A0A087YDW4_POEFO Loading...

Calsequestrin

Calsequestrin is a high-capacity, moderate affinity, calcium-binding protein and thus acts as an internal calcium store in muscle.

AlphaFold DB , UniProt , Accession A0A087YDW4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 428 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	49.3	Very low	49.7	Very low	240 Å²	240	136.1 Å²	136.1	100%	1.182	68%	0.679	S	S	*	*				0	118.2	0	-67.7	-172.5	-123	0	0	106.8
2	K	49.9	Very low	49.4	Very low	159 Å²	159	136.3 Å²	136.3	69%	0.691	68%	0.683	S	S	*	*			cis	-150.6	76.9	9	-70.3	174.5	173.9	179.6	0	107.1
3	W	47.5	Very low	49.2	Very low	227 Å²	227	133 Å²	133	86%	0.86	68%	0.681	S	S	*	*	S	Bend	trans	-100.9	-15.9	176	-106.5	16.8	0	0	0	113.5	W5	W3-W5 VanDerWaalsContact C-N 3.28Å; W3-W5 PolarHBondContact O-N 2.79Å
4	T	50.3	Low	48.8	Very low	111 Å²	111	136.3 Å²	136.3	68%	0.681	69%	0.688	S	S	*	*	H	α-helix	trans	-72.5	-18.8	172	35.9	0	0	0	0	113.7	V8	T4-V8 WeakPolarHBondContact O-CG2 3.36Å
5	W	48.3	Very low	48.5	Very low	202 Å²	202	131.9 Å²	131.9	77%	0.765	69%	0.691	S	S	*	*	H	α-helix	trans	-87.1	-22.6	178.9	-78.8	72.3	0	0	0	113.7	W3 A9	W3-W5 VanDerWaalsContact C-N 3.28Å; W3-W5 PolarHBondContact O-N 2.79Å; W5-A9 PolarHBondContact O-N 2.81Å
6	V	54.1	Low	48.3	Very low	88 Å²	88	127.9 Å²	127.9	53%	0.533	69%	0.692	S	S	.	*	H	α-helix	trans	-77.7	-34	179.2	-179.4	0	0	0	0	110.9	A9 V10	V6-A9 PolarHBondContact O-N 3.38Å; V6-V10 WeakPolarHBondContact O-CG2 3.33Å; V6-V10 PolarHBondContact O-N 2.66Å
7	L	47.3	Very low	47.9	Very low	121 Å²	121	131.2 Å²	131.2	63%	0.634	70%	0.702	S	S	*	*	H	α-helix	trans	-71.1	-30.8	175.9	-91.8	158.7	0	0	0	113.3	L11	L7-L11 WeakPolarHBondContact O-CG 3.41Å; L7-L11 PolarHBondContact O-N 3.09Å
8	V	53.8	Low	47.7	Very low	82 Å²	82	130.1 Å²	130.1	50%	0.497	71%	0.706	S	S	.	*	H	α-helix	trans	-73.1	-35	174.8	176.1	0	0	0	0	111.2	T4 L11 L12	T4-V8 WeakPolarHBondContact O-CG2 3.36Å; V8-L11 PolarHBondContact O-N 3.4Å; V8-L12 HydrophobicContact CG1-CD1 3.88Å; V8-L12 WeakPolarHBondContact O-CB 3.48Å; V8-L12 WeakPolarHBondContact O-CG 3.2Å; V8-L12 PolarHBondContact O-N 3.01Å
9	A	51.5	Low	47.6	Very low	54 Å²	54	131.6 Å²	131.6	45%	0.446	71%	0.712	S	S	.	*	H	α-helix	trans	-68.9	-36.3	175.8	0	0	0	0	0	113	W5 V6 S13	W5-A9 PolarHBondContact O-N 2.81Å; V6-A9 PolarHBondContact O-N 3.38Å; A9-S13 PolarHBondContact O-N 3.08Å; A9-S13 PolarHBondContact O-OG 3.14Å
10	V	49.9	Very low	47.5	Very low	80 Å²	80	129.2 Å²	129.2	49%	0.485	71%	0.711	S	S	.	*	H	α-helix	trans	-72.4	-35.4	176.1	176.5	0	0	0	0	111.4	V6 S13 F14	V6-V10 WeakPolarHBondContact O-CG2 3.33Å; V6-V10 PolarHBondContact O-N 2.66Å; V10-S13 PolarHBondContact O-N 2.91Å; V10-F14 HydrophobicContact CG1-CE2 4.44Å; V10-F14 WeakPolarHBondContact O-CD2 3.41Å
11	L	44.7	Very low	47.6	Very low	133 Å²	133	131.3 Å²	131.3	70%	0.696	71%	0.713	S	S	*	*	H	α-helix	trans	-72.3	-26.1	175.2	-76.5	165.2	0	0	0	113.6	L7 V8 S13	L7-L11 WeakPolarHBondContact O-CG 3.41Å; L7-L11 PolarHBondContact O-N 3.09Å; V8-L11 PolarHBondContact O-N 3.4Å; L11-S13 VanDerWaalsContact C-N 3.33Å
12	L	45.5	Very low	47.8	Very low	138 Å²	138	129.1 Å²	129.1	72%	0.723	70%	0.7	S	S	*	*	H	α-helix	trans	-81.8	-10.5	172.5	-76.3	165.7	0	0	0	113.6	V8	V8-L12 HydrophobicContact CG1-CD1 3.88Å; V8-L12 WeakPolarHBondContact O-CB 3.48Å; V8-L12 WeakPolarHBondContact O-CG 3.2Å; V8-L12 PolarHBondContact O-N 3.01Å
13	S	47.3	Very low	48.3	Very low	94 Å²	94	125.2 Å²	125.2	66%	0.657	69%	0.689	S	S	*	*	S	Bend	trans	-90.9	-8.6	176.9	-52	0	0	0	0	113.2	A9 V10 L11	A9-S13 PolarHBondContact O-N 3.08Å; A9-S13 PolarHBondContact O-OG 3.14Å; V10-S13 PolarHBondContact O-N 2.91Å; L11-S13 VanDerWaalsContact C-N 3.33Å
14	F	43.4	Very low	49.3	Very low	179 Å²	179	121.9 Å²	121.9	79%	0.785	69%	0.688	S	S	*	*	S	Bend	trans	-110.4	6.1	174.7	-80.2	-80.8	0	0	0	112.6	V10	V10-F14 HydrophobicContact CG1-CE2 4.44Å; V10-F14 WeakPolarHBondContact O-CD2 3.41Å
15	G	44.9	Very low	50.5	Low	71 Å²	71	122.4 Å²	122.4	73%	0.732	69%	0.686	S	S	*	*	S	Bend	trans	-98	26	179.9	0	0	0	0	0	114.4
16	G	44.4	Very low	51.8	Low	68 Å²	68	121 Å²	121	70%	0.701	69%	0.686	S	S	*	*			trans	-138.6	17.5	-175.8	0	0	0	0	0	114.3
17	Q	41.7	Very low	52.8	Low	184 Å²	184	121.8 Å²	121.8	86%	0.86	69%	0.693	S	S	*	*			trans	-107	85.4	151.9	-64	-151	-54.9	0	0	105	L19	Q17-L19 PolarHBondContact O-N 2.98Å
18	S	44.7	Very low	54.7	Low	111 Å²	111	124.2 Å²	124.2	78%	0.776	70%	0.701	S	S	*	*			trans	-56	107.1	148.9	56.1	0	0	0	0	104	A20	S18-A20 PolarHBondContact O-N 3.3Å
19	L	46	Very low	56.5	Low	159 Å²	159	124.2 Å²	124.2	83%	0.832	69%	0.693	S	S	*	*			trans	-35.8	106.8	140	-81.5	141.6	0	0	0	104.6	Q17 K21	Q17-L19 PolarHBondContact O-N 2.98Å; L19-K21 PolarHBondContact O-N 2.86Å
20	A	45.3	Very low	58.5	Low	83 Å²	83	124.8 Å²	124.8	69%	0.686	69%	0.688	S	S	*	*			trans	-49.3	108.6	157.5	0	0	0	0	0	102.7	S18 E22	S18-A20 PolarHBondContact O-N 3.3Å; A20-E22 PolarHBondContact O-N 3.15Å
21	K	50.5	Low	60.6	Low	173 Å²	173	123.6 Å²	123.6	75%	0.752	69%	0.692	S	S	*	*			trans	-61.5	109.3	158	-80.2	179.3	173.1	-179.6	0	100.7	L19 T23	L19-K21 PolarHBondContact O-N 2.86Å; K21-T23 HydrophobicContact CB-CG2 4.09Å; K21-T23 PolarHBondContact O-N 2.97Å; K21-T23 PolarHBondContact O-OG1 3.14Å
22	E	52.9	Low	63	Low	195 Å²	195	123 Å²	123	91%	0.911	68%	0.684	S	S	*	*			trans	-57.5	88	157.1	-74.4	166.1	169.7	0	0	104.2	A20	A20-E22 PolarHBondContact O-N 3.15Å
23	T	59.2	Low	65.4	Low	76 Å²	76	122.7 Å²	122.7	47%	0.466	68%	0.683	S	S	.	*			trans	-74.6	160.3	165.3	30.5	0	0	0	0	106.7	K21 D25	K21-T23 HydrophobicContact CB-CG2 4.09Å; K21-T23 PolarHBondContact O-N 2.97Å; K21-T23 PolarHBondContact O-OG1 3.14Å; T23-D25 VanDerWaalsContact CB-OD1 3.29Å; T23-D25 WeakPolarHBondContact CB-OD1 3.48Å; T23-D25 PolarHBondContact O-N 2.97Å; T23-D25 PolarHBondContact OG1-OD1 3.47Å; T23-D25 PolarHBondContact OG1-OD2 3.41Å
24	L	70.2	Confident	67.8	Low	158 Å²	158	119.7 Å²	119.7	83%	0.827	66%	0.657	S	S	*	*			trans	-69.4	70.4	166.7	-171.9	76	0	0	0	107.2
25	D	75	Confident	70.4	Confident	121 Å²	121	111.6 Å²	111.6	65%	0.647	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-78.4	125.3	176.1	-68.3	-17.7	0	0	0	106.9	T23	T23-D25 VanDerWaalsContact CB-OD1 3.29Å; T23-D25 WeakPolarHBondContact CB-OD1 3.48Å; T23-D25 PolarHBondContact O-N 2.97Å; T23-D25 PolarHBondContact OG1-OD1 3.47Å; T23-D25 PolarHBondContact OG1-OD2 3.41Å
26	F	75.2	Confident	73	Confident	173 Å²	173	110.5 Å²	110.5	76%	0.759	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-73.1	133.2	173.9	-69.2	-90.1	0	0	0	108.5	E28	F26-E28 PolarHBondContact O-N 3.21Å
27	P	75.4	Confident	75.5	Confident	105 Å²	105	111.6 Å²	111.6	68%	0.682	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-56.8	128.9	173.5	-22.6	32.8	0	0	0	110.3
28	E	87.6	Confident	78.2	Confident	171 Å²	171	102.9 Å²	102.9	80%	0.799	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-95.5	150.3	170.3	-68.1	-178.2	-179.7	0	0	109.2	F26 D30 Q83	F26-E28 PolarHBondContact O-N 3.21Å; E28-D30 PolarHBondContact O-N 3.34Å; E28-Q83 PolarHBondContact O-NE2 3.36Å
29	Y	91.4	Very high	80.7	Confident	83 Å²	83	99.4 Å²	99.4	33%	0.325	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-58.4	122.6	172	176.8	-124.1	0	0	0	110	G31 K32 L76 E79 R80 Q83	Y29-G31 VanDerWaalsContact C-N 3.32Å; Y29-G31 PolarHBondContact O-N 3.14Å; Y29-K32 PolarHBondContact OH-O 3.32Å; Y29-L76 HydrophobicContact CD1-CD1 3.95Å; Y29-L76 HydrophobicContact CE1-CD1 3.71Å; Y29-E79 HydrophobicContact CE2-CB 3.87Å; Y29-R80 HydrophobicContact CD2-CG 4.36Å; Y29-Q83 VanDerWaalsContact CA-OE1 3.29Å; Y29-Q83 VanDerWaalsContact CD2-OE1 3.31Å
30	D	92.7	Very high	83.1	Confident	66 Å²	66	94.8 Å²	94.8	35%	0.353	50%	0.504	S	S	.	.			trans	-87.2	-2	-170.7	75.3	-3.6	0	0	0	114.2	E28 K32 R34 Q83	E28-D30 PolarHBondContact O-N 3.34Å; D30-K32 VanDerWaalsContact C-N 3.29Å; D30-K32 PolarHBondContact O-N 3.47Å; D30-K32 WeakPolarHBondContact OD1-CB 3.43Å; D30-K32 WeakPolarHBondContact OD1-CG 3.45Å; D30-K32 PolarHBondContact OD1-N 3.05Å; D30-K32 WeakPolarHBondContact OD2-CD 3.49Å; D30-K32 VanDerWaalsContact OD2-CE 3.27Å; D30-K32 WeakPolarHBondContact OD2-CE 3.21Å; D30-K32 IonicContact OD2-NZ 2.71Å; D30-K32 PolarHBondContact OD2-NZ 2.94Å; D30-R34 VanDerWaalsContact CG-NH2 3.33Å; D30-R34 IonicContact OD1-CZ 3.39Å; D30-R34 IonicContact OD1-NH1 3.22Å; D30-R34 PolarHBondContact OD1-NH1 2.64Å; D30-R34 IonicContact OD1-NH2 3.86Å; D30-R34 PolarHBondContact OD1-NH2 3.3Å; D30-R34 IonicContact OD2-CZ 2.74Å; D30-R34 IonicContact OD2-NH1 2.83Å; D30-R34 IonicContact OD2-NH2 2.94Å; D30-R34 PolarHBondContact OD2-NH2 3.01Å; D30-Q83 PolarHBondContact OD1-OE1 2.94Å
31	G	94.2	Very high	85.6	Confident	54 Å²	54	100.4 Å²	100.4	56%	0.557	51%	0.513	S	S	*	.			trans	75.3	10.9	177.3	0	0	0	0	0	114.8	Y29	Y29-G31 VanDerWaalsContact C-N 3.32Å; Y29-G31 PolarHBondContact O-N 3.14Å
32	K	95.8	Very high	87.9	Confident	122 Å²	122	94.2 Å²	94.2	53%	0.53	49%	0.489	S	S	.	.			trans	-84.8	132.4	172.2	-57.1	-178	-164.2	123.9	0	110.2	Y29 D30 R34	Y29-K32 PolarHBondContact OH-O 3.32Å; D30-K32 VanDerWaalsContact C-N 3.29Å; D30-K32 PolarHBondContact O-N 3.47Å; D30-K32 WeakPolarHBondContact OD1-CB 3.43Å; D30-K32 WeakPolarHBondContact OD1-CG 3.45Å; D30-K32 PolarHBondContact OD1-N 3.05Å; D30-K32 WeakPolarHBondContact OD2-CD 3.49Å; D30-K32 VanDerWaalsContact OD2-CE 3.27Å; D30-K32 WeakPolarHBondContact OD2-CE 3.21Å; D30-K32 IonicContact OD2-NZ 2.71Å; D30-K32 PolarHBondContact OD2-NZ 2.94Å; K32-R34 PolarHBondContact O-N 3.32Å; K32-R34 PolarHBondContact O-NH1 2.97Å
33	D	96.6	Very high	90	Very high	130 Å²	130	85.8 Å²	85.8	70%	0.695	45%	0.449	S	S	*	.			trans	-71.3	111.4	169.6	176.2	-1.2	0	0	0	109.8	E79	D33-E79 WeakPolarHBondContact CA-OE1 3.45Å
34	R	97	Very high	91.8	Very high	32 Å²	32	87.8 Å²	87.8	12%	0.121	45%	0.451	C	S	.	.			trans	-114.4	-22.9	179.5	-65.6	180	176.2	77.6	-4.5	112.2	D30 K32 H36 E79 A82 D86	D30-R34 VanDerWaalsContact CG-NH2 3.33Å; D30-R34 IonicContact OD1-CZ 3.39Å; D30-R34 IonicContact OD1-NH1 3.22Å; D30-R34 PolarHBondContact OD1-NH1 2.64Å; D30-R34 IonicContact OD1-NH2 3.86Å; D30-R34 PolarHBondContact OD1-NH2 3.3Å; D30-R34 IonicContact OD2-CZ 2.74Å; D30-R34 IonicContact OD2-NH1 2.83Å; D30-R34 IonicContact OD2-NH2 2.94Å; D30-R34 PolarHBondContact OD2-NH2 3.01Å; K32-R34 PolarHBondContact O-N 3.32Å; K32-R34 PolarHBondContact O-NH1 2.97Å; R34-H36 PolarHBondContact O-N 2.93Å; R34-H36 PolarHBondContact O-NE2 2.92Å; R34-E79 WeakPolarHBondContact CB-OE2 3.47Å; R34-E79 PolarHBondContact N-OE1 2.74Å; R34-E79 PolarHBondContact N-OE2 2.66Å; R34-A82 HydrophobicContact CB-CB 3.74Å; R34-D86 IonicContact NE-OD2 2.65Å; R34-D86 PolarHBondContact NE-OD2 3.37Å
35	V	98.1	Very high	93	Very high	8 Å²	8	83.9 Å²	83.9	5%	0.048	44%	0.437	C	S	.	.			trans	-78.1	123.1	-173.6	178.5	0	0	0	0	110.4	N37 L78 E79 A82 V95 L97	V35-N37 PolarHBondContact O-N 3.42Å; V35-L78 HydrophobicContact CG2-CB 3.94Å; V35-E79 HydrophobicContact CB-CG 4.47Å; V35-E79 WeakPolarHBondContact CB-OE1 3.13Å; V35-E79 HydrophobicContact CG2-CB 4.43Å; V35-E79 VanDerWaalsContact CG2-CD 3.45Å; V35-E79 HydrophobicContact CG2-CG 3.79Å; V35-E79 WeakPolarHBondContact CG2-OE1 3.36Å; V35-E79 PolarHBondContact N-OE1 2.81Å; V35-A82 HydrophobicContact CG2-CB 4.31Å; V35-V95 HydrophobicContact CG1-CG1 4.32Å; V35-V95 HydrophobicContact CG2-CB 4.27Å; V35-V95 HydrophobicContact CG2-CG1 4.03Å; V35-L97 HydrophobicContact CG1-CD1 3.57Å; V35-L97 HydrophobicContact CG1-CD2 4.49Å; V35-L97 HydrophobicContact CG1-CG 3.52Å
36	H	98.2	Very high	94.1	Very high	49 Å²	49	79 Å²	79	23%	0.227	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.2	-176.4	-63.5	-81.9	0	0	0	111.8	R34 L38 V46 Y50 M53 V95 G96 L97	R34-H36 PolarHBondContact O-N 2.93Å; R34-H36 PolarHBondContact O-NE2 2.92Å; H36-L38 HydrophobicContact CB-CD2 3.83Å; H36-L38 HydrophobicContact CB-CG 4.49Å; H36-L38 PolarHBondContact O-N 3.1Å; H36-L38 VanDerWaalsContact O-N 3.09Å; H36-V46 HydrophobicContact CB-CG1 3.9Å; H36-Y50 AromaticContact CD2-CE2 3.94Å; H36-Y50 AromaticContact NE2-CE2 3.52Å; H36-Y50 AromaticContact NE2-CZ 3.56Å; H36-Y50 PolarHBondContact NE2-OH 2.84Å; H36-M53 HydrophobicContact CB-CE 4.43Å; H36-V95 PolarHBondContact CD2-O 3.44Å; H36-V95 VanDerWaalsContact CD2-O 3.27Å; H36-V95 PolarHBondContact N-O 3.49Å; H36-G96 CarbonylContact O-C 3.52Å; H36-G96 WeakPolarHBondContact O-CA 3.44Å; H36-L97 PolarHBondContact O-N 2.85Å
37	N	97.8	Very high	95.1	Very high	91 Å²	91	72.5 Å²	72.5	49%	0.487	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	105.5	164	-172.8	-59.7	0	0	0	110.5	V35 N42	V35-N37 PolarHBondContact O-N 3.42Å; N37-N42 PolarHBondContact O-ND2 2.84Å
38	L	98.1	Very high	96	Very high	0 Å²	0	76.9 Å²	76.9	0%	0	39%	0.386	C	S	.	.			trans	-90	125.5	-175.7	-57.4	-179.3	0	0	0	111	H36 V46 M53 V55 L97 I98	H36-L38 HydrophobicContact CB-CD2 3.83Å; H36-L38 HydrophobicContact CB-CG 4.49Å; H36-L38 PolarHBondContact O-N 3.1Å; H36-L38 VanDerWaalsContact O-N 3.09Å; L38-V46 HydrophobicContact CD2-CB 3.86Å; L38-V46 HydrophobicContact CD2-CG1 3.73Å; L38-V46 HydrophobicContact CD2-CG2 4.3Å; L38-M53 HydrophobicContact CD1-CE 3.82Å; L38-M53 HydrophobicContact CD2-CE 4.01Å; L38-M53 HydrophobicContact CG-CE 4.28Å; L38-V55 HydrophobicContact CD1-CG1 4.21Å; L38-V55 HydrophobicContact CD1-CG2 3.97Å; L38-L97 WeakPolarHBondContact CB-O 3.48Å; L38-L97 PolarHBondContact N-O 2.91Å; L38-I98 HydrophobicContact CB-CD1 4.3Å; L38-I98 HydrophobicContact CB-CG1 3.69Å; L38-I98 HydrophobicContact CD1-CD1 4.14Å; L38-I98 HydrophobicContact CD1-CG1 4.07Å; L38-I98 HydrophobicContact CG-CG1 4.41Å
39	N	97.4	Very high	96.4	Very high	39 Å²	39	74.9 Å²	74.9	21%	0.209	38%	0.375	C	S	.	.			trans	-141.7	176.5	179	59.6	69	0	0	0	111.3	K41 N42 Y43 D103 V106	N39-K41 PolarHBondContact O-N 2.83Å; N39-K41 VanDerWaalsContact OD1-CB 3.26Å; N39-K41 WeakPolarHBondContact OD1-CB 3.4Å; N39-K41 PolarHBondContact OD1-N 3.02Å; N39-N42 PolarHBondContact N-OD1 3.07Å; N39-N42 PolarHBondContact O-N 3.06Å; N39-N42 VanDerWaalsContact O-N 3.12Å; N39-N42 PolarHBondContact O-OD1 3.11Å; N39-N42 VanDerWaalsContact O-OD1 3.08Å; N39-N42 PolarHBondContact OD1-OD1 3.26Å; N39-Y43 WeakPolarHBondContact O-CD1 3.24Å; N39-Y43 PolarHBondContact O-N 3Å; N39-D103 WeakPolarHBondContact CA-OD1 3.45Å; N39-D103 WeakPolarHBondContact CB-OD1 3.38Å; N39-V106 VanDerWaalsContact C-CG2 3.46Å
40	A	97.1	Very high	96.6	Very high	62 Å²	62	72.6 Å²	72.6	51%	0.512	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.2	-176.1	0	0	0	0	0	114.7	V106	A40-V106 HydrophobicContact CB-CG2 4.25Å; A40-V106 VanDerWaalsContact N-CG2 3.32Å
41	K	97.4	Very high	96.8	Very high	201 Å²	201	72.7 Å²	72.7	87%	0.874	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-34.2	-179.3	-56.9	172.8	-176.9	164.2	0	113.1	N39	N39-K41 PolarHBondContact O-N 2.83Å; N39-K41 VanDerWaalsContact OD1-CB 3.26Å; N39-K41 WeakPolarHBondContact OD1-CB 3.4Å; N39-K41 PolarHBondContact OD1-N 3.02Å
42	N	97.6	Very high	96.9	Very high	43 Å²	43	70.5 Å²	70.5	23%	0.23	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-20.9	-168	67.4	-5.4	0	0	0	114.7	N37 N39 K44 S45 V46	N37-N42 PolarHBondContact O-ND2 2.84Å; N39-N42 PolarHBondContact N-OD1 3.07Å; N39-N42 PolarHBondContact O-N 3.06Å; N39-N42 VanDerWaalsContact O-N 3.12Å; N39-N42 PolarHBondContact O-OD1 3.11Å; N39-N42 VanDerWaalsContact O-OD1 3.08Å; N39-N42 PolarHBondContact OD1-OD1 3.26Å; N42-K44 VanDerWaalsContact C-N 3.32Å; N42-K44 PolarHBondContact O-N 2.89Å; N42-K44 VanDerWaalsContact O-N 3.13Å; N42-S45 PolarHBondContact O-N 3.25Å; N42-S45 PolarHBondContact O-OG 2.95Å; N42-V46 HydrophobicContact CB-CG2 4.12Å; N42-V46 PolarHBondContact O-N 3.01Å
43	Y	97.6	Very high	97	Very high	18 Å²	18	64.9 Å²	64.9	7%	0.071	32%	0.318	C	S	.	.	H	α-helix	trans	-52.9	-46.9	-167.8	83.1	-79.5	0	0	0	112.8	N39 S45 V46 M47 V106 K109 L110	N39-Y43 WeakPolarHBondContact O-CD1 3.24Å; N39-Y43 PolarHBondContact O-N 3Å; Y43-S45 VanDerWaalsContact C-N 3.29Å; Y43-S45 PolarHBondContact O-N 3.09Å; Y43-V46 PolarHBondContact O-N 3.04Å; Y43-M47 HydrophobicContact CD2-SD 4.07Å; Y43-M47 WeakPolarHBondContact O-CB 3.25Å; Y43-M47 VanDerWaalsContact O-CG 3.27Å; Y43-M47 WeakPolarHBondContact O-CG 3.46Å; Y43-M47 PolarHBondContact O-N 3.04Å; Y43-V106 HydrophobicContact CD1-CG1 4.15Å; Y43-V106 HydrophobicContact CD1-CG2 4.15Å; Y43-V106 HydrophobicContact CD2-CG1 3.84Å; Y43-V106 HydrophobicContact CE2-CG1 4.42Å; Y43-V106 HydrophobicContact CG-CG1 3.67Å; Y43-V106 HydrophobicContact CG-CG2 4.45Å; Y43-K109 WeakPolarHBondContact OH-CD 3.43Å; Y43-L110 HydrophobicContact CD2-CD2 4.21Å; Y43-L110 HydrophobicContact CE2-CD2 4.15Å
44	K	96.5	Very high	97.1	Very high	118 Å²	118	58.7 Å²	58.7	51%	0.513	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-29.5	178.3	-61.5	-167.6	177.1	-167.6	0	115	N42 R48	N42-K44 VanDerWaalsContact C-N 3.32Å; N42-K44 PolarHBondContact O-N 2.89Å; N42-K44 VanDerWaalsContact O-N 3.13Å; K44-R48 WeakPolarHBondContact O-CG 3.42Å; K44-R48 PolarHBondContact O-NE 3.24Å; K44-R48 PolarHBondContact O-NH2 2.88Å
45	S	97.4	Very high	97.1	Very high	76 Å²	76	57.1 Å²	57.1	53%	0.531	28%	0.279	S	S	.	.	H	α-helix	trans	-86.2	-33.3	-180	45.9	0	0	0	0	111.6	N42 Y43	N42-S45 PolarHBondContact O-N 3.25Å; N42-S45 PolarHBondContact O-OG 2.95Å; Y43-S45 VanDerWaalsContact C-N 3.29Å; Y43-S45 PolarHBondContact O-N 3.09Å
46	V	97.2	Very high	97.2	Very high	18 Å²	18	56.9 Å²	56.9	11%	0.109	28%	0.277	C	S	.	.	H	α-helix	trans	-72.4	-52	177.3	176.9	0	0	0	0	109.8	H36 L38 N42 Y43 R48 K49 Y50 M53	H36-V46 HydrophobicContact CB-CG1 3.9Å; L38-V46 HydrophobicContact CD2-CB 3.86Å; L38-V46 HydrophobicContact CD2-CG1 3.73Å; L38-V46 HydrophobicContact CD2-CG2 4.3Å; N42-V46 HydrophobicContact CB-CG2 4.12Å; N42-V46 PolarHBondContact O-N 3.01Å; Y43-V46 PolarHBondContact O-N 3.04Å; V46-R48 PolarHBondContact O-N 2.98Å; V46-R48 VanDerWaalsContact O-N 3.12Å; V46-K49 WeakPolarHBondContact O-CB 3.38Å; V46-K49 PolarHBondContact O-N 2.97Å; V46-Y50 HydrophobicContact CG1-CD2 4.36Å; V46-Y50 HydrophobicContact CG1-CE2 4.07Å; V46-Y50 WeakPolarHBondContact O-CD2 3.06Å; V46-M53 HydrophobicContact CG1-CE 4.05Å; V46-M53 HydrophobicContact CG1-SD 4.42Å
47	M	95.4	Very high	97.1	Very high	36 Å²	36	55.6 Å²	55.6	18%	0.177	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-58.4	-30.9	179.8	-65.8	-178.6	82.5	0	0	113.1	Y43 K49 M53 L110 F121	Y43-M47 HydrophobicContact CD2-SD 4.07Å; Y43-M47 WeakPolarHBondContact O-CB 3.25Å; Y43-M47 VanDerWaalsContact O-CG 3.27Å; Y43-M47 WeakPolarHBondContact O-CG 3.46Å; Y43-M47 PolarHBondContact O-N 3.04Å; M47-K49 VanDerWaalsContact C-N 3.25Å; M47-K49 PolarHBondContact O-N 3.2Å; M47-M53 HydrophobicContact CG-CG 4.23Å; M47-L110 HydrophobicContact CE-CD1 4.29Å; M47-L110 HydrophobicContact CE-CD2 3.89Å; M47-L110 HydrophobicContact SD-CD1 3.93Å; M47-L110 HydrophobicContact SD-CD2 3.67Å; M47-L110 HydrophobicContact SD-CG 4.47Å; M47-F121 HydrophobicContact CE-CB 4.23Å; M47-F121 HydrophobicContact CE-CD1 3.83Å; M47-F121 HydrophobicContact CE-CD2 3.98Å; M47-F121 HydrophobicContact CE-CE1 4.21Å; M47-F121 HydrophobicContact CE-CE2 4.34Å; M47-F121 HydrophobicContact CE-CG 3.73Å; M47-F121 HydrophobicContact CE-CZ 4.45Å
48	R	95	Very high	97.1	Very high	197 Å²	197	51.5 Å²	51.5	74%	0.743	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-78.9	-3.7	177	-81.9	-170.9	-78.1	-162.8	-4.4	115	K44 V46	K44-R48 WeakPolarHBondContact O-CG 3.42Å; K44-R48 PolarHBondContact O-NE 3.24Å; K44-R48 PolarHBondContact O-NH2 2.88Å; V46-R48 PolarHBondContact O-N 2.98Å; V46-R48 VanDerWaalsContact O-N 3.12Å
49	K	95.9	Very high	96.9	Very high	130 Å²	130	56.1 Å²	56.1	57%	0.565	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-86.2	-24.5	177.8	-171.6	-165.5	161.6	-148.7	0	111	V46 M47	V46-K49 WeakPolarHBondContact O-CB 3.38Å; V46-K49 PolarHBondContact O-N 2.97Å; M47-K49 VanDerWaalsContact C-N 3.25Å; M47-K49 PolarHBondContact O-N 3.2Å
50	Y	96.7	Very high	96.8	Very high	35 Å²	35	57.1 Å²	57.1	14%	0.137	28%	0.277	C	S	.	.			trans	-114.4	143.7	-170.7	-63.9	-73.4	0	0	0	109	H36 V46 V52 M53 D92 I93 G94	H36-Y50 AromaticContact CD2-CE2 3.94Å; H36-Y50 AromaticContact NE2-CE2 3.52Å; H36-Y50 AromaticContact NE2-CZ 3.56Å; H36-Y50 PolarHBondContact NE2-OH 2.84Å; V46-Y50 HydrophobicContact CG1-CD2 4.36Å; V46-Y50 HydrophobicContact CG1-CE2 4.07Å; V46-Y50 WeakPolarHBondContact O-CD2 3.06Å; Y50-V52 WeakPolarHBondContact CB-O 3.46Å; Y50-M53 HydrophobicContact CD2-SD 3.88Å; Y50-M53 HydrophobicContact CG-SD 4.49Å; Y50-D92 CarbonylContact C-O 3.45Å; Y50-D92 VanDerWaalsContact CA-O 3.24Å; Y50-D92 WeakPolarHBondContact CA-O 3.49Å; Y50-D92 VanDerWaalsContact CB-O 3.28Å; Y50-D92 WeakPolarHBondContact CB-O 3.31Å; Y50-D92 HydrophobicContact CD1-CB 4.22Å; Y50-I93 WeakPolarHBondContact CE1-O 3.46Å; Y50-G94 VanDerWaalsContact CD1-N 3.27Å
51	D	95.3	Very high	96.5	Very high	67 Å²	67	55.7 Å²	55.7	36%	0.358	26%	0.262	S	S	.	.	S	Bend	trans	-75.3	-36	173.7	-56.1	-52.2	0	0	0	109.5	E91 D92	D51-E91 HydrophobicContact CB-CB 4.5Å; D51-E91 WeakPolarHBondContact CB-OE2 3.21Å; D51-D92 PolarHBondContact N-O 3.45Å; D51-D92 WeakPolarHBondContact OD2-CB 3.2Å; D51-D92 PolarHBondContact OD2-N 2.73Å
52	V	97.1	Very high	96.1	Very high	8 Å²	8	47.6 Å²	47.6	5%	0.048	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134	171.6	-179.9	0	0	0	0	110.9	Y50 D92 I93 G94 I120 F121 T122 L146	Y50-V52 WeakPolarHBondContact CB-O 3.46Å; V52-D92 PolarHBondContact N-O 2.9Å; V52-I93 HydrophobicContact CB-CG1 4.32Å; V52-I93 HydrophobicContact CB-CG2 4.37Å; V52-I93 HydrophobicContact CG1-CG2 4.44Å; V52-I93 WeakPolarHBondContact O-CA 3.32Å; V52-G94 PolarHBondContact O-N 2.95Å; V52-I120 HydrophobicContact CG1-CG2 3.6Å; V52-F121 CarbonylContact C-O 3.58Å; V52-F121 WeakPolarHBondContact CA-O 3.42Å; V52-T122 HydrophobicContact CG1-CG2 4.39Å; V52-T122 HydrophobicContact CG2-CG2 4.16Å; V52-L146 HydrophobicContact CG2-CD2 3.65Å
53	M	97.9	Very high	95.8	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.02	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	112.3	176.2	-169.8	79.3	-172.2	0	0	111.1	H36 L38 V46 M47 Y50 V55 G94 F121	H36-M53 HydrophobicContact CB-CE 4.43Å; L38-M53 HydrophobicContact CD1-CE 3.82Å; L38-M53 HydrophobicContact CD2-CE 4.01Å; L38-M53 HydrophobicContact CG-CE 4.28Å; V46-M53 HydrophobicContact CG1-CE 4.05Å; V46-M53 HydrophobicContact CG1-SD 4.42Å; M47-M53 HydrophobicContact CG-CG 4.23Å; Y50-M53 HydrophobicContact CD2-SD 3.88Å; Y50-M53 HydrophobicContact CG-SD 4.49Å; M53-V55 HydrophobicContact CE-CG2 4.44Å; M53-V55 HydrophobicContact CG-CG2 3.62Å; M53-G94 CarbonylContact C-O 3.55Å; M53-G94 WeakPolarHBondContact CA-O 3.37Å; M53-F121 HydrophobicContact CB-CB 4.25Å; M53-F121 PolarHBondContact N-O 3.4Å; M53-F121 WeakPolarHBondContact O-CD2 3.38Å; M53-F121 PolarHBondContact O-N 3.23Å
54	V	98.2	Very high	95.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125	170.5	-173.6	0	0	0	0	108.4	I93 G94 V95 G96 I118 F119 I120 I142	V54-I93 HydrophobicContact CG2-CG2 4.34Å; V54-G94 PolarHBondContact N-O 2.9Å; V54-V95 HydrophobicContact CB-CG1 4.49Å; V54-V95 HydrophobicContact CB-CG2 4.3Å; V54-V95 CarbonylContact O-C 3.5Å; V54-V95 VanDerWaalsContact O-CA 3.3Å; V54-V95 WeakPolarHBondContact O-CA 3.42Å; V54-G96 PolarHBondContact O-N 2.9Å; V54-I118 HydrophobicContact CG1-CG2 3.7Å; V54-F119 CarbonylContact C-O 3.59Å; V54-I120 HydrophobicContact CG1-CG1 4.38Å; V54-I120 HydrophobicContact CG2-CG1 4.4Å; V54-I120 HydrophobicContact CG2-CG2 4.48Å; V54-I142 HydrophobicContact CG1-CD1 4.33Å; V54-I142 HydrophobicContact CG2-CD1 3.54Å; V54-I142 HydrophobicContact CG2-CG1 4.04Å
55	V	98.3	Very high	95.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	113.3	-174.3	-179.4	0	0	0	0	109.8	L38 M53 G96 I98 L112 I118 F119 F121	L38-V55 HydrophobicContact CD1-CG1 4.21Å; L38-V55 HydrophobicContact CD1-CG2 3.97Å; M53-V55 HydrophobicContact CE-CG2 4.44Å; M53-V55 HydrophobicContact CG-CG2 3.62Å; V55-G96 WeakPolarHBondContact CA-O 3.36Å; V55-I98 HydrophobicContact CG1-CB 4.48Å; V55-I98 HydrophobicContact CG1-CD1 3.62Å; V55-I98 HydrophobicContact CG1-CG1 3.88Å; V55-L112 HydrophobicContact CG1-CD1 4.43Å; V55-I118 WeakPolarHBondContact O-CA 3.16Å; V55-F119 PolarHBondContact N-O 3.38Å; V55-F119 PolarHBondContact O-N 2.84Å; V55-F121 HydrophobicContact CB-CD2 4.35Å; V55-F121 HydrophobicContact CB-CE2 3.99Å; V55-F121 HydrophobicContact CG2-CD2 3.82Å; V55-F121 HydrophobicContact CG2-CE2 3.81Å
56	Y	98.4	Very high	95.4	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.3	169.6	177.4	-140.3	0	0	0	109.9	H58 E74 L78 G96 L97 I98 D116 I118 L133	Y56-H58 HydrophobicContact CD1-CB 3.69Å; Y56-H58 HydrophobicContact CD2-CB 4.42Å; Y56-H58 HydrophobicContact CE1-CB 3.32Å; Y56-H58 HydrophobicContact CE2-CB 4.1Å; Y56-H58 HydrophobicContact CG-CB 4.22Å; Y56-H58 PolarHBondContact O-N 3.49Å; Y56-E74 HydrophobicContact CE1-CB 4.07Å; Y56-E74 PolarHBondContact OH-OE2 3.15Å; Y56-L78 HydrophobicContact CD1-CD1 3.52Å; Y56-L78 HydrophobicContact CG-CD1 3.94Å; Y56-G96 PolarHBondContact N-O 3.47Å; Y56-L97 HydrophobicContact CD1-CD2 3.57Å; Y56-L97 HydrophobicContact CG-CD2 4.24Å; Y56-L97 WeakPolarHBondContact O-CA 3.42Å; Y56-I98 PolarHBondContact O-N 3.38Å; Y56-D116 PolarHBondContact OH-OD1 3.34Å; Y56-I118 HydrophobicContact CD2-CD1 4.36Å; Y56-I118 HydrophobicContact CD2-CG1 3.63Å; Y56-I118 HydrophobicContact CG-CG1 4.16Å; Y56-L133 HydrophobicContact CD1-CD2 4.38Å; Y56-L133 HydrophobicContact CD2-CD2 4.49Å; Y56-L133 HydrophobicContact CE1-CD2 4.02Å; Y56-L133 HydrophobicContact CE2-CD2 4.15Å
57	Y	97.7	Very high	95.2	Very high	23 Å²	23	59.1 Å²	59.1	9%	0.09	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	75.1	179.4	-179.9	-139.4	0	0	0	110.3	I98 A100 A107 L112 E114 S115 D116 S117 F119	Y57-I98 CarbonylContact C-O 3.56Å; Y57-I98 HydrophobicContact CD2-CB 4Å; Y57-I98 HydrophobicContact CD2-CG2 3.68Å; Y57-I98 WeakPolarHBondContact CD2-O 3.48Å; Y57-I98 HydrophobicContact CE2-CG2 3.98Å; Y57-A100 HydrophobicContact CD2-CB 4.46Å; Y57-A100 HydrophobicContact CE2-CB 3.68Å; Y57-A107 HydrophobicContact CD2-CB 4.15Å; Y57-A107 HydrophobicContact CE1-CB 4.44Å; Y57-A107 HydrophobicContact CE2-CB 3.47Å; Y57-A107 VanDerWaalsContact CE2-CB 3.47Å; Y57-L112 HydrophobicContact CD1-CB 3.59Å; Y57-L112 HydrophobicContact CD1-CD1 4.35Å; Y57-L112 HydrophobicContact CD2-CD1 4.13Å; Y57-L112 HydrophobicContact CE1-CB 4.02Å; Y57-L112 HydrophobicContact CG-CB 3.99Å; Y57-L112 HydrophobicContact CG-CD1 3.86Å; Y57-E114 WeakPolarHBondContact CD1-O 3.45Å; Y57-S115 CarbonylContact O-C 3.54Å; Y57-S115 WeakPolarHBondContact O-CA 3.37Å; Y57-D116 PolarHBondContact O-N 3.45Å; Y57-S117 PolarHBondContact N-O 3.1Å; Y57-F119 HydrophobicContact CD1-CE2 4.41Å
58	H	96.8	Very high	95.2	Very high	5 Å²	5	61.2 Å²	61.2	2%	0.023	32%	0.315	C	S	.	.			trans	-80.6	155.2	-166	72.6	88.9	0	0	0	114.3	Y56 F71 I98 D99 A100	Y56-H58 HydrophobicContact CD1-CB 3.69Å; Y56-H58 HydrophobicContact CD2-CB 4.42Å; Y56-H58 HydrophobicContact CE1-CB 3.32Å; Y56-H58 HydrophobicContact CE2-CB 4.1Å; Y56-H58 HydrophobicContact CG-CB 4.22Å; Y56-H58 PolarHBondContact O-N 3.49Å; H58-F71 HydrophobicContact CB-CD2 4.32Å; H58-F71 HydrophobicContact CB-CE2 3.88Å; H58-F71 AromaticContact CD2-CE2 3.63Å; H58-F71 AromaticContact CE1-CE2 3.54Å; H58-F71 AromaticContact CE1-CZ 3.67Å; H58-F71 AromaticContact CG-CE2 3.35Å; H58-F71 AromaticContact ND1-CD2 3.82Å; H58-F71 AromaticContact ND1-CE2 3.3Å; H58-F71 VanDerWaalsContact ND1-CE2 3.3Å; H58-F71 WeakPolarHBondContact ND1-CE2 3.26Å; H58-F71 AromaticContact ND1-CZ 3.92Å; H58-F71 AromaticContact NE2-CE2 3.77Å; H58-F71 AromaticContact NE2-CZ 3.74Å; H58-I98 PolarHBondContact CD2-O 3.31Å; H58-I98 VanDerWaalsContact CD2-O 3.31Å; H58-I98 PolarHBondContact N-O 2.91Å; H58-D99 IonicContact CE1-OD2 3.74Å; H58-D99 WeakPolarHBondContact NE2-CA 3.28Å; H58-A100 VanDerWaalsContact O-CB 3.31Å; H58-A100 WeakPolarHBondContact O-CB 3.37Å; H58-A100 PolarHBondContact O-N 3.18Å
59	D	95.1	Very high	95.3	Very high	96 Å²	96	58.1 Å²	58.1	51%	0.513	31%	0.307	S	S	.	.			trans	-69.8	151.2	171.8	-129.3	-6.5	0	0	0	111.7	P61	D59-P61 WeakPolarHBondContact O-CD 3.46Å
60	H	94.9	Very high	95.2	Very high	61 Å²	61	57 Å²	57	28%	0.282	30%	0.304	S	S	.	.			trans	-81.3	110.5	-178.1	-177.9	81.4	0	0	0	110.7	G62 D99 K101	H60-G62 PolarHBondContact CD2-N 2.82Å; H60-G62 PolarHBondContact O-N 3.05Å; H60-D99 IonicContact CE1-OD2 3.47Å; H60-D99 IonicContact CG-OD1 3.34Å; H60-D99 IonicContact CG-OD2 3.29Å; H60-D99 IonicContact ND1-OD1 2.75Å; H60-D99 PolarHBondContact ND1-OD1 3.4Å; H60-D99 IonicContact ND1-OD2 2.74Å; H60-D99 PolarHBondContact ND1-OD2 2.91Å; H60-K101 HydrophobicContact CB-CB 3.56Å; H60-K101 HydrophobicContact CB-CD 3.94Å; H60-K101 HydrophobicContact CB-CG 4.47Å; H60-K101 VanDerWaalsContact CD2-CD 3.41Å; H60-K101 WeakPolarHBondContact CD2-CD 3.28Å
61	P	90.8	Very high	95.2	Very high	31 Å²	31	56.9 Å²	56.9	20%	0.201	30%	0.304	C	S	.	.			trans	-64.4	-15.4	-170	24.8	-35.2	0	0	0	114	D59 A67 Q68 F71	D59-P61 WeakPolarHBondContact O-CD 3.46Å; P61-A67 HydrophobicContact CB-CB 4.16Å; P61-A67 VanDerWaalsContact O-CB 3.28Å; P61-A67 WeakPolarHBondContact O-CB 3.33Å; P61-Q68 HydrophobicContact CB-CG 4.4Å; P61-F71 HydrophobicContact CB-CB 4.09Å; P61-F71 HydrophobicContact CG-CB 4.17Å; P61-F71 HydrophobicContact CG-CD1 4.27Å; P61-F71 HydrophobicContact CG-CG 4.15Å
62	G	89.1	Confident	95.2	Very high	32 Å²	32	59.2 Å²	59.2	33%	0.33	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	-143.8	175.8	0	0	0	0	0	112.7	H60 Q68	H60-G62 PolarHBondContact CD2-N 2.82Å; H60-G62 PolarHBondContact O-N 3.05Å; G62-Q68 PolarHBondContact O-NE2 3.4Å
63	S	90.2	Very high	95.2	Very high	120 Å²	120	61.4 Å²	61.4	84%	0.839	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	1.1	-178.6	62.3	0	0	0	0	114.1	R65	S63-R65 PolarHBondContact O-N 3.16Å
64	S	94.4	Very high	95.1	Very high	61 Å²	61	62.6 Å²	62.6	43%	0.427	34%	0.337	S	S	.	.			trans	-72.6	124.4	178.6	174.9	0	0	0	0	109.2	V66 A67 Q68	S64-V66 PolarHBondContact O-N 3.16Å; S64-V66 PolarHBondContact OG-N 3.43Å; S64-A67 PolarHBondContact O-N 2.9Å; S64-Q68 WeakPolarHBondContact O-CG 3.27Å; S64-Q68 PolarHBondContact O-N 2.91Å
65	R	94.4	Very high	95.1	Very high	190 Å²	190	65.8 Å²	65.8	72%	0.717	35%	0.352	S	S	*	.	H	α-helix	trans	-61.3	-31	176.7	-172.7	179	67.3	162.9	-0.2	112.2	S63 K69	S63-R65 PolarHBondContact O-N 3.16Å; R65-K69 WeakPolarHBondContact O-CG 3.34Å; R65-K69 PolarHBondContact O-N 3.1Å
66	V	94.7	Very high	95	Very high	109 Å²	109	68.9 Å²	68.9	66%	0.661	37%	0.368	S	S	*	.	H	α-helix	trans	-70.1	-50.6	178.2	177.8	0	0	0	0	109.7	S64 Q68 K69 Q70	S64-V66 PolarHBondContact O-N 3.16Å; S64-V66 PolarHBondContact OG-N 3.43Å; V66-Q68 VanDerWaalsContact C-N 3.3Å; V66-Q68 PolarHBondContact O-N 2.99Å; V66-K69 PolarHBondContact O-N 3.09Å; V66-K69 VanDerWaalsContact O-N 3.09Å; V66-Q70 PolarHBondContact O-N 3.06Å
67	A	93.4	Very high	94.9	Very high	34 Å²	34	69.3 Å²	69.3	28%	0.281	37%	0.372	S	S	.	.	H	α-helix	trans	-62.1	-36.1	178.3	0	0	0	0	0	112.6	P61 S64 Q70 F71	P61-A67 HydrophobicContact CB-CB 4.16Å; P61-A67 VanDerWaalsContact O-CB 3.28Å; P61-A67 WeakPolarHBondContact O-CB 3.33Å; S64-A67 PolarHBondContact O-N 2.9Å; A67-Q70 PolarHBondContact O-N 3.02Å; A67-F71 WeakPolarHBondContact O-CB 3.37Å; A67-F71 PolarHBondContact O-N 3.41Å
68	Q	95.1	Very high	94.9	Very high	81 Å²	81	68.2 Å²	68.2	38%	0.379	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-42.2	173.3	-74	173.4	1.1	0	0	112.4	P61 G62 S64 V66 Q70 F71 E72	P61-Q68 HydrophobicContact CB-CG 4.4Å; G62-Q68 PolarHBondContact O-NE2 3.4Å; S64-Q68 WeakPolarHBondContact O-CG 3.27Å; S64-Q68 PolarHBondContact O-N 2.91Å; V66-Q68 VanDerWaalsContact C-N 3.3Å; V66-Q68 PolarHBondContact O-N 2.99Å; Q68-Q70 VanDerWaalsContact C-N 3.35Å; Q68-F71 PolarHBondContact O-N 3Å; Q68-E72 WeakPolarHBondContact O-CB 3.23Å; Q68-E72 VanDerWaalsContact O-CG 3.27Å; Q68-E72 WeakPolarHBondContact O-CG 3.31Å; Q68-E72 PolarHBondContact O-N 3.34Å
69	K	96.7	Very high	95	Very high	131 Å²	131	68.4 Å²	68.4	57%	0.57	37%	0.369	S	S	*	.	H	α-helix	trans	-69.1	-34.6	177.5	-79.6	-171.8	167.5	-154.8	0	113.1	R65 V66 A73	R65-K69 WeakPolarHBondContact O-CG 3.34Å; R65-K69 PolarHBondContact O-N 3.1Å; V66-K69 PolarHBondContact O-N 3.09Å; V66-K69 VanDerWaalsContact O-N 3.09Å; K69-A73 PolarHBondContact O-N 2.87Å; K69-A73 VanDerWaalsContact O-N 3.14Å
