A0A146ZPS8_FUNHE Loading...

Serine/threonine-protein kinase 40

May be a negative regulator of NF-kappa-B and p53-mediated gene transcription.

AlphaFold DB , UniProt , Accession A0A146ZPS8, Species FUNHE (Fundulus heteroclitus, Killifish), Gene n/a, Length 436 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.5	Very low	28.3	Very low	248 Å²	248	166.4 Å²	166.4	100%	1.222	87%	0.869	S	S	*	*				0	139.7	0	-91.1	176.9	163.3	0	0	109.8
2	S	28.9	Very low	28	Very low	113 Å²	113	158.6 Å²	158.6	79%	0.79	86%	0.859	S	S	*	*			trans	-6.7	127.6	174.3	-75.3	0	0	0	0	122.1
3	K	33	Very low	28.1	Very low	192 Å²	192	161.4 Å²	161.4	84%	0.835	86%	0.863	S	S	*	*				17.4	135.1	119.7	-65.5	178.4	176.6	175.2	0	117.3
4	R	26.9	Very low	28	Very low	252 Å²	252	159.9 Å²	159.9	95%	0.951	86%	0.863	S	S	*	*				-175.3	156.9	101.3	-99.7	171.8	-178.2	-172.3	0.4	114.1
5	R	30.3	Very low	28	Very low	241 Å²	241	157.1 Å²	157.1	91%	0.909	86%	0.86	S	S	*	*			trans	-83.8	178.6	-170.8	-74.8	174.7	160.9	176.1	-6.5	113.4
6	S	27.9	Very low	27.9	Very low	116 Å²	116	152.1 Å²	152.1	81%	0.811	86%	0.856	S	S	*	*			trans	97.9	139.2	149.9	67.4	0	0	0	0	116.6
7	S	27	Very low	27.9	Very low	106 Å²	106	157.3 Å²	157.3	74%	0.741	86%	0.859	S	S	*	*			cis	-176.1	174.3	-9.5	50	0	0	0	0	108.4
8	E	26.1	Very low	28	Very low	149 Å²	149	153.9 Å²	153.9	70%	0.696	86%	0.856	S	S	*	*			trans	99.3	131.2	167.8	-72.5	-167.4	-176.8	0	0	116.4
9	R	28.2	Very low	28	Very low	218 Å²	218	151.5 Å²	151.5	82%	0.823	85%	0.851	S	S	*	*			cis	-150.4	143.8	13.8	-84.1	137.2	-159.9	-144	6.3	107.8
10	G	24.8	Very low	28.3	Very low	81 Å²	81	153.8 Å²	153.8	84%	0.835	85%	0.851	S	S	*	*				65.5	128.9	93.2	0	0	0	0	0	113.4
11	A	26	Very low	28.4	Very low	114 Å²	114	154.4 Å²	154.4	94%	0.942	85%	0.852	S	S	*	*			cis	-160.6	160.6	5.9	0	0	0	0	0	108.6
12	G	24.7	Very low	28.3	Very low	73 Å²	73	150.3 Å²	150.3	75%	0.753	83%	0.83	S	S	*	*			trans	173.4	88	174	0	0	0	0	0	112.8
13	E	28.4	Very low	28.6	Very low	195 Å²	195	148.5 Å²	148.5	91%	0.911	82%	0.816	S	S	*	*			trans	-63	132.9	172.3	-68.5	175.8	146.3	0	0	111.1
14	T	27.2	Very low	28.6	Very low	140 Å²	140	145.5 Å²	145.5	86%	0.859	82%	0.817	S	S	*	*			trans	-131	111.6	159.3	45.7	0	0	0	0	109.3	G16	T14-G16 PolarHBondContact O-N 2.83Å
15	S	27.5	Very low	29.3	Very low	118 Å²	118	136.5 Å²	136.5	83%	0.825	80%	0.802	S	S	*	*			trans	-67.8	107.9	173.2	156.9	0	0	0	0	110	R17	S15-R17 PolarHBondContact O-N 3.17Å
16	G	26.5	Very low	30.1	Very low	77 Å²	77	125.7 Å²	125.7	79%	0.794	76%	0.762	S	S	*	*			trans	-72.9	107.7	168.7	0	0	0	0	0	111.2	T14 A18	T14-G16 PolarHBondContact O-N 2.83Å; G16-A18 PolarHBondContact O-N 3.28Å
17	R	28.4	Very low	30.9	Very low	241 Å²	241	123.4 Å²	123.4	91%	0.909	75%	0.746	S	S	*	*			trans	-73.3	105.8	179.5	-151.7	176.5	-168.8	179.7	2.7	109.3	S15 S19	S15-R17 PolarHBondContact O-N 3.17Å; R17-S19 PolarHBondContact O-N 3.37Å
18	A	29.1	Very low	31.6	Very low	96 Å²	96	120.5 Å²	120.5	79%	0.793	73%	0.733	S	S	*	*			trans	-66.1	114.5	168.3	0	0	0	0	0	109.5	G16 K20	G16-A18 PolarHBondContact O-N 3.28Å; A18-K20 PolarHBondContact O-N 3.28Å
19	S	28.5	Very low	32.8	Very low	109 Å²	109	119.4 Å²	119.4	76%	0.762	74%	0.741	S	S	*	*			trans	-71.8	109.8	176.5	51.9	0	0	0	0	110.4	R17 L21	R17-S19 PolarHBondContact O-N 3.37Å; S19-L21 PolarHBondContact O-N 2.72Å
20	K	33	Very low	34.3	Very low	197 Å²	197	116.3 Å²	116.3	86%	0.857	74%	0.741	S	S	*	*			trans	-60.1	113.2	163.2	-76.5	177.4	175.9	178	0	108.8	A18 Q22	A18-K20 PolarHBondContact O-N 3.28Å; K20-Q22 PolarHBondContact O-N 3.33Å
21	L	30.6	Very low	36.6	Very low	166 Å²	166	114 Å²	114	87%	0.869	71%	0.714	S	S	*	*			trans	-64.8	100.8	160.2	-84.8	140.3	0	0	0	107.5	S19 C23	S19-L21 PolarHBondContact O-N 2.72Å; L21-C23 PolarHBondContact O-N 3.2Å
22	Q	32.1	Very low	39.6	Very low	163 Å²	163	116.8 Å²	116.8	76%	0.762	71%	0.705	S	S	*	*			trans	-78.3	112.4	168.2	-85.4	175.8	-20.8	0	0	108.2	K20 P24	K20-Q22 PolarHBondContact O-N 3.33Å; Q22-P24 WeakPolarHBondContact O-CD 3.5Å
23	C	34.3	Very low	42.7	Very low	75 Å²	75	118.6 Å²	118.6	51%	0.507	69%	0.689	S	S	.	*			trans	-76	114	173.8	-61.9	0	0	0	0	110.5	L21 G25 S27	L21-C23 PolarHBondContact O-N 3.2Å; C23-G25 PolarHBondContact O-N 3.22Å; C23-G25 VanDerWaalsContact O-N 3.16Å; C23-S27 PolarHBondContact O-OG 3.2Å
24	P	33.5	Very low	45.8	Very low	129 Å²	129	109.3 Å²	109.3	84%	0.838	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	107.8	177.8	28.9	-27.4	0	0	0	109.1	Q22	Q22-P24 WeakPolarHBondContact O-CD 3.5Å
25	G	42	Very low	48.9	Very low	63 Å²	63	104.6 Å²	104.6	65%	0.649	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	151.2	-27.2	175.4	0	0	0	0	0	114.6	C23	C23-G25 PolarHBondContact O-N 3.22Å; C23-G25 VanDerWaalsContact O-N 3.16Å
26	I	46.7	Very low	52.1	Low	14 Å²	14	102.2 Å²	102.2	7%	0.072	61%	0.607	C	S	.	*	T	Hydrogen-bonded Turn	trans	-126	-8.4	175.9	-58.7	178.3	0	0	0	111.6	I38 R57 F64 F150	I26-I38 HydrophobicContact CG2-CB 4.1Å; I26-I38 HydrophobicContact CG2-CD1 4.48Å; I26-I38 HydrophobicContact CG2-CG2 3.61Å; I26-R57 HydrophobicContact CG2-CB 4.27Å; I26-F64 HydrophobicContact CD1-CE1 3.74Å; I26-F64 HydrophobicContact CD1-CZ 4.43Å; I26-F150 HydrophobicContact CD1-CB 4.2Å; I26-F150 HydrophobicContact CD1-CD1 3.56Å; I26-F150 HydrophobicContact CD1-CD2 3.75Å; I26-F150 HydrophobicContact CD1-CE1 3.76Å; I26-F150 HydrophobicContact CD1-CE2 3.93Å; I26-F150 HydrophobicContact CD1-CG 3.54Å; I26-F150 HydrophobicContact CD1-CZ 3.94Å; I26-F150 HydrophobicContact CG1-CD1 3.93Å; I26-F150 HydrophobicContact CG1-CE1 3.74Å; I26-F150 HydrophobicContact CG1-CG 4.41Å; I26-F150 HydrophobicContact CG1-CZ 4.08Å
27	S	44.1	Very low	55.4	Low	68 Å²	68	99.3 Å²	99.3	48%	0.476	57%	0.572	S	S	.	*			trans	-98.2	96.3	170.9	67.4	0	0	0	0	111.1	C23	C23-S27 PolarHBondContact O-OG 3.2Å
28	G	42.8	Very low	58.6	Low	44 Å²	44	88.1 Å²	88.1	45%	0.454	53%	0.53	S	S	.	.			trans	-149.3	139.7	164.3	0	0	0	0	0	108.9	N30 A31	G28-N30 PolarHBondContact O-N 3.43Å; G28-A31 PolarHBondContact O-N 3.47Å; G28-A31 VanDerWaalsContact O-N 3.09Å
29	S	50.3	Low	61.8	Low	126 Å²	126	85 Å²	85	88%	0.881	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-9.8	174.2	54.7	0	0	0	0	113.9
30	N	59.4	Low	64.9	Low	153 Å²	153	81.1 Å²	81.1	82%	0.818	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	10.7	-178.3	-65.3	-9.5	0	0	0	114.3	G28	G28-N30 PolarHBondContact O-N 3.43Å
31	A	72.9	Confident	67.7	Low	33 Å²	33	75 Å²	75	27%	0.273	46%	0.458	S	S	.	.			trans	-68.1	135.2	178.2	0	0	0	0	0	111.3	G28 I38	G28-A31 PolarHBondContact O-N 3.47Å; G28-A31 VanDerWaalsContact O-N 3.09Å; A31-I38 HydrophobicContact CB-CG2 3.67Å
32	K	88.5	Confident	70.7	Confident	172 Å²	172	76 Å²	76	75%	0.748	45%	0.45	S	S	*	.			trans	-60.9	140.1	175.1	-70	-175.2	179.6	-178.3	0	109.3	L39	K32-L39 HydrophobicContact CB-CB 4.3Å; K32-L39 HydrophobicContact CB-CD1 4.25Å; K32-L39 WeakPolarHBondContact O-CB 3.49Å; K32-L39 PolarHBondContact O-N 2.87Å
33	R	91.6	Very high	73.4	Confident	112 Å²	112	70 Å²	70	42%	0.423	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	154.1	-177.1	-73.8	168.8	172.2	-98.9	4	111.5	F37 I38 D59 R137	R33-F37 CarbonylContact C-O 3.5Å; R33-F37 VanDerWaalsContact CA-O 3.27Å; R33-F37 WeakPolarHBondContact CA-O 3.46Å; R33-I38 HydrophobicContact CG-CG1 4.41Å; R33-D59 IonicContact CZ-OD2 2.81Å; R33-D59 IonicContact NH1-OD2 3.15Å; R33-D59 PolarHBondContact NH1-OD2 2.93Å; R33-D59 IonicContact NH2-OD1 3.54Å; R33-D59 IonicContact NH2-OD2 2.66Å; R33-D59 PolarHBondContact NH2-OD2 3.49Å; R33-R137 PolarHBondContact O-NH1 3.42Å; R33-R137 PolarHBondContact O-NH2 3.35Å
34	A	93.5	Very high	75.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	113.6	163.8	0	0	0	0	0	108.8	F37 L39 L67 I69 F115 D117	A34-F37 PolarHBondContact N-O 3.13Å; A34-F37 WeakPolarHBondContact O-CB 3.33Å; A34-F37 WeakPolarHBondContact O-CD2 3.34Å; A34-F37 PolarHBondContact O-N 3.27Å; A34-L39 HydrophobicContact CB-CD1 4.22Å; A34-L39 HydrophobicContact CB-CD2 3.87Å; A34-L39 HydrophobicContact CB-CG 4.31Å; A34-L67 HydrophobicContact CB-CD2 4.26Å; A34-I69 HydrophobicContact CB-CD1 4.31Å; A34-F115 HydrophobicContact CB-CE2 4.25Å; A34-F115 HydrophobicContact CB-CZ 3.93Å; A34-F115 WeakPolarHBondContact O-CZ 3.38Å; A34-D117 WeakPolarHBondContact CA-OD2 3.49Å
35	G	91.7	Very high	78	Confident	40 Å²	40	67 Å²	67	41%	0.412	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	-125.8	-169.8	0	0	0	0	0	112.3	F37 D117	G35-F37 PolarHBondContact O-N 3.28Å; G35-D117 PolarHBondContact N-OD2 3.12Å
36	P	94.6	Very high	79.9	Confident	68 Å²	68	64.7 Å²	64.7	44%	0.442	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	8.3	179.4	35.8	-36.3	0	0	0	114.1	D59	P36-D59 WeakPolarHBondContact O-CB 3.19Å; P36-D59 PolarHBondContact O-N 2.77Å
37	F	96.7	Very high	81.5	Confident	17 Å²	17	66.2 Å²	66.2	8%	0.075	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.4	-175.4	-56.8	-86.2	0	0	0	111.9	R33 A34 G35 A56 R57 K58 Y65 L67 F115 V141	R33-F37 CarbonylContact C-O 3.5Å; R33-F37 VanDerWaalsContact CA-O 3.27Å; R33-F37 WeakPolarHBondContact CA-O 3.46Å; A34-F37 PolarHBondContact N-O 3.13Å; A34-F37 WeakPolarHBondContact O-CB 3.33Å; A34-F37 WeakPolarHBondContact O-CD2 3.34Å; A34-F37 PolarHBondContact O-N 3.27Å; G35-F37 PolarHBondContact O-N 3.28Å; F37-A56 HydrophobicContact CB-CB 3.95Å; F37-R57 WeakPolarHBondContact CA-O 3.39Å; F37-K58 HydrophobicContact CD1-CB 3.97Å; F37-K58 HydrophobicContact CE1-CB 3.9Å; F37-K58 HydrophobicContact CE1-CG 4.27Å; F37-Y65 HydrophobicContact CD1-CD2 4.18Å; F37-Y65 AromaticContact CE1-CD2 3.72Å; F37-Y65 HydrophobicContact CE1-CD2 3.72Å; F37-Y65 HydrophobicContact CE1-CE2 4.1Å; F37-Y65 HydrophobicContact CE1-CG 4.24Å; F37-L67 HydrophobicContact CB-CD2 3.84Å; F37-L67 HydrophobicContact CD1-CD1 4.32Å; F37-L67 HydrophobicContact CD2-CD2 4.1Å; F37-L67 HydrophobicContact CG-CD1 4.34Å; F37-L67 HydrophobicContact CG-CD2 4Å; F37-F115 AromaticContact CD2-CE1 3.67Å; F37-F115 HydrophobicContact CD2-CE1 3.67Å; F37-F115 AromaticContact CD2-CZ 3.85Å; F37-F115 HydrophobicContact CD2-CZ 3.85Å; F37-F115 HydrophobicContact CE2-CD1 4.28Å; F37-F115 AromaticContact CE2-CE1 3.58Å; F37-F115 HydrophobicContact CE2-CE1 3.58Å; F37-F115 HydrophobicContact CE2-CZ 4.21Å; F37-V141 HydrophobicContact CD2-CG2 4.42Å; F37-V141 HydrophobicContact CE1-CG1 4.01Å; F37-V141 HydrophobicContact CE2-CG2 3.64Å; F37-V141 HydrophobicContact CZ-CB 4.39Å; F37-V141 HydrophobicContact CZ-CG1 3.78Å; F37-V141 HydrophobicContact CZ-CG2 3.73Å
38	I	95.6	Very high	83.5	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	118.6	171.4	-57.6	161.7	0	0	0	107.3	I26 A31 R33 A56 R57 D59	I26-I38 HydrophobicContact CG2-CB 4.1Å; I26-I38 HydrophobicContact CG2-CD1 4.48Å; I26-I38 HydrophobicContact CG2-CG2 3.61Å; A31-I38 HydrophobicContact CB-CG2 3.67Å; R33-I38 HydrophobicContact CG-CG1 4.41Å; I38-A56 CarbonylContact O-C 3.28Å; I38-A56 WeakPolarHBondContact O-CA 3.46Å; I38-A56 WeakPolarHBondContact O-CB 3.41Å; I38-R57 PolarHBondContact N-O 3.21Å; I38-R57 PolarHBondContact O-N 3.36Å; I38-D59 HydrophobicContact CD1-CB 4.41Å
39	L	94.9	Very high	85.5	Confident	30 Å²	30	65.7 Å²	65.7	16%	0.157	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.7	-176.2	-55.1	-177.8	0	0	0	110.5	K32 A34 A56 L67 I69	K32-L39 HydrophobicContact CB-CB 4.3Å; K32-L39 HydrophobicContact CB-CD1 4.25Å; K32-L39 WeakPolarHBondContact O-CB 3.49Å; K32-L39 PolarHBondContact O-N 2.87Å; A34-L39 HydrophobicContact CB-CD1 4.22Å; A34-L39 HydrophobicContact CB-CD2 3.87Å; A34-L39 HydrophobicContact CB-CG 4.31Å; L39-A56 HydrophobicContact CD2-CB 4.14Å; L39-L67 HydrophobicContact CD2-CD2 3.78Å; L39-I69 HydrophobicContact CD1-CD1 3.95Å; L39-I69 HydrophobicContact CD2-CD1 3.85Å
40	G	93.1	Very high	87.2	Confident	28 Å²	28	60.3 Å²	60.3	29%	0.289	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-150.6	177.4	0	0	0	0	0	112.3	L55	G40-L55 WeakPolarHBondContact CA-O 3.24Å; G40-L55 PolarHBondContact N-O 3.43Å
41	P	93.6	Very high	88.7	Confident	68 Å²	68	53.5 Å²	53.5	44%	0.442	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	154	-176.6	25.9	-35	0	0	0	112.7	C54 L55 F150	P41-C54 VanDerWaalsContact O-CA 3.32Å; P41-C54 WeakPolarHBondContact O-CA 3.36Å; P41-C54 WeakPolarHBondContact O-CB 3.38Å; P41-L55 HydrophobicContact CG-CB 4.18Å; P41-L55 HydrophobicContact CG-CD2 4.26Å; P41-L55 PolarHBondContact O-N 3.34Å; P41-F150 HydrophobicContact CG-CE2 4.45Å
42	R	93.2	Very high	89.7	Confident	187 Å²	187	53.6 Å²	53.6	71%	0.706	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	139.6	172.2	-69.8	-172.1	177.9	-160	-0.7	110.1	V52 Q53	R42-V52 HydrophobicContact CG-CG1 4.07Å; R42-Q53 CarbonylContact C-O 3.38Å; R42-Q53 WeakPolarHBondContact CA-O 3.27Å
43	L	88.5	Confident	90	Very high	38 Å²	38	46.1 Å²	46.1	20%	0.199	27%	0.27	C	S	.	.			trans	-110.6	87	-179.8	-65.5	179.7	0	0	0	109	Q53 L55 Q66	L43-Q53 PolarHBondContact N-O 3.39Å; L43-Q53 WeakPolarHBondContact O-CB 3.48Å; L43-L55 HydrophobicContact CD1-CB 3.92Å; L43-L55 HydrophobicContact CD1-CD1 4.42Å; L43-L55 HydrophobicContact CD2-CB 4.24Å; L43-L55 HydrophobicContact CG-CB 4.11Å; L43-Q66 HydrophobicContact CD1-CB 4.18Å; L43-Q66 HydrophobicContact CD1-CG 3.98Å
44	G	81.5	Confident	90.2	Very high	56 Å²	56	41 Å²	41	58%	0.577	25%	0.252	S	S	*	.	S	Bend	trans	65	-171.2	179.8	0	0	0	0	0	114.3
45	N	81.9	Confident	90.4	Very high	85 Å²	85	41.2 Å²	41.2	46%	0.455	25%	0.253	S	S	.	.			trans	-100.3	157.5	-178.7	-62.5	-51.5	0	0	0	111.4	E388	N45-E388 VanDerWaalsContact ND2-CB 3.27Å; N45-E388 WeakPolarHBondContact ND2-CB 3.47Å; N45-E388 VanDerWaalsContact ND2-CD 3.31Å; N45-E388 WeakPolarHBondContact ND2-CG 3.37Å; N45-E388 PolarHBondContact ND2-OE1 3.31Å
46	S	83.6	Confident	90.6	Very high	14 Å²	14	39.3 Å²	39.3	10%	0.098	23%	0.234	C	C	.	.			trans	-113.5	150.1	178.3	-167.1	0	0	0	0	110.7	V48 I51 N391	S46-V48 PolarHBondContact O-N 3.17Å; S46-I51 WeakPolarHBondContact CB-O 3.25Å; S46-I51 VanDerWaalsContact OG-CB 3.24Å; S46-I51 WeakPolarHBondContact OG-CB 3.31Å; S46-I51 WeakPolarHBondContact OG-CG2 3.49Å; S46-I51 PolarHBondContact OG-O 3.43Å; S46-N391 PolarHBondContact O-ND2 3.28Å
47	P	79.2	Confident	90.7	Very high	46 Å²	46	38 Å²	38	30%	0.299	22%	0.22	S	C	.	.	S	Bend	trans	-58.1	-18.9	179.7	-26.1	35.1	0	0	0	115.5	L91 N391	P47-L91 HydrophobicContact CB-CD1 3.91Å; P47-L91 HydrophobicContact CG-CD1 4.33Å; P47-N391 VanDerWaalsContact CA-CG 3.46Å; P47-N391 WeakPolarHBondContact CA-ND2 3.44Å; P47-N391 VanDerWaalsContact CA-OD1 3.27Å; P47-N391 WeakPolarHBondContact CA-OD1 3.27Å; P47-N391 VanDerWaalsContact O-CB 3.31Å; P47-N391 WeakPolarHBondContact O-CB 3.46Å; P47-N391 PolarHBondContact O-OD1 3.48Å
48	V	86.1	Confident	90.7	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.024	23%	0.234	C	C	.	.	S	Bend	trans	-132.6	137.1	175.3	-66.1	0	0	0	0	109.3	S46 S50 I51 E84 Q87 L91	S46-V48 PolarHBondContact O-N 3.17Å; V48-S50 WeakPolarHBondContact CG2-OG 3.41Å; V48-S50 PolarHBondContact O-N 3.43Å; V48-I51 HydrophobicContact CG2-CB 4.01Å; V48-I51 HydrophobicContact CG2-CD1 3.63Å; V48-I51 HydrophobicContact CG2-CG1 3.66Å; V48-I51 PolarHBondContact O-N 3.37Å; V48-E84 HydrophobicContact CB-CG 4.28Å; V48-Q87 HydrophobicContact CG1-CB 4.18Å; V48-Q87 HydrophobicContact CG1-CG 3.76Å; V48-L91 HydrophobicContact CG1-CD1 4.12Å; V48-L91 HydrophobicContact CG2-CD1 4.12Å
49	P	84.8	Confident	90.6	Very high	98 Å²	98	44.7 Å²	44.7	64%	0.636	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.6	-179.8	-22.5	29.7	0	0	0	114.1	I51 E84	P49-I51 PolarHBondContact O-N 2.89Å; P49-E84 VanDerWaalsContact CB-OE1 3.26Å; P49-E84 WeakPolarHBondContact CB-OE1 3.34Å; P49-E84 WeakPolarHBondContact CD-OE1 3.11Å
50	S	87	Confident	90.5	Very high	13 Å²	13	46.7 Å²	46.7	9%	0.091	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.8	178.2	59.4	0	0	0	0	113.7	V48 L70 T71 E84	V48-S50 WeakPolarHBondContact CG2-OG 3.41Å; V48-S50 PolarHBondContact O-N 3.43Å; S50-L70 WeakPolarHBondContact O-CA 3.37Å; S50-L70 WeakPolarHBondContact OG-CD1 3.17Å; S50-T71 PolarHBondContact O-N 3.31Å; S50-E84 WeakPolarHBondContact CA-OE1 3.24Å; S50-E84 VanDerWaalsContact CB-OE1 3.3Å; S50-E84 WeakPolarHBondContact CB-OE1 3.3Å; S50-E84 PolarHBondContact N-OE1 3.17Å
51	I	91.1	Very high	90.6	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.046	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124	173.4	-64	173.8	0	0	0	109.5	S46 V48 P49 K68 I69 L70 L91 L92	S46-I51 WeakPolarHBondContact CB-O 3.25Å; S46-I51 VanDerWaalsContact OG-CB 3.24Å; S46-I51 WeakPolarHBondContact OG-CB 3.31Å; S46-I51 WeakPolarHBondContact OG-CG2 3.49Å; S46-I51 PolarHBondContact OG-O 3.43Å; V48-I51 HydrophobicContact CG2-CB 4.01Å; V48-I51 HydrophobicContact CG2-CD1 3.63Å; V48-I51 HydrophobicContact CG2-CG1 3.66Å; V48-I51 PolarHBondContact O-N 3.37Å; P49-I51 PolarHBondContact O-N 2.89Å; I51-K68 HydrophobicContact CG2-CB 4.36Å; I51-I69 CarbonylContact C-O 3.48Å; I51-I69 VanDerWaalsContact CA-O 3.32Å; I51-I69 WeakPolarHBondContact CA-O 3.47Å; I51-L70 HydrophobicContact CG1-CB 4.08Å; I51-L70 HydrophobicContact CG1-CD1 3.86Å; I51-L91 HydrophobicContact CD1-CB 4.18Å; I51-L91 HydrophobicContact CD1-CD1 4.47Å; I51-L92 HydrophobicContact CD1-CG 3.95Å; I51-L92 HydrophobicContact CG1-CG 4.49Å
52	V	93.8	Very high	90.6	Very high	35 Å²	35	49.3 Å²	49.3	21%	0.212	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.7	169.9	177.5	0	0	0	0	109.4	R42 I69	R42-V52 HydrophobicContact CG-CG1 4.07Å; V52-I69 PolarHBondContact N-O 3.34Å; V52-I69 PolarHBondContact O-N 3.1Å
53	Q	94.9	Very high	90.7	Very high	15 Å²	15	43.5 Å²	43.5	7%	0.07	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.4	172.6	-47	-170	29.9	0	0	108.7	R42 L43 L67 K68	R42-Q53 CarbonylContact C-O 3.38Å; R42-Q53 WeakPolarHBondContact CA-O 3.27Å; L43-Q53 PolarHBondContact N-O 3.39Å; L43-Q53 WeakPolarHBondContact O-CB 3.48Å; Q53-L67 CarbonylContact C-O 3.43Å; Q53-L67 VanDerWaalsContact CA-O 3.3Å; Q53-L67 WeakPolarHBondContact CA-O 3.35Å; Q53-K68 HydrophobicContact CG-CD 4.46Å; Q53-K68 HydrophobicContact CG-CG 4.01Å; Q53-K68 VanDerWaalsContact OE1-CE 3.3Å
54	C	95.4	Very high	91.1	Very high	6 Å²	6	42.9 Å²	42.9	4%	0.041	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	154.5	-177.8	59.5	0	0	0	0	112.1	P41 L67	P41-C54 VanDerWaalsContact O-CA 3.32Å; P41-C54 WeakPolarHBondContact O-CA 3.36Å; P41-C54 WeakPolarHBondContact O-CB 3.38Å; C54-L67 PolarHBondContact N-O 2.82Å; C54-L67 PolarHBondContact O-N 3.27Å
55	L	96.9	Very high	91.9	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.016	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	139	169	-176.1	65.5	0	0	0	107.6	G40 P41 L43 F64 C144 H148 F150	G40-L55 WeakPolarHBondContact CA-O 3.24Å; G40-L55 PolarHBondContact N-O 3.43Å; P41-L55 HydrophobicContact CG-CB 4.18Å; P41-L55 HydrophobicContact CG-CD2 4.26Å; P41-L55 PolarHBondContact O-N 3.34Å; L43-L55 HydrophobicContact CD1-CB 3.92Å; L43-L55 HydrophobicContact CD1-CD1 4.42Å; L43-L55 HydrophobicContact CD2-CB 4.24Å; L43-L55 HydrophobicContact CG-CB 4.11Å; L55-F64 HydrophobicContact CD1-CB 4.27Å; L55-F64 HydrophobicContact CD1-CD1 4.22Å; L55-F64 HydrophobicContact CD2-CD1 4.29Å; L55-F64 HydrophobicContact CG-CD1 4.26Å; L55-C144 WeakPolarHBondContact CD1-SG 3.45Å; L55-H148 HydrophobicContact CD2-CB 4.14Å; L55-F150 HydrophobicContact CD2-CD2 3.74Å; L55-F150 HydrophobicContact CD2-CE2 3.95Å
56	A	97.1	Very high	92.7	Very high	1 Å²	1	39 Å²	39	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	147	172.1	0	0	0	0	0	111.1	F37 I38 L39 F64 Y65 L67	F37-A56 HydrophobicContact CB-CB 3.95Å; I38-A56 CarbonylContact O-C 3.28Å; I38-A56 WeakPolarHBondContact O-CA 3.46Å; I38-A56 WeakPolarHBondContact O-CB 3.41Å; L39-A56 HydrophobicContact CD2-CB 4.14Å; A56-F64 CarbonylContact O-C 3.53Å; A56-F64 WeakPolarHBondContact O-CA 3.48Å; A56-Y65 PolarHBondContact N-O 2.63Å; A56-Y65 PolarHBondContact O-N 2.91Å; A56-L67 HydrophobicContact CB-CB 4.49Å; A56-L67 HydrophobicContact CB-CD1 3.66Å; A56-L67 HydrophobicContact CB-CD2 3.89Å; A56-L67 HydrophobicContact CB-CG 4.21Å
57	R	96.8	Very high	93.3	Very high	40 Å²	40	38.3 Å²	38.3	15%	0.151	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.9	172.7	-170.7	179.5	63.9	87.3	-2	109.1	I26 F37 I38 T61 D63 F64	I26-R57 HydrophobicContact CG2-CB 4.27Å; F37-R57 WeakPolarHBondContact CA-O 3.39Å; I38-R57 PolarHBondContact N-O 3.21Å; I38-R57 PolarHBondContact O-N 3.36Å; R57-T61 WeakPolarHBondContact CD-O 3.32Å; R57-T61 WeakPolarHBondContact CG-O 3.48Å; R57-T61 PolarHBondContact NH1-O 3Å; R57-D63 WeakPolarHBondContact CA-O 3.35Å; R57-F64 HydrophobicContact CB-CD1 4.01Å; R57-F64 HydrophobicContact CB-CE1 3.84Å; R57-F64 HydrophobicContact CB-CZ 4.36Å; R57-F64 HydrophobicContact CG-CD1 4.3Å; R57-F64 HydrophobicContact CG-CE1 4Å; R57-F64 HydrophobicContact CG-CE2 4.33Å; R57-F64 HydrophobicContact CG-CZ 4.01Å
58	K	96.3	Very high	94.2	Very high	88 Å²	88	36.3 Å²	36.3	38%	0.383	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	129.4	174.4	178.9	179.8	-176.5	-178	0	109.7	F37 T61 D63 Y65	F37-K58 HydrophobicContact CD1-CB 3.97Å; F37-K58 HydrophobicContact CE1-CB 3.9Å; F37-K58 HydrophobicContact CE1-CG 4.27Å; K58-T61 WeakPolarHBondContact CB-OG1 3.16Å; K58-T61 HydrophobicContact CD-CG2 4.38Å; K58-T61 HydrophobicContact CG-CG2 4.38Å; K58-T61 PolarHBondContact O-N 3.19Å; K58-T61 VanDerWaalsContact O-N 3.11Å; K58-T61 PolarHBondContact O-OG1 2.99Å; K58-D63 PolarHBondContact N-O 3.19Å; K58-Y65 HydrophobicContact CB-CD2 4.22Å; K58-Y65 HydrophobicContact CB-CE2 3.77Å; K58-Y65 HydrophobicContact CD-CE2 4.29Å
59	D	93.6	Very high	94.6	Very high	74 Å²	74	36.5 Å²	36.5	40%	0.396	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	141.7	-173.2	-159.4	7.4	0	0	0	111.7	R33 P36 I38 T61	R33-D59 IonicContact CZ-OD2 2.81Å; R33-D59 IonicContact NH1-OD2 3.15Å; R33-D59 PolarHBondContact NH1-OD2 2.93Å; R33-D59 IonicContact NH2-OD1 3.54Å; R33-D59 IonicContact NH2-OD2 2.66Å; R33-D59 PolarHBondContact NH2-OD2 3.49Å; P36-D59 WeakPolarHBondContact O-CB 3.19Å; P36-D59 PolarHBondContact O-N 2.77Å; I38-D59 HydrophobicContact CD1-CB 4.41Å; D59-T61 PolarHBondContact O-N 3.32Å
60	G	92.3	Very high	95.1	Very high	73 Å²	73	31.9 Å²	31.9	75%	0.753	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.7	4.8	-174	0	0	0	0	0	116
61	T	94.8	Very high	95.4	Very high	38 Å²	38	33.2 Å²	33.2	23%	0.233	19%	0.187	C	C	.	.	S	Bend	trans	-131.9	163.1	-179.7	72.6	0	0	0	0	112.5	R57 K58 D59 D63	R57-T61 WeakPolarHBondContact CD-O 3.32Å; R57-T61 WeakPolarHBondContact CG-O 3.48Å; R57-T61 PolarHBondContact NH1-O 3Å; K58-T61 WeakPolarHBondContact CB-OG1 3.16Å; K58-T61 HydrophobicContact CD-CG2 4.38Å; K58-T61 HydrophobicContact CG-CG2 4.38Å; K58-T61 PolarHBondContact O-N 3.19Å; K58-T61 VanDerWaalsContact O-N 3.11Å; K58-T61 PolarHBondContact O-OG1 2.99Å; D59-T61 PolarHBondContact O-N 3.32Å; T61-D63 VanDerWaalsContact C-N 3.28Å; T61-D63 PolarHBondContact OG1-N 3.46Å
62	D	93.3	Very high	95.2	Very high	113 Å²	113	33.4 Å²	33.4	60%	0.604	19%	0.188	S	C	*	.	S	Bend	trans	-98.1	30.1	169.8	-63.7	-27.2	0	0	0	111.6	K153	D62-K153 PolarHBondContact O-NZ 3.07Å
63	D	96.2	Very high	94.6	Very high	64 Å²	64	34.9 Å²	34.9	34%	0.342	19%	0.193	S	C	.	.			trans	-100	127.5	178.1	-61.8	-35	0	0	0	110.2	R57 K58 T61 Y65 K153	R57-D63 WeakPolarHBondContact CA-O 3.35Å; K58-D63 PolarHBondContact N-O 3.19Å; T61-D63 VanDerWaalsContact C-N 3.28Å; T61-D63 PolarHBondContact OG1-N 3.46Å; D63-Y65 HydrophobicContact CB-CE2 3.8Å; D63-K153 IonicContact OD1-NZ 2.75Å; D63-K153 PolarHBondContact OD1-NZ 3.44Å
64	F	97.4	Very high	93.3	Very high	25 Å²	25	37.8 Å²	37.8	11%	0.11	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	144.8	-176.2	-68.8	-96.3	0	0	0	110.4	I26 L55 A56 R57 C144 H148 F150	I26-F64 HydrophobicContact CD1-CE1 3.74Å; I26-F64 HydrophobicContact CD1-CZ 4.43Å; L55-F64 HydrophobicContact CD1-CB 4.27Å; L55-F64 HydrophobicContact CD1-CD1 4.22Å; L55-F64 HydrophobicContact CD2-CD1 4.29Å; L55-F64 HydrophobicContact CG-CD1 4.26Å; A56-F64 CarbonylContact O-C 3.53Å; A56-F64 WeakPolarHBondContact O-CA 3.48Å; R57-F64 HydrophobicContact CB-CD1 4.01Å; R57-F64 HydrophobicContact CB-CE1 3.84Å; R57-F64 HydrophobicContact CB-CZ 4.36Å; R57-F64 HydrophobicContact CG-CD1 4.3Å; R57-F64 HydrophobicContact CG-CE1 4Å; R57-F64 HydrophobicContact CG-CE2 4.33Å; R57-F64 HydrophobicContact CG-CZ 4.01Å; F64-C144 HydrophobicContact CB-CB 4.1Å; F64-C144 VanDerWaalsContact O-CB 3.24Å; F64-C144 WeakPolarHBondContact O-CB 3.33Å; F64-H148 AromaticContact CD1-CE1 3.75Å; F64-H148 AromaticContact CD1-NE2 3.71Å; F64-H148 AromaticContact CD2-CE1 3.8Å; F64-H148 AromaticContact CD2-NE2 3.99Å; F64-H148 AromaticContact CE1-CE1 3.99Å; F64-H148 AromaticContact CG-CE1 3.65Å; F64-H148 AromaticContact CG-NE2 3.48Å; F64-H148 WeakPolarHBondContact CG-NE2 3.42Å; F64-F150 HydrophobicContact CE1-CB 3.58Å; F64-F150 HydrophobicContact CE1-CD2 4.37Å; F64-F150 HydrophobicContact CE1-CG 4.19Å; F64-F150 HydrophobicContact CE2-CB 4.35Å; F64-F150 HydrophobicContact CZ-CB 3.41Å; F64-F150 VanDerWaalsContact CZ-CB 3.41Å; F64-F150 HydrophobicContact CZ-CG 4.42Å
65	Y	97.9	Very high	92.1	Very high	31 Å²	31	42.5 Å²	42.5	12%	0.122	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158.3	-175.2	-61.3	-84.1	0	0	0	110	F37 A56 K58 D63 H112 V141 L142	F37-Y65 HydrophobicContact CD1-CD2 4.18Å; F37-Y65 AromaticContact CE1-CD2 3.72Å; F37-Y65 HydrophobicContact CE1-CD2 3.72Å; F37-Y65 HydrophobicContact CE1-CE2 4.1Å; F37-Y65 HydrophobicContact CE1-CG 4.24Å; A56-Y65 PolarHBondContact N-O 2.63Å; A56-Y65 PolarHBondContact O-N 2.91Å; K58-Y65 HydrophobicContact CB-CD2 4.22Å; K58-Y65 HydrophobicContact CB-CE2 3.77Å; K58-Y65 HydrophobicContact CD-CE2 4.29Å; D63-Y65 HydrophobicContact CB-CE2 3.8Å; Y65-H112 AromaticContact CD1-CD2 3.75Å; Y65-H112 HydrophobicContact CE1-CB 4.42Å; Y65-H112 AromaticContact CE1-CD2 3.67Å; Y65-H112 AromaticContact CE1-CG 3.73Å; Y65-H112 AromaticContact CE1-ND1 3.96Å; Y65-H112 AromaticContact CE1-NE2 3.84Å; Y65-V141 HydrophobicContact CD1-CG1 3.8Å; Y65-V141 HydrophobicContact CG-CG1 3.84Å; Y65-L142 WeakPolarHBondContact CA-O 3.29Å; Y65-L142 WeakPolarHBondContact CB-O 3.18Å
66	Q	97.6	Very high	90.3	Very high	29 Å²	29	49.4 Å²	49.4	14%	0.136	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.4	164.6	176	173.2	1.3	0	0	108.8	L43 L142	L43-Q66 HydrophobicContact CD1-CB 4.18Å; L43-Q66 HydrophobicContact CD1-CG 3.98Å; Q66-L142 HydrophobicContact CB-CB 4.33Å; Q66-L142 PolarHBondContact N-O 3.22Å; Q66-L142 PolarHBondContact O-N 2.83Å
67	L	97.4	Very high	88.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125	174.6	-92.6	59.3	0	0	0	109.8	A34 F37 L39 Q53 C54 A56 I69 L140 V141	A34-L67 HydrophobicContact CB-CD2 4.26Å; F37-L67 HydrophobicContact CB-CD2 3.84Å; F37-L67 HydrophobicContact CD1-CD1 4.32Å; F37-L67 HydrophobicContact CD2-CD2 4.1Å; F37-L67 HydrophobicContact CG-CD1 4.34Å; F37-L67 HydrophobicContact CG-CD2 4Å; L39-L67 HydrophobicContact CD2-CD2 3.78Å; Q53-L67 CarbonylContact C-O 3.43Å; Q53-L67 VanDerWaalsContact CA-O 3.3Å; Q53-L67 WeakPolarHBondContact CA-O 3.35Å; C54-L67 PolarHBondContact N-O 2.82Å; C54-L67 PolarHBondContact O-N 3.27Å; A56-L67 HydrophobicContact CB-CB 4.49Å; A56-L67 HydrophobicContact CB-CD1 3.66Å; A56-L67 HydrophobicContact CB-CD2 3.89Å; A56-L67 HydrophobicContact CB-CG 4.21Å; L67-I69 HydrophobicContact CB-CD1 4.28Å; L67-I69 HydrophobicContact CB-CG1 4.04Å; L67-I69 HydrophobicContact CD2-CD1 4.46Å; L67-L140 WeakPolarHBondContact CA-O 3.18Å; L67-V141 HydrophobicContact CD1-CB 4.31Å; L67-V141 HydrophobicContact CD1-CG1 3.9Å; L67-V141 HydrophobicContact CD1-CG2 4.11Å; L67-V141 HydrophobicContact CG-CG2 4.29Å
68	K	97.2	Very high	86.3	Confident	4 Å²	4	60 Å²	60	2%	0.017	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	112	164.8	-59.5	-169.3	172.6	-179.7	0	108.5	I51 Q53 L92 E95 C139 L140 L142 N217	I51-K68 HydrophobicContact CG2-CB 4.36Å; Q53-K68 HydrophobicContact CG-CD 4.46Å; Q53-K68 HydrophobicContact CG-CG 4.01Å; Q53-K68 VanDerWaalsContact OE1-CE 3.3Å; K68-L92 HydrophobicContact CB-CD2 3.68Å; K68-L92 HydrophobicContact CD-CD2 4.48Å; K68-E95 WeakPolarHBondContact CD-OE2 3.45Å; K68-E95 IonicContact NZ-OE1 3.12Å; K68-E95 PolarHBondContact NZ-OE1 3.43Å; K68-E95 IonicContact NZ-OE2 3.38Å; K68-E95 PolarHBondContact NZ-OE2 2.81Å; K68-C139 WeakPolarHBondContact O-CA 3.36Å; K68-L140 HydrophobicContact CB-CB 4.38Å; K68-L140 PolarHBondContact N-O 3.45Å; K68-L140 PolarHBondContact O-N 3Å; K68-L142 HydrophobicContact CD-CD1 3.94Å; K68-L142 HydrophobicContact CG-CD1 4.12Å; K68-N217 PolarHBondContact NZ-OD1 3.19Å
69	I	96	Very high	84.6	Confident	8 Å²	8	58.6 Å²	58.6	4%	0.041	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	109.5	-171.1	-55.5	-179.1	0	0	0	108.9	A34 L39 I51 V52 L67 R137 I138	A34-I69 HydrophobicContact CB-CD1 4.31Å; L39-I69 HydrophobicContact CD1-CD1 3.95Å; L39-I69 HydrophobicContact CD2-CD1 3.85Å; I51-I69 CarbonylContact C-O 3.48Å; I51-I69 VanDerWaalsContact CA-O 3.32Å; I51-I69 WeakPolarHBondContact CA-O 3.47Å; V52-I69 PolarHBondContact N-O 3.34Å; V52-I69 PolarHBondContact O-N 3.1Å; L67-I69 HydrophobicContact CB-CD1 4.28Å; L67-I69 HydrophobicContact CB-CG1 4.04Å; L67-I69 HydrophobicContact CD2-CD1 4.46Å; I69-R137 HydrophobicContact CG2-CB 4.02Å; I69-R137 HydrophobicContact CG2-CG 4.27Å; I69-I138 WeakPolarHBondContact CA-O 3.44Å
70	L	95.2	Very high	83.4	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	121.9	168.2	172.9	64.6	0	0	0	109.6	S50 I51 L72 K89 L92 R137 I138	S50-L70 WeakPolarHBondContact O-CA 3.37Å; S50-L70 WeakPolarHBondContact OG-CD1 3.17Å; I51-L70 HydrophobicContact CG1-CB 4.08Å; I51-L70 HydrophobicContact CG1-CD1 3.86Å; L70-L72 HydrophobicContact CD1-CD2 4.22Å; L70-L72 HydrophobicContact CD2-CD2 3.92Å; L70-L72 HydrophobicContact CD2-CG 4.47Å; L70-L72 HydrophobicContact CG-CD2 3.87Å; L70-L72 HydrophobicContact CG-CG 4.26Å; L70-K89 HydrophobicContact CD2-CB 4.28Å; L70-K89 HydrophobicContact CD2-CG 3.55Å; L70-L92 HydrophobicContact CB-CD1 3.31Å; L70-L92 HydrophobicContact CB-CG 4.45Å; L70-L92 HydrophobicContact CD2-CD1 4.12Å; L70-L92 HydrophobicContact CG-CD1 4.36Å; L70-R137 CarbonylContact O-C 3.52Å; L70-R137 WeakPolarHBondContact O-CA 3.48Å; L70-I138 HydrophobicContact CB-CB 4.38Å; L70-I138 HydrophobicContact CD2-CD1 4.49Å; L70-I138 PolarHBondContact N-O 3.22Å; L70-I138 PolarHBondContact O-N 3.38Å
71	T	91.7	Very high	82.8	Confident	41 Å²	41	58.3 Å²	58.3	25%	0.252	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.7	174.8	-54.1	0	0	0	0	109.5	S50 K135 R137	S50-T71 PolarHBondContact O-N 3.31Å; T71-K135 HydrophobicContact CG2-CB 3.77Å; T71-K135 HydrophobicContact CG2-CD 4.29Å; T71-K135 HydrophobicContact CG2-CG 4.09Å; T71-R137 HydrophobicContact CG2-CG 4.35Å
72	L	88.4	Confident	82.4	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.068	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139.5	-179.9	-58.7	175.2	0	0	0	109.5	L70 E85 K136 I138	L70-L72 HydrophobicContact CD1-CD2 4.22Å; L70-L72 HydrophobicContact CD2-CD2 3.92Å; L70-L72 HydrophobicContact CD2-CG 4.47Å; L70-L72 HydrophobicContact CG-CD2 3.87Å; L70-L72 HydrophobicContact CG-CG 4.26Å; L72-E85 HydrophobicContact CD2-CB 3.99Å; L72-E85 HydrophobicContact CD2-CG 3.88Å; L72-K136 HydrophobicContact CB-CB 4.45Å; L72-K136 PolarHBondContact N-O 3.32Å; L72-K136 PolarHBondContact O-N 3.43Å; L72-I138 HydrophobicContact CD1-CD1 3.87Å; L72-I138 HydrophobicContact CD1-CG1 4.11Å
