G4VSL7_SCHMA Loading...

Obg-like ATPase 1

Hydrolyzes ATP, and can also hydrolyze GTP with lower efficiency. Has lower affinity for GTP.

AlphaFold DB , UniProt , Accession G4VSL7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 396 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	39.1	Very low	242 Å²	242	162.1 Å²	162.1	100%	1.192	84%	0.838	S	S	*	*				0	103.9	0	-64.4	-176.8	-161.5	0	0	108.3	K3	M1-K3 PolarHBondContact O-N 2.95Å
2	S	36.7	Very low	41	Very low	118 Å²	118	158.7 Å²	158.7	83%	0.825	83%	0.83	S	S	*	*			trans	-69.1	108.6	-177.4	40.3	0	0	0	0	110.1	K4	S2-K4 PolarHBondContact O-N 3.3Å; S2-K4 VanDerWaalsContact O-N 3.07Å
3	K	34.7	Very low	43.7	Very low	202 Å²	202	149.3 Å²	149.3	88%	0.878	78%	0.783	S	S	*	*			trans	-59.1	111.9	165.1	-80.8	178.1	173.7	177.5	0	107.4	M1 K5	M1-K3 PolarHBondContact O-N 2.95Å; K3-K5 PolarHBondContact O-N 3.48Å
4	K	36.4	Very low	46.7	Very low	206 Å²	206	142 Å²	142	90%	0.896	75%	0.745	S	S	*	*			trans	-48.3	115.8	167.5	-80.4	178.5	171.9	179.6	0	107.3	S2 G6	S2-K4 PolarHBondContact O-N 3.3Å; S2-K4 VanDerWaalsContact O-N 3.07Å; K4-G6 PolarHBondContact O-N 3.43Å
5	K	37.7	Very low	49.6	Very low	208 Å²	208	136.1 Å²	136.1	90%	0.904	71%	0.714	S	S	*	*			trans	-54.8	109.7	166.9	-80.7	177.2	172.5	178.4	0	105.7	K3 D7	K3-K5 PolarHBondContact O-N 3.48Å; K5-D7 PolarHBondContact O-N 3.29Å
6	G	37	Very low	52.2	Low	64 Å²	64	128.8 Å²	128.8	66%	0.66	68%	0.681	S	S	*	*			trans	-56.2	132.5	171.5	0	0	0	0	0	107.8	K4 V8	K4-G6 PolarHBondContact O-N 3.43Å; G6-V8 PolarHBondContact O-N 2.98Å
7	D	39.7	Very low	54.4	Low	164 Å²	164	125.7 Å²	125.7	88%	0.877	66%	0.658	S	S	*	*			trans	-51.8	104.6	170.9	-91.3	-40.2	0	0	0	107.8	K5 P9	K5-D7 PolarHBondContact O-N 3.29Å; D7-P9 WeakPolarHBondContact O-CD 3.44Å
8	V	36.1	Very low	56.1	Low	125 Å²	125	125.1 Å²	125.1	76%	0.758	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-62.7	121.4	169.3	-179.8	0	0	0	0	104.7	G6 K10	G6-V8 PolarHBondContact O-N 2.98Å; V8-K10 PolarHBondContact O-N 3.33Å
9	P	41.5	Very low	57.7	Low	116 Å²	116	119.3 Å²	119.3	75%	0.753	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-52.5	122	-179.5	-23.5	31.8	0	0	0	108.5	D7 K11	D7-P9 WeakPolarHBondContact O-CD 3.44Å; P9-K11 PolarHBondContact O-N 3.1Å
10	K	45	Very low	58.9	Low	197 Å²	197	115.1 Å²	115.1	86%	0.857	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-50.8	116.6	175.9	-81.2	179.8	176.5	179.1	0	107	V8 T12	V8-K10 PolarHBondContact O-N 3.33Å; K10-T12 VanDerWaalsContact C-N 3.35Å; K10-T12 PolarHBondContact O-N 2.82Å
11	K	49	Very low	60.3	Low	141 Å²	141	115 Å²	115	61%	0.613	61%	0.607	S	S	*	*			trans	-59.1	100.6	174.2	-167.4	-171.6	179.1	-159.9	0	106.2	P9 V13 E210	P9-K11 PolarHBondContact O-N 3.1Å; K11-V13 VanDerWaalsContact C-N 3.29Å; K11-V13 HydrophobicContact CD-CG2 4.17Å; K11-V13 HydrophobicContact CG-CG2 4.14Å; K11-V13 PolarHBondContact O-N 3.01Å; K11-E210 IonicContact NZ-OE1 3.21Å; K11-E210 PolarHBondContact NZ-OE1 2.78Å
12	T	61.7	Low	62.8	Low	121 Å²	121	103.9 Å²	103.9	74%	0.742	55%	0.553	S	S	*	*			trans	-74.6	89	176.4	45.8	0	0	0	0	107.1	K10	K10-T12 VanDerWaalsContact C-N 3.35Å; K10-T12 PolarHBondContact O-N 2.82Å
13	V	76.4	Confident	65.5	Low	37 Å²	37	100.4 Å²	100.4	22%	0.224	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-76.5	122.2	172.1	-169.5	0	0	0	0	107	K11 P206 V209 E210	K11-V13 VanDerWaalsContact C-N 3.29Å; K11-V13 HydrophobicContact CD-CG2 4.17Å; K11-V13 HydrophobicContact CG-CG2 4.14Å; K11-V13 PolarHBondContact O-N 3.01Å; V13-P206 HydrophobicContact CG2-CB 3.83Å; V13-V209 HydrophobicContact CB-CB 4.13Å; V13-V209 HydrophobicContact CB-CG1 3.94Å; V13-V209 HydrophobicContact CG1-CB 3.92Å; V13-V209 HydrophobicContact CG1-CG1 3.46Å; V13-V209 VanDerWaalsContact CG1-CG1 3.46Å; V13-E210 HydrophobicContact CG1-CG 4.17Å
14	L	85.6	Confident	68.4	Low	47 Å²	47	90.8 Å²	90.8	25%	0.246	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-79.5	134.8	177.8	-63	173.5	0	0	0	109.4	I18 V209 N213 Q302 Q320	L14-I18 HydrophobicContact CB-CD1 4.14Å; L14-V209 WeakPolarHBondContact O-CG1 3.49Å; L14-N213 PolarHBondContact O-ND2 2.89Å; L14-Q302 HydrophobicContact CD1-CB 4.46Å; L14-Q320 HydrophobicContact CD1-CG 3.79Å
15	L	90	Very high	71.1	Confident	54 Å²	54	81 Å²	81	28%	0.283	44%	0.438	S	S	.	.	S	Bend	trans	-74.9	133.2	169.5	-174.8	66.2	0	0	0	109.4	V209 L212	L15-V209 HydrophobicContact CB-CG1 4.34Å; L15-V209 HydrophobicContact CD1-CG1 4.35Å; L15-L212 HydrophobicContact CD1-CB 3.68Å; L15-L212 HydrophobicContact CD1-CD1 3.77Å; L15-L212 HydrophobicContact CD1-CG 4.38Å
16	G	91	Very high	73.7	Confident	19 Å²	19	71 Å²	71	20%	0.196	40%	0.395	C	S	.	.	S	Bend	trans	106.7	-175.6	-174.2	0	0	0	0	0	113.3	N213	G16-N213 PolarHBondContact N-OD1 3.29Å; G16-N213 PolarHBondContact O-ND2 3.08Å; G16-N213 PolarHBondContact O-OD1 3.03Å
17	R	90	Very high	76.3	Confident	76 Å²	76	68 Å²	68	29%	0.287	36%	0.364	S	S	.	.			trans	-67.2	139.1	-179.2	-64.7	-168.1	-173	110.4	-3.1	111.2	L22 R114 G115 V116 D117 L216 Q320	R17-L22 HydrophobicContact CB-CD2 3.9Å; R17-R114 PolarHBondContact NH2-O 3.42Å; R17-G115 PolarHBondContact NH1-O 3.02Å; R17-V116 PolarHBondContact NH1-O 2.86Å; R17-D117 WeakPolarHBondContact CB-OD1 3.37Å; R17-D117 WeakPolarHBondContact CD-OD1 3.49Å; R17-D117 VanDerWaalsContact CG-OD1 3.28Å; R17-D117 WeakPolarHBondContact CG-OD1 3.5Å; R17-D117 IonicContact CZ-OD1 3.38Å; R17-D117 IonicContact NE-OD1 3.61Å; R17-D117 IonicContact NH1-OD1 2.88Å; R17-D117 PolarHBondContact NH1-OD1 3.37Å; R17-D117 IonicContact NH1-OD2 3.12Å; R17-L216 HydrophobicContact CG-CD1 4.13Å; R17-L216 HydrophobicContact CG-CD2 3.52Å; R17-L216 HydrophobicContact CG-CG 4.49Å; R17-L216 VanDerWaalsContact NE-CD1 3.31Å; R17-Q320 PolarHBondContact O-NE2 2.93Å
18	I	84.9	Confident	78.8	Confident	114 Å²	114	60.2 Å²	60.2	59%	0.585	32%	0.322	S	S	*	.			trans	-91	122.3	170.1	-54.5	-58.1	0	0	0	108.4	L14	L14-I18 HydrophobicContact CB-CD1 4.14Å
19	G	86	Confident	81.3	Confident	16 Å²	16	54.3 Å²	54.3	17%	0.165	29%	0.287	C	S	.	.	S	Bend	trans	159.3	176.3	-177	0	0	0	0	0	113.2	L22	G19-L22 WeakPolarHBondContact O-CG 3.43Å
20	T	83.1	Confident	83.4	Confident	35 Å²	35	50.2 Å²	50.2	22%	0.215	26%	0.26	C	S	.	.	S	Bend	trans	-111.9	-13	179.7	54.4	0	0	0	0	113	L22 T318 R331	T20-L22 PolarHBondContact O-N 3.12Å; T20-T318 HydrophobicContact CG2-CG2 4.08Å; T20-T318 VanDerWaalsContact CG2-O 3.29Å; T20-T318 WeakPolarHBondContact CG2-O 3.18Å; T20-R331 PolarHBondContact OG1-NH1 3.44Å
21	N	86.7	Confident	85.4	Confident	112 Å²	112	45.1 Å²	45.1	60%	0.599	24%	0.242	S	C	*	.			trans	-93.4	52.8	174.9	-165.2	26.1	0	0	0	110.5	N88	N21-N88 PolarHBondContact OD1-ND2 2.75Å
22	L	90.1	Very high	87.4	Confident	9 Å²	9	38.5 Å²	38.5	5%	0.047	21%	0.213	C	C	.	.			trans	-88	153.7	-179.9	-52	178.8	0	0	0	110.3	R17 G19 T20 N88 D117 L301 L303	R17-L22 HydrophobicContact CB-CD2 3.9Å; G19-L22 WeakPolarHBondContact O-CG 3.43Å; T20-L22 PolarHBondContact O-N 3.12Å; L22-N88 PolarHBondContact O-ND2 3.32Å; L22-D117 WeakPolarHBondContact CA-OD2 3.36Å; L22-D117 HydrophobicContact CB-CB 4.09Å; L22-D117 HydrophobicContact CD2-CB 4.33Å; L22-L301 HydrophobicContact CB-CB 4.37Å; L22-L301 HydrophobicContact CB-CD1 4.17Å; L22-L301 HydrophobicContact CB-CD2 3.95Å; L22-L301 HydrophobicContact CB-CG 4.4Å; L22-L301 HydrophobicContact CD1-CB 4.31Å; L22-L301 WeakPolarHBondContact CD1-O 3.4Å; L22-L303 HydrophobicContact CB-CD1 4.3Å; L22-L303 HydrophobicContact CD1-CD2 3.93Å; L22-L303 HydrophobicContact CD1-CG 4.24Å; L22-L303 HydrophobicContact CG-CD2 4.45Å
23	K	93.3	Very high	88.8	Confident	45 Å²	45	33.3 Å²	33.3	20%	0.196	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	142.9	-171.8	-50.1	-173.8	-175.6	-168.6	0	112.4	E60 N88 V90 V116 D117 A118	K23-E60 WeakPolarHBondContact CD-OE1 3.49Å; K23-E60 WeakPolarHBondContact CE-OE1 3.47Å; K23-E60 IonicContact NZ-OE1 2.78Å; K23-E60 PolarHBondContact NZ-OE1 2.9Å; K23-E60 IonicContact NZ-OE2 2.88Å; K23-E60 PolarHBondContact NZ-OE2 3.5Å; K23-N88 WeakPolarHBondContact CA-O 3.44Å; K23-N88 HydrophobicContact CB-CB 4.33Å; K23-N88 HydrophobicContact CG-CB 3.9Å; K23-V90 HydrophobicContact CB-CG2 4.19Å; K23-V90 HydrophobicContact CD-CG2 3.79Å; K23-V116 HydrophobicContact CB-CB 4.47Å; K23-V116 HydrophobicContact CB-CG1 4.3Å; K23-D117 PolarHBondContact N-OD2 3.46Å; K23-D117 PolarHBondContact O-N 3.44Å; K23-A118 PolarHBondContact O-N 3.3Å
24	C	94.7	Very high	89.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.5	165.7	-69.3	0	0	0	0	110	N88 V89 V90 A118 F120	C24-N88 PolarHBondContact N-O 3.16Å; C24-V89 CarbonylContact O-C 3.54Å; C24-V89 VanDerWaalsContact O-CA 3.29Å; C24-V89 WeakPolarHBondContact O-CA 3.22Å; C24-V90 PolarHBondContact O-N 3.32Å; C24-A118 CarbonylContact C-O 3.57Å; C24-A118 WeakPolarHBondContact CA-O 3.33Å; C24-F120 HydrophobicContact CB-CD2 3.59Å; C24-F120 HydrophobicContact CB-CE2 3.42Å; C24-F120 VanDerWaalsContact CB-CE2 3.42Å; C24-F120 HydrophobicContact CB-CZ 4.31Å
25	G	93.4	Very high	89.3	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.1	172.8	0	0	0	0	0	112.2	V90 A118 I119 F120	G25-V90 WeakPolarHBondContact CA-O 3.34Å; G25-A118 PolarHBondContact N-O 3.4Å; G25-I119 CarbonylContact O-C 3.53Å; G25-I119 WeakPolarHBondContact O-CA 3.49Å; G25-F120 PolarHBondContact O-N 2.74Å
26	V	93	Very high	89.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.7	175	-170.4	0	0	0	0	109.5	K34 F37 V89 V90 I92 F120 M122	V26-K34 HydrophobicContact CG1-CB 4.04Å; V26-K34 HydrophobicContact CG1-CD 4.1Å; V26-K34 HydrophobicContact CG1-CG 3.84Å; V26-F37 HydrophobicContact CG1-CD1 4.22Å; V26-F37 HydrophobicContact CG2-CD1 4.02Å; V26-F37 HydrophobicContact CG2-CE1 3.81Å; V26-V89 HydrophobicContact CG2-CG1 3.67Å; V26-V90 PolarHBondContact N-O 3.12Å; V26-I92 VanDerWaalsContact O-CB 3.31Å; V26-I92 WeakPolarHBondContact O-CB 3.23Å; V26-I92 PolarHBondContact O-N 3.29Å; V26-F120 WeakPolarHBondContact CA-O 3.37Å; V26-F120 HydrophobicContact CG2-CB 4.39Å; V26-F120 HydrophobicContact CG2-CD2 4.41Å; V26-M122 HydrophobicContact CG1-CE 4.08Å
27	V	91.9	Very high	89.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.3	-175	168.5	0	0	0	0	109.7	I92 F109 I113 I119 F120 H121 M122 I147	V27-I92 HydrophobicContact CG2-CD1 3.91Å; V27-F109 HydrophobicContact CB-CE2 4.4Å; V27-F109 HydrophobicContact CB-CZ 4.2Å; V27-F109 HydrophobicContact CG1-CE2 4.04Å; V27-F109 HydrophobicContact CG1-CZ 3.54Å; V27-F109 HydrophobicContact CG2-CE2 4.03Å; V27-F109 HydrophobicContact CG2-CZ 3.79Å; V27-I113 HydrophobicContact CG2-CD1 3.62Å; V27-I113 HydrophobicContact CG2-CG1 4.08Å; V27-I119 HydrophobicContact CB-CG2 3.75Å; V27-I119 HydrophobicContact CG2-CG2 3.78Å; V27-F120 PolarHBondContact N-O 3.48Å; V27-H121 CarbonylContact O-C 3.55Å; V27-H121 WeakPolarHBondContact O-CA 3.1Å; V27-M122 PolarHBondContact O-N 2.81Å; V27-I147 HydrophobicContact CG1-CG2 3.94Å
28	G	91.5	Very high	89.2	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.166	C	C	.	.			trans	162.1	169.8	172.2	0	0	0	0	0	110.4	K34 L95	G28-K34 PolarHBondContact O-NZ 3.31Å; G28-L95 PolarHBondContact O-N 3.48Å
29	L	89.1	Confident	89.2	Confident	2 Å²	2	28 Å²	28	1%	0.01	16%	0.163	C	C	.	.	S	Bend	trans	-57.2	165.2	176.2	-65.4	-174.7	0	0	0	111.9	V32 K34 I134 D143 I146 I147	L29-V32 HydrophobicContact CB-CG1 3.98Å; L29-V32 WeakPolarHBondContact O-CG1 3.33Å; L29-V32 VanDerWaalsContact O-CG2 3.27Å; L29-V32 WeakPolarHBondContact O-CG2 3.3Å; L29-K34 PolarHBondContact O-NZ 3.37Å; L29-I134 HydrophobicContact CD1-CG2 4.14Å; L29-D143 HydrophobicContact CD1-CB 3.67Å; L29-D143 WeakPolarHBondContact CD1-OD1 3.24Å; L29-D143 HydrophobicContact CG-CB 4.38Å; L29-I146 HydrophobicContact CD2-CG2 4.09Å; L29-I147 HydrophobicContact CD2-CD1 3.71Å; L29-I147 HydrophobicContact CD2-CG1 4.36Å; L29-I147 HydrophobicContact CG-CD1 4.22Å; L29-I147 HydrophobicContact CG-CG1 4.5Å
30	P	85.9	Confident	89.3	Confident	30 Å²	30	27.3 Å²	27.3	20%	0.195	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	153	174.9	-21.5	37.2	0	0	0	110.6	V32 L95 V96 I134	P30-V32 PolarHBondContact O-N 2.65Å; P30-V32 VanDerWaalsContact O-N 3.13Å; P30-L95 VanDerWaalsContact CD-O 3.3Å; P30-L95 WeakPolarHBondContact CD-O 3.42Å; P30-V96 HydrophobicContact CG-CG1 3.83Å; P30-I134 HydrophobicContact CG-CD1 3.99Å
31	N	86	Confident	89.5	Confident	89 Å²	89	25.8 Å²	25.8	48%	0.476	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	18.4	174.9	-54.1	-21	0	0	0	116.4	G33 I131 T132	N31-G33 VanDerWaalsContact C-N 3.31Å; N31-I131 HydrophobicContact CB-CG2 3.66Å; N31-T132 PolarHBondContact ND2-O 3.19Å
32	V	91.1	Very high	89	Confident	2 Å²	2	22.9 Å²	22.9	1%	0.012	13%	0.132	C	C	.	.	S	Bend	trans	-82.4	-3.9	175.1	-55.6	0	0	0	0	114.5	L29 P30 K34 M122 R124 N228	L29-V32 HydrophobicContact CB-CG1 3.98Å; L29-V32 WeakPolarHBondContact O-CG1 3.33Å; L29-V32 VanDerWaalsContact O-CG2 3.27Å; L29-V32 WeakPolarHBondContact O-CG2 3.3Å; P30-V32 PolarHBondContact O-N 2.65Å; P30-V32 VanDerWaalsContact O-N 3.13Å; V32-K34 HydrophobicContact CG2-CD 4.37Å; V32-K34 HydrophobicContact CG2-CG 3.66Å; V32-M122 HydrophobicContact CB-CG 4.26Å; V32-M122 HydrophobicContact CG2-CB 3.97Å; V32-M122 HydrophobicContact CG2-CG 3.78Å; V32-M122 HydrophobicContact CG2-SD 4.11Å; V32-R124 HydrophobicContact CB-CB 3.99Å; V32-R124 HydrophobicContact CG1-CB 3.81Å; V32-N228 PolarHBondContact O-ND2 2.85Å
33	G	90.4	Very high	88.2	Confident	12 Å²	12	28.3 Å²	28.3	12%	0.124	16%	0.156	C	C	.	.	S	Bend	trans	99.4	15.4	179.6	0	0	0	0	0	115.9	N31 S35 T36 F37	N31-G33 VanDerWaalsContact C-N 3.31Å; G33-S35 PolarHBondContact O-N 3.34Å; G33-T36 PolarHBondContact O-N 2.9Å; G33-F37 WeakPolarHBondContact O-CB 3.46Å; G33-F37 PolarHBondContact O-N 3.31Å
34	K	89.5	Confident	86.8	Confident	15 Å²	15	28.5 Å²	28.5	7%	0.065	16%	0.162	C	C	.	.	H	α-helix	trans	-54.7	-51.7	-179.2	-61.9	-170.4	-65.4	-70.1	0	112.8	V26 G28 L29 V32 T36 F37 F38 I92 M122	V26-K34 HydrophobicContact CG1-CB 4.04Å; V26-K34 HydrophobicContact CG1-CD 4.1Å; V26-K34 HydrophobicContact CG1-CG 3.84Å; G28-K34 PolarHBondContact O-NZ 3.31Å; L29-K34 PolarHBondContact O-NZ 3.37Å; V32-K34 HydrophobicContact CG2-CD 4.37Å; V32-K34 HydrophobicContact CG2-CG 3.66Å; K34-T36 PolarHBondContact O-N 3.04Å; K34-F37 WeakPolarHBondContact O-CB 3.35Å; K34-F37 PolarHBondContact O-N 2.91Å; K34-F38 WeakPolarHBondContact O-CB 3.47Å; K34-F38 PolarHBondContact O-N 2.94Å; K34-I92 WeakPolarHBondContact CE-O 3.45Å; K34-M122 HydrophobicContact CG-CB 4.42Å; K34-M122 HydrophobicContact CG-SD 4.12Å; K34-M122 PolarHBondContact N-SD 3.24Å; K34-M122 VanDerWaalsContact N-SD 3.41Å
35	S	84.5	Confident	85.1	Confident	70 Å²	70	31.7 Å²	31.7	49%	0.49	18%	0.177	S	C	.	.	H	α-helix	trans	-66.4	-37.1	-178.5	-50.2	0	0	0	0	112.1	G33 F38 N39	G33-S35 PolarHBondContact O-N 3.34Å; S35-F38 PolarHBondContact O-N 3.24Å; S35-N39 WeakPolarHBondContact O-CB 3.38Å; S35-N39 PolarHBondContact O-N 3.47Å; S35-N39 PolarHBondContact O-ND2 2.79Å
36	T	89	Confident	82.9	Confident	42 Å²	42	36.2 Å²	36.2	26%	0.258	21%	0.205	S	C	.	.	H	α-helix	trans	-59.9	-50.6	172.6	-52.2	0	0	0	0	110.7	G33 K34 F38 N39 I40 A263	G33-T36 PolarHBondContact O-N 2.9Å; K34-T36 PolarHBondContact O-N 3.04Å; T36-F38 PolarHBondContact O-N 3.4Å; T36-N39 PolarHBondContact O-N 3.3Å; T36-I40 HydrophobicContact CG2-CD1 4Å; T36-I40 WeakPolarHBondContact O-CD1 3.27Å; T36-I40 VanDerWaalsContact O-CG1 3.23Å; T36-I40 WeakPolarHBondContact O-CG1 3.3Å; T36-I40 PolarHBondContact O-N 2.95Å; T36-A263 HydrophobicContact CG2-CB 4.02Å
37	F	92.2	Very high	80.4	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-44.5	176	170.6	-105.5	0	0	0	112.8	V26 G33 K34 N39 I40 L41 M122 L226 F261 L290 I293	V26-F37 HydrophobicContact CG1-CD1 4.22Å; V26-F37 HydrophobicContact CG2-CD1 4.02Å; V26-F37 HydrophobicContact CG2-CE1 3.81Å; G33-F37 WeakPolarHBondContact O-CB 3.46Å; G33-F37 PolarHBondContact O-N 3.31Å; K34-F37 WeakPolarHBondContact O-CB 3.35Å; K34-F37 PolarHBondContact O-N 2.91Å; F37-N39 VanDerWaalsContact C-N 3.35Å; F37-N39 PolarHBondContact O-N 3.45Å; F37-I40 PolarHBondContact O-N 3.13Å; F37-L41 HydrophobicContact CD1-CD1 4.07Å; F37-L41 HydrophobicContact CE1-CD1 3.43Å; F37-L41 VanDerWaalsContact CE1-CD1 3.43Å; F37-L41 HydrophobicContact CE1-CG 4.24Å; F37-L41 HydrophobicContact CE2-CD1 4.14Å; F37-L41 HydrophobicContact CE2-CD2 4.34Å; F37-L41 HydrophobicContact CE2-CG 4.15Å; F37-L41 HydrophobicContact CZ-CD1 3.48Å; F37-L41 VanDerWaalsContact CZ-CD1 3.48Å; F37-L41 HydrophobicContact CZ-CD2 4.29Å; F37-L41 HydrophobicContact CZ-CG 3.99Å; F37-L41 WeakPolarHBondContact O-CG 3.46Å; F37-L41 PolarHBondContact O-N 2.96Å; F37-M122 HydrophobicContact CB-CE 3.55Å; F37-M122 HydrophobicContact CB-SD 4.48Å; F37-M122 HydrophobicContact CD1-CE 3.68Å; F37-M122 HydrophobicContact CD2-CE 4.28Å; F37-M122 HydrophobicContact CE1-CE 4.44Å; F37-M122 HydrophobicContact CG-CE 3.57Å; F37-L226 HydrophobicContact CE1-CD1 4.01Å; F37-L226 HydrophobicContact CE2-CD1 4.08Å; F37-L226 HydrophobicContact CZ-CD1 3.68Å; F37-F261 AromaticContact CD2-CE2 3.76Å; F37-F261 HydrophobicContact CD2-CE2 3.76Å; F37-F261 HydrophobicContact CD2-CZ 4.04Å; F37-F261 HydrophobicContact CE2-CE2 4.46Å; F37-F261 HydrophobicContact CG-CZ 4.48Å; F37-L290 HydrophobicContact CE2-CD2 4.24Å; F37-I293 HydrophobicContact CE2-CD1 4.09Å; F37-I293 HydrophobicContact CE2-CG2 4.07Å; F37-I293 HydrophobicContact CZ-CG2 3.81Å
38	F	87.7	Confident	77.9	Confident	13 Å²	13	44 Å²	44	6%	0.057	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-38.7	178.3	-171.1	-96.1	0	0	0	112.4	K34 S35 T36 L41 T42 N59 V89 D91	K34-F38 WeakPolarHBondContact O-CB 3.47Å; K34-F38 PolarHBondContact O-N 2.94Å; S35-F38 PolarHBondContact O-N 3.24Å; T36-F38 PolarHBondContact O-N 3.4Å; F38-L41 PolarHBondContact O-N 3.46Å; F38-T42 WeakPolarHBondContact O-CB 3.26Å; F38-T42 PolarHBondContact O-N 2.84Å; F38-T42 PolarHBondContact O-OG1 3.29Å; F38-N59 VanDerWaalsContact CZ-C 3.44Å; F38-N59 WeakPolarHBondContact CZ-O 3.37Å; F38-V89 HydrophobicContact CD2-CG1 4.41Å; F38-D91 HydrophobicContact CB-CB 4.39Å; F38-D91 HydrophobicContact CD1-CB 4.23Å; F38-D91 HydrophobicContact CD2-CB 3.69Å; F38-D91 HydrophobicContact CE1-CB 4.45Å; F38-D91 HydrophobicContact CE2-CB 3.93Å; F38-D91 HydrophobicContact CG-CB 3.84Å; F38-D91 HydrophobicContact CZ-CB 4.3Å
39	N	84	Confident	75.4	Confident	95 Å²	95	51.5 Å²	51.5	51%	0.508	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-41.8	174.9	-73.4	-19	0	0	0	111.7	S35 T36 F37 T42 K43	S35-N39 WeakPolarHBondContact O-CB 3.38Å; S35-N39 PolarHBondContact O-N 3.47Å; S35-N39 PolarHBondContact O-ND2 2.79Å; T36-N39 PolarHBondContact O-N 3.3Å; F37-N39 VanDerWaalsContact C-N 3.35Å; F37-N39 PolarHBondContact O-N 3.45Å; N39-T42 PolarHBondContact O-N 3.41Å; N39-K43 WeakPolarHBondContact O-CG 3.31Å; N39-K43 PolarHBondContact O-N 3.26Å
40	I	88.3	Confident	72.7	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.015	33%	0.333	C	S	.	.	H	α-helix	trans	-60.3	-48.8	175.6	-66.8	157.5	0	0	0	110.1	T36 F37 T42 K43 S44 A263 E266 Q267 L290	T36-I40 HydrophobicContact CG2-CD1 4Å; T36-I40 WeakPolarHBondContact O-CD1 3.27Å; T36-I40 VanDerWaalsContact O-CG1 3.23Å; T36-I40 WeakPolarHBondContact O-CG1 3.3Å; T36-I40 PolarHBondContact O-N 2.95Å; F37-I40 PolarHBondContact O-N 3.13Å; I40-T42 VanDerWaalsContact C-N 3.26Å; I40-T42 PolarHBondContact O-N 3.01Å; I40-K43 PolarHBondContact O-N 3.48Å; I40-S44 PolarHBondContact O-N 2.66Å; I40-S44 PolarHBondContact O-OG 2.94Å; I40-S44 VanDerWaalsContact O-OG 3.06Å; I40-A263 HydrophobicContact CD1-CB 4.36Å; I40-A263 WeakPolarHBondContact CD1-O 3.35Å; I40-E266 HydrophobicContact CD1-CB 3.96Å; I40-E266 HydrophobicContact CG2-CB 4.12Å; I40-Q267 HydrophobicContact CD1-CB 3.98Å; I40-Q267 HydrophobicContact CG1-CB 4.12Å; I40-L290 HydrophobicContact CG2-CD1 3.4Å; I40-L290 VanDerWaalsContact CG2-CD1 3.4Å; I40-L290 HydrophobicContact CG2-CD2 3.91Å; I40-L290 HydrophobicContact CG2-CG 4.24Å
41	L	86.7	Confident	70.6	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-57.4	-39.9	175.8	-75.1	-177.5	0	0	0	112.6	F37 F38 S44 V63 V89 L290 I294	F37-L41 HydrophobicContact CD1-CD1 4.07Å; F37-L41 HydrophobicContact CE1-CD1 3.43Å; F37-L41 VanDerWaalsContact CE1-CD1 3.43Å; F37-L41 HydrophobicContact CE1-CG 4.24Å; F37-L41 HydrophobicContact CE2-CD1 4.14Å; F37-L41 HydrophobicContact CE2-CD2 4.34Å; F37-L41 HydrophobicContact CE2-CG 4.15Å; F37-L41 HydrophobicContact CZ-CD1 3.48Å; F37-L41 VanDerWaalsContact CZ-CD1 3.48Å; F37-L41 HydrophobicContact CZ-CD2 4.29Å; F37-L41 HydrophobicContact CZ-CG 3.99Å; F37-L41 WeakPolarHBondContact O-CG 3.46Å; F37-L41 PolarHBondContact O-N 2.96Å; F38-L41 PolarHBondContact O-N 3.46Å; L41-S44 PolarHBondContact O-N 3.27Å; L41-V63 HydrophobicContact CB-CG2 3.91Å; L41-V63 HydrophobicContact CD2-CG2 4.27Å; L41-V63 WeakPolarHBondContact O-CG2 3.33Å; L41-V89 HydrophobicContact CD1-CB 4.24Å; L41-V89 HydrophobicContact CD1-CG1 3.94Å; L41-V89 HydrophobicContact CD1-CG2 4.08Å; L41-L290 HydrophobicContact CD2-CD2 4.15Å; L41-I294 HydrophobicContact CD2-CD1 4.29Å; L41-I294 HydrophobicContact CD2-CG1 4.16Å
42	T	77.1	Confident	68	Low	50 Å²	50	63.2 Å²	63.2	31%	0.307	36%	0.356	S	S	.	.	H	α-helix	trans	-71.2	-36.7	180	-56.4	0	0	0	0	112.2	F38 N39 I40 S44 Q45 S61	F38-T42 WeakPolarHBondContact O-CB 3.26Å; F38-T42 PolarHBondContact O-N 2.84Å; F38-T42 PolarHBondContact O-OG1 3.29Å; N39-T42 PolarHBondContact O-N 3.41Å; I40-T42 VanDerWaalsContact C-N 3.26Å; I40-T42 PolarHBondContact O-N 3.01Å; T42-S44 VanDerWaalsContact C-N 3.28Å; T42-S44 PolarHBondContact O-N 3.36Å; T42-Q45 VanDerWaalsContact O-CB 3.27Å; T42-Q45 WeakPolarHBondContact O-CB 3.48Å; T42-Q45 WeakPolarHBondContact O-CG 3.35Å; T42-Q45 PolarHBondContact O-N 2.94Å; T42-S61 WeakPolarHBondContact OG1-CB 3.5Å; T42-S61 PolarHBondContact OG1-OG 2.83Å
43	K	73.2	Confident	65.2	Low	124 Å²	124	72.1 Å²	72.1	54%	0.539	40%	0.395	S	S	.	.	H	α-helix	trans	-67.9	-28.7	172.1	-72.6	-178.1	179.5	-177.1	0	112.5	N39 I40 Q45	N39-K43 WeakPolarHBondContact O-CG 3.31Å; N39-K43 PolarHBondContact O-N 3.26Å; I40-K43 PolarHBondContact O-N 3.48Å; K43-Q45 PolarHBondContact O-N 3.08Å
44	S	63.7	Low	62.7	Low	48 Å²	48	75.6 Å²	75.6	34%	0.336	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	2.8	173.5	-55	0	0	0	0	114	I40 L41 T42 V46	I40-S44 PolarHBondContact O-N 2.66Å; I40-S44 PolarHBondContact O-OG 2.94Å; I40-S44 VanDerWaalsContact O-OG 3.06Å; L41-S44 PolarHBondContact O-N 3.27Å; T42-S44 VanDerWaalsContact C-N 3.28Å; T42-S44 PolarHBondContact O-N 3.36Å; S44-V46 PolarHBondContact O-N 3.16Å; S44-V46 VanDerWaalsContact O-N 3.11Å
45	Q	58.4	Low	59.9	Low	67 Å²	67	81.6 Å²	81.6	31%	0.313	45%	0.454	S	S	.	.			trans	-66.7	110.2	172.8	-68.6	-178.1	7.2	0	0	109.8	T42 K43 S61 R62	T42-Q45 VanDerWaalsContact O-CB 3.27Å; T42-Q45 WeakPolarHBondContact O-CB 3.48Å; T42-Q45 WeakPolarHBondContact O-CG 3.35Å; T42-Q45 PolarHBondContact O-N 2.94Å; K43-Q45 PolarHBondContact O-N 3.08Å; Q45-S61 PolarHBondContact NE2-OG 3.36Å; Q45-R62 WeakPolarHBondContact CG-O 3.5Å
46	V	48.1	Very low	58.3	Low	96 Å²	96	82.5 Å²	82.5	58%	0.582	45%	0.453	S	S	*	.			trans	-60.5	130.4	157.6	-177.8	0	0	0	0	106.1	S44 A48	S44-V46 PolarHBondContact O-N 3.16Å; S44-V46 VanDerWaalsContact O-N 3.11Å; V46-A48 PolarHBondContact O-N 3.26Å
47	P	41.1	Very low	56.7	Low	120 Å²	120	85.7 Å²	85.7	78%	0.779	47%	0.468	S	S	*	.			trans	-54.4	103.8	179.6	-1.1	-0.8	0	0	0	108.8	E49	P47-E49 PolarHBondContact O-N 3.28Å
48	A	39.4	Very low	55	Low	43 Å²	43	90.8 Å²	90.8	36%	0.355	50%	0.501	S	S	.	.			trans	-68.4	118.2	171.5	0	0	0	0	0	105.3	V46 N50 F51	V46-A48 PolarHBondContact O-N 3.26Å; A48-N50 PolarHBondContact O-N 3.27Å; A48-F51 HydrophobicContact CB-CD2 4.27Å; A48-F51 HydrophobicContact CB-CE2 4.33Å
49	E	38.7	Very low	54.3	Low	158 Å²	158	93.7 Å²	93.7	74%	0.738	52%	0.517	S	S	*	.			trans	-49.1	116.7	176.2	-70.8	-167	159.5	0	0	109.6	P47 F51	P47-E49 PolarHBondContact O-N 3.28Å; E49-F51 WeakPolarHBondContact O-CD2 3.45Å; E49-F51 PolarHBondContact O-N 3.22Å
50	N	32	Very low	54.3	Low	154 Å²	154	90.9 Å²	90.9	82%	0.824	50%	0.501	S	S	*	.			trans	6.6	80.4	167.8	-64.5	-36.4	0	0	0	115.9	A48 P52	A48-N50 PolarHBondContact O-N 3.27Å; N50-P52 WeakPolarHBondContact O-CD 3.49Å
51	F	40.9	Very low	54.1	Low	109 Å²	109	90.8 Å²	90.8	48%	0.478	50%	0.5	S	S	.	.			trans	-81.5	104.2	163	-75.9	-82.1	0	0	0	108.8	A48 E49 F53	A48-F51 HydrophobicContact CB-CD2 4.27Å; A48-F51 HydrophobicContact CB-CE2 4.33Å; E49-F51 WeakPolarHBondContact O-CD2 3.45Å; E49-F51 PolarHBondContact O-N 3.22Å; F51-F53 PolarHBondContact O-N 3.46Å
52	P	31.2	Very low	54.1	Low	104 Å²	104	94.5 Å²	94.5	68%	0.675	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	10	-164.7	-15.4	32	0	0	0	115.7	N50	N50-P52 WeakPolarHBondContact O-CD 3.49Å
53	F	32.1	Very low	54.7	Low	189 Å²	189	92.2 Å²	92.2	83%	0.829	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	5.4	-170.1	-58.3	-70.2	0	0	0	115	F51 T55	F51-F53 PolarHBondContact O-N 3.46Å; F53-T55 PolarHBondContact O-N 2.96Å
54	C	39.3	Very low	55.6	Low	84 Å²	84	87.2 Å²	87.2	57%	0.568	48%	0.482	S	S	*	.			trans	-89.7	94.7	171.6	-70.3	0	0	0	0	109.1	I56	C54-I56 HydrophobicContact CB-CG1 3.95Å; C54-I56 PolarHBondContact O-N 3.02Å
55	T	30.2	Very low	57.1	Low	141 Å²	141	85.3 Å²	85.3	87%	0.865	47%	0.468	S	S	*	.			trans	-65.9	86.5	153.8	-42.2	0	0	0	0	106	F53 N57	F53-T55 PolarHBondContact O-N 2.96Å; T55-N57 PolarHBondContact O-N 3.39Å
56	I	50.6	Low	58.7	Low	90 Å²	90	83.9 Å²	83.9	46%	0.462	47%	0.465	S	S	.	.			trans	-65.3	110.7	173.7	-60.1	177.6	0	0	0	104.9	C54 E60	C54-I56 HydrophobicContact CB-CG1 3.95Å; C54-I56 PolarHBondContact O-N 3.02Å; I56-E60 HydrophobicContact CG2-CB 4.26Å; I56-E60 WeakPolarHBondContact CG2-O 3.3Å
57	N	55.3	Low	61	Low	108 Å²	108	80 Å²	80	58%	0.578	44%	0.441	S	S	*	.			trans	-51.8	137	170	-124.9	-23.2	0	0	0	106.7	T55 N59 E60	T55-N57 PolarHBondContact O-N 3.39Å; N57-N59 PolarHBondContact O-N 3.44Å; N57-E60 HydrophobicContact CB-CB 4.27Å; N57-E60 PolarHBondContact O-N 2.96Å
58	P	56.6	Low	63.6	Low	108 Å²	108	80.9 Å²	80.9	70%	0.701	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-17.5	-173.5	19.6	-31.5	0	0	0	113.9
59	N	74.1	Confident	66.4	Low	73 Å²	73	81 Å²	81	39%	0.39	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	14.3	177.2	-53.4	-25.1	0	0	0	113.1	F38 N57 V90 D91	F38-N59 VanDerWaalsContact CZ-C 3.44Å; F38-N59 WeakPolarHBondContact CZ-O 3.37Å; N57-N59 PolarHBondContact O-N 3.44Å; N59-V90 CarbonylContact O-C 3.58Å; N59-V90 VanDerWaalsContact O-CA 3.23Å; N59-V90 WeakPolarHBondContact O-CA 3.33Å; N59-V90 WeakPolarHBondContact O-CG1 3.38Å; N59-D91 HydrophobicContact CB-CB 4.38Å; N59-D91 PolarHBondContact O-N 3.32Å
60	E	83.5	Confident	69.2	Low	37 Å²	37	74.2 Å²	74.2	17%	0.173	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.9	176.3	-174.1	166.3	179.3	0	0	110.2	K23 I56 N57 V89 V90	K23-E60 WeakPolarHBondContact CD-OE1 3.49Å; K23-E60 WeakPolarHBondContact CE-OE1 3.47Å; K23-E60 IonicContact NZ-OE1 2.78Å; K23-E60 PolarHBondContact NZ-OE1 2.9Å; K23-E60 IonicContact NZ-OE2 2.88Å; K23-E60 PolarHBondContact NZ-OE2 3.5Å; I56-E60 HydrophobicContact CG2-CB 4.26Å; I56-E60 WeakPolarHBondContact CG2-O 3.3Å; N57-E60 HydrophobicContact CB-CB 4.27Å; N57-E60 PolarHBondContact O-N 2.96Å; E60-V89 CarbonylContact C-O 2.93Å; E60-V89 WeakPolarHBondContact CA-O 3.2Å; E60-V90 HydrophobicContact CB-CG2 4.37Å; E60-V90 HydrophobicContact CG-CG2 4.08Å
61	S	82.8	Confident	72.3	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.1	-178.8	-173.6	0	0	0	0	108.8	T42 Q45 V89	T42-S61 WeakPolarHBondContact OG1-CB 3.5Å; T42-S61 PolarHBondContact OG1-OG 2.83Å; Q45-S61 PolarHBondContact NE2-OG 3.36Å; S61-V89 PolarHBondContact N-O 3.34Å; S61-V89 PolarHBondContact O-N 3.41Å
62	R	88.1	Confident	75	Confident	82 Å²	82	68.8 Å²	68.8	31%	0.309	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	108.1	-178.8	-174.5	177.7	-173.6	-150.4	-2.5	108.8	Q45 Y86 N88	Q45-R62 WeakPolarHBondContact CG-O 3.5Å; R62-Y86 VanDerWaalsContact CG-CB 3.47Å; R62-Y86 HydrophobicContact CG-CD1 3.63Å; R62-Y86 HydrophobicContact CG-CG 3.74Å; R62-Y86 VanDerWaalsContact NE-CG 3.29Å; R62-N88 WeakPolarHBondContact CG-OD1 3.48Å
63	V	89.7	Confident	78.2	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.012	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.3	-172.5	-167.6	0	0	0	0	109.9	L41 V65 Y86 L87 I294	L41-V63 HydrophobicContact CB-CG2 3.91Å; L41-V63 HydrophobicContact CD2-CG2 4.27Å; L41-V63 WeakPolarHBondContact O-CG2 3.33Å; V63-V65 PolarHBondContact O-N 2.98Å; V63-Y86 CarbonylContact O-C 3.52Å; V63-Y86 VanDerWaalsContact O-CA 3.27Å; V63-Y86 WeakPolarHBondContact O-CA 3.45Å; V63-L87 PolarHBondContact N-O 2.92Å; V63-L87 PolarHBondContact O-N 3.45Å; V63-I294 HydrophobicContact CG1-CD1 3.61Å; V63-I294 HydrophobicContact CG1-CG1 4.32Å
64	A	92.7	Very high	81.3	Confident	19 Å²	19	54.9 Å²	54.9	16%	0.157	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	135	176.6	0	0	0	0	0	110.1	P66 P84 A85 Y86	A64-P66 WeakPolarHBondContact O-CD 3.43Å; A64-P84 HydrophobicContact CB-CB 4.29Å; A64-P84 HydrophobicContact CB-CG 3.84Å; A64-A85 WeakPolarHBondContact CA-O 3.3Å; A64-Y86 HydrophobicContact CB-CD1 4.25Å; A64-Y86 HydrophobicContact CB-CE1 4.1Å
65	V	94.2	Very high	84.1	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.042	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-77.6	116.6	174.8	-179	0	0	0	0	107.9	V63 D67 A85 L87 I294 R295 Y298 Y305	V63-V65 PolarHBondContact O-N 2.98Å; V65-D67 PolarHBondContact O-N 3.5Å; V65-A85 HydrophobicContact CB-CB 4.31Å; V65-A85 HydrophobicContact CG2-CB 4.24Å; V65-A85 PolarHBondContact N-O 2.9Å; V65-L87 HydrophobicContact CG2-CB 4.36Å; V65-I294 HydrophobicContact CB-CG2 4.39Å; V65-I294 HydrophobicContact CG2-CG2 4.12Å; V65-R295 HydrophobicContact CG1-CG 4.37Å; V65-Y298 HydrophobicContact CG2-CD2 3.55Å; V65-Y298 HydrophobicContact CG2-CE2 3.97Å; V65-Y298 HydrophobicContact CG2-CG 3.92Å; V65-Y305 HydrophobicContact CG1-CE1 4.4Å
66	P	92.9	Very high	87.3	Confident	38 Å²	38	55.8 Å²	55.8	25%	0.247	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-70.2	123.4	-179.2	24.8	-29.1	0	0	0	110	A64 P291 R295	A64-P66 WeakPolarHBondContact O-CD 3.43Å; P66-P291 HydrophobicContact CB-CB 4.37Å; P66-P291 HydrophobicContact CG-CB 3.65Å; P66-R295 HydrophobicContact CG-CG 4.42Å; P66-R295 VanDerWaalsContact O-CZ 3.28Å; P66-R295 PolarHBondContact O-NE 3.02Å; P66-R295 PolarHBondContact O-NH2 2.82Å
67	D	95.8	Very high	89.5	Confident	13 Å²	13	53.3 Å²	53.3	7%	0.07	26%	0.264	C	S	.	.			trans	-147.1	112.3	-176.9	-170.5	-16	0	0	0	111.2	V65 R69 F70 D71 Y305	V65-D67 PolarHBondContact O-N 3.5Å; D67-R69 PolarHBondContact O-N 3.19Å; D67-R69 VanDerWaalsContact O-N 3.13Å; D67-R69 WeakPolarHBondContact OD1-CB 3.47Å; D67-R69 VanDerWaalsContact OD1-CG 3.23Å; D67-R69 WeakPolarHBondContact OD1-CG 3.37Å; D67-R69 PolarHBondContact OD1-N 3.3Å; D67-R69 IonicContact OD1-NE 3.84Å; D67-R69 PolarHBondContact OD1-NE 2.87Å; D67-R69 VanDerWaalsContact OD1-NE 3.12Å; D67-R69 IonicContact OD2-CZ 2.67Å; D67-R69 IonicContact OD2-NE 2.77Å; D67-R69 PolarHBondContact OD2-NE 3.32Å; D67-R69 IonicContact OD2-NH2 2.65Å; D67-R69 PolarHBondContact OD2-NH2 2.88Å; D67-F70 HydrophobicContact CB-CB 4.13Å; D67-F70 WeakPolarHBondContact O-CB 3.27Å; D67-F70 PolarHBondContact O-N 3.36Å; D67-D71 PolarHBondContact O-N 3Å; D67-Y305 WeakPolarHBondContact CB-OH 3.34Å; D67-Y305 WeakPolarHBondContact OD2-CE2 3.44Å; D67-Y305 VanDerWaalsContact OD2-CZ 3.24Å; D67-Y305 PolarHBondContact OD2-OH 3.49Å
68	E	96	Very high	91.5	Very high	139 Å²	139	55.7 Å²	55.7	65%	0.65	27%	0.271	S	S	*	.	H	α-helix	trans	-60	-25.7	179.1	-65.9	168.6	-152.8	0	0	112.5	W72	E68-W72 VanDerWaalsContact O-CB 3.26Å; E68-W72 WeakPolarHBondContact O-CB 3.48Å; E68-W72 PolarHBondContact O-N 3.19Å
69	R	97.9	Very high	93.4	Very high	47 Å²	47	51 Å²	51	18%	0.177	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-44	175.2	-52.6	177.3	-68.6	-173.4	-0.7	110.8	D67 L73 F307 Y348 D377	D67-R69 PolarHBondContact O-N 3.19Å; D67-R69 VanDerWaalsContact O-N 3.13Å; D67-R69 WeakPolarHBondContact OD1-CB 3.47Å; D67-R69 VanDerWaalsContact OD1-CG 3.23Å; D67-R69 WeakPolarHBondContact OD1-CG 3.37Å; D67-R69 PolarHBondContact OD1-N 3.3Å; D67-R69 IonicContact OD1-NE 3.84Å; D67-R69 PolarHBondContact OD1-NE 2.87Å; D67-R69 VanDerWaalsContact OD1-NE 3.12Å; D67-R69 IonicContact OD2-CZ 2.67Å; D67-R69 IonicContact OD2-NE 2.77Å; D67-R69 PolarHBondContact OD2-NE 3.32Å; D67-R69 IonicContact OD2-NH2 2.65Å; D67-R69 PolarHBondContact OD2-NH2 2.88Å; R69-L73 WeakPolarHBondContact O-CB 3.45Å; R69-L73 WeakPolarHBondContact O-CD1 3.4Å; R69-L73 WeakPolarHBondContact O-CG 3.44Å; R69-L73 PolarHBondContact O-N 2.85Å; R69-F307 HydrophobicContact CB-CE2 4.05Å; R69-F307 HydrophobicContact CB-CZ 4.08Å; R69-Y348 VanDerWaalsContact CA-CE2 3.48Å; R69-Y348 HydrophobicContact CB-CD1 4.09Å; R69-Y348 HydrophobicContact CB-CD2 3.76Å; R69-Y348 HydrophobicContact CB-CE1 4Å; R69-Y348 HydrophobicContact CB-CE2 3.64Å; R69-Y348 HydrophobicContact CB-CG 3.97Å; R69-Y348 HydrophobicContact CG-CD1 3.65Å; R69-Y348 HydrophobicContact CG-CD2 4.26Å; R69-Y348 HydrophobicContact CG-CE1 3.5Å; R69-Y348 VanDerWaalsContact CG-CE1 3.5Å; R69-Y348 HydrophobicContact CG-CE2 4.12Å; R69-Y348 HydrophobicContact CG-CG 4.02Å; R69-D377 IonicContact CZ-OD2 2.82Å; R69-D377 VanDerWaalsContact CZ-OD2 3.29Å; R69-D377 PolarHBondContact NH1-O 2.82Å; R69-D377 IonicContact NH1-OD2 2.73Å; R69-D377 PolarHBondContact NH1-OD2 2.82Å; R69-D377 IonicContact NH2-OD1 2.78Å; R69-D377 IonicContact NH2-OD2 3.25Å; R69-D377 PolarHBondContact NH2-OD2 3.2Å