70	Q	94.8	Very high	95	Very high	107 Å²	107	70 Å²	70	50%	0.5	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-52.6	173.9	-178.6	59.8	30.4	0	0	109.5	V66 A67 Q68 E72 A73 E74	V66-Q70 PolarHBondContact O-N 3.06Å; A67-Q70 PolarHBondContact O-N 3.02Å; Q68-Q70 VanDerWaalsContact C-N 3.35Å; Q70-E72 VanDerWaalsContact C-N 3.34Å; Q70-E72 PolarHBondContact O-N 3.04Å; Q70-A73 WeakPolarHBondContact O-CA 3.49Å; Q70-A73 WeakPolarHBondContact O-CB 3.45Å; Q70-A73 PolarHBondContact O-N 3.27Å; Q70-E74 VanDerWaalsContact CG-OE1 3.27Å; Q70-E74 WeakPolarHBondContact CG-OE1 3.43Å; Q70-E74 PolarHBondContact NE2-OE1 2.83Å; Q70-E74 WeakPolarHBondContact O-CG 3.42Å; Q70-E74 PolarHBondContact O-N 2.91Å
71	F	96.3	Very high	95.1	Very high	32 Å²	32	67.1 Å²	67.1	14%	0.14	36%	0.355	C	S	.	.	H	α-helix	trans	-59.6	-39.7	176	-176.4	-105.8	0	0	0	113.8	H58 P61 A67 Q68 A73 E74 E75 L97	H58-F71 HydrophobicContact CB-CD2 4.32Å; H58-F71 HydrophobicContact CB-CE2 3.88Å; H58-F71 AromaticContact CD2-CE2 3.63Å; H58-F71 AromaticContact CE1-CE2 3.54Å; H58-F71 AromaticContact CE1-CZ 3.67Å; H58-F71 AromaticContact CG-CE2 3.35Å; H58-F71 AromaticContact ND1-CD2 3.82Å; H58-F71 AromaticContact ND1-CE2 3.3Å; H58-F71 VanDerWaalsContact ND1-CE2 3.3Å; H58-F71 WeakPolarHBondContact ND1-CE2 3.26Å; H58-F71 AromaticContact ND1-CZ 3.92Å; H58-F71 AromaticContact NE2-CE2 3.77Å; H58-F71 AromaticContact NE2-CZ 3.74Å; P61-F71 HydrophobicContact CB-CB 4.09Å; P61-F71 HydrophobicContact CG-CB 4.17Å; P61-F71 HydrophobicContact CG-CD1 4.27Å; P61-F71 HydrophobicContact CG-CG 4.15Å; A67-F71 WeakPolarHBondContact O-CB 3.37Å; A67-F71 PolarHBondContact O-N 3.41Å; Q68-F71 PolarHBondContact O-N 3Å; F71-A73 PolarHBondContact O-N 3.47Å; F71-E74 WeakPolarHBondContact CA-OE2 3.4Å; F71-E74 PolarHBondContact O-N 3.35Å; F71-E75 VanDerWaalsContact O-CB 3.32Å; F71-E75 WeakPolarHBondContact O-CB 3.44Å; F71-E75 PolarHBondContact O-N 2.67Å; F71-L97 HydrophobicContact CE2-CD2 4.29Å; F71-L97 HydrophobicContact CZ-CD1 4.16Å; F71-L97 HydrophobicContact CZ-CD2 4.37Å
72	E	95.9	Very high	95.4	Very high	116 Å²	116	66 Å²	66	54%	0.542	35%	0.348	S	S	.	.	H	α-helix	trans	-60.9	-32.2	173.8	-76.8	170.2	-172.8	0	0	112.6	Q68 Q70 L76	Q68-E72 WeakPolarHBondContact O-CB 3.23Å; Q68-E72 VanDerWaalsContact O-CG 3.27Å; Q68-E72 WeakPolarHBondContact O-CG 3.31Å; Q68-E72 PolarHBondContact O-N 3.34Å; Q70-E72 VanDerWaalsContact C-N 3.34Å; Q70-E72 PolarHBondContact O-N 3.04Å; E72-L76 WeakPolarHBondContact O-CB 3.31Å; E72-L76 PolarHBondContact O-N 3.13Å
73	A	96.1	Very high	95.7	Very high	54 Å²	54	65.2 Å²	65.2	45%	0.446	34%	0.336	S	S	.	.	H	α-helix	trans	-75	-44	177.3	0	0	0	0	0	111.5	K69 Q70 F71 L76 A77	K69-A73 PolarHBondContact O-N 2.87Å; K69-A73 VanDerWaalsContact O-N 3.14Å; Q70-A73 WeakPolarHBondContact O-CA 3.49Å; Q70-A73 WeakPolarHBondContact O-CB 3.45Å; Q70-A73 PolarHBondContact O-N 3.27Å; F71-A73 PolarHBondContact O-N 3.47Å; A73-L76 PolarHBondContact O-N 3.1Å; A73-A77 PolarHBondContact O-N 2.77Å
74	E	96.6	Very high	95.9	Very high	29 Å²	29	62.4 Å²	62.4	14%	0.136	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-48	175.9	-67.3	159.8	-179.1	0	0	111.4	Y56 Q70 F71 L76 A77 L78 L133	Y56-E74 HydrophobicContact CE1-CB 4.07Å; Y56-E74 PolarHBondContact OH-OE2 3.15Å; Q70-E74 VanDerWaalsContact CG-OE1 3.27Å; Q70-E74 WeakPolarHBondContact CG-OE1 3.43Å; Q70-E74 PolarHBondContact NE2-OE1 2.83Å; Q70-E74 WeakPolarHBondContact O-CG 3.42Å; Q70-E74 PolarHBondContact O-N 2.91Å; F71-E74 WeakPolarHBondContact CA-OE2 3.4Å; F71-E74 PolarHBondContact O-N 3.35Å; E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 2.83Å; E74-A77 WeakPolarHBondContact O-CB 3.22Å; E74-A77 PolarHBondContact O-N 2.88Å; E74-A77 VanDerWaalsContact O-N 3.12Å; E74-L78 WeakPolarHBondContact O-CG 3.39Å; E74-L78 PolarHBondContact O-N 2.95Å; E74-L133 HydrophobicContact CB-CD2 3.82Å; E74-L133 HydrophobicContact CG-CD2 3.83Å
75	E	97.1	Very high	95.9	Very high	67 Å²	67	59.5 Å²	59.5	31%	0.313	29%	0.293	S	S	.	.	H	α-helix	trans	-58.8	-39.3	175	-177.4	176	-150.9	0	0	111.1	F71 L78 E79 L97	F71-E75 VanDerWaalsContact O-CB 3.32Å; F71-E75 WeakPolarHBondContact O-CB 3.44Å; F71-E75 PolarHBondContact O-N 2.67Å; E75-L78 PolarHBondContact O-N 2.84Å; E75-E79 WeakPolarHBondContact O-CG 3.43Å; E75-E79 PolarHBondContact O-N 3.04Å; E75-L97 HydrophobicContact CG-CD1 4.19Å
76	L	96.9	Very high	95.8	Very high	65 Å²	65	55.4 Å²	55.4	34%	0.34	29%	0.286	S	S	.	.	H	α-helix	trans	-68.7	-34.7	176.9	-176.1	63.9	0	0	0	112.9	Y29 E72 A73 E74 E79 R80	Y29-L76 HydrophobicContact CD1-CD1 3.95Å; Y29-L76 HydrophobicContact CE1-CD1 3.71Å; E72-L76 WeakPolarHBondContact O-CB 3.31Å; E72-L76 PolarHBondContact O-N 3.13Å; A73-L76 PolarHBondContact O-N 3.1Å; E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 2.83Å; L76-E79 PolarHBondContact O-N 2.87Å; L76-R80 WeakPolarHBondContact O-CG 3.28Å; L76-R80 PolarHBondContact O-N 3.38Å; L76-R80 VanDerWaalsContact O-N 3.11Å
77	A	96.8	Very high	95.6	Very high	11 Å²	11	56.6 Å²	56.6	9%	0.091	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-45.2	172.5	0	0	0	0	0	110.5	A73 E74 E79 R80 A81 A135	A73-A77 PolarHBondContact O-N 2.77Å; E74-A77 WeakPolarHBondContact O-CB 3.22Å; E74-A77 PolarHBondContact O-N 2.88Å; E74-A77 VanDerWaalsContact O-N 3.12Å; A77-E79 PolarHBondContact O-N 2.91Å; A77-R80 WeakPolarHBondContact O-CB 3.49Å; A77-R80 PolarHBondContact O-N 2.77Å; A77-A81 PolarHBondContact O-N 2.93Å; A77-A135 WeakPolarHBondContact O-CB 3.48Å
78	L	97.9	Very high	95.4	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-39.4	175.6	-68.1	170.2	0	0	0	112.8	V35 Y56 E74 E75 R80 A81 A82 V95 L97 I118 L133 L138	V35-L78 HydrophobicContact CG2-CB 3.94Å; Y56-L78 HydrophobicContact CD1-CD1 3.52Å; Y56-L78 HydrophobicContact CG-CD1 3.94Å; E74-L78 WeakPolarHBondContact O-CG 3.39Å; E74-L78 PolarHBondContact O-N 2.95Å; E75-L78 PolarHBondContact O-N 2.84Å; L78-R80 VanDerWaalsContact C-N 3.3Å; L78-R80 PolarHBondContact O-N 3.36Å; L78-A81 PolarHBondContact O-N 3.05Å; L78-A82 VanDerWaalsContact O-CB 3.26Å; L78-A82 WeakPolarHBondContact O-CB 3.34Å; L78-A82 PolarHBondContact O-N 2.78Å; L78-V95 HydrophobicContact CB-CG1 4.09Å; L78-V95 HydrophobicContact CD2-CG1 3.99Å; L78-L97 HydrophobicContact CD1-CD2 3.72Å; L78-I118 HydrophobicContact CD2-CD1 4.44Å; L78-L133 HydrophobicContact CD2-CD1 4.09Å; L78-L133 HydrophobicContact CG-CD1 4.31Å; L78-L138 HydrophobicContact CD2-CD2 3.72Å
79	E	97.8	Very high	95.1	Very high	9 Å²	9	63.1 Å²	63.1	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-36.5	175.2	-78.2	-66.3	176.9	0	0	112.5	Y29 D33 R34 V35 E75 L76 A77 Q83	Y29-E79 HydrophobicContact CE2-CB 3.87Å; D33-E79 WeakPolarHBondContact CA-OE1 3.45Å; R34-E79 WeakPolarHBondContact CB-OE2 3.47Å; R34-E79 PolarHBondContact N-OE1 2.74Å; R34-E79 PolarHBondContact N-OE2 2.66Å; V35-E79 HydrophobicContact CB-CG 4.47Å; V35-E79 WeakPolarHBondContact CB-OE1 3.13Å; V35-E79 HydrophobicContact CG2-CB 4.43Å; V35-E79 VanDerWaalsContact CG2-CD 3.45Å; V35-E79 HydrophobicContact CG2-CG 3.79Å; V35-E79 WeakPolarHBondContact CG2-OE1 3.36Å; V35-E79 PolarHBondContact N-OE1 2.81Å; E75-E79 WeakPolarHBondContact O-CG 3.43Å; E75-E79 PolarHBondContact O-N 3.04Å; L76-E79 PolarHBondContact O-N 2.87Å; A77-E79 PolarHBondContact O-N 2.91Å; E79-Q83 WeakPolarHBondContact O-CB 3.28Å; E79-Q83 PolarHBondContact O-N 2.6Å
80	R	96.1	Very high	94.7	Very high	130 Å²	130	63.1 Å²	63.1	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-69	-44	174.4	-73	175.5	177.3	-174.2	2	111.7	Y29 L76 A77 L78 Q83 V84 A135	Y29-R80 HydrophobicContact CD2-CG 4.36Å; L76-R80 WeakPolarHBondContact O-CG 3.28Å; L76-R80 PolarHBondContact O-N 3.38Å; L76-R80 VanDerWaalsContact O-N 3.11Å; A77-R80 WeakPolarHBondContact O-CB 3.49Å; A77-R80 PolarHBondContact O-N 2.77Å; L78-R80 VanDerWaalsContact C-N 3.3Å; L78-R80 PolarHBondContact O-N 3.36Å; R80-Q83 PolarHBondContact O-N 3.23Å; R80-V84 PolarHBondContact O-N 2.81Å; R80-A135 HydrophobicContact CB-CB 3.74Å
81	A	96.5	Very high	94.6	Very high	1 Å²	1	62 Å²	62	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-58.8	-49.4	173.6	0	0	0	0	0	110.3	A77 L78 Q83 V84 L85 L138 V139	A77-A81 PolarHBondContact O-N 2.93Å; L78-A81 PolarHBondContact O-N 3.05Å; A81-Q83 VanDerWaalsContact C-N 3.26Å; A81-Q83 PolarHBondContact O-N 3.17Å; A81-V84 PolarHBondContact O-N 3.18Å; A81-L85 HydrophobicContact CB-CD1 4.44Å; A81-L85 VanDerWaalsContact O-CG 3.24Å; A81-L85 WeakPolarHBondContact O-CG 3.24Å; A81-L85 PolarHBondContact O-N 2.74Å; A81-L138 HydrophobicContact CB-CD2 4.22Å; A81-V139 HydrophobicContact CB-CG2 3.77Å
82	A	97.3	Very high	94.6	Very high	7 Å²	7	65.4 Å²	65.4	6%	0.058	33%	0.329	C	S	.	.	H	α-helix	trans	-57.9	-36.1	177.3	0	0	0	0	0	112.9	R34 V35 L78 D86 V95	R34-A82 HydrophobicContact CB-CB 3.74Å; V35-A82 HydrophobicContact CG2-CB 4.31Å; L78-A82 VanDerWaalsContact O-CB 3.26Å; L78-A82 WeakPolarHBondContact O-CB 3.34Å; L78-A82 PolarHBondContact O-N 2.78Å; A82-D86 WeakPolarHBondContact O-CB 3.43Å; A82-D86 PolarHBondContact O-N 3.27Å; A82-V95 HydrophobicContact CB-CB 3.97Å; A82-V95 HydrophobicContact CB-CG2 3.64Å
83	Q	95.6	Very high	94.7	Very high	16 Å²	16	60.5 Å²	60.5	8%	0.075	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-42.2	175.4	175.4	173.3	-28	0	0	112.4	E28 Y29 D30 E79 R80 A81	E28-Q83 PolarHBondContact O-NE2 3.36Å; Y29-Q83 VanDerWaalsContact CA-OE1 3.29Å; Y29-Q83 VanDerWaalsContact CD2-OE1 3.31Å; D30-Q83 PolarHBondContact OD1-OE1 2.94Å; E79-Q83 WeakPolarHBondContact O-CB 3.28Å; E79-Q83 PolarHBondContact O-N 2.6Å; R80-Q83 PolarHBondContact O-N 3.23Å; A81-Q83 VanDerWaalsContact C-N 3.26Å; A81-Q83 PolarHBondContact O-N 3.17Å
84	V	94.2	Very high	94.7	Very high	60 Å²	60	58 Å²	58	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-69.8	-43.9	179	177.2	0	0	0	0	110.3	R80 A81 D86 E87 V139 Y143	R80-V84 PolarHBondContact O-N 2.81Å; A81-V84 PolarHBondContact O-N 3.18Å; V84-D86 PolarHBondContact O-N 2.72Å; V84-E87 PolarHBondContact O-N 3.19Å; V84-E87 VanDerWaalsContact O-N 3.13Å; V84-V139 HydrophobicContact CB-CG2 4.34Å; V84-V139 HydrophobicContact CG1-CG1 3.99Å; V84-Y143 WeakPolarHBondContact CG1-OH 3.13Å
85	L	94.8	Very high	94.8	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-69.8	-29.3	-178.2	-61.6	166	0	0	0	112.8	A81 E87 F88 I93 V95 V139 I142 Y143	A81-L85 HydrophobicContact CB-CD1 4.44Å; A81-L85 VanDerWaalsContact O-CG 3.24Å; A81-L85 WeakPolarHBondContact O-CG 3.24Å; A81-L85 PolarHBondContact O-N 2.74Å; L85-E87 PolarHBondContact O-N 2.99Å; L85-F88 WeakPolarHBondContact O-CB 3.34Å; L85-F88 PolarHBondContact O-N 3.45Å; L85-I93 HydrophobicContact CB-CB 4.12Å; L85-I93 HydrophobicContact CB-CD1 4.3Å; L85-I93 HydrophobicContact CB-CG2 4.09Å; L85-I93 HydrophobicContact CD1-CG2 4.05Å; L85-I93 HydrophobicContact CD2-CD1 3.86Å; L85-I93 HydrophobicContact CG-CG2 4.45Å; L85-V95 HydrophobicContact CD1-CG2 4.21Å; L85-V139 HydrophobicContact CD1-CG2 4.48Å; L85-V139 HydrophobicContact CD2-CG1 4.5Å; L85-V139 HydrophobicContact CD2-CG2 4.45Å; L85-V139 HydrophobicContact CG-CG2 4.26Å; L85-I142 HydrophobicContact CD1-CD1 3.58Å; L85-I142 HydrophobicContact CD2-CB 4.37Å; L85-I142 HydrophobicContact CD2-CD1 4.47Å; L85-I142 HydrophobicContact CD2-CG2 3.8Å; L85-Y143 HydrophobicContact CD2-CE1 4.13Å
86	D	92.4	Very high	94.9	Very high	104 Å²	104	53.6 Å²	53.6	56%	0.556	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.9	172.6	-174.8	53.5	0	0	0	112.7	R34 A82 V84	R34-D86 IonicContact NE-OD2 2.65Å; R34-D86 PolarHBondContact NE-OD2 3.37Å; A82-D86 WeakPolarHBondContact O-CB 3.43Å; A82-D86 PolarHBondContact O-N 3.27Å; V84-D86 PolarHBondContact O-N 2.72Å
87	E	89.1	Confident	94.9	Very high	134 Å²	134	50.7 Å²	50.7	63%	0.626	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-5.9	172.4	-63.7	-173	-179.9	0	0	113	V84 L85 E89	V84-E87 PolarHBondContact O-N 3.19Å; V84-E87 VanDerWaalsContact O-N 3.13Å; L85-E87 PolarHBondContact O-N 2.99Å; E87-E89 PolarHBondContact O-N 2.69Å
88	F	90.4	Very high	95	Very high	60 Å²	60	50.2 Å²	50.2	26%	0.263	25%	0.246	S	C	.	.			trans	-72.7	118.2	176.6	-162.9	-107.4	0	0	0	109.8	L85 D90 E91 I93 Y143 L146	L85-F88 WeakPolarHBondContact O-CB 3.34Å; L85-F88 PolarHBondContact O-N 3.45Å; F88-D90 HydrophobicContact CD1-CB 4.33Å; F88-D90 HydrophobicContact CE1-CB 3.73Å; F88-D90 HydrophobicContact CZ-CB 4.14Å; F88-E91 HydrophobicContact CD1-CB 4.3Å; F88-E91 HydrophobicContact CE1-CB 4.31Å; F88-E91 HydrophobicContact CE1-CG 4.46Å; F88-I93 HydrophobicContact CB-CD1 4.24Å; F88-I93 HydrophobicContact CD1-CD1 3.82Å; F88-I93 HydrophobicContact CG-CD1 4.23Å; F88-Y143 HydrophobicContact CD2-CD1 4.42Å; F88-Y143 AromaticContact CD2-CE1 3.7Å; F88-Y143 HydrophobicContact CD2-CE1 3.7Å; F88-Y143 HydrophobicContact CE2-CD1 4.17Å; F88-Y143 AromaticContact CE2-CE1 3.86Å; F88-Y143 HydrophobicContact CE2-CE1 3.86Å; F88-Y143 HydrophobicContact CG-CE1 4.45Å; F88-L146 HydrophobicContact CD1-CD1 4.26Å; F88-L146 HydrophobicContact CE1-CD1 3.78Å; F88-L146 HydrophobicContact CZ-CD1 4.09Å
89	E	88.6	Confident	95	Very high	191 Å²	191	50.8 Å²	50.8	89%	0.893	25%	0.249	S	C	*	.	S	Bend	trans	-86.6	-18.4	-170.9	-66.7	-169	167.5	0	0	114	E87	E87-E89 PolarHBondContact O-N 2.69Å
90	D	88.7	Confident	94.9	Very high	132 Å²	132	50.9 Å²	50.9	71%	0.706	25%	0.251	S	S	*	.	S	Bend	trans	-82.7	-31.4	-171.1	-69.5	-38.4	0	0	0	112.6	F88	F88-D90 HydrophobicContact CD1-CB 4.33Å; F88-D90 HydrophobicContact CE1-CB 3.73Å; F88-D90 HydrophobicContact CZ-CB 4.14Å
91	E	91.7	Very high	94.9	Very high	82 Å²	82	50.6 Å²	50.6	38%	0.383	25%	0.254	S	S	.	.	S	Bend	trans	-139.2	142.9	-178.6	-64.7	-62.2	157.2	0	0	111.3	D51 F88 I93 L146	D51-E91 HydrophobicContact CB-CB 4.5Å; D51-E91 WeakPolarHBondContact CB-OE2 3.21Å; F88-E91 HydrophobicContact CD1-CB 4.3Å; F88-E91 HydrophobicContact CE1-CB 4.31Å; F88-E91 HydrophobicContact CE1-CG 4.46Å; E91-I93 HydrophobicContact CB-CG1 4.28Å; E91-I93 PolarHBondContact O-N 2.72Å; E91-L146 HydrophobicContact CB-CD2 4.44Å; E91-L146 HydrophobicContact CG-CD2 4.21Å
92	D	95.6	Very high	94.9	Very high	105 Å²	105	56.1 Å²	56.1	56%	0.561	28%	0.282	S	S	*	.			trans	-79.4	101.9	173.3	-79.5	-45.4	0	0	0	109.6	Y50 D51 V52	Y50-D92 CarbonylContact C-O 3.45Å; Y50-D92 VanDerWaalsContact CA-O 3.24Å; Y50-D92 WeakPolarHBondContact CA-O 3.49Å; Y50-D92 VanDerWaalsContact CB-O 3.28Å; Y50-D92 WeakPolarHBondContact CB-O 3.31Å; Y50-D92 HydrophobicContact CD1-CB 4.22Å; D51-D92 PolarHBondContact N-O 3.45Å; D51-D92 WeakPolarHBondContact OD2-CB 3.2Å; D51-D92 PolarHBondContact OD2-N 2.73Å; V52-D92 PolarHBondContact N-O 2.9Å
93	I	97.7	Very high	94.9	Very high	12 Å²	12	56.9 Å²	56.9	6%	0.062	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.4	-177.5	-51.4	169	0	0	0	111.4	Y50 V52 V54 L85 F88 E91 I142 L146	Y50-I93 WeakPolarHBondContact CE1-O 3.46Å; V52-I93 HydrophobicContact CB-CG1 4.32Å; V52-I93 HydrophobicContact CB-CG2 4.37Å; V52-I93 HydrophobicContact CG1-CG2 4.44Å; V52-I93 WeakPolarHBondContact O-CA 3.32Å; V54-I93 HydrophobicContact CG2-CG2 4.34Å; L85-I93 HydrophobicContact CB-CB 4.12Å; L85-I93 HydrophobicContact CB-CD1 4.3Å; L85-I93 HydrophobicContact CB-CG2 4.09Å; L85-I93 HydrophobicContact CD1-CG2 4.05Å; L85-I93 HydrophobicContact CD2-CD1 3.86Å; L85-I93 HydrophobicContact CG-CG2 4.45Å; F88-I93 HydrophobicContact CB-CD1 4.24Å; F88-I93 HydrophobicContact CD1-CD1 3.82Å; F88-I93 HydrophobicContact CG-CD1 4.23Å; E91-I93 HydrophobicContact CB-CG1 4.28Å; E91-I93 PolarHBondContact O-N 2.72Å; I93-I142 HydrophobicContact CD1-CG2 4.4Å; I93-L146 HydrophobicContact CD1-CD1 3.58Å
94	G	97.6	Very high	94.8	Very high	2 Å²	2	62.3 Å²	62.3	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.7	177.2	0	0	0	0	0	112.3	Y50 V52 M53 V54	Y50-G94 VanDerWaalsContact CD1-N 3.27Å; V52-G94 PolarHBondContact O-N 2.95Å; M53-G94 CarbonylContact C-O 3.55Å; M53-G94 WeakPolarHBondContact CA-O 3.37Å; V54-G94 PolarHBondContact N-O 2.9Å
95	V	98.5	Very high	94.9	Very high	4 Å²	4	63.7 Å²	63.7	2%	0.024	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	138.4	172.2	-173.1	0	0	0	0	109.3	V35 H36 V54 L78 A82 L85	V35-V95 HydrophobicContact CG1-CG1 4.32Å; V35-V95 HydrophobicContact CG2-CB 4.27Å; V35-V95 HydrophobicContact CG2-CG1 4.03Å; H36-V95 PolarHBondContact CD2-O 3.44Å; H36-V95 VanDerWaalsContact CD2-O 3.27Å; H36-V95 PolarHBondContact N-O 3.49Å; V54-V95 HydrophobicContact CB-CG1 4.49Å; V54-V95 HydrophobicContact CB-CG2 4.3Å; V54-V95 CarbonylContact O-C 3.5Å; V54-V95 VanDerWaalsContact O-CA 3.3Å; V54-V95 WeakPolarHBondContact O-CA 3.42Å; L78-V95 HydrophobicContact CB-CG1 4.09Å; L78-V95 HydrophobicContact CD2-CG1 3.99Å; A82-V95 HydrophobicContact CB-CB 3.97Å; A82-V95 HydrophobicContact CB-CG2 3.64Å; L85-V95 HydrophobicContact CD1-CG2 4.21Å
96	G	98.1	Very high	95	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	164.3	-178.5	0	0	0	0	0	114.4	H36 V54 V55 Y56	H36-G96 CarbonylContact O-C 3.52Å; H36-G96 WeakPolarHBondContact O-CA 3.44Å; V54-G96 PolarHBondContact O-N 2.9Å; V55-G96 WeakPolarHBondContact CA-O 3.36Å; Y56-G96 PolarHBondContact N-O 3.47Å
97	L	98.3	Very high	95.1	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.1	-178.8	-69.3	163.9	0	0	0	109.9	V35 H36 L38 Y56 F71 E75 L78	V35-L97 HydrophobicContact CG1-CD1 3.57Å; V35-L97 HydrophobicContact CG1-CD2 4.49Å; V35-L97 HydrophobicContact CG1-CG 3.52Å; H36-L97 PolarHBondContact O-N 2.85Å; L38-L97 WeakPolarHBondContact CB-O 3.48Å; L38-L97 PolarHBondContact N-O 2.91Å; Y56-L97 HydrophobicContact CD1-CD2 3.57Å; Y56-L97 HydrophobicContact CG-CD2 4.24Å; Y56-L97 WeakPolarHBondContact O-CA 3.42Å; F71-L97 HydrophobicContact CE2-CD2 4.29Å; F71-L97 HydrophobicContact CZ-CD1 4.16Å; F71-L97 HydrophobicContact CZ-CD2 4.37Å; E75-L97 HydrophobicContact CG-CD1 4.19Å; L78-L97 HydrophobicContact CD1-CD2 3.72Å
98	I	98.3	Very high	95.4	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.299	C	S	.	.			trans	-127.4	123	168.6	-66.9	175.8	0	0	0	108.6	L38 V55 Y56 Y57 H58 D103 V106 A107 L110 L112	L38-I98 HydrophobicContact CB-CD1 4.3Å; L38-I98 HydrophobicContact CB-CG1 3.69Å; L38-I98 HydrophobicContact CD1-CD1 4.14Å; L38-I98 HydrophobicContact CD1-CG1 4.07Å; L38-I98 HydrophobicContact CG-CG1 4.41Å; V55-I98 HydrophobicContact CG1-CB 4.48Å; V55-I98 HydrophobicContact CG1-CD1 3.62Å; V55-I98 HydrophobicContact CG1-CG1 3.88Å; Y56-I98 PolarHBondContact O-N 3.38Å; Y57-I98 CarbonylContact C-O 3.56Å; Y57-I98 HydrophobicContact CD2-CB 4Å; Y57-I98 HydrophobicContact CD2-CG2 3.68Å; Y57-I98 WeakPolarHBondContact CD2-O 3.48Å; Y57-I98 HydrophobicContact CE2-CG2 3.98Å; H58-I98 PolarHBondContact CD2-O 3.31Å; H58-I98 VanDerWaalsContact CD2-O 3.31Å; H58-I98 PolarHBondContact N-O 2.91Å; I98-D103 HydrophobicContact CG2-CB 3.9Å; I98-V106 HydrophobicContact CD1-CG1 3.79Å; I98-A107 HydrophobicContact CG2-CB 4.2Å; I98-L110 HydrophobicContact CD1-CD1 3.58Å; I98-L112 HydrophobicContact CD1-CD1 3.77Å
99	D	97.6	Very high	95.7	Very high	13 Å²	13	63.9 Å²	63.9	7%	0.07	31%	0.311	C	S	.	.			trans	-81.6	121.3	177.9	179.8	-56.3	0	0	0	110.8	H58 H60 K101 L102 D103	H58-D99 IonicContact CE1-OD2 3.74Å; H58-D99 WeakPolarHBondContact NE2-CA 3.28Å; H60-D99 IonicContact CE1-OD2 3.47Å; H60-D99 IonicContact CG-OD1 3.34Å; H60-D99 IonicContact CG-OD2 3.29Å; H60-D99 IonicContact ND1-OD1 2.75Å; H60-D99 PolarHBondContact ND1-OD1 3.4Å; H60-D99 IonicContact ND1-OD2 2.74Å; H60-D99 PolarHBondContact ND1-OD2 2.91Å; D99-K101 PolarHBondContact O-N 3.07Å; D99-K101 VanDerWaalsContact O-N 3.12Å; D99-K101 VanDerWaalsContact OD1-CA 3.3Å; D99-K101 WeakPolarHBondContact OD1-CA 3.34Å; D99-K101 VanDerWaalsContact OD1-CB 3.28Å; D99-K101 WeakPolarHBondContact OD1-CB 3.43Å; D99-K101 PolarHBondContact OD1-N 3.38Å; D99-L102 HydrophobicContact CB-CB 4.04Å; D99-L102 HydrophobicContact CB-CD1 4.47Å; D99-L102 HydrophobicContact CB-CG 4.36Å; D99-L102 PolarHBondContact O-N 2.99Å; D99-L102 PolarHBondContact OD1-N 2.85Å; D99-L102 WeakPolarHBondContact OD2-CD1 3.43Å; D99-D103 WeakPolarHBondContact O-CA 3.38Å; D99-D103 PolarHBondContact O-N 2.96Å
100	A	96.1	Very high	96	Very high	11 Å²	11	56.3 Å²	56.3	9%	0.091	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.1	179.9	0	0	0	0	0	114.9	Y57 H58 K104	Y57-A100 HydrophobicContact CD2-CB 4.46Å; Y57-A100 HydrophobicContact CE2-CB 3.68Å; H58-A100 VanDerWaalsContact O-CB 3.31Å; H58-A100 WeakPolarHBondContact O-CB 3.37Å; H58-A100 PolarHBondContact O-N 3.18Å; A100-K104 WeakPolarHBondContact O-CE 3.38Å; A100-K104 WeakPolarHBondContact O-CG 3.37Å
101	K	95.3	Very high	96.3	Very high	124 Å²	124	52.3 Å²	52.3	54%	0.539	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-43.8	178.4	-173.3	-177.8	179.7	-179.6	0	112.6	H60 D99 K104	H60-K101 HydrophobicContact CB-CB 3.56Å; H60-K101 HydrophobicContact CB-CD 3.94Å; H60-K101 HydrophobicContact CB-CG 4.47Å; H60-K101 VanDerWaalsContact CD2-CD 3.41Å; H60-K101 WeakPolarHBondContact CD2-CD 3.28Å; D99-K101 PolarHBondContact O-N 3.07Å; D99-K101 VanDerWaalsContact O-N 3.12Å; D99-K101 VanDerWaalsContact OD1-CA 3.3Å; D99-K101 WeakPolarHBondContact OD1-CA 3.34Å; D99-K101 VanDerWaalsContact OD1-CB 3.28Å; D99-K101 WeakPolarHBondContact OD1-CB 3.43Å; D99-K101 PolarHBondContact OD1-N 3.38Å; K101-K104 WeakPolarHBondContact O-CE 3.25Å
102	L	96.6	Very high	96.4	Very high	116 Å²	116	49 Å²	49	61%	0.607	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-35.3	-171.2	-58.4	-179.6	0	0	0	112.4	D99	D99-L102 HydrophobicContact CB-CB 4.04Å; D99-L102 HydrophobicContact CB-CD1 4.47Å; D99-L102 HydrophobicContact CB-CG 4.36Å; D99-L102 PolarHBondContact O-N 2.99Å; D99-L102 PolarHBondContact OD1-N 2.85Å; D99-L102 WeakPolarHBondContact OD2-CD1 3.43Å
103	D	96.9	Very high	96	Very high	23 Å²	23	52.7 Å²	52.7	12%	0.123	27%	0.265	C	S	.	.			trans	-116.2	26.2	-169.2	-71.2	-68.4	0	0	0	113.8	N39 I98 D99 V105 V106 A107	N39-D103 WeakPolarHBondContact CA-OD1 3.45Å; N39-D103 WeakPolarHBondContact CB-OD1 3.38Å; I98-D103 HydrophobicContact CG2-CB 3.9Å; D99-D103 WeakPolarHBondContact O-CA 3.38Å; D99-D103 PolarHBondContact O-N 2.96Å; D103-V105 PolarHBondContact O-N 3.23Å; D103-V106 HydrophobicContact CB-CB 4.47Å; D103-V106 HydrophobicContact CB-CG2 4.41Å; D103-V106 WeakPolarHBondContact O-CA 3.44Å; D103-V106 WeakPolarHBondContact O-CB 3.38Å; D103-V106 PolarHBondContact O-N 3.1Å; D103-A107 PolarHBondContact O-N 3.21Å; D103-A107 VanDerWaalsContact O-N 3.12Å
104	K	94.9	Very high	95.6	Very high	130 Å²	130	58 Å²	58	57%	0.565	29%	0.29	S	S	*	.	H	α-helix	trans	-43.3	-35.4	174.4	-65.9	-174.5	-175.1	-151	0	115.4	A100 K101 V106 K108	A100-K104 WeakPolarHBondContact O-CE 3.38Å; A100-K104 WeakPolarHBondContact O-CG 3.37Å; K101-K104 WeakPolarHBondContact O-CE 3.25Å; K104-V106 VanDerWaalsContact C-N 3.33Å; K104-K108 VanDerWaalsContact O-CB 3.28Å; K104-K108 WeakPolarHBondContact O-CB 3.48Å; K104-K108 PolarHBondContact O-N 3.45Å
105	V	95.6	Very high	95.4	Very high	89 Å²	89	59.9 Å²	59.9	54%	0.539	30%	0.303	S	S	.	.	H	α-helix	trans	-72.9	-29.3	-179.5	176.8	0	0	0	0	111.7	D103 K109	D103-V105 PolarHBondContact O-N 3.23Å; V105-K109 WeakPolarHBondContact O-CD 3.3Å; V105-K109 VanDerWaalsContact O-CG 3.22Å; V105-K109 WeakPolarHBondContact O-CG 3.4Å
106	V	96.8	Very high	95.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-76.5	-52.2	173.7	-175.2	0	0	0	0	109.2	N39 A40 Y43 I98 D103 K104 K108 K109 L110	N39-V106 VanDerWaalsContact C-CG2 3.46Å; A40-V106 HydrophobicContact CB-CG2 4.25Å; A40-V106 VanDerWaalsContact N-CG2 3.32Å; Y43-V106 HydrophobicContact CD1-CG1 4.15Å; Y43-V106 HydrophobicContact CD1-CG2 4.15Å; Y43-V106 HydrophobicContact CD2-CG1 3.84Å; Y43-V106 HydrophobicContact CE2-CG1 4.42Å; Y43-V106 HydrophobicContact CG-CG1 3.67Å; Y43-V106 HydrophobicContact CG-CG2 4.45Å; I98-V106 HydrophobicContact CD1-CG1 3.79Å; D103-V106 HydrophobicContact CB-CB 4.47Å; D103-V106 HydrophobicContact CB-CG2 4.41Å; D103-V106 WeakPolarHBondContact O-CA 3.44Å; D103-V106 WeakPolarHBondContact O-CB 3.38Å; D103-V106 PolarHBondContact O-N 3.1Å; K104-V106 VanDerWaalsContact C-N 3.33Å; V106-K108 VanDerWaalsContact C-N 3.34Å; V106-K108 PolarHBondContact O-N 2.91Å; V106-K109 WeakPolarHBondContact O-CA 3.2Å; V106-K109 WeakPolarHBondContact O-CB 3.36Å; V106-K109 PolarHBondContact O-N 3.49Å; V106-L110 HydrophobicContact CG1-CD1 3.9Å; V106-L110 HydrophobicContact CG1-CG 4.31Å; V106-L110 PolarHBondContact O-N 3.48Å
107	A	95.8	Very high	95	Very high	2 Å²	2	64.7 Å²	64.7	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-48	-54.4	176.4	0	0	0	0	0	111.8	Y57 I98 D103 K109 L110 G111 L112	Y57-A107 HydrophobicContact CD2-CB 4.15Å; Y57-A107 HydrophobicContact CE1-CB 4.44Å; Y57-A107 HydrophobicContact CE2-CB 3.47Å; Y57-A107 VanDerWaalsContact CE2-CB 3.47Å; I98-A107 HydrophobicContact CG2-CB 4.2Å; D103-A107 PolarHBondContact O-N 3.21Å; D103-A107 VanDerWaalsContact O-N 3.12Å; A107-K109 PolarHBondContact O-N 3Å; A107-K109 VanDerWaalsContact O-N 3.09Å; A107-L110 CarbonylContact O-C 3.53Å; A107-L110 PolarHBondContact O-N 2.95Å; A107-G111 PolarHBondContact O-N 2.78Å; A107-L112 HydrophobicContact CB-CB 4.16Å; A107-L112 HydrophobicContact CB-CD1 4.32Å; A107-L112 HydrophobicContact CB-CG 4.49Å; A107-L112 PolarHBondContact O-N 3.01Å; A107-L112 VanDerWaalsContact O-N 3.08Å
108	K	95.4	Very high	94.9	Very high	181 Å²	181	64.8 Å²	64.8	79%	0.787	33%	0.33	S	S	*	.	H	α-helix	trans	-58.9	-28.1	176.7	-179.9	166	-176.1	156.5	0	115	K104 V106	K104-K108 VanDerWaalsContact O-CB 3.28Å; K104-K108 WeakPolarHBondContact O-CB 3.48Å; K104-K108 PolarHBondContact O-N 3.45Å; V106-K108 VanDerWaalsContact C-N 3.34Å; V106-K108 PolarHBondContact O-N 2.91Å
109	K	95.6	Very high	94.9	Very high	120 Å²	120	65.4 Å²	65.4	52%	0.522	33%	0.332	S	S	.	.	H	α-helix	trans	-83.4	-24.8	178.2	-77.7	178.1	-168.7	164.3	0	112.7	Y43 V105 V106 A107	Y43-K109 WeakPolarHBondContact OH-CD 3.43Å; V105-K109 WeakPolarHBondContact O-CD 3.3Å; V105-K109 VanDerWaalsContact O-CG 3.22Å; V105-K109 WeakPolarHBondContact O-CG 3.4Å; V106-K109 WeakPolarHBondContact O-CA 3.2Å; V106-K109 WeakPolarHBondContact O-CB 3.36Å; V106-K109 PolarHBondContact O-N 3.49Å; A107-K109 PolarHBondContact O-N 3Å; A107-K109 VanDerWaalsContact O-N 3.09Å
110	L	94.8	Very high	94.9	Very high	33 Å²	33	64.8 Å²	64.8	17%	0.173	33%	0.329	C	S	.	.	H	α-helix	trans	-90.1	-10.5	175.5	-64.2	-178.1	0	0	0	111.9	Y43 M47 I98 V106 A107 L112 F121	Y43-L110 HydrophobicContact CD2-CD2 4.21Å; Y43-L110 HydrophobicContact CE2-CD2 4.15Å; M47-L110 HydrophobicContact CE-CD1 4.29Å; M47-L110 HydrophobicContact CE-CD2 3.89Å; M47-L110 HydrophobicContact SD-CD1 3.93Å; M47-L110 HydrophobicContact SD-CD2 3.67Å; M47-L110 HydrophobicContact SD-CG 4.47Å; I98-L110 HydrophobicContact CD1-CD1 3.58Å; V106-L110 HydrophobicContact CG1-CD1 3.9Å; V106-L110 HydrophobicContact CG1-CG 4.31Å; V106-L110 PolarHBondContact O-N 3.48Å; A107-L110 CarbonylContact O-C 3.53Å; A107-L110 PolarHBondContact O-N 2.95Å; L110-L112 HydrophobicContact CB-CD1 4.35Å; L110-L112 HydrophobicContact CB-CD2 4.09Å; L110-L112 HydrophobicContact CB-CG 3.95Å; L110-F121 HydrophobicContact CB-CE1 4.32Å; L110-F121 HydrophobicContact CB-CZ 3.97Å; L110-F121 HydrophobicContact CD1-CZ 4.36Å; L110-F121 HydrophobicContact CD2-CE1 4.46Å
111	G	94.9	Very high	94.9	Very high	48 Å²	48	65.4 Å²	65.4	50%	0.495	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	17.6	178.5	0	0	0	0	0	113.5	A107 E113	A107-G111 PolarHBondContact O-N 2.78Å; G111-E113 WeakPolarHBondContact O-CG 3.43Å; G111-E113 PolarHBondContact O-N 3.49Å
112	L	94.4	Very high	94.8	Very high	11 Å²	11	61.5 Å²	61.5	6%	0.058	32%	0.316	C	S	.	.			trans	-76.5	116.6	-179.6	-41.3	-178.5	0	0	0	108.8	V55 Y57 I98 A107 L110 F119 F121	V55-L112 HydrophobicContact CG1-CD1 4.43Å; Y57-L112 HydrophobicContact CD1-CB 3.59Å; Y57-L112 HydrophobicContact CD1-CD1 4.35Å; Y57-L112 HydrophobicContact CD2-CD1 4.13Å; Y57-L112 HydrophobicContact CE1-CB 4.02Å; Y57-L112 HydrophobicContact CG-CB 3.99Å; Y57-L112 HydrophobicContact CG-CD1 3.86Å; I98-L112 HydrophobicContact CD1-CD1 3.77Å; A107-L112 HydrophobicContact CB-CB 4.16Å; A107-L112 HydrophobicContact CB-CD1 4.32Å; A107-L112 HydrophobicContact CB-CG 4.49Å; A107-L112 PolarHBondContact O-N 3.01Å; A107-L112 VanDerWaalsContact O-N 3.08Å; L110-L112 HydrophobicContact CB-CD1 4.35Å; L110-L112 HydrophobicContact CB-CD2 4.09Å; L110-L112 HydrophobicContact CB-CG 3.95Å; L112-F119 HydrophobicContact CB-CE2 4.11Å; L112-F119 HydrophobicContact CB-CZ 4.46Å; L112-F119 HydrophobicContact CD1-CD2 4.45Å; L112-F119 HydrophobicContact CD2-CB 4.11Å; L112-F119 HydrophobicContact CD2-CD1 4.01Å; L112-F119 HydrophobicContact CD2-CD2 3.51Å; L112-F119 HydrophobicContact CD2-CE1 4.34Å; L112-F119 HydrophobicContact CD2-CE2 3.87Å; L112-F119 HydrophobicContact CD2-CG 3.58Å; L112-F119 HydrophobicContact CD2-CZ 4.28Å; L112-F119 HydrophobicContact CG-CD2 4.35Å; L112-F119 HydrophobicContact CG-CE2 4.42Å; L112-F121 HydrophobicContact CD2-CE2 4.33Å; L112-F121 HydrophobicContact CD2-CZ 3.81Å
113	E	87.8	Confident	94.2	Very high	184 Å²	184	62.9 Å²	62.9	86%	0.86	32%	0.324	S	S	*	.			trans	-98.9	-47	-175.1	-55.3	-152.4	153.2	0	0	111.4	G111	G111-E113 WeakPolarHBondContact O-CG 3.43Å; G111-E113 PolarHBondContact O-N 3.49Å
114	E	89.1	Confident	93.2	Very high	124 Å²	124	67.6 Å²	67.6	58%	0.579	35%	0.349	S	S	*	.	S	Bend	trans	-103	122.9	-175.3	-173.7	143.7	-150.2	0	0	112.4	Y57 S117	Y57-E114 WeakPolarHBondContact CD1-O 3.45Å; E114-S117 PolarHBondContact O-OG 3.31Å
115	S	92	Very high	92.9	Very high	41 Å²	41	65 Å²	65	29%	0.287	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	151.6	172.9	51.9	0	0	0	0	109.9	Y57 S117	Y57-S115 CarbonylContact O-C 3.54Å; Y57-S115 WeakPolarHBondContact O-CA 3.37Å; S115-S117 VanDerWaalsContact C-N 3.35Å
116	D	93	Very high	92.8	Very high	94 Å²	94	64.1 Å²	64.1	50%	0.503	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	10	-171.2	-145.6	23.2	0	0	0	114.9	Y56 Y57	Y56-D116 PolarHBondContact OH-OD1 3.34Å; Y57-D116 PolarHBondContact O-N 3.45Å
117	S	94.9	Very high	92.7	Very high	11 Å²	11	65 Å²	65	8%	0.077	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	157.4	176.1	-41.8	0	0	0	0	113.3	Y57 E114 S115	Y57-S117 PolarHBondContact N-O 3.1Å; E114-S117 PolarHBondContact O-OG 3.31Å; S115-S117 VanDerWaalsContact C-N 3.35Å
118	I	97.8	Very high	92.7	Very high	6 Å²	6	68.2 Å²	68.2	3%	0.031	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.4	175.2	-64.7	176.1	0	0	0	109.7	V54 V55 Y56 L78 Y129 L133 L138	V54-I118 HydrophobicContact CG1-CG2 3.7Å; V55-I118 WeakPolarHBondContact O-CA 3.16Å; Y56-I118 HydrophobicContact CD2-CD1 4.36Å; Y56-I118 HydrophobicContact CD2-CG1 3.63Å; Y56-I118 HydrophobicContact CG-CG1 4.16Å; L78-I118 HydrophobicContact CD2-CD1 4.44Å; I118-Y129 HydrophobicContact CB-CD1 4.07Å; I118-Y129 HydrophobicContact CD1-CD1 4.06Å; I118-Y129 HydrophobicContact CD1-CE1 4.45Å; I118-Y129 HydrophobicContact CG2-CD1 4.47Å; I118-Y129 PolarHBondContact O-N 3.33Å; I118-L133 HydrophobicContact CD1-CD1 3.54Å; I118-L133 HydrophobicContact CD1-CD2 4.29Å; I118-L133 HydrophobicContact CD1-CG 4.4Å; I118-L138 HydrophobicContact CD1-CD1 4.37Å; I118-L138 HydrophobicContact CD1-CD2 4.24Å; I118-L138 HydrophobicContact CG2-CD1 4.24Å
119	F	97.3	Very high	92.7	Very high	13 Å²	13	59.9 Å²	59.9	6%	0.057	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.6	179.5	-60.4	-89	0	0	0	110.4	V54 V55 Y57 L112 F121 V126 V127 E128	V54-F119 CarbonylContact C-O 3.59Å; V55-F119 PolarHBondContact N-O 3.38Å; V55-F119 PolarHBondContact O-N 2.84Å; Y57-F119 HydrophobicContact CD1-CE2 4.41Å; L112-F119 HydrophobicContact CB-CE2 4.11Å; L112-F119 HydrophobicContact CB-CZ 4.46Å; L112-F119 HydrophobicContact CD1-CD2 4.45Å; L112-F119 HydrophobicContact CD2-CB 4.11Å; L112-F119 HydrophobicContact CD2-CD1 4.01Å; L112-F119 HydrophobicContact CD2-CD2 3.51Å; L112-F119 HydrophobicContact CD2-CE1 4.34Å; L112-F119 HydrophobicContact CD2-CE2 3.87Å; L112-F119 HydrophobicContact CD2-CG 3.58Å; L112-F119 HydrophobicContact CD2-CZ 4.28Å; L112-F119 HydrophobicContact CG-CD2 4.35Å; L112-F119 HydrophobicContact CG-CE2 4.42Å; F119-F121 HydrophobicContact CB-CD2 4.39Å; F119-F121 HydrophobicContact CB-CE2 3.71Å; F119-F121 HydrophobicContact CB-CZ 4.24Å; F119-V126 HydrophobicContact CB-CG1 4.28Å; F119-V126 HydrophobicContact CD1-CG1 4.32Å; F119-V127 CarbonylContact C-O 3.53Å; F119-V127 WeakPolarHBondContact CA-O 3.06Å; F119-E128 HydrophobicContact CD1-CB 4.32Å; F119-E128 HydrophobicContact CD1-CG 4.37Å; F119-E128 HydrophobicContact CE1-CB 4.24Å; F119-E128 HydrophobicContact CE1-CG 3.94Å; F119-E128 WeakPolarHBondContact CE1-OE1 3.46Å; F119-E128 HydrophobicContact CZ-CG 4.48Å; F119-E128 WeakPolarHBondContact CZ-OE1 3.49Å