73	E	80.4	Confident	82.1	Confident	65 Å²	65	59.8 Å²	59.8	30%	0.304	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	130.1	172.4	-63	-143.4	106.9	0	0	111.3	R75 E85 K133 K135	E73-R75 HydrophobicContact CB-CG 4.25Å; E73-R75 PolarHBondContact O-N 3.42Å; E73-R75 IonicContact OE2-CZ 3.49Å; E73-R75 IonicContact OE2-NE 3.49Å; E73-R75 PolarHBondContact OE2-NE 3.45Å; E73-R75 IonicContact OE2-NH2 3.3Å; E73-R75 PolarHBondContact OE2-NH2 2.57Å; E73-E85 PolarHBondContact N-OE1 3.23Å; E73-K133 IonicContact OE1-NZ 3.93Å; E73-K133 PolarHBondContact OE1-NZ 3.06Å; E73-K135 IonicContact OE1-NZ 2.7Å; E73-K135 PolarHBondContact OE1-NZ 2.58Å
74	E	68.8	Low	81.6	Confident	76 Å²	76	60.2 Å²	60.2	36%	0.355	33%	0.334	S	S	.	.			trans	-83.8	110.3	166.8	-153.5	160.6	-148	0	0	107.4	R118 M134	E74-R118 IonicContact OE1-CZ 2.74Å; E74-R118 IonicContact OE1-NE 3.64Å; E74-R118 IonicContact OE1-NH2 3.7Å; E74-R118 PolarHBondContact OE1-NH2 3.44Å; E74-M134 WeakPolarHBondContact OE2-CE 3.27Å
75	R	69.4	Low	81.1	Confident	106 Å²	106	59.7 Å²	59.7	40%	0.4	33%	0.331	S	S	.	.			trans	-106.4	132.2	179.1	-65.1	-178.8	178.4	-173	-4.4	109.2	E73	E73-R75 HydrophobicContact CB-CG 4.25Å; E73-R75 PolarHBondContact O-N 3.42Å; E73-R75 IonicContact OE2-CZ 3.49Å; E73-R75 IonicContact OE2-NE 3.49Å; E73-R75 PolarHBondContact OE2-NE 3.45Å; E73-R75 IonicContact OE2-NH2 3.3Å; E73-R75 PolarHBondContact OE2-NH2 2.57Å
76	V	59.5	Low	80.8	Confident	147 Å²	147	65 Å²	65	89%	0.891	35%	0.352	S	S	*	.	S	Bend	trans	-79.9	-27.5	179.6	-172.6	0	0	0	0	110.8
77	D	55.2	Low	80.4	Confident	129 Å²	129	67.5 Å²	67.5	69%	0.69	36%	0.363	S	S	*	.	S	Bend	trans	-97	149.1	178.6	-58.4	-41.7	0	0	0	111.5	A79	D77-A79 PolarHBondContact O-N 3.15Å
78	S	54.5	Low	80.2	Confident	135 Å²	135	67.5 Å²	67.5	94%	0.944	36%	0.363	S	S	*	.			trans	-60.2	17.6	178.4	-47.8	0	0	0	0	115.8	G80	S78-G80 PolarHBondContact O-N 2.95Å; S78-G80 VanDerWaalsContact O-N 3.09Å
79	A	60.8	Low	80	Confident	58 Å²	58	70 Å²	70	48%	0.479	37%	0.374	S	S	.	.			trans	-63.2	109	170.5	0	0	0	0	0	108.6	D77	D77-A79 PolarHBondContact O-N 3.15Å
80	G	68.4	Low	80	Confident	51 Å²	51	74.2 Å²	74.2	53%	0.526	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-54.9	160.3	-176.4	0	0	0	0	0	113.9	S78	S78-G80 PolarHBondContact O-N 2.95Å; S78-G80 VanDerWaalsContact O-N 3.09Å
81	E	79.8	Confident	80	Confident	91 Å²	91	74.3 Å²	74.3	43%	0.425	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-52	138.8	-179.9	-55.8	-174.2	168.8	0	0	112	R86 K89	E81-R86 HydrophobicContact CB-CG 4.02Å; E81-R86 PolarHBondContact O-NE 3.02Å; E81-R86 VanDerWaalsContact O-NE 3.09Å; E81-R86 PolarHBondContact O-NH2 3.14Å; E81-K89 IonicContact OE1-NZ 3.83Å; E81-K89 PolarHBondContact OE1-NZ 2.88Å; E81-K89 IonicContact OE2-NZ 2.63Å; E81-K89 PolarHBondContact OE2-NZ 3.41Å
82	T	85.9	Confident	80.2	Confident	37 Å²	37	72.7 Å²	72.7	23%	0.227	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-66.5	156.5	179.2	72.7	0	0	0	0	110.9	E84 E85 R86	T82-E84 PolarHBondContact O-N 3.31Å; T82-E85 PolarHBondContact N-OE2 3.1Å; T82-E85 PolarHBondContact O-N 3.31Å; T82-E85 WeakPolarHBondContact OG1-CB 3.48Å; T82-E85 VanDerWaalsContact OG1-CG 3.24Å; T82-E85 WeakPolarHBondContact OG1-CG 3.27Å; T82-E85 PolarHBondContact OG1-N 3.29Å; T82-E85 VanDerWaalsContact OG1-N 3.08Å; T82-R86 WeakPolarHBondContact O-CG 3.33Å; T82-R86 PolarHBondContact O-N 3.43Å
83	Q	86.1	Confident	80.6	Confident	144 Å²	144	77.8 Å²	77.8	67%	0.673	41%	0.408	S	S	*	.	H	α-helix	trans	-59.5	-37.4	175.8	-178.1	157.7	-24	0	0	111.7	R86 Q87	Q83-R86 PolarHBondContact O-N 2.63Å; Q83-Q87 WeakPolarHBondContact O-CB 3.41Å; Q83-Q87 PolarHBondContact O-N 3.42Å
84	E	86.1	Confident	81.3	Confident	74 Å²	74	76.3 Å²	76.3	35%	0.346	40%	0.403	S	S	.	.	H	α-helix	trans	-63.1	-46.6	176.1	-169.4	-168.2	167.9	0	0	112.4	V48 P49 S50 T82 R86 Q87 G88	V48-E84 HydrophobicContact CB-CG 4.28Å; P49-E84 VanDerWaalsContact CB-OE1 3.26Å; P49-E84 WeakPolarHBondContact CB-OE1 3.34Å; P49-E84 WeakPolarHBondContact CD-OE1 3.11Å; S50-E84 WeakPolarHBondContact CA-OE1 3.24Å; S50-E84 VanDerWaalsContact CB-OE1 3.3Å; S50-E84 WeakPolarHBondContact CB-OE1 3.3Å; S50-E84 PolarHBondContact N-OE1 3.17Å; T82-E84 PolarHBondContact O-N 3.31Å; E84-R86 VanDerWaalsContact C-N 3.34Å; E84-R86 PolarHBondContact O-N 2.92Å; E84-Q87 PolarHBondContact O-N 3.13Å; E84-G88 PolarHBondContact O-N 2.69Å
85	E	87.9	Confident	82.7	Confident	13 Å²	13	72.8 Å²	72.8	6%	0.061	39%	0.387	C	S	.	.	H	α-helix	trans	-62.6	-42.5	177.4	-73.5	172.5	149.6	0	0	111.2	L72 E73 T82 Q87 G88 K89	L72-E85 HydrophobicContact CD2-CB 3.99Å; L72-E85 HydrophobicContact CD2-CG 3.88Å; E73-E85 PolarHBondContact N-OE1 3.23Å; T82-E85 PolarHBondContact N-OE2 3.1Å; T82-E85 PolarHBondContact O-N 3.31Å; T82-E85 WeakPolarHBondContact OG1-CB 3.48Å; T82-E85 VanDerWaalsContact OG1-CG 3.24Å; T82-E85 WeakPolarHBondContact OG1-CG 3.27Å; T82-E85 PolarHBondContact OG1-N 3.29Å; T82-E85 VanDerWaalsContact OG1-N 3.08Å; E85-Q87 VanDerWaalsContact C-N 3.34Å; E85-Q87 PolarHBondContact O-N 3.17Å; E85-G88 PolarHBondContact O-N 3.29Å; E85-K89 WeakPolarHBondContact O-CB 3.49Å; E85-K89 VanDerWaalsContact O-CG 3.29Å; E85-K89 WeakPolarHBondContact O-CG 3.29Å; E85-K89 PolarHBondContact O-N 2.88Å
86	R	90.2	Very high	84.1	Confident	144 Å²	144	71.4 Å²	71.4	54%	0.543	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-43.8	176.1	-68.8	175.6	-167.6	-169.3	2.6	111.4	E81 T82 Q83 E84 M90	E81-R86 HydrophobicContact CB-CG 4.02Å; E81-R86 PolarHBondContact O-NE 3.02Å; E81-R86 VanDerWaalsContact O-NE 3.09Å; E81-R86 PolarHBondContact O-NH2 3.14Å; T82-R86 WeakPolarHBondContact O-CG 3.33Å; T82-R86 PolarHBondContact O-N 3.43Å; Q83-R86 PolarHBondContact O-N 2.63Å; E84-R86 VanDerWaalsContact C-N 3.34Å; E84-R86 PolarHBondContact O-N 2.92Å; R86-M90 WeakPolarHBondContact O-CB 3.18Å; R86-M90 PolarHBondContact O-N 3.46Å
87	Q	90.6	Very high	85.9	Confident	81 Å²	81	66.4 Å²	66.4	38%	0.379	35%	0.354	S	S	.	.	H	α-helix	trans	-65.4	-44.5	177	-173.9	176	-4.4	0	0	111.2	V48 Q83 E84 E85 K89 M90 L91	V48-Q87 HydrophobicContact CG1-CB 4.18Å; V48-Q87 HydrophobicContact CG1-CG 3.76Å; Q83-Q87 WeakPolarHBondContact O-CB 3.41Å; Q83-Q87 PolarHBondContact O-N 3.42Å; E84-Q87 PolarHBondContact O-N 3.13Å; E85-Q87 VanDerWaalsContact C-N 3.34Å; E85-Q87 PolarHBondContact O-N 3.17Å; Q87-K89 PolarHBondContact O-N 2.75Å; Q87-M90 WeakPolarHBondContact O-CB 2.81Å; Q87-M90 PolarHBondContact O-N 2.9Å; Q87-L91 HydrophobicContact CG-CD1 4.35Å; Q87-L91 WeakPolarHBondContact O-CG 3.36Å; Q87-L91 PolarHBondContact O-N 3.49Å
88	G	92.6	Very high	88	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.9	-43.5	176.4	0	0	0	0	0	112.9	E84 E85 M90 L91 L92	E84-G88 PolarHBondContact O-N 2.69Å; E85-G88 PolarHBondContact O-N 3.29Å; G88-M90 VanDerWaalsContact C-N 3.34Å; G88-M90 PolarHBondContact O-N 3.15Å; G88-L91 PolarHBondContact O-N 2.76Å; G88-L92 PolarHBondContact O-N 3.27Å
89	K	93.7	Very high	90.1	Very high	57 Å²	57	54.2 Å²	54.2	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-58.6	-46.3	173.1	-73.8	178.2	-173.2	176.1	0	111.5	L70 E81 E85 Q87 L91 H93	L70-K89 HydrophobicContact CD2-CB 4.28Å; L70-K89 HydrophobicContact CD2-CG 3.55Å; E81-K89 IonicContact OE1-NZ 3.83Å; E81-K89 PolarHBondContact OE1-NZ 2.88Å; E81-K89 IonicContact OE2-NZ 2.63Å; E81-K89 PolarHBondContact OE2-NZ 3.41Å; E85-K89 WeakPolarHBondContact O-CB 3.49Å; E85-K89 VanDerWaalsContact O-CG 3.29Å; E85-K89 WeakPolarHBondContact O-CG 3.29Å; E85-K89 PolarHBondContact O-N 2.88Å; Q87-K89 PolarHBondContact O-N 2.75Å; K89-L91 PolarHBondContact O-N 3.49Å; K89-H93 WeakPolarHBondContact O-CB 3.48Å; K89-H93 PolarHBondContact O-N 2.87Å
90	M	94.3	Very high	91.8	Very high	95 Å²	95	53.3 Å²	53.3	47%	0.468	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-43.6	178.6	-176.3	-165.4	-62.8	0	0	111.9	R86 Q87 G88 T94	R86-M90 WeakPolarHBondContact O-CB 3.18Å; R86-M90 PolarHBondContact O-N 3.46Å; Q87-M90 WeakPolarHBondContact O-CB 2.81Å; Q87-M90 PolarHBondContact O-N 2.9Å; G88-M90 VanDerWaalsContact C-N 3.34Å; G88-M90 PolarHBondContact O-N 3.15Å; M90-T94 VanDerWaalsContact O-CB 3.24Å; M90-T94 WeakPolarHBondContact O-CB 3.28Å; M90-T94 PolarHBondContact O-N 3.05Å; M90-T94 PolarHBondContact O-OG1 2.82Å
91	L	95.2	Very high	93.2	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-49.7	179.8	-70	174.7	0	0	0	111.7	P47 V48 I51 Q87 G88 K89 T94 E95 C219 L220	P47-L91 HydrophobicContact CB-CD1 3.91Å; P47-L91 HydrophobicContact CG-CD1 4.33Å; V48-L91 HydrophobicContact CG1-CD1 4.12Å; V48-L91 HydrophobicContact CG2-CD1 4.12Å; I51-L91 HydrophobicContact CD1-CB 4.18Å; I51-L91 HydrophobicContact CD1-CD1 4.47Å; Q87-L91 HydrophobicContact CG-CD1 4.35Å; Q87-L91 WeakPolarHBondContact O-CG 3.36Å; Q87-L91 PolarHBondContact O-N 3.49Å; G88-L91 PolarHBondContact O-N 2.76Å; K89-L91 PolarHBondContact O-N 3.49Å; L91-T94 PolarHBondContact O-N 3.26Å; L91-E95 WeakPolarHBondContact O-CB 3.44Å; L91-E95 PolarHBondContact O-N 3.09Å; L91-C219 HydrophobicContact CB-CB 4.13Å; L91-C219 HydrophobicContact CD2-CB 4.11Å; L91-C219 WeakPolarHBondContact CD2-O 3.42Å; L91-L220 HydrophobicContact CD2-CD2 3.62Å
92	L	96	Very high	94.1	Very high	6 Å²	6	50.5 Å²	50.5	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-42.9	177.2	-83	-175.6	0	0	0	112.3	I51 K68 L70 G88 E95 Y96 I138 L140	I51-L92 HydrophobicContact CD1-CG 3.95Å; I51-L92 HydrophobicContact CG1-CG 4.49Å; K68-L92 HydrophobicContact CB-CD2 3.68Å; K68-L92 HydrophobicContact CD-CD2 4.48Å; L70-L92 HydrophobicContact CB-CD1 3.31Å; L70-L92 HydrophobicContact CB-CG 4.45Å; L70-L92 HydrophobicContact CD2-CD1 4.12Å; L70-L92 HydrophobicContact CG-CD1 4.36Å; G88-L92 PolarHBondContact O-N 3.27Å; L92-E95 PolarHBondContact O-N 3.42Å; L92-Y96 VanDerWaalsContact O-CB 3.3Å; L92-Y96 WeakPolarHBondContact O-CB 3.48Å; L92-Y96 PolarHBondContact O-N 3.05Å; L92-I138 HydrophobicContact CD1-CG2 4.43Å; L92-L140 HydrophobicContact CD2-CB 3.85Å; L92-L140 HydrophobicContact CD2-CD2 3.98Å
93	H	96.4	Very high	94.4	Very high	121 Å²	121	54.2 Å²	54.2	56%	0.56	26%	0.258	S	S	*	.	H	α-helix	trans	-63.4	-45.6	179.2	177.1	-83.8	0	0	0	111.3	K89 Y96 S97	K89-H93 WeakPolarHBondContact O-CB 3.48Å; K89-H93 PolarHBondContact O-N 2.87Å; H93-Y96 PolarHBondContact O-N 3.15Å; H93-S97 PolarHBondContact CE1-OG 3.45Å; H93-S97 VanDerWaalsContact CE1-OG 3.23Å; H93-S97 VanDerWaalsContact O-CB 3.24Å; H93-S97 WeakPolarHBondContact O-CB 3.41Å; H93-S97 PolarHBondContact O-N 3.41Å; H93-S97 PolarHBondContact O-OG 2.78Å
94	T	96.9	Very high	94.8	Very high	33 Å²	33	53.8 Å²	53.8	20%	0.202	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-49.8	176.5	-60.2	0	0	0	0	110.4	M90 L91 S97 L98 G221	M90-T94 VanDerWaalsContact O-CB 3.24Å; M90-T94 WeakPolarHBondContact O-CB 3.28Å; M90-T94 PolarHBondContact O-N 3.05Å; M90-T94 PolarHBondContact O-OG1 2.82Å; L91-T94 PolarHBondContact O-N 3.26Å; T94-S97 PolarHBondContact O-N 3.43Å; T94-L98 HydrophobicContact CG2-CD1 3.88Å; T94-L98 WeakPolarHBondContact O-CB 3.34Å; T94-L98 VanDerWaalsContact O-CG 3.32Å; T94-L98 WeakPolarHBondContact O-CG 3.38Å; T94-L98 PolarHBondContact O-N 3.03Å; T94-G221 VanDerWaalsContact CG2-O 3.23Å; T94-G221 WeakPolarHBondContact CG2-O 3.45Å
95	E	97.8	Very high	95.3	Very high	3 Å²	3	51.7 Å²	51.7	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-62.5	-49.6	-180	-170.6	159.3	-155.2	0	0	112	K68 L91 L92 S97 L98 L99 L140 N217 F218 C219	K68-E95 WeakPolarHBondContact CD-OE2 3.45Å; K68-E95 IonicContact NZ-OE1 3.12Å; K68-E95 PolarHBondContact NZ-OE1 3.43Å; K68-E95 IonicContact NZ-OE2 3.38Å; K68-E95 PolarHBondContact NZ-OE2 2.81Å; L91-E95 WeakPolarHBondContact O-CB 3.44Å; L91-E95 PolarHBondContact O-N 3.09Å; L92-E95 PolarHBondContact O-N 3.42Å; E95-S97 VanDerWaalsContact C-N 3.35Å; E95-S97 PolarHBondContact O-N 2.99Å; E95-L98 PolarHBondContact O-N 3.41Å; E95-L99 HydrophobicContact CG-CD1 3.92Å; E95-L99 HydrophobicContact CG-CG 4.37Å; E95-L99 WeakPolarHBondContact O-CB 3.36Å; E95-L99 VanDerWaalsContact O-CG 3.24Å; E95-L99 WeakPolarHBondContact O-CG 3.21Å; E95-L99 PolarHBondContact O-N 3.27Å; E95-L140 HydrophobicContact CB-CD2 4.24Å; E95-L140 HydrophobicContact CG-CD2 4.07Å; E95-N217 WeakPolarHBondContact OE1-CA 3.23Å; E95-F218 HydrophobicContact CG-CB 4.25Å; E95-F218 PolarHBondContact OE1-N 3.42Å; E95-C219 HydrophobicContact CB-CB 4.13Å
96	Y	98.2	Very high	95.8	Very high	77 Å²	77	55.1 Å²	55.1	30%	0.302	27%	0.269	S	S	.	.	H	α-helix	trans	-57.4	-46.2	176.8	173	-103.5	0	0	0	112.5	L92 H93 L99 S100 H111 L114 L140	L92-Y96 VanDerWaalsContact O-CB 3.3Å; L92-Y96 WeakPolarHBondContact O-CB 3.48Å; L92-Y96 PolarHBondContact O-N 3.05Å; H93-Y96 PolarHBondContact O-N 3.15Å; Y96-L99 PolarHBondContact O-N 2.89Å; Y96-S100 WeakPolarHBondContact O-CB 3.36Å; Y96-S100 PolarHBondContact O-N 2.96Å; Y96-S100 PolarHBondContact O-OG 3.46Å; Y96-H111 AromaticContact CD2-CE1 3.87Å; Y96-H111 AromaticContact CD2-ND1 3.62Å; Y96-H111 AromaticContact CE2-CE1 3.44Å; Y96-H111 VanDerWaalsContact CE2-CE1 3.44Å; Y96-H111 WeakPolarHBondContact CE2-CE1 3.33Å; Y96-H111 AromaticContact CE2-ND1 3.46Å; Y96-H111 WeakPolarHBondContact CE2-ND1 3.33Å; Y96-L114 HydrophobicContact CD2-CB 4.04Å; Y96-L114 HydrophobicContact CE2-CB 3.89Å; Y96-L140 HydrophobicContact CD2-CD1 3.76Å; Y96-L140 HydrophobicContact CG-CD1 4.42Å
97	S	98.1	Very high	96.1	Very high	41 Å²	41	48.4 Å²	48.4	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-42.9	-177.1	-57.9	0	0	0	0	111.8	H93 T94 E95 S100	H93-S97 PolarHBondContact CE1-OG 3.45Å; H93-S97 VanDerWaalsContact CE1-OG 3.23Å; H93-S97 VanDerWaalsContact O-CB 3.24Å; H93-S97 WeakPolarHBondContact O-CB 3.41Å; H93-S97 PolarHBondContact O-N 3.41Å; H93-S97 PolarHBondContact O-OG 2.78Å; T94-S97 PolarHBondContact O-N 3.43Å; E95-S97 VanDerWaalsContact C-N 3.35Å; E95-S97 PolarHBondContact O-N 2.99Å; S97-S100 PolarHBondContact O-N 3.19Å
98	L	98.2	Very high	96.5	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-45	177.9	-70.4	175.3	0	0	0	111.6	T94 E95 S100 L101 L102 I194 F218 G221 H223	T94-L98 HydrophobicContact CG2-CD1 3.88Å; T94-L98 WeakPolarHBondContact O-CB 3.34Å; T94-L98 VanDerWaalsContact O-CG 3.32Å; T94-L98 WeakPolarHBondContact O-CG 3.38Å; T94-L98 PolarHBondContact O-N 3.03Å; E95-L98 PolarHBondContact O-N 3.41Å; L98-S100 PolarHBondContact O-N 3.36Å; L98-L101 WeakPolarHBondContact O-CB 3.49Å; L98-L101 PolarHBondContact O-N 3Å; L98-L101 VanDerWaalsContact O-N 3.08Å; L98-L102 WeakPolarHBondContact O-CG 3.31Å; L98-L102 PolarHBondContact O-N 2.76Å; L98-I194 HydrophobicContact CD2-CG1 4.29Å; L98-I194 HydrophobicContact CD2-CG2 4.21Å; L98-F218 HydrophobicContact CB-CB 4.43Å; L98-F218 HydrophobicContact CD1-CB 4.29Å; L98-F218 WeakPolarHBondContact CD1-O 3.25Å; L98-G221 VanDerWaalsContact CD1-C 3.49Å; L98-H223 HydrophobicContact CD2-CB 3.81Å
99	L	98.4	Very high	96.8	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-28.5	179.9	-65.8	-176.7	0	0	0	112.4	E95 Y96 L101 L102 H103 V108 V109 H111 L142 F218	E95-L99 HydrophobicContact CG-CD1 3.92Å; E95-L99 HydrophobicContact CG-CG 4.37Å; E95-L99 WeakPolarHBondContact O-CB 3.36Å; E95-L99 VanDerWaalsContact O-CG 3.24Å; E95-L99 WeakPolarHBondContact O-CG 3.21Å; E95-L99 PolarHBondContact O-N 3.27Å; Y96-L99 PolarHBondContact O-N 2.89Å; L99-L101 PolarHBondContact O-N 3.06Å; L99-L102 HydrophobicContact CD2-CD1 4.4Å; L99-L102 CarbonylContact O-C 3.58Å; L99-L102 WeakPolarHBondContact O-CA 3.42Å; L99-L102 PolarHBondContact O-N 3.38Å; L99-H103 PolarHBondContact O-N 3.26Å; L99-V108 HydrophobicContact CD2-CG1 3.87Å; L99-V109 HydrophobicContact CD1-CG1 4.07Å; L99-V109 HydrophobicContact CD2-CG1 4.07Å; L99-V109 WeakPolarHBondContact CD2-O 3.4Å; L99-H111 HydrophobicContact CB-CB 4.39Å; L99-H111 HydrophobicContact CD1-CB 4.33Å; L99-L142 HydrophobicContact CD1-CD2 3.59Å; L99-F218 HydrophobicContact CD2-CB 4.34Å; L99-F218 HydrophobicContact CD2-CD2 3.64Å; L99-F218 HydrophobicContact CD2-CE2 4.07Å; L99-F218 HydrophobicContact CD2-CG 3.94Å
100	S	98.1	Very high	97	Very high	39 Å²	39	44.5 Å²	44.5	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-60.3	-34	172.8	-61.4	0	0	0	0	112.4	Y96 S97 L98 L102 H103 H111	Y96-S100 WeakPolarHBondContact O-CB 3.36Å; Y96-S100 PolarHBondContact O-N 2.96Å; Y96-S100 PolarHBondContact O-OG 3.46Å; S97-S100 PolarHBondContact O-N 3.19Å; L98-S100 PolarHBondContact O-N 3.36Å; S100-L102 PolarHBondContact O-N 3.42Å; S100-H103 PolarHBondContact O-ND1 3.22Å; S100-H111 VanDerWaalsContact CA-NE2 3.28Å; S100-H111 WeakPolarHBondContact CA-NE2 3.3Å; S100-H111 PolarHBondContact N-NE2 3.23Å; S100-H111 PolarHBondContact OG-CE1 2.81Å; S100-H111 PolarHBondContact OG-NE2 3.44Å
101	L	97.8	Very high	97.2	Very high	84 Å²	84	41.7 Å²	41.7	44%	0.44	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-10.4	175.4	-56.7	174.2	0	0	0	112.8	L98 L99 I194 H223	L98-L101 WeakPolarHBondContact O-CB 3.49Å; L98-L101 PolarHBondContact O-N 3Å; L98-L101 VanDerWaalsContact O-N 3.08Å; L99-L101 PolarHBondContact O-N 3.06Å; L101-I194 HydrophobicContact CB-CD1 4.25Å; L101-I194 HydrophobicContact CD1-CD1 4.4Å; L101-H223 HydrophobicContact CD1-CB 4.41Å
102	L	97.7	Very high	97.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	11.6	-170.3	-63.2	172.6	0	0	0	113.7	L98 L99 S100 N104 Q105 V108 H110 L189 K192 I194 F218	L98-L102 WeakPolarHBondContact O-CG 3.31Å; L98-L102 PolarHBondContact O-N 2.76Å; L99-L102 HydrophobicContact CD2-CD1 4.4Å; L99-L102 CarbonylContact O-C 3.58Å; L99-L102 WeakPolarHBondContact O-CA 3.42Å; L99-L102 PolarHBondContact O-N 3.38Å; S100-L102 PolarHBondContact O-N 3.42Å; L102-N104 PolarHBondContact O-N 3.49Å; L102-N104 VanDerWaalsContact O-N 3.1Å; L102-Q105 HydrophobicContact CB-CB 4.15Å; L102-Q105 HydrophobicContact CD2-CB 4.07Å; L102-Q105 HydrophobicContact CD2-CG 4.25Å; L102-Q105 VanDerWaalsContact O-CB 3.28Å; L102-Q105 WeakPolarHBondContact O-CB 3.41Å; L102-Q105 PolarHBondContact O-N 3.48Å; L102-V108 HydrophobicContact CB-CG1 4.2Å; L102-V108 HydrophobicContact CD1-CG1 4.05Å; L102-H110 PolarHBondContact O-CD2 3.27Å; L102-H110 PolarHBondContact O-NE2 3.25Å; L102-L189 HydrophobicContact CD1-CD2 3.64Å; L102-L189 HydrophobicContact CD2-CD2 3.64Å; L102-L189 HydrophobicContact CG-CD2 4.32Å; L102-K192 HydrophobicContact CD2-CD 4.01Å; L102-I194 HydrophobicContact CD1-CD1 4.13Å; L102-I194 HydrophobicContact CD2-CD1 3.76Å; L102-I194 HydrophobicContact CG-CD1 3.95Å; L102-F218 HydrophobicContact CD1-CD1 4.23Å; L102-F218 HydrophobicContact CD1-CE1 3.79Å; L102-F218 HydrophobicContact CD1-CZ 4.24Å
103	H	92.9	Very high	97.3	Very high	114 Å²	114	47 Å²	47	53%	0.528	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-29.2	-178.5	64.2	-82	0	0	0	114.8	L99 S100	L99-H103 PolarHBondContact O-N 3.26Å; S100-H103 PolarHBondContact O-ND1 3.22Å
104	N	93.7	Very high	97.3	Very high	136 Å²	136	44.8 Å²	44.8	73%	0.727	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	8.8	176.5	-65.9	-26.2	0	0	0	113.4	L102	L102-N104 PolarHBondContact O-N 3.49Å; L102-N104 VanDerWaalsContact O-N 3.1Å
105	Q	97.8	Very high	97.3	Very high	29 Å²	29	45.3 Å²	45.3	14%	0.136	24%	0.236	C	C	.	.			trans	-92.8	112.2	-177.1	-170.6	60.7	50.7	0	0	110.3	L102 V108 H110 A188	L102-Q105 HydrophobicContact CB-CB 4.15Å; L102-Q105 HydrophobicContact CD2-CB 4.07Å; L102-Q105 HydrophobicContact CD2-CG 4.25Å; L102-Q105 VanDerWaalsContact O-CB 3.28Å; L102-Q105 WeakPolarHBondContact O-CB 3.41Å; L102-Q105 PolarHBondContact O-N 3.48Å; Q105-V108 HydrophobicContact CB-CB 4.45Å; Q105-V108 HydrophobicContact CB-CG2 4.3Å; Q105-V108 HydrophobicContact CG-CB 4.37Å; Q105-V108 HydrophobicContact CG-CG2 3.71Å; Q105-H110 PolarHBondContact O-CE1 3.13Å; Q105-H110 PolarHBondContact O-NE2 2.92Å; Q105-A188 VanDerWaalsContact NE2-CB 3.3Å
106	D	96.7	Very high	97.2	Very high	85 Å²	85	50.4 Å²	50.4	46%	0.455	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	150.6	169.4	176.7	48.3	0	0	0	111.4	V108 R184 R212	D106-V108 VanDerWaalsContact C-N 3.28Å; D106-R184 IonicContact OD2-CZ 2.73Å; D106-R184 IonicContact OD2-NH1 3.05Å; D106-R184 IonicContact OD2-NH2 3.35Å; D106-R184 PolarHBondContact OD2-NH2 3.16Å; D106-R184 VanDerWaalsContact OD2-NH2 3.15Å; D106-R212 IonicContact OD2-CZ 3.75Å; D106-R212 IonicContact OD2-NH2 2.69Å; D106-R212 PolarHBondContact OD2-NH2 3.44Å
107	G	97.8	Very high	96.9	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.031	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	16.5	-177.9	0	0	0	0	0	114.4	V185 I213 T214 I215	G107-V185 WeakPolarHBondContact O-CG1 3.24Å; G107-I213 VanDerWaalsContact CA-O 3.25Å; G107-I213 WeakPolarHBondContact CA-O 3.42Å; G107-T214 CarbonylContact O-C 3.55Å; G107-T214 WeakPolarHBondContact O-CA 3.05Å; G107-I215 PolarHBondContact O-N 2.56Å
108	V	98.5	Very high	96.5	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.018	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-127.1	141.7	175.4	174.4	0	0	0	0	109.1	L99 L102 Q105 D106 H110 V185 L189 F218	L99-V108 HydrophobicContact CD2-CG1 3.87Å; L102-V108 HydrophobicContact CB-CG1 4.2Å; L102-V108 HydrophobicContact CD1-CG1 4.05Å; Q105-V108 HydrophobicContact CB-CB 4.45Å; Q105-V108 HydrophobicContact CB-CG2 4.3Å; Q105-V108 HydrophobicContact CG-CB 4.37Å; Q105-V108 HydrophobicContact CG-CG2 3.71Å; D106-V108 VanDerWaalsContact C-N 3.28Å; V108-H110 PolarHBondContact O-CE1 3.39Å; V108-H110 PolarHBondContact O-NE2 2.84Å; V108-V185 HydrophobicContact CG2-CG1 3.68Å; V108-L189 HydrophobicContact CG2-CD2 4.11Å; V108-F218 HydrophobicContact CG1-CE2 3.67Å; V108-F218 HydrophobicContact CG1-CZ 3.66Å; V108-F218 HydrophobicContact CG2-CZ 4.2Å
109	V	98.1	Very high	96	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.012	27%	0.274	C	S	.	.			trans	-61.7	133.9	171.8	62.9	0	0	0	0	111.2	L99 L142 D143 L145 I215 T216 F218	L99-V109 HydrophobicContact CD1-CG1 4.07Å; L99-V109 HydrophobicContact CD2-CG1 4.07Å; L99-V109 WeakPolarHBondContact CD2-O 3.4Å; V109-L142 HydrophobicContact CG2-CB 4.13Å; V109-D143 HydrophobicContact CG2-CB 4.18Å; V109-L145 HydrophobicContact CB-CD1 3.73Å; V109-L145 HydrophobicContact CG2-CD1 3.7Å; V109-I215 PolarHBondContact N-O 2.86Å; V109-T216 HydrophobicContact CB-CG2 4.21Å; V109-T216 HydrophobicContact CG1-CG2 4.45Å; V109-F218 HydrophobicContact CG1-CD2 4.25Å; V109-F218 HydrophobicContact CG1-CE2 4.32Å
110	H	98.3	Very high	95.2	Very high	52 Å²	52	61.9 Å²	61.9	24%	0.241	30%	0.304	C	S	.	.			trans	-101.1	155.5	176.5	-56.5	121.6	0	0	0	111.9	L102 Q105 V108 L142 D143	L102-H110 PolarHBondContact O-CD2 3.27Å; L102-H110 PolarHBondContact O-NE2 3.25Å; Q105-H110 PolarHBondContact O-CE1 3.13Å; Q105-H110 PolarHBondContact O-NE2 2.92Å; V108-H110 PolarHBondContact O-CE1 3.39Å; V108-H110 PolarHBondContact O-NE2 2.84Å; H110-L142 WeakPolarHBondContact O-CA 3.47Å; H110-D143 WeakPolarHBondContact CA-OD2 3.4Å; H110-D143 WeakPolarHBondContact CB-OD2 3.4Å; H110-D143 IonicContact CG-OD2 2.77Å; H110-D143 PolarHBondContact N-OD2 3.07Å; H110-D143 IonicContact ND1-OD2 3.95Å; H110-D143 PolarHBondContact O-N 2.79Å
111	H	98.2	Very high	94.4	Very high	36 Å²	36	64.7 Å²	64.7	17%	0.167	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	148	173.6	76.1	100.4	0	0	0	110.8	Y96 L99 S100 G113 L140 V141 L142	Y96-H111 AromaticContact CD2-CE1 3.87Å; Y96-H111 AromaticContact CD2-ND1 3.62Å; Y96-H111 AromaticContact CE2-CE1 3.44Å; Y96-H111 VanDerWaalsContact CE2-CE1 3.44Å; Y96-H111 WeakPolarHBondContact CE2-CE1 3.33Å; Y96-H111 AromaticContact CE2-ND1 3.46Å; Y96-H111 WeakPolarHBondContact CE2-ND1 3.33Å; L99-H111 HydrophobicContact CB-CB 4.39Å; L99-H111 HydrophobicContact CD1-CB 4.33Å; S100-H111 VanDerWaalsContact CA-NE2 3.28Å; S100-H111 WeakPolarHBondContact CA-NE2 3.3Å; S100-H111 PolarHBondContact N-NE2 3.23Å; S100-H111 PolarHBondContact OG-CE1 2.81Å; S100-H111 PolarHBondContact OG-NE2 3.44Å; H111-G113 PolarHBondContact ND1-N 3.1Å; H111-L140 HydrophobicContact CB-CD1 3.99Å; H111-V141 CarbonylContact C-O 3.6Å; H111-V141 WeakPolarHBondContact CA-O 3.44Å; H111-V141 WeakPolarHBondContact CB-O 3.47Å; H111-L142 HydrophobicContact CB-CD2 3.66Å
112	H	97.6	Very high	93.4	Very high	97 Å²	97	65.9 Å²	65.9	45%	0.449	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	27.4	179.9	-62.1	-89.3	0	0	0	111.7	Y65 V141 D143	Y65-H112 AromaticContact CD1-CD2 3.75Å; Y65-H112 HydrophobicContact CE1-CB 4.42Å; Y65-H112 AromaticContact CE1-CD2 3.67Å; Y65-H112 AromaticContact CE1-CG 3.73Å; Y65-H112 AromaticContact CE1-ND1 3.96Å; Y65-H112 AromaticContact CE1-NE2 3.84Å; H112-V141 HydrophobicContact CB-CB 4.11Å; H112-V141 HydrophobicContact CB-CG1 3.84Å; H112-V141 PolarHBondContact N-O 2.78Å; H112-D143 IonicContact CD2-OD1 2.77Å; H112-D143 IonicContact CE1-OD1 3.22Å; H112-D143 IonicContact NE2-OD1 3.99Å; H112-D143 PolarHBondContact NE2-OD1 3.22Å
113	G	96.4	Very high	92.4	Very high	24 Å²	24	68.6 Å²	68.6	25%	0.247	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102	176.6	179.5	0	0	0	0	0	114.6	H111 V141	H111-G113 PolarHBondContact ND1-N 3.1Å; G113-V141 PolarHBondContact O-N 2.87Å; G113-V141 VanDerWaalsContact O-N 3.14Å
114	L	96.9	Very high	91.7	Very high	75 Å²	75	69.4 Å²	69.4	39%	0.393	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.5	-179.2	-173.4	81.8	0	0	0	107.5	Y96 I138 C139 L140	Y96-L114 HydrophobicContact CD2-CB 4.04Å; Y96-L114 HydrophobicContact CE2-CB 3.89Å; L114-I138 HydrophobicContact CD1-CG2 3.77Å; L114-I138 HydrophobicContact CD2-CG2 4.26Å; L114-I138 HydrophobicContact CG-CG2 4.1Å; L114-C139 WeakPolarHBondContact CA-O 3.4Å; L114-L140 HydrophobicContact CD1-CB 3.92Å; L114-L140 HydrophobicContact CD1-CD1 4.26Å
115	F	96.6	Very high	90.8	Very high	44 Å²	44	67.2 Å²	67.2	19%	0.193	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	161.2	174.5	72.6	-87.5	0	0	0	111.5	A34 F37 D117 C139 V141	A34-F115 HydrophobicContact CB-CE2 4.25Å; A34-F115 HydrophobicContact CB-CZ 3.93Å; A34-F115 WeakPolarHBondContact O-CZ 3.38Å; F37-F115 AromaticContact CD2-CE1 3.67Å; F37-F115 HydrophobicContact CD2-CE1 3.67Å; F37-F115 AromaticContact CD2-CZ 3.85Å; F37-F115 HydrophobicContact CD2-CZ 3.85Å; F37-F115 HydrophobicContact CE2-CD1 4.28Å; F37-F115 AromaticContact CE2-CE1 3.58Å; F37-F115 HydrophobicContact CE2-CE1 3.58Å; F37-F115 HydrophobicContact CE2-CZ 4.21Å; F115-D117 HydrophobicContact CE2-CB 4.39Å; F115-C139 HydrophobicContact CD1-CB 3.9Å; F115-C139 HydrophobicContact CD2-CB 4.24Å; F115-C139 HydrophobicContact CE1-CB 3.45Å; F115-C139 VanDerWaalsContact CE1-CB 3.45Å; F115-C139 HydrophobicContact CE2-CB 3.82Å; F115-C139 HydrophobicContact CG-CB 4.27Å; F115-C139 HydrophobicContact CZ-CB 3.4Å; F115-C139 VanDerWaalsContact CZ-CB 3.4Å; F115-C139 PolarHBondContact N-O 3.22Å; F115-C139 PolarHBondContact O-N 3.42Å; F115-V141 HydrophobicContact CD1-CG2 4.02Å; F115-V141 HydrophobicContact CE1-CG2 3.72Å
116	Q	95.1	Very high	89.6	Confident	109 Å²	109	74.9 Å²	74.9	51%	0.509	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143.2	175.4	-60.4	-170.7	-21.5	0	0	109.4	R137 I138	Q116-R137 VanDerWaalsContact CA-O 3.29Å; Q116-R137 WeakPolarHBondContact CA-O 3.28Å; Q116-I138 HydrophobicContact CG-CG1 4.15Å
117	D	92.1	Very high	88.8	Confident	30 Å²	30	78 Å²	78	16%	0.16	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	-178.1	169.9	78.2	10.1	0	0	0	112	A34 G35 F115 R137	A34-D117 WeakPolarHBondContact CA-OD2 3.49Å; G35-D117 PolarHBondContact N-OD2 3.12Å; F115-D117 HydrophobicContact CE2-CB 4.39Å; D117-R137 PolarHBondContact N-O 3.46Å; D117-R137 VanDerWaalsContact N-O 3.08Å; D117-R137 PolarHBondContact O-N 3.1Å; D117-R137 WeakPolarHBondContact OD1-CB 3.37Å; D117-R137 IonicContact OD1-CZ 3.98Å; D117-R137 VanDerWaalsContact OD1-CZ 3.3Å; D117-R137 IonicContact OD1-NE 3.61Å; D117-R137 PolarHBondContact OD1-NE 2.87Å; D117-R137 IonicContact OD1-NH2 3.63Å; D117-R137 PolarHBondContact OD1-NH2 2.84Å; D117-R137 IonicContact OD2-CZ 3.08Å; D117-R137 IonicContact OD2-NE 2.91Å; D117-R137 IonicContact OD2-NH2 2.7Å; D117-R137 PolarHBondContact OD2-NH2 3.07Å
118	R	90.1	Very high	87.8	Confident	151 Å²	151	81.2 Å²	81.2	57%	0.57	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	136	174.9	-74.2	174.5	161	169.9	-4.8	109	E74 M134 K135	E74-R118 IonicContact OE1-CZ 2.74Å; E74-R118 IonicContact OE1-NE 3.64Å; E74-R118 IonicContact OE1-NH2 3.7Å; E74-R118 PolarHBondContact OE1-NH2 3.44Å; R118-M134 HydrophobicContact CB-CG 4.28Å; R118-M134 HydrophobicContact CB-SD 4.28Å; R118-K135 WeakPolarHBondContact CA-O 3.07Å
119	A	86.4	Confident	86.9	Confident	24 Å²	24	85.3 Å²	85.3	20%	0.198	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	146	176.8	0	0	0	0	0	111	K135 R137	A119-K135 PolarHBondContact N-O 3.15Å; A119-K135 PolarHBondContact O-N 2.79Å; A119-R137 VanDerWaalsContact CB-CZ 3.46Å
120	Y	83.1	Confident	86.1	Confident	162 Å²	162	92.6 Å²	92.6	64%	0.635	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.6	171	-68.5	-77.3	0	0	0	110	R132 K133 M134	Y120-R132 HydrophobicContact CD1-CB 4.19Å; Y120-K133 WeakPolarHBondContact CA-O 3.28Å; Y120-M134 HydrophobicContact CD1-CB 4.13Å; Y120-M134 HydrophobicContact CE1-CB 3.91Å; Y120-M134 HydrophobicContact CE1-CG 4.26Å; Y120-M134 HydrophobicContact CE1-SD 4.43Å
121	E	79.9	Confident	85.3	Confident	98 Å²	98	93.6 Å²	93.6	46%	0.458	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.6	170	-169.2	167.9	-150.1	0	0	109	R132 K133 K135	E121-R132 WeakPolarHBondContact O-CA 3.37Å; E121-K133 PolarHBondContact N-O 3.21Å; E121-K133 PolarHBondContact O-N 2.88Å; E121-K135 HydrophobicContact CB-CG 4.24Å
122	I	77.4	Confident	84.5	Confident	109 Å²	109	101 Å²	101	56%	0.559	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	115.4	175.2	-59.5	173.2	0	0	0	106.6	K130 V131 R132	I122-K130 HydrophobicContact CG2-CB 3.7Å; I122-K130 HydrophobicContact CG2-CD 4.11Å; I122-K130 HydrophobicContact CG2-CG 3.88Å; I122-V131 WeakPolarHBondContact CA-O 3.28Å; I122-R132 HydrophobicContact CG1-CG 4.43Å
123	V	77.2	Confident	83.7	Confident	57 Å²	57	99.8 Å²	99.8	35%	0.345	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139	177.4	-174.7	0	0	0	0	107.7	V131 K133	V123-V131 PolarHBondContact N-O 2.77Å; V123-V131 PolarHBondContact O-N 3.26Å; V123-K133 HydrophobicContact CG2-CB 4Å
124	E	77.2	Confident	83.2	Confident	132 Å²	132	101.4 Å²	101.4	62%	0.617	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	125	171.8	-68.3	178	175.6	0	0	108.6	N129 K130	E124-N129 WeakPolarHBondContact CA-O 3.23Å; E124-K130 HydrophobicContact CG-CG 4.27Å
125	D	75.9	Confident	82.7	Confident	89 Å²	89	98.8 Å²	98.8	48%	0.476	47%	0.474	S	S	.	.			trans	-75.8	172.8	174.5	-160.3	0.5	0	0	0	110.9	E127 A128 N129 V131	D125-E127 PolarHBondContact O-N 3.03Å; D125-A128 WeakPolarHBondContact O-CA 3.47Å; D125-A128 PolarHBondContact O-N 3.14Å; D125-N129 PolarHBondContact N-O 3.25Å; D125-V131 HydrophobicContact CB-CG2 4.2Å
126	M	72.3	Confident	82.4	Confident	191 Å²	191	100.3 Å²	100.3	94%	0.941	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-25.1	177	-65.9	-82.8	-117.8	0	0	113.1
127	E	80.4	Confident	82.4	Confident	149 Å²	149	96.4 Å²	96.4	70%	0.696	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	13.4	177.3	-60.1	-178	166.5	0	0	113.6	D125 N129	D125-E127 PolarHBondContact O-N 3.03Å; E127-N129 PolarHBondContact O-N 3.4Å; E127-N129 VanDerWaalsContact O-N 3.16Å; E127-N129 PolarHBondContact OE2-ND2 3.44Å
128	A	76.1	Confident	82.6	Confident	71 Å²	71	96 Å²	96	59%	0.587	46%	0.459	S	S	*	.	S	Bend	trans	59.6	17.1	-173.7	0	0	0	0	0	114.9	D125	D125-A128 WeakPolarHBondContact O-CA 3.47Å; D125-A128 PolarHBondContact O-N 3.14Å