70	F	97.7	Very high	94.5	Very high	14 Å²	14	53.7 Å²	53.7	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-65.5	-44.3	176.9	176.3	-98.9	0	0	0	111	D67 W72 L73 C74 R82 V83 P84 F307 V314 A316	D67-F70 HydrophobicContact CB-CB 4.13Å; D67-F70 WeakPolarHBondContact O-CB 3.27Å; D67-F70 PolarHBondContact O-N 3.36Å; F70-W72 PolarHBondContact O-N 3.01Å; F70-L73 PolarHBondContact O-N 2.75Å; F70-C74 VanDerWaalsContact CZ-SG 3.52Å; F70-C74 PolarHBondContact O-N 3.3Å; F70-C74 PolarHBondContact O-SG 3.24Å; F70-R82 HydrophobicContact CZ-CB 4.1Å; F70-V83 WeakPolarHBondContact CE2-O 3.45Å; F70-P84 HydrophobicContact CD1-CB 4.18Å; F70-P84 HydrophobicContact CE1-CB 3.82Å; F70-P84 HydrophobicContact CE1-CG 4.45Å; F70-P84 HydrophobicContact CE2-CB 4.49Å; F70-P84 HydrophobicContact CZ-CB 4Å; F70-F307 HydrophobicContact CB-CE1 3.89Å; F70-F307 HydrophobicContact CB-CZ 4.24Å; F70-F307 HydrophobicContact CD2-CD1 4.28Å; F70-F307 AromaticContact CD2-CE1 3.98Å; F70-F307 HydrophobicContact CD2-CE1 3.98Å; F70-F307 HydrophobicContact CG-CE1 4.43Å; F70-V314 HydrophobicContact CD2-CG1 3.99Å; F70-V314 HydrophobicContact CE2-CG1 3.84Å; F70-A316 HydrophobicContact CD2-CB 4.37Å
71	D	96.7	Very high	95.1	Very high	94 Å²	94	53.3 Å²	53.3	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-46.6	178.8	-63.4	-30.5	0	0	0	111.2	D67 L73 C74 E75	D67-D71 PolarHBondContact O-N 3Å; D71-L73 PolarHBondContact O-N 3.23Å; D71-C74 WeakPolarHBondContact O-CB 3.25Å; D71-C74 PolarHBondContact O-N 2.87Å; D71-E75 PolarHBondContact O-N 3.24Å
72	W	98	Very high	95.7	Very high	55 Å²	55	60.6 Å²	60.6	21%	0.208	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-42.1	176.4	-176	88.6	0	0	0	112.2	E68 F70 C74 E75 Y76 Y348 F351 K352	E68-W72 VanDerWaalsContact O-CB 3.26Å; E68-W72 WeakPolarHBondContact O-CB 3.48Å; E68-W72 PolarHBondContact O-N 3.19Å; F70-W72 PolarHBondContact O-N 3.01Å; W72-C74 VanDerWaalsContact C-N 3.31Å; W72-C74 PolarHBondContact O-N 3.11Å; W72-E75 PolarHBondContact O-N 3.41Å; W72-Y76 AromaticContact CH2-CD2 3.73Å; W72-Y76 HydrophobicContact CH2-CD2 3.73Å; W72-Y76 HydrophobicContact CH2-CE2 4.4Å; W72-Y76 AromaticContact CH2-CG 3.9Å; W72-Y76 HydrophobicContact CH2-CG 3.9Å; W72-Y76 AromaticContact CZ2-CD2 4Å; W72-Y76 HydrophobicContact CZ2-CD2 4Å; W72-Y76 HydrophobicContact CZ2-CG 4.41Å; W72-Y76 HydrophobicContact CZ3-CD2 4.43Å; W72-Y76 HydrophobicContact CZ3-CG 4.14Å; W72-Y76 VanDerWaalsContact O-CB 3.3Å; W72-Y76 WeakPolarHBondContact O-CB 3.45Å; W72-Y76 PolarHBondContact O-N 2.85Å; W72-Y348 HydrophobicContact CB-CE2 4.29Å; W72-Y348 HydrophobicContact CD2-CE2 4.16Å; W72-Y348 HydrophobicContact CE3-CD2 4.41Å; W72-Y348 AromaticContact CE3-CE2 3.7Å; W72-Y348 HydrophobicContact CE3-CE2 3.7Å; W72-Y348 HydrophobicContact CG-CE2 4.42Å; W72-Y348 HydrophobicContact CZ3-CE2 4.47Å; W72-F351 AromaticContact CH2-CD1 3.95Å; W72-F351 HydrophobicContact CH2-CD1 3.95Å; W72-F351 HydrophobicContact CH2-CE1 4.01Å; W72-F351 AromaticContact CZ3-CD1 3.63Å; W72-F351 HydrophobicContact CZ3-CD1 3.63Å; W72-F351 AromaticContact CZ3-CE1 3.76Å; W72-F351 HydrophobicContact CZ3-CE1 3.76Å; W72-K352 HydrophobicContact CD2-CD 4.31Å; W72-K352 HydrophobicContact CD2-CG 4.3Å; W72-K352 HydrophobicContact CH2-CB 4.11Å; W72-K352 HydrophobicContact CH2-CG 4.3Å; W72-K352 HydrophobicContact CZ2-CB 4.14Å; W72-K352 HydrophobicContact CZ2-CG 3.81Å; W72-K352 HydrophobicContact CZ3-CB 4.36Å
73	L	98	Very high	96.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-39.1	176.4	-74.1	166.9	0	0	0	111.6	R69 F70 D71 H77 F307 V314 Y348 F351 I380	R69-L73 WeakPolarHBondContact O-CB 3.45Å; R69-L73 WeakPolarHBondContact O-CD1 3.4Å; R69-L73 WeakPolarHBondContact O-CG 3.44Å; R69-L73 PolarHBondContact O-N 2.85Å; F70-L73 PolarHBondContact O-N 2.75Å; D71-L73 PolarHBondContact O-N 3.23Å; L73-H77 WeakPolarHBondContact O-CB 3.43Å; L73-H77 PolarHBondContact O-CD2 3.47Å; L73-H77 VanDerWaalsContact O-CD2 3.32Å; L73-H77 PolarHBondContact O-N 3.12Å; L73-F307 HydrophobicContact CD1-CB 3.98Å; L73-F307 HydrophobicContact CD1-CD1 4.13Å; L73-F307 HydrophobicContact CD1-CD2 3.52Å; L73-F307 HydrophobicContact CD1-CE1 4.48Å; L73-F307 HydrophobicContact CD1-CE2 3.92Å; L73-F307 HydrophobicContact CD1-CG 3.62Å; L73-F307 HydrophobicContact CD1-CZ 4.37Å; L73-V314 HydrophobicContact CB-CG1 3.88Å; L73-Y348 HydrophobicContact CD1-CD2 4.21Å; L73-Y348 HydrophobicContact CD2-CD2 4.46Å; L73-Y348 HydrophobicContact CG-CD2 4.15Å; L73-Y348 HydrophobicContact CG-CE2 4.37Å; L73-F351 HydrophobicContact CD2-CD1 4.07Å; L73-F351 HydrophobicContact CD2-CE1 4.09Å; L73-I380 HydrophobicContact CD2-CD1 3.83Å
74	C	97.8	Very high	96.4	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.014	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-40.6	175	-69.1	0	0	0	0	112.1	F70 D71 W72 Q78 P79 R82	F70-C74 VanDerWaalsContact CZ-SG 3.52Å; F70-C74 PolarHBondContact O-N 3.3Å; F70-C74 PolarHBondContact O-SG 3.24Å; D71-C74 WeakPolarHBondContact O-CB 3.25Å; D71-C74 PolarHBondContact O-N 2.87Å; W72-C74 VanDerWaalsContact C-N 3.31Å; W72-C74 PolarHBondContact O-N 3.11Å; C74-Q78 WeakPolarHBondContact O-CA 3.43Å; C74-Q78 PolarHBondContact O-N 2.95Å; C74-P79 WeakPolarHBondContact O-CD 3.14Å; C74-R82 HydrophobicContact CB-CG 4.31Å
75	E	97.3	Very high	96.5	Very high	145 Å²	145	57.7 Å²	57.7	68%	0.678	28%	0.278	S	S	*	.	H	α-helix	trans	-64.8	-45.2	175.5	-174.6	177.1	-170.2	0	0	111.4	D71 W72 Q78	D71-E75 PolarHBondContact O-N 3.24Å; W72-E75 PolarHBondContact O-N 3.41Å; E75-Q78 VanDerWaalsContact O-CG 3.28Å; E75-Q78 WeakPolarHBondContact O-CG 2.96Å
76	Y	97.6	Very high	96.4	Very high	99 Å²	99	58.4 Å²	58.4	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-47.9	-179.2	178.2	-86.3	0	0	0	112.5	W72 F351 G355	W72-Y76 AromaticContact CH2-CD2 3.73Å; W72-Y76 HydrophobicContact CH2-CD2 3.73Å; W72-Y76 HydrophobicContact CH2-CE2 4.4Å; W72-Y76 AromaticContact CH2-CG 3.9Å; W72-Y76 HydrophobicContact CH2-CG 3.9Å; W72-Y76 AromaticContact CZ2-CD2 4Å; W72-Y76 HydrophobicContact CZ2-CD2 4Å; W72-Y76 HydrophobicContact CZ2-CG 4.41Å; W72-Y76 HydrophobicContact CZ3-CD2 4.43Å; W72-Y76 HydrophobicContact CZ3-CG 4.14Å; W72-Y76 VanDerWaalsContact O-CB 3.3Å; W72-Y76 WeakPolarHBondContact O-CB 3.45Å; W72-Y76 PolarHBondContact O-N 2.85Å; Y76-F351 AromaticContact CD1-CE1 3.86Å; Y76-F351 HydrophobicContact CD1-CE1 3.86Å; Y76-F351 HydrophobicContact CD1-CZ 4.04Å; Y76-F351 AromaticContact CE1-CE1 3.82Å; Y76-F351 HydrophobicContact CE1-CE1 3.82Å; Y76-F351 AromaticContact CE1-CZ 3.54Å; Y76-F351 HydrophobicContact CE1-CZ 3.54Å; Y76-F351 HydrophobicContact CG-CE1 4.43Å; Y76-G355 WeakPolarHBondContact CE2-O 3.13Å; Y76-G355 PolarHBondContact OH-O 2.62Å
77	H	96.8	Very high	96.5	Very high	38 Å²	38	56.8 Å²	56.8	18%	0.176	27%	0.269	C	S	.	.	H	α-helix	trans	-84.2	-20.5	-176.1	-75.8	-73	0	0	0	114	L73 P79 C309 V314 F351	L73-H77 WeakPolarHBondContact O-CB 3.43Å; L73-H77 PolarHBondContact O-CD2 3.47Å; L73-H77 VanDerWaalsContact O-CD2 3.32Å; L73-H77 PolarHBondContact O-N 3.12Å; H77-P79 VanDerWaalsContact C-N 3.35Å; H77-C309 WeakPolarHBondContact NE2-CB 3.44Å; H77-V314 HydrophobicContact CB-CG2 3.9Å; H77-F351 AromaticContact NE2-CE1 3.83Å; H77-F351 AromaticContact NE2-CZ 3.77Å
78	Q	96.5	Very high	96.3	Very high	158 Å²	158	56.9 Å²	56.9	74%	0.738	27%	0.27	S	S	*	.			trans	46.6	54.2	-172.3	-57.1	-176.5	-35.1	0	0	112	C74 E75	C74-Q78 WeakPolarHBondContact O-CA 3.43Å; C74-Q78 PolarHBondContact O-N 2.95Å; E75-Q78 VanDerWaalsContact O-CG 3.28Å; E75-Q78 WeakPolarHBondContact O-CG 2.96Å
79	P	97.3	Very high	96.1	Very high	9 Å²	9	50.3 Å²	50.3	6%	0.058	24%	0.239	C	C	.	.			trans	-70.9	155.2	-171.6	34.3	-38.7	0	0	0	111.6	C74 H77 S81 R82 G310 K311 V314	C74-P79 WeakPolarHBondContact O-CD 3.14Å; H77-P79 VanDerWaalsContact C-N 3.35Å; P79-S81 WeakPolarHBondContact CB-O 3.45Å; P79-S81 WeakPolarHBondContact CG-O 3.33Å; P79-R82 HydrophobicContact CG-CG 3.8Å; P79-G310 WeakPolarHBondContact CB-O 3.29Å; P79-K311 CarbonylContact C-O 3.47Å; P79-K311 VanDerWaalsContact CA-O 3.22Å; P79-K311 WeakPolarHBondContact CA-O 3.49Å; P79-V314 HydrophobicContact CB-CB 4.42Å; P79-V314 HydrophobicContact CB-CG2 4Å; P79-V314 HydrophobicContact CG-CB 3.97Å; P79-V314 HydrophobicContact CG-CG2 3.71Å
80	V	96.4	Very high	95.7	Very high	130 Å²	130	49 Å²	49	79%	0.788	24%	0.236	S	C	*	.	S	Bend	trans	-65.1	-43.3	168.9	-178.3	0	0	0	0	110.6	K311 D312	V80-K311 PolarHBondContact N-O 3.49Å; V80-D312 WeakPolarHBondContact CB-O 3.43Å; V80-D312 PolarHBondContact N-O 3.42Å
81	S	96.2	Very high	95.1	Very high	28 Å²	28	49.5 Å²	49.5	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.4	-179.5	176	0	0	0	0	112	P79 V83 D312 E313 V314	P79-S81 WeakPolarHBondContact CB-O 3.45Å; P79-S81 WeakPolarHBondContact CG-O 3.33Å; S81-V83 WeakPolarHBondContact OG-CG2 3.41Å; S81-D312 PolarHBondContact N-O 3.08Å; S81-E313 WeakPolarHBondContact O-CA 3.43Å; S81-E313 PolarHBondContact OG-OE2 3.25Å; S81-E313 VanDerWaalsContact OG-OE2 3.05Å; S81-V314 PolarHBondContact O-N 3.43Å
82	R	96.9	Very high	94.3	Very high	154 Å²	154	45 Å²	45	58%	0.581	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	107.5	176.5	-60.2	-178.9	-170.8	-164.8	1.9	109.3	F70 C74 P79 P84	F70-R82 HydrophobicContact CZ-CB 4.1Å; C74-R82 HydrophobicContact CB-CG 4.31Å; P79-R82 HydrophobicContact CG-CG 3.8Å; R82-P84 WeakPolarHBondContact O-CD 3.48Å
83	V	95.9	Very high	93	Very high	19 Å²	19	44.2 Å²	44.2	12%	0.115	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	94.6	-175.5	-173.9	0	0	0	0	110.6	F70 S81 V314 K315 A316	F70-V83 WeakPolarHBondContact CE2-O 3.45Å; S81-V83 WeakPolarHBondContact OG-CG2 3.41Å; V83-V314 PolarHBondContact N-O 3.17Å; V83-K315 HydrophobicContact CB-CB 3.99Å; V83-K315 HydrophobicContact CB-CD 3.91Å; V83-K315 HydrophobicContact CB-CG 3.74Å; V83-K315 HydrophobicContact CG1-CD 3.92Å; V83-K315 HydrophobicContact CG1-CG 3.91Å; V83-K315 HydrophobicContact CG2-CD 4.28Å; V83-K315 WeakPolarHBondContact O-CA 3.44Å; V83-A316 PolarHBondContact O-N 3.14Å
84	P	95.6	Very high	91.4	Very high	19 Å²	19	45.4 Å²	45.4	12%	0.123	23%	0.233	C	C	.	.			trans	-72	170.3	178.2	31.1	-35.1	0	0	0	111.6	A64 F70 R82 Y86	A64-P84 HydrophobicContact CB-CB 4.29Å; A64-P84 HydrophobicContact CB-CG 3.84Å; F70-P84 HydrophobicContact CD1-CB 4.18Å; F70-P84 HydrophobicContact CE1-CB 3.82Å; F70-P84 HydrophobicContact CE1-CG 4.45Å; F70-P84 HydrophobicContact CE2-CB 4.49Å; F70-P84 HydrophobicContact CZ-CB 4Å; R82-P84 WeakPolarHBondContact O-CD 3.48Å; P84-Y86 HydrophobicContact CG-CE1 4.33Å; P84-Y86 HydrophobicContact CG-CE2 3.96Å; P84-Y86 WeakPolarHBondContact O-CD2 3.46Å; P84-Y86 WeakPolarHBondContact O-CE2 3.14Å
85	A	94.7	Very high	89.9	Confident	3 Å²	3	45.3 Å²	45.3	3%	0.025	23%	0.233	C	C	.	.			trans	-74.3	154.8	165.8	0	0	0	0	0	109	A64 V65 Y298 Y305 A316	A64-A85 WeakPolarHBondContact CA-O 3.3Å; V65-A85 HydrophobicContact CB-CB 4.31Å; V65-A85 HydrophobicContact CG2-CB 4.24Å; V65-A85 PolarHBondContact N-O 2.9Å; A85-Y298 HydrophobicContact CB-CE2 4.36Å; A85-Y305 HydrophobicContact CB-CD1 3.4Å; A85-Y305 HydrophobicContact CB-CE1 3.52Å; A85-Y305 HydrophobicContact CB-CG 3.96Å; A85-A316 HydrophobicContact CB-CB 4.02Å
86	Y	93.4	Very high	88.2	Confident	23 Å²	23	40.9 Å²	40.9	9%	0.09	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.1	-177.9	-66.5	-94.9	0	0	0	111.8	R62 V63 A64 P84 Y298	R62-Y86 VanDerWaalsContact CG-CB 3.47Å; R62-Y86 HydrophobicContact CG-CD1 3.63Å; R62-Y86 HydrophobicContact CG-CG 3.74Å; R62-Y86 VanDerWaalsContact NE-CG 3.29Å; V63-Y86 CarbonylContact O-C 3.52Å; V63-Y86 VanDerWaalsContact O-CA 3.27Å; V63-Y86 WeakPolarHBondContact O-CA 3.45Å; A64-Y86 HydrophobicContact CB-CD1 4.25Å; A64-Y86 HydrophobicContact CB-CE1 4.1Å; P84-Y86 HydrophobicContact CG-CE1 4.33Å; P84-Y86 HydrophobicContact CG-CE2 3.96Å; P84-Y86 WeakPolarHBondContact O-CD2 3.46Å; P84-Y86 WeakPolarHBondContact O-CE2 3.14Å; Y86-Y298 WeakPolarHBondContact O-CE2 3.39Å
87	L	93.1	Very high	86.5	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	125.1	167	-179.4	65.8	0	0	0	109.1	V63 V65 V89 F120 I294 Y298 L301	V63-L87 PolarHBondContact N-O 2.92Å; V63-L87 PolarHBondContact O-N 3.45Å; V65-L87 HydrophobicContact CG2-CB 4.36Å; L87-V89 HydrophobicContact CD2-CG2 3.85Å; L87-V89 HydrophobicContact CG-CG2 3.85Å; L87-F120 HydrophobicContact CD2-CE2 4.27Å; L87-F120 HydrophobicContact CD2-CZ 4.26Å; L87-I294 HydrophobicContact CB-CG2 4.07Å; L87-I294 HydrophobicContact CD2-CB 4.41Å; L87-I294 HydrophobicContact CD2-CG2 4.1Å; L87-Y298 HydrophobicContact CB-CD2 4.4Å; L87-Y298 HydrophobicContact CD1-CD2 4.36Å; L87-L301 HydrophobicContact CD1-CD1 3.58Å
88	N	92.6	Very high	84.7	Confident	15 Å²	15	41.9 Å²	41.9	8%	0.08	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	124.9	170.7	-59.2	-44.6	0	0	0	109.3	N21 L22 K23 C24 R62	N21-N88 PolarHBondContact OD1-ND2 2.75Å; L22-N88 PolarHBondContact O-ND2 3.32Å; K23-N88 WeakPolarHBondContact CA-O 3.44Å; K23-N88 HydrophobicContact CB-CB 4.33Å; K23-N88 HydrophobicContact CG-CB 3.9Å; C24-N88 PolarHBondContact N-O 3.16Å; R62-N88 WeakPolarHBondContact CG-OD1 3.48Å
89	V	92.1	Very high	82.9	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136	179.4	-174.5	0	0	0	0	108.9	C24 V26 F38 L41 E60 S61 L87 F120	C24-V89 CarbonylContact O-C 3.54Å; C24-V89 VanDerWaalsContact O-CA 3.29Å; C24-V89 WeakPolarHBondContact O-CA 3.22Å; V26-V89 HydrophobicContact CG2-CG1 3.67Å; F38-V89 HydrophobicContact CD2-CG1 4.41Å; L41-V89 HydrophobicContact CD1-CB 4.24Å; L41-V89 HydrophobicContact CD1-CG1 3.94Å; L41-V89 HydrophobicContact CD1-CG2 4.08Å; E60-V89 CarbonylContact C-O 2.93Å; E60-V89 WeakPolarHBondContact CA-O 3.2Å; S61-V89 PolarHBondContact N-O 3.34Å; S61-V89 PolarHBondContact O-N 3.41Å; L87-V89 HydrophobicContact CD2-CG2 3.85Å; L87-V89 HydrophobicContact CG-CG2 3.85Å; V89-F120 HydrophobicContact CG1-CD2 4.49Å; V89-F120 HydrophobicContact CG2-CE2 4.35Å
90	V	89.2	Confident	80.9	Confident	20 Å²	20	36.6 Å²	36.6	12%	0.121	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127	178.1	-178.5	0	0	0	0	108.9	K23 C24 G25 V26 N59 E60 I92 V116	K23-V90 HydrophobicContact CB-CG2 4.19Å; K23-V90 HydrophobicContact CD-CG2 3.79Å; C24-V90 PolarHBondContact O-N 3.32Å; G25-V90 WeakPolarHBondContact CA-O 3.34Å; V26-V90 PolarHBondContact N-O 3.12Å; N59-V90 CarbonylContact O-C 3.58Å; N59-V90 VanDerWaalsContact O-CA 3.23Å; N59-V90 WeakPolarHBondContact O-CA 3.33Å; N59-V90 WeakPolarHBondContact O-CG1 3.38Å; E60-V90 HydrophobicContact CB-CG2 4.37Å; E60-V90 HydrophobicContact CG-CG2 4.08Å; V90-I92 HydrophobicContact CG1-CG1 4.38Å; V90-I92 PolarHBondContact O-N 3.46Å; V90-V116 HydrophobicContact CB-CG1 3.99Å; V90-V116 HydrophobicContact CG2-CG1 4.11Å
91	D	85.6	Confident	79.3	Confident	24 Å²	24	36.8 Å²	36.8	13%	0.128	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	119	167.1	-166.3	18.8	0	0	0	108.9	F38 N59	F38-D91 HydrophobicContact CB-CB 4.39Å; F38-D91 HydrophobicContact CD1-CB 4.23Å; F38-D91 HydrophobicContact CD2-CB 3.69Å; F38-D91 HydrophobicContact CE1-CB 4.45Å; F38-D91 HydrophobicContact CE2-CB 3.93Å; F38-D91 HydrophobicContact CG-CB 3.84Å; F38-D91 HydrophobicContact CZ-CB 4.3Å; N59-D91 HydrophobicContact CB-CB 4.38Å; N59-D91 PolarHBondContact O-N 3.32Å
92	I	79.5	Confident	77.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-104	136.6	174.5	-50.3	177.5	0	0	0	106.3	V26 V27 K34 V90 F109 H112 I113 V116	V26-I92 VanDerWaalsContact O-CB 3.31Å; V26-I92 WeakPolarHBondContact O-CB 3.23Å; V26-I92 PolarHBondContact O-N 3.29Å; V27-I92 HydrophobicContact CG2-CD1 3.91Å; K34-I92 WeakPolarHBondContact CE-O 3.45Å; V90-I92 HydrophobicContact CG1-CG1 4.38Å; V90-I92 PolarHBondContact O-N 3.46Å; I92-F109 HydrophobicContact CB-CD2 4.36Å; I92-F109 HydrophobicContact CB-CE2 4.2Å; I92-F109 HydrophobicContact CG2-CD2 3.32Å; I92-F109 HydrophobicContact CG2-CE2 3.5Å; I92-F109 HydrophobicContact CG2-CG 4.07Å; I92-F109 HydrophobicContact CG2-CZ 4.35Å; I92-H112 HydrophobicContact CG2-CB 3.94Å; I92-I113 HydrophobicContact CD1-CB 3.97Å; I92-I113 HydrophobicContact CD1-CG1 3.96Å; I92-V116 HydrophobicContact CD1-CG1 4.2Å; I92-V116 HydrophobicContact CD1-CG2 4.09Å
93	A	69.9	Low	75.2	Confident	39 Å²	39	36.5 Å²	36.5	32%	0.322	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-49.2	163.7	-178.8	0	0	0	0	0	112.9	L95 F109	A93-L95 PolarHBondContact O-N 3.2Å; A93-F109 WeakPolarHBondContact O-CD2 3.45Å; A93-F109 VanDerWaalsContact O-CE2 3.29Å; A93-F109 WeakPolarHBondContact O-CE2 3.32Å
94	G	65.8	Low	73.3	Confident	25 Å²	25	38.8 Å²	38.8	26%	0.258	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-65.1	131.5	171.6	0	0	0	0	0	111.5
95	L	65.9	Low	71.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-79.7	131.2	167.8	-171.1	84	0	0	0	108.8	G28 P30 A93 A99 F109 L110 I147 E150	G28-L95 PolarHBondContact O-N 3.48Å; P30-L95 VanDerWaalsContact CD-O 3.3Å; P30-L95 WeakPolarHBondContact CD-O 3.42Å; A93-L95 PolarHBondContact O-N 3.2Å; L95-A99 HydrophobicContact CD1-CB 3.39Å; L95-A99 HydrophobicContact CG-CB 4.06Å; L95-F109 HydrophobicContact CB-CD1 4.24Å; L95-F109 HydrophobicContact CB-CD2 4.18Å; L95-F109 HydrophobicContact CB-CE1 4.12Å; L95-F109 HydrophobicContact CB-CE2 4.03Å; L95-F109 HydrophobicContact CB-CG 4.28Å; L95-F109 HydrophobicContact CB-CZ 4Å; L95-F109 HydrophobicContact CD1-CB 4.41Å; L95-F109 HydrophobicContact CD1-CD1 3.15Å; L95-F109 HydrophobicContact CD1-CD2 4.45Å; L95-F109 HydrophobicContact CD1-CE1 3.42Å; L95-F109 VanDerWaalsContact CD1-CE1 3.42Å; L95-F109 HydrophobicContact CD1-CG 3.74Å; L95-F109 HydrophobicContact CD1-CZ 4.17Å; L95-F109 HydrophobicContact CD2-CE1 4.47Å; L95-F109 HydrophobicContact CG-CD1 4.25Å; L95-F109 HydrophobicContact CG-CE1 4.21Å; L95-L110 HydrophobicContact CD1-CD2 4.28Å; L95-I147 HydrophobicContact CB-CD1 3.89Å; L95-I147 HydrophobicContact CD2-CD1 3.45Å; L95-I147 VanDerWaalsContact CD2-CD1 3.45Å; L95-I147 HydrophobicContact CG-CD1 4.26Å; L95-E150 HydrophobicContact CD2-CB 3.62Å; L95-E150 HydrophobicContact CD2-CG 3.85Å
96	V	62.3	Low	69.8	Low	52 Å²	52	43.7 Å²	43.7	32%	0.315	26%	0.255	S	S	.	.			trans	-104.1	149.8	165.6	-64	0	0	0	0	109.2	P30 A99 I134	P30-V96 HydrophobicContact CG-CG1 3.83Å; V96-A99 WeakPolarHBondContact O-CB 3.29Å; V96-A99 PolarHBondContact O-N 3.18Å; V96-A99 VanDerWaalsContact O-N 3.16Å; V96-I134 HydrophobicContact CB-CD1 4.16Å; V96-I134 HydrophobicContact CG1-CD1 3.6Å
97	K	60.1	Low	68.4	Low	135 Å²	135	46.1 Å²	46.1	59%	0.587	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	138.3	175	-174.9	174.6	-180	176.2	0	110.7	A99 I146	K97-A99 VanDerWaalsContact C-N 3.35Å; K97-I146 HydrophobicContact CB-CG2 4.3Å
98	G	60.4	Low	67	Low	22 Å²	22	47.9 Å²	47.9	23%	0.227	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	6.8	-174.7	0	0	0	0	0	114.5	H100 E101 E150	G98-H100 PolarHBondContact O-N 3.01Å; G98-E101 WeakPolarHBondContact O-CB 3.37Å; G98-E101 PolarHBondContact O-N 3.18Å; G98-E150 PolarHBondContact N-OE1 2.88Å
99	A	59	Low	65.9	Low	2 Å²	2	47.2 Å²	47.2	2%	0.017	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-60.8	-26.7	177.1	0	0	0	0	0	113.4	L95 V96 K97 E101 G102 G106 E150	L95-A99 HydrophobicContact CD1-CB 3.39Å; L95-A99 HydrophobicContact CG-CB 4.06Å; V96-A99 WeakPolarHBondContact O-CB 3.29Å; V96-A99 PolarHBondContact O-N 3.18Å; V96-A99 VanDerWaalsContact O-N 3.16Å; K97-A99 VanDerWaalsContact C-N 3.35Å; A99-E101 PolarHBondContact O-N 3.33Å; A99-G102 PolarHBondContact O-N 3.07Å; A99-G102 VanDerWaalsContact O-N 3.16Å; A99-G106 VanDerWaalsContact CB-CA 3.46Å; A99-E150 PolarHBondContact N-OE2 3.16Å
100	H	55	Low	64.8	Low	54 Å²	54	47.3 Å²	47.3	25%	0.25	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-61.6	-25.9	173.3	68.8	-82.2	0	0	0	113.7	G98 G102 E150 L153	G98-H100 PolarHBondContact O-N 3.01Å; H100-G102 PolarHBondContact O-N 3.23Å; H100-E150 WeakPolarHBondContact CB-OE2 3.21Å; H100-E150 IonicContact CE1-OE1 3.62Å; H100-E150 IonicContact CE1-OE2 2.71Å; H100-E150 IonicContact CG-OE2 3.48Å; H100-E150 PolarHBondContact N-OE2 3.38Å; H100-E150 IonicContact ND1-OE1 2.78Å; H100-E150 PolarHBondContact ND1-OE1 3.47Å; H100-E150 VanDerWaalsContact ND1-OE1 3.08Å; H100-E150 IonicContact ND1-OE2 3.71Å; H100-E150 PolarHBondContact ND1-OE2 2.87Å; H100-L153 HydrophobicContact CB-CB 4.41Å
101	E	62	Low	64	Low	134 Å²	134	49.6 Å²	49.6	63%	0.626	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-71.8	-4	176.4	-59.9	-172.1	168.4	0	0	113.2	G98 A99 Q103	G98-E101 WeakPolarHBondContact O-CB 3.37Å; G98-E101 PolarHBondContact O-N 3.18Å; A99-E101 PolarHBondContact O-N 3.33Å; E101-Q103 PolarHBondContact O-N 3.39Å
102	G	55.3	Low	63.7	Low	26 Å²	26	52.6 Å²	52.6	27%	0.268	31%	0.312	S	S	.	.			trans	78.6	17.3	169.8	0	0	0	0	0	115.3	A99 H100 N107	A99-G102 PolarHBondContact O-N 3.07Å; A99-G102 VanDerWaalsContact O-N 3.16Å; H100-G102 PolarHBondContact O-N 3.23Å; G102-N107 VanDerWaalsContact CA-ND2 3.27Å; G102-N107 WeakPolarHBondContact CA-ND2 3.45Å; G102-N107 WeakPolarHBondContact CA-OD1 3.43Å; G102-N107 PolarHBondContact O-ND2 3.02Å
103	Q	51.2	Low	64	Low	150 Å²	150	52.6 Å²	52.6	70%	0.701	31%	0.312	S	S	*	.			trans	-83.1	123.7	173.5	-59.7	-170.2	20.7	0	0	111.2	E101 L105 G106	E101-Q103 PolarHBondContact O-N 3.39Å; Q103-L105 PolarHBondContact O-N 2.8Å; Q103-G106 PolarHBondContact O-N 3.16Å
104	G	57.4	Low	64.8	Low	67 Å²	67	53.1 Å²	53.1	69%	0.691	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	-125.2	167.9	0	0	0	0	0	116	G106 N107	G104-G106 PolarHBondContact O-N 3.38Å; G104-N107 PolarHBondContact O-N 3.44Å
105	L	56.1	Low	65.9	Low	126 Å²	126	53.8 Å²	53.8	66%	0.66	31%	0.312	S	S	*	.	H	α-helix	trans	-59.7	-24.5	-174	-75.5	158	0	0	0	113.9	Q103 A108 F109	Q103-L105 PolarHBondContact O-N 2.8Å; L105-A108 PolarHBondContact O-N 3.24Å; L105-F109 PolarHBondContact O-N 3.08Å
106	G	60.7	Low	67.2	Low	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-41.6	-178.8	0	0	0	0	0	113.8	A99 Q103 G104 A108 F109 L110	A99-G106 VanDerWaalsContact CB-CA 3.46Å; Q103-G106 PolarHBondContact O-N 3.16Å; G104-G106 PolarHBondContact O-N 3.38Å; G106-A108 PolarHBondContact O-N 3.47Å; G106-F109 WeakPolarHBondContact O-CB 3.31Å; G106-F109 PolarHBondContact O-N 3.22Å; G106-L110 VanDerWaalsContact O-CG 3.25Å; G106-L110 WeakPolarHBondContact O-CG 3.32Å; G106-L110 PolarHBondContact O-N 2.9Å
107	N	63.4	Low	68.7	Low	74 Å²	74	52.4 Å²	52.4	40%	0.396	30%	0.303	S	S	.	.	H	α-helix	trans	-66.9	-38.1	179.5	-90.3	-22.2	0	0	0	112.5	G102 G104 L110 S111	G102-N107 VanDerWaalsContact CA-ND2 3.27Å; G102-N107 WeakPolarHBondContact CA-ND2 3.45Å; G102-N107 WeakPolarHBondContact CA-OD1 3.43Å; G102-N107 PolarHBondContact O-ND2 3.02Å; G104-N107 PolarHBondContact O-N 3.44Å; N107-L110 PolarHBondContact O-N 3.41Å; N107-S111 WeakPolarHBondContact O-CB 3.4Å; N107-S111 PolarHBondContact O-N 3.38Å; N107-S111 PolarHBondContact O-OG 3.44Å
108	A	64.7	Low	70.4	Confident	40 Å²	40	46 Å²	46	33%	0.331	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-48.2	176.2	0	0	0	0	0	110.7	L105 G106 L110 S111 H112	L105-A108 PolarHBondContact O-N 3.24Å; G106-A108 PolarHBondContact O-N 3.47Å; A108-L110 PolarHBondContact O-N 3.27Å; A108-S111 PolarHBondContact O-N 2.87Å; A108-S111 PolarHBondContact O-OG 3.26Å; A108-H112 PolarHBondContact O-CD2 3.35Å; A108-H112 VanDerWaalsContact O-CG 3.3Å; A108-H112 PolarHBondContact O-N 2.75Å
109	F	69.6	Low	72.1	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-51.5	-52.9	173.5	174.1	-87.8	0	0	0	112.1	V27 I92 A93 L95 L105 G106 S111 H112 I113 L151	V27-F109 HydrophobicContact CB-CE2 4.4Å; V27-F109 HydrophobicContact CB-CZ 4.2Å; V27-F109 HydrophobicContact CG1-CE2 4.04Å; V27-F109 HydrophobicContact CG1-CZ 3.54Å; V27-F109 HydrophobicContact CG2-CE2 4.03Å; V27-F109 HydrophobicContact CG2-CZ 3.79Å; I92-F109 HydrophobicContact CB-CD2 4.36Å; I92-F109 HydrophobicContact CB-CE2 4.2Å; I92-F109 HydrophobicContact CG2-CD2 3.32Å; I92-F109 HydrophobicContact CG2-CE2 3.5Å; I92-F109 HydrophobicContact CG2-CG 4.07Å; I92-F109 HydrophobicContact CG2-CZ 4.35Å; A93-F109 WeakPolarHBondContact O-CD2 3.45Å; A93-F109 VanDerWaalsContact O-CE2 3.29Å; A93-F109 WeakPolarHBondContact O-CE2 3.32Å; L95-F109 HydrophobicContact CB-CD1 4.24Å; L95-F109 HydrophobicContact CB-CD2 4.18Å; L95-F109 HydrophobicContact CB-CE1 4.12Å; L95-F109 HydrophobicContact CB-CE2 4.03Å; L95-F109 HydrophobicContact CB-CG 4.28Å; L95-F109 HydrophobicContact CB-CZ 4Å; L95-F109 HydrophobicContact CD1-CB 4.41Å; L95-F109 HydrophobicContact CD1-CD1 3.15Å; L95-F109 HydrophobicContact CD1-CD2 4.45Å; L95-F109 HydrophobicContact CD1-CE1 3.42Å; L95-F109 VanDerWaalsContact CD1-CE1 3.42Å; L95-F109 HydrophobicContact CD1-CG 3.74Å; L95-F109 HydrophobicContact CD1-CZ 4.17Å; L95-F109 HydrophobicContact CD2-CE1 4.47Å; L95-F109 HydrophobicContact CG-CD1 4.25Å; L95-F109 HydrophobicContact CG-CE1 4.21Å; L105-F109 PolarHBondContact O-N 3.08Å; G106-F109 WeakPolarHBondContact O-CB 3.31Å; G106-F109 PolarHBondContact O-N 3.22Å; F109-S111 VanDerWaalsContact C-N 3.32Å; F109-S111 PolarHBondContact O-N 2.8Å; F109-H112 PolarHBondContact O-N 3.5Å; F109-I113 HydrophobicContact CE1-CB 4.4Å; F109-I113 HydrophobicContact CE1-CD1 4.05Å; F109-I113 HydrophobicContact CE1-CG2 4.37Å; F109-I113 HydrophobicContact CZ-CD1 3.97Å; F109-I113 PolarHBondContact O-N 2.96Å; F109-L151 HydrophobicContact CE1-CD2 4.05Å
110	L	68.7	Low	73.9	Confident	3 Å²	3	45 Å²	45	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-70.6	-28.1	-173.9	-65.1	170.6	0	0	0	112.5	L95 G106 N107 A108 I113 L151 K154	L95-L110 HydrophobicContact CD1-CD2 4.28Å; G106-L110 VanDerWaalsContact O-CG 3.25Å; G106-L110 WeakPolarHBondContact O-CG 3.32Å; G106-L110 PolarHBondContact O-N 2.9Å; N107-L110 PolarHBondContact O-N 3.41Å; A108-L110 PolarHBondContact O-N 3.27Å; L110-I113 WeakPolarHBondContact O-CG2 3.44Å; L110-L151 HydrophobicContact CD2-CD2 4.44Å; L110-K154 HydrophobicContact CB-CG 4.34Å; L110-K154 HydrophobicContact CD1-CB 4.45Å; L110-K154 HydrophobicContact CD1-CD 3.83Å; L110-K154 HydrophobicContact CD1-CG 4.03Å; L110-K154 HydrophobicContact CD2-CB 4.19Å; L110-K154 HydrophobicContact CD2-CG 4.08Å; L110-K154 HydrophobicContact CG-CG 4.37Å
111	S	71.4	Confident	75.9	Confident	69 Å²	69	42.8 Å²	42.8	48%	0.483	25%	0.254	S	S	.	.	H	α-helix	trans	-70.5	-41.3	171.9	75.8	0	0	0	0	111.7	N107 A108 F109 R114	N107-S111 WeakPolarHBondContact O-CB 3.4Å; N107-S111 PolarHBondContact O-N 3.38Å; N107-S111 PolarHBondContact O-OG 3.44Å; A108-S111 PolarHBondContact O-N 2.87Å; A108-S111 PolarHBondContact O-OG 3.26Å; F109-S111 VanDerWaalsContact C-N 3.32Å; F109-S111 PolarHBondContact O-N 2.8Å; S111-R114 PolarHBondContact O-N 2.84Å
112	H	79.5	Confident	77.5	Confident	87 Å²	87	36.4 Å²	36.4	40%	0.403	22%	0.224	S	C	.	.	H	α-helix	trans	-71.4	-38.7	-178.9	-69.9	-175.2	0	0	0	111.8	I92 A108 F109 R114 G115	I92-H112 HydrophobicContact CG2-CB 3.94Å; A108-H112 PolarHBondContact O-CD2 3.35Å; A108-H112 VanDerWaalsContact O-CG 3.3Å; A108-H112 PolarHBondContact O-N 2.75Å; F109-H112 PolarHBondContact O-N 3.5Å; H112-R114 PolarHBondContact O-N 3.11Å; H112-G115 WeakPolarHBondContact O-CA 3.45Å; H112-G115 PolarHBondContact O-N 2.99Å
113	I	86.5	Confident	79.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-29	177.7	-158.7	177.3	0	0	0	111.9	V27 I92 F109 L110 G115 V116 I119 L151 I218 K221	V27-I113 HydrophobicContact CG2-CD1 3.62Å; V27-I113 HydrophobicContact CG2-CG1 4.08Å; I92-I113 HydrophobicContact CD1-CB 3.97Å; I92-I113 HydrophobicContact CD1-CG1 3.96Å; F109-I113 HydrophobicContact CE1-CB 4.4Å; F109-I113 HydrophobicContact CE1-CD1 4.05Å; F109-I113 HydrophobicContact CE1-CG2 4.37Å; F109-I113 HydrophobicContact CZ-CD1 3.97Å; F109-I113 PolarHBondContact O-N 2.96Å; L110-I113 WeakPolarHBondContact O-CG2 3.44Å; I113-G115 PolarHBondContact O-N 3.06Å; I113-V116 HydrophobicContact CG1-CG2 4.32Å; I113-V116 VanDerWaalsContact O-CG2 3.23Å; I113-V116 WeakPolarHBondContact O-CG2 3.37Å; I113-V116 PolarHBondContact O-N 3.29Å; I113-I119 HydrophobicContact CD1-CD1 3.87Å; I113-I119 HydrophobicContact CD1-CG1 4.35Å; I113-I119 HydrophobicContact CG1-CD1 4.31Å; I113-I119 HydrophobicContact CG1-CG1 4.43Å; I113-L151 HydrophobicContact CD1-CD1 4.04Å; I113-L151 HydrophobicContact CD1-CD2 3.6Å; I113-L151 HydrophobicContact CD1-CG 4.48Å; I113-I218 HydrophobicContact CD1-CG2 3.81Å; I113-I218 HydrophobicContact CG1-CG2 4.19Å; I113-I218 HydrophobicContact CG2-CD1 3.71Å; I113-I218 HydrophobicContact CG2-CG1 4.05Å; I113-I218 HydrophobicContact CG2-CG2 4.09Å; I113-K221 PolarHBondContact O-NZ 3.1Å
114	R	86.8	Confident	81.6	Confident	50 Å²	50	28.3 Å²	28.3	19%	0.189	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-29.1	170.4	-77.3	-174.8	175.9	-101	-9.4	112.3	R17 S111 H112 V116 D155 I218 K221	R17-R114 PolarHBondContact NH2-O 3.42Å; S111-R114 PolarHBondContact O-N 2.84Å; H112-R114 PolarHBondContact O-N 3.11Å; R114-V116 VanDerWaalsContact C-N 3.34Å; R114-V116 PolarHBondContact O-N 2.99Å; R114-D155 IonicContact NH2-OD1 2.7Å; R114-D155 PolarHBondContact NH2-OD1 2.94Å; R114-I218 HydrophobicContact CG-CD1 4.06Å; R114-I218 HydrophobicContact CG-CG1 3.8Å; R114-K221 VanDerWaalsContact C-NZ 3.28Å; R114-K221 VanDerWaalsContact CA-NZ 3.31Å; R114-K221 PolarHBondContact O-NZ 3.37Å
115	G	87.7	Confident	83.3	Confident	39 Å²	39	25.8 Å²	25.8	40%	0.402	15%	0.15	S	C	.	.	H	α-helix	trans	-70.2	-19.4	179.9	0	0	0	0	0	115.6	R17 H112 I113	R17-G115 PolarHBondContact NH1-O 3.02Å; H112-G115 WeakPolarHBondContact O-CA 3.45Å; H112-G115 PolarHBondContact O-N 2.99Å; I113-G115 PolarHBondContact O-N 3.06Å
116	V	92.7	Very high	85.1	Confident	2 Å²	2	20.4 Å²	20.4	1%	0.012	12%	0.121	C	C	.	.			trans	-97.6	172	-179.5	-58.1	0	0	0	0	112.8	R17 K23 V90 I92 I113 R114 K221	R17-V116 PolarHBondContact NH1-O 2.86Å; K23-V116 HydrophobicContact CB-CB 4.47Å; K23-V116 HydrophobicContact CB-CG1 4.3Å; V90-V116 HydrophobicContact CB-CG1 3.99Å; V90-V116 HydrophobicContact CG2-CG1 4.11Å; I92-V116 HydrophobicContact CD1-CG1 4.2Å; I92-V116 HydrophobicContact CD1-CG2 4.09Å; I113-V116 HydrophobicContact CG1-CG2 4.32Å; I113-V116 VanDerWaalsContact O-CG2 3.23Å; I113-V116 WeakPolarHBondContact O-CG2 3.37Å; I113-V116 PolarHBondContact O-N 3.29Å; R114-V116 VanDerWaalsContact C-N 3.34Å; R114-V116 PolarHBondContact O-N 2.99Å; V116-K221 VanDerWaalsContact O-CE 3.32Å; V116-K221 WeakPolarHBondContact O-CE 3.36Å; V116-K221 PolarHBondContact O-NZ 3.14Å
117	D	95.4	Very high	86.3	Confident	21 Å²	21	27.9 Å²	27.9	11%	0.112	16%	0.156	C	C	.	.	S	Bend	trans	-118.8	-22.3	-173.5	-52.1	-72.8	0	0	0	112.8	R17 L22 K23 P222 L301	R17-D117 WeakPolarHBondContact CB-OD1 3.37Å; R17-D117 WeakPolarHBondContact CD-OD1 3.49Å; R17-D117 VanDerWaalsContact CG-OD1 3.28Å; R17-D117 WeakPolarHBondContact CG-OD1 3.5Å; R17-D117 IonicContact CZ-OD1 3.38Å; R17-D117 IonicContact NE-OD1 3.61Å; R17-D117 IonicContact NH1-OD1 2.88Å; R17-D117 PolarHBondContact NH1-OD1 3.37Å; R17-D117 IonicContact NH1-OD2 3.12Å; L22-D117 WeakPolarHBondContact CA-OD2 3.36Å; L22-D117 HydrophobicContact CB-CB 4.09Å; L22-D117 HydrophobicContact CD2-CB 4.33Å; K23-D117 PolarHBondContact N-OD2 3.46Å; K23-D117 PolarHBondContact O-N 3.44Å; D117-P222 WeakPolarHBondContact O-CD 3.31Å; D117-L301 HydrophobicContact CB-CD2 3.76Å
118	A	95.9	Very high	87.3	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	163.1	167.2	0	0	0	0	0	110.6	K23 C24 G25 P222 T300 L301	K23-A118 PolarHBondContact O-N 3.3Å; C24-A118 CarbonylContact C-O 3.57Å; C24-A118 WeakPolarHBondContact CA-O 3.33Å; G25-A118 PolarHBondContact N-O 3.4Å; A118-P222 WeakPolarHBondContact CA-O 3.45Å; A118-P222 HydrophobicContact CB-CG 3.98Å; A118-T300 HydrophobicContact CB-CG2 3.96Å; A118-L301 HydrophobicContact CB-CD2 3.55Å; A118-L301 HydrophobicContact CB-CG 4.27Å
119	I	95.8	Very high	88.1	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.8	-176.8	-61.6	165.5	0	0	0	110.1	G25 V27 I113 H121 L151 I218 K221 P222 V223 I224	G25-I119 CarbonylContact O-C 3.53Å; G25-I119 WeakPolarHBondContact O-CA 3.49Å; V27-I119 HydrophobicContact CB-CG2 3.75Å; V27-I119 HydrophobicContact CG2-CG2 3.78Å; I113-I119 HydrophobicContact CD1-CD1 3.87Å; I113-I119 HydrophobicContact CD1-CG1 4.35Å; I113-I119 HydrophobicContact CG1-CD1 4.31Å; I113-I119 HydrophobicContact CG1-CG1 4.43Å; I119-H121 HydrophobicContact CG2-CB 4.27Å; I119-L151 HydrophobicContact CD1-CD1 4.08Å; I119-I218 HydrophobicContact CD1-CG2 4.44Å; I119-K221 HydrophobicContact CD1-CB 4.18Å; I119-K221 HydrophobicContact CD1-CD 4.48Å; I119-K221 HydrophobicContact CG1-CB 4.38Å; I119-P222 PolarHBondContact N-O 3.45Å; I119-V223 HydrophobicContact CB-CG1 4.41Å; I119-V223 HydrophobicContact CB-CG2 4.31Å; I119-V223 HydrophobicContact CD1-CG2 4.45Å; I119-V223 HydrophobicContact CG2-CG1 4.39Å; I119-V223 CarbonylContact O-C 3.56Å; I119-V223 WeakPolarHBondContact O-CA 2.9Å; I119-I224 PolarHBondContact O-N 3.26Å
120	F	96.7	Very high	88.7	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	100	158.6	-74.5	-57.4	0	0	0	108.3	C24 G25 V26 V27 L87 V89 M122 I224 L226 I293	C24-F120 HydrophobicContact CB-CD2 3.59Å; C24-F120 HydrophobicContact CB-CE2 3.42Å; C24-F120 VanDerWaalsContact CB-CE2 3.42Å; C24-F120 HydrophobicContact CB-CZ 4.31Å; G25-F120 PolarHBondContact O-N 2.74Å; V26-F120 WeakPolarHBondContact CA-O 3.37Å; V26-F120 HydrophobicContact CG2-CB 4.39Å; V26-F120 HydrophobicContact CG2-CD2 4.41Å; V27-F120 PolarHBondContact N-O 3.48Å; L87-F120 HydrophobicContact CD2-CE2 4.27Å; L87-F120 HydrophobicContact CD2-CZ 4.26Å; V89-F120 HydrophobicContact CG1-CD2 4.49Å; V89-F120 HydrophobicContact CG2-CE2 4.35Å; F120-M122 PolarHBondContact O-N 3.23Å; F120-I224 CarbonylContact C-O 3.46Å; F120-I224 WeakPolarHBondContact CA-O 3.31Å; F120-I224 HydrophobicContact CD1-CB 3.76Å; F120-I224 HydrophobicContact CD1-CD1 3.9Å; F120-I224 HydrophobicContact CD1-CG1 4.46Å; F120-I224 HydrophobicContact CD1-CG2 3.9Å; F120-I224 HydrophobicContact CE1-CB 4.04Å; F120-I224 HydrophobicContact CE1-CD1 3.42Å; F120-I224 VanDerWaalsContact CE1-CD1 3.42Å; F120-I224 HydrophobicContact CE1-CG1 4.36Å; F120-I224 HydrophobicContact CE1-CG2 3.98Å; F120-I224 HydrophobicContact CZ-CD1 4.18Å; F120-L226 HydrophobicContact CB-CD1 3.82Å; F120-L226 HydrophobicContact CB-CG 4.23Å; F120-L226 HydrophobicContact CD1-CD1 3.69Å; F120-L226 HydrophobicContact CD1-CD2 4.04Å; F120-L226 HydrophobicContact CD1-CG 3.85Å; F120-L226 HydrophobicContact CE1-CD1 4.42Å; F120-L226 HydrophobicContact CE1-CD2 4.41Å; F120-L226 HydrophobicContact CG-CD1 3.86Å; F120-L226 HydrophobicContact CG-CG 4.37Å; F120-I293 HydrophobicContact CD1-CG2 4.45Å; F120-I293 HydrophobicContact CE1-CG2 3.76Å; F120-I293 HydrophobicContact CZ-CG2 3.84Å