120	I	97.4	Very high	92.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	108.2	179.3	-54.5	171	0	0	0	107.9	V52 V54 T122 V126 V127 F141 I142 V145	V52-I120 HydrophobicContact CG1-CG2 3.6Å; V54-I120 HydrophobicContact CG1-CG1 4.38Å; V54-I120 HydrophobicContact CG2-CG1 4.4Å; V54-I120 HydrophobicContact CG2-CG2 4.48Å; I120-T122 HydrophobicContact CG2-CG2 4.49Å; I120-V126 WeakPolarHBondContact O-CA 3.42Å; I120-V127 HydrophobicContact CB-CB 4.42Å; I120-V127 PolarHBondContact N-O 3.12Å; I120-V127 PolarHBondContact O-N 3.31Å; I120-F141 HydrophobicContact CD1-CD1 3.62Å; I120-F141 HydrophobicContact CD1-CE1 3.66Å; I120-I142 HydrophobicContact CD1-CG1 3.87Å; I120-V145 HydrophobicContact CD1-CG2 4.02Å; I120-V145 HydrophobicContact CG2-CG1 4.08Å
121	F	96.8	Very high	92.6	Very high	24 Å²	24	55.1 Å²	55.1	11%	0.105	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	118.3	177.5	-64.9	-96.6	0	0	0	109.3	M47 V52 M53 V55 L110 L112 F119 V126	M47-F121 HydrophobicContact CE-CB 4.23Å; M47-F121 HydrophobicContact CE-CD1 3.83Å; M47-F121 HydrophobicContact CE-CD2 3.98Å; M47-F121 HydrophobicContact CE-CE1 4.21Å; M47-F121 HydrophobicContact CE-CE2 4.34Å; M47-F121 HydrophobicContact CE-CG 3.73Å; M47-F121 HydrophobicContact CE-CZ 4.45Å; V52-F121 CarbonylContact C-O 3.58Å; V52-F121 WeakPolarHBondContact CA-O 3.42Å; M53-F121 HydrophobicContact CB-CB 4.25Å; M53-F121 PolarHBondContact N-O 3.4Å; M53-F121 WeakPolarHBondContact O-CD2 3.38Å; M53-F121 PolarHBondContact O-N 3.23Å; V55-F121 HydrophobicContact CB-CD2 4.35Å; V55-F121 HydrophobicContact CB-CE2 3.99Å; V55-F121 HydrophobicContact CG2-CD2 3.82Å; V55-F121 HydrophobicContact CG2-CE2 3.81Å; L110-F121 HydrophobicContact CB-CE1 4.32Å; L110-F121 HydrophobicContact CB-CZ 3.97Å; L110-F121 HydrophobicContact CD1-CZ 4.36Å; L110-F121 HydrophobicContact CD2-CE1 4.46Å; L112-F121 HydrophobicContact CD2-CE2 4.33Å; L112-F121 HydrophobicContact CD2-CZ 3.81Å; F119-F121 HydrophobicContact CB-CD2 4.39Å; F119-F121 HydrophobicContact CB-CE2 3.71Å; F119-F121 HydrophobicContact CB-CZ 4.24Å; F121-V126 HydrophobicContact CD1-CB 4.44Å; F121-V126 HydrophobicContact CD1-CG1 4.12Å; F121-V126 HydrophobicContact CD1-CG2 3.51Å; F121-V126 HydrophobicContact CE1-CB 4.47Å; F121-V126 HydrophobicContact CE1-CG1 3.89Å; F121-V126 HydrophobicContact CE1-CG2 3.66Å; F121-V126 HydrophobicContact CG-CG2 4.38Å; F121-V126 HydrophobicContact CZ-CG1 4.08Å
122	T	92.8	Very high	92.6	Very high	41 Å²	41	54.9 Å²	54.9	25%	0.252	29%	0.285	S	S	.	.			trans	-105.7	-178.4	167.4	70.8	0	0	0	0	109.8	V52 I120 D124 E125 V145	V52-T122 HydrophobicContact CG1-CG2 4.39Å; V52-T122 HydrophobicContact CG2-CG2 4.16Å; I120-T122 HydrophobicContact CG2-CG2 4.49Å; T122-D124 PolarHBondContact O-N 3.48Å; T122-D124 PolarHBondContact OG1-N 2.82Å; T122-E125 PolarHBondContact N-O 2.93Å; T122-E125 PolarHBondContact OG1-N 2.77Å; T122-E125 PolarHBondContact OG1-O 3.05Å; T122-V145 HydrophobicContact CG2-CG1 3.83Å
123	D	83.9	Confident	92.7	Very high	146 Å²	146	56.1 Å²	56.1	78%	0.781	29%	0.292	S	S	*	.	S	Bend	trans	-67.2	-27.5	174.8	-98.5	-11.8	0	0	0	112.3
124	D	76.6	Confident	93	Very high	121 Å²	121	51.4 Å²	51.4	65%	0.647	27%	0.27	S	S	*	.	S	Bend	trans	-102.3	-42	-170.6	-59.8	-52.7	0	0	0	111.8	T122	T122-D124 PolarHBondContact O-N 3.48Å; T122-D124 PolarHBondContact OG1-N 2.82Å
125	E	88.3	Confident	93.3	Very high	75 Å²	75	46.2 Å²	46.2	35%	0.35	25%	0.248	S	C	.	.			trans	-142.8	169.6	-171.2	-75.7	-57.1	151	0	0	114.4	T122	T122-E125 PolarHBondContact N-O 2.93Å; T122-E125 PolarHBondContact OG1-N 2.77Å; T122-E125 PolarHBondContact OG1-O 3.05Å
126	V	93.7	Very high	93.4	Very high	72 Å²	72	50.3 Å²	50.3	44%	0.436	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	111.9	168.9	-175.7	0	0	0	0	108.3	F119 I120 F121	F119-V126 HydrophobicContact CB-CG1 4.28Å; F119-V126 HydrophobicContact CD1-CG1 4.32Å; I120-V126 WeakPolarHBondContact O-CA 3.42Å; F121-V126 HydrophobicContact CD1-CB 4.44Å; F121-V126 HydrophobicContact CD1-CG1 4.12Å; F121-V126 HydrophobicContact CD1-CG2 3.51Å; F121-V126 HydrophobicContact CE1-CB 4.47Å; F121-V126 HydrophobicContact CE1-CG1 3.89Å; F121-V126 HydrophobicContact CE1-CG2 3.66Å; F121-V126 HydrophobicContact CG-CG2 4.38Å; F121-V126 HydrophobicContact CZ-CG1 4.08Å
127	V	94.7	Very high	93.6	Very high	17 Å²	17	46.2 Å²	46.2	10%	0.103	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.2	178.8	-176.6	0	0	0	0	108.9	F119 I120 F141 V145	F119-V127 CarbonylContact C-O 3.53Å; F119-V127 WeakPolarHBondContact CA-O 3.06Å; I120-V127 HydrophobicContact CB-CB 4.42Å; I120-V127 PolarHBondContact N-O 3.12Å; I120-V127 PolarHBondContact O-N 3.31Å; V127-F141 HydrophobicContact CG1-CE1 3.96Å; V127-F141 HydrophobicContact CG1-CZ 3.93Å; V127-V145 HydrophobicContact CG1-CG2 4.45Å
128	E	94.7	Very high	93.7	Very high	71 Å²	71	45.7 Å²	45.7	33%	0.332	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	134.7	170.5	-174	157.8	-151.8	0	0	109.2	F119	F119-E128 HydrophobicContact CD1-CB 4.32Å; F119-E128 HydrophobicContact CD1-CG 4.37Å; F119-E128 HydrophobicContact CE1-CB 4.24Å; F119-E128 HydrophobicContact CE1-CG 3.94Å; F119-E128 WeakPolarHBondContact CE1-OE1 3.46Å; F119-E128 HydrophobicContact CZ-CG 4.48Å; F119-E128 WeakPolarHBondContact CZ-OE1 3.49Å
129	Y	96	Very high	93.6	Very high	5 Å²	5	46 Å²	46	2%	0.02	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.6	178.1	171.4	-99.1	0	0	0	109.3	I118 G131 E132 T137 L138 F141	I118-Y129 HydrophobicContact CB-CD1 4.07Å; I118-Y129 HydrophobicContact CD1-CD1 4.06Å; I118-Y129 HydrophobicContact CD1-CE1 4.45Å; I118-Y129 HydrophobicContact CG2-CD1 4.47Å; I118-Y129 PolarHBondContact O-N 3.33Å; Y129-G131 WeakPolarHBondContact CE1-O 2.98Å; Y129-G131 VanDerWaalsContact CZ-CA 3.49Å; Y129-E132 WeakPolarHBondContact CE1-O 3.46Å; Y129-E132 PolarHBondContact OH-N 2.79Å; Y129-E132 PolarHBondContact OH-O 2.96Å; Y129-T137 VanDerWaalsContact OH-CG2 3.25Å; Y129-T137 WeakPolarHBondContact OH-CG2 3.49Å; Y129-L138 HydrophobicContact CD1-CD1 3.97Å; Y129-L138 HydrophobicContact CE1-CD1 4.07Å; Y129-L138 HydrophobicContact CG-CD1 4.21Å; Y129-F141 HydrophobicContact CD2-CB 3.99Å; Y129-F141 AromaticContact CD2-CD1 3.37Å; Y129-F141 HydrophobicContact CD2-CD1 3.37Å; Y129-F141 AromaticContact CD2-CD2 3.89Å; Y129-F141 HydrophobicContact CD2-CD2 3.89Å; Y129-F141 AromaticContact CD2-CE1 3.68Å; Y129-F141 HydrophobicContact CD2-CE1 3.68Å; Y129-F141 HydrophobicContact CD2-CE2 4.16Å; Y129-F141 AromaticContact CD2-CG 3.46Å; Y129-F141 HydrophobicContact CD2-CG 3.46Å; Y129-F141 VanDerWaalsContact CD2-CG 3.46Å; Y129-F141 HydrophobicContact CD2-CZ 4.06Å; Y129-F141 HydrophobicContact CE2-CB 3.76Å; Y129-F141 HydrophobicContact CE2-CD1 4.06Å; Y129-F141 HydrophobicContact CE2-CD2 4.07Å; Y129-F141 AromaticContact CE2-CG 3.7Å; Y129-F141 HydrophobicContact CE2-CG 3.7Å; Y129-F141 HydrophobicContact CG-CD1 4.17Å; Y129-F141 HydrophobicContact CG-CE1 4.31Å
130	D	93.4	Very high	93.6	Very high	47 Å²	47	51.6 Å²	51.6	25%	0.251	27%	0.266	S	S	.	.			trans	-112.3	45.9	-178.3	-68.9	-28.4	0	0	0	111	N260 V261 Y262 E263	D130-N260 CarbonylContact O-C 3.59Å; D130-V261 PolarHBondContact O-N 3.08Å; D130-Y262 WeakPolarHBondContact O-CB 3.42Å; D130-Y262 PolarHBondContact O-N 3.16Å; D130-E263 HydrophobicContact CB-CB 3.98Å; D130-E263 PolarHBondContact O-N 2.95Å
131	G	95.3	Very high	93.6	Very high	6 Å²	6	52.1 Å²	52.1	6%	0.062	27%	0.268	C	S	.	.	S	Bend	trans	-115.5	179.9	174.7	0	0	0	0	0	113	Y129 L133 P258 S259 Y262	Y129-G131 WeakPolarHBondContact CE1-O 2.98Å; Y129-G131 VanDerWaalsContact CZ-CA 3.49Å; G131-L133 PolarHBondContact O-N 2.85Å; G131-P258 CarbonylContact C-O 3.6Å; G131-P258 VanDerWaalsContact CA-O 3.27Å; G131-P258 WeakPolarHBondContact CA-O 3.41Å; G131-S259 WeakPolarHBondContact CA-O 3.16Å; G131-Y262 WeakPolarHBondContact O-CE2 3.49Å
132	E	95.5	Very high	93.6	Very high	43 Å²	43	51 Å²	51	20%	0.201	26%	0.263	C	S	.	.			trans	-59.3	136.1	176.8	-65.7	-170.9	162.1	0	0	111.6	Y129 E134 P258 V261 F315	Y129-E132 WeakPolarHBondContact CE1-O 3.46Å; Y129-E132 PolarHBondContact OH-N 2.79Å; Y129-E132 PolarHBondContact OH-O 2.96Å; E132-E134 PolarHBondContact O-N 2.99Å; E132-P258 HydrophobicContact CG-CB 4.36Å; E132-P258 PolarHBondContact N-O 3.45Å; E132-V261 HydrophobicContact CG-CG1 3.9Å; E132-F315 WeakPolarHBondContact OE1-CD1 3.48Å
133	L	95.4	Very high	93.7	Very high	38 Å²	38	52.9 Å²	52.9	20%	0.199	27%	0.266	C	S	.	.			trans	-80.2	63.6	174.2	-175.7	40.8	0	0	0	111.7	Y56 E74 L78 I118 G131 L138	Y56-L133 HydrophobicContact CD1-CD2 4.38Å; Y56-L133 HydrophobicContact CD2-CD2 4.49Å; Y56-L133 HydrophobicContact CE1-CD2 4.02Å; Y56-L133 HydrophobicContact CE2-CD2 4.15Å; E74-L133 HydrophobicContact CB-CD2 3.82Å; E74-L133 HydrophobicContact CG-CD2 3.83Å; L78-L133 HydrophobicContact CD2-CD1 4.09Å; L78-L133 HydrophobicContact CG-CD1 4.31Å; I118-L133 HydrophobicContact CD1-CD1 3.54Å; I118-L133 HydrophobicContact CD1-CD2 4.29Å; I118-L133 HydrophobicContact CD1-CG 4.4Å; G131-L133 PolarHBondContact O-N 2.85Å; L133-L138 HydrophobicContact CD1-CD2 4.34Å
134	E	95.3	Very high	94.3	Very high	84 Å²	84	48.3 Å²	48.3	39%	0.393	24%	0.242	S	C	.	.			trans	-114.5	138.1	172.8	-78.4	-64.7	160.7	0	0	110.7	E132 H136 T137 L138	E132-E134 PolarHBondContact O-N 2.99Å; E134-H136 PolarHBondContact O-N 3.03Å; E134-H136 VanDerWaalsContact O-N 3.12Å; E134-T137 PolarHBondContact O-N 3.11Å; E134-L138 WeakPolarHBondContact O-CB 3.45Å; E134-L138 PolarHBondContact O-N 3.42Å
135	A	95	Very high	95.2	Very high	16 Å²	16	43 Å²	43	13%	0.132	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-31.8	-170.2	0	0	0	0	0	113.4	A77 R80 V139	A77-A135 WeakPolarHBondContact O-CB 3.48Å; R80-A135 HydrophobicContact CB-CB 3.74Å; A135-V139 WeakPolarHBondContact O-CB 3.46Å; A135-V139 WeakPolarHBondContact O-CG2 3.42Å; A135-V139 PolarHBondContact O-N 2.92Å
136	H	94	Very high	95.4	Very high	126 Å²	126	41.7 Å²	41.7	58%	0.583	21%	0.209	S	C	*	.	H	α-helix	trans	-78.2	-47.2	-178.8	66.5	-74.8	0	0	0	111.5	E134 L138 V139 E140	E134-H136 PolarHBondContact O-N 3.03Å; E134-H136 VanDerWaalsContact O-N 3.12Å; H136-L138 PolarHBondContact O-N 3.33Å; H136-V139 PolarHBondContact O-N 3.04Å; H136-E140 WeakPolarHBondContact O-CB 3.44Å; H136-E140 PolarHBondContact O-N 3.02Å
137	T	96.2	Very high	95.4	Very high	8 Å²	8	43.3 Å²	43.3	5%	0.049	21%	0.212	C	C	.	.	H	α-helix	trans	-58	-47	175.3	-43.3	0	0	0	0	111.3	Y129 E134 V139 E140 F141 P258	Y129-T137 VanDerWaalsContact OH-CG2 3.25Å; Y129-T137 WeakPolarHBondContact OH-CG2 3.49Å; E134-T137 PolarHBondContact O-N 3.11Å; T137-V139 PolarHBondContact O-N 3.49Å; T137-E140 PolarHBondContact O-N 3.02Å; T137-F141 PolarHBondContact O-N 2.98Å; T137-P258 HydrophobicContact CG2-CB 3.72Å
138	L	97.3	Very high	95.4	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-42	178.1	179.7	61.3	0	0	0	112.1	L78 A81 I118 Y129 L133 E134 H136 F141 I142	L78-L138 HydrophobicContact CD2-CD2 3.72Å; A81-L138 HydrophobicContact CB-CD2 4.22Å; I118-L138 HydrophobicContact CD1-CD1 4.37Å; I118-L138 HydrophobicContact CD1-CD2 4.24Å; I118-L138 HydrophobicContact CG2-CD1 4.24Å; Y129-L138 HydrophobicContact CD1-CD1 3.97Å; Y129-L138 HydrophobicContact CE1-CD1 4.07Å; Y129-L138 HydrophobicContact CG-CD1 4.21Å; L133-L138 HydrophobicContact CD1-CD2 4.34Å; E134-L138 WeakPolarHBondContact O-CB 3.45Å; E134-L138 PolarHBondContact O-N 3.42Å; H136-L138 PolarHBondContact O-N 3.33Å; L138-F141 PolarHBondContact O-N 3.39Å; L138-I142 HydrophobicContact CD1-CD1 4Å; L138-I142 HydrophobicContact CD1-CG1 4.33Å; L138-I142 HydrophobicContact CG-CD1 3.8Å; L138-I142 WeakPolarHBondContact O-CB 3.48Å; L138-I142 VanDerWaalsContact O-CD1 3.3Å; L138-I142 WeakPolarHBondContact O-CD1 3.26Å; L138-I142 WeakPolarHBondContact O-CG1 3.48Å; L138-I142 PolarHBondContact O-N 3.11Å
139	V	96.6	Very high	95.5	Very high	13 Å²	13	47 Å²	47	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-65.9	-40.6	177.7	165.8	0	0	0	0	111.6	A81 V84 L85 A135 H136 T137 I142 Y143	A81-V139 HydrophobicContact CB-CG2 3.77Å; V84-V139 HydrophobicContact CB-CG2 4.34Å; V84-V139 HydrophobicContact CG1-CG1 3.99Å; L85-V139 HydrophobicContact CD1-CG2 4.48Å; L85-V139 HydrophobicContact CD2-CG1 4.5Å; L85-V139 HydrophobicContact CD2-CG2 4.45Å; L85-V139 HydrophobicContact CG-CG2 4.26Å; A135-V139 WeakPolarHBondContact O-CB 3.46Å; A135-V139 WeakPolarHBondContact O-CG2 3.42Å; A135-V139 PolarHBondContact O-N 2.92Å; H136-V139 PolarHBondContact O-N 3.04Å; T137-V139 PolarHBondContact O-N 3.49Å; V139-I142 PolarHBondContact O-N 3.1Å; V139-Y143 HydrophobicContact CG1-CD2 4Å; V139-Y143 HydrophobicContact CG1-CE1 4.33Å; V139-Y143 HydrophobicContact CG1-CE2 3.41Å; V139-Y143 VanDerWaalsContact CG1-CE2 3.41Å; V139-Y143 WeakPolarHBondContact O-CD2 3.45Å; V139-Y143 PolarHBondContact O-N 2.76Å
140	E	96.4	Very high	95.6	Very high	129 Å²	129	47.4 Å²	47.4	60%	0.603	24%	0.238	S	C	*	.	H	α-helix	trans	-60.4	-48.7	174.8	-177.2	168.7	-176.2	0	0	111	H136 T137 I142 Y143 D144	H136-E140 WeakPolarHBondContact O-CB 3.44Å; H136-E140 PolarHBondContact O-N 3.02Å; T137-E140 PolarHBondContact O-N 3.02Å; E140-I142 VanDerWaalsContact C-N 3.33Å; E140-I142 PolarHBondContact O-N 3.49Å; E140-Y143 WeakPolarHBondContact O-CB 3.46Å; E140-Y143 PolarHBondContact O-N 2.99Å; E140-Y143 VanDerWaalsContact O-N 3.1Å; E140-D144 PolarHBondContact O-N 3Å
141	F	97.4	Very high	95.8	Very high	12 Å²	12	49.4 Å²	49.4	5%	0.053	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-40.5	176.2	-172.8	-95.6	0	0	0	112.7	I120 V127 Y129 T137 L138 Y143 D144 V145 P195 H196	I120-F141 HydrophobicContact CD1-CD1 3.62Å; I120-F141 HydrophobicContact CD1-CE1 3.66Å; V127-F141 HydrophobicContact CG1-CE1 3.96Å; V127-F141 HydrophobicContact CG1-CZ 3.93Å; Y129-F141 HydrophobicContact CD2-CB 3.99Å; Y129-F141 AromaticContact CD2-CD1 3.37Å; Y129-F141 HydrophobicContact CD2-CD1 3.37Å; Y129-F141 AromaticContact CD2-CD2 3.89Å; Y129-F141 HydrophobicContact CD2-CD2 3.89Å; Y129-F141 AromaticContact CD2-CE1 3.68Å; Y129-F141 HydrophobicContact CD2-CE1 3.68Å; Y129-F141 HydrophobicContact CD2-CE2 4.16Å; Y129-F141 AromaticContact CD2-CG 3.46Å; Y129-F141 HydrophobicContact CD2-CG 3.46Å; Y129-F141 VanDerWaalsContact CD2-CG 3.46Å; Y129-F141 HydrophobicContact CD2-CZ 4.06Å; Y129-F141 HydrophobicContact CE2-CB 3.76Å; Y129-F141 HydrophobicContact CE2-CD1 4.06Å; Y129-F141 HydrophobicContact CE2-CD2 4.07Å; Y129-F141 AromaticContact CE2-CG 3.7Å; Y129-F141 HydrophobicContact CE2-CG 3.7Å; Y129-F141 HydrophobicContact CG-CD1 4.17Å; Y129-F141 HydrophobicContact CG-CE1 4.31Å; T137-F141 PolarHBondContact O-N 2.98Å; L138-F141 PolarHBondContact O-N 3.39Å; F141-Y143 VanDerWaalsContact C-N 3.32Å; F141-Y143 PolarHBondContact O-N 3.44Å; F141-D144 WeakPolarHBondContact O-CB 3.5Å; F141-D144 PolarHBondContact O-N 2.94Å; F141-V145 HydrophobicContact CD1-CG2 3.99Å; F141-V145 HydrophobicContact CE1-CG2 3.75Å; F141-V145 HydrophobicContact CZ-CG2 4.4Å; F141-V145 WeakPolarHBondContact O-CG2 3.47Å; F141-V145 PolarHBondContact O-N 3.23Å; F141-P195 HydrophobicContact CD2-CG 4.23Å; F141-P195 HydrophobicContact CE1-CG 4.34Å; F141-P195 HydrophobicContact CE2-CG 3.65Å; F141-P195 HydrophobicContact CZ-CG 3.72Å; F141-H196 AromaticContact CE2-CE1 3.88Å; F141-H196 AromaticContact CE2-NE2 3.97Å; F141-H196 AromaticContact CZ-CE1 3.82Å; F141-H196 AromaticContact CZ-NE2 3.56Å
142	I	96.5	Very high	96	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64	-38	175.7	-69.2	158.9	0	0	0	111.1	V54 L85 I93 I120 L138 V139 E140 D144 V145 L146	V54-I142 HydrophobicContact CG1-CD1 4.33Å; V54-I142 HydrophobicContact CG2-CD1 3.54Å; V54-I142 HydrophobicContact CG2-CG1 4.04Å; L85-I142 HydrophobicContact CD1-CD1 3.58Å; L85-I142 HydrophobicContact CD2-CB 4.37Å; L85-I142 HydrophobicContact CD2-CD1 4.47Å; L85-I142 HydrophobicContact CD2-CG2 3.8Å; I93-I142 HydrophobicContact CD1-CG2 4.4Å; I120-I142 HydrophobicContact CD1-CG1 3.87Å; L138-I142 HydrophobicContact CD1-CD1 4Å; L138-I142 HydrophobicContact CD1-CG1 4.33Å; L138-I142 HydrophobicContact CG-CD1 3.8Å; L138-I142 WeakPolarHBondContact O-CB 3.48Å; L138-I142 VanDerWaalsContact O-CD1 3.3Å; L138-I142 WeakPolarHBondContact O-CD1 3.26Å; L138-I142 WeakPolarHBondContact O-CG1 3.48Å; L138-I142 PolarHBondContact O-N 3.11Å; V139-I142 PolarHBondContact O-N 3.1Å; E140-I142 VanDerWaalsContact C-N 3.33Å; E140-I142 PolarHBondContact O-N 3.49Å; I142-D144 VanDerWaalsContact C-N 3.32Å; I142-V145 PolarHBondContact O-N 2.94Å; I142-L146 HydrophobicContact CG2-CD1 4.03Å; I142-L146 HydrophobicContact CG2-CG 4.41Å; I142-L146 WeakPolarHBondContact O-CG 3.27Å; I142-L146 PolarHBondContact O-N 3.34Å
143	Y	95.8	Very high	96.1	Very high	81 Å²	81	50.8 Å²	50.8	32%	0.318	25%	0.252	S	S	.	.	H	α-helix	trans	-62.8	-41.8	174.3	-68.3	-30.5	0	0	0	111.8	V84 L85 F88 V139 E140 F141 V145 L146 E147	V84-Y143 WeakPolarHBondContact CG1-OH 3.13Å; L85-Y143 HydrophobicContact CD2-CE1 4.13Å; F88-Y143 HydrophobicContact CD2-CD1 4.42Å; F88-Y143 AromaticContact CD2-CE1 3.7Å; F88-Y143 HydrophobicContact CD2-CE1 3.7Å; F88-Y143 HydrophobicContact CE2-CD1 4.17Å; F88-Y143 AromaticContact CE2-CE1 3.86Å; F88-Y143 HydrophobicContact CE2-CE1 3.86Å; F88-Y143 HydrophobicContact CG-CE1 4.45Å; V139-Y143 HydrophobicContact CG1-CD2 4Å; V139-Y143 HydrophobicContact CG1-CE1 4.33Å; V139-Y143 HydrophobicContact CG1-CE2 3.41Å; V139-Y143 VanDerWaalsContact CG1-CE2 3.41Å; V139-Y143 WeakPolarHBondContact O-CD2 3.45Å; V139-Y143 PolarHBondContact O-N 2.76Å; E140-Y143 WeakPolarHBondContact O-CB 3.46Å; E140-Y143 PolarHBondContact O-N 2.99Å; E140-Y143 VanDerWaalsContact O-N 3.1Å; F141-Y143 VanDerWaalsContact C-N 3.32Å; F141-Y143 PolarHBondContact O-N 3.44Å; Y143-V145 VanDerWaalsContact C-N 3.34Å; Y143-V145 PolarHBondContact O-N 3Å; Y143-L146 HydrophobicContact CD1-CD1 4.22Å; Y143-L146 WeakPolarHBondContact O-CB 2.96Å; Y143-L146 PolarHBondContact O-N 2.76Å; Y143-L146 VanDerWaalsContact O-N 3.11Å; Y143-E147 WeakPolarHBondContact O-CG 3.45Å; Y143-E147 PolarHBondContact O-N 3.45Å
144	D	95.6	Very high	96.2	Very high	50 Å²	50	53.4 Å²	53.4	27%	0.267	27%	0.266	S	S	.	.	H	α-helix	trans	-58.8	-43.5	172.8	-91	30.2	0	0	0	111.9	E140 F141 I142 L146 E147 H194 P195 K198	E140-D144 PolarHBondContact O-N 3Å; F141-D144 WeakPolarHBondContact O-CB 3.5Å; F141-D144 PolarHBondContact O-N 2.94Å; I142-D144 VanDerWaalsContact C-N 3.32Å; D144-L146 VanDerWaalsContact C-N 3.26Å; D144-L146 PolarHBondContact O-N 2.66Å; D144-E147 PolarHBondContact O-N 2.9Å; D144-H194 PolarHBondContact O-CE1 3.31Å; D144-H194 PolarHBondContact O-NE2 3.05Å; D144-P195 HydrophobicContact CB-CB 3.82Å; D144-P195 HydrophobicContact CB-CG 4.11Å; D144-K198 IonicContact OD2-NZ 3.67Å; D144-K198 PolarHBondContact OD2-NZ 3.39Å
145	V	95.6	Very high	96.3	Very high	10 Å²	10	52.4 Å²	52.4	6%	0.061	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-34.8	174.5	173.1	0	0	0	0	112.2	I120 T122 V127 F141 I142 Y143 E147 H194 P195	I120-V145 HydrophobicContact CD1-CG2 4.02Å; I120-V145 HydrophobicContact CG2-CG1 4.08Å; T122-V145 HydrophobicContact CG2-CG1 3.83Å; V127-V145 HydrophobicContact CG1-CG2 4.45Å; F141-V145 HydrophobicContact CD1-CG2 3.99Å; F141-V145 HydrophobicContact CE1-CG2 3.75Å; F141-V145 HydrophobicContact CZ-CG2 4.4Å; F141-V145 WeakPolarHBondContact O-CG2 3.47Å; F141-V145 PolarHBondContact O-N 3.23Å; I142-V145 PolarHBondContact O-N 2.94Å; Y143-V145 VanDerWaalsContact C-N 3.34Å; Y143-V145 PolarHBondContact O-N 3Å; V145-E147 VanDerWaalsContact C-N 3.32Å; V145-H194 PolarHBondContact O-CD2 3.12Å; V145-H194 PolarHBondContact O-NE2 2.77Å; V145-P195 HydrophobicContact CG2-CG 3.82Å
146	L	93.8	Very high	96.4	Very high	46 Å²	46	55.9 Å²	55.9	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-78.5	-13.5	-178.9	-66.8	167.7	0	0	0	113.8	V52 F88 E91 I93 I142 Y143 D144	V52-L146 HydrophobicContact CG2-CD2 3.65Å; F88-L146 HydrophobicContact CD1-CD1 4.26Å; F88-L146 HydrophobicContact CE1-CD1 3.78Å; F88-L146 HydrophobicContact CZ-CD1 4.09Å; E91-L146 HydrophobicContact CB-CD2 4.44Å; E91-L146 HydrophobicContact CG-CD2 4.21Å; I93-L146 HydrophobicContact CD1-CD1 3.58Å; I142-L146 HydrophobicContact CG2-CD1 4.03Å; I142-L146 HydrophobicContact CG2-CG 4.41Å; I142-L146 WeakPolarHBondContact O-CG 3.27Å; I142-L146 PolarHBondContact O-N 3.34Å; Y143-L146 HydrophobicContact CD1-CD1 4.22Å; Y143-L146 WeakPolarHBondContact O-CB 2.96Å; Y143-L146 PolarHBondContact O-N 2.76Å; Y143-L146 VanDerWaalsContact O-N 3.11Å; D144-L146 VanDerWaalsContact C-N 3.26Å; D144-L146 PolarHBondContact O-N 2.66Å
147	E	94	Very high	96.5	Very high	107 Å²	107	59.6 Å²	59.6	50%	0.5	30%	0.296	S	S	.	.	S	Bend	trans	-71.9	159.3	174.9	-59.6	-160	150.8	0	0	111.8	Y143 D144 V145 H194	Y143-E147 WeakPolarHBondContact O-CG 3.45Å; Y143-E147 PolarHBondContact O-N 3.45Å; D144-E147 PolarHBondContact O-N 2.9Å; V145-E147 VanDerWaalsContact C-N 3.32Å; E147-H194 PolarHBondContact O-CE1 3.33Å; E147-H194 PolarHBondContact O-NE2 2.88Å; E147-H194 VanDerWaalsContact O-NE2 3.11Å
148	D	94.6	Very high	96.6	Very high	132 Å²	132	63 Å²	63	71%	0.706	31%	0.311	S	S	*	.			trans	-63.1	134.1	174.7	-77	-28.6	0	0	0	109.3	V150	D148-V150 PolarHBondContact O-N 3.28Å
149	P	95.8	Very high	96.7	Very high	33 Å²	33	63.5 Å²	63.5	21%	0.214	31%	0.314	C	S	.	.	S	Bend	trans	-65.9	-14.5	-177.4	26.8	-36.2	0	0	0	113.3	A190 E191 H194 F199	P149-A190 HydrophobicContact CB-CB 4.06Å; P149-E191 HydrophobicContact CB-CG 4.27Å; P149-E191 HydrophobicContact CG-CG 3.87Å; P149-H194 HydrophobicContact CB-CB 4.08Å; P149-F199 WeakPolarHBondContact O-CB 3.43Å
150	V	98.3	Very high	96.7	Very high	13 Å²	13	69.8 Å²	69.8	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	113.1	175	-174.1	0	0	0	0	112	D148 I152 F183 F186 A187 A190 F199 A201	D148-V150 PolarHBondContact O-N 3.28Å; V150-I152 HydrophobicContact CG1-CD1 4.44Å; V150-F183 HydrophobicContact CG1-CE2 3.99Å; V150-F183 HydrophobicContact CG1-CZ 4.46Å; V150-F186 HydrophobicContact CG1-CD1 4.29Å; V150-F186 HydrophobicContact CG1-CE1 3.9Å; V150-F186 HydrophobicContact CG2-CD1 4.32Å; V150-F186 HydrophobicContact CG2-CE1 4.32Å; V150-A187 HydrophobicContact CG2-CB 4.02Å; V150-A190 HydrophobicContact CG2-CB 3.5Å; V150-F199 WeakPolarHBondContact CA-O 3.19Å; V150-F199 HydrophobicContact CG2-CB 4.08Å; V150-A201 HydrophobicContact CG1-CB 3.72Å
151	E	98.3	Very high	96.7	Very high	89 Å²	89	65.3 Å²	65.3	42%	0.416	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	138.4	175.3	-74.3	-169.1	-108	0	0	112.9	F199 F200 A201	E151-F199 PolarHBondContact N-O 2.85Å; E151-F200 HydrophobicContact CB-CD1 3.57Å; E151-F200 HydrophobicContact CB-CE1 3.67Å; E151-F200 HydrophobicContact CB-CG 4.48Å; E151-F200 HydrophobicContact CG-CE1 4.21Å; E151-F200 CarbonylContact O-C 3.56Å; E151-F200 VanDerWaalsContact O-CA 3.28Å; E151-F200 WeakPolarHBondContact O-CA 3.39Å; E151-F200 WeakPolarHBondContact OE1-CE1 3.31Å; E151-A201 PolarHBondContact O-N 3.26Å
152	I	98.4	Very high	96.8	Very high	75 Å²	75	64.9 Å²	64.9	39%	0.385	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118	-177.6	-53.3	-56.3	0	0	0	112.4	V150 F183 A201 F203	V150-I152 HydrophobicContact CG1-CD1 4.44Å; I152-F183 HydrophobicContact CD1-CE2 4.22Å; I152-F183 HydrophobicContact CD1-CZ 4.26Å; I152-A201 CarbonylContact C-O 3.53Å; I152-A201 WeakPolarHBondContact CA-O 3.4Å; I152-A201 HydrophobicContact CD1-CB 3.92Å; I152-F203 HydrophobicContact CD1-CE2 3.79Å; I152-F203 HydrophobicContact CD1-CZ 3.95Å; I152-F203 HydrophobicContact CG1-CE2 4.34Å; I152-F203 HydrophobicContact CG2-CD2 4.21Å; I152-F203 HydrophobicContact CG2-CE2 4.14Å
153	I	98.6	Very high	96.8	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.021	35%	0.35	C	S	.	.			trans	-91.2	104.8	172.8	-50	174	0	0	0	109.9	E158 L159 F162 V172 F200 A201 T202 V207	I153-E158 HydrophobicContact CG2-CB 3.89Å; I153-L159 HydrophobicContact CG2-CB 3.96Å; I153-F162 HydrophobicContact CD1-CB 3.59Å; I153-F162 HydrophobicContact CD1-CD1 4.27Å; I153-F162 HydrophobicContact CD1-CD2 3.94Å; I153-F162 HydrophobicContact CD1-CG 3.65Å; I153-V172 HydrophobicContact CD1-CG2 4.22Å; I153-F200 HydrophobicContact CD1-CB 3.84Å; I153-F200 HydrophobicContact CD1-CD1 3.97Å; I153-F200 HydrophobicContact CD1-CG 4.12Å; I153-F200 HydrophobicContact CG1-CB 4.25Å; I153-F200 HydrophobicContact CG1-CD1 3.97Å; I153-F200 HydrophobicContact CG1-CG 4.5Å; I153-A201 PolarHBondContact N-O 3.21Å; I153-T202 VanDerWaalsContact O-CB 3.24Å; I153-T202 WeakPolarHBondContact O-CB 3.38Å; I153-T202 PolarHBondContact O-OG1 3.45Å; I153-V207 HydrophobicContact CB-CG1 4.18Å; I153-V207 HydrophobicContact CG2-CG1 3.59Å; I153-V207 HydrophobicContact CG2-CG2 4.4Å
154	D	97	Very high	96.8	Very high	92 Å²	92	69.9 Å²	69.9	49%	0.492	36%	0.362	S	S	.	.			trans	-107.5	-17.1	179.2	-167.6	37.8	0	0	0	113.4	E158 N204	D154-E158 WeakPolarHBondContact CA-OE2 3.3Å; D154-E158 PolarHBondContact N-OE2 2.87Å; D154-N204 PolarHBondContact O-ND2 2.83Å; D154-N204 PolarHBondContact OD1-ND2 2.73Å
155	N	97.3	Very high	96.9	Very high	63 Å²	63	69.6 Å²	69.6	34%	0.337	36%	0.36	S	S	.	.	S	Bend	trans	-142.8	172.6	-178.2	68.8	73.7	0	0	0	115.3	R157 E158 L159	N155-R157 PolarHBondContact O-N 3.32Å; N155-R157 VanDerWaalsContact OD1-CB 3.29Å; N155-R157 WeakPolarHBondContact OD1-CB 3.49Å; N155-R157 PolarHBondContact OD1-N 3.37Å; N155-E158 PolarHBondContact N-OE2 2.94Å; N155-E158 PolarHBondContact ND2-OE1 2.82Å; N155-E158 PolarHBondContact ND2-OE2 2.79Å; N155-E158 PolarHBondContact O-N 3.4Å; N155-E158 PolarHBondContact OD1-N 3.37Å; N155-L159 PolarHBondContact O-N 3.05Å
156	S	96.7	Very high	96.9	Very high	89 Å²	89	73.5 Å²	73.5	62%	0.622	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.2	-175.1	64.8	0	0	0	0	114.6	K160	S156-K160 WeakPolarHBondContact O-CG 3.43Å
157	R	97.3	Very high	97	Very high	204 Å²	204	73.7 Å²	73.7	77%	0.77	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-48.9	173.7	-178.6	-170.9	-64.3	-177.2	-2.1	109.3	N155 L159 K160 G161	N155-R157 PolarHBondContact O-N 3.32Å; N155-R157 VanDerWaalsContact OD1-CB 3.29Å; N155-R157 WeakPolarHBondContact OD1-CB 3.49Å; N155-R157 PolarHBondContact OD1-N 3.37Å; R157-L159 VanDerWaalsContact C-N 3.28Å; R157-L159 PolarHBondContact O-N 2.86Å; R157-K160 WeakPolarHBondContact O-CB 3.44Å; R157-K160 PolarHBondContact O-N 2.79Å; R157-K160 VanDerWaalsContact O-N 3.08Å; R157-G161 PolarHBondContact O-N 3.39Å; R157-G161 VanDerWaalsContact O-N 3.17Å
158	E	98.1	Very high	97.1	Very high	79 Å²	79	70.8 Å²	70.8	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-58.2	-42.7	174.1	-71.1	148	-159.5	0	0	110.8	I153 D154 N155 K160 G161 F162	I153-E158 HydrophobicContact CG2-CB 3.89Å; D154-E158 WeakPolarHBondContact CA-OE2 3.3Å; D154-E158 PolarHBondContact N-OE2 2.87Å; N155-E158 PolarHBondContact N-OE2 2.94Å; N155-E158 PolarHBondContact ND2-OE1 2.82Å; N155-E158 PolarHBondContact ND2-OE2 2.79Å; N155-E158 PolarHBondContact O-N 3.4Å; N155-E158 PolarHBondContact OD1-N 3.37Å; E158-K160 PolarHBondContact O-N 3.27Å; E158-G161 WeakPolarHBondContact O-CA 3.32Å; E158-G161 PolarHBondContact O-N 2.7Å; E158-F162 PolarHBondContact O-N 2.73Å
159	L	97.9	Very high	97.2	Very high	13 Å²	13	65.2 Å²	65.2	7%	0.068	34%	0.336	C	S	.	.	H	α-helix	trans	-56.5	-36.9	175.1	176	62.7	0	0	0	112.6	I153 N155 R157 F162 E163 V207 A210 L211	I153-L159 HydrophobicContact CG2-CB 3.96Å; N155-L159 PolarHBondContact O-N 3.05Å; R157-L159 VanDerWaalsContact C-N 3.28Å; R157-L159 PolarHBondContact O-N 2.86Å; L159-F162 HydrophobicContact CD1-CD1 4.2Å; L159-F162 WeakPolarHBondContact O-CB 3.21Å; L159-F162 PolarHBondContact O-N 3.37Å; L159-E163 HydrophobicContact CD1-CG 4.35Å; L159-E163 HydrophobicContact CG-CG 4.5Å; L159-E163 WeakPolarHBondContact O-CB 3.42Å; L159-E163 VanDerWaalsContact O-CG 3.26Å; L159-E163 WeakPolarHBondContact O-CG 3.37Å; L159-E163 PolarHBondContact O-N 3.24Å; L159-V207 HydrophobicContact CD1-CG1 4.43Å; L159-A210 HydrophobicContact CD2-CB 3.64Å; L159-L211 HydrophobicContact CD1-CD1 3.95Å; L159-L211 HydrophobicContact CD1-CD2 3.57Å; L159-L211 HydrophobicContact CD1-CG 3.67Å
160	K	97.3	Very high	97.3	Very high	144 Å²	144	64.3 Å²	64.3	63%	0.626	33%	0.328	S	S	*	.	H	α-helix	trans	-71.8	-31.3	176.3	-73.9	178.3	172.7	-148.2	0	113.1	S156 R157 E158 S164	S156-K160 WeakPolarHBondContact O-CG 3.43Å; R157-K160 WeakPolarHBondContact O-CB 3.44Å; R157-K160 PolarHBondContact O-N 2.79Å; R157-K160 VanDerWaalsContact O-N 3.08Å; E158-K160 PolarHBondContact O-N 3.27Å; K160-S164 PolarHBondContact O-N 3.43Å; K160-S164 VanDerWaalsContact O-N 3.15Å; K160-S164 PolarHBondContact O-OG 2.95Å
161	G	97.4	Very high	97.4	Very high	35 Å²	35	63.7 Å²	63.7	36%	0.361	32%	0.324	S	S	.	.	H	α-helix	trans	-66.4	-45.4	172.9	0	0	0	0	0	110.3	R157 E158 E163 S164	R157-G161 PolarHBondContact O-N 3.39Å; R157-G161 VanDerWaalsContact O-N 3.17Å; E158-G161 WeakPolarHBondContact O-CA 3.32Å; E158-G161 PolarHBondContact O-N 2.7Å; G161-E163 PolarHBondContact O-N 3.06Å; G161-S164 PolarHBondContact O-N 3.23Å; G161-S164 PolarHBondContact O-OG 3.24Å
162	F	97.7	Very high	97.4	Very high	3 Å²	3	59.4 Å²	59.4	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-56.5	-47.9	171.3	169.2	-97.9	0	0	0	112.2	I153 E158 L159 S164 I165 K170 V172 F200 L211 Y221	I153-F162 HydrophobicContact CD1-CB 3.59Å; I153-F162 HydrophobicContact CD1-CD1 4.27Å; I153-F162 HydrophobicContact CD1-CD2 3.94Å; I153-F162 HydrophobicContact CD1-CG 3.65Å; E158-F162 PolarHBondContact O-N 2.73Å; L159-F162 HydrophobicContact CD1-CD1 4.2Å; L159-F162 WeakPolarHBondContact O-CB 3.21Å; L159-F162 PolarHBondContact O-N 3.37Å; F162-S164 PolarHBondContact O-N 3.27Å; F162-I165 PolarHBondContact O-N 3.36Å; F162-K170 HydrophobicContact CD2-CD 4.08Å; F162-K170 HydrophobicContact CE2-CB 4.32Å; F162-K170 HydrophobicContact CE2-CD 3.6Å; F162-K170 HydrophobicContact CE2-CG 3.86Å; F162-K170 HydrophobicContact CZ-CD 4.02Å; F162-K170 HydrophobicContact CZ-CG 4.25Å; F162-K170 PolarHBondContact O-NZ 3.14Å; F162-V172 HydrophobicContact CE1-CG1 4.07Å; F162-V172 HydrophobicContact CE2-CB 3.94Å; F162-V172 HydrophobicContact CE2-CG1 4.19Å; F162-V172 HydrophobicContact CZ-CB 3.8Å; F162-V172 HydrophobicContact CZ-CG1 3.52Å; F162-F200 HydrophobicContact CD2-CB 4.17Å; F162-F200 HydrophobicContact CD2-CD1 4.05Å; F162-F200 AromaticContact CD2-CD2 3.42Å; F162-F200 HydrophobicContact CD2-CD2 3.42Å; F162-F200 VanDerWaalsContact CD2-CD2 3.42Å; F162-F200 HydrophobicContact CD2-CE1 4.34Å; F162-F200 AromaticContact CD2-CE2 3.74Å; F162-F200 HydrophobicContact CD2-CE2 3.74Å; F162-F200 AromaticContact CD2-CG 3.59Å; F162-F200 HydrophobicContact CD2-CG 3.59Å; F162-F200 HydrophobicContact CD2-CZ 4.21Å; F162-F200 HydrophobicContact CE2-CB 4.32Å; F162-F200 AromaticContact CE2-CD2 3.58Å; F162-F200 HydrophobicContact CE2-CD2 3.58Å; F162-F200 HydrophobicContact CE2-CE2 4.12Å; F162-F200 HydrophobicContact CE2-CG 4.02Å; F162-L211 HydrophobicContact CD1-CD2 4.15Å; F162-L211 HydrophobicContact CE1-CD2 3.77Å; F162-Y221 HydrophobicContact CE1-CE2 4.15Å; F162-Y221 AromaticContact CZ-CD2 3.92Å; F162-Y221 HydrophobicContact CZ-CD2 3.92Å; F162-Y221 AromaticContact CZ-CE2 3.69Å; F162-Y221 HydrophobicContact CZ-CE2 3.69Å
163	E	96.8	Very high	97.4	Very high	103 Å²	103	55.9 Å²	55.9	48%	0.481	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-25.6	179.4	-74.2	166.5	174.8	0	0	113.1	L159 G161	L159-E163 HydrophobicContact CD1-CG 4.35Å; L159-E163 HydrophobicContact CG-CG 4.5Å; L159-E163 WeakPolarHBondContact O-CB 3.42Å; L159-E163 VanDerWaalsContact O-CG 3.26Å; L159-E163 WeakPolarHBondContact O-CG 3.37Å; L159-E163 PolarHBondContact O-N 3.24Å; G161-E163 PolarHBondContact O-N 3.06Å
164	S	96.5	Very high	97.4	Very high	83 Å²	83	57.6 Å²	57.6	58%	0.58	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-8.4	-179.6	57	0	0	0	0	115.4	K160 G161 F162 E166	K160-S164 PolarHBondContact O-N 3.43Å; K160-S164 VanDerWaalsContact O-N 3.15Å; K160-S164 PolarHBondContact O-OG 2.95Å; G161-S164 PolarHBondContact O-N 3.23Å; G161-S164 PolarHBondContact O-OG 3.24Å; F162-S164 PolarHBondContact O-N 3.27Å; S164-E166 PolarHBondContact O-N 2.9Å
165	I	96.9	Very high	97.5	Very high	44 Å²	44	53.3 Å²	53.3	23%	0.226	27%	0.27	C	S	.	.			trans	-78.1	106.2	175.4	-62.2	164.3	0	0	0	107.4	F162 D168 K170 F200	F162-I165 PolarHBondContact O-N 3.36Å; I165-D168 HydrophobicContact CG2-CB 4.07Å; I165-K170 HydrophobicContact CB-CD 4.01Å; I165-K170 HydrophobicContact CG2-CD 4.1Å; I165-K170 WeakPolarHBondContact O-CE 3.41Å; I165-K170 PolarHBondContact O-NZ 2.95Å; I165-F200 HydrophobicContact CD1-CE2 4.08Å; I165-F200 HydrophobicContact CD1-CZ 3.56Å