129	N	80.3	Confident	82.9	Confident	89 Å²	89	88.9 Å²	88.9	48%	0.476	43%	0.431	S	S	.	.			trans	-77.6	132.6	174	-74.3	-36	0	0	0	110.7	E124 D125 E127 V131	E124-N129 WeakPolarHBondContact CA-O 3.23Å; D125-N129 PolarHBondContact N-O 3.25Å; E127-N129 PolarHBondContact O-N 3.4Å; E127-N129 VanDerWaalsContact O-N 3.16Å; E127-N129 PolarHBondContact OE2-ND2 3.44Å; N129-V131 PolarHBondContact O-N 3.47Å
130	K	80.6	Confident	83.5	Confident	156 Å²	156	87.7 Å²	87.7	68%	0.678	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	101.5	178.1	-74	-179	-178.8	178.1	0	110.7	I122 E124	I122-K130 HydrophobicContact CG2-CB 3.7Å; I122-K130 HydrophobicContact CG2-CD 4.11Å; I122-K130 HydrophobicContact CG2-CG 3.88Å; E124-K130 HydrophobicContact CG-CG 4.27Å
131	V	82.3	Confident	84.2	Confident	73 Å²	73	80.1 Å²	80.1	44%	0.442	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	139.9	177.1	-175.2	0	0	0	0	109.9	I122 V123 D125 N129	I122-V131 WeakPolarHBondContact CA-O 3.28Å; V123-V131 PolarHBondContact N-O 2.77Å; V123-V131 PolarHBondContact O-N 3.26Å; D125-V131 HydrophobicContact CB-CG2 4.2Å; N129-V131 PolarHBondContact O-N 3.47Å
132	R	80.3	Confident	85.1	Confident	190 Å²	190	75.6 Å²	75.6	72%	0.717	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	111	172.7	-68.7	-176.3	-178.6	-175.5	1.5	109.4	Y120 E121 I122	Y120-R132 HydrophobicContact CD1-CB 4.19Å; E121-R132 WeakPolarHBondContact O-CA 3.37Å; I122-R132 HydrophobicContact CG1-CG 4.43Å
133	K	82	Confident	86	Confident	73 Å²	73	72.1 Å²	72.1	32%	0.317	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.4	173.4	-165.9	170.7	-179.7	-175.8	0	109.2	E73 Y120 E121 V123	E73-K133 IonicContact OE1-NZ 3.93Å; E73-K133 PolarHBondContact OE1-NZ 3.06Å; Y120-K133 WeakPolarHBondContact CA-O 3.28Å; E121-K133 PolarHBondContact N-O 3.21Å; E121-K133 PolarHBondContact O-N 2.88Å; V123-K133 HydrophobicContact CG2-CB 4Å
134	M	84.3	Confident	86.9	Confident	57 Å²	57	70 Å²	70	28%	0.281	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.1	171.6	-166	166.2	75.3	0	0	109	E74 R118 Y120	E74-M134 WeakPolarHBondContact OE2-CE 3.27Å; R118-M134 HydrophobicContact CB-CG 4.28Å; R118-M134 HydrophobicContact CB-SD 4.28Å; Y120-M134 HydrophobicContact CD1-CB 4.13Å; Y120-M134 HydrophobicContact CE1-CB 3.91Å; Y120-M134 HydrophobicContact CE1-CG 4.26Å; Y120-M134 HydrophobicContact CE1-SD 4.43Å
135	K	87.3	Confident	87.8	Confident	21 Å²	21	64.9 Å²	64.9	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.2	177.9	-62.2	-74.2	-171	154.7	0	109	T71 E73 R118 A119 E121	T71-K135 HydrophobicContact CG2-CB 3.77Å; T71-K135 HydrophobicContact CG2-CD 4.29Å; T71-K135 HydrophobicContact CG2-CG 4.09Å; E73-K135 IonicContact OE1-NZ 2.7Å; E73-K135 PolarHBondContact OE1-NZ 2.58Å; R118-K135 WeakPolarHBondContact CA-O 3.07Å; A119-K135 PolarHBondContact N-O 3.15Å; A119-K135 PolarHBondContact O-N 2.79Å; E121-K135 HydrophobicContact CB-CG 4.24Å
136	K	91	Very high	88.7	Confident	75 Å²	75	62.4 Å²	62.4	33%	0.326	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	137	170.8	-176.2	174.9	179.9	175.9	0	108.4	L72	L72-K136 HydrophobicContact CB-CB 4.45Å; L72-K136 PolarHBondContact N-O 3.32Å; L72-K136 PolarHBondContact O-N 3.43Å
137	R	94.1	Very high	89.6	Confident	28 Å²	28	55.8 Å²	55.8	11%	0.106	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.7	176.5	-53.7	-178.6	-60	-176.8	-2.2	111.2	R33 I69 L70 T71 Q116 D117 A119	R33-R137 PolarHBondContact O-NH1 3.42Å; R33-R137 PolarHBondContact O-NH2 3.35Å; I69-R137 HydrophobicContact CG2-CB 4.02Å; I69-R137 HydrophobicContact CG2-CG 4.27Å; L70-R137 CarbonylContact O-C 3.52Å; L70-R137 WeakPolarHBondContact O-CA 3.48Å; T71-R137 HydrophobicContact CG2-CG 4.35Å; Q116-R137 VanDerWaalsContact CA-O 3.29Å; Q116-R137 WeakPolarHBondContact CA-O 3.28Å; D117-R137 PolarHBondContact N-O 3.46Å; D117-R137 VanDerWaalsContact N-O 3.08Å; D117-R137 PolarHBondContact O-N 3.1Å; D117-R137 WeakPolarHBondContact OD1-CB 3.37Å; D117-R137 IonicContact OD1-CZ 3.98Å; D117-R137 VanDerWaalsContact OD1-CZ 3.3Å; D117-R137 IonicContact OD1-NE 3.61Å; D117-R137 PolarHBondContact OD1-NE 2.87Å; D117-R137 IonicContact OD1-NH2 3.63Å; D117-R137 PolarHBondContact OD1-NH2 2.84Å; D117-R137 IonicContact OD2-CZ 3.08Å; D117-R137 IonicContact OD2-NE 2.91Å; D117-R137 IonicContact OD2-NH2 2.7Å; D117-R137 PolarHBondContact OD2-NH2 3.07Å; A119-R137 VanDerWaalsContact CB-CZ 3.46Å
138	I	95.9	Very high	90.1	Very high	22 Å²	22	50 Å²	50	11%	0.113	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.5	169.3	-54.6	-176	0	0	0	106.9	I69 L70 L72 L92 L114 Q116	I69-I138 WeakPolarHBondContact CA-O 3.44Å; L70-I138 HydrophobicContact CB-CB 4.38Å; L70-I138 HydrophobicContact CD2-CD1 4.49Å; L70-I138 PolarHBondContact N-O 3.22Å; L70-I138 PolarHBondContact O-N 3.38Å; L72-I138 HydrophobicContact CD1-CD1 3.87Å; L72-I138 HydrophobicContact CD1-CG1 4.11Å; L92-I138 HydrophobicContact CD1-CG2 4.43Å; L114-I138 HydrophobicContact CD1-CG2 3.77Å; L114-I138 HydrophobicContact CD2-CG2 4.26Å; L114-I138 HydrophobicContact CG-CG2 4.1Å; Q116-I138 HydrophobicContact CG-CG1 4.15Å
139	C	97.1	Very high	90.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	118.7	-173	-59	0	0	0	0	110	K68 L114 F115	K68-C139 WeakPolarHBondContact O-CA 3.36Å; L114-C139 WeakPolarHBondContact CA-O 3.4Å; F115-C139 HydrophobicContact CD1-CB 3.9Å; F115-C139 HydrophobicContact CD2-CB 4.24Å; F115-C139 HydrophobicContact CE1-CB 3.45Å; F115-C139 VanDerWaalsContact CE1-CB 3.45Å; F115-C139 HydrophobicContact CE2-CB 3.82Å; F115-C139 HydrophobicContact CG-CB 4.27Å; F115-C139 HydrophobicContact CZ-CB 3.4Å; F115-C139 VanDerWaalsContact CZ-CB 3.4Å; F115-C139 PolarHBondContact N-O 3.22Å; F115-C139 PolarHBondContact O-N 3.42Å
140	L	98.1	Very high	91.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.2	169.1	176.3	60.9	0	0	0	108.8	L67 K68 L92 E95 Y96 H111 L114 L142	L67-L140 WeakPolarHBondContact CA-O 3.18Å; K68-L140 HydrophobicContact CB-CB 4.38Å; K68-L140 PolarHBondContact N-O 3.45Å; K68-L140 PolarHBondContact O-N 3Å; L92-L140 HydrophobicContact CD2-CB 3.85Å; L92-L140 HydrophobicContact CD2-CD2 3.98Å; E95-L140 HydrophobicContact CB-CD2 4.24Å; E95-L140 HydrophobicContact CG-CD2 4.07Å; Y96-L140 HydrophobicContact CD2-CD1 3.76Å; Y96-L140 HydrophobicContact CG-CD1 4.42Å; H111-L140 HydrophobicContact CB-CD1 3.99Å; L114-L140 HydrophobicContact CD1-CB 3.92Å; L114-L140 HydrophobicContact CD1-CD1 4.26Å; L140-L142 HydrophobicContact CD1-CD2 4.25Å; L140-L142 HydrophobicContact CD2-CD2 4.05Å; L140-L142 HydrophobicContact CD2-CG 4.47Å; L140-L142 HydrophobicContact CG-CD2 3.88Å; L140-L142 HydrophobicContact CG-CG 4.18Å
141	V	98.3	Very high	92	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.9	180	-173.3	0	0	0	0	108.7	F37 Y65 L67 H111 H112 G113 F115	F37-V141 HydrophobicContact CD2-CG2 4.42Å; F37-V141 HydrophobicContact CE1-CG1 4.01Å; F37-V141 HydrophobicContact CE2-CG2 3.64Å; F37-V141 HydrophobicContact CZ-CB 4.39Å; F37-V141 HydrophobicContact CZ-CG1 3.78Å; F37-V141 HydrophobicContact CZ-CG2 3.73Å; Y65-V141 HydrophobicContact CD1-CG1 3.8Å; Y65-V141 HydrophobicContact CG-CG1 3.84Å; L67-V141 HydrophobicContact CD1-CB 4.31Å; L67-V141 HydrophobicContact CD1-CG1 3.9Å; L67-V141 HydrophobicContact CD1-CG2 4.11Å; L67-V141 HydrophobicContact CG-CG2 4.29Å; H111-V141 CarbonylContact C-O 3.6Å; H111-V141 WeakPolarHBondContact CA-O 3.44Å; H111-V141 WeakPolarHBondContact CB-O 3.47Å; H112-V141 HydrophobicContact CB-CB 4.11Å; H112-V141 HydrophobicContact CB-CG1 3.84Å; H112-V141 PolarHBondContact N-O 2.78Å; G113-V141 PolarHBondContact O-N 2.87Å; G113-V141 VanDerWaalsContact O-N 3.14Å; F115-V141 HydrophobicContact CD1-CG2 4.02Å; F115-V141 HydrophobicContact CE1-CG2 3.72Å
142	L	98.3	Very high	92.5	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	162.3	-178.8	-57.3	177.4	0	0	0	110.7	Y65 Q66 K68 L99 V109 H110 H111 L140	Y65-L142 WeakPolarHBondContact CA-O 3.29Å; Y65-L142 WeakPolarHBondContact CB-O 3.18Å; Q66-L142 HydrophobicContact CB-CB 4.33Å; Q66-L142 PolarHBondContact N-O 3.22Å; Q66-L142 PolarHBondContact O-N 2.83Å; K68-L142 HydrophobicContact CD-CD1 3.94Å; K68-L142 HydrophobicContact CG-CD1 4.12Å; L99-L142 HydrophobicContact CD1-CD2 3.59Å; V109-L142 HydrophobicContact CG2-CB 4.13Å; H110-L142 WeakPolarHBondContact O-CA 3.47Å; H111-L142 HydrophobicContact CB-CD2 3.66Å; L140-L142 HydrophobicContact CD1-CD2 4.25Å; L140-L142 HydrophobicContact CD2-CD2 4.05Å; L140-L142 HydrophobicContact CD2-CG 4.47Å; L140-L142 HydrophobicContact CG-CD2 3.88Å; L140-L142 HydrophobicContact CG-CG 4.18Å
143	D	97.8	Very high	93.1	Very high	37 Å²	37	48.3 Å²	48.3	20%	0.198	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	144.3	169.4	-62.4	-39.4	0	0	0	111.7	V109 H110 H112 L145	V109-D143 HydrophobicContact CG2-CB 4.18Å; H110-D143 WeakPolarHBondContact CA-OD2 3.4Å; H110-D143 WeakPolarHBondContact CB-OD2 3.4Å; H110-D143 IonicContact CG-OD2 2.77Å; H110-D143 PolarHBondContact N-OD2 3.07Å; H110-D143 IonicContact ND1-OD2 3.95Å; H110-D143 PolarHBondContact O-N 2.79Å; H112-D143 IonicContact CD2-OD1 2.77Å; H112-D143 IonicContact CE1-OD1 3.22Å; H112-D143 IonicContact NE2-OD1 3.99Å; H112-D143 PolarHBondContact NE2-OD1 3.22Å; D143-L145 HydrophobicContact CB-CD2 4.13Å; D143-L145 HydrophobicContact CB-CG 4.09Å; D143-L145 PolarHBondContact O-N 3.09Å
144	C	96.6	Very high	93.7	Very high	12 Å²	12	45.7 Å²	45.7	8%	0.081	24%	0.238	C	C	.	.			trans	-81.1	109.6	167.7	-175.2	0	0	0	0	109.4	L55 F64 C146 T154	L55-C144 WeakPolarHBondContact CD1-SG 3.45Å; F64-C144 HydrophobicContact CB-CB 4.1Å; F64-C144 VanDerWaalsContact O-CB 3.24Å; F64-C144 WeakPolarHBondContact O-CB 3.33Å; C144-C146 VanDerWaalsContact SG-SG 3.62Å; C144-T154 WeakPolarHBondContact O-CG2 3.48Å
145	L	95.9	Very high	94.1	Very high	25 Å²	25	44.9 Å²	44.9	13%	0.131	24%	0.241	C	C	.	.			trans	-111.7	19.8	-179.7	-59.2	174.4	0	0	0	112.7	V109 D143 L157 V205 T214 T216	V109-L145 HydrophobicContact CB-CD1 3.73Å; V109-L145 HydrophobicContact CG2-CD1 3.7Å; D143-L145 HydrophobicContact CB-CD2 4.13Å; D143-L145 HydrophobicContact CB-CG 4.09Å; D143-L145 PolarHBondContact O-N 3.09Å; L145-L157 HydrophobicContact CB-CD1 4.46Å; L145-L157 HydrophobicContact CD2-CD1 4.16Å; L145-V205 HydrophobicContact CB-CB 4.45Å; L145-V205 HydrophobicContact CB-CG1 4.29Å; L145-V205 HydrophobicContact CB-CG2 4Å; L145-V205 WeakPolarHBondContact O-CG1 3.13Å; L145-T214 HydrophobicContact CD1-CG2 3.55Å; L145-T214 HydrophobicContact CD2-CG2 4.25Å; L145-T216 HydrophobicContact CD1-CG2 3.5Å; L145-T216 VanDerWaalsContact CD1-CG2 3.5Å
146	C	93.1	Very high	94.6	Very high	36 Å²	36	47.1 Å²	47.1	24%	0.243	25%	0.254	C	S	.	.	S	Bend	trans	-115.6	137.5	175.3	60.6	0	0	0	0	110.8	C144 H148 T154	C144-C146 VanDerWaalsContact SG-SG 3.62Å; C146-H148 PolarHBondContact O-CD2 3.48Å; C146-T154 PolarHBondContact O-OG1 3.08Å
147	A	91.9	Very high	94.9	Very high	53 Å²	53	44.8 Å²	44.8	44%	0.438	25%	0.245	S	C	.	.			trans	-65.2	140	166.2	0	0	0	0	0	110.1
148	H	92.1	Very high	95	Very high	28 Å²	28	45.2 Å²	45.2	13%	0.13	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-155.4	158.1	-178.9	61.3	61.9	0	0	0	112	L55 F64 C146 F150 S151	L55-H148 HydrophobicContact CD2-CB 4.14Å; F64-H148 AromaticContact CD1-CE1 3.75Å; F64-H148 AromaticContact CD1-NE2 3.71Å; F64-H148 AromaticContact CD2-CE1 3.8Å; F64-H148 AromaticContact CD2-NE2 3.99Å; F64-H148 AromaticContact CE1-CE1 3.99Å; F64-H148 AromaticContact CG-CE1 3.65Å; F64-H148 AromaticContact CG-NE2 3.48Å; F64-H148 WeakPolarHBondContact CG-NE2 3.42Å; C146-H148 PolarHBondContact O-CD2 3.48Å; H148-F150 HydrophobicContact CB-CD2 4.35Å; H148-F150 AromaticContact ND1-CD2 3.95Å; H148-F150 PolarHBondContact ND1-N 2.97Å; H148-F150 PolarHBondContact O-N 3.31Å; H148-F150 VanDerWaalsContact O-N 3.09Å; H148-S151 PolarHBondContact CE1-N 3.32Å; H148-S151 PolarHBondContact ND1-N 3.34Å
149	D	91.9	Very high	95.1	Very high	166 Å²	166	46 Å²	46	89%	0.888	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-11.7	-172	-54.2	-31.1	0	0	0	114.6
150	F	90.8	Very high	95.1	Very high	74 Å²	74	46 Å²	46	33%	0.325	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-11.3	-175.1	-48.7	-73.7	0	0	0	114.7	I26 P41 L55 F64 H148	I26-F150 HydrophobicContact CD1-CB 4.2Å; I26-F150 HydrophobicContact CD1-CD1 3.56Å; I26-F150 HydrophobicContact CD1-CD2 3.75Å; I26-F150 HydrophobicContact CD1-CE1 3.76Å; I26-F150 HydrophobicContact CD1-CE2 3.93Å; I26-F150 HydrophobicContact CD1-CG 3.54Å; I26-F150 HydrophobicContact CD1-CZ 3.94Å; I26-F150 HydrophobicContact CG1-CD1 3.93Å; I26-F150 HydrophobicContact CG1-CE1 3.74Å; I26-F150 HydrophobicContact CG1-CG 4.41Å; I26-F150 HydrophobicContact CG1-CZ 4.08Å; P41-F150 HydrophobicContact CG-CE2 4.45Å; L55-F150 HydrophobicContact CD2-CD2 3.74Å; L55-F150 HydrophobicContact CD2-CE2 3.95Å; F64-F150 HydrophobicContact CE1-CB 3.58Å; F64-F150 HydrophobicContact CE1-CD2 4.37Å; F64-F150 HydrophobicContact CE1-CG 4.19Å; F64-F150 HydrophobicContact CE2-CB 4.35Å; F64-F150 HydrophobicContact CZ-CB 3.41Å; F64-F150 VanDerWaalsContact CZ-CB 3.41Å; F64-F150 HydrophobicContact CZ-CG 4.42Å; H148-F150 HydrophobicContact CB-CD2 4.35Å; H148-F150 AromaticContact ND1-CD2 3.95Å; H148-F150 PolarHBondContact ND1-N 2.97Å; H148-F150 PolarHBondContact O-N 3.31Å; H148-F150 VanDerWaalsContact O-N 3.09Å
151	S	92.8	Very high	95.1	Very high	23 Å²	23	47.1 Å²	47.1	16%	0.161	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-164.3	141.7	179.5	-165.7	0	0	0	0	111.6	H148 K153	H148-S151 PolarHBondContact CE1-N 3.32Å; H148-S151 PolarHBondContact ND1-N 3.34Å; S151-K153 VanDerWaalsContact C-N 3.31Å; S151-K153 PolarHBondContact O-N 3.38Å; S151-K153 PolarHBondContact OG-N 3.14Å
152	D	92.9	Very high	94.9	Very high	143 Å²	143	51.4 Å²	51.4	77%	0.765	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-82.7	-6.1	176.8	-60.8	-39.7	0	0	0	113.7	T154 A155	D152-T154 PolarHBondContact O-N 2.84Å; D152-T154 VanDerWaalsContact O-N 3.08Å; D152-A155 WeakPolarHBondContact O-CB 3.32Å; D152-A155 PolarHBondContact O-N 3.01Å; D152-A155 VanDerWaalsContact O-N 3.13Å
153	K	92.4	Very high	94.9	Very high	136 Å²	136	52.7 Å²	52.7	59%	0.591	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-53.7	-34.3	-176.4	-73.8	176.5	177.4	171	0	113.1	D62 D63 S151	D62-K153 PolarHBondContact O-NZ 3.07Å; D63-K153 IonicContact OD1-NZ 2.75Å; D63-K153 PolarHBondContact OD1-NZ 3.44Å; S151-K153 VanDerWaalsContact C-N 3.31Å; S151-K153 PolarHBondContact O-N 3.38Å; S151-K153 PolarHBondContact OG-N 3.14Å
154	T	94.4	Very high	94.8	Very high	18 Å²	18	50.9 Å²	50.9	11%	0.11	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-114.1	12.8	-176.2	57.7	0	0	0	0	112.9	C144 C146 D152 D156 L157	C144-T154 WeakPolarHBondContact O-CG2 3.48Å; C146-T154 PolarHBondContact O-OG1 3.08Å; D152-T154 PolarHBondContact O-N 2.84Å; D152-T154 VanDerWaalsContact O-N 3.08Å; T154-D156 PolarHBondContact O-N 2.78Å; T154-D156 VanDerWaalsContact O-N 3.16Å; T154-L157 HydrophobicContact CG2-CD1 3.99Å; T154-L157 WeakPolarHBondContact O-CB 3.18Å; T154-L157 PolarHBondContact O-N 3.15Å
155	A	94.6	Very high	94.8	Very high	41 Å²	41	52.7 Å²	52.7	34%	0.339	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.4	-174.8	0	0	0	0	0	114.2	D152 L157 K208	D152-A155 WeakPolarHBondContact O-CB 3.32Å; D152-A155 PolarHBondContact O-N 3.01Å; D152-A155 VanDerWaalsContact O-N 3.13Å; A155-L157 VanDerWaalsContact C-N 3.31Å; A155-K208 PolarHBondContact O-NZ 2.87Å
156	D	96	Very high	94.7	Very high	67 Å²	67	58.1 Å²	58.1	36%	0.358	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-9	176.1	-75.4	-29	0	0	0	113.7	T154 K208 R209	T154-D156 PolarHBondContact O-N 2.78Å; T154-D156 VanDerWaalsContact O-N 3.16Å; D156-K208 WeakPolarHBondContact O-CE 3.46Å; D156-K208 WeakPolarHBondContact O-CG 3.37Å; D156-K208 PolarHBondContact O-N 3.44Å; D156-R209 IonicContact OD2-NE 3.68Å
157	L	97.6	Very high	94.8	Very high	26 Å²	26	60.1 Å²	60.1	14%	0.136	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.6	-178.8	-57.3	-174.3	0	0	0	111.5	L145 T154 A155 V205 L206 N207	L145-L157 HydrophobicContact CB-CD1 4.46Å; L145-L157 HydrophobicContact CD2-CD1 4.16Å; T154-L157 HydrophobicContact CG2-CD1 3.99Å; T154-L157 WeakPolarHBondContact O-CB 3.18Å; T154-L157 PolarHBondContact O-N 3.15Å; A155-L157 VanDerWaalsContact C-N 3.31Å; L157-V205 HydrophobicContact CB-CG1 3.85Å; L157-V205 HydrophobicContact CD1-CG1 4.37Å; L157-V205 HydrophobicContact CD2-CG1 4.34Å; L157-V205 HydrophobicContact CG-CG1 4.41Å; L157-L206 CarbonylContact C-O 3.52Å; L157-L206 WeakPolarHBondContact CA-O 3.39Å; L157-N207 HydrophobicContact CD2-CB 3.83Å
158	I	97.3	Very high	94.9	Very high	38 Å²	38	62.1 Å²	62.1	20%	0.195	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	142.5	175	-170.2	168.4	0	0	0	110.2	L160 H162 Y163 V205 L206 K208	I158-L160 PolarHBondContact O-N 3.34Å; I158-H162 HydrophobicContact CG1-CB 4.39Å; I158-Y163 HydrophobicContact CD1-CD2 4.18Å; I158-Y163 HydrophobicContact CG2-CD2 4.12Å; I158-Y163 HydrophobicContact CG2-CG 4.27Å; I158-V205 CarbonylContact O-C 3.55Å; I158-L206 HydrophobicContact CG2-CB 4.06Å; I158-L206 HydrophobicContact CG2-CD2 4.29Å; I158-L206 HydrophobicContact CG2-CG 4.42Å; I158-L206 PolarHBondContact N-O 2.95Å; I158-L206 PolarHBondContact O-N 2.97Å; I158-K208 HydrophobicContact CG2-CD 4.17Å; I158-K208 HydrophobicContact CG2-CG 3.72Å
159	N	97.3	Very high	94.9	Very high	38 Å²	38	65.6 Å²	65.6	20%	0.203	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	130.1	170.2	-174.3	-79.5	0	0	0	109.9	Q161 H162 Y163 G202	N159-Q161 PolarHBondContact O-N 2.86Å; N159-Q161 WeakPolarHBondContact OD1-CB 3.35Å; N159-Q161 PolarHBondContact OD1-N 3.09Å; N159-H162 HydrophobicContact CB-CB 4.3Å; N159-H162 WeakPolarHBondContact O-CB 3.39Å; N159-H162 PolarHBondContact O-N 3.23Å; N159-Y163 PolarHBondContact O-N 3.48Å; N159-G202 PolarHBondContact ND2-O 2.93Å
160	L	97.9	Very high	95.2	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-31.7	-173.4	-176.1	62.4	0	0	0	112.1	I158 Y163 V164 I178 L201 M204 L206 I213 M268	I158-L160 PolarHBondContact O-N 3.34Å; L160-Y163 HydrophobicContact CD1-CD1 4.28Å; L160-Y163 PolarHBondContact O-N 3.44Å; L160-V164 HydrophobicContact CD1-CG2 4.5Å; L160-V164 WeakPolarHBondContact O-CG2 3.24Å; L160-V164 PolarHBondContact O-N 3.31Å; L160-I178 HydrophobicContact CD1-CG2 4.21Å; L160-I178 HydrophobicContact CD2-CG2 4.34Å; L160-L201 HydrophobicContact CD2-CD2 3.58Å; L160-L201 HydrophobicContact CG-CD2 3.82Å; L160-M204 HydrophobicContact CB-CB 3.99Å; L160-M204 WeakPolarHBondContact CB-O 3.46Å; L160-M204 HydrophobicContact CD2-CB 4.04Å; L160-M204 HydrophobicContact CD2-SD 3.91Å; L160-M204 PolarHBondContact N-O 3.34Å; L160-L206 HydrophobicContact CD1-CB 4.3Å; L160-L206 HydrophobicContact CD1-CD2 4.13Å; L160-I213 HydrophobicContact CD1-CD1 4.49Å; L160-I213 HydrophobicContact CD2-CD1 4.07Å; L160-M268 HydrophobicContact CD2-SD 4.24Å
161	Q	96.4	Very high	95.5	Very high	23 Å²	23	57.7 Å²	57.7	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-46.3	173.6	-169.7	177.7	-0.9	0	0	111.5	N159 Y163 V164 I165 L201 M380	N159-Q161 PolarHBondContact O-N 2.86Å; N159-Q161 WeakPolarHBondContact OD1-CB 3.35Å; N159-Q161 PolarHBondContact OD1-N 3.09Å; Q161-Y163 VanDerWaalsContact C-N 3.28Å; Q161-Y163 PolarHBondContact O-N 3.4Å; Q161-V164 PolarHBondContact O-N 2.81Å; Q161-I165 HydrophobicContact CG-CD1 4.04Å; Q161-I165 VanDerWaalsContact O-CG1 3.27Å; Q161-I165 WeakPolarHBondContact O-CG1 3.09Å; Q161-I165 PolarHBondContact O-N 2.95Å; Q161-L201 HydrophobicContact CB-CB 3.77Å; Q161-L201 HydrophobicContact CG-CB 4.34Å; Q161-L201 PolarHBondContact N-O 3.3Å; Q161-M380 HydrophobicContact CG-CE 3.47Å; Q161-M380 VanDerWaalsContact CG-CE 3.47Å
162	H	95.9	Very high	95.7	Very high	92 Å²	92	58.2 Å²	58.2	43%	0.426	29%	0.287	S	S	.	.	H	α-helix	trans	-64	-36.1	176.7	-64.4	165	0	0	0	111.8	I158 N159 K166	I158-H162 HydrophobicContact CG1-CB 4.39Å; N159-H162 HydrophobicContact CB-CB 4.3Å; N159-H162 WeakPolarHBondContact O-CB 3.39Å; N159-H162 PolarHBondContact O-N 3.23Å; H162-K166 VanDerWaalsContact O-CB 3.28Å; H162-K166 WeakPolarHBondContact O-CB 3.49Å; H162-K166 PolarHBondContact O-N 3.06Å
163	Y	97.4	Very high	95.9	Very high	30 Å²	30	59.6 Å²	59.6	12%	0.118	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-50.8	175.5	-172.1	-114.6	0	0	0	111.7	I158 N159 L160 Q161 I165 K166 E167 L170 E174 I178 L206	I158-Y163 HydrophobicContact CD1-CD2 4.18Å; I158-Y163 HydrophobicContact CG2-CD2 4.12Å; I158-Y163 HydrophobicContact CG2-CG 4.27Å; N159-Y163 PolarHBondContact O-N 3.48Å; L160-Y163 HydrophobicContact CD1-CD1 4.28Å; L160-Y163 PolarHBondContact O-N 3.44Å; Q161-Y163 VanDerWaalsContact C-N 3.28Å; Q161-Y163 PolarHBondContact O-N 3.4Å; Y163-I165 PolarHBondContact O-N 2.96Å; Y163-K166 PolarHBondContact O-N 3.21Å; Y163-K166 VanDerWaalsContact O-N 3.17Å; Y163-E167 HydrophobicContact CD2-CG 4.18Å; Y163-E167 HydrophobicContact CE1-CG 4.33Å; Y163-E167 HydrophobicContact CE2-CG 3.84Å; Y163-E167 WeakPolarHBondContact O-CG 3.48Å; Y163-E167 PolarHBondContact O-N 3.49Å; Y163-L170 HydrophobicContact CD1-CD1 4.31Å; Y163-L170 HydrophobicContact CD1-CD2 3.84Å; Y163-L170 HydrophobicContact CE1-CD1 4.24Å; Y163-L170 HydrophobicContact CE1-CD2 3.5Å; Y163-L170 VanDerWaalsContact CE1-CD2 3.5Å; Y163-E174 VanDerWaalsContact CE1-OE1 3.27Å; Y163-E174 WeakPolarHBondContact CE1-OE1 3.44Å; Y163-E174 VanDerWaalsContact CZ-OE1 3.32Å; Y163-E174 PolarHBondContact OH-OE1 2.71Å; Y163-I178 HydrophobicContact CE1-CD1 4.49Å; Y163-L206 HydrophobicContact CD1-CD2 3.45Å; Y163-L206 VanDerWaalsContact CD1-CD2 3.45Å; Y163-L206 HydrophobicContact CD2-CD2 4.36Å; Y163-L206 HydrophobicContact CE1-CD2 3.64Å; Y163-L206 HydrophobicContact CG-CD2 3.84Å
164	V	96.7	Very high	96.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-41.9	177.4	175	0	0	0	0	111.7	L160 Q161 K166 E167 K168 L170 L201 M268	L160-V164 HydrophobicContact CD1-CG2 4.5Å; L160-V164 WeakPolarHBondContact O-CG2 3.24Å; L160-V164 PolarHBondContact O-N 3.31Å; Q161-V164 PolarHBondContact O-N 2.81Å; V164-K166 VanDerWaalsContact C-N 3.32Å; V164-K166 PolarHBondContact O-N 3.41Å; V164-E167 PolarHBondContact O-N 3.4Å; V164-K168 CarbonylContact O-C 3.59Å; V164-K168 VanDerWaalsContact O-C 3.28Å; V164-K168 VanDerWaalsContact O-CA 3.27Å; V164-K168 WeakPolarHBondContact O-CA 3.35Å; V164-K168 PolarHBondContact O-N 3.42Å; V164-L170 HydrophobicContact CG2-CD1 4.16Å; V164-L170 HydrophobicContact CG2-CG 4.24Å; V164-L201 HydrophobicContact CG2-CD1 4.37Å; V164-M268 HydrophobicContact CG2-CG 4.16Å
165	I	94.9	Very high	96.3	Very high	50 Å²	50	54 Å²	54	26%	0.256	26%	0.256	S	S	.	.	H	α-helix	trans	-62	-41.2	176.6	-69.7	166.2	0	0	0	111.4	Q161 Y163 K168 M380	Q161-I165 HydrophobicContact CG-CD1 4.04Å; Q161-I165 VanDerWaalsContact O-CG1 3.27Å; Q161-I165 WeakPolarHBondContact O-CG1 3.09Å; Q161-I165 PolarHBondContact O-N 2.95Å; Y163-I165 PolarHBondContact O-N 2.96Å; I165-K168 PolarHBondContact O-N 3.17Å; I165-M380 HydrophobicContact CD1-CB 4.09Å; I165-M380 HydrophobicContact CD1-CE 4.22Å; I165-M380 HydrophobicContact CG1-CB 4.46Å; I165-M380 HydrophobicContact CG1-CE 4.3Å
166	K	95.3	Very high	96.5	Very high	139 Å²	139	52 Å²	52	60%	0.604	24%	0.24	S	C	*	.	H	α-helix	trans	-66.9	-48	-179.7	-178.1	-174.2	166.9	-101.3	0	111.2	H162 Y163 V164 K168	H162-K166 VanDerWaalsContact O-CB 3.28Å; H162-K166 WeakPolarHBondContact O-CB 3.49Å; H162-K166 PolarHBondContact O-N 3.06Å; Y163-K166 PolarHBondContact O-N 3.21Å; Y163-K166 VanDerWaalsContact O-N 3.17Å; V164-K166 VanDerWaalsContact C-N 3.32Å; V164-K166 PolarHBondContact O-N 3.41Å; K166-K168 PolarHBondContact O-N 2.93Å
167	E	95.3	Very high	96.6	Very high	77 Å²	77	51.5 Å²	51.5	36%	0.36	24%	0.239	S	C	.	.	H	α-helix	trans	-80.8	-4.2	-179.3	-57.4	-54.4	139.4	0	0	113	Y163 V164 R169 L170	Y163-E167 HydrophobicContact CD2-CG 4.18Å; Y163-E167 HydrophobicContact CE1-CG 4.33Å; Y163-E167 HydrophobicContact CE2-CG 3.84Å; Y163-E167 WeakPolarHBondContact O-CG 3.48Å; Y163-E167 PolarHBondContact O-N 3.49Å; V164-E167 PolarHBondContact O-N 3.4Å; E167-R169 PolarHBondContact O-N 3.4Å; E167-L170 HydrophobicContact CB-CD2 4.01Å; E167-L170 HydrophobicContact CG-CD2 4.3Å
168	K	93	Very high	96.6	Very high	95 Å²	95	50.2 Å²	50.2	41%	0.413	23%	0.233	S	C	.	.	S	Bend	trans	67.4	-47	-172.4	-51.5	-59.8	174.5	-166.6	0	113.7	V164 I165 K166 G271 E377	V164-K168 CarbonylContact O-C 3.59Å; V164-K168 VanDerWaalsContact O-C 3.28Å; V164-K168 VanDerWaalsContact O-CA 3.27Å; V164-K168 WeakPolarHBondContact O-CA 3.35Å; V164-K168 PolarHBondContact O-N 3.42Å; I165-K168 PolarHBondContact O-N 3.17Å; K166-K168 PolarHBondContact O-N 2.93Å; K168-G271 WeakPolarHBondContact O-CA 3.48Å; K168-E377 IonicContact NZ-OE1 3.49Å; K168-E377 PolarHBondContact NZ-OE1 2.96Å
169	R	93	Very high	96.7	Very high	101 Å²	101	48.4 Å²	48.4	38%	0.381	22%	0.223	S	C	.	.	S	Bend	trans	-158.9	159.1	173.9	60.4	178.4	178.9	-133.2	-2	108.9	E167 R299	E167-R169 PolarHBondContact O-N 3.4Å; R169-R299 VanDerWaalsContact CZ-CZ 3.49Å
170	L	97.4	Very high	96.7	Very high	6 Å²	6	50 Å²	50	3%	0.031	23%	0.227	C	C	.	.			trans	-98.4	148.7	177	-54.7	-174.6	0	0	0	110.5	Y163 V164 E167 A175 I178 M268	Y163-L170 HydrophobicContact CD1-CD1 4.31Å; Y163-L170 HydrophobicContact CD1-CD2 3.84Å; Y163-L170 HydrophobicContact CE1-CD1 4.24Å; Y163-L170 HydrophobicContact CE1-CD2 3.5Å; Y163-L170 VanDerWaalsContact CE1-CD2 3.5Å; V164-L170 HydrophobicContact CG2-CD1 4.16Å; V164-L170 HydrophobicContact CG2-CG 4.24Å; E167-L170 HydrophobicContact CB-CD2 4.01Å; E167-L170 HydrophobicContact CG-CD2 4.3Å; L170-A175 HydrophobicContact CB-CB 4.13Å; L170-I178 HydrophobicContact CD1-CD1 4.09Å; L170-M268 HydrophobicContact CD1-CB 4.26Å; L170-M268 HydrophobicContact CD1-CE 3.94Å; L170-M268 HydrophobicContact CD1-CG 4.33Å; L170-M268 PolarHBondContact N-O 2.74Å
171	S	97.2	Very high	96.8	Very high	68 Å²	68	50.1 Å²	50.1	48%	0.476	23%	0.228	S	C	.	.			trans	-63	151.3	169	68.8	0	0	0	0	110.4	R173 E174 A175	S171-R173 PolarHBondContact O-N 3.5Å; S171-E174 PolarHBondContact O-N 3.46Å; S171-E174 VanDerWaalsContact O-N 3.17Å; S171-E174 VanDerWaalsContact OG-CB 3.3Å; S171-E174 WeakPolarHBondContact OG-CB 3.4Å; S171-E174 PolarHBondContact OG-N 3Å; S171-A175 WeakPolarHBondContact O-CB 3.45Å; S171-A175 PolarHBondContact O-N 3.01Å
172	E	97.1	Very high	96.9	Very high	35 Å²	35	49 Å²	49	16%	0.164	22%	0.223	C	C	.	.	H	α-helix	trans	-53	-44.7	177.7	178.9	176.7	-148.6	0	0	111.7	E174 A175 I176 L269 S301 T304	E172-E174 PolarHBondContact O-N 2.84Å; E172-A175 PolarHBondContact O-N 2.88Å; E172-I176 HydrophobicContact CG-CG1 4.13Å; E172-I176 WeakPolarHBondContact O-CB 3.37Å; E172-I176 WeakPolarHBondContact O-CG1 3.49Å; E172-I176 PolarHBondContact O-N 3.43Å; E172-L269 HydrophobicContact CB-CD2 4.18Å; E172-L269 HydrophobicContact CG-CD2 4.45Å; E172-S301 VanDerWaalsContact CD-N 3.31Å; E172-S301 VanDerWaalsContact OE1-CB 3.24Å; E172-S301 WeakPolarHBondContact OE1-CB 3.46Å; E172-S301 PolarHBondContact OE1-N 3.43Å; E172-S301 PolarHBondContact OE1-OG 2.85Å; E172-S301 PolarHBondContact OE2-N 3.42Å; E172-S301 VanDerWaalsContact OE2-N 3.1Å; E172-T304 WeakPolarHBondContact OE1-CB 3.47Å; E172-T304 PolarHBondContact OE1-OG1 2.59Å
173	R	96.4	Very high	97	Very high	171 Å²	171	44.7 Å²	44.7	65%	0.645	20%	0.202	S	C	*	.	H	α-helix	trans	-59.2	-47.2	-179.5	-172.8	175.8	-178.6	179.5	1	112.4	S171 V177 W336	S171-R173 PolarHBondContact O-N 3.5Å; R173-V177 WeakPolarHBondContact O-CG2 3.45Å; R173-V177 PolarHBondContact O-N 3.5Å; R173-W336 HydrophobicContact CB-CH2 4.2Å; R173-W336 HydrophobicContact CB-CZ3 4.4Å; R173-W336 HydrophobicContact CG-CE3 4.06Å; R173-W336 HydrophobicContact CG-CH2 4.03Å; R173-W336 HydrophobicContact CG-CZ3 3.72Å
174	E	97.4	Very high	97.1	Very high	37 Å²	37	46.1 Å²	46.1	17%	0.173	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-45.9	179	-178.1	179.6	-165.6	0	0	111.5	Y163 S171 E172 I176 V177 I178	Y163-E174 VanDerWaalsContact CE1-OE1 3.27Å; Y163-E174 WeakPolarHBondContact CE1-OE1 3.44Å; Y163-E174 VanDerWaalsContact CZ-OE1 3.32Å; Y163-E174 PolarHBondContact OH-OE1 2.71Å; S171-E174 PolarHBondContact O-N 3.46Å; S171-E174 VanDerWaalsContact O-N 3.17Å; S171-E174 VanDerWaalsContact OG-CB 3.3Å; S171-E174 WeakPolarHBondContact OG-CB 3.4Å; S171-E174 PolarHBondContact OG-N 3Å; E172-E174 PolarHBondContact O-N 2.84Å; E174-I176 VanDerWaalsContact C-N 3.32Å; E174-I176 PolarHBondContact O-N 2.78Å; E174-V177 PolarHBondContact O-N 3.46Å; E174-I178 HydrophobicContact CG-CD1 3.83Å; E174-I178 WeakPolarHBondContact O-CG1 3.47Å; E174-I178 PolarHBondContact O-N 3.2Å
175	A	98.3	Very high	97.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.5	-44.8	-178.9	0	0	0	0	0	111.5	L170 S171 E172 I178 F179 M268 L269	L170-A175 HydrophobicContact CB-CB 4.13Å; S171-A175 WeakPolarHBondContact O-CB 3.45Å; S171-A175 PolarHBondContact O-N 3.01Å; E172-A175 PolarHBondContact O-N 2.88Å; A175-I178 PolarHBondContact O-N 3.02Å; A175-F179 WeakPolarHBondContact O-CB 3.18Å; A175-F179 PolarHBondContact O-N 2.92Å; A175-M268 HydrophobicContact CB-CB 4.24Å; A175-M268 HydrophobicContact CB-CE 4.06Å; A175-M268 VanDerWaalsContact O-CE 3.29Å; A175-M268 WeakPolarHBondContact O-CE 3.48Å; A175-L269 HydrophobicContact CB-CD2 3.62Å; A175-L269 HydrophobicContact CB-CG 4.15Å
176	I	98.3	Very high	97.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.6	-37.4	-179.3	-69.1	-71.7	0	0	0	112.1	E172 E174 Y180 L265 T304 L329 I332 I333 W336	E172-I176 HydrophobicContact CG-CG1 4.13Å; E172-I176 WeakPolarHBondContact O-CB 3.37Å; E172-I176 WeakPolarHBondContact O-CG1 3.49Å; E172-I176 PolarHBondContact O-N 3.43Å; E174-I176 VanDerWaalsContact C-N 3.32Å; E174-I176 PolarHBondContact O-N 2.78Å; I176-Y180 WeakPolarHBondContact O-CB 3.43Å; I176-Y180 PolarHBondContact O-N 3.29Å; I176-L265 HydrophobicContact CD1-CD1 4.35Å; I176-T304 HydrophobicContact CD1-CG2 3.81Å; I176-L329 HydrophobicContact CD1-CD2 3.43Å; I176-L329 VanDerWaalsContact CD1-CD2 3.43Å; I176-L329 HydrophobicContact CG2-CD2 3.96Å; I176-I332 HydrophobicContact CG2-CG2 4.28Å; I176-I333 HydrophobicContact CG2-CD1 4.12Å; I176-I333 HydrophobicContact CG2-CG1 3.76Å; I176-W336 HydrophobicContact CB-CH2 3.73Å; I176-W336 HydrophobicContact CB-CZ2 4.44Å; I176-W336 HydrophobicContact CG1-CH2 4.3Å; I176-W336 HydrophobicContact CG2-CH2 3.58Å; I176-W336 HydrophobicContact CG2-CZ2 4.3Å; I176-W336 HydrophobicContact CG2-CZ3 4.26Å
177	V	97.9	Very high	97.5	Very high	55 Å²	55	38.9 Å²	38.9	33%	0.333	18%	0.175	S	C	.	.	H	α-helix	trans	-65.3	-45.6	175.6	169.6	0	0	0	0	111	R173 E174 D181 H211 W336	R173-V177 WeakPolarHBondContact O-CG2 3.45Å; R173-V177 PolarHBondContact O-N 3.5Å; E174-V177 PolarHBondContact O-N 3.46Å; V177-D181 PolarHBondContact O-N 2.6Å; V177-H211 HydrophobicContact CG1-CB 4.16Å; V177-W336 HydrophobicContact CG2-CZ3 4.39Å
178	I	98.6	Very high	97.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-47.4	177.1	-67	171.5	0	0	0	110	L160 Y163 L170 E174 A175 Y180 D181 V182 L206 H211 I213 M268	L160-I178 HydrophobicContact CD1-CG2 4.21Å; L160-I178 HydrophobicContact CD2-CG2 4.34Å; Y163-I178 HydrophobicContact CE1-CD1 4.49Å; L170-I178 HydrophobicContact CD1-CD1 4.09Å; E174-I178 HydrophobicContact CG-CD1 3.83Å; E174-I178 WeakPolarHBondContact O-CG1 3.47Å; E174-I178 PolarHBondContact O-N 3.2Å; A175-I178 PolarHBondContact O-N 3.02Å; I178-Y180 VanDerWaalsContact C-N 3.33Å; I178-Y180 PolarHBondContact O-N 3.45Å; I178-D181 PolarHBondContact O-N 2.93Å; I178-D181 VanDerWaalsContact O-N 3.09Å; I178-V182 WeakPolarHBondContact O-CG2 3.45Å; I178-V182 PolarHBondContact O-N 3.22Å; I178-L206 HydrophobicContact CD1-CD1 3.91Å; I178-L206 HydrophobicContact CD1-CD2 3.93Å; I178-L206 HydrophobicContact CG1-CD1 3.95Å; I178-L206 HydrophobicContact CG2-CD1 4.3Å; I178-H211 HydrophobicContact CG1-CB 4.33Å; I178-I213 HydrophobicContact CG2-CD1 3.8Å; I178-I213 HydrophobicContact CG2-CG1 3.79Å; I178-M268 HydrophobicContact CB-CE 3.83Å; I178-M268 HydrophobicContact CG2-CE 3.72Å
