrophobicContact CD2-CD1 3.63Å; L97-F175 HydrophobicContact CD2-CE1 4.42Å; L97-F175 HydrophobicContact CD2-CG 3.81Å; V171-F175 VanDerWaalsContact O-CB 3.29Å; V171-F175 WeakPolarHBondContact O-CB 3.48Å; V171-F175 PolarHBondContact O-N 3.42Å; Y172-F175 PolarHBondContact O-N 2.92Å; S173-F175 PolarHBondContact O-N 3.02Å; F175-K179 HydrophobicContact CE2-CB 4.47Å; F175-K179 HydrophobicContact CE2-CD 4.47Å; F175-K179 PolarHBondContact O-N 3.28Å; F175-L180 HydrophobicContact CE1-CB 4.4Å; F175-L180 PolarHBondContact O-N 3.2Å
176	L	97.8	Very high	95.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-64.3	-48.5	179.3	-59.8	-161.7	0	0	0	111.5	L43 A46 I132 Y172 S173 G178 L180 K181	L43-L176 HydrophobicContact CD2-CB 3.58Å; L43-L176 WeakPolarHBondContact CD2-O 3.45Å; A46-L176 HydrophobicContact CB-CD1 3.86Å; I132-L176 HydrophobicContact CD1-CD1 3.96Å; I132-L176 HydrophobicContact CD1-CD2 3.8Å; Y172-L176 HydrophobicContact CD2-CD1 4.29Å; Y172-L176 HydrophobicContact CD2-CD2 4.4Å; Y172-L176 HydrophobicContact CD2-CG 4.11Å; Y172-L176 HydrophobicContact CE2-CD1 3.57Å; Y172-L176 HydrophobicContact CE2-CD2 4.04Å; Y172-L176 HydrophobicContact CE2-CG 3.83Å; Y172-L176 WeakPolarHBondContact O-CG 3.48Å; Y172-L176 PolarHBondContact O-N 2.98Å; Y172-L176 VanDerWaalsContact O-N 3.08Å; S173-L176 PolarHBondContact O-N 3.07Å; L176-G178 VanDerWaalsContact C-N 3.3Å; L176-G178 PolarHBondContact O-N 2.84Å; L176-L180 HydrophobicContact CB-CD2 4.32Å; L176-L180 HydrophobicContact CD2-CD2 3.43Å; L176-L180 VanDerWaalsContact CD2-CD2 3.43Å; L176-L180 HydrophobicContact CG-CD2 4.4Å; L176-K181 WeakPolarHBondContact O-CB 3.44Å; L176-K181 PolarHBondContact O-N 3.11Å; L176-K181 VanDerWaalsContact O-N 3.11Å
177	R	96.6	Very high	95.8	Very high	119 Å²	119	30.1 Å²	30.1	45%	0.449	15%	0.146	S	C	.	.	I	π-helix	trans	-72.9	-23	-177	79.1	-164.3	-178.9	-171.8	4.5	113.9	L43 E50 S173 N174	L43-R177 VanDerWaalsContact CD2-CA 3.46Å; L43-R177 HydrophobicContact CD2-CB 3.88Å; L43-R177 VanDerWaalsContact CD2-N 3.34Å; E50-R177 IonicContact OE2-NH1 2.61Å; E50-R177 PolarHBondContact OE2-NH1 3.41Å; S173-R177 WeakPolarHBondContact O-CB 3.48Å; S173-R177 WeakPolarHBondContact O-CD 3.13Å; S173-R177 VanDerWaalsContact O-CG 3.23Å; S173-R177 WeakPolarHBondContact O-CG 3.37Å; S173-R177 PolarHBondContact O-N 3.37Å; S173-R177 PolarHBondContact OG-NH1 3.35Å; N174-R177 PolarHBondContact OD1-NE 3.38Å; N174-R177 PolarHBondContact OD1-NH2 3.11Å