166	E	96.1	Very high	97.5	Very high	93 Å²	93	58 Å²	58	44%	0.435	29%	0.287	S	S	.	.			trans	-106.8	-33.8	179.3	-66.9	179.1	-161.7	0	0	112	S164 D168 S223 F224 K293	S164-E166 PolarHBondContact O-N 2.9Å; E166-D168 PolarHBondContact O-N 3.04Å; E166-S223 CarbonylContact O-C 3.59Å; E166-S223 WeakPolarHBondContact O-CA 3.22Å; E166-F224 HydrophobicContact CB-CD1 4.04Å; E166-F224 HydrophobicContact CB-CE1 4.39Å; E166-F224 PolarHBondContact O-N 3.19Å; E166-K293 IonicContact OE2-NZ 3.65Å; E166-K293 PolarHBondContact OE2-NZ 3.05Å
167	E	95.5	Very high	97.5	Very high	50 Å²	50	55.5 Å²	55.5	23%	0.234	27%	0.27	C	S	.	.	S	Bend	trans	-76.7	-21.7	-169.1	-53.6	-174.3	161.8	0	0	114.4	S223 F224 K255 K257	E167-S223 VanDerWaalsContact O-CB 3.27Å; E167-S223 WeakPolarHBondContact O-CB 3.3Å; E167-F224 HydrophobicContact CB-CE1 4.26Å; E167-F224 HydrophobicContact CB-CZ 3.95Å; E167-F224 HydrophobicContact CG-CE1 3.81Å; E167-F224 HydrophobicContact CG-CZ 3.83Å; E167-K255 HydrophobicContact CG-CD 4.25Å; E167-K255 WeakPolarHBondContact OE1-CD 3.28Å; E167-K255 IonicContact OE1-NZ 3.14Å; E167-K255 PolarHBondContact OE1-NZ 3.26Å; E167-K255 VanDerWaalsContact OE2-CD 3.31Å; E167-K255 WeakPolarHBondContact OE2-CD 3.49Å; E167-K255 IonicContact OE2-NZ 3.23Å; E167-K255 PolarHBondContact OE2-NZ 2.74Å; E167-K257 VanDerWaalsContact OE2-CE 3.29Å; E167-K257 WeakPolarHBondContact OE2-CE 3.3Å; E167-K257 IonicContact OE2-NZ 3.38Å; E167-K257 PolarHBondContact OE2-NZ 2.98Å
168	D	95.8	Very high	97.4	Very high	45 Å²	45	51.6 Å²	51.6	24%	0.241	26%	0.26	C	S	.	.	S	Bend	trans	-109.6	143.8	-173.9	-57.6	-62.4	0	0	0	111.4	I165 E166 K170 K198 K257	I165-D168 HydrophobicContact CG2-CB 4.07Å; E166-D168 PolarHBondContact O-N 3.04Å; D168-K170 PolarHBondContact O-N 2.98Å; D168-K198 HydrophobicContact CB-CG 4.38Å; D168-K257 VanDerWaalsContact CG-NZ 3.27Å; D168-K257 IonicContact OD1-NZ 2.6Å; D168-K257 PolarHBondContact OD1-NZ 2.9Å; D168-K257 IonicContact OD2-NZ 2.85Å; D168-K257 PolarHBondContact OD2-NZ 2.79Å
169	I	97.9	Very high	97.2	Very high	15 Å²	15	55.9 Å²	55.9	8%	0.077	28%	0.277	C	S	.	.			trans	-59.3	131.6	165.5	-59	176.8	0	0	0	108.1	L171 I197 K198 F220 Y221 P251	I169-L171 HydrophobicContact CG2-CD1 4.48Å; I169-I197 HydrophobicContact CB-CG1 4.39Å; I169-I197 HydrophobicContact CB-CG2 4.21Å; I169-I197 HydrophobicContact CG2-CD1 4.48Å; I169-I197 HydrophobicContact CG2-CG2 3.84Å; I169-K198 PolarHBondContact O-N 2.9Å; I169-K198 VanDerWaalsContact O-N 3.11Å; I169-F220 HydrophobicContact CD1-CZ 4.43Å; I169-F220 HydrophobicContact CG2-CD2 4.22Å; I169-F220 HydrophobicContact CG2-CE1 4.32Å; I169-F220 HydrophobicContact CG2-CE2 3.35Å; I169-F220 HydrophobicContact CG2-CZ 3.4Å; I169-Y221 WeakPolarHBondContact CA-O 3.44Å; I169-P251 HydrophobicContact CD1-CG 3.75Å; I169-P251 HydrophobicContact CG1-CG 3.84Å
170	K	98.4	Very high	97.2	Very high	14 Å²	14	56 Å²	56	6%	0.061	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	144.5	179.1	67.8	-170.9	-176.3	-169.2	0	112.9	F162 I165 D168 K198 F200 Y221	F162-K170 HydrophobicContact CD2-CD 4.08Å; F162-K170 HydrophobicContact CE2-CB 4.32Å; F162-K170 HydrophobicContact CE2-CD 3.6Å; F162-K170 HydrophobicContact CE2-CG 3.86Å; F162-K170 HydrophobicContact CZ-CD 4.02Å; F162-K170 HydrophobicContact CZ-CG 4.25Å; F162-K170 PolarHBondContact O-NZ 3.14Å; I165-K170 HydrophobicContact CB-CD 4.01Å; I165-K170 HydrophobicContact CG2-CD 4.1Å; I165-K170 WeakPolarHBondContact O-CE 3.41Å; I165-K170 PolarHBondContact O-NZ 2.95Å; D168-K170 PolarHBondContact O-N 2.98Å; K170-K198 CarbonylContact C-O 3.52Å; K170-K198 WeakPolarHBondContact CA-O 3.42Å; K170-K198 HydrophobicContact CB-CB 4.28Å; K170-F200 HydrophobicContact CB-CD2 4.39Å; K170-F200 HydrophobicContact CB-CE2 4.14Å; K170-Y221 HydrophobicContact CG-CD2 4.39Å; K170-Y221 HydrophobicContact CG-CG 4.24Å; K170-Y221 PolarHBondContact N-O 3.44Å; K170-Y221 WeakPolarHBondContact O-CB 3.5Å; K170-Y221 PolarHBondContact O-N 2.65Å
171	L	98.6	Very high	97.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.9	176.7	-68.4	89.8	0	0	0	110.7	I169 F186 I197 K198 F199 F200 V218 D219 F220 I231 I245	I169-L171 HydrophobicContact CG2-CD1 4.48Å; L171-F186 HydrophobicContact CB-CE2 4.24Å; L171-F186 HydrophobicContact CB-CZ 4.21Å; L171-I197 HydrophobicContact CD1-CG2 3.41Å; L171-I197 VanDerWaalsContact CD1-CG2 3.41Å; L171-K198 PolarHBondContact N-O 2.77Å; L171-F199 HydrophobicContact CB-CD1 4.37Å; L171-F199 HydrophobicContact CB-CG 4.49Å; L171-F199 HydrophobicContact CD1-CD2 4.25Å; L171-F199 HydrophobicContact CD1-CE1 4.47Å; L171-F199 HydrophobicContact CD1-CE2 3.94Å; L171-F199 HydrophobicContact CD1-CZ 4.09Å; L171-F199 HydrophobicContact CD2-CE1 4.2Å; L171-F199 HydrophobicContact CD2-CZ 4.38Å; L171-F200 WeakPolarHBondContact O-CA 3.41Å; L171-F200 WeakPolarHBondContact O-CB 3.5Å; L171-F200 PolarHBondContact O-N 3.44Å; L171-V218 HydrophobicContact CB-CG1 4.39Å; L171-V218 HydrophobicContact CD2-CG1 4.02Å; L171-D219 CarbonylContact C-O 3.59Å; L171-D219 WeakPolarHBondContact CA-O 3.46Å; L171-F220 HydrophobicContact CD1-CD2 3.97Å; L171-F220 HydrophobicContact CD1-CE2 4.31Å; L171-F220 HydrophobicContact CD2-CD2 4.08Å; L171-F220 HydrophobicContact CG-CD2 3.87Å; L171-I231 HydrophobicContact CD2-CD1 3.96Å; L171-I245 HydrophobicContact CD1-CD1 4.16Å; L171-I245 HydrophobicContact CD1-CG1 4.44Å; L171-I245 HydrophobicContact CD2-CD1 3.73Å; L171-I245 HydrophobicContact CD2-CG1 3.99Å
172	V	98.7	Very high	97.2	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	123.4	170.8	61.6	0	0	0	0	112.8	I153 F162 F200 L211 L213 V218 D219 Y221	I153-V172 HydrophobicContact CD1-CG2 4.22Å; F162-V172 HydrophobicContact CE1-CG1 4.07Å; F162-V172 HydrophobicContact CE2-CB 3.94Å; F162-V172 HydrophobicContact CE2-CG1 4.19Å; F162-V172 HydrophobicContact CZ-CB 3.8Å; F162-V172 HydrophobicContact CZ-CG1 3.52Å; V172-F200 VanDerWaalsContact CA-O 3.28Å; V172-F200 WeakPolarHBondContact CA-O 3.3Å; V172-F200 HydrophobicContact CB-CB 4.1Å; V172-F200 HydrophobicContact CG2-CB 4.03Å; V172-L211 HydrophobicContact CG1-CD1 4.19Å; V172-L211 HydrophobicContact CG2-CD1 3.73Å; V172-L213 HydrophobicContact CG1-CD1 4.18Å; V172-L213 HydrophobicContact CG2-CD1 4.14Å; V172-V218 WeakPolarHBondContact O-CA 3.36Å; V172-D219 HydrophobicContact CG1-CB 4.24Å; V172-D219 PolarHBondContact N-O 2.9Å; V172-D219 PolarHBondContact O-N 3.26Å; V172-Y221 HydrophobicContact CG1-CD2 4.47Å; V172-Y221 HydrophobicContact CG1-CE2 3.75Å
173	G	98.5	Very high	97.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	138.6	178.6	0	0	0	0	0	113.9	F200 A201 T202 E217	G173-F200 PolarHBondContact N-O 3.42Å; G173-A201 CarbonylContact O-C 3.4Å; G173-A201 WeakPolarHBondContact O-CA 3.48Å; G173-T202 PolarHBondContact O-N 3.11Å; G173-E217 WeakPolarHBondContact CA-O 3.41Å
174	Y	98.6	Very high	97.2	Very high	40 Å²	40	58 Å²	58	16%	0.157	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	111.8	169.3	171.9	-140.9	0	0	0	111.7	T202 A208 K214 L215 N216 E217	Y174-T202 HydrophobicContact CD2-CG2 3.96Å; Y174-T202 WeakPolarHBondContact CD2-O 3.37Å; Y174-T202 HydrophobicContact CG-CG2 4.36Å; Y174-A208 HydrophobicContact CD1-CB 3.43Å; Y174-A208 VanDerWaalsContact CD1-CB 3.43Å; Y174-A208 HydrophobicContact CD2-CB 3.6Å; Y174-A208 HydrophobicContact CE1-CB 3.82Å; Y174-A208 HydrophobicContact CE2-CB 3.98Å; Y174-A208 HydrophobicContact CG-CB 3.33Å; Y174-K214 VanDerWaalsContact CD1-C 3.48Å; Y174-L215 HydrophobicContact CD1-CB 4.39Å; Y174-L215 HydrophobicContact CD1-CD1 4.47Å; Y174-L215 HydrophobicContact CE1-CB 4.16Å; Y174-L215 HydrophobicContact CE1-CD1 4.14Å; Y174-L215 HydrophobicContact CE2-CD1 4.48Å; Y174-N216 WeakPolarHBondContact O-CA 3.39Å; Y174-N216 PolarHBondContact O-N 3.33Å; Y174-E217 PolarHBondContact N-O 3.29Å
175	F	98.6	Very high	97.3	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.009	26%	0.26	C	S	.	.			trans	-119.5	167.4	-178.4	-53.1	-77	0	0	0	112.7	H182 F183 F186 A201 T202 F203 V218	F175-H182 HydrophobicContact CD1-CB 3.95Å; F175-H182 HydrophobicContact CE1-CB 4.04Å; F175-H182 WeakPolarHBondContact CE1-O 3.26Å; F175-F183 HydrophobicContact CB-CB 4.01Å; F175-F183 HydrophobicContact CD1-CB 4.27Å; F175-F183 HydrophobicContact CD2-CB 4.1Å; F175-F183 AromaticContact CD2-CD2 3.65Å; F175-F183 HydrophobicContact CD2-CD2 3.65Å; F175-F183 HydrophobicContact CD2-CG 4.35Å; F175-F183 HydrophobicContact CE2-CD2 4.03Å; F175-F183 HydrophobicContact CG-CB 3.86Å; F175-F183 HydrophobicContact CG-CD2 4.27Å; F175-F186 HydrophobicContact CE1-CB 4.32Å; F175-F186 HydrophobicContact CE2-CB 4.04Å; F175-F186 AromaticContact CE2-CD1 3.67Å; F175-F186 HydrophobicContact CE2-CD1 3.67Å; F175-F186 HydrophobicContact CE2-CD2 4.38Å; F175-F186 HydrophobicContact CE2-CE1 4.18Å; F175-F186 AromaticContact CE2-CG 3.77Å; F175-F186 HydrophobicContact CE2-CG 3.77Å; F175-F186 HydrophobicContact CZ-CB 3.54Å; F175-F186 AromaticContact CZ-CD1 3.97Å; F175-F186 HydrophobicContact CZ-CD1 3.97Å; F175-F186 AromaticContact CZ-CD2 3.95Å; F175-F186 HydrophobicContact CZ-CD2 3.95Å; F175-F186 AromaticContact CZ-CG 3.55Å; F175-F186 HydrophobicContact CZ-CG 3.55Å; F175-A201 HydrophobicContact CD2-CB 4.08Å; F175-A201 HydrophobicContact CE2-CB 4.19Å; F175-T202 PolarHBondContact N-O 3.04Å; F175-F203 HydrophobicContact CB-CD1 4.04Å; F175-F203 HydrophobicContact CB-CE1 3.95Å; F175-V218 HydrophobicContact CE1-CG2 4.45Å; F175-V218 HydrophobicContact CZ-CG2 3.87Å
176	K	97.4	Very high	97.4	Very high	162 Å²	162	52.7 Å²	52.7	70%	0.704	25%	0.249	S	C	*	.	S	Bend	trans	-70.2	-36.5	-178.7	-173.4	178.1	177.1	-174.7	0	112.9	L215	K176-L215 HydrophobicContact CB-CD1 4.22Å
177	S	96.9	Very high	97.5	Very high	37 Å²	37	49 Å²	49	26%	0.259	24%	0.235	S	C	.	.			trans	-179.8	165.5	-177.2	58.9	0	0	0	0	109.6	K179 S180	S177-K179 PolarHBondContact O-N 3.35Å; S177-K179 PolarHBondContact OG-N 3.47Å; S177-S180 WeakPolarHBondContact O-CB 3.46Å; S177-S180 PolarHBondContact O-N 3.18Å
178	H	95.5	Very high	97.5	Very high	122 Å²	122	49.3 Å²	49.3	57%	0.565	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-12.6	170.3	65.5	-92.3	0	0	0	115.8	F183 F203	H178-F183 HydrophobicContact CB-CD1 4.37Å; H178-F183 HydrophobicContact CB-CE1 4.16Å; H178-F183 WeakPolarHBondContact O-CD1 3.47Å; H178-F203 HydrophobicContact CB-CE2 4.17Å; H178-F203 HydrophobicContact CB-CZ 3.98Å; H178-F203 VanDerWaalsContact N-CZ 3.32Å
179	K	95	Very high	97.5	Very high	168 Å²	168	47.1 Å²	47.1	73%	0.73	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	11.3	177.1	-50.8	-168.2	-178.6	-168	0	113.7	S177	S177-K179 PolarHBondContact O-N 3.35Å; S177-K179 PolarHBondContact OG-N 3.47Å
180	S	96.4	Very high	97.5	Very high	16 Å²	16	46.4 Å²	46.4	11%	0.112	22%	0.223	C	C	.	.			trans	-81.1	132.5	-179.3	-178.8	0	0	0	0	109	S177 H182 F183 E184	S177-S180 WeakPolarHBondContact O-CB 3.46Å; S177-S180 PolarHBondContact O-N 3.18Å; S180-H182 PolarHBondContact O-N 2.77Å; S180-H182 VanDerWaalsContact O-N 3.14Å; S180-F183 WeakPolarHBondContact O-CB 3.43Å; S180-F183 PolarHBondContact O-N 3.08Å; S180-E184 PolarHBondContact O-N 2.91Å
181	E	97.1	Very high	97.4	Very high	140 Å²	140	49.1 Å²	49.1	65%	0.654	24%	0.235	S	C	*	.	H	α-helix	trans	-56.1	-30.6	174.5	66	-172.3	177.2	0	0	112.3	A185	E181-A185 PolarHBondContact O-N 3.23Å; E181-A185 VanDerWaalsContact O-N 3.09Å
182	H	97.6	Very high	97.2	Very high	39 Å²	39	54 Å²	54	18%	0.181	26%	0.259	C	S	.	.	H	α-helix	trans	-76.7	-23.6	176.1	-50.3	-52.7	0	0	0	114.2	F175 S180 F186 N216 P235	F175-H182 HydrophobicContact CD1-CB 3.95Å; F175-H182 HydrophobicContact CE1-CB 4.04Å; F175-H182 WeakPolarHBondContact CE1-O 3.26Å; S180-H182 PolarHBondContact O-N 2.77Å; S180-H182 VanDerWaalsContact O-N 3.14Å; H182-F186 WeakPolarHBondContact O-CB 3.27Å; H182-F186 PolarHBondContact O-N 2.98Å; H182-N216 PolarHBondContact CD2-ND2 2.89Å; H182-N216 PolarHBondContact CD2-OD1 3.46Å; H182-N216 PolarHBondContact NE2-ND2 3.04Å; H182-P235 WeakPolarHBondContact CE1-CB 3.41Å; H182-P235 WeakPolarHBondContact ND1-CB 3.4Å
183	F	98.4	Very high	97	Very high	27 Å²	27	55.4 Å²	55.4	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-80.2	-40.1	173.4	171.5	-101.5	0	0	0	109.6	V150 I152 F175 H178 S180 F186 A187 A201 F203	V150-F183 HydrophobicContact CG1-CE2 3.99Å; V150-F183 HydrophobicContact CG1-CZ 4.46Å; I152-F183 HydrophobicContact CD1-CE2 4.22Å; I152-F183 HydrophobicContact CD1-CZ 4.26Å; F175-F183 HydrophobicContact CB-CB 4.01Å; F175-F183 HydrophobicContact CD1-CB 4.27Å; F175-F183 HydrophobicContact CD2-CB 4.1Å; F175-F183 AromaticContact CD2-CD2 3.65Å; F175-F183 HydrophobicContact CD2-CD2 3.65Å; F175-F183 HydrophobicContact CD2-CG 4.35Å; F175-F183 HydrophobicContact CE2-CD2 4.03Å; F175-F183 HydrophobicContact CG-CB 3.86Å; F175-F183 HydrophobicContact CG-CD2 4.27Å; H178-F183 HydrophobicContact CB-CD1 4.37Å; H178-F183 HydrophobicContact CB-CE1 4.16Å; H178-F183 WeakPolarHBondContact O-CD1 3.47Å; S180-F183 WeakPolarHBondContact O-CB 3.43Å; S180-F183 PolarHBondContact O-N 3.08Å; F183-F186 CarbonylContact O-C 3.59Å; F183-F186 WeakPolarHBondContact O-CB 3.41Å; F183-F186 PolarHBondContact O-N 2.81Å; F183-F186 VanDerWaalsContact O-N 3.07Å; F183-A187 PolarHBondContact O-N 3.12Å; F183-A201 HydrophobicContact CD2-CB 4.03Å; F183-A201 HydrophobicContact CE2-CB 3.63Å; F183-F203 HydrophobicContact CD1-CZ 4.38Å; F183-F203 AromaticContact CD2-CE1 3.84Å; F183-F203 HydrophobicContact CD2-CE1 3.84Å; F183-F203 AromaticContact CD2-CZ 3.9Å; F183-F203 HydrophobicContact CD2-CZ 3.9Å; F183-F203 HydrophobicContact CE1-CZ 4.27Å; F183-F203 HydrophobicContact CE2-CE1 4.18Å; F183-F203 AromaticContact CE2-CZ 3.79Å; F183-F203 HydrophobicContact CE2-CZ 3.79Å; F183-F203 HydrophobicContact CG-CE1 4.06Å; F183-F203 HydrophobicContact CG-CZ 4.18Å; F183-F203 AromaticContact CZ-CZ 3.98Å; F183-F203 HydrophobicContact CZ-CZ 3.98Å
184	E	97.7	Very high	96.9	Very high	120 Å²	120	56.8 Å²	56.8	56%	0.561	27%	0.271	S	S	*	.	H	α-helix	trans	-54.7	-54.4	172.6	-168.9	172.7	-174.9	0	0	110.2	S180 F186 A187 D188	S180-E184 PolarHBondContact O-N 2.91Å; E184-F186 PolarHBondContact O-N 3.29Å; E184-A187 PolarHBondContact O-N 2.97Å; E184-D188 PolarHBondContact O-N 3.12Å
185	A	97.8	Very high	96.7	Very high	16 Å²	16	55.1 Å²	55.1	13%	0.132	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-21	175.9	0	0	0	0	0	115.3	E181 A189 E238	E181-A185 PolarHBondContact O-N 3.23Å; E181-A185 VanDerWaalsContact O-N 3.09Å; A185-A189 PolarHBondContact O-N 2.87Å; A185-E238 WeakPolarHBondContact O-CA 3.36Å
186	F	98.4	Very high	96.4	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-84.3	-35.1	175	176.7	-97.9	0	0	0	111.6	V150 L171 F175 H182 F183 E184 A190 F199 F200 A201 V218 L241	V150-F186 HydrophobicContact CG1-CD1 4.29Å; V150-F186 HydrophobicContact CG1-CE1 3.9Å; V150-F186 HydrophobicContact CG2-CD1 4.32Å; V150-F186 HydrophobicContact CG2-CE1 4.32Å; L171-F186 HydrophobicContact CB-CE2 4.24Å; L171-F186 HydrophobicContact CB-CZ 4.21Å; F175-F186 HydrophobicContact CE1-CB 4.32Å; F175-F186 HydrophobicContact CE2-CB 4.04Å; F175-F186 AromaticContact CE2-CD1 3.67Å; F175-F186 HydrophobicContact CE2-CD1 3.67Å; F175-F186 HydrophobicContact CE2-CD2 4.38Å; F175-F186 HydrophobicContact CE2-CE1 4.18Å; F175-F186 AromaticContact CE2-CG 3.77Å; F175-F186 HydrophobicContact CE2-CG 3.77Å; F175-F186 HydrophobicContact CZ-CB 3.54Å; F175-F186 AromaticContact CZ-CD1 3.97Å; F175-F186 HydrophobicContact CZ-CD1 3.97Å; F175-F186 AromaticContact CZ-CD2 3.95Å; F175-F186 HydrophobicContact CZ-CD2 3.95Å; F175-F186 AromaticContact CZ-CG 3.55Å; F175-F186 HydrophobicContact CZ-CG 3.55Å; H182-F186 WeakPolarHBondContact O-CB 3.27Å; H182-F186 PolarHBondContact O-N 2.98Å; F183-F186 CarbonylContact O-C 3.59Å; F183-F186 WeakPolarHBondContact O-CB 3.41Å; F183-F186 PolarHBondContact O-N 2.81Å; F183-F186 VanDerWaalsContact O-N 3.07Å; E184-F186 PolarHBondContact O-N 3.29Å; F186-A190 PolarHBondContact O-N 2.87Å; F186-A190 VanDerWaalsContact O-N 3.11Å; F186-F199 HydrophobicContact CD1-CD1 4.35Å; F186-F199 HydrophobicContact CD2-CD1 4.18Å; F186-F199 HydrophobicContact CD2-CE1 4.38Å; F186-F199 HydrophobicContact CE1-CB 4.14Å; F186-F199 AromaticContact CE1-CD1 3.8Å; F186-F199 HydrophobicContact CE1-CD1 3.8Å; F186-F199 HydrophobicContact CE1-CG 4.47Å; F186-F199 AromaticContact CE2-CD1 3.58Å; F186-F199 HydrophobicContact CE2-CD1 3.58Å; F186-F199 AromaticContact CE2-CE1 3.98Å; F186-F199 HydrophobicContact CE2-CE1 3.98Å; F186-F199 HydrophobicContact CZ-CB 4.12Å; F186-F199 AromaticContact CZ-CD1 3.39Å; F186-F199 HydrophobicContact CZ-CD1 3.39Å; F186-F199 HydrophobicContact CZ-CE1 4.25Å; F186-F199 HydrophobicContact CZ-CG 4.14Å; F186-F200 VanDerWaalsContact CE1-O 3.32Å; F186-F200 WeakPolarHBondContact CE1-O 3.19Å; F186-F200 WeakPolarHBondContact CZ-O 3.37Å; F186-A201 HydrophobicContact CE1-CB 4.36Å; F186-V218 HydrophobicContact CD2-CG1 4.24Å; F186-V218 HydrophobicContact CD2-CG2 3.81Å; F186-V218 HydrophobicContact CE2-CB 4.48Å; F186-V218 HydrophobicContact CE2-CG1 3.63Å; F186-V218 HydrophobicContact CE2-CG2 3.92Å; F186-L241 HydrophobicContact CB-CD1 4.15Å; F186-L241 HydrophobicContact CD2-CD1 3.95Å
187	A	97.6	Very high	96.4	Very high	17 Å²	17	50.8 Å²	50.8	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-70.9	-43.4	173.4	0	0	0	0	0	111.3	V150 F183 E184 A189 A190 E191	V150-A187 HydrophobicContact CG2-CB 4.02Å; F183-A187 PolarHBondContact O-N 3.12Å; E184-A187 PolarHBondContact O-N 2.97Å; A187-A189 PolarHBondContact O-N 3.13Å; A187-A190 WeakPolarHBondContact O-CA 3.07Å; A187-A190 VanDerWaalsContact O-CB 3.31Å; A187-A190 WeakPolarHBondContact O-CB 3.21Å; A187-A190 PolarHBondContact O-N 3.38Å; A187-E191 PolarHBondContact O-N 2.9Å; A187-E191 VanDerWaalsContact O-N 3.1Å
188	D	96.1	Very high	96.4	Very high	55 Å²	55	50.9 Å²	50.9	29%	0.294	24%	0.243	S	C	.	.	H	α-helix	trans	-57.2	-38.1	173.7	-57.8	-16.9	0	0	0	110.6	E184 A190 E238	E184-D188 PolarHBondContact O-N 3.12Å; D188-A190 VanDerWaalsContact C-N 3.35Å; D188-E238 HydrophobicContact CB-CB 4.41Å; D188-E238 HydrophobicContact CB-CG 3.95Å
189	A	97.1	Very high	96.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-73.8	-24.7	175.3	0	0	0	0	0	113.4	A185 A187 F193 F199 E238 L241 V242	A185-A189 PolarHBondContact O-N 2.87Å; A187-A189 PolarHBondContact O-N 3.13Å; A189-F193 WeakPolarHBondContact O-CD2 3.39Å; A189-F199 HydrophobicContact CB-CE1 4.49Å; A189-E238 HydrophobicContact CB-CG 4.3Å; A189-L241 HydrophobicContact CB-CB 3.81Å; A189-L241 HydrophobicContact CB-CD1 3.98Å; A189-V242 HydrophobicContact CB-CG2 4.04Å
190	A	97.4	Very high	96.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-73.6	-36.8	178	0	0	0	0	0	111.4	P149 V150 F186 A187 D188 E192 F193 H194 F199	P149-A190 HydrophobicContact CB-CB 4.06Å; V150-A190 HydrophobicContact CG2-CB 3.5Å; F186-A190 PolarHBondContact O-N 2.87Å; F186-A190 VanDerWaalsContact O-N 3.11Å; A187-A190 WeakPolarHBondContact O-CA 3.07Å; A187-A190 VanDerWaalsContact O-CB 3.31Å; A187-A190 WeakPolarHBondContact O-CB 3.21Å; A187-A190 PolarHBondContact O-N 3.38Å; D188-A190 VanDerWaalsContact C-N 3.35Å; A190-E192 PolarHBondContact O-N 2.82Å; A190-F193 PolarHBondContact O-N 2.93Å; A190-F193 VanDerWaalsContact O-N 3.13Å; A190-H194 WeakPolarHBondContact O-CB 3.28Å; A190-H194 PolarHBondContact O-N 2.86Å; A190-F199 HydrophobicContact CB-CB 3.76Å; A190-F199 HydrophobicContact CB-CD1 3.46Å; A190-F199 VanDerWaalsContact CB-CD1 3.46Å; A190-F199 HydrophobicContact CB-CD2 3.88Å; A190-F199 HydrophobicContact CB-CE1 3.89Å; A190-F199 HydrophobicContact CB-CE2 4.27Å; A190-F199 HydrophobicContact CB-CG 3.45Å; A190-F199 VanDerWaalsContact CB-CG 3.45Å; A190-F199 HydrophobicContact CB-CZ 4.26Å
191	E	95.3	Very high	96.9	Very high	70 Å²	70	36.9 Å²	36.9	33%	0.327	18%	0.179	S	C	.	.	H	α-helix	trans	-56.3	-36	176.5	-71.3	170.4	-171.7	0	0	112	P149 A187 F193	P149-E191 HydrophobicContact CB-CG 4.27Å; P149-E191 HydrophobicContact CG-CG 3.87Å; A187-E191 PolarHBondContact O-N 2.9Å; A187-E191 VanDerWaalsContact O-N 3.1Å; E191-F193 VanDerWaalsContact C-N 3.3Å; E191-F193 PolarHBondContact O-N 3.38Å
192	E	94.7	Very high	96.9	Very high	104 Å²	104	30.2 Å²	30.2	49%	0.486	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.9	179.4	-61.6	-82.7	176	0	0	114.1	A190 V242	A190-E192 PolarHBondContact O-N 2.82Å; E192-V242 HydrophobicContact CB-CG2 4.35Å; E192-V242 HydrophobicContact CG-CG2 4.12Å
193	F	95.2	Very high	97	Very high	28 Å²	28	30.8 Å²	30.8	12%	0.123	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	5.5	-179.7	-55.7	-82	0	0	0	113.2	A189 A190 E191 P195 H196 I197 F199 V242 I245 E246	A189-F193 WeakPolarHBondContact O-CD2 3.39Å; A190-F193 PolarHBondContact O-N 2.93Å; A190-F193 VanDerWaalsContact O-N 3.13Å; E191-F193 VanDerWaalsContact C-N 3.3Å; E191-F193 PolarHBondContact O-N 3.38Å; F193-P195 CarbonylContact O-C 3.52Å; F193-H196 PolarHBondContact O-N 2.8Å; F193-I197 HydrophobicContact CB-CB 3.85Å; F193-I197 HydrophobicContact CB-CD1 4.13Å; F193-I197 HydrophobicContact CB-CG1 4.15Å; F193-I197 HydrophobicContact CD1-CD1 3.81Å; F193-I197 HydrophobicContact CE1-CD1 4.48Å; F193-I197 HydrophobicContact CG-CD1 4.06Å; F193-I197 PolarHBondContact O-N 3.35Å; F193-F199 HydrophobicContact CB-CE2 4.16Å; F193-F199 HydrophobicContact CD2-CE2 4.09Å; F193-F199 AromaticContact CD2-CZ 3.87Å; F193-F199 HydrophobicContact CD2-CZ 3.87Å; F193-V242 HydrophobicContact CE2-CB 4.21Å; F193-V242 HydrophobicContact CE2-CG1 4.27Å; F193-V242 HydrophobicContact CE2-CG2 3.99Å; F193-V242 HydrophobicContact CZ-CB 4.25Å; F193-V242 HydrophobicContact CZ-CG1 3.91Å; F193-V242 HydrophobicContact CZ-CG2 4.46Å; F193-I245 HydrophobicContact CD1-CG2 3.94Å; F193-I245 HydrophobicContact CD2-CD1 3.93Å; F193-I245 HydrophobicContact CD2-CG2 4.23Å; F193-I245 HydrophobicContact CE1-CB 4.14Å; F193-I245 HydrophobicContact CE1-CG2 3.55Å; F193-I245 HydrophobicContact CE2-CB 3.9Å; F193-I245 HydrophobicContact CE2-CD1 3.58Å; F193-I245 HydrophobicContact CE2-CG1 4.36Å; F193-I245 HydrophobicContact CE2-CG2 3.9Å; F193-I245 HydrophobicContact CG-CG2 4.26Å; F193-I245 HydrophobicContact CZ-CB 3.62Å; F193-I245 HydrophobicContact CZ-CD1 4.22Å; F193-I245 HydrophobicContact CZ-CG2 3.54Å; F193-E246 HydrophobicContact CE1-CG 4.3Å; F193-E246 HydrophobicContact CZ-CG 4.2Å
194	H	95.3	Very high	97	Very high	30 Å²	30	31.2 Å²	31.2	14%	0.139	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	131.3	-178.5	-174.3	66.5	0	0	0	110	D144 V145 E147 P149 A190	D144-H194 PolarHBondContact O-CE1 3.31Å; D144-H194 PolarHBondContact O-NE2 3.05Å; V145-H194 PolarHBondContact O-CD2 3.12Å; V145-H194 PolarHBondContact O-NE2 2.77Å; E147-H194 PolarHBondContact O-CE1 3.33Å; E147-H194 PolarHBondContact O-NE2 2.88Å; E147-H194 VanDerWaalsContact O-NE2 3.11Å; P149-H194 HydrophobicContact CB-CB 4.08Å; A190-H194 WeakPolarHBondContact O-CB 3.28Å; A190-H194 PolarHBondContact O-N 2.86Å
195	P	94.6	Very high	97	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.026	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	cis	-102.7	8.8	4.5	39.7	-35.9	0	0	0	115	F141 D144 V145 F193 I197 K198	F141-P195 HydrophobicContact CD2-CG 4.23Å; F141-P195 HydrophobicContact CE1-CG 4.34Å; F141-P195 HydrophobicContact CE2-CG 3.65Å; F141-P195 HydrophobicContact CZ-CG 3.72Å; D144-P195 HydrophobicContact CB-CB 3.82Å; D144-P195 HydrophobicContact CB-CG 4.11Å; V145-P195 HydrophobicContact CG2-CG 3.82Å; F193-P195 CarbonylContact O-C 3.52Å; P195-I197 PolarHBondContact O-N 2.99Å; P195-K198 PolarHBondContact O-NZ 2.8Å
196	H	93.1	Very high	97	Very high	60 Å²	60	36.9 Å²	36.9	28%	0.278	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-38.6	-172.9	-59.2	-98.8	0	0	0	112.7	F141 F193 E263	F141-H196 AromaticContact CE2-CE1 3.88Å; F141-H196 AromaticContact CE2-NE2 3.97Å; F141-H196 AromaticContact CZ-CE1 3.82Å; F141-H196 AromaticContact CZ-NE2 3.56Å; F193-H196 PolarHBondContact O-N 2.8Å; H196-E263 IonicContact CE1-OE2 2.8Å; H196-E263 PolarHBondContact CE1-OE2 3.45Å; H196-E263 IonicContact ND1-OE1 3.26Å; H196-E263 IonicContact ND1-OE2 3.5Å; H196-E263 PolarHBondContact ND1-OE2 3.38Å
197	I	96.7	Very high	97	Very high	13 Å²	13	37.2 Å²	37.2	7%	0.067	18%	0.183	C	C	.	.	S	Bend	trans	-113.5	129.1	178	-59.8	-179.3	0	0	0	109.9	I169 L171 F193 P195 F199 I245	I169-I197 HydrophobicContact CB-CG1 4.39Å; I169-I197 HydrophobicContact CB-CG2 4.21Å; I169-I197 HydrophobicContact CG2-CD1 4.48Å; I169-I197 HydrophobicContact CG2-CG2 3.84Å; L171-I197 HydrophobicContact CD1-CG2 3.41Å; L171-I197 VanDerWaalsContact CD1-CG2 3.41Å; F193-I197 HydrophobicContact CB-CB 3.85Å; F193-I197 HydrophobicContact CB-CD1 4.13Å; F193-I197 HydrophobicContact CB-CG1 4.15Å; F193-I197 HydrophobicContact CD1-CD1 3.81Å; F193-I197 HydrophobicContact CE1-CD1 4.48Å; F193-I197 HydrophobicContact CG-CD1 4.06Å; F193-I197 PolarHBondContact O-N 3.35Å; P195-I197 PolarHBondContact O-N 2.99Å; I197-F199 HydrophobicContact CB-CE2 4.13Å; I197-F199 HydrophobicContact CG2-CD2 4.1Å; I197-F199 HydrophobicContact CG2-CE2 3.72Å; I197-F199 WeakPolarHBondContact O-CD2 3.24Å; I197-I245 HydrophobicContact CD1-CG2 3.33Å
198	K	97.9	Very high	97	Very high	39 Å²	39	36.4 Å²	36.4	17%	0.17	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.7	-173.8	-54.8	-56.8	-173.1	-170.5	0	111.7	D144 D168 I169 K170 L171 P195 F200	D144-K198 IonicContact OD2-NZ 3.67Å; D144-K198 PolarHBondContact OD2-NZ 3.39Å; D168-K198 HydrophobicContact CB-CG 4.38Å; I169-K198 PolarHBondContact O-N 2.9Å; I169-K198 VanDerWaalsContact O-N 3.11Å; K170-K198 CarbonylContact C-O 3.52Å; K170-K198 WeakPolarHBondContact CA-O 3.42Å; K170-K198 HydrophobicContact CB-CB 4.28Å; L171-K198 PolarHBondContact N-O 2.77Å; P195-K198 PolarHBondContact O-NZ 2.8Å; K198-F200 HydrophobicContact CB-CE2 3.67Å; K198-F200 HydrophobicContact CB-CZ 4.25Å
199	F	98.6	Very high	97.1	Very high	5 Å²	5	41.9 Å²	41.9	2%	0.022	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.1	178.3	-76.9	-123.5	0	0	0	111.7	P149 V150 E151 L171 F186 A189 A190 F193 I197 I245	P149-F199 WeakPolarHBondContact O-CB 3.43Å; V150-F199 WeakPolarHBondContact CA-O 3.19Å; V150-F199 HydrophobicContact CG2-CB 4.08Å; E151-F199 PolarHBondContact N-O 2.85Å; L171-F199 HydrophobicContact CB-CD1 4.37Å; L171-F199 HydrophobicContact CB-CG 4.49Å; L171-F199 HydrophobicContact CD1-CD2 4.25Å; L171-F199 HydrophobicContact CD1-CE1 4.47Å; L171-F199 HydrophobicContact CD1-CE2 3.94Å; L171-F199 HydrophobicContact CD1-CZ 4.09Å; L171-F199 HydrophobicContact CD2-CE1 4.2Å; L171-F199 HydrophobicContact CD2-CZ 4.38Å; F186-F199 HydrophobicContact CD1-CD1 4.35Å; F186-F199 HydrophobicContact CD2-CD1 4.18Å; F186-F199 HydrophobicContact CD2-CE1 4.38Å; F186-F199 HydrophobicContact CE1-CB 4.14Å; F186-F199 AromaticContact CE1-CD1 3.8Å; F186-F199 HydrophobicContact CE1-CD1 3.8Å; F186-F199 HydrophobicContact CE1-CG 4.47Å; F186-F199 AromaticContact CE2-CD1 3.58Å; F186-F199 HydrophobicContact CE2-CD1 3.58Å; F186-F199 AromaticContact CE2-CE1 3.98Å; F186-F199 HydrophobicContact CE2-CE1 3.98Å; F186-F199 HydrophobicContact CZ-CB 4.12Å; F186-F199 AromaticContact CZ-CD1 3.39Å; F186-F199 HydrophobicContact CZ-CD1 3.39Å; F186-F199 HydrophobicContact CZ-CE1 4.25Å; F186-F199 HydrophobicContact CZ-CG 4.14Å; A189-F199 HydrophobicContact CB-CE1 4.49Å; A190-F199 HydrophobicContact CB-CB 3.76Å; A190-F199 HydrophobicContact CB-CD1 3.46Å; A190-F199 VanDerWaalsContact CB-CD1 3.46Å; A190-F199 HydrophobicContact CB-CD2 3.88Å; A190-F199 HydrophobicContact CB-CE1 3.89Å; A190-F199 HydrophobicContact CB-CE2 4.27Å; A190-F199 HydrophobicContact CB-CG 3.45Å; A190-F199 VanDerWaalsContact CB-CG 3.45Å; A190-F199 HydrophobicContact CB-CZ 4.26Å; F193-F199 HydrophobicContact CB-CE2 4.16Å; F193-F199 HydrophobicContact CD2-CE2 4.09Å; F193-F199 AromaticContact CD2-CZ 3.87Å; F193-F199 HydrophobicContact CD2-CZ 3.87Å; I197-F199 HydrophobicContact CB-CE2 4.13Å; I197-F199 HydrophobicContact CG2-CD2 4.1Å; I197-F199 HydrophobicContact CG2-CE2 3.72Å; I197-F199 WeakPolarHBondContact O-CD2 3.24Å; F199-I245 HydrophobicContact CE1-CD1 4.05Å; F199-I245 HydrophobicContact CE2-CD1 4.23Å; F199-I245 HydrophobicContact CZ-CD1 3.36Å
200	F	98.8	Very high	97.1	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.035	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	149.3	176.9	-62	-92.1	0	0	0	111.3	E151 I153 F162 I165 K170 L171 V172 G173 F186 K198	E151-F200 HydrophobicContact CB-CD1 3.57Å; E151-F200 HydrophobicContact CB-CE1 3.67Å; E151-F200 HydrophobicContact CB-CG 4.48Å; E151-F200 HydrophobicContact CG-CE1 4.21Å; E151-F200 CarbonylContact O-C 3.56Å; E151-F200 VanDerWaalsContact O-CA 3.28Å; E151-F200 WeakPolarHBondContact O-CA 3.39Å; E151-F200 WeakPolarHBondContact OE1-CE1 3.31Å; I153-F200 HydrophobicContact CD1-CB 3.84Å; I153-F200 HydrophobicContact CD1-CD1 3.97Å; I153-F200 HydrophobicContact CD1-CG 4.12Å; I153-F200 HydrophobicContact CG1-CB 4.25Å; I153-F200 HydrophobicContact CG1-CD1 3.97Å; I153-F200 HydrophobicContact CG1-CG 4.5Å; F162-F200 HydrophobicContact CD2-CB 4.17Å; F162-F200 HydrophobicContact CD2-CD1 4.05Å; F162-F200 AromaticContact CD2-CD2 3.42Å; F162-F200 HydrophobicContact CD2-CD2 3.42Å; F162-F200 VanDerWaalsContact CD2-CD2 3.42Å; F162-F200 HydrophobicContact CD2-CE1 4.34Å; F162-F200 AromaticContact CD2-CE2 3.74Å; F162-F200 HydrophobicContact CD2-CE2 3.74Å; F162-F200 AromaticContact CD2-CG 3.59Å; F162-F200 HydrophobicContact CD2-CG 3.59Å; F162-F200 HydrophobicContact CD2-CZ 4.21Å; F162-F200 HydrophobicContact CE2-CB 4.32Å; F162-F200 AromaticContact CE2-CD2 3.58Å; F162-F200 HydrophobicContact CE2-CD2 3.58Å; F162-F200 HydrophobicContact CE2-CE2 4.12Å; F162-F200 HydrophobicContact CE2-CG 4.02Å; I165-F200 HydrophobicContact CD1-CE2 4.08Å; I165-F200 HydrophobicContact CD1-CZ 3.56Å; K170-F200 HydrophobicContact CB-CD2 4.39Å; K170-F200 HydrophobicContact CB-CE2 4.14Å; L171-F200 WeakPolarHBondContact O-CA 3.41Å; L171-F200 WeakPolarHBondContact O-CB 3.5Å; L171-F200 PolarHBondContact O-N 3.44Å; V172-F200 VanDerWaalsContact CA-O 3.28Å; V172-F200 WeakPolarHBondContact CA-O 3.3Å; V172-F200 HydrophobicContact CB-CB 4.1Å; V172-F200 HydrophobicContact CG2-CB 4.03Å; G173-F200 PolarHBondContact N-O 3.42Å; F186-F200 VanDerWaalsContact CE1-O 3.32Å; F186-F200 WeakPolarHBondContact CE1-O 3.19Å; F186-F200 WeakPolarHBondContact CZ-O 3.37Å; K198-F200 HydrophobicContact CB-CE2 3.67Å; K198-F200 HydrophobicContact CB-CZ 4.25Å
201	A	98.7	Very high	97.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	149.5	171.2	0	0	0	0	0	111.9	V150 E151 I152 I153 G173 F175 F183 F186	V150-A201 HydrophobicContact CG1-CB 3.72Å; E151-A201 PolarHBondContact O-N 3.26Å; I152-A201 CarbonylContact C-O 3.53Å; I152-A201 WeakPolarHBondContact CA-O 3.4Å; I152-A201 HydrophobicContact CD1-CB 3.92Å; I153-A201 PolarHBondContact N-O 3.21Å; G173-A201 CarbonylContact O-C 3.4Å; G173-A201 WeakPolarHBondContact O-CA 3.48Å; F175-A201 HydrophobicContact CD2-CB 4.08Å; F175-A201 HydrophobicContact CE2-CB 4.19Å; F183-A201 HydrophobicContact CD2-CB 4.03Å; F183-A201 HydrophobicContact CE2-CB 3.63Å; F186-A201 HydrophobicContact CE1-CB 4.36Å
202	T	98.7	Very high	97.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	144	167.4	-168.9	0	0	0	0	111.3	I153 G173 Y174 F175 N204 V207 A208	I153-T202 VanDerWaalsContact O-CB 3.24Å; I153-T202 WeakPolarHBondContact O-CB 3.38Å; I153-T202 PolarHBondContact O-OG1 3.45Å; G173-T202 PolarHBondContact O-N 3.11Å; Y174-T202 HydrophobicContact CD2-CG2 3.96Å; Y174-T202 WeakPolarHBondContact CD2-O 3.37Å; Y174-T202 HydrophobicContact CG-CG2 4.36Å; F175-T202 PolarHBondContact N-O 3.04Å; T202-N204 PolarHBondContact OG1-N 3.32Å; T202-N204 VanDerWaalsContact OG1-N 3.1Å; T202-V207 HydrophobicContact CG2-CB 4.33Å; T202-V207 HydrophobicContact CG2-CG1 4.04Å; T202-V207 WeakPolarHBondContact OG1-CB 3.34Å; T202-A208 HydrophobicContact CG2-CB 4.02Å