179	F	98.8	Very high	98	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.5	-33.3	-177.6	-171.5	-109.4	0	0	0	112.4	A175 D181 V182 V183 L261 V264 L265 M268 L307 L311 V325 L329	A175-F179 WeakPolarHBondContact O-CB 3.18Å; A175-F179 PolarHBondContact O-N 2.92Å; F179-D181 VanDerWaalsContact C-N 3.29Å; F179-D181 PolarHBondContact O-N 2.85Å; F179-V182 HydrophobicContact CD2-CB 4.45Å; F179-V182 WeakPolarHBondContact O-CB 3.31Å; F179-V182 PolarHBondContact O-N 3.42Å; F179-V183 HydrophobicContact CD1-CG2 3.91Å; F179-V183 HydrophobicContact CE1-CG2 3.56Å; F179-V183 HydrophobicContact CE2-CG2 4.22Å; F179-V183 HydrophobicContact CG-CG2 4.38Å; F179-V183 HydrophobicContact CZ-CG2 3.74Å; F179-V183 VanDerWaalsContact O-CG2 3.3Å; F179-V183 WeakPolarHBondContact O-CG2 3.27Å; F179-V183 PolarHBondContact O-N 2.95Å; F179-L261 HydrophobicContact CE2-CB 3.99Å; F179-L261 HydrophobicContact CE2-CD2 4.36Å; F179-L261 VanDerWaalsContact CE2-O 3.24Å; F179-L261 WeakPolarHBondContact CE2-O 3.5Å; F179-L261 HydrophobicContact CZ-CB 3.91Å; F179-L261 WeakPolarHBondContact CZ-O 3.23Å; F179-V264 HydrophobicContact CD2-CG1 4.05Å; F179-V264 HydrophobicContact CE2-CB 4.43Å; F179-V264 HydrophobicContact CE2-CG1 4.07Å; F179-L265 HydrophobicContact CB-CD1 4.2Å; F179-L265 HydrophobicContact CD1-CB 4.37Å; F179-L265 HydrophobicContact CD1-CD1 3.96Å; F179-L265 HydrophobicContact CD1-CD2 4.09Å; F179-L265 HydrophobicContact CD1-CG 4.36Å; F179-L265 HydrophobicContact CD2-CB 4.09Å; F179-L265 HydrophobicContact CD2-CD1 4.41Å; F179-L265 HydrophobicContact CE1-CB 4.11Å; F179-L265 HydrophobicContact CE1-CD1 4.43Å; F179-L265 HydrophobicContact CE1-CD2 3.83Å; F179-L265 HydrophobicContact CE1-CG 4.35Å; F179-L265 HydrophobicContact CE2-CB 3.81Å; F179-L265 HydrophobicContact CG-CB 4.36Å; F179-L265 HydrophobicContact CG-CD1 3.94Å; F179-L265 HydrophobicContact CZ-CB 3.81Å; F179-L265 HydrophobicContact CZ-CD2 4.3Å; F179-M268 HydrophobicContact CB-CE 4.31Å; F179-M268 HydrophobicContact CD2-SD 4.48Å; F179-L307 HydrophobicContact CE1-CD2 4.43Å; F179-L311 HydrophobicContact CE1-CD1 4.43Å; F179-L311 HydrophobicContact CZ-CD1 4.15Å; F179-V325 HydrophobicContact CE1-CG1 4.07Å; F179-L329 HydrophobicContact CD1-CD1 3.66Å; F179-L329 HydrophobicContact CD1-CD2 4.03Å; F179-L329 HydrophobicContact CD1-CG 4.48Å; F179-L329 HydrophobicContact CE1-CD1 4.07Å
180	Y	98.7	Very high	98.2	Very high	70 Å²	70	27.2 Å²	27.2	28%	0.275	13%	0.129	S	C	.	.	H	α-helix	trans	-55.9	-45.3	169.6	175.9	-91.3	0	0	0	111.4	I176 I178 V183 R184 L326 L329 S330 I333	I176-Y180 WeakPolarHBondContact O-CB 3.43Å; I176-Y180 PolarHBondContact O-N 3.29Å; I178-Y180 VanDerWaalsContact C-N 3.33Å; I178-Y180 PolarHBondContact O-N 3.45Å; Y180-V183 PolarHBondContact O-N 2.69Å; Y180-R184 VanDerWaalsContact O-CB 3.31Å; Y180-R184 WeakPolarHBondContact O-CB 2.81Å; Y180-R184 PolarHBondContact O-N 2.79Å; Y180-L326 HydrophobicContact CD2-CG 4.31Å; Y180-L326 HydrophobicContact CE2-CD2 3.73Å; Y180-L326 HydrophobicContact CE2-CG 3.69Å; Y180-L329 HydrophobicContact CD2-CB 3.88Å; Y180-S330 WeakPolarHBondContact CE2-OG 3.27Å; Y180-I333 HydrophobicContact CD2-CD1 4.14Å; Y180-I333 HydrophobicContact CG-CD1 4.11Å
181	D	98.6	Very high	98.2	Very high	4 Å²	4	34 Å²	34	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-69.2	-36.4	178.1	-158.1	43	0	0	0	112.3	V177 I178 F179 R184 V185 R212 I213	V177-D181 PolarHBondContact O-N 2.6Å; I178-D181 PolarHBondContact O-N 2.93Å; I178-D181 VanDerWaalsContact O-N 3.09Å; F179-D181 VanDerWaalsContact C-N 3.29Å; F179-D181 PolarHBondContact O-N 2.85Å; D181-R184 PolarHBondContact O-N 3.28Å; D181-R184 IonicContact OD1-CZ 3.58Å; D181-R184 IonicContact OD1-NE 3.17Å; D181-R184 PolarHBondContact OD1-NE 3.08Å; D181-R184 IonicContact OD1-NH2 2.76Å; D181-R184 PolarHBondContact OD1-NH2 3.47Å; D181-R184 IonicContact OD2-NH2 3.93Å; D181-V185 WeakPolarHBondContact O-CG2 3.48Å; D181-V185 PolarHBondContact O-N 3.43Å; D181-R212 IonicContact OD1-CZ 3.21Å; D181-R212 IonicContact OD1-NE 2.7Å; D181-R212 PolarHBondContact OD1-NE 3.43Å; D181-R212 IonicContact OD1-NH1 3.84Å; D181-R212 PolarHBondContact OD1-NH1 2.93Å; D181-R212 VanDerWaalsContact OD2-CA 3.24Å; D181-R212 WeakPolarHBondContact OD2-CA 3.28Å; D181-R212 VanDerWaalsContact OD2-CD 3.27Å; D181-R212 WeakPolarHBondContact OD2-CD 3.46Å; D181-R212 IonicContact OD2-CZ 3.79Å; D181-R212 IonicContact OD2-NE 2.88Å; D181-R212 PolarHBondContact OD2-NE 2.73Å; D181-R212 IonicContact OD2-NH1 3.15Å; D181-I213 PolarHBondContact OD2-N 3.44Å
182	V	98.8	Very high	98.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.5	-53.7	171.3	176.8	0	0	0	0	110.6	I178 F179 R184 V185 V186 M204 I213 L261	I178-V182 WeakPolarHBondContact O-CG2 3.45Å; I178-V182 PolarHBondContact O-N 3.22Å; F179-V182 HydrophobicContact CD2-CB 4.45Å; F179-V182 WeakPolarHBondContact O-CB 3.31Å; F179-V182 PolarHBondContact O-N 3.42Å; V182-R184 VanDerWaalsContact C-N 3.33Å; V182-R184 PolarHBondContact O-N 3.49Å; V182-V185 PolarHBondContact O-N 2.83Å; V182-V186 WeakPolarHBondContact O-CG2 3.35Å; V182-V186 PolarHBondContact O-N 3.02Å; V182-M204 HydrophobicContact CG1-CE 3.6Å; V182-M204 HydrophobicContact CG1-SD 3.99Å; V182-M204 HydrophobicContact CG2-SD 3.9Å; V182-I213 HydrophobicContact CG2-CB 4.27Å; V182-I213 HydrophobicContact CG2-CG1 3.87Å; V182-I213 HydrophobicContact CG2-CG2 4.13Å; V182-L261 HydrophobicContact CG1-CD2 3.59Å
183	V	98.8	Very high	98.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-39.4	-177.6	176.9	0	0	0	0	110.5	F179 Y180 V185 V186 E187 L261 A322 V325 L326 L329	F179-V183 HydrophobicContact CD1-CG2 3.91Å; F179-V183 HydrophobicContact CE1-CG2 3.56Å; F179-V183 HydrophobicContact CE2-CG2 4.22Å; F179-V183 HydrophobicContact CG-CG2 4.38Å; F179-V183 HydrophobicContact CZ-CG2 3.74Å; F179-V183 VanDerWaalsContact O-CG2 3.3Å; F179-V183 WeakPolarHBondContact O-CG2 3.27Å; F179-V183 PolarHBondContact O-N 2.95Å; Y180-V183 PolarHBondContact O-N 2.69Å; V183-V185 VanDerWaalsContact C-N 3.32Å; V183-V185 PolarHBondContact O-N 3.47Å; V183-V186 PolarHBondContact O-N 2.79Å; V183-E187 WeakPolarHBondContact O-CB 3.11Å; V183-E187 PolarHBondContact O-N 3Å; V183-L261 HydrophobicContact CG2-CD1 4.17Å; V183-A322 HydrophobicContact CG1-CB 4.43Å; V183-A322 VanDerWaalsContact CG1-O 3.23Å; V183-A322 WeakPolarHBondContact CG1-O 3.22Å; V183-V325 HydrophobicContact CB-CG1 4.39Å; V183-V325 HydrophobicContact CG1-CB 4Å; V183-V325 HydrophobicContact CG1-CG1 3.85Å; V183-V325 HydrophobicContact CG2-CG1 3.74Å; V183-L326 HydrophobicContact CG1-CB 4.11Å; V183-L329 HydrophobicContact CB-CD1 4.31Å; V183-L329 HydrophobicContact CG2-CD1 4.01Å
184	R	98.7	Very high	98.4	Very high	60 Å²	60	26.2 Å²	26.2	23%	0.226	12%	0.121	C	C	.	.	H	α-helix	trans	-56.8	-43.3	174.4	-176	-168.9	68.8	103	13.5	112.3	D106 Y180 D181 V182 A188 R212 L326	D106-R184 IonicContact OD2-CZ 2.73Å; D106-R184 IonicContact OD2-NH1 3.05Å; D106-R184 IonicContact OD2-NH2 3.35Å; D106-R184 PolarHBondContact OD2-NH2 3.16Å; D106-R184 VanDerWaalsContact OD2-NH2 3.15Å; Y180-R184 VanDerWaalsContact O-CB 3.31Å; Y180-R184 WeakPolarHBondContact O-CB 2.81Å; Y180-R184 PolarHBondContact O-N 2.79Å; D181-R184 PolarHBondContact O-N 3.28Å; D181-R184 IonicContact OD1-CZ 3.58Å; D181-R184 IonicContact OD1-NE 3.17Å; D181-R184 PolarHBondContact OD1-NE 3.08Å; D181-R184 IonicContact OD1-NH2 2.76Å; D181-R184 PolarHBondContact OD1-NH2 3.47Å; D181-R184 IonicContact OD2-NH2 3.93Å; V182-R184 VanDerWaalsContact C-N 3.33Å; V182-R184 PolarHBondContact O-N 3.49Å; R184-A188 PolarHBondContact O-N 3.16Å; R184-R212 VanDerWaalsContact CZ-CZ 3.42Å; R184-R212 VanDerWaalsContact CZ-NH1 3.28Å; R184-R212 VanDerWaalsContact NH1-NH2 3.15Å; R184-L326 HydrophobicContact CB-CD1 3.9Å; R184-L326 HydrophobicContact CG-CD1 4.26Å
185	V	98.8	Very high	98.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.8	-47	176.6	177	0	0	0	0	110.5	G107 V108 D181 V182 V183 E187 A188 L189 I215	G107-V185 WeakPolarHBondContact O-CG1 3.24Å; V108-V185 HydrophobicContact CG2-CG1 3.68Å; D181-V185 WeakPolarHBondContact O-CG2 3.48Å; D181-V185 PolarHBondContact O-N 3.43Å; V182-V185 PolarHBondContact O-N 2.83Å; V183-V185 VanDerWaalsContact C-N 3.32Å; V183-V185 PolarHBondContact O-N 3.47Å; V185-E187 VanDerWaalsContact C-N 3.31Å; V185-E187 PolarHBondContact O-N 3.28Å; V185-A188 WeakPolarHBondContact O-CB 3.03Å; V185-A188 PolarHBondContact O-N 3.17Å; V185-A188 VanDerWaalsContact O-N 3.14Å; V185-L189 WeakPolarHBondContact O-CG 2.99Å; V185-L189 PolarHBondContact O-N 2.7Å; V185-I215 HydrophobicContact CB-CD1 3.97Å; V185-I215 HydrophobicContact CB-CG1 4.49Å; V185-I215 HydrophobicContact CG1-CB 4.49Å; V185-I215 HydrophobicContact CG1-CD1 3.61Å; V185-I215 HydrophobicContact CG1-CG1 4Å
186	V	98.8	Very high	98.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.1	-37.9	-179.6	174.9	0	0	0	0	111.8	V182 V183 A188 L189 H190 L199 I215 M258 L261	V182-V186 WeakPolarHBondContact O-CG2 3.35Å; V182-V186 PolarHBondContact O-N 3.02Å; V183-V186 PolarHBondContact O-N 2.79Å; V186-A188 VanDerWaalsContact C-N 3.32Å; V186-A188 PolarHBondContact O-N 3.48Å; V186-L189 WeakPolarHBondContact O-CB 3.46Å; V186-L189 PolarHBondContact O-N 3.11Å; V186-L189 VanDerWaalsContact O-N 3.16Å; V186-H190 WeakPolarHBondContact O-CB 3.43Å; V186-H190 PolarHBondContact O-CD2 2.85Å; V186-H190 PolarHBondContact O-N 2.86Å; V186-L199 HydrophobicContact CG1-CD1 4.25Å; V186-L199 HydrophobicContact CG2-CD1 3.91Å; V186-L199 HydrophobicContact CG2-CD2 4.18Å; V186-I215 HydrophobicContact CG2-CD1 3.71Å; V186-M258 HydrophobicContact CG1-SD 4.49Å; V186-L261 HydrophobicContact CB-CD1 4.18Å; V186-L261 HydrophobicContact CG1-CD1 4.07Å; V186-L261 HydrophobicContact CG2-CD1 4.13Å; V186-L261 HydrophobicContact CG2-CD2 4.45Å
187	E	98.7	Very high	98.4	Very high	37 Å²	37	25.6 Å²	25.6	17%	0.173	12%	0.117	C	C	.	.	H	α-helix	trans	-59.3	-43.3	174	-164.6	-83.1	164.3	0	0	111.4	V183 V185 L189 H190 K191 A322	V183-E187 WeakPolarHBondContact O-CB 3.11Å; V183-E187 PolarHBondContact O-N 3Å; V185-E187 VanDerWaalsContact C-N 3.31Å; V185-E187 PolarHBondContact O-N 3.28Å; E187-L189 VanDerWaalsContact C-N 3.35Å; E187-L189 PolarHBondContact O-N 3.43Å; E187-H190 PolarHBondContact O-N 3.22Å; E187-K191 PolarHBondContact O-N 2.93Å; E187-K191 WeakPolarHBondContact OE1-CD 3.36Å; E187-K191 WeakPolarHBondContact OE1-CE 3.31Å; E187-K191 IonicContact OE1-NZ 2.63Å; E187-K191 PolarHBondContact OE1-NZ 3.26Å; E187-K191 WeakPolarHBondContact OE2-CD 3.47Å; E187-K191 IonicContact OE2-NZ 2.92Å; E187-K191 PolarHBondContact OE2-NZ 3.5Å; E187-A322 HydrophobicContact CB-CB 3.75Å; E187-A322 HydrophobicContact CG-CB 3.95Å
188	A	98.6	Very high	98.3	Very high	15 Å²	15	23.8 Å²	23.8	12%	0.124	11%	0.106	C	C	.	.	H	α-helix	trans	-66.2	-34.8	175.3	0	0	0	0	0	112.9	Q105 R184 V185 V186 K192	Q105-A188 VanDerWaalsContact NE2-CB 3.3Å; R184-A188 PolarHBondContact O-N 3.16Å; V185-A188 WeakPolarHBondContact O-CB 3.03Å; V185-A188 PolarHBondContact O-N 3.17Å; V185-A188 VanDerWaalsContact O-N 3.14Å; V186-A188 VanDerWaalsContact C-N 3.32Å; V186-A188 PolarHBondContact O-N 3.48Å; A188-K192 PolarHBondContact O-N 3.3Å
189	L	98.6	Very high	98.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65	-47.4	171.4	-61.6	179	0	0	0	110.8	L102 V108 V185 V186 E187 K191 K192 N193 I194 F218	L102-L189 HydrophobicContact CD1-CD2 3.64Å; L102-L189 HydrophobicContact CD2-CD2 3.64Å; L102-L189 HydrophobicContact CG-CD2 4.32Å; V108-L189 HydrophobicContact CG2-CD2 4.11Å; V185-L189 WeakPolarHBondContact O-CG 2.99Å; V185-L189 PolarHBondContact O-N 2.7Å; V186-L189 WeakPolarHBondContact O-CB 3.46Å; V186-L189 PolarHBondContact O-N 3.11Å; V186-L189 VanDerWaalsContact O-N 3.16Å; E187-L189 VanDerWaalsContact C-N 3.35Å; E187-L189 PolarHBondContact O-N 3.43Å; L189-K191 PolarHBondContact O-N 2.79Å; L189-K192 CarbonylContact O-C 3.58Å; L189-K192 WeakPolarHBondContact O-CA 3.44Å; L189-K192 PolarHBondContact O-N 3.25Å; L189-N193 PolarHBondContact O-N 3.37Å; L189-I194 CarbonylContact C-O 3.35Å; L189-I194 HydrophobicContact CB-CB 4.35Å; L189-I194 HydrophobicContact CB-CG2 4.49Å; L189-I194 HydrophobicContact CD2-CG2 4.43Å; L189-I194 PolarHBondContact O-N 3.38Å; L189-F218 HydrophobicContact CD1-CE1 3.79Å; L189-F218 HydrophobicContact CD1-CZ 3.99Å; L189-F218 HydrophobicContact CD2-CE1 4.01Å; L189-F218 HydrophobicContact CD2-CZ 4.3Å
190	H	98.4	Very high	98.2	Very high	14 Å²	14	25.9 Å²	25.9	7%	0.065	12%	0.115	C	C	.	.	H	α-helix	trans	-63.9	-39.2	-179.2	-75.7	-169.5	0	0	0	111.6	V186 E187 K192 N193 I194 K254 D257	V186-H190 WeakPolarHBondContact O-CB 3.43Å; V186-H190 PolarHBondContact O-CD2 2.85Å; V186-H190 PolarHBondContact O-N 2.86Å; E187-H190 PolarHBondContact O-N 3.22Å; H190-K192 PolarHBondContact O-N 3.31Å; H190-N193 PolarHBondContact O-N 3.5Å; H190-I194 PolarHBondContact CD2-O 2.91Å; H190-K254 HydrophobicContact CB-CD 4.04Å; H190-K254 HydrophobicContact CB-CG 4.49Å; H190-K254 PolarHBondContact CE1-O 3.04Å; H190-K254 WeakPolarHBondContact O-CE 3.49Å; H190-K254 PolarHBondContact O-NZ 2.83Å; H190-D257 IonicContact CD2-OD2 3.39Å; H190-D257 IonicContact NE2-OD2 2.79Å; H190-D257 PolarHBondContact NE2-OD2 3.01Å; H190-D257 VanDerWaalsContact NE2-OD2 3.08Å
191	K	97.6	Very high	98.2	Very high	148 Å²	148	22.5 Å²	22.5	64%	0.643	10%	0.102	S	C	*	.	H	α-helix	trans	-58.3	-28.7	171.8	-84.5	178	166.5	143.6	0	113.7	E187 L189 N193	E187-K191 PolarHBondContact O-N 2.93Å; E187-K191 WeakPolarHBondContact OE1-CD 3.36Å; E187-K191 WeakPolarHBondContact OE1-CE 3.31Å; E187-K191 IonicContact OE1-NZ 2.63Å; E187-K191 PolarHBondContact OE1-NZ 3.26Å; E187-K191 WeakPolarHBondContact OE2-CD 3.47Å; E187-K191 IonicContact OE2-NZ 2.92Å; E187-K191 PolarHBondContact OE2-NZ 3.5Å; L189-K191 PolarHBondContact O-N 2.79Å; K191-N193 VanDerWaalsContact C-N 3.32Å
192	K	97.6	Very high	98.1	Very high	80 Å²	80	23 Å²	23	35%	0.348	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	12.1	175.5	-67.8	174	175.6	172.3	0	112.8	L102 A188 L189 H190 I194 H223	L102-K192 HydrophobicContact CD2-CD 4.01Å; A188-K192 PolarHBondContact O-N 3.3Å; L189-K192 CarbonylContact O-C 3.58Å; L189-K192 WeakPolarHBondContact O-CA 3.44Å; L189-K192 PolarHBondContact O-N 3.25Å; H190-K192 PolarHBondContact O-N 3.31Å; K192-I194 HydrophobicContact CB-CD1 4.18Å; K192-I194 HydrophobicContact CB-CG1 4.42Å; K192-I194 PolarHBondContact O-N 2.95Å; K192-H223 PolarHBondContact O-CD2 3.3Å; K192-H223 PolarHBondContact O-NE2 2.74Å
193	N	98.1	Very high	98	Very high	30 Å²	30	23.3 Å²	23.3	16%	0.16	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	29.5	-175.9	-84.8	-48.8	0	0	0	114.3	L189 H190 K191 L224 E227 K254	L189-N193 PolarHBondContact O-N 3.37Å; H190-N193 PolarHBondContact O-N 3.5Å; K191-N193 VanDerWaalsContact C-N 3.32Å; N193-L224 HydrophobicContact CB-CB 4.11Å; N193-L224 WeakPolarHBondContact O-CB 3.24Å; N193-L224 WeakPolarHBondContact O-CG 3.5Å; N193-L224 PolarHBondContact O-N 3.19Å; N193-E227 VanDerWaalsContact CG-OE1 3.24Å; N193-E227 PolarHBondContact ND2-OE1 2.77Å; N193-E227 VanDerWaalsContact OD1-CD 3.23Å; N193-E227 PolarHBondContact OD1-OE1 3.24Å; N193-K254 WeakPolarHBondContact OD1-CE 3.3Å; N193-K254 PolarHBondContact OD1-NZ 2.87Å
194	I	98.4	Very high	98	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.2	175	-66.4	167.1	0	0	0	108.7	L98 L101 L102 L189 H190 K192 H223	L98-I194 HydrophobicContact CD2-CG1 4.29Å; L98-I194 HydrophobicContact CD2-CG2 4.21Å; L101-I194 HydrophobicContact CB-CD1 4.25Å; L101-I194 HydrophobicContact CD1-CD1 4.4Å; L102-I194 HydrophobicContact CD1-CD1 4.13Å; L102-I194 HydrophobicContact CD2-CD1 3.76Å; L102-I194 HydrophobicContact CG-CD1 3.95Å; L189-I194 CarbonylContact C-O 3.35Å; L189-I194 HydrophobicContact CB-CB 4.35Å; L189-I194 HydrophobicContact CB-CG2 4.49Å; L189-I194 HydrophobicContact CD2-CG2 4.43Å; L189-I194 PolarHBondContact O-N 3.38Å; H190-I194 PolarHBondContact CD2-O 2.91Å; K192-I194 HydrophobicContact CB-CD1 4.18Å; K192-I194 HydrophobicContact CB-CG1 4.42Å; K192-I194 PolarHBondContact O-N 2.95Å; I194-H223 HydrophobicContact CG1-CB 4.49Å
195	V	98.3	Very high	98	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.3	172.1	-68.6	0	0	0	0	109.6	R197 G221 K222 L224 L231 K254 D257	V195-R197 HydrophobicContact CB-CG 4.07Å; V195-R197 HydrophobicContact CG2-CG 3.78Å; V195-G221 CarbonylContact O-C 3.59Å; V195-G221 WeakPolarHBondContact O-CA 3.28Å; V195-K222 HydrophobicContact CG2-CB 4.11Å; V195-K222 WeakPolarHBondContact CG2-O 3.23Å; V195-K222 PolarHBondContact N-O 3.47Å; V195-K222 PolarHBondContact O-N 2.91Å; V195-L224 HydrophobicContact CG1-CD1 3.86Å; V195-L224 HydrophobicContact CG1-CG 4.42Å; V195-L224 HydrophobicContact CG2-CD1 4.44Å; V195-L224 HydrophobicContact CG2-CD2 3.99Å; V195-L224 HydrophobicContact CG2-CG 4.21Å; V195-L231 HydrophobicContact CG2-CD1 4.2Å; V195-K254 HydrophobicContact CG1-CB 4.43Å; V195-K254 HydrophobicContact CG1-CG 3.65Å; V195-D257 WeakPolarHBondContact CA-OD2 3.46Å
196	H	98.3	Very high	98	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.101	C	C	.	.			trans	-86.8	-39.8	-175	-173.1	-57.6	0	0	0	112	D198 L199 I215 T216 N217 F218 G221 D257	H196-D198 PolarHBondContact ND1-N 2.73Å; H196-D198 PolarHBondContact O-N 3.13Å; H196-D198 VanDerWaalsContact O-N 3.09Å; H196-L199 HydrophobicContact CB-CD2 3.74Å; H196-L199 HydrophobicContact CB-CG 3.9Å; H196-I215 VanDerWaalsContact CD2-CG2 3.46Å; H196-I215 WeakPolarHBondContact CD2-CG2 3.43Å; H196-T216 PolarHBondContact NE2-O 2.87Å; H196-N217 PolarHBondContact CE1-O 2.8Å; H196-F218 AromaticContact CD2-CE1 3.86Å; H196-F218 AromaticContact CD2-CZ 3.92Å; H196-G221 WeakPolarHBondContact O-CA 3.47Å; H196-G221 PolarHBondContact O-N 3.25Å; H196-D257 PolarHBondContact N-OD2 2.7Å
197	R	96.9	Very high	97.9	Very high	24 Å²	24	22.5 Å²	22.5	9%	0.091	11%	0.11	C	C	.	.	S	Bend	trans	66	6.7	173.2	-48.1	176.4	57.2	-151.7	-5.8	116.3	V195 L220 L231 D233 Y251 D257	V195-R197 HydrophobicContact CB-CG 4.07Å; V195-R197 HydrophobicContact CG2-CG 3.78Å; R197-L220 WeakPolarHBondContact CD-O 3.45Å; R197-L220 PolarHBondContact NH1-O 3.14Å; R197-L231 HydrophobicContact CG-CD1 4.46Å; R197-D233 IonicContact CZ-OD1 2.81Å; R197-D233 IonicContact CZ-OD2 3.89Å; R197-D233 IonicContact NH1-OD1 3.54Å; R197-D233 PolarHBondContact NH1-OD1 2.95Å; R197-D233 IonicContact NH1-OD2 2.91Å; R197-D233 PolarHBondContact NH1-OD2 2.92Å; R197-D233 PolarHBondContact NH2-O 3.24Å; R197-D233 VanDerWaalsContact NH2-O 3.15Å; R197-D233 IonicContact NH2-OD1 3.74Å; R197-D233 PolarHBondContact NH2-OD1 2.98Å; R197-D233 VanDerWaalsContact NH2-OD1 3.12Å; R197-D233 IonicContact NH2-OD2 2.75Å; R197-D233 PolarHBondContact NH2-OD2 3.19Å; R197-Y251 PolarHBondContact NH2-OH 3.45Å; R197-D257 WeakPolarHBondContact CA-OD1 3.47Å; R197-D257 PolarHBondContact N-OD1 3.05Å
198	D	96.9	Very high	97.8	Very high	17 Å²	17	25.1 Å²	25.1	9%	0.091	12%	0.12	C	C	.	.			trans	-151.4	45.5	173.3	-166.3	43.8	0	0	0	110.1	H196 K200 N203 L220 S237	H196-D198 PolarHBondContact ND1-N 2.73Å; H196-D198 PolarHBondContact O-N 3.13Å; H196-D198 VanDerWaalsContact O-N 3.09Å; D198-K200 PolarHBondContact O-N 3.42Å; D198-K200 IonicContact OD1-NZ 3.3Å; D198-K200 VanDerWaalsContact OD2-CE 3.25Å; D198-K200 WeakPolarHBondContact OD2-CE 3.45Å; D198-K200 IonicContact OD2-NZ 3.69Å; D198-K200 PolarHBondContact OD2-NZ 3.5Å; D198-N203 PolarHBondContact O-ND2 3.05Å; D198-N203 PolarHBondContact OD2-ND2 2.99Å; D198-L220 HydrophobicContact CB-CB 4.49Å; D198-L220 HydrophobicContact CB-CD1 4Å; D198-S237 WeakPolarHBondContact OD1-CB 3.45Å; D198-S237 PolarHBondContact OD1-N 3.15Å; D198-S237 PolarHBondContact OD1-OG 3.07Å
199	L	98.5	Very high	97.6	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	15%	0.146	C	C	.	.			trans	-69.4	121.9	174.1	-66.5	173.4	0	0	0	109.2	V186 H196 M204 I215 D257 A260 L261	V186-L199 HydrophobicContact CG1-CD1 4.25Å; V186-L199 HydrophobicContact CG2-CD1 3.91Å; V186-L199 HydrophobicContact CG2-CD2 4.18Å; H196-L199 HydrophobicContact CB-CD2 3.74Å; H196-L199 HydrophobicContact CB-CG 3.9Å; L199-M204 HydrophobicContact CB-CE 4.43Å; L199-M204 HydrophobicContact CD2-CE 4.38Å; L199-I215 HydrophobicContact CD2-CD1 4.29Å; L199-I215 HydrophobicContact CD2-CG2 4.32Å; L199-D257 HydrophobicContact CD1-CB 3.68Å; L199-A260 HydrophobicContact CB-CB 4Å; L199-L261 HydrophobicContact CB-CD2 4.44Å; L199-L261 HydrophobicContact CD1-CD2 3.92Å; L199-L261 HydrophobicContact CD1-CG 4Å
200	K	97.4	Very high	97.4	Very high	42 Å²	42	35.5 Å²	35.5	18%	0.183	16%	0.163	C	C	.	.			trans	-157	161.1	177.1	58	177.8	164.7	-164	0	109.6	D198 G202 N203 M204 S237 Y240	D198-K200 PolarHBondContact O-N 3.42Å; D198-K200 IonicContact OD1-NZ 3.3Å; D198-K200 VanDerWaalsContact OD2-CE 3.25Å; D198-K200 WeakPolarHBondContact OD2-CE 3.45Å; D198-K200 IonicContact OD2-NZ 3.69Å; D198-K200 PolarHBondContact OD2-NZ 3.5Å; K200-G202 PolarHBondContact O-N 3.03Å; K200-G202 VanDerWaalsContact O-N 3.16Å; K200-N203 VanDerWaalsContact CE-CG 3.46Å; K200-N203 WeakPolarHBondContact CE-ND2 3.46Å; K200-N203 WeakPolarHBondContact CE-OD1 3.38Å; K200-N203 HydrophobicContact CG-CB 3.98Å; K200-N203 PolarHBondContact O-N 3.27Å; K200-M204 WeakPolarHBondContact O-CG 3.42Å; K200-S237 WeakPolarHBondContact CD-OG 3.44Å; K200-S237 PolarHBondContact NZ-OG 3.49Å; K200-Y240 HydrophobicContact CB-CD1 4.09Å; K200-Y240 HydrophobicContact CB-CD2 3.66Å; K200-Y240 HydrophobicContact CB-CE1 3.92Å; K200-Y240 HydrophobicContact CB-CE2 3.43Å; K200-Y240 VanDerWaalsContact CB-CE2 3.43Å; K200-Y240 HydrophobicContact CB-CG 3.97Å
201	L	97.6	Very high	97.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-53.6	-38.1	175.9	-60.6	171.6	0	0	0	111.7	L160 Q161 V164 N203 M204 V264 T267 M268	L160-L201 HydrophobicContact CD2-CD2 3.58Å; L160-L201 HydrophobicContact CG-CD2 3.82Å; Q161-L201 HydrophobicContact CB-CB 3.77Å; Q161-L201 HydrophobicContact CG-CB 4.34Å; Q161-L201 PolarHBondContact N-O 3.3Å; V164-L201 HydrophobicContact CG2-CD1 4.37Å; L201-N203 PolarHBondContact O-N 2.96Å; L201-M204 PolarHBondContact O-N 3.24Å; L201-M204 VanDerWaalsContact O-N 3.14Å; L201-V264 HydrophobicContact CD2-CB 4.46Å; L201-V264 HydrophobicContact CD2-CG1 3.81Å; L201-V264 HydrophobicContact CD2-CG2 4.41Å; L201-T267 HydrophobicContact CD1-CG2 3.6Å; L201-M268 HydrophobicContact CD2-CG 3.77Å; L201-M268 HydrophobicContact CD2-SD 4.18Å
202	G	95.9	Very high	97.2	Very high	13 Å²	13	35.1 Å²	35.1	13%	0.134	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-66.3	-17.9	179.7	0	0	0	0	0	115	N159 K200	N159-G202 PolarHBondContact ND2-O 2.93Å; K200-G202 PolarHBondContact O-N 3.03Å; K200-G202 VanDerWaalsContact O-N 3.16Å
203	N	97.6	Very high	97.3	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.043	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-101	11.1	177.1	-75	-13	0	0	0	112.2	D198 K200 L201 T216 N217	D198-N203 PolarHBondContact O-ND2 3.05Å; D198-N203 PolarHBondContact OD2-ND2 2.99Å; K200-N203 VanDerWaalsContact CE-CG 3.46Å; K200-N203 WeakPolarHBondContact CE-ND2 3.46Å; K200-N203 WeakPolarHBondContact CE-OD1 3.38Å; K200-N203 HydrophobicContact CG-CB 3.98Å; K200-N203 PolarHBondContact O-N 3.27Å; L201-N203 PolarHBondContact O-N 2.96Å; N203-T216 PolarHBondContact O-N 3.19Å; N203-T216 PolarHBondContact O-OG1 3.47Å; N203-N217 PolarHBondContact OD1-ND2 3.19Å
204	M	98.5	Very high	97.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.5	-179.8	-61.4	171.9	-174.7	0	0	109.9	L160 V182 L199 K200 L201 I213 L261 V264	L160-M204 HydrophobicContact CB-CB 3.99Å; L160-M204 WeakPolarHBondContact CB-O 3.46Å; L160-M204 HydrophobicContact CD2-CB 4.04Å; L160-M204 HydrophobicContact CD2-SD 3.91Å; L160-M204 PolarHBondContact N-O 3.34Å; V182-M204 HydrophobicContact CG1-CE 3.6Å; V182-M204 HydrophobicContact CG1-SD 3.99Å; V182-M204 HydrophobicContact CG2-SD 3.9Å; L199-M204 HydrophobicContact CB-CE 4.43Å; L199-M204 HydrophobicContact CD2-CE 4.38Å; K200-M204 WeakPolarHBondContact O-CG 3.42Å; L201-M204 PolarHBondContact O-N 3.24Å; L201-M204 VanDerWaalsContact O-N 3.14Å; M204-I213 HydrophobicContact CB-CD1 4.42Å; M204-I213 HydrophobicContact CB-CG2 4.06Å; M204-I213 HydrophobicContact CG-CG2 4.34Å; M204-L261 HydrophobicContact CE-CD2 4.08Å; M204-V264 HydrophobicContact CE-CG1 4.43Å; M204-V264 HydrophobicContact CE-CG2 4.09Å; M204-V264 HydrophobicContact SD-CG1 4.32Å
205	V	98.5	Very high	97.3	Very high	9 Å²	9	31.3 Å²	31.3	6%	0.055	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.4	175.7	179.9	0	0	0	0	108.9	L145 L157 I158 I213 T214 T216	L145-V205 HydrophobicContact CB-CB 4.45Å; L145-V205 HydrophobicContact CB-CG1 4.29Å; L145-V205 HydrophobicContact CB-CG2 4Å; L145-V205 WeakPolarHBondContact O-CG1 3.13Å; L157-V205 HydrophobicContact CB-CG1 3.85Å; L157-V205 HydrophobicContact CD1-CG1 4.37Å; L157-V205 HydrophobicContact CD2-CG1 4.34Å; L157-V205 HydrophobicContact CG-CG1 4.41Å; I158-V205 CarbonylContact O-C 3.55Å; V205-I213 CarbonylContact O-C 3.59Å; V205-I213 VanDerWaalsContact O-CA 3.31Å; V205-I213 WeakPolarHBondContact O-CA 3.41Å; V205-T214 PolarHBondContact N-O 3.13Å; V205-T214 PolarHBondContact O-N 3.05Å; V205-T216 HydrophobicContact CG2-CG2 4Å
206	L	98.5	Very high	97.3	Very high	1 Å²	1	32 Å²	32	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.8	177.8	175.8	66.4	0	0	0	110.3	L157 I158 L160 Y163 I178 I213	L157-L206 CarbonylContact C-O 3.52Å; L157-L206 WeakPolarHBondContact CA-O 3.39Å; I158-L206 HydrophobicContact CG2-CB 4.06Å; I158-L206 HydrophobicContact CG2-CD2 4.29Å; I158-L206 HydrophobicContact CG2-CG 4.42Å; I158-L206 PolarHBondContact N-O 2.95Å; I158-L206 PolarHBondContact O-N 2.97Å; L160-L206 HydrophobicContact CD1-CB 4.3Å; L160-L206 HydrophobicContact CD1-CD2 4.13Å; Y163-L206 HydrophobicContact CD1-CD2 3.45Å; Y163-L206 VanDerWaalsContact CD1-CD2 3.45Å; Y163-L206 HydrophobicContact CD2-CD2 4.36Å; Y163-L206 HydrophobicContact CE1-CD2 3.64Å; Y163-L206 HydrophobicContact CG-CD2 3.84Å; I178-L206 HydrophobicContact CD1-CD1 3.91Å; I178-L206 HydrophobicContact CD1-CD2 3.93Å; I178-L206 HydrophobicContact CG1-CD1 3.95Å; I178-L206 HydrophobicContact CG2-CD1 4.3Å; L206-I213 HydrophobicContact CB-CD1 3.86Å; L206-I213 HydrophobicContact CD1-CD1 3.93Å; L206-I213 HydrophobicContact CD1-CG1 4.49Å
207	N	97.9	Very high	97.2	Very high	33 Å²	33	33.6 Å²	33.6	18%	0.176	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	110.3	161.1	-175	-50.3	0	0	0	109.1	L157 R209 T210 H211 R212	L157-N207 HydrophobicContact CD2-CB 3.83Å; N207-R209 PolarHBondContact O-N 3.09Å; N207-R209 WeakPolarHBondContact OD1-CB 3.4Å; N207-R209 PolarHBondContact OD1-N 2.98Å; N207-T210 WeakPolarHBondContact CB-OG1 3.33Å; N207-T210 VanDerWaalsContact CG-OG1 3.29Å; N207-T210 PolarHBondContact O-N 3.16Å; N207-T210 PolarHBondContact OD1-N 2.97Å; N207-T210 VanDerWaalsContact OD1-N 3.1Å; N207-T210 PolarHBondContact OD1-OG1 3Å; N207-H211 WeakPolarHBondContact O-CA 3.46Å; N207-H211 PolarHBondContact O-N 3.26Å; N207-R212 PolarHBondContact N-O 3.1Å
208	K	95.2	Very high	97.2	Very high	91 Å²	91	32.5 Å²	32.5	40%	0.396	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-29.7	-176.1	-67.4	173.5	-68.7	178.1	0	113.3	A155 D156 I158 H211	A155-K208 PolarHBondContact O-NZ 2.87Å; D156-K208 WeakPolarHBondContact O-CE 3.46Å; D156-K208 WeakPolarHBondContact O-CG 3.37Å; D156-K208 PolarHBondContact O-N 3.44Å; I158-K208 HydrophobicContact CG2-CD 4.17Å; I158-K208 HydrophobicContact CG2-CG 3.72Å; K208-H211 PolarHBondContact O-CD2 2.99Å; K208-H211 VanDerWaalsContact O-CD2 3.29Å
209	R	94.3	Very high	97.1	Very high	174 Å²	174	32.3 Å²	32.3	66%	0.657	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-37.5	-176.1	-172.6	-177.5	60.4	75.2	2	112.1	D156 N207	D156-R209 IonicContact OD2-NE 3.68Å; N207-R209 PolarHBondContact O-N 3.09Å; N207-R209 WeakPolarHBondContact OD1-CB 3.4Å; N207-R209 PolarHBondContact OD1-N 2.98Å
210	T	95.5	Very high	97	Very high	59 Å²	59	33.7 Å²	33.7	36%	0.362	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-10.1	-174.9	68.1	0	0	0	0	113.7	N207 R212	N207-T210 WeakPolarHBondContact CB-OG1 3.33Å; N207-T210 VanDerWaalsContact CG-OG1 3.29Å; N207-T210 PolarHBondContact O-N 3.16Å; N207-T210 PolarHBondContact OD1-N 2.97Å; N207-T210 VanDerWaalsContact OD1-N 3.1Å; N207-T210 PolarHBondContact OD1-OG1 3Å; T210-R212 PolarHBondContact O-N 3.44Å; T210-R212 WeakPolarHBondContact OG1-CB 3.49Å; T210-R212 WeakPolarHBondContact OG1-CG 3.21Å; T210-R212 PolarHBondContact OG1-N 2.63Å
211	H	94.4	Very high	96.9	Very high	64 Å²	64	32 Å²	32	30%	0.296	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	25.5	-173.1	-65.7	-148.4	0	0	0	113.1	V177 I178 N207 K208	V177-H211 HydrophobicContact CG1-CB 4.16Å; I178-H211 HydrophobicContact CG1-CB 4.33Å; N207-H211 WeakPolarHBondContact O-CA 3.46Å; N207-H211 PolarHBondContact O-N 3.26Å; K208-H211 PolarHBondContact O-CD2 2.99Å; K208-H211 VanDerWaalsContact O-CD2 3.29Å
212	R	97.8	Very high	96.9	Very high	90 Å²	90	36.1 Å²	36.1	34%	0.34	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	146.7	178.9	-64.9	-72	-74	-156.8	-22.8	110.5	D106 D181 R184 N207 T210	D106-R212 IonicContact OD2-CZ 3.75Å; D106-R212 IonicContact OD2-NH2 2.69Å; D106-R212 PolarHBondContact OD2-NH2 3.44Å; D181-R212 IonicContact OD1-CZ 3.21Å; D181-R212 IonicContact OD1-NE 2.7Å; D181-R212 PolarHBondContact OD1-NE 3.43Å; D181-R212 IonicContact OD1-NH1 3.84Å; D181-R212 PolarHBondContact OD1-NH1 2.93Å; D181-R212 VanDerWaalsContact OD2-CA 3.24Å; D181-R212 WeakPolarHBondContact OD2-CA 3.28Å; D181-R212 VanDerWaalsContact OD2-CD 3.27Å; D181-R212 WeakPolarHBondContact OD2-CD 3.46Å; D181-R212 IonicContact OD2-CZ 3.79Å; D181-R212 IonicContact OD2-NE 2.88Å; D181-R212 PolarHBondContact OD2-NE 2.73Å; D181-R212 IonicContact OD2-NH1 3.15Å; R184-R212 VanDerWaalsContact CZ-CZ 3.42Å; R184-R212 VanDerWaalsContact CZ-NH1 3.28Å; R184-R212 VanDerWaalsContact NH1-NH2 3.15Å; N207-R212 PolarHBondContact N-O 3.1Å; T210-R212 PolarHBondContact O-N 3.44Å; T210-R212 WeakPolarHBondContact OG1-CB 3.49Å; T210-R212 WeakPolarHBondContact OG1-CG 3.21Å; T210-R212 PolarHBondContact OG1-N 2.63Å
213	I	98.3	Very high	97	Very high	1 Å²	1	40 Å²	40	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.9	-179.5	-68.3	-75.4	0	0	0	110.9	G107 L160 I178 D181 V182 M204 V205 L206 I215	G107-I213 VanDerWaalsContact CA-O 3.25Å; G107-I213 WeakPolarHBondContact CA-O 3.42Å; L160-I213 HydrophobicContact CD1-CD1 4.49Å; L160-I213 HydrophobicContact CD2-CD1 4.07Å; I178-I213 HydrophobicContact CG2-CD1 3.8Å; I178-I213 HydrophobicContact CG2-CG1 3.79Å; D181-I213 PolarHBondContact OD2-N 3.44Å; V182-I213 HydrophobicContact CG2-CB 4.27Å; V182-I213 HydrophobicContact CG2-CG1 3.87Å; V182-I213 HydrophobicContact CG2-CG2 4.13Å; M204-I213 HydrophobicContact CB-CD1 4.42Å; M204-I213 HydrophobicContact CB-CG2 4.06Å; M204-I213 HydrophobicContact CG-CG2 4.34Å; V205-I213 CarbonylContact O-C 3.59Å; V205-I213 VanDerWaalsContact O-CA 3.31Å; V205-I213 WeakPolarHBondContact O-CA 3.41Å; L206-I213 HydrophobicContact CB-CD1 3.86Å; L206-I213 HydrophobicContact CD1-CD1 3.93Å; L206-I213 HydrophobicContact CD1-CG1 4.49Å; I213-I215 HydrophobicContact CG2-CG1 4.22Å