121	H	96.6	Very high	89.2	Confident	8 Å²	8	44.5 Å²	44.5	4%	0.037	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	103.9	177.5	-171.5	173.1	0	0	0	109.3	V27 I119 I147 V223 I224 Y225 L226	V27-H121 CarbonylContact O-C 3.55Å; V27-H121 WeakPolarHBondContact O-CA 3.1Å; I119-H121 HydrophobicContact CG2-CB 4.27Å; H121-I147 VanDerWaalsContact CE1-CB 3.46Å; H121-I147 WeakPolarHBondContact CE1-CB 3.38Å; H121-I147 VanDerWaalsContact CE1-CG2 3.49Å; H121-I147 WeakPolarHBondContact CE1-CG2 3.4Å; H121-I147 WeakPolarHBondContact NE2-CG1 3.44Å; H121-V223 HydrophobicContact CB-CG1 3.64Å; H121-I224 PolarHBondContact N-O 3.33Å; H121-Y225 HydrophobicContact CB-CD1 3.95Å; H121-Y225 HydrophobicContact CB-CE1 4.18Å; H121-Y225 AromaticContact ND1-CD1 3.88Å; H121-Y225 AromaticContact ND1-CE1 3.51Å; H121-Y225 CarbonylContact O-C 3.58Å; H121-Y225 WeakPolarHBondContact O-CA 3.37Å; H121-L226 PolarHBondContact O-N 3.1Å
122	M	96.2	Very high	89.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	125.1	-179.4	-172	166.6	-64.2	0	0	112.3	V26 V27 V32 K34 F37 F120 L226 N228 F261	V26-M122 HydrophobicContact CG1-CE 4.08Å; V27-M122 PolarHBondContact O-N 2.81Å; V32-M122 HydrophobicContact CB-CG 4.26Å; V32-M122 HydrophobicContact CG2-CB 3.97Å; V32-M122 HydrophobicContact CG2-CG 3.78Å; V32-M122 HydrophobicContact CG2-SD 4.11Å; K34-M122 HydrophobicContact CG-CB 4.42Å; K34-M122 HydrophobicContact CG-SD 4.12Å; K34-M122 PolarHBondContact N-SD 3.24Å; K34-M122 VanDerWaalsContact N-SD 3.41Å; F37-M122 HydrophobicContact CB-CE 3.55Å; F37-M122 HydrophobicContact CB-SD 4.48Å; F37-M122 HydrophobicContact CD1-CE 3.68Å; F37-M122 HydrophobicContact CD2-CE 4.28Å; F37-M122 HydrophobicContact CE1-CE 4.44Å; F37-M122 HydrophobicContact CG-CE 3.57Å; F120-M122 PolarHBondContact O-N 3.23Å; M122-L226 CarbonylContact C-O 3.55Å; M122-L226 WeakPolarHBondContact CA-O 3.49Å; M122-L226 HydrophobicContact CE-CD1 4.28Å; M122-N228 HydrophobicContact CG-CB 4.36Å; M122-F261 HydrophobicContact CE-CE1 4.29Å; M122-F261 HydrophobicContact CE-CZ 3.76Å; M122-F261 HydrophobicContact SD-CZ 4.42Å
123	L	96.3	Very high	89.9	Confident	2 Å²	2	43 Å²	43	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	143.8	176	-56.8	176.1	0	0	0	110.4	L125 L144 L226 V227 N228 I245	L123-L125 HydrophobicContact CB-CD1 3.96Å; L123-L144 HydrophobicContact CD1-CD1 3.94Å; L123-L144 HydrophobicContact CD1-CD2 3.9Å; L123-L144 HydrophobicContact CD1-CG 3.91Å; L123-L144 HydrophobicContact CD2-CD2 3.76Å; L123-L144 HydrophobicContact CD2-CG 3.74Å; L123-L144 HydrophobicContact CG-CD2 4.34Å; L123-L144 HydrophobicContact CG-CG 4.47Å; L123-L226 PolarHBondContact N-O 3.04Å; L123-V227 HydrophobicContact CD1-CG2 4.37Å; L123-N228 VanDerWaalsContact O-CB 3.3Å; L123-N228 WeakPolarHBondContact O-CB 3.31Å; L123-N228 PolarHBondContact O-N 2.73Å; L123-I245 HydrophobicContact CD1-CD1 4.1Å; L123-I245 HydrophobicContact CD1-CG1 4.26Å; L123-I245 HydrophobicContact CD1-CG2 3.99Å
124	R	94.7	Very high	89.7	Confident	3 Å²	3	46.7 Å²	46.7	1%	0.011	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.6	175.6	175.2	169.2	178.5	-168.2	-0.9	111.2	V32 F126 I131 I138	V32-R124 HydrophobicContact CB-CB 3.99Å; V32-R124 HydrophobicContact CG1-CB 3.81Å; R124-F126 HydrophobicContact CB-CE1 4.33Å; R124-F126 HydrophobicContact CG-CD1 3.93Å; R124-F126 HydrophobicContact CG-CE1 3.7Å; R124-F126 HydrophobicContact CG-CE2 4.37Å; R124-F126 HydrophobicContact CG-CG 4.35Å; R124-F126 HydrophobicContact CG-CZ 3.93Å; R124-F126 PolarHBondContact NE-O 2.58Å; R124-I131 VanDerWaalsContact NH1-CG2 3.26Å; R124-I131 PolarHBondContact NH1-O 3Å; R124-I131 PolarHBondContact NH2-O 3.41Å; R124-I138 HydrophobicContact CG-CD1 4.48Å; R124-I138 WeakPolarHBondContact O-CG2 3.39Å
125	L	95.1	Very high	89.5	Confident	15 Å²	15	47.1 Å²	47.1	8%	0.079	25%	0.249	C	C	.	.			trans	-119.7	-0.9	172.8	-81.8	69.7	0	0	0	113	L123 P140 V227 N228 M229 W241 I245	L123-L125 HydrophobicContact CB-CD1 3.96Å; L125-P140 HydrophobicContact CD1-CB 3.93Å; L125-P140 HydrophobicContact CD1-CG 3.58Å; L125-P140 HydrophobicContact CG-CG 3.86Å; L125-V227 HydrophobicContact CB-CG1 4.49Å; L125-V227 HydrophobicContact CD1-CG1 3.42Å; L125-V227 VanDerWaalsContact CD1-CG1 3.42Å; L125-V227 HydrophobicContact CD2-CG1 3.24Å; L125-V227 HydrophobicContact CG-CG1 3.86Å; L125-N228 WeakPolarHBondContact CA-O 3.38Å; L125-N228 WeakPolarHBondContact CB-O 3.49Å; L125-N228 PolarHBondContact N-O 2.96Å; L125-M229 HydrophobicContact CB-CG 4.29Å; L125-M229 HydrophobicContact CD2-CG 4.33Å; L125-W241 HydrophobicContact CD2-CB 3.79Å; L125-W241 HydrophobicContact CG-CB 4.18Å; L125-I245 HydrophobicContact CD1-CD1 3.82Å; L125-I245 HydrophobicContact CD2-CD1 3.9Å; L125-I245 HydrophobicContact CG-CD1 4.3Å
126	F	92.1	Very high	89.4	Confident	13 Å²	13	48.4 Å²	48.4	6%	0.057	26%	0.262	C	S	.	.			trans	-89.4	130.6	175.9	64.4	-90	0	0	0	111.4	R124 N128 I131 I138 N228	R124-F126 HydrophobicContact CB-CE1 4.33Å; R124-F126 HydrophobicContact CG-CD1 3.93Å; R124-F126 HydrophobicContact CG-CE1 3.7Å; R124-F126 HydrophobicContact CG-CE2 4.37Å; R124-F126 HydrophobicContact CG-CG 4.35Å; R124-F126 HydrophobicContact CG-CZ 3.93Å; R124-F126 PolarHBondContact NE-O 2.58Å; F126-N128 HydrophobicContact CD2-CB 4.26Å; F126-I131 HydrophobicContact CE2-CD1 4.01Å; F126-I138 WeakPolarHBondContact O-CD1 3.16Å; F126-N228 HydrophobicContact CD1-CB 4.43Å; F126-N228 HydrophobicContact CE1-CB 4.42Å; F126-N228 VanDerWaalsContact CE1-ND2 3.33Å; F126-N228 WeakPolarHBondContact CE1-ND2 3.48Å; F126-N228 PolarHBondContact N-O 2.99Å
127	E	86.2	Confident	89.3	Confident	157 Å²	157	52.5 Å²	52.5	73%	0.734	28%	0.284	S	S	*	.			trans	-83.8	132.7	167.3	-70.7	168.5	-160.8	0	0	108.7	I138	E127-I138 HydrophobicContact CB-CD1 4.41Å; E127-I138 HydrophobicContact CG-CD1 3.81Å
128	N	84.8	Confident	89.1	Confident	64 Å²	64	52.9 Å²	52.9	34%	0.342	29%	0.286	S	S	.	.			trans	-150.2	120.3	173.4	-177.2	-25.9	0	0	0	107.3	F126 D130 I131	F126-N128 HydrophobicContact CD2-CB 4.26Å; N128-D130 PolarHBondContact O-N 2.94Å; N128-D130 WeakPolarHBondContact OD1-CB 3.31Å; N128-D130 PolarHBondContact OD1-N 3.27Å; N128-I131 HydrophobicContact CB-CB 4.21Å; N128-I131 HydrophobicContact CB-CD1 4Å; N128-I131 HydrophobicContact CB-CG1 4.08Å; N128-I131 WeakPolarHBondContact ND2-CD1 3.23Å; N128-I131 PolarHBondContact O-N 2.71Å; N128-I131 VanDerWaalsContact O-N 3.1Å
129	E	80.8	Confident	89	Confident	198 Å²	198	55 Å²	55	93%	0.925	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.6	-176.4	-64.2	-177.5	179.6	0	0	112.4	I131	E129-I131 VanDerWaalsContact C-N 3.3Å; E129-I131 PolarHBondContact O-N 3.45Å
130	D	82.3	Confident	89	Confident	150 Å²	150	55 Å²	55	80%	0.802	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-9	178.8	-59.5	-43.7	0	0	0	113	N128	N128-D130 PolarHBondContact O-N 2.94Å; N128-D130 WeakPolarHBondContact OD1-CB 3.31Å; N128-D130 PolarHBondContact OD1-N 3.27Å
131	I	80	Confident	89	Confident	53 Å²	53	56.5 Å²	56.5	27%	0.272	31%	0.306	S	S	.	.	S	Bend	trans	-121.6	98.8	-173.5	-51.6	177.1	0	0	0	110.2	N31 R124 F126 N128 E129	N31-I131 HydrophobicContact CB-CG2 3.66Å; R124-I131 VanDerWaalsContact NH1-CG2 3.26Å; R124-I131 PolarHBondContact NH1-O 3Å; R124-I131 PolarHBondContact NH2-O 3.41Å; F126-I131 HydrophobicContact CE2-CD1 4.01Å; N128-I131 HydrophobicContact CB-CB 4.21Å; N128-I131 HydrophobicContact CB-CD1 4Å; N128-I131 HydrophobicContact CB-CG1 4.08Å; N128-I131 WeakPolarHBondContact ND2-CD1 3.23Å; N128-I131 PolarHBondContact O-N 2.71Å; N128-I131 VanDerWaalsContact O-N 3.1Å; E129-I131 VanDerWaalsContact C-N 3.3Å; E129-I131 PolarHBondContact O-N 3.45Å
132	T	82.2	Confident	89	Confident	109 Å²	109	59 Å²	59	67%	0.669	32%	0.315	S	S	*	.			trans	-65.6	138.7	176.5	56.5	0	0	0	0	112.1	N31	N31-T132 PolarHBondContact ND2-O 3.19Å
133	H	83.2	Confident	88.9	Confident	15 Å²	15	59 Å²	59	7%	0.069	32%	0.316	C	S	.	.			trans	-82.2	138.9	168.1	-161.4	-91.5	0	0	0	109.9	E135 G136 D137 D143	H133-E135 PolarHBondContact ND1-N 2.93Å; H133-E135 PolarHBondContact O-N 2.71Å; H133-G136 PolarHBondContact O-N 3Å; H133-D137 PolarHBondContact ND1-O 2.92Å; H133-D143 IonicContact CE1-OD1 3.3Å; H133-D143 PolarHBondContact CE1-OD1 3.28Å; H133-D143 VanDerWaalsContact CE1-OD1 3.3Å; H133-D143 IonicContact CE1-OD2 3.44Å; H133-D143 PolarHBondContact CE1-OD2 3.49Å; H133-D143 IonicContact NE2-OD1 3.84Å; H133-D143 IonicContact NE2-OD2 3.12Å; H133-D143 PolarHBondContact NE2-OD2 3.5Å; H133-D143 VanDerWaalsContact NE2-OD2 3.12Å
134	I	81.8	Confident	88.8	Confident	78 Å²	78	59 Å²	59	40%	0.4	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.4	-175.9	-169.4	162.3	0	0	0	112.7	L29 P30 V96 G136	L29-I134 HydrophobicContact CD1-CG2 4.14Å; P30-I134 HydrophobicContact CG-CD1 3.99Å; V96-I134 HydrophobicContact CB-CD1 4.16Å; V96-I134 HydrophobicContact CG1-CD1 3.6Å; I134-G136 VanDerWaalsContact C-N 3.32Å
135	E	84	Confident	88.9	Confident	60 Å²	60	62.3 Å²	62.3	28%	0.28	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	8.7	175.7	-59.7	-67.1	131.4	0	0	112.9	H133 D137 R142 I146	H133-E135 PolarHBondContact ND1-N 2.93Å; H133-E135 PolarHBondContact O-N 2.71Å; E135-D137 PolarHBondContact O-N 3.44Å; E135-R142 VanDerWaalsContact CB-NH2 3.26Å; E135-I146 HydrophobicContact CG-CD1 3.92Å
136	G	84.8	Confident	88.7	Confident	66 Å²	66	62.4 Å²	62.4	68%	0.68	33%	0.334	S	S	*	.	S	Bend	trans	92.1	-42.2	178.1	0	0	0	0	0	115	H133 I134	H133-G136 PolarHBondContact O-N 3Å; I134-G136 VanDerWaalsContact C-N 3.32Å
137	D	89.6	Confident	88.6	Confident	88 Å²	88	61.9 Å²	61.9	47%	0.471	33%	0.332	S	S	.	.	S	Bend	trans	-130.9	161.2	178.9	69.7	-34.8	0	0	0	112.6	H133 E135 D139 R142	H133-D137 PolarHBondContact ND1-O 2.92Å; E135-D137 PolarHBondContact O-N 3.44Å; D137-D139 PolarHBondContact O-N 3.38Å; D137-R142 PolarHBondContact O-NH2 3.06Å; D137-R142 IonicContact OD1-CZ 3.5Å; D137-R142 IonicContact OD1-NH1 2.74Å; D137-R142 PolarHBondContact OD1-NH1 2.84Å; D137-R142 IonicContact OD1-NH2 3.4Å; D137-R142 PolarHBondContact OD1-NH2 3.4Å
138	I	91.2	Very high	89	Confident	29 Å²	29	55.6 Å²	55.6	15%	0.149	30%	0.303	C	S	.	.			trans	-83	111.6	178.3	-64.6	169.1	0	0	0	109.3	R124 F126 E127 P140 W241	R124-I138 HydrophobicContact CG-CD1 4.48Å; R124-I138 WeakPolarHBondContact O-CG2 3.39Å; F126-I138 WeakPolarHBondContact O-CD1 3.16Å; E127-I138 HydrophobicContact CB-CD1 4.41Å; E127-I138 HydrophobicContact CG-CD1 3.81Å; I138-P140 HydrophobicContact CG2-CG 4.3Å; I138-W241 VanDerWaalsContact O-CZ2 3.24Å; I138-W241 WeakPolarHBondContact O-CZ2 3.25Å
139	D	94.8	Very high	89.4	Confident	44 Å²	44	55.7 Å²	55.7	24%	0.235	30%	0.301	C	S	.	.			trans	-137.7	93.1	170.1	-171.7	-22.4	0	0	0	109.6	D137 V141 R142 D143 W241	D137-D139 PolarHBondContact O-N 3.38Å; D139-V141 PolarHBondContact O-N 3.14Å; D139-V141 VanDerWaalsContact O-N 3.16Å; D139-V141 WeakPolarHBondContact OD1-CB 3.48Å; D139-V141 PolarHBondContact OD1-N 2.82Å; D139-R142 HydrophobicContact CB-CB 3.99Å; D139-R142 PolarHBondContact O-N 3.04Å; D139-R142 PolarHBondContact OD1-N 3.48Å; D139-D143 PolarHBondContact O-N 3.2Å; D139-W241 HydrophobicContact CB-CH2 4.18Å; D139-W241 WeakPolarHBondContact OD1-CZ3 3.45Å
140	P	95.6	Very high	89.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-23.9	-178.2	-23.2	33.8	0	0	0	114	L125 I138 L144 W241 I245	L125-P140 HydrophobicContact CD1-CB 3.93Å; L125-P140 HydrophobicContact CD1-CG 3.58Å; L125-P140 HydrophobicContact CG-CG 3.86Å; I138-P140 HydrophobicContact CG2-CG 4.3Å; P140-L144 WeakPolarHBondContact O-CD1 3.27Å; P140-L144 WeakPolarHBondContact O-CG 3.43Å; P140-L144 PolarHBondContact O-N 2.91Å; P140-W241 HydrophobicContact CG-CB 4.2Å; P140-W241 HydrophobicContact CG-CD2 4.05Å; P140-W241 HydrophobicContact CG-CE3 4.37Å; P140-W241 HydrophobicContact CG-CG 3.96Å; P140-I245 HydrophobicContact CB-CD1 3.87Å; P140-I245 HydrophobicContact CB-CG1 4.1Å; P140-I245 HydrophobicContact CG-CD1 4.41Å
141	V	96.9	Very high	90.3	Very high	33 Å²	33	40 Å²	40	20%	0.2	22%	0.223	C	C	.	.	H	α-helix	trans	-76	-46.1	179.8	-178.2	0	0	0	0	109.6	D139 D143 L144 D145 W241 K244 W248	D139-V141 PolarHBondContact O-N 3.14Å; D139-V141 VanDerWaalsContact O-N 3.16Å; D139-V141 WeakPolarHBondContact OD1-CB 3.48Å; D139-V141 PolarHBondContact OD1-N 2.82Å; V141-D143 VanDerWaalsContact C-N 3.25Å; V141-D143 PolarHBondContact O-N 3.05Å; V141-L144 WeakPolarHBondContact O-CB 3.41Å; V141-L144 PolarHBondContact O-N 3.4Å; V141-D145 PolarHBondContact O-N 3.29Å; V141-D145 VanDerWaalsContact O-N 3.1Å; V141-W241 HydrophobicContact CG2-CE3 4.49Å; V141-K244 HydrophobicContact CG2-CB 3.79Å; V141-W248 HydrophobicContact CG1-CG 4.39Å
142	R	95.3	Very high	91	Very high	60 Å²	60	38 Å²	38	23%	0.226	21%	0.212	C	C	.	.	H	α-helix	trans	-58.2	-41.5	171	-179.4	-168.3	61.6	-150.4	-16.2	111.2	E135 D137 D139 L144 D145 I146	E135-R142 VanDerWaalsContact CB-NH2 3.26Å; D137-R142 PolarHBondContact O-NH2 3.06Å; D137-R142 IonicContact OD1-CZ 3.5Å; D137-R142 IonicContact OD1-NH1 2.74Å; D137-R142 PolarHBondContact OD1-NH1 2.84Å; D137-R142 IonicContact OD1-NH2 3.4Å; D137-R142 PolarHBondContact OD1-NH2 3.4Å; D139-R142 HydrophobicContact CB-CB 3.99Å; D139-R142 PolarHBondContact O-N 3.04Å; D139-R142 PolarHBondContact OD1-N 3.48Å; R142-L144 VanDerWaalsContact C-N 3.32Å; R142-L144 PolarHBondContact O-N 3.46Å; R142-D145 PolarHBondContact O-N 3.43Å; R142-I146 HydrophobicContact CG-CD1 3.94Å; R142-I146 HydrophobicContact CG-CG1 4.43Å; R142-I146 VanDerWaalsContact O-CG1 3.31Å; R142-I146 WeakPolarHBondContact O-CG1 3.49Å; R142-I146 PolarHBondContact O-N 2.77Å
143	D	94.3	Very high	91.5	Very high	3 Å²	3	35 Å²	35	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-36.9	-179.1	-59.7	-13.2	0	0	0	111.8	L29 H133 D139 V141 I146 I147	L29-D143 HydrophobicContact CD1-CB 3.67Å; L29-D143 WeakPolarHBondContact CD1-OD1 3.24Å; L29-D143 HydrophobicContact CG-CB 4.38Å; H133-D143 IonicContact CE1-OD1 3.3Å; H133-D143 PolarHBondContact CE1-OD1 3.28Å; H133-D143 VanDerWaalsContact CE1-OD1 3.3Å; H133-D143 IonicContact CE1-OD2 3.44Å; H133-D143 PolarHBondContact CE1-OD2 3.49Å; H133-D143 IonicContact NE2-OD1 3.84Å; H133-D143 IonicContact NE2-OD2 3.12Å; H133-D143 PolarHBondContact NE2-OD2 3.5Å; H133-D143 VanDerWaalsContact NE2-OD2 3.12Å; D139-D143 PolarHBondContact O-N 3.2Å; V141-D143 VanDerWaalsContact C-N 3.25Å; V141-D143 PolarHBondContact O-N 3.05Å; D143-I146 PolarHBondContact O-N 3.41Å; D143-I147 WeakPolarHBondContact O-CG1 3.41Å; D143-I147 PolarHBondContact O-N 3.45Å; D143-I147 VanDerWaalsContact O-N 3.1Å
144	L	96.1	Very high	91.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.2	-50.1	171	-78.6	163.4	0	0	0	111.2	L123 P140 V141 R142 I146 I147 D148 Y225 I245 W248	L123-L144 HydrophobicContact CD1-CD1 3.94Å; L123-L144 HydrophobicContact CD1-CD2 3.9Å; L123-L144 HydrophobicContact CD1-CG 3.91Å; L123-L144 HydrophobicContact CD2-CD2 3.76Å; L123-L144 HydrophobicContact CD2-CG 3.74Å; L123-L144 HydrophobicContact CG-CD2 4.34Å; L123-L144 HydrophobicContact CG-CG 4.47Å; P140-L144 WeakPolarHBondContact O-CD1 3.27Å; P140-L144 WeakPolarHBondContact O-CG 3.43Å; P140-L144 PolarHBondContact O-N 2.91Å; V141-L144 WeakPolarHBondContact O-CB 3.41Å; V141-L144 PolarHBondContact O-N 3.4Å; R142-L144 VanDerWaalsContact C-N 3.32Å; R142-L144 PolarHBondContact O-N 3.46Å; L144-I146 PolarHBondContact O-N 2.7Å; L144-I147 PolarHBondContact O-N 3.34Å; L144-D148 WeakPolarHBondContact O-CB 3.48Å; L144-D148 PolarHBondContact O-N 3.02Å; L144-Y225 HydrophobicContact CD2-CD1 3.51Å; L144-Y225 HydrophobicContact CD2-CE1 3.36Å; L144-I245 HydrophobicContact CD1-CG1 4.39Å; L144-I245 HydrophobicContact CD1-CG2 4.29Å; L144-W248 HydrophobicContact CB-CD2 3.86Å; L144-W248 HydrophobicContact CB-CE3 4.06Å; L144-W248 HydrophobicContact CB-CH2 4.03Å; L144-W248 HydrophobicContact CB-CZ2 3.79Å; L144-W248 HydrophobicContact CB-CZ3 4.16Å; L144-W248 HydrophobicContact CD1-CB 4.28Å; L144-W248 HydrophobicContact CD1-CD2 3.79Å; L144-W248 HydrophobicContact CD1-CE3 3.73Å; L144-W248 HydrophobicContact CD1-CG 4.02Å; L144-W248 HydrophobicContact CD1-CZ3 4.41Å; L144-W248 HydrophobicContact CD2-CE3 3.93Å; L144-W248 HydrophobicContact CD2-CH2 4.25Å; L144-W248 HydrophobicContact CD2-CZ3 3.78Å; L144-W248 HydrophobicContact CG-CD2 4.28Å; L144-W248 HydrophobicContact CG-CE3 4.13Å; L144-W248 HydrophobicContact CG-CZ3 4.35Å
145	D	94.9	Very high	92.4	Very high	74 Å²	74	31.9 Å²	31.9	40%	0.396	18%	0.175	S	C	.	.	H	α-helix	trans	-59.8	-44.1	178.4	-69.7	-35.1	0	0	0	112	V141 R142 I147 E149 W248	V141-D145 PolarHBondContact O-N 3.29Å; V141-D145 VanDerWaalsContact O-N 3.1Å; R142-D145 PolarHBondContact O-N 3.43Å; D145-I147 PolarHBondContact O-N 3.3Å; D145-E149 WeakPolarHBondContact O-CB 3.3Å; D145-E149 PolarHBondContact O-N 3.39Å; D145-W248 PolarHBondContact OD1-NE1 2.95Å
146	I	91.8	Very high	93	Very high	17 Å²	17	30.2 Å²	30.2	9%	0.087	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-50.3	179	-70.6	166.4	0	0	0	110.3	L29 K97 E135 R142 D143 L144 E150	L29-I146 HydrophobicContact CD2-CG2 4.09Å; K97-I146 HydrophobicContact CB-CG2 4.3Å; E135-I146 HydrophobicContact CG-CD1 3.92Å; R142-I146 HydrophobicContact CG-CD1 3.94Å; R142-I146 HydrophobicContact CG-CG1 4.43Å; R142-I146 VanDerWaalsContact O-CG1 3.31Å; R142-I146 WeakPolarHBondContact O-CG1 3.49Å; R142-I146 PolarHBondContact O-N 2.77Å; D143-I146 PolarHBondContact O-N 3.41Å; L144-I146 PolarHBondContact O-N 2.7Å; I146-E150 WeakPolarHBondContact O-CB 3.3Å; I146-E150 WeakPolarHBondContact O-CG 3.47Å; I146-E150 PolarHBondContact O-N 2.78Å; I146-E150 VanDerWaalsContact O-N 3.11Å
147	I	91.1	Very high	93.4	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-48.7	-178.3	-63.4	-60.7	0	0	0	110.3	V27 L29 L95 H121 D143 L144 D145 E149 E150 L151	V27-I147 HydrophobicContact CG1-CG2 3.94Å; L29-I147 HydrophobicContact CD2-CD1 3.71Å; L29-I147 HydrophobicContact CD2-CG1 4.36Å; L29-I147 HydrophobicContact CG-CD1 4.22Å; L29-I147 HydrophobicContact CG-CG1 4.5Å; L95-I147 HydrophobicContact CB-CD1 3.89Å; L95-I147 HydrophobicContact CD2-CD1 3.45Å; L95-I147 VanDerWaalsContact CD2-CD1 3.45Å; L95-I147 HydrophobicContact CG-CD1 4.26Å; H121-I147 VanDerWaalsContact CE1-CB 3.46Å; H121-I147 WeakPolarHBondContact CE1-CB 3.38Å; H121-I147 VanDerWaalsContact CE1-CG2 3.49Å; H121-I147 WeakPolarHBondContact CE1-CG2 3.4Å; H121-I147 WeakPolarHBondContact NE2-CG1 3.44Å; D143-I147 WeakPolarHBondContact O-CG1 3.41Å; D143-I147 PolarHBondContact O-N 3.45Å; D143-I147 VanDerWaalsContact O-N 3.1Å; L144-I147 PolarHBondContact O-N 3.34Å; D145-I147 PolarHBondContact O-N 3.3Å; I147-E149 VanDerWaalsContact C-N 3.35Å; I147-E149 PolarHBondContact O-N 3.07Å; I147-E150 PolarHBondContact O-N 3.44Å; I147-L151 HydrophobicContact CG2-CD1 4.24Å; I147-L151 HydrophobicContact CG2-CG 4.27Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 3.45Å; I147-L151 PolarHBondContact O-N 3.02Å
148	D	93.7	Very high	93.7	Very high	24 Å²	24	29 Å²	29	13%	0.128	14%	0.14	C	C	.	.	H	α-helix	trans	-59.4	-45.6	-177.8	-170.3	69.4	0	0	0	111.9	L144 E150 L151 R152 N198 W248	L144-D148 WeakPolarHBondContact O-CB 3.48Å; L144-D148 PolarHBondContact O-N 3.02Å; D148-E150 PolarHBondContact O-N 2.83Å; D148-L151 PolarHBondContact O-N 3.31Å; D148-R152 WeakPolarHBondContact O-CB 3.37Å; D148-R152 PolarHBondContact O-N 2.84Å; D148-N198 PolarHBondContact OD1-ND2 3.49Å; D148-W248 HydrophobicContact CB-CH2 4.04Å; D148-W248 HydrophobicContact CB-CZ2 4.17Å
149	E	92.8	Very high	93.9	Very high	67 Å²	67	27.7 Å²	27.7	31%	0.313	13%	0.133	S	C	.	.	H	α-helix	trans	-61.4	-44.3	177.9	-179	64.1	-176.3	0	0	111.9	D145 I147 L151 R152 L153	D145-E149 WeakPolarHBondContact O-CB 3.3Å; D145-E149 PolarHBondContact O-N 3.39Å; I147-E149 VanDerWaalsContact C-N 3.35Å; I147-E149 PolarHBondContact O-N 3.07Å; E149-L151 PolarHBondContact O-N 2.89Å; E149-R152 PolarHBondContact O-N 2.8Å; E149-R152 IonicContact OE1-CZ 2.8Å; E149-R152 IonicContact OE1-NH2 3.58Å; E149-R152 PolarHBondContact OE1-NH2 3.3Å; E149-R152 IonicContact OE2-CZ 3.33Å; E149-R152 IonicContact OE2-NE 3.96Å; E149-R152 PolarHBondContact OE2-NE 2.95Å; E149-R152 IonicContact OE2-NH2 3.29Å; E149-R152 PolarHBondContact OE2-NH2 3.3Å; E149-L153 HydrophobicContact CG-CD1 3.96Å; E149-L153 HydrophobicContact CG-CG 4.33Å; E149-L153 WeakPolarHBondContact O-CB 3.26Å; E149-L153 VanDerWaalsContact O-CG 3.25Å; E149-L153 WeakPolarHBondContact O-CG 3.43Å; E149-L153 PolarHBondContact O-N 3.45Å
150	E	89.6	Confident	94.1	Very high	10 Å²	10	27.1 Å²	27.1	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-40.2	178.5	-70.6	-77.6	156.5	0	0	112.2	L95 G98 A99 H100 I146 I147 D148 R152 K154	L95-E150 HydrophobicContact CD2-CB 3.62Å; L95-E150 HydrophobicContact CD2-CG 3.85Å; G98-E150 PolarHBondContact N-OE1 2.88Å; A99-E150 PolarHBondContact N-OE2 3.16Å; H100-E150 WeakPolarHBondContact CB-OE2 3.21Å; H100-E150 IonicContact CE1-OE1 3.62Å; H100-E150 IonicContact CE1-OE2 2.71Å; H100-E150 IonicContact CG-OE2 3.48Å; H100-E150 PolarHBondContact N-OE2 3.38Å; H100-E150 IonicContact ND1-OE1 2.78Å; H100-E150 PolarHBondContact ND1-OE1 3.47Å; H100-E150 VanDerWaalsContact ND1-OE1 3.08Å; H100-E150 IonicContact ND1-OE2 3.71Å; H100-E150 PolarHBondContact ND1-OE2 2.87Å; I146-E150 WeakPolarHBondContact O-CB 3.3Å; I146-E150 WeakPolarHBondContact O-CG 3.47Å; I146-E150 PolarHBondContact O-N 2.78Å; I146-E150 VanDerWaalsContact O-N 3.11Å; I147-E150 PolarHBondContact O-N 3.44Å; D148-E150 PolarHBondContact O-N 2.83Å; E150-R152 VanDerWaalsContact C-N 3.35Å; E150-K154 PolarHBondContact O-N 3.21Å
151	L	92.2	Very high	94.1	Very high	8 Å²	8	32.2 Å²	32.2	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-64.5	-41.6	175.7	-61.9	-168.9	0	0	0	111.1	F109 L110 I113 I119 I147 D148 E149 K154 D155 I218 T219	F109-L151 HydrophobicContact CE1-CD2 4.05Å; L110-L151 HydrophobicContact CD2-CD2 4.44Å; I113-L151 HydrophobicContact CD1-CD1 4.04Å; I113-L151 HydrophobicContact CD1-CD2 3.6Å; I113-L151 HydrophobicContact CD1-CG 4.48Å; I119-L151 HydrophobicContact CD1-CD1 4.08Å; I147-L151 HydrophobicContact CG2-CD1 4.24Å; I147-L151 HydrophobicContact CG2-CG 4.27Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 3.45Å; I147-L151 PolarHBondContact O-N 3.02Å; D148-L151 PolarHBondContact O-N 3.31Å; E149-L151 PolarHBondContact O-N 2.89Å; L151-K154 PolarHBondContact O-N 3.28Å; L151-D155 PolarHBondContact O-N 2.75Å; L151-I218 HydrophobicContact CB-CG2 4.16Å; L151-I218 HydrophobicContact CD1-CG2 4.04Å; L151-I218 HydrophobicContact CD2-CG2 4Å; L151-I218 HydrophobicContact CG-CG2 4.26Å; L151-T219 HydrophobicContact CB-CG2 4.46Å
152	R	94.8	Very high	94.1	Very high	10 Å²	10	32.8 Å²	32.8	4%	0.038	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-49.7	176.6	-172.6	-174.8	70.8	84.9	1.3	111.9	D148 E149 E150 K154 D155 I156 L192 T219	D148-R152 WeakPolarHBondContact O-CB 3.37Å; D148-R152 PolarHBondContact O-N 2.84Å; E149-R152 PolarHBondContact O-N 2.8Å; E149-R152 IonicContact OE1-CZ 2.8Å; E149-R152 IonicContact OE1-NH2 3.58Å; E149-R152 PolarHBondContact OE1-NH2 3.3Å; E149-R152 IonicContact OE2-CZ 3.33Å; E149-R152 IonicContact OE2-NE 3.96Å; E149-R152 PolarHBondContact OE2-NE 2.95Å; E149-R152 IonicContact OE2-NH2 3.29Å; E149-R152 PolarHBondContact OE2-NH2 3.3Å; E150-R152 VanDerWaalsContact C-N 3.35Å; R152-K154 PolarHBondContact O-N 3.42Å; R152-D155 PolarHBondContact O-N 2.67Å; R152-D155 VanDerWaalsContact O-N 3.12Å; R152-I156 HydrophobicContact CG-CD1 4.28Å; R152-I156 WeakPolarHBondContact O-CG1 3.38Å; R152-I156 PolarHBondContact O-N 3.47Å; R152-L192 HydrophobicContact CG-CD2 3.98Å; R152-L192 PolarHBondContact NH1-O 3.43Å; R152-T219 HydrophobicContact CB-CG2 4.41Å
153	L	92.9	Very high	94.2	Very high	48 Å²	48	31.5 Å²	31.5	25%	0.251	15%	0.149	S	C	.	.	H	α-helix	trans	-58.6	-37.1	177.9	-73.2	174.1	0	0	0	111.7	H100 E149 I156 E157	H100-L153 HydrophobicContact CB-CB 4.41Å; E149-L153 HydrophobicContact CG-CD1 3.96Å; E149-L153 HydrophobicContact CG-CG 4.33Å; E149-L153 WeakPolarHBondContact O-CB 3.26Å; E149-L153 VanDerWaalsContact O-CG 3.25Å; E149-L153 WeakPolarHBondContact O-CG 3.43Å; E149-L153 PolarHBondContact O-N 3.45Å; L153-I156 HydrophobicContact CD2-CD1 4.34Å; L153-I156 WeakPolarHBondContact O-CB 3.01Å; L153-I156 PolarHBondContact O-N 2.81Å; L153-E157 PolarHBondContact O-N 2.94Å
154	K	89.9	Confident	94.3	Very high	26 Å²	26	35.3 Å²	35.3	11%	0.113	17%	0.167	C	C	.	.	H	α-helix	trans	-66.8	-39.5	176.3	-170.2	54.5	162.1	-169.8	0	113	L110 E150 L151 R152 I156 E157 Y158 I218	L110-K154 HydrophobicContact CB-CG 4.34Å; L110-K154 HydrophobicContact CD1-CB 4.45Å; L110-K154 HydrophobicContact CD1-CD 3.83Å; L110-K154 HydrophobicContact CD1-CG 4.03Å; L110-K154 HydrophobicContact CD2-CB 4.19Å; L110-K154 HydrophobicContact CD2-CG 4.08Å; L110-K154 HydrophobicContact CG-CG 4.37Å; E150-K154 PolarHBondContact O-N 3.21Å; L151-K154 PolarHBondContact O-N 3.28Å; R152-K154 PolarHBondContact O-N 3.42Å; K154-I156 VanDerWaalsContact C-N 3.32Å; K154-E157 WeakPolarHBondContact CD-OE2 3.49Å; K154-E157 WeakPolarHBondContact CE-OE2 3.24Å; K154-E157 IonicContact NZ-OE2 3.75Å; K154-E157 PolarHBondContact NZ-OE2 3.16Å; K154-E157 PolarHBondContact O-N 2.93Å; K154-Y158 PolarHBondContact O-N 2.88Å; K154-Y158 VanDerWaalsContact O-N 3.14Å; K154-I218 HydrophobicContact CB-CD1 4.2Å; K154-I218 HydrophobicContact CG-CD1 3.88Å
155	D	95	Very high	94.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.3	-31.3	173.7	-82.2	-15.5	0	0	0	112	R114 L151 R152 Y158 V159 L192 F217 I218 T219	R114-D155 IonicContact NH2-OD1 2.7Å; R114-D155 PolarHBondContact NH2-OD1 2.94Å; L151-D155 PolarHBondContact O-N 2.75Å; R152-D155 PolarHBondContact O-N 2.67Å; R152-D155 VanDerWaalsContact O-N 3.12Å; D155-Y158 PolarHBondContact O-N 3.28Å; D155-V159 WeakPolarHBondContact O-CB 3.04Å; D155-V159 VanDerWaalsContact O-CG1 3.3Å; D155-V159 WeakPolarHBondContact O-CG1 3.47Å; D155-V159 PolarHBondContact O-N 2.84Å; D155-L192 HydrophobicContact CB-CD1 3.73Å; D155-F217 HydrophobicContact CB-CD1 4.17Å; D155-F217 WeakPolarHBondContact OD2-CB 3.49Å; D155-I218 VanDerWaalsContact CG-N 3.34Å; D155-I218 PolarHBondContact OD1-N 3.24Å; D155-I218 PolarHBondContact OD2-N 3.11Å; D155-T219 HydrophobicContact CB-CG2 4.41Å; D155-T219 WeakPolarHBondContact OD2-CB 3.43Å; D155-T219 WeakPolarHBondContact OD2-CG2 3.39Å; D155-T219 PolarHBondContact OD2-N 3.32Å; D155-T219 PolarHBondContact OD2-OG1 2.81Å
156	I	96.3	Very high	94.2	Very high	26 Å²	26	38.1 Å²	38.1	13%	0.133	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-46.5	171.8	-70.6	168.7	0	0	0	111.2	R152 L153 K154 Y158 V159 T160 L192 I193	R152-I156 HydrophobicContact CG-CD1 4.28Å; R152-I156 WeakPolarHBondContact O-CG1 3.38Å; R152-I156 PolarHBondContact O-N 3.47Å; L153-I156 HydrophobicContact CD2-CD1 4.34Å; L153-I156 WeakPolarHBondContact O-CB 3.01Å; L153-I156 PolarHBondContact O-N 2.81Å; K154-I156 VanDerWaalsContact C-N 3.32Å; I156-Y158 VanDerWaalsContact C-N 3.3Å; I156-Y158 PolarHBondContact O-N 3.21Å; I156-V159 WeakPolarHBondContact O-CG1 3.4Å; I156-T160 VanDerWaalsContact O-CB 3.24Å; I156-T160 WeakPolarHBondContact O-CB 3.43Å; I156-T160 PolarHBondContact O-N 2.9Å; I156-T160 PolarHBondContact O-OG1 2.75Å; I156-L192 HydrophobicContact CD1-CB 4.25Å; I156-L192 HydrophobicContact CG1-CB 3.67Å; I156-L192 HydrophobicContact CG1-CD1 4.49Å; I156-I193 HydrophobicContact CB-CG1 4.47Å; I156-I193 HydrophobicContact CD1-CG1 3.92Å; I156-I193 HydrophobicContact CG1-CG1 3.87Å; I156-I193 HydrophobicContact CG2-CD1 4.03Å; I156-I193 HydrophobicContact CG2-CG1 3.81Å
157	E	93.6	Very high	94.4	Very high	69 Å²	69	39.8 Å²	39.8	32%	0.322	19%	0.185	S	C	.	.	H	α-helix	trans	-58.4	-45.9	177.3	-168.7	-151.6	148.7	0	0	110.8	L153 K154 K161	L153-E157 PolarHBondContact O-N 2.94Å; K154-E157 WeakPolarHBondContact CD-OE2 3.49Å; K154-E157 WeakPolarHBondContact CE-OE2 3.24Å; K154-E157 IonicContact NZ-OE2 3.75Å; K154-E157 PolarHBondContact NZ-OE2 3.16Å; K154-E157 PolarHBondContact O-N 2.93Å; E157-K161 WeakPolarHBondContact O-CG 3.33Å; E157-K161 PolarHBondContact O-N 2.93Å; E157-K161 IonicContact OE1-NZ 3.08Å; E157-K161 PolarHBondContact OE1-NZ 3.23Å
158	Y	94.1	Very high	94.6	Very high	60 Å²	60	44.7 Å²	44.7	24%	0.235	21%	0.206	C	C	.	.	H	α-helix	trans	-69.6	-50.7	-178.8	176.5	-105.6	0	0	0	112.7	K154 D155 I156 T160 K161 E162 H215 F217	K154-Y158 PolarHBondContact O-N 2.88Å; K154-Y158 VanDerWaalsContact O-N 3.14Å; D155-Y158 PolarHBondContact O-N 3.28Å; I156-Y158 VanDerWaalsContact C-N 3.3Å; I156-Y158 PolarHBondContact O-N 3.21Å; Y158-T160 VanDerWaalsContact C-N 3.25Å; Y158-T160 PolarHBondContact O-N 3.31Å; Y158-K161 PolarHBondContact O-N 2.84Å; Y158-E162 HydrophobicContact CD2-CG 4.38Å; Y158-E162 HydrophobicContact CE1-CG 4.17Å; Y158-E162 HydrophobicContact CE2-CG 3.9Å; Y158-E162 PolarHBondContact O-N 2.89Å; Y158-E162 VanDerWaalsContact O-N 3.08Å; Y158-H215 HydrophobicContact CE1-CB 4.03Å; Y158-H215 AromaticContact CE1-ND1 3.85Å; Y158-H215 AromaticContact CZ-ND1 3.96Å; Y158-H215 PolarHBondContact OH-ND1 3.39Å; Y158-F217 AromaticContact CD1-CD1 3.97Å; Y158-F217 HydrophobicContact CD1-CD1 3.97Å; Y158-F217 AromaticContact CD1-CE1 3.57Å; Y158-F217 HydrophobicContact CD1-CE1 3.57Å; Y158-F217 HydrophobicContact CD1-CZ 4.41Å; Y158-F217 HydrophobicContact CE1-CD1 4.33Å; Y158-F217 AromaticContact CE1-CE1 3.87Å; Y158-F217 HydrophobicContact CE1-CE1 3.87Å; Y158-F217 HydrophobicContact CE1-CZ 4.32Å
159	V	97.2	Very high	94.6	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-35.3	-179.1	76.2	0	0	0	0	110.9	D155 I156 K161 E162 W163 L185 V188 K189 L192 F217	D155-V159 WeakPolarHBondContact O-CB 3.04Å; D155-V159 VanDerWaalsContact O-CG1 3.3Å; D155-V159 WeakPolarHBondContact O-CG1 3.47Å; D155-V159 PolarHBondContact O-N 2.84Å; I156-V159 WeakPolarHBondContact O-CG1 3.4Å; V159-K161 PolarHBondContact O-N 3.09Å; V159-E162 PolarHBondContact O-N 3.42Å; V159-W163 WeakPolarHBondContact O-CA 3.4Å; V159-W163 WeakPolarHBondContact O-CB 3.23Å; V159-W163 PolarHBondContact O-N 2.83Å; V159-L185 HydrophobicContact CG2-CD2 4.01Å; V159-V188 HydrophobicContact CB-CG1 4.42Å; V159-V188 HydrophobicContact CG2-CB 4.13Å; V159-V188 HydrophobicContact CG2-CG1 3.8Å; V159-K189 HydrophobicContact CG1-CB 3.96Å; V159-K189 HydrophobicContact CG1-CG 4.15Å; V159-K189 HydrophobicContact CG2-CB 4.16Å; V159-L192 HydrophobicContact CG1-CD1 4.25Å; V159-F217 HydrophobicContact CB-CE1 3.8Å; V159-F217 HydrophobicContact CB-CZ 4.26Å; V159-F217 HydrophobicContact CG2-CE1 4.03Å; V159-F217 HydrophobicContact CG2-CZ 3.97Å
160	T	97.4	Very high	94.6	Very high	33 Å²	33	44 Å²	44	20%	0.202	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-44.9	178.5	-61.6	0	0	0	0	110.9	I156 Y158 E164	I156-T160 VanDerWaalsContact O-CB 3.24Å; I156-T160 WeakPolarHBondContact O-CB 3.43Å; I156-T160 PolarHBondContact O-N 2.9Å; I156-T160 PolarHBondContact O-OG1 2.75Å; Y158-T160 VanDerWaalsContact C-N 3.25Å; Y158-T160 PolarHBondContact O-N 3.31Å; T160-E164 WeakPolarHBondContact O-CB 3.44Å; T160-E164 VanDerWaalsContact O-CG 3.32Å; T160-E164 WeakPolarHBondContact O-CG 3.27Å; T160-E164 PolarHBondContact O-N 3.48Å
161	K	96.4	Very high	94.6	Very high	106 Å²	106	48 Å²	48	46%	0.461	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-45.2	177	-70.7	170.8	178.7	172.9	0	112.4	E157 Y158 V159 K165	E157-K161 WeakPolarHBondContact O-CG 3.33Å; E157-K161 PolarHBondContact O-N 2.93Å; E157-K161 IonicContact OE1-NZ 3.08Å; E157-K161 PolarHBondContact OE1-NZ 3.23Å; Y158-K161 PolarHBondContact O-N 2.84Å; V159-K161 PolarHBondContact O-N 3.09Å; K161-K165 WeakPolarHBondContact O-CG 3.35Å; K161-K165 PolarHBondContact O-N 3.49Å
162	E	96.6	Very high	94.4	Very high	45 Å²	45	56.9 Å²	56.9	21%	0.21	26%	0.261	C	S	.	.	H	α-helix	trans	-70.5	-38.8	179.6	-66	-49.2	124	0	0	112.1	Y158 V159 K165 C166 L185	Y158-E162 HydrophobicContact CD2-CG 4.38Å; Y158-E162 HydrophobicContact CE1-CG 4.17Å; Y158-E162 HydrophobicContact CE2-CG 3.9Å; Y158-E162 PolarHBondContact O-N 2.89Å; Y158-E162 VanDerWaalsContact O-N 3.08Å; V159-E162 PolarHBondContact O-N 3.42Å; E162-K165 PolarHBondContact O-N 3.41Å; E162-K165 IonicContact OE1-NZ 3.72Å; E162-K165 PolarHBondContact OE1-NZ 2.65Å; E162-K165 IonicContact OE2-NZ 2.75Å; E162-C166 WeakPolarHBondContact O-CB 3.34Å; E162-C166 PolarHBondContact O-N 2.91Å; E162-L185 HydrophobicContact CB-CD1 4.41Å
163	W	96.9	Very high	94.2	Very high	33 Å²	33	59 Å²	59	13%	0.125	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-44.5	174.9	178.3	86	0	0	0	111.9	V159 K165 C166 E167 Y182 L185 T186 K189	V159-W163 WeakPolarHBondContact O-CA 3.4Å; V159-W163 WeakPolarHBondContact O-CB 3.23Å; V159-W163 PolarHBondContact O-N 2.83Å; W163-K165 VanDerWaalsContact C-N 3.33Å; W163-K165 PolarHBondContact O-N 2.82Å; W163-C166 PolarHBondContact O-N 2.85Å; W163-E167 HydrophobicContact CH2-CG 4.31Å; W163-E167 VanDerWaalsContact CH2-OE1 3.25Å; W163-E167 WeakPolarHBondContact CH2-OE1 3.35Å; W163-E167 HydrophobicContact CZ2-CG 4.39Å; W163-E167 WeakPolarHBondContact O-CB 3.42Å; W163-E167 PolarHBondContact O-N 3.4Å; W163-Y182 AromaticContact CE2-CE2 3.66Å; W163-Y182 AromaticContact CZ2-CE2 3.89Å; W163-Y182 HydrophobicContact CZ2-CE2 3.89Å; W163-Y182 AromaticContact NE1-CD2 3.89Å; W163-Y182 AromaticContact NE1-CE2 3.3Å; W163-Y182 VanDerWaalsContact NE1-CE2 3.3Å; W163-Y182 AromaticContact NE1-CZ 3.95Å; W163-L185 HydrophobicContact CB-CB 4.38Å; W163-T186 PolarHBondContact NE1-OG1 3.04Å; W163-K189 HydrophobicContact CB-CD 4.38Å; W163-K189 HydrophobicContact CD2-CD 3.95Å; W163-K189 HydrophobicContact CE3-CD 4.24Å; W163-K189 HydrophobicContact CG-CD 4.01Å; W163-K189 VanDerWaalsContact CZ3-NZ 3.31Å
164	E	96.7	Very high	94.1	Very high	84 Å²	84	62.4 Å²	62.4	39%	0.393	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-37	177.7	-78.3	177.7	-172.2	0	0	113	T160 K168	T160-E164 WeakPolarHBondContact O-CB 3.44Å; T160-E164 VanDerWaalsContact O-CG 3.32Å; T160-E164 WeakPolarHBondContact O-CG 3.27Å; T160-E164 PolarHBondContact O-N 3.48Å; E164-K168 WeakPolarHBondContact O-CD 3.32Å; E164-K168 VanDerWaalsContact O-CG 3.28Å; E164-K168 WeakPolarHBondContact O-CG 3.32Å; E164-K168 PolarHBondContact O-N 2.9Å