203	F	98.4	Very high	97.4	Very high	51 Å²	51	45.7 Å²	45.7	22%	0.224	23%	0.227	C	C	.	.			trans	-109.5	0.8	166.7	-46.9	-56.7	0	0	0	111.6	I152 F175 H178 F183 P205	I152-F203 HydrophobicContact CD1-CE2 3.79Å; I152-F203 HydrophobicContact CD1-CZ 3.95Å; I152-F203 HydrophobicContact CG1-CE2 4.34Å; I152-F203 HydrophobicContact CG2-CD2 4.21Å; I152-F203 HydrophobicContact CG2-CE2 4.14Å; F175-F203 HydrophobicContact CB-CD1 4.04Å; F175-F203 HydrophobicContact CB-CE1 3.95Å; H178-F203 HydrophobicContact CB-CE2 4.17Å; H178-F203 HydrophobicContact CB-CZ 3.98Å; H178-F203 VanDerWaalsContact N-CZ 3.32Å; F183-F203 HydrophobicContact CD1-CZ 4.38Å; F183-F203 AromaticContact CD2-CE1 3.84Å; F183-F203 HydrophobicContact CD2-CE1 3.84Å; F183-F203 AromaticContact CD2-CZ 3.9Å; F183-F203 HydrophobicContact CD2-CZ 3.9Å; F183-F203 HydrophobicContact CE1-CZ 4.27Å; F183-F203 HydrophobicContact CE2-CE1 4.18Å; F183-F203 AromaticContact CE2-CZ 3.79Å; F183-F203 HydrophobicContact CE2-CZ 3.79Å; F183-F203 HydrophobicContact CG-CE1 4.06Å; F183-F203 HydrophobicContact CG-CZ 4.18Å; F183-F203 AromaticContact CZ-CZ 3.98Å; F183-F203 HydrophobicContact CZ-CZ 3.98Å; F203-P205 WeakPolarHBondContact O-CD 3.43Å
204	N	98.2	Very high	97.5	Very high	36 Å²	36	50.2 Å²	50.2	19%	0.193	25%	0.247	C	C	.	.			trans	-95.2	114.9	-173.8	-172	-27.7	0	0	0	110.5	D154 T202 K206 V207 A208	D154-N204 PolarHBondContact O-ND2 2.83Å; D154-N204 PolarHBondContact OD1-ND2 2.73Å; T202-N204 PolarHBondContact OG1-N 3.32Å; T202-N204 VanDerWaalsContact OG1-N 3.1Å; N204-K206 PolarHBondContact O-N 3.47Å; N204-K206 WeakPolarHBondContact OD1-CB 3.31Å; N204-K206 PolarHBondContact OD1-N 2.83Å; N204-V207 HydrophobicContact CB-CB 4.2Å; N204-V207 HydrophobicContact CB-CG2 3.95Å; N204-V207 PolarHBondContact O-N 3.27Å; N204-A208 PolarHBondContact O-N 2.93Å
205	P	98	Very high	97.7	Very high	83 Å²	83	52.7 Å²	52.7	54%	0.539	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-17	-179	-22.6	32.7	0	0	0	114.6	F203 K209	F203-P205 WeakPolarHBondContact O-CD 3.43Å; P205-K209 VanDerWaalsContact O-CB 3.26Å; P205-K209 WeakPolarHBondContact O-CB 3.21Å; P205-K209 PolarHBondContact O-N 3.22Å
206	K	98.1	Very high	97.8	Very high	172 Å²	172	53.9 Å²	53.9	75%	0.748	27%	0.266	S	S	*	.	H	α-helix	trans	-79.6	-40.1	175.4	-65	179.9	-178.1	172.2	0	112.1	N204 K209 A210	N204-K206 PolarHBondContact O-N 3.47Å; N204-K206 WeakPolarHBondContact OD1-CB 3.31Å; N204-K206 PolarHBondContact OD1-N 2.83Å; K206-K209 PolarHBondContact O-N 3.09Å; K206-A210 PolarHBondContact O-N 3Å; K206-A210 VanDerWaalsContact O-N 3.17Å
207	V	98.4	Very high	98.1	Very high	6 Å²	6	51.7 Å²	51.7	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-50.5	175.9	174.2	0	0	0	0	108.6	I153 L159 T202 N204 K209 A210 L211	I153-V207 HydrophobicContact CB-CG1 4.18Å; I153-V207 HydrophobicContact CG2-CG1 3.59Å; I153-V207 HydrophobicContact CG2-CG2 4.4Å; L159-V207 HydrophobicContact CD1-CG1 4.43Å; T202-V207 HydrophobicContact CG2-CB 4.33Å; T202-V207 HydrophobicContact CG2-CG1 4.04Å; T202-V207 WeakPolarHBondContact OG1-CB 3.34Å; N204-V207 HydrophobicContact CB-CB 4.2Å; N204-V207 HydrophobicContact CB-CG2 3.95Å; N204-V207 PolarHBondContact O-N 3.27Å; V207-K209 PolarHBondContact O-N 3.43Å; V207-K209 VanDerWaalsContact O-N 3.15Å; V207-A210 WeakPolarHBondContact O-CA 3.05Å; V207-A210 WeakPolarHBondContact O-CB 3.35Å; V207-A210 PolarHBondContact O-N 2.96Å; V207-L211 HydrophobicContact CG1-CD1 4.06Å; V207-L211 PolarHBondContact O-N 3.2Å
208	A	98.2	Very high	98.2	Very high	1 Å²	1	51 Å²	51	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-54.7	-37.6	175	0	0	0	0	0	113	Y174 T202 N204 L211 E212 L213	Y174-A208 HydrophobicContact CD1-CB 3.43Å; Y174-A208 VanDerWaalsContact CD1-CB 3.43Å; Y174-A208 HydrophobicContact CD2-CB 3.6Å; Y174-A208 HydrophobicContact CE1-CB 3.82Å; Y174-A208 HydrophobicContact CE2-CB 3.98Å; Y174-A208 HydrophobicContact CG-CB 3.33Å; T202-A208 HydrophobicContact CG2-CB 4.02Å; N204-A208 PolarHBondContact O-N 2.93Å; A208-L211 CarbonylContact O-C 3.58Å; A208-L211 PolarHBondContact O-N 3.04Å; A208-E212 CarbonylContact O-C 3.52Å; A208-E212 PolarHBondContact O-N 2.74Å; A208-L213 HydrophobicContact CB-CB 4.31Å; A208-L213 PolarHBondContact O-N 3.17Å
209	K	98.2	Very high	98.2	Very high	170 Å²	170	49.6 Å²	49.6	74%	0.739	25%	0.247	S	C	*	.	H	α-helix	trans	-68.3	-33.1	175.6	-177.9	178.8	177.4	-169.6	0	113	P205 K206 V207 E212	P205-K209 VanDerWaalsContact O-CB 3.26Å; P205-K209 WeakPolarHBondContact O-CB 3.21Å; P205-K209 PolarHBondContact O-N 3.22Å; K206-K209 PolarHBondContact O-N 3.09Å; V207-K209 PolarHBondContact O-N 3.43Å; V207-K209 VanDerWaalsContact O-N 3.15Å; K209-E212 PolarHBondContact O-N 3.43Å
210	A	97.8	Very high	98.2	Very high	61 Å²	61	49.6 Å²	49.6	50%	0.504	25%	0.247	S	C	.	.	H	α-helix	trans	-70.8	-38.6	177.6	0	0	0	0	0	111.1	L159 K206 V207 E212	L159-A210 HydrophobicContact CD2-CB 3.64Å; K206-A210 PolarHBondContact O-N 3Å; K206-A210 VanDerWaalsContact O-N 3.17Å; V207-A210 WeakPolarHBondContact O-CA 3.05Å; V207-A210 WeakPolarHBondContact O-CB 3.35Å; V207-A210 PolarHBondContact O-N 2.96Å; A210-E212 PolarHBondContact O-N 2.92Å
211	L	97.4	Very high	98.2	Very high	13 Å²	13	50.4 Å²	50.4	7%	0.068	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	2.9	172.1	-67.3	168.3	0	0	0	113.8	L159 F162 V172 V207 A208 L213	L159-L211 HydrophobicContact CD1-CD1 3.95Å; L159-L211 HydrophobicContact CD1-CD2 3.57Å; L159-L211 HydrophobicContact CD1-CG 3.67Å; F162-L211 HydrophobicContact CD1-CD2 4.15Å; F162-L211 HydrophobicContact CE1-CD2 3.77Å; V172-L211 HydrophobicContact CG1-CD1 4.19Å; V172-L211 HydrophobicContact CG2-CD1 3.73Å; V207-L211 HydrophobicContact CG1-CD1 4.06Å; V207-L211 PolarHBondContact O-N 3.2Å; A208-L211 CarbonylContact O-C 3.58Å; A208-L211 PolarHBondContact O-N 3.04Å; L211-L213 HydrophobicContact CB-CD1 3.85Å; L211-L213 HydrophobicContact CB-CG 3.92Å; L211-L213 HydrophobicContact CD1-CD1 3.87Å; L211-L213 PolarHBondContact O-N 3.08Å
212	E	97.8	Very high	98.1	Very high	168 Å²	168	52 Å²	52	79%	0.785	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	10.8	-175.1	-49.8	-158	156.6	0	0	117	A208 K209 A210	A208-E212 CarbonylContact O-C 3.52Å; A208-E212 PolarHBondContact O-N 2.74Å; K209-E212 PolarHBondContact O-N 3.43Å; A210-E212 PolarHBondContact O-N 2.92Å
213	L	97.9	Very high	98	Very high	11 Å²	11	52.1 Å²	52.1	6%	0.058	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-66.9	136.2	179.1	-70.9	168.9	0	0	0	114.1	V172 A208 L211 E217 D219	V172-L213 HydrophobicContact CG1-CD1 4.18Å; V172-L213 HydrophobicContact CG2-CD1 4.14Å; A208-L213 HydrophobicContact CB-CB 4.31Å; A208-L213 PolarHBondContact O-N 3.17Å; L211-L213 HydrophobicContact CB-CD1 3.85Å; L211-L213 HydrophobicContact CB-CG 3.92Å; L211-L213 HydrophobicContact CD1-CD1 3.87Å; L211-L213 PolarHBondContact O-N 3.08Å; L213-E217 HydrophobicContact CD2-CB 4.03Å; L213-E217 HydrophobicContact CD2-CG 4.18Å; L213-D219 HydrophobicContact CD2-CB 3.99Å; L213-D219 WeakPolarHBondContact CD2-OD1 3.41Å; L213-D219 VanDerWaalsContact CD2-OD2 3.27Å; L213-D219 WeakPolarHBondContact CD2-OD2 3.45Å
214	K	97.7	Very high	97.9	Very high	124 Å²	124	50.5 Å²	50.5	54%	0.539	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-90.9	163.7	165.3	-62.1	173.8	-138.2	69	0	111.3	Y174 N216 E217	Y174-K214 VanDerWaalsContact CD1-C 3.48Å; K214-N216 PolarHBondContact O-N 2.93Å; K214-E217 HydrophobicContact CB-CB 4.3Å; K214-E217 PolarHBondContact N-OE1 3.12Å; K214-E217 VanDerWaalsContact NZ-CD 3.25Å; K214-E217 IonicContact NZ-OE1 2.73Å; K214-E217 PolarHBondContact NZ-OE1 3.14Å; K214-E217 IonicContact NZ-OE2 3.45Å; K214-E217 PolarHBondContact NZ-OE2 2.94Å; K214-E217 WeakPolarHBondContact O-CB 3.46Å; K214-E217 PolarHBondContact O-N 3.33Å
215	L	97.8	Very high	97.8	Very high	81 Å²	81	49.6 Å²	49.6	42%	0.424	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	132.3	178.2	-173.8	68.6	0	0	0	111	Y174 K176 E217	Y174-L215 HydrophobicContact CD1-CB 4.39Å; Y174-L215 HydrophobicContact CD1-CD1 4.47Å; Y174-L215 HydrophobicContact CE1-CB 4.16Å; Y174-L215 HydrophobicContact CE1-CD1 4.14Å; Y174-L215 HydrophobicContact CE2-CD1 4.48Å; K176-L215 HydrophobicContact CB-CD1 4.22Å; L215-E217 PolarHBondContact O-N 3.26Å
216	N	97.9	Very high	97.5	Very high	30 Å²	30	53.1 Å²	53.1	16%	0.16	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	20	-173.7	-46.5	-31.4	0	0	0	114.1	Y174 H182 K214 K234 Y236	Y174-N216 WeakPolarHBondContact O-CA 3.39Å; Y174-N216 PolarHBondContact O-N 3.33Å; H182-N216 PolarHBondContact CD2-ND2 2.89Å; H182-N216 PolarHBondContact CD2-OD1 3.46Å; H182-N216 PolarHBondContact NE2-ND2 3.04Å; K214-N216 PolarHBondContact O-N 2.93Å; N216-K234 WeakPolarHBondContact O-CD 3.5Å; N216-Y236 VanDerWaalsContact O-CE2 3.24Å; N216-Y236 WeakPolarHBondContact O-CE2 3.39Å
217	E	98.5	Very high	97.3	Very high	13 Å²	13	49.8 Å²	49.8	6%	0.061	25%	0.246	C	C	.	.			trans	-82.6	140.7	167.5	-155.9	149.7	73	0	0	108.3	G173 Y174 L213 K214 L215 V230 K234	G173-E217 WeakPolarHBondContact CA-O 3.41Å; Y174-E217 PolarHBondContact N-O 3.29Å; L213-E217 HydrophobicContact CD2-CB 4.03Å; L213-E217 HydrophobicContact CD2-CG 4.18Å; K214-E217 HydrophobicContact CB-CB 4.3Å; K214-E217 PolarHBondContact N-OE1 3.12Å; K214-E217 VanDerWaalsContact NZ-CD 3.25Å; K214-E217 IonicContact NZ-OE1 2.73Å; K214-E217 PolarHBondContact NZ-OE1 3.14Å; K214-E217 IonicContact NZ-OE2 3.45Å; K214-E217 PolarHBondContact NZ-OE2 2.94Å; K214-E217 WeakPolarHBondContact O-CB 3.46Å; K214-E217 PolarHBondContact O-N 3.33Å; L215-E217 PolarHBondContact O-N 3.26Å; E217-V230 HydrophobicContact CG-CG1 3.55Å; E217-K234 HydrophobicContact CB-CD 4.31Å; E217-K234 IonicContact OE2-NZ 2.66Å; E217-K234 PolarHBondContact OE2-NZ 2.78Å
218	V	98.6	Very high	97.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.9	172.3	175.5	0	0	0	0	106.4	L171 V172 F175 F186 I231 Y236 L241	L171-V218 HydrophobicContact CB-CG1 4.39Å; L171-V218 HydrophobicContact CD2-CG1 4.02Å; V172-V218 WeakPolarHBondContact O-CA 3.36Å; F175-V218 HydrophobicContact CE1-CG2 4.45Å; F175-V218 HydrophobicContact CZ-CG2 3.87Å; F186-V218 HydrophobicContact CD2-CG1 4.24Å; F186-V218 HydrophobicContact CD2-CG2 3.81Å; F186-V218 HydrophobicContact CE2-CB 4.48Å; F186-V218 HydrophobicContact CE2-CG1 3.63Å; F186-V218 HydrophobicContact CE2-CG2 3.92Å; V218-I231 HydrophobicContact CB-CD1 4.24Å; V218-I231 HydrophobicContact CG1-CD1 3.72Å; V218-I231 HydrophobicContact CG1-CG1 4.36Å; V218-I231 PolarHBondContact O-N 3.17Å; V218-Y236 HydrophobicContact CB-CD2 4.44Å; V218-Y236 HydrophobicContact CB-CE2 3.81Å; V218-Y236 HydrophobicContact CG2-CD2 3.97Å; V218-Y236 HydrophobicContact CG2-CE2 3.65Å; V218-Y236 PolarHBondContact N-OH 2.86Å; V218-L241 HydrophobicContact CG1-CD2 4.49Å
219	D	98.6	Very high	97.2	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.043	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.5	175.1	-75.4	3.4	0	0	0	108.2	L171 V172 L213 Y221 P228 V230	L171-D219 CarbonylContact C-O 3.59Å; L171-D219 WeakPolarHBondContact CA-O 3.46Å; V172-D219 HydrophobicContact CG1-CB 4.24Å; V172-D219 PolarHBondContact N-O 2.9Å; V172-D219 PolarHBondContact O-N 3.26Å; L213-D219 HydrophobicContact CD2-CB 3.99Å; L213-D219 WeakPolarHBondContact CD2-OD1 3.41Å; L213-D219 VanDerWaalsContact CD2-OD2 3.27Å; L213-D219 WeakPolarHBondContact CD2-OD2 3.45Å; D219-Y221 HydrophobicContact CB-CE2 3.95Å; D219-P228 HydrophobicContact CB-CB 3.78Å; D219-P228 HydrophobicContact CB-CG 4.18Å; D219-V230 WeakPolarHBondContact OD1-CG2 3.41Å
220	F	98.6	Very high	97.2	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	127.2	174.9	176.3	-85.6	0	0	0	108.5	I169 L171 E222 P228 V229 I231 F244 I245 N248	I169-F220 HydrophobicContact CD1-CZ 4.43Å; I169-F220 HydrophobicContact CG2-CD2 4.22Å; I169-F220 HydrophobicContact CG2-CE1 4.32Å; I169-F220 HydrophobicContact CG2-CE2 3.35Å; I169-F220 HydrophobicContact CG2-CZ 3.4Å; L171-F220 HydrophobicContact CD1-CD2 3.97Å; L171-F220 HydrophobicContact CD1-CE2 4.31Å; L171-F220 HydrophobicContact CD2-CD2 4.08Å; L171-F220 HydrophobicContact CG-CD2 3.87Å; F220-E222 HydrophobicContact CE1-CB 4.16Å; F220-P228 CarbonylContact O-C 3.58Å; F220-P228 VanDerWaalsContact O-CA 3.23Å; F220-P228 WeakPolarHBondContact O-CA 3.41Å; F220-P228 WeakPolarHBondContact O-CB 3.29Å; F220-V229 PolarHBondContact N-O 3.22Å; F220-V229 PolarHBondContact O-N 3.28Å; F220-I231 HydrophobicContact CB-CD1 4.45Å; F220-I231 HydrophobicContact CB-CG1 4.23Å; F220-F244 HydrophobicContact CB-CE1 3.83Å; F220-F244 HydrophobicContact CD1-CE1 4.3Å; F220-F244 HydrophobicContact CD2-CD1 4.43Å; F220-F244 HydrophobicContact CD2-CE1 4.09Å; F220-F244 AromaticContact CG-CE1 3.83Å; F220-F244 HydrophobicContact CG-CE1 3.83Å; F220-I245 HydrophobicContact CD2-CG1 4.45Å; F220-I245 HydrophobicContact CE2-CG1 4.43Å; F220-N248 HydrophobicContact CE1-CB 4.14Å; F220-N248 HydrophobicContact CZ-CB 4.03Å; F220-N248 VanDerWaalsContact CZ-O 3.28Å; F220-N248 WeakPolarHBondContact CZ-O 3.18Å
221	Y	98.3	Very high	97.2	Very high	25 Å²	25	47.7 Å²	47.7	10%	0.098	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.3	174.4	-67.8	-103.1	0	0	0	107.8	F162 I169 K170 V172 D219 E226 P228	F162-Y221 HydrophobicContact CE1-CE2 4.15Å; F162-Y221 AromaticContact CZ-CD2 3.92Å; F162-Y221 HydrophobicContact CZ-CD2 3.92Å; F162-Y221 AromaticContact CZ-CE2 3.69Å; F162-Y221 HydrophobicContact CZ-CE2 3.69Å; I169-Y221 WeakPolarHBondContact CA-O 3.44Å; K170-Y221 HydrophobicContact CG-CD2 4.39Å; K170-Y221 HydrophobicContact CG-CG 4.24Å; K170-Y221 PolarHBondContact N-O 3.44Å; K170-Y221 WeakPolarHBondContact O-CB 3.5Å; K170-Y221 PolarHBondContact O-N 2.65Å; V172-Y221 HydrophobicContact CG1-CD2 4.47Å; V172-Y221 HydrophobicContact CG1-CE2 3.75Å; D219-Y221 HydrophobicContact CB-CE2 3.95Å; Y221-E226 WeakPolarHBondContact CE1-O 3.47Å; Y221-P228 HydrophobicContact CD1-CB 3.94Å; Y221-P228 HydrophobicContact CD1-CG 4.5Å; Y221-P228 HydrophobicContact CD2-CB 3.83Å; Y221-P228 HydrophobicContact CE1-CB 3.72Å; Y221-P228 HydrophobicContact CE1-CG 3.82Å; Y221-P228 HydrophobicContact CE2-CB 3.57Å; Y221-P228 HydrophobicContact CE2-CG 4.03Å; Y221-P228 HydrophobicContact CG-CB 4Å
222	E	97.7	Very high	97.1	Very high	32 Å²	32	51.5 Å²	51.5	15%	0.15	27%	0.267	C	S	.	.			trans	-68.1	152.8	166.8	-175.7	-177.7	156.2	0	0	109.8	F220 F224 I225 P251 T252 T300	F220-E222 HydrophobicContact CE1-CB 4.16Å; E222-F224 PolarHBondContact O-N 3.45Å; E222-I225 HydrophobicContact CB-CB 4.11Å; E222-I225 HydrophobicContact CB-CG1 3.85Å; E222-I225 HydrophobicContact CG-CG1 3.96Å; E222-I225 PolarHBondContact O-N 3.43Å; E222-P251 HydrophobicContact CG-CB 3.74Å; E222-P251 HydrophobicContact CG-CG 4.4Å; E222-T252 VanDerWaalsContact OE1-CB 3.25Å; E222-T252 WeakPolarHBondContact OE1-CB 3.42Å; E222-T252 PolarHBondContact OE1-N 3.27Å; E222-T252 PolarHBondContact OE1-OG1 2.86Å; E222-T300 PolarHBondContact OE2-OG1 2.95Å
223	S	96.5	Very high	96.8	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.021	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	137.1	176.1	49.7	0	0	0	0	111	E166 E167 I225 P251 L253	E166-S223 CarbonylContact O-C 3.59Å; E166-S223 WeakPolarHBondContact O-CA 3.22Å; E167-S223 VanDerWaalsContact O-CB 3.27Å; E167-S223 WeakPolarHBondContact O-CB 3.3Å; S223-I225 PolarHBondContact O-N 2.79Å; S223-P251 WeakPolarHBondContact OG-CB 3.34Å; S223-P251 WeakPolarHBondContact OG-CG 3.38Å; S223-L253 PolarHBondContact OG-O 3.26Å
224	F	96.8	Very high	96.3	Very high	17 Å²	17	49.7 Å²	49.7	8%	0.075	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	2.2	-178.1	-52	-71	0	0	0	116.4	E166 E167 E222 L253 K255 K293 W309	E166-F224 HydrophobicContact CB-CD1 4.04Å; E166-F224 HydrophobicContact CB-CE1 4.39Å; E166-F224 PolarHBondContact O-N 3.19Å; E167-F224 HydrophobicContact CB-CE1 4.26Å; E167-F224 HydrophobicContact CB-CZ 3.95Å; E167-F224 HydrophobicContact CG-CE1 3.81Å; E167-F224 HydrophobicContact CG-CZ 3.83Å; E222-F224 PolarHBondContact O-N 3.45Å; F224-L253 HydrophobicContact CB-CD2 4.1Å; F224-L253 HydrophobicContact CD2-CB 3.99Å; F224-L253 HydrophobicContact CD2-CD2 3.67Å; F224-L253 HydrophobicContact CD2-CG 3.6Å; F224-L253 VanDerWaalsContact CD2-O 3.32Å; F224-L253 WeakPolarHBondContact CD2-O 3.47Å; F224-L253 HydrophobicContact CE2-CD2 4.26Å; F224-L253 HydrophobicContact CE2-CG 4Å; F224-L253 HydrophobicContact CG-CD2 3.9Å; F224-L253 HydrophobicContact CG-CG 4.34Å; F224-K255 HydrophobicContact CE2-CB 4.41Å; F224-K255 HydrophobicContact CZ-CB 4.23Å; F224-K293 HydrophobicContact CB-CD 4.48Å; F224-K293 HydrophobicContact CB-CG 4.12Å; F224-K293 HydrophobicContact CD1-CD 4.15Å; F224-K293 HydrophobicContact CD1-CG 4.32Å; F224-K293 HydrophobicContact CG-CG 4.39Å; F224-W309 HydrophobicContact CE1-CE3 4.22Å; F224-W309 AromaticContact CE1-CZ3 3.92Å; F224-W309 HydrophobicContact CE1-CZ3 3.92Å; F224-W309 HydrophobicContact CE2-CE3 4.26Å; F224-W309 AromaticContact CZ-CE3 3.57Å; F224-W309 HydrophobicContact CZ-CE3 3.57Å; F224-W309 AromaticContact CZ-CZ3 3.61Å; F224-W309 HydrophobicContact CZ-CZ3 3.61Å
225	I	95.8	Very high	95.9	Very high	17 Å²	17	47.4 Å²	47.4	9%	0.087	27%	0.272	C	S	.	.			trans	-97.7	118.4	177.1	-52.6	-52.9	0	0	0	110.3	E222 S223 N227 E297	E222-I225 HydrophobicContact CB-CB 4.11Å; E222-I225 HydrophobicContact CB-CG1 3.85Å; E222-I225 HydrophobicContact CG-CG1 3.96Å; E222-I225 PolarHBondContact O-N 3.43Å; S223-I225 PolarHBondContact O-N 2.79Å; I225-N227 PolarHBondContact O-N 3.15Å; I225-E297 HydrophobicContact CD1-CB 4.18Å
226	E	92	Very high	95.8	Very high	157 Å²	157	44.3 Å²	44.3	73%	0.734	26%	0.255	S	S	*	.	S	Bend	trans	-68.5	-34.5	-178	-68	-168.2	170.7	0	0	113.1	Y221	Y221-E226 WeakPolarHBondContact CE1-O 3.47Å
227	N	93.6	Very high	95.8	Very high	102 Å²	102	45.4 Å²	45.4	55%	0.545	27%	0.265	S	S	.	.	S	Bend	trans	-94.1	123.5	-172.7	-68	-63.1	0	0	0	111	I225 E297	I225-N227 PolarHBondContact O-N 3.15Å; N227-E297 PolarHBondContact ND2-OE1 2.87Å
228	P	96.9	Very high	95.7	Very high	42 Å²	42	47.7 Å²	47.7	27%	0.273	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-79	157.9	-178.5	30.9	-34.3	0	0	0	113.3	D219 F220 Y221	D219-P228 HydrophobicContact CB-CB 3.78Å; D219-P228 HydrophobicContact CB-CG 4.18Å; F220-P228 CarbonylContact O-C 3.58Å; F220-P228 VanDerWaalsContact O-CA 3.23Å; F220-P228 WeakPolarHBondContact O-CA 3.41Å; F220-P228 WeakPolarHBondContact O-CB 3.29Å; Y221-P228 HydrophobicContact CD1-CB 3.94Å; Y221-P228 HydrophobicContact CD1-CG 4.5Å; Y221-P228 HydrophobicContact CD2-CB 3.83Å; Y221-P228 HydrophobicContact CE1-CB 3.72Å; Y221-P228 HydrophobicContact CE1-CG 3.82Å; Y221-P228 HydrophobicContact CE2-CB 3.57Å; Y221-P228 HydrophobicContact CE2-CG 4.03Å; Y221-P228 HydrophobicContact CG-CB 4Å
229	V	97	Very high	95.6	Very high	79 Å²	79	55.2 Å²	55.2	48%	0.479	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	119.2	162.8	-178.1	0	0	0	0	109.3	F220 I231 F244	F220-V229 PolarHBondContact N-O 3.22Å; F220-V229 PolarHBondContact O-N 3.28Å; V229-I231 PolarHBondContact O-N 3.43Å; V229-F244 HydrophobicContact CG1-CZ 3.98Å
230	V	97.8	Very high	95.6	Very high	69 Å²	69	59.8 Å²	59.8	42%	0.418	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	118.5	172.9	-175.3	0	0	0	0	109	E217 D219	E217-V230 HydrophobicContact CG-CG1 3.55Å; D219-V230 WeakPolarHBondContact OD1-CG2 3.41Å
231	I	97.7	Very high	95.6	Very high	5 Å²	5	59.6 Å²	59.6	3%	0.026	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-60.8	125.5	-179.8	-58.1	-174.2	0	0	0	109.4	L171 V218 F220 V229 Y236 L241 F244	L171-I231 HydrophobicContact CD2-CD1 3.96Å; V218-I231 HydrophobicContact CB-CD1 4.24Å; V218-I231 HydrophobicContact CG1-CD1 3.72Å; V218-I231 HydrophobicContact CG1-CG1 4.36Å; V218-I231 PolarHBondContact O-N 3.17Å; F220-I231 HydrophobicContact CB-CD1 4.45Å; F220-I231 HydrophobicContact CB-CG1 4.23Å; V229-I231 PolarHBondContact O-N 3.43Å; I231-Y236 HydrophobicContact CB-CE1 3.87Å; I231-Y236 HydrophobicContact CG2-CD1 3.97Å; I231-Y236 HydrophobicContact CG2-CE1 3.56Å; I231-Y236 VanDerWaalsContact O-CE1 3.25Å; I231-Y236 WeakPolarHBondContact O-CE1 3.29Å; I231-Y236 PolarHBondContact O-OH 2.82Å; I231-L241 HydrophobicContact CD1-CD2 3.82Å; I231-F244 HydrophobicContact CD1-CD1 3.71Å; I231-F244 HydrophobicContact CD1-CE1 4.14Å; I231-F244 HydrophobicContact CD1-CG 4.22Å; I231-F244 HydrophobicContact CG1-CD1 3.77Å; I231-F244 HydrophobicContact CG1-CE1 3.76Å; I231-F244 HydrophobicContact CG1-CG 4.19Å; I231-F244 HydrophobicContact CG1-CZ 4.17Å; I231-F244 HydrophobicContact CG2-CB 4.21Å; I231-F244 HydrophobicContact CG2-CD1 4.35Å; I231-F244 HydrophobicContact CG2-CD2 3.97Å; I231-F244 HydrophobicContact CG2-CE2 4.46Å; I231-F244 HydrophobicContact CG2-CG 3.9Å
232	P	95.3	Very high	95.5	Very high	93 Å²	93	59.2 Å²	59.2	60%	0.604	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	153	-175.6	29.7	-35	0	0	0	112.1	Y236	P232-Y236 WeakPolarHBondContact O-CE1 3.37Å
233	G	91.4	Very high	95.5	Very high	67 Å²	67	63.9 Å²	63.9	69%	0.691	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.4	10.3	164.1	0	0	0	0	0	117.6
234	K	88.8	Confident	95.6	Very high	74 Å²	74	65.3 Å²	65.3	32%	0.322	36%	0.355	S	S	.	.	S	Bend	trans	-50.1	149.9	-178.6	76.4	-175.5	-178.2	-178.8	0	115.7	N216 E217 Y236	N216-K234 WeakPolarHBondContact O-CD 3.5Å; E217-K234 HydrophobicContact CB-CD 4.31Å; E217-K234 IonicContact OE2-NZ 2.66Å; E217-K234 PolarHBondContact OE2-NZ 2.78Å; K234-Y236 HydrophobicContact CB-CD1 4.26Å; K234-Y236 HydrophobicContact CB-CD2 4.32Å; K234-Y236 HydrophobicContact CB-CE1 3.69Å; K234-Y236 HydrophobicContact CB-CE2 3.72Å; K234-Y236 VanDerWaalsContact CB-CZ 3.4Å
235	P	89.3	Confident	95.6	Very high	75 Å²	75	64.5 Å²	64.5	49%	0.487	35%	0.351	S	S	.	.	S	Bend	cis	-73.1	147.6	-1.8	31.1	-34.2	0	0	0	112.3	H182	H182-P235 WeakPolarHBondContact CE1-CB 3.41Å; H182-P235 WeakPolarHBondContact ND1-CB 3.4Å
236	Y	95.5	Very high	95.7	Very high	17 Å²	17	68.8 Å²	68.8	7%	0.067	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-92.4	149.6	-174.8	-37.1	-77.7	0	0	0	111.7	N216 V218 I231 P232 K234 L241	N216-Y236 VanDerWaalsContact O-CE2 3.24Å; N216-Y236 WeakPolarHBondContact O-CE2 3.39Å; V218-Y236 HydrophobicContact CB-CD2 4.44Å; V218-Y236 HydrophobicContact CB-CE2 3.81Å; V218-Y236 HydrophobicContact CG2-CD2 3.97Å; V218-Y236 HydrophobicContact CG2-CE2 3.65Å; V218-Y236 PolarHBondContact N-OH 2.86Å; I231-Y236 HydrophobicContact CB-CE1 3.87Å; I231-Y236 HydrophobicContact CG2-CD1 3.97Å; I231-Y236 HydrophobicContact CG2-CE1 3.56Å; I231-Y236 VanDerWaalsContact O-CE1 3.25Å; I231-Y236 WeakPolarHBondContact O-CE1 3.29Å; I231-Y236 PolarHBondContact O-OH 2.82Å; P232-Y236 WeakPolarHBondContact O-CE1 3.37Å; K234-Y236 HydrophobicContact CB-CD1 4.26Å; K234-Y236 HydrophobicContact CB-CD2 4.32Å; K234-Y236 HydrophobicContact CB-CE1 3.69Å; K234-Y236 HydrophobicContact CB-CE2 3.72Å; K234-Y236 VanDerWaalsContact CB-CZ 3.4Å; Y236-L241 HydrophobicContact CD1-CD2 4.44Å; Y236-L241 HydrophobicContact CD2-CD2 3.99Å; Y236-L241 HydrophobicContact CG-CD2 3.85Å; Y236-L241 HydrophobicContact CG-CG 4.29Å
237	S	96.9	Very high	95.8	Very high	52 Å²	52	66.6 Å²	66.6	36%	0.364	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-91.9	159.2	156.3	55.4	0	0	0	0	110.5	K239 E240 L241	S237-K239 VanDerWaalsContact C-N 3.29Å; S237-K239 PolarHBondContact O-N 2.8Å; S237-E240 PolarHBondContact N-OE2 2.8Å; S237-E240 WeakPolarHBondContact O-CB 3.29Å; S237-E240 PolarHBondContact O-N 2.73Å; S237-E240 VanDerWaalsContact OG-CD 3.28Å; S237-E240 WeakPolarHBondContact OG-CG 3.41Å; S237-E240 PolarHBondContact OG-OE2 2.9Å; S237-L241 PolarHBondContact O-N 3.08Å; S237-L241 VanDerWaalsContact O-N 3.15Å
238	E	97	Very high	95.9	Very high	61 Å²	61	64.9 Å²	64.9	29%	0.285	36%	0.355	S	S	.	.	H	α-helix	trans	-44.2	-53.9	172.2	176.2	-148.3	113.1	0	0	111.2	A185 D188 A189 E240 L241 V242	A185-E238 WeakPolarHBondContact O-CA 3.36Å; D188-E238 HydrophobicContact CB-CB 4.41Å; D188-E238 HydrophobicContact CB-CG 3.95Å; A189-E238 HydrophobicContact CB-CG 4.3Å; E238-E240 VanDerWaalsContact C-N 3.26Å; E238-E240 PolarHBondContact O-N 2.88Å; E238-E240 VanDerWaalsContact O-N 3.14Å; E238-L241 WeakPolarHBondContact O-CA 3.49Å; E238-L241 WeakPolarHBondContact O-CB 3.14Å; E238-L241 PolarHBondContact O-N 3.06Å; E238-V242 HydrophobicContact CG-CG2 4.42Å; E238-V242 WeakPolarHBondContact O-CG2 3.45Å; E238-V242 PolarHBondContact O-N 2.86Å
239	K	97	Very high	95.7	Very high	158 Å²	158	66.7 Å²	66.7	69%	0.687	36%	0.363	S	S	*	.	H	α-helix	trans	-59.4	-28.8	178.5	-60.6	-170.1	178.5	-161.8	0	115.7	S237 K243	S237-K239 VanDerWaalsContact C-N 3.29Å; S237-K239 PolarHBondContact O-N 2.8Å; K239-K243 WeakPolarHBondContact O-CB 3.5Å; K239-K243 PolarHBondContact O-N 3.36Å
240	E	97.5	Very high	95.7	Very high	104 Å²	104	66.9 Å²	66.9	49%	0.486	36%	0.355	S	S	.	.	H	α-helix	trans	-78.5	-32	176.7	-73.7	164.7	144.2	0	0	111.2	S237 E238 F244	S237-E240 PolarHBondContact N-OE2 2.8Å; S237-E240 WeakPolarHBondContact O-CB 3.29Å; S237-E240 PolarHBondContact O-N 2.73Å; S237-E240 VanDerWaalsContact OG-CD 3.28Å; S237-E240 WeakPolarHBondContact OG-CG 3.41Å; S237-E240 PolarHBondContact OG-OE2 2.9Å; E238-E240 VanDerWaalsContact C-N 3.26Å; E238-E240 PolarHBondContact O-N 2.88Å; E238-E240 VanDerWaalsContact O-N 3.14Å; E240-F244 WeakPolarHBondContact O-CB 3.29Å; E240-F244 PolarHBondContact O-N 3.46Å; E240-F244 VanDerWaalsContact O-N 3.14Å
241	L	98	Very high	95.6	Very high	2 Å²	2	64 Å²	64	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-72	-53.7	173.8	-67.5	168.9	0	0	0	110.6	F186 A189 V218 I231 Y236 S237 E238 K243 F244 I245	F186-L241 HydrophobicContact CB-CD1 4.15Å; F186-L241 HydrophobicContact CD2-CD1 3.95Å; A189-L241 HydrophobicContact CB-CB 3.81Å; A189-L241 HydrophobicContact CB-CD1 3.98Å; V218-L241 HydrophobicContact CG1-CD2 4.49Å; I231-L241 HydrophobicContact CD1-CD2 3.82Å; Y236-L241 HydrophobicContact CD1-CD2 4.44Å; Y236-L241 HydrophobicContact CD2-CD2 3.99Å; Y236-L241 HydrophobicContact CG-CD2 3.85Å; Y236-L241 HydrophobicContact CG-CG 4.29Å; S237-L241 PolarHBondContact O-N 3.08Å; S237-L241 VanDerWaalsContact O-N 3.15Å; E238-L241 WeakPolarHBondContact O-CA 3.49Å; E238-L241 WeakPolarHBondContact O-CB 3.14Å; E238-L241 PolarHBondContact O-N 3.06Å; L241-K243 VanDerWaalsContact C-N 3.31Å; L241-K243 PolarHBondContact O-N 2.99Å; L241-F244 WeakPolarHBondContact O-CA 3.39Å; L241-F244 WeakPolarHBondContact O-CB 3.29Å; L241-F244 PolarHBondContact O-N 2.88Å; L241-I245 WeakPolarHBondContact O-CG1 3.36Å; L241-I245 PolarHBondContact O-N 2.88Å
242	V	98	Very high	95.6	Very high	17 Å²	17	64 Å²	64	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-51.6	-53.2	177.2	171.7	0	0	0	0	110.2	A189 E192 F193 E238 F244 I245 E246	A189-V242 HydrophobicContact CB-CG2 4.04Å; E192-V242 HydrophobicContact CB-CG2 4.35Å; E192-V242 HydrophobicContact CG-CG2 4.12Å; F193-V242 HydrophobicContact CE2-CB 4.21Å; F193-V242 HydrophobicContact CE2-CG1 4.27Å; F193-V242 HydrophobicContact CE2-CG2 3.99Å; F193-V242 HydrophobicContact CZ-CB 4.25Å; F193-V242 HydrophobicContact CZ-CG1 3.91Å; F193-V242 HydrophobicContact CZ-CG2 4.46Å; E238-V242 HydrophobicContact CG-CG2 4.42Å; E238-V242 WeakPolarHBondContact O-CG2 3.45Å; E238-V242 PolarHBondContact O-N 2.86Å; V242-F244 VanDerWaalsContact C-N 3.29Å; V242-F244 PolarHBondContact O-N 3.43Å; V242-I245 PolarHBondContact O-N 3.22Å; V242-I245 VanDerWaalsContact O-N 3.09Å; V242-E246 HydrophobicContact CG1-CG 4.17Å; V242-E246 WeakPolarHBondContact O-CG 3.39Å; V242-E246 PolarHBondContact O-N 2.97Å
243	K	97.7	Very high	95.8	Very high	130 Å²	130	59.6 Å²	59.6	57%	0.565	31%	0.309	S	S	*	.	H	α-helix	trans	-59.6	-38.6	177.5	-178	173.3	-179.5	177.2	0	112.7	K239 L241 I245 N247	K239-K243 WeakPolarHBondContact O-CB 3.5Å; K239-K243 PolarHBondContact O-N 3.36Å; L241-K243 VanDerWaalsContact C-N 3.31Å; L241-K243 PolarHBondContact O-N 2.99Å; K243-I245 VanDerWaalsContact C-N 3.33Å; K243-N247 WeakPolarHBondContact CG-ND2 3.06Å; K243-N247 PolarHBondContact O-N 3.23Å; K243-N247 PolarHBondContact O-ND2 2.84Å
244	F	97.9	Very high	96	Very high	33 Å²	33	57.1 Å²	57.1	15%	0.145	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-45.7	178.2	-178.8	-86.7	0	0	0	110.1	F220 V229 I231 E240 L241 V242 N247 N248	F220-F244 HydrophobicContact CB-CE1 3.83Å; F220-F244 HydrophobicContact CD1-CE1 4.3Å; F220-F244 HydrophobicContact CD2-CD1 4.43Å; F220-F244 HydrophobicContact CD2-CE1 4.09Å; F220-F244 AromaticContact CG-CE1 3.83Å; F220-F244 HydrophobicContact CG-CE1 3.83Å; V229-F244 HydrophobicContact CG1-CZ 3.98Å; I231-F244 HydrophobicContact CD1-CD1 3.71Å; I231-F244 HydrophobicContact CD1-CE1 4.14Å; I231-F244 HydrophobicContact CD1-CG 4.22Å; I231-F244 HydrophobicContact CG1-CD1 3.77Å; I231-F244 HydrophobicContact CG1-CE1 3.76Å; I231-F244 HydrophobicContact CG1-CG 4.19Å; I231-F244 HydrophobicContact CG1-CZ 4.17Å; I231-F244 HydrophobicContact CG2-CB 4.21Å; I231-F244 HydrophobicContact CG2-CD1 4.35Å; I231-F244 HydrophobicContact CG2-CD2 3.97Å; I231-F244 HydrophobicContact CG2-CE2 4.46Å; I231-F244 HydrophobicContact CG2-CG 3.9Å; E240-F244 WeakPolarHBondContact O-CB 3.29Å; E240-F244 PolarHBondContact O-N 3.46Å; E240-F244 VanDerWaalsContact O-N 3.14Å; L241-F244 WeakPolarHBondContact O-CA 3.39Å; L241-F244 WeakPolarHBondContact O-CB 3.29Å; L241-F244 PolarHBondContact O-N 2.88Å; V242-F244 VanDerWaalsContact C-N 3.29Å; V242-F244 PolarHBondContact O-N 3.43Å; F244-N247 PolarHBondContact O-N 2.84Å; F244-N248 PolarHBondContact O-N 3.29Å; F244-N248 PolarHBondContact O-ND2 3.03Å
245	I	97.5	Very high	96.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-49.9	-178.7	-63.2	164.5	0	0	0	110.6	L171 F193 I197 F199 F220 L241 V242 K243 N247 N248 D249	L171-I245 HydrophobicContact CD1-CD1 4.16Å; L171-I245 HydrophobicContact CD1-CG1 4.44Å; L171-I245 HydrophobicContact CD2-CD1 3.73Å; L171-I245 HydrophobicContact CD2-CG1 3.99Å; F193-I245 HydrophobicContact CD1-CG2 3.94Å; F193-I245 HydrophobicContact CD2-CD1 3.93Å; F193-I245 HydrophobicContact CD2-CG2 4.23Å; F193-I245 HydrophobicContact CE1-CB 4.14Å; F193-I245 HydrophobicContact CE1-CG2 3.55Å; F193-I245 HydrophobicContact CE2-CB 3.9Å; F193-I245 HydrophobicContact CE2-CD1 3.58Å; F193-I245 HydrophobicContact CE2-CG1 4.36Å; F193-I245 HydrophobicContact CE2-CG2 3.9Å; F193-I245 HydrophobicContact CG-CG2 4.26Å; F193-I245 HydrophobicContact CZ-CB 3.62Å; F193-I245 HydrophobicContact CZ-CD1 4.22Å; F193-I245 HydrophobicContact CZ-CG2 3.54Å; I197-I245 HydrophobicContact CD1-CG2 3.33Å; F199-I245 HydrophobicContact CE1-CD1 4.05Å; F199-I245 HydrophobicContact CE2-CD1 4.23Å; F199-I245 HydrophobicContact CZ-CD1 3.36Å; F220-I245 HydrophobicContact CD2-CG1 4.45Å; F220-I245 HydrophobicContact CE2-CG1 4.43Å; L241-I245 WeakPolarHBondContact O-CG1 3.36Å; L241-I245 PolarHBondContact O-N 2.88Å; V242-I245 PolarHBondContact O-N 3.22Å; V242-I245 VanDerWaalsContact O-N 3.09Å; K243-I245 VanDerWaalsContact C-N 3.33Å; I245-N247 PolarHBondContact O-N 2.69Å; I245-N248 CarbonylContact O-C 3.32Å; I245-N248 PolarHBondContact O-N 2.76Å; I245-D249 WeakPolarHBondContact O-CB 3.47Å; I245-D249 PolarHBondContact O-N 2.91Å
246	E	96.2	Very high	96.9	Very high	108 Å²	108	51 Å²	51	51%	0.505	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-16.9	175.3	-69.3	173.3	159.1	0	0	114.8	F193 V242 D249	F193-E246 HydrophobicContact CE1-CG 4.3Å; F193-E246 HydrophobicContact CZ-CG 4.2Å; V242-E246 HydrophobicContact CG1-CG 4.17Å; V242-E246 WeakPolarHBondContact O-CG 3.39Å; V242-E246 PolarHBondContact O-N 2.97Å; E246-D249 WeakPolarHBondContact CA-OD2 3.09Å
247	N	95.5	Very high	96.9	Very high	110 Å²	110	51.8 Å²	51.8	59%	0.588	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-2.3	176.3	-74.1	-75.9	0	0	0	112.5	K243 F244 I245	K243-N247 WeakPolarHBondContact CG-ND2 3.06Å; K243-N247 PolarHBondContact O-N 3.23Å; K243-N247 PolarHBondContact O-ND2 2.84Å; F244-N247 PolarHBondContact O-N 2.84Å; I245-N247 PolarHBondContact O-N 2.69Å
248	N	95.3	Very high	96.9	Very high	66 Å²	66	50.6 Å²	50.6	35%	0.353	24%	0.239	S	C	.	.	S	Bend	trans	-141.3	18.3	-175.5	-57.3	-95.7	0	0	0	111.3	F220 F244 I245 R250	F220-N248 HydrophobicContact CE1-CB 4.14Å; F220-N248 HydrophobicContact CZ-CB 4.03Å; F220-N248 VanDerWaalsContact CZ-O 3.28Å; F220-N248 WeakPolarHBondContact CZ-O 3.18Å; F244-N248 PolarHBondContact O-N 3.29Å; F244-N248 PolarHBondContact O-ND2 3.03Å; I245-N248 CarbonylContact O-C 3.32Å; I245-N248 PolarHBondContact O-N 2.76Å; N248-R250 VanDerWaalsContact C-N 3.3Å
249	D	93.5	Very high	96.8	Very high	81 Å²	81	49.4 Å²	49.4	43%	0.433	24%	0.238	S	C	.	.			trans	-85.7	-1.3	-177.2	56.6	-6.9	0	0	0	113.2	I245 E246 P251	I245-D249 WeakPolarHBondContact O-CB 3.47Å; I245-D249 PolarHBondContact O-N 2.91Å; E246-D249 WeakPolarHBondContact CA-OD2 3.09Å; D249-P251 WeakPolarHBondContact O-CD 3.48Å
