A0A077Z106_TRITR Loading...

Leucine rich repeat and calponiny

AlphaFold DB , UniProt , Accession A0A077Z106, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 494 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	32.7	Very low	234 Å²	234	123.7 Å²	123.7	100%	1.153	85%	0.851	S	S	*	*				0	110.6	0	-91.9	-167.7	-177.8	0	0	106.4	I3	M1-I3 PolarHBondContact O-N 3.11Å
2	A	29.2	Very low	33	Very low	102 Å²	102	123.2 Å²	123.2	84%	0.843	84%	0.839	S	S	*	*			trans	-67	125.9	176.9	0	0	0	0	0	109.3
3	I	38.9	Very low	33.3	Very low	169 Å²	169	118.8 Å²	118.8	87%	0.867	81%	0.811	S	S	*	*			trans	-105.7	112	161.9	-57.3	-178.1	0	0	0	106.5	M1	M1-I3 PolarHBondContact O-N 3.11Å
4	V	37.6	Very low	34.2	Very low	124 Å²	124	114.6 Å²	114.6	75%	0.752	80%	0.797	S	S	*	*			trans	-52.9	132.1	-179.6	169.5	0	0	0	0	111.8	G6	V4-G6 PolarHBondContact O-N 3.35Å
5	S	32.6	Very low	35.3	Very low	125 Å²	125	110.6 Å²	110.6	87%	0.874	77%	0.769	S	S	*	*			trans	-57.8	116.9	160.3	-68.5	0	0	0	0	110.1
6	G	32.6	Very low	36.1	Very low	68 Å²	68	107.7 Å²	107.7	70%	0.701	75%	0.748	S	S	*	*			trans	-143.5	114.6	172.6	0	0	0	0	0	109.5	V4	V4-G6 PolarHBondContact O-N 3.35Å
7	A	30.6	Very low	37.5	Very low	116 Å²	116	108.2 Å²	108.2	96%	0.959	74%	0.74	S	S	*	*			trans	-56.3	138.3	174.4	0	0	0	0	0	111.6
8	G	31.1	Very low	38.9	Very low	69 Å²	69	105 Å²	105	71%	0.711	72%	0.719	S	S	*	*			trans	177.9	99	173.8	0	0	0	0	0	111.1	G10	G8-G10 PolarHBondContact O-N 2.92Å; G8-G10 VanDerWaalsContact O-N 3.15Å
9	D	31.6	Very low	40.1	Very low	185 Å²	185	108.6 Å²	108.6	99%	0.989	72%	0.715	S	S	*	*			trans	-53.4	114	160	-85.4	-39.4	0	0	0	108.7
10	G	31	Very low	41.8	Very low	58 Å²	58	106.8 Å²	106.8	60%	0.598	70%	0.704	S	S	*	*			trans	-177.4	121.7	-179.5	0	0	0	0	0	109.3	G8 V12	G8-G10 PolarHBondContact O-N 2.92Å; G8-G10 VanDerWaalsContact O-N 3.15Å; G10-V12 PolarHBondContact O-N 3.47Å
11	A	34.3	Very low	43.7	Very low	111 Å²	111	103.2 Å²	103.2	92%	0.917	68%	0.678	S	S	*	*			trans	-59.8	79.6	179.1	0	0	0	0	0	111.7	S13	A11-S13 PolarHBondContact O-N 3.44Å
12	V	36.8	Very low	46.1	Very low	117 Å²	117	94.2 Å²	94.2	71%	0.709	63%	0.634	S	S	*	*			trans	-77.8	85.1	170.3	-177	0	0	0	0	107.6	G10	G10-V12 PolarHBondContact O-N 3.47Å
13	S	37	Very low	48.7	Very low	67 Å²	67	95.4 Å²	95.4	47%	0.469	62%	0.619	S	S	.	*			trans	7.7	114	157	-168.3	0	0	0	0	116.2	A11 S15 C16	A11-S13 PolarHBondContact O-N 3.44Å; S13-S15 PolarHBondContact O-N 3.47Å; S13-S15 PolarHBondContact OG-OG 3.03Å; S13-C16 PolarHBondContact O-N 3.21Å
14	G	44.7	Very low	51	Low	60 Å²	60	88.4 Å²	88.4	62%	0.619	59%	0.585	S	S	*	*	H	α-helix	trans	-53.1	-15.7	171.5	0	0	0	0	0	114.6	S18	G14-S18 WeakPolarHBondContact O-CB 3.31Å; G14-S18 PolarHBondContact O-N 3.2Å; G14-S18 VanDerWaalsContact O-N 3.15Å
15	S	51.5	Low	53.3	Low	54 Å²	54	82.7 Å²	82.7	38%	0.378	55%	0.55	S	S	.	.	H	α-helix	trans	-69.9	-31	174.4	75	0	0	0	0	114.2	S13 R19	S13-S15 PolarHBondContact O-N 3.47Å; S13-S15 PolarHBondContact OG-OG 3.03Å; S15-R19 WeakPolarHBondContact O-CG 3.26Å; S15-R19 PolarHBondContact O-N 3.37Å; S15-R19 VanDerWaalsContact O-N 3.11Å
16	C	48.4	Very low	55.7	Low	64 Å²	64	81.7 Å²	81.7	43%	0.432	53%	0.531	S	S	.	.	H	α-helix	trans	-76.8	-43.2	-179.3	-169.8	0	0	0	0	111	S13 S18 R19 C20	S13-C16 PolarHBondContact O-N 3.21Å; C16-S18 VanDerWaalsContact C-N 3.31Å; C16-S18 PolarHBondContact O-N 3.47Å; C16-R19 PolarHBondContact O-N 3.17Å; C16-C20 WeakPolarHBondContact O-CB 3.47Å; C16-C20 PolarHBondContact O-N 3.23Å; C16-C20 PolarHBondContact O-SG 3.14Å; C16-C20 VanDerWaalsContact O-SG 3.41Å
17	L	60.1	Low	58.2	Low	116 Å²	116	82.1 Å²	82.1	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-60.7	-41.3	173.1	-72	173	0	0	0	111.4	C20 L21	L17-C20 PolarHBondContact O-N 3.13Å; L17-L21 VanDerWaalsContact O-CG 3.3Å; L17-L21 WeakPolarHBondContact O-CG 3.34Å; L17-L21 PolarHBondContact O-N 3.34Å
18	S	62.4	Low	60.7	Low	51 Å²	51	76.6 Å²	76.6	36%	0.357	47%	0.472	S	S	.	.	H	α-helix	trans	-58.8	-53.4	174.6	-166.2	0	0	0	0	111.2	G14 C16 C20 L21 E22	G14-S18 WeakPolarHBondContact O-CB 3.31Å; G14-S18 PolarHBondContact O-N 3.2Å; G14-S18 VanDerWaalsContact O-N 3.15Å; C16-S18 VanDerWaalsContact C-N 3.31Å; C16-S18 PolarHBondContact O-N 3.47Å; S18-C20 VanDerWaalsContact C-N 3.27Å; S18-C20 PolarHBondContact O-N 3.38Å; S18-L21 PolarHBondContact O-N 3.21Å; S18-E22 VanDerWaalsContact O-CG 3.26Å; S18-E22 WeakPolarHBondContact O-CG 3.33Å; S18-E22 PolarHBondContact O-N 3.46Å; S18-E22 PolarHBondContact OG-OE1 3.46Å
19	R	60.3	Low	63.2	Low	173 Å²	173	77.4 Å²	77.4	65%	0.653	46%	0.457	S	S	*	.	H	α-helix	trans	-59.1	-37.9	179.1	-75.9	-172.5	-124.4	161.8	-0.2	113	S15 C16 K23	S15-R19 WeakPolarHBondContact O-CG 3.26Å; S15-R19 PolarHBondContact O-N 3.37Å; S15-R19 VanDerWaalsContact O-N 3.11Å; C16-R19 PolarHBondContact O-N 3.17Å; R19-K23 PolarHBondContact O-N 3.46Å
20	C	74.1	Confident	65.6	Low	73 Å²	73	73.1 Å²	73.1	49%	0.493	43%	0.434	S	S	.	.	H	α-helix	trans	-66.3	-37	175.8	-75.2	0	0	0	0	112.4	C16 L17 S18 V24	C16-C20 WeakPolarHBondContact O-CB 3.47Å; C16-C20 PolarHBondContact O-N 3.23Å; C16-C20 PolarHBondContact O-SG 3.14Å; C16-C20 VanDerWaalsContact O-SG 3.41Å; L17-C20 PolarHBondContact O-N 3.13Å; S18-C20 VanDerWaalsContact C-N 3.27Å; S18-C20 PolarHBondContact O-N 3.38Å; C20-V24 WeakPolarHBondContact O-CG2 3.48Å; C20-V24 PolarHBondContact O-N 3.5Å
21	L	82.4	Confident	68.2	Low	31 Å²	31	72.3 Å²	72.3	16%	0.162	42%	0.419	C	S	.	.	H	α-helix	trans	-72	-43.1	176.7	-71	171.5	0	0	0	111.6	L17 S18 K23 V24 F25 L36 L41 P45	L17-L21 VanDerWaalsContact O-CG 3.3Å; L17-L21 WeakPolarHBondContact O-CG 3.34Å; L17-L21 PolarHBondContact O-N 3.34Å; S18-L21 PolarHBondContact O-N 3.21Å; L21-K23 VanDerWaalsContact C-N 3.31Å; L21-K23 PolarHBondContact O-N 3.12Å; L21-V24 WeakPolarHBondContact O-CB 3.46Å; L21-V24 PolarHBondContact O-N 3.21Å; L21-F25 WeakPolarHBondContact O-CD2 3.42Å; L21-F25 PolarHBondContact O-N 2.92Å; L21-L36 HydrophobicContact CD2-CD2 3.57Å; L21-L41 HydrophobicContact CD1-CD2 4.41Å; L21-L41 HydrophobicContact CD2-CD2 4.44Å; L21-P45 HydrophobicContact CD1-CB 3.91Å; L21-P45 HydrophobicContact CD1-CG 4.17Å; L21-P45 HydrophobicContact CD2-CG 4.07Å
22	E	81.7	Confident	70.8	Confident	46 Å²	46	68.1 Å²	68.1	22%	0.215	38%	0.383	C	S	.	.	H	α-helix	trans	-55	-48.6	177.3	-66.2	176.7	171.4	0	0	110.8	S18 V24 F25 E26 R50 Y51	S18-E22 VanDerWaalsContact O-CG 3.26Å; S18-E22 WeakPolarHBondContact O-CG 3.33Å; S18-E22 PolarHBondContact O-N 3.46Å; S18-E22 PolarHBondContact OG-OE1 3.46Å; E22-V24 VanDerWaalsContact C-N 3.31Å; E22-V24 PolarHBondContact O-N 3.36Å; E22-F25 PolarHBondContact O-N 3.3Å; E22-F25 VanDerWaalsContact O-N 3.15Å; E22-E26 WeakPolarHBondContact O-CG 3.41Å; E22-E26 PolarHBondContact O-N 3.36Å; E22-R50 IonicContact OE1-CZ 3.74Å; E22-R50 IonicContact OE1-NH1 3.8Å; E22-R50 PolarHBondContact OE1-NH1 3.35Å; E22-R50 IonicContact OE1-NH2 3.2Å; E22-R50 PolarHBondContact OE1-NH2 3.06Å; E22-R50 IonicContact OE2-NH2 3.03Å; E22-Y51 WeakPolarHBondContact CA-OH 3.4Å; E22-Y51 VanDerWaalsContact CG-OH 3.29Å; E22-Y51 WeakPolarHBondContact CG-OH 3.31Å
23	K	83.3	Confident	73.3	Confident	126 Å²	126	62.8 Å²	62.8	55%	0.548	35%	0.351	S	S	.	.	H	α-helix	trans	-59.7	-38.9	175.7	-173.1	175.9	179.2	178.9	0	113.1	R19 L21 F25 E26 D27	R19-K23 PolarHBondContact O-N 3.46Å; L21-K23 VanDerWaalsContact C-N 3.31Å; L21-K23 PolarHBondContact O-N 3.12Å; K23-F25 VanDerWaalsContact C-N 3.32Å; K23-F25 PolarHBondContact O-N 2.86Å; K23-E26 PolarHBondContact O-N 2.98Å; K23-D27 VanDerWaalsContact O-CB 3.3Å; K23-D27 WeakPolarHBondContact O-CB 3.4Å; K23-D27 PolarHBondContact O-N 3.47Å
24	V	86.3	Confident	75.9	Confident	23 Å²	23	59.6 Å²	59.6	14%	0.139	33%	0.329	C	S	.	.	H	α-helix	trans	-65.8	-37.4	178.5	170.7	0	0	0	0	111.3	C20 L21 E22 A28 L34 N35 L36	C20-V24 WeakPolarHBondContact O-CG2 3.48Å; C20-V24 PolarHBondContact O-N 3.5Å; L21-V24 WeakPolarHBondContact O-CB 3.46Å; L21-V24 PolarHBondContact O-N 3.21Å; E22-V24 VanDerWaalsContact C-N 3.31Å; E22-V24 PolarHBondContact O-N 3.36Å; V24-A28 VanDerWaalsContact O-CB 3.31Å; V24-A28 WeakPolarHBondContact O-CB 3.45Å; V24-A28 PolarHBondContact O-N 3.4Å; V24-L34 HydrophobicContact CG1-CD1 3.95Å; V24-N35 WeakPolarHBondContact CG1-O 3.37Å; V24-L36 HydrophobicContact CB-CD2 4.4Å; V24-L36 HydrophobicContact CG1-CD2 3.72Å; V24-L36 HydrophobicContact CG1-CG 4.24Å
25	F	85.9	Confident	78.2	Confident	3 Å²	3	59.2 Å²	59.2	1%	0.013	31%	0.313	C	S	.	.	H	α-helix	trans	-70.3	-41.8	175.3	-76.9	-72.7	0	0	0	112.1	L21 E22 K23 A28 Q29 L34 L36 F44 P45 Y51 L53	L21-F25 WeakPolarHBondContact O-CD2 3.42Å; L21-F25 PolarHBondContact O-N 2.92Å; E22-F25 PolarHBondContact O-N 3.3Å; E22-F25 VanDerWaalsContact O-N 3.15Å; K23-F25 VanDerWaalsContact C-N 3.32Å; K23-F25 PolarHBondContact O-N 2.86Å; F25-A28 WeakPolarHBondContact O-CB 3.26Å; F25-A28 PolarHBondContact O-N 2.92Å; F25-Q29 WeakPolarHBondContact O-CG 3.5Å; F25-Q29 PolarHBondContact O-N 3.35Å; F25-Q29 VanDerWaalsContact O-N 3.12Å; F25-L34 HydrophobicContact CD1-CD1 3.82Å; F25-L34 HydrophobicContact CE1-CD1 3.87Å; F25-L34 HydrophobicContact CE1-CD2 4Å; F25-L34 HydrophobicContact CG-CD1 4.5Å; F25-L36 HydrophobicContact CE1-CD1 4.39Å; F25-L36 HydrophobicContact CZ-CD1 3.91Å; F25-F44 HydrophobicContact CE1-CZ 4.46Å; F25-P45 HydrophobicContact CE2-CB 4.43Å; F25-P45 HydrophobicContact CE2-CG 4.02Å; F25-P45 WeakPolarHBondContact CE2-O 3.45Å; F25-P45 HydrophobicContact CZ-CG 4.08Å; F25-P45 WeakPolarHBondContact CZ-O 3.26Å; F25-Y51 HydrophobicContact CB-CD1 3.49Å; F25-Y51 VanDerWaalsContact CB-CD1 3.49Å; F25-Y51 HydrophobicContact CB-CD2 3.71Å; F25-Y51 HydrophobicContact CB-CE1 3.64Å; F25-Y51 HydrophobicContact CB-CE2 3.84Å; F25-Y51 HydrophobicContact CB-CG 3.53Å; F25-Y51 AromaticContact CD1-CD2 3.97Å; F25-Y51 HydrophobicContact CD1-CD2 3.97Å; F25-Y51 HydrophobicContact CD1-CG 4.15Å; F25-Y51 HydrophobicContact CD2-CD2 4.02Å; F25-Y51 AromaticContact CD2-CE2 3.82Å; F25-Y51 HydrophobicContact CD2-CE2 3.82Å; F25-Y51 HydrophobicContact CG-CD1 4.35Å; F25-Y51 AromaticContact CG-CD2 3.64Å; F25-Y51 HydrophobicContact CG-CD2 3.64Å; F25-Y51 AromaticContact CG-CE2 3.84Å; F25-Y51 HydrophobicContact CG-CE2 3.84Å; F25-Y51 AromaticContact CG-CG 3.91Å; F25-Y51 HydrophobicContact CG-CG 3.91Å; F25-L53 HydrophobicContact CD1-CD2 4.07Å; F25-L53 HydrophobicContact CE1-CD1 4.2Å; F25-L53 HydrophobicContact CE1-CD2 4.49Å
26	E	83.7	Confident	80	Confident	104 Å²	104	56.7 Å²	56.7	49%	0.486	30%	0.295	S	S	.	.	H	α-helix	trans	-59.6	-45.6	172.7	-70.2	173.4	179.6	0	0	111.5	E22 K23 A28 Q29 L30 Y51	E22-E26 WeakPolarHBondContact O-CG 3.41Å; E22-E26 PolarHBondContact O-N 3.36Å; K23-E26 PolarHBondContact O-N 2.98Å; E26-A28 VanDerWaalsContact C-N 3.28Å; E26-A28 PolarHBondContact O-N 3.34Å; E26-Q29 PolarHBondContact O-N 3.45Å; E26-L30 PolarHBondContact O-N 3.14Å; E26-Y51 HydrophobicContact CG-CE1 4.49Å
27	D	84.5	Confident	82	Confident	78 Å²	78	54.2 Å²	54.2	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-63.1	-34.5	175.7	-74	-18.8	0	0	0	111.5	K23 L30 S31	K23-D27 VanDerWaalsContact O-CB 3.3Å; K23-D27 WeakPolarHBondContact O-CB 3.4Å; K23-D27 PolarHBondContact O-N 3.47Å; D27-L30 PolarHBondContact O-N 3.11Å; D27-S31 VanDerWaalsContact O-CB 3.29Å; D27-S31 WeakPolarHBondContact O-CB 3.17Å; D27-S31 PolarHBondContact O-N 3.46Å; D27-S31 PolarHBondContact O-OG 3.41Å
28	A	84.2	Confident	83.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-35.5	177.9	0	0	0	0	0	112.5	V24 F25 E26 L30 S31 S32 A33 L34	V24-A28 VanDerWaalsContact O-CB 3.31Å; V24-A28 WeakPolarHBondContact O-CB 3.45Å; V24-A28 PolarHBondContact O-N 3.4Å; F25-A28 WeakPolarHBondContact O-CB 3.26Å; F25-A28 PolarHBondContact O-N 2.92Å; E26-A28 VanDerWaalsContact C-N 3.28Å; E26-A28 PolarHBondContact O-N 3.34Å; A28-L30 PolarHBondContact O-N 3.49Å; A28-S31 PolarHBondContact O-N 2.79Å; A28-S32 WeakPolarHBondContact O-CA 3.33Å; A28-S32 PolarHBondContact O-N 3.04Å; A28-A33 WeakPolarHBondContact CA-O 3.2Å; A28-A33 WeakPolarHBondContact CB-O 3.23Å; A28-L34 HydrophobicContact CB-CB 4.01Å; A28-L34 HydrophobicContact CB-CD1 3.72Å; A28-L34 HydrophobicContact CB-CG 4.48Å
29	Q	82.8	Confident	84.6	Confident	86 Å²	86	56.8 Å²	56.8	40%	0.402	28%	0.279	S	S	.	.	H	α-helix	trans	-63.8	-31.8	173.6	-66.3	-174.2	-52.6	0	0	112.1	F25 E26 D52	F25-Q29 WeakPolarHBondContact O-CG 3.5Å; F25-Q29 PolarHBondContact O-N 3.35Å; F25-Q29 VanDerWaalsContact O-N 3.12Å; E26-Q29 PolarHBondContact O-N 3.45Å; Q29-D52 WeakPolarHBondContact CG-O 3.39Å; Q29-D52 PolarHBondContact NE2-O 3.26Å
30	L	82.6	Confident	86	Confident	94 Å²	94	53.3 Å²	53.3	49%	0.492	27%	0.274	S	S	.	.	H	α-helix	trans	-84.1	-40.2	177.8	-66.8	176	0	0	0	112.1	E26 D27 A28 R452	E26-L30 PolarHBondContact O-N 3.14Å; D27-L30 PolarHBondContact O-N 3.11Å; A28-L30 PolarHBondContact O-N 3.49Å; L30-R452 VanDerWaalsContact C-NH2 3.33Å; L30-R452 PolarHBondContact O-NE 3.35Å; L30-R452 PolarHBondContact O-NH2 3.46Å
31	S	86	Confident	86.6	Confident	42 Å²	42	51 Å²	51	29%	0.294	26%	0.256	S	S	.	.	H	α-helix	trans	-94.5	-10.9	-171.1	62.1	0	0	0	0	114.6	D27 A28 A33	D27-S31 VanDerWaalsContact O-CB 3.29Å; D27-S31 WeakPolarHBondContact O-CB 3.17Å; D27-S31 PolarHBondContact O-N 3.46Å; D27-S31 PolarHBondContact O-OG 3.41Å; A28-S31 PolarHBondContact O-N 2.79Å; S31-A33 PolarHBondContact O-N 3.07Å; S31-A33 PolarHBondContact OG-N 3.26Å; S31-A33 PolarHBondContact OG-O 3.18Å
32	S	87.5	Confident	86.9	Confident	23 Å²	23	57.1 Å²	57.1	16%	0.161	28%	0.281	C	S	.	.	S	Bend	trans	57.6	18.6	-167.9	-64.8	0	0	0	0	113.5	A28 D55 V57 F58	A28-S32 WeakPolarHBondContact O-CA 3.33Å; A28-S32 PolarHBondContact O-N 3.04Å; S32-D55 VanDerWaalsContact CB-O 3.23Å; S32-D55 WeakPolarHBondContact CB-O 3.27Å; S32-D55 PolarHBondContact OG-O 3.47Å; S32-V57 PolarHBondContact O-N 3.26Å; S32-F58 PolarHBondContact O-N 2.89Å
33	A	91	Very high	87.2	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.033	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	118.1	-178.5	0	0	0	0	0	111	A28 S31 F58 Y438	A28-A33 WeakPolarHBondContact CA-O 3.2Å; A28-A33 WeakPolarHBondContact CB-O 3.23Å; S31-A33 PolarHBondContact O-N 3.07Å; S31-A33 PolarHBondContact OG-N 3.26Å; S31-A33 PolarHBondContact OG-O 3.18Å; A33-F58 CarbonylContact C-O 3.23Å; A33-F58 VanDerWaalsContact CA-O 3.29Å; A33-F58 WeakPolarHBondContact CA-O 3.25Å; A33-F58 HydrophobicContact CB-CB 4.13Å; A33-F58 HydrophobicContact CB-CD1 4.22Å; A33-Y438 HydrophobicContact CB-CE2 3.63Å; A33-Y438 WeakPolarHBondContact CB-OH 3.24Å
34	L	91.3	Very high	87.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	104.5	178.4	-178.8	64.7	0	0	0	110.2	V24 F25 A28 L36 F44 L53 V56 F58 V59 D60 L73	V24-L34 HydrophobicContact CG1-CD1 3.95Å; F25-L34 HydrophobicContact CD1-CD1 3.82Å; F25-L34 HydrophobicContact CE1-CD1 3.87Å; F25-L34 HydrophobicContact CE1-CD2 4Å; F25-L34 HydrophobicContact CG-CD1 4.5Å; A28-L34 HydrophobicContact CB-CB 4.01Å; A28-L34 HydrophobicContact CB-CD1 3.72Å; A28-L34 HydrophobicContact CB-CG 4.48Å; L34-L36 HydrophobicContact CD1-CD1 3.97Å; L34-L36 HydrophobicContact CD1-CG 3.98Å; L34-L36 HydrophobicContact CD2-CD1 3.91Å; L34-L36 HydrophobicContact CG-CD1 3.93Å; L34-L36 HydrophobicContact CG-CG 4.06Å; L34-F44 HydrophobicContact CD2-CE2 4.13Å; L34-F44 HydrophobicContact CD2-CZ 3.84Å; L34-L53 HydrophobicContact CD2-CD1 4.25Å; L34-V56 HydrophobicContact CB-CG1 4.22Å; L34-F58 PolarHBondContact N-O 3.46Å; L34-V59 HydrophobicContact CB-CG1 4.41Å; L34-V59 HydrophobicContact CB-CG2 4.11Å; L34-V59 HydrophobicContact CD2-CG1 4.27Å; L34-V59 WeakPolarHBondContact O-CA 3.41Å; L34-D60 PolarHBondContact O-N 3.15Å; L34-L73 HydrophobicContact CD2-CD2 4.44Å
35	N	91.4	Very high	87.1	Confident	53 Å²	53	53.7 Å²	53.7	28%	0.283	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	96.1	179.6	-68.1	-43.5	0	0	0	111	V24 R39 F58 Y438	V24-N35 WeakPolarHBondContact CG1-O 3.37Å; N35-R39 PolarHBondContact O-NH1 3.39Å; N35-R39 PolarHBondContact O-NH2 3.21Å; N35-F58 VanDerWaalsContact OD1-CE1 3.26Å; N35-F58 WeakPolarHBondContact OD1-CE1 3.22Å; N35-Y438 PolarHBondContact ND2-OH 3.44Å; N35-Y438 VanDerWaalsContact ND2-OH 3.13Å
36	L	90.7	Very high	86.6	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.29	C	S	.	.			trans	-111.7	10.4	176.2	-69.4	174.4	0	0	0	113.6	L21 V24 F25 L34 L41 F44 P45 D60 V61 N64	L21-L36 HydrophobicContact CD2-CD2 3.57Å; V24-L36 HydrophobicContact CB-CD2 4.4Å; V24-L36 HydrophobicContact CG1-CD2 3.72Å; V24-L36 HydrophobicContact CG1-CG 4.24Å; F25-L36 HydrophobicContact CE1-CD1 4.39Å; F25-L36 HydrophobicContact CZ-CD1 3.91Å; L34-L36 HydrophobicContact CD1-CD1 3.97Å; L34-L36 HydrophobicContact CD1-CG 3.98Å; L34-L36 HydrophobicContact CD2-CD1 3.91Å; L34-L36 HydrophobicContact CG-CD1 3.93Å; L34-L36 HydrophobicContact CG-CG 4.06Å; L36-L41 HydrophobicContact CB-CD1 4.18Å; L36-F44 HydrophobicContact CD1-CD2 4.32Å; L36-F44 HydrophobicContact CD1-CE2 3.7Å; L36-F44 HydrophobicContact CD1-CZ 4.37Å; L36-P45 HydrophobicContact CD1-CG 4.16Å; L36-D60 CarbonylContact C-O 3.42Å; L36-D60 VanDerWaalsContact CA-O 3.3Å; L36-D60 WeakPolarHBondContact CA-O 3.15Å; L36-D60 PolarHBondContact N-O 3.37Å; L36-V61 HydrophobicContact CB-CG1 4.01Å; L36-V61 HydrophobicContact CB-CG2 4.47Å; L36-N64 PolarHBondContact O-ND2 3.48Å
37	G	90	Very high	86	Confident	12 Å²	12	54.6 Å²	54.6	12%	0.124	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	153.2	178.1	0	0	0	0	0	114.4	R39 D60 S62	G37-R39 VanDerWaalsContact C-N 3.32Å; G37-R39 WeakPolarHBondContact O-CG 3.3Å; G37-R39 PolarHBondContact O-N 3.48Å; G37-R39 PolarHBondContact O-NH1 2.68Å; G37-D60 PolarHBondContact N-O 2.9Å; G37-S62 CarbonylContact C-O 3.23Å; G37-S62 WeakPolarHBondContact CA-O 3.21Å
38	E	89.8	Confident	85.1	Confident	125 Å²	125	56 Å²	56	58%	0.584	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	34.2	172.2	-64.8	-172.4	178.5	0	0	115.6	S62 R63	E38-S62 PolarHBondContact N-O 3.45Å; E38-R63 WeakPolarHBondContact CA-O 3.31Å; E38-R63 HydrophobicContact CB-CB 4.48Å; E38-R63 HydrophobicContact CG-CB 3.55Å; E38-R63 HydrophobicContact CG-CG 4.18Å; E38-R63 WeakPolarHBondContact OE1-CD 3.39Å; E38-R63 IonicContact OE1-CZ 3.22Å; E38-R63 IonicContact OE1-NE 2.9Å; E38-R63 IonicContact OE1-NH1 2.88Å; E38-R63 PolarHBondContact OE1-NH1 2.94Å
39	R	88.2	Confident	84.3	Confident	97 Å²	97	59.9 Å²	59.9	37%	0.366	34%	0.342	S	S	.	.	S	Bend	trans	-107.4	7.8	-175.2	-78.8	177.6	178.5	85.9	-19.8	115.1	N35 G37 L41 N64	N35-R39 PolarHBondContact O-NH1 3.39Å; N35-R39 PolarHBondContact O-NH2 3.21Å; G37-R39 VanDerWaalsContact C-N 3.32Å; G37-R39 WeakPolarHBondContact O-CG 3.3Å; G37-R39 PolarHBondContact O-N 3.48Å; G37-R39 PolarHBondContact O-NH1 2.68Å; R39-L41 HydrophobicContact CB-CD1 4Å; R39-L41 HydrophobicContact CB-CD2 4.29Å; R39-L41 HydrophobicContact CB-CG 3.72Å; R39-L41 PolarHBondContact O-N 3.44Å; R39-L41 VanDerWaalsContact O-N 3.16Å; R39-N64 WeakPolarHBondContact CA-OD1 3.38Å; R39-N64 PolarHBondContact N-OD1 3.22Å
40	N	87.8	Confident	84	Confident	100 Å²	100	61.8 Å²	61.8	54%	0.535	35%	0.346	S	S	.	.			trans	54.1	28.1	-175.7	-72.2	-63.9	0	0	0	113.9	K42 N64 R65	N40-K42 PolarHBondContact O-N 3.21Å; N40-N64 PolarHBondContact N-OD1 2.92Å; N40-N64 VanDerWaalsContact N-OD1 3.08Å; N40-R65 PolarHBondContact OD1-NE 3.45Å; N40-R65 VanDerWaalsContact OD1-NE 3.13Å; N40-R65 PolarHBondContact OD1-NH2 2.76Å
41	L	87.7	Confident	83.6	Confident	24 Å²	24	58.3 Å²	58.3	13%	0.126	33%	0.326	C	S	.	.			trans	-68.1	128.1	-178.4	-61.6	169.9	0	0	0	110.4	L21 L36 R39 P45 N64 R65 L66	L21-L41 HydrophobicContact CD1-CD2 4.41Å; L21-L41 HydrophobicContact CD2-CD2 4.44Å; L36-L41 HydrophobicContact CB-CD1 4.18Å; R39-L41 HydrophobicContact CB-CD1 4Å; R39-L41 HydrophobicContact CB-CD2 4.29Å; R39-L41 HydrophobicContact CB-CG 3.72Å; R39-L41 PolarHBondContact O-N 3.44Å; R39-L41 VanDerWaalsContact O-N 3.16Å; L41-P45 HydrophobicContact CD1-CG 4.13Å; L41-P45 HydrophobicContact CD2-CG 4.42Å; L41-N64 HydrophobicContact CB-CB 4.18Å; L41-N64 WeakPolarHBondContact CB-OD1 3.46Å; L41-N64 WeakPolarHBondContact CG-OD1 3.46Å; L41-N64 PolarHBondContact N-OD1 2.99Å; L41-R65 CarbonylContact O-C 3.6Å; L41-R65 VanDerWaalsContact O-C 3.23Å; L41-R65 VanDerWaalsContact O-CA 3.28Å; L41-R65 WeakPolarHBondContact O-CA 3.21Å; L41-R65 PolarHBondContact O-N 2.74Å; L41-L66 HydrophobicContact CB-CD2 4.43Å; L41-L66 PolarHBondContact O-N 2.95Å
42	K	88.2	Confident	83.3	Confident	159 Å²	159	61.1 Å²	61.1	69%	0.691	34%	0.338	S	S	*	.	S	Bend	trans	-83.1	-25.8	175.8	-65.7	-178.8	-179.9	177.1	0	112.9	N40	N40-K42 PolarHBondContact O-N 3.21Å
43	A	88.6	Confident	83.1	Confident	67 Å²	67	60.5 Å²	60.5	55%	0.554	33%	0.333	S	S	*	.	S	Bend	trans	-144.1	158.9	178.3	0	0	0	0	0	108.7	P45	A43-P45 WeakPolarHBondContact O-CD 3.31Å
44	F	86.9	Confident	82.8	Confident	23 Å²	23	62.3 Å²	62.3	10%	0.101	35%	0.345	C	S	.	.			trans	-69.2	123.3	176.9	-172.4	-112.3	0	0	0	109.3	F25 L34 L36 F46 V61 P70 E72 L73	F25-F44 HydrophobicContact CE1-CZ 4.46Å; L34-F44 HydrophobicContact CD2-CE2 4.13Å; L34-F44 HydrophobicContact CD2-CZ 3.84Å; L36-F44 HydrophobicContact CD1-CD2 4.32Å; L36-F44 HydrophobicContact CD1-CE2 3.7Å; L36-F44 HydrophobicContact CD1-CZ 4.37Å; F44-F46 HydrophobicContact CD1-CB 3.56Å; F44-F46 HydrophobicContact CD1-CG 4.5Å; F44-F46 HydrophobicContact CE1-CB 3.68Å; F44-F46 HydrophobicContact CE1-CD2 4.2Å; F44-F46 HydrophobicContact CE1-CG 4.24Å; F44-F46 PolarHBondContact O-N 3.31Å; F44-V61 HydrophobicContact CD2-CG1 4.26Å; F44-V61 HydrophobicContact CD2-CG2 4.31Å; F44-V61 HydrophobicContact CE2-CG2 3.99Å; F44-P70 HydrophobicContact CB-CB 3.79Å; F44-P70 HydrophobicContact CD1-CB 3.99Å; F44-P70 HydrophobicContact CD2-CB 3.84Å; F44-P70 HydrophobicContact CE2-CB 4.43Å; F44-P70 HydrophobicContact CG-CB 3.61Å; F44-E72 HydrophobicContact CD1-CB 4.17Å; F44-E72 HydrophobicContact CD1-CG 4.43Å; F44-E72 HydrophobicContact CE1-CB 4.1Å; F44-L73 HydrophobicContact CE1-CD2 4.18Å; F44-L73 HydrophobicContact CE1-CG 4.5Å; F44-L73 HydrophobicContact CE2-CD2 4.24Å; F44-L73 HydrophobicContact CZ-CD2 3.62Å; F44-L73 HydrophobicContact CZ-CG 4.15Å