178	G	96.4	Very high	95.6	Very high	14 Å²	14	28.4 Å²	28.4	14%	0.144	14%	0.14	C	C	.	.	I	π-helix	trans	-95	-106.3	179.9	0	0	0	0	0	111.9	N174 L176 L180 K181 L182	N174-G178 WeakPolarHBondContact O-CA 3.42Å; N174-G178 PolarHBondContact O-N 3.08Å; L176-G178 VanDerWaalsContact C-N 3.3Å; L176-G178 PolarHBondContact O-N 2.84Å; G178-L180 VanDerWaalsContact C-N 3.33Å; G178-L180 PolarHBondContact O-N 2.01Å; G178-K181 PolarHBondContact O-N 3.19Å; G178-L182 WeakPolarHBondContact O-CB 3.22Å; G178-L182 VanDerWaalsContact O-CG 3.27Å; G178-L182 WeakPolarHBondContact O-CG 3.47Å; G178-L182 PolarHBondContact O-N 2.96Å
179	K	95.8	Very high	95.1	Very high	11 Å²	11	35.5 Å²	35.5	5%	0.048	17%	0.167	C	C	.	.	I	π-helix	trans	-52.5	-46.7	-171	-66.2	-171.5	-180	-166.3	0	113	D70 K72 V73 W78 E89 V90 F175 L182 Y183	D70-K179 WeakPolarHBondContact O-CE 3.42Å; D70-K179 PolarHBondContact O-NZ 2.8Å; K72-K179 VanDerWaalsContact O-CE 3.25Å; K72-K179 WeakPolarHBondContact O-CE 3.34Å; V73-K179 HydrophobicContact CG2-CB 4.47Å; V73-K179 HydrophobicContact CG2-CD 4.45Å; V73-K179 HydrophobicContact CG2-CG 3.41Å; V73-K179 VanDerWaalsContact CG2-CG 3.41Å; W78-K179 HydrophobicContact CH2-CB 3.96Å; W78-K179 HydrophobicContact CH2-CG 4.13Å; W78-K179 HydrophobicContact CZ3-CB 4.31Å; W78-K179 HydrophobicContact CZ3-CD 4.17Å; W78-K179 HydrophobicContact CZ3-CG 3.96Å; E89-K179 WeakPolarHBondContact OE2-CE 3.37Å; E89-K179 IonicContact OE2-NZ 3.38Å; E89-K179 PolarHBondContact OE2-NZ 2.93Å; V90-K179 HydrophobicContact CG2-CB 4Å; F175-K179 HydrophobicContact CE2-CB 4.47Å; F175-K179 HydrophobicContact CE2-CD 4.47Å; F175-K179 PolarHBondContact O-N 3.28Å; K179-L182 PolarHBondContact O-N 3.42Å; K179-Y183 WeakPolarHBondContact O-CB 3.41Å; K179-Y183 PolarHBondContact O-N 2.92Å
180	L	96.4	Very high	94.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-61.8	-53.4	-178.9	179.1	69	0	0	0	111.7	L39 V90 I132 L136 F175 L176 G178 L182 Y183 T184	L39-L180 HydrophobicContact CD1-CD2 3.88Å; L39-L180 HydrophobicContact CD1-CG 4.37Å; V90-L180 HydrophobicContact CG1-CD1 3.69Å; I132-L180 HydrophobicContact CD1-CD2 4.26Å; I132-L180 HydrophobicContact CG2-CD1 4.13Å; I132-L180 HydrophobicContact CG2-CD2 3.76Å; L136-L180 HydrophobicContact CD1-CD1 3.6Å; L136-L180 HydrophobicContact CD2-CD1 3.78Å; L136-L180 HydrophobicContact CG-CD1 3.97Å; F175-L180 HydrophobicContact CE1-CB 4.4Å; F175-L180 PolarHBondContact O-N 3.2Å; L176-L180 HydrophobicContact CB-CD2 4.32Å; L176-L180 HydrophobicContact CD2-CD2 3.43Å; L176-L180 VanDerWaalsContact CD2-CD2 3.43Å; L176-L180 HydrophobicContact CG-CD2 4.4Å; G178-L180 VanDerWaalsContact C-N 3.33Å; G178-L180 PolarHBondContact O-N 2.01Å; L180-L182 VanDerWaalsContact C-N 3.29Å; L180-L182 PolarHBondContact O-N 3.31Å; L180-Y183 PolarHBondContact O-N 3.05Å; L180-T184 WeakPolarHBondContact O-CB 3.37Å; L180-T184 PolarHBondContact O-N 2.92Å; L180-T184 PolarHBondContact O-OG1 3.28Å; L180-T184 VanDerWaalsContact O-OG1 3.05Å