250	R	95.6	Very high	96.7	Very high	83 Å²	83	43 Å²	43	31%	0.313	21%	0.211	S	C	.	.	S	Bend	trans	-103.9	101.2	167.2	-171.6	-179.1	-66.4	-155.9	9	110.4	N248 D267 D268	N248-R250 VanDerWaalsContact C-N 3.3Å; R250-D267 VanDerWaalsContact CZ-CG 3.48Å; R250-D267 IonicContact CZ-OD1 2.74Å; R250-D267 IonicContact CZ-OD2 3.74Å; R250-D267 IonicContact NE-OD1 3.72Å; R250-D267 IonicContact NE-OD2 3.47Å; R250-D267 PolarHBondContact NE-OD2 3.43Å; R250-D267 PolarHBondContact NH1-O 3.09Å; R250-D267 IonicContact NH2-OD1 3.69Å; R250-D267 PolarHBondContact NH2-OD1 2.67Å; R250-D267 IonicContact NH2-OD2 2.81Å; R250-D267 PolarHBondContact NH2-OD2 2.83Å; R250-D268 VanDerWaalsContact NH1-C 3.33Å; R250-D268 PolarHBondContact NH1-O 3.5Å; R250-D268 PolarHBondContact NH2-O 3.49Å
251	P	96.4	Very high	96.5	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.058	19%	0.193	C	C	.	.			trans	-71	155.6	176	-21.1	35.4	0	0	0	113.3	I169 E222 S223 D249 L253 R254 S306	I169-P251 HydrophobicContact CD1-CG 3.75Å; I169-P251 HydrophobicContact CG1-CG 3.84Å; E222-P251 HydrophobicContact CG-CB 3.74Å; E222-P251 HydrophobicContact CG-CG 4.4Å; S223-P251 WeakPolarHBondContact OG-CB 3.34Å; S223-P251 WeakPolarHBondContact OG-CG 3.38Å; D249-P251 WeakPolarHBondContact O-CD 3.48Å; P251-L253 VanDerWaalsContact C-N 3.3Å; P251-L253 WeakPolarHBondContact CB-O 3.4Å; P251-L253 PolarHBondContact O-N 3.48Å; P251-R254 HydrophobicContact CB-CB 4.37Å; P251-R254 HydrophobicContact CG-CB 4.39Å; P251-S306 PolarHBondContact O-OG 2.82Å
252	T	97.7	Very high	96.3	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.031	22%	0.216	C	C	.	.	S	Bend	trans	-65.5	-34.9	173.4	-44.4	0	0	0	0	111.8	E222 A296 T300 L305 I307	E222-T252 VanDerWaalsContact OE1-CB 3.25Å; E222-T252 WeakPolarHBondContact OE1-CB 3.42Å; E222-T252 PolarHBondContact OE1-N 3.27Å; E222-T252 PolarHBondContact OE1-OG1 2.86Å; T252-A296 HydrophobicContact CG2-CB 4.07Å; T252-T300 WeakPolarHBondContact OG1-CA 3.12Å; T252-L305 HydrophobicContact CG2-CB 4.45Å; T252-L305 HydrophobicContact CG2-CD2 3.81Å; T252-L305 HydrophobicContact CG2-CG 3.96Å; T252-I307 PolarHBondContact O-N 3.26Å
253	L	98.3	Very high	96	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120.7	170.3	-179.9	65.5	0	0	0	108.3	S223 F224 P251 L292 K293 A296 I307 W309	S223-L253 PolarHBondContact OG-O 3.26Å; F224-L253 HydrophobicContact CB-CD2 4.1Å; F224-L253 HydrophobicContact CD2-CB 3.99Å; F224-L253 HydrophobicContact CD2-CD2 3.67Å; F224-L253 HydrophobicContact CD2-CG 3.6Å; F224-L253 VanDerWaalsContact CD2-O 3.32Å; F224-L253 WeakPolarHBondContact CD2-O 3.47Å; F224-L253 HydrophobicContact CE2-CD2 4.26Å; F224-L253 HydrophobicContact CE2-CG 4Å; F224-L253 HydrophobicContact CG-CD2 3.9Å; F224-L253 HydrophobicContact CG-CG 4.34Å; P251-L253 VanDerWaalsContact C-N 3.3Å; P251-L253 WeakPolarHBondContact CB-O 3.4Å; P251-L253 PolarHBondContact O-N 3.48Å; L253-L292 HydrophobicContact CD2-CB 4.37Å; L253-K293 HydrophobicContact CD2-CG 3.91Å; L253-A296 HydrophobicContact CB-CB 3.66Å; L253-A296 HydrophobicContact CD2-CB 4.42Å; L253-I307 WeakPolarHBondContact CA-O 3.36Å; L253-I307 HydrophobicContact CD1-CB 3.94Å; L253-I307 HydrophobicContact CD1-CG2 3.9Å; L253-W309 HydrophobicContact CD1-CB 4Å
254	R	97.2	Very high	95.7	Very high	14 Å²	14	42.1 Å²	42.1	5%	0.053	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	143.7	-179.1	58.4	-177.2	-176.5	-175.1	-1.3	110.2	P251 D267 S306 I307 L308 W309	P251-R254 HydrophobicContact CB-CB 4.37Å; P251-R254 HydrophobicContact CG-CB 4.39Å; R254-D267 IonicContact CZ-OD2 3.95Å; R254-D267 IonicContact NH1-OD2 3.46Å; R254-D267 PolarHBondContact NH1-OD2 3.46Å; R254-D267 PolarHBondContact NH2-O 2.78Å; R254-S306 PolarHBondContact NE-OG 3.49Å; R254-I307 PolarHBondContact N-O 3.23Å; R254-L308 HydrophobicContact CG-CD1 4.12Å; R254-W309 PolarHBondContact O-N 3.42Å
255	K	97.9	Very high	95.5	Very high	18 Å²	18	43.8 Å²	43.8	8%	0.078	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.7	179.3	-169.4	-177.6	-171.4	-178.6	0	110.2	E167 F224 K257 I264 W309 D314	E167-K255 HydrophobicContact CG-CD 4.25Å; E167-K255 WeakPolarHBondContact OE1-CD 3.28Å; E167-K255 IonicContact OE1-NZ 3.14Å; E167-K255 PolarHBondContact OE1-NZ 3.26Å; E167-K255 VanDerWaalsContact OE2-CD 3.31Å; E167-K255 WeakPolarHBondContact OE2-CD 3.49Å; E167-K255 IonicContact OE2-NZ 3.23Å; E167-K255 PolarHBondContact OE2-NZ 2.74Å; F224-K255 HydrophobicContact CE2-CB 4.41Å; F224-K255 HydrophobicContact CZ-CB 4.23Å; K255-K257 HydrophobicContact CD-CG 4.45Å; K255-K257 HydrophobicContact CG-CG 4.43Å; K255-I264 VanDerWaalsContact O-CD1 3.22Å; K255-I264 WeakPolarHBondContact O-CD1 3.47Å; K255-W309 CarbonylContact C-O 3.47Å; K255-W309 WeakPolarHBondContact CA-O 3.49Å; K255-W309 HydrophobicContact CB-CE3 3.98Å; K255-W309 HydrophobicContact CB-CZ3 4.42Å; K255-W309 HydrophobicContact CD-CE3 3.91Å; K255-W309 HydrophobicContact CD-CH2 4.07Å; K255-W309 HydrophobicContact CD-CZ3 3.6Å; K255-W309 HydrophobicContact CG-CD2 4.24Å; K255-W309 HydrophobicContact CG-CE3 3.73Å; K255-W309 HydrophobicContact CG-CZ3 3.98Å; K255-D314 WeakPolarHBondContact CE-OD2 3.45Å; K255-D314 IonicContact NZ-OD2 2.81Å; K255-D314 PolarHBondContact NZ-OD2 3.47Å
256	L	97.5	Very high	95.3	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.016	24%	0.241	C	C	.	.			trans	-72.8	125.6	167.3	-160.5	64.9	0	0	0	109.2	V261 I264 L308 W309 I310 F315	L256-V261 HydrophobicContact CD1-CB 4.38Å; L256-V261 HydrophobicContact CD1-CG2 4.06Å; L256-V261 HydrophobicContact CD2-CG2 4.13Å; L256-V261 HydrophobicContact CG-CG2 4.19Å; L256-I264 HydrophobicContact CD1-CB 3.84Å; L256-I264 HydrophobicContact CD1-CD1 4.45Å; L256-I264 HydrophobicContact CD1-CG2 3.74Å; L256-L308 HydrophobicContact CB-CD1 3.78Å; L256-L308 HydrophobicContact CB-CG 4.36Å; L256-L308 HydrophobicContact CD1-CD1 4.13Å; L256-L308 HydrophobicContact CD1-CD2 4.21Å; L256-L308 HydrophobicContact CD2-CD2 4.48Å; L256-L308 HydrophobicContact CG-CD1 4.5Å; L256-W309 PolarHBondContact N-O 2.74Å; L256-I310 HydrophobicContact CB-CG1 3.89Å; L256-I310 HydrophobicContact CD2-CD1 3.67Å; L256-I310 HydrophobicContact CD2-CG1 3.8Å; L256-I310 HydrophobicContact CD2-CG2 4.32Å; L256-F315 HydrophobicContact CB-CE2 4.17Å; L256-F315 HydrophobicContact CB-CZ 4.31Å; L256-F315 HydrophobicContact CD2-CE2 4.08Å; L256-F315 HydrophobicContact CD2-CZ 3.99Å; L256-F315 HydrophobicContact CG-CE2 4.06Å; L256-F315 HydrophobicContact CG-CZ 3.78Å
257	K	96.4	Very high	95.1	Very high	33 Å²	33	47 Å²	47	14%	0.143	23%	0.231	C	C	.	.			trans	-123	152.1	177	-60.1	178.1	178	-177	0	109.5	E167 D168 K255 S259 N260 V261	E167-K257 VanDerWaalsContact OE2-CE 3.29Å; E167-K257 WeakPolarHBondContact OE2-CE 3.3Å; E167-K257 IonicContact OE2-NZ 3.38Å; E167-K257 PolarHBondContact OE2-NZ 2.98Å; D168-K257 VanDerWaalsContact CG-NZ 3.27Å; D168-K257 IonicContact OD1-NZ 2.6Å; D168-K257 PolarHBondContact OD1-NZ 2.9Å; D168-K257 IonicContact OD2-NZ 2.85Å; D168-K257 PolarHBondContact OD2-NZ 2.79Å; K255-K257 HydrophobicContact CD-CG 4.45Å; K255-K257 HydrophobicContact CG-CG 4.43Å; K257-S259 PolarHBondContact O-N 2.93Å; K257-N260 WeakPolarHBondContact CA-OD1 3.3Å; K257-N260 WeakPolarHBondContact CB-OD1 3.3Å; K257-N260 PolarHBondContact N-OD1 3.36Å; K257-N260 PolarHBondContact O-N 3.31Å; K257-N260 VanDerWaalsContact O-N 3.09Å; K257-N260 PolarHBondContact O-OD1 2.98Å; K257-V261 PolarHBondContact O-N 3.1Å; K257-V261 VanDerWaalsContact O-N 3.14Å
258	P	96.8	Very high	95	Very high	27 Å²	27	44.4 Å²	44.4	18%	0.175	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.5	175.8	-29.4	37	0	0	0	113.4	G131 E132 T137 F315	G131-P258 CarbonylContact C-O 3.6Å; G131-P258 VanDerWaalsContact CA-O 3.27Å; G131-P258 WeakPolarHBondContact CA-O 3.41Å; E132-P258 HydrophobicContact CG-CB 4.36Å; E132-P258 PolarHBondContact N-O 3.45Å; T137-P258 HydrophobicContact CG2-CB 3.72Å; P258-F315 HydrophobicContact CB-CE1 4.42Å; P258-F315 HydrophobicContact CG-CE1 4.05Å; P258-F315 HydrophobicContact CG-CZ 4.17Å
259	S	95.1	Very high	94.8	Very high	36 Å²	36	43.5 Å²	43.5	25%	0.252	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-11.3	-178.7	60	0	0	0	0	115.4	G131 K257	G131-S259 WeakPolarHBondContact CA-O 3.16Å; K257-S259 PolarHBondContact O-N 2.93Å
260	N	94.3	Very high	94.7	Very high	24 Å²	24	43.3 Å²	43.3	13%	0.128	23%	0.231	C	C	.	.	S	Bend	trans	-138	18.3	-175.6	68.2	4.6	0	0	0	113.1	D130 K257 Y262 E263 I264	D130-N260 CarbonylContact O-C 3.59Å; K257-N260 WeakPolarHBondContact CA-OD1 3.3Å; K257-N260 WeakPolarHBondContact CB-OD1 3.3Å; K257-N260 PolarHBondContact N-OD1 3.36Å; K257-N260 PolarHBondContact O-N 3.31Å; K257-N260 VanDerWaalsContact O-N 3.09Å; K257-N260 PolarHBondContact O-OD1 2.98Å; N260-Y262 VanDerWaalsContact C-N 3.29Å; N260-Y262 PolarHBondContact O-N 2.54Å; N260-E263 HydrophobicContact CB-CB 4.44Å; N260-E263 PolarHBondContact O-N 2.93Å; N260-I264 HydrophobicContact CB-CD1 4.49Å; N260-I264 HydrophobicContact CB-CG1 4.48Å; N260-I264 VanDerWaalsContact CG-CD1 3.5Å; N260-I264 VanDerWaalsContact ND2-CD1 3.3Å; N260-I264 WeakPolarHBondContact ND2-CD1 3.4Å; N260-I264 PolarHBondContact O-N 2.95Å; N260-I264 WeakPolarHBondContact OD1-CD1 3.48Å
261	V	94.3	Very high	94.5	Very high	16 Å²	16	40.8 Å²	40.8	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-40.9	-171.7	65.4	0	0	0	0	112.5	D130 E132 L256 K257 W265 F315	D130-V261 PolarHBondContact O-N 3.08Å; E132-V261 HydrophobicContact CG-CG1 3.9Å; L256-V261 HydrophobicContact CD1-CB 4.38Å; L256-V261 HydrophobicContact CD1-CG2 4.06Å; L256-V261 HydrophobicContact CD2-CG2 4.13Å; L256-V261 HydrophobicContact CG-CG2 4.19Å; K257-V261 PolarHBondContact O-N 3.1Å; K257-V261 VanDerWaalsContact O-N 3.14Å; V261-W265 WeakPolarHBondContact O-CB 3.18Å; V261-W265 PolarHBondContact O-N 3.45Å; V261-W265 VanDerWaalsContact O-N 3.12Å; V261-F315 HydrophobicContact CB-CE1 4.41Å; V261-F315 HydrophobicContact CG2-CE1 4.21Å
262	Y	92.7	Very high	94.4	Very high	125 Å²	125	43.1 Å²	43.1	49%	0.49	24%	0.241	S	C	.	.	H	α-helix	trans	-79.6	-40.4	-178.4	-56.5	-63.2	0	0	0	111.2	D130 G131 N260 I264 W265 D266	D130-Y262 WeakPolarHBondContact O-CB 3.42Å; D130-Y262 PolarHBondContact O-N 3.16Å; G131-Y262 WeakPolarHBondContact O-CE2 3.49Å; N260-Y262 VanDerWaalsContact C-N 3.29Å; N260-Y262 PolarHBondContact O-N 2.54Å; Y262-I264 VanDerWaalsContact C-N 3.31Å; Y262-I264 PolarHBondContact O-N 3.33Å; Y262-W265 PolarHBondContact O-N 3.19Å; Y262-D266 WeakPolarHBondContact O-CB 3.32Å; Y262-D266 PolarHBondContact O-N 3.46Å
263	E	91.5	Very high	94.4	Very high	80 Å²	80	43 Å²	43	37%	0.374	24%	0.24	S	C	.	.	H	α-helix	trans	-53.1	-48.2	173.6	-177.7	-172.6	174.3	0	0	111.5	D130 H196 N260 D267	D130-E263 HydrophobicContact CB-CB 3.98Å; D130-E263 PolarHBondContact O-N 2.95Å; H196-E263 IonicContact CE1-OE2 2.8Å; H196-E263 PolarHBondContact CE1-OE2 3.45Å; H196-E263 IonicContact ND1-OE1 3.26Å; H196-E263 IonicContact ND1-OE2 3.5Å; H196-E263 PolarHBondContact ND1-OE2 3.38Å; N260-E263 HydrophobicContact CB-CB 4.44Å; N260-E263 PolarHBondContact O-N 2.93Å; E263-D267 WeakPolarHBondContact O-CB 3.45Å
264	I	92.9	Very high	94.4	Very high	14 Å²	14	43.7 Å²	43.7	7%	0.072	24%	0.244	C	C	.	.	H	α-helix	trans	-74	-38.4	-178.2	-70.6	-174.7	0	0	0	111.9	K255 L256 N260 Y262 D267 H273 L308	K255-I264 VanDerWaalsContact O-CD1 3.22Å; K255-I264 WeakPolarHBondContact O-CD1 3.47Å; L256-I264 HydrophobicContact CD1-CB 3.84Å; L256-I264 HydrophobicContact CD1-CD1 4.45Å; L256-I264 HydrophobicContact CD1-CG2 3.74Å; N260-I264 HydrophobicContact CB-CD1 4.49Å; N260-I264 HydrophobicContact CB-CG1 4.48Å; N260-I264 VanDerWaalsContact CG-CD1 3.5Å; N260-I264 VanDerWaalsContact ND2-CD1 3.3Å; N260-I264 WeakPolarHBondContact ND2-CD1 3.4Å; N260-I264 PolarHBondContact O-N 2.95Å; N260-I264 WeakPolarHBondContact OD1-CD1 3.48Å; Y262-I264 VanDerWaalsContact C-N 3.31Å; Y262-I264 PolarHBondContact O-N 3.33Å; I264-D267 PolarHBondContact O-N 3.48Å; I264-H273 PolarHBondContact O-CE1 2.96Å; I264-L308 HydrophobicContact CG2-CD1 3.42Å; I264-L308 VanDerWaalsContact CG2-CD1 3.42Å; I264-L308 HydrophobicContact CG2-CD2 4.07Å; I264-L308 HydrophobicContact CG2-CG 4.36Å
265	W	93.1	Very high	94.4	Very high	68 Å²	68	43 Å²	43	26%	0.258	24%	0.241	S	C	.	.	H	α-helix	trans	-72.2	-34.4	-176.7	-167.7	-92.6	0	0	0	112.6	V261 Y262 D267 H273 L308 I338	V261-W265 WeakPolarHBondContact O-CB 3.18Å; V261-W265 PolarHBondContact O-N 3.45Å; V261-W265 VanDerWaalsContact O-N 3.12Å; Y262-W265 PolarHBondContact O-N 3.19Å; W265-D267 PolarHBondContact O-N 3.06Å; W265-H273 PolarHBondContact O-CE1 2.89Å; W265-H273 PolarHBondContact O-NE2 3.34Å; W265-L308 HydrophobicContact CE3-CD2 4.18Å; W265-L308 HydrophobicContact CZ3-CD2 4.27Å; W265-I338 HydrophobicContact CH2-CD1 4.27Å; W265-I338 HydrophobicContact CH2-CG2 4.17Å; W265-I338 HydrophobicContact CZ2-CG2 4.46Å
266	D	92.4	Very high	94.4	Very high	119 Å²	119	42.1 Å²	42.1	64%	0.636	24%	0.237	S	C	*	.	S	Bend	trans	-77	-10.2	176.4	-70.3	-12.5	0	0	0	112.7	Y262 D268	Y262-D266 WeakPolarHBondContact O-CB 3.32Å; Y262-D266 PolarHBondContact O-N 3.46Å; D266-D268 PolarHBondContact O-N 2.8Å
267	D	93.8	Very high	94.5	Very high	57 Å²	57	42.1 Å²	42.1	31%	0.305	24%	0.237	S	C	.	.	S	Bend	trans	-95.5	54.2	179.8	-168.6	54.3	0	0	0	112.4	R250 R254 E263 I264 W265	R250-D267 VanDerWaalsContact CZ-CG 3.48Å; R250-D267 IonicContact CZ-OD1 2.74Å; R250-D267 IonicContact CZ-OD2 3.74Å; R250-D267 IonicContact NE-OD1 3.72Å; R250-D267 IonicContact NE-OD2 3.47Å; R250-D267 PolarHBondContact NE-OD2 3.43Å; R250-D267 PolarHBondContact NH1-O 3.09Å; R250-D267 IonicContact NH2-OD1 3.69Å; R250-D267 PolarHBondContact NH2-OD1 2.67Å; R250-D267 IonicContact NH2-OD2 2.81Å; R250-D267 PolarHBondContact NH2-OD2 2.83Å; R254-D267 IonicContact CZ-OD2 3.95Å; R254-D267 IonicContact NH1-OD2 3.46Å; R254-D267 PolarHBondContact NH1-OD2 3.46Å; R254-D267 PolarHBondContact NH2-O 2.78Å; E263-D267 WeakPolarHBondContact O-CB 3.45Å; I264-D267 PolarHBondContact O-N 3.48Å; W265-D267 PolarHBondContact O-N 3.06Å
268	D	93	Very high	94.5	Very high	54 Å²	54	40.6 Å²	40.6	29%	0.289	23%	0.231	S	C	.	.			trans	-67.9	161.2	-179.9	72	78.4	0	0	0	113.8	R250 D266 G270 G271 H273 A340	R250-D268 VanDerWaalsContact NH1-C 3.33Å; R250-D268 PolarHBondContact NH1-O 3.5Å; R250-D268 PolarHBondContact NH2-O 3.49Å; D266-D268 PolarHBondContact O-N 2.8Å; D268-G270 PolarHBondContact OD1-N 3.09Å; D268-G271 WeakPolarHBondContact OD1-CA 3.47Å; D268-G271 PolarHBondContact OD1-N 2.86Å; D268-H273 VanDerWaalsContact CA-CE1 3.45Å; D268-H273 WeakPolarHBondContact CA-CE1 3.27Å; D268-A340 HydrophobicContact CB-CB 4.33Å
269	V	91.4	Very high	94.6	Very high	47 Å²	47	42.3 Å²	42.3	29%	0.285	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-105.8	91.7	170.2	-174.5	0	0	0	0	108.8	E272	V269-E272 PolarHBondContact N-O 2.86Å
270	G	89.8	Confident	94.6	Very high	78 Å²	78	44.5 Å²	44.5	80%	0.804	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.2	22.1	170.7	0	0	0	0	0	114.8	D268	D268-G270 PolarHBondContact OD1-N 3.09Å
271	G	92.3	Very high	94.6	Very high	30 Å²	30	47.4 Å²	47.4	31%	0.309	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.5	-4.3	-176.5	0	0	0	0	0	113.6	D268 A340	D268-G271 WeakPolarHBondContact OD1-CA 3.47Å; D268-G271 PolarHBondContact OD1-N 2.86Å; G271-A340 VanDerWaalsContact O-CB 3.31Å; G271-A340 WeakPolarHBondContact O-CB 3.49Å; G271-A340 PolarHBondContact O-N 3.47Å
272	E	94.5	Very high	94.6	Very high	57 Å²	57	49.2 Å²	49.2	27%	0.266	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	155.2	-167.9	-68.3	163.4	-155.8	0	0	112.9	V269 V337 I338 E339	V269-E272 PolarHBondContact N-O 2.86Å; E272-V337 HydrophobicContact CB-CG1 3.98Å; E272-V337 HydrophobicContact CG-CG1 4.12Å; E272-I338 CarbonylContact C-O 3.53Å; E272-I338 WeakPolarHBondContact CA-O 3.33Å; E272-E339 HydrophobicContact CG-CG 4.41Å
273	H	96.9	Very high	94.7	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.019	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.3	167	-70	-79.1	0	0	0	110.9	I264 W265 D268 V275 V337 I338	I264-H273 PolarHBondContact O-CE1 2.96Å; W265-H273 PolarHBondContact O-CE1 2.89Å; W265-H273 PolarHBondContact O-NE2 3.34Å; D268-H273 VanDerWaalsContact CA-CE1 3.45Å; D268-H273 WeakPolarHBondContact CA-CE1 3.27Å; H273-V275 HydrophobicContact CB-CG2 3.81Å; H273-V275 PolarHBondContact O-N 2.84Å; H273-V337 CarbonylContact O-C 3.44Å; H273-V337 WeakPolarHBondContact O-CA 3.37Å; H273-I338 PolarHBondContact N-O 2.93Å; H273-I338 PolarHBondContact O-N 3.33Å
274	I	98.1	Very high	94.8	Very high	13 Å²	13	49.3 Å²	49.3	7%	0.067	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	113.2	163.5	-59.3	171.4	0	0	0	107	L305 I307 L308 I335 G336 V337 W365 L366 V369 L370	I274-L305 HydrophobicContact CD1-CD1 3.91Å; I274-I307 HydrophobicContact CG2-CG1 4.13Å; I274-I307 HydrophobicContact CG2-CG2 4.36Å; I274-I307 WeakPolarHBondContact O-CA 3.47Å; I274-L308 PolarHBondContact O-N 3.22Å; I274-I335 HydrophobicContact CG2-CD1 4.44Å; I274-I335 HydrophobicContact CG2-CG1 4.41Å; I274-G336 CarbonylContact C-O 3.57Å; I274-G336 WeakPolarHBondContact CA-O 3.25Å; I274-V337 HydrophobicContact CG1-CG2 4.48Å; I274-W365 HydrophobicContact CG2-CZ3 4.47Å; I274-L366 HydrophobicContact CD1-CD2 3.95Å; I274-L366 HydrophobicContact CG2-CD2 3.68Å; I274-V369 HydrophobicContact CD1-CG1 4.07Å; I274-V369 HydrophobicContact CG1-CG1 4.21Å; I274-L370 HydrophobicContact CD1-CD2 4.19Å
275	V	98.3	Very high	95	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.3	-174.2	179.6	0	0	0	0	110.5	H273 F277 L308 I310 I335 G336 I338 W347	H273-V275 HydrophobicContact CB-CG2 3.81Å; H273-V275 PolarHBondContact O-N 2.84Å; V275-F277 HydrophobicContact CG1-CD2 4.17Å; V275-F277 HydrophobicContact CG1-CE2 3.9Å; V275-F277 HydrophobicContact CG1-CZ 4.23Å; V275-L308 CarbonylContact C-O 3.53Å; V275-L308 WeakPolarHBondContact CA-O 3.1Å; V275-L308 HydrophobicContact CG2-CB 4.33Å; V275-L308 HydrophobicContact CG2-CD2 4.32Å; V275-I310 HydrophobicContact CG1-CD1 3.56Å; V275-I310 HydrophobicContact CG1-CG1 4.04Å; V275-I335 CarbonylContact O-C 3.59Å; V275-I335 VanDerWaalsContact O-CA 3.29Å; V275-I335 WeakPolarHBondContact O-CA 3.36Å; V275-G336 PolarHBondContact N-O 3.27Å; V275-G336 PolarHBondContact O-N 3.49Å; V275-I338 HydrophobicContact CB-CD1 3.97Å; V275-I338 HydrophobicContact CB-CG1 4.41Å; V275-I338 HydrophobicContact CG1-CD1 4.35Å; V275-I338 HydrophobicContact CG2-CD1 3.66Å; V275-I338 HydrophobicContact CG2-CG1 4.09Å; V275-W347 HydrophobicContact CB-CH2 4.38Å; V275-W347 HydrophobicContact CG1-CH2 4.39Å
276	A	98.5	Very high	95.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	119.6	172.6	0	0	0	0	0	110.5	F288 L292 I307 L308 W309 I310 Q334 I335	A276-F288 HydrophobicContact CB-CE1 4.36Å; A276-L292 HydrophobicContact CB-CD1 3.54Å; A276-L292 HydrophobicContact CB-CD2 4.47Å; A276-I307 HydrophobicContact CB-CG2 4.03Å; A276-L308 PolarHBondContact N-O 3.09Å; A276-W309 CarbonylContact O-C 3.47Å; A276-W309 WeakPolarHBondContact O-CA 3.34Å; A276-I310 PolarHBondContact O-N 3.05Å; A276-Q334 CarbonylContact C-O 3.44Å; A276-Q334 VanDerWaalsContact CA-O 3.25Å; A276-Q334 WeakPolarHBondContact CA-O 3.41Å; A276-I335 HydrophobicContact CB-CB 4.41Å; A276-I335 HydrophobicContact CB-CD1 4.44Å; A276-I335 HydrophobicContact CB-CG1 4.19Å
277	F	98.4	Very high	95.3	Very high	2 Å²	2	49 Å²	49	1%	0.009	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	124.9	171.5	-71.7	-78.7	0	0	0	110.1	V275 I310 P312 W322 F326 I328 L330 P333 Q334 W347	V275-F277 HydrophobicContact CG1-CD2 4.17Å; V275-F277 HydrophobicContact CG1-CE2 3.9Å; V275-F277 HydrophobicContact CG1-CZ 4.23Å; F277-I310 WeakPolarHBondContact CA-O 3.43Å; F277-I310 HydrophobicContact CD1-CB 3.67Å; F277-I310 HydrophobicContact CD1-CD1 4.47Å; F277-I310 HydrophobicContact CD1-CG2 3.89Å; F277-I310 HydrophobicContact CE1-CB 3.7Å; F277-I310 HydrophobicContact CE1-CD1 3.75Å; F277-I310 HydrophobicContact CE1-CG1 4.27Å; F277-I310 HydrophobicContact CE1-CG2 3.64Å; F277-I310 HydrophobicContact CZ-CD1 3.9Å; F277-P312 HydrophobicContact CB-CG 4.47Å; F277-P312 HydrophobicContact CD1-CG 4.12Å; F277-W322 HydrophobicContact CE1-CD2 4.01Å; F277-W322 AromaticContact CE1-CE3 3.65Å; F277-W322 HydrophobicContact CE1-CE3 3.65Å; F277-W322 HydrophobicContact CE1-CH2 4.38Å; F277-W322 AromaticContact CE1-CZ3 3.86Å; F277-W322 HydrophobicContact CE1-CZ3 3.86Å; F277-W322 HydrophobicContact CZ-CB 4.36Å; F277-W322 AromaticContact CZ-CD2 3.94Å; F277-W322 HydrophobicContact CZ-CD2 3.94Å; F277-W322 HydrophobicContact CZ-CE3 4.06Å; F277-W322 HydrophobicContact CZ-CG 4.11Å; F277-F326 HydrophobicContact CE2-CD2 4.44Å; F277-F326 HydrophobicContact CZ-CE2 4.49Å; F277-I328 HydrophobicContact CD2-CD1 3.9Å; F277-I328 HydrophobicContact CE2-CD1 3.85Å; F277-L330 HydrophobicContact CB-CD2 3.61Å; F277-L330 HydrophobicContact CD1-CD1 4.36Å; F277-L330 HydrophobicContact CD1-CD2 3.77Å; F277-L330 HydrophobicContact CD2-CD2 3.54Å; F277-L330 HydrophobicContact CE1-CD1 4.28Å; F277-L330 HydrophobicContact CE1-CD2 4.27Å; F277-L330 HydrophobicContact CE2-CD2 4.06Å; F277-L330 HydrophobicContact CG-CD2 3.37Å; F277-L330 HydrophobicContact CZ-CD2 4.41Å; F277-P333 VanDerWaalsContact O-CA 3.28Å; F277-P333 WeakPolarHBondContact O-CA 3.31Å; F277-Q334 HydrophobicContact CB-CB 4.2Å; F277-Q334 HydrophobicContact CD2-CB 4.4Å; F277-Q334 PolarHBondContact N-O 3.34Å; F277-Q334 PolarHBondContact O-N 3.37Å; F277-W347 AromaticContact CD2-CH2 3.7Å; F277-W347 HydrophobicContact CD2-CH2 3.7Å; F277-W347 AromaticContact CD2-CZ3 3.84Å; F277-W347 HydrophobicContact CD2-CZ3 3.84Å; F277-W347 AromaticContact CE2-CH2 3.49Å; F277-W347 HydrophobicContact CE2-CH2 3.49Å; F277-W347 VanDerWaalsContact CE2-CH2 3.49Å; F277-W347 HydrophobicContact CE2-CZ2 4.3Å; F277-W347 HydrophobicContact CE2-CZ3 4.13Å
278	A	97.5	Very high	95.4	Very high	2 Å²	2	46.2 Å²	46.2	2%	0.017	27%	0.271	C	S	.	.			trans	-156.2	124.2	174.3	0	0	0	0	0	111.2	E280 F288 W309 I310	A278-E280 PolarHBondContact O-N 3.16Å; A278-F288 HydrophobicContact CB-CD1 4.06Å; A278-W309 PolarHBondContact O-NE1 3.13Å; A278-I310 PolarHBondContact N-O 3.04Å; A278-I310 VanDerWaalsContact N-O 3.09Å
279	E	96.9	Very high	95.6	Very high	63 Å²	63	43.8 Å²	43.8	29%	0.294	26%	0.258	S	S	.	.			trans	-76.7	114.8	173	-174.6	-170.8	150.2	0	0	109.5	A281 D282 G285 D311	E279-A281 HydrophobicContact CG-CB 4.23Å; E279-A281 PolarHBondContact O-N 3.3Å; E279-D282 HydrophobicContact CB-CB 4.04Å; E279-D282 HydrophobicContact CG-CB 4.21Å; E279-D282 PolarHBondContact O-N 3.29Å; E279-G285 CarbonylContact O-C 3.53Å; E279-G285 WeakPolarHBondContact O-CA 3.38Å; E279-D311 WeakPolarHBondContact CA-OD1 3.27Å
280	E	95.4	Very high	95.9	Very high	82 Å²	82	45.9 Å²	45.9	38%	0.383	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-30.2	-178.7	-169.9	-174.6	-168.4	0	0	111.8	A278 D282 F286 L289 W309 D311	A278-E280 PolarHBondContact O-N 3.16Å; E280-D282 VanDerWaalsContact C-N 3.32Å; E280-F286 HydrophobicContact CG-CD2 4.49Å; E280-L289 HydrophobicContact CG-CD2 4.21Å; E280-W309 HydrophobicContact CB-CH2 4.23Å; E280-W309 HydrophobicContact CB-CZ2 4.02Å; E280-D311 PolarHBondContact N-OD2 3.13Å
281	A	94.9	Very high	96.2	Very high	85 Å²	85	43.7 Å²	43.7	70%	0.702	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.1	-178.9	0	0	0	0	0	113.6	E279	E279-A281 HydrophobicContact CG-CB 4.23Å; E279-A281 PolarHBondContact O-N 3.3Å
282	D	95.2	Very high	96.5	Very high	54 Å²	54	42.2 Å²	42.2	29%	0.289	22%	0.218	S	C	.	.	S	Bend	trans	-84.6	152	175.6	-179.6	58.8	0	0	0	112.1	E279 E280 D284 G285 F286	E279-D282 HydrophobicContact CB-CB 4.04Å; E279-D282 HydrophobicContact CG-CB 4.21Å; E279-D282 PolarHBondContact O-N 3.29Å; E280-D282 VanDerWaalsContact C-N 3.32Å; D282-D284 WeakPolarHBondContact OD2-CA 3.42Å; D282-D284 WeakPolarHBondContact OD2-CB 3.41Å; D282-D284 PolarHBondContact OD2-N 3.08Å; D282-G285 PolarHBondContact OD2-N 3.31Å; D282-F286 WeakPolarHBondContact O-CB 3.45Å; D282-F286 PolarHBondContact O-N 3.44Å
283	I	93.8	Very high	96.6	Very high	135 Å²	135	40.8 Å²	40.8	69%	0.692	21%	0.211	S	C	*	.	H	α-helix	trans	-67.4	-44.3	-177.9	-63.6	175	0	0	0	111.3	E287	I283-E287 PolarHBondContact O-N 2.97Å; I283-E287 VanDerWaalsContact O-N 3.08Å
284	D	94	Very high	96.7	Very high	72 Å²	72	45.1 Å²	45.1	39%	0.385	23%	0.231	S	C	.	.	H	α-helix	trans	-75.5	-40.1	-177.2	-61.2	-27	0	0	0	109.2	D282 E287 F288 P333 L356	D282-D284 WeakPolarHBondContact OD2-CA 3.42Å; D282-D284 WeakPolarHBondContact OD2-CB 3.41Å; D282-D284 PolarHBondContact OD2-N 3.08Å; D284-E287 PolarHBondContact O-N 3.01Å; D284-F288 WeakPolarHBondContact O-CB 3.35Å; D284-F288 PolarHBondContact O-N 3.26Å; D284-P333 HydrophobicContact CB-CG 4.23Å; D284-L356 HydrophobicContact CB-CD1 4.25Å; D284-L356 WeakPolarHBondContact O-CD1 3.45Å
285	G	95.9	Very high	96.6	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-45.9	171.5	0	0	0	0	0	113.3	E279 D282 E287 F288 L289	E279-G285 CarbonylContact O-C 3.53Å; E279-G285 WeakPolarHBondContact O-CA 3.38Å; D282-G285 PolarHBondContact OD2-N 3.31Å; G285-E287 PolarHBondContact O-N 2.89Å; G285-F288 PolarHBondContact O-N 2.87Å; G285-L289 WeakPolarHBondContact O-CB 3.25Å; G285-L289 PolarHBondContact O-N 3.05Å
286	F	95.9	Very high	96.6	Very high	97 Å²	97	44.5 Å²	44.5	43%	0.425	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-42.8	175	-179.2	-95.7	0	0	0	113	E280 D282 H290	E280-F286 HydrophobicContact CG-CD2 4.49Å; D282-F286 WeakPolarHBondContact O-CB 3.45Å; D282-F286 PolarHBondContact O-N 3.44Å; F286-H290 AromaticContact CD1-CD2 3.77Å; F286-H290 AromaticContact CE1-CD2 3.3Å; F286-H290 WeakPolarHBondContact CE1-CD2 2.98Å; F286-H290 AromaticContact CE1-NE2 3.39Å; F286-H290 WeakPolarHBondContact CE1-NE2 3.38Å; F286-H290 AromaticContact CE2-CD2 3.89Å; F286-H290 AromaticContact CE2-NE2 3.59Å; F286-H290 AromaticContact CZ-CD2 3.38Å; F286-H290 WeakPolarHBondContact CZ-CD2 3.39Å; F286-H290 AromaticContact CZ-NE2 2.98Å; F286-H290 WeakPolarHBondContact CZ-NE2 3.3Å; F286-H290 PolarHBondContact O-CD2 3.37Å; F286-H290 PolarHBondContact O-N 2.95Å; F286-H290 VanDerWaalsContact O-N 3.16Å
287	E	95.9	Very high	96.5	Very high	94 Å²	94	48.3 Å²	48.3	44%	0.439	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-44.6	176.2	-178.8	176	156.5	0	0	111.3	I283 D284 G285 H290 K291 L356	I283-E287 PolarHBondContact O-N 2.97Å; I283-E287 VanDerWaalsContact O-N 3.08Å; D284-E287 PolarHBondContact O-N 3.01Å; G285-E287 PolarHBondContact O-N 2.89Å; E287-H290 WeakPolarHBondContact O-CB 3.38Å; E287-H290 PolarHBondContact O-N 3.49Å; E287-K291 PolarHBondContact O-N 3.29Å; E287-K291 WeakPolarHBondContact OE1-CE 3.5Å; E287-K291 IonicContact OE1-NZ 3.84Å; E287-K291 PolarHBondContact OE1-NZ 2.8Å; E287-L356 HydrophobicContact CB-CD1 3.96Å; E287-L356 HydrophobicContact CG-CD1 4.04Å
288	F	97.1	Very high	96.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.5	-46.7	179.1	-170.8	-111.5	0	0	0	111.8	A276 A278 D284 G285 H290 K291 L292 P333 I335 I350 L356 P357 L362	A276-F288 HydrophobicContact CB-CE1 4.36Å; A278-F288 HydrophobicContact CB-CD1 4.06Å; D284-F288 WeakPolarHBondContact O-CB 3.35Å; D284-F288 PolarHBondContact O-N 3.26Å; G285-F288 PolarHBondContact O-N 2.87Å; F288-H290 VanDerWaalsContact C-N 3.27Å; F288-H290 PolarHBondContact O-N 3.02Å; F288-K291 WeakPolarHBondContact O-CA 3.33Å; F288-K291 WeakPolarHBondContact O-CB 3.4Å; F288-K291 PolarHBondContact O-N 3.13Å; F288-L292 HydrophobicContact CD1-CD1 3.82Å; F288-L292 HydrophobicContact CD1-CG 4.23Å; F288-L292 HydrophobicContact CE1-CD1 3.69Å; F288-L292 HydrophobicContact CE1-CD2 4.25Å; F288-L292 HydrophobicContact CE1-CG 4.09Å; F288-L292 HydrophobicContact CZ-CD2 4.29Å; F288-L292 HydrophobicContact CZ-CG 4.5Å; F288-L292 PolarHBondContact O-N 3.32Å; F288-P333 HydrophobicContact CB-CB 3.82Å; F288-P333 HydrophobicContact CB-CG 3.98Å; F288-P333 HydrophobicContact CD1-CB 3.6Å; F288-P333 HydrophobicContact CD2-CB 4.19Å; F288-P333 HydrophobicContact CE1-CB 4.13Å; F288-P333 HydrophobicContact CG-CB 3.61Å; F288-P333 HydrophobicContact CG-CG 4.32Å; F288-I335 HydrophobicContact CE1-CB 4.48Å; F288-I335 HydrophobicContact CZ-CB 4.01Å; F288-I335 HydrophobicContact CZ-CG2 4.07Å; F288-I350 HydrophobicContact CE2-CD1 4.24Å; F288-I350 HydrophobicContact CZ-CD1 4.34Å; F288-L356 HydrophobicContact CB-CD1 4.14Å; F288-L356 HydrophobicContact CD2-CD2 4.3Å; F288-P357 HydrophobicContact CD2-CG 4.41Å; F288-P357 HydrophobicContact CE2-CG 3.82Å; F288-L362 HydrophobicContact CE2-CD1 4.22Å; F288-L362 HydrophobicContact CE2-CD2 3.98Å; F288-L362 HydrophobicContact CZ-CD2 4.17Å
289	L	97.2	Very high	96.3	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-57.2	-40.9	175.8	178.7	62.3	0	0	0	111.8	E280 G285 K291 L292 K293 W309	E280-L289 HydrophobicContact CG-CD2 4.21Å; G285-L289 WeakPolarHBondContact O-CB 3.25Å; G285-L289 PolarHBondContact O-N 3.05Å; L289-K291 VanDerWaalsContact C-N 3.28Å; L289-K291 PolarHBondContact O-N 2.97Å; L289-L292 PolarHBondContact O-N 3.44Å; L289-K293 WeakPolarHBondContact O-CG 3.28Å; L289-K293 PolarHBondContact O-N 3.06Å; L289-W309 HydrophobicContact CD1-CD2 3.6Å; L289-W309 HydrophobicContact CD1-CE3 3.7Å; L289-W309 HydrophobicContact CD1-CG 4.07Å; L289-W309 HydrophobicContact CD1-CH2 4.35Å; L289-W309 HydrophobicContact CD1-CZ2 4.27Å; L289-W309 HydrophobicContact CD1-CZ3 4.07Å; L289-W309 HydrophobicContact CD2-CD2 4.46Å; L289-W309 HydrophobicContact CD2-CE3 4.33Å; L289-W309 HydrophobicContact CD2-CH2 3.48Å; L289-W309 VanDerWaalsContact CD2-CH2 3.48Å; L289-W309 HydrophobicContact CD2-CZ2 3.63Å; L289-W309 HydrophobicContact CD2-CZ3 3.85Å
290	H	96.5	Very high	96.1	Very high	92 Å²	92	54 Å²	54	43%	0.426	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-34.7	175.6	-95	-64.3	0	0	0	113.5	F286 E287 F288 Q294	F286-H290 AromaticContact CD1-CD2 3.77Å; F286-H290 AromaticContact CE1-CD2 3.3Å; F286-H290 WeakPolarHBondContact CE1-CD2 2.98Å; F286-H290 AromaticContact CE1-NE2 3.39Å; F286-H290 WeakPolarHBondContact CE1-NE2 3.38Å; F286-H290 AromaticContact CE2-CD2 3.89Å; F286-H290 AromaticContact CE2-NE2 3.59Å; F286-H290 AromaticContact CZ-CD2 3.38Å; F286-H290 WeakPolarHBondContact CZ-CD2 3.39Å; F286-H290 AromaticContact CZ-NE2 2.98Å; F286-H290 WeakPolarHBondContact CZ-NE2 3.3Å; F286-H290 PolarHBondContact O-CD2 3.37Å; F286-H290 PolarHBondContact O-N 2.95Å; F286-H290 VanDerWaalsContact O-N 3.16Å; E287-H290 WeakPolarHBondContact O-CB 3.38Å; E287-H290 PolarHBondContact O-N 3.49Å; F288-H290 VanDerWaalsContact C-N 3.27Å; F288-H290 PolarHBondContact O-N 3.02Å; H290-Q294 PolarHBondContact O-N 3.24Å
291	K	97.8	Very high	96	Very high	31 Å²	31	57.8 Å²	57.8	14%	0.135	30%	0.303	C	S	.	.	H	α-helix	trans	-69.9	-43	174	-63.2	175.5	-177.6	172.7	0	110.8	E287 F288 L289 K293 Q294 V295 L356 P357 V359 L362	E287-K291 PolarHBondContact O-N 3.29Å; E287-K291 WeakPolarHBondContact OE1-CE 3.5Å; E287-K291 IonicContact OE1-NZ 3.84Å; E287-K291 PolarHBondContact OE1-NZ 2.8Å; F288-K291 WeakPolarHBondContact O-CA 3.33Å; F288-K291 WeakPolarHBondContact O-CB 3.4Å; F288-K291 PolarHBondContact O-N 3.13Å; L289-K291 VanDerWaalsContact C-N 3.28Å; L289-K291 PolarHBondContact O-N 2.97Å; K291-K293 VanDerWaalsContact C-N 3.34Å; K291-K293 PolarHBondContact O-N 2.93Å; K291-Q294 WeakPolarHBondContact O-CA 3.41Å; K291-Q294 WeakPolarHBondContact O-CB 3.26Å; K291-Q294 PolarHBondContact O-N 3.01Å; K291-V295 WeakPolarHBondContact O-CG2 3.24Å; K291-V295 PolarHBondContact O-N 2.88Å; K291-L356 PolarHBondContact NZ-O 2.93Å; K291-P357 WeakPolarHBondContact CD-O 3.17Å; K291-P357 WeakPolarHBondContact CE-O 3.32Å; K291-P357 PolarHBondContact NZ-O 3.14Å; K291-V359 HydrophobicContact CB-CG2 4.07Å; K291-V359 HydrophobicContact CG-CG2 4.26Å; K291-L362 HydrophobicContact CB-CD1 3.98Å
292	L	97.8	Very high	95.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-42.2	174.6	-66	175.1	0	0	0	112.4	L253 A276 F288 L289 Q294 V295 A296 I335 L362	L253-L292 HydrophobicContact CD2-CB 4.37Å; A276-L292 HydrophobicContact CB-CD1 3.54Å; A276-L292 HydrophobicContact CB-CD2 4.47Å; F288-L292 HydrophobicContact CD1-CD1 3.82Å; F288-L292 HydrophobicContact CD1-CG 4.23Å; F288-L292 HydrophobicContact CE1-CD1 3.69Å; F288-L292 HydrophobicContact CE1-CD2 4.25Å; F288-L292 HydrophobicContact CE1-CG 4.09Å; F288-L292 HydrophobicContact CZ-CD2 4.29Å; F288-L292 HydrophobicContact CZ-CG 4.5Å; F288-L292 PolarHBondContact O-N 3.32Å; L289-L292 PolarHBondContact O-N 3.44Å; L292-Q294 VanDerWaalsContact C-N 3.25Å; L292-Q294 PolarHBondContact O-N 3.46Å; L292-V295 PolarHBondContact O-N 2.94Å; L292-A296 WeakPolarHBondContact O-CB 3.21Å; L292-A296 PolarHBondContact O-N 3.34Å; L292-I335 HydrophobicContact CD2-CD1 3.97Å; L292-L362 HydrophobicContact CD2-CD1 4.35Å