45	P	80.2	Confident	82.5	Confident	34 Å²	34	66.5 Å²	66.5	22%	0.221	37%	0.368	C	S	.	.			trans	-81.8	65.9	-172.2	32.5	-34.3	0	0	0	110.7	L21 F25 L36 L41 A43	L21-P45 HydrophobicContact CD1-CB 3.91Å; L21-P45 HydrophobicContact CD1-CG 4.17Å; L21-P45 HydrophobicContact CD2-CG 4.07Å; F25-P45 HydrophobicContact CE2-CB 4.43Å; F25-P45 HydrophobicContact CE2-CG 4.02Å; F25-P45 WeakPolarHBondContact CE2-O 3.45Å; F25-P45 HydrophobicContact CZ-CG 4.08Å; F25-P45 WeakPolarHBondContact CZ-O 3.26Å; L36-P45 HydrophobicContact CD1-CG 4.16Å; L41-P45 HydrophobicContact CD1-CG 4.13Å; L41-P45 HydrophobicContact CD2-CG 4.42Å; A43-P45 WeakPolarHBondContact O-CD 3.31Å
46	F	75.1	Confident	82.5	Confident	50 Å²	50	64 Å²	64	22%	0.219	36%	0.355	C	S	.	.			trans	-105.2	140	178.3	-172.3	-104.8	0	0	0	111.6	F44 P48 L53 E72	F44-F46 HydrophobicContact CD1-CB 3.56Å; F44-F46 HydrophobicContact CD1-CG 4.5Å; F44-F46 HydrophobicContact CE1-CB 3.68Å; F44-F46 HydrophobicContact CE1-CD2 4.2Å; F44-F46 HydrophobicContact CE1-CG 4.24Å; F44-F46 PolarHBondContact O-N 3.31Å; F46-P48 HydrophobicContact CD1-CG 4.17Å; F46-P48 VanDerWaalsContact CE1-CA 3.46Å; F46-P48 HydrophobicContact CE1-CB 4.13Å; F46-P48 HydrophobicContact CE1-CG 4.03Å; F46-L53 HydrophobicContact CD2-CD1 4.14Å; F46-L53 HydrophobicContact CE2-CD1 3.98Å; F46-L53 HydrophobicContact CE2-CG 4.48Å; F46-E72 HydrophobicContact CB-CB 4.25Å; F46-E72 HydrophobicContact CB-CG 3.92Å; F46-E72 HydrophobicContact CD1-CB 3.79Å; F46-E72 HydrophobicContact CD1-CG 3.39Å; F46-E72 HydrophobicContact CD2-CB 4.41Å; F46-E72 HydrophobicContact CE1-CB 4.11Å; F46-E72 HydrophobicContact CE1-CG 4Å; F46-E72 HydrophobicContact CG-CB 3.91Å; F46-E72 HydrophobicContact CG-CG 3.8Å
47	T	71.5	Confident	82.6	Confident	75 Å²	75	64.9 Å²	64.9	46%	0.46	36%	0.36	S	S	.	.			trans	-123.2	113.3	168.8	-50.9	0	0	0	0	106.8	G49 R50	T47-G49 PolarHBondContact O-N 3.24Å; T47-R50 HydrophobicContact CG2-CB 4.44Å; T47-R50 WeakPolarHBondContact O-CB 3.49Å; T47-R50 PolarHBondContact O-N 3.31Å; T47-R50 VanDerWaalsContact O-N 3.09Å
48	P	66.3	Low	82.8	Confident	108 Å²	108	66.9 Å²	66.9	70%	0.701	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	131.3	-179.1	-26.4	32.9	0	0	0	111.8	F46 R50	F46-P48 HydrophobicContact CD1-CG 4.17Å; F46-P48 VanDerWaalsContact CE1-CA 3.46Å; F46-P48 HydrophobicContact CE1-CB 4.13Å; F46-P48 HydrophobicContact CE1-CG 4.03Å; P48-R50 VanDerWaalsContact C-N 3.27Å; P48-R50 PolarHBondContact O-N 3.45Å
49	G	66.9	Low	83	Confident	82 Å²	82	60.9 Å²	60.9	85%	0.845	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	-5.1	177.7	0	0	0	0	0	116	T47	T47-G49 PolarHBondContact O-N 3.24Å
50	R	75.4	Confident	83.3	Confident	126 Å²	126	58 Å²	58	48%	0.475	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-34.5	177.7	-162.5	175.5	-174.1	-167.7	-1.7	112.8	E22 T47 P48	E22-R50 IonicContact OE1-CZ 3.74Å; E22-R50 IonicContact OE1-NH1 3.8Å; E22-R50 PolarHBondContact OE1-NH1 3.35Å; E22-R50 IonicContact OE1-NH2 3.2Å; E22-R50 PolarHBondContact OE1-NH2 3.06Å; E22-R50 IonicContact OE2-NH2 3.03Å; T47-R50 HydrophobicContact CG2-CB 4.44Å; T47-R50 WeakPolarHBondContact O-CB 3.49Å; T47-R50 PolarHBondContact O-N 3.31Å; T47-R50 VanDerWaalsContact O-N 3.09Å; P48-R50 VanDerWaalsContact C-N 3.27Å; P48-R50 PolarHBondContact O-N 3.45Å
51	Y	76.1	Confident	83.6	Confident	21 Å²	21	53.2 Å²	53.2	8%	0.082	30%	0.303	C	S	.	.			trans	-135.3	132.6	-179.2	-51.5	-70.3	0	0	0	109.6	E22 F25 E26	E22-Y51 WeakPolarHBondContact CA-OH 3.4Å; E22-Y51 VanDerWaalsContact CG-OH 3.29Å; E22-Y51 WeakPolarHBondContact CG-OH 3.31Å; F25-Y51 HydrophobicContact CB-CD1 3.49Å; F25-Y51 VanDerWaalsContact CB-CD1 3.49Å; F25-Y51 HydrophobicContact CB-CD2 3.71Å; F25-Y51 HydrophobicContact CB-CE1 3.64Å; F25-Y51 HydrophobicContact CB-CE2 3.84Å; F25-Y51 HydrophobicContact CB-CG 3.53Å; F25-Y51 AromaticContact CD1-CD2 3.97Å; F25-Y51 HydrophobicContact CD1-CD2 3.97Å; F25-Y51 HydrophobicContact CD1-CG 4.15Å; F25-Y51 HydrophobicContact CD2-CD2 4.02Å; F25-Y51 AromaticContact CD2-CE2 3.82Å; F25-Y51 HydrophobicContact CD2-CE2 3.82Å; F25-Y51 HydrophobicContact CG-CD1 4.35Å; F25-Y51 AromaticContact CG-CD2 3.64Å; F25-Y51 HydrophobicContact CG-CD2 3.64Å; F25-Y51 AromaticContact CG-CE2 3.84Å; F25-Y51 HydrophobicContact CG-CE2 3.84Å; F25-Y51 AromaticContact CG-CG 3.91Å; F25-Y51 HydrophobicContact CG-CG 3.91Å; E26-Y51 HydrophobicContact CG-CE1 4.49Å
52	D	79.4	Confident	83.9	Confident	100 Å²	100	52.3 Å²	52.3	54%	0.535	30%	0.299	S	S	.	.			trans	-89.4	113.8	170.9	-175	3.2	0	0	0	109.3	Q29 S54	Q29-D52 WeakPolarHBondContact CG-O 3.39Å; Q29-D52 PolarHBondContact NE2-O 3.26Å; D52-S54 VanDerWaalsContact CG-OG 3.28Å; D52-S54 WeakPolarHBondContact OD1-CB 3.32Å; D52-S54 PolarHBondContact OD1-N 2.66Å; D52-S54 PolarHBondContact OD1-OG 3.18Å; D52-S54 PolarHBondContact OD2-OG 3.14Å
53	L	83.1	Confident	84.2	Confident	11 Å²	11	52 Å²	52	6%	0.058	29%	0.294	C	S	.	.			trans	-105.1	8.3	179.2	-57.7	178.1	0	0	0	112.5	F25 L34 F46 D55 V56 C76	F25-L53 HydrophobicContact CD1-CD2 4.07Å; F25-L53 HydrophobicContact CE1-CD1 4.2Å; F25-L53 HydrophobicContact CE1-CD2 4.49Å; L34-L53 HydrophobicContact CD2-CD1 4.25Å; F46-L53 HydrophobicContact CD2-CD1 4.14Å; F46-L53 HydrophobicContact CE2-CD1 3.98Å; F46-L53 HydrophobicContact CE2-CG 4.48Å; L53-D55 PolarHBondContact O-N 3.48Å; L53-V56 HydrophobicContact CB-CG2 3.96Å; L53-V56 HydrophobicContact CD2-CG2 3.94Å; L53-V56 WeakPolarHBondContact O-CB 3.28Å; L53-V56 WeakPolarHBondContact O-CG2 3.1Å; L53-V56 PolarHBondContact O-N 3.39Å; L53-C76 PolarHBondContact O-SG 2.97Å; L53-C76 VanDerWaalsContact O-SG 3.35Å
54	S	83.8	Confident	84.4	Confident	42 Å²	42	49.2 Å²	49.2	29%	0.294	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-36.3	-175.4	56.6	0	0	0	0	113	D52 V56 F78	D52-S54 VanDerWaalsContact CG-OG 3.28Å; D52-S54 WeakPolarHBondContact OD1-CB 3.32Å; D52-S54 PolarHBondContact OD1-N 2.66Å; D52-S54 PolarHBondContact OD1-OG 3.18Å; D52-S54 PolarHBondContact OD2-OG 3.14Å; S54-V56 VanDerWaalsContact C-N 3.34Å; S54-V56 PolarHBondContact O-N 3.5Å; S54-F78 WeakPolarHBondContact O-CD2 3.39Å
55	D	86.3	Confident	84.7	Confident	87 Å²	87	54.5 Å²	54.5	47%	0.465	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	3.1	-179.6	-79.1	-20.8	0	0	0	114.6	S32 L53 V57	S32-D55 VanDerWaalsContact CB-O 3.23Å; S32-D55 WeakPolarHBondContact CB-O 3.27Å; S32-D55 PolarHBondContact OG-O 3.47Å; L53-D55 PolarHBondContact O-N 3.48Å; D55-V57 PolarHBondContact O-N 2.94Å
56	V	90.1	Very high	85.3	Confident	2 Å²	2	53 Å²	53	1%	0.012	28%	0.279	C	S	.	.			trans	-75.5	127.3	-178.5	179.7	0	0	0	0	110.6	L34 L53 S54 F58 V59 F78 L79	L34-V56 HydrophobicContact CB-CG1 4.22Å; L53-V56 HydrophobicContact CB-CG2 3.96Å; L53-V56 HydrophobicContact CD2-CG2 3.94Å; L53-V56 WeakPolarHBondContact O-CB 3.28Å; L53-V56 WeakPolarHBondContact O-CG2 3.1Å; L53-V56 PolarHBondContact O-N 3.39Å; S54-V56 VanDerWaalsContact C-N 3.34Å; S54-V56 PolarHBondContact O-N 3.5Å; V56-F58 WeakPolarHBondContact CG1-O 3.23Å; V56-V59 HydrophobicContact CG1-CG2 3.46Å; V56-V59 VanDerWaalsContact CG1-CG2 3.46Å; V56-F78 CarbonylContact O-C 3.18Å; V56-L79 WeakPolarHBondContact O-CA 3.49Å; V56-L79 PolarHBondContact O-N 3.16Å
57	V	93.2	Very high	86.1	Confident	18 Å²	18	55.2 Å²	55.2	11%	0.109	29%	0.293	C	S	.	.			trans	-105.2	-28.8	-179.1	-179.5	0	0	0	0	111.4	S32 D55 F78 E80 T81 I434	S32-V57 PolarHBondContact O-N 3.26Å; D55-V57 PolarHBondContact O-N 2.94Å; V57-F78 HydrophobicContact CG2-CB 4.39Å; V57-E80 HydrophobicContact CG1-CB 3.83Å; V57-E80 HydrophobicContact CG1-CG 3.82Å; V57-E80 PolarHBondContact O-N 3.01Å; V57-T81 PolarHBondContact O-N 3.38Å; V57-T81 VanDerWaalsContact O-N 3.12Å; V57-I434 HydrophobicContact CG2-CD1 4.2Å
58	F	93.8	Very high	87.1	Confident	53 Å²	53	57.3 Å²	57.3	23%	0.232	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127	-177.3	-178.7	-81.4	0	0	0	110.2	S32 A33 L34 N35 V56 D60 T81 Y83	S32-F58 PolarHBondContact O-N 2.89Å; A33-F58 CarbonylContact C-O 3.23Å; A33-F58 VanDerWaalsContact CA-O 3.29Å; A33-F58 WeakPolarHBondContact CA-O 3.25Å; A33-F58 HydrophobicContact CB-CB 4.13Å; A33-F58 HydrophobicContact CB-CD1 4.22Å; L34-F58 PolarHBondContact N-O 3.46Å; N35-F58 VanDerWaalsContact OD1-CE1 3.26Å; N35-F58 WeakPolarHBondContact OD1-CE1 3.22Å; V56-F58 WeakPolarHBondContact CG1-O 3.23Å; F58-D60 HydrophobicContact CE1-CB 3.75Å; F58-D60 HydrophobicContact CZ-CB 4.29Å; F58-T81 HydrophobicContact CD2-CG2 3.76Å; F58-T81 HydrophobicContact CE2-CG2 3.76Å; F58-Y83 HydrophobicContact CE2-CD2 4.01Å; F58-Y83 AromaticContact CE2-CE2 3.6Å; F58-Y83 HydrophobicContact CE2-CE2 3.6Å; F58-Y83 AromaticContact CZ-CD2 3.73Å; F58-Y83 HydrophobicContact CZ-CD2 3.73Å; F58-Y83 AromaticContact CZ-CE2 3.66Å; F58-Y83 HydrophobicContact CZ-CE2 3.66Å
59	V	94.5	Very high	88.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.7	173.5	177.4	0	0	0	0	109.6	L34 V56 V61 L73 L79 T81 L82 Y83	L34-V59 HydrophobicContact CB-CG1 4.41Å; L34-V59 HydrophobicContact CB-CG2 4.11Å; L34-V59 HydrophobicContact CD2-CG1 4.27Å; L34-V59 WeakPolarHBondContact O-CA 3.41Å; V56-V59 HydrophobicContact CG1-CG2 3.46Å; V56-V59 VanDerWaalsContact CG1-CG2 3.46Å; V59-V61 HydrophobicContact CG1-CG2 3.5Å; V59-L73 HydrophobicContact CB-CD1 4.39Å; V59-L73 HydrophobicContact CG1-CD1 3.71Å; V59-L73 HydrophobicContact CG1-CD2 4.24Å; V59-L73 HydrophobicContact CG2-CD1 4.49Å; V59-L73 HydrophobicContact CG2-CD2 4.11Å; V59-L79 HydrophobicContact CB-CD1 3.9Å; V59-L79 HydrophobicContact CG2-CD1 3.4Å; V59-L79 VanDerWaalsContact CG2-CD1 3.4Å; V59-L79 HydrophobicContact CG2-CD2 4.36Å; V59-T81 PolarHBondContact N-O 3.03Å; V59-L82 HydrophobicContact CB-CD1 3.85Å; V59-L82 HydrophobicContact CG1-CD1 3.84Å; V59-L82 WeakPolarHBondContact O-CA 3.44Å; V59-Y83 PolarHBondContact O-N 3.1Å
60	D	94.6	Very high	89.5	Confident	35 Å²	35	48.7 Å²	48.7	19%	0.187	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	110.2	169.3	-179.5	6.4	0	0	0	110.5	L34 L36 G37 F58 S62 Y83	L34-D60 PolarHBondContact O-N 3.15Å; L36-D60 CarbonylContact C-O 3.42Å; L36-D60 VanDerWaalsContact CA-O 3.3Å; L36-D60 WeakPolarHBondContact CA-O 3.15Å; L36-D60 PolarHBondContact N-O 3.37Å; G37-D60 PolarHBondContact N-O 2.9Å; F58-D60 HydrophobicContact CE1-CB 3.75Å; F58-D60 HydrophobicContact CZ-CB 4.29Å; D60-S62 WeakPolarHBondContact OD1-CB 3.43Å; D60-S62 PolarHBondContact OD1-N 3Å; D60-S62 PolarHBondContact OD1-OG 2.82Å; D60-Y83 HydrophobicContact CB-CD2 4.4Å
61	V	93.8	Very high	90.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.227	C	C	.	.			trans	-120.2	25.2	170.9	-152.2	0	0	0	0	110.5	L36 F44 V59 N64 L66 Y83 L84 N87	L36-V61 HydrophobicContact CB-CG1 4.01Å; L36-V61 HydrophobicContact CB-CG2 4.47Å; F44-V61 HydrophobicContact CD2-CG1 4.26Å; F44-V61 HydrophobicContact CD2-CG2 4.31Å; F44-V61 HydrophobicContact CE2-CG2 3.99Å; V59-V61 HydrophobicContact CG1-CG2 3.5Å; V61-N64 PolarHBondContact O-ND2 2.75Å; V61-L66 HydrophobicContact CB-CD1 4.27Å; V61-L66 HydrophobicContact CG1-CD1 3.69Å; V61-Y83 CarbonylContact C-O 3.12Å; V61-Y83 PolarHBondContact N-O 2.55Å; V61-L84 HydrophobicContact CB-CD2 4.15Å; V61-N87 PolarHBondContact O-ND2 3.33Å
62	S	94.1	Very high	90.7	Very high	6 Å²	6	48.3 Å²	48.3	4%	0.042	24%	0.239	C	C	.	.			trans	-65.3	159.3	-178.9	68.8	0	0	0	0	112.8	G37 E38 D60 N64 Y83 Q85	G37-S62 CarbonylContact C-O 3.23Å; G37-S62 WeakPolarHBondContact CA-O 3.21Å; E38-S62 PolarHBondContact N-O 3.45Å; D60-S62 WeakPolarHBondContact OD1-CB 3.43Å; D60-S62 PolarHBondContact OD1-N 3Å; D60-S62 PolarHBondContact OD1-OG 2.82Å; S62-N64 VanDerWaalsContact C-N 3.25Å; S62-N64 PolarHBondContact O-N 3.35Å; S62-N64 PolarHBondContact O-ND2 3.49Å; S62-N64 VanDerWaalsContact O-ND2 3.16Å; S62-Y83 PolarHBondContact N-O 2.84Å; S62-Q85 CarbonylContact C-O 3.13Å; S62-Q85 WeakPolarHBondContact CA-O 3.38Å; S62-Q85 WeakPolarHBondContact CB-O 3.23Å
63	R	93.8	Very high	91.2	Very high	152 Å²	152	43.6 Å²	43.6	57%	0.574	21%	0.213	S	C	*	.	S	Bend	trans	55.5	41.5	172.6	-59	174.3	173.9	-143.7	-4.9	112.7	E38 Q85 G86	E38-R63 WeakPolarHBondContact CA-O 3.31Å; E38-R63 HydrophobicContact CB-CB 4.48Å; E38-R63 HydrophobicContact CG-CB 3.55Å; E38-R63 HydrophobicContact CG-CG 4.18Å; E38-R63 WeakPolarHBondContact OE1-CD 3.39Å; E38-R63 IonicContact OE1-CZ 3.22Å; E38-R63 IonicContact OE1-NE 2.9Å; E38-R63 IonicContact OE1-NH1 2.88Å; E38-R63 PolarHBondContact OE1-NH1 2.94Å; R63-Q85 PolarHBondContact N-O 2.86Å; R63-G86 VanDerWaalsContact CA-O 3.3Å; R63-G86 WeakPolarHBondContact CA-O 3.37Å
64	N	94.1	Very high	91.3	Very high	9 Å²	9	43.5 Å²	43.5	5%	0.048	21%	0.214	C	C	.	.	S	Bend	trans	-110.1	-164.5	172.1	-78.9	-64.6	0	0	0	109.6	L36 R39 N40 L41 V61 S62 L66 G86 N87	L36-N64 PolarHBondContact O-ND2 3.48Å; R39-N64 WeakPolarHBondContact CA-OD1 3.38Å; R39-N64 PolarHBondContact N-OD1 3.22Å; N40-N64 PolarHBondContact N-OD1 2.92Å; N40-N64 VanDerWaalsContact N-OD1 3.08Å; L41-N64 HydrophobicContact CB-CB 4.18Å; L41-N64 WeakPolarHBondContact CB-OD1 3.46Å; L41-N64 WeakPolarHBondContact CG-OD1 3.46Å; L41-N64 PolarHBondContact N-OD1 2.99Å; V61-N64 PolarHBondContact O-ND2 2.75Å; S62-N64 VanDerWaalsContact C-N 3.25Å; S62-N64 PolarHBondContact O-N 3.35Å; S62-N64 PolarHBondContact O-ND2 3.49Å; S62-N64 VanDerWaalsContact O-ND2 3.16Å; N64-L66 HydrophobicContact CB-CG 4.19Å; N64-G86 PolarHBondContact N-O 3.18Å; N64-N87 VanDerWaalsContact CA-OD1 3.31Å; N64-N87 WeakPolarHBondContact CA-OD1 3.43Å; N64-N87 WeakPolarHBondContact CB-OD1 3.34Å; N64-N87 PolarHBondContact N-OD1 3.19Å; N64-N87 PolarHBondContact O-OD1 2.91Å
65	R	92.9	Very high	91.3	Very high	133 Å²	133	47.8 Å²	47.8	50%	0.502	23%	0.233	S	C	.	.			trans	-121.6	31.3	178.6	-56.3	-178.2	-169.9	-175	3.2	110.7	N40 L41 L67 N87	N40-R65 PolarHBondContact OD1-NE 3.45Å; N40-R65 VanDerWaalsContact OD1-NE 3.13Å; N40-R65 PolarHBondContact OD1-NH2 2.76Å; L41-R65 CarbonylContact O-C 3.6Å; L41-R65 VanDerWaalsContact O-C 3.23Å; L41-R65 VanDerWaalsContact O-CA 3.28Å; L41-R65 WeakPolarHBondContact O-CA 3.21Å; L41-R65 PolarHBondContact O-N 2.74Å; R65-L67 PolarHBondContact O-N 2.91Å; R65-N87 PolarHBondContact N-OD1 3.47Å
66	L	92.5	Very high	91.4	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	21%	0.212	C	C	.	.			trans	-61.9	123.4	-178.6	-60.8	-179.1	0	0	0	109.8	L41 V61 N64 L84 N87 C88 I89	L41-L66 HydrophobicContact CB-CD2 4.43Å; L41-L66 PolarHBondContact O-N 2.95Å; V61-L66 HydrophobicContact CB-CD1 4.27Å; V61-L66 HydrophobicContact CG1-CD1 3.69Å; N64-L66 HydrophobicContact CB-CG 4.19Å; L66-L84 HydrophobicContact CD1-CD2 4.27Å; L66-N87 HydrophobicContact CB-CB 4.2Å; L66-N87 WeakPolarHBondContact CB-OD1 3.5Å; L66-N87 VanDerWaalsContact CG-OD1 3.31Å; L66-N87 WeakPolarHBondContact CG-OD1 3.29Å; L66-N87 PolarHBondContact N-OD1 3.08Å; L66-C88 CarbonylContact O-C 3.17Å; L66-C88 VanDerWaalsContact O-CA 3.23Å; L66-C88 WeakPolarHBondContact O-CA 3.44Å; L66-C88 WeakPolarHBondContact O-CB 3.46Å; L66-C88 PolarHBondContact O-N 3.28Å; L66-I89 HydrophobicContact CB-CG1 4.45Å; L66-I89 PolarHBondContact O-N 3.12Å
67	L	91.9	Very high	91.1	Very high	98 Å²	98	45.2 Å²	45.2	51%	0.513	23%	0.228	S	C	.	.	S	Bend	trans	-80.7	-30.9	175.8	-64.3	175.6	0	0	0	111.9	R65 C88 I89	R65-L67 PolarHBondContact O-N 2.91Å; L67-C88 HydrophobicContact CD2-CB 3.94Å; L67-I89 WeakPolarHBondContact O-CA 3.36Å
68	D	92.6	Very high	90.9	Very high	119 Å²	119	50.1 Å²	50.1	64%	0.636	25%	0.248	S	C	*	.	S	Bend	trans	-124.1	154.6	-175.6	-61.4	-55	0	0	0	110.7
69	F	92.5	Very high	90.9	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.026	24%	0.237	C	C	.	.			trans	-65.9	135.4	172.1	-173.2	-81.3	0	0	0	109.5	V71 L82 L84 I89 V92 P93 I96	F69-V71 WeakPolarHBondContact O-CG2 3.31Å; F69-V71 PolarHBondContact O-N 3.07Å; F69-L82 HydrophobicContact CE2-CD2 4.24Å; F69-L82 HydrophobicContact CZ-CD2 3.83Å; F69-L84 HydrophobicContact CD2-CD1 3.62Å; F69-L84 HydrophobicContact CE2-CD1 3.27Å; F69-L84 HydrophobicContact CZ-CD1 3.99Å; F69-I89 HydrophobicContact CB-CG2 4.28Å; F69-V92 HydrophobicContact CD2-CG1 4.32Å; F69-V92 HydrophobicContact CE2-CG1 4.4Å; F69-P93 HydrophobicContact CB-CG 3.91Å; F69-P93 HydrophobicContact CD1-CG 3.68Å; F69-P93 HydrophobicContact CE1-CG 4.47Å; F69-P93 VanDerWaalsContact CG-CD 3.48Å; F69-P93 HydrophobicContact CG-CG 3.93Å; F69-I96 HydrophobicContact CE2-CD1 3.94Å; F69-I96 HydrophobicContact CE2-CG1 4.47Å; F69-I96 HydrophobicContact CZ-CD1 3.9Å; F69-I96 HydrophobicContact CZ-CG1 3.95Å
70	P	91.5	Very high	91	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.019	25%	0.245	C	C	.	.			trans	-69.3	92.6	179.2	30.6	-37.1	0	0	0	110.7	F44 E72 L73 L84	F44-P70 HydrophobicContact CB-CB 3.79Å; F44-P70 HydrophobicContact CD1-CB 3.99Å; F44-P70 HydrophobicContact CD2-CB 3.84Å; F44-P70 HydrophobicContact CE2-CB 4.43Å; F44-P70 HydrophobicContact CG-CB 3.61Å; P70-E72 WeakPolarHBondContact CA-OE2 3.45Å; P70-E72 PolarHBondContact O-N 2.83Å; P70-L73 HydrophobicContact CB-CD1 4.09Å; P70-L73 HydrophobicContact CB-CG 4.03Å; P70-L73 HydrophobicContact CG-CD1 3.5Å; P70-L73 HydrophobicContact CG-CG 3.96Å; P70-L73 PolarHBondContact O-N 2.95Å; P70-L73 VanDerWaalsContact O-N 3.12Å; P70-L84 HydrophobicContact CG-CD2 3.97Å
71	V	89.3	Confident	91.1	Very high	71 Å²	71	49.2 Å²	49.2	43%	0.43	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-61.3	-27.2	-175.6	-152	0	0	0	0	110.9	F69 L73 S74 C95	F69-V71 WeakPolarHBondContact O-CG2 3.31Å; F69-V71 PolarHBondContact O-N 3.07Å; V71-L73 PolarHBondContact O-N 3.15Å; V71-S74 WeakPolarHBondContact O-CB 3.19Å; V71-S74 PolarHBondContact O-N 3.32Å; V71-S74 PolarHBondContact O-OG 3.11Å; V71-C95 HydrophobicContact CG1-CB 4.35Å; V71-C95 WeakPolarHBondContact CG1-SG 3.03Å
72	E	87.5	Confident	91.2	Very high	68 Å²	68	49.2 Å²	49.2	32%	0.318	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-65.4	-26.2	179.9	-56.4	76	-165	0	0	112.4	F44 F46 P70 S74 D75	F44-E72 HydrophobicContact CD1-CB 4.17Å; F44-E72 HydrophobicContact CD1-CG 4.43Å; F44-E72 HydrophobicContact CE1-CB 4.1Å; F46-E72 HydrophobicContact CB-CB 4.25Å; F46-E72 HydrophobicContact CB-CG 3.92Å; F46-E72 HydrophobicContact CD1-CB 3.79Å; F46-E72 HydrophobicContact CD1-CG 3.39Å; F46-E72 HydrophobicContact CD2-CB 4.41Å; F46-E72 HydrophobicContact CE1-CB 4.11Å; F46-E72 HydrophobicContact CE1-CG 4Å; F46-E72 HydrophobicContact CG-CB 3.91Å; F46-E72 HydrophobicContact CG-CG 3.8Å; P70-E72 WeakPolarHBondContact CA-OE2 3.45Å; P70-E72 PolarHBondContact O-N 2.83Å; E72-S74 PolarHBondContact O-N 2.85Å; E72-D75 PolarHBondContact O-N 2.95Å
73	L	88.6	Confident	91.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-69	-15.1	173.9	-64.2	-176.3	0	0	0	112.4	L34 F44 V59 P70 V71 D75 C76 L82 L99	L34-L73 HydrophobicContact CD2-CD2 4.44Å; F44-L73 HydrophobicContact CE1-CD2 4.18Å; F44-L73 HydrophobicContact CE1-CG 4.5Å; F44-L73 HydrophobicContact CE2-CD2 4.24Å; F44-L73 HydrophobicContact CZ-CD2 3.62Å; F44-L73 HydrophobicContact CZ-CG 4.15Å; V59-L73 HydrophobicContact CB-CD1 4.39Å; V59-L73 HydrophobicContact CG1-CD1 3.71Å; V59-L73 HydrophobicContact CG1-CD2 4.24Å; V59-L73 HydrophobicContact CG2-CD1 4.49Å; V59-L73 HydrophobicContact CG2-CD2 4.11Å; P70-L73 HydrophobicContact CB-CD1 4.09Å; P70-L73 HydrophobicContact CB-CG 4.03Å; P70-L73 HydrophobicContact CG-CD1 3.5Å; P70-L73 HydrophobicContact CG-CG 3.96Å; P70-L73 PolarHBondContact O-N 2.95Å; P70-L73 VanDerWaalsContact O-N 3.12Å; V71-L73 PolarHBondContact O-N 3.15Å; L73-D75 PolarHBondContact O-N 3Å; L73-D75 VanDerWaalsContact O-N 3.15Å; L73-C76 VanDerWaalsContact O-CB 3.26Å; L73-C76 WeakPolarHBondContact O-CB 3.44Å; L73-C76 PolarHBondContact O-N 3.09Å; L73-C76 PolarHBondContact O-SG 2.99Å; L73-L82 HydrophobicContact CD1-CD1 3.67Å; L73-L99 VanDerWaalsContact O-CD2 3.22Å; L73-L99 WeakPolarHBondContact O-CD2 3.2Å
74	S	85.9	Confident	91.4	Very high	10 Å²	10	44.5 Å²	44.5	7%	0.07	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-61.7	-21.7	179.1	-48.4	0	0	0	0	112.4	V71 E72 C76 C95 S98	V71-S74 WeakPolarHBondContact O-CB 3.19Å; V71-S74 PolarHBondContact O-N 3.32Å; V71-S74 PolarHBondContact O-OG 3.11Å; E72-S74 PolarHBondContact O-N 2.85Å; S74-C76 VanDerWaalsContact C-N 3.31Å; S74-C95 PolarHBondContact OG-SG 3.17Å; S74-S98 WeakPolarHBondContact CA-OG 3.29Å; S74-S98 WeakPolarHBondContact CB-OG 3.26Å; S74-S98 WeakPolarHBondContact O-CB 3.17Å; S74-S98 PolarHBondContact O-OG 3.37Å
75	D	84.7	Confident	91.5	Very high	132 Å²	132	45.7 Å²	45.7	71%	0.706	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-81.4	-11.1	177.5	-64.4	-25.1	0	0	0	112.8	E72 L73 G77	E72-D75 PolarHBondContact O-N 2.95Å; L73-D75 PolarHBondContact O-N 3Å; L73-D75 VanDerWaalsContact O-N 3.15Å; D75-G77 PolarHBondContact O-N 3.04Å
76	C	86.6	Confident	91.6	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.007	22%	0.221	C	C	.	.			trans	-77.5	80.5	178.3	-55	0	0	0	0	111	L53 L73 S74 F78 L79	L53-C76 PolarHBondContact O-SG 2.97Å; L53-C76 VanDerWaalsContact O-SG 3.35Å; L73-C76 VanDerWaalsContact O-CB 3.26Å; L73-C76 WeakPolarHBondContact O-CB 3.44Å; L73-C76 PolarHBondContact O-N 3.09Å; L73-C76 PolarHBondContact O-SG 2.99Å; S74-C76 VanDerWaalsContact C-N 3.31Å; C76-F78 PolarHBondContact O-N 2.71Å; C76-F78 VanDerWaalsContact O-N 3.17Å; C76-L79 HydrophobicContact CB-CB 3.93Å; C76-L79 HydrophobicContact CB-CD2 4.49Å; C76-L79 VanDerWaalsContact O-CB 3.28Å; C76-L79 WeakPolarHBondContact O-CB 3.29Å; C76-L79 PolarHBondContact O-N 3.34Å; C76-L79 VanDerWaalsContact O-N 3.11Å
77	G	84.1	Confident	91.8	Very high	34 Å²	34	40.9 Å²	40.9	35%	0.351	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.4	-176	0	0	0	0	0	115.5	D75 S101	D75-G77 PolarHBondContact O-N 3.04Å; G77-S101 PolarHBondContact O-OG 3.22Å
78	F	90.4	Very high	92	Very high	121 Å²	121	38 Å²	38	53%	0.531	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	5.4	178.2	-62.4	-66	0	0	0	114.1	S54 V56 V57 C76 E80	S54-F78 WeakPolarHBondContact O-CD2 3.39Å; V56-F78 CarbonylContact O-C 3.18Å; V57-F78 HydrophobicContact CG2-CB 4.39Å; C76-F78 PolarHBondContact O-N 2.71Å; C76-F78 VanDerWaalsContact O-N 3.17Å; F78-E80 PolarHBondContact O-N 3.26Å; F78-E80 VanDerWaalsContact O-N 3.16Å