165	K	95.7	Very high	94.2	Very high	116 Å²	116	64 Å²	64	50%	0.504	31%	0.314	S	S	.	.	H	α-helix	trans	-64.8	-46.9	173.4	-68.2	169.9	-171.9	169.1	0	110.2	K161 E162 W163 K168 V169	K161-K165 WeakPolarHBondContact O-CG 3.35Å; K161-K165 PolarHBondContact O-N 3.49Å; E162-K165 PolarHBondContact O-N 3.41Å; E162-K165 IonicContact OE1-NZ 3.72Å; E162-K165 PolarHBondContact OE1-NZ 2.65Å; E162-K165 IonicContact OE2-NZ 2.75Å; W163-K165 VanDerWaalsContact C-N 3.33Å; W163-K165 PolarHBondContact O-N 2.82Å; K165-K168 PolarHBondContact O-N 3.34Å; K165-V169 WeakPolarHBondContact O-CG2 3.38Å; K165-V169 PolarHBondContact O-N 3.41Å
166	C	94.2	Very high	94.1	Very high	16 Å²	16	71.4 Å²	71.4	11%	0.108	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-44.1	-179.7	-161.6	0	0	0	0	111.8	E162 W163 K168 V169 V170 Y182 L185	E162-C166 WeakPolarHBondContact O-CB 3.34Å; E162-C166 PolarHBondContact O-N 2.91Å; W163-C166 PolarHBondContact O-N 2.85Å; C166-K168 PolarHBondContact O-N 3.37Å; C166-V169 PolarHBondContact O-N 3.14Å; C166-V170 WeakPolarHBondContact O-CB 3.29Å; C166-V170 WeakPolarHBondContact O-CG2 3.39Å; C166-V170 PolarHBondContact O-N 3.38Å; C166-Y182 VanDerWaalsContact SG-CA 3.59Å; C166-Y182 PolarHBondContact SG-N 3.04Å; C166-L185 HydrophobicContact CB-CD1 4.08Å
167	E	95.7	Very high	93.9	Very high	53 Å²	53	78.9 Å²	78.9	25%	0.248	38%	0.378	C	S	.	.	H	α-helix	trans	-58.3	-46	177.5	-171	-168.7	-145	0	0	111.7	W163 V169 V170 I171 Y182	W163-E167 HydrophobicContact CH2-CG 4.31Å; W163-E167 VanDerWaalsContact CH2-OE1 3.25Å; W163-E167 WeakPolarHBondContact CH2-OE1 3.35Å; W163-E167 HydrophobicContact CZ2-CG 4.39Å; W163-E167 WeakPolarHBondContact O-CB 3.42Å; W163-E167 PolarHBondContact O-N 3.4Å; E167-V169 VanDerWaalsContact C-N 3.3Å; E167-V169 PolarHBondContact O-N 3.46Å; E167-V170 PolarHBondContact O-N 2.99Å; E167-I171 HydrophobicContact CG-CB 4.42Å; E167-I171 HydrophobicContact CG-CG1 3.9Å; E167-I171 VanDerWaalsContact O-CB 3.28Å; E167-I171 WeakPolarHBondContact O-CB 3.5Å; E167-I171 PolarHBondContact O-N 3Å; E167-Y182 HydrophobicContact CB-CD2 4.14Å; E167-Y182 HydrophobicContact CB-CE2 3.62Å; E167-Y182 HydrophobicContact CG-CE2 3.75Å
168	K	94.9	Very high	93.9	Very high	104 Å²	104	80 Å²	80	45%	0.452	38%	0.383	S	S	.	.	I	π-helix	trans	-59.5	-42.3	177.8	-73.3	168.5	-171.5	168.4	0	111.5	E164 K165 C166 R172 G173	E164-K168 WeakPolarHBondContact O-CD 3.32Å; E164-K168 VanDerWaalsContact O-CG 3.28Å; E164-K168 WeakPolarHBondContact O-CG 3.32Å; E164-K168 PolarHBondContact O-N 2.9Å; K165-K168 PolarHBondContact O-N 3.34Å; C166-K168 PolarHBondContact O-N 3.37Å; K168-R172 VanDerWaalsContact O-CB 3.27Å; K168-R172 WeakPolarHBondContact O-CB 3.48Å; K168-R172 PolarHBondContact O-N 2.73Å; K168-G173 PolarHBondContact O-N 2.89Å; K168-G173 VanDerWaalsContact O-N 3.1Å
169	V	93.6	Very high	93.9	Very high	72 Å²	72	79.9 Å²	79.9	44%	0.436	39%	0.385	S	S	.	.	I	π-helix	trans	-70.6	-47.3	-179.7	173.8	0	0	0	0	111.4	K165 C166 E167 G173 D175 Q178	K165-V169 WeakPolarHBondContact O-CG2 3.38Å; K165-V169 PolarHBondContact O-N 3.41Å; C166-V169 PolarHBondContact O-N 3.14Å; E167-V169 VanDerWaalsContact C-N 3.3Å; E167-V169 PolarHBondContact O-N 3.46Å; V169-G173 CarbonylContact O-C 3.55Å; V169-G173 WeakPolarHBondContact O-CA 3.09Å; V169-G173 PolarHBondContact O-N 3.25Å; V169-D175 HydrophobicContact CG1-CB 4.17Å; V169-D175 PolarHBondContact O-N 3.42Å; V169-Q178 HydrophobicContact CG1-CG 4.41Å
170	V	93.1	Very high	93.8	Very high	4 Å²	4	82.7 Å²	82.7	2%	0.024	40%	0.404	C	S	.	.	I	π-helix	trans	-75.1	-51	-174.6	174.3	0	0	0	0	112	C166 E167 N174 D175 Q178 M179 Y182	C166-V170 WeakPolarHBondContact O-CB 3.29Å; C166-V170 WeakPolarHBondContact O-CG2 3.39Å; C166-V170 PolarHBondContact O-N 3.38Å; E167-V170 PolarHBondContact O-N 2.99Å; V170-N174 VanDerWaalsContact O-CA 3.22Å; V170-N174 WeakPolarHBondContact O-CA 3.34Å; V170-N174 PolarHBondContact O-N 2.79Å; V170-D175 PolarHBondContact O-N 2.73Å; V170-Q178 HydrophobicContact CG2-CB 3.44Å; V170-Q178 VanDerWaalsContact CG2-CB 3.44Å; V170-M179 HydrophobicContact CG1-CB 4.41Å; V170-M179 HydrophobicContact CG1-CE 3.43Å; V170-M179 VanDerWaalsContact CG1-CE 3.43Å; V170-M179 HydrophobicContact CG1-SD 3.61Å; V170-Y182 HydrophobicContact CB-CG 4.47Å; V170-Y182 HydrophobicContact CG1-CD1 4.4Å; V170-Y182 HydrophobicContact CG1-CG 4.42Å
171	I	90.2	Very high	93.8	Very high	95 Å²	95	81.9 Å²	81.9	49%	0.487	40%	0.401	S	S	.	.	I	π-helix	trans	-83.1	-49.8	-172	-54.5	-60.6	0	0	0	110.9	E167 Y182	E167-I171 HydrophobicContact CG-CB 4.42Å; E167-I171 HydrophobicContact CG-CG1 3.9Å; E167-I171 VanDerWaalsContact O-CB 3.28Å; E167-I171 WeakPolarHBondContact O-CB 3.5Å; E167-I171 PolarHBondContact O-N 3Å; I171-Y182 HydrophobicContact CD1-CE1 4.08Å; I171-Y182 HydrophobicContact CG1-CE1 4.45Å
172	R	87	Confident	93.8	Very high	194 Å²	194	78.7 Å²	78.7	73%	0.732	39%	0.386	S	S	*	.	I	π-helix	trans	-81.7	-37.5	-177.6	-50.4	-179.3	-177.8	-174.4	-1.1	112.1	K168	K168-R172 VanDerWaalsContact O-CB 3.27Å; K168-R172 WeakPolarHBondContact O-CB 3.48Å; K168-R172 PolarHBondContact O-N 2.73Å
173	G	90.7	Very high	93.8	Very high	55 Å²	55	82.1 Å²	82.1	57%	0.567	40%	0.402	S	S	*	.	S	Bend	trans	-81.4	-10.5	176.6	0	0	0	0	0	114.7	K168 V169 D175	K168-G173 PolarHBondContact O-N 2.89Å; K168-G173 VanDerWaalsContact O-N 3.1Å; V169-G173 CarbonylContact O-C 3.55Å; V169-G173 WeakPolarHBondContact O-CA 3.09Å; V169-G173 PolarHBondContact O-N 3.25Å; G173-D175 PolarHBondContact O-N 2.97Å
174	N	91.4	Very high	93.9	Very high	119 Å²	119	80.6 Å²	80.6	64%	0.636	40%	0.396	S	S	*	.			trans	55.5	30.3	-176.3	-165.9	31.8	0	0	0	113.7	V170 K176	V170-N174 VanDerWaalsContact O-CA 3.22Å; V170-N174 WeakPolarHBondContact O-CA 3.34Å; V170-N174 PolarHBondContact O-N 2.79Å; N174-K176 PolarHBondContact O-N 3.45Å; N174-K176 VanDerWaalsContact O-N 3.16Å
175	D	92.4	Very high	93.9	Very high	60 Å²	60	76.8 Å²	76.8	32%	0.321	38%	0.379	S	S	.	.			trans	-82.3	91.7	175.1	-171.1	-2.5	0	0	0	111.1	V169 V170 G173 K177 Q178	V169-D175 HydrophobicContact CG1-CB 4.17Å; V169-D175 PolarHBondContact O-N 3.42Å; V170-D175 PolarHBondContact O-N 2.73Å; G173-D175 PolarHBondContact O-N 2.97Å; D175-K177 PolarHBondContact O-N 2.77Å; D175-K177 VanDerWaalsContact OD1-CB 3.29Å; D175-K177 WeakPolarHBondContact OD1-CB 3.27Å; D175-K177 PolarHBondContact OD1-N 3.43Å; D175-Q178 PolarHBondContact O-N 3.3Å
176	K	91.6	Very high	94	Very high	156 Å²	156	73 Å²	73	68%	0.678	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-63.8	-17	178.2	-65.4	-174.3	177.7	-176.7	0	113.9	N174 Q178 M179	N174-K176 PolarHBondContact O-N 3.45Å; N174-K176 VanDerWaalsContact O-N 3.16Å; K176-Q178 VanDerWaalsContact C-N 3.27Å; K176-Q178 PolarHBondContact O-N 2.62Å; K176-M179 WeakPolarHBondContact O-CB 3.4Å; K176-M179 PolarHBondContact O-N 2.68Å
177	K	93.1	Very high	94.2	Very high	183 Å²	183	76 Å²	76	80%	0.796	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-69.1	-29.6	179.2	-64.3	179.1	178.4	176.2	0	112.1	D175 P180	D175-K177 PolarHBondContact O-N 2.77Å; D175-K177 VanDerWaalsContact OD1-CB 3.29Å; D175-K177 WeakPolarHBondContact OD1-CB 3.27Å; D175-K177 PolarHBondContact OD1-N 3.43Å; K177-P180 WeakPolarHBondContact O-CD 3.21Å
178	Q	93	Very high	94.4	Very high	91 Å²	91	73.4 Å²	73.4	43%	0.425	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-90.2	-0.2	-179.3	-63.8	-62.4	-21.3	0	0	113.1	V169 V170 D175 K176 P180 A181 Y182	V169-Q178 HydrophobicContact CG1-CG 4.41Å; V170-Q178 HydrophobicContact CG2-CB 3.44Å; V170-Q178 VanDerWaalsContact CG2-CB 3.44Å; D175-Q178 PolarHBondContact O-N 3.3Å; K176-Q178 VanDerWaalsContact C-N 3.27Å; K176-Q178 PolarHBondContact O-N 2.62Å; Q178-P180 VanDerWaalsContact C-CD 3.49Å; Q178-A181 PolarHBondContact O-N 2.87Å; Q178-A181 VanDerWaalsContact O-N 3.14Å; Q178-Y182 PolarHBondContact O-N 3.24Å; Q178-Y182 VanDerWaalsContact O-N 3.1Å
179	M	94.7	Very high	94.5	Very high	58 Å²	58	70.2 Å²	70.2	29%	0.286	35%	0.35	S	S	.	.	H	α-helix	trans	-54.7	-43.5	179.6	-170.5	65.3	74	0	0	113.4	V170 K176 A181 Y182 E183	V170-M179 HydrophobicContact CG1-CB 4.41Å; V170-M179 HydrophobicContact CG1-CE 3.43Å; V170-M179 VanDerWaalsContact CG1-CE 3.43Å; V170-M179 HydrophobicContact CG1-SD 3.61Å; K176-M179 WeakPolarHBondContact O-CB 3.4Å; K176-M179 PolarHBondContact O-N 2.68Å; M179-A181 VanDerWaalsContact C-N 3.3Å; M179-A181 PolarHBondContact O-N 3.02Å; M179-Y182 PolarHBondContact O-N 2.92Å; M179-Y182 VanDerWaalsContact O-N 3.17Å; M179-Y182 HydrophobicContact SD-CD1 3.97Å; M179-E183 HydrophobicContact CG-CG 4.25Å; M179-E183 WeakPolarHBondContact O-CG 3.11Å; M179-E183 PolarHBondContact O-N 2.77Å; M179-E183 HydrophobicContact SD-CG 4.35Å
180	P	95.5	Very high	94.7	Very high	59 Å²	59	70.4 Å²	70.4	38%	0.383	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-37.4	178.1	-24.8	36	0	0	0	113.5	K177 Q178 C184 I211	K177-P180 WeakPolarHBondContact O-CD 3.21Å; Q178-P180 VanDerWaalsContact C-CD 3.49Å; P180-C184 VanDerWaalsContact O-CB 3.27Å; P180-C184 WeakPolarHBondContact O-CB 3.26Å; P180-C184 PolarHBondContact O-N 2.81Å; P180-I211 HydrophobicContact CB-CD1 4.31Å
181	A	96.2	Very high	94.9	Very high	17 Å²	17	70.7 Å²	70.7	14%	0.14	35%	0.35	C	S	.	.	H	α-helix	trans	-67.3	-43.4	176.1	0	0	0	0	0	111.3	Q178 M179 C184 L185 I211	Q178-A181 PolarHBondContact O-N 2.87Å; Q178-A181 VanDerWaalsContact O-N 3.14Å; M179-A181 VanDerWaalsContact C-N 3.3Å; M179-A181 PolarHBondContact O-N 3.02Å; A181-C184 PolarHBondContact O-N 3.2Å; A181-L185 WeakPolarHBondContact O-CB 3.17Å; A181-L185 WeakPolarHBondContact O-CG 3.24Å; A181-L185 PolarHBondContact O-N 3.12Å; A181-I211 HydrophobicContact CB-CG2 4.45Å
182	Y	96.8	Very high	95.3	Very high	38 Å²	38	66.2 Å²	66.2	15%	0.149	33%	0.327	C	S	.	.	H	α-helix	trans	-61.7	-45.5	176.4	173.8	-107	0	0	0	112.4	W163 C166 E167 V170 I171 Q178 M179 L185 T186	W163-Y182 AromaticContact CE2-CE2 3.66Å; W163-Y182 AromaticContact CZ2-CE2 3.89Å; W163-Y182 HydrophobicContact CZ2-CE2 3.89Å; W163-Y182 AromaticContact NE1-CD2 3.89Å; W163-Y182 AromaticContact NE1-CE2 3.3Å; W163-Y182 VanDerWaalsContact NE1-CE2 3.3Å; W163-Y182 AromaticContact NE1-CZ 3.95Å; C166-Y182 VanDerWaalsContact SG-CA 3.59Å; C166-Y182 PolarHBondContact SG-N 3.04Å; E167-Y182 HydrophobicContact CB-CD2 4.14Å; E167-Y182 HydrophobicContact CB-CE2 3.62Å; E167-Y182 HydrophobicContact CG-CE2 3.75Å; V170-Y182 HydrophobicContact CB-CG 4.47Å; V170-Y182 HydrophobicContact CG1-CD1 4.4Å; V170-Y182 HydrophobicContact CG1-CG 4.42Å; I171-Y182 HydrophobicContact CD1-CE1 4.08Å; I171-Y182 HydrophobicContact CG1-CE1 4.45Å; Q178-Y182 PolarHBondContact O-N 3.24Å; Q178-Y182 VanDerWaalsContact O-N 3.1Å; M179-Y182 PolarHBondContact O-N 2.92Å; M179-Y182 VanDerWaalsContact O-N 3.17Å; M179-Y182 HydrophobicContact SD-CD1 3.97Å; Y182-L185 PolarHBondContact O-N 2.76Å; Y182-T186 VanDerWaalsContact O-CB 3.31Å; Y182-T186 WeakPolarHBondContact O-CB 3.36Å; Y182-T186 PolarHBondContact O-N 3.24Å; Y182-T186 PolarHBondContact O-OG1 2.92Å
183	E	97	Very high	95.8	Very high	118 Å²	118	60 Å²	60	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-62.8	-44.7	177.2	-71.6	175.2	168	0	0	111.5	M179 T186 K187	M179-E183 HydrophobicContact CG-CG 4.25Å; M179-E183 WeakPolarHBondContact O-CG 3.11Å; M179-E183 PolarHBondContact O-N 2.77Å; M179-E183 HydrophobicContact SD-CG 4.35Å; E183-T186 PolarHBondContact O-N 2.96Å; E183-K187 WeakPolarHBondContact O-CB 3.41Å; E183-K187 PolarHBondContact O-N 3.19Å
184	C	97.8	Very high	96.1	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.007	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-49.8	176.3	-175.1	0	0	0	0	111.6	P180 A181 T186 K187 V188 E208 I211	P180-C184 VanDerWaalsContact O-CB 3.27Å; P180-C184 WeakPolarHBondContact O-CB 3.26Å; P180-C184 PolarHBondContact O-N 2.81Å; A181-C184 PolarHBondContact O-N 3.2Å; C184-T186 VanDerWaalsContact C-N 3.32Å; C184-T186 PolarHBondContact O-N 2.8Å; C184-K187 WeakPolarHBondContact O-CB 3.24Å; C184-K187 PolarHBondContact O-N 2.9Å; C184-K187 VanDerWaalsContact O-N 3.17Å; C184-V188 WeakPolarHBondContact O-CG2 3.45Å; C184-V188 PolarHBondContact O-N 2.85Å; C184-E208 HydrophobicContact CB-CG 4.3Å; C184-I211 HydrophobicContact CB-CD1 4.14Å; C184-I211 HydrophobicContact CB-CG2 4.2Å
185	L	98.2	Very high	96.3	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-34.5	178.1	-71.8	175.4	0	0	0	112.7	V159 E162 W163 C166 A181 Y182 K187 V188 K189 F217	V159-L185 HydrophobicContact CG2-CD2 4.01Å; E162-L185 HydrophobicContact CB-CD1 4.41Å; W163-L185 HydrophobicContact CB-CB 4.38Å; C166-L185 HydrophobicContact CB-CD1 4.08Å; A181-L185 WeakPolarHBondContact O-CB 3.17Å; A181-L185 WeakPolarHBondContact O-CG 3.24Å; A181-L185 PolarHBondContact O-N 3.12Å; Y182-L185 PolarHBondContact O-N 2.76Å; L185-K187 VanDerWaalsContact C-N 3.34Å; L185-V188 PolarHBondContact O-N 3.41Å; L185-K189 VanDerWaalsContact O-CB 3.25Å; L185-K189 WeakPolarHBondContact O-CB 3.32Å; L185-K189 PolarHBondContact O-N 2.83Å; L185-F217 HydrophobicContact CD2-CZ 3.97Å
186	T	97.8	Very high	96.4	Very high	35 Å²	35	66 Å²	66	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-44.7	173.4	-58.4	0	0	0	0	110.4	W163 Y182 E183 C184 K189 N190	W163-T186 PolarHBondContact NE1-OG1 3.04Å; Y182-T186 VanDerWaalsContact O-CB 3.31Å; Y182-T186 WeakPolarHBondContact O-CB 3.36Å; Y182-T186 PolarHBondContact O-N 3.24Å; Y182-T186 PolarHBondContact O-OG1 2.92Å; E183-T186 PolarHBondContact O-N 2.96Å; C184-T186 VanDerWaalsContact C-N 3.32Å; C184-T186 PolarHBondContact O-N 2.8Å; T186-K189 PolarHBondContact O-N 3.46Å; T186-N190 WeakPolarHBondContact O-CB 3.33Å; T186-N190 PolarHBondContact O-N 2.83Å; T186-N190 PolarHBondContact O-ND2 3.11Å
187	K	98.2	Very high	96.6	Very high	79 Å²	79	63.9 Å²	63.9	34%	0.343	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-46.1	176.8	-178.3	173.3	160.3	-169	0	111.8	E183 C184 L185 N190 M191 D203 W204 E208	E183-K187 WeakPolarHBondContact O-CB 3.41Å; E183-K187 PolarHBondContact O-N 3.19Å; C184-K187 WeakPolarHBondContact O-CB 3.24Å; C184-K187 PolarHBondContact O-N 2.9Å; C184-K187 VanDerWaalsContact O-N 3.17Å; L185-K187 VanDerWaalsContact C-N 3.34Å; K187-N190 PolarHBondContact O-N 3.47Å; K187-M191 VanDerWaalsContact O-CB 3.29Å; K187-M191 WeakPolarHBondContact O-CB 3.16Å; K187-M191 PolarHBondContact O-N 3.12Å; K187-D203 PolarHBondContact NZ-O 3.42Å; K187-W204 HydrophobicContact CB-CZ3 4.18Å; K187-W204 HydrophobicContact CD-CE3 4.19Å; K187-W204 HydrophobicContact CD-CH2 4.21Å; K187-W204 HydrophobicContact CD-CZ3 3.5Å; K187-W204 HydrophobicContact CG-CH2 3.9Å; K187-W204 HydrophobicContact CG-CZ3 3.66Å; K187-E208 WeakPolarHBondContact CD-OE1 3.12Å; K187-E208 IonicContact NZ-OE1 3.17Å; K187-E208 PolarHBondContact NZ-OE1 2.78Å; K187-E208 IonicContact NZ-OE2 2.82Å; K187-E208 PolarHBondContact NZ-OE2 3Å
188	V	98.4	Very high	96.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.7	-49	174.8	174	0	0	0	0	111.4	V159 C184 L185 N190 M191 L192 V199 W204 L212 F217	V159-V188 HydrophobicContact CB-CG1 4.42Å; V159-V188 HydrophobicContact CG2-CB 4.13Å; V159-V188 HydrophobicContact CG2-CG1 3.8Å; C184-V188 WeakPolarHBondContact O-CG2 3.45Å; C184-V188 PolarHBondContact O-N 2.85Å; L185-V188 PolarHBondContact O-N 3.41Å; V188-N190 PolarHBondContact O-N 2.81Å; V188-M191 PolarHBondContact O-N 3.25Å; V188-L192 HydrophobicContact CG1-CD1 3.71Å; V188-L192 HydrophobicContact CG1-CG 4.31Å; V188-L192 WeakPolarHBondContact O-CB 3.01Å; V188-L192 WeakPolarHBondContact O-CG 3.48Å; V188-L192 PolarHBondContact O-N 3.49Å; V188-V199 HydrophobicContact CG1-CG2 3.8Å; V188-W204 HydrophobicContact CB-CH2 4.47Å; V188-W204 HydrophobicContact CG2-CH2 3.54Å; V188-W204 HydrophobicContact CG2-CZ2 4.14Å; V188-W204 HydrophobicContact CG2-CZ3 4.11Å; V188-L212 HydrophobicContact CG2-CD2 3.44Å; V188-L212 VanDerWaalsContact CG2-CD2 3.44Å; V188-F217 HydrophobicContact CG1-CE1 4.12Å; V188-F217 HydrophobicContact CG1-CE2 4.11Å; V188-F217 HydrophobicContact CG1-CZ 3.9Å; V188-F217 HydrophobicContact CG2-CE2 4.36Å
189	K	98.3	Very high	96.9	Very high	37 Å²	37	51.1 Å²	51.1	16%	0.161	25%	0.251	C	S	.	.	H	α-helix	trans	-58.5	-47.1	179.6	-177.5	-179.4	176.4	-171	0	111.6	V159 W163 L185 T186 L192 I193	V159-K189 HydrophobicContact CG1-CB 3.96Å; V159-K189 HydrophobicContact CG1-CG 4.15Å; V159-K189 HydrophobicContact CG2-CB 4.16Å; W163-K189 HydrophobicContact CB-CD 4.38Å; W163-K189 HydrophobicContact CD2-CD 3.95Å; W163-K189 HydrophobicContact CE3-CD 4.24Å; W163-K189 HydrophobicContact CG-CD 4.01Å; W163-K189 VanDerWaalsContact CZ3-NZ 3.31Å; L185-K189 VanDerWaalsContact O-CB 3.25Å; L185-K189 WeakPolarHBondContact O-CB 3.32Å; L185-K189 PolarHBondContact O-N 2.83Å; T186-K189 PolarHBondContact O-N 3.46Å; K189-L192 PolarHBondContact O-N 2.67Å; K189-I193 HydrophobicContact CD-CD1 4.44Å; K189-I193 HydrophobicContact CG-CD1 3.62Å; K189-I193 HydrophobicContact CG-CG1 4.46Å; K189-I193 WeakPolarHBondContact O-CB 3.33Å; K189-I193 VanDerWaalsContact O-CG1 3.27Å; K189-I193 WeakPolarHBondContact O-CG1 3.43Å; K189-I193 PolarHBondContact O-N 3.47Å
190	N	97.9	Very high	96.9	Very high	75 Å²	75	50.1 Å²	50.1	40%	0.401	25%	0.245	S	C	.	.	H	α-helix	trans	-63.6	-44.4	177.7	-74.5	-21.2	0	0	0	112.2	T186 K187 V188 L192 I193 N194 D195	T186-N190 WeakPolarHBondContact O-CB 3.33Å; T186-N190 PolarHBondContact O-N 2.83Å; T186-N190 PolarHBondContact O-ND2 3.11Å; K187-N190 PolarHBondContact O-N 3.47Å; V188-N190 PolarHBondContact O-N 2.81Å; N190-L192 PolarHBondContact O-N 2.9Å; N190-I193 PolarHBondContact O-N 3.02Å; N190-N194 WeakPolarHBondContact O-CA 3.21Å; N190-N194 WeakPolarHBondContact O-CB 3.48Å; N190-N194 PolarHBondContact O-N 3.34Å; N190-D195 PolarHBondContact O-N 2.88Å
191	M	97.6	Very high	96.8	Very high	11 Å²	11	49.1 Å²	49.1	5%	0.054	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-43.6	178.5	-177	-175.8	176.5	0	0	112	K187 V188 D195 K196 R197 N198 F201 W204	K187-M191 VanDerWaalsContact O-CB 3.29Å; K187-M191 WeakPolarHBondContact O-CB 3.16Å; K187-M191 PolarHBondContact O-N 3.12Å; V188-M191 PolarHBondContact O-N 3.25Å; M191-D195 CarbonylContact O-C 3.55Å; M191-D195 WeakPolarHBondContact O-CB 3.39Å; M191-D195 PolarHBondContact O-N 2.91Å; M191-K196 PolarHBondContact O-N 2.91Å; M191-R197 HydrophobicContact CE-CB 3.84Å; M191-R197 HydrophobicContact CE-CG 3.57Å; M191-R197 HydrophobicContact CG-CB 4.06Å; M191-R197 PolarHBondContact O-N 3.16Å; M191-R197 VanDerWaalsContact O-N 3.1Å; M191-N198 WeakPolarHBondContact CE-O 3.17Å; M191-F201 HydrophobicContact CE-CB 4.37Å; M191-W204 HydrophobicContact SD-CH2 4.26Å; M191-W204 HydrophobicContact SD-CZ2 3.78Å
192	L	97.9	Very high	96.7	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-70.7	-45.3	179	-71.1	172	0	0	0	111.9	R152 D155 I156 V159 V188 K189 N190 V199 T219	R152-L192 HydrophobicContact CG-CD2 3.98Å; R152-L192 PolarHBondContact NH1-O 3.43Å; D155-L192 HydrophobicContact CB-CD1 3.73Å; I156-L192 HydrophobicContact CD1-CB 4.25Å; I156-L192 HydrophobicContact CG1-CB 3.67Å; I156-L192 HydrophobicContact CG1-CD1 4.49Å; V159-L192 HydrophobicContact CG1-CD1 4.25Å; V188-L192 HydrophobicContact CG1-CD1 3.71Å; V188-L192 HydrophobicContact CG1-CG 4.31Å; V188-L192 WeakPolarHBondContact O-CB 3.01Å; V188-L192 WeakPolarHBondContact O-CG 3.48Å; V188-L192 PolarHBondContact O-N 3.49Å; K189-L192 PolarHBondContact O-N 2.67Å; N190-L192 PolarHBondContact O-N 2.9Å; L192-V199 HydrophobicContact CD1-CG2 4.25Å; L192-V199 HydrophobicContact CD2-CG2 4.17Å; L192-V199 HydrophobicContact CG-CG2 4.28Å; L192-T219 HydrophobicContact CD2-CG2 4.3Å
193	I	97.7	Very high	96.6	Very high	64 Å²	64	53.7 Å²	53.7	33%	0.328	26%	0.262	S	S	.	.	H	α-helix	trans	-78.1	-53.2	-174	-64.3	175.4	0	0	0	111.9	I156 K189 N190	I156-I193 HydrophobicContact CB-CG1 4.47Å; I156-I193 HydrophobicContact CD1-CG1 3.92Å; I156-I193 HydrophobicContact CG1-CG1 3.87Å; I156-I193 HydrophobicContact CG2-CD1 4.03Å; I156-I193 HydrophobicContact CG2-CG1 3.81Å; K189-I193 HydrophobicContact CD-CD1 4.44Å; K189-I193 HydrophobicContact CG-CD1 3.62Å; K189-I193 HydrophobicContact CG-CG1 4.46Å; K189-I193 WeakPolarHBondContact O-CB 3.33Å; K189-I193 VanDerWaalsContact O-CG1 3.27Å; K189-I193 WeakPolarHBondContact O-CG1 3.43Å; K189-I193 PolarHBondContact O-N 3.47Å; N190-I193 PolarHBondContact O-N 3.02Å
194	N	96.8	Very high	96.5	Very high	110 Å²	110	49.8 Å²	49.8	59%	0.588	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-47.3	-168.6	-56.4	-38.4	0	0	0	111.4	N190 K196	N190-N194 WeakPolarHBondContact O-CA 3.21Å; N190-N194 WeakPolarHBondContact O-CB 3.48Å; N190-N194 PolarHBondContact O-N 3.34Å; N194-K196 VanDerWaalsContact C-N 3.27Å; N194-K196 PolarHBondContact O-N 3.47Å
195	D	95.1	Very high	96.4	Very high	113 Å²	113	53.4 Å²	53.4	60%	0.604	26%	0.261	S	S	*	.	S	Bend	trans	-82.4	-10.7	-177.3	-50.5	-24.9	0	0	0	112.1	N190 M191 R197	N190-D195 PolarHBondContact O-N 2.88Å; M191-D195 CarbonylContact O-C 3.55Å; M191-D195 WeakPolarHBondContact O-CB 3.39Å; M191-D195 PolarHBondContact O-N 2.91Å; D195-R197 HydrophobicContact CB-CB 4.19Å; D195-R197 PolarHBondContact O-N 3.21Å; D195-R197 VanDerWaalsContact O-N 3.16Å
196	K	95.5	Very high	96.2	Very high	136 Å²	136	56.2 Å²	56.2	59%	0.591	28%	0.28	S	S	*	.			trans	47.6	39.4	-173.6	-62.4	-169.6	173	-169.1	0	112.8	M191 N194	M191-K196 PolarHBondContact O-N 2.91Å; N194-K196 VanDerWaalsContact C-N 3.27Å; N194-K196 PolarHBondContact O-N 3.47Å
197	R	94.6	Very high	96.1	Very high	113 Å²	113	58.3 Å²	58.3	43%	0.426	29%	0.293	S	S	.	.			trans	-115.9	136.5	-173.2	-166	178.4	177.8	-147.9	1.4	111.1	M191 D195 F201	M191-R197 HydrophobicContact CE-CB 3.84Å; M191-R197 HydrophobicContact CE-CG 3.57Å; M191-R197 HydrophobicContact CG-CB 4.06Å; M191-R197 PolarHBondContact O-N 3.16Å; M191-R197 VanDerWaalsContact O-N 3.1Å; D195-R197 HydrophobicContact CB-CB 4.19Å; D195-R197 PolarHBondContact O-N 3.21Å; D195-R197 VanDerWaalsContact O-N 3.16Å; R197-F201 HydrophobicContact CG-CB 4.31Å; R197-F201 HydrophobicContact CG-CD2 4.25Å; R197-F201 PolarHBondContact NH1-O 3.08Å; R197-F201 PolarHBondContact NH2-O 3.31Å
198	N	95.9	Very high	96	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.027	28%	0.282	C	S	.	.			trans	-68.5	141.8	179.9	-75.2	-28.8	0	0	0	113	D148 M191 R200 F201 T219	D148-N198 PolarHBondContact OD1-ND2 3.49Å; M191-N198 WeakPolarHBondContact CE-O 3.17Å; N198-R200 HydrophobicContact CB-CG 4.34Å; N198-R200 PolarHBondContact ND2-NH1 2.77Å; N198-R200 PolarHBondContact O-N 3.21Å; N198-F201 HydrophobicContact CB-CD2 3.88Å; N198-F201 HydrophobicContact CB-CE2 3.81Å; N198-F201 PolarHBondContact O-N 2.71Å; N198-T219 HydrophobicContact CB-CG2 4.47Å; N198-T219 WeakPolarHBondContact OD1-CB 3.46Å; N198-T219 WeakPolarHBondContact OD1-CG2 3.41Å
199	V	96.7	Very high	95.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-53.1	-32.5	-176.3	173.8	0	0	0	0	113.1	V188 L192 F201 G202 W204 L212 F217 T219	V188-V199 HydrophobicContact CG1-CG2 3.8Å; L192-V199 HydrophobicContact CD1-CG2 4.25Å; L192-V199 HydrophobicContact CD2-CG2 4.17Å; L192-V199 HydrophobicContact CG-CG2 4.28Å; V199-F201 PolarHBondContact O-N 3.4Å; V199-F201 VanDerWaalsContact O-N 3.07Å; V199-G202 PolarHBondContact O-N 2.97Å; V199-G202 VanDerWaalsContact O-N 3.08Å; V199-W204 HydrophobicContact CG1-CZ2 4.09Å; V199-W204 PolarHBondContact O-NE1 3.22Å; V199-L212 HydrophobicContact CG1-CD1 4.35Å; V199-L212 HydrophobicContact CG1-CD2 4.23Å; V199-F217 HydrophobicContact CG2-CB 4.25Å; V199-F217 HydrophobicContact CG2-CG 4.32Å; V199-T219 WeakPolarHBondContact CG2-OG1 2.94Å; V199-T219 PolarHBondContact N-O 2.93Å; V199-T219 PolarHBondContact N-OG1 2.96Å
200	R	95.3	Very high	95.7	Very high	38 Å²	38	58.8 Å²	58.8	14%	0.143	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-59.2	-19.5	179.9	75.4	-179.4	76	103	10.2	114.5	N198 T219 S220 K221 D253	N198-R200 HydrophobicContact CB-CG 4.34Å; N198-R200 PolarHBondContact ND2-NH1 2.77Å; N198-R200 PolarHBondContact O-N 3.21Å; R200-T219 WeakPolarHBondContact CB-O 3.45Å; R200-T219 PolarHBondContact N-O 2.81Å; R200-T219 PolarHBondContact NE-O 3.34Å; R200-S220 WeakPolarHBondContact CB-O 3.36Å; R200-K221 VanDerWaalsContact CZ-O 3.25Å; R200-K221 PolarHBondContact NE-O 3.38Å; R200-K221 PolarHBondContact NH2-O 2.6Å; R200-K221 VanDerWaalsContact NH2-O 3.12Å; R200-D253 IonicContact CZ-OD2 2.88Å; R200-D253 IonicContact NH1-OD2 3.21Å; R200-D253 PolarHBondContact NH1-OD2 3.47Å
201	F	94.5	Very high	95.6	Very high	38 Å²	38	56.1 Å²	56.1	17%	0.167	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-101.5	4	-179.9	-50.6	-62.8	0	0	0	114	M191 R197 N198 V199 H252 D253	M191-F201 HydrophobicContact CE-CB 4.37Å; R197-F201 HydrophobicContact CG-CB 4.31Å; R197-F201 HydrophobicContact CG-CD2 4.25Å; R197-F201 PolarHBondContact NH1-O 3.08Å; R197-F201 PolarHBondContact NH2-O 3.31Å; N198-F201 HydrophobicContact CB-CD2 3.88Å; N198-F201 HydrophobicContact CB-CE2 3.81Å; N198-F201 PolarHBondContact O-N 2.71Å; V199-F201 PolarHBondContact O-N 3.4Å; V199-F201 VanDerWaalsContact O-N 3.07Å; F201-H252 WeakPolarHBondContact CE2-O 3.28Å; F201-H252 WeakPolarHBondContact CZ-O 3.05Å; F201-D253 VanDerWaalsContact CZ-CA 3.49Å; F201-D253 HydrophobicContact CZ-CB 3.92Å; F201-D253 WeakPolarHBondContact CZ-OD1 3.49Å
202	G	93.5	Very high	95.6	Very high	14 Å²	14	55.7 Å²	55.7	14%	0.144	28%	0.281	C	S	.	.	S	Bend	trans	-73.9	147.2	178.7	0	0	0	0	0	111.8	V199 W204	V199-G202 PolarHBondContact O-N 2.97Å; V199-G202 VanDerWaalsContact O-N 3.08Å; G202-W204 PolarHBondContact O-N 3.48Å; G202-W204 PolarHBondContact O-NE1 3.41Å
203	D	93.4	Very high	95.5	Very high	136 Å²	136	57.2 Å²	57.2	73%	0.727	29%	0.289	S	S	*	.			trans	-82.8	92.8	172.4	-64.9	-56.5	0	0	0	109.4	K187	K187-D203 PolarHBondContact NZ-O 3.42Å
204	W	95.5	Very high	95.3	Very high	37 Å²	37	61.6 Å²	61.6	14%	0.14	31%	0.308	C	S	.	.			trans	-103.6	130.7	-175.5	-50.3	113.8	0	0	0	111.8	K187 V188 M191 V199 G202 E208 V209 L212	K187-W204 HydrophobicContact CB-CZ3 4.18Å; K187-W204 HydrophobicContact CD-CE3 4.19Å; K187-W204 HydrophobicContact CD-CH2 4.21Å; K187-W204 HydrophobicContact CD-CZ3 3.5Å; K187-W204 HydrophobicContact CG-CH2 3.9Å; K187-W204 HydrophobicContact CG-CZ3 3.66Å; V188-W204 HydrophobicContact CB-CH2 4.47Å; V188-W204 HydrophobicContact CG2-CH2 3.54Å; V188-W204 HydrophobicContact CG2-CZ2 4.14Å; V188-W204 HydrophobicContact CG2-CZ3 4.11Å; M191-W204 HydrophobicContact SD-CH2 4.26Å; M191-W204 HydrophobicContact SD-CZ2 3.78Å; V199-W204 HydrophobicContact CG1-CZ2 4.09Å; V199-W204 PolarHBondContact O-NE1 3.22Å; G202-W204 PolarHBondContact O-N 3.48Å; G202-W204 PolarHBondContact O-NE1 3.41Å; W204-E208 WeakPolarHBondContact CA-OE2 3.45Å; W204-E208 HydrophobicContact CB-CB 4.14Å; W204-E208 HydrophobicContact CE3-CB 4.08Å; W204-E208 HydrophobicContact CE3-CG 4.41Å; W204-V209 HydrophobicContact CB-CG2 3.66Å; W204-L212 HydrophobicContact CB-CD1 4.18Å; W204-L212 HydrophobicContact CD2-CD1 3.44Å; W204-L212 VanDerWaalsContact CD2-CD1 3.44Å; W204-L212 HydrophobicContact CE3-CD1 3.95Å; W204-L212 HydrophobicContact CG-CD1 3.5Å; W204-L212 HydrophobicContact CZ2-CD1 4.31Å
205	N	95.4	Very high	95.2	Very high	76 Å²	76	57.5 Å²	57.5	41%	0.406	29%	0.285	S	S	.	.			trans	-77.7	164.9	169.7	76.1	58.9	0	0	0	111.1	T207 E208 V209	N205-T207 VanDerWaalsContact C-N 3.28Å; N205-T207 PolarHBondContact O-N 2.96Å; N205-T207 VanDerWaalsContact O-N 3.17Å; N205-T207 WeakPolarHBondContact OD1-CA 3.43Å; N205-T207 VanDerWaalsContact OD1-CB 3.32Å; N205-T207 WeakPolarHBondContact OD1-CB 3.32Å; N205-T207 PolarHBondContact OD1-N 2.91Å; N205-E208 VanDerWaalsContact CG-OE2 3.31Å; N205-E208 PolarHBondContact N-OE2 2.94Å; N205-E208 VanDerWaalsContact ND2-CD 3.26Å; N205-E208 WeakPolarHBondContact ND2-CG 3.11Å; N205-E208 PolarHBondContact ND2-OE2 2.84Å; N205-E208 WeakPolarHBondContact O-CB 3.3Å; N205-E208 PolarHBondContact O-N 3.38Å; N205-E208 PolarHBondContact OD1-N 3.32Å; N205-V209 WeakPolarHBondContact O-CG2 3.45Å; N205-V209 PolarHBondContact O-N 2.82Å
206	P	94.7	Very high	95.1	Very high	64 Å²	64	54 Å²	54	42%	0.416	27%	0.267	S	S	.	.	H	α-helix	trans	-53.6	-38.2	-177	-30.9	38.1	0	0	0	115.2	V13 V209 E210	V13-P206 HydrophobicContact CG2-CB 3.83Å; P206-V209 PolarHBondContact O-N 2.68Å; P206-E210 WeakPolarHBondContact O-CG 3.45Å; P206-E210 PolarHBondContact O-N 2.95Å; P206-E210 VanDerWaalsContact O-N 3.12Å
207	T	94.8	Very high	95.1	Very high	79 Å²	79	47.6 Å²	47.6	49%	0.485	24%	0.239	S	C	.	.	H	α-helix	trans	-69	-41.9	177.7	-52.8	0	0	0	0	111.2	N205 V209 E210 I211	N205-T207 VanDerWaalsContact C-N 3.28Å; N205-T207 PolarHBondContact O-N 2.96Å; N205-T207 VanDerWaalsContact O-N 3.17Å; N205-T207 WeakPolarHBondContact OD1-CA 3.43Å; N205-T207 VanDerWaalsContact OD1-CB 3.32Å; N205-T207 WeakPolarHBondContact OD1-CB 3.32Å; N205-T207 PolarHBondContact OD1-N 2.91Å; T207-V209 VanDerWaalsContact C-N 3.34Å; T207-E210 PolarHBondContact O-N 2.78Å; T207-I211 HydrophobicContact CG2-CD1 4.29Å; T207-I211 WeakPolarHBondContact O-CD1 3.45Å; T207-I211 WeakPolarHBondContact O-CG1 3.48Å; T207-I211 PolarHBondContact O-N 3.39Å
208	E	97.1	Very high	95.1	Very high	26 Å²	26	42.2 Å²	42.2	12%	0.121	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-42.5	174.4	-70.4	171.6	125.2	0	0	110.9	C184 K187 W204 N205 E210 I211 L212	C184-E208 HydrophobicContact CB-CG 4.3Å; K187-E208 WeakPolarHBondContact CD-OE1 3.12Å; K187-E208 IonicContact NZ-OE1 3.17Å; K187-E208 PolarHBondContact NZ-OE1 2.78Å; K187-E208 IonicContact NZ-OE2 2.82Å; K187-E208 PolarHBondContact NZ-OE2 3Å; W204-E208 WeakPolarHBondContact CA-OE2 3.45Å; W204-E208 HydrophobicContact CB-CB 4.14Å; W204-E208 HydrophobicContact CE3-CB 4.08Å; W204-E208 HydrophobicContact CE3-CG 4.41Å; N205-E208 VanDerWaalsContact CG-OE2 3.31Å; N205-E208 PolarHBondContact N-OE2 2.94Å; N205-E208 VanDerWaalsContact ND2-CD 3.26Å; N205-E208 WeakPolarHBondContact ND2-CG 3.11Å; N205-E208 PolarHBondContact ND2-OE2 2.84Å; N205-E208 WeakPolarHBondContact O-CB 3.3Å; N205-E208 PolarHBondContact O-N 3.38Å; N205-E208 PolarHBondContact OD1-N 3.32Å; E208-E210 VanDerWaalsContact C-N 3.33Å; E208-E210 PolarHBondContact O-N 2.77Å; E208-I211 PolarHBondContact O-N 2.61Å; E208-I211 VanDerWaalsContact O-N 3.17Å; E208-L212 VanDerWaalsContact O-CG 3.23Å; E208-L212 WeakPolarHBondContact O-CG 3.25Å; E208-L212 PolarHBondContact O-N 2.96Å
209	V	95.9	Very high	95.1	Very high	11 Å²	11	42 Å²	42	7%	0.067	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-41.1	177.5	-179.8	0	0	0	0	111.6	V13 L14 L15 W204 N205 P206 T207 I211 L212 N213	V13-V209 HydrophobicContact CB-CB 4.13Å; V13-V209 HydrophobicContact CB-CG1 3.94Å; V13-V209 HydrophobicContact CG1-CB 3.92Å; V13-V209 HydrophobicContact CG1-CG1 3.46Å; V13-V209 VanDerWaalsContact CG1-CG1 3.46Å; L14-V209 WeakPolarHBondContact O-CG1 3.49Å; L15-V209 HydrophobicContact CB-CG1 4.34Å; L15-V209 HydrophobicContact CD1-CG1 4.35Å; W204-V209 HydrophobicContact CB-CG2 3.66Å; N205-V209 WeakPolarHBondContact O-CG2 3.45Å; N205-V209 PolarHBondContact O-N 2.82Å; P206-V209 PolarHBondContact O-N 2.68Å; T207-V209 VanDerWaalsContact C-N 3.34Å; V209-I211 VanDerWaalsContact C-N 3.32Å; V209-I211 PolarHBondContact O-N 3.27Å; V209-L212 PolarHBondContact O-N 3.41Å; V209-N213 WeakPolarHBondContact O-CB 3.33Å; V209-N213 PolarHBondContact O-N 3.48Å; V209-N213 PolarHBondContact O-ND2 3.47Å; V209-N213 PolarHBondContact O-OD1 3.18Å
210	E	94.7	Very high	95.1	Very high	88 Å²	88	42.4 Å²	42.4	41%	0.411	22%	0.221	S	C	.	.	H	α-helix	trans	-58.9	-43.2	175.2	-72.7	175.4	-179.4	0	0	111.1	K11 V13 P206 T207 E208 N213	K11-E210 IonicContact NZ-OE1 3.21Å; K11-E210 PolarHBondContact NZ-OE1 2.78Å; V13-E210 HydrophobicContact CG1-CG 4.17Å; P206-E210 WeakPolarHBondContact O-CG 3.45Å; P206-E210 PolarHBondContact O-N 2.95Å; P206-E210 VanDerWaalsContact O-N 3.12Å; T207-E210 PolarHBondContact O-N 2.78Å; E208-E210 VanDerWaalsContact C-N 3.33Å; E208-E210 PolarHBondContact O-N 2.77Å; E210-N213 PolarHBondContact O-N 2.95Å
211	I	96.3	Very high	95.1	Very high	20 Å²	20	41 Å²	41	10%	0.103	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-47.3	175.5	-64.9	157.1	0	0	0	111.4	P180 A181 C184 T207 E208 V209 N213 E214 H215	P180-I211 HydrophobicContact CB-CD1 4.31Å; A181-I211 HydrophobicContact CB-CG2 4.45Å; C184-I211 HydrophobicContact CB-CD1 4.14Å; C184-I211 HydrophobicContact CB-CG2 4.2Å; T207-I211 HydrophobicContact CG2-CD1 4.29Å; T207-I211 WeakPolarHBondContact O-CD1 3.45Å; T207-I211 WeakPolarHBondContact O-CG1 3.48Å; T207-I211 PolarHBondContact O-N 3.39Å; E208-I211 PolarHBondContact O-N 2.61Å; E208-I211 VanDerWaalsContact O-N 3.17Å; V209-I211 VanDerWaalsContact C-N 3.32Å; V209-I211 PolarHBondContact O-N 3.27Å; I211-N213 PolarHBondContact O-N 3.42Å; I211-E214 WeakPolarHBondContact O-CB 3.43Å; I211-E214 PolarHBondContact O-N 2.81Å; I211-E214 VanDerWaalsContact O-N 3.08Å; I211-H215 PolarHBondContact O-CD2 3.03Å; I211-H215 VanDerWaalsContact O-CD2 3.31Å
212	L	97.1	Very high	95.2	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-36.1	179.9	-68.3	172.1	0	0	0	112.3	L15 V188 V199 W204 E208 V209 E214 H215 L216 F217	L15-L212 HydrophobicContact CD1-CB 3.68Å; L15-L212 HydrophobicContact CD1-CD1 3.77Å; L15-L212 HydrophobicContact CD1-CG 4.38Å; V188-L212 HydrophobicContact CG2-CD2 3.44Å; V188-L212 VanDerWaalsContact CG2-CD2 3.44Å; V199-L212 HydrophobicContact CG1-CD1 4.35Å; V199-L212 HydrophobicContact CG1-CD2 4.23Å; W204-L212 HydrophobicContact CB-CD1 4.18Å; W204-L212 HydrophobicContact CD2-CD1 3.44Å; W204-L212 VanDerWaalsContact CD2-CD1 3.44Å; W204-L212 HydrophobicContact CE3-CD1 3.95Å; W204-L212 HydrophobicContact CG-CD1 3.5Å; W204-L212 HydrophobicContact CZ2-CD1 4.31Å; E208-L212 VanDerWaalsContact O-CG 3.23Å; E208-L212 WeakPolarHBondContact O-CG 3.25Å; E208-L212 PolarHBondContact O-N 2.96Å; V209-L212 PolarHBondContact O-N 3.41Å; L212-E214 PolarHBondContact O-N 3.45Å; L212-H215 PolarHBondContact O-N 3.43Å; L212-H215 VanDerWaalsContact O-N 3.08Å; L212-L216 PolarHBondContact O-N 3.47Å; L212-F217 HydrophobicContact CD2-CD2 3.97Å; L212-F217 HydrophobicContact CD2-CE2 3.77Å