293	K	97.6	Very high	95.7	Very high	27 Å²	27	58.9 Å²	58.9	12%	0.117	30%	0.303	C	S	.	.	H	α-helix	trans	-58.7	-39.3	173.9	-69.6	-177.3	-176	-173.3	0	111.6	E166 F224 L253 L289 K291 E297	E166-K293 IonicContact OE2-NZ 3.65Å; E166-K293 PolarHBondContact OE2-NZ 3.05Å; F224-K293 HydrophobicContact CB-CD 4.48Å; F224-K293 HydrophobicContact CB-CG 4.12Å; F224-K293 HydrophobicContact CD1-CD 4.15Å; F224-K293 HydrophobicContact CD1-CG 4.32Å; F224-K293 HydrophobicContact CG-CG 4.39Å; L253-K293 HydrophobicContact CD2-CG 3.91Å; L289-K293 WeakPolarHBondContact O-CG 3.28Å; L289-K293 PolarHBondContact O-N 3.06Å; K291-K293 VanDerWaalsContact C-N 3.34Å; K291-K293 PolarHBondContact O-N 2.93Å; K293-E297 PolarHBondContact O-N 3.33Å
294	Q	97.4	Very high	95.7	Very high	95 Å²	95	57.2 Å²	57.2	44%	0.444	30%	0.295	S	S	.	.	H	α-helix	trans	-68.8	-45.9	176.6	-165.9	-173.1	-33.2	0	0	111.9	H290 K291 L292 A296 E297 D298 V359	H290-Q294 PolarHBondContact O-N 3.24Å; K291-Q294 WeakPolarHBondContact O-CA 3.41Å; K291-Q294 WeakPolarHBondContact O-CB 3.26Å; K291-Q294 PolarHBondContact O-N 3.01Å; L292-Q294 VanDerWaalsContact C-N 3.25Å; L292-Q294 PolarHBondContact O-N 3.46Å; Q294-A296 VanDerWaalsContact C-N 3.27Å; Q294-A296 PolarHBondContact O-N 3.01Å; Q294-E297 PolarHBondContact O-N 3.12Å; Q294-D298 PolarHBondContact O-N 3.32Å; Q294-V359 HydrophobicContact CB-CG2 4.2Å; Q294-V359 HydrophobicContact CG-CG1 4.41Å; Q294-V359 HydrophobicContact CG-CG2 4.42Å
295	V	97.6	Very high	95.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-55.3	-45	174.2	171.5	0	0	0	0	110.6	K291 L292 D298 N299 I307 V359 L362 E363 L366	K291-V295 WeakPolarHBondContact O-CG2 3.24Å; K291-V295 PolarHBondContact O-N 2.88Å; L292-V295 PolarHBondContact O-N 2.94Å; V295-D298 PolarHBondContact O-N 2.96Å; V295-N299 WeakPolarHBondContact O-CB 3.48Å; V295-N299 PolarHBondContact O-N 3.21Å; V295-N299 VanDerWaalsContact O-N 3.07Å; V295-N299 PolarHBondContact O-ND2 3.36Å; V295-I307 HydrophobicContact CG1-CD1 4.39Å; V295-V359 HydrophobicContact CG2-CG1 3.84Å; V295-L362 HydrophobicContact CG2-CB 3.9Å; V295-L362 HydrophobicContact CG2-CD1 4.22Å; V295-E363 HydrophobicContact CG1-CG 4.19Å; V295-E363 HydrophobicContact CG2-CG 4.18Å; V295-L366 HydrophobicContact CG1-CD1 3.55Å
296	A	96.9	Very high	95.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.1	-42.4	177.9	0	0	0	0	0	112.3	T252 L253 L292 Q294 N299 T300	T252-A296 HydrophobicContact CG2-CB 4.07Å; L253-A296 HydrophobicContact CB-CB 3.66Å; L253-A296 HydrophobicContact CD2-CB 4.42Å; L292-A296 WeakPolarHBondContact O-CB 3.21Å; L292-A296 PolarHBondContact O-N 3.34Å; Q294-A296 VanDerWaalsContact C-N 3.27Å; Q294-A296 PolarHBondContact O-N 3.01Å; A296-N299 CarbonylContact O-C 3.59Å; A296-N299 PolarHBondContact O-N 3.47Å; A296-T300 WeakPolarHBondContact O-CA 3.35Å; A296-T300 PolarHBondContact O-N 3.41Å
297	E	96.1	Very high	96	Very high	80 Å²	80	49.7 Å²	49.7	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-64.1	-40.5	175.9	-172.5	175.7	-163.6	0	0	112.3	I225 N227 K293 Q294 N299 T300	I225-E297 HydrophobicContact CD1-CB 4.18Å; N227-E297 PolarHBondContact ND2-OE1 2.87Å; K293-E297 PolarHBondContact O-N 3.33Å; Q294-E297 PolarHBondContact O-N 3.12Å; E297-N299 VanDerWaalsContact C-N 3.25Å; E297-N299 PolarHBondContact O-N 3Å; E297-T300 WeakPolarHBondContact O-CG2 3.32Å
298	D	96.4	Very high	96.1	Very high	96 Å²	96	45.3 Å²	45.3	51%	0.513	24%	0.239	S	C	.	.	H	α-helix	trans	-70.7	-22.5	179.5	-74.9	-33.3	0	0	0	112.2	Q294 V295 E363	Q294-D298 PolarHBondContact O-N 3.32Å; V295-D298 PolarHBondContact O-N 2.96Å; D298-E363 WeakPolarHBondContact CB-OE1 3.27Å
299	N	95.4	Very high	96.2	Very high	42 Å²	42	45.3 Å²	45.3	23%	0.225	24%	0.239	C	C	.	.	H	α-helix	trans	-118.7	11.4	-174.9	-64.7	-81.6	0	0	0	115.5	V295 A296 E297 D301 N302 L305 E363	V295-N299 WeakPolarHBondContact O-CB 3.48Å; V295-N299 PolarHBondContact O-N 3.21Å; V295-N299 VanDerWaalsContact O-N 3.07Å; V295-N299 PolarHBondContact O-ND2 3.36Å; A296-N299 CarbonylContact O-C 3.59Å; A296-N299 PolarHBondContact O-N 3.47Å; E297-N299 VanDerWaalsContact C-N 3.25Å; E297-N299 PolarHBondContact O-N 3Å; N299-D301 PolarHBondContact O-N 3.48Å; N299-N302 VanDerWaalsContact O-CB 3.31Å; N299-N302 WeakPolarHBondContact O-CB 3.46Å; N299-N302 PolarHBondContact O-N 3.3Å; N299-L305 HydrophobicContact CB-CD2 3.51Å; N299-E363 PolarHBondContact ND2-OE1 3.49Å
300	T	94	Very high	96.2	Very high	49 Å²	49	45.3 Å²	45.3	30%	0.301	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.4	-177.6	180	0	0	0	0	115.1	E222 T252 A296 E297 N302	E222-T300 PolarHBondContact OE2-OG1 2.95Å; T252-T300 WeakPolarHBondContact OG1-CA 3.12Å; A296-T300 WeakPolarHBondContact O-CA 3.35Å; A296-T300 PolarHBondContact O-N 3.41Å; E297-T300 WeakPolarHBondContact O-CG2 3.32Å; T300-N302 VanDerWaalsContact C-N 3.28Å; T300-N302 PolarHBondContact O-N 2.82Å
301	D	92.3	Very high	96.3	Very high	161 Å²	161	41.4 Å²	41.4	86%	0.861	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-3.3	177.2	-76.3	-40.8	0	0	0	113.5	N299 P303	N299-D301 PolarHBondContact O-N 3.48Å; D301-P303 VanDerWaalsContact O-CD 3.31Å; D301-P303 WeakPolarHBondContact O-CD 3.44Å
302	N	93.7	Very high	96.3	Very high	50 Å²	50	40.1 Å²	40.1	27%	0.267	22%	0.216	S	C	.	.			trans	-92.1	104.3	-179.1	-174.4	-0.7	0	0	0	111.5	N299 T300 N304 L305	N299-N302 VanDerWaalsContact O-CB 3.31Å; N299-N302 WeakPolarHBondContact O-CB 3.46Å; N299-N302 PolarHBondContact O-N 3.3Å; T300-N302 VanDerWaalsContact C-N 3.28Å; T300-N302 PolarHBondContact O-N 2.82Å; N302-N304 PolarHBondContact O-N 2.87Å; N302-N304 VanDerWaalsContact O-N 3.1Å; N302-N304 PolarHBondContact OD1-N 2.93Å; N302-N304 VanDerWaalsContact OD1-N 3.16Å; N302-L305 HydrophobicContact CB-CB 4.18Å; N302-L305 PolarHBondContact O-N 3.12Å; N302-L305 VanDerWaalsContact O-N 3.16Å
303	P	90.9	Very high	96.2	Very high	111 Å²	111	44.7 Å²	44.7	72%	0.721	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-8.9	-175.4	32.3	-38.3	0	0	0	114.2	D301	D301-P303 VanDerWaalsContact O-CD 3.31Å; D301-P303 WeakPolarHBondContact O-CD 3.44Å
304	N	92.4	Very high	96.2	Very high	100 Å²	100	46.3 Å²	46.3	54%	0.535	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-5.9	178.9	-60.1	-17.3	0	0	0	112.2	N302 L370	N302-N304 PolarHBondContact O-N 2.87Å; N302-N304 VanDerWaalsContact O-N 3.1Å; N302-N304 PolarHBondContact OD1-N 2.93Å; N302-N304 VanDerWaalsContact OD1-N 3.16Å; N304-L370 WeakPolarHBondContact O-CD2 3.48Å
305	L	96.4	Very high	96.2	Very high	8 Å²	8	42 Å²	42	4%	0.042	23%	0.23	C	C	.	.			trans	-99.9	120.4	178.3	179.9	63.7	0	0	0	109.4	T252 I274 N299 N302 I307 L366 L370	T252-L305 HydrophobicContact CG2-CB 4.45Å; T252-L305 HydrophobicContact CG2-CD2 3.81Å; T252-L305 HydrophobicContact CG2-CG 3.96Å; I274-L305 HydrophobicContact CD1-CD1 3.91Å; N299-L305 HydrophobicContact CB-CD2 3.51Å; N302-L305 HydrophobicContact CB-CB 4.18Å; N302-L305 PolarHBondContact O-N 3.12Å; N302-L305 VanDerWaalsContact O-N 3.16Å; L305-I307 HydrophobicContact CD1-CD1 4.25Å; L305-I307 HydrophobicContact CD1-CG1 3.88Å; L305-I307 HydrophobicContact CG-CG1 4.41Å; L305-L366 HydrophobicContact CD1-CD1 4.41Å; L305-L366 HydrophobicContact CD1-CD2 4.27Å; L305-L370 HydrophobicContact CB-CD1 4.26Å; L305-L370 HydrophobicContact CD1-CD1 4.23Å
306	S	97.8	Very high	96.1	Very high	6 Å²	6	46.1 Å²	46.1	4%	0.042	26%	0.257	C	S	.	.			trans	-146.2	106.4	172.1	167.3	0	0	0	0	108.3	P251 R254	P251-S306 PolarHBondContact O-OG 2.82Å; R254-S306 PolarHBondContact NE-OG 3.49Å
307	I	98.5	Very high	96	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124	-180	-55	172.6	0	0	0	108.6	T252 L253 R254 I274 A276 V295 L305 L366	T252-I307 PolarHBondContact O-N 3.26Å; L253-I307 WeakPolarHBondContact CA-O 3.36Å; L253-I307 HydrophobicContact CD1-CB 3.94Å; L253-I307 HydrophobicContact CD1-CG2 3.9Å; R254-I307 PolarHBondContact N-O 3.23Å; I274-I307 HydrophobicContact CG2-CG1 4.13Å; I274-I307 HydrophobicContact CG2-CG2 4.36Å; I274-I307 WeakPolarHBondContact O-CA 3.47Å; A276-I307 HydrophobicContact CB-CG2 4.03Å; V295-I307 HydrophobicContact CG1-CD1 4.39Å; L305-I307 HydrophobicContact CD1-CD1 4.25Å; L305-I307 HydrophobicContact CD1-CG1 3.88Å; L305-I307 HydrophobicContact CG-CG1 4.41Å; I307-L366 HydrophobicContact CD1-CD1 3.84Å; I307-L366 HydrophobicContact CD1-CD2 4.47Å
308	L	98.2	Very high	96	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	105.9	172.9	-179.6	56.5	0	0	0	110.1	R254 L256 I264 W265 I274 V275 A276 I310	R254-L308 HydrophobicContact CG-CD1 4.12Å; L256-L308 HydrophobicContact CB-CD1 3.78Å; L256-L308 HydrophobicContact CB-CG 4.36Å; L256-L308 HydrophobicContact CD1-CD1 4.13Å; L256-L308 HydrophobicContact CD1-CD2 4.21Å; L256-L308 HydrophobicContact CD2-CD2 4.48Å; L256-L308 HydrophobicContact CG-CD1 4.5Å; I264-L308 HydrophobicContact CG2-CD1 3.42Å; I264-L308 VanDerWaalsContact CG2-CD1 3.42Å; I264-L308 HydrophobicContact CG2-CD2 4.07Å; I264-L308 HydrophobicContact CG2-CG 4.36Å; W265-L308 HydrophobicContact CE3-CD2 4.18Å; W265-L308 HydrophobicContact CZ3-CD2 4.27Å; I274-L308 PolarHBondContact O-N 3.22Å; V275-L308 CarbonylContact C-O 3.53Å; V275-L308 WeakPolarHBondContact CA-O 3.1Å; V275-L308 HydrophobicContact CG2-CB 4.33Å; V275-L308 HydrophobicContact CG2-CD2 4.32Å; A276-L308 PolarHBondContact N-O 3.09Å; L308-I310 HydrophobicContact CD2-CD1 4.31Å; L308-I310 HydrophobicContact CD2-CG1 4.41Å; L308-I310 HydrophobicContact CG-CD1 4.47Å; L308-I310 HydrophobicContact CG-CG1 4.07Å
309	W	98.5	Very high	95.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	127.1	169.5	171.2	38.7	0	0	0	110.4	F224 L253 R254 K255 L256 A276 A278 E280 L289 D311	F224-W309 HydrophobicContact CE1-CE3 4.22Å; F224-W309 AromaticContact CE1-CZ3 3.92Å; F224-W309 HydrophobicContact CE1-CZ3 3.92Å; F224-W309 HydrophobicContact CE2-CE3 4.26Å; F224-W309 AromaticContact CZ-CE3 3.57Å; F224-W309 HydrophobicContact CZ-CE3 3.57Å; F224-W309 AromaticContact CZ-CZ3 3.61Å; F224-W309 HydrophobicContact CZ-CZ3 3.61Å; L253-W309 HydrophobicContact CD1-CB 4Å; R254-W309 PolarHBondContact O-N 3.42Å; K255-W309 CarbonylContact C-O 3.47Å; K255-W309 WeakPolarHBondContact CA-O 3.49Å; K255-W309 HydrophobicContact CB-CE3 3.98Å; K255-W309 HydrophobicContact CB-CZ3 4.42Å; K255-W309 HydrophobicContact CD-CE3 3.91Å; K255-W309 HydrophobicContact CD-CH2 4.07Å; K255-W309 HydrophobicContact CD-CZ3 3.6Å; K255-W309 HydrophobicContact CG-CD2 4.24Å; K255-W309 HydrophobicContact CG-CE3 3.73Å; K255-W309 HydrophobicContact CG-CZ3 3.98Å; L256-W309 PolarHBondContact N-O 2.74Å; A276-W309 CarbonylContact O-C 3.47Å; A276-W309 WeakPolarHBondContact O-CA 3.34Å; A278-W309 PolarHBondContact O-NE1 3.13Å; E280-W309 HydrophobicContact CB-CH2 4.23Å; E280-W309 HydrophobicContact CB-CZ2 4.02Å; L289-W309 HydrophobicContact CD1-CD2 3.6Å; L289-W309 HydrophobicContact CD1-CE3 3.7Å; L289-W309 HydrophobicContact CD1-CG 4.07Å; L289-W309 HydrophobicContact CD1-CH2 4.35Å; L289-W309 HydrophobicContact CD1-CZ2 4.27Å; L289-W309 HydrophobicContact CD1-CZ3 4.07Å; L289-W309 HydrophobicContact CD2-CD2 4.46Å; L289-W309 HydrophobicContact CD2-CE3 4.33Å; L289-W309 HydrophobicContact CD2-CH2 3.48Å; L289-W309 VanDerWaalsContact CD2-CH2 3.48Å; L289-W309 HydrophobicContact CD2-CZ2 3.63Å; L289-W309 HydrophobicContact CD2-CZ3 3.85Å; W309-D311 HydrophobicContact CZ2-CB 4.1Å
310	I	98.5	Very high	95.9	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.4	172.3	-51.2	179.6	0	0	0	108.1	L256 V275 A276 F277 A278 L308 P312 F315 W322	L256-I310 HydrophobicContact CB-CG1 3.89Å; L256-I310 HydrophobicContact CD2-CD1 3.67Å; L256-I310 HydrophobicContact CD2-CG1 3.8Å; L256-I310 HydrophobicContact CD2-CG2 4.32Å; V275-I310 HydrophobicContact CG1-CD1 3.56Å; V275-I310 HydrophobicContact CG1-CG1 4.04Å; A276-I310 PolarHBondContact O-N 3.05Å; F277-I310 WeakPolarHBondContact CA-O 3.43Å; F277-I310 HydrophobicContact CD1-CB 3.67Å; F277-I310 HydrophobicContact CD1-CD1 4.47Å; F277-I310 HydrophobicContact CD1-CG2 3.89Å; F277-I310 HydrophobicContact CE1-CB 3.7Å; F277-I310 HydrophobicContact CE1-CD1 3.75Å; F277-I310 HydrophobicContact CE1-CG1 4.27Å; F277-I310 HydrophobicContact CE1-CG2 3.64Å; F277-I310 HydrophobicContact CZ-CD1 3.9Å; A278-I310 PolarHBondContact N-O 3.04Å; A278-I310 VanDerWaalsContact N-O 3.09Å; L308-I310 HydrophobicContact CD2-CD1 4.31Å; L308-I310 HydrophobicContact CD2-CG1 4.41Å; L308-I310 HydrophobicContact CG-CD1 4.47Å; L308-I310 HydrophobicContact CG-CG1 4.07Å; I310-P312 WeakPolarHBondContact O-CD 3.28Å; I310-F315 HydrophobicContact CG2-CD2 3.92Å; I310-F315 HydrophobicContact CG2-CE2 4.17Å; I310-W322 HydrophobicContact CG2-CH2 3.83Å; I310-W322 HydrophobicContact CG2-CZ3 4.05Å
311	D	98.2	Very high	96	Very high	9 Å²	9	54.2 Å²	54.2	5%	0.048	30%	0.301	C	S	.	.			trans	-85.6	114.8	164.6	-165.7	-36.4	0	0	0	108.4	E279 E280 W309 D313 D314	E279-D311 WeakPolarHBondContact CA-OD1 3.27Å; E280-D311 PolarHBondContact N-OD2 3.13Å; W309-D311 HydrophobicContact CZ2-CB 4.1Å; D311-D313 PolarHBondContact O-N 2.95Å; D311-D313 VanDerWaalsContact O-N 3.13Å; D311-D313 WeakPolarHBondContact OD1-CB 3.49Å; D311-D313 PolarHBondContact OD1-N 3.21Å; D311-D314 PolarHBondContact O-N 2.84Å; D311-D314 VanDerWaalsContact O-N 3.09Å
312	P	97.3	Very high	96.2	Very high	5 Å²	5	47.7 Å²	47.7	3%	0.032	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-58.2	-25.1	-179.2	-23.6	34	0	0	0	114.1	F277 I310 D314 F315 L319 L330	F277-P312 HydrophobicContact CB-CG 4.47Å; F277-P312 HydrophobicContact CD1-CG 4.12Å; I310-P312 WeakPolarHBondContact O-CD 3.28Å; P312-D314 VanDerWaalsContact C-N 3.27Å; P312-D314 PolarHBondContact O-N 2.93Å; P312-F315 CarbonylContact O-C 3.46Å; P312-F315 PolarHBondContact O-N 3.3Å; P312-L319 HydrophobicContact CB-CD1 4.08Å; P312-L330 HydrophobicContact CG-CB 4.47Å
313	D	96.8	Very high	96.3	Very high	96 Å²	96	48.5 Å²	48.5	51%	0.513	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-69.4	-24.2	179	-93.5	-3.5	0	0	0	112.8	D311 F315	D311-D313 PolarHBondContact O-N 2.95Å; D311-D313 VanDerWaalsContact O-N 3.13Å; D311-D313 WeakPolarHBondContact OD1-CB 3.49Å; D311-D313 PolarHBondContact OD1-N 3.21Å; D313-F315 VanDerWaalsContact C-N 3.28Å
314	D	96.8	Very high	96.6	Very high	61 Å²	61	51.8 Å²	51.8	33%	0.326	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-74.1	-21.6	176	-71.1	-23.2	0	0	0	111.5	K255 D311 P312 P316	K255-D314 WeakPolarHBondContact CE-OD2 3.45Å; K255-D314 IonicContact NZ-OD2 2.81Å; K255-D314 PolarHBondContact NZ-OD2 3.47Å; D311-D314 PolarHBondContact O-N 2.84Å; D311-D314 VanDerWaalsContact O-N 3.09Å; P312-D314 VanDerWaalsContact C-N 3.27Å; P312-D314 PolarHBondContact O-N 2.93Å; D314-P316 VanDerWaalsContact C-CD 3.46Å; D314-P316 WeakPolarHBondContact O-CD 3.4Å
315	F	96.8	Very high	96.7	Very high	3 Å²	3	50 Å²	50	1%	0.013	26%	0.262	C	S	.	.			trans	-129.7	58.4	-174.7	-59.1	-86.5	0	0	0	113.6	E132 L256 P258 V261 I310 P312 D313 L317 L318 L319 W322	E132-F315 WeakPolarHBondContact OE1-CD1 3.48Å; L256-F315 HydrophobicContact CB-CE2 4.17Å; L256-F315 HydrophobicContact CB-CZ 4.31Å; L256-F315 HydrophobicContact CD2-CE2 4.08Å; L256-F315 HydrophobicContact CD2-CZ 3.99Å; L256-F315 HydrophobicContact CG-CE2 4.06Å; L256-F315 HydrophobicContact CG-CZ 3.78Å; P258-F315 HydrophobicContact CB-CE1 4.42Å; P258-F315 HydrophobicContact CG-CE1 4.05Å; P258-F315 HydrophobicContact CG-CZ 4.17Å; V261-F315 HydrophobicContact CB-CE1 4.41Å; V261-F315 HydrophobicContact CG2-CE1 4.21Å; I310-F315 HydrophobicContact CG2-CD2 3.92Å; I310-F315 HydrophobicContact CG2-CE2 4.17Å; P312-F315 CarbonylContact O-C 3.46Å; P312-F315 PolarHBondContact O-N 3.3Å; D313-F315 VanDerWaalsContact C-N 3.28Å; F315-L317 PolarHBondContact O-N 2.88Å; F315-L318 HydrophobicContact CB-CB 4.21Å; F315-L318 HydrophobicContact CB-CD1 4.23Å; F315-L318 HydrophobicContact CB-CG 4.44Å; F315-L318 HydrophobicContact CD1-CD1 3.98Å; F315-L318 HydrophobicContact CG-CD1 4.4Å; F315-L318 PolarHBondContact O-N 3.45Å; F315-L319 PolarHBondContact O-N 3.24Å; F315-W322 HydrophobicContact CB-CH2 3.37Å; F315-W322 HydrophobicContact CB-CZ2 4.48Å; F315-W322 HydrophobicContact CB-CZ3 3.6Å; F315-W322 HydrophobicContact CD1-CH2 4.37Å; F315-W322 AromaticContact CD2-CH2 3.9Å; F315-W322 HydrophobicContact CD2-CH2 3.9Å; F315-W322 HydrophobicContact CD2-CZ3 4.5Å; F315-W322 AromaticContact CG-CH2 3.65Å; F315-W322 HydrophobicContact CG-CH2 3.65Å; F315-W322 HydrophobicContact CG-CZ3 4.3Å
316	P	95.6	Very high	96.7	Very high	88 Å²	88	50.7 Å²	50.7	57%	0.571	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.6	-172.4	27	-36.5	0	0	0	114.1	D314	D314-P316 VanDerWaalsContact C-CD 3.46Å; D314-P316 WeakPolarHBondContact O-CD 3.4Å
317	L	95.1	Very high	96.6	Very high	151 Å²	151	53.7 Å²	53.7	79%	0.791	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-24.5	176.9	-62.3	-177.5	0	0	0	112.9	F315	F315-L317 PolarHBondContact O-N 2.88Å
318	L	95.6	Very high	96.4	Very high	54 Å²	54	54.7 Å²	54.7	28%	0.283	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-22.8	-179.7	-61.7	179.8	0	0	0	112.5	F315 H321 W322	F315-L318 HydrophobicContact CB-CB 4.21Å; F315-L318 HydrophobicContact CB-CD1 4.23Å; F315-L318 HydrophobicContact CB-CG 4.44Å; F315-L318 HydrophobicContact CD1-CD1 3.98Å; F315-L318 HydrophobicContact CG-CD1 4.4Å; F315-L318 PolarHBondContact O-N 3.45Å; L318-H321 WeakPolarHBondContact O-CA 3.42Å; L318-H321 VanDerWaalsContact O-CB 3.28Å; L318-H321 WeakPolarHBondContact O-CB 3.5Å; L318-H321 PolarHBondContact O-N 2.9Å; L318-W322 HydrophobicContact CB-CD2 3.83Å; L318-W322 HydrophobicContact CB-CE3 3.88Å; L318-W322 HydrophobicContact CB-CH2 3.66Å; L318-W322 HydrophobicContact CB-CZ2 3.58Å; L318-W322 HydrophobicContact CB-CZ3 3.8Å; L318-W322 HydrophobicContact CD1-CH2 3.79Å; L318-W322 HydrophobicContact CD1-CZ2 3.41Å; L318-W322 VanDerWaalsContact CD1-CZ2 3.41Å; L318-W322 HydrophobicContact CG-CH2 4.36Å; L318-W322 HydrophobicContact CG-CZ2 4.13Å; L318-W322 PolarHBondContact O-N 2.9Å
319	L	94.8	Very high	96.2	Very high	45 Å²	45	57.7 Å²	57.7	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-47.4	-53.2	-179.2	-172.9	165.5	0	0	0	113.7	P312 F315 H321 W322 E323 L330	P312-L319 HydrophobicContact CB-CD1 4.08Å; F315-L319 PolarHBondContact O-N 3.24Å; L319-H321 PolarHBondContact O-N 3.25Å; L319-W322 PolarHBondContact O-N 3.18Å; L319-E323 HydrophobicContact CD2-CG 4.15Å; L319-E323 PolarHBondContact O-N 3.06Å; L319-E323 VanDerWaalsContact O-N 3.07Å; L319-L330 HydrophobicContact CG-CB 4.42Å; L319-L330 HydrophobicContact CG-CD1 4.09Å
320	P	96.1	Very high	96.1	Very high	80 Å²	80	58.2 Å²	58.2	52%	0.519	32%	0.321	S	S	.	.	H	α-helix	trans	-68.2	-22.8	179.6	-18.4	32.8	0	0	0	113.8	K324	P320-K324 VanDerWaalsContact O-CB 3.32Å; P320-K324 WeakPolarHBondContact O-CB 3.38Å; P320-K324 PolarHBondContact O-N 2.89Å
321	H	95.6	Very high	95.8	Very high	107 Å²	107	61.6 Å²	61.6	50%	0.495	35%	0.345	S	S	.	.	H	α-helix	trans	-73.3	-49.7	175.4	177.1	40.7	0	0	0	110	L318 L319 K324 T325	L318-H321 WeakPolarHBondContact O-CA 3.42Å; L318-H321 VanDerWaalsContact O-CB 3.28Å; L318-H321 WeakPolarHBondContact O-CB 3.5Å; L318-H321 PolarHBondContact O-N 2.9Å; L319-H321 PolarHBondContact O-N 3.25Å; H321-K324 PolarHBondContact O-N 3.21Å; H321-T325 PolarHBondContact CE1-OG1 3Å; H321-T325 PolarHBondContact ND1-OG1 3.25Å; H321-T325 VanDerWaalsContact ND1-OG1 3.13Å; H321-T325 WeakPolarHBondContact O-CB 3.33Å; H321-T325 PolarHBondContact O-N 3.41Å; H321-T325 PolarHBondContact O-OG1 2.9Å
322	W	96.9	Very high	95.6	Very high	23 Å²	23	64 Å²	64	9%	0.087	36%	0.355	C	S	.	.	H	α-helix	trans	-60.7	-48.1	178.5	-66.9	-37.1	0	0	0	112.9	F277 I310 F315 L318 L319 K324 T325 F326 L330	F277-W322 HydrophobicContact CE1-CD2 4.01Å; F277-W322 AromaticContact CE1-CE3 3.65Å; F277-W322 HydrophobicContact CE1-CE3 3.65Å; F277-W322 HydrophobicContact CE1-CH2 4.38Å; F277-W322 AromaticContact CE1-CZ3 3.86Å; F277-W322 HydrophobicContact CE1-CZ3 3.86Å; F277-W322 HydrophobicContact CZ-CB 4.36Å; F277-W322 AromaticContact CZ-CD2 3.94Å; F277-W322 HydrophobicContact CZ-CD2 3.94Å; F277-W322 HydrophobicContact CZ-CE3 4.06Å; F277-W322 HydrophobicContact CZ-CG 4.11Å; I310-W322 HydrophobicContact CG2-CH2 3.83Å; I310-W322 HydrophobicContact CG2-CZ3 4.05Å; F315-W322 HydrophobicContact CB-CH2 3.37Å; F315-W322 HydrophobicContact CB-CZ2 4.48Å; F315-W322 HydrophobicContact CB-CZ3 3.6Å; F315-W322 HydrophobicContact CD1-CH2 4.37Å; F315-W322 AromaticContact CD2-CH2 3.9Å; F315-W322 HydrophobicContact CD2-CH2 3.9Å; F315-W322 HydrophobicContact CD2-CZ3 4.5Å; F315-W322 AromaticContact CG-CH2 3.65Å; F315-W322 HydrophobicContact CG-CH2 3.65Å; F315-W322 HydrophobicContact CG-CZ3 4.3Å; L318-W322 HydrophobicContact CB-CD2 3.83Å; L318-W322 HydrophobicContact CB-CE3 3.88Å; L318-W322 HydrophobicContact CB-CH2 3.66Å; L318-W322 HydrophobicContact CB-CZ2 3.58Å; L318-W322 HydrophobicContact CB-CZ3 3.8Å; L318-W322 HydrophobicContact CD1-CH2 3.79Å; L318-W322 HydrophobicContact CD1-CZ2 3.41Å; L318-W322 VanDerWaalsContact CD1-CZ2 3.41Å; L318-W322 HydrophobicContact CG-CH2 4.36Å; L318-W322 HydrophobicContact CG-CZ2 4.13Å; L318-W322 PolarHBondContact O-N 2.9Å; L319-W322 PolarHBondContact O-N 3.18Å; W322-K324 PolarHBondContact O-N 3.18Å; W322-T325 PolarHBondContact O-N 3.27Å; W322-F326 HydrophobicContact CB-CD2 3.9Å; W322-F326 HydrophobicContact CB-CE2 3.93Å; W322-F326 AromaticContact CD1-CE2 3.38Å; W322-F326 HydrophobicContact CG-CD2 4.36Å; W322-F326 AromaticContact CG-CE2 3.88Å; W322-F326 HydrophobicContact CG-CE2 3.88Å; W322-F326 WeakPolarHBondContact O-CB 3.15Å; W322-F326 WeakPolarHBondContact O-CD2 3.32Å; W322-F326 PolarHBondContact O-N 2.87Å; W322-L330 HydrophobicContact CB-CD1 3.86Å; W322-L330 HydrophobicContact CE3-CD1 4.04Å
323	E	96.4	Very high	95.5	Very high	67 Å²	67	64 Å²	64	31%	0.313	36%	0.355	S	S	.	.	H	α-helix	trans	-55.9	-39.1	175.8	-70.9	-175.6	150.8	0	0	112	L319 G327 I328 L330	L319-E323 HydrophobicContact CD2-CG 4.15Å; L319-E323 PolarHBondContact O-N 3.06Å; L319-E323 VanDerWaalsContact O-N 3.07Å; E323-G327 VanDerWaalsContact O-CA 3.3Å; E323-G327 WeakPolarHBondContact O-CA 3.39Å; E323-G327 PolarHBondContact O-N 3.36Å; E323-I328 WeakPolarHBondContact CA-O 3.35Å; E323-L330 HydrophobicContact CG-CB 4.1Å; E323-L330 HydrophobicContact CG-CD1 4.11Å; E323-L330 HydrophobicContact CG-CG 3.88Å; E323-L330 PolarHBondContact OE1-N 2.85Å
324	K	96.5	Very high	95.6	Very high	180 Å²	180	60 Å²	60	78%	0.783	33%	0.334	S	S	*	.	H	α-helix	trans	-75.5	-42.7	-179.4	-175.2	-169.4	171.2	-154.3	0	112.3	P320 H321 W322	P320-K324 VanDerWaalsContact O-CB 3.32Å; P320-K324 WeakPolarHBondContact O-CB 3.38Å; P320-K324 PolarHBondContact O-N 2.89Å; H321-K324 PolarHBondContact O-N 3.21Å; W322-K324 PolarHBondContact O-N 3.18Å
325	T	95.4	Very high	95.6	Very high	62 Å²	62	57.1 Å²	57.1	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-69.6	-48.7	-176.7	-59.8	0	0	0	0	110.1	H321 W322	H321-T325 PolarHBondContact CE1-OG1 3Å; H321-T325 PolarHBondContact ND1-OG1 3.25Å; H321-T325 VanDerWaalsContact ND1-OG1 3.13Å; H321-T325 WeakPolarHBondContact O-CB 3.33Å; H321-T325 PolarHBondContact O-N 3.41Å; H321-T325 PolarHBondContact O-OG1 2.9Å; W322-T325 PolarHBondContact O-N 3.27Å
326	F	95.6	Very high	95.7	Very high	23 Å²	23	57 Å²	57	10%	0.101	32%	0.318	C	S	.	.	H	α-helix	trans	-91.4	-9.4	-173.4	-53.9	-42.6	0	0	0	113.5	F277 W322 I328 I338 A343 S345 W347	F277-F326 HydrophobicContact CE2-CD2 4.44Å; F277-F326 HydrophobicContact CZ-CE2 4.49Å; W322-F326 HydrophobicContact CB-CD2 3.9Å; W322-F326 HydrophobicContact CB-CE2 3.93Å; W322-F326 AromaticContact CD1-CE2 3.38Å; W322-F326 HydrophobicContact CG-CD2 4.36Å; W322-F326 AromaticContact CG-CE2 3.88Å; W322-F326 HydrophobicContact CG-CE2 3.88Å; W322-F326 WeakPolarHBondContact O-CB 3.15Å; W322-F326 WeakPolarHBondContact O-CD2 3.32Å; W322-F326 PolarHBondContact O-N 2.87Å; F326-I328 HydrophobicContact CB-CD1 3.87Å; F326-I328 HydrophobicContact CB-CG1 3.97Å; F326-I328 HydrophobicContact CB-CG2 4.24Å; F326-I328 HydrophobicContact CD2-CD1 4.08Å; F326-I328 HydrophobicContact CG-CD1 4.45Å; F326-I328 PolarHBondContact O-N 3Å; F326-I338 HydrophobicContact CE1-CD1 4.01Å; F326-I338 HydrophobicContact CE1-CG1 4.48Å; F326-I338 HydrophobicContact CE1-CG2 4.14Å; F326-I338 HydrophobicContact CE2-CD1 3.92Å; F326-I338 HydrophobicContact CZ-CD1 3.63Å; F326-I338 HydrophobicContact CZ-CG2 4.39Å; F326-A343 HydrophobicContact CE1-CB 4.37Å; F326-S345 WeakPolarHBondContact CD1-OG 3.35Å; F326-W347 HydrophobicContact CB-CZ2 3.91Å; F326-W347 HydrophobicContact CD1-CZ2 4.35Å; F326-W347 AromaticContact CD2-CZ2 3.86Å; F326-W347 HydrophobicContact CD2-CZ2 3.86Å; F326-W347 HydrophobicContact CE2-CZ2 4.49Å; F326-W347 AromaticContact CG-CZ2 3.79Å; F326-W347 HydrophobicContact CG-CZ2 3.79Å
327	G	95.2	Very high	95.7	Very high	70 Å²	70	52.8 Å²	52.8	72%	0.722	29%	0.29	S	S	*	.			trans	68	19.1	-180	0	0	0	0	0	114.4	E323	E323-G327 VanDerWaalsContact O-CA 3.3Å; E323-G327 WeakPolarHBondContact O-CA 3.39Å; E323-G327 PolarHBondContact O-N 3.36Å
328	I	95.1	Very high	95.8	Very high	20 Å²	20	45.6 Å²	45.6	10%	0.103	25%	0.253	C	S	.	.			trans	-99.3	163	-178.3	64.4	-172.5	0	0	0	112.5	F277 E323 F326 L330 Q334 W347	F277-I328 HydrophobicContact CD2-CD1 3.9Å; F277-I328 HydrophobicContact CE2-CD1 3.85Å; E323-I328 WeakPolarHBondContact CA-O 3.35Å; F326-I328 HydrophobicContact CB-CD1 3.87Å; F326-I328 HydrophobicContact CB-CG1 3.97Å; F326-I328 HydrophobicContact CB-CG2 4.24Å; F326-I328 HydrophobicContact CD2-CD1 4.08Å; F326-I328 HydrophobicContact CG-CD1 4.45Å; F326-I328 PolarHBondContact O-N 3Å; I328-L330 HydrophobicContact CD1-CD2 3.61Å; I328-L330 HydrophobicContact CD1-CG 4.34Å; I328-L330 HydrophobicContact CG1-CD2 3.98Å; I328-L330 HydrophobicContact CG1-CG 4.27Å; I328-Q334 HydrophobicContact CB-CG 4.23Å; I328-Q334 HydrophobicContact CD1-CB 4.5Å; I328-Q334 HydrophobicContact CD1-CG 4.24Å; I328-W347 HydrophobicContact CD1-CD2 4.3Å; I328-W347 HydrophobicContact CD1-CE3 4.27Å; I328-W347 HydrophobicContact CD1-CH2 3.84Å; I328-W347 HydrophobicContact CD1-CZ2 3.79Å; I328-W347 HydrophobicContact CD1-CZ3 4.07Å; I328-W347 HydrophobicContact CG2-CB 4.33Å; I328-W347 HydrophobicContact CG2-CD2 3.65Å; I328-W347 HydrophobicContact CG2-CE3 4.24Å; I328-W347 HydrophobicContact CG2-CG 3.63Å
329	D	94.2	Very high	95.7	Very high	65 Å²	65	44.2 Å²	44.2	35%	0.348	25%	0.245	S	C	.	.			trans	-107	105.5	173.5	-174.9	-12.3	0	0	0	109.6	S331 H332 Q334	D329-S331 VanDerWaalsContact CG-OG 3.24Å; D329-S331 PolarHBondContact O-N 3.39Å; D329-S331 VanDerWaalsContact OD1-CB 3.26Å; D329-S331 WeakPolarHBondContact OD1-CB 3.4Å; D329-S331 PolarHBondContact OD1-N 3.23Å; D329-S331 PolarHBondContact OD1-OG 2.74Å; D329-S331 PolarHBondContact OD2-OG 3.29Å; D329-H332 PolarHBondContact O-N 3.4Å; D329-H332 IonicContact OD2-CD2 3.86Å; D329-Q334 PolarHBondContact O-NE2 2.95Å
330	L	95.6	Very high	95.4	Very high	11 Å²	11	43.5 Å²	43.5	6%	0.058	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	3.5	-177.4	-67.1	-176.4	0	0	0	113.3	F277 P312 L319 W322 E323 I328 H332 Q334	F277-L330 HydrophobicContact CB-CD2 3.61Å; F277-L330 HydrophobicContact CD1-CD1 4.36Å; F277-L330 HydrophobicContact CD1-CD2 3.77Å; F277-L330 HydrophobicContact CD2-CD2 3.54Å; F277-L330 HydrophobicContact CE1-CD1 4.28Å; F277-L330 HydrophobicContact CE1-CD2 4.27Å; F277-L330 HydrophobicContact CE2-CD2 4.06Å; F277-L330 HydrophobicContact CG-CD2 3.37Å; F277-L330 HydrophobicContact CZ-CD2 4.41Å; P312-L330 HydrophobicContact CG-CB 4.47Å; L319-L330 HydrophobicContact CG-CB 4.42Å; L319-L330 HydrophobicContact CG-CD1 4.09Å; W322-L330 HydrophobicContact CB-CD1 3.86Å; W322-L330 HydrophobicContact CE3-CD1 4.04Å; E323-L330 HydrophobicContact CG-CB 4.1Å; E323-L330 HydrophobicContact CG-CD1 4.11Å; E323-L330 HydrophobicContact CG-CG 3.88Å; E323-L330 PolarHBondContact OE1-N 2.85Å; I328-L330 HydrophobicContact CD1-CD2 3.61Å; I328-L330 HydrophobicContact CD1-CG 4.34Å; I328-L330 HydrophobicContact CG1-CD2 3.98Å; I328-L330 HydrophobicContact CG1-CG 4.27Å; L330-H332 PolarHBondContact O-N 3.07Å; L330-Q334 HydrophobicContact CD2-CG 4.25Å
331	S	92.3	Very high	94.9	Very high	74 Å²	74	47.3 Å²	47.3	52%	0.517	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-5.9	165.7	72.9	0	0	0	0	113.5	D329	D329-S331 VanDerWaalsContact CG-OG 3.24Å; D329-S331 PolarHBondContact O-N 3.39Å; D329-S331 VanDerWaalsContact OD1-CB 3.26Å; D329-S331 WeakPolarHBondContact OD1-CB 3.4Å; D329-S331 PolarHBondContact OD1-N 3.23Å; D329-S331 PolarHBondContact OD1-OG 2.74Å; D329-S331 PolarHBondContact OD2-OG 3.29Å
332	H	93.4	Very high	94.6	Very high	58 Å²	58	46.7 Å²	46.7	27%	0.269	26%	0.262	S	S	.	.	S	Bend	trans	-128	153.8	175.5	-65	-67.4	0	0	0	110.6	D329 L330 Q334 N352	D329-H332 PolarHBondContact O-N 3.4Å; D329-H332 IonicContact OD2-CD2 3.86Å; L330-H332 PolarHBondContact O-N 3.07Å; H332-Q334 PolarHBondContact O-NE2 2.75Å; H332-N352 VanDerWaalsContact CB-OD1 3.32Å; H332-N352 WeakPolarHBondContact CB-OD1 3.45Å
333	P	96.7	Very high	94.2	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.032	27%	0.271	C	S	.	.			trans	-61.1	138.6	175.4	-22.8	34.6	0	0	0	112.2	F277 D284 F288 L356	F277-P333 VanDerWaalsContact O-CA 3.28Å; F277-P333 WeakPolarHBondContact O-CA 3.31Å; D284-P333 HydrophobicContact CB-CG 4.23Å; F288-P333 HydrophobicContact CB-CB 3.82Å; F288-P333 HydrophobicContact CB-CG 3.98Å; F288-P333 HydrophobicContact CD1-CB 3.6Å; F288-P333 HydrophobicContact CD2-CB 4.19Å; F288-P333 HydrophobicContact CE1-CB 4.13Å; F288-P333 HydrophobicContact CG-CB 3.61Å; F288-P333 HydrophobicContact CG-CG 4.32Å; P333-L356 HydrophobicContact CB-CD2 4.3Å; P333-L356 HydrophobicContact CG-CD2 3.99Å
334	Q	97.4	Very high	94.1	Very high	13 Å²	13	47.9 Å²	47.9	6%	0.061	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.3	179.4	-52.4	-61.7	-28.6	0	0	109.9	A276 F277 I328 D329 L330 H332 W347	A276-Q334 CarbonylContact C-O 3.44Å; A276-Q334 VanDerWaalsContact CA-O 3.25Å; A276-Q334 WeakPolarHBondContact CA-O 3.41Å; F277-Q334 HydrophobicContact CB-CB 4.2Å; F277-Q334 HydrophobicContact CD2-CB 4.4Å; F277-Q334 PolarHBondContact N-O 3.34Å; F277-Q334 PolarHBondContact O-N 3.37Å; I328-Q334 HydrophobicContact CB-CG 4.23Å; I328-Q334 HydrophobicContact CD1-CB 4.5Å; I328-Q334 HydrophobicContact CD1-CG 4.24Å; D329-Q334 PolarHBondContact O-NE2 2.95Å; L330-Q334 HydrophobicContact CD2-CG 4.25Å; H332-Q334 PolarHBondContact O-NE2 2.75Å; Q334-W347 HydrophobicContact CB-CE3 3.83Å; Q334-W347 HydrophobicContact CB-CZ3 3.88Å
335	I	98.1	Very high	94.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	136.3	164.9	-170.5	171	0	0	0	109.5	I274 V275 A276 F288 L292 W347 M348 I350 L362 W365 L366	I274-I335 HydrophobicContact CG2-CD1 4.44Å; I274-I335 HydrophobicContact CG2-CG1 4.41Å; V275-I335 CarbonylContact O-C 3.59Å; V275-I335 VanDerWaalsContact O-CA 3.29Å; V275-I335 WeakPolarHBondContact O-CA 3.36Å; A276-I335 HydrophobicContact CB-CB 4.41Å; A276-I335 HydrophobicContact CB-CD1 4.44Å; A276-I335 HydrophobicContact CB-CG1 4.19Å; F288-I335 HydrophobicContact CE1-CB 4.48Å; F288-I335 HydrophobicContact CZ-CB 4.01Å; F288-I335 HydrophobicContact CZ-CG2 4.07Å; L292-I335 HydrophobicContact CD2-CD1 3.97Å; I335-W347 VanDerWaalsContact C-CE3 3.44Å; I335-M348 HydrophobicContact CG2-CB 3.7Å; I335-M348 HydrophobicContact CG2-CG 4.39Å; I335-M348 HydrophobicContact CG2-SD 3.85Å; I335-M348 PolarHBondContact O-N 3.4Å; I335-I350 HydrophobicContact CG2-CD1 4.37Å; I335-L362 HydrophobicContact CD1-CD2 4.39Å; I335-L362 HydrophobicContact CG2-CD2 4.09Å; I335-W365 HydrophobicContact CD1-CZ3 4.26Å; I335-W365 HydrophobicContact CG1-CZ3 4Å; I335-L366 HydrophobicContact CD1-CD2 4.32Å
336	G	97.4	Very high	94.1	Very high	0 Å²	0	39 Å²	39	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	176.2	-174.2	0	0	0	0	0	112.4	I274 V275 V346	I274-G336 CarbonylContact C-O 3.57Å; I274-G336 WeakPolarHBondContact CA-O 3.25Å; V275-G336 PolarHBondContact N-O 3.27Å; V275-G336 PolarHBondContact O-N 3.49Å; G336-V346 CarbonylContact C-O 3.6Å; G336-V346 WeakPolarHBondContact CA-O 3.48Å