214	T	98.8	Very high	96.9	Very high	31 Å²	31	39.9 Å²	39.9	19%	0.19	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.8	163	-54.8	0	0	0	0	109.8	G107 L145 V205	G107-T214 CarbonylContact O-C 3.55Å; G107-T214 WeakPolarHBondContact O-CA 3.05Å; L145-T214 HydrophobicContact CD1-CG2 3.55Å; L145-T214 HydrophobicContact CD2-CG2 4.25Å; V205-T214 PolarHBondContact N-O 3.13Å; V205-T214 PolarHBondContact O-N 3.05Å
215	I	98.8	Very high	96.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	139.7	176	-59	-175.1	0	0	0	109.7	G107 V109 V185 V186 H196 L199 I213 F218	G107-I215 PolarHBondContact O-N 2.56Å; V109-I215 PolarHBondContact N-O 2.86Å; V185-I215 HydrophobicContact CB-CD1 3.97Å; V185-I215 HydrophobicContact CB-CG1 4.49Å; V185-I215 HydrophobicContact CG1-CB 4.49Å; V185-I215 HydrophobicContact CG1-CD1 3.61Å; V185-I215 HydrophobicContact CG1-CG1 4Å; V186-I215 HydrophobicContact CG2-CD1 3.71Å; H196-I215 VanDerWaalsContact CD2-CG2 3.46Å; H196-I215 WeakPolarHBondContact CD2-CG2 3.43Å; L199-I215 HydrophobicContact CD2-CD1 4.29Å; L199-I215 HydrophobicContact CD2-CG2 4.32Å; I213-I215 HydrophobicContact CG2-CG1 4.22Å; I215-F218 HydrophobicContact CB-CE2 4.46Å; I215-F218 HydrophobicContact CB-CZ 4.42Å; I215-F218 HydrophobicContact CG2-CE2 3.99Å; I215-F218 HydrophobicContact CG2-CZ 3.97Å
216	T	98	Very high	96.4	Very high	14 Å²	14	48.5 Å²	48.5	9%	0.086	24%	0.241	C	C	.	.			trans	-133.5	169.2	-173.1	67.2	0	0	0	0	111.7	V109 L145 H196 N203 V205	V109-T216 HydrophobicContact CB-CG2 4.21Å; V109-T216 HydrophobicContact CG1-CG2 4.45Å; L145-T216 HydrophobicContact CD1-CG2 3.5Å; L145-T216 VanDerWaalsContact CD1-CG2 3.5Å; H196-T216 PolarHBondContact NE2-O 2.87Å; N203-T216 PolarHBondContact O-N 3.19Å; N203-T216 PolarHBondContact O-OG1 3.47Å; V205-T216 HydrophobicContact CG2-CG2 4Å
217	N	95.7	Very high	95.9	Very high	34 Å²	34	53.1 Å²	53.1	18%	0.182	26%	0.262	C	S	.	.			trans	65.3	61.3	174.4	-62.5	-50.2	0	0	0	115.2	K68 E95 H196 N203 C219	K68-N217 PolarHBondContact NZ-OD1 3.19Å; E95-N217 WeakPolarHBondContact OE1-CA 3.23Å; H196-N217 PolarHBondContact CE1-O 2.8Å; N203-N217 PolarHBondContact OD1-ND2 3.19Å; N217-C219 PolarHBondContact O-N 3.13Å; N217-C219 VanDerWaalsContact O-N 3.17Å
218	F	97.4	Very high	95.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-78.8	10.5	177.9	-74.1	-103.5	0	0	0	114	E95 L98 L99 L102 V108 V109 L189 H196 I215 L220 G221	E95-F218 HydrophobicContact CG-CB 4.25Å; E95-F218 PolarHBondContact OE1-N 3.42Å; L98-F218 HydrophobicContact CB-CB 4.43Å; L98-F218 HydrophobicContact CD1-CB 4.29Å; L98-F218 WeakPolarHBondContact CD1-O 3.25Å; L99-F218 HydrophobicContact CD2-CB 4.34Å; L99-F218 HydrophobicContact CD2-CD2 3.64Å; L99-F218 HydrophobicContact CD2-CE2 4.07Å; L99-F218 HydrophobicContact CD2-CG 3.94Å; L102-F218 HydrophobicContact CD1-CD1 4.23Å; L102-F218 HydrophobicContact CD1-CE1 3.79Å; L102-F218 HydrophobicContact CD1-CZ 4.24Å; V108-F218 HydrophobicContact CG1-CE2 3.67Å; V108-F218 HydrophobicContact CG1-CZ 3.66Å; V108-F218 HydrophobicContact CG2-CZ 4.2Å; V109-F218 HydrophobicContact CG1-CD2 4.25Å; V109-F218 HydrophobicContact CG1-CE2 4.32Å; L189-F218 HydrophobicContact CD1-CE1 3.79Å; L189-F218 HydrophobicContact CD1-CZ 3.99Å; L189-F218 HydrophobicContact CD2-CE1 4.01Å; L189-F218 HydrophobicContact CD2-CZ 4.3Å; H196-F218 AromaticContact CD2-CE1 3.86Å; H196-F218 AromaticContact CD2-CZ 3.92Å; I215-F218 HydrophobicContact CB-CE2 4.46Å; I215-F218 HydrophobicContact CB-CZ 4.42Å; I215-F218 HydrophobicContact CG2-CE2 3.99Å; I215-F218 HydrophobicContact CG2-CZ 3.97Å; F218-L220 PolarHBondContact O-N 3.15Å; F218-G221 PolarHBondContact O-N 3.47Å
219	C	95.3	Very high	95.3	Very high	14 Å²	14	54.1 Å²	54.1	10%	0.095	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-67	-17.5	-173.2	61.9	0	0	0	0	115	L91 E95 N217	L91-C219 HydrophobicContact CB-CB 4.13Å; L91-C219 HydrophobicContact CD2-CB 4.11Å; L91-C219 WeakPolarHBondContact CD2-O 3.42Å; E95-C219 HydrophobicContact CB-CB 4.13Å; N217-C219 PolarHBondContact O-N 3.13Å; N217-C219 VanDerWaalsContact O-N 3.17Å
220	L	94.8	Very high	95.3	Very high	29 Å²	29	50.4 Å²	50.4	15%	0.152	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-103.2	-4.1	173.9	-60.2	-175.8	0	0	0	113.4	L91 R197 D198 F218	L91-L220 HydrophobicContact CD2-CD2 3.62Å; R197-L220 WeakPolarHBondContact CD-O 3.45Å; R197-L220 PolarHBondContact NH1-O 3.14Å; D198-L220 HydrophobicContact CB-CB 4.49Å; D198-L220 HydrophobicContact CB-CD1 4Å; F218-L220 PolarHBondContact O-N 3.15Å
221	G	96.5	Very high	95.3	Very high	6 Å²	6	47.7 Å²	47.7	6%	0.062	25%	0.248	C	C	.	.			trans	-69.6	175.4	-176.6	0	0	0	0	0	113	T94 L98 V195 H196 F218	T94-G221 VanDerWaalsContact CG2-O 3.23Å; T94-G221 WeakPolarHBondContact CG2-O 3.45Å; L98-G221 VanDerWaalsContact CD1-C 3.49Å; V195-G221 CarbonylContact O-C 3.59Å; V195-G221 WeakPolarHBondContact O-CA 3.28Å; H196-G221 WeakPolarHBondContact O-CA 3.47Å; H196-G221 PolarHBondContact O-N 3.25Å; F218-G221 PolarHBondContact O-N 3.47Å
222	K	97.1	Very high	95.2	Very high	87 Å²	87	52.3 Å²	52.3	38%	0.378	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	142.2	174.8	-168.9	167.8	171.1	-170	0	111.3	V195 L231	V195-K222 HydrophobicContact CG2-CB 4.11Å; V195-K222 WeakPolarHBondContact CG2-O 3.23Å; V195-K222 PolarHBondContact N-O 3.47Å; V195-K222 PolarHBondContact O-N 2.91Å; K222-L231 HydrophobicContact CD-CD2 3.6Å
223	H	97.8	Very high	94.8	Very high	96 Å²	96	50.3 Å²	50.3	44%	0.444	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.6	166.4	-175.6	-153.5	0	0	0	107.6	L98 L101 K192 I194	L98-H223 HydrophobicContact CD2-CB 3.81Å; L101-H223 HydrophobicContact CD1-CB 4.41Å; K192-H223 PolarHBondContact O-CD2 3.3Å; K192-H223 PolarHBondContact O-NE2 2.74Å; I194-H223 HydrophobicContact CG1-CB 4.49Å
224	L	96.8	Very high	94.4	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.021	29%	0.288	C	S	.	.			trans	-81.6	142	178.3	-51.3	177.9	0	0	0	109.1	N193 V195 S226 D229 L231 K254	N193-L224 HydrophobicContact CB-CB 4.11Å; N193-L224 WeakPolarHBondContact O-CB 3.24Å; N193-L224 WeakPolarHBondContact O-CG 3.5Å; N193-L224 PolarHBondContact O-N 3.19Å; V195-L224 HydrophobicContact CG1-CD1 3.86Å; V195-L224 HydrophobicContact CG1-CG 4.42Å; V195-L224 HydrophobicContact CG2-CD1 4.44Å; V195-L224 HydrophobicContact CG2-CD2 3.99Å; V195-L224 HydrophobicContact CG2-CG 4.21Å; L224-S226 WeakPolarHBondContact CB-O 3.48Å; L224-D229 HydrophobicContact CB-CB 4.16Å; L224-D229 HydrophobicContact CD2-CB 4.12Å; L224-L231 HydrophobicContact CD2-CD2 3.97Å; L224-K254 HydrophobicContact CD1-CG 4.5Å
225	V	93.4	Very high	93.9	Very high	139 Å²	139	58.5 Å²	58.5	84%	0.842	30%	0.295	S	S	*	.	S	Bend	trans	-77.7	-35.6	174.6	-177.3	0	0	0	0	110	D229	V225-D229 WeakPolarHBondContact CA-OD2 3.44Å; V225-D229 WeakPolarHBondContact CB-OD2 3.38Å; V225-D229 PolarHBondContact N-OD2 3.37Å
226	S	92.9	Very high	93.4	Very high	52 Å²	52	59.8 Å²	59.8	36%	0.364	31%	0.308	S	S	.	.	S	Bend	trans	-136.1	157.3	176.7	-175	0	0	0	0	111.5	L224 D228 D229	L224-S226 WeakPolarHBondContact CB-O 3.48Å; S226-D228 PolarHBondContact O-N 3.32Å; S226-D228 PolarHBondContact OG-N 3.5Å; S226-D229 WeakPolarHBondContact CB-OD1 3.34Å; S226-D229 PolarHBondContact N-OD1 3.46Å; S226-D229 PolarHBondContact N-OD2 2.99Å; S226-D229 VanDerWaalsContact O-CB 3.31Å; S226-D229 WeakPolarHBondContact O-CB 3.41Å; S226-D229 PolarHBondContact O-N 3.08Å; S226-D229 VanDerWaalsContact O-N 3.13Å
227	E	87.7	Confident	93.1	Very high	97 Å²	97	60.1 Å²	60.1	45%	0.453	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.7	170.8	-68.1	-68.7	147.5	0	0	112.5	N193 D229 K254	N193-E227 VanDerWaalsContact CG-OE1 3.24Å; N193-E227 PolarHBondContact ND2-OE1 2.77Å; N193-E227 VanDerWaalsContact OD1-CD 3.23Å; N193-E227 PolarHBondContact OD1-OE1 3.24Å; E227-D229 VanDerWaalsContact C-N 3.34Å; E227-K254 IonicContact OE1-NZ 3.23Å; E227-K254 PolarHBondContact OE1-NZ 3.48Å; E227-K254 WeakPolarHBondContact OE2-CE 3.27Å; E227-K254 IonicContact OE2-NZ 2.91Å; E227-K254 PolarHBondContact OE2-NZ 2.78Å
228	D	87.7	Confident	93	Very high	101 Å²	101	59.8 Å²	59.8	54%	0.54	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	3.1	-178.3	-72.2	-52.9	0	0	0	114	S226 L230 R252	S226-D228 PolarHBondContact O-N 3.32Å; S226-D228 PolarHBondContact OG-N 3.5Å; D228-L230 PolarHBondContact O-N 2.78Å; D228-R252 IonicContact OD1-CZ 2.75Å; D228-R252 IonicContact OD1-NE 3.17Å; D228-R252 IonicContact OD1-NH2 3.96Å; D228-R252 PolarHBondContact OD1-NH2 3.27Å
229	D	92.2	Very high	92.8	Very high	45 Å²	45	59.9 Å²	59.9	24%	0.241	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-60.9	126.7	-178.5	-83.3	4.7	0	0	0	111.8	L224 V225 S226 E227	L224-D229 HydrophobicContact CB-CB 4.16Å; L224-D229 HydrophobicContact CD2-CB 4.12Å; V225-D229 WeakPolarHBondContact CA-OD2 3.44Å; V225-D229 WeakPolarHBondContact CB-OD2 3.38Å; V225-D229 PolarHBondContact N-OD2 3.37Å; S226-D229 WeakPolarHBondContact CB-OD1 3.34Å; S226-D229 PolarHBondContact N-OD1 3.46Å; S226-D229 PolarHBondContact N-OD2 2.99Å; S226-D229 VanDerWaalsContact O-CB 3.31Å; S226-D229 WeakPolarHBondContact O-CB 3.41Å; S226-D229 PolarHBondContact O-N 3.08Å; S226-D229 VanDerWaalsContact O-N 3.13Å; E227-D229 VanDerWaalsContact C-N 3.34Å
230	L	94.9	Very high	93	Very high	96 Å²	96	60 Å²	60	50%	0.503	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	133.7	176.7	-58.9	176.9	0	0	0	111.3	D228 P250 Y251 R252	D228-L230 PolarHBondContact O-N 2.78Å; L230-P250 HydrophobicContact CB-CB 3.85Å; L230-P250 HydrophobicContact CD1-CB 3.97Å; L230-P250 HydrophobicContact CG-CB 4.47Å; L230-Y251 CarbonylContact C-O 3.54Å; L230-Y251 WeakPolarHBondContact CA-O 3.4Å; L230-R252 HydrophobicContact CD2-CG 3.69Å
231	L	94.3	Very high	93	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	147.2	174.6	-55.5	178.9	0	0	0	109.5	V195 R197 K222 L224 P250 Y251	V195-L231 HydrophobicContact CG2-CD1 4.2Å; R197-L231 HydrophobicContact CG-CD1 4.46Å; K222-L231 HydrophobicContact CD-CD2 3.6Å; L224-L231 HydrophobicContact CD2-CD2 3.97Å; L231-P250 CarbonylContact O-C 3.51Å; L231-P250 WeakPolarHBondContact O-CA 3.22Å; L231-Y251 HydrophobicContact CB-CD1 4.22Å; L231-Y251 HydrophobicContact CB-CD2 4.4Å; L231-Y251 HydrophobicContact CB-CE1 3.69Å; L231-Y251 HydrophobicContact CB-CE2 3.89Å; L231-Y251 VanDerWaalsContact CB-CZ 3.5Å; L231-Y251 HydrophobicContact CD1-CE2 3.89Å; L231-Y251 HydrophobicContact CG-CE2 4.43Å; L231-Y251 PolarHBondContact N-O 3.32Å; L231-Y251 WeakPolarHBondContact O-CD1 3.31Å; L231-Y251 WeakPolarHBondContact O-CE1 3.4Å; L231-Y251 PolarHBondContact O-N 3.48Å
232	K	92.7	Very high	93.1	Very high	162 Å²	162	59.2 Å²	59.2	70%	0.704	31%	0.305	S	S	*	.			trans	-120.1	-19	-178.2	-62.2	-175.8	-178	178.5	0	113	P250	K232-P250 HydrophobicContact CG-CB 4.28Å; K232-P250 HydrophobicContact CG-CG 4.18Å
233	D	90.1	Very high	93.1	Very high	48 Å²	48	55.7 Å²	55.7	26%	0.257	29%	0.291	S	S	.	.			trans	-84.2	137.7	-176.6	61.7	-56.7	0	0	0	111.4	R197 R235 Y251	R197-D233 IonicContact CZ-OD1 2.81Å; R197-D233 IonicContact CZ-OD2 3.89Å; R197-D233 IonicContact NH1-OD1 3.54Å; R197-D233 PolarHBondContact NH1-OD1 2.95Å; R197-D233 IonicContact NH1-OD2 2.91Å; R197-D233 PolarHBondContact NH1-OD2 2.92Å; R197-D233 PolarHBondContact NH2-O 3.24Å; R197-D233 VanDerWaalsContact NH2-O 3.15Å; R197-D233 IonicContact NH2-OD1 3.74Å; R197-D233 PolarHBondContact NH2-OD1 2.98Å; R197-D233 VanDerWaalsContact NH2-OD1 3.12Å; R197-D233 IonicContact NH2-OD2 2.75Å; R197-D233 PolarHBondContact NH2-OD2 3.19Å; D233-R235 VanDerWaalsContact OD2-CD 3.29Å; D233-R235 WeakPolarHBondContact OD2-CD 3.49Å; D233-R235 IonicContact OD2-NE 2.61Å; D233-R235 PolarHBondContact OD2-NE 3.28Å; D233-R235 VanDerWaalsContact OD2-NE 3.15Å; D233-Y251 WeakPolarHBondContact O-CE1 3.17Å; D233-Y251 PolarHBondContact O-OH 3.31Å
234	Q	90.1	Very high	93	Very high	115 Å²	115	52 Å²	52	54%	0.537	27%	0.274	S	S	.	.			trans	-97.2	98.3	-179.3	-60.9	178.7	29.9	0	0	109	V245 G248	Q234-V245 HydrophobicContact CB-CG1 4.02Å; Q234-V245 HydrophobicContact CG-CG1 4.15Å; Q234-V245 WeakPolarHBondContact CG-O 3.4Å; Q234-G248 VanDerWaalsContact NE2-CA 3.28Å
235	R	87.3	Confident	93	Very high	89 Å²	89	51.9 Å²	51.9	34%	0.336	27%	0.274	S	S	.	.			trans	-137.8	157.8	179.9	-56.3	-174.2	-173	-149.5	-1.6	108.9	D233	D233-R235 VanDerWaalsContact OD2-CD 3.29Å; D233-R235 WeakPolarHBondContact OD2-CD 3.49Å; D233-R235 IonicContact OD2-NE 2.61Å; D233-R235 PolarHBondContact OD2-NE 3.28Å; D233-R235 VanDerWaalsContact OD2-NE 3.15Å
236	G	88.9	Confident	93	Very high	26 Å²	26	46.1 Å²	46.1	27%	0.268	24%	0.238	S	C	.	.	S	Bend	trans	127.3	167.2	-180	0	0	0	0	0	112.1
237	S	92.4	Very high	92.9	Very high	21 Å²	21	46.5 Å²	46.5	15%	0.147	24%	0.241	C	C	.	.			trans	-75.1	131.3	-178.3	-61.4	0	0	0	0	111.6	D198 K200 A239 Y240 I241	D198-S237 WeakPolarHBondContact OD1-CB 3.45Å; D198-S237 PolarHBondContact OD1-N 3.15Å; D198-S237 PolarHBondContact OD1-OG 3.07Å; K200-S237 WeakPolarHBondContact CD-OG 3.44Å; K200-S237 PolarHBondContact NZ-OG 3.49Å; S237-A239 VanDerWaalsContact C-N 3.29Å; S237-A239 PolarHBondContact O-N 3.07Å; S237-A239 VanDerWaalsContact O-N 3.1Å; S237-Y240 PolarHBondContact O-N 3.16Å; S237-I241 PolarHBondContact O-N 3.18Å
238	P	93	Very high	93	Very high	27 Å²	27	44 Å²	44	18%	0.175	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-31.9	-170.7	-32	37.8	0	0	0	116.8	Y240 I241 L283 F284 I287	P238-Y240 VanDerWaalsContact C-N 3.33Å; P238-I241 WeakPolarHBondContact O-CG2 3.41Å; P238-L283 HydrophobicContact CB-CD2 4.33Å; P238-F284 HydrophobicContact CB-CE1 4.12Å; P238-F284 HydrophobicContact CB-CZ 4.46Å; P238-I287 WeakPolarHBondContact O-CD1 3.22Å
239	A	93.9	Very high	93.2	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.025	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-16.4	178.7	0	0	0	0	0	113.6	S237 F273	S237-A239 VanDerWaalsContact C-N 3.29Å; S237-A239 PolarHBondContact O-N 3.07Å; S237-A239 VanDerWaalsContact O-N 3.1Å; A239-F273 HydrophobicContact CB-CD1 3.82Å; A239-F273 HydrophobicContact CB-CE1 3.66Å; A239-F273 HydrophobicContact CB-CE2 4.43Å; A239-F273 HydrophobicContact CB-CG 4.28Å; A239-F273 HydrophobicContact CB-CZ 4Å
240	Y	97.6	Very high	93.4	Very high	15 Å²	15	49.3 Å²	49.3	6%	0.059	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-8.4	-175.8	-62.4	-91	0	0	0	112.9	K200 S237 P238 S242 V263 V264 F273	K200-Y240 HydrophobicContact CB-CD1 4.09Å; K200-Y240 HydrophobicContact CB-CD2 3.66Å; K200-Y240 HydrophobicContact CB-CE1 3.92Å; K200-Y240 HydrophobicContact CB-CE2 3.43Å; K200-Y240 VanDerWaalsContact CB-CE2 3.43Å; K200-Y240 HydrophobicContact CB-CG 3.97Å; S237-Y240 PolarHBondContact O-N 3.16Å; P238-Y240 VanDerWaalsContact C-N 3.33Å; Y240-S242 PolarHBondContact O-N 2.89Å; Y240-V263 HydrophobicContact CD1-CB 3.8Å; Y240-V263 HydrophobicContact CD1-CG1 3.48Å; Y240-V263 VanDerWaalsContact CD1-CG1 3.48Å; Y240-V263 HydrophobicContact CE1-CB 4.24Å; Y240-V263 HydrophobicContact CE1-CG1 3.63Å; Y240-V263 HydrophobicContact CG-CG1 4.19Å; Y240-V264 HydrophobicContact CD1-CG2 4.2Å; Y240-V264 HydrophobicContact CE1-CG2 3.78Å; Y240-F273 HydrophobicContact CD2-CE1 4.42Å; Y240-F273 HydrophobicContact CE1-CE1 4.16Å; Y240-F273 AromaticContact CE2-CE1 3.63Å; Y240-F273 HydrophobicContact CE2-CE1 3.63Å; Y240-F273 HydrophobicContact CE2-CZ 4.05Å; Y240-F273 AromaticContact CZ-CE1 3.48Å; Y240-F273 VanDerWaalsContact CZ-CE1 3.48Å; Y240-F273 WeakPolarHBondContact OH-CE1 3.35Å
241	I	96.3	Very high	93.5	Very high	19 Å²	19	45.2 Å²	45.2	10%	0.097	24%	0.238	C	C	.	.			trans	-67.1	133.3	-175.4	-162.6	165.4	0	0	0	110.8	S237 P238 V245 L246 W259 F284 I287	S237-I241 PolarHBondContact O-N 3.18Å; P238-I241 WeakPolarHBondContact O-CG2 3.41Å; I241-V245 HydrophobicContact CD1-CB 4.28Å; I241-V245 HydrophobicContact CD1-CG1 3.69Å; I241-V245 HydrophobicContact CG1-CB 3.85Å; I241-V245 HydrophobicContact CG1-CG1 3.8Å; I241-V245 HydrophobicContact CG1-CG2 4.47Å; I241-L246 HydrophobicContact CD1-CD2 3.85Å; I241-L246 HydrophobicContact CD1-CG 4.46Å; I241-L246 HydrophobicContact CG1-CD2 4.24Å; I241-L246 HydrophobicContact CG1-CG 4.33Å; I241-L246 HydrophobicContact CG2-CD1 3.96Å; I241-L246 HydrophobicContact CG2-CD2 3.86Å; I241-L246 HydrophobicContact CG2-CG 3.94Å; I241-W259 PolarHBondContact O-NE1 2.97Å; I241-F284 HydrophobicContact CG2-CE1 4.33Å; I241-I287 HydrophobicContact CG2-CD1 4.12Å; I241-I287 WeakPolarHBondContact O-CG2 3.32Å
242	S	97.7	Very high	93.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.255	C	S	.	.			trans	-76.8	154.4	-178.9	65.6	0	0	0	0	113	Y240 D244 V245 L246 S256 W259	Y240-S242 PolarHBondContact O-N 2.89Å; S242-D244 PolarHBondContact O-N 3.39Å; S242-V245 PolarHBondContact O-N 2.96Å; S242-V245 WeakPolarHBondContact OG-CG2 3.28Å; S242-V245 PolarHBondContact OG-N 2.8Å; S242-L246 PolarHBondContact O-N 2.8Å; S242-S256 PolarHBondContact OG-OG 3.18Å; S242-W259 VanDerWaalsContact CA-CD1 3.41Å
243	P	97.5	Very high	93.8	Very high	13 Å²	13	42.2 Å²	42.2	8%	0.084	22%	0.222	C	C	.	.	H	α-helix	trans	-57	-32.9	173.3	24.8	-35.9	0	0	0	112.5	V245 L246 S247 W259 L314	P243-V245 VanDerWaalsContact C-N 3.35Å; P243-V245 PolarHBondContact O-N 3.35Å; P243-L246 CarbonylContact O-C 3.56Å; P243-L246 PolarHBondContact O-N 3.17Å; P243-S247 PolarHBondContact O-N 3.45Å; P243-W259 HydrophobicContact CG-CD2 4.46Å; P243-W259 HydrophobicContact CG-CE3 4.1Å; P243-W259 HydrophobicContact CG-CH2 4.09Å; P243-W259 HydrophobicContact CG-CZ2 4.45Å; P243-W259 HydrophobicContact CG-CZ3 3.9Å; P243-L314 HydrophobicContact CB-CD2 4.07Å; P243-L314 HydrophobicContact CG-CD2 3.94Å
244	D	96.3	Very high	94.2	Very high	18 Å²	18	41.3 Å²	41.3	10%	0.096	22%	0.216	C	C	.	.	H	α-helix	trans	-60	-44.5	179.4	-41.1	-33.9	0	0	0	111.4	S242 S247 R319	S242-D244 PolarHBondContact O-N 3.39Å; D244-S247 WeakPolarHBondContact O-CB 3.39Å; D244-S247 PolarHBondContact O-N 3.31Å; D244-S247 PolarHBondContact O-OG 3.3Å; D244-R319 IonicContact OD1-NH2 2.59Å; D244-R319 PolarHBondContact OD1-NH2 2.82Å; D244-R319 IonicContact OD2-CZ 3.69Å; D244-R319 IonicContact OD2-NH1 2.71Å; D244-R319 PolarHBondContact OD2-NH1 3.43Å; D244-R319 IonicContact OD2-NH2 2.78Å; D244-R319 PolarHBondContact OD2-NH2 2.86Å
245	V	95.9	Very high	94.6	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.018	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-43.4	176.3	-179.8	0	0	0	0	110.3	Q234 I241 S242 P243 S247 G248 Y251 S256	Q234-V245 HydrophobicContact CB-CG1 4.02Å; Q234-V245 HydrophobicContact CG-CG1 4.15Å; Q234-V245 WeakPolarHBondContact CG-O 3.4Å; I241-V245 HydrophobicContact CD1-CB 4.28Å; I241-V245 HydrophobicContact CD1-CG1 3.69Å; I241-V245 HydrophobicContact CG1-CB 3.85Å; I241-V245 HydrophobicContact CG1-CG1 3.8Å; I241-V245 HydrophobicContact CG1-CG2 4.47Å; S242-V245 PolarHBondContact O-N 2.96Å; S242-V245 WeakPolarHBondContact OG-CG2 3.28Å; S242-V245 PolarHBondContact OG-N 2.8Å; P243-V245 VanDerWaalsContact C-N 3.35Å; P243-V245 PolarHBondContact O-N 3.35Å; V245-S247 PolarHBondContact O-N 3.32Å; V245-G248 PolarHBondContact O-N 2.94Å; V245-Y251 HydrophobicContact CG1-CE1 4.48Å; V245-Y251 HydrophobicContact CG2-CD1 4.38Å; V245-Y251 HydrophobicContact CG2-CD2 3.91Å; V245-Y251 HydrophobicContact CG2-CE1 4.05Å; V245-Y251 HydrophobicContact CG2-CE2 3.54Å; V245-Y251 HydrophobicContact CG2-CG 4.33Å; V245-S256 WeakPolarHBondContact CG2-OG 3.37Å
246	L	94.6	Very high	95.1	Very high	18 Å²	18	33.3 Å²	33.3	9%	0.094	19%	0.186	C	C	.	.	H	α-helix	trans	-70.5	-12.3	179.9	-64.7	179.8	0	0	0	114	I241 S242 P243 G248 F284 I287 K288	I241-L246 HydrophobicContact CD1-CD2 3.85Å; I241-L246 HydrophobicContact CD1-CG 4.46Å; I241-L246 HydrophobicContact CG1-CD2 4.24Å; I241-L246 HydrophobicContact CG1-CG 4.33Å; I241-L246 HydrophobicContact CG2-CD1 3.96Å; I241-L246 HydrophobicContact CG2-CD2 3.86Å; I241-L246 HydrophobicContact CG2-CG 3.94Å; S242-L246 PolarHBondContact O-N 2.8Å; P243-L246 CarbonylContact O-C 3.56Å; P243-L246 PolarHBondContact O-N 3.17Å; L246-G248 PolarHBondContact O-N 3.49Å; L246-F284 HydrophobicContact CD1-CB 4.07Å; L246-F284 HydrophobicContact CD1-CD1 3.91Å; L246-F284 HydrophobicContact CD1-CG 4.17Å; L246-F284 HydrophobicContact CD2-CD1 4.04Å; L246-F284 HydrophobicContact CD2-CE1 4.22Å; L246-F284 HydrophobicContact CD2-CG 4.22Å; L246-I287 HydrophobicContact CD1-CB 4.02Å; L246-I287 HydrophobicContact CD1-CD1 4.4Å; L246-I287 HydrophobicContact CD1-CG2 3.61Å; L246-K288 VanDerWaalsContact CB-CE 3.43Å; L246-K288 HydrophobicContact CB-CG 4.31Å; L246-K288 HydrophobicContact CD1-CG 4.35Å; L246-K288 WeakPolarHBondContact O-CE 3.41Å; L246-K288 PolarHBondContact O-NZ 3.05Å
247	S	90.7	Very high	95.5	Very high	59 Å²	59	32.2 Å²	32.2	41%	0.413	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-22.3	176.5	78.9	0	0	0	0	112.6	P243 D244 V245 R249	P243-S247 PolarHBondContact O-N 3.45Å; D244-S247 WeakPolarHBondContact O-CB 3.39Å; D244-S247 PolarHBondContact O-N 3.31Å; D244-S247 PolarHBondContact O-OG 3.3Å; V245-S247 PolarHBondContact O-N 3.32Å; S247-R249 PolarHBondContact O-N 2.8Å; S247-R249 PolarHBondContact OG-N 2.8Å; S247-R249 VanDerWaalsContact OG-N 3.12Å
248	G	88.5	Confident	95.8	Very high	46 Å²	46	31.3 Å²	31.3	47%	0.474	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	9.5	-173.2	0	0	0	0	0	114.8	Q234 V245 L246	Q234-G248 VanDerWaalsContact NE2-CA 3.28Å; V245-G248 PolarHBondContact O-N 2.94Å; L246-G248 PolarHBondContact O-N 3.49Å
249	R	92.9	Very high	96.1	Very high	187 Å²	187	30 Å²	30	71%	0.706	16%	0.159	S	C	*	.	S	Bend	trans	-99.7	161.8	174.5	-59.9	180	-176.7	-179.2	0.5	110.1	S247 Y251	S247-R249 PolarHBondContact O-N 2.8Å; S247-R249 PolarHBondContact OG-N 2.8Å; S247-R249 VanDerWaalsContact OG-N 3.12Å; R249-Y251 PolarHBondContact O-N 2.73Å
250	P	95.9	Very high	96.4	Very high	69 Å²	69	30.2 Å²	30.2	45%	0.448	16%	0.161	S	C	.	.			trans	-55.9	136.1	171	-22.8	33.2	0	0	0	111.4	L230 L231 K232	L230-P250 HydrophobicContact CB-CB 3.85Å; L230-P250 HydrophobicContact CD1-CB 3.97Å; L230-P250 HydrophobicContact CG-CB 4.47Å; L231-P250 CarbonylContact O-C 3.51Å; L231-P250 WeakPolarHBondContact O-CA 3.22Å; K232-P250 HydrophobicContact CG-CB 4.28Å; K232-P250 HydrophobicContact CG-CG 4.18Å
251	Y	96.5	Very high	96.4	Very high	11 Å²	11	29.5 Å²	29.5	4%	0.043	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	158.8	-174.8	67.6	-83.2	0	0	0	112.1	R197 L230 L231 D233 V245 R249	R197-Y251 PolarHBondContact NH2-OH 3.45Å; L230-Y251 CarbonylContact C-O 3.54Å; L230-Y251 WeakPolarHBondContact CA-O 3.4Å; L231-Y251 HydrophobicContact CB-CD1 4.22Å; L231-Y251 HydrophobicContact CB-CD2 4.4Å; L231-Y251 HydrophobicContact CB-CE1 3.69Å; L231-Y251 HydrophobicContact CB-CE2 3.89Å; L231-Y251 VanDerWaalsContact CB-CZ 3.5Å; L231-Y251 HydrophobicContact CD1-CE2 3.89Å; L231-Y251 HydrophobicContact CG-CE2 4.43Å; L231-Y251 PolarHBondContact N-O 3.32Å; L231-Y251 WeakPolarHBondContact O-CD1 3.31Å; L231-Y251 WeakPolarHBondContact O-CE1 3.4Å; L231-Y251 PolarHBondContact O-N 3.48Å; D233-Y251 WeakPolarHBondContact O-CE1 3.17Å; D233-Y251 PolarHBondContact O-OH 3.31Å; V245-Y251 HydrophobicContact CG1-CE1 4.48Å; V245-Y251 HydrophobicContact CG2-CD1 4.38Å; V245-Y251 HydrophobicContact CG2-CD2 3.91Å; V245-Y251 HydrophobicContact CG2-CE1 4.05Å; V245-Y251 HydrophobicContact CG2-CE2 3.54Å; V245-Y251 HydrophobicContact CG2-CG 4.33Å; R249-Y251 PolarHBondContact O-N 2.73Å
252	R	96.6	Very high	96.5	Very high	98 Å²	98	28.6 Å²	28.6	37%	0.37	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	131	174.2	-71.8	-178	166.2	167	-6.8	110.5	D228 L230 P255	D228-R252 IonicContact OD1-CZ 2.75Å; D228-R252 IonicContact OD1-NE 3.17Å; D228-R252 IonicContact OD1-NH2 3.96Å; D228-R252 PolarHBondContact OD1-NH2 3.27Å; L230-R252 HydrophobicContact CD2-CG 3.69Å; R252-P255 HydrophobicContact CB-CG 3.95Å
253	G	96.8	Very high	96.6	Very high	2 Å²	2	28.6 Å²	28.6	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-68.9	-42.9	-175.7	0	0	0	0	0	114.2	S256 D257	G253-S256 WeakPolarHBondContact O-CB 3.45Å; G253-S256 PolarHBondContact O-N 3.08Å; G253-S256 VanDerWaalsContact O-N 3.16Å; G253-D257 PolarHBondContact O-N 2.87Å
254	K	98.3	Very high	96.6	Very high	28 Å²	28	28 Å²	28	12%	0.122	15%	0.149	C	C	.	.	H	α-helix	trans	-63.9	-48	-175.3	-58.2	-178.3	-174.7	-173.8	0	112.9	H190 N193 V195 L224 E227 S256 D257 M258	H190-K254 HydrophobicContact CB-CD 4.04Å; H190-K254 HydrophobicContact CB-CG 4.49Å; H190-K254 PolarHBondContact CE1-O 3.04Å; H190-K254 WeakPolarHBondContact O-CE 3.49Å; H190-K254 PolarHBondContact O-NZ 2.83Å; N193-K254 WeakPolarHBondContact OD1-CE 3.3Å; N193-K254 PolarHBondContact OD1-NZ 2.87Å; V195-K254 HydrophobicContact CG1-CB 4.43Å; V195-K254 HydrophobicContact CG1-CG 3.65Å; L224-K254 HydrophobicContact CD1-CG 4.5Å; E227-K254 IonicContact OE1-NZ 3.23Å; E227-K254 PolarHBondContact OE1-NZ 3.48Å; E227-K254 WeakPolarHBondContact OE2-CE 3.27Å; E227-K254 IonicContact OE2-NZ 2.91Å; E227-K254 PolarHBondContact OE2-NZ 2.78Å; K254-S256 PolarHBondContact O-N 3Å; K254-D257 WeakPolarHBondContact O-CB 3.49Å; K254-D257 PolarHBondContact O-N 2.93Å; K254-M258 WeakPolarHBondContact O-CG 3.36Å; K254-M258 PolarHBondContact O-N 2.81Å; K254-M258 VanDerWaalsContact O-N 3.15Å
255	P	98.3	Very high	96.8	Very high	23 Å²	23	27.1 Å²	27.1	15%	0.149	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-33.3	173.5	-24.9	36	0	0	0	113.1	R252 M258 W259 P316 R319	R252-P255 HydrophobicContact CB-CG 3.95Å; P255-M258 PolarHBondContact O-N 2.84Å; P255-W259 PolarHBondContact O-N 2.74Å; P255-W259 VanDerWaalsContact O-N 3.08Å; P255-P316 HydrophobicContact CB-CB 3.74Å; P255-P316 HydrophobicContact CG-CB 4.26Å; P255-R319 VanDerWaalsContact O-CD 3.23Å; P255-R319 WeakPolarHBondContact O-CD 3.47Å; P255-R319 PolarHBondContact O-NH1 3.48Å
256	S	98.2	Very high	96.9	Very high	14 Å²	14	27.1 Å²	27.1	10%	0.098	14%	0.144	C	C	.	.	H	α-helix	trans	-65	-41.4	177	-171.7	0	0	0	0	111.9	S242 V245 G253 K254 M258 W259 A260	S242-S256 PolarHBondContact OG-OG 3.18Å; V245-S256 WeakPolarHBondContact CG2-OG 3.37Å; G253-S256 WeakPolarHBondContact O-CB 3.45Å; G253-S256 PolarHBondContact O-N 3.08Å; G253-S256 VanDerWaalsContact O-N 3.16Å; K254-S256 PolarHBondContact O-N 3Å; S256-M258 VanDerWaalsContact C-N 3.3Å; S256-M258 PolarHBondContact O-N 2.97Å; S256-W259 WeakPolarHBondContact O-CB 3.46Å; S256-W259 PolarHBondContact O-N 3Å; S256-A260 PolarHBondContact O-N 3.33Å
257	D	98.6	Very high	97.1	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.011	14%	0.14	C	C	.	.	H	α-helix	trans	-59.7	-40.3	171.2	-82.5	-14.4	0	0	0	111.4	H190 V195 H196 R197 L199 G253 K254 W259 A260 L261	H190-D257 IonicContact CD2-OD2 3.39Å; H190-D257 IonicContact NE2-OD2 2.79Å; H190-D257 PolarHBondContact NE2-OD2 3.01Å; H190-D257 VanDerWaalsContact NE2-OD2 3.08Å; V195-D257 WeakPolarHBondContact CA-OD2 3.46Å; H196-D257 PolarHBondContact N-OD2 2.7Å; R197-D257 WeakPolarHBondContact CA-OD1 3.47Å; R197-D257 PolarHBondContact N-OD1 3.05Å; L199-D257 HydrophobicContact CD1-CB 3.68Å; G253-D257 PolarHBondContact O-N 2.87Å; K254-D257 WeakPolarHBondContact O-CB 3.49Å; K254-D257 PolarHBondContact O-N 2.93Å; D257-W259 PolarHBondContact O-N 3.5Å; D257-A260 WeakPolarHBondContact O-CB 3.4Å; D257-A260 PolarHBondContact O-N 3.28Å; D257-L261 PolarHBondContact O-N 3.13Å
258	M	98.8	Very high	97.4	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-65.6	-35.3	179.3	-59.4	-46.8	-61.2	0	0	113	V186 K254 P255 S256 A260 L261 G262 L311 R319 L320 A322 V325	V186-M258 HydrophobicContact CG1-SD 4.49Å; K254-M258 WeakPolarHBondContact O-CG 3.36Å; K254-M258 PolarHBondContact O-N 2.81Å; K254-M258 VanDerWaalsContact O-N 3.15Å; P255-M258 PolarHBondContact O-N 2.84Å; S256-M258 VanDerWaalsContact C-N 3.3Å; S256-M258 PolarHBondContact O-N 2.97Å; M258-A260 VanDerWaalsContact C-N 3.34Å; M258-A260 PolarHBondContact O-N 2.81Å; M258-L261 HydrophobicContact CE-CD1 3.92Å; M258-L261 PolarHBondContact O-N 2.92Å; M258-L261 HydrophobicContact SD-CD1 4.01Å; M258-G262 PolarHBondContact O-N 3.22Å; M258-L311 HydrophobicContact CB-CD2 4.11Å; M258-L311 HydrophobicContact CE-CD2 3.9Å; M258-R319 HydrophobicContact CB-CG 4.3Å; M258-L320 WeakPolarHBondContact CG-O 3.24Å; M258-A322 HydrophobicContact CE-CB 4.09Å; M258-A322 HydrophobicContact SD-CB 3.81Å; M258-V325 HydrophobicContact CE-CB 4.4Å; M258-V325 HydrophobicContact CE-CG2 3.77Å
259	W	98.8	Very high	97.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.4	-46.9	171.3	173.9	-83	0	0	0	111.3	I241 S242 P243 P255 S256 D257 L261 G262 V263 F275 I287 A290 L312 V313	I241-W259 PolarHBondContact O-NE1 2.97Å; S242-W259 VanDerWaalsContact CA-CD1 3.41Å; P243-W259 HydrophobicContact CG-CD2 4.46Å; P243-W259 HydrophobicContact CG-CE3 4.1Å; P243-W259 HydrophobicContact CG-CH2 4.09Å; P243-W259 HydrophobicContact CG-CZ2 4.45Å; P243-W259 HydrophobicContact CG-CZ3 3.9Å; P255-W259 PolarHBondContact O-N 2.74Å; P255-W259 VanDerWaalsContact O-N 3.08Å; S256-W259 WeakPolarHBondContact O-CB 3.46Å; S256-W259 PolarHBondContact O-N 3Å; D257-W259 PolarHBondContact O-N 3.5Å; W259-L261 PolarHBondContact O-N 3.31Å; W259-G262 WeakPolarHBondContact O-CA 3.24Å; W259-G262 PolarHBondContact O-N 3.46Å; W259-V263 PolarHBondContact O-N 2.9Å; W259-V263 VanDerWaalsContact O-N 3.13Å; W259-F275 HydrophobicContact CH2-CE2 4.09Å; W259-F275 AromaticContact CH2-CZ 3.76Å; W259-F275 HydrophobicContact CH2-CZ 3.76Å; W259-F275 HydrophobicContact CZ2-CD2 4.32Å; W259-F275 AromaticContact CZ2-CE2 3.35Å; W259-F275 HydrophobicContact CZ2-CE2 3.35Å; W259-F275 AromaticContact CZ2-CZ 3.5Å; W259-F275 HydrophobicContact CZ2-CZ 3.5Å; W259-F275 VanDerWaalsContact CZ2-CZ 3.5Å; W259-I287 HydrophobicContact CZ2-CG2 3.93Å; W259-A290 HydrophobicContact CH2-CB 4.18Å; W259-L312 HydrophobicContact CD2-CD2 3.88Å; W259-L312 HydrophobicContact CE3-CD2 4.06Å; W259-L312 HydrophobicContact CG-CD2 4.39Å; W259-L312 HydrophobicContact CH2-CB 4.5Å; W259-L312 HydrophobicContact CH2-CD2 4.36Å; W259-L312 HydrophobicContact CZ2-CD2 4.17Å; W259-L312 VanDerWaalsContact CZ3-C 3.49Å; W259-L312 HydrophobicContact CZ3-CB 4.23Å; W259-L312 HydrophobicContact CZ3-CD2 4.3Å; W259-V313 WeakPolarHBondContact CZ3-O 3.22Å
260	A	98.8	Very high	98.1	Very high	7 Å²	7	13.4 Å²	13.4	6%	0.058	7%	0.068	C	C	.	.	H	α-helix	trans	-61	-35	178.4	0	0	0	0	0	111.8	L199 S256 D257 M258 V263 V264	L199-A260 HydrophobicContact CB-CB 4Å; S256-A260 PolarHBondContact O-N 3.33Å; D257-A260 WeakPolarHBondContact O-CB 3.4Å; D257-A260 PolarHBondContact O-N 3.28Å; M258-A260 VanDerWaalsContact C-N 3.34Å; M258-A260 PolarHBondContact O-N 2.81Å; A260-V263 WeakPolarHBondContact O-CB 3.38Å; A260-V263 PolarHBondContact O-N 2.82Å; A260-V264 WeakPolarHBondContact O-CG2 3.41Å; A260-V264 PolarHBondContact O-N 3.16Å