79	L	94	Very high	92.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.18	C	C	.	.			trans	-64	117.1	-178.9	-173.1	61.6	0	0	0	110.7	V56 V59 C76 T81 L82 L99 S101 L102	V56-L79 WeakPolarHBondContact O-CA 3.49Å; V56-L79 PolarHBondContact O-N 3.16Å; V59-L79 HydrophobicContact CB-CD1 3.9Å; V59-L79 HydrophobicContact CG2-CD1 3.4Å; V59-L79 VanDerWaalsContact CG2-CD1 3.4Å; V59-L79 HydrophobicContact CG2-CD2 4.36Å; C76-L79 HydrophobicContact CB-CB 3.93Å; C76-L79 HydrophobicContact CB-CD2 4.49Å; C76-L79 VanDerWaalsContact O-CB 3.28Å; C76-L79 WeakPolarHBondContact O-CB 3.29Å; C76-L79 PolarHBondContact O-N 3.34Å; C76-L79 VanDerWaalsContact O-N 3.11Å; L79-T81 WeakPolarHBondContact CD1-O 3.36Å; L79-L82 HydrophobicContact CD2-CB 4.24Å; L79-L82 HydrophobicContact CD2-CD1 4.43Å; L79-L82 HydrophobicContact CD2-CD2 4.25Å; L79-L99 HydrophobicContact CB-CD2 4.28Å; L79-L99 HydrophobicContact CD2-CD1 4.15Å; L79-L99 HydrophobicContact CD2-CD2 4.08Å; L79-S101 CarbonylContact O-C 3.32Å; L79-L102 HydrophobicContact CD2-CD1 4.27Å; L79-L102 HydrophobicContact CG-CD1 3.93Å; L79-L102 WeakPolarHBondContact O-CA 3.42Å; L79-L102 PolarHBondContact O-N 3.25Å
80	E	95.3	Very high	92.2	Very high	39 Å²	39	37.7 Å²	37.7	18%	0.182	20%	0.203	C	C	.	.			trans	-104.1	-33.3	-179.7	-70.4	-178.7	-178.1	0	0	112.1	V57 F78 S101 T103 F104 S431	V57-E80 HydrophobicContact CG1-CB 3.83Å; V57-E80 HydrophobicContact CG1-CG 3.82Å; V57-E80 PolarHBondContact O-N 3.01Å; F78-E80 PolarHBondContact O-N 3.26Å; F78-E80 VanDerWaalsContact O-N 3.16Å; E80-S101 WeakPolarHBondContact CA-O 3.46Å; E80-T103 PolarHBondContact O-N 3Å; E80-T103 PolarHBondContact O-OG1 2.88Å; E80-T103 VanDerWaalsContact O-OG1 3.1Å; E80-F104 PolarHBondContact O-N 2.59Å; E80-S431 VanDerWaalsContact OE1-CB 3.25Å; E80-S431 WeakPolarHBondContact OE1-CB 3.4Å; E80-S431 PolarHBondContact OE1-OG 3.35Å; E80-S431 WeakPolarHBondContact OE2-CB 3.31Å; E80-S431 PolarHBondContact OE2-OG 3.48Å
81	T	96.3	Very high	92.3	Very high	29 Å²	29	42 Å²	42	18%	0.178	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.9	-176.2	-57.7	0	0	0	0	111.1	V57 F58 V59 L79 Y83 F104	V57-T81 PolarHBondContact O-N 3.38Å; V57-T81 VanDerWaalsContact O-N 3.12Å; F58-T81 HydrophobicContact CD2-CG2 3.76Å; F58-T81 HydrophobicContact CE2-CG2 3.76Å; V59-T81 PolarHBondContact N-O 3.03Å; L79-T81 WeakPolarHBondContact CD1-O 3.36Å; T81-Y83 HydrophobicContact CG2-CD2 3.93Å; T81-Y83 HydrophobicContact CG2-CE2 3.46Å; T81-Y83 VanDerWaalsContact CG2-CE2 3.46Å; T81-F104 HydrophobicContact CG2-CB 4.16Å; T81-F104 HydrophobicContact CG2-CD1 3.84Å; T81-F104 HydrophobicContact CG2-CG 4.2Å
82	L	96.6	Very high	92.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	116.6	178.8	180	56.3	0	0	0	111.5	V59 F69 L73 L79 L84 L99 L102 F104 L105 D106	V59-L82 HydrophobicContact CB-CD1 3.85Å; V59-L82 HydrophobicContact CG1-CD1 3.84Å; V59-L82 WeakPolarHBondContact O-CA 3.44Å; F69-L82 HydrophobicContact CE2-CD2 4.24Å; F69-L82 HydrophobicContact CZ-CD2 3.83Å; L73-L82 HydrophobicContact CD1-CD1 3.67Å; L79-L82 HydrophobicContact CD2-CB 4.24Å; L79-L82 HydrophobicContact CD2-CD1 4.43Å; L79-L82 HydrophobicContact CD2-CD2 4.25Å; L82-L84 HydrophobicContact CD1-CD1 4.23Å; L82-L84 HydrophobicContact CD1-CG 4Å; L82-L84 HydrophobicContact CD2-CD1 3.76Å; L82-L84 HydrophobicContact CD2-CG 4.4Å; L82-L84 HydrophobicContact CG-CD1 3.9Å; L82-L84 HydrophobicContact CG-CG 4.01Å; L82-L99 HydrophobicContact CD2-CD1 4.42Å; L82-L102 HydrophobicContact CB-CD1 3.72Å; L82-F104 PolarHBondContact N-O 2.97Å; L82-L105 HydrophobicContact CB-CD1 4.09Å; L82-L105 HydrophobicContact CD2-CD1 3.92Å; L82-L105 HydrophobicContact CG-CD1 4.02Å; L82-D106 PolarHBondContact O-N 2.62Å
83	Y	96.8	Very high	92.8	Very high	60 Å²	60	37.2 Å²	37.2	24%	0.235	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	116.7	173.3	-71.7	-73.7	0	0	0	110.6	F58 V59 D60 V61 S62 T81 F104 D106	F58-Y83 HydrophobicContact CE2-CD2 4.01Å; F58-Y83 AromaticContact CE2-CE2 3.6Å; F58-Y83 HydrophobicContact CE2-CE2 3.6Å; F58-Y83 AromaticContact CZ-CD2 3.73Å; F58-Y83 HydrophobicContact CZ-CD2 3.73Å; F58-Y83 AromaticContact CZ-CE2 3.66Å; F58-Y83 HydrophobicContact CZ-CE2 3.66Å; V59-Y83 PolarHBondContact O-N 3.1Å; D60-Y83 HydrophobicContact CB-CD2 4.4Å; V61-Y83 CarbonylContact C-O 3.12Å; V61-Y83 PolarHBondContact N-O 2.55Å; S62-Y83 PolarHBondContact N-O 2.84Å; T81-Y83 HydrophobicContact CG2-CD2 3.93Å; T81-Y83 HydrophobicContact CG2-CE2 3.46Å; T81-Y83 VanDerWaalsContact CG2-CE2 3.46Å; Y83-F104 AromaticContact CD1-CE1 3.82Å; Y83-F104 HydrophobicContact CD1-CE1 3.82Å; Y83-F104 HydrophobicContact CE1-CD1 4.12Å; Y83-F104 AromaticContact CE1-CE1 3.17Å; Y83-F104 HydrophobicContact CE1-CE1 3.17Å; Y83-F104 AromaticContact CE1-CZ 3.65Å; Y83-F104 HydrophobicContact CE1-CZ 3.65Å; Y83-F104 HydrophobicContact CE2-CE1 4.36Å; Y83-F104 AromaticContact CZ-CE1 3.49Å; Y83-F104 VanDerWaalsContact CZ-CE1 3.49Å; Y83-F104 AromaticContact CZ-CZ 3.94Å; Y83-D106 HydrophobicContact CD1-CB 3.79Å; Y83-D106 HydrophobicContact CE1-CB 4.25Å
84	L	96.1	Very high	93	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.			trans	-128.2	11	178.1	-75.8	169.1	0	0	0	112.1	V61 L66 F69 P70 L82 N87 I89 D106 L107 N110	V61-L84 HydrophobicContact CB-CD2 4.15Å; L66-L84 HydrophobicContact CD1-CD2 4.27Å; F69-L84 HydrophobicContact CD2-CD1 3.62Å; F69-L84 HydrophobicContact CE2-CD1 3.27Å; F69-L84 HydrophobicContact CZ-CD1 3.99Å; P70-L84 HydrophobicContact CG-CD2 3.97Å; L82-L84 HydrophobicContact CD1-CD1 4.23Å; L82-L84 HydrophobicContact CD1-CG 4Å; L82-L84 HydrophobicContact CD2-CD1 3.76Å; L82-L84 HydrophobicContact CD2-CG 4.4Å; L82-L84 HydrophobicContact CG-CD1 3.9Å; L82-L84 HydrophobicContact CG-CG 4.01Å; L84-N87 PolarHBondContact O-ND2 3.12Å; L84-I89 HydrophobicContact CB-CD1 4.16Å; L84-I89 HydrophobicContact CD1-CD1 4.27Å; L84-I89 HydrophobicContact CD2-CD1 4.09Å; L84-I89 HydrophobicContact CG-CD1 4.42Å; L84-D106 CarbonylContact C-O 3.5Å; L84-D106 WeakPolarHBondContact CA-O 3.43Å; L84-D106 WeakPolarHBondContact CB-O 3.36Å; L84-D106 PolarHBondContact N-O 3.15Å; L84-L107 HydrophobicContact CB-CD2 3.77Å; L84-L107 HydrophobicContact CD1-CD2 3.74Å; L84-L107 HydrophobicContact CG-CD2 4.43Å; L84-N110 PolarHBondContact O-ND2 3.21Å
85	Q	96.3	Very high	93.3	Very high	33 Å²	33	44.3 Å²	44.3	15%	0.154	25%	0.246	C	C	.	.			trans	-64.3	148.1	-176.2	70.9	-78.6	17.3	0	0	112.7	S62 R63 D106 S108	S62-Q85 CarbonylContact C-O 3.13Å; S62-Q85 WeakPolarHBondContact CA-O 3.38Å; S62-Q85 WeakPolarHBondContact CB-O 3.23Å; R63-Q85 PolarHBondContact N-O 2.86Å; Q85-D106 PolarHBondContact N-O 3.31Å; Q85-S108 CarbonylContact C-O 3.26Å; Q85-S108 WeakPolarHBondContact CA-O 3.07Å; Q85-S108 VanDerWaalsContact CB-O 3.28Å; Q85-S108 WeakPolarHBondContact CB-O 3.12Å
86	G	95	Very high	93.7	Very high	27 Å²	27	38 Å²	38	28%	0.278	21%	0.212	S	C	.	.	S	Bend	trans	69.9	39	177.9	0	0	0	0	0	113.3	R63 N64 S108 Y109	R63-G86 VanDerWaalsContact CA-O 3.3Å; R63-G86 WeakPolarHBondContact CA-O 3.37Å; N64-G86 PolarHBondContact N-O 3.18Å; G86-S108 PolarHBondContact N-O 3.33Å; G86-Y109 WeakPolarHBondContact CA-O 3.3Å; G86-Y109 PolarHBondContact N-O 3.41Å
87	N	95.9	Very high	94	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.043	23%	0.225	C	C	.	.	S	Bend	trans	-114.8	-171.9	172.6	-81.9	-71.8	0	0	0	110.3	V61 N64 R65 L66 L84 I89 Y109 N110	V61-N87 PolarHBondContact O-ND2 3.33Å; N64-N87 VanDerWaalsContact CA-OD1 3.31Å; N64-N87 WeakPolarHBondContact CA-OD1 3.43Å; N64-N87 WeakPolarHBondContact CB-OD1 3.34Å; N64-N87 PolarHBondContact N-OD1 3.19Å; N64-N87 PolarHBondContact O-OD1 2.91Å; R65-N87 PolarHBondContact N-OD1 3.47Å; L66-N87 HydrophobicContact CB-CB 4.2Å; L66-N87 WeakPolarHBondContact CB-OD1 3.5Å; L66-N87 VanDerWaalsContact CG-OD1 3.31Å; L66-N87 WeakPolarHBondContact CG-OD1 3.29Å; L66-N87 PolarHBondContact N-OD1 3.08Å; L84-N87 PolarHBondContact O-ND2 3.12Å; N87-I89 HydrophobicContact CB-CD1 4.16Å; N87-I89 HydrophobicContact CB-CG1 4.02Å; N87-Y109 PolarHBondContact N-O 3.31Å; N87-Y109 VanDerWaalsContact O-O 3.09Å; N87-N110 WeakPolarHBondContact CA-OD1 3.49Å; N87-N110 WeakPolarHBondContact CB-OD1 3.26Å; N87-N110 PolarHBondContact O-OD1 3.49Å
88	C	95.1	Very high	94.3	Very high	38 Å²	38	40.3 Å²	40.3	26%	0.257	23%	0.225	S	C	.	.			trans	-110.9	25.2	177.8	-69.2	0	0	0	0	112.3	L66 L67 K90 N110	L66-C88 CarbonylContact O-C 3.17Å; L66-C88 VanDerWaalsContact O-CA 3.23Å; L66-C88 WeakPolarHBondContact O-CA 3.44Å; L66-C88 WeakPolarHBondContact O-CB 3.46Å; L66-C88 PolarHBondContact O-N 3.28Å; L67-C88 HydrophobicContact CD2-CB 3.94Å; C88-K90 PolarHBondContact O-N 3.18Å; C88-N110 PolarHBondContact N-OD1 3.12Å
89	I	95.4	Very high	94.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.			trans	-66.2	127.1	-173.8	-59.2	168.8	0	0	0	109.4	L66 L67 F69 L84 N87 V91 N110 Q111 I112	L66-I89 HydrophobicContact CB-CG1 4.45Å; L66-I89 PolarHBondContact O-N 3.12Å; L67-I89 WeakPolarHBondContact O-CA 3.36Å; F69-I89 HydrophobicContact CB-CG2 4.28Å; L84-I89 HydrophobicContact CB-CD1 4.16Å; L84-I89 HydrophobicContact CD1-CD1 4.27Å; L84-I89 HydrophobicContact CD2-CD1 4.09Å; L84-I89 HydrophobicContact CG-CD1 4.42Å; N87-I89 HydrophobicContact CB-CD1 4.16Å; N87-I89 HydrophobicContact CB-CG1 4.02Å; I89-V91 WeakPolarHBondContact CG2-O 3.39Å; I89-N110 HydrophobicContact CB-CB 4.4Å; I89-N110 VanDerWaalsContact CB-OD1 3.31Å; I89-N110 WeakPolarHBondContact CB-OD1 3.42Å; I89-N110 WeakPolarHBondContact CG1-OD1 3.4Å; I89-N110 PolarHBondContact N-OD1 2.75Å; I89-Q111 CarbonylContact O-C 3.58Å; I89-Q111 WeakPolarHBondContact O-CA 3.48Å; I89-Q111 PolarHBondContact O-N 3.38Å; I89-I112 HydrophobicContact CG2-CG1 4.47Å; I89-I112 PolarHBondContact O-N 3.03Å
90	K	94.4	Very high	94.3	Very high	117 Å²	117	44.4 Å²	44.4	51%	0.509	24%	0.237	S	C	.	.			trans	-100.7	-31.5	179.3	-65.5	177.9	-176.1	173.5	0	113.4	C88 Q111 I112	C88-K90 PolarHBondContact O-N 3.18Å; K90-Q111 HydrophobicContact CG-CB 4.09Å; K90-I112 WeakPolarHBondContact O-CA 3.42Å
91	V	94.3	Very high	94.2	Very high	95 Å²	95	44.4 Å²	44.4	58%	0.576	24%	0.241	S	C	*	.			trans	-134.6	131.9	-173.4	-178.2	0	0	0	0	108.8	I89	I89-V91 WeakPolarHBondContact CG2-O 3.39Å
92	V	94.6	Very high	94.2	Very high	4 Å²	4	43 Å²	43	2%	0.024	23%	0.232	C	C	.	.			trans	-92.6	121.2	167.5	-178.9	0	0	0	0	107.6	F69 I96 L107 I112 P116 L119	F69-V92 HydrophobicContact CD2-CG1 4.32Å; F69-V92 HydrophobicContact CE2-CG1 4.4Å; V92-I96 HydrophobicContact CG1-CB 4.29Å; V92-I96 HydrophobicContact CG1-CD1 3.73Å; V92-I96 HydrophobicContact CG1-CG2 4.14Å; V92-L107 HydrophobicContact CG2-CD1 3.89Å; V92-I112 HydrophobicContact CG2-CD1 3.82Å; V92-I112 HydrophobicContact CG2-CG1 4.37Å; V92-I112 HydrophobicContact CG2-CG2 4.49Å; V92-P116 HydrophobicContact CB-CG 3.97Å; V92-P116 HydrophobicContact CG1-CG 3.95Å; V92-P116 WeakPolarHBondContact O-CG 3.22Å; V92-L119 HydrophobicContact CG1-CD1 4.49Å
93	P	93.5	Very high	94.2	Very high	34 Å²	34	44.8 Å²	44.8	22%	0.221	24%	0.243	C	C	.	.			trans	-75	155.8	-177.2	30.7	-36.3	0	0	0	112	F69 C95 I96	F69-P93 HydrophobicContact CB-CG 3.91Å; F69-P93 HydrophobicContact CD1-CG 3.68Å; F69-P93 HydrophobicContact CE1-CG 4.47Å; F69-P93 VanDerWaalsContact CG-CD 3.48Å; F69-P93 HydrophobicContact CG-CG 3.93Å; P93-C95 VanDerWaalsContact CB-SG 3.56Å; P93-C95 WeakPolarHBondContact CG-SG 2.92Å; P93-C95 PolarHBondContact O-N 2.84Å; P93-I96 WeakPolarHBondContact O-CG2 3.26Å; P93-I96 PolarHBondContact O-N 3.39Å
94	N	92.6	Very high	94.3	Very high	117 Å²	117	43.9 Å²	43.9	63%	0.626	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-66	-19.7	178.3	-71.4	-26.7	0	0	0	113.5	I96 A97 P116 A118	N94-I96 PolarHBondContact O-N 2.94Å; N94-A97 WeakPolarHBondContact O-CB 3.12Å; N94-A97 PolarHBondContact O-N 3.13Å; N94-P116 WeakPolarHBondContact OD1-CB 3.42Å; N94-A118 HydrophobicContact CB-CB 4.17Å
95	C	91.8	Very high	94.3	Very high	42 Å²	42	43.9 Å²	43.9	28%	0.284	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-63.4	-16.9	176.8	63.2	0	0	0	0	112.9	V71 S74 P93 A97 S98	V71-C95 HydrophobicContact CG1-CB 4.35Å; V71-C95 WeakPolarHBondContact CG1-SG 3.03Å; S74-C95 PolarHBondContact OG-SG 3.17Å; P93-C95 VanDerWaalsContact CB-SG 3.56Å; P93-C95 WeakPolarHBondContact CG-SG 2.92Å; P93-C95 PolarHBondContact O-N 2.84Å; C95-A97 PolarHBondContact O-N 2.7Å; C95-S98 WeakPolarHBondContact O-CB 3.5Å; C95-S98 PolarHBondContact O-N 3.12Å; C95-S98 PolarHBondContact O-OG 3.49Å
96	I	93	Very high	94.4	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-54.5	-25.6	174	-156.8	178.5	0	0	0	112.4	F69 V92 P93 N94 S98 L99 L105 A118 L119 L122	F69-I96 HydrophobicContact CE2-CD1 3.94Å; F69-I96 HydrophobicContact CE2-CG1 4.47Å; F69-I96 HydrophobicContact CZ-CD1 3.9Å; F69-I96 HydrophobicContact CZ-CG1 3.95Å; V92-I96 HydrophobicContact CG1-CB 4.29Å; V92-I96 HydrophobicContact CG1-CD1 3.73Å; V92-I96 HydrophobicContact CG1-CG2 4.14Å; P93-I96 WeakPolarHBondContact O-CG2 3.26Å; P93-I96 PolarHBondContact O-N 3.39Å; N94-I96 PolarHBondContact O-N 2.94Å; I96-S98 PolarHBondContact O-N 3.49Å; I96-S98 VanDerWaalsContact O-N 3.14Å; I96-L99 HydrophobicContact CG1-CD1 3.86Å; I96-L99 WeakPolarHBondContact O-CB 3.43Å; I96-L99 WeakPolarHBondContact O-CG 3.1Å; I96-L99 PolarHBondContact O-N 2.96Å; I96-L99 VanDerWaalsContact O-N 3.12Å; I96-L105 HydrophobicContact CD1-CD2 3.79Å; I96-A118 HydrophobicContact CG2-CB 4.46Å; I96-L119 HydrophobicContact CD1-CD1 4.32Å; I96-L119 HydrophobicContact CG2-CB 4.46Å; I96-L122 HydrophobicContact CD1-CD1 4.28Å; I96-L122 HydrophobicContact CG1-CD1 3.99Å; I96-L122 HydrophobicContact CG2-CD1 4.49Å; I96-L122 WeakPolarHBondContact O-CD2 3.34Å
97	A	91.5	Very high	94.5	Very high	34 Å²	34	41.7 Å²	41.7	28%	0.281	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-62.1	-15.5	176.1	0	0	0	0	0	114.6	N94 C95 L99 A118	N94-A97 WeakPolarHBondContact O-CB 3.12Å; N94-A97 PolarHBondContact O-N 3.13Å; C95-A97 PolarHBondContact O-N 2.7Å; A97-L99 VanDerWaalsContact C-N 3.25Å; A97-L99 PolarHBondContact O-N 3.16Å; A97-A118 HydrophobicContact CB-CB 4.06Å
98	S	91.7	Very high	94.5	Very high	49 Å²	49	41.7 Å²	41.7	34%	0.343	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-71	-21.8	174.6	64.9	0	0	0	0	112.9	S74 C95 I96 R100	S74-S98 WeakPolarHBondContact CA-OG 3.29Å; S74-S98 WeakPolarHBondContact CB-OG 3.26Å; S74-S98 WeakPolarHBondContact O-CB 3.17Å; S74-S98 PolarHBondContact O-OG 3.37Å; C95-S98 WeakPolarHBondContact O-CB 3.5Å; C95-S98 PolarHBondContact O-N 3.12Å; C95-S98 PolarHBondContact O-OG 3.49Å; I96-S98 PolarHBondContact O-N 3.49Å; I96-S98 VanDerWaalsContact O-N 3.14Å; S98-R100 PolarHBondContact O-N 2.83Å
99	L	93.1	Very high	94.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.			trans	-77.4	60.6	-175.8	-56.9	178.6	0	0	0	112.2	L73 L79 L82 I96 A97 S101 L102 L122	L73-L99 VanDerWaalsContact O-CD2 3.22Å; L73-L99 WeakPolarHBondContact O-CD2 3.2Å; L79-L99 HydrophobicContact CB-CD2 4.28Å; L79-L99 HydrophobicContact CD2-CD1 4.15Å; L79-L99 HydrophobicContact CD2-CD2 4.08Å; L82-L99 HydrophobicContact CD2-CD1 4.42Å; I96-L99 HydrophobicContact CG1-CD1 3.86Å; I96-L99 WeakPolarHBondContact O-CB 3.43Å; I96-L99 WeakPolarHBondContact O-CG 3.1Å; I96-L99 PolarHBondContact O-N 2.96Å; I96-L99 VanDerWaalsContact O-N 3.12Å; A97-L99 VanDerWaalsContact C-N 3.25Å; A97-L99 PolarHBondContact O-N 3.16Å; L99-S101 PolarHBondContact O-N 3.09Å; L99-L102 HydrophobicContact CB-CB 3.9Å; L99-L102 HydrophobicContact CB-CD2 4.4Å; L99-L102 HydrophobicContact CD1-CD2 3.98Å; L99-L102 VanDerWaalsContact O-CB 3.27Å; L99-L102 WeakPolarHBondContact O-CB 3.46Å; L99-L102 PolarHBondContact O-N 3.13Å; L99-L122 HydrophobicContact CB-CD2 4.37Å; L99-L122 WeakPolarHBondContact O-CD2 3.4Å
100	R	91.6	Very high	94.7	Very high	207 Å²	207	45.2 Å²	45.2	78%	0.781	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.9	-171.7	-66.1	-179.8	-177.1	170	2.2	114.8	S98 P123	S98-R100 PolarHBondContact O-N 2.83Å; R100-P123 WeakPolarHBondContact O-CD 3.38Å; R100-P123 WeakPolarHBondContact O-CG 3.2Å
101	S	93.7	Very high	94.7	Very high	38 Å²	38	42.1 Å²	42.1	27%	0.266	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-3.6	178.1	-52.7	0	0	0	0	112.8	G77 L79 E80 L99 T103	G77-S101 PolarHBondContact O-OG 3.22Å; L79-S101 CarbonylContact O-C 3.32Å; E80-S101 WeakPolarHBondContact CA-O 3.46Å; L99-S101 PolarHBondContact O-N 3.09Å; S101-T103 PolarHBondContact O-N 3.48Å
102	L	96.2	Very high	94.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.			trans	-71.1	116.4	-172.2	-165.9	73.2	0	0	0	111.1	L79 L82 L99 L105 L122 P123 L124	L79-L102 HydrophobicContact CD2-CD1 4.27Å; L79-L102 HydrophobicContact CG-CD1 3.93Å; L79-L102 WeakPolarHBondContact O-CA 3.42Å; L79-L102 PolarHBondContact O-N 3.25Å; L82-L102 HydrophobicContact CB-CD1 3.72Å; L99-L102 HydrophobicContact CB-CB 3.9Å; L99-L102 HydrophobicContact CB-CD2 4.4Å; L99-L102 HydrophobicContact CD1-CD2 3.98Å; L99-L102 VanDerWaalsContact O-CB 3.27Å; L99-L102 WeakPolarHBondContact O-CB 3.46Å; L99-L102 PolarHBondContact O-N 3.13Å; L102-L105 HydrophobicContact CD2-CB 4.13Å; L102-L105 HydrophobicContact CD2-CD1 4.33Å; L102-L105 HydrophobicContact CD2-CD2 4.3Å; L102-L105 HydrophobicContact CD2-CG 4.5Å; L102-L122 HydrophobicContact CD2-CD1 4.06Å; L102-P123 CarbonylContact O-C 3.56Å; L102-L124 HydrophobicContact CD2-CD2 4.1Å; L102-L124 HydrophobicContact CG-CD2 4.07Å
103	T	96.5	Very high	94.8	Very high	38 Å²	38	39.8 Å²	39.8	23%	0.233	21%	0.209	C	C	.	.			trans	-109.2	-29.3	-179.7	60.9	0	0	0	0	112.2	E80 S101 E125 V126	E80-T103 PolarHBondContact O-N 3Å; E80-T103 PolarHBondContact O-OG1 2.88Å; E80-T103 VanDerWaalsContact O-OG1 3.1Å; S101-T103 PolarHBondContact O-N 3.48Å; T103-E125 HydrophobicContact CG2-CG 4.45Å; T103-E125 PolarHBondContact O-N 3.37Å; T103-V126 PolarHBondContact O-N 3.22Å
104	F	97.5	Very high	94.8	Very high	40 Å²	40	44.3 Å²	44.3	18%	0.175	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.5	-178.8	-174.4	-75.2	0	0	0	109.9	E80 T81 L82 Y83 D106 V126 L128	E80-F104 PolarHBondContact O-N 2.59Å; T81-F104 HydrophobicContact CG2-CB 4.16Å; T81-F104 HydrophobicContact CG2-CD1 3.84Å; T81-F104 HydrophobicContact CG2-CG 4.2Å; L82-F104 PolarHBondContact N-O 2.97Å; Y83-F104 AromaticContact CD1-CE1 3.82Å; Y83-F104 HydrophobicContact CD1-CE1 3.82Å; Y83-F104 HydrophobicContact CE1-CD1 4.12Å; Y83-F104 AromaticContact CE1-CE1 3.17Å; Y83-F104 HydrophobicContact CE1-CE1 3.17Å; Y83-F104 AromaticContact CE1-CZ 3.65Å; Y83-F104 HydrophobicContact CE1-CZ 3.65Å; Y83-F104 HydrophobicContact CE2-CE1 4.36Å; Y83-F104 AromaticContact CZ-CE1 3.49Å; Y83-F104 VanDerWaalsContact CZ-CE1 3.49Å; Y83-F104 AromaticContact CZ-CZ 3.94Å; F104-D106 HydrophobicContact CE1-CB 3.8Å; F104-D106 HydrophobicContact CZ-CB 4.41Å; F104-V126 HydrophobicContact CD2-CB 3.61Å; F104-V126 HydrophobicContact CD2-CG1 3.83Å; F104-V126 HydrophobicContact CD2-CG2 3.99Å; F104-V126 HydrophobicContact CE2-CB 3.95Å; F104-V126 HydrophobicContact CE2-CG1 3.61Å; F104-V126 HydrophobicContact CE2-CG2 4.37Å; F104-V126 HydrophobicContact CG-CB 4.39Å; F104-V126 HydrophobicContact CZ-CG1 4.37Å; F104-L128 HydrophobicContact CZ-CD1 3.87Å
105	L	97.4	Very high	94.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	118.2	176.8	178.1	58.9	0	0	0	110.5	L82 I96 L102 L107 L119 L124 V126 L127 L128	L82-L105 HydrophobicContact CB-CD1 4.09Å; L82-L105 HydrophobicContact CD2-CD1 3.92Å; L82-L105 HydrophobicContact CG-CD1 4.02Å; I96-L105 HydrophobicContact CD1-CD2 3.79Å; L102-L105 HydrophobicContact CD2-CB 4.13Å; L102-L105 HydrophobicContact CD2-CD1 4.33Å; L102-L105 HydrophobicContact CD2-CD2 4.3Å; L102-L105 HydrophobicContact CD2-CG 4.5Å; L105-L107 HydrophobicContact CD1-CD1 4.21Å; L105-L107 HydrophobicContact CD1-CD2 4.49Å; L105-L107 HydrophobicContact CD1-CG 3.96Å; L105-L107 HydrophobicContact CD2-CD1 3.81Å; L105-L107 HydrophobicContact CD2-CG 4.42Å; L105-L107 HydrophobicContact CG-CD1 3.97Å; L105-L107 HydrophobicContact CG-CG 4.05Å; L105-L119 HydrophobicContact CD2-CD1 3.79Å; L105-L119 HydrophobicContact CD2-CG 4.43Å; L105-L124 HydrophobicContact CB-CD2 3.76Å; L105-V126 PolarHBondContact N-O 2.81Å; L105-V126 VanDerWaalsContact N-O 3.09Å; L105-L127 HydrophobicContact CB-CD1 4.24Å; L105-L127 HydrophobicContact CD2-CD1 3.99Å; L105-L127 HydrophobicContact CG-CD1 4.16Å; L105-L128 PolarHBondContact O-N 3.14Å
106	D	97.5	Very high	94.9	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.08	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	113.6	172.7	-171.2	1	0	0	0	111.2	L82 Y83 L84 Q85 F104 S108 L128	L82-D106 PolarHBondContact O-N 2.62Å; Y83-D106 HydrophobicContact CD1-CB 3.79Å; Y83-D106 HydrophobicContact CE1-CB 4.25Å; L84-D106 CarbonylContact C-O 3.5Å; L84-D106 WeakPolarHBondContact CA-O 3.43Å; L84-D106 WeakPolarHBondContact CB-O 3.36Å; L84-D106 PolarHBondContact N-O 3.15Å; Q85-D106 PolarHBondContact N-O 3.31Å; F104-D106 HydrophobicContact CE1-CB 3.8Å; F104-D106 HydrophobicContact CZ-CB 4.41Å; D106-S108 WeakPolarHBondContact OD1-CB 3.46Å; D106-S108 PolarHBondContact OD1-N 3.15Å; D106-S108 PolarHBondContact OD1-OG 3.04Å; D106-L128 HydrophobicContact CB-CB 4.25Å; D106-L128 HydrophobicContact CB-CD1 4.2Å; D106-L128 WeakPolarHBondContact OD1-CB 3.34Å
107	L	97	Very high	95	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.209	C	C	.	.			trans	-117.4	17.7	177.5	-74.2	167.1	0	0	0	111	L84 V92 L105 N110 I112 L119 L128 L129 N132	L84-L107 HydrophobicContact CB-CD2 3.77Å; L84-L107 HydrophobicContact CD1-CD2 3.74Å; L84-L107 HydrophobicContact CG-CD2 4.43Å; V92-L107 HydrophobicContact CG2-CD1 3.89Å; L105-L107 HydrophobicContact CD1-CD1 4.21Å; L105-L107 HydrophobicContact CD1-CD2 4.49Å; L105-L107 HydrophobicContact CD1-CG 3.96Å; L105-L107 HydrophobicContact CD2-CD1 3.81Å; L105-L107 HydrophobicContact CD2-CG 4.42Å; L105-L107 HydrophobicContact CG-CD1 3.97Å; L105-L107 HydrophobicContact CG-CG 4.05Å; L107-N110 WeakPolarHBondContact O-CB 3.38Å; L107-N110 PolarHBondContact O-ND2 3.47Å; L107-I112 HydrophobicContact CB-CD1 3.85Å; L107-I112 HydrophobicContact CD1-CD1 4.01Å; L107-I112 HydrophobicContact CD2-CD1 4.09Å; L107-I112 HydrophobicContact CG-CD1 4.22Å; L107-L119 HydrophobicContact CD1-CD1 4.42Å; L107-L128 PolarHBondContact N-O 2.76Å; L107-L129 HydrophobicContact CB-CD2 3.72Å; L107-L129 HydrophobicContact CD1-CD2 3.99Å; L107-N132 PolarHBondContact O-ND2 2.86Å