337	V	97.4	Very high	94.2	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.1	172.4	-170.3	0	0	0	0	107.7	E272 H273 I274 S345 V346 W365 V369 P376	E272-V337 HydrophobicContact CB-CG1 3.98Å; E272-V337 HydrophobicContact CG-CG1 4.12Å; H273-V337 CarbonylContact O-C 3.44Å; H273-V337 WeakPolarHBondContact O-CA 3.37Å; I274-V337 HydrophobicContact CG1-CG2 4.48Å; V337-S345 WeakPolarHBondContact O-CA 3.41Å; V337-S345 VanDerWaalsContact O-CB 3.29Å; V337-S345 WeakPolarHBondContact O-CB 3.49Å; V337-V346 HydrophobicContact CB-CG1 4.08Å; V337-V346 HydrophobicContact CG2-CG1 4.31Å; V337-V346 PolarHBondContact N-O 3.24Å; V337-V346 PolarHBondContact O-N 2.93Å; V337-W365 HydrophobicContact CG2-CH2 3.81Å; V337-W365 HydrophobicContact CG2-CZ2 4.44Å; V337-V369 HydrophobicContact CG2-CB 4.22Å; V337-V369 HydrophobicContact CG2-CG1 3.46Å; V337-V369 VanDerWaalsContact CG2-CG1 3.46Å; V337-V369 HydrophobicContact CG2-CG2 3.63Å; V337-P376 HydrophobicContact CB-CG 4.4Å; V337-P376 HydrophobicContact CG1-CG 4.37Å
338	I	96	Very high	94.2	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129	177.9	-52.2	179.5	0	0	0	108.4	W265 E272 H273 V275 F326 A343 D344 W347	W265-I338 HydrophobicContact CH2-CD1 4.27Å; W265-I338 HydrophobicContact CH2-CG2 4.17Å; W265-I338 HydrophobicContact CZ2-CG2 4.46Å; E272-I338 CarbonylContact C-O 3.53Å; E272-I338 WeakPolarHBondContact CA-O 3.33Å; H273-I338 PolarHBondContact N-O 2.93Å; H273-I338 PolarHBondContact O-N 3.33Å; V275-I338 HydrophobicContact CB-CD1 3.97Å; V275-I338 HydrophobicContact CB-CG1 4.41Å; V275-I338 HydrophobicContact CG1-CD1 4.35Å; V275-I338 HydrophobicContact CG2-CD1 3.66Å; V275-I338 HydrophobicContact CG2-CG1 4.09Å; F326-I338 HydrophobicContact CE1-CD1 4.01Å; F326-I338 HydrophobicContact CE1-CG1 4.48Å; F326-I338 HydrophobicContact CE1-CG2 4.14Å; F326-I338 HydrophobicContact CE2-CD1 3.92Å; F326-I338 HydrophobicContact CZ-CD1 3.63Å; F326-I338 HydrophobicContact CZ-CG2 4.39Å; I338-A343 HydrophobicContact CG2-CB 4.45Å; I338-D344 WeakPolarHBondContact CA-O 3.38Å; I338-W347 HydrophobicContact CD1-CH2 4.09Å; I338-W347 HydrophobicContact CD1-CZ2 3.92Å; I338-W347 HydrophobicContact CG1-CH2 4.41Å; I338-W347 HydrophobicContact CG1-CZ2 4.05Å
339	E	93.7	Very high	94	Very high	24 Å²	24	44.5 Å²	44.5	11%	0.112	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	133.6	169.4	-69.5	-168.8	-154.9	0	0	110.9	E272 D341 A343 D344 P376 E377	E272-E339 HydrophobicContact CG-CG 4.41Å; E339-D341 VanDerWaalsContact C-N 3.31Å; E339-D341 PolarHBondContact O-N 3.22Å; E339-A343 VanDerWaalsContact O-CA 3.29Å; E339-A343 WeakPolarHBondContact O-CA 3.34Å; E339-A343 PolarHBondContact O-N 2.88Å; E339-D344 PolarHBondContact N-O 3.11Å; E339-P376 HydrophobicContact CG-CB 4.13Å; E339-P376 HydrophobicContact CG-CG 4.06Å; E339-E377 VanDerWaalsContact OE1-CG 3.3Å; E339-E377 WeakPolarHBondContact OE1-CG 3.27Å
340	A	89.3	Confident	93.8	Very high	30 Å²	30	42.1 Å²	42.1	25%	0.248	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-26.3	-176.4	0	0	0	0	0	113.1	D268 G271	D268-A340 HydrophobicContact CB-CB 4.33Å; G271-A340 VanDerWaalsContact O-CB 3.31Å; G271-A340 WeakPolarHBondContact O-CB 3.49Å; G271-A340 PolarHBondContact O-N 3.47Å
341	D	85.9	Confident	93	Very high	161 Å²	161	45.8 Å²	45.8	86%	0.861	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-41.7	-169.9	-85.1	-10.4	0	0	0	113.9	E339	E339-D341 VanDerWaalsContact C-N 3.31Å; E339-D341 PolarHBondContact O-N 3.22Å
342	D	87.9	Confident	92	Very high	94 Å²	94	46.1 Å²	46.1	50%	0.503	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-2.5	-177.6	59.8	16.9	0	0	0	115.1	D344	D342-D344 VanDerWaalsContact C-N 3.26Å; D342-D344 PolarHBondContact O-N 3.46Å; D342-D344 WeakPolarHBondContact OD1-CB 3.34Å; D342-D344 PolarHBondContact OD1-N 2.97Å; D342-D344 VanDerWaalsContact OD1-N 3.08Å
343	A	89.8	Confident	90.4	Very high	34 Å²	34	46.7 Å²	46.7	28%	0.281	27%	0.273	S	S	.	.			trans	64.7	24.4	-179.5	0	0	0	0	0	114.6	F326 I338 E339	F326-A343 HydrophobicContact CE1-CB 4.37Å; I338-A343 HydrophobicContact CG2-CB 4.45Å; E339-A343 VanDerWaalsContact O-CA 3.29Å; E339-A343 WeakPolarHBondContact O-CA 3.34Å; E339-A343 PolarHBondContact O-N 2.88Å
344	D	93.3	Very high	89.1	Confident	80 Å²	80	53.6 Å²	53.6	43%	0.428	31%	0.305	S	S	.	.			trans	-63.5	146.8	163.4	-75	-12.4	0	0	0	109.9	I338 E339 D342 P376	I338-D344 WeakPolarHBondContact CA-O 3.38Å; E339-D344 PolarHBondContact N-O 3.11Å; D342-D344 VanDerWaalsContact C-N 3.26Å; D342-D344 PolarHBondContact O-N 3.46Å; D342-D344 WeakPolarHBondContact OD1-CB 3.34Å; D342-D344 PolarHBondContact OD1-N 2.97Å; D342-D344 VanDerWaalsContact OD1-N 3.08Å; D344-P376 HydrophobicContact CB-CB 4.44Å
345	S	95.9	Very high	88.4	Confident	34 Å²	34	60.8 Å²	60.8	24%	0.238	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	145.4	-167.5	69.7	0	0	0	0	113.6	F326 V337 W347	F326-S345 WeakPolarHBondContact CD1-OG 3.35Å; V337-S345 WeakPolarHBondContact O-CA 3.41Å; V337-S345 VanDerWaalsContact O-CB 3.29Å; V337-S345 WeakPolarHBondContact O-CB 3.49Å; S345-W347 PolarHBondContact OG-NE1 3.23Å
346	V	96.5	Very high	88.1	Confident	22 Å²	22	62 Å²	62	13%	0.133	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138.8	172.3	66.3	0	0	0	0	109.6	G336 V337 I374 P376	G336-V346 CarbonylContact C-O 3.6Å; G336-V346 WeakPolarHBondContact CA-O 3.48Å; V337-V346 HydrophobicContact CB-CG1 4.08Å; V337-V346 HydrophobicContact CG2-CG1 4.31Å; V337-V346 PolarHBondContact N-O 3.24Å; V337-V346 PolarHBondContact O-N 2.93Å; V346-I374 HydrophobicContact CG1-CG2 3.61Å; V346-I374 HydrophobicContact CG2-CG2 4.15Å; V346-P376 HydrophobicContact CG1-CG 4.03Å
347	W	96.6	Very high	88	Confident	43 Å²	43	62.5 Å²	62.5	16%	0.163	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	142.8	-172.9	-62.8	85	0	0	0	111.2	V275 F277 F326 I328 Q334 I335 I338 S345 D349	V275-W347 HydrophobicContact CB-CH2 4.38Å; V275-W347 HydrophobicContact CG1-CH2 4.39Å; F277-W347 AromaticContact CD2-CH2 3.7Å; F277-W347 HydrophobicContact CD2-CH2 3.7Å; F277-W347 AromaticContact CD2-CZ3 3.84Å; F277-W347 HydrophobicContact CD2-CZ3 3.84Å; F277-W347 AromaticContact CE2-CH2 3.49Å; F277-W347 HydrophobicContact CE2-CH2 3.49Å; F277-W347 VanDerWaalsContact CE2-CH2 3.49Å; F277-W347 HydrophobicContact CE2-CZ2 4.3Å; F277-W347 HydrophobicContact CE2-CZ3 4.13Å; F326-W347 HydrophobicContact CB-CZ2 3.91Å; F326-W347 HydrophobicContact CD1-CZ2 4.35Å; F326-W347 AromaticContact CD2-CZ2 3.86Å; F326-W347 HydrophobicContact CD2-CZ2 3.86Å; F326-W347 HydrophobicContact CE2-CZ2 4.49Å; F326-W347 AromaticContact CG-CZ2 3.79Å; F326-W347 HydrophobicContact CG-CZ2 3.79Å; I328-W347 HydrophobicContact CD1-CD2 4.3Å; I328-W347 HydrophobicContact CD1-CE3 4.27Å; I328-W347 HydrophobicContact CD1-CH2 3.84Å; I328-W347 HydrophobicContact CD1-CZ2 3.79Å; I328-W347 HydrophobicContact CD1-CZ3 4.07Å; I328-W347 HydrophobicContact CG2-CB 4.33Å; I328-W347 HydrophobicContact CG2-CD2 3.65Å; I328-W347 HydrophobicContact CG2-CE3 4.24Å; I328-W347 HydrophobicContact CG2-CG 3.63Å; Q334-W347 HydrophobicContact CB-CE3 3.83Å; Q334-W347 HydrophobicContact CB-CZ3 3.88Å; I335-W347 VanDerWaalsContact C-CE3 3.44Å; I338-W347 HydrophobicContact CD1-CH2 4.09Å; I338-W347 HydrophobicContact CD1-CZ2 3.92Å; I338-W347 HydrophobicContact CG1-CH2 4.41Å; I338-W347 HydrophobicContact CG1-CZ2 4.05Å; S345-W347 PolarHBondContact OG-NE1 3.23Å; W347-D349 PolarHBondContact O-N 3.42Å
348	M	95.7	Very high	87.9	Confident	27 Å²	27	64.7 Å²	64.7	13%	0.133	37%	0.369	C	S	.	.			trans	-63.1	131	172.8	-172.9	-177	-172.1	0	0	110	I335 I350 P357 L362 W365	I335-M348 HydrophobicContact CG2-CB 3.7Å; I335-M348 HydrophobicContact CG2-CG 4.39Å; I335-M348 HydrophobicContact CG2-SD 3.85Å; I335-M348 PolarHBondContact O-N 3.4Å; M348-I350 HydrophobicContact CB-CG1 4.35Å; M348-I350 HydrophobicContact CG-CG1 4.15Å; M348-I350 PolarHBondContact O-N 2.95Å; M348-I350 HydrophobicContact SD-CD1 4.48Å; M348-I350 HydrophobicContact SD-CG1 4.22Å; M348-P357 HydrophobicContact CE-CB 3.78Å; M348-P357 HydrophobicContact CE-CG 4.32Å; M348-P357 HydrophobicContact SD-CB 4.37Å; M348-P357 HydrophobicContact SD-CG 4.27Å; M348-L362 HydrophobicContact SD-CD2 3.97Å; M348-W365 HydrophobicContact CB-CD2 4.26Å; M348-W365 HydrophobicContact CB-CG 4.48Å; M348-W365 HydrophobicContact CB-CZ2 4.27Å; M348-W365 HydrophobicContact CE-CB 4.43Å; M348-W365 HydrophobicContact CG-CD2 4.48Å; M348-W365 HydrophobicContact CG-CG 4.22Å; M348-W365 HydrophobicContact SD-CB 4.5Å; M348-W365 HydrophobicContact SD-CG 4.3Å
349	D	91.5	Very high	88	Confident	158 Å²	158	65.4 Å²	65.4	85%	0.845	37%	0.373	S	S	*	.			trans	-72.3	94.6	174.5	-172.6	13.1	0	0	0	110.1	W347	W347-D349 PolarHBondContact O-N 3.42Å
350	I	88.4	Confident	88.2	Confident	15 Å²	15	69.5 Å²	69.5	8%	0.077	40%	0.396	C	S	.	.			trans	-99.4	114.9	174.9	-58.9	174.9	0	0	0	107.9	F288 I335 M348 N352 P357	F288-I350 HydrophobicContact CE2-CD1 4.24Å; F288-I350 HydrophobicContact CZ-CD1 4.34Å; I335-I350 HydrophobicContact CG2-CD1 4.37Å; M348-I350 HydrophobicContact CB-CG1 4.35Å; M348-I350 HydrophobicContact CG-CG1 4.15Å; M348-I350 PolarHBondContact O-N 2.95Å; M348-I350 HydrophobicContact SD-CD1 4.48Å; M348-I350 HydrophobicContact SD-CG1 4.22Å; I350-N352 PolarHBondContact O-N 3.34Å; I350-P357 HydrophobicContact CD1-CG 4.26Å; I350-P357 HydrophobicContact CG1-CG 4.39Å
351	D	79.1	Confident	88.5	Confident	88 Å²	88	73 Å²	73	47%	0.471	41%	0.407	S	S	.	.			trans	-68.4	105.4	176.3	-173.6	-17.5	0	0	0	110.3	G353 E354	D351-G353 PolarHBondContact O-N 3.31Å; D351-G353 PolarHBondContact OD1-N 3.2Å; D351-E354 HydrophobicContact CB-CB 4.07Å; D351-E354 HydrophobicContact CB-CG 4.26Å; D351-E354 PolarHBondContact O-N 3.27Å; D351-E354 WeakPolarHBondContact OD2-CG 3.28Å
352	N	71.1	Confident	89.1	Confident	82 Å²	82	65.3 Å²	65.3	44%	0.439	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	0.5	179.5	-62.4	-44.9	0	0	0	114.7	H332 I350	H332-N352 VanDerWaalsContact CB-OD1 3.32Å; H332-N352 WeakPolarHBondContact CB-OD1 3.45Å; I350-N352 PolarHBondContact O-N 3.34Å
353	G	61.7	Low	89.5	Confident	69 Å²	69	62.9 Å²	62.9	71%	0.711	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.4	-2.1	173.2	0	0	0	0	0	116.1	D351	D351-G353 PolarHBondContact O-N 3.31Å; D351-G353 PolarHBondContact OD1-N 3.2Å
354	E	68.6	Low	89.9	Confident	151 Å²	151	66 Å²	66	71%	0.706	36%	0.364	S	S	*	.	S	Bend	trans	-113.4	-169.2	-179.5	-66.8	-162.4	162.7	0	0	112.7	D351	D351-E354 HydrophobicContact CB-CB 4.07Å; D351-E354 HydrophobicContact CB-CG 4.26Å; D351-E354 PolarHBondContact O-N 3.27Å; D351-E354 WeakPolarHBondContact OD2-CG 3.28Å
355	D	82.6	Confident	90.1	Very high	164 Å²	164	63.5 Å²	63.5	88%	0.877	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-73.7	134.3	179	-65.3	-38.9	0	0	0	109.5
356	L	92.4	Very high	90.1	Very high	25 Å²	25	62.1 Å²	62.1	13%	0.131	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-51.4	147.1	173.1	-71.9	170.1	0	0	0	111.6	D284 E287 F288 K291 P333	D284-L356 HydrophobicContact CB-CD1 4.25Å; D284-L356 WeakPolarHBondContact O-CD1 3.45Å; E287-L356 HydrophobicContact CB-CD1 3.96Å; E287-L356 HydrophobicContact CG-CD1 4.04Å; F288-L356 HydrophobicContact CB-CD1 4.14Å; F288-L356 HydrophobicContact CD2-CD2 4.3Å; K291-L356 PolarHBondContact NZ-O 2.93Å; P333-L356 HydrophobicContact CB-CD2 4.3Å; P333-L356 HydrophobicContact CG-CD2 3.99Å
357	P	94.8	Very high	90	Very high	10 Å²	10	66.8 Å²	66.8	7%	0.065	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-55	146.3	-178.7	25.8	-36.1	0	0	0	110.9	F288 K291 M348 I350 E361 L362	F288-P357 HydrophobicContact CD2-CG 4.41Å; F288-P357 HydrophobicContact CE2-CG 3.82Å; K291-P357 WeakPolarHBondContact CD-O 3.17Å; K291-P357 WeakPolarHBondContact CE-O 3.32Å; K291-P357 PolarHBondContact NZ-O 3.14Å; M348-P357 HydrophobicContact CE-CB 3.78Å; M348-P357 HydrophobicContact CE-CG 4.32Å; M348-P357 HydrophobicContact SD-CB 4.37Å; M348-P357 HydrophobicContact SD-CG 4.27Å; I350-P357 HydrophobicContact CD1-CG 4.26Å; I350-P357 HydrophobicContact CG1-CG 4.39Å; P357-E361 HydrophobicContact CB-CB 4.27Å; P357-L362 HydrophobicContact CB-CD2 4.33Å; P357-L362 HydrophobicContact CB-CG 4.22Å; P357-L362 HydrophobicContact CG-CD2 3.9Å; P357-L362 HydrophobicContact CG-CG 4.14Å
358	S	95.9	Very high	90	Very high	46 Å²	46	68.2 Å²	68.2	32%	0.322	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-75.1	167.2	173.7	63.2	0	0	0	0	111.3	D360 E361 L362	S358-D360 VanDerWaalsContact C-N 3.32Å; S358-D360 PolarHBondContact O-N 2.96Å; S358-E361 WeakPolarHBondContact CB-OE2 3.3Å; S358-E361 PolarHBondContact N-OE2 3.09Å; S358-E361 PolarHBondContact O-N 3.22Å; S358-E361 VanDerWaalsContact OG-CD 3.28Å; S358-E361 WeakPolarHBondContact OG-CG 3.26Å; S358-E361 PolarHBondContact OG-N 2.98Å; S358-E361 PolarHBondContact OG-OE2 3.46Å; S358-L362 WeakPolarHBondContact O-CG 3.42Å; S358-L362 PolarHBondContact O-N 3.24Å
359	V	97.3	Very high	89.9	Confident	16 Å²	16	67.3 Å²	67.3	10%	0.097	37%	0.365	C	S	.	.	H	α-helix	trans	-58.5	-46.1	175.8	173.6	0	0	0	0	110.6	K291 Q294 V295 E361 L362 E363	K291-V359 HydrophobicContact CB-CG2 4.07Å; K291-V359 HydrophobicContact CG-CG2 4.26Å; Q294-V359 HydrophobicContact CB-CG2 4.2Å; Q294-V359 HydrophobicContact CG-CG1 4.41Å; Q294-V359 HydrophobicContact CG-CG2 4.42Å; V295-V359 HydrophobicContact CG2-CG1 3.84Å; V359-E361 VanDerWaalsContact C-N 3.31Å; V359-E361 PolarHBondContact O-N 3.04Å; V359-L362 PolarHBondContact O-N 3.05Å; V359-E363 HydrophobicContact CG1-CG 4.44Å; V359-E363 WeakPolarHBondContact O-CG 3.49Å; V359-E363 PolarHBondContact O-N 3.07Å
360	D	97.2	Very high	89.9	Confident	111 Å²	111	63.1 Å²	63.1	59%	0.594	34%	0.342	S	S	*	.	H	α-helix	trans	-59.2	-40.1	178	-59.4	-4.7	0	0	0	111.8	S358 E363 D364	S358-D360 VanDerWaalsContact C-N 3.32Å; S358-D360 PolarHBondContact O-N 2.96Å; D360-E363 PolarHBondContact O-N 2.98Å; D360-D364 WeakPolarHBondContact O-CB 3.46Å; D360-D364 PolarHBondContact O-N 2.84Å
361	E	96.8	Very high	90.2	Very high	103 Å²	103	65.8 Å²	65.8	48%	0.481	36%	0.362	S	S	.	.	H	α-helix	trans	-70.3	-34.5	178.2	-73.5	161.2	147.9	0	0	112.7	P357 S358 V359 W365	P357-E361 HydrophobicContact CB-CB 4.27Å; S358-E361 WeakPolarHBondContact CB-OE2 3.3Å; S358-E361 PolarHBondContact N-OE2 3.09Å; S358-E361 PolarHBondContact O-N 3.22Å; S358-E361 VanDerWaalsContact OG-CD 3.28Å; S358-E361 WeakPolarHBondContact OG-CG 3.26Å; S358-E361 PolarHBondContact OG-N 2.98Å; S358-E361 PolarHBondContact OG-OE2 3.46Å; V359-E361 VanDerWaalsContact C-N 3.31Å; V359-E361 PolarHBondContact O-N 3.04Å; E361-W365 WeakPolarHBondContact O-CB 3.47Å; E361-W365 PolarHBondContact O-N 3.34Å; E361-W365 VanDerWaalsContact O-N 3.14Å
362	L	97.4	Very high	90.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-68.3	-42.4	173.1	-72.2	169.1	0	0	0	111.2	F288 K291 L292 V295 I335 M348 P357 S358 V359 W365 L366	F288-L362 HydrophobicContact CE2-CD1 4.22Å; F288-L362 HydrophobicContact CE2-CD2 3.98Å; F288-L362 HydrophobicContact CZ-CD2 4.17Å; K291-L362 HydrophobicContact CB-CD1 3.98Å; L292-L362 HydrophobicContact CD2-CD1 4.35Å; V295-L362 HydrophobicContact CG2-CB 3.9Å; V295-L362 HydrophobicContact CG2-CD1 4.22Å; I335-L362 HydrophobicContact CD1-CD2 4.39Å; I335-L362 HydrophobicContact CG2-CD2 4.09Å; M348-L362 HydrophobicContact SD-CD2 3.97Å; P357-L362 HydrophobicContact CB-CD2 4.33Å; P357-L362 HydrophobicContact CB-CG 4.22Å; P357-L362 HydrophobicContact CG-CD2 3.9Å; P357-L362 HydrophobicContact CG-CG 4.14Å; S358-L362 WeakPolarHBondContact O-CG 3.42Å; S358-L362 PolarHBondContact O-N 3.24Å; V359-L362 PolarHBondContact O-N 3.05Å; L362-W365 PolarHBondContact O-N 2.59Å; L362-L366 WeakPolarHBondContact O-CB 3.46Å; L362-L366 WeakPolarHBondContact O-CD1 3.29Å; L362-L366 WeakPolarHBondContact O-CG 3.45Å; L362-L366 PolarHBondContact O-N 2.95Å
363	E	97.2	Very high	91.4	Very high	42 Å²	42	65 Å²	65	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-62.5	-47.6	176.1	-71.9	-172.6	157.9	0	0	111.6	V295 D298 N299 V359 D360 W365 L366 E367	V295-E363 HydrophobicContact CG1-CG 4.19Å; V295-E363 HydrophobicContact CG2-CG 4.18Å; D298-E363 WeakPolarHBondContact CB-OE1 3.27Å; N299-E363 PolarHBondContact ND2-OE1 3.49Å; V359-E363 HydrophobicContact CG1-CG 4.44Å; V359-E363 WeakPolarHBondContact O-CG 3.49Å; V359-E363 PolarHBondContact O-N 3.07Å; D360-E363 PolarHBondContact O-N 2.98Å; E363-W365 VanDerWaalsContact C-N 3.32Å; E363-W365 PolarHBondContact O-N 3.24Å; E363-L366 PolarHBondContact O-N 3.47Å; E363-E367 WeakPolarHBondContact O-CG 3.48Å; E363-E367 PolarHBondContact O-N 3.44Å
364	D	97	Very high	92.6	Very high	99 Å²	99	63.5 Å²	63.5	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-57.8	-44.9	177.5	-75.8	-15.3	0	0	0	110.9	D360 E367 D368	D360-D364 WeakPolarHBondContact O-CB 3.46Å; D360-D364 PolarHBondContact O-N 2.84Å; D364-E367 PolarHBondContact O-N 2.71Å; D364-D368 PolarHBondContact O-N 3.48Å; D364-D368 VanDerWaalsContact O-N 3.1Å
365	W	97.6	Very high	93.3	Very high	28 Å²	28	58.3 Å²	58.3	11%	0.106	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-41.1	178	-175.5	86.7	0	0	0	112.5	I274 I335 V337 M348 E361 L362 E363 D368 V369 I374	I274-W365 HydrophobicContact CG2-CZ3 4.47Å; I335-W365 HydrophobicContact CD1-CZ3 4.26Å; I335-W365 HydrophobicContact CG1-CZ3 4Å; V337-W365 HydrophobicContact CG2-CH2 3.81Å; V337-W365 HydrophobicContact CG2-CZ2 4.44Å; M348-W365 HydrophobicContact CB-CD2 4.26Å; M348-W365 HydrophobicContact CB-CG 4.48Å; M348-W365 HydrophobicContact CB-CZ2 4.27Å; M348-W365 HydrophobicContact CE-CB 4.43Å; M348-W365 HydrophobicContact CG-CD2 4.48Å; M348-W365 HydrophobicContact CG-CG 4.22Å; M348-W365 HydrophobicContact SD-CB 4.5Å; M348-W365 HydrophobicContact SD-CG 4.3Å; E361-W365 WeakPolarHBondContact O-CB 3.47Å; E361-W365 PolarHBondContact O-N 3.34Å; E361-W365 VanDerWaalsContact O-N 3.14Å; L362-W365 PolarHBondContact O-N 2.59Å; E363-W365 VanDerWaalsContact C-N 3.32Å; E363-W365 PolarHBondContact O-N 3.24Å; W365-D368 PolarHBondContact O-N 3.47Å; W365-V369 HydrophobicContact CD2-CG2 4.12Å; W365-V369 HydrophobicContact CE3-CG2 3.98Å; W365-V369 HydrophobicContact CH2-CG2 3.66Å; W365-V369 HydrophobicContact CZ2-CG2 3.81Å; W365-V369 HydrophobicContact CZ3-CG2 3.76Å; W365-V369 WeakPolarHBondContact O-CG2 3.48Å; W365-V369 PolarHBondContact O-N 3.19Å; W365-I374 HydrophobicContact CG-CD1 4.26Å
366	L	96.7	Very high	93.3	Very high	5 Å²	5	51 Å²	51	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-68	-34.9	176.1	-70	167.9	0	0	0	112.3	I274 V295 L305 I307 I335 L362 E363 D368 V369 L370	I274-L366 HydrophobicContact CD1-CD2 3.95Å; I274-L366 HydrophobicContact CG2-CD2 3.68Å; V295-L366 HydrophobicContact CG1-CD1 3.55Å; L305-L366 HydrophobicContact CD1-CD1 4.41Å; L305-L366 HydrophobicContact CD1-CD2 4.27Å; I307-L366 HydrophobicContact CD1-CD1 3.84Å; I307-L366 HydrophobicContact CD1-CD2 4.47Å; I335-L366 HydrophobicContact CD1-CD2 4.32Å; L362-L366 WeakPolarHBondContact O-CB 3.46Å; L362-L366 WeakPolarHBondContact O-CD1 3.29Å; L362-L366 WeakPolarHBondContact O-CG 3.45Å; L362-L366 PolarHBondContact O-N 2.95Å; E363-L366 PolarHBondContact O-N 3.47Å; L366-D368 VanDerWaalsContact C-N 3.33Å; L366-V369 PolarHBondContact O-N 3.03Å; L366-L370 WeakPolarHBondContact O-CB 3.42Å; L366-L370 WeakPolarHBondContact O-CG 3.46Å; L366-L370 PolarHBondContact O-N 2.9Å
367	E	95.2	Very high	92.4	Very high	121 Å²	121	56.6 Å²	56.6	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-62	-42.9	173.1	-76.4	-170.6	177.2	0	0	111.2	E363 D364 L370 S371	E363-E367 WeakPolarHBondContact O-CG 3.48Å; E363-E367 PolarHBondContact O-N 3.44Å; D364-E367 PolarHBondContact O-N 2.71Å; E367-L370 PolarHBondContact O-N 3.3Å; E367-S371 VanDerWaalsContact O-CB 3.3Å; E367-S371 WeakPolarHBondContact O-CB 3.45Å; E367-S371 PolarHBondContact O-N 2.77Å; E367-S371 PolarHBondContact O-OG 3.43Å
368	D	95.4	Very high	90.8	Very high	73 Å²	73	62.7 Å²	62.7	39%	0.39	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-47.4	177.2	-70.9	-15.6	0	0	0	110.8	D364 W365 L366 S371 G372 D373 I374	D364-D368 PolarHBondContact O-N 3.48Å; D364-D368 VanDerWaalsContact O-N 3.1Å; W365-D368 PolarHBondContact O-N 3.47Å; L366-D368 VanDerWaalsContact C-N 3.33Å; D368-S371 PolarHBondContact O-N 2.89Å; D368-S371 PolarHBondContact O-OG 2.74Å; D368-G372 PolarHBondContact O-N 2.84Å; D368-D373 HydrophobicContact CB-CB 4.25Å; D368-D373 PolarHBondContact O-N 2.92Å; D368-I374 HydrophobicContact CB-CD1 3.73Å; D368-I374 HydrophobicContact CB-CG1 3.98Å
369	V	94.1	Very high	88.9	Confident	7 Å²	7	66.4 Å²	66.4	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-54.8	-54.7	172.7	166.2	0	0	0	0	111.7	I274 V337 W365 L366 S371 G372 I374	I274-V369 HydrophobicContact CD1-CG1 4.07Å; I274-V369 HydrophobicContact CG1-CG1 4.21Å; V337-V369 HydrophobicContact CG2-CB 4.22Å; V337-V369 HydrophobicContact CG2-CG1 3.46Å; V337-V369 VanDerWaalsContact CG2-CG1 3.46Å; V337-V369 HydrophobicContact CG2-CG2 3.63Å; W365-V369 HydrophobicContact CD2-CG2 4.12Å; W365-V369 HydrophobicContact CE3-CG2 3.98Å; W365-V369 HydrophobicContact CH2-CG2 3.66Å; W365-V369 HydrophobicContact CZ2-CG2 3.81Å; W365-V369 HydrophobicContact CZ3-CG2 3.76Å; W365-V369 WeakPolarHBondContact O-CG2 3.48Å; W365-V369 PolarHBondContact O-N 3.19Å; L366-V369 PolarHBondContact O-N 3.03Å; V369-S371 PolarHBondContact O-N 3.17Å; V369-S371 VanDerWaalsContact O-N 3.1Å; V369-G372 PolarHBondContact O-N 2.61Å; V369-I374 HydrophobicContact CG2-CB 3.87Å; V369-I374 HydrophobicContact CG2-CD1 4.32Å; V369-I374 HydrophobicContact CG2-CG2 3.89Å
370	L	92.7	Very high	86.9	Confident	70 Å²	70	72.3 Å²	72.3	37%	0.366	38%	0.381	S	S	.	.	H	α-helix	trans	-66	-18.7	-176.9	-69.2	176.8	0	0	0	113.4	I274 N304 L305 L366 E367	I274-L370 HydrophobicContact CD1-CD2 4.19Å; N304-L370 WeakPolarHBondContact O-CD2 3.48Å; L305-L370 HydrophobicContact CB-CD1 4.26Å; L305-L370 HydrophobicContact CD1-CD1 4.23Å; L366-L370 WeakPolarHBondContact O-CB 3.42Å; L366-L370 WeakPolarHBondContact O-CG 3.46Å; L366-L370 PolarHBondContact O-N 2.9Å; E367-L370 PolarHBondContact O-N 3.3Å
371	S	92.7	Very high	84.6	Confident	71 Å²	71	74 Å²	74	50%	0.497	39%	0.39	S	S	.	.	H	α-helix	trans	-87.2	-12.4	175.3	77	0	0	0	0	113.6	E367 D368 V369 D373	E367-S371 VanDerWaalsContact O-CB 3.3Å; E367-S371 WeakPolarHBondContact O-CB 3.45Å; E367-S371 PolarHBondContact O-N 2.77Å; E367-S371 PolarHBondContact O-OG 3.43Å; D368-S371 PolarHBondContact O-N 2.89Å; D368-S371 PolarHBondContact O-OG 2.74Å; V369-S371 PolarHBondContact O-N 3.17Å; V369-S371 VanDerWaalsContact O-N 3.1Å; S371-D373 PolarHBondContact OG-N 2.7Å; S371-D373 PolarHBondContact OG-OD2 3.01Å
372	G	88.8	Confident	82.4	Confident	35 Å²	35	76.6 Å²	76.6	36%	0.361	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	17.4	-172.6	0	0	0	0	0	113.5	D368 V369 I374	D368-G372 PolarHBondContact O-N 2.84Å; V369-G372 PolarHBondContact O-N 2.61Å; G372-I374 VanDerWaalsContact C-N 3.29Å
373	D	87.9	Confident	80.3	Confident	118 Å²	118	84.5 Å²	84.5	63%	0.631	45%	0.45	S	S	*	.	S	Bend	trans	-80.3	-16.6	173.3	-75.9	-11.8	0	0	0	111.1	D368 S371	D368-D373 HydrophobicContact CB-CB 4.25Å; D368-D373 PolarHBondContact O-N 2.92Å; S371-D373 PolarHBondContact OG-N 2.7Å; S371-D373 PolarHBondContact OG-OD2 3.01Å
374	I	87.1	Confident	78.1	Confident	38 Å²	38	89.8 Å²	89.8	20%	0.195	48%	0.479	C	S	.	.	S	Bend	trans	-125.2	114.3	168.9	-63.9	173.9	0	0	0	106.8	V346 W365 D368 V369 G372	V346-I374 HydrophobicContact CG1-CG2 3.61Å; V346-I374 HydrophobicContact CG2-CG2 4.15Å; W365-I374 HydrophobicContact CG-CD1 4.26Å; D368-I374 HydrophobicContact CB-CD1 3.73Å; D368-I374 HydrophobicContact CB-CG1 3.98Å; V369-I374 HydrophobicContact CG2-CB 3.87Å; V369-I374 HydrophobicContact CG2-CD1 4.32Å; V369-I374 HydrophobicContact CG2-CG2 3.89Å; G372-I374 VanDerWaalsContact C-N 3.29Å
375	D	83.5	Confident	75.9	Confident	43 Å²	43	92.6 Å²	92.6	23%	0.23	49%	0.494	C	S	.	.			trans	-143.9	128.9	-174.2	-173.1	-24.4	0	0	0	108.5	E377 E378	D375-E377 PolarHBondContact O-N 3.28Å; D375-E377 PolarHBondContact OD1-N 3.26Å; D375-E378 HydrophobicContact CB-CG 4.39Å; D375-E378 PolarHBondContact O-N 3.19Å
376	P	81.6	Confident	73.7	Confident	11 Å²	11	98.4 Å²	98.4	7%	0.071	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-54.9	-29	174.7	-22.3	32.5	0	0	0	114.2	V337 E339 D344 V346 E378	V337-P376 HydrophobicContact CB-CG 4.4Å; V337-P376 HydrophobicContact CG1-CG 4.37Å; E339-P376 HydrophobicContact CG-CB 4.13Å; E339-P376 HydrophobicContact CG-CG 4.06Å; D344-P376 HydrophobicContact CB-CB 4.44Å; V346-P376 HydrophobicContact CG1-CG 4.03Å; P376-E378 VanDerWaalsContact C-N 3.34Å; P376-E378 PolarHBondContact O-N 3.44Å
377	E	74.5	Confident	71.7	Confident	142 Å²	142	105.3 Å²	105.3	66%	0.664	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-69.6	-24.7	179.4	-68.2	-163.1	170.9	0	0	113.6	E339 D375	E339-E377 VanDerWaalsContact OE1-CG 3.3Å; E339-E377 WeakPolarHBondContact OE1-CG 3.27Å; D375-E377 PolarHBondContact O-N 3.28Å; D375-E377 PolarHBondContact OD1-N 3.26Å
378	E	61.2	Low	69.8	Low	137 Å²	137	106.6 Å²	106.6	64%	0.64	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-84.5	-12.2	-173.4	-71.1	-158.5	164.3	0	0	114.4	D375 P376 D380	D375-E378 HydrophobicContact CB-CG 4.39Å; D375-E378 PolarHBondContact O-N 3.19Å; P376-E378 VanDerWaalsContact C-N 3.34Å; P376-E378 PolarHBondContact O-N 3.44Å; E378-D380 PolarHBondContact O-N 3.04Å
379	D	55.6	Low	67.9	Low	124 Å²	124	110.4 Å²	110.4	66%	0.663	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-75.5	-6.5	-178.2	-101.4	-18.2	0	0	0	113.8
380	D	54.1	Low	66.1	Low	141 Å²	141	116.9 Å²	116.9	75%	0.754	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-91.2	-6.7	-174.8	-94.7	-1.4	0	0	0	115.3	E378	E378-D380 PolarHBondContact O-N 3.04Å
381	D	50	Low	64.3	Low	145 Å²	145	121.5 Å²	121.5	78%	0.775	66%	0.655	S	S	*	*	S	Bend	trans	-104.8	2.4	-165.5	-96.2	-11.2	0	0	0	116.6
382	D	50.9	Low	62.7	Low	159 Å²	159	125 Å²	125	85%	0.85	67%	0.668	S	S	*	*	S	Bend	trans	-116.5	28.2	-165.8	-102.1	-0.1	0	0	0	117.2
383	D	52.1	Low	60.9	Low	166 Å²	166	131 Å²	131	89%	0.888	69%	0.692	S	S	*	*			trans	-126.4	30.8	178.5	-109.4	-3.2	0	0	0	115.4
384	D	51.7	Low	59.5	Low	153 Å²	153	132 Å²	132	82%	0.818	70%	0.697	S	S	*	*			trans	-118	53.5	174.5	-97.2	-5.9	0	0	0	112.6
385	D	50.1	Low	57.8	Low	157 Å²	157	136.5 Å²	136.5	84%	0.84	72%	0.722	S	S	*	*			trans	-101.5	66.1	161.8	-95.3	-14.9	0	0	0	110	D387	D385-D387 VanDerWaalsContact C-N 3.3Å; D385-D387 PolarHBondContact O-N 3.48Å
386	D	52.9	Low	56.4	Low	151 Å²	151	140.6 Å²	140.6	81%	0.807	74%	0.743	S	S	*	*			trans	-71.7	86.5	161	-96	-22.1	0	0	0	108.7	D388	D386-D388 VanDerWaalsContact C-N 3.31Å; D386-D388 PolarHBondContact O-N 3.32Å
387	D	53.6	Low	55	Low	149 Å²	149	145.7 Å²	145.7	80%	0.797	77%	0.77	S	S	*	*			trans	-68.4	90.5	164.1	-96.1	-26.8	0	0	0	109.1	D385 D389	D385-D387 VanDerWaalsContact C-N 3.3Å; D385-D387 PolarHBondContact O-N 3.48Å; D387-D389 VanDerWaalsContact C-N 3.31Å; D387-D389 PolarHBondContact O-N 3.18Å
388	D	55.3	Low	54	Low	149 Å²	149	145.1 Å²	145.1	80%	0.797	77%	0.772	S	S	*	*			trans	-56.5	88	158.3	-88	-33.2	0	0	0	109.9	D386	D386-D388 VanDerWaalsContact C-N 3.31Å; D386-D388 PolarHBondContact O-N 3.32Å
389	D	54.7	Low	53.6	Low	152 Å²	152	144.4 Å²	144.4	81%	0.813	77%	0.772	S	S	*	*			trans	-98.5	89	160.1	-95.3	-19.3	0	0	0	109.5	D387 D391	D387-D389 VanDerWaalsContact C-N 3.31Å; D387-D389 PolarHBondContact O-N 3.18Å; D389-D391 PolarHBondContact O-N 3.45Å
390	D	58	Low	53.5	Low	144 Å²	144	144.8 Å²	144.8	77%	0.77	77%	0.774	S	S	*	*			trans	-47	117.9	153.9	-82.8	-39	0	0	0	110.3
391	D	53.7	Low	53.5	Low	166 Å²	166	144.5 Å²	144.5	89%	0.888	77%	0.773	S	S	*	*			trans	-144.3	99.6	149.9	-99.4	-26	0	0	0	109.7	D389	D389-D391 PolarHBondContact O-N 3.45Å
392	D	58.5	Low	53.7	Low	146 Å²	146	143.6 Å²	143.6	78%	0.781	77%	0.768	S	S	*	*			trans	-50.2	133.7	159	-76.5	-46	0	0	0	111.1
393	D	52.4	Low	53.8	Low	160 Å²	160	143.7 Å²	143.7	86%	0.856	76%	0.763	S	S	*	*			trans	-160.9	96.3	141.2	-100.4	-22.3	0	0	0	110.1
394	D	57.4	Low	54	Low	139 Å²	139	142.5 Å²	142.5	74%	0.743	76%	0.757	S	S	*	*			trans	7.2	126.5	138	-73	-28.4	0	0	0	118.4
395	D	52.2	Low	54.1	Low	133 Å²	133	141.6 Å²	141.6	71%	0.711	75%	0.752	S	S	*	*				157.6	123.5	104.1	-91.6	-25.1	0	0	0	112.8
396	D	53.7	Low	54.3	Low	128 Å²	128	140.5 Å²	140.5	68%	0.684	75%	0.746	S	S	*	*				85.9	131	128.1	-73	-16.1	0	0	0	124.1
397	D	52.7	Low	54.4	Low	118 Å²	118	139.8 Å²	139.8	63%	0.631	74%	0.742	S	S	*	*			trans	82	105.9	142.8	-62.9	-12.1	0	0	0	117.3
398	D	52.9	Low	54.3	Low	131 Å²	131	138.3 Å²	138.3	70%	0.701	74%	0.735	S	S	*	*				112.9	143.2	81.7	-88.2	-12.6	0	0	0	104.2
399	D	52.9	Low	54.4	Low	121 Å²	121	137.1 Å²	137.1	65%	0.647	73%	0.728	S	S	*	*			cis	-175.3	166.7	6.4	-122.3	-21.5	0	0	0	103.8
400	D	53.6	Low	54.4	Low	133 Å²	133	137 Å²	137	71%	0.711	73%	0.727	S	S	*	*			trans	70.3	134.3	155.7	-55.6	-21.5	0	0	0	117.4
401	D	53.9	Low	54.3	Low	135 Å²	135	136.3 Å²	136.3	72%	0.722	72%	0.724	S	S	*	*			cis	157.5	165	-5.1	-114.7	-14.4	0	0	0	103
402	D	54.7	Low	54.4	Low	125 Å²	125	134.6 Å²	134.6	67%	0.668	71%	0.714	S	S	*	*			trans	88.9	98.1	160.3	-56.2	-21.5	0	0	0	117
403	E	52.6	Low	54.3	Low	161 Å²	161	133.7 Å²	133.7	75%	0.752	71%	0.71	S	S	*	*				82.8	99.6	83.7	-78.8	-176.3	-173.3	0	0	109.2
404	D	56.3	Low	54.5	Low	141 Å²	141	132.2 Å²	132.2	75%	0.754	70%	0.702	S	S	*	*				96.3	152.7	85.9	-90.6	-16.4	0	0	0	111.8
405	D	53.3	Low	54.4	Low	134 Å²	134	133.3 Å²	133.3	72%	0.717	71%	0.708	S	S	*	*			trans	88	94.3	158.9	-60.1	-16.9	0	0	0	119.3
406	D	56.1	Low	54.6	Low	135 Å²	135	133.4 Å²	133.4	72%	0.722	71%	0.708	S	S	*	*				56.5	149.1	97.5	-72.5	-12.9	0	0	0	121.5
407	D	53.1	Low	54.6	Low	135 Å²	135	135 Å²	135	72%	0.722	72%	0.716	S	S	*	*			trans	79.8	142.2	155.7	-58.5	-17.1	0	0	0	117
408	D	53.3	Low	54.8	Low	119 Å²	119	135.8 Å²	135.8	64%	0.636	72%	0.721	S	S	*	*			cis	-177	157.2	-11.5	-108.1	-21.9	0	0	0	104.1
409	D	55.9	Low	55	Low	124 Å²	124	137.7 Å²	137.7	66%	0.663	73%	0.731	S	S	*	*			trans	39.8	130.8	138.9	-59.6	-22.7	0	0	0	122.6
410	D	55.6	Low	55.1	Low	149 Å²	149	138.5 Å²	138.5	80%	0.797	74%	0.736	S	S	*	*				163.6	103.7	113.2	-83.4	-25.5	0	0	0	106.8
411	D	56	Low	55.1	Low	130 Å²	130	139.4 Å²	139.4	70%	0.695	74%	0.74	S	S	*	*				63.3	133.9	79.6	-86.9	-9.9	0	0	0	114.7
412	D	56.3	Low	55.3	Low	129 Å²	129	139.5 Å²	139.5	69%	0.69	74%	0.741	S	S	*	*			trans	74.5	139.9	146.6	-64.1	-8	0	0	0	118
413	D	55.7	Low	55.2	Low	128 Å²	128	141.2 Å²	141.2	68%	0.684	75%	0.75	S	S	*	*			cis	-162.9	151	15.7	-105.1	-31.1	0	0	0	109.3
414	D	56.1	Low	55.6	Low	129 Å²	129	140.6 Å²	140.6	69%	0.69	75%	0.752	S	S	*	*			trans	6	138.8	134.6	-63	-26.8	0	0	0	119
415	D	54.7	Low	55.6	Low	162 Å²	162	141.6 Å²	141.6	87%	0.866	76%	0.757	S	S	*	*				-168	126.5	107.1	-97	-26	0	0	0	111.7
416	D	56.5	Low	56	Low	135 Å²	135	142.3 Å²	142.3	72%	0.722	76%	0.761	S	S	*	*			trans	-50.2	154.9	159.8	-67.4	-52.2	0	0	0	112.3
417	D	54.3	Low	56.2	Low	160 Å²	160	143.8 Å²	143.8	86%	0.856	77%	0.769	S	S	*	*				-174.6	129.9	111.2	-95.6	-25.7	0	0	0	111.3
418	D	57.3	Low	56.3	Low	135 Å²	135	148.7 Å²	148.7	72%	0.722	80%	0.795	S	S	*	*			trans	-49	155.6	164.1	-65.6	-52.3	0	0	0	113
419	D	56	Low	56.5	Low	171 Å²	171	150.2 Å²	150.2	91%	0.914	80%	0.803	S	S	*	*				-159.1	107.6	128.8	-96.8	-26.2	0	0	0	108.9
420	D	56.9	Low	56.5	Low	139 Å²	139	151.5 Å²	151.5	74%	0.743	81%	0.81	S	S	*	*			trans	-53.1	146.4	153.9	-73.3	-47.2	0	0	0	110.4
421	D	53.2	Low	56.6	Low	151 Å²	151	151.7 Å²	151.7	81%	0.807	81%	0.811	S	S	*	*				176.5	131.6	114.3	-92.5	-22.7	0	0	0	111.9
422	D	56.5	Low	56.6	Low	138 Å²	138	152.9 Å²	152.9	74%	0.738	82%	0.818	S	S	*	*			trans	-23.4	147.8	158.3	-64.7	-41.7	0	0	0	117.5
423	D	54.5	Low	56.6	Low	161 Å²	161	154.4 Å²	154.4	86%	0.861	83%	0.826	S	S	*	*				-174	131.3	108.8	-96	-27.4	0	0	0	111.8
424	D	59.9	Low	56.7	Low	147 Å²	147	156.2 Å²	156.2	79%	0.786	84%	0.835	S	S	*	*			trans	-52.7	150.1	162.8	-70.6	-50.6	0	0	0	112.1
425	D	56.1	Low	56.7	Low	163 Å²	163	158.1 Å²	158.1	87%	0.872	85%	0.846	S	S	*	*				-170.9	130.8	121.7	-99.5	-24.9	0	0	0	111.5
426	D	62.2	Low	56.9	Low	149 Å²	149	157.8 Å²	157.8	80%	0.797	84%	0.844	S	S	*	*			trans	-51.8	154	166.5	-71.7	-51.9	0	0	0	112.7
427	D	60.8	Low	56.9	Low	166 Å²	166	159.8 Å²	159.8	89%	0.888	85%	0.854	S	S	*	*			trans	-161.7	140.1	130.2	-102.8	-23.1	0	0	0	112
428	D	54.9	Low	57.1	Low	237 Å²	237	159.7 Å²	159.7	100%	1.267	85%	0.854	S	S	*	*			trans	-43.2	0	-178	-76.9	-48.9	0	0	0	119.1

Retrieved 428 of 428 residues in 285.8 ms (Link to these results)

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