261	L	98.8	Very high	98	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-67.3	-34	172.6	-67.1	-173.4	0	0	0	113.3	F179 V182 V183 V186 L199 M204 D257 M258 W259 V263 V264 L265	F179-L261 HydrophobicContact CE2-CB 3.99Å; F179-L261 HydrophobicContact CE2-CD2 4.36Å; F179-L261 VanDerWaalsContact CE2-O 3.24Å; F179-L261 WeakPolarHBondContact CE2-O 3.5Å; F179-L261 HydrophobicContact CZ-CB 3.91Å; F179-L261 WeakPolarHBondContact CZ-O 3.23Å; V182-L261 HydrophobicContact CG1-CD2 3.59Å; V183-L261 HydrophobicContact CG2-CD1 4.17Å; V186-L261 HydrophobicContact CB-CD1 4.18Å; V186-L261 HydrophobicContact CG1-CD1 4.07Å; V186-L261 HydrophobicContact CG2-CD1 4.13Å; V186-L261 HydrophobicContact CG2-CD2 4.45Å; L199-L261 HydrophobicContact CB-CD2 4.44Å; L199-L261 HydrophobicContact CD1-CD2 3.92Å; L199-L261 HydrophobicContact CD1-CG 4Å; M204-L261 HydrophobicContact CE-CD2 4.08Å; D257-L261 PolarHBondContact O-N 3.13Å; M258-L261 HydrophobicContact CE-CD1 3.92Å; M258-L261 PolarHBondContact O-N 2.92Å; M258-L261 HydrophobicContact SD-CD1 4.01Å; W259-L261 PolarHBondContact O-N 3.31Å; L261-V263 VanDerWaalsContact C-N 3.32Å; L261-V263 PolarHBondContact O-N 3.27Å; L261-V264 WeakPolarHBondContact O-CB 3.3Å; L261-V264 PolarHBondContact O-N 3.43Å; L261-L265 PolarHBondContact O-N 2.78Å
262	G	98.8	Very high	97.9	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-60	-43.1	170.6	0	0	0	0	0	112.2	M258 W259 L265 F266	M258-G262 PolarHBondContact O-N 3.22Å; W259-G262 WeakPolarHBondContact O-CA 3.24Å; W259-G262 PolarHBondContact O-N 3.46Å; G262-L265 PolarHBondContact O-N 3.18Å; G262-F266 WeakPolarHBondContact O-CB 3.23Å; G262-F266 PolarHBondContact O-N 3.42Å; G262-F266 VanDerWaalsContact O-N 3.07Å
263	V	98.8	Very high	97.9	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-63.1	-44.5	173.7	178.9	0	0	0	0	111	Y240 W259 A260 L261 L265 F266 T267 F273 P274 F275 L312	Y240-V263 HydrophobicContact CD1-CB 3.8Å; Y240-V263 HydrophobicContact CD1-CG1 3.48Å; Y240-V263 VanDerWaalsContact CD1-CG1 3.48Å; Y240-V263 HydrophobicContact CE1-CB 4.24Å; Y240-V263 HydrophobicContact CE1-CG1 3.63Å; Y240-V263 HydrophobicContact CG-CG1 4.19Å; W259-V263 PolarHBondContact O-N 2.9Å; W259-V263 VanDerWaalsContact O-N 3.13Å; A260-V263 WeakPolarHBondContact O-CB 3.38Å; A260-V263 PolarHBondContact O-N 2.82Å; L261-V263 VanDerWaalsContact C-N 3.32Å; L261-V263 PolarHBondContact O-N 3.27Å; V263-L265 PolarHBondContact O-N 2.95Å; V263-F266 PolarHBondContact O-N 3.48Å; V263-T267 WeakPolarHBondContact O-CB 3.49Å; V263-T267 PolarHBondContact O-N 2.98Å; V263-T267 PolarHBondContact O-OG1 2.9Å; V263-F273 HydrophobicContact CG1-CD1 3.92Å; V263-F273 HydrophobicContact CG1-CE1 4.33Å; V263-P274 HydrophobicContact CB-CG 4.3Å; V263-P274 HydrophobicContact CG1-CG 4.05Å; V263-P274 HydrophobicContact CG2-CG 4.04Å; V263-F275 HydrophobicContact CG2-CE2 4.29Å; V263-L312 HydrophobicContact CG2-CD2 3.96Å
264	V	98.8	Very high	97.9	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-56.5	-50.9	176.6	162.5	0	0	0	0	111.5	F179 L201 M204 Y240 A260 L261 T267 M268	F179-V264 HydrophobicContact CD2-CG1 4.05Å; F179-V264 HydrophobicContact CE2-CB 4.43Å; F179-V264 HydrophobicContact CE2-CG1 4.07Å; L201-V264 HydrophobicContact CD2-CB 4.46Å; L201-V264 HydrophobicContact CD2-CG1 3.81Å; L201-V264 HydrophobicContact CD2-CG2 4.41Å; M204-V264 HydrophobicContact CE-CG1 4.43Å; M204-V264 HydrophobicContact CE-CG2 4.09Å; M204-V264 HydrophobicContact SD-CG1 4.32Å; Y240-V264 HydrophobicContact CD1-CG2 4.2Å; Y240-V264 HydrophobicContact CE1-CG2 3.78Å; A260-V264 WeakPolarHBondContact O-CG2 3.41Å; A260-V264 PolarHBondContact O-N 3.16Å; L261-V264 WeakPolarHBondContact O-CB 3.3Å; L261-V264 PolarHBondContact O-N 3.43Å; V264-T267 PolarHBondContact O-N 3.39Å; V264-M268 HydrophobicContact CG1-SD 3.7Å; V264-M268 VanDerWaalsContact O-CG 3.28Å; V264-M268 WeakPolarHBondContact O-CG 3.4Å; V264-M268 PolarHBondContact O-N 2.87Å
265	L	98.8	Very high	97.9	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-61.8	-46.4	-179.3	179.4	58.7	0	0	0	111.6	I176 F179 L261 G262 V263 T267 M268 L269 T304 L307 I308	I176-L265 HydrophobicContact CD1-CD1 4.35Å; F179-L265 HydrophobicContact CB-CD1 4.2Å; F179-L265 HydrophobicContact CD1-CB 4.37Å; F179-L265 HydrophobicContact CD1-CD1 3.96Å; F179-L265 HydrophobicContact CD1-CD2 4.09Å; F179-L265 HydrophobicContact CD1-CG 4.36Å; F179-L265 HydrophobicContact CD2-CB 4.09Å; F179-L265 HydrophobicContact CD2-CD1 4.41Å; F179-L265 HydrophobicContact CE1-CB 4.11Å; F179-L265 HydrophobicContact CE1-CD1 4.43Å; F179-L265 HydrophobicContact CE1-CD2 3.83Å; F179-L265 HydrophobicContact CE1-CG 4.35Å; F179-L265 HydrophobicContact CE2-CB 3.81Å; F179-L265 HydrophobicContact CG-CB 4.36Å; F179-L265 HydrophobicContact CG-CD1 3.94Å; F179-L265 HydrophobicContact CZ-CB 3.81Å; F179-L265 HydrophobicContact CZ-CD2 4.3Å; L261-L265 PolarHBondContact O-N 2.78Å; G262-L265 PolarHBondContact O-N 3.18Å; V263-L265 PolarHBondContact O-N 2.95Å; L265-T267 VanDerWaalsContact C-N 3.34Å; L265-T267 PolarHBondContact O-N 3.43Å; L265-M268 PolarHBondContact O-N 2.91Å; L265-L269 HydrophobicContact CD1-CD1 3.82Å; L265-L269 HydrophobicContact CD1-CG 4.26Å; L265-L269 HydrophobicContact CG-CD1 3.93Å; L265-L269 WeakPolarHBondContact O-CG 3.32Å; L265-L269 PolarHBondContact O-N 3.11Å; L265-L269 VanDerWaalsContact O-N 3.15Å; L265-T304 HydrophobicContact CD2-CG2 4.43Å; L265-L307 HydrophobicContact CD2-CD2 3.97Å; L265-L307 HydrophobicContact CD2-CG 4.35Å; L265-I308 HydrophobicContact CD2-CG1 3.8Å; L265-I308 HydrophobicContact CG-CD1 4.49Å; L265-I308 HydrophobicContact CG-CG1 4.04Å
266	F	98.6	Very high	97.5	Very high	3 Å²	3	11.1 Å²	11.1	1%	0.013	6%	0.055	C	C	.	.	H	α-helix	trans	-57.5	-48.3	176.5	-176.2	-76.7	0	0	0	111.1	G262 V263 M268 L269 Y270 Q272 P274 Y292 I294 I308	G262-F266 WeakPolarHBondContact O-CB 3.23Å; G262-F266 PolarHBondContact O-N 3.42Å; G262-F266 VanDerWaalsContact O-N 3.07Å; V263-F266 PolarHBondContact O-N 3.48Å; F266-M268 VanDerWaalsContact C-N 3.34Å; F266-M268 PolarHBondContact O-N 3.28Å; F266-L269 PolarHBondContact O-N 3.42Å; F266-Y270 AromaticContact CD1-CD2 3.91Å; F266-Y270 HydrophobicContact CD1-CD2 3.91Å; F266-Y270 AromaticContact CD2-CD2 3.7Å; F266-Y270 HydrophobicContact CD2-CD2 3.7Å; F266-Y270 AromaticContact CD2-CE2 3.87Å; F266-Y270 HydrophobicContact CD2-CE2 3.87Å; F266-Y270 AromaticContact CE1-CD2 3.9Å; F266-Y270 HydrophobicContact CE1-CD2 3.9Å; F266-Y270 HydrophobicContact CE1-CG 4.36Å; F266-Y270 AromaticContact CE2-CD2 3.7Å; F266-Y270 HydrophobicContact CE2-CD2 3.7Å; F266-Y270 AromaticContact CE2-CE2 3.95Å; F266-Y270 HydrophobicContact CE2-CE2 3.95Å; F266-Y270 AromaticContact CG-CD2 3.81Å; F266-Y270 HydrophobicContact CG-CD2 3.81Å; F266-Y270 HydrophobicContact CG-CE2 4.33Å; F266-Y270 AromaticContact CZ-CD2 3.8Å; F266-Y270 HydrophobicContact CZ-CD2 3.8Å; F266-Y270 HydrophobicContact CZ-CE2 4.46Å; F266-Y270 HydrophobicContact CZ-CG 4.34Å; F266-Y270 VanDerWaalsContact O-CD2 3.28Å; F266-Y270 WeakPolarHBondContact O-CD2 3.39Å; F266-Y270 PolarHBondContact O-N 3.27Å; F266-Q272 VanDerWaalsContact CD1-O 3.27Å; F266-Q272 WeakPolarHBondContact CD1-O 3.32Å; F266-Q272 HydrophobicContact CE1-CG 4.13Å; F266-Q272 WeakPolarHBondContact CE1-O 3.22Å; F266-P274 HydrophobicContact CB-CB 4.44Å; F266-P274 HydrophobicContact CB-CG 4.3Å; F266-P274 HydrophobicContact CD1-CB 3.78Å; F266-P274 VanDerWaalsContact CD1-CD 3.48Å; F266-P274 HydrophobicContact CD1-CG 4.06Å; F266-P274 HydrophobicContact CD2-CB 3.99Å; F266-P274 VanDerWaalsContact CE1-CA 3.49Å; F266-P274 HydrophobicContact CE1-CB 3.95Å; F266-P274 HydrophobicContact CE2-CB 4.14Å; F266-P274 HydrophobicContact CG-CB 3.81Å; F266-P274 HydrophobicContact CG-CG 4.13Å; F266-P274 HydrophobicContact CZ-CB 4.13Å; F266-Y292 HydrophobicContact CD2-CD2 4.41Å; F266-Y292 HydrophobicContact CE2-CD2 4.09Å; F266-I294 HydrophobicContact CD2-CG1 4.45Å; F266-I294 HydrophobicContact CE2-CG1 4Å; F266-I308 HydrophobicContact CB-CD1 4.48Å; F266-I308 HydrophobicContact CB-CG2 4.48Å; F266-I308 HydrophobicContact CD2-CD1 4.4Å; F266-I308 HydrophobicContact CD2-CG2 4.16Å
267	T	98.3	Very high	97.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-67.7	-32.7	-177.7	-57	0	0	0	0	113.1	L201 V263 V264 L265 G271 Q272	L201-T267 HydrophobicContact CD1-CG2 3.6Å; V263-T267 WeakPolarHBondContact O-CB 3.49Å; V263-T267 PolarHBondContact O-N 2.98Å; V263-T267 PolarHBondContact O-OG1 2.9Å; V264-T267 PolarHBondContact O-N 3.39Å; L265-T267 VanDerWaalsContact C-N 3.34Å; L265-T267 PolarHBondContact O-N 3.43Å; T267-G271 VanDerWaalsContact O-CA 3.31Å; T267-G271 WeakPolarHBondContact O-CA 3.35Å; T267-G271 PolarHBondContact O-N 3.21Å; T267-Q272 VanDerWaalsContact CA-O 3.23Å; T267-Q272 WeakPolarHBondContact CA-O 3.41Å; T267-Q272 PolarHBondContact OG1-O 2.71Å; T267-Q272 VanDerWaalsContact OG1-O 3.09Å
268	M	98.4	Very high	97	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.8	-43.8	172.3	-72.4	167.1	63.2	0	0	111.8	L160 V164 L170 A175 I178 F179 L201 V264 L265 F266	L160-M268 HydrophobicContact CD2-SD 4.24Å; V164-M268 HydrophobicContact CG2-CG 4.16Å; L170-M268 HydrophobicContact CD1-CB 4.26Å; L170-M268 HydrophobicContact CD1-CE 3.94Å; L170-M268 HydrophobicContact CD1-CG 4.33Å; L170-M268 PolarHBondContact N-O 2.74Å; A175-M268 HydrophobicContact CB-CB 4.24Å; A175-M268 HydrophobicContact CB-CE 4.06Å; A175-M268 VanDerWaalsContact O-CE 3.29Å; A175-M268 WeakPolarHBondContact O-CE 3.48Å; I178-M268 HydrophobicContact CB-CE 3.83Å; I178-M268 HydrophobicContact CG2-CE 3.72Å; F179-M268 HydrophobicContact CB-CE 4.31Å; F179-M268 HydrophobicContact CD2-SD 4.48Å; L201-M268 HydrophobicContact CD2-CG 3.77Å; L201-M268 HydrophobicContact CD2-SD 4.18Å; V264-M268 HydrophobicContact CG1-SD 3.7Å; V264-M268 VanDerWaalsContact O-CG 3.28Å; V264-M268 WeakPolarHBondContact O-CG 3.4Å; V264-M268 PolarHBondContact O-N 2.87Å; L265-M268 PolarHBondContact O-N 2.91Å; F266-M268 VanDerWaalsContact C-N 3.34Å; F266-M268 PolarHBondContact O-N 3.28Å
269	L	98.2	Very high	96.7	Very high	6 Å²	6	20.9 Å²	20.9	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	-76.4	-41.4	-174.4	-69.7	165.3	0	0	0	113.4	E172 A175 L265 F266 V300 T304 I308	E172-L269 HydrophobicContact CB-CD2 4.18Å; E172-L269 HydrophobicContact CG-CD2 4.45Å; A175-L269 HydrophobicContact CB-CD2 3.62Å; A175-L269 HydrophobicContact CB-CG 4.15Å; L265-L269 HydrophobicContact CD1-CD1 3.82Å; L265-L269 HydrophobicContact CD1-CG 4.26Å; L265-L269 HydrophobicContact CG-CD1 3.93Å; L265-L269 WeakPolarHBondContact O-CG 3.32Å; L265-L269 PolarHBondContact O-N 3.11Å; L265-L269 VanDerWaalsContact O-N 3.15Å; F266-L269 PolarHBondContact O-N 3.42Å; L269-V300 HydrophobicContact CB-CG2 4.29Å; L269-V300 HydrophobicContact CD1-CG1 4.11Å; L269-V300 HydrophobicContact CD1-CG2 4.47Å; L269-V300 HydrophobicContact CD2-CG2 4.11Å; L269-T304 HydrophobicContact CD1-CG2 3.63Å; L269-I308 HydrophobicContact CD1-CD1 3.86Å
270	Y	96.6	Very high	96.3	Very high	16 Å²	16	23.9 Å²	23.9	6%	0.063	13%	0.132	C	C	.	.	H	α-helix	trans	-104	-9.6	-172.1	-59.3	-67.7	0	0	0	113.4	F266 Q272 I294 P295 V300 I308	F266-Y270 AromaticContact CD1-CD2 3.91Å; F266-Y270 HydrophobicContact CD1-CD2 3.91Å; F266-Y270 AromaticContact CD2-CD2 3.7Å; F266-Y270 HydrophobicContact CD2-CD2 3.7Å; F266-Y270 AromaticContact CD2-CE2 3.87Å; F266-Y270 HydrophobicContact CD2-CE2 3.87Å; F266-Y270 AromaticContact CE1-CD2 3.9Å; F266-Y270 HydrophobicContact CE1-CD2 3.9Å; F266-Y270 HydrophobicContact CE1-CG 4.36Å; F266-Y270 AromaticContact CE2-CD2 3.7Å; F266-Y270 HydrophobicContact CE2-CD2 3.7Å; F266-Y270 AromaticContact CE2-CE2 3.95Å; F266-Y270 HydrophobicContact CE2-CE2 3.95Å; F266-Y270 AromaticContact CG-CD2 3.81Å; F266-Y270 HydrophobicContact CG-CD2 3.81Å; F266-Y270 HydrophobicContact CG-CE2 4.33Å; F266-Y270 AromaticContact CZ-CD2 3.8Å; F266-Y270 HydrophobicContact CZ-CD2 3.8Å; F266-Y270 HydrophobicContact CZ-CE2 4.46Å; F266-Y270 HydrophobicContact CZ-CG 4.34Å; F266-Y270 VanDerWaalsContact O-CD2 3.28Å; F266-Y270 WeakPolarHBondContact O-CD2 3.39Å; F266-Y270 PolarHBondContact O-N 3.27Å; Y270-Q272 PolarHBondContact O-N 3.23Å; Y270-I294 HydrophobicContact CE2-CG2 4.29Å; Y270-I294 VanDerWaalsContact OH-CG2 3.23Å; Y270-I294 WeakPolarHBondContact OH-CG2 3.47Å; Y270-P295 HydrophobicContact CD1-CG 3.92Å; Y270-P295 HydrophobicContact CE1-CB 4.45Å; Y270-P295 HydrophobicContact CE1-CG 4.17Å; Y270-V300 HydrophobicContact CE1-CG2 3.92Å; Y270-V300 WeakPolarHBondContact OH-CB 3.41Å; Y270-V300 WeakPolarHBondContact OH-CG2 3.44Å; Y270-I308 HydrophobicContact CE2-CD1 4.07Å
271	G	94.6	Very high	96.1	Very high	8 Å²	8	29.8 Å²	29.8	8%	0.082	16%	0.159	C	C	.	.	S	Bend	trans	65.4	21.9	-177.1	0	0	0	0	0	112.9	K168 T267 F376	K168-G271 WeakPolarHBondContact O-CA 3.48Å; T267-G271 VanDerWaalsContact O-CA 3.31Å; T267-G271 WeakPolarHBondContact O-CA 3.35Å; T267-G271 PolarHBondContact O-N 3.21Å; G271-F376 WeakPolarHBondContact O-CD1 3.34Å; G271-F376 WeakPolarHBondContact O-CE1 3.01Å; G271-F376 WeakPolarHBondContact O-CE2 3.47Å; G271-F376 WeakPolarHBondContact O-CZ 3.45Å
272	Q	94.3	Very high	95.9	Very high	72 Å²	72	33.3 Å²	33.3	34%	0.336	18%	0.175	S	C	.	.	S	Bend	trans	-148.6	161.8	177.7	62.1	-178.8	-9.2	0	0	111.6	F266 T267 Y270 F376	F266-Q272 VanDerWaalsContact CD1-O 3.27Å; F266-Q272 WeakPolarHBondContact CD1-O 3.32Å; F266-Q272 HydrophobicContact CE1-CG 4.13Å; F266-Q272 WeakPolarHBondContact CE1-O 3.22Å; T267-Q272 VanDerWaalsContact CA-O 3.23Å; T267-Q272 WeakPolarHBondContact CA-O 3.41Å; T267-Q272 PolarHBondContact OG1-O 2.71Å; T267-Q272 VanDerWaalsContact OG1-O 3.09Å; Y270-Q272 PolarHBondContact O-N 3.23Å; Q272-F376 VanDerWaalsContact CA-CE2 3.41Å; Q272-F376 HydrophobicContact CB-CD2 3.92Å; Q272-F376 HydrophobicContact CB-CE2 4.18Å; Q272-F376 HydrophobicContact CB-CG 4.39Å
273	F	96.6	Very high	95.7	Very high	15 Å²	15	33.6 Å²	33.6	7%	0.066	18%	0.177	C	C	.	.			trans	-77.4	145.6	174.9	-72.2	-75.8	0	0	0	111.3	A239 Y240 V263 F275 F376 Y379 M380	A239-F273 HydrophobicContact CB-CD1 3.82Å; A239-F273 HydrophobicContact CB-CE1 3.66Å; A239-F273 HydrophobicContact CB-CE2 4.43Å; A239-F273 HydrophobicContact CB-CG 4.28Å; A239-F273 HydrophobicContact CB-CZ 4Å; Y240-F273 HydrophobicContact CD2-CE1 4.42Å; Y240-F273 HydrophobicContact CE1-CE1 4.16Å; Y240-F273 AromaticContact CE2-CE1 3.63Å; Y240-F273 HydrophobicContact CE2-CE1 3.63Å; Y240-F273 HydrophobicContact CE2-CZ 4.05Å; Y240-F273 AromaticContact CZ-CE1 3.48Å; Y240-F273 VanDerWaalsContact CZ-CE1 3.48Å; Y240-F273 WeakPolarHBondContact OH-CE1 3.35Å; V263-F273 HydrophobicContact CG1-CD1 3.92Å; V263-F273 HydrophobicContact CG1-CE1 4.33Å; F273-F275 WeakPolarHBondContact CB-O 3.3Å; F273-F275 PolarHBondContact O-N 3.4Å; F273-F376 AromaticContact CD2-CE2 3.94Å; F273-F376 HydrophobicContact CD2-CE2 3.94Å; F273-F376 HydrophobicContact CE2-CE2 4.21Å; F273-Y379 AromaticContact CD2-CD1 3.95Å; F273-Y379 HydrophobicContact CD2-CD1 3.95Å; F273-Y379 AromaticContact CD2-CE1 3.54Å; F273-Y379 HydrophobicContact CD2-CE1 3.54Å; F273-Y379 AromaticContact CE2-CD1 3.96Å; F273-Y379 HydrophobicContact CE2-CD1 3.96Å; F273-Y379 AromaticContact CE2-CE1 3.55Å; F273-Y379 HydrophobicContact CE2-CE1 3.55Å; F273-M380 HydrophobicContact CD2-SD 4.45Å; F273-M380 HydrophobicContact CE2-CE 4.2Å; F273-M380 HydrophobicContact CE2-CG 4.31Å; F273-M380 HydrophobicContact CE2-SD 3.31Å; F273-M380 WeakPolarHBondContact CE2-SD 3.25Å; F273-M380 HydrophobicContact CZ-CE 4.11Å; F273-M380 HydrophobicContact CZ-SD 3.65Å
274	P	97.4	Very high	95.5	Very high	13 Å²	13	36.7 Å²	36.7	8%	0.084	19%	0.19	C	C	.	.	S	Bend	trans	-65.3	-32.1	172	25.6	-30.7	0	0	0	111.5	V263 F266 Y292 L312	V263-P274 HydrophobicContact CB-CG 4.3Å; V263-P274 HydrophobicContact CG1-CG 4.05Å; V263-P274 HydrophobicContact CG2-CG 4.04Å; F266-P274 HydrophobicContact CB-CB 4.44Å; F266-P274 HydrophobicContact CB-CG 4.3Å; F266-P274 HydrophobicContact CD1-CB 3.78Å; F266-P274 VanDerWaalsContact CD1-CD 3.48Å; F266-P274 HydrophobicContact CD1-CG 4.06Å; F266-P274 HydrophobicContact CD2-CB 3.99Å; F266-P274 VanDerWaalsContact CE1-CA 3.49Å; F266-P274 HydrophobicContact CE1-CB 3.95Å; F266-P274 HydrophobicContact CE2-CB 4.14Å; F266-P274 HydrophobicContact CG-CB 3.81Å; F266-P274 HydrophobicContact CG-CG 4.13Å; F266-P274 HydrophobicContact CZ-CB 4.13Å; P274-Y292 HydrophobicContact CB-CD2 4.26Å; P274-Y292 HydrophobicContact CB-CG 4.14Å; P274-Y292 WeakPolarHBondContact O-CB 3.33Å; P274-L312 HydrophobicContact CB-CD1 4.16Å; P274-L312 HydrophobicContact CG-CD1 4.24Å
275	F	96.9	Very high	95.5	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	21%	0.209	C	C	.	.	S	Bend	trans	-120.3	119.7	177.1	-43.1	-73.5	0	0	0	109	W259 V263 F273 L283 K286 I287 E291 Y292 L312	W259-F275 HydrophobicContact CH2-CE2 4.09Å; W259-F275 AromaticContact CH2-CZ 3.76Å; W259-F275 HydrophobicContact CH2-CZ 3.76Å; W259-F275 HydrophobicContact CZ2-CD2 4.32Å; W259-F275 AromaticContact CZ2-CE2 3.35Å; W259-F275 HydrophobicContact CZ2-CE2 3.35Å; W259-F275 AromaticContact CZ2-CZ 3.5Å; W259-F275 HydrophobicContact CZ2-CZ 3.5Å; W259-F275 VanDerWaalsContact CZ2-CZ 3.5Å; V263-F275 HydrophobicContact CG2-CE2 4.29Å; F273-F275 WeakPolarHBondContact CB-O 3.3Å; F273-F275 PolarHBondContact O-N 3.4Å; F275-L283 HydrophobicContact CB-CD1 3.81Å; F275-L283 WeakPolarHBondContact O-CD1 3.33Å; F275-K286 HydrophobicContact CD1-CB 4.37Å; F275-I287 HydrophobicContact CB-CG1 3.77Å; F275-I287 HydrophobicContact CD1-CG1 4.33Å; F275-I287 HydrophobicContact CD2-CG1 3.81Å; F275-I287 HydrophobicContact CG-CG1 3.69Å; F275-E291 WeakPolarHBondContact CD1-O 3.39Å; F275-Y292 AromaticContact CE1-CD1 3.66Å; F275-Y292 HydrophobicContact CE1-CD1 3.66Å; F275-Y292 HydrophobicContact CE1-CG 4.12Å; F275-Y292 AromaticContact CZ-CD1 3.75Å; F275-Y292 HydrophobicContact CZ-CD1 3.75Å; F275-Y292 HydrophobicContact CZ-CE1 4.44Å; F275-Y292 HydrophobicContact CZ-CG 4.32Å; F275-L312 HydrophobicContact CE2-CD1 4.44Å; F275-L312 HydrophobicContact CE2-CD2 4.27Å; F275-L312 HydrophobicContact CZ-CD1 4.37Å
276	Y	91.6	Very high	95.4	Very high	74 Å²	74	43.6 Å²	43.6	29%	0.29	22%	0.218	S	C	.	.			trans	-142.3	135.8	175.2	176.7	-123.6	0	0	0	110.7	K286 Y379	Y276-K286 PolarHBondContact O-NZ 2.89Å; Y276-Y379 AromaticContact CD2-CD1 3.77Å; Y276-Y379 HydrophobicContact CD2-CD1 3.77Å; Y276-Y379 AromaticContact CD2-CD2 3.83Å; Y276-Y379 HydrophobicContact CD2-CD2 3.83Å; Y276-Y379 AromaticContact CD2-CE1 3.63Å; Y276-Y379 HydrophobicContact CD2-CE1 3.63Å; Y276-Y379 AromaticContact CD2-CE2 3.64Å; Y276-Y379 HydrophobicContact CD2-CE2 3.64Å; Y276-Y379 AromaticContact CD2-CG 3.82Å; Y276-Y379 HydrophobicContact CD2-CG 3.82Å; Y276-Y379 AromaticContact CD2-CZ 3.51Å; Y276-Y379 AromaticContact CE2-CD1 3.73Å; Y276-Y379 HydrophobicContact CE2-CD1 3.73Å; Y276-Y379 AromaticContact CE2-CD2 3.03Å; Y276-Y379 HydrophobicContact CE2-CD2 3.03Å; Y276-Y379 AromaticContact CE2-CE1 3.89Å; Y276-Y379 HydrophobicContact CE2-CE1 3.89Å; Y276-Y379 AromaticContact CE2-CE2 3.18Å; Y276-Y379 HydrophobicContact CE2-CE2 3.18Å; Y276-Y379 AromaticContact CE2-CG 3.26Å; Y276-Y379 HydrophobicContact CE2-CG 3.26Å; Y276-Y379 AromaticContact CE2-CZ 3.6Å; Y276-Y379 AromaticContact CZ-CD2 3.71Å; Y276-Y379 AromaticContact CZ-CG 3.73Å
277	D	93.4	Very high	95.3	Very high	36 Å²	36	43.5 Å²	43.5	19%	0.193	22%	0.217	C	C	.	.			trans	-155.9	149.8	167.1	-150.9	-72.3	0	0	0	109.9	I279 E282 L283 K286	D277-I279 VanDerWaalsContact C-N 3.29Å; D277-I279 PolarHBondContact OD1-N 3.4Å; D277-E282 HydrophobicContact CB-CB 3.99Å; D277-E282 VanDerWaalsContact CG-CB 3.45Å; D277-L283 HydrophobicContact CB-CB 4.02Å; D277-K286 HydrophobicContact CB-CD 4.49Å; D277-K286 IonicContact OD2-NZ 2.6Å; D277-K286 PolarHBondContact OD2-NZ 2.75Å
278	S	91.1	Very high	95.3	Very high	100 Å²	100	48.7 Å²	48.7	70%	0.699	24%	0.24	S	C	*	.	S	Bend	trans	-70.9	-28.3	173.1	65.9	0	0	0	0	112
279	I	92.8	Very high	95.2	Very high	87 Å²	87	51.2 Å²	51.2	45%	0.446	26%	0.261	S	S	.	.	S	Bend	trans	-95.7	117.7	179.6	-58.5	175.4	0	0	0	108.7	D277 Q281 E282 L283	D277-I279 VanDerWaalsContact C-N 3.29Å; D277-I279 PolarHBondContact OD1-N 3.4Å; I279-Q281 HydrophobicContact CG2-CB 4.17Å; I279-Q281 PolarHBondContact O-N 3.49Å; I279-Q281 VanDerWaalsContact O-N 3.14Å; I279-E282 HydrophobicContact CB-CB 4.22Å; I279-E282 HydrophobicContact CB-CG 4.2Å; I279-E282 HydrophobicContact CG2-CG 4.31Å; I279-E282 PolarHBondContact O-N 2.89Å; I279-L283 PolarHBondContact O-N 3Å
280	P	91.3	Very high	95.1	Very high	64 Å²	64	52.1 Å²	52.1	42%	0.416	27%	0.269	S	S	.	.	H	α-helix	trans	-55.6	-35.3	-178.3	-28.1	35.6	0	0	0	114.2	L283 F284	P280-L283 PolarHBondContact O-N 3.04Å; P280-F284 HydrophobicContact CB-CE2 4.49Å; P280-F284 VanDerWaalsContact O-CD2 3.26Å; P280-F284 WeakPolarHBondContact O-CD2 3.32Å; P280-F284 WeakPolarHBondContact O-CG 3.39Å; P280-F284 PolarHBondContact O-N 3.14Å
281	Q	93.6	Very high	95.2	Very high	131 Å²	131	55.8 Å²	55.8	61%	0.612	29%	0.286	S	S	*	.	H	α-helix	trans	-63.8	-42	177.5	-64.9	83	-10.2	0	0	111.8	I279 F284 R285	I279-Q281 HydrophobicContact CG2-CB 4.17Å; I279-Q281 PolarHBondContact O-N 3.49Å; I279-Q281 VanDerWaalsContact O-N 3.14Å; Q281-F284 PolarHBondContact O-N 2.88Å; Q281-R285 PolarHBondContact O-N 3.17Å
282	E	95.4	Very high	95.3	Very high	73 Å²	73	57.9 Å²	57.9	34%	0.341	29%	0.292	S	S	.	.	H	α-helix	trans	-71.9	-37.8	177.4	-71.1	-52.5	128.1	0	0	111.9	D277 I279 F284 R285 K286	D277-E282 HydrophobicContact CB-CB 3.99Å; D277-E282 VanDerWaalsContact CG-CB 3.45Å; I279-E282 HydrophobicContact CB-CB 4.22Å; I279-E282 HydrophobicContact CB-CG 4.2Å; I279-E282 HydrophobicContact CG2-CG 4.31Å; I279-E282 PolarHBondContact O-N 2.89Å; E282-F284 VanDerWaalsContact C-N 3.32Å; E282-F284 PolarHBondContact O-N 2.74Å; E282-R285 WeakPolarHBondContact O-CB 3.27Å; E282-R285 PolarHBondContact O-N 3.04Å; E282-R285 IonicContact OE2-CZ 2.97Å; E282-R285 IonicContact OE2-NE 3.31Å; E282-R285 PolarHBondContact OE2-NE 3.41Å; E282-K286 WeakPolarHBondContact O-CG 3.37Å; E282-K286 PolarHBondContact O-N 3.17Å
283	L	94.8	Very high	95.3	Very high	6 Å²	6	59 Å²	59	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-56	-48.9	170.5	174.3	62.4	0	0	0	110.7	P238 F275 D277 I279 P280 R285 K286 I287	P238-L283 HydrophobicContact CB-CD2 4.33Å; F275-L283 HydrophobicContact CB-CD1 3.81Å; F275-L283 WeakPolarHBondContact O-CD1 3.33Å; D277-L283 HydrophobicContact CB-CB 4.02Å; I279-L283 PolarHBondContact O-N 3Å; P280-L283 PolarHBondContact O-N 3.04Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 3.42Å; L283-K286 PolarHBondContact O-N 2.98Å; L283-I287 HydrophobicContact CD1-CD1 4.07Å; L283-I287 HydrophobicContact CD1-CG1 4.43Å; L283-I287 HydrophobicContact CG-CD1 4.02Å; L283-I287 WeakPolarHBondContact O-CG1 3.42Å; L283-I287 PolarHBondContact O-N 3.42Å
284	F	95.3	Very high	95.2	Very high	65 Å²	65	59.7 Å²	59.7	29%	0.285	31%	0.312	S	S	.	.	H	α-helix	trans	-67.7	-31.5	178.6	-62.3	-24.1	0	0	0	112.9	P238 I241 L246 P280 Q281 E282 I287 K288	P238-F284 HydrophobicContact CB-CE1 4.12Å; P238-F284 HydrophobicContact CB-CZ 4.46Å; I241-F284 HydrophobicContact CG2-CE1 4.33Å; L246-F284 HydrophobicContact CD1-CB 4.07Å; L246-F284 HydrophobicContact CD1-CD1 3.91Å; L246-F284 HydrophobicContact CD1-CG 4.17Å; L246-F284 HydrophobicContact CD2-CD1 4.04Å; L246-F284 HydrophobicContact CD2-CE1 4.22Å; L246-F284 HydrophobicContact CD2-CG 4.22Å; P280-F284 HydrophobicContact CB-CE2 4.49Å; P280-F284 VanDerWaalsContact O-CD2 3.26Å; P280-F284 WeakPolarHBondContact O-CD2 3.32Å; P280-F284 WeakPolarHBondContact O-CG 3.39Å; P280-F284 PolarHBondContact O-N 3.14Å; Q281-F284 PolarHBondContact O-N 2.88Å; E282-F284 VanDerWaalsContact C-N 3.32Å; E282-F284 PolarHBondContact O-N 2.74Å; F284-I287 HydrophobicContact CD1-CD1 4.3Å; F284-K288 WeakPolarHBondContact O-CB 3.37Å; F284-K288 VanDerWaalsContact O-CG 3.26Å; F284-K288 WeakPolarHBondContact O-CG 3.4Å; F284-K288 PolarHBondContact O-N 3.22Å
285	R	97.1	Very high	95	Very high	102 Å²	102	61.1 Å²	61.1	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-49.7	171.9	-168.7	-162.4	66.5	68.4	0.2	110.7	Q281 E282 L283 I287 K288 A289 E291	Q281-R285 PolarHBondContact O-N 3.17Å; E282-R285 WeakPolarHBondContact O-CB 3.27Å; E282-R285 PolarHBondContact O-N 3.04Å; E282-R285 IonicContact OE2-CZ 2.97Å; E282-R285 IonicContact OE2-NE 3.31Å; E282-R285 PolarHBondContact OE2-NE 3.41Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 3.42Å; R285-I287 PolarHBondContact O-N 3.09Å; R285-K288 PolarHBondContact O-N 3.45Å; R285-A289 WeakPolarHBondContact O-CB 3.43Å; R285-A289 PolarHBondContact O-N 3.34Å; R285-E291 IonicContact CZ-OE2 2.72Å; R285-E291 VanDerWaalsContact CZ-OE2 3.22Å; R285-E291 IonicContact NH1-OE2 3.91Å; R285-E291 PolarHBondContact NH1-OE2 2.93Å; R285-E291 IonicContact NH2-OE1 2.76Å; R285-E291 PolarHBondContact NH2-OE1 3.23Å; R285-E291 IonicContact NH2-OE2 3.01Å; R285-E291 PolarHBondContact NH2-OE2 2.64Å
286	K	97.3	Very high	94.6	Very high	44 Å²	44	70.6 Å²	70.6	19%	0.191	37%	0.366	C	S	.	.	H	α-helix	trans	-57.8	-45.7	176.6	-74.3	169	169.4	167.6	0	111.8	F275 Y276 D277 E282 L283 A289 A290 E291	F275-K286 HydrophobicContact CD1-CB 4.37Å; Y276-K286 PolarHBondContact O-NZ 2.89Å; D277-K286 HydrophobicContact CB-CD 4.49Å; D277-K286 IonicContact OD2-NZ 2.6Å; D277-K286 PolarHBondContact OD2-NZ 2.75Å; E282-K286 WeakPolarHBondContact O-CG 3.37Å; E282-K286 PolarHBondContact O-N 3.17Å; L283-K286 PolarHBondContact O-N 2.98Å; K286-A289 CarbonylContact O-C 3.57Å; K286-A289 PolarHBondContact O-N 2.92Å; K286-A290 PolarHBondContact O-N 2.93Å; K286-E291 HydrophobicContact CB-CB 4.37Å; K286-E291 HydrophobicContact CG-CB 4.45Å; K286-E291 PolarHBondContact O-N 2.92Å
287	I	97.4	Very high	94.4	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-47.6	176.5	-68.9	168.6	0	0	0	111.3	P238 I241 L246 W259 F275 L283 F284 R285 A289 A290	P238-I287 WeakPolarHBondContact O-CD1 3.22Å; I241-I287 HydrophobicContact CG2-CD1 4.12Å; I241-I287 WeakPolarHBondContact O-CG2 3.32Å; L246-I287 HydrophobicContact CD1-CB 4.02Å; L246-I287 HydrophobicContact CD1-CD1 4.4Å; L246-I287 HydrophobicContact CD1-CG2 3.61Å; W259-I287 HydrophobicContact CZ2-CG2 3.93Å; F275-I287 HydrophobicContact CB-CG1 3.77Å; F275-I287 HydrophobicContact CD1-CG1 4.33Å; F275-I287 HydrophobicContact CD2-CG1 3.81Å; F275-I287 HydrophobicContact CG-CG1 3.69Å; L283-I287 HydrophobicContact CD1-CD1 4.07Å; L283-I287 HydrophobicContact CD1-CG1 4.43Å; L283-I287 HydrophobicContact CG-CD1 4.02Å; L283-I287 WeakPolarHBondContact O-CG1 3.42Å; L283-I287 PolarHBondContact O-N 3.42Å; F284-I287 HydrophobicContact CD1-CD1 4.3Å; R285-I287 PolarHBondContact O-N 3.09Å; I287-A289 PolarHBondContact O-N 2.99Å; I287-A290 PolarHBondContact O-N 2.77Å; I287-A290 VanDerWaalsContact O-N 3.09Å
288	K	96.6	Very high	94.1	Very high	109 Å²	109	71.7 Å²	71.7	47%	0.474	40%	0.395	S	S	.	.	H	α-helix	trans	-64.9	-25.9	179.6	-75.1	178.3	-178.8	-171.1	0	113.6	L246 F284 R285 L314	L246-K288 VanDerWaalsContact CB-CE 3.43Å; L246-K288 HydrophobicContact CB-CG 4.31Å; L246-K288 HydrophobicContact CD1-CG 4.35Å; L246-K288 WeakPolarHBondContact O-CE 3.41Å; L246-K288 PolarHBondContact O-NZ 3.05Å; F284-K288 WeakPolarHBondContact O-CB 3.37Å; F284-K288 VanDerWaalsContact O-CG 3.26Å; F284-K288 WeakPolarHBondContact O-CG 3.4Å; F284-K288 PolarHBondContact O-N 3.22Å; R285-K288 PolarHBondContact O-N 3.45Å; K288-L314 VanDerWaalsContact O-CD2 3.32Å; K288-L314 WeakPolarHBondContact O-CD2 2.96Å
289	A	97	Very high	94.1	Very high	54 Å²	54	71.7 Å²	71.7	45%	0.446	38%	0.38	S	S	.	.	H	α-helix	trans	-91.4	-5.8	175.9	0	0	0	0	0	113.3	R285 K286 I287 E291	R285-A289 WeakPolarHBondContact O-CB 3.43Å; R285-A289 PolarHBondContact O-N 3.34Å; K286-A289 CarbonylContact O-C 3.57Å; K286-A289 PolarHBondContact O-N 2.92Å; I287-A289 PolarHBondContact O-N 2.99Å; A289-E291 HydrophobicContact CB-CB 4.15Å; A289-E291 PolarHBondContact O-N 2.83Å
290	A	97.1	Very high	94.3	Very high	24 Å²	24	68.5 Å²	68.5	20%	0.198	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	42.5	-166.4	0	0	0	0	0	112.1	W259 K286 I287 Y292 L314	W259-A290 HydrophobicContact CH2-CB 4.18Å; K286-A290 PolarHBondContact O-N 2.93Å; I287-A290 PolarHBondContact O-N 2.77Å; I287-A290 VanDerWaalsContact O-N 3.09Å; A290-Y292 VanDerWaalsContact O-CD1 3.28Å; A290-Y292 WeakPolarHBondContact O-CD1 3.45Å; A290-Y292 PolarHBondContact O-N 2.92Å; A290-L314 HydrophobicContact CB-CD1 4.49Å; A290-L314 HydrophobicContact CB-CD2 3.68Å; A290-L314 HydrophobicContact CB-CG 3.9Å
291	E	97	Very high	94.5	Very high	93 Å²	93	67.3 Å²	67.3	44%	0.435	36%	0.357	S	S	.	.			trans	-86.2	93.7	-177.7	-171	-176.1	155.4	0	0	110.3	F275 R285 K286 A289	F275-E291 WeakPolarHBondContact CD1-O 3.39Å; R285-E291 IonicContact CZ-OE2 2.72Å; R285-E291 VanDerWaalsContact CZ-OE2 3.22Å; R285-E291 IonicContact NH1-OE2 3.91Å; R285-E291 PolarHBondContact NH1-OE2 2.93Å; R285-E291 IonicContact NH2-OE1 2.76Å; R285-E291 PolarHBondContact NH2-OE1 3.23Å; R285-E291 IonicContact NH2-OE2 3.01Å; R285-E291 PolarHBondContact NH2-OE2 2.64Å; K286-E291 HydrophobicContact CB-CB 4.37Å; K286-E291 HydrophobicContact CG-CB 4.45Å; K286-E291 PolarHBondContact O-N 2.92Å; A289-E291 HydrophobicContact CB-CB 4.15Å; A289-E291 PolarHBondContact O-N 2.83Å
292	Y	96.8	Very high	94.6	Very high	53 Å²	53	66.7 Å²	66.7	21%	0.208	35%	0.354	C	S	.	.			trans	-144	155.3	174	68.6	-78.4	0	0	0	110.3	F266 P274 F275 A290 I294 I308 R309 L312	F266-Y292 HydrophobicContact CD2-CD2 4.41Å; F266-Y292 HydrophobicContact CE2-CD2 4.09Å; P274-Y292 HydrophobicContact CB-CD2 4.26Å; P274-Y292 HydrophobicContact CB-CG 4.14Å; P274-Y292 WeakPolarHBondContact O-CB 3.33Å; F275-Y292 AromaticContact CE1-CD1 3.66Å; F275-Y292 HydrophobicContact CE1-CD1 3.66Å; F275-Y292 HydrophobicContact CE1-CG 4.12Å; F275-Y292 AromaticContact CZ-CD1 3.75Å; F275-Y292 HydrophobicContact CZ-CD1 3.75Å; F275-Y292 HydrophobicContact CZ-CE1 4.44Å; F275-Y292 HydrophobicContact CZ-CG 4.32Å; A290-Y292 VanDerWaalsContact O-CD1 3.28Å; A290-Y292 WeakPolarHBondContact O-CD1 3.45Å; A290-Y292 PolarHBondContact O-N 2.92Å; Y292-I294 HydrophobicContact CD2-CG1 4.2Å; Y292-I294 HydrophobicContact CE2-CD1 4.01Å; Y292-I294 HydrophobicContact CE2-CG1 3.9Å; Y292-I308 HydrophobicContact CE2-CG2 4.13Å; Y292-R309 WeakPolarHBondContact OH-CA 3.35Å; Y292-L312 HydrophobicContact CD1-CD1 4.34Å; Y292-L312 HydrophobicContact CD2-CD1 4.33Å; Y292-L312 HydrophobicContact CE1-CB 3.79Å; Y292-L312 HydrophobicContact CE1-CD1 4Å; Y292-L312 HydrophobicContact CE2-CD1 3.98Å
293	S	95.5	Very high	94.6	Very high	96 Å²	96	68.1 Å²	68.1	67%	0.671	36%	0.364	S	S	*	.			trans	-117.4	141.3	174	56.5	0	0	0	0	110.5
294	I	94.8	Very high	94.7	Very high	29 Å²	29	67.8 Å²	67.8	15%	0.149	36%	0.363	C	S	.	.			trans	-99	123.1	172	-66.3	177.2	0	0	0	106.9	F266 Y270 Y292 E296 V305 I308 R309	F266-I294 HydrophobicContact CD2-CG1 4.45Å; F266-I294 HydrophobicContact CE2-CG1 4Å; Y270-I294 HydrophobicContact CE2-CG2 4.29Å; Y270-I294 VanDerWaalsContact OH-CG2 3.23Å; Y270-I294 WeakPolarHBondContact OH-CG2 3.47Å; Y292-I294 HydrophobicContact CD2-CG1 4.2Å; Y292-I294 HydrophobicContact CE2-CD1 4.01Å; Y292-I294 HydrophobicContact CE2-CG1 3.9Å; I294-E296 PolarHBondContact O-N 3.04Å; I294-V305 HydrophobicContact CD1-CG1 3.74Å; I294-V305 HydrophobicContact CG2-CG1 4.46Å; I294-V305 HydrophobicContact CG2-CG2 4.12Å; I294-I308 HydrophobicContact CD1-CB 4.44Å; I294-I308 HydrophobicContact CD1-CG2 4.18Å; I294-R309 HydrophobicContact CD1-CG 4.29Å
295	P	92.1	Very high	94.8	Very high	43 Å²	43	65.1 Å²	65.1	28%	0.279	35%	0.351	S	S	.	.			trans	-58.9	130.4	176.6	-25.7	35.2	0	0	0	112.5	Y270 D297	Y270-P295 HydrophobicContact CD1-CG 3.92Å; Y270-P295 HydrophobicContact CE1-CB 4.45Å; Y270-P295 HydrophobicContact CE1-CG 4.17Å; P295-D297 WeakPolarHBondContact CB-OD2 3.22Å; P295-D297 PolarHBondContact O-N 3.3Å; P295-D297 VanDerWaalsContact O-N 3.1Å
296	E	88.3	Confident	94.8	Very high	199 Å²	199	62.4 Å²	62.4	93%	0.93	35%	0.348	S	S	*	.			trans	-87	53.5	177.9	-63.8	-176.4	-179.9	0	0	111.6	I294	I294-E296 PolarHBondContact O-N 3.04Å