181	K	96.2	Very high	92.8	Very high	111 Å²	111	38.7 Å²	38.7	48%	0.483	19%	0.189	S	C	.	.	H	α-helix	trans	-59.9	-40.4	179.9	-173.4	176.9	-173.3	171.7	0	112.2	L39 L43 L176 G178 G185	L39-K181 HydrophobicContact CD2-CB 4.21Å; L39-K181 HydrophobicContact CD2-CG 4.13Å; L43-K181 HydrophobicContact CD1-CD 3.89Å; L176-K181 WeakPolarHBondContact O-CB 3.44Å; L176-K181 PolarHBondContact O-N 3.11Å; L176-K181 VanDerWaalsContact O-N 3.11Å; G178-K181 PolarHBondContact O-N 3.19Å; K181-G185 PolarHBondContact O-N 3.15Å
182	L	95.8	Very high	90.8	Very high	55 Å²	55	45.5 Å²	45.5	29%	0.288	23%	0.226	S	C	.	.	H	α-helix	trans	-65.7	-46.9	178.8	-69.1	170.6	0	0	0	112.1	V73 F75 W78 G178 K179 L180 G185 E186	V73-L182 HydrophobicContact CB-CD1 4.4Å; V73-L182 HydrophobicContact CG1-CD1 3.75Å; V73-L182 HydrophobicContact CG2-CD1 4.32Å; F75-L182 HydrophobicContact CD1-CD1 4.27Å; F75-L182 HydrophobicContact CE1-CD1 3.83Å; F75-L182 HydrophobicContact CE1-CD2 4.18Å; W78-L182 HydrophobicContact CZ2-CB 4.14Å; G178-L182 WeakPolarHBondContact O-CB 3.22Å; G178-L182 VanDerWaalsContact O-CG 3.27Å; G178-L182 WeakPolarHBondContact O-CG 3.47Å; G178-L182 PolarHBondContact O-N 2.96Å; K179-L182 PolarHBondContact O-N 3.42Å; L180-L182 VanDerWaalsContact C-N 3.29Å; L180-L182 PolarHBondContact O-N 3.31Å; L182-G185 PolarHBondContact O-N 3.43Å; L182-E186 PolarHBondContact O-N 3.11Å
183	Y	95.3	Very high	88.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-51.5	177.3	170.5	-108.1	0	0	0	111.4	V83 Q86 A87 V90 L136 L139 A141 E144 K179 L180 G185 E186 A187	V83-Y183 HydrophobicContact CG1-CE2 3.97Å; Q86-Y183 HydrophobicContact CB-CD2 3.78Å; Q86-Y183 HydrophobicContact CB-CE2 4.49Å; A87-Y183 HydrophobicContact CB-CD2 4.44Å; A87-Y183 HydrophobicContact CB-CE2 3.54Å; A87-Y183 WeakPolarHBondContact CB-OH 3.44Å; V90-Y183 HydrophobicContact CB-CD1 4.38Å; V90-Y183 HydrophobicContact CB-CG 4.48Å; V90-Y183 HydrophobicContact CG1-CD1 4.25Å; V90-Y183 HydrophobicContact CG2-CD1 4.41Å; V90-Y183 HydrophobicContact CG2-CG 4.11Å; L136-Y183 HydrophobicContact CD2-CD1 4.17Å; L136-Y183 HydrophobicContact CD2-CE1 4.08Å; L139-Y183 HydrophobicContact CD2-CE1 4.08Å; A141-Y183 VanDerWaalsContact CA-OH 3.29Å; A141-Y183 WeakPolarHBondContact CA-OH 3.47Å; A141-Y183 HydrophobicContact CB-CE1 3.68Å; A141-Y183 WeakPolarHBondContact CB-OH 3.46Å; E144-Y183 PolarHBondContact OE2-OH 3.39Å; K179-Y183 WeakPolarHBondContact O-CB 3.41Å; K179-Y183 PolarHBondContact O-N 2.92Å; L180-Y183 PolarHBondContact O-N 3.05Å; Y183-G185 PolarHBondContact O-N 2.8Å; Y183-E186 PolarHBondContact O-N 3.47Å; Y183-A187 HydrophobicContact CE1-CB 4.3Å; Y183-A187 HydrophobicContact CE2-CB 4.12Å; Y183-A187 WeakPolarHBondContact O-CB 3.45Å; Y183-A187 PolarHBondContact O-N 3.14Å