108	S	97.1	Very high	95.1	Very high	7 Å²	7	38.9 Å²	38.9	5%	0.049	20%	0.201	C	C	.	.			trans	-60.9	153.6	-177.2	-54.6	0	0	0	0	112.2	Q85 G86 D106 N110 L128 K130	Q85-S108 CarbonylContact C-O 3.26Å; Q85-S108 WeakPolarHBondContact CA-O 3.07Å; Q85-S108 VanDerWaalsContact CB-O 3.28Å; Q85-S108 WeakPolarHBondContact CB-O 3.12Å; G86-S108 PolarHBondContact N-O 3.33Å; D106-S108 WeakPolarHBondContact OD1-CB 3.46Å; D106-S108 PolarHBondContact OD1-N 3.15Å; D106-S108 PolarHBondContact OD1-OG 3.04Å; S108-N110 PolarHBondContact O-N 3.12Å; S108-N110 PolarHBondContact O-ND2 3.25Å; S108-L128 WeakPolarHBondContact OG-CB 3.19Å; S108-K130 CarbonylContact C-O 3.06Å; S108-K130 WeakPolarHBondContact CA-O 3.38Å; S108-K130 PolarHBondContact OG-N 3.2Å
109	Y	96.9	Very high	95.2	Very high	103 Å²	103	36.6 Å²	36.6	40%	0.404	19%	0.185	S	C	.	.	S	Bend	trans	54.8	49.6	179.2	-55.4	-89.7	0	0	0	112.9	G86 N87 K130 S131	G86-Y109 WeakPolarHBondContact CA-O 3.3Å; G86-Y109 PolarHBondContact N-O 3.41Å; N87-Y109 PolarHBondContact N-O 3.31Å; N87-Y109 VanDerWaalsContact O-O 3.09Å; Y109-K130 HydrophobicContact CE2-CD 4.24Å; Y109-K130 PolarHBondContact N-O 2.95Å; Y109-K130 WeakPolarHBondContact OH-CE 3.5Å; Y109-K130 PolarHBondContact OH-NZ 3.33Å; Y109-S131 WeakPolarHBondContact CA-O 3.46Å
110	N	96.8	Very high	95.1	Very high	9 Å²	9	36.7 Å²	36.7	5%	0.048	19%	0.186	C	C	.	.	S	Bend	trans	-120.2	-166.5	171.9	-83.8	-78.3	0	0	0	109.8	L84 N87 C88 I89 L107 S108 I112 S131 N132	L84-N110 PolarHBondContact O-ND2 3.21Å; N87-N110 WeakPolarHBondContact CA-OD1 3.49Å; N87-N110 WeakPolarHBondContact CB-OD1 3.26Å; N87-N110 PolarHBondContact O-OD1 3.49Å; C88-N110 PolarHBondContact N-OD1 3.12Å; I89-N110 HydrophobicContact CB-CB 4.4Å; I89-N110 VanDerWaalsContact CB-OD1 3.31Å; I89-N110 WeakPolarHBondContact CB-OD1 3.42Å; I89-N110 WeakPolarHBondContact CG1-OD1 3.4Å; I89-N110 PolarHBondContact N-OD1 2.75Å; L107-N110 WeakPolarHBondContact O-CB 3.38Å; L107-N110 PolarHBondContact O-ND2 3.47Å; S108-N110 PolarHBondContact O-N 3.12Å; S108-N110 PolarHBondContact O-ND2 3.25Å; N110-I112 HydrophobicContact CB-CD1 4.18Å; N110-I112 HydrophobicContact CB-CG1 4.11Å; N110-S131 PolarHBondContact N-O 3.15Å; N110-N132 WeakPolarHBondContact CA-OD1 3.26Å; N110-N132 WeakPolarHBondContact CB-OD1 2.98Å; N110-N132 PolarHBondContact N-OD1 2.84Å; N110-N132 PolarHBondContact O-OD1 3.48Å
111	Q	95.6	Very high	95.1	Very high	53 Å²	53	30.6 Å²	30.6	25%	0.248	17%	0.172	C	C	.	.			trans	-118.9	27.6	-179.7	-59.8	-178.7	43.9	0	0	112	I89 K90 S113 N132	I89-Q111 CarbonylContact O-C 3.58Å; I89-Q111 WeakPolarHBondContact O-CA 3.48Å; I89-Q111 PolarHBondContact O-N 3.38Å; K90-Q111 HydrophobicContact CG-CB 4.09Å; Q111-S113 PolarHBondContact O-N 3.14Å; Q111-N132 PolarHBondContact N-OD1 3.15Å
112	I	96	Very high	95.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.			trans	-68.5	125	-174.3	-58.4	165.8	0	0	0	109.5	I89 K90 V92 L107 N110 I114 L115 L129 N132 R133 V134	I89-I112 HydrophobicContact CG2-CG1 4.47Å; I89-I112 PolarHBondContact O-N 3.03Å; K90-I112 WeakPolarHBondContact O-CA 3.42Å; V92-I112 HydrophobicContact CG2-CD1 3.82Å; V92-I112 HydrophobicContact CG2-CG1 4.37Å; V92-I112 HydrophobicContact CG2-CG2 4.49Å; L107-I112 HydrophobicContact CB-CD1 3.85Å; L107-I112 HydrophobicContact CD1-CD1 4.01Å; L107-I112 HydrophobicContact CD2-CD1 4.09Å; L107-I112 HydrophobicContact CG-CD1 4.22Å; N110-I112 HydrophobicContact CB-CD1 4.18Å; N110-I112 HydrophobicContact CB-CG1 4.11Å; I112-I114 WeakPolarHBondContact CG2-O 3.38Å; I112-L115 HydrophobicContact CG2-CD2 4.07Å; I112-L129 HydrophobicContact CD1-CD2 4.25Å; I112-N132 HydrophobicContact CB-CB 4.41Å; I112-N132 WeakPolarHBondContact CB-OD1 3.34Å; I112-N132 WeakPolarHBondContact CG1-OD1 3.37Å; I112-N132 PolarHBondContact N-OD1 3.02Å; I112-R133 CarbonylContact O-C 3.56Å; I112-R133 VanDerWaalsContact O-CA 3.31Å; I112-R133 WeakPolarHBondContact O-CA 3.35Å; I112-R133 PolarHBondContact O-N 3.33Å; I112-V134 HydrophobicContact CG2-CG2 4.41Å; I112-V134 PolarHBondContact O-N 3.04Å; I112-V134 VanDerWaalsContact O-N 3.17Å
113	S	93.5	Very high	95	Very high	50 Å²	50	31.1 Å²	31.1	35%	0.35	17%	0.174	S	C	.	.			trans	-100.5	-33.8	177.2	54	0	0	0	0	113.4	Q111 V134	Q111-S113 PolarHBondContact O-N 3.14Å; S113-V134 WeakPolarHBondContact O-CA 3.35Å
114	I	93.8	Very high	95	Very high	128 Å²	128	29.3 Å²	29.3	66%	0.656	16%	0.163	S	C	*	.			trans	-131.8	134.4	-175.7	-58.7	172.7	0	0	0	108.6	I112	I112-I114 WeakPolarHBondContact CG2-O 3.38Å
115	L	93.9	Very high	95	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.047	17%	0.171	C	C	.	.			trans	-95.6	129.3	172.1	-63.4	170.8	0	0	0	109.9	I112 L129 V134 L137 P138	I112-L115 HydrophobicContact CG2-CD2 4.07Å; L115-L129 HydrophobicContact CD1-CD1 3.52Å; L115-L129 HydrophobicContact CD2-CD1 3.79Å; L115-L129 HydrophobicContact CD2-CD2 3.76Å; L115-L129 HydrophobicContact CD2-CG 4.46Å; L115-L129 HydrophobicContact CG-CD1 4.28Å; L115-V134 HydrophobicContact CD1-CG1 4.24Å; L115-V134 HydrophobicContact CG-CG1 4.37Å; L115-V134 HydrophobicContact CG-CG2 4.42Å; L115-L137 HydrophobicContact CD1-CD2 3.65Å; L115-P138 HydrophobicContact CB-CG 4.29Å
116	P	93.8	Very high	95	Very high	16 Å²	16	31.9 Å²	31.9	10%	0.104	18%	0.177	C	C	.	.			trans	-71.7	143.9	177.6	31.3	-36.5	0	0	0	110.8	V92 N94 A118 L119	V92-P116 HydrophobicContact CB-CG 3.97Å; V92-P116 HydrophobicContact CG1-CG 3.95Å; V92-P116 WeakPolarHBondContact O-CG 3.22Å; N94-P116 WeakPolarHBondContact OD1-CB 3.42Å; P116-A118 HydrophobicContact CB-CB 4.31Å; P116-A118 PolarHBondContact O-N 2.98Å; P116-A118 VanDerWaalsContact O-N 3.1Å; P116-L119 HydrophobicContact CG-CB 4.2Å; P116-L119 WeakPolarHBondContact O-CB 3.34Å; P116-L119 PolarHBondContact O-N 2.89Å
117	A	93.3	Very high	95	Very high	38 Å²	38	31.1 Å²	31.1	31%	0.314	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-58.8	-24.3	173.2	0	0	0	0	0	112.8	L119 C120 E140	A117-L119 PolarHBondContact O-N 2.79Å; A117-C120 WeakPolarHBondContact O-CB 3.37Å; A117-C120 PolarHBondContact O-N 3.01Å; A117-C120 VanDerWaalsContact O-N 3.12Å; A117-E140 HydrophobicContact CB-CB 4.27Å; A117-E140 HydrophobicContact CB-CG 3.93Å
118	A	93.4	Very high	95.1	Very high	16 Å²	16	32.1 Å²	32.1	13%	0.132	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-60.4	-28.7	173.8	0	0	0	0	0	113.4	N94 I96 A97 P116 C120 T121	N94-A118 HydrophobicContact CB-CB 4.17Å; I96-A118 HydrophobicContact CG2-CB 4.46Å; A97-A118 HydrophobicContact CB-CB 4.06Å; P116-A118 HydrophobicContact CB-CB 4.31Å; P116-A118 PolarHBondContact O-N 2.98Å; P116-A118 VanDerWaalsContact O-N 3.1Å; A118-C120 PolarHBondContact O-N 2.69Å; A118-T121 PolarHBondContact O-N 2.9Å; A118-T121 PolarHBondContact O-OG1 2.98Å
119	L	94.1	Very high	95.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-66.5	-30.8	175.7	-175.1	145.3	0	0	0	111.2	V92 I96 L105 L107 P116 A117 T121 L122 L124 L127	V92-L119 HydrophobicContact CG1-CD1 4.49Å; I96-L119 HydrophobicContact CD1-CD1 4.32Å; I96-L119 HydrophobicContact CG2-CB 4.46Å; L105-L119 HydrophobicContact CD2-CD1 3.79Å; L105-L119 HydrophobicContact CD2-CG 4.43Å; L107-L119 HydrophobicContact CD1-CD1 4.42Å; P116-L119 HydrophobicContact CG-CB 4.2Å; P116-L119 WeakPolarHBondContact O-CB 3.34Å; P116-L119 PolarHBondContact O-N 2.89Å; A117-L119 PolarHBondContact O-N 2.79Å; L119-T121 PolarHBondContact O-N 3.45Å; L119-L122 PolarHBondContact O-N 3.09Å; L119-L124 HydrophobicContact CD2-CD1 3.81Å; L119-L124 HydrophobicContact CG-CD1 4.18Å; L119-L127 HydrophobicContact CD1-CD1 4.45Å; L119-L127 HydrophobicContact CD2-CD1 4.24Å; L119-L127 HydrophobicContact CD2-CD2 3.64Å
120	C	91.5	Very high	95	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.014	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-78.1	-2.4	-179	-53.5	0	0	0	0	114.1	A117 A118 E140 K143 L144	A117-C120 WeakPolarHBondContact O-CB 3.37Å; A117-C120 PolarHBondContact O-N 3.01Å; A117-C120 VanDerWaalsContact O-N 3.12Å; A118-C120 PolarHBondContact O-N 2.69Å; C120-E140 HydrophobicContact CB-CB 3.82Å; C120-E140 WeakPolarHBondContact CB-O 3.3Å; C120-K143 WeakPolarHBondContact O-CB 3.21Å; C120-L144 HydrophobicContact CB-CG 4.38Å; C120-L144 WeakPolarHBondContact O-CD2 3.39Å
121	T	92.5	Very high	95	Very high	80 Å²	80	30 Å²	30	49%	0.491	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-89.3	-10	173.8	63.2	0	0	0	0	113.1	A118 L119	A118-T121 PolarHBondContact O-N 2.9Å; A118-T121 PolarHBondContact O-OG1 2.98Å; L119-T121 PolarHBondContact O-N 3.45Å
122	L	93.8	Very high	95.1	Very high	4 Å²	4	28 Å²	28	2%	0.021	17%	0.165	C	C	.	.	S	Bend	trans	-80.5	148.6	-178.1	-61	-179.9	0	0	0	111.3	I96 L99 L102 L119 L124 L144	I96-L122 HydrophobicContact CD1-CD1 4.28Å; I96-L122 HydrophobicContact CG1-CD1 3.99Å; I96-L122 HydrophobicContact CG2-CD1 4.49Å; I96-L122 WeakPolarHBondContact O-CD2 3.34Å; L99-L122 HydrophobicContact CB-CD2 4.37Å; L99-L122 WeakPolarHBondContact O-CD2 3.4Å; L102-L122 HydrophobicContact CD2-CD1 4.06Å; L119-L122 PolarHBondContact O-N 3.09Å; L122-L124 HydrophobicContact CB-CD1 4.24Å; L122-L124 HydrophobicContact CB-CG 3.86Å; L122-L124 PolarHBondContact O-N 3.05Å; L122-L144 WeakPolarHBondContact O-CD2 3.23Å
123	P	94.1	Very high	95.1	Very high	45 Å²	45	33.1 Å²	33.1	29%	0.292	18%	0.184	S	C	.	.			trans	-80	49	177	35.9	-36.7	0	0	0	112.2	R100 L102 E125 T147	R100-P123 WeakPolarHBondContact O-CD 3.38Å; R100-P123 WeakPolarHBondContact O-CG 3.2Å; L102-P123 CarbonylContact O-C 3.56Å; P123-E125 PolarHBondContact O-N 3.1Å; P123-T147 HydrophobicContact CB-CG2 3.98Å
124	L	96.5	Very high	95.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.			trans	-63.1	127.6	-177.5	-68.6	169.4	0	0	0	110.5	L102 L105 L119 L122 L127 L144 T147 L148	L102-L124 HydrophobicContact CD2-CD2 4.1Å; L102-L124 HydrophobicContact CG-CD2 4.07Å; L105-L124 HydrophobicContact CB-CD2 3.76Å; L119-L124 HydrophobicContact CD2-CD1 3.81Å; L119-L124 HydrophobicContact CG-CD1 4.18Å; L122-L124 HydrophobicContact CB-CD1 4.24Å; L122-L124 HydrophobicContact CB-CG 3.86Å; L122-L124 PolarHBondContact O-N 3.05Å; L124-L127 HydrophobicContact CD1-CD1 4.33Å; L124-L144 HydrophobicContact CB-CD2 4.42Å; L124-T147 CarbonylContact O-C 3.38Å; L124-T147 VanDerWaalsContact O-C 3.23Å; L124-T147 VanDerWaalsContact O-CB 3.23Å; L124-T147 WeakPolarHBondContact O-CB 3.31Å; L124-T147 PolarHBondContact O-OG1 3.26Å; L124-L148 HydrophobicContact CB-CD1 4.03Å; L124-L148 WeakPolarHBondContact O-CA 3.42Å; L124-L148 PolarHBondContact O-N 3.22Å; L124-L148 VanDerWaalsContact O-N 3.12Å
125	E	97	Very high	95.1	Very high	73 Å²	73	30 Å²	30	34%	0.341	16%	0.161	S	C	.	.	S	Bend	trans	-92	-34	168.9	-65.1	-170.4	179.7	0	0	110.5	T103 P123 T149 E150 K427	T103-E125 HydrophobicContact CG2-CG 4.45Å; T103-E125 PolarHBondContact O-N 3.37Å; P123-E125 PolarHBondContact O-N 3.1Å; E125-T149 PolarHBondContact O-N 3.02Å; E125-T149 PolarHBondContact O-OG1 2.78Å; E125-E150 PolarHBondContact O-N 3.12Å; E125-K427 IonicContact OE1-NZ 3.55Å; E125-K427 PolarHBondContact OE1-NZ 3.01Å
126	V	97.5	Very high	95.1	Very high	20 Å²	20	32.9 Å²	32.9	12%	0.121	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	127.6	179.7	-177.6	0	0	0	0	110.5	T103 F104 L105 L128 E150	T103-V126 PolarHBondContact O-N 3.22Å; F104-V126 HydrophobicContact CD2-CB 3.61Å; F104-V126 HydrophobicContact CD2-CG1 3.83Å; F104-V126 HydrophobicContact CD2-CG2 3.99Å; F104-V126 HydrophobicContact CE2-CB 3.95Å; F104-V126 HydrophobicContact CE2-CG1 3.61Å; F104-V126 HydrophobicContact CE2-CG2 4.37Å; F104-V126 HydrophobicContact CG-CB 4.39Å; F104-V126 HydrophobicContact CZ-CG1 4.37Å; L105-V126 PolarHBondContact N-O 2.81Å; L105-V126 VanDerWaalsContact N-O 3.09Å; V126-L128 HydrophobicContact CG1-CD1 4.47Å; V126-L128 HydrophobicContact CG1-CD2 3.91Å; V126-L128 HydrophobicContact CG1-CG 3.95Å; V126-E150 HydrophobicContact CG1-CB 4.13Å; V126-E150 HydrophobicContact CG1-CG 4.18Å; V126-E150 HydrophobicContact CG2-CB 4.2Å
127	L	97.6	Very high	95.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	115.2	175	177.4	61	0	0	0	110.3	L105 L119 L124 L129 L148 E150 L151 D152	L105-L127 HydrophobicContact CB-CD1 4.24Å; L105-L127 HydrophobicContact CD2-CD1 3.99Å; L105-L127 HydrophobicContact CG-CD1 4.16Å; L119-L127 HydrophobicContact CD1-CD1 4.45Å; L119-L127 HydrophobicContact CD2-CD1 4.24Å; L119-L127 HydrophobicContact CD2-CD2 3.64Å; L124-L127 HydrophobicContact CD1-CD1 4.33Å; L127-L129 HydrophobicContact CD1-CD1 4.14Å; L127-L129 HydrophobicContact CD1-CG 4.11Å; L127-L129 HydrophobicContact CD2-CD1 3.87Å; L127-L129 HydrophobicContact CG-CD1 3.89Å; L127-L129 HydrophobicContact CG-CG 4.18Å; L127-L148 HydrophobicContact CB-CD1 3.96Å; L127-E150 PolarHBondContact N-O 3.36Å; L127-L151 HydrophobicContact CB-CD1 4.04Å; L127-L151 HydrophobicContact CD2-CD1 3.82Å; L127-L151 HydrophobicContact CG-CD1 4Å; L127-L151 WeakPolarHBondContact O-CA 3.46Å; L127-D152 PolarHBondContact O-N 3.13Å
128	L	97.7	Very high	95.1	Very high	21 Å²	21	31.7 Å²	31.7	11%	0.11	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.4	179	-50.4	177.9	0	0	0	110.1	F104 L105 D106 L107 S108 V126 E150 D152	F104-L128 HydrophobicContact CZ-CD1 3.87Å; L105-L128 PolarHBondContact O-N 3.14Å; D106-L128 HydrophobicContact CB-CB 4.25Å; D106-L128 HydrophobicContact CB-CD1 4.2Å; D106-L128 WeakPolarHBondContact OD1-CB 3.34Å; L107-L128 PolarHBondContact N-O 2.76Å; S108-L128 WeakPolarHBondContact OG-CB 3.19Å; V126-L128 HydrophobicContact CG1-CD1 4.47Å; V126-L128 HydrophobicContact CG1-CD2 3.91Å; V126-L128 HydrophobicContact CG1-CG 3.95Å; L128-E150 HydrophobicContact CD2-CG 4.42Å; L128-D152 HydrophobicContact CD2-CB 3.65Å
129	L	97	Very high	94.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.184	C	C	.	.			trans	-135.6	19.2	-175.1	-74.9	165.6	0	0	0	111.3	L107 I112 L115 L127 N132 D152 V153 N156	L107-L129 HydrophobicContact CB-CD2 3.72Å; L107-L129 HydrophobicContact CD1-CD2 3.99Å; I112-L129 HydrophobicContact CD1-CD2 4.25Å; L115-L129 HydrophobicContact CD1-CD1 3.52Å; L115-L129 HydrophobicContact CD2-CD1 3.79Å; L115-L129 HydrophobicContact CD2-CD2 3.76Å; L115-L129 HydrophobicContact CD2-CG 4.46Å; L115-L129 HydrophobicContact CG-CD1 4.28Å; L127-L129 HydrophobicContact CD1-CD1 4.14Å; L127-L129 HydrophobicContact CD1-CG 4.11Å; L127-L129 HydrophobicContact CD2-CD1 3.87Å; L127-L129 HydrophobicContact CG-CD1 3.89Å; L127-L129 HydrophobicContact CG-CG 4.18Å; L129-N132 PolarHBondContact O-ND2 2.93Å; L129-D152 CarbonylContact C-O 3.53Å; L129-D152 WeakPolarHBondContact CA-O 3.43Å; L129-D152 WeakPolarHBondContact CB-O 3.4Å; L129-D152 PolarHBondContact N-O 2.83Å; L129-V153 HydrophobicContact CB-CG1 3.97Å; L129-V153 HydrophobicContact CD1-CG1 3.97Å; L129-N156 PolarHBondContact O-ND2 3.21Å
130	K	96.4	Very high	94.9	Very high	42 Å²	42	36.7 Å²	36.7	18%	0.183	20%	0.198	C	C	.	.			trans	-52.7	143.6	-179.6	170.4	176.9	-176.7	-164	0	111.4	S108 Y109 N132 S154	S108-K130 CarbonylContact C-O 3.06Å; S108-K130 WeakPolarHBondContact CA-O 3.38Å; S108-K130 PolarHBondContact OG-N 3.2Å; Y109-K130 HydrophobicContact CE2-CD 4.24Å; Y109-K130 PolarHBondContact N-O 2.95Å; Y109-K130 WeakPolarHBondContact OH-CE 3.5Å; Y109-K130 PolarHBondContact OH-NZ 3.33Å; K130-N132 PolarHBondContact O-N 3.01Å; K130-N132 PolarHBondContact O-ND2 2.84Å; K130-S154 CarbonylContact C-O 3.56Å; K130-S154 VanDerWaalsContact CA-O 3.27Å; K130-S154 WeakPolarHBondContact CA-O 3.32Å; K130-S154 VanDerWaalsContact CG-OG 3.31Å; K130-S154 WeakPolarHBondContact CG-OG 3.44Å
131	S	96.7	Very high	94.9	Very high	32 Å²	32	36.6 Å²	36.6	22%	0.224	20%	0.197	C	C	.	.	S	Bend	trans	55.9	53	174.5	-60.6	0	0	0	0	113.1	Y109 N110 S154 C155	Y109-S131 WeakPolarHBondContact CA-O 3.46Å; N110-S131 PolarHBondContact N-O 3.15Å; S131-S154 PolarHBondContact N-O 3.18Å; S131-C155 WeakPolarHBondContact CA-O 3.47Å
132	N	96.8	Very high	94.7	Very high	10 Å²	10	33.6 Å²	33.6	5%	0.053	18%	0.182	C	C	.	.	S	Bend	trans	-116.4	-163.4	171	-86	-79	0	0	0	110	L107 N110 Q111 I112 L129 K130 V134 N156	L107-N132 PolarHBondContact O-ND2 2.86Å; N110-N132 WeakPolarHBondContact CA-OD1 3.26Å; N110-N132 WeakPolarHBondContact CB-OD1 2.98Å; N110-N132 PolarHBondContact N-OD1 2.84Å; N110-N132 PolarHBondContact O-OD1 3.48Å; Q111-N132 PolarHBondContact N-OD1 3.15Å; I112-N132 HydrophobicContact CB-CB 4.41Å; I112-N132 WeakPolarHBondContact CB-OD1 3.34Å; I112-N132 WeakPolarHBondContact CG1-OD1 3.37Å; I112-N132 PolarHBondContact N-OD1 3.02Å; L129-N132 PolarHBondContact O-ND2 2.93Å; K130-N132 PolarHBondContact O-N 3.01Å; K130-N132 PolarHBondContact O-ND2 2.84Å; N132-V134 HydrophobicContact CB-CG2 4.05Å; N132-N156 VanDerWaalsContact CA-OD1 3.25Å; N132-N156 WeakPolarHBondContact CA-OD1 3.34Å; N132-N156 WeakPolarHBondContact CB-OD1 3.44Å; N132-N156 PolarHBondContact N-OD1 3.01Å; N132-N156 PolarHBondContact O-OD1 3.17Å
133	R	95.5	Very high	94.7	Very high	109 Å²	109	39.8 Å²	39.8	41%	0.411	21%	0.209	S	C	.	.			trans	-118.8	27.3	177.2	-59.8	179.7	-176	161.6	5.6	111.6	I112 E135 N156	I112-R133 CarbonylContact O-C 3.56Å; I112-R133 VanDerWaalsContact O-CA 3.31Å; I112-R133 WeakPolarHBondContact O-CA 3.35Å; I112-R133 PolarHBondContact O-N 3.33Å; R133-E135 PolarHBondContact O-N 3.31Å; R133-N156 PolarHBondContact N-OD1 3.15Å
134	V	95.7	Very high	94.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.			trans	-66.7	122.4	-174.8	-176.3	0	0	0	0	109.7	I112 S113 L115 N132 S136 L137 N156 R157 L158	I112-V134 HydrophobicContact CG2-CG2 4.41Å; I112-V134 PolarHBondContact O-N 3.04Å; I112-V134 VanDerWaalsContact O-N 3.17Å; S113-V134 WeakPolarHBondContact O-CA 3.35Å; L115-V134 HydrophobicContact CD1-CG1 4.24Å; L115-V134 HydrophobicContact CG-CG1 4.37Å; L115-V134 HydrophobicContact CG-CG2 4.42Å; N132-V134 HydrophobicContact CB-CG2 4.05Å; V134-S136 VanDerWaalsContact CG1-O 3.24Å; V134-S136 WeakPolarHBondContact CG1-O 3.15Å; V134-L137 HydrophobicContact CG1-CD2 4.28Å; V134-N156 HydrophobicContact CB-CB 4.37Å; V134-N156 WeakPolarHBondContact CB-OD1 3.48Å; V134-N156 WeakPolarHBondContact CG2-OD1 3.45Å; V134-N156 PolarHBondContact N-OD1 3.32Å; V134-R157 CarbonylContact O-C 3.4Å; V134-R157 VanDerWaalsContact O-C 3.26Å; V134-R157 WeakPolarHBondContact O-CA 3.32Å; V134-R157 PolarHBondContact O-N 3.43Å; V134-L158 HydrophobicContact CG1-CD2 3.91Å; V134-L158 PolarHBondContact O-N 3Å
135	E	93.1	Very high	94.3	Very high	112 Å²	112	38.7 Å²	38.7	52%	0.523	20%	0.204	S	C	.	.			trans	-94.1	-29.1	-177.9	-63.6	-175.4	176.3	0	0	113	R133 R157 L158 S159	R133-E135 PolarHBondContact O-N 3.31Å; E135-R157 HydrophobicContact CG-CB 4.32Å; E135-L158 WeakPolarHBondContact O-CA 3.43Å; E135-S159 PolarHBondContact O-N 3.38Å
136	S	93	Very high	94	Very high	70 Å²	70	37.1 Å²	37.1	49%	0.49	21%	0.207	S	C	.	.			trans	-151.1	153.5	176.3	58.5	0	0	0	0	110.9	V134	V134-S136 VanDerWaalsContact CG1-O 3.24Å; V134-S136 WeakPolarHBondContact CG1-O 3.15Å
137	L	93.5	Very high	93.8	Very high	9 Å²	9	38 Å²	38	5%	0.047	21%	0.213	C	C	.	.			trans	-92.6	142.3	170.1	-61.7	177.3	0	0	0	109.6	L115 V134 L151 V153 L158 L161 P162	L115-L137 HydrophobicContact CD1-CD2 3.65Å; V134-L137 HydrophobicContact CG1-CD2 4.28Å; L137-L151 HydrophobicContact CD1-CD2 4.43Å; L137-V153 HydrophobicContact CD2-CG1 4.11Å; L137-L158 HydrophobicContact CD2-CD2 4.36Å; L137-L158 HydrophobicContact CG-CD1 4.45Å; L137-L158 HydrophobicContact CG-CD2 4.07Å; L137-L161 HydrophobicContact CD1-CD2 4.06Å; L137-P162 HydrophobicContact CB-CG 4Å
138	P	93.1	Very high	93.8	Very high	20 Å²	20	38 Å²	38	13%	0.13	21%	0.213	C	C	.	.			trans	-65.3	145.3	177.3	27.5	-34.5	0	0	0	110.9	L115 E140 I141	L115-P138 HydrophobicContact CB-CG 4.29Å; P138-E140 PolarHBondContact O-N 2.9Å; P138-I141 WeakPolarHBondContact O-CB 3.29Å; P138-I141 VanDerWaalsContact O-CG2 3.29Å; P138-I141 WeakPolarHBondContact O-CG2 3.3Å; P138-I141 PolarHBondContact O-N 3.45Å
139	S	89.8	Confident	93.7	Very high	59 Å²	59	39.3 Å²	39.3	41%	0.413	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-57.7	-30.1	176.3	63.3	0	0	0	0	112.4	I141 G142 E164	S139-I141 PolarHBondContact O-N 3.18Å; S139-I141 VanDerWaalsContact O-N 3.07Å; S139-G142 PolarHBondContact O-N 3.25Å; S139-E164 WeakPolarHBondContact O-CB 3.17Å; S139-E164 WeakPolarHBondContact O-CG 3.43Å
140	E	93.2	Very high	93.7	Very high	62 Å²	62	41.6 Å²	41.6	29%	0.29	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-65	-10.7	178.4	-67.8	84.8	165.7	0	0	113.3	A117 C120 P138 G142 K143	A117-E140 HydrophobicContact CB-CB 4.27Å; A117-E140 HydrophobicContact CB-CG 3.93Å; C120-E140 HydrophobicContact CB-CB 3.82Å; C120-E140 WeakPolarHBondContact CB-O 3.3Å; P138-E140 PolarHBondContact O-N 2.9Å; E140-G142 PolarHBondContact O-N 3.37Å; E140-K143 HydrophobicContact CB-CD 4.17Å; E140-K143 HydrophobicContact CG-CD 4.41Å; E140-K143 VanDerWaalsContact O-CB 3.23Å; E140-K143 WeakPolarHBondContact O-CB 3.5Å; E140-K143 WeakPolarHBondContact O-CG 3.48Å; E140-K143 PolarHBondContact O-N 3.02Å
141	I	92.8	Very high	93.8	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-51.7	-31.5	173.5	-162.2	73.9	0	0	0	111.5	P138 S139 K143 L144 P162 L168	P138-I141 WeakPolarHBondContact O-CB 3.29Å; P138-I141 VanDerWaalsContact O-CG2 3.29Å; P138-I141 WeakPolarHBondContact O-CG2 3.3Å; P138-I141 PolarHBondContact O-N 3.45Å; S139-I141 PolarHBondContact O-N 3.18Å; S139-I141 VanDerWaalsContact O-N 3.07Å; I141-K143 PolarHBondContact O-N 3.42Å; I141-K143 VanDerWaalsContact O-N 3.13Å; I141-L144 HydrophobicContact CD1-CD1 3.66Å; I141-L144 HydrophobicContact CG1-CD1 4.46Å; I141-L144 WeakPolarHBondContact O-CB 3.26Å; I141-L144 PolarHBondContact O-N 3.29Å; I141-P162 HydrophobicContact CG2-CG 3.92Å; I141-L168 HydrophobicContact CG1-CD1 4.36Å; I141-L168 WeakPolarHBondContact O-CD2 3.44Å