297	D	88.7	Confident	94.8	Very high	57 Å²	57	60.6 Å²	60.6	31%	0.305	34%	0.34	S	S	.	.	S	Bend	trans	-95.1	-1.3	-174.6	57.3	36.9	0	0	0	114	P295 R299	P295-D297 WeakPolarHBondContact CB-OD2 3.22Å; P295-D297 PolarHBondContact O-N 3.3Å; P295-D297 VanDerWaalsContact O-N 3.1Å; D297-R299 HydrophobicContact CB-CG 4.2Å; D297-R299 PolarHBondContact O-N 3.02Å; D297-R299 WeakPolarHBondContact OD1-CB 3.04Å; D297-R299 VanDerWaalsContact OD1-CG 3.29Å; D297-R299 WeakPolarHBondContact OD1-CG 3.43Å; D297-R299 PolarHBondContact OD1-N 3.26Å; D297-R299 IonicContact OD1-NE 3.49Å; D297-R299 PolarHBondContact OD1-NE 3.26Å; D297-R299 IonicContact OD2-CZ 3.98Å; D297-R299 IonicContact OD2-NE 2.75Å; D297-R299 PolarHBondContact OD2-NE 2.98Å; D297-R299 IonicContact OD2-NH2 2.76Å; D297-R299 PolarHBondContact OD2-NH2 3.09Å
298	G	86.9	Confident	94.9	Very high	77 Å²	77	60.6 Å²	60.6	79%	0.794	34%	0.34	S	S	*	.	S	Bend	trans	69.6	6.2	-178.8	0	0	0	0	0	115.3
299	R	91.3	Very high	94.9	Very high	100 Å²	100	60.8 Å²	60.8	38%	0.377	34%	0.338	S	S	.	.	S	Bend	trans	-80.5	-20.2	-176.7	-59.6	-176.9	-70	-144.9	7.7	113.6	R169 D297 E369	R169-R299 VanDerWaalsContact CZ-CZ 3.49Å; D297-R299 HydrophobicContact CB-CG 4.2Å; D297-R299 PolarHBondContact O-N 3.02Å; D297-R299 WeakPolarHBondContact OD1-CB 3.04Å; D297-R299 VanDerWaalsContact OD1-CG 3.29Å; D297-R299 WeakPolarHBondContact OD1-CG 3.43Å; D297-R299 PolarHBondContact OD1-N 3.26Å; D297-R299 IonicContact OD1-NE 3.49Å; D297-R299 PolarHBondContact OD1-NE 3.26Å; D297-R299 IonicContact OD2-CZ 3.98Å; D297-R299 IonicContact OD2-NE 2.75Å; D297-R299 PolarHBondContact OD2-NE 2.98Å; D297-R299 IonicContact OD2-NH2 2.76Å; D297-R299 PolarHBondContact OD2-NH2 3.09Å; R299-E369 IonicContact NH1-OE1 3.26Å
300	V	95.6	Very high	95	Very high	20 Å²	20	63 Å²	63	12%	0.121	34%	0.337	C	S	.	.	S	Bend	trans	-121.3	130.5	-178.6	-177	0	0	0	0	108.6	L269 Y270 T304 V305	L269-V300 HydrophobicContact CB-CG2 4.29Å; L269-V300 HydrophobicContact CD1-CG1 4.11Å; L269-V300 HydrophobicContact CD1-CG2 4.47Å; L269-V300 HydrophobicContact CD2-CG2 4.11Å; Y270-V300 HydrophobicContact CE1-CG2 3.92Å; Y270-V300 WeakPolarHBondContact OH-CB 3.41Å; Y270-V300 WeakPolarHBondContact OH-CG2 3.44Å; V300-T304 HydrophobicContact CG1-CG2 3.61Å; V300-V305 HydrophobicContact CB-CG2 4.31Å; V300-V305 HydrophobicContact CG1-CG2 3.93Å
301	S	95.6	Very high	95.1	Very high	38 Å²	38	61.9 Å²	61.9	27%	0.266	33%	0.328	S	S	.	.			trans	-65.3	152.2	179.4	73.6	0	0	0	0	112.6	E172 N303 T304 V305	E172-S301 VanDerWaalsContact CD-N 3.31Å; E172-S301 VanDerWaalsContact OE1-CB 3.24Å; E172-S301 WeakPolarHBondContact OE1-CB 3.46Å; E172-S301 PolarHBondContact OE1-N 3.43Å; E172-S301 PolarHBondContact OE1-OG 2.85Å; E172-S301 PolarHBondContact OE2-N 3.42Å; E172-S301 VanDerWaalsContact OE2-N 3.1Å; S301-N303 PolarHBondContact O-N 3.1Å; S301-N303 VanDerWaalsContact O-N 3.15Å; S301-T304 PolarHBondContact O-N 3.46Å; S301-T304 PolarHBondContact OG-N 2.85Å; S301-T304 PolarHBondContact OG-OG1 2.89Å; S301-V305 WeakPolarHBondContact O-CG2 3.32Å; S301-V305 PolarHBondContact O-N 3.09Å
302	E	95.4	Very high	95.1	Very high	118 Å²	118	57.6 Å²	57.6	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-59.6	-28.9	177.3	-171.5	57.3	-151.6	0	0	112.2	V305 C306 R309	E302-V305 PolarHBondContact O-N 2.9Å; E302-C306 WeakPolarHBondContact O-CB 3.36Å; E302-C306 PolarHBondContact O-N 3.37Å; E302-R309 IonicContact OE1-CZ 3.89Å; E302-R309 IonicContact OE1-NH1 2.74Å; E302-R309 PolarHBondContact OE1-NH1 2.93Å
303	N	95.8	Very high	95.2	Very high	103 Å²	103	57 Å²	57	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-63	-44.7	175.9	-69	-24.5	0	0	0	111.7	S301 L307 I332	S301-N303 PolarHBondContact O-N 3.1Å; S301-N303 VanDerWaalsContact O-N 3.15Å; N303-L307 PolarHBondContact O-N 3.02Å; N303-L307 VanDerWaalsContact O-N 3.15Å; N303-I332 HydrophobicContact CB-CD1 4.07Å; N303-I332 HydrophobicContact CB-CG1 3.96Å
304	T	96.9	Very high	95.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-71.9	-39.3	177.5	-61.1	0	0	0	0	111.6	E172 I176 L265 L269 V300 S301 C306 L307 I308	E172-T304 WeakPolarHBondContact OE1-CB 3.47Å; E172-T304 PolarHBondContact OE1-OG1 2.59Å; I176-T304 HydrophobicContact CD1-CG2 3.81Å; L265-T304 HydrophobicContact CD2-CG2 4.43Å; L269-T304 HydrophobicContact CD1-CG2 3.63Å; V300-T304 HydrophobicContact CG1-CG2 3.61Å; S301-T304 PolarHBondContact O-N 3.46Å; S301-T304 PolarHBondContact OG-N 2.85Å; S301-T304 PolarHBondContact OG-OG1 2.89Å; T304-C306 VanDerWaalsContact C-N 3.32Å; T304-C306 PolarHBondContact O-N 2.98Å; T304-L307 WeakPolarHBondContact O-CB 3.12Å; T304-L307 PolarHBondContact O-N 3.45Å; T304-L307 VanDerWaalsContact O-N 3.14Å; T304-I308 PolarHBondContact O-N 3.49Å; T304-I308 VanDerWaalsContact O-N 3.09Å
305	V	97.3	Very high	95.4	Very high	8 Å²	8	58.2 Å²	58.2	5%	0.048	31%	0.309	C	S	.	.	H	α-helix	trans	-59.3	-44.1	173.2	167.5	0	0	0	0	111.2	I294 V300 S301 E302 L307 I308 R309	I294-V305 HydrophobicContact CD1-CG1 3.74Å; I294-V305 HydrophobicContact CG2-CG1 4.46Å; I294-V305 HydrophobicContact CG2-CG2 4.12Å; V300-V305 HydrophobicContact CB-CG2 4.31Å; V300-V305 HydrophobicContact CG1-CG2 3.93Å; S301-V305 WeakPolarHBondContact O-CG2 3.32Å; S301-V305 PolarHBondContact O-N 3.09Å; E302-V305 PolarHBondContact O-N 2.9Å; V305-L307 VanDerWaalsContact C-N 3.27Å; V305-L307 PolarHBondContact O-N 2.82Å; V305-I308 PolarHBondContact O-N 2.8Å; V305-R309 VanDerWaalsContact CG1-CZ 3.42Å; V305-R309 WeakPolarHBondContact O-CG 3.45Å; V305-R309 PolarHBondContact O-N 3.44Å
306	C	97.1	Very high	95.6	Very high	46 Å²	46	58.1 Å²	58.1	31%	0.311	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-39.3	174.9	-177.5	0	0	0	0	111.5	E302 T304 R309 K310	E302-C306 WeakPolarHBondContact O-CB 3.36Å; E302-C306 PolarHBondContact O-N 3.37Å; T304-C306 VanDerWaalsContact C-N 3.32Å; T304-C306 PolarHBondContact O-N 2.98Å; C306-R309 PolarHBondContact O-N 3.3Å; C306-K310 WeakPolarHBondContact O-CB 3.42Å; C306-K310 WeakPolarHBondContact O-CG 3.47Å; C306-K310 PolarHBondContact O-N 2.82Å
307	L	97.9	Very high	95.9	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-44.8	175.9	-167.5	64.2	0	0	0	112.2	F179 L265 N303 T304 V305 R309 K310 L311 L320 V325 L329	F179-L307 HydrophobicContact CE1-CD2 4.43Å; L265-L307 HydrophobicContact CD2-CD2 3.97Å; L265-L307 HydrophobicContact CD2-CG 4.35Å; N303-L307 PolarHBondContact O-N 3.02Å; N303-L307 VanDerWaalsContact O-N 3.15Å; T304-L307 WeakPolarHBondContact O-CB 3.12Å; T304-L307 PolarHBondContact O-N 3.45Å; T304-L307 VanDerWaalsContact O-N 3.14Å; V305-L307 VanDerWaalsContact C-N 3.27Å; V305-L307 PolarHBondContact O-N 2.82Å; L307-R309 VanDerWaalsContact C-N 3.35Å; L307-R309 PolarHBondContact O-N 3.18Å; L307-K310 PolarHBondContact O-N 2.77Å; L307-L311 HydrophobicContact CG-CD1 4.37Å; L307-L311 WeakPolarHBondContact O-CG 3.47Å; L307-L311 PolarHBondContact O-N 2.77Å; L307-L320 HydrophobicContact CD1-CD1 3.76Å; L307-V325 HydrophobicContact CD1-CB 4.46Å; L307-V325 HydrophobicContact CD1-CG1 4.12Å; L307-V325 HydrophobicContact CD1-CG2 4.31Å; L307-V325 HydrophobicContact CD2-CG1 4.2Å; L307-V325 HydrophobicContact CG-CG1 4.5Å; L307-L329 HydrophobicContact CD2-CD2 3.53Å; L307-L329 HydrophobicContact CD2-CG 3.86Å
308	I	98.3	Very high	96.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.2	-48.7	174.7	-64.2	171.3	0	0	0	110.2	L265 F266 L269 Y270 Y292 I294 T304 V305 K310 L311 L312	L265-I308 HydrophobicContact CD2-CG1 3.8Å; L265-I308 HydrophobicContact CG-CD1 4.49Å; L265-I308 HydrophobicContact CG-CG1 4.04Å; F266-I308 HydrophobicContact CB-CD1 4.48Å; F266-I308 HydrophobicContact CB-CG2 4.48Å; F266-I308 HydrophobicContact CD2-CD1 4.4Å; F266-I308 HydrophobicContact CD2-CG2 4.16Å; L269-I308 HydrophobicContact CD1-CD1 3.86Å; Y270-I308 HydrophobicContact CE2-CD1 4.07Å; Y292-I308 HydrophobicContact CE2-CG2 4.13Å; I294-I308 HydrophobicContact CD1-CB 4.44Å; I294-I308 HydrophobicContact CD1-CG2 4.18Å; T304-I308 PolarHBondContact O-N 3.49Å; T304-I308 VanDerWaalsContact O-N 3.09Å; V305-I308 PolarHBondContact O-N 2.8Å; I308-K310 VanDerWaalsContact C-N 3.29Å; I308-K310 PolarHBondContact O-N 3.35Å; I308-L311 PolarHBondContact O-N 2.64Å; I308-L311 VanDerWaalsContact O-N 3.13Å; I308-L312 HydrophobicContact CG2-CD1 3.83Å; I308-L312 HydrophobicContact CG2-CG 4.38Å; I308-L312 PolarHBondContact O-N 2.68Å
309	R	98.2	Very high	96.9	Very high	114 Å²	114	56.2 Å²	56.2	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-59.7	-39.1	-179.6	-71.6	178.7	-178.2	139.5	1.1	112.3	Y292 I294 E302 V305 C306 L307 V313	Y292-R309 WeakPolarHBondContact OH-CA 3.35Å; I294-R309 HydrophobicContact CD1-CG 4.29Å; E302-R309 IonicContact OE1-CZ 3.89Å; E302-R309 IonicContact OE1-NH1 2.74Å; E302-R309 PolarHBondContact OE1-NH1 2.93Å; V305-R309 VanDerWaalsContact CG1-CZ 3.42Å; V305-R309 WeakPolarHBondContact O-CG 3.45Å; V305-R309 PolarHBondContact O-N 3.44Å; C306-R309 PolarHBondContact O-N 3.3Å; L307-R309 VanDerWaalsContact C-N 3.35Å; L307-R309 PolarHBondContact O-N 3.18Å; R309-V313 WeakPolarHBondContact O-CG1 3.48Å
310	K	98.3	Very high	97.2	Very high	100 Å²	100	52.4 Å²	52.4	44%	0.435	26%	0.263	S	S	.	.	H	α-helix	trans	-75.4	-19.9	178.2	-72.1	-177.5	176.8	-178.6	0	114.3	C306 L307 I308 L320	C306-K310 WeakPolarHBondContact O-CB 3.42Å; C306-K310 WeakPolarHBondContact O-CG 3.47Å; C306-K310 PolarHBondContact O-N 2.82Å; L307-K310 PolarHBondContact O-N 2.77Å; I308-K310 VanDerWaalsContact C-N 3.29Å; I308-K310 PolarHBondContact O-N 3.35Å; K310-L320 HydrophobicContact CB-CD1 3.51Å; K310-L320 HydrophobicContact CB-CG 3.84Å; K310-L320 HydrophobicContact CD-CD1 3.78Å; K310-L320 HydrophobicContact CD-CD2 4.42Å; K310-L320 HydrophobicContact CD-CG 4.24Å; K310-L320 HydrophobicContact CG-CD1 4.3Å; K310-L320 PolarHBondContact O-N 2.69Å
311	L	98.6	Very high	97.3	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-86.1	-40.2	172.7	-73	171.5	0	0	0	112.1	F179 M258 L307 I308 V313 R319 L320 V325	F179-L311 HydrophobicContact CE1-CD1 4.43Å; F179-L311 HydrophobicContact CZ-CD1 4.15Å; M258-L311 HydrophobicContact CB-CD2 4.11Å; M258-L311 HydrophobicContact CE-CD2 3.9Å; L307-L311 HydrophobicContact CG-CD1 4.37Å; L307-L311 WeakPolarHBondContact O-CG 3.47Å; L307-L311 PolarHBondContact O-N 2.77Å; I308-L311 PolarHBondContact O-N 2.64Å; I308-L311 VanDerWaalsContact O-N 3.13Å; L311-V313 PolarHBondContact O-N 3.08Å; L311-R319 VanDerWaalsContact O-CD 3.24Å; L311-R319 WeakPolarHBondContact O-CD 3.43Å; L311-R319 WeakPolarHBondContact O-CG 3.29Å; L311-R319 PolarHBondContact O-NE 2.75Å; L311-L320 HydrophobicContact CD2-CB 4.45Å; L311-V325 HydrophobicContact CD2-CG2 3.77Å; L311-V325 HydrophobicContact CG-CG2 4.45Å
312	L	98.5	Very high	97.5	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.267	C	S	.	.	S	Bend	trans	-90	44.1	-179.5	-61.4	-178.3	0	0	0	112.3	W259 V263 P274 F275 Y292 I308	W259-L312 HydrophobicContact CD2-CD2 3.88Å; W259-L312 HydrophobicContact CE3-CD2 4.06Å; W259-L312 HydrophobicContact CG-CD2 4.39Å; W259-L312 HydrophobicContact CH2-CB 4.5Å; W259-L312 HydrophobicContact CH2-CD2 4.36Å; W259-L312 HydrophobicContact CZ2-CD2 4.17Å; W259-L312 VanDerWaalsContact CZ3-C 3.49Å; W259-L312 HydrophobicContact CZ3-CB 4.23Å; W259-L312 HydrophobicContact CZ3-CD2 4.3Å; V263-L312 HydrophobicContact CG2-CD2 3.96Å; P274-L312 HydrophobicContact CB-CD1 4.16Å; P274-L312 HydrophobicContact CG-CD1 4.24Å; F275-L312 HydrophobicContact CE2-CD1 4.44Å; F275-L312 HydrophobicContact CE2-CD2 4.27Å; F275-L312 HydrophobicContact CZ-CD1 4.37Å; Y292-L312 HydrophobicContact CD1-CD1 4.34Å; Y292-L312 HydrophobicContact CD2-CD1 4.33Å; Y292-L312 HydrophobicContact CE1-CB 3.79Å; Y292-L312 HydrophobicContact CE1-CD1 4Å; Y292-L312 HydrophobicContact CE2-CD1 3.98Å; I308-L312 HydrophobicContact CG2-CD1 3.83Å; I308-L312 HydrophobicContact CG2-CG 4.38Å; I308-L312 PolarHBondContact O-N 2.68Å
313	V	97.8	Very high	97.6	Very high	39 Å²	39	48 Å²	48	24%	0.236	25%	0.254	C	S	.	.			trans	-94.3	146.4	171.9	-60.9	0	0	0	0	111.4	W259 R309 L311 R319	W259-V313 WeakPolarHBondContact CZ3-O 3.22Å; R309-V313 WeakPolarHBondContact O-CG1 3.48Å; L311-V313 PolarHBondContact O-N 3.08Å; V313-R319 VanDerWaalsContact CG2-CA 3.44Å; V313-R319 HydrophobicContact CG2-CB 3.55Å; V313-R319 HydrophobicContact CG2-CG 3.93Å; V313-R319 PolarHBondContact O-NE 2.76Å; V313-R319 PolarHBondContact O-NH2 3.48Å
314	L	97.7	Very high	97.7	Very high	78 Å²	78	47.6 Å²	47.6	41%	0.408	25%	0.249	S	C	.	.	S	Bend	trans	-71.9	-38.7	-179.3	-65.5	178.3	0	0	0	112.8	P243 K288 A290 P316	P243-L314 HydrophobicContact CB-CD2 4.07Å; P243-L314 HydrophobicContact CG-CD2 3.94Å; K288-L314 VanDerWaalsContact O-CD2 3.32Å; K288-L314 WeakPolarHBondContact O-CD2 2.96Å; A290-L314 HydrophobicContact CB-CD1 4.49Å; A290-L314 HydrophobicContact CB-CD2 3.68Å; A290-L314 HydrophobicContact CB-CG 3.9Å; L314-P316 VanDerWaalsContact O-CD 3.28Å; L314-P316 WeakPolarHBondContact O-CD 3.25Å
315	D	97.3	Very high	97.8	Very high	73 Å²	73	47.6 Å²	47.6	39%	0.39	25%	0.249	S	C	.	.			trans	-77.6	114	179	-175.8	-7.1	0	0	0	110.4	Q317 Q318 R319	D315-Q317 PolarHBondContact O-N 3.43Å; D315-Q317 WeakPolarHBondContact OD1-CB 3.12Å; D315-Q317 PolarHBondContact OD1-N 2.84Å; D315-Q318 HydrophobicContact CB-CB 4.22Å; D315-Q318 HydrophobicContact CB-CG 4.04Å; D315-Q318 PolarHBondContact O-N 3.39Å; D315-Q318 WeakPolarHBondContact OD2-CG 3.24Å; D315-R319 PolarHBondContact O-N 2.83Å
316	P	96.1	Very high	97.9	Very high	42 Å²	42	48.7 Å²	48.7	27%	0.273	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.1	179.7	27.5	-35.9	0	0	0	113.8	P255 L314	P255-P316 HydrophobicContact CB-CB 3.74Å; P255-P316 HydrophobicContact CG-CB 4.26Å; L314-P316 VanDerWaalsContact O-CD 3.28Å; L314-P316 WeakPolarHBondContact O-CD 3.25Å
317	Q	95.3	Very high	97.9	Very high	141 Å²	141	53.1 Å²	53.1	66%	0.659	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-26.8	176.7	-61.3	-172.2	-0.8	0	0	112.9	D315	D315-Q317 PolarHBondContact O-N 3.43Å; D315-Q317 WeakPolarHBondContact OD1-CB 3.12Å; D315-Q317 PolarHBondContact OD1-N 2.84Å
318	Q	97	Very high	97.9	Very high	140 Å²	140	55 Å²	55	65%	0.654	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-9.3	176.1	-60.3	-61.4	-36.8	0	0	112.3	D315	D315-Q318 HydrophobicContact CB-CB 4.22Å; D315-Q318 HydrophobicContact CB-CG 4.04Å; D315-Q318 PolarHBondContact O-N 3.39Å; D315-Q318 WeakPolarHBondContact OD2-CG 3.24Å
319	R	98.3	Very high	97.8	Very high	12 Å²	12	55 Å²	55	5%	0.045	28%	0.284	C	S	.	.	S	Bend	trans	-74.6	130.4	179.6	-164.6	176.6	-60.5	135.3	8.8	109.8	D244 P255 M258 L311 V313 D315 A321	D244-R319 IonicContact OD1-NH2 2.59Å; D244-R319 PolarHBondContact OD1-NH2 2.82Å; D244-R319 IonicContact OD2-CZ 3.69Å; D244-R319 IonicContact OD2-NH1 2.71Å; D244-R319 PolarHBondContact OD2-NH1 3.43Å; D244-R319 IonicContact OD2-NH2 2.78Å; D244-R319 PolarHBondContact OD2-NH2 2.86Å; P255-R319 VanDerWaalsContact O-CD 3.23Å; P255-R319 WeakPolarHBondContact O-CD 3.47Å; P255-R319 PolarHBondContact O-NH1 3.48Å; M258-R319 HydrophobicContact CB-CG 4.3Å; L311-R319 VanDerWaalsContact O-CD 3.24Å; L311-R319 WeakPolarHBondContact O-CD 3.43Å; L311-R319 WeakPolarHBondContact O-CG 3.29Å; L311-R319 PolarHBondContact O-NE 2.75Å; V313-R319 VanDerWaalsContact CG2-CA 3.44Å; V313-R319 HydrophobicContact CG2-CB 3.55Å; V313-R319 HydrophobicContact CG2-CG 3.93Å; V313-R319 PolarHBondContact O-NE 2.76Å; V313-R319 PolarHBondContact O-NH2 3.48Å; D315-R319 PolarHBondContact O-N 2.83Å; R319-A321 PolarHBondContact O-N 2.9Å
320	L	98.3	Very high	97.8	Very high	19 Å²	19	51.7 Å²	51.7	10%	0.099	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-58	135.9	-179.8	-69.2	172	0	0	0	111.9	M258 L307 K310 L311 E324 V325	M258-L320 WeakPolarHBondContact CG-O 3.24Å; L307-L320 HydrophobicContact CD1-CD1 3.76Å; K310-L320 HydrophobicContact CB-CD1 3.51Å; K310-L320 HydrophobicContact CB-CG 3.84Å; K310-L320 HydrophobicContact CD-CD1 3.78Å; K310-L320 HydrophobicContact CD-CD2 4.42Å; K310-L320 HydrophobicContact CD-CG 4.24Å; K310-L320 HydrophobicContact CG-CD1 4.3Å; K310-L320 PolarHBondContact O-N 2.69Å; L311-L320 HydrophobicContact CD2-CB 4.45Å; L320-E324 WeakPolarHBondContact CA-OE2 3.48Å; L320-E324 HydrophobicContact CB-CB 4.48Å; L320-E324 HydrophobicContact CD2-CB 3.87Å; L320-V325 HydrophobicContact CB-CG2 3.63Å; L320-V325 HydrophobicContact CD1-CG2 4.08Å
321	A	98.4	Very high	97.7	Very high	53 Å²	53	50 Å²	50	44%	0.438	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-75.3	160	169	0	0	0	0	0	111.2	R319 G323 E324 V325	R319-A321 PolarHBondContact O-N 2.9Å; A321-G323 VanDerWaalsContact C-N 3.27Å; A321-G323 PolarHBondContact O-N 2.66Å; A321-E324 HydrophobicContact CB-CG 4.47Å; A321-E324 PolarHBondContact N-OE2 2.91Å; A321-E324 PolarHBondContact O-N 3.44Å; A321-E324 VanDerWaalsContact O-N 3.13Å; A321-V325 WeakPolarHBondContact O-CG2 3.18Å; A321-V325 PolarHBondContact O-N 3.48Å; A321-V325 VanDerWaalsContact O-N 3.15Å
322	A	98.4	Very high	97.5	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-56.1	-38.5	-176.7	0	0	0	0	0	113.6	V183 E187 M258 L326	V183-A322 HydrophobicContact CG1-CB 4.43Å; V183-A322 VanDerWaalsContact CG1-O 3.23Å; V183-A322 WeakPolarHBondContact CG1-O 3.22Å; E187-A322 HydrophobicContact CB-CB 3.75Å; E187-A322 HydrophobicContact CG-CB 3.95Å; M258-A322 HydrophobicContact CE-CB 4.09Å; M258-A322 HydrophobicContact SD-CB 3.81Å; A322-L326 WeakPolarHBondContact O-CB 3.47Å; A322-L326 PolarHBondContact O-N 2.81Å
323	G	98.4	Very high	97.3	Very high	27 Å²	27	52.2 Å²	52.2	28%	0.278	29%	0.294	S	S	.	.	H	α-helix	trans	-62.6	-45.9	176.5	0	0	0	0	0	113.2	A321 V325 L326 E327	A321-G323 VanDerWaalsContact C-N 3.27Å; A321-G323 PolarHBondContact O-N 2.66Å; G323-V325 VanDerWaalsContact C-N 3.33Å; G323-V325 PolarHBondContact O-N 3.15Å; G323-L326 WeakPolarHBondContact O-CB 3.29Å; G323-L326 PolarHBondContact O-N 3.38Å; G323-L326 VanDerWaalsContact O-N 3.14Å; G323-E327 PolarHBondContact O-N 3.12Å
324	E	98.4	Very high	97	Very high	94 Å²	94	52.8 Å²	52.8	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-66	-36.2	-179	-57.1	173.9	111.6	0	0	112	L320 A321 S328	L320-E324 WeakPolarHBondContact CA-OE2 3.48Å; L320-E324 HydrophobicContact CB-CB 4.48Å; L320-E324 HydrophobicContact CD2-CB 3.87Å; A321-E324 HydrophobicContact CB-CG 4.47Å; A321-E324 PolarHBondContact N-OE2 2.91Å; A321-E324 PolarHBondContact O-N 3.44Å; A321-E324 VanDerWaalsContact O-N 3.13Å; E324-S328 WeakPolarHBondContact O-CB 3.45Å; E324-S328 PolarHBondContact O-N 2.86Å; E324-S328 PolarHBondContact O-OG 3.03Å
325	V	98.6	Very high	96.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-43.4	173.4	175.7	0	0	0	0	110.4	F179 V183 M258 L307 L311 L320 A321 G323 E327 S328 L329	F179-V325 HydrophobicContact CE1-CG1 4.07Å; V183-V325 HydrophobicContact CB-CG1 4.39Å; V183-V325 HydrophobicContact CG1-CB 4Å; V183-V325 HydrophobicContact CG1-CG1 3.85Å; V183-V325 HydrophobicContact CG2-CG1 3.74Å; M258-V325 HydrophobicContact CE-CB 4.4Å; M258-V325 HydrophobicContact CE-CG2 3.77Å; L307-V325 HydrophobicContact CD1-CB 4.46Å; L307-V325 HydrophobicContact CD1-CG1 4.12Å; L307-V325 HydrophobicContact CD1-CG2 4.31Å; L307-V325 HydrophobicContact CD2-CG1 4.2Å; L307-V325 HydrophobicContact CG-CG1 4.5Å; L311-V325 HydrophobicContact CD2-CG2 3.77Å; L311-V325 HydrophobicContact CG-CG2 4.45Å; L320-V325 HydrophobicContact CB-CG2 3.63Å; L320-V325 HydrophobicContact CD1-CG2 4.08Å; A321-V325 WeakPolarHBondContact O-CG2 3.18Å; A321-V325 PolarHBondContact O-N 3.48Å; A321-V325 VanDerWaalsContact O-N 3.15Å; G323-V325 VanDerWaalsContact C-N 3.33Å; G323-V325 PolarHBondContact O-N 3.15Å; V325-E327 PolarHBondContact O-N 3.08Å; V325-S328 PolarHBondContact O-N 3.44Å; V325-L329 HydrophobicContact CG1-CD1 3.83Å; V325-L329 HydrophobicContact CG1-CG 4.34Å; V325-L329 WeakPolarHBondContact O-CB 3.34Å; V325-L329 VanDerWaalsContact O-CG 3.25Å; V325-L329 WeakPolarHBondContact O-CG 3.33Å; V325-L329 PolarHBondContact O-N 3.45Å
326	L	97.9	Very high	96.3	Very high	32 Å²	32	50.6 Å²	50.6	17%	0.168	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-41.7	179.7	-167.6	151.5	0	0	0	111.8	Y180 V183 R184 A322 G323 L329 S330	Y180-L326 HydrophobicContact CD2-CG 4.31Å; Y180-L326 HydrophobicContact CE2-CD2 3.73Å; Y180-L326 HydrophobicContact CE2-CG 3.69Å; V183-L326 HydrophobicContact CG1-CB 4.11Å; R184-L326 HydrophobicContact CB-CD1 3.9Å; R184-L326 HydrophobicContact CG-CD1 4.26Å; A322-L326 WeakPolarHBondContact O-CB 3.47Å; A322-L326 PolarHBondContact O-N 2.81Å; G323-L326 WeakPolarHBondContact O-CB 3.29Å; G323-L326 PolarHBondContact O-N 3.38Å; G323-L326 VanDerWaalsContact O-N 3.14Å; L326-L329 PolarHBondContact O-N 3.31Å; L326-S330 WeakPolarHBondContact O-CB 3.2Å; L326-S330 PolarHBondContact O-N 2.93Å; L326-S330 PolarHBondContact O-OG 3.39Å
327	E	97.8	Very high	95.3	Very high	139 Å²	139	55.2 Å²	55.2	65%	0.65	31%	0.309	S	S	*	.	H	α-helix	trans	-62.2	-46.1	173.9	-71.4	177.1	-171.7	0	0	111.5	G323 V325 L329 S330 A331	G323-E327 PolarHBondContact O-N 3.12Å; V325-E327 PolarHBondContact O-N 3.08Å; E327-L329 PolarHBondContact O-N 2.83Å; E327-S330 WeakPolarHBondContact O-CB 3.47Å; E327-S330 PolarHBondContact O-N 3.15Å; E327-A331 PolarHBondContact O-N 2.92Å
328	S	97.7	Very high	94.2	Very high	45 Å²	45	51.9 Å²	51.9	32%	0.315	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-45	177.3	-59.8	0	0	0	0	111.8	E324 V325 S330 A331 I332	E324-S328 WeakPolarHBondContact O-CB 3.45Å; E324-S328 PolarHBondContact O-N 2.86Å; E324-S328 PolarHBondContact O-OG 3.03Å; V325-S328 PolarHBondContact O-N 3.44Å; S328-S330 VanDerWaalsContact C-N 3.35Å; S328-S330 PolarHBondContact O-N 2.84Å; S328-A331 PolarHBondContact O-N 3.18Å; S328-I332 WeakPolarHBondContact O-CG1 3.35Å; S328-I332 PolarHBondContact O-N 2.82Å; S328-I332 VanDerWaalsContact O-N 3.07Å
329	L	97.6	Very high	92.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.2	-39.4	176.4	-69.5	167.7	0	0	0	111.8	I176 F179 Y180 V183 L307 V325 L326 E327 A331 I332 I333	I176-L329 HydrophobicContact CD1-CD2 3.43Å; I176-L329 VanDerWaalsContact CD1-CD2 3.43Å; I176-L329 HydrophobicContact CG2-CD2 3.96Å; F179-L329 HydrophobicContact CD1-CD1 3.66Å; F179-L329 HydrophobicContact CD1-CD2 4.03Å; F179-L329 HydrophobicContact CD1-CG 4.48Å; F179-L329 HydrophobicContact CE1-CD1 4.07Å; Y180-L329 HydrophobicContact CD2-CB 3.88Å; V183-L329 HydrophobicContact CB-CD1 4.31Å; V183-L329 HydrophobicContact CG2-CD1 4.01Å; L307-L329 HydrophobicContact CD2-CD2 3.53Å; L307-L329 HydrophobicContact CD2-CG 3.86Å; V325-L329 HydrophobicContact CG1-CD1 3.83Å; V325-L329 HydrophobicContact CG1-CG 4.34Å; V325-L329 WeakPolarHBondContact O-CB 3.34Å; V325-L329 VanDerWaalsContact O-CG 3.25Å; V325-L329 WeakPolarHBondContact O-CG 3.33Å; V325-L329 PolarHBondContact O-N 3.45Å; L326-L329 PolarHBondContact O-N 3.31Å; E327-L329 PolarHBondContact O-N 2.83Å; L329-A331 VanDerWaalsContact C-N 3.32Å; L329-A331 PolarHBondContact O-N 3.21Å; L329-I332 PolarHBondContact O-N 2.94Å; L329-I333 VanDerWaalsContact O-CG1 3.27Å; L329-I333 WeakPolarHBondContact O-CG1 3.32Å; L329-I333 PolarHBondContact O-N 3.35Å
330	S	96.8	Very high	90.8	Very high	44 Å²	44	53.9 Å²	53.9	31%	0.308	33%	0.328	S	S	.	.	H	α-helix	trans	-61.2	-42.1	176.1	-58.2	0	0	0	0	111.6	Y180 L326 E327 S328 I333 A334	Y180-S330 WeakPolarHBondContact CE2-OG 3.27Å; L326-S330 WeakPolarHBondContact O-CB 3.2Å; L326-S330 PolarHBondContact O-N 2.93Å; L326-S330 PolarHBondContact O-OG 3.39Å; E327-S330 WeakPolarHBondContact O-CB 3.47Å; E327-S330 PolarHBondContact O-N 3.15Å; S328-S330 VanDerWaalsContact C-N 3.35Å; S328-S330 PolarHBondContact O-N 2.84Å; S330-I333 PolarHBondContact O-N 2.63Å; S330-A334 WeakPolarHBondContact O-CB 3.17Å; S330-A334 PolarHBondContact O-N 3.25Å
331	A	95.9	Very high	88.7	Confident	63 Å²	63	56.8 Å²	56.8	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-64.1	-42.4	176.1	0	0	0	0	0	112	E327 S328 L329 A334 S335	E327-A331 PolarHBondContact O-N 2.92Å; S328-A331 PolarHBondContact O-N 3.18Å; L329-A331 VanDerWaalsContact C-N 3.32Å; L329-A331 PolarHBondContact O-N 3.21Å; A331-A334 PolarHBondContact O-N 2.72Å; A331-S335 PolarHBondContact O-N 2.77Å
332	I	94.9	Very high	86.5	Confident	11 Å²	11	61.2 Å²	61.2	6%	0.056	36%	0.364	C	S	.	.	H	α-helix	trans	-59.8	-48.7	174.5	-66.3	166.7	0	0	0	110.2	I176 N303 S328 L329 A334 S335 W336	I176-I332 HydrophobicContact CG2-CG2 4.28Å; N303-I332 HydrophobicContact CB-CD1 4.07Å; N303-I332 HydrophobicContact CB-CG1 3.96Å; S328-I332 WeakPolarHBondContact O-CG1 3.35Å; S328-I332 PolarHBondContact O-N 2.82Å; S328-I332 VanDerWaalsContact O-N 3.07Å; L329-I332 PolarHBondContact O-N 2.94Å; I332-A334 PolarHBondContact O-N 3.01Å; I332-S335 WeakPolarHBondContact O-CB 3.24Å; I332-S335 PolarHBondContact O-N 2.94Å; I332-S335 PolarHBondContact O-OG 3.47Å; I332-W336 HydrophobicContact CG2-CH2 4.29Å; I332-W336 HydrophobicContact CG2-CZ2 3.62Å
333	I	94.6	Very high	84.1	Confident	40 Å²	40	65.5 Å²	65.5	21%	0.205	39%	0.393	C	S	.	.	H	α-helix	trans	-62.3	-42.5	179.8	-67.5	165.3	0	0	0	111.4	I176 Y180 L329 S330 S335 W336	I176-I333 HydrophobicContact CG2-CD1 4.12Å; I176-I333 HydrophobicContact CG2-CG1 3.76Å; Y180-I333 HydrophobicContact CD2-CD1 4.14Å; Y180-I333 HydrophobicContact CG-CD1 4.11Å; L329-I333 VanDerWaalsContact O-CG1 3.27Å; L329-I333 WeakPolarHBondContact O-CG1 3.32Å; L329-I333 PolarHBondContact O-N 3.35Å; S330-I333 PolarHBondContact O-N 2.63Å; I333-S335 VanDerWaalsContact C-N 3.3Å; I333-S335 PolarHBondContact O-N 3.43Å; I333-W336 HydrophobicContact CB-CE3 4.46Å; I333-W336 HydrophobicContact CB-CZ3 4.45Å; I333-W336 HydrophobicContact CG1-CE3 4.4Å; I333-W336 HydrophobicContact CG1-CH2 4.41Å; I333-W336 HydrophobicContact CG1-CZ3 3.91Å; I333-W336 PolarHBondContact O-N 3.19Å
334	A	92.6	Very high	82.2	Confident	51 Å²	51	66.4 Å²	66.4	42%	0.421	40%	0.402	S	S	.	.	H	α-helix	trans	-64	-35.1	178.1	0	0	0	0	0	112.2	S330 A331 I332 W336 Q337 S338	S330-A334 WeakPolarHBondContact O-CB 3.17Å; S330-A334 PolarHBondContact O-N 3.25Å; A331-A334 PolarHBondContact O-N 2.72Å; I332-A334 PolarHBondContact O-N 3.01Å; A334-W336 VanDerWaalsContact C-N 3.25Å; A334-W336 PolarHBondContact O-N 2.83Å; A334-Q337 WeakPolarHBondContact O-CB 3.17Å; A334-Q337 PolarHBondContact O-N 2.76Å; A334-Q337 VanDerWaalsContact O-N 3.12Å; A334-S338 PolarHBondContact O-N 2.85Å
335	S	91.5	Very high	79.8	Confident	49 Å²	49	68.4 Å²	68.4	34%	0.343	42%	0.424	S	S	.	.	H	α-helix	trans	-60	-34.6	178.6	78.7	0	0	0	0	112.7	A331 I332 I333 Q337 S338 V339	A331-S335 PolarHBondContact O-N 2.77Å; I332-S335 WeakPolarHBondContact O-CB 3.24Å; I332-S335 PolarHBondContact O-N 2.94Å; I332-S335 PolarHBondContact O-OG 3.47Å; I333-S335 VanDerWaalsContact C-N 3.3Å; I333-S335 PolarHBondContact O-N 3.43Å; S335-Q337 VanDerWaalsContact C-N 3.32Å; S335-Q337 PolarHBondContact O-N 3.44Å; S335-S338 PolarHBondContact O-N 3.03Å; S335-V339 WeakPolarHBondContact O-CG2 3.26Å; S335-V339 PolarHBondContact O-N 3.43Å
336	W	88.4	Confident	77.7	Confident	57 Å²	57	75.9 Å²	75.9	22%	0.216	46%	0.463	C	S	.	.	H	α-helix	trans	-69	-30.4	178.1	-56.1	-28	0	0	0	113.4	R173 I176 V177 I332 I333 A334 S340	R173-W336 HydrophobicContact CB-CH2 4.2Å; R173-W336 HydrophobicContact CB-CZ3 4.4Å; R173-W336 HydrophobicContact CG-CE3 4.06Å; R173-W336 HydrophobicContact CG-CH2 4.03Å; R173-W336 HydrophobicContact CG-CZ3 3.72Å; I176-W336 HydrophobicContact CB-CH2 3.73Å; I176-W336 HydrophobicContact CB-CZ2 4.44Å; I176-W336 HydrophobicContact CG1-CH2 4.3Å; I176-W336 HydrophobicContact CG2-CH2 3.58Å; I176-W336 HydrophobicContact CG2-CZ2 4.3Å; I176-W336 HydrophobicContact CG2-CZ3 4.26Å; V177-W336 HydrophobicContact CG2-CZ3 4.39Å; I332-W336 HydrophobicContact CG2-CH2 4.29Å; I332-W336 HydrophobicContact CG2-CZ2 3.62Å; I333-W336 HydrophobicContact CB-CE3 4.46Å; I333-W336 HydrophobicContact CB-CZ3 4.45Å; I333-W336 HydrophobicContact CG1-CE3 4.4Å; I333-W336 HydrophobicContact CG1-CH2 4.41Å; I333-W336 HydrophobicContact CG1-CZ3 3.91Å; I333-W336 PolarHBondContact O-N 3.19Å; A334-W336 VanDerWaalsContact C-N 3.25Å; A334-W336 PolarHBondContact O-N 2.83Å; W336-S340 PolarHBondContact O-N 3.4Å; W336-S340 VanDerWaalsContact O-N 3.17Å; W336-S340 PolarHBondContact O-OG 3.45Å
337	Q	75.4	Confident	75.6	Confident	138 Å²	138	82.9 Å²	82.9	65%	0.645	50%	0.495	S	S	*	.	H	α-helix	trans	-71.7	-40.3	177.1	-62.5	179.3	-7.3	0	0	110.7	A334 S335 V339 S340 S341	A334-Q337 WeakPolarHBondContact O-CB 3.17Å; A334-Q337 PolarHBondContact O-N 2.76Å; A334-Q337 VanDerWaalsContact O-N 3.12Å; S335-Q337 VanDerWaalsContact C-N 3.32Å; S335-Q337 PolarHBondContact O-N 3.44Å; Q337-V339 PolarHBondContact O-N 2.78Å; Q337-S340 PolarHBondContact O-N 3.31Å; Q337-S341 PolarHBondContact O-N 2.89Å
338	S	71.8	Confident	73.4	Confident	72 Å²	72	82.7 Å²	82.7	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-42.7	175.4	-168	0	0	0	0	111.7	A334 S335 S340 S341 M342	A334-S338 PolarHBondContact O-N 2.85Å; S335-S338 PolarHBondContact O-N 3.03Å; S338-S340 VanDerWaalsContact C-N 3.35Å; S338-S340 PolarHBondContact O-N 2.98Å; S338-S341 PolarHBondContact O-N 2.91Å; S338-S341 PolarHBondContact O-OG 3.03Å; S338-M342 WeakPolarHBondContact O-CG 3.4Å; S338-M342 PolarHBondContact O-N 3.43Å
339	V	62.1	Low	71.3	Confident	106 Å²	106	86 Å²	86	64%	0.642	52%	0.52	S	S	*	.	H	α-helix	trans	-65	-38.5	178	175.9	0	0	0	0	111.6	S335 Q337 S341 M342	S335-V339 WeakPolarHBondContact O-CG2 3.26Å; S335-V339 PolarHBondContact O-N 3.43Å; Q337-V339 PolarHBondContact O-N 2.78Å; V339-S341 PolarHBondContact O-N 3.19Å; V339-M342 PolarHBondContact O-N 2.93Å
340	S	60.3	Low	68.7	Low	87 Å²	87	91 Å²	91	61%	0.608	55%	0.553	S	S	*	*	H	α-helix	trans	-65.5	-28.1	177.2	-56.4	0	0	0	0	112.7	W336 Q337 S338	W336-S340 PolarHBondContact O-N 3.4Å; W336-S340 VanDerWaalsContact O-N 3.17Å; W336-S340 PolarHBondContact O-OG 3.45Å; Q337-S340 PolarHBondContact O-N 3.31Å; S338-S340 VanDerWaalsContact C-N 3.35Å; S338-S340 PolarHBondContact O-N 2.98Å
341	S	54.6	Low	66.1	Low	81 Å²	81	96.6 Å²	96.6	57%	0.566	58%	0.579	S	S	*	*	H	α-helix	trans	-79.5	-15.1	177.1	76	0	0	0	0	114.4	Q337 S338 V339	Q337-S341 PolarHBondContact O-N 2.89Å; S338-S341 PolarHBondContact O-N 2.91Å; S338-S341 PolarHBondContact O-OG 3.03Å; V339-S341 PolarHBondContact O-N 3.19Å
342	M	52.6	Low	63.8	Low	146 Å²	146	100.5 Å²	100.5	72%	0.719	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	4.8	-178.8	-67.5	-69.7	98.6	0	0	113.6	S338 V339 G344	S338-M342 WeakPolarHBondContact O-CG 3.4Å; S338-M342 PolarHBondContact O-N 3.43Å; V339-M342 PolarHBondContact O-N 2.93Å; M342-G344 PolarHBondContact O-N 2.76Å
343	S	49.1	Very low	61.2	Low	93 Å²	93	107.1 Å²	107.1	65%	0.65	63%	0.626	S	S	*	*			trans	-73.4	73.1	173.6	-173.9	0	0	0	0	111.1
344	G	57.8	Low	58.8	Low	46 Å²	46	112.1 Å²	112.1	47%	0.474	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-61.5	170.3	155	0	0	0	0	0	111	M342 L346	M342-G344 PolarHBondContact O-N 2.76Å; G344-L346 PolarHBondContact O-N 3.28Å; G344-L346 VanDerWaalsContact O-N 3.17Å
345	P	47.8	Very low	56.5	Low	136 Å²	136	118.4 Å²	118.4	88%	0.883	67%	0.674	S	S	*	*	S	Bend	trans	-55.4	126	-177.1	22.5	-31.1	0	0	0	110.3	Q347	P345-Q347 PolarHBondContact O-N 3.46Å
346	L	53.4	Low	54.2	Low	157 Å²	157	122 Å²	122	82%	0.822	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-49.9	125	-179.8	-70.1	162	0	0	0	110.2	G344 V348	G344-L346 PolarHBondContact O-N 3.28Å; G344-L346 VanDerWaalsContact O-N 3.17Å; L346-V348 PolarHBondContact O-N 3.01Å