184	T	94.1	Very high	87.8	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-56.6	-41.7	179.3	-58.8	0	0	0	0	111	I33 L39 L139 L180 E186 A187 C188	I33-T184 HydrophobicContact CB-CG2 4.42Å; I33-T184 HydrophobicContact CD1-CG2 4.16Å; I33-T184 HydrophobicContact CG1-CG2 3.99Å; I33-T184 HydrophobicContact CG2-CG2 4Å; I33-T184 WeakPolarHBondContact O-CG2 3.34Å; L39-T184 HydrophobicContact CD2-CG2 4.42Å; L139-T184 HydrophobicContact CD2-CG2 4.29Å; L180-T184 WeakPolarHBondContact O-CB 3.37Å; L180-T184 PolarHBondContact O-N 2.92Å; L180-T184 PolarHBondContact O-OG1 3.28Å; L180-T184 VanDerWaalsContact O-OG1 3.05Å; T184-E186 VanDerWaalsContact C-N 3.32Å; T184-E186 PolarHBondContact O-N 3.15Å; T184-A187 PolarHBondContact O-N 3.31Å; T184-C188 WeakPolarHBondContact O-CB 2.83Å; T184-C188 PolarHBondContact O-N 3.45Å; T184-C188 PolarHBondContact O-SG 3.1Å
185	G	92.9	Very high	87.3	Confident	35 Å²	35	62.8 Å²	62.8	36%	0.361	29%	0.293	S	S	.	.	H	α-helix	trans	-65	-28.6	177.2	0	0	0	0	0	114.9	K181 L182 Y183 R189	K181-G185 PolarHBondContact O-N 3.15Å; L182-G185 PolarHBondContact O-N 3.43Å; Y183-G185 PolarHBondContact O-N 2.8Å; G185-R189 WeakPolarHBondContact O-CG 3.31Å; G185-R189 PolarHBondContact O-NE 3.38Å
186	E	91.8	Very high	86.7	Confident	54 Å²	54	66.3 Å²	66.3	25%	0.252	31%	0.309	S	S	.	.	H	α-helix	trans	-81.1	-48.1	173.4	-175.9	62.5	-143.9	0	0	111.3	V83 L182 Y183 T184 C188 R189 R190	V83-E186 HydrophobicContact CG2-CG 3.75Å; L182-E186 PolarHBondContact O-N 3.11Å; Y183-E186 PolarHBondContact O-N 3.47Å; T184-E186 VanDerWaalsContact C-N 3.32Å; T184-E186 PolarHBondContact O-N 3.15Å; E186-C188 VanDerWaalsContact C-N 3.32Å; E186-C188 PolarHBondContact O-N 2.92Å; E186-R189 PolarHBondContact O-N 3.21Å; E186-R189 IonicContact OE2-CZ 2.69Å; E186-R189 IonicContact OE2-NH1 3.04Å; E186-R189 IonicContact OE2-NH2 3.28Å; E186-R189 PolarHBondContact OE2-NH2 3.32Å; E186-R190 PolarHBondContact O-N 3.35Å; E186-R190 VanDerWaalsContact O-N 3.14Å
187	A	90.6	Very high	86	Confident	6 Å²	6	70.2 Å²	70.2	5%	0.05	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-35.5	-178.7	0	0	0	0	0	112.9	R31 L139 Y183 T184 G191	R31-A187 PolarHBondContact NH1-O 3.31Å; R31-A187 VanDerWaalsContact NH1-O 3.12Å; L139-A187 HydrophobicContact CD1-CB 4.42Å; L139-A187 HydrophobicContact CD2-CB 3.86Å; L139-A187 HydrophobicContact CG-CB 4.17Å; Y183-A187 HydrophobicContact CE1-CB 4.3Å; Y183-A187 HydrophobicContact CE2-CB 4.12Å; Y183-A187 WeakPolarHBondContact O-CB 3.45Å; Y183-A187 PolarHBondContact O-N 3.14Å; T184-A187 PolarHBondContact O-N 3.31Å; A187-G191 PolarHBondContact O-N 3.2Å