142	G	88.7	Confident	93.8	Very high	16 Å²	16	39.2 Å²	39.2	17%	0.165	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-58.9	-21.7	174.6	0	0	0	0	0	114.7	S139 E140 L144 A145	S139-G142 PolarHBondContact O-N 3.25Å; E140-G142 PolarHBondContact O-N 3.37Å; G142-L144 PolarHBondContact O-N 2.83Å; G142-A145 WeakPolarHBondContact O-CB 3.3Å; G142-A145 PolarHBondContact O-N 3.46Å; G142-A145 VanDerWaalsContact O-N 3.15Å
143	K	92.2	Very high	93.8	Very high	134 Å²	134	38.8 Å²	38.8	58%	0.583	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-65.2	-25.2	174.7	-66	178	-177.6	170.4	0	112.6	C120 E140 I141 A145	C120-K143 WeakPolarHBondContact O-CB 3.21Å; E140-K143 HydrophobicContact CB-CD 4.17Å; E140-K143 HydrophobicContact CG-CD 4.41Å; E140-K143 VanDerWaalsContact O-CB 3.23Å; E140-K143 WeakPolarHBondContact O-CB 3.5Å; E140-K143 WeakPolarHBondContact O-CG 3.48Å; E140-K143 PolarHBondContact O-N 3.02Å; I141-K143 PolarHBondContact O-N 3.42Å; I141-K143 VanDerWaalsContact O-N 3.13Å; K143-A145 PolarHBondContact O-N 2.89Å
144	L	93.2	Very high	93.8	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-76.3	4.6	176.1	-58.3	177.1	0	0	0	113.2	C120 L122 L124 I141 G142 G146 T147 L148 L168	C120-L144 HydrophobicContact CB-CG 4.38Å; C120-L144 WeakPolarHBondContact O-CD2 3.39Å; L122-L144 WeakPolarHBondContact O-CD2 3.23Å; L124-L144 HydrophobicContact CB-CD2 4.42Å; I141-L144 HydrophobicContact CD1-CD1 3.66Å; I141-L144 HydrophobicContact CG1-CD1 4.46Å; I141-L144 WeakPolarHBondContact O-CB 3.26Å; I141-L144 PolarHBondContact O-N 3.29Å; G142-L144 PolarHBondContact O-N 2.83Å; L144-G146 PolarHBondContact O-N 3.12Å; L144-T147 PolarHBondContact O-N 3.17Å; L144-L148 HydrophobicContact CB-CB 3.93Å; L144-L148 HydrophobicContact CB-CD2 4.4Å; L144-L148 HydrophobicContact CD1-CD1 4.48Å; L144-L148 HydrophobicContact CD1-CD2 4.05Å; L144-L148 PolarHBondContact O-N 3.17Å; L144-L168 HydrophobicContact CB-CD2 3.99Å
145	A	89.9	Confident	93.8	Very high	22 Å²	22	35 Å²	35	18%	0.182	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-54	-28.2	-177.4	0	0	0	0	0	115.1	G142 K143 A167 S169	G142-A145 WeakPolarHBondContact O-CB 3.3Å; G142-A145 PolarHBondContact O-N 3.46Å; G142-A145 VanDerWaalsContact O-N 3.15Å; K143-A145 PolarHBondContact O-N 2.89Å; A145-A167 HydrophobicContact CB-CB 4.36Å; A145-A167 WeakPolarHBondContact CB-O 3.38Å; A145-S169 PolarHBondContact O-OG 3.1Å
146	G	90.4	Very high	93.9	Very high	40 Å²	40	30.1 Å²	30.1	41%	0.412	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-82.6	-13.9	-179.4	0	0	0	0	0	114.9	L144 K170	L144-G146 PolarHBondContact O-N 3.12Å; G146-K170 VanDerWaalsContact O-CD 3.22Å; G146-K170 WeakPolarHBondContact O-CD 3.45Å; G146-K170 WeakPolarHBondContact O-CE 3.11Å; G146-K170 PolarHBondContact O-NZ 3.36Å
147	T	94.6	Very high	94	Very high	39 Å²	39	33.4 Å²	33.4	24%	0.239	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.2	-39.9	-169.4	57.2	0	0	0	0	113.9	P123 L124 L144 T149	P123-T147 HydrophobicContact CB-CG2 3.98Å; L124-T147 CarbonylContact O-C 3.38Å; L124-T147 VanDerWaalsContact O-C 3.23Å; L124-T147 VanDerWaalsContact O-CB 3.23Å; L124-T147 WeakPolarHBondContact O-CB 3.31Å; L124-T147 PolarHBondContact O-OG1 3.26Å; L144-T147 PolarHBondContact O-N 3.17Å; T147-T149 WeakPolarHBondContact O-CG2 3.08Å; T147-T149 PolarHBondContact O-N 3.33Å
148	L	96.6	Very high	94	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.			trans	-69.7	126.7	-167.9	-162.2	71.8	0	0	0	112.3	L124 L127 L144 L151 L168 K170 L171	L124-L148 HydrophobicContact CB-CD1 4.03Å; L124-L148 WeakPolarHBondContact O-CA 3.42Å; L124-L148 PolarHBondContact O-N 3.22Å; L124-L148 VanDerWaalsContact O-N 3.12Å; L127-L148 HydrophobicContact CB-CD1 3.96Å; L144-L148 HydrophobicContact CB-CB 3.93Å; L144-L148 HydrophobicContact CB-CD2 4.4Å; L144-L148 HydrophobicContact CD1-CD1 4.48Å; L144-L148 HydrophobicContact CD1-CD2 4.05Å; L144-L148 PolarHBondContact O-N 3.17Å; L148-L151 HydrophobicContact CD2-CB 4.16Å; L148-L168 HydrophobicContact CD2-CD1 4.22Å; L148-K170 CarbonylContact O-C 3.48Å; L148-K170 WeakPolarHBondContact O-CB 3.2Å; L148-L171 HydrophobicContact CD2-CD1 4.19Å; L148-L171 HydrophobicContact CG-CD1 4.15Å; L148-L171 WeakPolarHBondContact O-CA 3.42Å; L148-L171 PolarHBondContact O-N 3.41Å; L148-L171 VanDerWaalsContact O-N 3.09Å
149	T	96.3	Very high	93.9	Very high	48 Å²	48	34.9 Å²	34.9	29%	0.294	20%	0.197	S	C	.	.			trans	-114.4	-29.3	-178.3	65.7	0	0	0	0	112.6	E125 T147 R172 V173	E125-T149 PolarHBondContact O-N 3.02Å; E125-T149 PolarHBondContact O-OG1 2.78Å; T147-T149 WeakPolarHBondContact O-CG2 3.08Å; T147-T149 PolarHBondContact O-N 3.33Å; T149-R172 PolarHBondContact O-N 3.47Å; T149-V173 PolarHBondContact O-N 2.8Å; T149-V173 VanDerWaalsContact O-N 3.08Å
150	E	97.1	Very high	93.8	Very high	48 Å²	48	34.1 Å²	34.1	22%	0.224	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	127.6	-178	179.3	166.5	173.1	0	0	110.6	E125 V126 L127 L128 V173	E125-E150 PolarHBondContact O-N 3.12Å; V126-E150 HydrophobicContact CG1-CB 4.13Å; V126-E150 HydrophobicContact CG1-CG 4.18Å; V126-E150 HydrophobicContact CG2-CB 4.2Å; L127-E150 PolarHBondContact N-O 3.36Å; L128-E150 HydrophobicContact CD2-CG 4.42Å; E150-V173 WeakPolarHBondContact CA-O 3.44Å; E150-V173 HydrophobicContact CB-CB 4.21Å; E150-V173 HydrophobicContact CG-CB 3.93Å; E150-V173 HydrophobicContact CG-CG1 4.08Å
151	L	96.9	Very high	93.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	114.8	176.3	179	61.1	0	0	0	109.2	L127 L137 L148 V153 L171 V173 L174 N175	L127-L151 HydrophobicContact CB-CD1 4.04Å; L127-L151 HydrophobicContact CD2-CD1 3.82Å; L127-L151 HydrophobicContact CG-CD1 4Å; L127-L151 WeakPolarHBondContact O-CA 3.46Å; L137-L151 HydrophobicContact CD1-CD2 4.43Å; L148-L151 HydrophobicContact CD2-CB 4.16Å; L151-V153 HydrophobicContact CD1-CG1 3.83Å; L151-V153 HydrophobicContact CG-CG1 4.16Å; L151-L171 HydrophobicContact CB-CD1 3.9Å; L151-V173 PolarHBondContact N-O 3.04Å; L151-L174 HydrophobicContact CB-CD1 4.1Å; L151-L174 HydrophobicContact CD2-CD1 3.93Å; L151-L174 HydrophobicContact CG-CD1 4.12Å; L151-L174 WeakPolarHBondContact O-CA 3.29Å; L151-N175 PolarHBondContact O-N 3.07Å
152	D	97.1	Very high	93.4	Very high	24 Å²	24	32.6 Å²	32.6	13%	0.128	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.1	171.1	-168.8	-19.2	0	0	0	110	L127 L128 L129 S154 N175	L127-D152 PolarHBondContact O-N 3.13Å; L128-D152 HydrophobicContact CD2-CB 3.65Å; L129-D152 CarbonylContact C-O 3.53Å; L129-D152 WeakPolarHBondContact CA-O 3.43Å; L129-D152 WeakPolarHBondContact CB-O 3.4Å; L129-D152 PolarHBondContact N-O 2.83Å; D152-S154 WeakPolarHBondContact OD1-CB 3.38Å; D152-S154 PolarHBondContact OD1-N 3Å; D152-S154 PolarHBondContact OD1-OG 2.88Å; D152-N175 HydrophobicContact CB-CB 4.17Å; D152-N175 PolarHBondContact OD1-ND2 2.85Å; D152-N175 PolarHBondContact OD2-ND2 3.04Å; D152-N175 VanDerWaalsContact OD2-ND2 3.15Å
153	V	96.2	Very high	93.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.198	C	C	.	.			trans	-126.5	30.6	173.2	-64.4	0	0	0	0	109.8	L129 L137 L151 N156 L158 N175 L176 N179	L129-V153 HydrophobicContact CB-CG1 3.97Å; L129-V153 HydrophobicContact CD1-CG1 3.97Å; L137-V153 HydrophobicContact CD2-CG1 4.11Å; L151-V153 HydrophobicContact CD1-CG1 3.83Å; L151-V153 HydrophobicContact CG-CG1 4.16Å; V153-N156 WeakPolarHBondContact O-CB 3.06Å; V153-N156 PolarHBondContact O-ND2 2.96Å; V153-L158 HydrophobicContact CB-CD1 3.96Å; V153-L158 HydrophobicContact CG2-CD1 3.48Å; V153-L158 VanDerWaalsContact CG2-CD1 3.48Å; V153-N175 CarbonylContact C-O 3.34Å; V153-N175 WeakPolarHBondContact CG2-O 3.12Å; V153-N175 PolarHBondContact N-O 2.61Å; V153-L176 HydrophobicContact CG2-CD2 3.38Å; V153-N179 PolarHBondContact O-ND2 3.38Å
154	S	95.8	Very high	93.1	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	19%	0.187	C	C	.	.			trans	-64.3	157.9	177.2	59.7	0	0	0	0	112.6	K130 S131 D152 N156 N175 R177	K130-S154 CarbonylContact C-O 3.56Å; K130-S154 VanDerWaalsContact CA-O 3.27Å; K130-S154 WeakPolarHBondContact CA-O 3.32Å; K130-S154 VanDerWaalsContact CG-OG 3.31Å; K130-S154 WeakPolarHBondContact CG-OG 3.44Å; S131-S154 PolarHBondContact N-O 3.18Å; D152-S154 WeakPolarHBondContact OD1-CB 3.38Å; D152-S154 PolarHBondContact OD1-N 3Å; D152-S154 PolarHBondContact OD1-OG 2.88Å; S154-N156 VanDerWaalsContact C-N 3.3Å; S154-N156 PolarHBondContact O-N 2.88Å; S154-N156 PolarHBondContact O-ND2 3.46Å; S154-N175 WeakPolarHBondContact CB-OD1 3.33Å; S154-N175 PolarHBondContact N-O 2.79Å; S154-R177 CarbonylContact C-O 3.51Å; S154-R177 WeakPolarHBondContact CA-O 3.5Å; S154-R177 WeakPolarHBondContact CB-O 3.29Å
155	C	96.2	Very high	92.9	Very high	28 Å²	28	31.7 Å²	31.7	19%	0.189	19%	0.186	C	C	.	.	S	Bend	trans	54.5	43.7	179.9	-55.9	0	0	0	0	112.9	S131 R177 Q178	S131-C155 WeakPolarHBondContact CA-O 3.47Å; C155-R177 PolarHBondContact N-O 3.29Å; C155-Q178 CarbonylContact C-O 3.41Å; C155-Q178 VanDerWaalsContact CA-O 3.22Å; C155-Q178 WeakPolarHBondContact CA-O 3.33Å; C155-Q178 PolarHBondContact N-O 3.31Å; C155-Q178 PolarHBondContact SG-OE1 2.66Å
156	N	96.1	Very high	92.7	Very high	11 Å²	11	31 Å²	31	6%	0.059	18%	0.182	C	C	.	.	S	Bend	trans	-116	-164.8	176.2	-84.5	-79.1	0	0	0	110.5	L129 N132 R133 V134 V153 S154 L158 Q178 N179	L129-N156 PolarHBondContact O-ND2 3.21Å; N132-N156 VanDerWaalsContact CA-OD1 3.25Å; N132-N156 WeakPolarHBondContact CA-OD1 3.34Å; N132-N156 WeakPolarHBondContact CB-OD1 3.44Å; N132-N156 PolarHBondContact N-OD1 3.01Å; N132-N156 PolarHBondContact O-OD1 3.17Å; R133-N156 PolarHBondContact N-OD1 3.15Å; V134-N156 HydrophobicContact CB-CB 4.37Å; V134-N156 WeakPolarHBondContact CB-OD1 3.48Å; V134-N156 WeakPolarHBondContact CG2-OD1 3.45Å; V134-N156 PolarHBondContact N-OD1 3.32Å; V153-N156 WeakPolarHBondContact O-CB 3.06Å; V153-N156 PolarHBondContact O-ND2 2.96Å; S154-N156 VanDerWaalsContact C-N 3.3Å; S154-N156 PolarHBondContact O-N 2.88Å; S154-N156 PolarHBondContact O-ND2 3.46Å; N156-L158 HydrophobicContact CB-CG 4.37Å; N156-Q178 PolarHBondContact N-O 2.88Å; N156-N179 VanDerWaalsContact CA-OD1 3.3Å; N156-N179 WeakPolarHBondContact CA-OD1 2.95Å; N156-N179 WeakPolarHBondContact CB-OD1 3.16Å; N156-N179 PolarHBondContact N-OD1 3.12Å; N156-N179 PolarHBondContact O-OD1 2.9Å
157	R	94.2	Very high	92.6	Very high	138 Å²	138	31.6 Å²	31.6	52%	0.521	18%	0.183	S	C	.	.			trans	-118.6	28.7	-179.4	-60.4	179.2	-178.6	-174.6	-2.6	111.6	V134 E135 S159 N179 V180	V134-R157 CarbonylContact O-C 3.4Å; V134-R157 VanDerWaalsContact O-C 3.26Å; V134-R157 WeakPolarHBondContact O-CA 3.32Å; V134-R157 PolarHBondContact O-N 3.43Å; E135-R157 HydrophobicContact CG-CB 4.32Å; R157-S159 PolarHBondContact O-N 2.96Å; R157-N179 PolarHBondContact N-OD1 3.2Å; R157-V180 WeakPolarHBondContact O-CG2 3.19Å
158	L	93.9	Very high	92.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.171	C	C	.	.			trans	-62.3	120.3	-178.1	-64	173.4	0	0	0	110	V134 E135 L137 V153 N156 L161 L176 N179 V180 L181	V134-L158 HydrophobicContact CG1-CD2 3.91Å; V134-L158 PolarHBondContact O-N 3Å; E135-L158 WeakPolarHBondContact O-CA 3.43Å; L137-L158 HydrophobicContact CD2-CD2 4.36Å; L137-L158 HydrophobicContact CG-CD1 4.45Å; L137-L158 HydrophobicContact CG-CD2 4.07Å; V153-L158 HydrophobicContact CB-CD1 3.96Å; V153-L158 HydrophobicContact CG2-CD1 3.48Å; V153-L158 VanDerWaalsContact CG2-CD1 3.48Å; N156-L158 HydrophobicContact CB-CG 4.37Å; L158-L161 HydrophobicContact CD1-CD2 4.27Å; L158-L176 HydrophobicContact CD1-CD2 4.27Å; L158-N179 HydrophobicContact CB-CB 4.13Å; L158-N179 VanDerWaalsContact CB-OD1 3.27Å; L158-N179 WeakPolarHBondContact CB-OD1 3.41Å; L158-N179 WeakPolarHBondContact CG-OD1 3.34Å; L158-N179 PolarHBondContact N-OD1 3Å; L158-V180 CarbonylContact O-C 3.49Å; L158-V180 VanDerWaalsContact O-C 3.22Å; L158-V180 WeakPolarHBondContact O-CA 3.47Å; L158-V180 VanDerWaalsContact O-CG2 3.24Å; L158-V180 WeakPolarHBondContact O-CG2 3.31Å; L158-V180 PolarHBondContact O-N 3.09Å; L158-L181 HydrophobicContact CB-CD2 4Å; L158-L181 PolarHBondContact O-N 3Å
159	S	90.2	Very high	92.1	Very high	60 Å²	60	32.9 Å²	32.9	42%	0.42	19%	0.193	S	C	.	.			trans	-92.7	-27.2	176.7	57.8	0	0	0	0	112.8	E135 R157	E135-S159 PolarHBondContact O-N 3.38Å; R157-S159 PolarHBondContact O-N 2.96Å
160	S	88.4	Confident	91.9	Very high	43 Å²	43	35.5 Å²	35.5	30%	0.301	20%	0.201	S	C	.	.			trans	-152.4	165.4	176.9	58.7	0	0	0	0	110.1
161	L	89.6	Confident	91.8	Very high	11 Å²	11	33.2 Å²	33.2	6%	0.058	19%	0.19	C	C	.	.			trans	-112.2	140.7	171	-60.7	169.8	0	0	0	109.4	L137 L158 I165 L176 L181 L184 P185 F206	L137-L161 HydrophobicContact CD1-CD2 4.06Å; L158-L161 HydrophobicContact CD1-CD2 4.27Å; L161-I165 HydrophobicContact CD1-CD1 4.18Å; L161-I165 HydrophobicContact CD2-CD1 4.27Å; L161-L176 HydrophobicContact CD1-CD1 3.58Å; L161-L176 HydrophobicContact CD1-CD2 4.36Å; L161-L176 HydrophobicContact CD2-CD2 3.83Å; L161-L181 HydrophobicContact CD1-CD1 4.31Å; L161-L181 HydrophobicContact CD2-CD2 4.39Å; L161-L181 HydrophobicContact CG-CD1 4.37Å; L161-L181 HydrophobicContact CG-CD2 4.04Å; L161-L184 HydrophobicContact CD1-CD2 4.02Å; L161-P185 HydrophobicContact CB-CG 4.02Å; L161-F206 HydrophobicContact CD1-CE2 4.27Å
162	P	88.7	Confident	91.7	Very high	21 Å²	21	37.3 Å²	37.3	14%	0.136	21%	0.205	C	C	.	.			trans	-64.2	147.3	173.9	28	-34.3	0	0	0	110.7	L137 I141 E164 I165	L137-P162 HydrophobicContact CB-CG 4Å; I141-P162 HydrophobicContact CG2-CG 3.92Å; P162-E164 WeakPolarHBondContact CB-OE2 3.45Å; P162-E164 PolarHBondContact O-N 2.88Å; P162-I165 WeakPolarHBondContact O-CB 3.43Å; P162-I165 WeakPolarHBondContact O-CG2 3.49Å; P162-I165 PolarHBondContact O-N 3.36Å; P162-I165 VanDerWaalsContact O-N 3.13Å
163	S	85	Confident	91.6	Very high	56 Å²	56	38.2 Å²	38.2	39%	0.392	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-60	-29.7	177.8	61.1	0	0	0	0	112.6	I165 G166 D205	S163-I165 PolarHBondContact O-N 2.9Å; S163-I165 VanDerWaalsContact O-N 3.14Å; S163-G166 PolarHBondContact O-N 2.69Å; S163-D205 VanDerWaalsContact O-CB 3.32Å; S163-D205 WeakPolarHBondContact O-CB 3.28Å
164	E	87.9	Confident	91.6	Very high	75 Å²	75	38.2 Å²	38.2	35%	0.35	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-63.7	-17.5	179.5	-65.6	80.9	177	0	0	112.5	S139 P162 G166 A167	S139-E164 WeakPolarHBondContact O-CB 3.17Å; S139-E164 WeakPolarHBondContact O-CG 3.43Å; P162-E164 WeakPolarHBondContact CB-OE2 3.45Å; P162-E164 PolarHBondContact O-N 2.88Å; E164-G166 PolarHBondContact O-N 3.03Å; E164-G166 VanDerWaalsContact O-N 3.17Å; E164-A167 VanDerWaalsContact O-CB 3.26Å; E164-A167 WeakPolarHBondContact O-CB 3.12Å; E164-A167 PolarHBondContact O-N 3.03Å
165	I	89.5	Confident	91.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-55.8	-32.5	170.4	-157.6	170.6	0	0	0	110.8	L161 P162 S163 A167 L168 L174 P185 F206 L209	L161-I165 HydrophobicContact CD1-CD1 4.18Å; L161-I165 HydrophobicContact CD2-CD1 4.27Å; P162-I165 WeakPolarHBondContact O-CB 3.43Å; P162-I165 WeakPolarHBondContact O-CG2 3.49Å; P162-I165 PolarHBondContact O-N 3.36Å; P162-I165 VanDerWaalsContact O-N 3.13Å; S163-I165 PolarHBondContact O-N 2.9Å; S163-I165 VanDerWaalsContact O-N 3.14Å; I165-A167 PolarHBondContact O-N 3.37Å; I165-L168 HydrophobicContact CG1-CD1 3.9Å; I165-L168 WeakPolarHBondContact O-CB 3.28Å; I165-L168 WeakPolarHBondContact O-CG 3.02Å; I165-L168 PolarHBondContact O-N 2.96Å; I165-L168 VanDerWaalsContact O-N 3.15Å; I165-L174 HydrophobicContact CD1-CD1 4.42Å; I165-L174 HydrophobicContact CD1-CD2 4.14Å; I165-P185 HydrophobicContact CG2-CG 3.94Å; I165-F206 HydrophobicContact CG2-CD2 4.26Å; I165-L209 WeakPolarHBondContact O-CD2 3.38Å
166	G	85.2	Confident	91.5	Very high	9 Å²	9	37.9 Å²	37.9	9%	0.093	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-64.8	-16.6	177	0	0	0	0	0	115.2	S163 E164 L168 D205	S163-G166 PolarHBondContact O-N 2.69Å; E164-G166 PolarHBondContact O-N 3.03Å; E164-G166 VanDerWaalsContact O-N 3.17Å; G166-L168 VanDerWaalsContact C-N 3.26Å; G166-L168 PolarHBondContact O-N 2.97Å; G166-D205 WeakPolarHBondContact CA-O 3.43Å
167	A	88.2	Confident	91.4	Very high	51 Å²	51	40.3 Å²	40.3	42%	0.421	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-74.9	-15.7	175.9	0	0	0	0	0	112.6	A145 E164 I165 S169	A145-A167 HydrophobicContact CB-CB 4.36Å; A145-A167 WeakPolarHBondContact CB-O 3.38Å; E164-A167 VanDerWaalsContact O-CB 3.26Å; E164-A167 WeakPolarHBondContact O-CB 3.12Å; E164-A167 PolarHBondContact O-N 3.03Å; I165-A167 PolarHBondContact O-N 3.37Å; A167-S169 PolarHBondContact O-N 3.27Å
168	L	91.7	Very high	91.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.214	C	C	.	.			trans	-71.9	68.4	-173.8	-59.4	175.5	0	0	0	113.7	I141 L144 L148 I165 G166 K170 L171 L209	I141-L168 HydrophobicContact CG1-CD1 4.36Å; I141-L168 WeakPolarHBondContact O-CD2 3.44Å; L144-L168 HydrophobicContact CB-CD2 3.99Å; L148-L168 HydrophobicContact CD2-CD1 4.22Å; I165-L168 HydrophobicContact CG1-CD1 3.9Å; I165-L168 WeakPolarHBondContact O-CB 3.28Å; I165-L168 WeakPolarHBondContact O-CG 3.02Å; I165-L168 PolarHBondContact O-N 2.96Å; I165-L168 VanDerWaalsContact O-N 3.15Å; G166-L168 VanDerWaalsContact C-N 3.26Å; G166-L168 PolarHBondContact O-N 2.97Å; L168-K170 PolarHBondContact O-N 3.11Å; L168-K170 VanDerWaalsContact O-N 3.1Å; L168-L171 HydrophobicContact CB-CB 3.86Å; L168-L171 HydrophobicContact CB-CD2 4.24Å; L168-L171 HydrophobicContact CD1-CD2 3.91Å; L168-L171 VanDerWaalsContact O-CB 3.26Å; L168-L171 WeakPolarHBondContact O-CB 3.34Å; L168-L171 PolarHBondContact O-N 2.85Å; L168-L209 HydrophobicContact CB-CD2 3.85Å; L168-L209 WeakPolarHBondContact O-CD2 3.48Å
169	S	89	Confident	91.4	Very high	67 Å²	67	39 Å²	39	47%	0.469	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.6	-171.2	70.3	0	0	0	0	114.9	A145 A167 R172	A145-S169 PolarHBondContact O-OG 3.1Å; A167-S169 PolarHBondContact O-N 3.27Å; S169-R172 PolarHBondContact O-NH1 3.32Å
170	K	93	Very high	91.5	Very high	103 Å²	103	38.7 Å²	38.7	45%	0.448	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-8.1	178.2	-69.2	-164.1	-175.6	171	0	114.2	G146 L148 L168 R172	G146-K170 VanDerWaalsContact O-CD 3.22Å; G146-K170 WeakPolarHBondContact O-CD 3.45Å; G146-K170 WeakPolarHBondContact O-CE 3.11Å; G146-K170 PolarHBondContact O-NZ 3.36Å; L148-K170 CarbonylContact O-C 3.48Å; L148-K170 WeakPolarHBondContact O-CB 3.2Å; L168-K170 PolarHBondContact O-N 3.11Å; L168-K170 VanDerWaalsContact O-N 3.1Å; K170-R172 WeakPolarHBondContact O-CG 3.4Å; K170-R172 PolarHBondContact O-N 3.44Å; K170-R172 PolarHBondContact O-NH1 2.96Å
171	L	95.1	Very high	91.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.			trans	-63	131.4	-179.5	-162.5	68.1	0	0	0	109.9	L148 L151 L168 L174 L209 R210 L211	L148-L171 HydrophobicContact CD2-CD1 4.19Å; L148-L171 HydrophobicContact CG-CD1 4.15Å; L148-L171 WeakPolarHBondContact O-CA 3.42Å; L148-L171 PolarHBondContact O-N 3.41Å; L148-L171 VanDerWaalsContact O-N 3.09Å; L151-L171 HydrophobicContact CB-CD1 3.9Å; L168-L171 HydrophobicContact CB-CB 3.86Å; L168-L171 HydrophobicContact CB-CD2 4.24Å; L168-L171 HydrophobicContact CD1-CD2 3.91Å; L168-L171 VanDerWaalsContact O-CB 3.26Å; L168-L171 WeakPolarHBondContact O-CB 3.34Å; L168-L171 PolarHBondContact O-N 2.85Å; L171-L174 HydrophobicContact CD2-CB 4.18Å; L171-L174 HydrophobicContact CD2-CD1 4.33Å; L171-L174 HydrophobicContact CD2-CD2 4.41Å; L171-L209 HydrophobicContact CB-CD2 4.49Å; L171-L209 HydrophobicContact CD2-CD1 4.47Å; L171-R210 CarbonylContact O-C 3.49Å; L171-L211 HydrophobicContact CB-CD2 4.02Å; L171-L211 HydrophobicContact CD2-CD2 3.81Å; L171-L211 HydrophobicContact CG-CD2 3.7Å
172	R	94	Very high	91.4	Very high	85 Å²	85	38.7 Å²	38.7	32%	0.321	21%	0.211	S	C	.	.			trans	-122.3	-34.7	-179.8	-63.1	-60.6	176	-102.8	-2.7	111.5	T149 S169 K170 R210 R212 Y213	T149-R172 PolarHBondContact O-N 3.47Å; S169-R172 PolarHBondContact O-NH1 3.32Å; K170-R172 WeakPolarHBondContact O-CG 3.4Å; K170-R172 PolarHBondContact O-N 3.44Å; K170-R172 PolarHBondContact O-NH1 2.96Å; R172-R210 WeakPolarHBondContact CD-O 3.46Å; R172-R210 PolarHBondContact NH1-O 2.77Å; R172-R212 PolarHBondContact O-N 2.74Å; R172-Y213 PolarHBondContact O-N 3.32Å
173	V	95.5	Very high	91.1	Very high	43 Å²	43	42.2 Å²	42.2	26%	0.261	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	123.6	-179.9	-178.1	0	0	0	0	108.3	T149 E150 L151 Y213	T149-V173 PolarHBondContact O-N 2.8Å; T149-V173 VanDerWaalsContact O-N 3.08Å; E150-V173 WeakPolarHBondContact CA-O 3.44Å; E150-V173 HydrophobicContact CB-CB 4.21Å; E150-V173 HydrophobicContact CG-CB 3.93Å; E150-V173 HydrophobicContact CG-CG1 4.08Å; L151-V173 PolarHBondContact N-O 3.04Å; V173-Y213 HydrophobicContact CG2-CD2 4.13Å
174	L	95.9	Very high	90.9	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	116.4	175.3	177.7	58.6	0	0	0	109.2	L151 I165 L171 L176 F206 L211 Y213 C214 D215	L151-L174 HydrophobicContact CB-CD1 4.1Å; L151-L174 HydrophobicContact CD2-CD1 3.93Å; L151-L174 HydrophobicContact CG-CD1 4.12Å; L151-L174 WeakPolarHBondContact O-CA 3.29Å; I165-L174 HydrophobicContact CD1-CD1 4.42Å; I165-L174 HydrophobicContact CD1-CD2 4.14Å; L171-L174 HydrophobicContact CD2-CB 4.18Å; L171-L174 HydrophobicContact CD2-CD1 4.33Å; L171-L174 HydrophobicContact CD2-CD2 4.41Å; L174-L176 HydrophobicContact CD1-CD1 4.44Å; L174-L176 HydrophobicContact CD1-CD2 4.04Å; L174-L176 HydrophobicContact CD1-CG 4.03Å; L174-L176 HydrophobicContact CD2-CD1 3.89Å; L174-L176 HydrophobicContact CD2-CG 4.34Å; L174-L176 HydrophobicContact CG-CD1 4.03Å; L174-L176 HydrophobicContact CG-CD2 4.48Å; L174-L176 HydrophobicContact CG-CG 3.94Å; L174-F206 HydrophobicContact CD2-CE2 3.69Å; L174-F206 HydrophobicContact CD2-CZ 4.03Å; L174-L211 HydrophobicContact CB-CD1 3.99Å; L174-L211 HydrophobicContact CB-CD2 3.95Å; L174-L211 HydrophobicContact CD2-CD1 4Å; L174-Y213 PolarHBondContact N-O 3.14Å; L174-C214 WeakPolarHBondContact O-CA 3.2Å; L174-D215 PolarHBondContact O-N 3.08Å