347	Q	55.3	Low	52.3	Low	180 Å²	180	125.6 Å²	125.6	84%	0.841	72%	0.717	S	S	*	*			trans	-70.4	115.5	171.9	-175	173.3	-5.5	0	0	108.6	P345 V349	P345-Q347 PolarHBondContact O-N 3.46Å; Q347-V349 PolarHBondContact O-N 3.14Å
348	V	51.9	Low	50.7	Low	134 Å²	134	125 Å²	125	81%	0.812	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-71.6	118.7	177.1	-176	0	0	0	0	108.7	L346	L346-V348 PolarHBondContact O-N 3.01Å
349	V	52	Low	49.3	Very low	114 Å²	114	128.9 Å²	128.9	69%	0.691	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-95.3	128.3	170.8	-177.7	0	0	0	0	107.6	Q347	Q347-V349 PolarHBondContact O-N 3.14Å
350	P	43.6	Very low	48.6	Very low	105 Å²	105	132.2 Å²	132.2	68%	0.682	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-67.5	134.6	174.1	-16.9	30.1	0	0	0	111.4	I352	P350-I352 PolarHBondContact O-N 3.03Å
351	D	43.4	Very low	47.9	Very low	162 Å²	162	135 Å²	135	87%	0.866	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-65.2	125.7	175.8	-65.7	-44	0	0	0	110.6
352	I	46.4	Very low	47.4	Very low	146 Å²	146	136.6 Å²	136.6	75%	0.749	74%	0.741	S	S	*	*			trans	-108.6	117.8	165.9	-61	175.9	0	0	0	106.4	P350 D354	P350-I352 PolarHBondContact O-N 3.03Å; I352-D354 PolarHBondContact O-N 2.91Å; I352-D354 VanDerWaalsContact O-N 3.13Å
353	D	40.7	Very low	46.9	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	74%	0.741	S	S	*	*			trans	-70.5	97.9	177.4	-82.4	-33.7	0	0	0	110.8
354	D	43.1	Very low	46.7	Very low	144 Å²	144	139 Å²	139	77%	0.77	74%	0.741	S	S	*	*			trans	-99.4	94.6	164.5	-84.6	-28.8	0	0	0	110.1	I352 V356	I352-D354 PolarHBondContact O-N 2.91Å; I352-D354 VanDerWaalsContact O-N 3.13Å; D354-V356 PolarHBondContact O-N 2.64Å
355	Q	45.9	Very low	46.2	Very low	184 Å²	184	139.6 Å²	139.6	86%	0.86	74%	0.741	S	S	*	*			trans	-74.6	96.8	165.4	-67.1	-175.3	5.9	0	0	109.5
356	V	42.5	Very low	46.1	Very low	124 Å²	124	139.4 Å²	139.4	75%	0.752	73%	0.726	S	S	*	*			trans	-131.2	117.9	160	-173.5	0	0	0	0	110.9	D354 N358	D354-V356 PolarHBondContact O-N 2.64Å; V356-N358 PolarHBondContact O-N 2.92Å
357	N	47.7	Very low	45.8	Very low	133 Å²	133	134.7 Å²	134.7	71%	0.711	71%	0.71	S	S	*	*			trans	-60.8	114.9	178.6	-170.2	25.3	0	0	0	111.8
358	N	43.5	Very low	45.7	Very low	124 Å²	124	131.9 Å²	131.9	66%	0.663	70%	0.699	S	S	*	*			trans	-135.4	71.4	168.5	-96.4	-17.4	0	0	0	109.6	V356	V356-N358 PolarHBondContact O-N 2.92Å
359	Q	41.7	Very low	45.5	Very low	155 Å²	155	130.1 Å²	130.1	72%	0.724	68%	0.682	S	S	*	*			trans	-94.6	-5.4	175.5	-85.2	-173.5	-22.5	0	0	114.6
360	E	46.4	Very low	45.4	Very low	176 Å²	176	131 Å²	131	82%	0.822	68%	0.679	S	S	*	*	S	Bend	trans	-92.7	-23.2	-174.7	-67.3	-173.4	166.3	0	0	114.5
361	H	45.9	Very low	45.5	Very low	145 Å²	145	129.2 Å²	129.2	67%	0.671	67%	0.669	S	S	*	*	H	α-helix	trans	-85.9	-14.5	-179.8	-94.4	-62.9	0	0	0	115.7
362	L	43.9	Very low	46	Very low	114 Å²	114	123.9 Å²	123.9	60%	0.597	64%	0.644	S	S	*	*	H	α-helix	trans	-83.9	-17.5	-178.3	-86.3	111	0	0	0	114.4	K366	L362-K366 PolarHBondContact O-N 3.5Å
363	Q	43	Very low	46.3	Very low	152 Å²	152	120.9 Å²	120.9	71%	0.71	63%	0.627	S	S	*	*	H	α-helix	trans	-85	-36.9	-177.5	-77.5	177.4	0.8	0	0	112.8	A367	Q363-A367 PolarHBondContact O-N 3.05Å; Q363-A367 VanDerWaalsContact O-N 3.15Å
364	E	45.4	Very low	47.2	Very low	139 Å²	139	121.5 Å²	121.5	65%	0.65	62%	0.619	S	S	*	*	H	α-helix	trans	-68.9	-38.7	174.8	-81.7	-175.8	149.5	0	0	112.4	K366 A367 I368	E364-K366 PolarHBondContact O-N 3.38Å; E364-A367 PolarHBondContact O-N 2.69Å; E364-I368 WeakPolarHBondContact O-CG1 3.37Å; E364-I368 PolarHBondContact O-N 3.07Å
365	A	47.2	Very low	48.1	Very low	58 Å²	58	119.6 Å²	119.6	48%	0.479	61%	0.606	S	S	.	*	H	α-helix	trans	-65.4	-39.1	176.9	0	0	0	0	0	112.5	E369	A365-E369 PolarHBondContact O-N 3.12Å
366	K	44.6	Very low	48.8	Very low	131 Å²	131	112 Å²	112	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-67.5	-39.7	176	-91.9	-176.8	172.7	-179.9	0	113.1	L362 E364 E369 E370	L362-K366 PolarHBondContact O-N 3.5Å; E364-K366 PolarHBondContact O-N 3.38Å; K366-E369 PolarHBondContact O-N 3.3Å; K366-E370 WeakPolarHBondContact O-CB 3.27Å; K366-E370 WeakPolarHBondContact O-CG 2.95Å; K366-E370 PolarHBondContact O-N 3.21Å
367	A	47.7	Very low	49.6	Very low	59 Å²	59	109.4 Å²	109.4	49%	0.488	55%	0.55	S	S	.	.	H	α-helix	trans	-68.1	-36	-179.8	0	0	0	0	0	112.3	Q363 E364 S371	Q363-A367 PolarHBondContact O-N 3.05Å; Q363-A367 VanDerWaalsContact O-N 3.15Å; E364-A367 PolarHBondContact O-N 2.69Å; A367-S371 PolarHBondContact O-N 3.47Å
368	I	52.8	Low	50.3	Low	121 Å²	121	105.9 Å²	105.9	62%	0.621	53%	0.531	S	S	*	.	H	α-helix	trans	-73.2	-39.3	175.8	-63.1	168.7	0	0	0	111.1	E364 S372	E364-I368 WeakPolarHBondContact O-CG1 3.37Å; E364-I368 PolarHBondContact O-N 3.07Å; I368-S372 WeakPolarHBondContact O-CB 3.18Å; I368-S372 PolarHBondContact O-N 3.29Å; I368-S372 VanDerWaalsContact O-N 3.13Å; I368-S372 PolarHBondContact O-OG 3.02Å
369	E	48.3	Very low	51.2	Low	97 Å²	97	100.3 Å²	100.3	45%	0.453	50%	0.501	S	S	.	.	H	α-helix	trans	-61.4	-46.6	172.2	-99.2	-173.7	151.2	0	0	111.5	R299 A365 K366 S371 S372 Q373	R299-E369 IonicContact NH1-OE1 3.26Å; A365-E369 PolarHBondContact O-N 3.12Å; K366-E369 PolarHBondContact O-N 3.3Å; E369-S371 PolarHBondContact O-N 2.87Å; E369-S372 PolarHBondContact O-OG 2.87Å; E369-S372 VanDerWaalsContact O-OG 3.1Å; E369-Q373 WeakPolarHBondContact O-CB 3.42Å; E369-Q373 PolarHBondContact O-N 3.48Å
370	E	49.2	Very low	52.1	Low	131 Å²	131	93 Å²	93	61%	0.612	47%	0.466	S	S	*	.	H	α-helix	trans	-66.5	-36.2	-178.4	-76.9	-179	178.4	0	0	113.2	K366 Y374	K366-E370 WeakPolarHBondContact O-CB 3.27Å; K366-E370 WeakPolarHBondContact O-CG 2.95Å; K366-E370 PolarHBondContact O-N 3.21Å; E370-Y374 PolarHBondContact O-N 3.34Å; E370-Y374 VanDerWaalsContact O-N 3.11Å
371	S	45.6	Very low	52.8	Low	69 Å²	69	93 Å²	93	48%	0.483	46%	0.459	S	S	.	.	H	α-helix	trans	-70	-47.1	177.4	-170.4	0	0	0	0	112.2	A367 E369 Q373 Y374 E375	A367-S371 PolarHBondContact O-N 3.47Å; E369-S371 PolarHBondContact O-N 2.87Å; S371-Q373 VanDerWaalsContact C-N 3.27Å; S371-Q373 PolarHBondContact O-N 3.49Å; S371-Y374 PolarHBondContact O-N 2.82Å; S371-E375 PolarHBondContact O-N 2.95Å
372	S	54.9	Low	53.4	Low	49 Å²	49	90.8 Å²	90.8	34%	0.343	45%	0.449	S	S	.	.	H	α-helix	trans	-66.6	-30.7	176.9	53.3	0	0	0	0	112	I368 E369 F376	I368-S372 WeakPolarHBondContact O-CB 3.18Å; I368-S372 PolarHBondContact O-N 3.29Å; I368-S372 VanDerWaalsContact O-N 3.13Å; I368-S372 PolarHBondContact O-OG 3.02Å; E369-S372 PolarHBondContact O-OG 2.87Å; E369-S372 VanDerWaalsContact O-OG 3.1Å; S372-F376 VanDerWaalsContact O-CB 3.3Å; S372-F376 WeakPolarHBondContact O-CB 3.18Å; S372-F376 PolarHBondContact O-N 2.79Å
373	Q	53.1	Low	54	Low	84 Å²	84	86.8 Å²	86.8	39%	0.393	43%	0.427	S	S	.	.	H	α-helix	trans	-67.4	-43.8	174.8	-178.9	179.6	3.4	0	0	113.3	E369 S371 F376 E377	E369-Q373 WeakPolarHBondContact O-CB 3.42Å; E369-Q373 PolarHBondContact O-N 3.48Å; S371-Q373 VanDerWaalsContact C-N 3.27Å; S371-Q373 PolarHBondContact O-N 3.49Å; Q373-F376 PolarHBondContact O-N 2.9Å; Q373-E377 WeakPolarHBondContact O-CB 3.37Å; Q373-E377 WeakPolarHBondContact O-CG 3.4Å; Q373-E377 PolarHBondContact O-N 2.69Å
374	Y	58.2	Low	54.4	Low	162 Å²	162	83.1 Å²	83.1	64%	0.635	41%	0.412	S	S	*	.	H	α-helix	trans	-66.8	-38.8	176.1	-178.9	-105.8	0	0	0	111.6	E370 S371 N378	E370-Y374 PolarHBondContact O-N 3.34Å; E370-Y374 VanDerWaalsContact O-N 3.11Å; S371-Y374 PolarHBondContact O-N 2.82Å; Y374-N378 VanDerWaalsContact CD1-ND2 3.25Å; Y374-N378 WeakPolarHBondContact CD1-ND2 3.08Å; Y374-N378 WeakPolarHBondContact CE1-ND2 3.4Å; Y374-N378 WeakPolarHBondContact CE2-ND2 3.08Å; Y374-N378 VanDerWaalsContact O-CB 3.27Å; Y374-N378 WeakPolarHBondContact O-CB 3.27Å; Y374-N378 VanDerWaalsContact O-CG 3.29Å; Y374-N378 PolarHBondContact O-N 3.47Å; Y374-N378 PolarHBondContact O-ND2 3.4Å
375	E	63.5	Low	54.5	Low	104 Å²	104	80.7 Å²	80.7	49%	0.486	40%	0.403	S	S	.	.	H	α-helix	trans	-65.8	-40.6	173.7	-73.5	-178.2	-177	0	0	112.2	S371 Y379	S371-E375 PolarHBondContact O-N 2.95Å; E375-Y379 WeakPolarHBondContact O-CB 3.38Å; E375-Y379 PolarHBondContact O-N 3.14Å
376	F	59.1	Low	54.4	Low	26 Å²	26	79.3 Å²	79.3	11%	0.114	39%	0.388	C	S	.	.	H	α-helix	trans	-65.5	-46.9	175.8	174.4	-100.4	0	0	0	112.4	G271 Q272 F273 S372 Q373 N378 Y379 M380	G271-F376 WeakPolarHBondContact O-CD1 3.34Å; G271-F376 WeakPolarHBondContact O-CE1 3.01Å; G271-F376 WeakPolarHBondContact O-CE2 3.47Å; G271-F376 WeakPolarHBondContact O-CZ 3.45Å; Q272-F376 VanDerWaalsContact CA-CE2 3.41Å; Q272-F376 HydrophobicContact CB-CD2 3.92Å; Q272-F376 HydrophobicContact CB-CE2 4.18Å; Q272-F376 HydrophobicContact CB-CG 4.39Å; F273-F376 AromaticContact CD2-CE2 3.94Å; F273-F376 HydrophobicContact CD2-CE2 3.94Å; F273-F376 HydrophobicContact CE2-CE2 4.21Å; S372-F376 VanDerWaalsContact O-CB 3.3Å; S372-F376 WeakPolarHBondContact O-CB 3.18Å; S372-F376 PolarHBondContact O-N 2.79Å; Q373-F376 PolarHBondContact O-N 2.9Å; F376-N378 VanDerWaalsContact C-N 3.32Å; F376-N378 PolarHBondContact O-N 3.23Å; F376-Y379 PolarHBondContact O-N 3.07Å; F376-M380 HydrophobicContact CD1-CG 4.42Å; F376-M380 HydrophobicContact CD2-CG 4.23Å; F376-M380 HydrophobicContact CE1-CG 3.77Å; F376-M380 HydrophobicContact CE2-CG 3.53Å; F376-M380 HydrophobicContact CE2-SD 4.33Å; F376-M380 HydrophobicContact CZ-CE 4.17Å; F376-M380 HydrophobicContact CZ-CG 3.3Å; F376-M380 HydrophobicContact CZ-SD 4.23Å; F376-M380 WeakPolarHBondContact O-CB 3.15Å; F376-M380 PolarHBondContact O-N 3.19Å
377	E	59.5	Low	54.3	Low	68 Å²	68	75.7 Å²	75.7	32%	0.318	38%	0.382	S	S	.	.	H	α-helix	trans	-61.5	-43.4	177	-79.2	-177.4	-162.4	0	0	111.1	K168 Q373 M380 R381	K168-E377 IonicContact NZ-OE1 3.49Å; K168-E377 PolarHBondContact NZ-OE1 2.96Å; Q373-E377 WeakPolarHBondContact O-CB 3.37Å; Q373-E377 WeakPolarHBondContact O-CG 3.4Å; Q373-E377 PolarHBondContact O-N 2.69Å; E377-M380 PolarHBondContact O-N 2.71Å; E377-R381 WeakPolarHBondContact O-CB 3.17Å; E377-R381 PolarHBondContact O-N 2.84Å
378	N	62.3	Low	53.9	Low	59 Å²	59	77.7 Å²	77.7	32%	0.316	38%	0.381	S	S	.	.	H	α-helix	trans	-66.8	-36.9	175.2	-77.2	-41.2	0	0	0	112.4	Y374 F376 R381 Q382	Y374-N378 VanDerWaalsContact CD1-ND2 3.25Å; Y374-N378 WeakPolarHBondContact CD1-ND2 3.08Å; Y374-N378 WeakPolarHBondContact CE1-ND2 3.4Å; Y374-N378 WeakPolarHBondContact CE2-ND2 3.08Å; Y374-N378 VanDerWaalsContact O-CB 3.27Å; Y374-N378 WeakPolarHBondContact O-CB 3.27Å; Y374-N378 VanDerWaalsContact O-CG 3.29Å; Y374-N378 PolarHBondContact O-N 3.47Å; Y374-N378 PolarHBondContact O-ND2 3.4Å; F376-N378 VanDerWaalsContact C-N 3.32Å; F376-N378 PolarHBondContact O-N 3.23Å; N378-R381 CarbonylContact O-C 3.53Å; N378-R381 WeakPolarHBondContact O-CB 3.47Å; N378-R381 PolarHBondContact O-N 3.15Å; N378-Q382 WeakPolarHBondContact O-CA 3.29Å; N378-Q382 WeakPolarHBondContact O-CB 3.33Å; N378-Q382 PolarHBondContact O-N 3.49Å
379	Y	62.2	Low	53	Low	7 Å²	7	77.6 Å²	77.6	3%	0.027	38%	0.378	C	S	.	.	H	α-helix	trans	-67.3	-40.9	174.6	176	-110.3	0	0	0	111.6	F273 Y276 E375 F376 R381 Q382 Q383	F273-Y379 AromaticContact CD2-CD1 3.95Å; F273-Y379 HydrophobicContact CD2-CD1 3.95Å; F273-Y379 AromaticContact CD2-CE1 3.54Å; F273-Y379 HydrophobicContact CD2-CE1 3.54Å; F273-Y379 AromaticContact CE2-CD1 3.96Å; F273-Y379 HydrophobicContact CE2-CD1 3.96Å; F273-Y379 AromaticContact CE2-CE1 3.55Å; F273-Y379 HydrophobicContact CE2-CE1 3.55Å; Y276-Y379 AromaticContact CD2-CD1 3.77Å; Y276-Y379 HydrophobicContact CD2-CD1 3.77Å; Y276-Y379 AromaticContact CD2-CD2 3.83Å; Y276-Y379 HydrophobicContact CD2-CD2 3.83Å; Y276-Y379 AromaticContact CD2-CE1 3.63Å; Y276-Y379 HydrophobicContact CD2-CE1 3.63Å; Y276-Y379 AromaticContact CD2-CE2 3.64Å; Y276-Y379 HydrophobicContact CD2-CE2 3.64Å; Y276-Y379 AromaticContact CD2-CG 3.82Å; Y276-Y379 HydrophobicContact CD2-CG 3.82Å; Y276-Y379 AromaticContact CD2-CZ 3.51Å; Y276-Y379 AromaticContact CE2-CD1 3.73Å; Y276-Y379 HydrophobicContact CE2-CD1 3.73Å; Y276-Y379 AromaticContact CE2-CD2 3.03Å; Y276-Y379 HydrophobicContact CE2-CD2 3.03Å; Y276-Y379 AromaticContact CE2-CE1 3.89Å; Y276-Y379 HydrophobicContact CE2-CE1 3.89Å; Y276-Y379 AromaticContact CE2-CE2 3.18Å; Y276-Y379 HydrophobicContact CE2-CE2 3.18Å; Y276-Y379 AromaticContact CE2-CG 3.26Å; Y276-Y379 HydrophobicContact CE2-CG 3.26Å; Y276-Y379 AromaticContact CE2-CZ 3.6Å; Y276-Y379 AromaticContact CZ-CD2 3.71Å; Y276-Y379 AromaticContact CZ-CG 3.73Å; E375-Y379 WeakPolarHBondContact O-CB 3.38Å; E375-Y379 PolarHBondContact O-N 3.14Å; F376-Y379 PolarHBondContact O-N 3.07Å; Y379-R381 VanDerWaalsContact C-N 3.34Å; Y379-Q382 CarbonylContact O-C 3.59Å; Y379-Q382 WeakPolarHBondContact O-CA 3.42Å; Y379-Q382 WeakPolarHBondContact O-CB 3.07Å; Y379-Q382 PolarHBondContact O-N 3.24Å; Y379-Q382 VanDerWaalsContact O-N 3.08Å; Y379-Q383 HydrophobicContact CD1-CG 4.06Å; Y379-Q383 HydrophobicContact CD2-CG 4.19Å; Y379-Q383 HydrophobicContact CE1-CG 3.57Å; Y379-Q383 HydrophobicContact CE2-CG 3.77Å; Y379-Q383 HydrophobicContact CG-CG 4.38Å; Y379-Q383 VanDerWaalsContact CZ-CG 3.46Å; Y379-Q383 WeakPolarHBondContact O-CG 3.35Å; Y379-Q383 PolarHBondContact O-N 3.47Å; Y379-Q383 PolarHBondContact OH-NE2 2.97Å
380	M	60.7	Low	52.6	Low	2 Å²	2	76.9 Å²	76.9	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-66.7	-39.2	175.1	-82	-62.2	-106.4	0	0	111.5	Q161 I165 F273 F376 E377 Q382 Q383 L384	Q161-M380 HydrophobicContact CG-CE 3.47Å; Q161-M380 VanDerWaalsContact CG-CE 3.47Å; I165-M380 HydrophobicContact CD1-CB 4.09Å; I165-M380 HydrophobicContact CD1-CE 4.22Å; I165-M380 HydrophobicContact CG1-CB 4.46Å; I165-M380 HydrophobicContact CG1-CE 4.3Å; F273-M380 HydrophobicContact CD2-SD 4.45Å; F273-M380 HydrophobicContact CE2-CE 4.2Å; F273-M380 HydrophobicContact CE2-CG 4.31Å; F273-M380 HydrophobicContact CE2-SD 3.31Å; F273-M380 WeakPolarHBondContact CE2-SD 3.25Å; F273-M380 HydrophobicContact CZ-CE 4.11Å; F273-M380 HydrophobicContact CZ-SD 3.65Å; F376-M380 HydrophobicContact CD1-CG 4.42Å; F376-M380 HydrophobicContact CD2-CG 4.23Å; F376-M380 HydrophobicContact CE1-CG 3.77Å; F376-M380 HydrophobicContact CE2-CG 3.53Å; F376-M380 HydrophobicContact CE2-SD 4.33Å; F376-M380 HydrophobicContact CZ-CE 4.17Å; F376-M380 HydrophobicContact CZ-CG 3.3Å; F376-M380 HydrophobicContact CZ-SD 4.23Å; F376-M380 WeakPolarHBondContact O-CB 3.15Å; F376-M380 PolarHBondContact O-N 3.19Å; E377-M380 PolarHBondContact O-N 2.71Å; M380-Q382 VanDerWaalsContact C-N 3.29Å; M380-Q383 PolarHBondContact O-N 2.77Å; M380-L384 WeakPolarHBondContact O-CB 3.47Å; M380-L384 PolarHBondContact O-N 3.31Å
381	R	61	Low	52.1	Low	176 Å²	176	73.7 Å²	73.7	66%	0.664	36%	0.361	S	S	*	.	H	α-helix	trans	-60.7	-40.8	167.1	-120.5	175.9	176.7	-150.4	-2.8	111.1	E377 N378 Y379 L384 L385	E377-R381 WeakPolarHBondContact O-CB 3.17Å; E377-R381 PolarHBondContact O-N 2.84Å; N378-R381 CarbonylContact O-C 3.53Å; N378-R381 WeakPolarHBondContact O-CB 3.47Å; N378-R381 PolarHBondContact O-N 3.15Å; Y379-R381 VanDerWaalsContact C-N 3.34Å; R381-L384 WeakPolarHBondContact O-CB 3.43Å; R381-L384 PolarHBondContact O-N 3.26Å; R381-L385 WeakPolarHBondContact O-CB 3.46Å; R381-L385 WeakPolarHBondContact O-CD1 3.21Å; R381-L385 WeakPolarHBondContact O-CG 3.47Å; R381-L385 PolarHBondContact O-N 2.61Å
382	Q	59.9	Low	51.6	Low	99 Å²	99	75.3 Å²	75.3	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-71.9	-31	178.7	-165.3	179.1	27.6	0	0	111.5	N378 Y379 M380 L385 L386	N378-Q382 WeakPolarHBondContact O-CA 3.29Å; N378-Q382 WeakPolarHBondContact O-CB 3.33Å; N378-Q382 PolarHBondContact O-N 3.49Å; Y379-Q382 CarbonylContact O-C 3.59Å; Y379-Q382 WeakPolarHBondContact O-CA 3.42Å; Y379-Q382 WeakPolarHBondContact O-CB 3.07Å; Y379-Q382 PolarHBondContact O-N 3.24Å; Y379-Q382 VanDerWaalsContact O-N 3.08Å; M380-Q382 VanDerWaalsContact C-N 3.29Å; Q382-L385 CarbonylContact O-C 3.51Å; Q382-L385 PolarHBondContact O-N 2.81Å; Q382-L386 HydrophobicContact CG-CD1 3.91Å; Q382-L386 HydrophobicContact CG-CG 4.1Å; Q382-L386 WeakPolarHBondContact O-CA 3.48Å; Q382-L386 WeakPolarHBondContact O-CB 3.26Å; Q382-L386 WeakPolarHBondContact O-CG 3.26Å; Q382-L386 PolarHBondContact O-N 3.07Å
383	Q	55.7	Low	50.6	Low	30 Å²	30	78.7 Å²	78.7	14%	0.14	38%	0.381	C	S	.	.	H	α-helix	trans	-75	-33.1	171.2	-73.4	-54.2	-43.6	0	0	110.9	Y379 M380 A387	Y379-Q383 HydrophobicContact CD1-CG 4.06Å; Y379-Q383 HydrophobicContact CD2-CG 4.19Å; Y379-Q383 HydrophobicContact CE1-CG 3.57Å; Y379-Q383 HydrophobicContact CE2-CG 3.77Å; Y379-Q383 HydrophobicContact CG-CG 4.38Å; Y379-Q383 VanDerWaalsContact CZ-CG 3.46Å; Y379-Q383 WeakPolarHBondContact O-CG 3.35Å; Y379-Q383 PolarHBondContact O-N 3.47Å; Y379-Q383 PolarHBondContact OH-NE2 2.97Å; M380-Q383 PolarHBondContact O-N 2.77Å; Q383-A387 VanDerWaalsContact O-CB 3.22Å; Q383-A387 WeakPolarHBondContact O-CB 3.35Å; Q383-A387 PolarHBondContact O-N 3.36Å
384	L	52	Low	49.7	Very low	75 Å²	75	84.1 Å²	84.1	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-49.2	167.9	-163.2	73.2	0	0	0	109.4	M380 R381 A387 E388	M380-L384 WeakPolarHBondContact O-CB 3.47Å; M380-L384 PolarHBondContact O-N 3.31Å; R381-L384 WeakPolarHBondContact O-CB 3.43Å; R381-L384 PolarHBondContact O-N 3.26Å; L384-A387 WeakPolarHBondContact O-CB 3.03Å; L384-A387 PolarHBondContact O-N 3.24Å; L384-E388 WeakPolarHBondContact O-CG 3.3Å; L384-E388 PolarHBondContact O-N 2.75Å
385	L	47.9	Very low	48.5	Very low	88 Å²	88	84.1 Å²	84.1	46%	0.461	41%	0.411	S	S	.	.	H	α-helix	trans	-65.8	-38.3	176.2	-69	164.6	0	0	0	113.2	R381 Q382 E388 E389	R381-L385 WeakPolarHBondContact O-CB 3.46Å; R381-L385 WeakPolarHBondContact O-CD1 3.21Å; R381-L385 WeakPolarHBondContact O-CG 3.47Å; R381-L385 PolarHBondContact O-N 2.61Å; Q382-L385 CarbonylContact O-C 3.51Å; Q382-L385 PolarHBondContact O-N 2.81Å; L385-E388 WeakPolarHBondContact CD2-OE2 3.47Å; L385-E388 CarbonylContact O-C 3.36Å; L385-E388 WeakPolarHBondContact O-CA 3.24Å; L385-E388 WeakPolarHBondContact O-CB 3.49Å; L385-E388 WeakPolarHBondContact O-CG 3.47Å; L385-E388 PolarHBondContact O-N 3.43Å; L385-E389 PolarHBondContact O-N 3.08Å
386	L	43.4	Very low	46.9	Very low	29 Å²	29	83.5 Å²	83.5	15%	0.152	43%	0.425	C	S	.	.	H	α-helix	trans	-79.4	-24.7	179.1	-75.3	169.6	0	0	0	111.4	Q382 E388 E389 K390	Q382-L386 HydrophobicContact CG-CD1 3.91Å; Q382-L386 HydrophobicContact CG-CG 4.1Å; Q382-L386 WeakPolarHBondContact O-CA 3.48Å; Q382-L386 WeakPolarHBondContact O-CB 3.26Å; Q382-L386 WeakPolarHBondContact O-CG 3.26Å; Q382-L386 PolarHBondContact O-N 3.07Å; L386-E388 PolarHBondContact O-N 3.28Å; L386-E389 HydrophobicContact CD2-CB 4.34Å; L386-E389 PolarHBondContact O-N 3.04Å; L386-K390 HydrophobicContact CB-CD 4.33Å; L386-K390 HydrophobicContact CB-CG 4.27Å; L386-K390 HydrophobicContact CD2-CG 4.33Å; L386-K390 WeakPolarHBondContact O-CB 3.31Å; L386-K390 WeakPolarHBondContact O-CG 3.19Å; L386-K390 PolarHBondContact O-N 3.47Å
387	A	43.7	Very low	45.7	Very low	55 Å²	55	92.4 Å²	92.4	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-65	-21.4	161	0	0	0	0	0	111.1	Q383 L384	Q383-A387 VanDerWaalsContact O-CB 3.22Å; Q383-A387 WeakPolarHBondContact O-CB 3.35Å; Q383-A387 PolarHBondContact O-N 3.36Å; L384-A387 WeakPolarHBondContact O-CB 3.03Å; L384-A387 PolarHBondContact O-N 3.24Å
388	E	39.5	Very low	44.4	Very low	100 Å²	100	93.3 Å²	93.3	47%	0.467	48%	0.477	S	S	.	.	H	α-helix	trans	-83.4	-34.1	168.6	-28.7	-170.2	125.8	0	0	112.2	N45 L384 L385 L386	N45-E388 VanDerWaalsContact ND2-CB 3.27Å; N45-E388 WeakPolarHBondContact ND2-CB 3.47Å; N45-E388 VanDerWaalsContact ND2-CD 3.31Å; N45-E388 WeakPolarHBondContact ND2-CG 3.37Å; N45-E388 PolarHBondContact ND2-OE1 3.31Å; L384-E388 WeakPolarHBondContact O-CG 3.3Å; L384-E388 PolarHBondContact O-N 2.75Å; L385-E388 WeakPolarHBondContact CD2-OE2 3.47Å; L385-E388 CarbonylContact O-C 3.36Å; L385-E388 WeakPolarHBondContact O-CA 3.24Å; L385-E388 WeakPolarHBondContact O-CB 3.49Å; L385-E388 WeakPolarHBondContact O-CG 3.47Å; L385-E388 PolarHBondContact O-N 3.43Å; L386-E388 PolarHBondContact O-N 3.28Å
389	E	33.4	Very low	42.8	Very low	120 Å²	120	99.7 Å²	99.7	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-94.6	-31.3	-175.8	-70.8	-176.8	156.6	0	0	116	L385 L386 N391 T392	L385-E389 PolarHBondContact O-N 3.08Å; L386-E389 HydrophobicContact CD2-CB 4.34Å; L386-E389 PolarHBondContact O-N 3.04Å; E389-N391 PolarHBondContact O-N 2.95Å; E389-T392 PolarHBondContact O-N 2.83Å; E389-T392 VanDerWaalsContact O-N 3.14Å; E389-T392 PolarHBondContact O-OG1 3.33Å
390	K	39.3	Very low	41.3	Very low	82 Å²	82	107.6 Å²	107.6	36%	0.357	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	4.6	-170.7	-77.7	-175.5	175.2	175.1	0	115.8	L386 T392	L386-K390 HydrophobicContact CB-CD 4.33Å; L386-K390 HydrophobicContact CB-CG 4.27Å; L386-K390 HydrophobicContact CD2-CG 4.33Å; L386-K390 WeakPolarHBondContact O-CB 3.31Å; L386-K390 WeakPolarHBondContact O-CG 3.19Å; L386-K390 PolarHBondContact O-N 3.47Å; K390-T392 PolarHBondContact O-N 3.25Å
391	N	38.9	Very low	39.8	Very low	63 Å²	63	113.9 Å²	113.9	34%	0.337	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	2	168	-59	-33.5	0	0	0	113.2	S46 P47 E389	S46-N391 PolarHBondContact O-ND2 3.28Å; P47-N391 VanDerWaalsContact CA-CG 3.46Å; P47-N391 WeakPolarHBondContact CA-ND2 3.44Å; P47-N391 VanDerWaalsContact CA-OD1 3.27Å; P47-N391 WeakPolarHBondContact CA-OD1 3.27Å; P47-N391 VanDerWaalsContact O-CB 3.31Å; P47-N391 WeakPolarHBondContact O-CB 3.46Å; P47-N391 PolarHBondContact O-OD1 3.48Å; E389-N391 PolarHBondContact O-N 2.95Å
392	T	35.1	Very low	38.5	Very low	104 Å²	104	115.6 Å²	115.6	64%	0.638	60%	0.595	S	S	*	*	S	Bend	trans	-107.6	-11.1	-179.3	56.2	0	0	0	0	115.1	E389 K390 H394	E389-T392 PolarHBondContact O-N 2.83Å; E389-T392 VanDerWaalsContact O-N 3.14Å; E389-T392 PolarHBondContact O-OG1 3.33Å; K390-T392 PolarHBondContact O-N 3.25Å; T392-H394 PolarHBondContact O-N 2.85Å
393	I	33.5	Very low	37	Very low	120 Å²	120	122.3 Å²	122.3	62%	0.615	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	8.7	-165	-55.9	-179.9	0	0	0	114.3
394	H	33.9	Very low	35.7	Very low	198 Å²	198	130.4 Å²	130.4	92%	0.917	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	4.2	173.1	-104.2	-54.5	0	0	0	116.5	T392	T392-H394 PolarHBondContact O-N 2.85Å
395	E	34.7	Very low	34.6	Very low	161 Å²	161	136.7 Å²	136.7	75%	0.752	68%	0.679	S	S	*	*	S	Bend	trans	-121.8	-4.9	-177.8	-75.2	-171.2	159.3	0	0	117.7	K397	E395-K397 PolarHBondContact O-N 2.88Å; E395-K397 VanDerWaalsContact O-N 3.09Å
396	A	29.4	Very low	33.8	Very low	92 Å²	92	135.7 Å²	135.7	76%	0.76	69%	0.689	S	S	*	*			trans	-92.2	70.7	-176.3	0	0	0	0	0	114
397	K	32.7	Very low	33.3	Very low	212 Å²	212	141.4 Å²	141.4	92%	0.922	72%	0.72	S	S	*	*	S	Bend	trans	-113.5	68.7	147.3	-88.3	-168.8	179.5	-179.8	0	109.7	E395	E395-K397 PolarHBondContact O-N 2.88Å; E395-K397 VanDerWaalsContact O-N 3.09Å
398	S	32.7	Very low	32.9	Very low	87 Å²	87	146.5 Å²	146.5	61%	0.608	74%	0.738	S	S	*	*	S	Bend	trans	179.5	152.4	139.9	55.5	0	0	0	0	109.2
399	F	29	Very low	32.5	Very low	193 Å²	193	146.8 Å²	146.8	85%	0.846	75%	0.749	S	S	*	*			trans	84.6	88.1	176.3	-55.6	-76.8	0	0	0	117.1
400	L	31.3	Very low	32.6	Very low	174 Å²	174	147.2 Å²	147.2	91%	0.911	76%	0.761	S	S	*	*			trans	-62.6	128.3	152.1	-79.1	152.6	0	0	0	109.9
401	T	27.8	Very low	32.3	Very low	133 Å²	133	150.1 Å²	150.1	82%	0.816	79%	0.786	S	S	*	*			trans	-152.8	129.3	142	22.1	0	0	0	0	110
402	K	33.8	Very low	32.1	Very low	213 Å²	213	158.3 Å²	158.3	93%	0.926	81%	0.812	S	S	*	*			trans	-56.4	132.8	176.6	-77.6	173.2	172.3	174.9	0	111
403	R	29.3	Very low	32.1	Very low	240 Å²	240	165.4 Å²	165.4	91%	0.906	83%	0.827	S	S	*	*			trans	-129.1	129.9	155	-80.2	-172	175.2	-176.8	-0.7	110.5
404	Q	29.3	Very low	32.2	Very low	199 Å²	199	168.3 Å²	168.3	93%	0.93	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-71.9	136	-179.4	-74.2	168	-30.9	0	0	110.8
405	F	28.9	Very low	32.4	Very low	208 Å²	208	161.7 Å²	161.7	91%	0.912	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-73.5	120.7	170.5	-86	-93.9	0	0	0	110.3
406	G	30.1	Very low	32.8	Very low	67 Å²	67	162.8 Å²	162.8	69%	0.691	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-97.2	133.3	167	0	0	0	0	0	110.7
407	N	33.6	Very low	33.4	Very low	148 Å²	148	165.8 Å²	165.8	79%	0.791	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-56.3	130.9	-174.9	-69.8	-22.8	0	0	0	114.3
408	I	35.4	Very low	33.9	Very low	163 Å²	163	160.6 Å²	160.6	84%	0.836	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-84.4	128.2	168.9	-59.3	170	0	0	0	108.6
409	P	30.9	Very low	34.5	Very low	106 Å²	106	164.2 Å²	164.2	69%	0.688	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-79.4	151.9	177	30.6	-31.2	0	0	0	112.2
410	P	34.3	Very low	35.2	Very low	128 Å²	128	160.6 Å²	160.6	83%	0.831	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-76.3	133.2	-169.8	29.4	-33.5	0	0	0	113.2
411	V	34.7	Very low	36.1	Very low	144 Å²	144	157.4 Å²	157.4	87%	0.873	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-78.1	119.3	174.3	179.1	0	0	0	0	109.7
412	R	33.9	Very low	37.7	Very low	235 Å²	235	153.2 Å²	153.2	89%	0.887	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-83.7	142.4	171.3	-81.5	-176.7	173.2	-176	-2.2	110.8
413	R	34.9	Very low	38.3	Very low	253 Å²	253	148.4 Å²	148.4	96%	0.955	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-60.8	131	179.2	-65.8	-176.7	-169.5	-146.4	2.2	111.3	G415	R413-G415 PolarHBondContact O-N 2.84Å
414	L	35.1	Very low	39.1	Very low	180 Å²	180	145.2 Å²	145.2	94%	0.942	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.9	117.2	174.6	-80.9	152.7	0	0	0	110.3
415	G	39.4	Very low	40	Very low	60 Å²	60	139.8 Å²	139.8	62%	0.619	76%	0.761	S	S	*	*			trans	-160.1	2.4	170.9	0	0	0	0	0	114.9	R413	R413-G415 PolarHBondContact O-N 2.84Å
416	H	42	Very low	41	Very low	184 Å²	184	132.4 Å²	132.4	85%	0.852	74%	0.738	S	S	*	*	S	Bend	trans	-145.3	139	176.5	-65.9	86.4	0	0	0	108.9
417	D	43.1	Very low	41.8	Very low	154 Å²	154	133 Å²	133	82%	0.824	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-59.5	146.2	-180	-69.9	-34.8	0	0	0	112.2	Q419	D417-Q419 PolarHBondContact O-N 3.42Å
418	A	43.3	Very low	42.4	Very low	104 Å²	104	128.7 Å²	128.7	86%	0.86	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-62.7	116.7	-178.1	0	0	0	0	0	111.4
419	Q	45	Very low	43.1	Very low	162 Å²	162	126 Å²	126	76%	0.757	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-93.6	147.6	169.8	-69.4	-70.4	-37.3	0	0	110.4	D417 V421	D417-Q419 PolarHBondContact O-N 3.42Å; Q419-V421 PolarHBondContact O-N 3.35Å
420	P	43.8	Very low	43.8	Very low	118 Å²	118	123.7 Å²	123.7	77%	0.766	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-61	134.7	175.3	-17.2	29.1	0	0	0	111.5	S422	P420-S422 PolarHBondContact O-N 3.31Å
421	V	49.9	Very low	44.3	Very low	107 Å²	107	124.5 Å²	124.5	65%	0.648	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-64.7	128.2	-179.7	-179.2	0	0	0	0	110	Q419 D425	Q419-V421 PolarHBondContact O-N 3.35Å; V421-D425 HydrophobicContact CG1-CB 3.7Å
422	S	60.4	Low	44.7	Very low	45 Å²	45	128.1 Å²	128.1	32%	0.315	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-73.2	153.4	178.2	81.2	0	0	0	0	111.3	P420 F424 D425 A426	P420-S422 PolarHBondContact O-N 3.31Å; S422-F424 PolarHBondContact O-N 3.45Å; S422-F424 PolarHBondContact OG-N 3.23Å; S422-D425 PolarHBondContact N-OD2 2.91Å; S422-D425 PolarHBondContact O-N 3.23Å; S422-D425 PolarHBondContact OG-N 3.09Å; S422-D425 PolarHBondContact OG-OD2 2.97Å; S422-A426 PolarHBondContact O-N 3.39Å
423	P	46.4	Very low	45.1	Very low	112 Å²	112	125.1 Å²	125.1	73%	0.727	68%	0.675	S	S	*	*	H	α-helix	trans	-56.7	-25	175.4	-24	33.4	0	0	0	113.4	T427	P423-T427 PolarHBondContact O-N 3.09Å; P423-T427 PolarHBondContact O-OG1 3.23Å
424	F	46.4	Very low	45.5	Very low	172 Å²	172	120.3 Å²	120.3	75%	0.754	67%	0.667	S	S	*	*	H	α-helix	trans	-71.9	-39.3	178.1	-153	-95.6	0	0	0	111.8	S422 T427 A428	S422-F424 PolarHBondContact O-N 3.45Å; S422-F424 PolarHBondContact OG-N 3.23Å; F424-T427 PolarHBondContact O-N 2.85Å; F424-A428 PolarHBondContact O-N 3.09Å
425	D	48.6	Very low	46.1	Very low	85 Å²	85	122.7 Å²	122.7	46%	0.455	66%	0.664	S	S	.	*	H	α-helix	trans	-70.4	-34.6	178.5	-62.7	-50.3	0	0	0	112.4	V421 S422 T427 L429	V421-D425 HydrophobicContact CG1-CB 3.7Å; S422-D425 PolarHBondContact N-OD2 2.91Å; S422-D425 PolarHBondContact O-N 3.23Å; S422-D425 PolarHBondContact OG-N 3.09Å; S422-D425 PolarHBondContact OG-OD2 2.97Å; D425-T427 VanDerWaalsContact C-N 3.3Å; D425-T427 PolarHBondContact O-N 3.43Å; D425-L429 PolarHBondContact O-N 2.73Å
426	A	49.7	Very low	46.1	Very low	53 Å²	53	132.1 Å²	132.1	44%	0.438	69%	0.688	S	S	.	*	H	α-helix	trans	-64.6	-35.8	174.5	0	0	0	0	0	112	S422 L429 A430	S422-A426 PolarHBondContact O-N 3.39Å; A426-L429 PolarHBondContact O-N 3.31Å; A426-A430 PolarHBondContact O-N 2.7Å; A426-A430 VanDerWaalsContact O-N 3.15Å
427	T	47.6	Very low	46.3	Very low	80 Å²	80	129.5 Å²	129.5	49%	0.491	68%	0.679	S	S	.	*	H	α-helix	trans	-73.2	-37.1	-178.5	-47.7	0	0	0	0	111.6	P423 F424 D425 A430 Q431	P423-T427 PolarHBondContact O-N 3.09Å; P423-T427 PolarHBondContact O-OG1 3.23Å; F424-T427 PolarHBondContact O-N 2.85Å; D425-T427 VanDerWaalsContact C-N 3.3Å; D425-T427 PolarHBondContact O-N 3.43Å; T427-A430 PolarHBondContact O-N 2.82Å; T427-Q431 PolarHBondContact O-N 2.82Å
428	A	45.4	Very low	46.5	Very low	58 Å²	58	128.2 Å²	128.2	48%	0.479	67%	0.672	S	S	.	*	H	α-helix	trans	-67.9	-33.7	175.3	0	0	0	0	0	113	F424	F424-A428 PolarHBondContact O-N 3.09Å
429	L	49.6	Very low	46.7	Very low	106 Å²	106	129.6 Å²	129.6	56%	0.555	66%	0.661	S	S	*	*	H	α-helix	trans	-69	-41.1	173.6	-90.5	157.1	0	0	0	112	D425 A426 Q431 R432 F433	D425-L429 PolarHBondContact O-N 2.73Å; A426-L429 PolarHBondContact O-N 3.31Å; L429-Q431 PolarHBondContact O-N 2.9Å; L429-R432 PolarHBondContact O-N 3.16Å; L429-F433 WeakPolarHBondContact O-CD2 3.43Å
430	A	45.8	Very low	46.8	Very low	57 Å²	57	127.6 Å²	127.6	47%	0.471	66%	0.656	S	S	.	*	H	α-helix	trans	-64.1	-37.4	179.2	0	0	0	0	0	113.1	A426 T427 R432 F433	A426-A430 PolarHBondContact O-N 2.7Å; A426-A430 VanDerWaalsContact O-N 3.15Å; T427-A430 PolarHBondContact O-N 2.82Å; A430-R432 PolarHBondContact O-N 3Å; A430-F433 PolarHBondContact O-N 3.36Å
431	Q	44.9	Very low	47	Very low	146 Å²	146	128.3 Å²	128.3	68%	0.682	65%	0.649	S	S	*	*	H	α-helix	trans	-68.1	-22.4	177.8	-73.6	-175.7	-11.2	0	0	113.6	T427 L429	T427-Q431 PolarHBondContact O-N 2.82Å; L429-Q431 PolarHBondContact O-N 2.9Å
432	R	44.1	Very low	46.8	Very low	219 Å²	219	129.7 Å²	129.7	83%	0.826	65%	0.649	S	S	*	*	H	α-helix	trans	-80.4	-17.2	-179.5	-140	173	179.6	176.7	-0.4	113.2	L429 A430	L429-R432 PolarHBondContact O-N 3.16Å; A430-R432 PolarHBondContact O-N 3Å
433	F	41.8	Very low	45.8	Very low	172 Å²	172	135.7 Å²	135.7	75%	0.754	67%	0.673	S	S	*	*	H	α-helix	trans	-90.3	-13.8	178.1	-85.6	-83.2	0	0	0	114.4	L429 A430	L429-F433 WeakPolarHBondContact O-CD2 3.43Å; A430-F433 PolarHBondContact O-N 3.36Å
434	L	43	Very low	45.8	Very low	153 Å²	153	137.5 Å²	137.5	80%	0.801	67%	0.669	S	S	*	*	S	Bend	trans	-94.6	7.8	-178	-78	162.3	0	0	0	114.5
435	R	47.3	Very low	45.7	Very low	229 Å²	229	134.7 Å²	134.7	86%	0.864	66%	0.662	S	S	*	*			trans	-117.1	70.2	170	-72.9	-172.2	179.5	-176.2	0.9	110.6
436	K	40.6	Very low	45.4	Very low	258 Å²	258	139.2 Å²	139.2	100%	1.122	68%	0.68	S	S	*	*			trans	-145.9	0	151.1	-84.5	-161.2	177	-176.7	0	109.5

Retrieved 436 of 436 residues in 992.4 ms (Link to these results)

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