188	C	90	Very high	85.3	Confident	14 Å²	14	67.1 Å²	67.1	10%	0.095	32%	0.32	C	S	.	.	H	α-helix	trans	-68	-43.7	174.7	-68.1	0	0	0	0	112.1	C34 T184 E186 R190 G191 D192	C34-C188 WeakPolarHBondContact CA-SG 3.35Å; C34-C188 HydrophobicContact CB-CB 3.69Å; C34-C188 WeakPolarHBondContact CB-SG 3.44Å; C34-C188 WeakPolarHBondContact SG-CB 3.5Å; C34-C188 CovalentContact SG-SG 2.02Å; C34-C188 PolarHBondContact SG-SG 3.34Å; T184-C188 WeakPolarHBondContact O-CB 2.83Å; T184-C188 PolarHBondContact O-N 3.45Å; T184-C188 PolarHBondContact O-SG 3.1Å; E186-C188 VanDerWaalsContact C-N 3.32Å; E186-C188 PolarHBondContact O-N 2.92Å; C188-R190 VanDerWaalsContact C-N 3.27Å; C188-R190 PolarHBondContact O-N 3.47Å; C188-G191 PolarHBondContact O-N 3.27Å; C188-D192 PolarHBondContact O-N 2.96Å
189	R	86.4	Confident	84.6	Confident	152 Å²	152	70.7 Å²	70.7	57%	0.574	33%	0.331	S	S	*	.	H	α-helix	trans	-63.6	-30.3	177.3	-77.8	-174.9	-70	138.8	-0.9	113.6	G185 E186	G185-R189 WeakPolarHBondContact O-CG 3.31Å; G185-R189 PolarHBondContact O-NE 3.38Å; E186-R189 PolarHBondContact O-N 3.21Å; E186-R189 IonicContact OE2-CZ 2.69Å; E186-R189 IonicContact OE2-NH1 3.04Å; E186-R189 IonicContact OE2-NH2 3.28Å; E186-R189 PolarHBondContact OE2-NH2 3.32Å
190	R	77.6	Confident	83.8	Confident	149 Å²	149	74.9 Å²	74.9	56%	0.562	35%	0.352	S	S	*	.	H	α-helix	trans	-73.6	-28.5	173.8	-81.2	-173.5	168.1	-152.2	-3.3	113.2	V83 E186 C188 D192	V83-R190 VanDerWaalsContact CG2-CZ 3.49Å; E186-R190 PolarHBondContact O-N 3.35Å; E186-R190 VanDerWaalsContact O-N 3.14Å; C188-R190 VanDerWaalsContact C-N 3.27Å; C188-R190 PolarHBondContact O-N 3.47Å; R190-D192 VanDerWaalsContact C-N 3.3Å
191	G	64.3	Low	82.8	Confident	35 Å²	35	80.7 Å²	80.7	36%	0.361	38%	0.379	S	S	.	.	H	α-helix	trans	-73.1	-22	177.3	0	0	0	0	0	114	A187 C188 R193	A187-G191 PolarHBondContact O-N 3.2Å; C188-G191 PolarHBondContact O-N 3.27Å; G191-R193 VanDerWaalsContact C-N 3.35Å
192	D	56.4	Low	81.7	Confident	148 Å²	148	78.2 Å²	78.2	79%	0.791	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.2	178.4	-63.6	-23.4	0	0	0	113.4	C188 R190	C188-D192 PolarHBondContact O-N 2.96Å; R190-D192 VanDerWaalsContact C-N 3.3Å
193	R	45.3	Very low	80.4	Confident	285 Å²	285	80.3 Å²	80.3	100%	1.075	38%	0.377	S	S	*	.			trans	-108.5	0	178.4	-91.3	-174.7	178.3	162.5	-0.3	111.4	G191	G191-R193 VanDerWaalsContact C-N 3.35Å

Retrieved 193 of 193 residues in 39.3 ms (Link to these results)

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