175	N	95.4	Very high	90	Very high	22 Å²	22	36.7 Å²	36.7	12%	0.118	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115	176.8	-171.1	0.6	0	0	0	110.4	L151 D152 V153 S154 R177	L151-N175 PolarHBondContact O-N 3.07Å; D152-N175 HydrophobicContact CB-CB 4.17Å; D152-N175 PolarHBondContact OD1-ND2 2.85Å; D152-N175 PolarHBondContact OD2-ND2 3.04Å; D152-N175 VanDerWaalsContact OD2-ND2 3.15Å; V153-N175 CarbonylContact C-O 3.34Å; V153-N175 WeakPolarHBondContact CG2-O 3.12Å; V153-N175 PolarHBondContact N-O 2.61Å; S154-N175 WeakPolarHBondContact CB-OD1 3.33Å; S154-N175 PolarHBondContact N-O 2.79Å; N175-R177 VanDerWaalsContact OD1-CB 3.24Å; N175-R177 WeakPolarHBondContact OD1-CB 3.24Å; N175-R177 PolarHBondContact OD1-N 3.27Å; N175-R177 VanDerWaalsContact OD1-N 3.12Å
176	L	94.8	Very high	88.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.			trans	-120.4	10.4	-179.2	-62.6	170.3	0	0	0	111.3	V153 L158 L161 L174 N179 L181 D215 I216 N219	V153-L176 HydrophobicContact CG2-CD2 3.38Å; L158-L176 HydrophobicContact CD1-CD2 4.27Å; L161-L176 HydrophobicContact CD1-CD1 3.58Å; L161-L176 HydrophobicContact CD1-CD2 4.36Å; L161-L176 HydrophobicContact CD2-CD2 3.83Å; L174-L176 HydrophobicContact CD1-CD1 4.44Å; L174-L176 HydrophobicContact CD1-CD2 4.04Å; L174-L176 HydrophobicContact CD1-CG 4.03Å; L174-L176 HydrophobicContact CD2-CD1 3.89Å; L174-L176 HydrophobicContact CD2-CG 4.34Å; L174-L176 HydrophobicContact CG-CD1 4.03Å; L174-L176 HydrophobicContact CG-CD2 4.48Å; L174-L176 HydrophobicContact CG-CG 3.94Å; L176-N179 PolarHBondContact O-ND2 3.32Å; L176-L181 HydrophobicContact CB-CD1 4.04Å; L176-L181 HydrophobicContact CD1-CD1 4Å; L176-L181 HydrophobicContact CD2-CD1 4.42Å; L176-L181 HydrophobicContact CG-CD1 4.38Å; L176-D215 CarbonylContact C-O 3.57Å; L176-D215 WeakPolarHBondContact CA-O 3.06Å; L176-D215 WeakPolarHBondContact CB-O 3.38Å; L176-D215 PolarHBondContact N-O 3.13Å; L176-I216 HydrophobicContact CB-CG2 3.98Å; L176-I216 HydrophobicContact CD1-CG2 3.67Å; L176-I216 HydrophobicContact CG-CG2 4.36Å; L176-N219 PolarHBondContact O-ND2 2.99Å
177	R	94	Very high	87.1	Confident	62 Å²	62	40.1 Å²	40.1	23%	0.234	21%	0.212	C	C	.	.			trans	-50.8	143.6	-177.5	170.2	179.2	167	101.2	6.3	111.9	S154 C155 N175 N179 D215 S217 F218	S154-R177 CarbonylContact C-O 3.51Å; S154-R177 WeakPolarHBondContact CA-O 3.5Å; S154-R177 WeakPolarHBondContact CB-O 3.29Å; C155-R177 PolarHBondContact N-O 3.29Å; N175-R177 VanDerWaalsContact OD1-CB 3.24Å; N175-R177 WeakPolarHBondContact OD1-CB 3.24Å; N175-R177 PolarHBondContact OD1-N 3.27Å; N175-R177 VanDerWaalsContact OD1-N 3.12Å; R177-N179 PolarHBondContact O-N 3.13Å; R177-N179 PolarHBondContact O-ND2 2.73Å; R177-D215 PolarHBondContact N-O 3.15Å; R177-S217 CarbonylContact C-O 3.43Å; R177-S217 VanDerWaalsContact CA-O 3.23Å; R177-S217 WeakPolarHBondContact CA-O 3.12Å; R177-S217 WeakPolarHBondContact CG-OG 3.06Å; R177-F218 HydrophobicContact CG-CD2 4.46Å
178	Q	94.6	Very high	84.6	Confident	101 Å²	101	40.8 Å²	40.8	47%	0.472	21%	0.208	S	C	.	.	S	Bend	trans	56.4	54.8	172.2	-166.2	173.5	-14.9	0	0	112.2	C155 N156 S217 F218	C155-Q178 CarbonylContact C-O 3.41Å; C155-Q178 VanDerWaalsContact CA-O 3.22Å; C155-Q178 WeakPolarHBondContact CA-O 3.33Å; C155-Q178 PolarHBondContact N-O 3.31Å; C155-Q178 PolarHBondContact SG-OE1 2.66Å; N156-Q178 PolarHBondContact N-O 2.88Å; Q178-S217 PolarHBondContact N-O 2.82Å; Q178-F218 VanDerWaalsContact CA-O 3.26Å; Q178-F218 WeakPolarHBondContact CA-O 3.48Å; Q178-F218 HydrophobicContact CB-CB 4.24Å
179	N	93.9	Very high	82	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.043	22%	0.222	C	C	.	.	S	Bend	trans	-119.1	-169.3	169.1	-83.4	-80	0	0	0	108.9	V153 N156 R157 L158 L176 R177 L181 N219	V153-N179 PolarHBondContact O-ND2 3.38Å; N156-N179 VanDerWaalsContact CA-OD1 3.3Å; N156-N179 WeakPolarHBondContact CA-OD1 2.95Å; N156-N179 WeakPolarHBondContact CB-OD1 3.16Å; N156-N179 PolarHBondContact N-OD1 3.12Å; N156-N179 PolarHBondContact O-OD1 2.9Å; R157-N179 PolarHBondContact N-OD1 3.2Å; L158-N179 HydrophobicContact CB-CB 4.13Å; L158-N179 VanDerWaalsContact CB-OD1 3.27Å; L158-N179 WeakPolarHBondContact CB-OD1 3.41Å; L158-N179 WeakPolarHBondContact CG-OD1 3.34Å; L158-N179 PolarHBondContact N-OD1 3Å; L176-N179 PolarHBondContact O-ND2 3.32Å; R177-N179 PolarHBondContact O-N 3.13Å; R177-N179 PolarHBondContact O-ND2 2.73Å; N179-L181 HydrophobicContact CB-CG 4.17Å; N179-N219 VanDerWaalsContact CA-OD1 3.29Å; N179-N219 WeakPolarHBondContact CA-OD1 3.07Å; N179-N219 WeakPolarHBondContact CB-OD1 3.31Å; N179-N219 PolarHBondContact N-OD1 2.82Å; N179-N219 PolarHBondContact O-OD1 2.97Å
180	V	92.8	Very high	79.8	Confident	55 Å²	55	44.1 Å²	44.1	33%	0.333	23%	0.226	S	C	.	.			trans	-115.6	30.1	177.8	-65.9	0	0	0	0	111.7	R157 L158 T182 N219 K220	R157-V180 WeakPolarHBondContact O-CG2 3.19Å; L158-V180 CarbonylContact O-C 3.49Å; L158-V180 VanDerWaalsContact O-C 3.22Å; L158-V180 WeakPolarHBondContact O-CA 3.47Å; L158-V180 VanDerWaalsContact O-CG2 3.24Å; L158-V180 WeakPolarHBondContact O-CG2 3.31Å; L158-V180 PolarHBondContact O-N 3.09Å; V180-T182 PolarHBondContact O-N 2.93Å; V180-N219 PolarHBondContact N-OD1 2.94Å; V180-K220 HydrophobicContact CB-CD 4.47Å
181	L	90.9	Very high	77.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.			trans	-65.3	129.5	-179.5	-61.5	173.4	0	0	0	110.6	L158 L161 L176 N179 N219 K220 I221	L158-L181 HydrophobicContact CB-CD2 4Å; L158-L181 PolarHBondContact O-N 3Å; L161-L181 HydrophobicContact CD1-CD1 4.31Å; L161-L181 HydrophobicContact CD2-CD2 4.39Å; L161-L181 HydrophobicContact CG-CD1 4.37Å; L161-L181 HydrophobicContact CG-CD2 4.04Å; L176-L181 HydrophobicContact CB-CD1 4.04Å; L176-L181 HydrophobicContact CD1-CD1 4Å; L176-L181 HydrophobicContact CD2-CD1 4.42Å; L176-L181 HydrophobicContact CG-CD1 4.38Å; N179-L181 HydrophobicContact CB-CG 4.17Å; L181-N219 HydrophobicContact CB-CB 4.28Å; L181-N219 VanDerWaalsContact CB-OD1 3.29Å; L181-N219 WeakPolarHBondContact CB-OD1 3.33Å; L181-N219 WeakPolarHBondContact CG-OD1 3.47Å; L181-N219 PolarHBondContact N-OD1 2.95Å; L181-K220 CarbonylContact O-C 3.56Å; L181-K220 VanDerWaalsContact O-CA 3.27Å; L181-K220 WeakPolarHBondContact O-CA 3.11Å; L181-K220 PolarHBondContact O-N 2.73Å; L181-I221 HydrophobicContact CB-CG1 4.47Å; L181-I221 WeakPolarHBondContact O-CG1 3.41Å; L181-I221 PolarHBondContact O-N 3.01Å
182	T	85.2	Confident	75.4	Confident	53 Å²	53	52.9 Å²	52.9	33%	0.325	27%	0.273	S	S	.	.			trans	-102	-29.9	178.2	41	0	0	0	0	112.7	V180 K220	V180-T182 PolarHBondContact O-N 2.93Å; T182-K220 HydrophobicContact CG2-CB 4.06Å
183	W	81.3	Confident	73.1	Confident	95 Å²	95	53.1 Å²	53.1	36%	0.36	28%	0.284	S	S	.	.			trans	-146.3	158.2	175.4	56.9	83.8	0	0	0	110.3	Y186 P191	W183-Y186 HydrophobicContact CB-CE2 4.12Å; W183-P191 HydrophobicContact CE3-CB 4.44Å; W183-P191 HydrophobicContact CE3-CG 4.43Å; W183-P191 HydrophobicContact CH2-CB 4.29Å; W183-P191 HydrophobicContact CH2-CG 3.54Å; W183-P191 HydrophobicContact CZ2-CG 3.6Å; W183-P191 HydrophobicContact CZ3-CB 4.17Å; W183-P191 HydrophobicContact CZ3-CG 3.93Å
184	L	81.6	Confident	70.4	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.294	C	S	.	.			trans	-90.2	153.4	167.2	-64.9	171.9	0	0	0	109.2	L161 Y186 F206 I216 I228	L161-L184 HydrophobicContact CD1-CD2 4.02Å; L184-Y186 HydrophobicContact CB-CE1 4.05Å; L184-Y186 WeakPolarHBondContact O-CD2 3.43Å; L184-Y186 WeakPolarHBondContact O-CE2 3.47Å; L184-Y186 PolarHBondContact O-N 3.04Å; L184-F206 HydrophobicContact CB-CG 4.43Å; L184-F206 HydrophobicContact CD1-CD1 4.06Å; L184-F206 HydrophobicContact CD1-CE1 3.84Å; L184-F206 HydrophobicContact CD1-CZ 4.19Å; L184-F206 HydrophobicContact CD2-CD2 4.34Å; L184-F206 HydrophobicContact CD2-CE2 4.02Å; L184-F206 HydrophobicContact CD2-CZ 4.13Å; L184-I216 HydrophobicContact CD1-CD1 4.35Å; L184-I216 HydrophobicContact CD2-CG2 4.5Å; L184-I228 HydrophobicContact CD1-CD1 4.15Å
185	P	69.1	Low	67.9	Low	15 Å²	15	59.4 Å²	59.4	10%	0.097	33%	0.334	C	S	.	.			trans	-67.9	102.3	-178.3	22.8	-28	0	0	0	110.5	L161 I165 F206	L161-P185 HydrophobicContact CB-CG 4.02Å; I165-P185 HydrophobicContact CG2-CG 3.94Å; P185-F206 HydrophobicContact CG-CB 4.18Å; P185-F206 HydrophobicContact CG-CD2 4.42Å
186	Y	66.2	Low	65.4	Low	46 Å²	46	63.3 Å²	63.3	18%	0.18	36%	0.363	C	S	.	.			trans	-88.8	126.3	168.6	-45.6	-61	0	0	0	108	W183 L184 I188 F189 D225	W183-Y186 HydrophobicContact CB-CE2 4.12Å; L184-Y186 HydrophobicContact CB-CE1 4.05Å; L184-Y186 WeakPolarHBondContact O-CD2 3.43Å; L184-Y186 WeakPolarHBondContact O-CE2 3.47Å; L184-Y186 PolarHBondContact O-N 3.04Å; Y186-I188 PolarHBondContact O-N 3.13Å; Y186-F189 PolarHBondContact O-N 3.08Å; Y186-D225 HydrophobicContact CD1-CB 3.65Å; Y186-D225 WeakPolarHBondContact CD1-OD2 3.47Å; Y186-D225 HydrophobicContact CE1-CB 3.23Å
187	G	46.3	Very low	62.8	Low	34 Å²	34	69.2 Å²	69.2	35%	0.351	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	9.2	-164.8	0	0	0	0	0	116.7	D205	G187-D205 WeakPolarHBondContact CA-OD2 3.46Å
188	I	36.7	Very low	60.3	Low	66 Å²	66	71.4 Å²	71.4	34%	0.338	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.6	-7.8	-178.1	-50.3	-179.2	0	0	0	113.6	Y186 R200 N202	Y186-I188 PolarHBondContact O-N 3.13Å; I188-R200 HydrophobicContact CD1-CB 3.97Å; I188-R200 WeakPolarHBondContact CD1-O 3.32Å; I188-N202 HydrophobicContact CD1-CB 4.33Å
189	F	37.6	Very low	57.8	Low	69 Å²	69	75.3 Å²	75.3	30%	0.303	42%	0.42	S	S	.	.			trans	-135.8	83.9	-174.1	-77	-85.7	0	0	0	112.8	Y186 V193 G194	Y186-F189 PolarHBondContact O-N 3.08Å; F189-V193 HydrophobicContact CD1-CB 4.47Å; F189-V193 VanDerWaalsContact CD1-O 3.26Å; F189-V193 WeakPolarHBondContact CD1-O 3.23Å; F189-V193 WeakPolarHBondContact CE1-O 3.49Å; F189-G194 WeakPolarHBondContact CE1-O 3.35Å
190	A	41.8	Very low	55.3	Low	67 Å²	67	83.9 Å²	83.9	55%	0.554	45%	0.452	S	S	*	.			trans	-61.4	147.1	149.7	0	0	0	0	0	108.5	F192 V193	A190-F192 PolarHBondContact O-N 3.11Å; A190-V193 PolarHBondContact O-N 3.01Å
191	P	44.9	Very low	53	Low	85 Å²	85	90.8 Å²	90.8	55%	0.552	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	11.1	-167.6	29.5	-41.2	0	0	0	116.3	W183	W183-P191 HydrophobicContact CE3-CB 4.44Å; W183-P191 HydrophobicContact CE3-CG 4.43Å; W183-P191 HydrophobicContact CH2-CB 4.29Å; W183-P191 HydrophobicContact CH2-CG 3.54Å; W183-P191 HydrophobicContact CZ2-CG 3.6Å; W183-P191 HydrophobicContact CZ3-CB 4.17Å; W183-P191 HydrophobicContact CZ3-CG 3.93Å
192	F	50.9	Low	50.9	Low	202 Å²	202	96.1 Å²	96.1	89%	0.886	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-4.7	-177.2	-111.3	-94	0	0	0	115.3	A190	A190-F192 PolarHBondContact O-N 3.11Å
193	V	45.3	Very low	49.5	Very low	90 Å²	90	96 Å²	96	55%	0.545	51%	0.505	S	S	.	.	S	Bend	trans	-106.7	113.1	179.9	-172	0	0	0	0	108.9	F189 A190	F189-V193 HydrophobicContact CD1-CB 4.47Å; F189-V193 VanDerWaalsContact CD1-O 3.26Å; F189-V193 WeakPolarHBondContact CD1-O 3.23Å; F189-V193 WeakPolarHBondContact CE1-O 3.49Å; A190-V193 PolarHBondContact O-N 3.01Å
194	G	39.5	Very low	48.9	Very low	45 Å²	45	91.5 Å²	91.5	46%	0.464	49%	0.489	S	S	.	.			trans	-57	160.4	-174.7	0	0	0	0	0	113.9	F189 S196	F189-G194 WeakPolarHBondContact CE1-O 3.35Å; G194-S196 PolarHBondContact O-N 3.38Å
195	P	43.5	Very low	48.5	Very low	131 Å²	131	93.1 Å²	93.1	85%	0.851	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	15.2	-166.4	27.4	-35.6	0	0	0	116.6
196	S	43.2	Very low	49	Very low	105 Å²	105	92.6 Å²	92.6	73%	0.734	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-6.4	-164.3	-79.9	0	0	0	0	117.6	G194	G194-S196 PolarHBondContact O-N 3.38Å
197	L	38.8	Very low	49.6	Very low	124 Å²	124	90.8 Å²	90.8	65%	0.649	49%	0.487	S	S	*	.	S	Bend	trans	-121.3	108.9	-178.7	-90.8	80.8	0	0	0	112.6
198	I	41.4	Very low	51.3	Low	108 Å²	108	93.9 Å²	93.9	55%	0.554	49%	0.491	S	S	*	.			trans	69.5	79.5	155.7	-48.3	171.8	0	0	0	114.1	R200	I198-R200 HydrophobicContact CG2-CB 4.15Å; I198-R200 HydrophobicContact CG2-CG 3.59Å; I198-R200 PolarHBondContact O-N 3.41Å
199	R	43.4	Very low	53.7	Low	182 Å²	182	90.9 Å²	90.9	69%	0.687	48%	0.476	S	S	*	.			trans	-62.9	78.1	151.2	-87.2	-162.8	-88.8	-127.1	-7	109.2
200	R	41.3	Very low	56.1	Low	189 Å²	189	95.6 Å²	95.6	71%	0.713	49%	0.492	S	S	*	.			trans	-74.4	134.6	160.3	-94.1	173.4	-177.5	-164.8	1.3	107.4	I188 I198 N202	I188-R200 HydrophobicContact CD1-CB 3.97Å; I188-R200 WeakPolarHBondContact CD1-O 3.32Å; I198-R200 HydrophobicContact CG2-CB 4.15Å; I198-R200 HydrophobicContact CG2-CG 3.59Å; I198-R200 PolarHBondContact O-N 3.41Å; R200-N202 PolarHBondContact O-N 2.7Å
201	Q	44.5	Very low	58.4	Low	200 Å²	200	92.4 Å²	92.4	94%	0.935	47%	0.465	S	S	*	.			trans	-63.6	28.8	-175.8	-66.9	172.7	-21.9	0	0	114.7	L203	Q201-L203 PolarHBondContact O-N 3.5Å
202	N	46.4	Very low	60.6	Low	111 Å²	111	95.2 Å²	95.2	59%	0.594	47%	0.465	S	S	*	.			trans	-79.8	114.2	173.6	-82.1	-10.3	0	0	0	108.5	I188 R200 S204	I188-N202 HydrophobicContact CD1-CB 4.33Å; R200-N202 PolarHBondContact O-N 2.7Å; N202-S204 PolarHBondContact O-N 3.03Å
203	L	56.8	Low	62.6	Low	50 Å²	50	89.2 Å²	89.2	26%	0.262	44%	0.437	S	S	.	.			trans	-43.7	133	165.9	-168.9	66.1	0	0	0	108.9	Q201 D205 C207 K208 D227 L230	Q201-L203 PolarHBondContact O-N 3.5Å; L203-D205 PolarHBondContact O-N 2.84Å; L203-C207 HydrophobicContact CD1-CB 3.82Å; L203-C207 HydrophobicContact CD2-CB 4.23Å; L203-C207 WeakPolarHBondContact CD2-O 3.34Å; L203-C207 HydrophobicContact CG-CB 3.79Å; L203-K208 HydrophobicContact CB-CG 4.46Å; L203-K208 HydrophobicContact CD2-CG 4Å; L203-K208 HydrophobicContact CG-CG 4.41Å; L203-D227 HydrophobicContact CD1-CB 4.17Å; L203-L230 HydrophobicContact CD1-CB 4.04Å; L203-L230 HydrophobicContact CD1-CD1 3.31Å; L203-L230 HydrophobicContact CD1-CG 4.26Å
204	S	67.3	Low	64.9	Low	2 Å²	2	85.2 Å²	85.2	1%	0.014	41%	0.413	C	S	.	.			trans	-47.6	134.9	171.9	50.5	0	0	0	0	110.1	N202 F206 C207 K208	N202-S204 PolarHBondContact O-N 3.03Å; S204-F206 PolarHBondContact O-N 3.09Å; S204-F206 VanDerWaalsContact O-N 3.12Å; S204-C207 WeakPolarHBondContact O-CA 3.33Å; S204-C207 PolarHBondContact O-N 3.44Å; S204-C207 WeakPolarHBondContact OG-CB 3.34Å; S204-C207 PolarHBondContact OG-SG 3.32Å; S204-K208 PolarHBondContact O-N 2.98Å
205	D	72.7	Confident	67.5	Low	35 Å²	35	84.7 Å²	84.7	19%	0.187	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-56	-37	-174.6	-67.1	-51.2	0	0	0	110.6	S163 G166 G187 L203 C207 K208	S163-D205 VanDerWaalsContact O-CB 3.32Å; S163-D205 WeakPolarHBondContact O-CB 3.28Å; G166-D205 WeakPolarHBondContact CA-O 3.43Å; G187-D205 WeakPolarHBondContact CA-OD2 3.46Å; L203-D205 PolarHBondContact O-N 2.84Å; D205-C207 PolarHBondContact O-N 3.22Å; D205-K208 WeakPolarHBondContact O-CB 3.37Å; D205-K208 PolarHBondContact O-N 2.76Å; D205-K208 WeakPolarHBondContact OD1-CE 3.24Å; D205-K208 IonicContact OD1-NZ 2.69Å; D205-K208 PolarHBondContact OD1-NZ 3.31Å
206	F	79.9	Confident	69.8	Low	4 Å²	4	78.5 Å²	78.5	2%	0.018	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-55.9	-43.4	171.1	-168.1	-94.5	0	0	0	114	L161 I165 L174 L184 P185 S204 K208 L209 L211 M231	L161-F206 HydrophobicContact CD1-CE2 4.27Å; I165-F206 HydrophobicContact CG2-CD2 4.26Å; L174-F206 HydrophobicContact CD2-CE2 3.69Å; L174-F206 HydrophobicContact CD2-CZ 4.03Å; L184-F206 HydrophobicContact CB-CG 4.43Å; L184-F206 HydrophobicContact CD1-CD1 4.06Å; L184-F206 HydrophobicContact CD1-CE1 3.84Å; L184-F206 HydrophobicContact CD1-CZ 4.19Å; L184-F206 HydrophobicContact CD2-CD2 4.34Å; L184-F206 HydrophobicContact CD2-CE2 4.02Å; L184-F206 HydrophobicContact CD2-CZ 4.13Å; P185-F206 HydrophobicContact CG-CB 4.18Å; P185-F206 HydrophobicContact CG-CD2 4.42Å; S204-F206 PolarHBondContact O-N 3.09Å; S204-F206 VanDerWaalsContact O-N 3.12Å; F206-K208 PolarHBondContact O-N 2.81Å; F206-L209 HydrophobicContact CD2-CD1 4.28Å; F206-L209 HydrophobicContact CE2-CD1 4.43Å; F206-L209 VanDerWaalsContact O-CB 3.29Å; F206-L209 WeakPolarHBondContact O-CB 3.44Å; F206-L209 VanDerWaalsContact O-CG 3.3Å; F206-L209 WeakPolarHBondContact O-CG 3.47Å; F206-L209 PolarHBondContact O-N 3.12Å; F206-L211 HydrophobicContact CZ-CD1 4.21Å; F206-M231 HydrophobicContact CD1-SD 4.24Å; F206-M231 HydrophobicContact CE1-CE 4.28Å; F206-M231 HydrophobicContact CE1-SD 4.21Å
207	C	80.1	Confident	72.1	Confident	7 Å²	7	73.6 Å²	73.6	5%	0.047	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-76.8	-6.6	-178.2	-67.4	0	0	0	0	113.9	L203 S204 D205 L209 D227 M231	L203-C207 HydrophobicContact CD1-CB 3.82Å; L203-C207 HydrophobicContact CD2-CB 4.23Å; L203-C207 WeakPolarHBondContact CD2-O 3.34Å; L203-C207 HydrophobicContact CG-CB 3.79Å; S204-C207 WeakPolarHBondContact O-CA 3.33Å; S204-C207 PolarHBondContact O-N 3.44Å; S204-C207 WeakPolarHBondContact OG-CB 3.34Å; S204-C207 PolarHBondContact OG-SG 3.32Å; D205-C207 PolarHBondContact O-N 3.22Å; C207-L209 PolarHBondContact O-N 3.38Å; C207-D227 VanDerWaalsContact SG-C 3.53Å; C207-M231 HydrophobicContact CB-CG 3.99Å; C207-M231 HydrophobicContact CB-SD 4.27Å
208	K	82	Confident	74.7	Confident	99 Å²	99	71.5 Å²	71.5	43%	0.43	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-69.5	-19	167.8	-62.4	174.3	-177.5	167.3	0	112.2	L203 S204 D205 F206	L203-K208 HydrophobicContact CB-CG 4.46Å; L203-K208 HydrophobicContact CD2-CG 4Å; L203-K208 HydrophobicContact CG-CG 4.41Å; S204-K208 PolarHBondContact O-N 2.98Å; D205-K208 WeakPolarHBondContact O-CB 3.37Å; D205-K208 PolarHBondContact O-N 2.76Å; D205-K208 WeakPolarHBondContact OD1-CE 3.24Å; D205-K208 IonicContact OD1-NZ 2.69Å; D205-K208 PolarHBondContact OD1-NZ 3.31Å; F206-K208 PolarHBondContact O-N 2.81Å
209	L	86.3	Confident	77.1	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.016	29%	0.286	C	S	.	.			trans	-68.6	139.2	-179.4	-63.8	172.8	0	0	0	112.1	I165 L168 L171 F206 C207 L211 M231	I165-L209 WeakPolarHBondContact O-CD2 3.38Å; L168-L209 HydrophobicContact CB-CD2 3.85Å; L168-L209 WeakPolarHBondContact O-CD2 3.48Å; L171-L209 HydrophobicContact CB-CD2 4.49Å; L171-L209 HydrophobicContact CD2-CD1 4.47Å; F206-L209 HydrophobicContact CD2-CD1 4.28Å; F206-L209 HydrophobicContact CE2-CD1 4.43Å; F206-L209 VanDerWaalsContact O-CB 3.29Å; F206-L209 WeakPolarHBondContact O-CB 3.44Å; F206-L209 VanDerWaalsContact O-CG 3.3Å; F206-L209 WeakPolarHBondContact O-CG 3.47Å; F206-L209 PolarHBondContact O-N 3.12Å; C207-L209 PolarHBondContact O-N 3.38Å; L209-L211 VanDerWaalsContact C-N 3.26Å; L209-L211 HydrophobicContact CB-CD1 4.42Å; L209-L211 HydrophobicContact CB-CD2 4.32Å; L209-L211 HydrophobicContact CB-CG 3.83Å; L209-L211 HydrophobicContact CD1-CD1 4.3Å; L209-L211 HydrophobicContact CD1-CD2 4.48Å; L209-L211 HydrophobicContact CD1-CG 4.37Å; L209-L211 PolarHBondContact O-N 3.39Å; L209-M231 HydrophobicContact CB-CE 4.33Å
210	R	87.5	Confident	79.3	Confident	169 Å²	169	63.7 Å²	63.7	64%	0.638	28%	0.278	S	S	*	.			trans	-95.1	48.3	174	-64.7	-178.6	-175.4	174.9	2	111.1	L171 R172 S233	L171-R210 CarbonylContact O-C 3.49Å; R172-R210 WeakPolarHBondContact CD-O 3.46Å; R172-R210 PolarHBondContact NH1-O 2.77Å; R210-S233 VanDerWaalsContact CA-OG 3.23Å; R210-S233 WeakPolarHBondContact CA-OG 3.32Å
211	L	90.9	Very high	81.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	24%	0.244	C	C	.	.			trans	-60.4	147.3	178	-62	-179.4	0	0	0	110.4	L171 L174 F206 L209 C214 M231 S233 L234	L171-L211 HydrophobicContact CB-CD2 4.02Å; L171-L211 HydrophobicContact CD2-CD2 3.81Å; L171-L211 HydrophobicContact CG-CD2 3.7Å; L174-L211 HydrophobicContact CB-CD1 3.99Å; L174-L211 HydrophobicContact CB-CD2 3.95Å; L174-L211 HydrophobicContact CD2-CD1 4Å; F206-L211 HydrophobicContact CZ-CD1 4.21Å; L209-L211 VanDerWaalsContact C-N 3.26Å; L209-L211 HydrophobicContact CB-CD1 4.42Å; L209-L211 HydrophobicContact CB-CD2 4.32Å; L209-L211 HydrophobicContact CB-CG 3.83Å; L209-L211 HydrophobicContact CD1-CD1 4.3Å; L209-L211 HydrophobicContact CD1-CD2 4.48Å; L209-L211 HydrophobicContact CD1-CG 4.37Å; L209-L211 PolarHBondContact O-N 3.39Å; L211-C214 HydrophobicContact CD1-CB 4Å; L211-M231 HydrophobicContact CB-CE 4.15Å; L211-M231 HydrophobicContact CD1-CE 3.94Å; L211-M231 HydrophobicContact CG-CE 4.1Å; L211-S233 PolarHBondContact N-OG 3.13Å; L211-S233 CarbonylContact O-C 3.22Å; L211-S233 WeakPolarHBondContact O-CB 3.15Å; L211-S233 VanDerWaalsContact O-O 3.12Å; L211-S233 PolarHBondContact O-OG 2.83Å; L211-L234 HydrophobicContact CB-CD1 3.85Å; L211-L234 WeakPolarHBondContact O-CA 3.41Å; L211-L234 PolarHBondContact O-N 3.35Å
212	R	91.7	Very high	83.5	Confident	144 Å²	144	47.3 Å²	47.3	54%	0.543	21%	0.214	S	C	.	.	S	Bend	trans	-104	-38.4	165.7	-75.5	-172.3	174	-175.2	-2.7	111	R172 V235 E236	R172-R212 PolarHBondContact O-N 2.74Å; R212-V235 HydrophobicContact CB-CG2 4.32Å; R212-V235 HydrophobicContact CG-CG2 4.41Å; R212-V235 WeakPolarHBondContact O-CA 3.4Å; R212-V235 WeakPolarHBondContact O-CB 3.22Å; R212-V235 PolarHBondContact O-N 2.88Å; R212-E236 PolarHBondContact O-N 3.19Å; R212-E236 VanDerWaalsContact O-N 3.13Å
213	Y	93.1	Very high	85.2	Confident	76 Å²	76	46 Å²	46	30%	0.298	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.7	179	-61.4	-87.9	0	0	0	109.3	R172 V173 L174 E236	R172-Y213 PolarHBondContact O-N 3.32Å; V173-Y213 HydrophobicContact CG2-CD2 4.13Å; L174-Y213 PolarHBondContact N-O 3.14Å; Y213-E236 HydrophobicContact CD1-CB 3.7Å; Y213-E236 HydrophobicContact CE1-CB 3.99Å; Y213-E236 WeakPolarHBondContact CE1-OE2 3.41Å
214	C	93.1	Very high	86.6	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.034	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	112.3	176.8	-173.1	0	0	0	0	109.6	L174 L211 L234 E236 I237 S238	L174-C214 WeakPolarHBondContact O-CA 3.2Å; L211-C214 HydrophobicContact CD1-CB 4Å; C214-L234 HydrophobicContact CB-CD1 3.62Å; C214-E236 PolarHBondContact N-O 3.32Å; C214-E236 VanDerWaalsContact N-O 3.13Å; C214-I237 HydrophobicContact CB-CG1 4.49Å; C214-I237 VanDerWaalsContact O-CA 3.3Å; C214-I237 WeakPolarHBondContact O-CA 3.37Å; C214-S238 PolarHBondContact O-N 2.96Å