213	N	95	Very high	95.3	Very high	31 Å²	31	41.2 Å²	41.2	17%	0.166	22%	0.218	C	C	.	.	H	α-helix	trans	-68.7	-19.6	179.2	-72	-7.9	0	0	0	113.3	L14 G16 V209 E210 I211 L216	L14-N213 PolarHBondContact O-ND2 2.89Å; G16-N213 PolarHBondContact N-OD1 3.29Å; G16-N213 PolarHBondContact O-ND2 3.08Å; G16-N213 PolarHBondContact O-OD1 3.03Å; V209-N213 WeakPolarHBondContact O-CB 3.33Å; V209-N213 PolarHBondContact O-N 3.48Å; V209-N213 PolarHBondContact O-ND2 3.47Å; V209-N213 PolarHBondContact O-OD1 3.18Å; E210-N213 PolarHBondContact O-N 2.95Å; I211-N213 PolarHBondContact O-N 3.42Å; N213-L216 VanDerWaalsContact O-CD2 3.24Å; N213-L216 WeakPolarHBondContact O-CD2 3.47Å; N213-L216 WeakPolarHBondContact O-CG 3.38Å
214	E	94.2	Very high	95.6	Very high	156 Å²	156	34.7 Å²	34.7	73%	0.729	18%	0.183	S	C	*	.	H	α-helix	trans	-75.1	-30.8	170.5	-61.9	-179.7	177.3	0	0	111.7	I211 L212	I211-E214 WeakPolarHBondContact O-CB 3.43Å; I211-E214 PolarHBondContact O-N 2.81Å; I211-E214 VanDerWaalsContact O-N 3.08Å; L212-E214 PolarHBondContact O-N 3.45Å
215	H	94.7	Very high	95.7	Very high	24 Å²	24	33.1 Å²	33.1	11%	0.111	18%	0.177	C	C	.	.	H	α-helix	trans	-89.6	-28.4	-175	-74.6	-70.5	0	0	0	114.4	Y158 I211 L212 F217	Y158-H215 HydrophobicContact CE1-CB 4.03Å; Y158-H215 AromaticContact CE1-ND1 3.85Å; Y158-H215 AromaticContact CZ-ND1 3.96Å; Y158-H215 PolarHBondContact OH-ND1 3.39Å; I211-H215 PolarHBondContact O-CD2 3.03Å; I211-H215 VanDerWaalsContact O-CD2 3.31Å; L212-H215 PolarHBondContact O-N 3.43Å; L212-H215 VanDerWaalsContact O-N 3.08Å; H215-F217 HydrophobicContact CB-CD2 3.87Å; H215-F217 HydrophobicContact CB-CE1 4.45Å; H215-F217 HydrophobicContact CB-CE2 3.41Å; H215-F217 VanDerWaalsContact CB-CE2 3.41Å; H215-F217 HydrophobicContact CB-CZ 3.74Å; H215-F217 AromaticContact CG-CE2 3.98Å; H215-F217 PolarHBondContact O-N 3.4Å
216	L	92.5	Very high	95.8	Very high	41 Å²	41	29.5 Å²	29.5	22%	0.215	16%	0.157	C	C	.	.			trans	51.9	50.3	176.7	-58.2	174.3	0	0	0	113.5	R17 L212 N213	R17-L216 HydrophobicContact CG-CD1 4.13Å; R17-L216 HydrophobicContact CG-CD2 3.52Å; R17-L216 HydrophobicContact CG-CG 4.49Å; R17-L216 VanDerWaalsContact NE-CD1 3.31Å; L212-L216 PolarHBondContact O-N 3.47Å; N213-L216 VanDerWaalsContact O-CD2 3.24Å; N213-L216 WeakPolarHBondContact O-CD2 3.47Å; N213-L216 WeakPolarHBondContact O-CG 3.38Å
217	F	95.7	Very high	96	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.			trans	-51.8	140.4	175.8	-67.8	-72.3	0	0	0	111.7	D155 Y158 V159 L185 V188 V199 L212 H215 S220	D155-F217 HydrophobicContact CB-CD1 4.17Å; D155-F217 WeakPolarHBondContact OD2-CB 3.49Å; Y158-F217 AromaticContact CD1-CD1 3.97Å; Y158-F217 HydrophobicContact CD1-CD1 3.97Å; Y158-F217 AromaticContact CD1-CE1 3.57Å; Y158-F217 HydrophobicContact CD1-CE1 3.57Å; Y158-F217 HydrophobicContact CD1-CZ 4.41Å; Y158-F217 HydrophobicContact CE1-CD1 4.33Å; Y158-F217 AromaticContact CE1-CE1 3.87Å; Y158-F217 HydrophobicContact CE1-CE1 3.87Å; Y158-F217 HydrophobicContact CE1-CZ 4.32Å; V159-F217 HydrophobicContact CB-CE1 3.8Å; V159-F217 HydrophobicContact CB-CZ 4.26Å; V159-F217 HydrophobicContact CG2-CE1 4.03Å; V159-F217 HydrophobicContact CG2-CZ 3.97Å; L185-F217 HydrophobicContact CD2-CZ 3.97Å; V188-F217 HydrophobicContact CG1-CE1 4.12Å; V188-F217 HydrophobicContact CG1-CE2 4.11Å; V188-F217 HydrophobicContact CG1-CZ 3.9Å; V188-F217 HydrophobicContact CG2-CE2 4.36Å; V199-F217 HydrophobicContact CG2-CB 4.25Å; V199-F217 HydrophobicContact CG2-CG 4.32Å; L212-F217 HydrophobicContact CD2-CD2 3.97Å; L212-F217 HydrophobicContact CD2-CE2 3.77Å; H215-F217 HydrophobicContact CB-CD2 3.87Å; H215-F217 HydrophobicContact CB-CE1 4.45Å; H215-F217 HydrophobicContact CB-CE2 3.41Å; H215-F217 VanDerWaalsContact CB-CE2 3.41Å; H215-F217 HydrophobicContact CB-CZ 3.74Å; H215-F217 AromaticContact CG-CE2 3.98Å; H215-F217 PolarHBondContact O-N 3.4Å; F217-S220 WeakPolarHBondContact O-CB 3.39Å; F217-S220 PolarHBondContact O-N 2.92Å; F217-S220 PolarHBondContact O-OG 3.17Å
218	I	94.7	Very high	96.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-65.5	-43.5	-179.2	-59.1	167.1	0	0	0	110.3	I113 R114 I119 L151 K154 D155 S220 K221	I113-I218 HydrophobicContact CD1-CG2 3.81Å; I113-I218 HydrophobicContact CG1-CG2 4.19Å; I113-I218 HydrophobicContact CG2-CD1 3.71Å; I113-I218 HydrophobicContact CG2-CG1 4.05Å; I113-I218 HydrophobicContact CG2-CG2 4.09Å; R114-I218 HydrophobicContact CG-CD1 4.06Å; R114-I218 HydrophobicContact CG-CG1 3.8Å; I119-I218 HydrophobicContact CD1-CG2 4.44Å; L151-I218 HydrophobicContact CB-CG2 4.16Å; L151-I218 HydrophobicContact CD1-CG2 4.04Å; L151-I218 HydrophobicContact CD2-CG2 4Å; L151-I218 HydrophobicContact CG-CG2 4.26Å; K154-I218 HydrophobicContact CB-CD1 4.2Å; K154-I218 HydrophobicContact CG-CD1 3.88Å; D155-I218 VanDerWaalsContact CG-N 3.34Å; D155-I218 PolarHBondContact OD1-N 3.24Å; D155-I218 PolarHBondContact OD2-N 3.11Å; I218-S220 PolarHBondContact O-N 3.1Å; I218-K221 WeakPolarHBondContact O-CB 3.29Å; I218-K221 WeakPolarHBondContact O-CG 3.32Å; I218-K221 PolarHBondContact O-N 3.3Å; I218-K221 VanDerWaalsContact O-N 3.11Å
219	T	96	Very high	96.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-71.2	-5	179	59.5	0	0	0	0	113.9	L151 R152 D155 L192 N198 V199 R200	L151-T219 HydrophobicContact CB-CG2 4.46Å; R152-T219 HydrophobicContact CB-CG2 4.41Å; D155-T219 HydrophobicContact CB-CG2 4.41Å; D155-T219 WeakPolarHBondContact OD2-CB 3.43Å; D155-T219 WeakPolarHBondContact OD2-CG2 3.39Å; D155-T219 PolarHBondContact OD2-N 3.32Å; D155-T219 PolarHBondContact OD2-OG1 2.81Å; L192-T219 HydrophobicContact CD2-CG2 4.3Å; N198-T219 HydrophobicContact CB-CG2 4.47Å; N198-T219 WeakPolarHBondContact OD1-CB 3.46Å; N198-T219 WeakPolarHBondContact OD1-CG2 3.41Å; V199-T219 WeakPolarHBondContact CG2-OG1 2.94Å; V199-T219 PolarHBondContact N-O 2.93Å; V199-T219 PolarHBondContact N-OG1 2.96Å; R200-T219 WeakPolarHBondContact CB-O 3.45Å; R200-T219 PolarHBondContact N-O 2.81Å; R200-T219 PolarHBondContact NE-O 3.34Å
220	S	95.8	Very high	96	Very high	10 Å²	10	22.8 Å²	22.8	7%	0.07	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-80.9	-18.2	169.9	74.1	0	0	0	0	112.9	R200 F217 I218	R200-S220 WeakPolarHBondContact CB-O 3.36Å; F217-S220 WeakPolarHBondContact O-CB 3.39Å; F217-S220 PolarHBondContact O-N 2.92Å; F217-S220 PolarHBondContact O-OG 3.17Å; I218-S220 PolarHBondContact O-N 3.1Å
221	K	95.3	Very high	95.9	Very high	9 Å²	9	21.1 Å²	21.1	4%	0.039	11%	0.111	C	C	.	.	S	Bend	trans	-77.6	134.8	-172.8	-59.9	175.2	-171	-160	0	110.4	I113 R114 V116 I119 R200 I218	I113-K221 PolarHBondContact O-NZ 3.1Å; R114-K221 VanDerWaalsContact C-NZ 3.28Å; R114-K221 VanDerWaalsContact CA-NZ 3.31Å; R114-K221 PolarHBondContact O-NZ 3.37Å; V116-K221 VanDerWaalsContact O-CE 3.32Å; V116-K221 WeakPolarHBondContact O-CE 3.36Å; V116-K221 PolarHBondContact O-NZ 3.14Å; I119-K221 HydrophobicContact CD1-CB 4.18Å; I119-K221 HydrophobicContact CD1-CD 4.48Å; I119-K221 HydrophobicContact CG1-CB 4.38Å; R200-K221 VanDerWaalsContact CZ-O 3.25Å; R200-K221 PolarHBondContact NE-O 3.38Å; R200-K221 PolarHBondContact NH2-O 2.6Å; R200-K221 VanDerWaalsContact NH2-O 3.12Å; I218-K221 WeakPolarHBondContact O-CB 3.29Å; I218-K221 WeakPolarHBondContact O-CG 3.32Å; I218-K221 PolarHBondContact O-N 3.3Å; I218-K221 VanDerWaalsContact O-N 3.11Å
222	P	95.9	Very high	95.8	Very high	46 Å²	46	27 Å²	27	30%	0.299	14%	0.136	S	C	.	.			trans	-67.4	150.6	173.5	30.4	-36.3	0	0	0	111.2	D117 A118 I119 T300	D117-P222 WeakPolarHBondContact O-CD 3.31Å; A118-P222 WeakPolarHBondContact CA-O 3.45Å; A118-P222 HydrophobicContact CB-CG 3.98Å; I119-P222 PolarHBondContact N-O 3.45Å; P222-T300 HydrophobicContact CB-CG2 3.58Å; P222-T300 HydrophobicContact CG-CG2 3.52Å
223	V	97.2	Very high	95.7	Very high	9 Å²	9	28 Å²	28	6%	0.055	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142.5	-174.1	-171.8	0	0	0	0	110.4	I119 H121 Y225	I119-V223 HydrophobicContact CB-CG1 4.41Å; I119-V223 HydrophobicContact CB-CG2 4.31Å; I119-V223 HydrophobicContact CD1-CG2 4.45Å; I119-V223 HydrophobicContact CG2-CG1 4.39Å; I119-V223 CarbonylContact O-C 3.56Å; I119-V223 WeakPolarHBondContact O-CA 2.9Å; H121-V223 HydrophobicContact CB-CG1 3.64Å; V223-Y225 HydrophobicContact CB-CE2 4.18Å; V223-Y225 HydrophobicContact CG1-CD1 4.34Å; V223-Y225 HydrophobicContact CG1-CD2 4.34Å; V223-Y225 HydrophobicContact CG1-CE1 3.94Å; V223-Y225 HydrophobicContact CG1-CE2 3.91Å
224	I	98.3	Very high	95.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.2	169.7	-59.6	157.8	0	0	0	106.7	I119 F120 H121 L226 A257 I259 V296 T300	I119-I224 PolarHBondContact O-N 3.26Å; F120-I224 CarbonylContact C-O 3.46Å; F120-I224 WeakPolarHBondContact CA-O 3.31Å; F120-I224 HydrophobicContact CD1-CB 3.76Å; F120-I224 HydrophobicContact CD1-CD1 3.9Å; F120-I224 HydrophobicContact CD1-CG1 4.46Å; F120-I224 HydrophobicContact CD1-CG2 3.9Å; F120-I224 HydrophobicContact CE1-CB 4.04Å; F120-I224 HydrophobicContact CE1-CD1 3.42Å; F120-I224 VanDerWaalsContact CE1-CD1 3.42Å; F120-I224 HydrophobicContact CE1-CG1 4.36Å; F120-I224 HydrophobicContact CE1-CG2 3.98Å; F120-I224 HydrophobicContact CZ-CD1 4.18Å; H121-I224 PolarHBondContact N-O 3.33Å; I224-L226 HydrophobicContact CG2-CD2 3.9Å; I224-L226 PolarHBondContact O-N 3.5Å; I224-A257 HydrophobicContact CG2-CB 4.19Å; I224-I259 HydrophobicContact CG2-CD1 3.9Å; I224-I259 HydrophobicContact CG2-CG1 4.31Å; I224-V296 HydrophobicContact CD1-CG1 3.93Å; I224-V296 HydrophobicContact CG1-CG1 4.09Å; I224-V296 HydrophobicContact CG2-CG1 4.33Å; I224-T300 HydrophobicContact CD1-CG2 4.03Å; I224-T300 HydrophobicContact CG1-CG2 4.15Å
225	Y	98.4	Very high	95.7	Very high	3 Å²	3	22.4 Å²	22.4	1%	0.012	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	109.5	-178.9	-62.1	-85.8	0	0	0	109.7	H121 L144 V223 W248 V249 D253 A256 A257 I258 I259	H121-Y225 HydrophobicContact CB-CD1 3.95Å; H121-Y225 HydrophobicContact CB-CE1 4.18Å; H121-Y225 AromaticContact ND1-CD1 3.88Å; H121-Y225 AromaticContact ND1-CE1 3.51Å; H121-Y225 CarbonylContact O-C 3.58Å; H121-Y225 WeakPolarHBondContact O-CA 3.37Å; L144-Y225 HydrophobicContact CD2-CD1 3.51Å; L144-Y225 HydrophobicContact CD2-CE1 3.36Å; V223-Y225 HydrophobicContact CB-CE2 4.18Å; V223-Y225 HydrophobicContact CG1-CD1 4.34Å; V223-Y225 HydrophobicContact CG1-CD2 4.34Å; V223-Y225 HydrophobicContact CG1-CE1 3.94Å; V223-Y225 HydrophobicContact CG1-CE2 3.91Å; Y225-W248 HydrophobicContact CE1-CZ3 4.02Å; Y225-W248 AromaticContact CZ-CZ3 3.99Å; Y225-V249 HydrophobicContact CD1-CG2 4.24Å; Y225-V249 HydrophobicContact CD2-CG1 3.99Å; Y225-V249 HydrophobicContact CD2-CG2 3.66Å; Y225-V249 HydrophobicContact CE1-CG2 4.32Å; Y225-V249 HydrophobicContact CE2-CB 4.49Å; Y225-V249 HydrophobicContact CE2-CG1 3.9Å; Y225-V249 HydrophobicContact CE2-CG2 3.78Å; Y225-V249 HydrophobicContact CG-CG2 3.92Å; Y225-D253 HydrophobicContact CE2-CB 4.05Å; Y225-D253 PolarHBondContact OH-OD2 3.07Å; Y225-A256 HydrophobicContact CD2-CB 3.87Å; Y225-A256 HydrophobicContact CE2-CB 3.56Å; Y225-A257 PolarHBondContact N-O 3.09Å; Y225-I258 WeakPolarHBondContact O-CA 3.49Å; Y225-I259 PolarHBondContact O-N 2.73Å
226	L	98.2	Very high	95.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	111.1	176.4	-60.1	-171.4	0	0	0	109.2	F37 F120 H121 M122 L123 I224 N228 I259 F261 I293	F37-L226 HydrophobicContact CE1-CD1 4.01Å; F37-L226 HydrophobicContact CE2-CD1 4.08Å; F37-L226 HydrophobicContact CZ-CD1 3.68Å; F120-L226 HydrophobicContact CB-CD1 3.82Å; F120-L226 HydrophobicContact CB-CG 4.23Å; F120-L226 HydrophobicContact CD1-CD1 3.69Å; F120-L226 HydrophobicContact CD1-CD2 4.04Å; F120-L226 HydrophobicContact CD1-CG 3.85Å; F120-L226 HydrophobicContact CE1-CD1 4.42Å; F120-L226 HydrophobicContact CE1-CD2 4.41Å; F120-L226 HydrophobicContact CG-CD1 3.86Å; F120-L226 HydrophobicContact CG-CG 4.37Å; H121-L226 PolarHBondContact O-N 3.1Å; M122-L226 CarbonylContact C-O 3.55Å; M122-L226 WeakPolarHBondContact CA-O 3.49Å; M122-L226 HydrophobicContact CE-CD1 4.28Å; L123-L226 PolarHBondContact N-O 3.04Å; I224-L226 HydrophobicContact CG2-CD2 3.9Å; I224-L226 PolarHBondContact O-N 3.5Å; L226-N228 PolarHBondContact O-N 3.32Å; L226-I259 HydrophobicContact CD2-CB 3.98Å; L226-I259 HydrophobicContact CD2-CD1 4.25Å; L226-I259 HydrophobicContact CD2-CG1 4.46Å; L226-F261 HydrophobicContact CB-CD1 4.27Å; L226-F261 HydrophobicContact CB-CE1 3.82Å; L226-I293 HydrophobicContact CD1-CG2 4.14Å; L226-I293 HydrophobicContact CD2-CD1 4.17Å; L226-I293 HydrophobicContact CD2-CG1 3.94Å; L226-I293 HydrophobicContact CD2-CG2 4.1Å
227	V	97.8	Very high	95.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	97.9	-174.1	-178.3	0	0	0	0	108.4	L123 L125 M229 L242 I245 I258 I259 F261	L123-V227 HydrophobicContact CD1-CG2 4.37Å; L125-V227 HydrophobicContact CB-CG1 4.49Å; L125-V227 HydrophobicContact CD1-CG1 3.42Å; L125-V227 VanDerWaalsContact CD1-CG1 3.42Å; L125-V227 HydrophobicContact CD2-CG1 3.24Å; L125-V227 HydrophobicContact CG-CG1 3.86Å; V227-M229 HydrophobicContact CG1-CG 4.2Å; V227-M229 PolarHBondContact O-N 3.26Å; V227-L242 HydrophobicContact CG1-CD2 3.92Å; V227-I245 HydrophobicContact CG1-CD1 4.09Å; V227-I245 HydrophobicContact CG2-CD1 4.38Å; V227-I245 HydrophobicContact CG2-CG2 4.32Å; V227-I258 HydrophobicContact CG2-CG2 3.62Å; V227-I259 PolarHBondContact N-O 3.04Å; V227-F261 PolarHBondContact O-N 3.03Å
228	N	97.3	Very high	94.9	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	105	-176.1	-170.3	10.6	0	0	0	110.8	V32 M122 L123 L125 F126 L226 F261 A263	V32-N228 PolarHBondContact O-ND2 2.85Å; M122-N228 HydrophobicContact CG-CB 4.36Å; L123-N228 VanDerWaalsContact O-CB 3.3Å; L123-N228 WeakPolarHBondContact O-CB 3.31Å; L123-N228 PolarHBondContact O-N 2.73Å; L125-N228 WeakPolarHBondContact CA-O 3.38Å; L125-N228 WeakPolarHBondContact CB-O 3.49Å; L125-N228 PolarHBondContact N-O 2.96Å; F126-N228 HydrophobicContact CD1-CB 4.43Å; F126-N228 HydrophobicContact CE1-CB 4.42Å; F126-N228 VanDerWaalsContact CE1-ND2 3.33Å; F126-N228 WeakPolarHBondContact CE1-ND2 3.48Å; F126-N228 PolarHBondContact N-O 2.99Å; L226-N228 PolarHBondContact O-N 3.32Å; N228-F261 HydrophobicContact CB-CE1 3.71Å; N228-F261 HydrophobicContact CB-CZ 3.97Å; N228-A263 PolarHBondContact OD1-N 3.24Å
229	M	96.3	Very high	94.7	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.015	21%	0.207	C	C	.	.			trans	-101.2	159.6	-177.2	-56.5	-179.9	78	0	0	111.2	L125 V227 A233 F234 L242 P260 F261 S262	L125-M229 HydrophobicContact CB-CG 4.29Å; L125-M229 HydrophobicContact CD2-CG 4.33Å; V227-M229 HydrophobicContact CG1-CG 4.2Å; V227-M229 PolarHBondContact O-N 3.26Å; M229-A233 HydrophobicContact CB-CB 4.43Å; M229-A233 HydrophobicContact CE-CB 3.83Å; M229-F234 HydrophobicContact CB-CB 4.2Å; M229-F234 HydrophobicContact SD-CD2 4.46Å; M229-L242 HydrophobicContact CE-CD1 3.99Å; M229-L242 HydrophobicContact SD-CD1 4.29Å; M229-P260 HydrophobicContact SD-CB 3.8Å; M229-F261 PolarHBondContact N-O 3.04Å; M229-S262 WeakPolarHBondContact O-CA 3.33Å; M229-S262 WeakPolarHBondContact O-CB 3.28Å; M229-S262 PolarHBondContact O-OG 3.21Å
230	S	94.4	Very high	94.6	Very high	36 Å²	36	49.5 Å²	49.5	25%	0.252	24%	0.238	S	C	.	.			trans	-67	152.7	166.4	64.3	0	0	0	0	110.2	K232 A233 F234	S230-K232 VanDerWaalsContact C-N 3.26Å; S230-K232 PolarHBondContact O-N 3.37Å; S230-A233 PolarHBondContact O-N 3Å; S230-A233 WeakPolarHBondContact OG-CB 3.24Å; S230-A233 PolarHBondContact OG-N 3.07Å; S230-F234 WeakPolarHBondContact O-CB 3.39Å; S230-F234 PolarHBondContact O-N 3.13Å
231	E	93.6	Very high	94.6	Very high	52 Å²	52	50.4 Å²	50.4	24%	0.243	24%	0.24	C	C	.	.	H	α-helix	trans	-50	-48.8	177.5	176.1	173.4	-175.2	0	0	111	A233 F234 L235 S262 L265 K268 Y280	E231-A233 PolarHBondContact O-N 3Å; E231-F234 PolarHBondContact O-N 2.76Å; E231-L235 HydrophobicContact CG-CD1 3.85Å; E231-L235 HydrophobicContact CG-CG 4.34Å; E231-L235 WeakPolarHBondContact O-CB 3.38Å; E231-L235 VanDerWaalsContact O-CG 3.3Å; E231-L235 WeakPolarHBondContact O-CG 3.25Å; E231-L235 PolarHBondContact O-N 2.99Å; E231-S262 PolarHBondContact N-OG 2.96Å; E231-L265 HydrophobicContact CG-CB 4.46Å; E231-L265 HydrophobicContact CG-CD1 3.94Å; E231-K268 IonicContact OE1-NZ 3.31Å; E231-K268 PolarHBondContact OE1-NZ 2.95Å; E231-K268 IonicContact OE2-NZ 3.96Å; E231-Y280 PolarHBondContact OE1-OH 3.32Å
232	K	93.6	Very high	94.5	Very high	144 Å²	144	51.9 Å²	51.9	63%	0.626	25%	0.247	S	C	*	.	H	α-helix	trans	-59.8	-41.2	178.7	-176.6	178.3	178.7	-179.6	0	113.3	S230 K236	S230-K232 VanDerWaalsContact C-N 3.26Å; S230-K232 PolarHBondContact O-N 3.37Å; K232-K236 HydrophobicContact CG-CD 4.38Å; K232-K236 WeakPolarHBondContact O-CB 3.34Å; K232-K236 VanDerWaalsContact O-CG 3.26Å; K232-K236 WeakPolarHBondContact O-CG 3.4Å; K232-K236 PolarHBondContact O-N 3.17Å
233	A	93.9	Very high	94.5	Very high	22 Å²	22	53.8 Å²	53.8	18%	0.182	26%	0.26	C	S	.	.	H	α-helix	trans	-73.8	-38.2	-179.4	0	0	0	0	0	111.6	M229 S230 E231 K237 K238	M229-A233 HydrophobicContact CB-CB 4.43Å; M229-A233 HydrophobicContact CE-CB 3.83Å; S230-A233 PolarHBondContact O-N 3Å; S230-A233 WeakPolarHBondContact OG-CB 3.24Å; S230-A233 PolarHBondContact OG-N 3.07Å; E231-A233 PolarHBondContact O-N 3Å; A233-K237 PolarHBondContact O-N 2.78Å; A233-K237 VanDerWaalsContact O-N 3.16Å; A233-K238 PolarHBondContact O-N 3.4Å
234	F	95.6	Very high	94.5	Very high	23 Å²	23	58.3 Å²	58.3	10%	0.101	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-51.3	176	179.8	-98.8	0	0	0	111.7	M229 S230 E231 K236 K237 L265 F286 M289	M229-F234 HydrophobicContact CB-CB 4.2Å; M229-F234 HydrophobicContact SD-CD2 4.46Å; S230-F234 WeakPolarHBondContact O-CB 3.39Å; S230-F234 PolarHBondContact O-N 3.13Å; E231-F234 PolarHBondContact O-N 2.76Å; F234-K236 VanDerWaalsContact C-N 3.3Å; F234-K236 PolarHBondContact O-N 3.23Å; F234-K237 WeakPolarHBondContact O-CA 3.41Å; F234-K237 PolarHBondContact O-N 3.08Å; F234-L265 HydrophobicContact CD1-CD2 3.41Å; F234-L265 VanDerWaalsContact CD1-CD2 3.41Å; F234-L265 HydrophobicContact CE1-CD2 3.7Å; F234-L265 HydrophobicContact CG-CD2 4.47Å; F234-F286 HydrophobicContact CE1-CB 4.31Å; F234-F286 AromaticContact CE1-CD2 3.86Å; F234-F286 HydrophobicContact CE1-CD2 3.86Å; F234-F286 HydrophobicContact CE1-CG 4.35Å; F234-M289 HydrophobicContact CE2-CG 3.83Å; F234-M289 HydrophobicContact CZ-CG 3.61Å; F234-M289 HydrophobicContact CZ-SD 4.25Å
235	L	94.2	Very high	94.5	Very high	47 Å²	47	58.3 Å²	58.3	25%	0.246	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-37.9	178.8	-68.5	177.6	0	0	0	112.2	E231 K237 L265 N284 F286	E231-L235 HydrophobicContact CG-CD1 3.85Å; E231-L235 HydrophobicContact CG-CG 4.34Å; E231-L235 WeakPolarHBondContact O-CB 3.38Å; E231-L235 VanDerWaalsContact O-CG 3.3Å; E231-L235 WeakPolarHBondContact O-CG 3.25Å; E231-L235 PolarHBondContact O-N 2.99Å; L235-K237 PolarHBondContact O-N 3.41Å; L235-L265 HydrophobicContact CD2-CD2 4.08Å; L235-L265 HydrophobicContact CG-CD2 4.45Å; L235-N284 HydrophobicContact CD2-CB 4.12Å; L235-F286 HydrophobicContact CD2-CB 4.07Å; L235-F286 HydrophobicContact CD2-CD1 3.42Å; L235-F286 VanDerWaalsContact CD2-CD1 3.42Å; L235-F286 HydrophobicContact CD2-CE1 3.93Å; L235-F286 HydrophobicContact CD2-CG 3.75Å
236	K	92.5	Very high	94.4	Very high	132 Å²	132	62.8 Å²	62.8	57%	0.574	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-8.1	174.8	-70.8	-176.5	-179.7	-163	0	114	K232 F234 K238	K232-K236 HydrophobicContact CG-CD 4.38Å; K232-K236 WeakPolarHBondContact O-CB 3.34Å; K232-K236 VanDerWaalsContact O-CG 3.26Å; K232-K236 WeakPolarHBondContact O-CG 3.4Å; K232-K236 PolarHBondContact O-N 3.17Å; F234-K236 VanDerWaalsContact C-N 3.3Å; F234-K236 PolarHBondContact O-N 3.23Å; K236-K238 WeakPolarHBondContact O-CG 3.43Å; K236-K238 PolarHBondContact O-N 3.31Å; K236-K238 VanDerWaalsContact O-N 3.12Å
237	K	88.3	Confident	94.3	Very high	156 Å²	156	69.3 Å²	69.3	68%	0.678	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	35.5	-176.5	-60.2	173.8	-175.6	165.5	0	112.5	A233 F234 L235	A233-K237 PolarHBondContact O-N 2.78Å; A233-K237 VanDerWaalsContact O-N 3.16Å; F234-K237 WeakPolarHBondContact O-CA 3.41Å; F234-K237 PolarHBondContact O-N 3.08Å; L235-K237 PolarHBondContact O-N 3.41Å
238	K	85.7	Confident	94.3	Very high	166 Å²	166	70 Å²	70	72%	0.722	33%	0.331	S	S	*	.			trans	-137.4	129.8	-174.1	-78.3	-178.4	-178.1	-175.6	0	111.2	A233 K236	A233-K238 PolarHBondContact O-N 3.4Å; K236-K238 WeakPolarHBondContact O-CG 3.43Å; K236-K238 PolarHBondContact O-N 3.31Å; K236-K238 VanDerWaalsContact O-N 3.12Å
239	S	91.2	Very high	94.3	Very high	33 Å²	33	70 Å²	70	23%	0.231	33%	0.331	C	S	.	.			trans	-154.7	141.7	166.3	169.4	0	0	0	0	109.6	W241 L242 P243	S239-W241 PolarHBondContact O-N 3.06Å; S239-W241 PolarHBondContact OG-N 2.83Å; S239-W241 VanDerWaalsContact OG-N 3.12Å; S239-L242 PolarHBondContact O-N 3.17Å; S239-P243 WeakPolarHBondContact O-CD 3.36Å
240	K	93	Very high	94.2	Very high	148 Å²	148	73.2 Å²	73.2	64%	0.643	35%	0.349	S	S	*	.	S	Bend	trans	-63	-19.8	173.2	66.7	-179.9	-179.1	-178.3	0	112.9
241	W	95.4	Very high	94.3	Very high	29 Å²	29	78.6 Å²	78.6	11%	0.11	37%	0.37	C	S	.	.	H	α-helix	trans	-88.9	-27.4	-176.5	-63.1	119.5	0	0	0	113.5	L125 I138 D139 P140 V141 S239 K244 I245	L125-W241 HydrophobicContact CD2-CB 3.79Å; L125-W241 HydrophobicContact CG-CB 4.18Å; I138-W241 VanDerWaalsContact O-CZ2 3.24Å; I138-W241 WeakPolarHBondContact O-CZ2 3.25Å; D139-W241 HydrophobicContact CB-CH2 4.18Å; D139-W241 WeakPolarHBondContact OD1-CZ3 3.45Å; P140-W241 HydrophobicContact CG-CB 4.2Å; P140-W241 HydrophobicContact CG-CD2 4.05Å; P140-W241 HydrophobicContact CG-CE3 4.37Å; P140-W241 HydrophobicContact CG-CG 3.96Å; V141-W241 HydrophobicContact CG2-CE3 4.49Å; S239-W241 PolarHBondContact O-N 3.06Å; S239-W241 PolarHBondContact OG-N 2.83Å; S239-W241 VanDerWaalsContact OG-N 3.12Å; W241-K244 HydrophobicContact CE3-CD 3.87Å; W241-K244 HydrophobicContact CZ3-CD 4.01Å; W241-K244 PolarHBondContact O-N 3.35Å; W241-K244 VanDerWaalsContact O-N 3.11Å; W241-I245 HydrophobicContact CB-CD1 4.1Å; W241-I245 VanDerWaalsContact O-CG1 3.3Å; W241-I245 WeakPolarHBondContact O-CG1 3.44Å; W241-I245 PolarHBondContact O-N 2.92Å
242	L	94.9	Very high	94.3	Very high	39 Å²	39	79.4 Å²	79.4	20%	0.204	37%	0.374	C	S	.	.	H	α-helix	trans	-57.3	-44.9	-177	-76.5	171.9	0	0	0	113.3	V227 M229 S239 K244 I245 K246 P260	V227-L242 HydrophobicContact CG1-CD2 3.92Å; M229-L242 HydrophobicContact CE-CD1 3.99Å; M229-L242 HydrophobicContact SD-CD1 4.29Å; S239-L242 PolarHBondContact O-N 3.17Å; L242-K244 PolarHBondContact O-N 3.41Å; L242-I245 PolarHBondContact O-N 3.47Å; L242-K246 WeakPolarHBondContact O-CB 3.45Å; L242-K246 PolarHBondContact O-N 3.33Å; L242-P260 HydrophobicContact CD2-CB 4.3Å; L242-P260 HydrophobicContact CD2-CG 3.76Å
243	P	95.4	Very high	94.3	Very high	86 Å²	86	73 Å²	73	56%	0.558	35%	0.346	S	S	*	.	H	α-helix	trans	-62.8	-40.6	175.2	-23.5	35.3	0	0	0	112.9	S239 K246 E247	S239-P243 WeakPolarHBondContact O-CD 3.36Å; P243-K246 WeakPolarHBondContact O-CB 3.41Å; P243-K246 PolarHBondContact O-N 3.05Å; P243-E247 WeakPolarHBondContact O-CB 3.46Å; P243-E247 PolarHBondContact O-N 3.27Å
244	K	97	Very high	94	Very high	105 Å²	105	76 Å²	76	46%	0.457	37%	0.366	S	S	.	.	H	α-helix	trans	-67.7	-40	-180	-61.4	-173.2	174.7	-169.9	0	112.6	V141 W241 L242 K246 E247 W248	V141-K244 HydrophobicContact CG2-CB 3.79Å; W241-K244 HydrophobicContact CE3-CD 3.87Å; W241-K244 HydrophobicContact CZ3-CD 4.01Å; W241-K244 PolarHBondContact O-N 3.35Å; W241-K244 VanDerWaalsContact O-N 3.11Å; L242-K244 PolarHBondContact O-N 3.41Å; K244-K246 VanDerWaalsContact C-N 3.32Å; K244-E247 PolarHBondContact O-N 2.96Å; K244-W248 WeakPolarHBondContact O-CB 3.37Å; K244-W248 PolarHBondContact O-N 3.43Å
245	I	97.1	Very high	93.5	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-64.2	-42.4	174.1	-67.2	163	0	0	0	109.7	L123 L125 P140 L144 V227 W241 L242 W248 V249 I258	L123-I245 HydrophobicContact CD1-CD1 4.1Å; L123-I245 HydrophobicContact CD1-CG1 4.26Å; L123-I245 HydrophobicContact CD1-CG2 3.99Å; L125-I245 HydrophobicContact CD1-CD1 3.82Å; L125-I245 HydrophobicContact CD2-CD1 3.9Å; L125-I245 HydrophobicContact CG-CD1 4.3Å; P140-I245 HydrophobicContact CB-CD1 3.87Å; P140-I245 HydrophobicContact CB-CG1 4.1Å; P140-I245 HydrophobicContact CG-CD1 4.41Å; L144-I245 HydrophobicContact CD1-CG1 4.39Å; L144-I245 HydrophobicContact CD1-CG2 4.29Å; V227-I245 HydrophobicContact CG1-CD1 4.09Å; V227-I245 HydrophobicContact CG2-CD1 4.38Å; V227-I245 HydrophobicContact CG2-CG2 4.32Å; W241-I245 HydrophobicContact CB-CD1 4.1Å; W241-I245 VanDerWaalsContact O-CG1 3.3Å; W241-I245 WeakPolarHBondContact O-CG1 3.44Å; W241-I245 PolarHBondContact O-N 2.92Å; L242-I245 PolarHBondContact O-N 3.47Å; I245-W248 PolarHBondContact O-N 2.76Å; I245-V249 HydrophobicContact CG2-CG2 4.32Å; I245-V249 WeakPolarHBondContact O-CB 3.33Å; I245-V249 VanDerWaalsContact O-CG2 3.26Å; I245-V249 WeakPolarHBondContact O-CG2 3.42Å; I245-V249 PolarHBondContact O-N 2.99Å; I245-I258 HydrophobicContact CG2-CD1 4.41Å; I245-I258 HydrophobicContact CG2-CG2 4.26Å
246	K	96.6	Very high	93.5	Very high	97 Å²	97	77.2 Å²	77.2	42%	0.422	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-46	176.9	178.1	56.3	174.5	144.5	0	111.8	L242 P243 K244 V249 D250 I258	L242-K246 WeakPolarHBondContact O-CB 3.45Å; L242-K246 PolarHBondContact O-N 3.33Å; P243-K246 WeakPolarHBondContact O-CB 3.41Å; P243-K246 PolarHBondContact O-N 3.05Å; K244-K246 VanDerWaalsContact C-N 3.32Å; K246-V249 PolarHBondContact O-N 2.9Å; K246-D250 WeakPolarHBondContact CD-OD2 3.49Å; K246-D250 WeakPolarHBondContact CE-OD2 3.35Å; K246-D250 IonicContact NZ-OD1 3.03Å; K246-D250 PolarHBondContact NZ-OD1 2.92Å; K246-D250 IonicContact NZ-OD2 2.79Å; K246-D250 PolarHBondContact NZ-OD2 3.41Å; K246-D250 WeakPolarHBondContact O-CB 3.46Å; K246-D250 VanDerWaalsContact O-CG 3.29Å; K246-D250 PolarHBondContact O-N 2.89Å; K246-I258 HydrophobicContact CB-CD1 4.2Å; K246-I258 HydrophobicContact CD-CD1 3.7Å
247	E	97.2	Very high	93.7	Very high	137 Å²	137	72.5 Å²	72.5	64%	0.64	38%	0.38	S	S	*	.	H	α-helix	trans	-58.3	-50	175	-177.2	175.2	-166.2	0	0	111.5	P243 K244 V249 D250 E251	P243-E247 WeakPolarHBondContact O-CB 3.46Å; P243-E247 PolarHBondContact O-N 3.27Å; K244-E247 PolarHBondContact O-N 2.96Å; E247-V249 PolarHBondContact O-N 2.92Å; E247-D250 PolarHBondContact O-N 2.77Å; E247-E251 PolarHBondContact O-N 3.4Å
248	W	97.6	Very high	94.2	Very high	13 Å²	13	67 Å²	67	5%	0.049	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-46.4	178	-172.2	97.1	0	0	0	112	V141 L144 D145 D148 Y225 K244 I245 D250 E251 H252	V141-W248 HydrophobicContact CG1-CG 4.39Å; L144-W248 HydrophobicContact CB-CD2 3.86Å; L144-W248 HydrophobicContact CB-CE3 4.06Å; L144-W248 HydrophobicContact CB-CH2 4.03Å; L144-W248 HydrophobicContact CB-CZ2 3.79Å; L144-W248 HydrophobicContact CB-CZ3 4.16Å; L144-W248 HydrophobicContact CD1-CB 4.28Å; L144-W248 HydrophobicContact CD1-CD2 3.79Å; L144-W248 HydrophobicContact CD1-CE3 3.73Å; L144-W248 HydrophobicContact CD1-CG 4.02Å; L144-W248 HydrophobicContact CD1-CZ3 4.41Å; L144-W248 HydrophobicContact CD2-CE3 3.93Å; L144-W248 HydrophobicContact CD2-CH2 4.25Å; L144-W248 HydrophobicContact CD2-CZ3 3.78Å; L144-W248 HydrophobicContact CG-CD2 4.28Å; L144-W248 HydrophobicContact CG-CE3 4.13Å; L144-W248 HydrophobicContact CG-CZ3 4.35Å; D145-W248 PolarHBondContact OD1-NE1 2.95Å; D148-W248 HydrophobicContact CB-CH2 4.04Å; D148-W248 HydrophobicContact CB-CZ2 4.17Å; Y225-W248 HydrophobicContact CE1-CZ3 4.02Å; Y225-W248 AromaticContact CZ-CZ3 3.99Å; K244-W248 WeakPolarHBondContact O-CB 3.37Å; K244-W248 PolarHBondContact O-N 3.43Å; I245-W248 PolarHBondContact O-N 2.76Å; W248-D250 VanDerWaalsContact C-N 3.35Å; W248-D250 PolarHBondContact O-N 2.87Å; W248-E251 PolarHBondContact O-N 3.36Å; W248-H252 AromaticContact CD1-CE1 3.81Å; W248-H252 AromaticContact CD1-ND1 3.77Å; W248-H252 HydrophobicContact CD2-CB 4.34Å; W248-H252 AromaticContact CD2-ND1 3.71Å; W248-H252 AromaticContact CE2-CG 3.86Å; W248-H252 AromaticContact CE2-ND1 3.67Å; W248-H252 HydrophobicContact CE3-CB 4.18Å; W248-H252 AromaticContact CG-ND1 3.79Å; W248-H252 HydrophobicContact CH2-CB 3.93Å; W248-H252 HydrophobicContact CZ2-CB 4.1Å; W248-H252 AromaticContact CZ2-CG 3.97Å; W248-H252 HydrophobicContact CZ3-CB 3.97Å; W248-H252 AromaticContact NE1-CE1 3.74Å; W248-H252 AromaticContact NE1-ND1 3.72Å; W248-H252 WeakPolarHBondContact O-CB 3.27Å; W248-H252 PolarHBondContact O-N 3.04Å; W248-H252 PolarHBondContact O-ND1 3.3Å
249	V	97	Very high	94.7	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-66.8	-36.6	179.3	171.5	0	0	0	0	111.3	Y225 I245 K246 E247 E251 D253 S254 A256 I258	Y225-V249 HydrophobicContact CD1-CG2 4.24Å; Y225-V249 HydrophobicContact CD2-CG1 3.99Å; Y225-V249 HydrophobicContact CD2-CG2 3.66Å; Y225-V249 HydrophobicContact CE1-CG2 4.32Å; Y225-V249 HydrophobicContact CE2-CB 4.49Å; Y225-V249 HydrophobicContact CE2-CG1 3.9Å; Y225-V249 HydrophobicContact CE2-CG2 3.78Å; Y225-V249 HydrophobicContact CG-CG2 3.92Å; I245-V249 HydrophobicContact CG2-CG2 4.32Å; I245-V249 WeakPolarHBondContact O-CB 3.33Å; I245-V249 VanDerWaalsContact O-CG2 3.26Å; I245-V249 WeakPolarHBondContact O-CG2 3.42Å; I245-V249 PolarHBondContact O-N 2.99Å; K246-V249 PolarHBondContact O-N 2.9Å; E247-V249 PolarHBondContact O-N 2.92Å; V249-E251 VanDerWaalsContact C-N 3.31Å; V249-E251 PolarHBondContact O-N 3.22Å; V249-D253 HydrophobicContact CG1-CB 4.42Å; V249-D253 CarbonylContact O-C 3.59Å; V249-D253 VanDerWaalsContact O-CA 3.24Å; V249-D253 WeakPolarHBondContact O-CA 3.44Å; V249-D253 PolarHBondContact O-N 2.93Å; V249-S254 PolarHBondContact O-N 2.87Å; V249-A256 HydrophobicContact CG1-CB 3.97Å; V249-I258 HydrophobicContact CB-CD1 3.72Å; V249-I258 HydrophobicContact CB-CG1 4.28Å; V249-I258 HydrophobicContact CG1-CD1 3.9Å; V249-I258 HydrophobicContact CG1-CG1 4.02Å; V249-I258 HydrophobicContact CG2-CD1 3.84Å; V249-I258 HydrophobicContact CG2-CG1 4.14Å
250	D	95.2	Very high	95	Very high	72 Å²	72	59.4 Å²	59.4	39%	0.385	33%	0.325	S	S	.	.	H	α-helix	trans	-66.8	-34.3	177	-76.9	-25.9	0	0	0	112.7	K246 E247 W248	K246-D250 WeakPolarHBondContact CD-OD2 3.49Å; K246-D250 WeakPolarHBondContact CE-OD2 3.35Å; K246-D250 IonicContact NZ-OD1 3.03Å; K246-D250 PolarHBondContact NZ-OD1 2.92Å; K246-D250 IonicContact NZ-OD2 2.79Å; K246-D250 PolarHBondContact NZ-OD2 3.41Å; K246-D250 WeakPolarHBondContact O-CB 3.46Å; K246-D250 VanDerWaalsContact O-CG 3.29Å; K246-D250 PolarHBondContact O-N 2.89Å; E247-D250 PolarHBondContact O-N 2.77Å; W248-D250 VanDerWaalsContact C-N 3.35Å; W248-D250 PolarHBondContact O-N 2.87Å
251	E	94.8	Very high	95.2	Very high	149 Å²	149	52.4 Å²	52.4	70%	0.696	29%	0.294	S	S	*	.	H	α-helix	trans	-74.5	-43.3	176.3	-176.6	175.5	-165.4	0	0	112.5	E247 W248 V249	E247-E251 PolarHBondContact O-N 3.4Å; W248-E251 PolarHBondContact O-N 3.36Å; V249-E251 VanDerWaalsContact C-N 3.31Å; V249-E251 PolarHBondContact O-N 3.22Å
252	H	94.4	Very high	95.3	Very high	69 Å²	69	51 Å²	51	32%	0.319	29%	0.289	S	S	.	.	H	α-helix	trans	-103.4	-24.7	-168.6	-59.7	83.5	0	0	0	114.4	F201 W248	F201-H252 WeakPolarHBondContact CE2-O 3.28Å; F201-H252 WeakPolarHBondContact CZ-O 3.05Å; W248-H252 AromaticContact CD1-CE1 3.81Å; W248-H252 AromaticContact CD1-ND1 3.77Å; W248-H252 HydrophobicContact CD2-CB 4.34Å; W248-H252 AromaticContact CD2-ND1 3.71Å; W248-H252 AromaticContact CE2-CG 3.86Å; W248-H252 AromaticContact CE2-ND1 3.67Å; W248-H252 HydrophobicContact CE3-CB 4.18Å; W248-H252 AromaticContact CG-ND1 3.79Å; W248-H252 HydrophobicContact CH2-CB 3.93Å; W248-H252 HydrophobicContact CZ2-CB 4.1Å; W248-H252 AromaticContact CZ2-CG 3.97Å; W248-H252 HydrophobicContact CZ3-CB 3.97Å; W248-H252 AromaticContact NE1-CE1 3.74Å; W248-H252 AromaticContact NE1-ND1 3.72Å; W248-H252 WeakPolarHBondContact O-CB 3.27Å; W248-H252 PolarHBondContact O-N 3.04Å; W248-H252 PolarHBondContact O-ND1 3.3Å
253	D	93.9	Very high	95.3	Very high	8 Å²	8	49.2 Å²	49.2	4%	0.043	28%	0.28	C	S	.	.	S	Bend	trans	-147	53.7	-175	-156.5	-17.5	0	0	0	112.7	R200 F201 Y225 V249 G255 A256	R200-D253 IonicContact CZ-OD2 2.88Å; R200-D253 IonicContact NH1-OD2 3.21Å; R200-D253 PolarHBondContact NH1-OD2 3.47Å; F201-D253 VanDerWaalsContact CZ-CA 3.49Å; F201-D253 HydrophobicContact CZ-CB 3.92Å; F201-D253 WeakPolarHBondContact CZ-OD1 3.49Å; Y225-D253 HydrophobicContact CE2-CB 4.05Å; Y225-D253 PolarHBondContact OH-OD2 3.07Å; V249-D253 HydrophobicContact CG1-CB 4.42Å; V249-D253 CarbonylContact O-C 3.59Å; V249-D253 VanDerWaalsContact O-CA 3.24Å; V249-D253 WeakPolarHBondContact O-CA 3.44Å; V249-D253 PolarHBondContact O-N 2.93Å; D253-G255 PolarHBondContact O-N 3.08Å; D253-A256 HydrophobicContact CB-CB 4.12Å; D253-A256 VanDerWaalsContact O-CB 3.24Å; D253-A256 WeakPolarHBondContact O-CB 3.44Å; D253-A256 PolarHBondContact O-N 3.2Å
254	S	86.6	Confident	95.2	Very high	85 Å²	85	48.8 Å²	48.8	59%	0.594	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	125.1	-176.6	61.1	0	0	0	0	112.2	V249	V249-S254 PolarHBondContact O-N 2.87Å
255	G	85.1	Confident	95.1	Very high	78 Å²	78	43.9 Å²	43.9	80%	0.804	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	-7.2	-178.3	0	0	0	0	0	115.2	D253	D253-G255 PolarHBondContact O-N 3.08Å
256	A	94.6	Very high	95	Very high	18 Å²	18	44 Å²	44	15%	0.149	25%	0.252	C	S	.	.			trans	-64.6	144.2	172	0	0	0	0	0	111.9	Y225 V249 D253	Y225-A256 HydrophobicContact CD2-CB 3.87Å; Y225-A256 HydrophobicContact CE2-CB 3.56Å; V249-A256 HydrophobicContact CG1-CB 3.97Å; D253-A256 HydrophobicContact CB-CB 4.12Å; D253-A256 VanDerWaalsContact O-CB 3.24Å; D253-A256 WeakPolarHBondContact O-CB 3.44Å; D253-A256 PolarHBondContact O-N 3.2Å