215	D	92.9	Very high	87.3	Confident	34 Å²	34	45.4 Å²	45.4	18%	0.182	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	112.2	173.5	-171	-6.7	0	0	0	109.6	L174 L176 R177 S217 S238	L174-D215 PolarHBondContact O-N 3.08Å; L176-D215 CarbonylContact C-O 3.57Å; L176-D215 WeakPolarHBondContact CA-O 3.06Å; L176-D215 WeakPolarHBondContact CB-O 3.38Å; L176-D215 PolarHBondContact N-O 3.13Å; R177-D215 PolarHBondContact N-O 3.15Å; D215-S217 WeakPolarHBondContact OD1-CB 3.45Å; D215-S217 PolarHBondContact OD1-N 2.73Å; D215-S217 PolarHBondContact OD1-OG 3.07Å; D215-S217 PolarHBondContact OD2-OG 3.02Å; D215-S238 WeakPolarHBondContact OD1-CB 3.3Å
216	I	92.1	Very high	87.7	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	20%	0.196	C	C	.	.			trans	-118.1	21.3	173.7	54.6	165	0	0	0	110.7	L176 L184 N219 I221 L224 S238 L239 N242	L176-I216 HydrophobicContact CB-CG2 3.98Å; L176-I216 HydrophobicContact CD1-CG2 3.67Å; L176-I216 HydrophobicContact CG-CG2 4.36Å; L184-I216 HydrophobicContact CD1-CD1 4.35Å; L184-I216 HydrophobicContact CD2-CG2 4.5Å; I216-N219 PolarHBondContact O-ND2 2.89Å; I216-I221 HydrophobicContact CB-CD1 4.14Å; I216-I221 HydrophobicContact CD1-CD1 3.63Å; I216-I221 HydrophobicContact CG1-CD1 4.37Å; I216-L224 HydrophobicContact CD1-CD2 4.15Å; I216-S238 CarbonylContact C-O 3.35Å; I216-S238 WeakPolarHBondContact CG1-O 3.38Å; I216-S238 PolarHBondContact N-O 2.91Å; I216-L239 HydrophobicContact CD1-CD2 3.24Å; I216-L239 HydrophobicContact CG1-CD2 3.51Å; I216-N242 PolarHBondContact O-ND2 2.73Å
217	S	92.4	Very high	87.9	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.014	20%	0.204	C	C	.	.			trans	-62.8	156.8	-179.3	63	0	0	0	0	112.5	R177 Q178 D215 N219 S238 E240	R177-S217 CarbonylContact C-O 3.43Å; R177-S217 VanDerWaalsContact CA-O 3.23Å; R177-S217 WeakPolarHBondContact CA-O 3.12Å; R177-S217 WeakPolarHBondContact CG-OG 3.06Å; Q178-S217 PolarHBondContact N-O 2.82Å; D215-S217 WeakPolarHBondContact OD1-CB 3.45Å; D215-S217 PolarHBondContact OD1-N 2.73Å; D215-S217 PolarHBondContact OD1-OG 3.07Å; D215-S217 PolarHBondContact OD2-OG 3.02Å; S217-N219 VanDerWaalsContact C-N 3.31Å; S217-N219 PolarHBondContact O-N 2.63Å; S217-N219 PolarHBondContact O-ND2 3.31Å; S217-N219 VanDerWaalsContact O-ND2 3.09Å; S217-S238 PolarHBondContact N-O 3.01Å; S217-E240 CarbonylContact C-O 3.16Å; S217-E240 WeakPolarHBondContact CA-O 3.37Å; S217-E240 VanDerWaalsContact CB-O 3.24Å; S217-E240 WeakPolarHBondContact CB-O 3.46Å
218	F	93	Very high	88.1	Confident	81 Å²	81	45.6 Å²	45.6	36%	0.355	20%	0.202	S	C	.	.	S	Bend	trans	54.1	43.7	178.3	-60.3	-88	0	0	0	113.3	R177 Q178 E240	R177-F218 HydrophobicContact CG-CD2 4.46Å; Q178-F218 VanDerWaalsContact CA-O 3.26Å; Q178-F218 WeakPolarHBondContact CA-O 3.48Å; Q178-F218 HydrophobicContact CB-CB 4.24Å; F218-E240 HydrophobicContact CE2-CB 4.48Å; F218-E240 HydrophobicContact CE2-CG 4.26Å; F218-E240 HydrophobicContact CZ-CG 4.22Å; F218-E240 PolarHBondContact N-O 3.46Å
219	N	91.9	Very high	88.1	Confident	7 Å²	7	43.8 Å²	43.8	4%	0.037	19%	0.193	C	C	.	.	S	Bend	trans	-112	-168.5	172	-84	-83.3	0	0	0	110.4	L176 N179 V180 L181 I216 S217 I221 N242	L176-N219 PolarHBondContact O-ND2 2.99Å; N179-N219 VanDerWaalsContact CA-OD1 3.29Å; N179-N219 WeakPolarHBondContact CA-OD1 3.07Å; N179-N219 WeakPolarHBondContact CB-OD1 3.31Å; N179-N219 PolarHBondContact N-OD1 2.82Å; N179-N219 PolarHBondContact O-OD1 2.97Å; V180-N219 PolarHBondContact N-OD1 2.94Å; L181-N219 HydrophobicContact CB-CB 4.28Å; L181-N219 VanDerWaalsContact CB-OD1 3.29Å; L181-N219 WeakPolarHBondContact CB-OD1 3.33Å; L181-N219 WeakPolarHBondContact CG-OD1 3.47Å; L181-N219 PolarHBondContact N-OD1 2.95Å; I216-N219 PolarHBondContact O-ND2 2.89Å; S217-N219 VanDerWaalsContact C-N 3.31Å; S217-N219 PolarHBondContact O-N 2.63Å; S217-N219 PolarHBondContact O-ND2 3.31Å; S217-N219 VanDerWaalsContact O-ND2 3.09Å; N219-I221 HydrophobicContact CB-CD1 4.28Å; N219-I221 HydrophobicContact CB-CG1 4.16Å; N219-N242 VanDerWaalsContact CA-OD1 3.29Å; N219-N242 WeakPolarHBondContact CA-OD1 3.24Å; N219-N242 WeakPolarHBondContact CB-OD1 3.32Å; N219-N242 PolarHBondContact N-OD1 2.62Å; N219-N242 PolarHBondContact O-OD1 2.93Å
220	K	89.9	Confident	88	Confident	119 Å²	119	47.3 Å²	47.3	52%	0.517	21%	0.211	S	C	.	.			trans	-111.4	29.5	179.1	-61.6	-175.4	178	-178.9	0	112.1	V180 L181 T182 C222 N242	V180-K220 HydrophobicContact CB-CD 4.47Å; L181-K220 CarbonylContact O-C 3.56Å; L181-K220 VanDerWaalsContact O-CA 3.27Å; L181-K220 WeakPolarHBondContact O-CA 3.11Å; L181-K220 PolarHBondContact O-N 2.73Å; T182-K220 HydrophobicContact CG2-CB 4.06Å; K220-C222 PolarHBondContact O-N 3.08Å; K220-N242 PolarHBondContact N-OD1 2.86Å
221	I	88.1	Confident	88	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.182	C	C	.	.			trans	-76.9	117.7	-176.3	-58.1	170.9	0	0	0	109.3	L181 I216 N219 Q223 L224 N242 P243 L244	L181-I221 HydrophobicContact CB-CG1 4.47Å; L181-I221 WeakPolarHBondContact O-CG1 3.41Å; L181-I221 PolarHBondContact O-N 3.01Å; I216-I221 HydrophobicContact CB-CD1 4.14Å; I216-I221 HydrophobicContact CD1-CD1 3.63Å; I216-I221 HydrophobicContact CG1-CD1 4.37Å; N219-I221 HydrophobicContact CB-CD1 4.28Å; N219-I221 HydrophobicContact CB-CG1 4.16Å; I221-Q223 WeakPolarHBondContact CG2-O 3.28Å; I221-L224 HydrophobicContact CG2-CD2 4.03Å; I221-N242 HydrophobicContact CB-CB 4.43Å; I221-N242 WeakPolarHBondContact CB-OD1 3.5Å; I221-N242 PolarHBondContact N-OD1 2.93Å; I221-P243 CarbonylContact O-C 3.51Å; I221-P243 WeakPolarHBondContact O-CD 3.5Å; I221-L244 HydrophobicContact CB-CD2 4.47Å; I221-L244 HydrophobicContact CG2-CD2 3.96Å; I221-L244 WeakPolarHBondContact O-CD2 3.19Å
222	C	84.5	Confident	87.8	Confident	44 Å²	44	49.8 Å²	49.8	30%	0.297	22%	0.221	S	C	.	.			trans	-92	-24.4	178.7	-59.4	0	0	0	0	113.3	K220 P243 L244 V245 F246	K220-C222 PolarHBondContact O-N 3.08Å; C222-P243 WeakPolarHBondContact CA-O 3.23Å; C222-L244 WeakPolarHBondContact O-CA 3.36Å; C222-V245 PolarHBondContact O-N 3.37Å; C222-F246 PolarHBondContact O-N 3.5Å
223	Q	84	Confident	87.6	Confident	84 Å²	84	45 Å²	45	39%	0.393	21%	0.21	S	C	.	.	B	Isolated β-bridge	trans	-144.8	137	-176.1	-178	168.3	8.8	0	0	111.2	I221 F246	I221-Q223 WeakPolarHBondContact CG2-O 3.28Å; Q223-F246 CarbonylContact C-O 3.49Å; Q223-F246 WeakPolarHBondContact CA-O 3.38Å; Q223-F246 HydrophobicContact CG-CB 4.29Å; Q223-F246 HydrophobicContact CG-CD1 4.28Å
224	L	84.4	Confident	87.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.197	C	C	.	.			trans	-96.5	136.8	167	-64.5	-176.9	0	0	0	110.5	I216 I221 I228 L239 L244 F246 P247 I259	I216-L224 HydrophobicContact CD1-CD2 4.15Å; I221-L224 HydrophobicContact CG2-CD2 4.03Å; L224-I228 HydrophobicContact CB-CD1 4Å; L224-I228 HydrophobicContact CD1-CD1 4.42Å; L224-I228 HydrophobicContact CD2-CD1 3.78Å; L224-I228 HydrophobicContact CG-CD1 4.28Å; L224-L239 HydrophobicContact CD1-CD1 3.42Å; L224-L239 VanDerWaalsContact CD1-CD1 3.42Å; L224-L239 HydrophobicContact CD1-CD2 3.83Å; L224-L239 HydrophobicContact CD1-CG 4.29Å; L224-L239 HydrophobicContact CD2-CD2 4.25Å; L224-L244 HydrophobicContact CD2-CD2 4.36Å; L224-L244 HydrophobicContact CG-CD2 3.94Å; L224-F246 PolarHBondContact N-O 3.03Å; L224-P247 HydrophobicContact CD1-CG 4.17Å; L224-I259 HydrophobicContact CD1-CG2 4.38Å
225	D	82.2	Confident	87.3	Confident	39 Å²	39	45.4 Å²	45.4	21%	0.209	22%	0.22	C	C	.	.			trans	-70.4	142.7	172.6	-165.2	-34.1	0	0	0	110.4	Y186 D227 I228	Y186-D225 HydrophobicContact CD1-CB 3.65Å; Y186-D225 WeakPolarHBondContact CD1-OD2 3.47Å; Y186-D225 HydrophobicContact CE1-CB 3.23Å; D225-D227 PolarHBondContact O-N 3.16Å; D225-D227 VanDerWaalsContact O-N 3.16Å; D225-D227 PolarHBondContact OD1-N 2.84Å; D225-I228 PolarHBondContact O-N 2.88Å
226	T	82.7	Confident	87.1	Confident	14 Å²	14	47.9 Å²	47.9	9%	0.086	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-51.3	-28.9	168.6	48.1	0	0	0	0	113.5	I228 R229 E266 A267	T226-I228 PolarHBondContact O-N 3.16Å; T226-R229 VanDerWaalsContact O-CB 3.3Å; T226-R229 WeakPolarHBondContact O-CB 3.36Å; T226-R229 VanDerWaalsContact O-CD 3.24Å; T226-R229 WeakPolarHBondContact O-CD 3.47Å; T226-R229 WeakPolarHBondContact O-CG 3.36Å; T226-R229 PolarHBondContact O-N 2.8Å; T226-R229 VanDerWaalsContact O-N 3.17Å; T226-R229 PolarHBondContact O-NH1 3.04Å; T226-E266 HydrophobicContact CG2-CB 4.2Å; T226-E266 HydrophobicContact CG2-CG 3.83Å; T226-A267 HydrophobicContact CG2-CB 4.45Å
227	D	83.2	Confident	87	Confident	35 Å²	35	48.6 Å²	48.6	19%	0.187	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-69.3	-16.4	-177.8	-76.3	-7.3	0	0	0	114.4	L203 C207 D225 R229 L230	L203-D227 HydrophobicContact CD1-CB 4.17Å; C207-D227 VanDerWaalsContact SG-C 3.53Å; D225-D227 PolarHBondContact O-N 3.16Å; D225-D227 VanDerWaalsContact O-N 3.16Å; D225-D227 PolarHBondContact OD1-N 2.84Å; D227-R229 PolarHBondContact O-N 2.93Å; D227-R229 VanDerWaalsContact O-N 3.12Å; D227-R229 IonicContact OD1-NH1 3.48Å; D227-R229 PolarHBondContact OD1-NH1 2.98Å; D227-L230 WeakPolarHBondContact O-CB 3.27Å; D227-L230 PolarHBondContact O-N 2.81Å
228	I	85.3	Confident	86.9	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-57.5	-29.1	170.9	-63.8	-179	0	0	0	111	L184 L224 D225 T226 L230 M231 I237 F260 L263	L184-I228 HydrophobicContact CD1-CD1 4.15Å; L224-I228 HydrophobicContact CB-CD1 4Å; L224-I228 HydrophobicContact CD1-CD1 4.42Å; L224-I228 HydrophobicContact CD2-CD1 3.78Å; L224-I228 HydrophobicContact CG-CD1 4.28Å; D225-I228 PolarHBondContact O-N 2.88Å; T226-I228 PolarHBondContact O-N 3.16Å; I228-L230 PolarHBondContact O-N 3.12Å; I228-M231 HydrophobicContact CG2-SD 4.47Å; I228-M231 WeakPolarHBondContact O-CB 3.46Å; I228-M231 PolarHBondContact O-N 3Å; I228-I237 HydrophobicContact CG2-CD1 4.4Å; I228-F260 HydrophobicContact CG2-CE2 4.07Å; I228-F260 HydrophobicContact CG2-CZ 4.3Å; I228-F260 WeakPolarHBondContact O-CE1 3.36Å; I228-F260 WeakPolarHBondContact O-CZ 3.46Å; I228-L263 HydrophobicContact CB-CD1 3.97Å; I228-L263 HydrophobicContact CG2-CD1 4.3Å
229	R	81.7	Confident	86.7	Confident	60 Å²	60	46.9 Å²	46.9	23%	0.226	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-56.5	-23.3	174.7	84.4	-168.1	179.9	-77.6	0.2	113.6	T226 D227 M231 F260 L263 E264	T226-R229 VanDerWaalsContact O-CB 3.3Å; T226-R229 WeakPolarHBondContact O-CB 3.36Å; T226-R229 VanDerWaalsContact O-CD 3.24Å; T226-R229 WeakPolarHBondContact O-CD 3.47Å; T226-R229 WeakPolarHBondContact O-CG 3.36Å; T226-R229 PolarHBondContact O-N 2.8Å; T226-R229 VanDerWaalsContact O-N 3.17Å; T226-R229 PolarHBondContact O-NH1 3.04Å; D227-R229 PolarHBondContact O-N 2.93Å; D227-R229 VanDerWaalsContact O-N 3.12Å; D227-R229 IonicContact OD1-NH1 3.48Å; D227-R229 PolarHBondContact OD1-NH1 2.98Å; R229-M231 VanDerWaalsContact C-N 3.31Å; R229-F260 WeakPolarHBondContact O-CD1 3.39Å; R229-F260 VanDerWaalsContact O-CE1 3.23Å; R229-F260 WeakPolarHBondContact O-CE1 3.42Å; R229-L263 HydrophobicContact CB-CB 4.09Å; R229-E264 HydrophobicContact CB-CG 4.2Å; R229-E264 HydrophobicContact CG-CG 4.46Å
230	L	84.4	Confident	86.6	Confident	78 Å²	78	52.1 Å²	52.1	41%	0.408	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-82.3	-11.9	-178	-60.6	173.1	0	0	0	112.3	L203 D227 I228 R232	L203-L230 HydrophobicContact CD1-CB 4.04Å; L203-L230 HydrophobicContact CD1-CD1 3.31Å; L203-L230 HydrophobicContact CD1-CG 4.26Å; D227-L230 WeakPolarHBondContact O-CB 3.27Å; D227-L230 PolarHBondContact O-N 2.81Å; I228-L230 PolarHBondContact O-N 3.12Å; L230-R232 PolarHBondContact O-N 3.17Å
231	M	86.5	Confident	86.5	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.025	25%	0.253	C	S	.	.			trans	-76.9	69.2	176.7	-59	-178.7	75.4	0	0	111.1	F206 C207 L209 L211 I228 R229 S233 L234 R256 F260	F206-M231 HydrophobicContact CD1-SD 4.24Å; F206-M231 HydrophobicContact CE1-CE 4.28Å; F206-M231 HydrophobicContact CE1-SD 4.21Å; C207-M231 HydrophobicContact CB-CG 3.99Å; C207-M231 HydrophobicContact CB-SD 4.27Å; L209-M231 HydrophobicContact CB-CE 4.33Å; L211-M231 HydrophobicContact CB-CE 4.15Å; L211-M231 HydrophobicContact CD1-CE 3.94Å; L211-M231 HydrophobicContact CG-CE 4.1Å; I228-M231 HydrophobicContact CG2-SD 4.47Å; I228-M231 WeakPolarHBondContact O-CB 3.46Å; I228-M231 PolarHBondContact O-N 3Å; R229-M231 VanDerWaalsContact C-N 3.31Å; M231-S233 PolarHBondContact O-N 3.23Å; M231-L234 HydrophobicContact CB-CB 4.34Å; M231-L234 PolarHBondContact O-N 3.01Å; M231-R256 PolarHBondContact O-NH1 2.98Å; M231-R256 VanDerWaalsContact O-NH1 3.13Å; M231-R256 PolarHBondContact O-NH2 3.15Å; M231-F260 HydrophobicContact CB-CZ 4.35Å
232	R	86.1	Confident	86.4	Confident	215 Å²	215	49.2 Å²	49.2	81%	0.811	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.8	-178.3	-66.2	-172.6	179.5	-170.8	-0.3	114	L230 L234 R256	L230-R232 PolarHBondContact O-N 3.17Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-R256 PolarHBondContact O-NH2 2.92Å
233	S	88.2	Confident	86.6	Confident	45 Å²	45	50.5 Å²	50.5	32%	0.315	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-19.4	179	60.3	0	0	0	0	114.4	R210 L211 M231	R210-S233 VanDerWaalsContact CA-OG 3.23Å; R210-S233 WeakPolarHBondContact CA-OG 3.32Å; L211-S233 PolarHBondContact N-OG 3.13Å; L211-S233 CarbonylContact O-C 3.22Å; L211-S233 WeakPolarHBondContact O-CB 3.15Å; L211-S233 VanDerWaalsContact O-O 3.12Å; L211-S233 PolarHBondContact O-OG 2.83Å; M231-S233 PolarHBondContact O-N 3.23Å
234	L	89.3	Confident	86.6	Confident	5 Å²	5	47 Å²	47	3%	0.026	25%	0.248	C	C	.	.			trans	-72.2	134.3	-173.2	177.4	83	0	0	0	108.5	L211 C214 M231 R232 E236 I237 R256 F260	L211-L234 HydrophobicContact CB-CD1 3.85Å; L211-L234 WeakPolarHBondContact O-CA 3.41Å; L211-L234 PolarHBondContact O-N 3.35Å; C214-L234 HydrophobicContact CB-CD1 3.62Å; M231-L234 HydrophobicContact CB-CB 4.34Å; M231-L234 PolarHBondContact O-N 3.01Å; R232-L234 VanDerWaalsContact C-N 3.33Å; L234-E236 WeakPolarHBondContact CD1-O 3.3Å; L234-I237 HydrophobicContact CD2-CB 3.88Å; L234-I237 HydrophobicContact CD2-CD1 4.12Å; L234-I237 HydrophobicContact CD2-CG1 4.39Å; L234-I237 HydrophobicContact CD2-CG2 4.44Å; L234-R256 VanDerWaalsContact O-CD 3.31Å; L234-R256 WeakPolarHBondContact O-CD 3.31Å; L234-R256 PolarHBondContact O-NE 3Å; L234-R256 PolarHBondContact O-NH1 3.35Å; L234-R256 PolarHBondContact O-NH2 3.4Å; L234-R256 VanDerWaalsContact O-NH2 3.12Å; L234-F260 HydrophobicContact CD2-CZ 4.5Å
235	V	89.7	Confident	86.6	Confident	84 Å²	84	48.8 Å²	48.8	51%	0.509	26%	0.258	S	S	.	.			trans	-101.9	-45	-178.2	177.1	0	0	0	0	108.1	R212 R256	R212-V235 HydrophobicContact CB-CG2 4.32Å; R212-V235 HydrophobicContact CG-CG2 4.41Å; R212-V235 WeakPolarHBondContact O-CA 3.4Å; R212-V235 WeakPolarHBondContact O-CB 3.22Å; R212-V235 PolarHBondContact O-N 2.88Å; V235-R256 WeakPolarHBondContact O-CD 3.36Å
236	E	89.5	Confident	86.6	Confident	85 Å²	85	49 Å²	49	40%	0.397	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	137.5	-176.2	-168.6	174.1	173.8	0	0	111	R212 Y213 C214 L234	R212-E236 PolarHBondContact O-N 3.19Å; R212-E236 VanDerWaalsContact O-N 3.13Å; Y213-E236 HydrophobicContact CD1-CB 3.7Å; Y213-E236 HydrophobicContact CE1-CB 3.99Å; Y213-E236 WeakPolarHBondContact CE1-OE2 3.41Å; C214-E236 PolarHBondContact N-O 3.32Å; C214-E236 VanDerWaalsContact N-O 3.13Å; L234-E236 WeakPolarHBondContact CD1-O 3.3Å
237	I	90.3	Very high	86.5	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.082	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	120.7	173.4	-171.6	172.9	0	0	0	110.1	C214 I228 L234 L239 R256 I259	C214-I237 HydrophobicContact CB-CG1 4.49Å; C214-I237 VanDerWaalsContact O-CA 3.3Å; C214-I237 WeakPolarHBondContact O-CA 3.37Å; I228-I237 HydrophobicContact CG2-CD1 4.4Å; L234-I237 HydrophobicContact CD2-CB 3.88Å; L234-I237 HydrophobicContact CD2-CD1 4.12Å; L234-I237 HydrophobicContact CD2-CG1 4.39Å; L234-I237 HydrophobicContact CD2-CG2 4.44Å; I237-L239 HydrophobicContact CD1-CD2 3.94Å; I237-L239 HydrophobicContact CD1-CG 4.44Å; I237-L239 HydrophobicContact CG1-CD2 3.97Å; I237-L239 HydrophobicContact CG1-CG 4.21Å; I237-R256 HydrophobicContact CG2-CB 4.25Å; I237-I259 HydrophobicContact CG2-CD1 3.74Å
238	S	90.6	Very high	86.3	Confident	37 Å²	37	50.7 Å²	50.7	26%	0.259	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	118.1	179.2	-65.5	0	0	0	0	110	C214 D215 I216 S217	C214-S238 PolarHBondContact O-N 2.96Å; D215-S238 WeakPolarHBondContact OD1-CB 3.3Å; I216-S238 CarbonylContact C-O 3.35Å; I216-S238 WeakPolarHBondContact CG1-O 3.38Å; I216-S238 PolarHBondContact N-O 2.91Å; S217-S238 PolarHBondContact N-O 3.01Å
239	L	89.1	Confident	85.9	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.052	28%	0.282	C	S	.	.			trans	-116.6	-0.1	-175.4	-63.8	179.5	0	0	0	113.3	I216 L224 I237 N242 L244 C252 I259	I216-L239 HydrophobicContact CD1-CD2 3.24Å; I216-L239 HydrophobicContact CG1-CD2 3.51Å; L224-L239 HydrophobicContact CD1-CD1 3.42Å; L224-L239 VanDerWaalsContact CD1-CD1 3.42Å; L224-L239 HydrophobicContact CD1-CD2 3.83Å; L224-L239 HydrophobicContact CD1-CG 4.29Å; L224-L239 HydrophobicContact CD2-CD2 4.25Å; I237-L239 HydrophobicContact CD1-CD2 3.94Å; I237-L239 HydrophobicContact CD1-CG 4.44Å; I237-L239 HydrophobicContact CG1-CD2 3.97Å; I237-L239 HydrophobicContact CG1-CG 4.21Å; L239-N242 PolarHBondContact O-ND2 3.26Å; L239-N242 VanDerWaalsContact O-ND2 3.09Å; L239-L244 HydrophobicContact CB-CD1 3.87Å; L239-L244 HydrophobicContact CD1-CD1 4.11Å; L239-L244 HydrophobicContact CG-CD1 4.43Å; L239-C252 HydrophobicContact CB-CB 4.19Å; L239-C252 HydrophobicContact CD1-CB 3.81Å; L239-I259 HydrophobicContact CD1-CD1 3.46Å; L239-I259 VanDerWaalsContact CD1-CD1 3.46Å; L239-I259 HydrophobicContact CD1-CG1 4.07Å; L239-I259 HydrophobicContact CD1-CG2 4.42Å; L239-I259 HydrophobicContact CG-CD1 4.33Å
240	E	88.7	Confident	85.8	Confident	118 Å²	118	58.6 Å²	58.6	55%	0.551	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	148.4	-174.6	-171.8	178.1	-176.4	0	0	111.9	S217 F218 N242	S217-E240 CarbonylContact C-O 3.16Å; S217-E240 WeakPolarHBondContact CA-O 3.37Å; S217-E240 VanDerWaalsContact CB-O 3.24Å; S217-E240 WeakPolarHBondContact CB-O 3.46Å; F218-E240 HydrophobicContact CE2-CB 4.48Å; F218-E240 HydrophobicContact CE2-CG 4.26Å; F218-E240 HydrophobicContact CZ-CG 4.22Å; F218-E240 PolarHBondContact N-O 3.46Å; E240-N242 PolarHBondContact O-N 3.09Å; E240-N242 PolarHBondContact O-ND2 3.37Å
241	G	87.5	Confident	85.7	Confident	45 Å²	45	57.1 Å²	57.1	46%	0.464	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	14	174.1	0	0	0	0	0	115.3
242	N	87.7	Confident	85.3	Confident	13 Å²	13	57.3 Å²	57.3	7%	0.07	30%	0.303	C	S	.	.	S	Bend	trans	-99.5	145.1	169.6	-76.5	-85.3	0	0	0	111.3	I216 N219 K220 I221 L239 E240 L244	I216-N242 PolarHBondContact O-ND2 2.73Å; N219-N242 VanDerWaalsContact CA-OD1 3.29Å; N219-N242 WeakPolarHBondContact CA-OD1 3.24Å; N219-N242 WeakPolarHBondContact CB-OD1 3.32Å; N219-N242 PolarHBondContact N-OD1 2.62Å; N219-N242 PolarHBondContact O-OD1 2.93Å; K220-N242 PolarHBondContact N-OD1 2.86Å; I221-N242 HydrophobicContact CB-CB 4.43Å; I221-N242 WeakPolarHBondContact CB-OD1 3.5Å; I221-N242 PolarHBondContact N-OD1 2.93Å; L239-N242 PolarHBondContact O-ND2 3.26Å; L239-N242 VanDerWaalsContact O-ND2 3.09Å; E240-N242 PolarHBondContact O-N 3.09Å; E240-N242 PolarHBondContact O-ND2 3.37Å; N242-L244 HydrophobicContact CB-CD1 4.22Å; N242-L244 HydrophobicContact CB-CG 3.8Å; N242-L244 PolarHBondContact O-N 2.99Å
243	P	87.8	Confident	84.9	Confident	70 Å²	70	52.9 Å²	52.9	46%	0.455	30%	0.296	S	S	.	.			trans	-74.7	49.5	175.3	33.9	-37.3	0	0	0	112.5	I221 C222 V245	I221-P243 CarbonylContact O-C 3.51Å; I221-P243 WeakPolarHBondContact O-CD 3.5Å; C222-P243 WeakPolarHBondContact CA-O 3.23Å; P243-V245 PolarHBondContact O-N 3.28Å
244	L	84.6	Confident	84.5	Confident	12 Å²	12	58.7 Å²	58.7	6%	0.063	31%	0.311	C	S	.	.			trans	-67.6	112.8	-173.7	-72.9	171.2	0	0	0	112.3	I221 C222 L224 L239 N242 P247 A249	I221-L244 HydrophobicContact CB-CD2 4.47Å; I221-L244 HydrophobicContact CG2-CD2 3.96Å; I221-L244 WeakPolarHBondContact O-CD2 3.19Å; C222-L244 WeakPolarHBondContact O-CA 3.36Å; L224-L244 HydrophobicContact CD2-CD2 4.36Å; L224-L244 HydrophobicContact CG-CD2 3.94Å; L239-L244 HydrophobicContact CB-CD1 3.87Å; L239-L244 HydrophobicContact CD1-CD1 4.11Å; L239-L244 HydrophobicContact CG-CD1 4.43Å; N242-L244 HydrophobicContact CB-CD1 4.22Å; N242-L244 HydrophobicContact CB-CG 3.8Å; N242-L244 PolarHBondContact O-N 2.99Å; L244-P247 WeakPolarHBondContact CB-O 3.31Å; L244-A249 HydrophobicContact CB-CB 4.46Å
245	V	83.7	Confident	84.2	Confident	36 Å²	36	60 Å²	60	22%	0.218	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-35.3	168.8	-175.9	0	0	0	0	110.4	C222 P243 L335	C222-V245 PolarHBondContact O-N 3.37Å; P243-V245 PolarHBondContact O-N 3.28Å; V245-L335 HydrophobicContact CG1-CD1 4.13Å; V245-L335 HydrophobicContact CG1-CD2 4.18Å; V245-L335 HydrophobicContact CG1-CG 4.07Å
246	F	81.7	Confident	84	Confident	45 Å²	45	57.7 Å²	57.7	20%	0.197	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-146.4	124.8	178.3	-179	-91.5	0	0	0	112.5	C222 Q223 L224 V262 L263 E266	C222-F246 PolarHBondContact O-N 3.5Å; Q223-F246 CarbonylContact C-O 3.49Å; Q223-F246 WeakPolarHBondContact CA-O 3.38Å; Q223-F246 HydrophobicContact CG-CB 4.29Å; Q223-F246 HydrophobicContact CG-CD1 4.28Å; L224-F246 PolarHBondContact N-O 3.03Å; F246-V262 HydrophobicContact CE2-CG1 4.29Å; F246-V262 HydrophobicContact CZ-CG1 4.39Å; F246-L263 HydrophobicContact CD1-CD2 4.47Å; F246-L263 HydrophobicContact CE1-CD2 3.61Å; F246-L263 HydrophobicContact CZ-CD2 4.14Å; F246-E266 HydrophobicContact CE1-CB 4.38Å; F246-E266 HydrophobicContact CE1-CG 4.05Å; F246-E266 HydrophobicContact CE2-CB 4.22Å; F246-E266 HydrophobicContact CE2-CG 4.14Å; F246-E266 HydrophobicContact CZ-CB 3.51Å; F246-E266 HydrophobicContact CZ-CG 3.46Å; F246-E266 VanDerWaalsContact CZ-CG 3.46Å
247	P	80.4	Confident	83.8	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	cis	-62.8	151.7	-14.3	23.2	-26.7	0	0	0	111.1	L224 L244 A249 I259 V262 L263	L224-P247 HydrophobicContact CD1-CG 4.17Å; L244-P247 WeakPolarHBondContact CB-O 3.31Å; P247-A249 PolarHBondContact O-N 3.48Å; P247-I259 HydrophobicContact CG-CG2 4.21Å; P247-V262 HydrophobicContact CB-CB 4.46Å; P247-V262 HydrophobicContact CB-CG1 3.89Å; P247-L263 HydrophobicContact CG-CD2 4.5Å