257	A	97.1	Very high	94.8	Very high	33 Å²	33	42.6 Å²	42.6	27%	0.273	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.3	178	0	0	0	0	0	110.5	I224 Y225 V296	I224-A257 HydrophobicContact CG2-CB 4.19Å; Y225-A257 PolarHBondContact N-O 3.09Å; A257-V296 HydrophobicContact CB-CG1 3.77Å
258	I	97.8	Very high	94.6	Very high	40 Å²	40	39.3 Å²	39.3	21%	0.205	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.8	171.1	-51.2	175.4	0	0	0	107.5	Y225 V227 I245 K246 V249	Y225-I258 WeakPolarHBondContact O-CA 3.49Å; V227-I258 HydrophobicContact CG2-CG2 3.62Å; I245-I258 HydrophobicContact CG2-CD1 4.41Å; I245-I258 HydrophobicContact CG2-CG2 4.26Å; K246-I258 HydrophobicContact CB-CD1 4.2Å; K246-I258 HydrophobicContact CD-CD1 3.7Å; V249-I258 HydrophobicContact CB-CD1 3.72Å; V249-I258 HydrophobicContact CB-CG1 4.28Å; V249-I258 HydrophobicContact CG1-CD1 3.9Å; V249-I258 HydrophobicContact CG1-CG1 4.02Å; V249-I258 HydrophobicContact CG2-CD1 3.84Å; V249-I258 HydrophobicContact CG2-CG1 4.14Å
259	I	97.6	Very high	94.4	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	99.4	-175.6	-50.5	179.6	0	0	0	109	I224 Y225 L226 V227 M289 I293 V296	I224-I259 HydrophobicContact CG2-CD1 3.9Å; I224-I259 HydrophobicContact CG2-CG1 4.31Å; Y225-I259 PolarHBondContact O-N 2.73Å; L226-I259 HydrophobicContact CD2-CB 3.98Å; L226-I259 HydrophobicContact CD2-CD1 4.25Å; L226-I259 HydrophobicContact CD2-CG1 4.46Å; V227-I259 PolarHBondContact N-O 3.04Å; I259-M289 HydrophobicContact CG2-CE 3.57Å; I259-I293 HydrophobicContact CD1-CG1 4.15Å; I259-I293 HydrophobicContact CG2-CD1 4.43Å; I259-I293 HydrophobicContact CG2-CG1 3.85Å; I259-V296 HydrophobicContact CD1-CB 4.04Å; I259-V296 HydrophobicContact CD1-CG1 4.15Å; I259-V296 HydrophobicContact CD1-CG2 4.1Å
260	P	97.3	Very high	94.1	Very high	39 Å²	39	41.7 Å²	41.7	25%	0.253	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	131.8	165.6	-17.6	32	0	0	0	110.5	M229 L242	M229-P260 HydrophobicContact SD-CB 3.8Å; L242-P260 HydrophobicContact CD2-CB 4.3Å; L242-P260 HydrophobicContact CD2-CG 3.76Å
261	F	97.3	Very high	93.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	173.3	173.7	83.5	-65.4	0	0	0	109.4	F37 M122 L226 V227 N228 M229 A263 E266 M289 I293	F37-F261 AromaticContact CD2-CE2 3.76Å; F37-F261 HydrophobicContact CD2-CE2 3.76Å; F37-F261 HydrophobicContact CD2-CZ 4.04Å; F37-F261 HydrophobicContact CE2-CE2 4.46Å; F37-F261 HydrophobicContact CG-CZ 4.48Å; M122-F261 HydrophobicContact CE-CE1 4.29Å; M122-F261 HydrophobicContact CE-CZ 3.76Å; M122-F261 HydrophobicContact SD-CZ 4.42Å; L226-F261 HydrophobicContact CB-CD1 4.27Å; L226-F261 HydrophobicContact CB-CE1 3.82Å; V227-F261 PolarHBondContact O-N 3.03Å; N228-F261 HydrophobicContact CB-CE1 3.71Å; N228-F261 HydrophobicContact CB-CZ 3.97Å; M229-F261 PolarHBondContact N-O 3.04Å; F261-A263 HydrophobicContact CE2-CB 3.88Å; F261-A263 HydrophobicContact CZ-CB 4.33Å; F261-E266 HydrophobicContact CD2-CG 4.34Å; F261-M289 HydrophobicContact CB-CB 3.81Å; F261-M289 HydrophobicContact CB-CG 4.1Å; F261-I293 HydrophobicContact CB-CD1 4.16Å; F261-I293 HydrophobicContact CD1-CD1 4.48Å; F261-I293 HydrophobicContact CD2-CD1 4.18Å; F261-I293 HydrophobicContact CG-CD1 4.02Å
262	S	96.5	Very high	93.7	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.007	24%	0.236	C	C	.	.			trans	-130.5	111.5	172.4	178.2	0	0	0	0	109.2	M229 E231 D264 L265 E266	M229-S262 WeakPolarHBondContact O-CA 3.33Å; M229-S262 WeakPolarHBondContact O-CB 3.28Å; M229-S262 PolarHBondContact O-OG 3.21Å; E231-S262 PolarHBondContact N-OG 2.96Å; S262-D264 VanDerWaalsContact C-N 3.26Å; S262-D264 PolarHBondContact O-N 2.93Å; S262-L265 PolarHBondContact O-N 3.28Å; S262-L265 PolarHBondContact OG-N 3.5Å; S262-E266 WeakPolarHBondContact O-CG 3.33Å; S262-E266 PolarHBondContact O-N 2.86Å
263	A	94.6	Very high	93.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-39.4	-180	0	0	0	0	0	111.6	T36 I40 N228 F261 L265 E266 Q267	T36-A263 HydrophobicContact CG2-CB 4.02Å; I40-A263 HydrophobicContact CD1-CB 4.36Å; I40-A263 WeakPolarHBondContact CD1-O 3.35Å; N228-A263 PolarHBondContact OD1-N 3.24Å; F261-A263 HydrophobicContact CE2-CB 3.88Å; F261-A263 HydrophobicContact CZ-CB 4.33Å; A263-L265 VanDerWaalsContact C-N 3.33Å; A263-L265 PolarHBondContact O-N 2.57Å; A263-E266 PolarHBondContact O-N 3.28Å; A263-Q267 WeakPolarHBondContact O-CB 3.48Å; A263-Q267 PolarHBondContact O-N 2.95Å
264	D	93.5	Very high	93.5	Very high	77 Å²	77	42.3 Å²	42.3	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-62.7	-41.2	177.8	-60.2	-19.4	0	0	0	111.7	S262 Q267 K268	S262-D264 VanDerWaalsContact C-N 3.26Å; S262-D264 PolarHBondContact O-N 2.93Å; D264-Q267 PolarHBondContact O-N 3.45Å; D264-K268 WeakPolarHBondContact O-CB 3.14Å; D264-K268 PolarHBondContact O-N 3.47Å
265	L	94.7	Very high	93.9	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-68	-43.4	178	-173.1	56.3	0	0	0	111.7	E231 F234 L235 S262 A263 Q267 K268 L269 Y280 F286	E231-L265 HydrophobicContact CG-CB 4.46Å; E231-L265 HydrophobicContact CG-CD1 3.94Å; F234-L265 HydrophobicContact CD1-CD2 3.41Å; F234-L265 VanDerWaalsContact CD1-CD2 3.41Å; F234-L265 HydrophobicContact CE1-CD2 3.7Å; F234-L265 HydrophobicContact CG-CD2 4.47Å; L235-L265 HydrophobicContact CD2-CD2 4.08Å; L235-L265 HydrophobicContact CG-CD2 4.45Å; S262-L265 PolarHBondContact O-N 3.28Å; S262-L265 PolarHBondContact OG-N 3.5Å; A263-L265 VanDerWaalsContact C-N 3.33Å; A263-L265 PolarHBondContact O-N 2.57Å; L265-Q267 VanDerWaalsContact C-N 3.31Å; L265-Q267 PolarHBondContact O-N 3.22Å; L265-K268 WeakPolarHBondContact O-CB 3.28Å; L265-K268 PolarHBondContact O-N 3Å; L265-L269 WeakPolarHBondContact O-CG 3.09Å; L265-L269 PolarHBondContact O-N 2.87Å; L265-Y280 HydrophobicContact CD1-CE1 3.81Å; L265-F286 HydrophobicContact CD1-CE1 4.31Å; L265-F286 HydrophobicContact CD1-CE2 4.1Å; L265-F286 HydrophobicContact CD1-CZ 3.62Å; L265-F286 HydrophobicContact CD2-CD2 3.81Å; L265-F286 HydrophobicContact CD2-CE1 4.34Å; L265-F286 HydrophobicContact CD2-CE2 3.39Å; L265-F286 HydrophobicContact CD2-CG 4.44Å; L265-F286 HydrophobicContact CD2-CZ 3.7Å; L265-F286 HydrophobicContact CG-CE2 3.67Å; L265-F286 HydrophobicContact CG-CZ 3.75Å
266	E	95.4	Very high	94.4	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.019	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-37.1	175.5	-63.6	-63.2	176.8	0	0	111.6	I40 F261 S262 A263 L269 S270 T288 M289 L290	I40-E266 HydrophobicContact CD1-CB 3.96Å; I40-E266 HydrophobicContact CG2-CB 4.12Å; F261-E266 HydrophobicContact CD2-CG 4.34Å; S262-E266 WeakPolarHBondContact O-CG 3.33Å; S262-E266 PolarHBondContact O-N 2.86Å; A263-E266 PolarHBondContact O-N 3.28Å; E266-L269 PolarHBondContact O-N 2.79Å; E266-S270 WeakPolarHBondContact O-CB 3.23Å; E266-S270 PolarHBondContact O-N 3.49Å; E266-T288 VanDerWaalsContact CD-OG1 3.24Å; E266-T288 WeakPolarHBondContact OE1-CA 3.27Å; E266-T288 PolarHBondContact OE1-OG1 3.44Å; E266-T288 VanDerWaalsContact OE2-CB 3.29Å; E266-T288 WeakPolarHBondContact OE2-CB 3.46Å; E266-T288 PolarHBondContact OE2-OG1 3.32Å; E266-M289 PolarHBondContact OE1-N 2.91Å; E266-L290 HydrophobicContact CB-CD1 4.3Å; E266-L290 HydrophobicContact CB-CG 4.41Å; E266-L290 HydrophobicContact CG-CD1 4.47Å; E266-L290 HydrophobicContact CG-CD2 4.39Å; E266-L290 HydrophobicContact CG-CG 4.09Å
267	Q	92.9	Very high	94.4	Very high	67 Å²	67	46.5 Å²	46.5	31%	0.313	25%	0.25	S	S	.	.	H	α-helix	trans	-62.9	-47.9	173.3	179.2	167.5	2.6	0	0	111.1	I40 A263 D264 L265 L269 S270 E271	I40-Q267 HydrophobicContact CD1-CB 3.98Å; I40-Q267 HydrophobicContact CG1-CB 4.12Å; A263-Q267 WeakPolarHBondContact O-CB 3.48Å; A263-Q267 PolarHBondContact O-N 2.95Å; D264-Q267 PolarHBondContact O-N 3.45Å; L265-Q267 VanDerWaalsContact C-N 3.31Å; L265-Q267 PolarHBondContact O-N 3.22Å; Q267-L269 VanDerWaalsContact C-N 3.31Å; Q267-L269 PolarHBondContact O-N 2.88Å; Q267-S270 WeakPolarHBondContact O-CA 3.38Å; Q267-S270 WeakPolarHBondContact O-CB 3.45Å; Q267-S270 PolarHBondContact O-N 2.78Å; Q267-S270 PolarHBondContact O-OG 3.12Å; Q267-E271 WeakPolarHBondContact CG-OE1 3.42Å; Q267-E271 PolarHBondContact NE2-OE1 3.38Å; Q267-E271 VanDerWaalsContact NE2-OE1 3.08Å; Q267-E271 WeakPolarHBondContact O-CG 3.19Å; Q267-E271 PolarHBondContact O-N 3.1Å
268	K	93.8	Very high	94.3	Very high	68 Å²	68	49.1 Å²	49.1	30%	0.296	26%	0.262	S	S	.	.	H	α-helix	trans	-56.7	-44.4	176.5	180	178.2	-176.2	177	0	111.8	E231 D264 L265 S270 E271 M272 Y280	E231-K268 IonicContact OE1-NZ 3.31Å; E231-K268 PolarHBondContact OE1-NZ 2.95Å; E231-K268 IonicContact OE2-NZ 3.96Å; D264-K268 WeakPolarHBondContact O-CB 3.14Å; D264-K268 PolarHBondContact O-N 3.47Å; L265-K268 WeakPolarHBondContact O-CB 3.28Å; L265-K268 PolarHBondContact O-N 3Å; K268-S270 VanDerWaalsContact C-N 3.32Å; K268-S270 PolarHBondContact O-N 3.03Å; K268-E271 PolarHBondContact O-N 3.18Å; K268-M272 HydrophobicContact CD-CE 4.27Å; K268-M272 HydrophobicContact CG-CE 3.73Å; K268-M272 WeakPolarHBondContact O-CG 3.3Å; K268-Y280 PolarHBondContact NZ-OH 3.17Å
269	L	93.1	Very high	94.2	Very high	16 Å²	16	49.9 Å²	49.9	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-36.9	174.6	-69.6	179.5	0	0	0	112.4	L265 E266 Q267 E271 M272 A277 Y280 M281 F286	L265-L269 WeakPolarHBondContact O-CG 3.09Å; L265-L269 PolarHBondContact O-N 2.87Å; E266-L269 PolarHBondContact O-N 2.79Å; Q267-L269 VanDerWaalsContact C-N 3.31Å; Q267-L269 PolarHBondContact O-N 2.88Å; L269-E271 PolarHBondContact O-N 3.28Å; L269-M272 HydrophobicContact CD2-SD 4.21Å; L269-M272 PolarHBondContact O-N 3.27Å; L269-A277 HydrophobicContact CD2-CB 4.02Å; L269-Y280 HydrophobicContact CD2-CD1 3.97Å; L269-M281 HydrophobicContact CD1-CG 4.06Å; L269-M281 HydrophobicContact CD1-SD 3.96Å; L269-M281 HydrophobicContact CD2-CG 3.98Å; L269-F286 HydrophobicContact CD1-CE2 3.79Å; L269-F286 HydrophobicContact CD1-CZ 4.04Å; L269-F286 HydrophobicContact CD2-CZ 4.2Å; L269-F286 HydrophobicContact CG-CZ 4.39Å
270	S	89	Confident	94.1	Very high	47 Å²	47	51.7 Å²	51.7	33%	0.329	28%	0.282	S	S	.	.	H	α-helix	trans	-68.4	-15.3	178.6	80.5	0	0	0	0	114.3	E266 Q267 K268	E266-S270 WeakPolarHBondContact O-CB 3.23Å; E266-S270 PolarHBondContact O-N 3.49Å; Q267-S270 WeakPolarHBondContact O-CA 3.38Å; Q267-S270 WeakPolarHBondContact O-CB 3.45Å; Q267-S270 PolarHBondContact O-N 2.78Å; Q267-S270 PolarHBondContact O-OG 3.12Å; K268-S270 VanDerWaalsContact C-N 3.32Å; K268-S270 PolarHBondContact O-N 3.03Å
271	E	90.3	Very high	94.1	Very high	123 Å²	123	51.6 Å²	51.6	58%	0.575	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-7.4	179.6	-68.3	169.7	-175	0	0	112.5	Q267 K268 L269	Q267-E271 WeakPolarHBondContact CG-OE1 3.42Å; Q267-E271 PolarHBondContact NE2-OE1 3.38Å; Q267-E271 VanDerWaalsContact NE2-OE1 3.08Å; Q267-E271 WeakPolarHBondContact O-CG 3.19Å; Q267-E271 PolarHBondContact O-N 3.1Å; K268-E271 PolarHBondContact O-N 3.18Å; L269-E271 PolarHBondContact O-N 3.28Å
272	M	92.4	Very high	94.1	Very high	52 Å²	52	59.9 Å²	59.9	26%	0.256	32%	0.315	S	S	.	.	S	Bend	trans	-92.3	160.1	177	-70.6	172.7	176.7	0	0	111.9	K268 L269 E276 A277 Y280	K268-M272 HydrophobicContact CD-CE 4.27Å; K268-M272 HydrophobicContact CG-CE 3.73Å; K268-M272 WeakPolarHBondContact O-CG 3.3Å; L269-M272 HydrophobicContact CD2-SD 4.21Å; L269-M272 PolarHBondContact O-N 3.27Å; M272-E276 HydrophobicContact CB-CB 3.99Å; M272-E276 HydrophobicContact CG-CB 4.42Å; M272-A277 HydrophobicContact CB-CB 4.09Å; M272-Y280 HydrophobicContact CE-CD2 4.15Å; M272-Y280 HydrophobicContact CE-CG 4.14Å; M272-Y280 HydrophobicContact SD-CG 4.28Å
273	S	93.1	Very high	94	Very high	41 Å²	41	67.2 Å²	67.2	29%	0.287	35%	0.349	S	S	.	.			trans	-66	159	165	98	0	0	0	0	111	E275 E276 A277	S273-E275 VanDerWaalsContact C-N 3.25Å; S273-E275 PolarHBondContact O-N 2.89Å; S273-E275 PolarHBondContact OG-N 2.89Å; S273-E275 PolarHBondContact OG-OE2 3.45Å; S273-E276 PolarHBondContact N-OE2 3.1Å; S273-E276 VanDerWaalsContact N-OE2 3.08Å; S273-E276 PolarHBondContact O-N 3.39Å; S273-E276 PolarHBondContact OG-N 3.42Å; S273-A277 VanDerWaalsContact O-CB 3.31Å; S273-A277 WeakPolarHBondContact O-CB 3.21Å; S273-A277 PolarHBondContact O-N 3.45Å
274	P	90.4	Very high	94	Very high	96 Å²	96	69.7 Å²	69.7	62%	0.623	36%	0.362	S	S	*	.	H	α-helix	trans	-54.7	-39.3	175	-26.7	36	0	0	0	113.5	T278	P274-T278 VanDerWaalsContact O-CB 3.32Å; P274-T278 WeakPolarHBondContact O-CB 3.26Å; P274-T278 PolarHBondContact O-N 3.44Å; P274-T278 PolarHBondContact O-OG1 2.83Å
275	E	94.6	Very high	94.1	Very high	139 Å²	139	73.8 Å²	73.8	65%	0.65	38%	0.379	S	S	*	.	H	α-helix	trans	-68.8	-44.2	178.4	-56.8	75.7	-163.3	0	0	111.7	S273 T278 A279	S273-E275 VanDerWaalsContact C-N 3.25Å; S273-E275 PolarHBondContact O-N 2.89Å; S273-E275 PolarHBondContact OG-N 2.89Å; S273-E275 PolarHBondContact OG-OE2 3.45Å; E275-T278 PolarHBondContact O-N 3.17Å; E275-A279 WeakPolarHBondContact O-CB 3.27Å; E275-A279 PolarHBondContact O-N 3.1Å
276	E	96.1	Very high	94.1	Very high	119 Å²	119	74.5 Å²	74.5	56%	0.556	38%	0.382	S	S	*	.	H	α-helix	trans	-63.9	-47	176.9	-71.4	175.9	161.5	0	0	111.5	M272 S273 T278 A279 Y280	M272-E276 HydrophobicContact CB-CB 3.99Å; M272-E276 HydrophobicContact CG-CB 4.42Å; S273-E276 PolarHBondContact N-OE2 3.1Å; S273-E276 VanDerWaalsContact N-OE2 3.08Å; S273-E276 PolarHBondContact O-N 3.39Å; S273-E276 PolarHBondContact OG-N 3.42Å; E276-T278 VanDerWaalsContact C-N 3.31Å; E276-T278 PolarHBondContact O-N 3.5Å; E276-A279 PolarHBondContact O-N 2.68Å; E276-Y280 WeakPolarHBondContact O-CB 3.34Å; E276-Y280 PolarHBondContact O-N 2.86Å
277	A	94.3	Very high	94	Very high	11 Å²	11	79 Å²	79	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-59	-42.9	175.6	0	0	0	0	0	111.4	L269 M272 S273 Y280 M281	L269-A277 HydrophobicContact CD2-CB 4.02Å; M272-A277 HydrophobicContact CB-CB 4.09Å; S273-A277 VanDerWaalsContact O-CB 3.31Å; S273-A277 WeakPolarHBondContact O-CB 3.21Å; S273-A277 PolarHBondContact O-N 3.45Å; A277-Y280 PolarHBondContact O-N 3.47Å; A277-M281 WeakPolarHBondContact O-CB 3.41Å; A277-M281 WeakPolarHBondContact O-CE 3.23Å; A277-M281 WeakPolarHBondContact O-CG 3.39Å; A277-M281 PolarHBondContact O-N 3.17Å
278	T	95	Very high	94.1	Very high	87 Å²	87	77.7 Å²	77.7	53%	0.534	41%	0.406	S	S	.	.	H	α-helix	trans	-64.1	-44.1	176.9	-60.1	0	0	0	0	111.7	P274 E275 E276 K282	P274-T278 VanDerWaalsContact O-CB 3.32Å; P274-T278 WeakPolarHBondContact O-CB 3.26Å; P274-T278 PolarHBondContact O-N 3.44Å; P274-T278 PolarHBondContact O-OG1 2.83Å; E275-T278 PolarHBondContact O-N 3.17Å; E276-T278 VanDerWaalsContact C-N 3.31Å; E276-T278 PolarHBondContact O-N 3.5Å; T278-K282 WeakPolarHBondContact O-CB 3.45Å; T278-K282 PolarHBondContact O-N 3.21Å
279	A	96.5	Very high	94.2	Very high	57 Å²	57	75.7 Å²	75.7	47%	0.471	40%	0.398	S	S	.	.	H	α-helix	trans	-62.8	-45.3	176.6	0	0	0	0	0	111.5	E275 E276 K282 E283	E275-A279 WeakPolarHBondContact O-CB 3.27Å; E275-A279 PolarHBondContact O-N 3.1Å; E276-A279 PolarHBondContact O-N 2.68Å; A279-K282 PolarHBondContact O-N 3.01Å; A279-E283 WeakPolarHBondContact O-CB 3.41Å; A279-E283 PolarHBondContact O-N 3.08Å
280	Y	96.3	Very high	94.2	Very high	39 Å²	39	75.6 Å²	75.6	15%	0.153	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-44.7	179.7	-173.2	-95.9	0	0	0	112.6	E231 L265 K268 L269 M272 E276 A277 K282 E283 N284 F286	E231-Y280 PolarHBondContact OE1-OH 3.32Å; L265-Y280 HydrophobicContact CD1-CE1 3.81Å; K268-Y280 PolarHBondContact NZ-OH 3.17Å; L269-Y280 HydrophobicContact CD2-CD1 3.97Å; M272-Y280 HydrophobicContact CE-CD2 4.15Å; M272-Y280 HydrophobicContact CE-CG 4.14Å; M272-Y280 HydrophobicContact SD-CG 4.28Å; E276-Y280 WeakPolarHBondContact O-CB 3.34Å; E276-Y280 PolarHBondContact O-N 2.86Å; A277-Y280 PolarHBondContact O-N 3.47Å; Y280-K282 VanDerWaalsContact C-N 3.33Å; Y280-K282 PolarHBondContact O-N 2.98Å; Y280-E283 PolarHBondContact O-N 3.27Å; Y280-N284 WeakPolarHBondContact CE2-ND2 3.28Å; Y280-N284 WeakPolarHBondContact O-CB 3.47Å; Y280-N284 PolarHBondContact O-N 2.85Å; Y280-N284 VanDerWaalsContact O-N 3.08Å; Y280-N284 PolarHBondContact O-ND2 3.4Å; Y280-F286 AromaticContact CD1-CE1 3.76Å; Y280-F286 HydrophobicContact CD1-CE1 3.76Å; Y280-F286 AromaticContact CD1-CZ 3.85Å; Y280-F286 HydrophobicContact CD1-CZ 3.85Å; Y280-F286 AromaticContact CE1-CE1 3.73Å; Y280-F286 HydrophobicContact CE1-CE1 3.73Å; Y280-F286 AromaticContact CE1-CZ 3.87Å; Y280-F286 HydrophobicContact CE1-CZ 3.87Å
281	M	96.5	Very high	94.4	Very high	37 Å²	37	75.4 Å²	75.4	18%	0.182	40%	0.395	C	S	.	.	H	α-helix	trans	-60.5	-42	174.5	-80.8	-170.8	-67.1	0	0	111.9	L269 A277 E285 F286 T288	L269-M281 HydrophobicContact CD1-CG 4.06Å; L269-M281 HydrophobicContact CD1-SD 3.96Å; L269-M281 HydrophobicContact CD2-CG 3.98Å; A277-M281 WeakPolarHBondContact O-CB 3.41Å; A277-M281 WeakPolarHBondContact O-CE 3.23Å; A277-M281 WeakPolarHBondContact O-CG 3.39Å; A277-M281 PolarHBondContact O-N 3.17Å; M281-E285 PolarHBondContact O-N 3.43Å; M281-F286 HydrophobicContact CB-CE1 4.46Å; M281-F286 VanDerWaalsContact CB-O 3.31Å; M281-F286 WeakPolarHBondContact CB-O 3.31Å; M281-F286 HydrophobicContact CG-CD2 4.37Å; M281-F286 HydrophobicContact CG-CE1 4.1Å; M281-F286 HydrophobicContact CG-CE2 3.87Å; M281-F286 HydrophobicContact CG-CZ 3.71Å; M281-F286 PolarHBondContact O-N 3.41Å; M281-F286 VanDerWaalsContact O-N 3.14Å; M281-T288 HydrophobicContact SD-CG2 4.3Å; M281-T288 PolarHBondContact SD-N 3Å; M281-T288 VanDerWaalsContact SD-N 3.41Å
282	K	96.4	Very high	94.7	Very high	175 Å²	175	74.8 Å²	74.8	76%	0.761	39%	0.391	S	S	*	.	H	α-helix	trans	-66.7	-43	177.9	-175.8	178.5	178.3	-178.2	0	112.3	T278 A279 Y280 N284	T278-K282 WeakPolarHBondContact O-CB 3.45Å; T278-K282 PolarHBondContact O-N 3.21Å; A279-K282 PolarHBondContact O-N 3.01Å; Y280-K282 VanDerWaalsContact C-N 3.33Å; Y280-K282 PolarHBondContact O-N 2.98Å; K282-N284 VanDerWaalsContact C-N 3.33Å
283	E	95.8	Very high	94.9	Very high	155 Å²	155	72.4 Å²	72.4	72%	0.724	38%	0.379	S	S	*	.	H	α-helix	trans	-63.8	-38.3	178.5	-176	-178.6	171	0	0	112.3	A279 Y280	A279-E283 WeakPolarHBondContact O-CB 3.41Å; A279-E283 PolarHBondContact O-N 3.08Å; Y280-E283 PolarHBondContact O-N 3.27Å
284	N	94.8	Very high	95	Very high	53 Å²	53	70.8 Å²	70.8	28%	0.283	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	8	-176.4	-68.4	-86.5	0	0	0	113.8	L235 Y280 K282 F286	L235-N284 HydrophobicContact CD2-CB 4.12Å; Y280-N284 WeakPolarHBondContact CE2-ND2 3.28Å; Y280-N284 WeakPolarHBondContact O-CB 3.47Å; Y280-N284 PolarHBondContact O-N 2.85Å; Y280-N284 VanDerWaalsContact O-N 3.08Å; Y280-N284 PolarHBondContact O-ND2 3.4Å; K282-N284 VanDerWaalsContact C-N 3.33Å; N284-F286 VanDerWaalsContact C-N 3.34Å; N284-F286 HydrophobicContact CB-CD1 3.57Å; N284-F286 HydrophobicContact CB-CE1 3.73Å; N284-F286 PolarHBondContact O-N 3.25Å
285	E	94.2	Very high	95.3	Very high	163 Å²	163	70.7 Å²	70.7	76%	0.762	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	44.7	176.1	-58.2	-174.2	169.9	0	0	114.9	M281	M281-E285 PolarHBondContact O-N 3.43Å
286	F	94.6	Very high	95.4	Very high	16 Å²	16	65.2 Å²	65.2	7%	0.07	33%	0.33	C	S	.	.			trans	-136.8	167.8	175.3	81.9	-79.5	0	0	0	111.8	F234 L235 L265 L269 Y280 M281 N284	F234-F286 HydrophobicContact CE1-CB 4.31Å; F234-F286 AromaticContact CE1-CD2 3.86Å; F234-F286 HydrophobicContact CE1-CD2 3.86Å; F234-F286 HydrophobicContact CE1-CG 4.35Å; L235-F286 HydrophobicContact CD2-CB 4.07Å; L235-F286 HydrophobicContact CD2-CD1 3.42Å; L235-F286 VanDerWaalsContact CD2-CD1 3.42Å; L235-F286 HydrophobicContact CD2-CE1 3.93Å; L235-F286 HydrophobicContact CD2-CG 3.75Å; L265-F286 HydrophobicContact CD1-CE1 4.31Å; L265-F286 HydrophobicContact CD1-CE2 4.1Å; L265-F286 HydrophobicContact CD1-CZ 3.62Å; L265-F286 HydrophobicContact CD2-CD2 3.81Å; L265-F286 HydrophobicContact CD2-CE1 4.34Å; L265-F286 HydrophobicContact CD2-CE2 3.39Å; L265-F286 HydrophobicContact CD2-CG 4.44Å; L265-F286 HydrophobicContact CD2-CZ 3.7Å; L265-F286 HydrophobicContact CG-CE2 3.67Å; L265-F286 HydrophobicContact CG-CZ 3.75Å; L269-F286 HydrophobicContact CD1-CE2 3.79Å; L269-F286 HydrophobicContact CD1-CZ 4.04Å; L269-F286 HydrophobicContact CD2-CZ 4.2Å; L269-F286 HydrophobicContact CG-CZ 4.39Å; Y280-F286 AromaticContact CD1-CE1 3.76Å; Y280-F286 HydrophobicContact CD1-CE1 3.76Å; Y280-F286 AromaticContact CD1-CZ 3.85Å; Y280-F286 HydrophobicContact CD1-CZ 3.85Å; Y280-F286 AromaticContact CE1-CE1 3.73Å; Y280-F286 HydrophobicContact CE1-CE1 3.73Å; Y280-F286 AromaticContact CE1-CZ 3.87Å; Y280-F286 HydrophobicContact CE1-CZ 3.87Å; M281-F286 HydrophobicContact CB-CE1 4.46Å; M281-F286 VanDerWaalsContact CB-O 3.31Å; M281-F286 WeakPolarHBondContact CB-O 3.31Å; M281-F286 HydrophobicContact CG-CD2 4.37Å; M281-F286 HydrophobicContact CG-CE1 4.1Å; M281-F286 HydrophobicContact CG-CE2 3.87Å; M281-F286 HydrophobicContact CG-CZ 3.71Å; M281-F286 PolarHBondContact O-N 3.41Å; M281-F286 VanDerWaalsContact O-N 3.14Å; N284-F286 VanDerWaalsContact C-N 3.34Å; N284-F286 HydrophobicContact CB-CD1 3.57Å; N284-F286 HydrophobicContact CB-CE1 3.73Å; N284-F286 PolarHBondContact O-N 3.25Å
287	T	93.8	Very high	95.4	Very high	98 Å²	98	59.5 Å²	59.5	60%	0.601	30%	0.304	S	S	*	.			trans	-126.9	151.3	172.2	58.4	0	0	0	0	108.9	M289	T287-M289 PolarHBondContact O-N 2.86Å
288	T	94.3	Very high	95.5	Very high	40 Å²	40	59.3 Å²	59.3	25%	0.245	30%	0.3	C	S	.	.			trans	-53.2	139.5	167.1	173.5	0	0	0	0	111.1	E266 M281 L290 P291	E266-T288 VanDerWaalsContact CD-OG1 3.24Å; E266-T288 WeakPolarHBondContact OE1-CA 3.27Å; E266-T288 PolarHBondContact OE1-OG1 3.44Å; E266-T288 VanDerWaalsContact OE2-CB 3.29Å; E266-T288 WeakPolarHBondContact OE2-CB 3.46Å; E266-T288 PolarHBondContact OE2-OG1 3.32Å; M281-T288 HydrophobicContact SD-CG2 4.3Å; M281-T288 PolarHBondContact SD-N 3Å; M281-T288 VanDerWaalsContact SD-N 3.41Å; T288-L290 PolarHBondContact OG1-N 3.45Å; T288-P291 HydrophobicContact CG2-CG 3.91Å
289	M	95.8	Very high	95.4	Very high	25 Å²	25	60.4 Å²	60.4	12%	0.123	30%	0.3	C	S	.	.	S	Bend	trans	-92.8	-12.8	176.4	-63.4	-58	-63.8	0	0	112.2	F234 I259 F261 E266 T287 K292 I293	F234-M289 HydrophobicContact CE2-CG 3.83Å; F234-M289 HydrophobicContact CZ-CG 3.61Å; F234-M289 HydrophobicContact CZ-SD 4.25Å; I259-M289 HydrophobicContact CG2-CE 3.57Å; F261-M289 HydrophobicContact CB-CB 3.81Å; F261-M289 HydrophobicContact CB-CG 4.1Å; E266-M289 PolarHBondContact OE1-N 2.91Å; T287-M289 PolarHBondContact O-N 2.86Å; M289-K292 HydrophobicContact CE-CD 3.75Å; M289-K292 WeakPolarHBondContact O-CB 3.48Å; M289-K292 PolarHBondContact O-N 3.12Å; M289-K292 VanDerWaalsContact O-N 3.09Å; M289-I293 HydrophobicContact CB-CD1 4.32Å; M289-I293 WeakPolarHBondContact O-CG1 3.42Å; M289-I293 PolarHBondContact O-N 2.79Å
290	L	94	Very high	95.4	Very high	15 Å²	15	59 Å²	59	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-54.3	-46.1	179.6	-64.9	171.1	0	0	0	112.7	F37 I40 L41 E266 T288 K292 I293 I294	F37-L290 HydrophobicContact CE2-CD2 4.24Å; I40-L290 HydrophobicContact CG2-CD1 3.4Å; I40-L290 VanDerWaalsContact CG2-CD1 3.4Å; I40-L290 HydrophobicContact CG2-CD2 3.91Å; I40-L290 HydrophobicContact CG2-CG 4.24Å; L41-L290 HydrophobicContact CD2-CD2 4.15Å; E266-L290 HydrophobicContact CB-CD1 4.3Å; E266-L290 HydrophobicContact CB-CG 4.41Å; E266-L290 HydrophobicContact CG-CD1 4.47Å; E266-L290 HydrophobicContact CG-CD2 4.39Å; E266-L290 HydrophobicContact CG-CG 4.09Å; T288-L290 PolarHBondContact OG1-N 3.45Å; L290-K292 VanDerWaalsContact C-N 3.27Å; L290-K292 PolarHBondContact O-N 2.94Å; L290-I293 PolarHBondContact O-N 3.38Å; L290-I293 VanDerWaalsContact O-N 3.16Å; L290-I294 WeakPolarHBondContact O-CD1 3.17Å; L290-I294 VanDerWaalsContact O-CG1 3.3Å; L290-I294 WeakPolarHBondContact O-CG1 3.43Å; L290-I294 PolarHBondContact O-N 2.91Å
291	P	93.8	Very high	95.3	Very high	42 Å²	42	57.4 Å²	57.4	27%	0.273	28%	0.279	S	S	.	.	H	α-helix	trans	-59.6	-39.3	178.4	-25.9	36.8	0	0	0	112.8	P66 T288 R295	P66-P291 HydrophobicContact CB-CB 4.37Å; P66-P291 HydrophobicContact CG-CB 3.65Å; T288-P291 HydrophobicContact CG2-CG 3.91Å; P291-R295 WeakPolarHBondContact O-CB 3.09Å; P291-R295 VanDerWaalsContact O-CG 3.26Å; P291-R295 WeakPolarHBondContact O-CG 3.29Å; P291-R295 PolarHBondContact O-N 2.93Å
292	K	96.1	Very high	95.2	Very high	111 Å²	111	59.1 Å²	59.1	48%	0.483	29%	0.287	S	S	.	.	H	α-helix	trans	-67.9	-43.5	176.9	-177.6	173.6	173.6	-179.2	0	111.4	M289 L290 I294 R295 V296	M289-K292 HydrophobicContact CE-CD 3.75Å; M289-K292 WeakPolarHBondContact O-CB 3.48Å; M289-K292 PolarHBondContact O-N 3.12Å; M289-K292 VanDerWaalsContact O-N 3.09Å; L290-K292 VanDerWaalsContact C-N 3.27Å; L290-K292 PolarHBondContact O-N 2.94Å; K292-I294 VanDerWaalsContact C-N 3.34Å; K292-I294 PolarHBondContact O-N 2.77Å; K292-R295 PolarHBondContact O-N 2.96Å; K292-V296 HydrophobicContact CG-CG2 4.15Å; K292-V296 WeakPolarHBondContact O-CB 3.45Å; K292-V296 WeakPolarHBondContact O-CG2 3.46Å; K292-V296 PolarHBondContact O-N 3.3Å
293	I	97.1	Very high	95.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-45.8	177.9	-67.6	168.3	0	0	0	110.5	F37 F120 L226 I259 F261 M289 L290 G297	F37-I293 HydrophobicContact CE2-CD1 4.09Å; F37-I293 HydrophobicContact CE2-CG2 4.07Å; F37-I293 HydrophobicContact CZ-CG2 3.81Å; F120-I293 HydrophobicContact CD1-CG2 4.45Å; F120-I293 HydrophobicContact CE1-CG2 3.76Å; F120-I293 HydrophobicContact CZ-CG2 3.84Å; L226-I293 HydrophobicContact CD1-CG2 4.14Å; L226-I293 HydrophobicContact CD2-CD1 4.17Å; L226-I293 HydrophobicContact CD2-CG1 3.94Å; L226-I293 HydrophobicContact CD2-CG2 4.1Å; I259-I293 HydrophobicContact CD1-CG1 4.15Å; I259-I293 HydrophobicContact CG2-CD1 4.43Å; I259-I293 HydrophobicContact CG2-CG1 3.85Å; F261-I293 HydrophobicContact CB-CD1 4.16Å; F261-I293 HydrophobicContact CD1-CD1 4.48Å; F261-I293 HydrophobicContact CD2-CD1 4.18Å; F261-I293 HydrophobicContact CG-CD1 4.02Å; M289-I293 HydrophobicContact CB-CD1 4.32Å; M289-I293 WeakPolarHBondContact O-CG1 3.42Å; M289-I293 PolarHBondContact O-N 2.79Å; L290-I293 PolarHBondContact O-N 3.38Å; L290-I293 VanDerWaalsContact O-N 3.16Å; I293-G297 PolarHBondContact O-N 2.88Å
294	I	95.5	Very high	95.1	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-48.6	179.6	-64	159.6	0	0	0	110.9	L41 V63 V65 L87 L290 K292 V296 G297 Y298	L41-I294 HydrophobicContact CD2-CD1 4.29Å; L41-I294 HydrophobicContact CD2-CG1 4.16Å; V63-I294 HydrophobicContact CG1-CD1 3.61Å; V63-I294 HydrophobicContact CG1-CG1 4.32Å; V65-I294 HydrophobicContact CB-CG2 4.39Å; V65-I294 HydrophobicContact CG2-CG2 4.12Å; L87-I294 HydrophobicContact CB-CG2 4.07Å; L87-I294 HydrophobicContact CD2-CB 4.41Å; L87-I294 HydrophobicContact CD2-CG2 4.1Å; L290-I294 WeakPolarHBondContact O-CD1 3.17Å; L290-I294 VanDerWaalsContact O-CG1 3.3Å; L290-I294 WeakPolarHBondContact O-CG1 3.43Å; L290-I294 PolarHBondContact O-N 2.91Å; K292-I294 VanDerWaalsContact C-N 3.34Å; K292-I294 PolarHBondContact O-N 2.77Å; I294-V296 PolarHBondContact O-N 3.4Å; I294-G297 PolarHBondContact O-N 3.38Å; I294-Y298 WeakPolarHBondContact O-CB 3.22Å; I294-Y298 PolarHBondContact O-N 3.46Å
295	R	95.5	Very high	95.3	Very high	94 Å²	94	42.4 Å²	42.4	36%	0.355	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-46.4	178.7	-73.4	175.8	-174.2	173.2	4.6	111.9	V65 P66 P291 K292 Y298 Q299	V65-R295 HydrophobicContact CG1-CG 4.37Å; P66-R295 HydrophobicContact CG-CG 4.42Å; P66-R295 VanDerWaalsContact O-CZ 3.28Å; P66-R295 PolarHBondContact O-NE 3.02Å; P66-R295 PolarHBondContact O-NH2 2.82Å; P291-R295 WeakPolarHBondContact O-CB 3.09Å; P291-R295 VanDerWaalsContact O-CG 3.26Å; P291-R295 WeakPolarHBondContact O-CG 3.29Å; P291-R295 PolarHBondContact O-N 2.93Å; K292-R295 PolarHBondContact O-N 2.96Å; R295-Y298 PolarHBondContact O-N 3.05Å; R295-Q299 WeakPolarHBondContact O-CB 3.44Å; R295-Q299 VanDerWaalsContact O-CG 3.31Å; R295-Q299 WeakPolarHBondContact O-CG 3.43Å; R295-Q299 PolarHBondContact O-N 2.88Å
296	V	97.1	Very high	95.5	Very high	23 Å²	23	34.7 Å²	34.7	14%	0.139	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-43.9	178.5	174.8	0	0	0	0	110.3	I224 A257 I259 K292 I294 Y298 Q299 T300	I224-V296 HydrophobicContact CD1-CG1 3.93Å; I224-V296 HydrophobicContact CG1-CG1 4.09Å; I224-V296 HydrophobicContact CG2-CG1 4.33Å; A257-V296 HydrophobicContact CB-CG1 3.77Å; I259-V296 HydrophobicContact CD1-CB 4.04Å; I259-V296 HydrophobicContact CD1-CG1 4.15Å; I259-V296 HydrophobicContact CD1-CG2 4.1Å; K292-V296 HydrophobicContact CG-CG2 4.15Å; K292-V296 WeakPolarHBondContact O-CB 3.45Å; K292-V296 WeakPolarHBondContact O-CG2 3.46Å; K292-V296 PolarHBondContact O-N 3.3Å; I294-V296 PolarHBondContact O-N 3.4Å; V296-Y298 VanDerWaalsContact C-N 3.33Å; V296-Y298 PolarHBondContact O-N 3.38Å; V296-Q299 PolarHBondContact O-N 2.84Å; V296-T300 VanDerWaalsContact O-CB 3.31Å; V296-T300 WeakPolarHBondContact O-CB 3.47Å; V296-T300 PolarHBondContact O-N 3.2Å; V296-T300 PolarHBondContact O-OG1 3.42Å
297	G	96.5	Very high	95.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-52.6	-50.1	173.2	0	0	0	0	0	112.7	I293 I294 Q299 T300 L301	I293-G297 PolarHBondContact O-N 2.88Å; I294-G297 PolarHBondContact O-N 3.38Å; G297-Q299 PolarHBondContact O-N 2.9Å; G297-T300 PolarHBondContact O-N 2.84Å; G297-L301 WeakPolarHBondContact O-CG 3.5Å; G297-L301 PolarHBondContact O-N 3.45Å; G297-L301 VanDerWaalsContact O-N 3.14Å
298	Y	95.6	Very high	95.8	Very high	6 Å²	6	30.7 Å²	30.7	2%	0.024	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-43.3	179.8	-163.2	-93.1	0	0	0	112.7	V65 A85 Y86 L87 I294 R295 V296 L301 L303 H304 Y305 T318	V65-Y298 HydrophobicContact CG2-CD2 3.55Å; V65-Y298 HydrophobicContact CG2-CE2 3.97Å; V65-Y298 HydrophobicContact CG2-CG 3.92Å; A85-Y298 HydrophobicContact CB-CE2 4.36Å; Y86-Y298 WeakPolarHBondContact O-CE2 3.39Å; L87-Y298 HydrophobicContact CB-CD2 4.4Å; L87-Y298 HydrophobicContact CD1-CD2 4.36Å; I294-Y298 WeakPolarHBondContact O-CB 3.22Å; I294-Y298 PolarHBondContact O-N 3.46Å; R295-Y298 PolarHBondContact O-N 3.05Å; V296-Y298 VanDerWaalsContact C-N 3.33Å; V296-Y298 PolarHBondContact O-N 3.38Å; Y298-L301 PolarHBondContact O-N 2.84Å; Y298-L303 HydrophobicContact CD1-CB 3.8Å; Y298-L303 WeakPolarHBondContact CD1-O 3.38Å; Y298-L303 HydrophobicContact CD2-CB 4.37Å; Y298-L303 HydrophobicContact CD2-CD1 4.3Å; Y298-L303 VanDerWaalsContact CE1-C 3.48Å; Y298-L303 HydrophobicContact CE1-CB 3.43Å; Y298-L303 VanDerWaalsContact CE1-CB 3.43Å; Y298-L303 HydrophobicContact CE2-CB 4.06Å; Y298-L303 HydrophobicContact CE2-CD1 3.97Å; Y298-L303 HydrophobicContact CG-CB 4.26Å; Y298-L303 PolarHBondContact O-N 2.62Å; Y298-H304 PolarHBondContact OH-O 2.74Å; Y298-Y305 HydrophobicContact CD1-CE1 4.27Å; Y298-Y305 AromaticContact CE1-CD1 3.54Å; Y298-Y305 HydrophobicContact CE1-CD1 3.54Å; Y298-Y305 AromaticContact CE1-CE1 3.67Å; Y298-Y305 HydrophobicContact CE1-CE1 3.67Å; Y298-Y305 AromaticContact CZ-CD1 3.75Å; Y298-Y305 WeakPolarHBondContact OH-CD1 3.31Å; Y298-T318 HydrophobicContact CE2-CG2 4.49Å; Y298-T318 VanDerWaalsContact OH-CB 3.27Å; Y298-T318 WeakPolarHBondContact OH-CB 3.3Å; Y298-T318 WeakPolarHBondContact OH-CG2 3.22Å; Y298-T318 PolarHBondContact OH-OG1 3.2Å
299	Q	94.4	Very high	95.9	Very high	111 Å²	111	30.5 Å²	30.5	52%	0.519	15%	0.15	S	C	.	.	H	α-helix	trans	-66.8	-36.7	176.9	-72.4	175.3	-7	0	0	112.9	R295 V296 G297 L301 Q302	R295-Q299 WeakPolarHBondContact O-CB 3.44Å; R295-Q299 VanDerWaalsContact O-CG 3.31Å; R295-Q299 WeakPolarHBondContact O-CG 3.43Å; R295-Q299 PolarHBondContact O-N 2.88Å; V296-Q299 PolarHBondContact O-N 2.84Å; G297-Q299 PolarHBondContact O-N 2.9Å; Q299-L301 VanDerWaalsContact C-N 3.3Å; Q299-Q302 WeakPolarHBondContact O-CA 3.13Å; Q299-Q302 PolarHBondContact O-N 3.36Å
300	T	95.2	Very high	95.8	Very high	27 Å²	27	30.4 Å²	30.4	17%	0.166	16%	0.155	C	C	.	.	H	α-helix	trans	-66.7	-32.2	177.6	-70.3	0	0	0	0	112	A118 P222 I224 V296 G297 Q302	A118-T300 HydrophobicContact CB-CG2 3.96Å; P222-T300 HydrophobicContact CB-CG2 3.58Å; P222-T300 HydrophobicContact CG-CG2 3.52Å; I224-T300 HydrophobicContact CD1-CG2 4.03Å; I224-T300 HydrophobicContact CG1-CG2 4.15Å; V296-T300 VanDerWaalsContact O-CB 3.31Å; V296-T300 WeakPolarHBondContact O-CB 3.47Å; V296-T300 PolarHBondContact O-N 3.2Å; V296-T300 PolarHBondContact O-OG1 3.42Å; G297-T300 PolarHBondContact O-N 2.84Å; T300-Q302 PolarHBondContact O-N 3.23Å; T300-Q302 VanDerWaalsContact O-N 3.09Å
301	L	95.3	Very high	95.8	Very high	6 Å²	6	37.6 Å²	37.6	3%	0.031	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	2.3	168.4	-65.1	172.3	0	0	0	113.2	L22 L87 D117 A118 G297 Y298 Q299 L303	L22-L301 HydrophobicContact CB-CB 4.37Å; L22-L301 HydrophobicContact CB-CD1 4.17Å; L22-L301 HydrophobicContact CB-CD2 3.95Å; L22-L301 HydrophobicContact CB-CG 4.4Å; L22-L301 HydrophobicContact CD1-CB 4.31Å; L22-L301 WeakPolarHBondContact CD1-O 3.4Å; L87-L301 HydrophobicContact CD1-CD1 3.58Å; D117-L301 HydrophobicContact CB-CD2 3.76Å; A118-L301 HydrophobicContact CB-CD2 3.55Å; A118-L301 HydrophobicContact CB-CG 4.27Å; G297-L301 WeakPolarHBondContact O-CG 3.5Å; G297-L301 PolarHBondContact O-N 3.45Å; G297-L301 VanDerWaalsContact O-N 3.14Å; Y298-L301 PolarHBondContact O-N 2.84Å; Q299-L301 VanDerWaalsContact C-N 3.3Å; L301-L303 HydrophobicContact CB-CD1 3.92Å; L301-L303 HydrophobicContact CB-CG 3.83Å; L301-L303 HydrophobicContact CD1-CD1 4.1Å; L301-L303 PolarHBondContact O-N 3.25Å
302	Q	94.1	Very high	95.9	Very high	73 Å²	73	42 Å²	42	34%	0.341	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	30.7	-174	-53.3	-62.7	-26.9	0	0	112.2	L14 Q299 T300 Q320 K321	L14-Q302 HydrophobicContact CD1-CB 4.46Å; Q299-Q302 WeakPolarHBondContact O-CA 3.13Å; Q299-Q302 PolarHBondContact O-N 3.36Å; T300-Q302 PolarHBondContact O-N 3.23Å; T300-Q302 VanDerWaalsContact O-N 3.09Å; Q302-Q320 HydrophobicContact CB-CG 4.43Å; Q302-Q320 CarbonylContact O-C 3.46Å; Q302-Q320 WeakPolarHBondContact O-CA 3.42Å; Q302-Q320 WeakPolarHBondContact O-CG 3.44Å; Q302-K321 WeakPolarHBondContact O-CG 3.2Å; Q302-K321 PolarHBondContact O-N 3.34Å; Q302-K321 VanDerWaalsContact OE1-CD 3.31Å
303	L	95.6	Very high	95.9	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	147.2	175.7	-60.8	177.1	0	0	0	110.2	L22 Y298 L301 T318 I319 Q320	L22-L303 HydrophobicContact CB-CD1 4.3Å; L22-L303 HydrophobicContact CD1-CD2 3.93Å; L22-L303 HydrophobicContact CD1-CG 4.24Å; L22-L303 HydrophobicContact CG-CD2 4.45Å; Y298-L303 HydrophobicContact CD1-CB 3.8Å; Y298-L303 WeakPolarHBondContact CD1-O 3.38Å; Y298-L303 HydrophobicContact CD2-CB 4.37Å; Y298-L303 HydrophobicContact CD2-CD1 4.3Å; Y298-L303 VanDerWaalsContact CE1-C 3.48Å; Y298-L303 HydrophobicContact CE1-CB 3.43Å; Y298-L303 VanDerWaalsContact CE1-CB 3.43Å; Y298-L303 HydrophobicContact CE2-CB 4.06Å; Y298-L303 HydrophobicContact CE2-CD1 3.97Å; Y298-L303 HydrophobicContact CG-CB 4.26Å; Y298-L303 PolarHBondContact O-N 2.62Å; L301-L303 HydrophobicContact CB-CD1 3.92Å; L301-L303 HydrophobicContact CB-CG 3.83Å; L301-L303 HydrophobicContact CD1-CD1 4.1Å; L301-L303 PolarHBondContact O-N 3.25Å; L303-T318 HydrophobicContact CB-CG2 4.35Å; L303-T318 HydrophobicContact CD1-CG2 4.08Å; L303-T318 HydrophobicContact CD2-CG2 3.95Å; L303-T318 HydrophobicContact CG-CG2 4.35Å; L303-I319 WeakPolarHBondContact CA-O 3.4Å; L303-Q320 HydrophobicContact CD2-CB 4.35Å; L303-Q320 HydrophobicContact CD2-CG 4.48Å
304	H	95	Very high	96	Very high	14 Å²	14	39.6 Å²	39.6	7%	0.065	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	-174.8	167.8	71.6	98.8	0	0	0	107.8	Y298 T318 I319 K321 V375 D377	Y298-H304 PolarHBondContact OH-O 2.74Å; H304-T318 WeakPolarHBondContact O-CA 3.36Å; H304-I319 WeakPolarHBondContact CE1-CD1 3.48Å; H304-I319 PolarHBondContact N-O 3.49Å; H304-I319 PolarHBondContact O-N 3.35Å; H304-K321 VanDerWaalsContact CD2-CA 3.45Å; H304-K321 WeakPolarHBondContact CD2-CA 3.43Å; H304-K321 VanDerWaalsContact CD2-CG 3.48Å; H304-K321 WeakPolarHBondContact CD2-CG 3.45Å; H304-K321 PolarHBondContact CD2-N 3Å; H304-K321 WeakPolarHBondContact NE2-CA 3.47Å; H304-V375 PolarHBondContact CE1-O 2.96Å; H304-V375 VanDerWaalsContact CE1-O 3.23Å; H304-D377 HydrophobicContact CB-CB 3.89Å; H304-D377 VanDerWaalsContact CB-OD1 3.32Å; H304-D377 WeakPolarHBondContact CB-OD1 3.18Å
305	Y	97.3	Very high	96.1	Very high	12 Å²	12	41.3 Å²	41.3	5%	0.047	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	160.1	178.3	40.2	-90.5	0	0	0	112	V65 D67 A85 Y298 F307 A316 W317 D377 G378	V65-Y305 HydrophobicContact CG1-CE1 4.4Å; D67-Y305 WeakPolarHBondContact CB-OH 3.34Å; D67-Y305 WeakPolarHBondContact OD2-CE2 3.44Å; D67-Y305 VanDerWaalsContact OD2-CZ 3.24Å; D67-Y305 PolarHBondContact OD2-OH 3.49Å; A85-Y305 HydrophobicContact CB-CD1 3.4Å; A85-Y305 HydrophobicContact CB-CE1 3.52Å; A85-Y305 HydrophobicContact CB-CG 3.96Å; Y298-Y305 HydrophobicContact CD1-CE1 4.27Å; Y298-Y305 AromaticContact CE1-CD1 3.54Å; Y298-Y305 HydrophobicContact CE1-CD1 3.54Å; Y298-Y305 AromaticContact CE1-CE1 3.67Å; Y298-Y305 HydrophobicContact CE1-CE1 3.67Å; Y298-Y305 AromaticContact CZ-CD1 3.75Å; Y298-Y305 WeakPolarHBondContact OH-CD1 3.31Å; Y305-F307 HydrophobicContact CD2-CD1 4.43Å; Y305-F307 AromaticContact CD2-CE1 3.72Å; Y305-F307 HydrophobicContact CD2-CE1 3.72Å; Y305-F307 AromaticContact CD2-CZ 3.83Å; Y305-F307 HydrophobicContact CD2-CZ 3.83Å; Y305-F307 AromaticContact CE2-CE1 3.72Å; Y305-F307 HydrophobicContact CE2-CE1 3.72Å; Y305-F307 AromaticContact CE2-CZ 3.57Å; Y305-F307 HydrophobicContact CE2-CZ 3.57Å; Y305-A316 HydrophobicContact CD2-CB 3.74Å; Y305-A316 HydrophobicContact CE2-CB 4.26Å; Y305-A316 HydrophobicContact CG-CB 4.07Å; Y305-W317 WeakPolarHBondContact CA-O 3.48Å; Y305-W317 WeakPolarHBondContact CB-O 3.39Å; Y305-D377 PolarHBondContact N-OD1 2.9Å; Y305-G378 PolarHBondContact O-N 2.74Å
306	F	98.3	Very high	96.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	162.8	165.5	70.7	-87.3	0	0	0	108.7	T308 W317 I319 A328 I332 V375 D379 I381 F383	F306-T308 HydrophobicContact CE2-CG2 4.01Å; F306-W317 HydrophobicContact CD1-CB 3.91Å; F306-W317 HydrophobicContact CD2-CB 4.37Å; F306-W317 HydrophobicContact CE1-CB 3.38Å; F306-W317 HydrophobicContact CE1-CG 4.18Å; F306-W317 HydrophobicContact CE2-CB 3.89Å; F306-W317 AromaticContact CE2-CD1 3.64Å; F306-W317 AromaticContact CE2-CG 3.91Å; F306-W317 HydrophobicContact CE2-CG 3.91Å; F306-W317 HydrophobicContact CG-CB 4.38Å; F306-W317 HydrophobicContact CZ-CB 3.36Å; F306-W317 AromaticContact CZ-CD1 3.87Å; F306-W317 AromaticContact CZ-CG 3.64Å; F306-W317 HydrophobicContact CZ-CG 3.64Å; F306-W317 PolarHBondContact N-O 2.91Å; F306-W317 PolarHBondContact O-N 3.24Å; F306-I319 HydrophobicContact CD1-CD1 4.04Å; F306-I319 HydrophobicContact CD1-CG1 4.46Å; F306-I319 HydrophobicContact CD1-CG2 4.26Å; F306-I319 HydrophobicContact CE1-CG2 4.07Å; F306-A328 HydrophobicContact CD1-CB 4.16Å; F306-A328 HydrophobicContact CE1-CB 3.75Å; F306-A328 HydrophobicContact CZ-CB 4.47Å; F306-I332 HydrophobicContact CE2-CD1 4.19Å; F306-I332 HydrophobicContact CZ-CD1 4.18Å; F306-I332 HydrophobicContact CZ-CG1 4.12Å; F306-V375 HydrophobicContact CB-CG1 3.93Å; F306-V375 HydrophobicContact CD1-CG1 4.35Å; F306-V375 HydrophobicContact CG-CG1 4.43Å; F306-D379 CarbonylContact C-O 3.42Å; F306-D379 VanDerWaalsContact CA-O 3.28Å; F306-D379 WeakPolarHBondContact CA-O 3.27Å; F306-D379 HydrophobicContact CB-CB 4.21Å; F306-D379 VanDerWaalsContact CB-O 3.31Å; F306-D379 WeakPolarHBondContact CB-O 3.43Å; F306-I381 HydrophobicContact CB-CD1 3.87Å; F306-I381 HydrophobicContact CB-CG1 4.2Å; F306-I381 HydrophobicContact CD2-CB 4Å; F306-I381 HydrophobicContact CD2-CD1 4.09Å; F306-I381 HydrophobicContact CD2-CG1 4.11Å; F306-I381 HydrophobicContact CE2-CB 4.49Å; F306-I381 HydrophobicContact CG-CD1 3.96Å; F306-I381 HydrophobicContact CG-CG1 4.37Å; F306-F383 HydrophobicContact CD2-CE2 4.41Å; F306-F383 HydrophobicContact CE1-CE2 4.47Å; F306-F383 AromaticContact CE2-CE2 3.6Å; F306-F383 HydrophobicContact CE2-CE2 3.6Å; F306-F383 HydrophobicContact CE2-CZ 4.27Å; F306-F383 AromaticContact CZ-CE2 3.63Å; F306-F383 HydrophobicContact CZ-CE2 3.63Å; F306-F383 HydrophobicContact CZ-CZ 4.18Å
307	F	98.6	Very high	96.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	141	179.3	-54.7	-70.5	0	0	0	111.8	R69 F70 L73 Y305 C309 K315 A316 D379 I380 I381	R69-F307 HydrophobicContact CB-CE2 4.05Å; R69-F307 HydrophobicContact CB-CZ 4.08Å; F70-F307 HydrophobicContact CB-CE1 3.89Å; F70-F307 HydrophobicContact CB-CZ 4.24Å; F70-F307 HydrophobicContact CD2-CD1 4.28Å; F70-F307 AromaticContact CD2-CE1 3.98Å; F70-F307 HydrophobicContact CD2-CE1 3.98Å; F70-F307 HydrophobicContact CG-CE1 4.43Å; L73-F307 HydrophobicContact CD1-CB 3.98Å; L73-F307 HydrophobicContact CD1-CD1 4.13Å; L73-F307 HydrophobicContact CD1-CD2 3.52Å; L73-F307 HydrophobicContact CD1-CE1 4.48Å; L73-F307 HydrophobicContact CD1-CE2 3.92Å; L73-F307 HydrophobicContact CD1-CG 3.62Å; L73-F307 HydrophobicContact CD1-CZ 4.37Å; Y305-F307 HydrophobicContact CD2-CD1 4.43Å; Y305-F307 AromaticContact CD2-CE1 3.72Å; Y305-F307 HydrophobicContact CD2-CE1 3.72Å; Y305-F307 AromaticContact CD2-CZ 3.83Å; Y305-F307 HydrophobicContact CD2-CZ 3.83Å; Y305-F307 AromaticContact CE2-CE1 3.72Å; Y305-F307 HydrophobicContact CE2-CE1 3.72Å; Y305-F307 AromaticContact CE2-CZ 3.57Å; Y305-F307 HydrophobicContact CE2-CZ 3.57Å; F307-C309 VanDerWaalsContact CB-SG 3.56Å; F307-K315 VanDerWaalsContact CA-O 3.31Å; F307-K315 WeakPolarHBondContact CA-O 3.32Å; F307-A316 HydrophobicContact CD1-CB 3.87Å; F307-A316 HydrophobicContact CE1-CB 3.74Å; F307-D379 PolarHBondContact N-O 3.19Å; F307-I380 HydrophobicContact CB-CG1 4.36Å; F307-I380 HydrophobicContact CD2-CG1 4.47Å; F307-I380 WeakPolarHBondContact O-CA 3.39Å; F307-I381 PolarHBondContact O-N 3.36Å
308	T	97.8	Very high	96.3	Very high	30 Å²	30	39 Å²	39	18%	0.184	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.7	154.7	54.8	0	0	0	0	107.5	F306 V314 K315 W317 I332	F306-T308 HydrophobicContact CE2-CG2 4.01Å; T308-V314 WeakPolarHBondContact O-CA 3.28Å; T308-K315 PolarHBondContact N-O 3.31Å; T308-K315 PolarHBondContact O-N 3.46Å; T308-W317 PolarHBondContact OG1-NE1 3.26Å; T308-I332 HydrophobicContact CG2-CD1 3.91Å
309	C	95.6	Very high	96.3	Very high	36 Å²	36	38.8 Å²	38.8	24%	0.243	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137.1	-170.7	-49.5	0	0	0	0	111.2	H77 F307 E313 V314 I380	H77-C309 WeakPolarHBondContact NE2-CB 3.44Å; F307-C309 VanDerWaalsContact CB-SG 3.56Å; C309-E313 CarbonylContact C-O 3.5Å; C309-V314 HydrophobicContact CB-CG2 4.2Å; C309-I380 HydrophobicContact CB-CG2 4.43Å
310	G	93.4	Very high	96.2	Very high	23 Å²	23	34.3 Å²	34.3	24%	0.237	18%	0.176	C	C	.	.	S	Bend	trans	-175.4	179.7	176.6	0	0	0	0	0	111	P79 D312 E313	P79-G310 WeakPolarHBondContact CB-O 3.29Å; G310-D312 PolarHBondContact O-N 3.45Å; G310-E313 PolarHBondContact N-O 3.3Å
311	K	94	Very high	96.1	Very high	167 Å²	167	37.4 Å²	37.4	73%	0.726	19%	0.187	S	C	*	.	S	Bend	trans	-68.4	-22.9	177.7	-66.8	-172.3	176.5	-173.7	0	113.3	P79 V80	P79-K311 CarbonylContact C-O 3.47Å; P79-K311 VanDerWaalsContact CA-O 3.22Å; P79-K311 WeakPolarHBondContact CA-O 3.49Å; V80-K311 PolarHBondContact N-O 3.49Å
312	D	95.9	Very high	95.9	Very high	133 Å²	133	39 Å²	39	71%	0.711	21%	0.206	S	C	*	.	S	Bend	trans	-82.6	-46.6	178.9	-57.3	-34.7	0	0	0	110.5	V80 S81 G310	V80-D312 WeakPolarHBondContact CB-O 3.43Å; V80-D312 PolarHBondContact N-O 3.42Å; S81-D312 PolarHBondContact N-O 3.08Å; G310-D312 PolarHBondContact O-N 3.45Å
313	E	97.5	Very high	95.9	Very high	62 Å²	62	36.1 Å²	36.1	29%	0.29	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	139.8	-176	-176.7	171.6	86.7	0	0	112	S81 C309 G310 K315	S81-E313 WeakPolarHBondContact O-CA 3.43Å; S81-E313 PolarHBondContact OG-OE2 3.25Å; S81-E313 VanDerWaalsContact OG-OE2 3.05Å; C309-E313 CarbonylContact C-O 3.5Å; G310-E313 PolarHBondContact N-O 3.3Å; E313-K315 HydrophobicContact CG-CB 3.86Å; E313-K315 WeakPolarHBondContact OE1-CB 3.39Å; E313-K315 WeakPolarHBondContact OE1-CD 3.36Å
314	V	98	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121.9	156.3	175	0	0	0	0	107.7	F70 L73 H77 P79 S81 V83 T308 C309	F70-V314 HydrophobicContact CD2-CG1 3.99Å; F70-V314 HydrophobicContact CE2-CG1 3.84Å; L73-V314 HydrophobicContact CB-CG1 3.88Å; H77-V314 HydrophobicContact CB-CG2 3.9Å; P79-V314 HydrophobicContact CB-CB 4.42Å; P79-V314 HydrophobicContact CB-CG2 4Å; P79-V314 HydrophobicContact CG-CB 3.97Å; P79-V314 HydrophobicContact CG-CG2 3.71Å; S81-V314 PolarHBondContact O-N 3.43Å; V83-V314 PolarHBondContact N-O 3.17Å; T308-V314 WeakPolarHBondContact O-CA 3.28Å; C309-V314 HydrophobicContact CB-CG2 4.2Å
315	K	97.9	Very high	96.1	Very high	44 Å²	44	38.3 Å²	38.3	19%	0.191	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	132.3	-175.2	178.7	161.5	178.9	-179.1	0	112.8	V83 F307 T308 E313 W317	V83-K315 HydrophobicContact CB-CB 3.99Å; V83-K315 HydrophobicContact CB-CD 3.91Å; V83-K315 HydrophobicContact CB-CG 3.74Å; V83-K315 HydrophobicContact CG1-CD 3.92Å; V83-K315 HydrophobicContact CG1-CG 3.91Å; V83-K315 HydrophobicContact CG2-CD 4.28Å; V83-K315 WeakPolarHBondContact O-CA 3.44Å; F307-K315 VanDerWaalsContact CA-O 3.31Å; F307-K315 WeakPolarHBondContact CA-O 3.32Å; T308-K315 PolarHBondContact N-O 3.31Å; T308-K315 PolarHBondContact O-N 3.46Å; E313-K315 HydrophobicContact CG-CB 3.86Å; E313-K315 WeakPolarHBondContact OE1-CB 3.39Å; E313-K315 WeakPolarHBondContact OE1-CD 3.36Å; K315-W317 HydrophobicContact CD-CD2 4.18Å; K315-W317 HydrophobicContact CD-CH2 4Å; K315-W317 HydrophobicContact CD-CZ2 3.47Å; K315-W317 VanDerWaalsContact CD-CZ2 3.47Å; K315-W317 HydrophobicContact CD-CZ3 4.49Å; K315-W317 VanDerWaalsContact CE-CH2 3.45Å; K315-W317 VanDerWaalsContact CE-CZ2 3.47Å; K315-W317 HydrophobicContact CG-CD2 4.16Å; K315-W317 HydrophobicContact CG-CG 4.34Å; K315-W317 HydrophobicContact CG-CZ2 4.19Å
316	A	97.8	Very high	96.1	Very high	6 Å²	6	38.4 Å²	38.4	5%	0.05	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	110.5	172.2	0	0	0	0	0	110.2	F70 V83 A85 Y305 F307	F70-A316 HydrophobicContact CD2-CB 4.37Å; V83-A316 PolarHBondContact O-N 3.14Å; A85-A316 HydrophobicContact CB-CB 4.02Å; Y305-A316 HydrophobicContact CD2-CB 3.74Å; Y305-A316 HydrophobicContact CE2-CB 4.26Å; Y305-A316 HydrophobicContact CG-CB 4.07Å; F307-A316 HydrophobicContact CD1-CB 3.87Å; F307-A316 HydrophobicContact CE1-CB 3.74Å
317	W	97.7	Very high	95.9	Very high	36 Å²	36	42.5 Å²	42.5	14%	0.136	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	107.8	-178.5	-66.7	92.3	0	0	0	110.8	Y305 F306 T308 K315 I319 R331 I332	Y305-W317 WeakPolarHBondContact CA-O 3.48Å; Y305-W317 WeakPolarHBondContact CB-O 3.39Å; F306-W317 HydrophobicContact CD1-CB 3.91Å; F306-W317 HydrophobicContact CD2-CB 4.37Å; F306-W317 HydrophobicContact CE1-CB 3.38Å; F306-W317 HydrophobicContact CE1-CG 4.18Å; F306-W317 HydrophobicContact CE2-CB 3.89Å; F306-W317 AromaticContact CE2-CD1 3.64Å; F306-W317 AromaticContact CE2-CG 3.91Å; F306-W317 HydrophobicContact CE2-CG 3.91Å; F306-W317 HydrophobicContact CG-CB 4.38Å; F306-W317 HydrophobicContact CZ-CB 3.36Å; F306-W317 AromaticContact CZ-CD1 3.87Å; F306-W317 AromaticContact CZ-CG 3.64Å; F306-W317 HydrophobicContact CZ-CG 3.64Å; F306-W317 PolarHBondContact N-O 2.91Å; F306-W317 PolarHBondContact O-N 3.24Å; T308-W317 PolarHBondContact OG1-NE1 3.26Å; K315-W317 HydrophobicContact CD-CD2 4.18Å; K315-W317 HydrophobicContact CD-CH2 4Å; K315-W317 HydrophobicContact CD-CZ2 3.47Å; K315-W317 VanDerWaalsContact CD-CZ2 3.47Å; K315-W317 HydrophobicContact CD-CZ3 4.49Å; K315-W317 VanDerWaalsContact CE-CH2 3.45Å; K315-W317 VanDerWaalsContact CE-CZ2 3.47Å; K315-W317 HydrophobicContact CG-CD2 4.16Å; K315-W317 HydrophobicContact CG-CG 4.34Å; K315-W317 HydrophobicContact CG-CZ2 4.19Å; W317-I319 PolarHBondContact O-N 3.38Å; W317-R331 HydrophobicContact CE3-CB 4.34Å; W317-R331 WeakPolarHBondContact CZ3-O 3.41Å; W317-I332 HydrophobicContact CD2-CG1 3.88Å; W317-I332 HydrophobicContact CE3-CG1 4.17Å; W317-I332 HydrophobicContact CG-CG1 4.39Å; W317-I332 HydrophobicContact CH2-CB 4.09Å; W317-I332 HydrophobicContact CH2-CG1 4.18Å; W317-I332 HydrophobicContact CH2-CG2 3.9Å; W317-I332 HydrophobicContact CZ2-CB 4.19Å; W317-I332 HydrophobicContact CZ2-CG1 3.9Å; W317-I332 HydrophobicContact CZ2-CG2 3.87Å; W317-I332 HydrophobicContact CZ3-CB 4.36Å; W317-I332 HydrophobicContact CZ3-CG1 4.34Å
318	T	96.9	Very high	95.9	Very high	28 Å²	28	42.5 Å²	42.5	17%	0.172	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	128.5	176.8	-59	0	0	0	0	112.1	T20 Y298 L303 H304	T20-T318 HydrophobicContact CG2-CG2 4.08Å; T20-T318 VanDerWaalsContact CG2-O 3.29Å; T20-T318 WeakPolarHBondContact CG2-O 3.18Å; Y298-T318 HydrophobicContact CE2-CG2 4.49Å; Y298-T318 VanDerWaalsContact OH-CB 3.27Å; Y298-T318 WeakPolarHBondContact OH-CB 3.3Å; Y298-T318 WeakPolarHBondContact OH-CG2 3.22Å; Y298-T318 PolarHBondContact OH-OG1 3.2Å; L303-T318 HydrophobicContact CB-CG2 4.35Å; L303-T318 HydrophobicContact CD1-CG2 4.08Å; L303-T318 HydrophobicContact CD2-CG2 3.95Å; L303-T318 HydrophobicContact CG-CG2 4.35Å; H304-T318 WeakPolarHBondContact O-CA 3.36Å
319	I	96	Very high	95.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	160.3	171	51.3	172.1	0	0	0	109.8	L303 H304 F306 W317 A328 R331 V375	L303-I319 WeakPolarHBondContact CA-O 3.4Å; H304-I319 WeakPolarHBondContact CE1-CD1 3.48Å; H304-I319 PolarHBondContact N-O 3.49Å; H304-I319 PolarHBondContact O-N 3.35Å; F306-I319 HydrophobicContact CD1-CD1 4.04Å; F306-I319 HydrophobicContact CD1-CG1 4.46Å; F306-I319 HydrophobicContact CD1-CG2 4.26Å; F306-I319 HydrophobicContact CE1-CG2 4.07Å; W317-I319 PolarHBondContact O-N 3.38Å; I319-A328 HydrophobicContact CD1-CB 4.49Å; I319-A328 HydrophobicContact CG2-CB 4.11Å; I319-R331 HydrophobicContact CG2-CG 3.74Å; I319-V375 HydrophobicContact CD1-CB 3.71Å; I319-V375 HydrophobicContact CD1-CG1 3.47Å; I319-V375 VanDerWaalsContact CD1-CG1 3.47Å
320	Q	92.7	Very high	95.8	Very high	17 Å²	17	40 Å²	40	8%	0.079	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	146.4	173.9	-160.8	170	20.8	0	0	109.6	L14 R17 Q302 L303 G322 S323	L14-Q320 HydrophobicContact CD1-CG 3.79Å; R17-Q320 PolarHBondContact O-NE2 2.93Å; Q302-Q320 HydrophobicContact CB-CG 4.43Å; Q302-Q320 CarbonylContact O-C 3.46Å; Q302-Q320 WeakPolarHBondContact O-CA 3.42Å; Q302-Q320 WeakPolarHBondContact O-CG 3.44Å; L303-Q320 HydrophobicContact CD2-CB 4.35Å; L303-Q320 HydrophobicContact CD2-CG 4.48Å; Q320-G322 PolarHBondContact O-N 3.04Å; Q320-S323 PolarHBondContact N-OG 3Å; Q320-S323 VanDerWaalsContact O-CB 3.27Å; Q320-S323 WeakPolarHBondContact O-CB 3.38Å; Q320-S323 PolarHBondContact O-N 3.18Å; Q320-S323 PolarHBondContact O-OG 3.44Å
321	K	92.1	Very high	95.9	Very high	92 Å²	92	43.8 Å²	43.8	40%	0.4	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	134.7	179.1	-72.4	-176.7	-161.6	159.8	0	111.5	Q302 H304	Q302-K321 WeakPolarHBondContact O-CG 3.2Å; Q302-K321 PolarHBondContact O-N 3.34Å; Q302-K321 VanDerWaalsContact OE1-CD 3.31Å; H304-K321 VanDerWaalsContact CD2-CA 3.45Å; H304-K321 WeakPolarHBondContact CD2-CA 3.43Å; H304-K321 VanDerWaalsContact CD2-CG 3.48Å; H304-K321 WeakPolarHBondContact CD2-CG 3.45Å; H304-K321 PolarHBondContact CD2-N 3Å; H304-K321 WeakPolarHBondContact NE2-CA 3.47Å
322	G	91.5	Very high	95.9	Very high	41 Å²	41	38 Å²	38	42%	0.423	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-1.8	-176.8	0	0	0	0	0	114.6	Q320 K324	Q320-G322 PolarHBondContact O-N 3.04Å; G322-K324 PolarHBondContact O-N 3.38Å
323	S	94.5	Very high	95.7	Very high	12 Å²	12	36.2 Å²	36.2	8%	0.084	18%	0.181	C	C	.	.			trans	-57	129.3	175.9	-66.8	0	0	0	0	111.1	Q320 V375	Q320-S323 PolarHBondContact N-OG 3Å; Q320-S323 VanDerWaalsContact O-CB 3.27Å; Q320-S323 WeakPolarHBondContact O-CB 3.38Å; Q320-S323 PolarHBondContact O-N 3.18Å; Q320-S323 PolarHBondContact O-OG 3.44Å; S323-V375 PolarHBondContact O-N 3.38Å
324	K	96.8	Very high	95.4	Very high	65 Å²	65	37 Å²	37	28%	0.283	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-78	156.6	175.1	-62.3	-63.5	-171	177	0	111.1	G322 P326 Q327 A328 E372 Y373 V374	G322-K324 PolarHBondContact O-N 3.38Å; K324-P326 VanDerWaalsContact C-CD 3.47Å; K324-P326 VanDerWaalsContact C-N 3.33Å; K324-Q327 HydrophobicContact CB-CG 4.48Å; K324-Q327 WeakPolarHBondContact O-CA 3.47Å; K324-Q327 WeakPolarHBondContact O-CB 3.19Å; K324-Q327 PolarHBondContact O-N 3.05Å; K324-A328 PolarHBondContact O-N 3Å; K324-E372 WeakPolarHBondContact CD-O 3.32Å; K324-E372 PolarHBondContact NZ-O 2.82Å; K324-E372 IonicContact NZ-OE2 4Å; K324-Y373 CarbonylContact C-O 3.47Å; K324-Y373 VanDerWaalsContact CA-O 3.24Å; K324-Y373 WeakPolarHBondContact CA-O 3.43Å; K324-V374 HydrophobicContact CD-CG2 3.9Å
325	A	97.6	Very high	95.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-50.7	-41.6	-179.2	0	0	0	0	0	114.5	Q327 A328 A329 F340 A343 Y373 V375 F383	A325-Q327 PolarHBondContact O-N 3.17Å; A325-A328 PolarHBondContact O-N 3.33Å; A325-A329 PolarHBondContact O-N 2.86Å; A325-F340 HydrophobicContact CB-CE2 3.71Å; A325-F340 HydrophobicContact CB-CZ 3.56Å; A325-A343 HydrophobicContact CB-CB 4.04Å; A325-Y373 HydrophobicContact CB-CD1 4.45Å; A325-Y373 PolarHBondContact N-O 3.04Å; A325-V375 HydrophobicContact CB-CG2 4.42Å; A325-F383 HydrophobicContact CB-CE1 4.4Å; A325-F383 VanDerWaalsContact O-CE1 3.27Å; A325-F383 WeakPolarHBondContact O-CE1 3.18Å
326	P	97.1	Very high	94.9	Very high	14 Å²	14	39 Å²	39	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-63.8	-39	174.6	-22.7	34.8	0	0	0	113.5	K324 A328 A329 G330 E337 F340 R371	K324-P326 VanDerWaalsContact C-CD 3.47Å; K324-P326 VanDerWaalsContact C-N 3.33Å; P326-A328 VanDerWaalsContact C-N 3.33Å; P326-A329 WeakPolarHBondContact O-CB 3.37Å; P326-A329 PolarHBondContact O-N 2.99Å; P326-G330 PolarHBondContact O-N 3.03Å; P326-E337 HydrophobicContact CB-CG 4.3Å; P326-E337 WeakPolarHBondContact O-CA 3.3Å; P326-E337 VanDerWaalsContact O-CB 3.27Å; P326-E337 WeakPolarHBondContact O-CB 3.3Å; P326-E337 VanDerWaalsContact O-CG 3.31Å; P326-E337 WeakPolarHBondContact O-CG 3.2Å; P326-F340 HydrophobicContact CB-CB 4.09Å; P326-F340 HydrophobicContact CB-CD1 4.47Å; P326-F340 HydrophobicContact CB-CD2 4.16Å; P326-F340 HydrophobicContact CB-CG 4Å; P326-F340 HydrophobicContact CG-CB 4.32Å; P326-F340 HydrophobicContact CG-CD1 3.81Å; P326-F340 HydrophobicContact CG-CD2 4.11Å; P326-F340 HydrophobicContact CG-CE1 4.08Å; P326-F340 HydrophobicContact CG-CE2 4.33Å; P326-F340 HydrophobicContact CG-CG 3.82Å; P326-F340 HydrophobicContact CG-CZ 4.32Å; P326-R371 VanDerWaalsContact CD-O 3.25Å; P326-R371 WeakPolarHBondContact CD-O 3.32Å; P326-R371 HydrophobicContact CG-CB 3.94Å; P326-R371 HydrophobicContact CG-CG 3.88Å
327	Q	95.5	Very high	94.8	Very high	87 Å²	87	42.2 Å²	42.2	41%	0.407	22%	0.216	S	C	.	.	H	α-helix	trans	-68	-36.4	179	-61.8	172.4	-46.2	0	0	111.2	K324 A325 G330 R331	K324-Q327 HydrophobicContact CB-CG 4.48Å; K324-Q327 WeakPolarHBondContact O-CA 3.47Å; K324-Q327 WeakPolarHBondContact O-CB 3.19Å; K324-Q327 PolarHBondContact O-N 3.05Å; A325-Q327 PolarHBondContact O-N 3.17Å; Q327-G330 PolarHBondContact O-N 2.95Å; Q327-R331 PolarHBondContact O-N 3.04Å
328	A	97	Very high	94.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-44	172.7	0	0	0	0	0	111.6	F306 I319 K324 A325 P326 G330 R331 V375 F383	F306-A328 HydrophobicContact CD1-CB 4.16Å; F306-A328 HydrophobicContact CE1-CB 3.75Å; F306-A328 HydrophobicContact CZ-CB 4.47Å; I319-A328 HydrophobicContact CD1-CB 4.49Å; I319-A328 HydrophobicContact CG2-CB 4.11Å; K324-A328 PolarHBondContact O-N 3Å; A325-A328 PolarHBondContact O-N 3.33Å; P326-A328 VanDerWaalsContact C-N 3.33Å; A328-G330 VanDerWaalsContact C-N 3.25Å; A328-G330 PolarHBondContact O-N 2.96Å; A328-R331 VanDerWaalsContact O-CB 3.32Å; A328-R331 WeakPolarHBondContact O-CB 3.42Å; A328-R331 PolarHBondContact O-N 2.89Å; A328-V375 HydrophobicContact CB-CB 4.49Å; A328-V375 HydrophobicContact CB-CG2 3.69Å; A328-F383 HydrophobicContact CB-CZ 3.83Å
329	A	96.9	Very high	94.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-38.6	173.1	0	0	0	0	0	111.9	A325 P326 R331 I332 H333 M336 F340 F383	A325-A329 PolarHBondContact O-N 2.86Å; P326-A329 WeakPolarHBondContact O-CB 3.37Å; P326-A329 PolarHBondContact O-N 2.99Å; A329-R331 PolarHBondContact O-N 3.44Å; A329-I332 WeakPolarHBondContact O-CB 3.31Å; A329-I332 PolarHBondContact O-N 2.81Å; A329-H333 PolarHBondContact O-N 3.13Å; A329-M336 HydrophobicContact CB-CB 3.94Å; A329-F340 HydrophobicContact CB-CD2 4.07Å; A329-F383 HydrophobicContact CB-CB 4.26Å; A329-F383 HydrophobicContact CB-CD1 3.65Å; A329-F383 HydrophobicContact CB-CD2 3.9Å; A329-F383 HydrophobicContact CB-CE1 3.85Å; A329-F383 HydrophobicContact CB-CE2 4.09Å; A329-F383 HydrophobicContact CB-CG 3.66Å; A329-F383 HydrophobicContact CB-CZ 4.07Å
330	G	95.5	Very high	94.6	Very high	13 Å²	13	45.6 Å²	45.6	13%	0.134	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-24	174.9	0	0	0	0	0	114.7	P326 Q327 A328 I332 H333	P326-G330 PolarHBondContact O-N 3.03Å; Q327-G330 PolarHBondContact O-N 2.95Å; A328-G330 VanDerWaalsContact C-N 3.25Å; A328-G330 PolarHBondContact O-N 2.96Å; G330-I332 VanDerWaalsContact C-N 3.33Å; G330-H333 WeakPolarHBondContact CA-O 3.43Å; G330-H333 CarbonylContact O-C 3.53Å
331	R	94.4	Very high	94.8	Very high	102 Å²	102	49.5 Å²	49.5	39%	0.385	25%	0.251	S	S	.	.	H	α-helix	trans	-71.2	-29	174	-60.3	-59	167.6	-179.9	-6.6	113.1	T20 W317 I319 Q327 A328 A329	T20-R331 PolarHBondContact OG1-NH1 3.44Å; W317-R331 HydrophobicContact CE3-CB 4.34Å; W317-R331 WeakPolarHBondContact CZ3-O 3.41Å; I319-R331 HydrophobicContact CG2-CG 3.74Å; Q327-R331 PolarHBondContact O-N 3.04Å; A328-R331 VanDerWaalsContact O-CB 3.32Å; A328-R331 WeakPolarHBondContact O-CB 3.42Å; A328-R331 PolarHBondContact O-N 2.89Å; A329-R331 PolarHBondContact O-N 3.44Å
332	I	94.5	Very high	95.1	Very high	46 Å²	46	47.4 Å²	47.4	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-74	-53.1	172.2	-52.9	-176.8	0	0	0	109.2	F306 T308 W317 A329 G330 M336 F383	F306-I332 HydrophobicContact CE2-CD1 4.19Å; F306-I332 HydrophobicContact CZ-CD1 4.18Å; F306-I332 HydrophobicContact CZ-CG1 4.12Å; T308-I332 HydrophobicContact CG2-CD1 3.91Å; W317-I332 HydrophobicContact CD2-CG1 3.88Å; W317-I332 HydrophobicContact CE3-CG1 4.17Å; W317-I332 HydrophobicContact CG-CG1 4.39Å; W317-I332 HydrophobicContact CH2-CB 4.09Å; W317-I332 HydrophobicContact CH2-CG1 4.18Å; W317-I332 HydrophobicContact CH2-CG2 3.9Å; W317-I332 HydrophobicContact CZ2-CB 4.19Å; W317-I332 HydrophobicContact CZ2-CG1 3.9Å; W317-I332 HydrophobicContact CZ2-CG2 3.87Å; W317-I332 HydrophobicContact CZ3-CB 4.36Å; W317-I332 HydrophobicContact CZ3-CG1 4.34Å; A329-I332 WeakPolarHBondContact O-CB 3.31Å; A329-I332 PolarHBondContact O-N 2.81Å; G330-I332 VanDerWaalsContact C-N 3.33Å; I332-M336 HydrophobicContact CB-CE 4.4Å; I332-M336 HydrophobicContact CB-SD 3.72Å; I332-M336 HydrophobicContact CD1-SD 4.25Å; I332-M336 HydrophobicContact CG2-CE 3.67Å; I332-M336 HydrophobicContact CG2-SD 3.67Å; I332-F383 HydrophobicContact CD1-CD2 3.67Å; I332-F383 HydrophobicContact CD1-CE2 3.92Å
333	H	91.9	Very high	95.4	Very high	95 Å²	95	45.5 Å²	45.5	44%	0.44	22%	0.224	S	C	.	.			trans	-159.8	140.3	175.6	-164.7	-94.9	0	0	0	110.7	A329 G330 D335 M336	A329-H333 PolarHBondContact O-N 3.13Å; G330-H333 WeakPolarHBondContact CA-O 3.43Å; G330-H333 CarbonylContact O-C 3.53Å; H333-D335 IonicContact CE1-OD2 3.57Å; H333-D335 PolarHBondContact CE1-OD2 2.94Å; H333-D335 WeakPolarHBondContact ND1-CB 3.42Å; H333-D335 PolarHBondContact ND1-N 2.8Å; H333-D335 VanDerWaalsContact ND1-N 3.18Å; H333-D335 IonicContact ND1-OD2 3.93Å; H333-D335 PolarHBondContact O-N 3.05Å; H333-D335 VanDerWaalsContact O-N 3.14Å; H333-M336 HydrophobicContact CB-CG 4.16Å; H333-M336 WeakPolarHBondContact O-CB 3.22Å; H333-M336 PolarHBondContact O-N 3.33Å
334	T	90.8	Very high	95.5	Very high	80 Å²	80	46 Å²	46	49%	0.491	23%	0.225	S	C	.	.	H	α-helix	trans	-60.5	-28.2	-178.3	56	0	0	0	0	113.2	M336 E337 K338	T334-M336 VanDerWaalsContact C-N 3.33Å; T334-E337 PolarHBondContact O-N 2.9Å; T334-K338 PolarHBondContact O-N 3.49Å
335	D	91.6	Very high	95.6	Very high	48 Å²	48	43.2 Å²	43.2	26%	0.257	21%	0.213	S	C	.	.	H	α-helix	trans	-69.7	-27.7	174.3	-66.3	-23.6	0	0	0	113.5	H333 E337 K338 G339	H333-D335 IonicContact CE1-OD2 3.57Å; H333-D335 PolarHBondContact CE1-OD2 2.94Å; H333-D335 WeakPolarHBondContact ND1-CB 3.42Å; H333-D335 PolarHBondContact ND1-N 2.8Å; H333-D335 VanDerWaalsContact ND1-N 3.18Å; H333-D335 IonicContact ND1-OD2 3.93Å; H333-D335 PolarHBondContact O-N 3.05Å; H333-D335 VanDerWaalsContact O-N 3.14Å; D335-E337 VanDerWaalsContact C-N 3.33Å; D335-K338 PolarHBondContact O-N 3.36Å; D335-K338 IonicContact OD1-NZ 2.62Å; D335-G339 PolarHBondContact O-N 3.03Å
336	M	94.7	Very high	95.6	Very high	36 Å²	36	43.8 Å²	43.8	18%	0.177	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-34.3	175	-64.1	-173.3	-176.9	0	0	111.5	A329 I332 H333 T334 F340 F385	A329-M336 HydrophobicContact CB-CB 3.94Å; I332-M336 HydrophobicContact CB-CE 4.4Å; I332-M336 HydrophobicContact CB-SD 3.72Å; I332-M336 HydrophobicContact CD1-SD 4.25Å; I332-M336 HydrophobicContact CG2-CE 3.67Å; I332-M336 HydrophobicContact CG2-SD 3.67Å; H333-M336 HydrophobicContact CB-CG 4.16Å; H333-M336 WeakPolarHBondContact O-CB 3.22Å; H333-M336 PolarHBondContact O-N 3.33Å; T334-M336 VanDerWaalsContact C-N 3.33Å; M336-F340 VanDerWaalsContact O-CA 3.28Å; M336-F340 WeakPolarHBondContact O-CA 3.19Å; M336-F340 WeakPolarHBondContact O-CB 3.29Å; M336-F340 PolarHBondContact O-N 2.78Å; M336-F385 HydrophobicContact CB-CB 4.44Å; M336-F385 HydrophobicContact CB-CD1 4.29Å; M336-F385 HydrophobicContact CB-CD2 4.33Å; M336-F385 HydrophobicContact CB-CG 4.1Å; M336-F385 HydrophobicContact CE-CD1 4.42Å; M336-F385 HydrophobicContact CE-CE1 3.59Å; M336-F385 HydrophobicContact CE-CZ 3.69Å; M336-F385 HydrophobicContact CG-CD1 3.7Å; M336-F385 HydrophobicContact CG-CD2 3.86Å; M336-F385 HydrophobicContact CG-CE1 3.68Å; M336-F385 HydrophobicContact CG-CE2 3.82Å; M336-F385 HydrophobicContact CG-CG 3.8Å; M336-F385 HydrophobicContact CG-CZ 3.74Å; M336-F385 HydrophobicContact SD-CD1 4.18Å; M336-F385 HydrophobicContact SD-CE1 3.93Å; M336-F385 HydrophobicContact SD-CZ 4.34Å
337	E	94.8	Very high	95.6	Very high	75 Å²	75	45 Å²	45	35%	0.35	22%	0.224	S	C	.	.	H	α-helix	trans	-66.5	-48.5	173.5	178.7	167.6	-161.4	0	0	111.6	P326 T334 D335 G339 F340	P326-E337 HydrophobicContact CB-CG 4.3Å; P326-E337 WeakPolarHBondContact O-CA 3.3Å; P326-E337 VanDerWaalsContact O-CB 3.27Å; P326-E337 WeakPolarHBondContact O-CB 3.3Å; P326-E337 VanDerWaalsContact O-CG 3.31Å; P326-E337 WeakPolarHBondContact O-CG 3.2Å; T334-E337 PolarHBondContact O-N 2.9Å; D335-E337 VanDerWaalsContact C-N 3.33Å; E337-G339 PolarHBondContact O-N 2.73Å; E337-F340 WeakPolarHBondContact O-CB 3.38Å; E337-F340 PolarHBondContact O-N 2.97Å
338	K	93.4	Very high	95.7	Very high	125 Å²	125	41.3 Å²	41.3	54%	0.543	21%	0.207	S	C	.	.	H	α-helix	trans	-62.4	-45.3	178.8	-67.5	173.6	-173	165.3	0	111.6	T334 D335 F340	T334-K338 PolarHBondContact O-N 3.49Å; D335-K338 PolarHBondContact O-N 3.36Å; D335-K338 IonicContact OD1-NZ 2.62Å; K338-F340 VanDerWaalsContact C-N 3.34Å
339	G	95.7	Very high	95.8	Very high	5 Å²	5	46.8 Å²	46.8	5%	0.052	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	5.4	-177.9	0	0	0	0	0	114.8	D335 E337 I341 F385 N386	D335-G339 PolarHBondContact O-N 3.03Å; E337-G339 PolarHBondContact O-N 2.73Å; G339-I341 PolarHBondContact O-N 3.21Å; G339-F385 CarbonylContact O-C 3.47Å; G339-F385 WeakPolarHBondContact O-CA 3.49Å; G339-F385 WeakPolarHBondContact O-CB 3.39Å; G339-N386 PolarHBondContact O-N 3.17Å
340	F	97.5	Very high	95.8	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.022	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	127.5	-171.2	-178.7	-84.8	0	0	0	112.8	A325 P326 A329 M336 E337 K338 M342 A343 R371 F383	A325-F340 HydrophobicContact CB-CE2 3.71Å; A325-F340 HydrophobicContact CB-CZ 3.56Å; P326-F340 HydrophobicContact CB-CB 4.09Å; P326-F340 HydrophobicContact CB-CD1 4.47Å; P326-F340 HydrophobicContact CB-CD2 4.16Å; P326-F340 HydrophobicContact CB-CG 4Å; P326-F340 HydrophobicContact CG-CB 4.32Å; P326-F340 HydrophobicContact CG-CD1 3.81Å; P326-F340 HydrophobicContact CG-CD2 4.11Å; P326-F340 HydrophobicContact CG-CE1 4.08Å; P326-F340 HydrophobicContact CG-CE2 4.33Å; P326-F340 HydrophobicContact CG-CG 3.82Å; P326-F340 HydrophobicContact CG-CZ 4.32Å; A329-F340 HydrophobicContact CB-CD2 4.07Å; M336-F340 VanDerWaalsContact O-CA 3.28Å; M336-F340 WeakPolarHBondContact O-CA 3.19Å; M336-F340 WeakPolarHBondContact O-CB 3.29Å; M336-F340 PolarHBondContact O-N 2.78Å; E337-F340 WeakPolarHBondContact O-CB 3.38Å; E337-F340 PolarHBondContact O-N 2.97Å; K338-F340 VanDerWaalsContact C-N 3.34Å; F340-M342 VanDerWaalsContact CZ-C 3.44Å; F340-A343 HydrophobicContact CE2-CB 4.22Å; F340-A343 HydrophobicContact CZ-CB 4.18Å; F340-R371 HydrophobicContact CD1-CG 3.5Å; F340-R371 VanDerWaalsContact CD1-CG 3.5Å; F340-R371 HydrophobicContact CE1-CB 4.34Å; F340-R371 HydrophobicContact CE1-CG 3.62Å; F340-R371 PolarHBondContact O-NH2 3.16Å; F340-F383 HydrophobicContact CD2-CD1 4.18Å; F340-F383 AromaticContact CE2-CD1 3.69Å; F340-F383 HydrophobicContact CE2-CD1 3.69Å; F340-F383 HydrophobicContact CE2-CE1 4.01Å
341	I	97.1	Very high	95.9	Very high	98 Å²	98	48 Å²	48	50%	0.503	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-61.4	173.2	-60.1	167.8	0	0	0	108.9	G339 K384 N386	G339-I341 PolarHBondContact O-N 3.21Å; I341-K384 WeakPolarHBondContact CA-O 3.36Å; I341-K384 HydrophobicContact CB-CB 4.25Å; I341-K384 VanDerWaalsContact CB-O 3.3Å; I341-K384 WeakPolarHBondContact CB-O 3.3Å; I341-K384 PolarHBondContact N-O 2.92Å; I341-N386 HydrophobicContact CD1-CB 4.42Å
342	M	97.5	Very high	96	Very high	49 Å²	49	47.4 Å²	47.4	24%	0.241	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	162.1	178.8	65.2	170	73.1	0	0	111.1	F340 E344 Q368 K369 K384	F340-M342 VanDerWaalsContact CZ-C 3.44Å; M342-E344 HydrophobicContact SD-CG 4.4Å; M342-Q368 HydrophobicContact SD-CB 3.93Å; M342-Q368 VanDerWaalsContact SD-CD 3.55Å; M342-Q368 HydrophobicContact SD-CG 3.69Å; M342-K369 WeakPolarHBondContact CA-O 3.27Å; M342-K384 HydrophobicContact CG-CB 3.91Å; M342-K384 HydrophobicContact CG-CG 3.95Å; M342-K384 PolarHBondContact N-O 2.96Å; M342-K384 PolarHBondContact O-N 3.38Å
343	A	98.2	Very high	96.2	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.3	165.9	0	0	0	0	0	108.9	A325 F340 V345 K369 I381 F383	A325-A343 HydrophobicContact CB-CB 4.04Å; F340-A343 HydrophobicContact CE2-CB 4.22Å; F340-A343 HydrophobicContact CZ-CB 4.18Å; A343-V345 HydrophobicContact CB-CG2 3.77Å; A343-K369 HydrophobicContact CB-CB 4.33Å; A343-K369 PolarHBondContact N-O 2.85Å; A343-K369 PolarHBondContact O-N 3.3Å; A343-I381 HydrophobicContact CB-CG2 3.86Å; A343-F383 HydrophobicContact CB-CD1 3.81Å; A343-F383 HydrophobicContact CB-CE1 3.74Å
344	E	97.8	Very high	96.4	Very high	24 Å²	24	48.5 Å²	48.5	11%	0.112	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	114.2	165.9	-61.3	-172.8	151	0	0	107.7	M342 Y366 K367 Q368 I381 L382 K384	M342-E344 HydrophobicContact SD-CG 4.4Å; E344-Y366 HydrophobicContact CB-CE1 3.62Å; E344-Y366 WeakPolarHBondContact CB-OH 3.4Å; E344-Y366 HydrophobicContact CG-CE1 4.02Å; E344-Y366 PolarHBondContact OE2-OH 3.48Å; E344-K367 WeakPolarHBondContact CA-O 3.44Å; E344-Q368 HydrophobicContact CG-CG 4.46Å; E344-I381 WeakPolarHBondContact O-CA 3.28Å; E344-L382 HydrophobicContact CB-CB 4.35Å; E344-L382 PolarHBondContact N-O 3.31Å; E344-L382 PolarHBondContact O-N 3.02Å; E344-K384 HydrophobicContact CG-CG 4.4Å; E344-K384 WeakPolarHBondContact OE1-CE 3.46Å; E344-K384 WeakPolarHBondContact OE2-CE 3.45Å; E344-K384 IonicContact OE2-NZ 3.68Å
345	V	98.2	Very high	96.5	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.03	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134	-166.1	-176.2	0	0	0	0	109.8	A343 K367 K369 Y373 D379 I381	A343-V345 HydrophobicContact CB-CG2 3.77Å; V345-K367 PolarHBondContact N-O 3.18Å; V345-K367 PolarHBondContact O-N 3.14Å; V345-K369 HydrophobicContact CB-CG 4.2Å; V345-K369 HydrophobicContact CG2-CB 4.12Å; V345-K369 HydrophobicContact CG2-CG 3.83Å; V345-Y373 HydrophobicContact CG1-CE1 4.12Å; V345-Y373 HydrophobicContact CG2-CD1 4.25Å; V345-Y373 HydrophobicContact CG2-CE1 3.9Å; V345-D379 HydrophobicContact CG1-CB 4.06Å; V345-I381 HydrophobicContact CG1-CG1 4.35Å; V345-I381 HydrophobicContact CG2-CD1 4.33Å; V345-I381 HydrophobicContact CG2-CG1 4.18Å; V345-I381 HydrophobicContact CG2-CG2 4.24Å
346	M	97.6	Very high	96.7	Very high	13 Å²	13	45.8 Å²	45.8	6%	0.064	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.7	162.6	60.3	-169.6	178.5	0	0	109.4	F351 E357 V360 Y366 I380	M346-F351 HydrophobicContact CE-CB 4.38Å; M346-F351 HydrophobicContact CE-CD2 3.34Å; M346-F351 HydrophobicContact CE-CE2 3.68Å; M346-F351 HydrophobicContact CE-CG 3.94Å; M346-F351 HydrophobicContact SD-CB 4.24Å; M346-F351 HydrophobicContact SD-CD2 3.58Å; M346-F351 VanDerWaalsContact SD-CD2 3.58Å; M346-F351 HydrophobicContact SD-CE2 4.34Å; M346-F351 HydrophobicContact SD-CG 4.25Å; M346-E357 HydrophobicContact SD-CG 4.35Å; M346-V360 HydrophobicContact CB-CG1 3.81Å; M346-V360 HydrophobicContact SD-CB 4.4Å; M346-V360 HydrophobicContact SD-CG1 4.14Å; M346-V360 HydrophobicContact SD-CG2 4.37Å; M346-Y366 HydrophobicContact CB-CD2 4.32Å; M346-Y366 HydrophobicContact SD-CD2 4.09Å; M346-Y366 HydrophobicContact SD-CE2 4.28Å; M346-I380 HydrophobicContact CE-CB 3.92Å; M346-I380 HydrophobicContact CE-CD1 4.04Å; M346-I380 HydrophobicContact CE-CG2 3.52Å; M346-I380 HydrophobicContact CG-CB 3.88Å; M346-I380 HydrophobicContact CG-CD1 4.49Å; M346-I380 HydrophobicContact CG-CG2 4.44Å; M346-I380 PolarHBondContact N-O 3.15Å; M346-I380 PolarHBondContact O-N 2.94Å
347	S	97.6	Very high	96.6	Very high	38 Å²	38	47.9 Å²	47.9	27%	0.266	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	149.9	174.3	74.9	0	0	0	0	110	E349 D350 F351	S347-E349 PolarHBondContact O-N 2.93Å; S347-D350 PolarHBondContact O-N 2.97Å; S347-D350 VanDerWaalsContact OG-CB 3.3Å; S347-D350 WeakPolarHBondContact OG-CB 3.49Å; S347-D350 PolarHBondContact OG-N 3.31Å; S347-D350 PolarHBondContact OG-OD2 2.86Å; S347-F351 PolarHBondContact O-N 2.98Å
348	Y	97.8	Very high	96.7	Very high	11 Å²	11	47.7 Å²	47.7	4%	0.043	26%	0.261	C	S	.	.	H	α-helix	trans	-54.6	-41.9	170.7	160.1	-93.8	0	0	0	112.1	R69 W72 L73 D350 F351 K352 G378	R69-Y348 VanDerWaalsContact CA-CE2 3.48Å; R69-Y348 HydrophobicContact CB-CD1 4.09Å; R69-Y348 HydrophobicContact CB-CD2 3.76Å; R69-Y348 HydrophobicContact CB-CE1 4Å; R69-Y348 HydrophobicContact CB-CE2 3.64Å; R69-Y348 HydrophobicContact CB-CG 3.97Å; R69-Y348 HydrophobicContact CG-CD1 3.65Å; R69-Y348 HydrophobicContact CG-CD2 4.26Å; R69-Y348 HydrophobicContact CG-CE1 3.5Å; R69-Y348 VanDerWaalsContact CG-CE1 3.5Å; R69-Y348 HydrophobicContact CG-CE2 4.12Å; R69-Y348 HydrophobicContact CG-CG 4.02Å; W72-Y348 HydrophobicContact CB-CE2 4.29Å; W72-Y348 HydrophobicContact CD2-CE2 4.16Å; W72-Y348 HydrophobicContact CE3-CD2 4.41Å; W72-Y348 AromaticContact CE3-CE2 3.7Å; W72-Y348 HydrophobicContact CE3-CE2 3.7Å; W72-Y348 HydrophobicContact CG-CE2 4.42Å; W72-Y348 HydrophobicContact CZ3-CE2 4.47Å; L73-Y348 HydrophobicContact CD1-CD2 4.21Å; L73-Y348 HydrophobicContact CD2-CD2 4.46Å; L73-Y348 HydrophobicContact CG-CD2 4.15Å; L73-Y348 HydrophobicContact CG-CE2 4.37Å; Y348-D350 PolarHBondContact O-N 3.26Å; Y348-F351 PolarHBondContact O-N 3.38Å; Y348-K352 HydrophobicContact CE1-CD 3.97Å; Y348-K352 HydrophobicContact CE2-CD 4.32Å; Y348-K352 WeakPolarHBondContact O-CB 3.25Å; Y348-K352 PolarHBondContact O-N 2.92Å; Y348-K352 WeakPolarHBondContact OH-CD 3.24Å; Y348-K352 PolarHBondContact OH-NZ 3.34Å; Y348-K352 VanDerWaalsContact OH-NZ 3.1Å; Y348-G378 WeakPolarHBondContact CB-O 3.38Å; Y348-G378 PolarHBondContact N-O 2.79Å
349	E	97.4	Very high	96.9	Very high	115 Å²	115	43 Å²	43	54%	0.537	25%	0.246	S	C	.	.	H	α-helix	trans	-64.2	-42.4	-178.4	-65.5	-57.9	152.8	0	0	112.2	S347 T353	S347-E349 PolarHBondContact O-N 2.93Å; E349-T353 VanDerWaalsContact O-CB 3.3Å; E349-T353 WeakPolarHBondContact O-CB 3.31Å; E349-T353 PolarHBondContact O-N 2.81Å; E349-T353 PolarHBondContact O-OG1 3.04Å
350	D	97.5	Very high	96.9	Very high	32 Å²	32	42.8 Å²	42.8	17%	0.171	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-43.7	175.2	-70.6	-45.3	0	0	0	110.7	S347 Y348 T353 E354 K365	S347-D350 PolarHBondContact O-N 2.97Å; S347-D350 VanDerWaalsContact OG-CB 3.3Å; S347-D350 WeakPolarHBondContact OG-CB 3.49Å; S347-D350 PolarHBondContact OG-N 3.31Å; S347-D350 PolarHBondContact OG-OD2 2.86Å; Y348-D350 PolarHBondContact O-N 3.26Å; D350-T353 PolarHBondContact O-N 2.93Å; D350-E354 WeakPolarHBondContact O-CB 3.46Å; D350-E354 VanDerWaalsContact O-CG 3.22Å; D350-E354 WeakPolarHBondContact O-CG 3.39Å; D350-E354 PolarHBondContact O-N 3.48Å; D350-K365 HydrophobicContact CB-CB 4.16Å; D350-K365 HydrophobicContact CB-CD 4.04Å; D350-K365 WeakPolarHBondContact OD1-CD 3.49Å; D350-K365 WeakPolarHBondContact OD1-CE 3.27Å; D350-K365 IonicContact OD1-NZ 2.91Å; D350-K365 PolarHBondContact OD1-NZ 3.13Å; D350-K365 VanDerWaalsContact OD1-NZ 3.17Å
351	F	97.8	Very high	96.9	Very high	5 Å²	5	47.2 Å²	47.2	2%	0.022	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-42.4	178.7	-175	-102.2	0	0	0	112.8	W72 L73 Y76 H77 M346 S347 Y348 T353 G355 E357 V360 I380	W72-F351 AromaticContact CH2-CD1 3.95Å; W72-F351 HydrophobicContact CH2-CD1 3.95Å; W72-F351 HydrophobicContact CH2-CE1 4.01Å; W72-F351 AromaticContact CZ3-CD1 3.63Å; W72-F351 HydrophobicContact CZ3-CD1 3.63Å; W72-F351 AromaticContact CZ3-CE1 3.76Å; W72-F351 HydrophobicContact CZ3-CE1 3.76Å; L73-F351 HydrophobicContact CD2-CD1 4.07Å; L73-F351 HydrophobicContact CD2-CE1 4.09Å; Y76-F351 AromaticContact CD1-CE1 3.86Å; Y76-F351 HydrophobicContact CD1-CE1 3.86Å; Y76-F351 HydrophobicContact CD1-CZ 4.04Å; Y76-F351 AromaticContact CE1-CE1 3.82Å; Y76-F351 HydrophobicContact CE1-CE1 3.82Å; Y76-F351 AromaticContact CE1-CZ 3.54Å; Y76-F351 HydrophobicContact CE1-CZ 3.54Å; Y76-F351 HydrophobicContact CG-CE1 4.43Å; H77-F351 AromaticContact NE2-CE1 3.83Å; H77-F351 AromaticContact NE2-CZ 3.77Å; M346-F351 HydrophobicContact CE-CB 4.38Å; M346-F351 HydrophobicContact CE-CD2 3.34Å; M346-F351 HydrophobicContact CE-CE2 3.68Å; M346-F351 HydrophobicContact CE-CG 3.94Å; M346-F351 HydrophobicContact SD-CB 4.24Å; M346-F351 HydrophobicContact SD-CD2 3.58Å; M346-F351 VanDerWaalsContact SD-CD2 3.58Å; M346-F351 HydrophobicContact SD-CE2 4.34Å; M346-F351 HydrophobicContact SD-CG 4.25Å; S347-F351 PolarHBondContact O-N 2.98Å; Y348-F351 PolarHBondContact O-N 3.38Å; F351-T353 VanDerWaalsContact C-N 3.34Å; F351-T353 PolarHBondContact O-N 2.72Å; F351-G355 WeakPolarHBondContact O-CA 3.22Å; F351-G355 PolarHBondContact O-N 2.84Å; F351-E357 HydrophobicContact CE2-CB 4.38Å; F351-V360 HydrophobicContact CB-CG2 4.35Å; F351-V360 HydrophobicContact CD2-CG2 4.17Å; F351-I380 HydrophobicContact CB-CD1 3.71Å; F351-I380 HydrophobicContact CD1-CD1 3.84Å; F351-I380 HydrophobicContact CG-CD1 3.82Å
352	K	97.4	Very high	96.9	Very high	91 Å²	91	46.9 Å²	46.9	40%	0.396	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-39.2	175.3	-178.4	171.1	-173.4	173.4	0	112.5	W72 Y348	W72-K352 HydrophobicContact CD2-CD 4.31Å; W72-K352 HydrophobicContact CD2-CG 4.3Å; W72-K352 HydrophobicContact CH2-CB 4.11Å; W72-K352 HydrophobicContact CH2-CG 4.3Å; W72-K352 HydrophobicContact CZ2-CB 4.14Å; W72-K352 HydrophobicContact CZ2-CG 3.81Å; W72-K352 HydrophobicContact CZ3-CB 4.36Å; Y348-K352 HydrophobicContact CE1-CD 3.97Å; Y348-K352 HydrophobicContact CE2-CD 4.32Å; Y348-K352 WeakPolarHBondContact O-CB 3.25Å; Y348-K352 PolarHBondContact O-N 2.92Å; Y348-K352 WeakPolarHBondContact OH-CD 3.24Å; Y348-K352 PolarHBondContact OH-NZ 3.34Å; Y348-K352 VanDerWaalsContact OH-NZ 3.1Å
353	T	97.4	Very high	96.8	Very high	100 Å²	100	46.9 Å²	46.9	61%	0.613	28%	0.282	S	S	*	.	H	α-helix	trans	-71.3	-46.7	-179.4	-59.3	0	0	0	0	112	E349 D350 F351	E349-T353 VanDerWaalsContact O-CB 3.3Å; E349-T353 WeakPolarHBondContact O-CB 3.31Å; E349-T353 PolarHBondContact O-N 2.81Å; E349-T353 PolarHBondContact O-OG1 3.04Å; D350-T353 PolarHBondContact O-N 2.93Å; F351-T353 VanDerWaalsContact C-N 3.34Å; F351-T353 PolarHBondContact O-N 2.72Å
354	E	96.7	Very high	96.7	Very high	64 Å²	64	49.7 Å²	49.7	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-83.9	-18.4	-175.6	-55.2	-59.8	157.2	0	0	112.5	D350 S356 A359 V360 A363 K365	D350-E354 WeakPolarHBondContact O-CB 3.46Å; D350-E354 VanDerWaalsContact O-CG 3.22Å; D350-E354 WeakPolarHBondContact O-CG 3.39Å; D350-E354 PolarHBondContact O-N 3.48Å; E354-S356 PolarHBondContact O-N 2.85Å; E354-S356 VanDerWaalsContact O-N 3.13Å; E354-A359 HydrophobicContact CB-CB 3.8Å; E354-A359 VanDerWaalsContact O-CB 3.3Å; E354-A359 WeakPolarHBondContact O-CB 3.42Å; E354-V360 HydrophobicContact CB-CG2 3.71Å; E354-V360 HydrophobicContact CG-CG2 3.94Å; E354-A363 HydrophobicContact CG-CB 4.36Å; E354-K365 HydrophobicContact CG-CD 4.37Å; E354-K365 IonicContact OE1-NZ 2.6Å; E354-K365 PolarHBondContact OE1-NZ 2.86Å
355	G	93.6	Very high	96.7	Very high	32 Å²	32	51.5 Å²	51.5	33%	0.33	32%	0.318	S	S	.	.			trans	73.5	-1.8	172.2	0	0	0	0	0	115.8	Y76 F351	Y76-G355 WeakPolarHBondContact CE2-O 3.13Å; Y76-G355 PolarHBondContact OH-O 2.62Å; F351-G355 WeakPolarHBondContact O-CA 3.22Å; F351-G355 PolarHBondContact O-N 2.84Å
356	S	94.8	Very high	96.6	Very high	39 Å²	39	53 Å²	53	27%	0.273	32%	0.324	S	S	.	.	S	Bend	trans	-161.6	155.3	171.6	69	0	0	0	0	112.5	E354 A358 A359 V360	E354-S356 PolarHBondContact O-N 2.85Å; E354-S356 VanDerWaalsContact O-N 3.13Å; S356-A358 VanDerWaalsContact C-N 3.26Å; S356-A358 PolarHBondContact O-N 3.11Å; S356-A359 PolarHBondContact O-N 3.14Å; S356-A359 VanDerWaalsContact O-N 3.14Å; S356-A359 VanDerWaalsContact OG-CB 3.29Å; S356-A359 WeakPolarHBondContact OG-CB 3.4Å; S356-A359 PolarHBondContact OG-N 3.3Å; S356-A359 VanDerWaalsContact OG-N 3.15Å; S356-V360 WeakPolarHBondContact O-CG2 3.36Å; S356-V360 PolarHBondContact O-N 3.36Å
357	E	93.7	Very high	96.6	Very high	79 Å²	79	57.4 Å²	57.4	37%	0.369	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-36.9	176.6	-171.6	-170.5	135.3	0	0	112.1	M346 F351 V360 K361 Y366	M346-E357 HydrophobicContact SD-CG 4.35Å; F351-E357 HydrophobicContact CE2-CB 4.38Å; E357-V360 PolarHBondContact O-N 3.4Å; E357-K361 WeakPolarHBondContact O-CG 3.19Å; E357-K361 PolarHBondContact O-N 3.3Å; E357-K361 WeakPolarHBondContact OE1-CE 3.29Å; E357-K361 IonicContact OE1-NZ 3.54Å; E357-K361 PolarHBondContact OE1-NZ 2.82Å; E357-Y366 HydrophobicContact CG-CD2 4.12Å; E357-Y366 HydrophobicContact CG-CE2 3.76Å
358	A	95.9	Very high	96.6	Very high	71 Å²	71	61.9 Å²	61.9	59%	0.587	36%	0.359	S	S	*	.	H	α-helix	trans	-63.7	-41.9	176.9	0	0	0	0	0	111.7	S356 K361 A362	S356-A358 VanDerWaalsContact C-N 3.26Å; S356-A358 PolarHBondContact O-N 3.11Å; A358-K361 PolarHBondContact O-N 3Å; A358-A362 WeakPolarHBondContact O-CB 3.35Å; A358-A362 PolarHBondContact O-N 3.15Å
359	A	97.1	Very high	96.6	Very high	28 Å²	28	64.3 Å²	64.3	23%	0.231	37%	0.37	C	S	.	.	H	α-helix	trans	-67.5	-41.2	175.5	0	0	0	0	0	111.8	E354 S356 K361 A362 A363	E354-A359 HydrophobicContact CB-CB 3.8Å; E354-A359 VanDerWaalsContact O-CB 3.3Å; E354-A359 WeakPolarHBondContact O-CB 3.42Å; S356-A359 PolarHBondContact O-N 3.14Å; S356-A359 VanDerWaalsContact O-N 3.14Å; S356-A359 VanDerWaalsContact OG-CB 3.29Å; S356-A359 WeakPolarHBondContact OG-CB 3.4Å; S356-A359 PolarHBondContact OG-N 3.3Å; S356-A359 VanDerWaalsContact OG-N 3.15Å; A359-K361 VanDerWaalsContact C-N 3.3Å; A359-K361 PolarHBondContact O-N 3.4Å; A359-A362 PolarHBondContact O-N 3.38Å; A359-A362 VanDerWaalsContact O-N 3.15Å; A359-A363 WeakPolarHBondContact O-CB 3.41Å; A359-A363 PolarHBondContact O-N 2.94Å
360	V	97.2	Very high	96.6	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-59.9	-39.4	174	176.6	0	0	0	0	112.1	M346 F351 E354 S356 E357 G364 K365 Y366	M346-V360 HydrophobicContact CB-CG1 3.81Å; M346-V360 HydrophobicContact SD-CB 4.4Å; M346-V360 HydrophobicContact SD-CG1 4.14Å; M346-V360 HydrophobicContact SD-CG2 4.37Å; F351-V360 HydrophobicContact CB-CG2 4.35Å; F351-V360 HydrophobicContact CD2-CG2 4.17Å; E354-V360 HydrophobicContact CB-CG2 3.71Å; E354-V360 HydrophobicContact CG-CG2 3.94Å; S356-V360 WeakPolarHBondContact O-CG2 3.36Å; S356-V360 PolarHBondContact O-N 3.36Å; E357-V360 PolarHBondContact O-N 3.4Å; V360-G364 PolarHBondContact O-N 3.37Å; V360-K365 HydrophobicContact CG1-CB 3.88Å; V360-K365 PolarHBondContact O-N 2.95Å; V360-Y366 PolarHBondContact O-N 3.5Å
361	K	96.8	Very high	96.6	Very high	97 Å²	97	65.4 Å²	65.4	42%	0.422	38%	0.38	S	S	.	.	H	α-helix	trans	-65.3	-46.8	172.7	-76.2	175.3	-175.8	172	0	111.9	E357 A358 A359 A363 G364 Y366	E357-K361 WeakPolarHBondContact O-CG 3.19Å; E357-K361 PolarHBondContact O-N 3.3Å; E357-K361 WeakPolarHBondContact OE1-CE 3.29Å; E357-K361 IonicContact OE1-NZ 3.54Å; E357-K361 PolarHBondContact OE1-NZ 2.82Å; A358-K361 PolarHBondContact O-N 3Å; A359-K361 VanDerWaalsContact C-N 3.3Å; A359-K361 PolarHBondContact O-N 3.4Å; K361-A363 PolarHBondContact O-N 2.86Å; K361-G364 PolarHBondContact O-N 3.31Å; K361-Y366 HydrophobicContact CD-CD1 4.39Å; K361-Y366 HydrophobicContact CD-CG 4.34Å; K361-Y366 VanDerWaalsContact CE-CE1 3.48Å; K361-Y366 VanDerWaalsContact CE-CZ 3.5Å; K361-Y366 VanDerWaalsContact CG-CB 3.48Å; K361-Y366 HydrophobicContact CG-CD1 3.91Å; K361-Y366 HydrophobicContact CG-CD2 3.94Å; K361-Y366 HydrophobicContact CG-CG 3.52Å
362	A	96.7	Very high	96.5	Very high	92 Å²	92	72 Å²	72	76%	0.76	41%	0.412	S	S	*	.	H	α-helix	trans	-62.2	-33.9	179	0	0	0	0	0	112.3	A358 A359 G364	A358-A362 WeakPolarHBondContact O-CB 3.35Å; A358-A362 PolarHBondContact O-N 3.15Å; A359-A362 PolarHBondContact O-N 3.38Å; A359-A362 VanDerWaalsContact O-N 3.15Å; A362-G364 PolarHBondContact O-N 3.33Å
363	A	96.7	Very high	96.6	Very high	48 Å²	48	69.1 Å²	69.1	40%	0.397	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-0.9	175.3	0	0	0	0	0	114	E354 A359 K361 K365	E354-A363 HydrophobicContact CG-CB 4.36Å; A359-A363 WeakPolarHBondContact O-CB 3.41Å; A359-A363 PolarHBondContact O-N 2.94Å; K361-A363 PolarHBondContact O-N 2.86Å; A363-K365 HydrophobicContact CB-CD 3.9Å; A363-K365 HydrophobicContact CB-CG 4.33Å; A363-K365 PolarHBondContact O-N 3.13Å
364	G	95.7	Very high	96.5	Very high	59 Å²	59	67.1 Å²	67.1	61%	0.608	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	17.1	-179.3	0	0	0	0	0	114.5	V360 K361 A362	V360-G364 PolarHBondContact O-N 3.37Å; K361-G364 PolarHBondContact O-N 3.31Å; A362-G364 PolarHBondContact O-N 3.33Å
365	K	96.7	Very high	96.6	Very high	62 Å²	62	64.2 Å²	64.2	27%	0.27	37%	0.372	S	S	.	.			trans	-96	-12	-177.1	-72.1	163.7	165	-165.9	0	113.1	D350 E354 V360 A363	D350-K365 HydrophobicContact CB-CB 4.16Å; D350-K365 HydrophobicContact CB-CD 4.04Å; D350-K365 WeakPolarHBondContact OD1-CD 3.49Å; D350-K365 WeakPolarHBondContact OD1-CE 3.27Å; D350-K365 IonicContact OD1-NZ 2.91Å; D350-K365 PolarHBondContact OD1-NZ 3.13Å; D350-K365 VanDerWaalsContact OD1-NZ 3.17Å; E354-K365 HydrophobicContact CG-CD 4.37Å; E354-K365 IonicContact OE1-NZ 2.6Å; E354-K365 PolarHBondContact OE1-NZ 2.86Å; V360-K365 HydrophobicContact CG1-CB 3.88Å; V360-K365 PolarHBondContact O-N 2.95Å; A363-K365 HydrophobicContact CB-CD 3.9Å; A363-K365 HydrophobicContact CB-CG 4.33Å; A363-K365 PolarHBondContact O-N 3.13Å
366	Y	97	Very high	96.7	Very high	38 Å²	38	68.2 Å²	68.2	15%	0.149	38%	0.383	C	S	.	.			trans	-80.1	116.1	170	-163.6	-92.2	0	0	0	110.6	E344 M346 E357 V360 K361	E344-Y366 HydrophobicContact CB-CE1 3.62Å; E344-Y366 WeakPolarHBondContact CB-OH 3.4Å; E344-Y366 HydrophobicContact CG-CE1 4.02Å; E344-Y366 PolarHBondContact OE2-OH 3.48Å; M346-Y366 HydrophobicContact CB-CD2 4.32Å; M346-Y366 HydrophobicContact SD-CD2 4.09Å; M346-Y366 HydrophobicContact SD-CE2 4.28Å; E357-Y366 HydrophobicContact CG-CD2 4.12Å; E357-Y366 HydrophobicContact CG-CE2 3.76Å; V360-Y366 PolarHBondContact O-N 3.5Å; K361-Y366 HydrophobicContact CD-CD1 4.39Å; K361-Y366 HydrophobicContact CD-CG 4.34Å; K361-Y366 VanDerWaalsContact CE-CE1 3.48Å; K361-Y366 VanDerWaalsContact CE-CZ 3.5Å; K361-Y366 VanDerWaalsContact CG-CB 3.48Å; K361-Y366 HydrophobicContact CG-CD1 3.91Å; K361-Y366 HydrophobicContact CG-CD2 3.94Å; K361-Y366 HydrophobicContact CG-CG 3.52Å
367	K	97.4	Very high	96.9	Very high	105 Å²	105	70 Å²	70	46%	0.457	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.6	-170	-63.1	172.9	-169.3	164.6	0	111.5	E344 V345 K369	E344-K367 WeakPolarHBondContact CA-O 3.44Å; V345-K367 PolarHBondContact N-O 3.18Å; V345-K367 PolarHBondContact O-N 3.14Å; K367-K369 HydrophobicContact CB-CD 4.46Å; K367-K369 HydrophobicContact CB-CG 4.42Å
368	Q	97.5	Very high	97	Very high	131 Å²	131	66.3 Å²	66.3	61%	0.612	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.3	165.5	-68.4	-178.6	-9.8	0	0	109.5	M342 E344	M342-Q368 HydrophobicContact SD-CB 3.93Å; M342-Q368 VanDerWaalsContact SD-CD 3.55Å; M342-Q368 HydrophobicContact SD-CG 3.69Å; E344-Q368 HydrophobicContact CG-CG 4.46Å
369	K	97.9	Very high	97.2	Very high	62 Å²	62	63.1 Å²	63.1	27%	0.27	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.9	-173.6	-66.7	-62.2	-167.5	172.3	0	110.6	M342 A343 V345 K367 Y373	M342-K369 WeakPolarHBondContact CA-O 3.27Å; A343-K369 HydrophobicContact CB-CB 4.33Å; A343-K369 PolarHBondContact N-O 2.85Å; A343-K369 PolarHBondContact O-N 3.3Å; V345-K369 HydrophobicContact CB-CG 4.2Å; V345-K369 HydrophobicContact CG2-CB 4.12Å; V345-K369 HydrophobicContact CG2-CG 3.83Å; K367-K369 HydrophobicContact CB-CD 4.46Å; K367-K369 HydrophobicContact CB-CG 4.42Å; K369-Y373 HydrophobicContact CB-CD1 3.81Å; K369-Y373 HydrophobicContact CB-CD2 4.37Å; K369-Y373 HydrophobicContact CB-CG 3.7Å; K369-Y373 HydrophobicContact CD-CD1 4.46Å; K369-Y373 HydrophobicContact CD-CD2 3.68Å; K369-Y373 HydrophobicContact CD-CE2 4.07Å; K369-Y373 HydrophobicContact CD-CG 3.91Å; K369-Y373 HydrophobicContact CG-CD1 3.85Å; K369-Y373 HydrophobicContact CG-CD2 3.99Å; K369-Y373 HydrophobicContact CG-CE1 4.15Å; K369-Y373 HydrophobicContact CG-CE2 4.32Å; K369-Y373 HydrophobicContact CG-CG 3.76Å
370	G	97.2	Very high	97.2	Very high	43 Å²	43	62.3 Å²	62.3	44%	0.443	34%	0.337	S	S	.	.			trans	-82	-174.7	177.7	0	0	0	0	0	113.5	E372 Y373	G370-E372 PolarHBondContact O-N 2.99Å; G370-E372 VanDerWaalsContact O-N 3.16Å; G370-Y373 WeakPolarHBondContact O-CB 3.45Å; G370-Y373 PolarHBondContact O-N 2.82Å; G370-Y373 VanDerWaalsContact O-N 3.13Å
371	R	97.3	Very high	97.3	Very high	127 Å²	127	62.7 Å²	62.7	48%	0.479	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.3	-176	-69.8	178.6	169.3	-110.4	-4.9	114.6	P326 F340 Y373	P326-R371 VanDerWaalsContact CD-O 3.25Å; P326-R371 WeakPolarHBondContact CD-O 3.32Å; P326-R371 HydrophobicContact CG-CB 3.94Å; P326-R371 HydrophobicContact CG-CG 3.88Å; F340-R371 HydrophobicContact CD1-CG 3.5Å; F340-R371 VanDerWaalsContact CD1-CG 3.5Å; F340-R371 HydrophobicContact CE1-CB 4.34Å; F340-R371 HydrophobicContact CE1-CG 3.62Å; F340-R371 PolarHBondContact O-NH2 3.16Å; R371-Y373 VanDerWaalsContact C-N 3.32Å; R371-Y373 PolarHBondContact O-N 3.39Å
372	E	96.6	Very high	97.3	Very high	145 Å²	145	62.1 Å²	62.1	68%	0.678	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-5.4	-177	-64.2	-51.9	129.3	0	0	114.3	K324 G370 V374	K324-E372 WeakPolarHBondContact CD-O 3.32Å; K324-E372 PolarHBondContact NZ-O 2.82Å; K324-E372 IonicContact NZ-OE2 4Å; G370-E372 PolarHBondContact O-N 2.99Å; G370-E372 VanDerWaalsContact O-N 3.16Å; E372-V374 PolarHBondContact O-N 3.27Å
373	Y	97.9	Very high	97.3	Very high	30 Å²	30	58.4 Å²	58.4	12%	0.118	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-64.1	128.1	177	-178.1	-118.7	0	0	0	110.5	K324 A325 V345 K369 G370 R371 V375 E376 D379	K324-Y373 CarbonylContact C-O 3.47Å; K324-Y373 VanDerWaalsContact CA-O 3.24Å; K324-Y373 WeakPolarHBondContact CA-O 3.43Å; A325-Y373 HydrophobicContact CB-CD1 4.45Å; A325-Y373 PolarHBondContact N-O 3.04Å; V345-Y373 HydrophobicContact CG1-CE1 4.12Å; V345-Y373 HydrophobicContact CG2-CD1 4.25Å; V345-Y373 HydrophobicContact CG2-CE1 3.9Å; K369-Y373 HydrophobicContact CB-CD1 3.81Å; K369-Y373 HydrophobicContact CB-CD2 4.37Å; K369-Y373 HydrophobicContact CB-CG 3.7Å; K369-Y373 HydrophobicContact CD-CD1 4.46Å; K369-Y373 HydrophobicContact CD-CD2 3.68Å; K369-Y373 HydrophobicContact CD-CE2 4.07Å; K369-Y373 HydrophobicContact CD-CG 3.91Å; K369-Y373 HydrophobicContact CG-CD1 3.85Å; K369-Y373 HydrophobicContact CG-CD2 3.99Å; K369-Y373 HydrophobicContact CG-CE1 4.15Å; K369-Y373 HydrophobicContact CG-CE2 4.32Å; K369-Y373 HydrophobicContact CG-CG 3.76Å; G370-Y373 WeakPolarHBondContact O-CB 3.45Å; G370-Y373 PolarHBondContact O-N 2.82Å; G370-Y373 VanDerWaalsContact O-N 3.13Å; R371-Y373 VanDerWaalsContact C-N 3.32Å; R371-Y373 PolarHBondContact O-N 3.39Å; Y373-V375 HydrophobicContact CD1-CG2 4.42Å; Y373-E376 PolarHBondContact OH-OE1 3.49Å; Y373-E376 VanDerWaalsContact OH-OE1 3.11Å; Y373-D379 PolarHBondContact OH-OD2 3.13Å
374	V	97.1	Very high	97.3	Very high	58 Å²	58	60 Å²	60	35%	0.352	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-86	120.6	169.3	-179.7	0	0	0	0	106.2	K324 E372	K324-V374 HydrophobicContact CD-CG2 3.9Å; E372-V374 PolarHBondContact O-N 3.27Å
375	V	97.6	Very high	97.3	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.018	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-65.9	135.1	179.3	174.4	0	0	0	0	109.3	H304 F306 I319 S323 A325 A328 Y373 D379 I381	H304-V375 PolarHBondContact CE1-O 2.96Å; H304-V375 VanDerWaalsContact CE1-O 3.23Å; F306-V375 HydrophobicContact CB-CG1 3.93Å; F306-V375 HydrophobicContact CD1-CG1 4.35Å; F306-V375 HydrophobicContact CG-CG1 4.43Å; I319-V375 HydrophobicContact CD1-CB 3.71Å; I319-V375 HydrophobicContact CD1-CG1 3.47Å; I319-V375 VanDerWaalsContact CD1-CG1 3.47Å; S323-V375 PolarHBondContact O-N 3.38Å; A325-V375 HydrophobicContact CB-CG2 4.42Å; A328-V375 HydrophobicContact CB-CB 4.49Å; A328-V375 HydrophobicContact CB-CG2 3.69Å; Y373-V375 HydrophobicContact CD1-CG2 4.42Å; V375-D379 HydrophobicContact CG1-CB 4.34Å; V375-I381 HydrophobicContact CB-CD1 4.42Å; V375-I381 HydrophobicContact CG1-CD1 3.63Å; V375-I381 HydrophobicContact CG2-CD1 3.95Å
376	E	96.9	Very high	97.1	Very high	116 Å²	116	62.3 Å²	62.3	54%	0.542	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-93.3	158.4	178.6	-66.7	169.7	-139.7	0	0	110.2	Y373 G378 D379	Y373-E376 PolarHBondContact OH-OE1 3.49Å; Y373-E376 VanDerWaalsContact OH-OE1 3.11Å; E376-G378 PolarHBondContact O-N 2.89Å; E376-D379 PolarHBondContact N-OD2 2.87Å; E376-D379 PolarHBondContact O-N 3.16Å
377	D	97.3	Very high	96.4	Very high	75 Å²	75	63.5 Å²	63.5	40%	0.401	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	129.5	178.5	-178.7	55.4	0	0	0	111.1	R69 H304 Y305 D379	R69-D377 IonicContact CZ-OD2 2.82Å; R69-D377 VanDerWaalsContact CZ-OD2 3.29Å; R69-D377 PolarHBondContact NH1-O 2.82Å; R69-D377 IonicContact NH1-OD2 2.73Å; R69-D377 PolarHBondContact NH1-OD2 2.82Å; R69-D377 IonicContact NH2-OD1 2.78Å; R69-D377 IonicContact NH2-OD2 3.25Å; R69-D377 PolarHBondContact NH2-OD2 3.2Å; H304-D377 HydrophobicContact CB-CB 3.89Å; H304-D377 VanDerWaalsContact CB-OD1 3.32Å; H304-D377 WeakPolarHBondContact CB-OD1 3.18Å; Y305-D377 PolarHBondContact N-OD1 2.9Å; D377-D379 VanDerWaalsContact C-N 3.31Å
378	G	97.5	Very high	95.5	Very high	2 Å²	2	60 Å²	60	2%	0.021	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	10.9	-179.2	0	0	0	0	0	114.9	Y305 Y348 E376	Y305-G378 PolarHBondContact O-N 2.74Å; Y348-G378 WeakPolarHBondContact CB-O 3.38Å; Y348-G378 PolarHBondContact N-O 2.79Å; E376-G378 PolarHBondContact O-N 2.89Å
379	D	98.4	Very high	94	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	141.2	168.1	-83.9	-19.4	0	0	0	110.4	F306 F307 V345 Y373 V375 E376 D377 I381	F306-D379 CarbonylContact C-O 3.42Å; F306-D379 VanDerWaalsContact CA-O 3.28Å; F306-D379 WeakPolarHBondContact CA-O 3.27Å; F306-D379 HydrophobicContact CB-CB 4.21Å; F306-D379 VanDerWaalsContact CB-O 3.31Å; F306-D379 WeakPolarHBondContact CB-O 3.43Å; F307-D379 PolarHBondContact N-O 3.19Å; V345-D379 HydrophobicContact CG1-CB 4.06Å; Y373-D379 PolarHBondContact OH-OD2 3.13Å; V375-D379 HydrophobicContact CG1-CB 4.34Å; E376-D379 PolarHBondContact N-OD2 2.87Å; E376-D379 PolarHBondContact O-N 3.16Å; D377-D379 VanDerWaalsContact C-N 3.31Å; D379-I381 HydrophobicContact CB-CD1 3.77Å; D379-I381 HydrophobicContact CB-CG1 3.7Å
380	I	98.5	Very high	92.1	Very high	11 Å²	11	53.6 Å²	53.6	6%	0.056	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.5	166.7	-54.2	168.2	0	0	0	107	L73 F307 C309 M346 F351	L73-I380 HydrophobicContact CD2-CD1 3.83Å; F307-I380 HydrophobicContact CB-CG1 4.36Å; F307-I380 HydrophobicContact CD2-CG1 4.47Å; F307-I380 WeakPolarHBondContact O-CA 3.39Å; C309-I380 HydrophobicContact CB-CG2 4.43Å; M346-I380 HydrophobicContact CE-CB 3.92Å; M346-I380 HydrophobicContact CE-CD1 4.04Å; M346-I380 HydrophobicContact CE-CG2 3.52Å; M346-I380 HydrophobicContact CG-CB 3.88Å; M346-I380 HydrophobicContact CG-CD1 4.49Å; M346-I380 HydrophobicContact CG-CG2 4.44Å; M346-I380 PolarHBondContact N-O 3.15Å; M346-I380 PolarHBondContact O-N 2.94Å; F351-I380 HydrophobicContact CB-CD1 3.71Å; F351-I380 HydrophobicContact CD1-CD1 3.84Å; F351-I380 HydrophobicContact CG-CD1 3.82Å
381	I	98.4	Very high	90.3	Very high	7 Å²	7	58.8 Å²	58.8	4%	0.036	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.8	-167.9	-50.3	-176.1	0	0	0	112.2	F306 F307 A343 E344 V345 V375 D379 F383	F306-I381 HydrophobicContact CB-CD1 3.87Å; F306-I381 HydrophobicContact CB-CG1 4.2Å; F306-I381 HydrophobicContact CD2-CB 4Å; F306-I381 HydrophobicContact CD2-CD1 4.09Å; F306-I381 HydrophobicContact CD2-CG1 4.11Å; F306-I381 HydrophobicContact CE2-CB 4.49Å; F306-I381 HydrophobicContact CG-CD1 3.96Å; F306-I381 HydrophobicContact CG-CG1 4.37Å; F307-I381 PolarHBondContact O-N 3.36Å; A343-I381 HydrophobicContact CB-CG2 3.86Å; E344-I381 WeakPolarHBondContact O-CA 3.28Å; V345-I381 HydrophobicContact CG1-CG1 4.35Å; V345-I381 HydrophobicContact CG2-CD1 4.33Å; V345-I381 HydrophobicContact CG2-CG1 4.18Å; V345-I381 HydrophobicContact CG2-CG2 4.24Å; V375-I381 HydrophobicContact CB-CD1 4.42Å; V375-I381 HydrophobicContact CG1-CD1 3.63Å; V375-I381 HydrophobicContact CG2-CD1 3.95Å; D379-I381 HydrophobicContact CB-CD1 3.77Å; D379-I381 HydrophobicContact CB-CG1 3.7Å; I381-F383 HydrophobicContact CB-CE2 4.27Å; I381-F383 HydrophobicContact CB-CZ 4.24Å; I381-F383 HydrophobicContact CD1-CZ 4.2Å; I381-F383 HydrophobicContact CG2-CD1 3.91Å; I381-F383 HydrophobicContact CG2-CD2 4.09Å; I381-F383 HydrophobicContact CG2-CE1 3.6Å; I381-F383 HydrophobicContact CG2-CE2 3.78Å; I381-F383 HydrophobicContact CG2-CG 4.17Å; I381-F383 HydrophobicContact CG2-CZ 3.53Å
382	L	97	Very high	88.3	Confident	85 Å²	85	60.7 Å²	60.7	45%	0.445	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.3	162	-178.8	65.6	0	0	0	109.8	E344	E344-L382 HydrophobicContact CB-CB 4.35Å; E344-L382 PolarHBondContact N-O 3.31Å; E344-L382 PolarHBondContact O-N 3.02Å
383	F	97.6	Very high	86.2	Confident	14 Å²	14	57.8 Å²	57.8	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	128.5	177.7	-65.3	-71.8	0	0	0	111.8	F306 A325 A328 A329 I332 F340 A343 I381	F306-F383 HydrophobicContact CD2-CE2 4.41Å; F306-F383 HydrophobicContact CE1-CE2 4.47Å; F306-F383 AromaticContact CE2-CE2 3.6Å; F306-F383 HydrophobicContact CE2-CE2 3.6Å; F306-F383 HydrophobicContact CE2-CZ 4.27Å; F306-F383 AromaticContact CZ-CE2 3.63Å; F306-F383 HydrophobicContact CZ-CE2 3.63Å; F306-F383 HydrophobicContact CZ-CZ 4.18Å; A325-F383 HydrophobicContact CB-CE1 4.4Å; A325-F383 VanDerWaalsContact O-CE1 3.27Å; A325-F383 WeakPolarHBondContact O-CE1 3.18Å; A328-F383 HydrophobicContact CB-CZ 3.83Å; A329-F383 HydrophobicContact CB-CB 4.26Å; A329-F383 HydrophobicContact CB-CD1 3.65Å; A329-F383 HydrophobicContact CB-CD2 3.9Å; A329-F383 HydrophobicContact CB-CE1 3.85Å; A329-F383 HydrophobicContact CB-CE2 4.09Å; A329-F383 HydrophobicContact CB-CG 3.66Å; A329-F383 HydrophobicContact CB-CZ 4.07Å; I332-F383 HydrophobicContact CD1-CD2 3.67Å; I332-F383 HydrophobicContact CD1-CE2 3.92Å; F340-F383 HydrophobicContact CD2-CD1 4.18Å; F340-F383 AromaticContact CE2-CD1 3.69Å; F340-F383 HydrophobicContact CE2-CD1 3.69Å; F340-F383 HydrophobicContact CE2-CE1 4.01Å; A343-F383 HydrophobicContact CB-CD1 3.81Å; A343-F383 HydrophobicContact CB-CE1 3.74Å; I381-F383 HydrophobicContact CB-CE2 4.27Å; I381-F383 HydrophobicContact CB-CZ 4.24Å; I381-F383 HydrophobicContact CD1-CZ 4.2Å; I381-F383 HydrophobicContact CG2-CD1 3.91Å; I381-F383 HydrophobicContact CG2-CD2 4.09Å; I381-F383 HydrophobicContact CG2-CE1 3.6Å; I381-F383 HydrophobicContact CG2-CE2 3.78Å; I381-F383 HydrophobicContact CG2-CG 4.17Å; I381-F383 HydrophobicContact CG2-CZ 3.53Å
384	K	96.9	Very high	83.8	Confident	81 Å²	81	65.4 Å²	65.4	35%	0.352	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	127	166.3	-56.2	-62.5	-179.7	-175.6	0	108.3	I341 M342 E344	I341-K384 WeakPolarHBondContact CA-O 3.36Å; I341-K384 HydrophobicContact CB-CB 4.25Å; I341-K384 VanDerWaalsContact CB-O 3.3Å; I341-K384 WeakPolarHBondContact CB-O 3.3Å; I341-K384 PolarHBondContact N-O 2.92Å; M342-K384 HydrophobicContact CG-CB 3.91Å; M342-K384 HydrophobicContact CG-CG 3.95Å; M342-K384 PolarHBondContact N-O 2.96Å; M342-K384 PolarHBondContact O-N 3.38Å; E344-K384 HydrophobicContact CG-CG 4.4Å; E344-K384 WeakPolarHBondContact OE1-CE 3.46Å; E344-K384 WeakPolarHBondContact OE2-CE 3.45Å; E344-K384 IonicContact OE2-NZ 3.68Å
385	F	95.1	Very high	81.2	Confident	72 Å²	72	72.9 Å²	72.9	32%	0.316	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	155.4	-178.7	67.8	-77.6	0	0	0	111	M336 G339 A387	M336-F385 HydrophobicContact CB-CB 4.44Å; M336-F385 HydrophobicContact CB-CD1 4.29Å; M336-F385 HydrophobicContact CB-CD2 4.33Å; M336-F385 HydrophobicContact CB-CG 4.1Å; M336-F385 HydrophobicContact CE-CD1 4.42Å; M336-F385 HydrophobicContact CE-CE1 3.59Å; M336-F385 HydrophobicContact CE-CZ 3.69Å; M336-F385 HydrophobicContact CG-CD1 3.7Å; M336-F385 HydrophobicContact CG-CD2 3.86Å; M336-F385 HydrophobicContact CG-CE1 3.68Å; M336-F385 HydrophobicContact CG-CE2 3.82Å; M336-F385 HydrophobicContact CG-CG 3.8Å; M336-F385 HydrophobicContact CG-CZ 3.74Å; M336-F385 HydrophobicContact SD-CD1 4.18Å; M336-F385 HydrophobicContact SD-CE1 3.93Å; M336-F385 HydrophobicContact SD-CZ 4.34Å; G339-F385 CarbonylContact O-C 3.47Å; G339-F385 WeakPolarHBondContact O-CA 3.49Å; G339-F385 WeakPolarHBondContact O-CB 3.39Å; F385-A387 HydrophobicContact CE2-CB 4.15Å
386	N	92.9	Very high	78.4	Confident	98 Å²	98	85.3 Å²	85.3	52%	0.524	44%	0.444	S	S	.	.			trans	-91.9	105.9	172.7	-175.4	-6.2	0	0	0	109.9	G339 I341 G388 A389	G339-N386 PolarHBondContact O-N 3.17Å; I341-N386 HydrophobicContact CD1-CB 4.42Å; N386-G388 PolarHBondContact O-N 2.89Å; N386-G388 VanDerWaalsContact O-N 3.13Å; N386-G388 PolarHBondContact OD1-N 3.08Å; N386-G388 VanDerWaalsContact OD1-N 3.08Å; N386-A389 WeakPolarHBondContact O-CB 3.45Å; N386-A389 PolarHBondContact O-N 2.93Å; N386-A389 VanDerWaalsContact O-N 3.13Å
387	A	81.8	Confident	77.5	Confident	64 Å²	64	83.8 Å²	83.8	53%	0.529	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-56.8	-28	179.8	0	0	0	0	0	113.5	F385 A389	F385-A387 HydrophobicContact CE2-CB 4.15Å; A387-A389 VanDerWaalsContact C-N 3.27Å; A387-A389 PolarHBondContact O-N 3.06Å
388	G	77.6	Confident	76.5	Confident	30 Å²	30	84.2 Å²	84.2	31%	0.309	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-72.2	-14.8	-179.9	0	0	0	0	0	115	N386 G390 L391	N386-G388 PolarHBondContact O-N 2.89Å; N386-G388 VanDerWaalsContact O-N 3.13Å; N386-G388 PolarHBondContact OD1-N 3.08Å; N386-G388 VanDerWaalsContact OD1-N 3.08Å; G388-G390 VanDerWaalsContact C-N 3.32Å; G388-G390 PolarHBondContact O-N 2.79Å; G388-L391 PolarHBondContact O-N 3.37Å
389	A	66.6	Low	75.3	Confident	38 Å²	38	88.8 Å²	88.8	31%	0.314	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-67.8	-29.2	-175.1	0	0	0	0	0	113.3	N386 A387 L391	N386-A389 WeakPolarHBondContact O-CB 3.45Å; N386-A389 PolarHBondContact O-N 2.93Å; N386-A389 VanDerWaalsContact O-N 3.13Å; A387-A389 VanDerWaalsContact C-N 3.27Å; A387-A389 PolarHBondContact O-N 3.06Å; A389-L391 VanDerWaalsContact C-N 3.34Å
390	G	57.5	Low	74	Confident	21 Å²	21	93.7 Å²	93.7	22%	0.216	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-70.6	-28.2	177.4	0	0	0	0	0	113.8	G388	G388-G390 VanDerWaalsContact C-N 3.32Å; G388-G390 PolarHBondContact O-N 2.79Å
391	L	59.6	Low	72.4	Confident	152 Å²	152	98.9 Å²	98.9	80%	0.796	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-21.3	-175.4	-70.8	164.2	0	0	0	113.5	G388 A389 A393	G388-L391 PolarHBondContact O-N 3.37Å; A389-L391 VanDerWaalsContact C-N 3.34Å; L391-A393 PolarHBondContact O-N 2.99Å
392	Q	54.8	Low	70.7	Confident	168 Å²	168	105 Å²	105	79%	0.785	55%	0.55	S	S	*	.			trans	-81.5	55.3	174.6	-64.1	-174.8	6.3	0	0	110.6	K394	Q392-K394 PolarHBondContact O-N 3.07Å
393	A	52.8	Low	68.8	Low	84 Å²	84	106.4 Å²	106.4	69%	0.694	56%	0.557	S	S	*	*			trans	-58.6	114.9	162.3	0	0	0	0	0	107.1	L391 K395	L391-A393 PolarHBondContact O-N 2.99Å; A393-K395 PolarHBondContact O-N 3.07Å
394	K	48.9	Very low	66.6	Low	189 Å²	189	113.5 Å²	113.5	82%	0.822	60%	0.595	S	S	*	*			trans	-36	108.7	-179	-72.6	174.6	174	175.3	0	110.3	Q392 K396	Q392-K394 PolarHBondContact O-N 3.07Å; K394-K396 VanDerWaalsContact C-N 3.27Å; K394-K396 PolarHBondContact O-N 3.2Å
395	K	41.8	Very low	64.1	Low	215 Å²	215	116.3 Å²	116.3	94%	0.935	62%	0.616	S	S	*	*			trans	-56.2	102.3	154.5	-79	-175.7	175.5	-179.2	0	105.5	A393	A393-K395 PolarHBondContact O-N 3.07Å
396	K	39.6	Very low	61.3	Low	264 Å²	264	120.3 Å²	120.3	100%	1.148	64%	0.643	S	S	*	*			trans	-84.8	0	158.2	-89.6	-170.6	173	-175.5	0	107.7	K394	K394-K396 VanDerWaalsContact C-N 3.27Å; K394-K396 PolarHBondContact O-N 3.2Å

Retrieved 396 of 396 residues in 116.7 ms (Link to these results)

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