248	L	79.2	Confident	83.6	Confident	83 Å²	83	62.6 Å²	62.6	44%	0.435	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	134.8	-178.8	-67.6	170.9	0	0	0	110.8	K250 L251 C252	L248-K250 PolarHBondContact O-N 3.31Å; L248-K250 VanDerWaalsContact O-N 3.08Å; L248-L251 HydrophobicContact CB-CD1 4.24Å; L248-L251 WeakPolarHBondContact O-CB 3.12Å; L248-L251 PolarHBondContact O-N 3.18Å; L248-C252 PolarHBondContact O-N 2.96Å; L248-C252 PolarHBondContact O-SG 3.06Å
249	A	78.2	Confident	83.5	Confident	42 Å²	42	60.9 Å²	60.9	35%	0.347	32%	0.321	S	S	.	.	H	α-helix	trans	-50.2	-39.9	-178	0	0	0	0	0	113.5	L244 P247 L251 C252 N253	L244-A249 HydrophobicContact CB-CB 4.46Å; P247-A249 PolarHBondContact O-N 3.48Å; A249-L251 VanDerWaalsContact C-N 3.25Å; A249-L251 PolarHBondContact O-N 2.88Å; A249-C252 WeakPolarHBondContact O-CB 3.3Å; A249-C252 PolarHBondContact O-N 3.27Å; A249-C252 VanDerWaalsContact O-N 3.07Å; A249-N253 PolarHBondContact O-N 2.78Å; A249-N253 PolarHBondContact O-OD1 3.44Å
250	K	79.3	Confident	83.4	Confident	185 Å²	185	61 Å²	61	80%	0.804	32%	0.322	S	S	*	.	H	α-helix	trans	-59.8	-31.1	177.5	-65.2	-175.9	-178.5	178.9	0	113.9	L248	L248-K250 PolarHBondContact O-N 3.31Å; L248-K250 VanDerWaalsContact O-N 3.08Å
251	L	80.7	Confident	83.3	Confident	48 Å²	48	62.9 Å²	62.9	25%	0.251	33%	0.328	S	S	.	.	H	α-helix	trans	-78.4	-35.7	176.3	-69.6	168.3	0	0	0	111.2	L248 A249 N253 R254 V262	L248-L251 HydrophobicContact CB-CD1 4.24Å; L248-L251 WeakPolarHBondContact O-CB 3.12Å; L248-L251 PolarHBondContact O-N 3.18Å; A249-L251 VanDerWaalsContact C-N 3.25Å; A249-L251 PolarHBondContact O-N 2.88Å; L251-N253 PolarHBondContact O-N 3.3Å; L251-R254 WeakPolarHBondContact O-CB 3.34Å; L251-R254 PolarHBondContact O-N 2.85Å; L251-R254 VanDerWaalsContact O-N 3.11Å; L251-V262 HydrophobicContact CD1-CG2 4.21Å
252	C	79.8	Confident	83.3	Confident	8 Å²	8	62.9 Å²	62.9	5%	0.054	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-35.3	179.6	-61.2	0	0	0	0	112.5	L239 L248 A249 R254 G255 I259	L239-C252 HydrophobicContact CB-CB 4.19Å; L239-C252 HydrophobicContact CD1-CB 3.81Å; L248-C252 PolarHBondContact O-N 2.96Å; L248-C252 PolarHBondContact O-SG 3.06Å; A249-C252 WeakPolarHBondContact O-CB 3.3Å; A249-C252 PolarHBondContact O-N 3.27Å; A249-C252 VanDerWaalsContact O-N 3.07Å; C252-R254 PolarHBondContact O-N 3.36Å; C252-G255 PolarHBondContact O-N 3.47Å; C252-G255 VanDerWaalsContact O-N 3.07Å; C252-I259 HydrophobicContact CB-CD1 4.32Å; C252-I259 HydrophobicContact CB-CG1 4.25Å
253	N	77.7	Confident	83.2	Confident	123 Å²	123	62.2 Å²	62.2	66%	0.658	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.5	178.4	-65.4	-1.1	0	0	0	113.9	A249 L251 G255	A249-N253 PolarHBondContact O-N 2.78Å; A249-N253 PolarHBondContact O-OD1 3.44Å; L251-N253 PolarHBondContact O-N 3.3Å; N253-G255 PolarHBondContact O-N 2.8Å
254	R	79.6	Confident	83.1	Confident	167 Å²	167	63.6 Å²	63.6	63%	0.63	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	5.7	174.8	-58.9	-172.2	176	-176.9	-0.9	113.5	L251 C252 H258	L251-R254 WeakPolarHBondContact O-CB 3.34Å; L251-R254 PolarHBondContact O-N 2.85Å; L251-R254 VanDerWaalsContact O-N 3.11Å; C252-R254 PolarHBondContact O-N 3.36Å; R254-H258 HydrophobicContact CB-CB 3.88Å; R254-H258 VanDerWaalsContact CB-CG 3.45Å; R254-H258 WeakPolarHBondContact CB-ND1 3.39Å; R254-H258 PolarHBondContact O-ND1 3.01Å
255	G	82.2	Confident	83.2	Confident	31 Å²	31	65.1 Å²	65.1	32%	0.32	33%	0.334	S	S	.	.			trans	89.1	177.6	175.9	0	0	0	0	0	114.5	C252 N253 D257 H258 I259	C252-G255 PolarHBondContact O-N 3.47Å; C252-G255 VanDerWaalsContact O-N 3.07Å; N253-G255 PolarHBondContact O-N 2.8Å; G255-D257 PolarHBondContact O-N 3.17Å; G255-H258 PolarHBondContact O-N 3.37Å; G255-I259 PolarHBondContact O-N 2.9Å
256	R	86.7	Confident	83.2	Confident	36 Å²	36	66.1 Å²	66.1	14%	0.136	34%	0.337	C	S	.	.	H	α-helix	trans	-49.6	-49.9	-172.6	177.2	-164.7	157.8	80.8	-8.7	113.7	M231 R232 L234 V235 I237 H258 I259 F260	M231-R256 PolarHBondContact O-NH1 2.98Å; M231-R256 VanDerWaalsContact O-NH1 3.13Å; M231-R256 PolarHBondContact O-NH2 3.15Å; R232-R256 PolarHBondContact O-NH2 2.92Å; L234-R256 VanDerWaalsContact O-CD 3.31Å; L234-R256 WeakPolarHBondContact O-CD 3.31Å; L234-R256 PolarHBondContact O-NE 3Å; L234-R256 PolarHBondContact O-NH1 3.35Å; L234-R256 PolarHBondContact O-NH2 3.4Å; L234-R256 VanDerWaalsContact O-NH2 3.12Å; V235-R256 WeakPolarHBondContact O-CD 3.36Å; I237-R256 HydrophobicContact CG2-CB 4.25Å; R256-H258 VanDerWaalsContact C-N 3.27Å; R256-H258 PolarHBondContact O-N 3.32Å; R256-I259 WeakPolarHBondContact O-CB 3.3Å; R256-I259 PolarHBondContact O-N 2.98Å; R256-I259 VanDerWaalsContact O-N 3.1Å; R256-F260 HydrophobicContact CG-CD2 3.85Å; R256-F260 HydrophobicContact CG-CE2 3.93Å; R256-F260 HydrophobicContact CG-CG 4.47Å; R256-F260 WeakPolarHBondContact O-CD2 3.32Å; R256-F260 PolarHBondContact O-N 2.89Å
257	D	85.1	Confident	83.1	Confident	126 Å²	126	64.6 Å²	64.6	67%	0.674	33%	0.332	S	S	*	.	H	α-helix	trans	-63	-35.7	-171.7	-64.1	-26.2	0	0	0	112.3	G255 K261	G255-D257 PolarHBondContact O-N 3.17Å; D257-K261 VanDerWaalsContact O-CB 3.27Å; D257-K261 WeakPolarHBondContact O-CB 3.14Å; D257-K261 PolarHBondContact O-N 3.03Å
258	H	86	Confident	83.2	Confident	78 Å²	78	68.2 Å²	68.2	36%	0.361	36%	0.358	S	S	.	.	H	α-helix	trans	-68.3	-43.1	175.3	-70.5	87.8	0	0	0	111.6	R254 G255 R256 F260 K261 V262	R254-H258 HydrophobicContact CB-CB 3.88Å; R254-H258 VanDerWaalsContact CB-CG 3.45Å; R254-H258 WeakPolarHBondContact CB-ND1 3.39Å; R254-H258 PolarHBondContact O-ND1 3.01Å; G255-H258 PolarHBondContact O-N 3.37Å; R256-H258 VanDerWaalsContact C-N 3.27Å; R256-H258 PolarHBondContact O-N 3.32Å; H258-F260 VanDerWaalsContact C-N 3.34Å; H258-K261 PolarHBondContact O-N 2.89Å; H258-V262 VanDerWaalsContact O-CG2 3.26Å; H258-V262 WeakPolarHBondContact O-CG2 3.3Å; H258-V262 PolarHBondContact O-N 3.32Å
259	I	87	Confident	83.1	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-58.5	-49.9	175.3	-63.4	157.3	0	0	0	109.4	L224 I237 L239 P247 C252 G255 R256 K261 V262 L263	L224-I259 HydrophobicContact CD1-CG2 4.38Å; I237-I259 HydrophobicContact CG2-CD1 3.74Å; L239-I259 HydrophobicContact CD1-CD1 3.46Å; L239-I259 VanDerWaalsContact CD1-CD1 3.46Å; L239-I259 HydrophobicContact CD1-CG1 4.07Å; L239-I259 HydrophobicContact CD1-CG2 4.42Å; L239-I259 HydrophobicContact CG-CD1 4.33Å; P247-I259 HydrophobicContact CG-CG2 4.21Å; C252-I259 HydrophobicContact CB-CD1 4.32Å; C252-I259 HydrophobicContact CB-CG1 4.25Å; G255-I259 PolarHBondContact O-N 2.9Å; R256-I259 WeakPolarHBondContact O-CB 3.3Å; R256-I259 PolarHBondContact O-N 2.98Å; R256-I259 VanDerWaalsContact O-N 3.1Å; I259-K261 PolarHBondContact O-N 2.93Å; I259-V262 PolarHBondContact O-N 3.38Å; I259-L263 HydrophobicContact CG2-CD1 3.93Å; I259-L263 HydrophobicContact CG2-CG 4.38Å; I259-L263 VanDerWaalsContact O-CG 3.3Å; I259-L263 WeakPolarHBondContact O-CG 3.13Å; I259-L263 PolarHBondContact O-N 2.85Å
260	F	87.5	Confident	82.8	Confident	14 Å²	14	67.2 Å²	67.2	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-63.2	-44.7	-178.1	-86.3	-126.3	0	0	0	111.5	I228 R229 M231 L234 R256 H258 V262 L263 E264	I228-F260 HydrophobicContact CG2-CE2 4.07Å; I228-F260 HydrophobicContact CG2-CZ 4.3Å; I228-F260 WeakPolarHBondContact O-CE1 3.36Å; I228-F260 WeakPolarHBondContact O-CZ 3.46Å; R229-F260 WeakPolarHBondContact O-CD1 3.39Å; R229-F260 VanDerWaalsContact O-CE1 3.23Å; R229-F260 WeakPolarHBondContact O-CE1 3.42Å; M231-F260 HydrophobicContact CB-CZ 4.35Å; L234-F260 HydrophobicContact CD2-CZ 4.5Å; R256-F260 HydrophobicContact CG-CD2 3.85Å; R256-F260 HydrophobicContact CG-CE2 3.93Å; R256-F260 HydrophobicContact CG-CG 4.47Å; R256-F260 WeakPolarHBondContact O-CD2 3.32Å; R256-F260 PolarHBondContact O-N 2.89Å; H258-F260 VanDerWaalsContact C-N 3.34Å; F260-V262 VanDerWaalsContact C-N 3.31Å; F260-V262 PolarHBondContact O-N 3Å; F260-L263 PolarHBondContact O-N 2.83Å; F260-E264 WeakPolarHBondContact O-CB 3.27Å; F260-E264 VanDerWaalsContact O-CG 3.32Å; F260-E264 WeakPolarHBondContact O-CG 3.26Å; F260-E264 PolarHBondContact O-N 2.93Å
261	K	86.9	Confident	82.2	Confident	157 Å²	157	61 Å²	61	68%	0.683	33%	0.328	S	S	*	.	H	α-helix	trans	-59.3	-39.9	176.3	-174.4	175	-178	175.8	0	112.6	D257 H258 I259 G265	D257-K261 VanDerWaalsContact O-CB 3.27Å; D257-K261 WeakPolarHBondContact O-CB 3.14Å; D257-K261 PolarHBondContact O-N 3.03Å; H258-K261 PolarHBondContact O-N 2.89Å; I259-K261 PolarHBondContact O-N 2.93Å; K261-G265 PolarHBondContact O-N 2.99Å
262	V	87.1	Confident	81.5	Confident	44 Å²	44	67.4 Å²	67.4	27%	0.267	35%	0.349	S	S	.	.	H	α-helix	trans	-68	-44.9	176.6	174	0	0	0	0	110.9	F246 P247 L251 H258 I259 F260 E264 G265 E266	F246-V262 HydrophobicContact CE2-CG1 4.29Å; F246-V262 HydrophobicContact CZ-CG1 4.39Å; P247-V262 HydrophobicContact CB-CB 4.46Å; P247-V262 HydrophobicContact CB-CG1 3.89Å; L251-V262 HydrophobicContact CD1-CG2 4.21Å; H258-V262 VanDerWaalsContact O-CG2 3.26Å; H258-V262 WeakPolarHBondContact O-CG2 3.3Å; H258-V262 PolarHBondContact O-N 3.32Å; I259-V262 PolarHBondContact O-N 3.38Å; F260-V262 VanDerWaalsContact C-N 3.31Å; F260-V262 PolarHBondContact O-N 3Å; V262-E264 PolarHBondContact O-N 3.38Å; V262-G265 PolarHBondContact O-N 2.89Å; V262-E266 PolarHBondContact O-N 3.49Å
263	L	86.5	Confident	81.1	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-65.5	-36.5	177.7	-65.8	178.5	0	0	0	112.4	I228 R229 F246 P247 I259 F260 A267	I228-L263 HydrophobicContact CB-CD1 3.97Å; I228-L263 HydrophobicContact CG2-CD1 4.3Å; R229-L263 HydrophobicContact CB-CB 4.09Å; F246-L263 HydrophobicContact CD1-CD2 4.47Å; F246-L263 HydrophobicContact CE1-CD2 3.61Å; F246-L263 HydrophobicContact CZ-CD2 4.14Å; P247-L263 HydrophobicContact CG-CD2 4.5Å; I259-L263 HydrophobicContact CG2-CD1 3.93Å; I259-L263 HydrophobicContact CG2-CG 4.38Å; I259-L263 VanDerWaalsContact O-CG 3.3Å; I259-L263 WeakPolarHBondContact O-CG 3.13Å; I259-L263 PolarHBondContact O-N 2.85Å; F260-L263 PolarHBondContact O-N 2.83Å; L263-A267 WeakPolarHBondContact O-CB 3.49Å; L263-A267 PolarHBondContact O-N 3.26Å
264	E	86.2	Confident	80.5	Confident	99 Å²	99	74.2 Å²	74.2	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-65.5	-42.2	172.5	-77.5	179.3	177.9	0	0	112.1	R229 F260 V262 A267 S268	R229-E264 HydrophobicContact CB-CG 4.2Å; R229-E264 HydrophobicContact CG-CG 4.46Å; F260-E264 WeakPolarHBondContact O-CB 3.27Å; F260-E264 VanDerWaalsContact O-CG 3.32Å; F260-E264 WeakPolarHBondContact O-CG 3.26Å; F260-E264 PolarHBondContact O-N 2.93Å; V262-E264 PolarHBondContact O-N 3.38Å; E264-A267 PolarHBondContact O-N 2.98Å; E264-S268 VanDerWaalsContact O-CB 3.3Å; E264-S268 WeakPolarHBondContact O-CB 3.26Å; E264-S268 PolarHBondContact O-N 3.41Å; E264-S268 PolarHBondContact O-OG 3.36Å
265	G	84.9	Confident	79.6	Confident	44 Å²	44	74.9 Å²	74.9	45%	0.454	37%	0.371	S	S	.	.	H	α-helix	trans	-60.2	-45.3	174.7	0	0	0	0	0	112.2	K261 V262 S268 G269	K261-G265 PolarHBondContact O-N 2.99Å; V262-G265 PolarHBondContact O-N 2.89Å; G265-S268 PolarHBondContact O-N 3.49Å; G265-G269 PolarHBondContact O-N 2.87Å
266	E	84.2	Confident	78.6	Confident	57 Å²	57	78.3 Å²	78.3	27%	0.266	38%	0.381	S	S	.	.	H	α-helix	trans	-65.2	-43.9	176.4	179.3	67.3	-166.5	0	0	112.1	T226 F246 V262 S268 G269 R270	T226-E266 HydrophobicContact CG2-CB 4.2Å; T226-E266 HydrophobicContact CG2-CG 3.83Å; F246-E266 HydrophobicContact CE1-CB 4.38Å; F246-E266 HydrophobicContact CE1-CG 4.05Å; F246-E266 HydrophobicContact CE2-CB 4.22Å; F246-E266 HydrophobicContact CE2-CG 4.14Å; F246-E266 HydrophobicContact CZ-CB 3.51Å; F246-E266 HydrophobicContact CZ-CG 3.46Å; F246-E266 VanDerWaalsContact CZ-CG 3.46Å; V262-E266 PolarHBondContact O-N 3.49Å; E266-S268 VanDerWaalsContact C-N 3.33Å; E266-S268 PolarHBondContact O-N 3.38Å; E266-G269 PolarHBondContact O-N 2.75Å; E266-R270 WeakPolarHBondContact O-CB 3.23Å; E266-R270 VanDerWaalsContact O-CG 3.31Å; E266-R270 WeakPolarHBondContact O-CG 3.36Å; E266-R270 PolarHBondContact O-N 3.43Å; E266-R270 IonicContact OE1-CZ 2.66Å; E266-R270 IonicContact OE1-NE 3.53Å; E266-R270 PolarHBondContact OE1-NE 3.37Å; E266-R270 IonicContact OE1-NH2 3.07Å; E266-R270 PolarHBondContact OE1-NH2 3.42Å
267	A	80.7	Confident	77.6	Confident	12 Å²	12	79.2 Å²	79.2	10%	0.099	39%	0.393	C	S	.	.	H	α-helix	trans	-62.7	-40.2	176.8	0	0	0	0	0	112.2	T226 L263 E264 S271	T226-A267 HydrophobicContact CG2-CB 4.45Å; L263-A267 WeakPolarHBondContact O-CB 3.49Å; L263-A267 PolarHBondContact O-N 3.26Å; E264-A267 PolarHBondContact O-N 2.98Å; A267-S271 PolarHBondContact O-N 3.4Å; A267-S271 VanDerWaalsContact O-N 3.08Å; A267-S271 PolarHBondContact O-OG 2.93Å
268	S	81.2	Confident	76.7	Confident	78 Å²	78	75.2 Å²	75.2	55%	0.545	38%	0.378	S	S	.	.	H	α-helix	trans	-69.1	-41.6	176.7	-57.7	0	0	0	0	111.5	E264 G265 E266 S271 R272	E264-S268 VanDerWaalsContact O-CB 3.3Å; E264-S268 WeakPolarHBondContact O-CB 3.26Å; E264-S268 PolarHBondContact O-N 3.41Å; E264-S268 PolarHBondContact O-OG 3.36Å; G265-S268 PolarHBondContact O-N 3.49Å; E266-S268 VanDerWaalsContact C-N 3.33Å; E266-S268 PolarHBondContact O-N 3.38Å; S268-S271 PolarHBondContact O-N 3.2Å; S268-R272 PolarHBondContact O-N 3.45Å
269	G	76.8	Confident	75.7	Confident	30 Å²	30	76.3 Å²	76.3	31%	0.309	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-43.9	175.6	0	0	0	0	0	112.5	G265 E266 R272 R273	G265-G269 PolarHBondContact O-N 2.87Å; E266-G269 PolarHBondContact O-N 2.75Å; G269-R272 PolarHBondContact O-N 3.29Å; G269-R273 WeakPolarHBondContact O-CG 3.39Å; G269-R273 PolarHBondContact O-N 2.85Å
270	R	71.7	Confident	74.6	Confident	74 Å²	74	81.2 Å²	81.2	28%	0.279	41%	0.412	S	S	.	.	H	α-helix	trans	-60.5	-44.6	173.8	-74.9	176.6	-175.5	-166.9	-1.8	112	E266 R272 R273 Q274	E266-R270 WeakPolarHBondContact O-CB 3.23Å; E266-R270 VanDerWaalsContact O-CG 3.31Å; E266-R270 WeakPolarHBondContact O-CG 3.36Å; E266-R270 PolarHBondContact O-N 3.43Å; E266-R270 IonicContact OE1-CZ 2.66Å; E266-R270 IonicContact OE1-NE 3.53Å; E266-R270 PolarHBondContact OE1-NE 3.37Å; E266-R270 IonicContact OE1-NH2 3.07Å; E266-R270 PolarHBondContact OE1-NH2 3.42Å; R270-R272 VanDerWaalsContact C-N 3.33Å; R270-R272 PolarHBondContact O-N 2.94Å; R270-R273 PolarHBondContact O-N 3.33Å; R270-Q274 WeakPolarHBondContact O-CB 3.34Å; R270-Q274 WeakPolarHBondContact O-CG 3.36Å; R270-Q274 PolarHBondContact O-N 3.44Å
271	S	67.4	Low	73.3	Confident	53 Å²	53	87 Å²	87	37%	0.371	44%	0.439	S	S	.	.	H	α-helix	trans	-62.4	-40.8	177.4	-57.8	0	0	0	0	111.6	A267 S268 Q274 R275	A267-S271 PolarHBondContact O-N 3.4Å; A267-S271 VanDerWaalsContact O-N 3.08Å; A267-S271 PolarHBondContact O-OG 2.93Å; S268-S271 PolarHBondContact O-N 3.2Å; S271-Q274 PolarHBondContact O-N 3.42Å; S271-R275 WeakPolarHBondContact O-CG 3.5Å; S271-R275 PolarHBondContact O-N 2.96Å
272	R	66.8	Low	72.2	Confident	184 Å²	184	84.1 Å²	84.1	69%	0.694	43%	0.434	S	S	*	.	H	α-helix	trans	-66.6	-42.3	175.8	-169.4	177.1	179.9	-178.9	0.2	112.1	S268 G269 R270 Q274 R275 L276	S268-R272 PolarHBondContact O-N 3.45Å; G269-R272 PolarHBondContact O-N 3.29Å; R270-R272 VanDerWaalsContact C-N 3.33Å; R270-R272 PolarHBondContact O-N 2.94Å; R272-Q274 VanDerWaalsContact C-N 3.35Å; R272-R275 PolarHBondContact O-N 3.16Å; R272-L276 HydrophobicContact CG-CD1 4.23Å; R272-L276 VanDerWaalsContact O-CG 3.31Å; R272-L276 WeakPolarHBondContact O-CG 3.36Å; R272-L276 PolarHBondContact O-N 2.99Å
273	R	71.4	Confident	70.9	Confident	181 Å²	181	85.4 Å²	85.4	68%	0.683	45%	0.446	S	S	*	.	H	α-helix	trans	-62.9	-40.4	175.1	-74.1	179.5	-177.1	171.4	2.7	112	G269 R270 L276 S277	G269-R273 WeakPolarHBondContact O-CG 3.39Å; G269-R273 PolarHBondContact O-N 2.85Å; R270-R273 PolarHBondContact O-N 3.33Å; R273-L276 PolarHBondContact O-N 3.08Å; R273-S277 WeakPolarHBondContact O-CB 3.26Å; R273-S277 PolarHBondContact O-N 3.3Å; R273-S277 PolarHBondContact O-OG 2.75Å
274	Q	65.5	Low	69.5	Low	92 Å²	92	91.3 Å²	91.3	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-65.2	-38.3	175.3	-77	176.3	-7.7	0	0	112.7	R270 S271 R272 S277 A278	R270-Q274 WeakPolarHBondContact O-CB 3.34Å; R270-Q274 WeakPolarHBondContact O-CG 3.36Å; R270-Q274 PolarHBondContact O-N 3.44Å; S271-Q274 PolarHBondContact O-N 3.42Å; R272-Q274 VanDerWaalsContact C-N 3.35Å; Q274-S277 WeakPolarHBondContact CA-OG 3.47Å; Q274-S277 PolarHBondContact O-OG 2.91Å; Q274-A278 WeakPolarHBondContact O-CB 3.46Å; Q274-A278 PolarHBondContact O-N 3.4Å
275	R	59.9	Low	68.1	Low	181 Å²	181	89.8 Å²	89.8	68%	0.683	48%	0.478	S	S	*	.	H	α-helix	trans	-65.3	-47.2	172.6	-71.2	-179.4	-160.6	176.7	4.5	111.3	S271 R272 S277 A278 D279	S271-R275 WeakPolarHBondContact O-CG 3.5Å; S271-R275 PolarHBondContact O-N 2.96Å; R272-R275 PolarHBondContact O-N 3.16Å; R275-S277 VanDerWaalsContact C-N 3.31Å; R275-S277 PolarHBondContact O-N 3.28Å; R275-A278 PolarHBondContact O-N 3.22Å; R275-A278 VanDerWaalsContact O-N 3.17Å; R275-D279 WeakPolarHBondContact O-CB 3.42Å; R275-D279 PolarHBondContact O-N 3.39Å
276	L	61.8	Low	66.7	Low	103 Å²	103	91 Å²	91	54%	0.539	48%	0.483	S	S	.	.	H	α-helix	trans	-62.3	-36.2	177.9	-70	168.8	0	0	0	112.6	R272 R273 L280	R272-L276 HydrophobicContact CG-CD1 4.23Å; R272-L276 VanDerWaalsContact O-CG 3.31Å; R272-L276 WeakPolarHBondContact O-CG 3.36Å; R272-L276 PolarHBondContact O-N 2.99Å; R273-L276 PolarHBondContact O-N 3.08Å; L276-L280 WeakPolarHBondContact O-CB 3.29Å; L276-L280 PolarHBondContact O-N 2.62Å
277	S	64.7	Low	65.3	Low	56 Å²	56	92.1 Å²	92.1	39%	0.392	50%	0.502	S	S	.	.	H	α-helix	trans	-69.5	-41.1	174.3	61.8	0	0	0	0	111.7	R273 Q274 R275 L280 E281	R273-S277 WeakPolarHBondContact O-CB 3.26Å; R273-S277 PolarHBondContact O-N 3.3Å; R273-S277 PolarHBondContact O-OG 2.75Å; Q274-S277 WeakPolarHBondContact CA-OG 3.47Å; Q274-S277 PolarHBondContact O-OG 2.91Å; R275-S277 VanDerWaalsContact C-N 3.31Å; R275-S277 PolarHBondContact O-N 3.28Å; S277-L280 PolarHBondContact O-N 2.95Å; S277-E281 WeakPolarHBondContact O-CB 3.36Å; S277-E281 WeakPolarHBondContact O-CG 3.36Å; S277-E281 PolarHBondContact O-N 2.84Å
278	A	66.7	Low	64	Low	42 Å²	42	95.4 Å²	95.4	35%	0.347	53%	0.53	S	S	.	.	H	α-helix	trans	-63.7	-40.9	174.3	0	0	0	0	0	111.6	Q274 R275 L280 E281 T282	Q274-A278 WeakPolarHBondContact O-CB 3.46Å; Q274-A278 PolarHBondContact O-N 3.4Å; R275-A278 PolarHBondContact O-N 3.22Å; R275-A278 VanDerWaalsContact O-N 3.17Å; A278-L280 VanDerWaalsContact C-N 3.33Å; A278-L280 PolarHBondContact O-N 3.12Å; A278-E281 PolarHBondContact O-N 2.78Å; A278-T282 WeakPolarHBondContact O-CB 3.37Å; A278-T282 PolarHBondContact O-N 2.98Å; A278-T282 PolarHBondContact O-OG1 2.79Å
279	D	63.9	Low	62.2	Low	100 Å²	100	94.1 Å²	94.1	54%	0.535	52%	0.523	S	S	.	.	H	α-helix	trans	-64.4	-38.3	175.9	-65.5	-26.7	0	0	0	111.3	R275 T282 S283	R275-D279 WeakPolarHBondContact O-CB 3.42Å; R275-D279 PolarHBondContact O-N 3.39Å; D279-T282 PolarHBondContact O-N 3.28Å; D279-S283 VanDerWaalsContact O-CB 3.22Å; D279-S283 WeakPolarHBondContact O-CB 3.36Å; D279-S283 PolarHBondContact O-N 3.49Å
280	L	65.6	Low	60.8	Low	104 Å²	104	98.8 Å²	98.8	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-69.4	-40.8	176	-166.6	69.5	0	0	0	111.9	L276 S277 A278 S283 Q284	L276-L280 WeakPolarHBondContact O-CB 3.29Å; L276-L280 PolarHBondContact O-N 2.62Å; S277-L280 PolarHBondContact O-N 2.95Å; A278-L280 VanDerWaalsContact C-N 3.33Å; A278-L280 PolarHBondContact O-N 3.12Å; L280-S283 PolarHBondContact O-N 2.71Å; L280-Q284 WeakPolarHBondContact O-CB 3.36Å; L280-Q284 WeakPolarHBondContact O-CG 3.48Å; L280-Q284 PolarHBondContact O-N 3.21Å
281	E	58.5	Low	59.5	Low	137 Å²	137	101 Å²	101	64%	0.64	57%	0.57	S	S	*	*	H	α-helix	trans	-63.9	-40.6	173.5	-75.3	176.8	176.4	0	0	111.3	S277 A278 A285	S277-E281 WeakPolarHBondContact O-CB 3.36Å; S277-E281 WeakPolarHBondContact O-CG 3.36Å; S277-E281 PolarHBondContact O-N 2.84Å; A278-E281 PolarHBondContact O-N 2.78Å; E281-A285 VanDerWaalsContact O-CB 3.29Å; E281-A285 WeakPolarHBondContact O-CB 3.46Å; E281-A285 PolarHBondContact O-N 2.96Å
282	T	64.2	Low	58.4	Low	95 Å²	95	106.4 Å²	106.4	58%	0.583	59%	0.594	S	S	*	*	H	α-helix	trans	-68.8	-39	177.4	-43.4	0	0	0	0	111.3	A278 D279 A285 A286	A278-T282 WeakPolarHBondContact O-CB 3.37Å; A278-T282 PolarHBondContact O-N 2.98Å; A278-T282 PolarHBondContact O-OG1 2.79Å; D279-T282 PolarHBondContact O-N 3.28Å; T282-A285 PolarHBondContact O-N 3.35Å; T282-A286 WeakPolarHBondContact O-CB 3.27Å; T282-A286 PolarHBondContact O-N 3.25Å
283	S	60.8	Low	57.2	Low	72 Å²	72	104.9 Å²	104.9	50%	0.503	60%	0.599	S	S	.	*	H	α-helix	trans	-69.6	-40.8	176.1	-176.8	0	0	0	0	112.4	D279 L280 A286 A287	D279-S283 VanDerWaalsContact O-CB 3.22Å; D279-S283 WeakPolarHBondContact O-CB 3.36Å; D279-S283 PolarHBondContact O-N 3.49Å; L280-S283 PolarHBondContact O-N 2.71Å; S283-A286 PolarHBondContact O-N 3.48Å; S283-A287 WeakPolarHBondContact O-CB 3.24Å; S283-A287 PolarHBondContact O-N 2.87Å
284	Q	56.5	Low	55.8	Low	123 Å²	123	101.5 Å²	101.5	58%	0.575	60%	0.6	S	S	*	*	H	α-helix	trans	-66.2	-37.2	173.3	-76.9	-178.8	1.4	0	0	111.9	L280 A287 A288	L280-Q284 WeakPolarHBondContact O-CB 3.36Å; L280-Q284 WeakPolarHBondContact O-CG 3.48Å; L280-Q284 PolarHBondContact O-N 3.21Å; Q284-A287 PolarHBondContact O-N 3.02Å; Q284-A288 WeakPolarHBondContact O-CB 3.46Å; Q284-A288 PolarHBondContact O-N 3.45Å
285	A	56.9	Low	54.9	Low	68 Å²	68	103.9 Å²	103.9	56%	0.562	62%	0.621	S	S	*	*	H	α-helix	trans	-65.8	-37.1	172.8	0	0	0	0	0	112.3	E281 T282	E281-A285 VanDerWaalsContact O-CB 3.29Å; E281-A285 WeakPolarHBondContact O-CB 3.46Å; E281-A285 PolarHBondContact O-N 2.96Å; T282-A285 PolarHBondContact O-N 3.35Å
286	A	56.7	Low	53.9	Low	69 Å²	69	99.9 Å²	99.9	57%	0.57	61%	0.614	S	S	*	*	H	α-helix	trans	-71.2	-36.6	174.9	0	0	0	0	0	112.8	T282 S283 A288 A289	T282-A286 WeakPolarHBondContact O-CB 3.27Å; T282-A286 PolarHBondContact O-N 3.25Å; S283-A286 PolarHBondContact O-N 3.48Å; A286-A288 VanDerWaalsContact C-N 3.32Å; A286-A289 WeakPolarHBondContact O-CB 3.43Å; A286-A289 PolarHBondContact O-N 2.59Å
287	A	54.8	Low	53.2	Low	80 Å²	80	100.1 Å²	100.1	66%	0.661	62%	0.622	S	S	*	*	H	α-helix	trans	-73.9	-21.8	176.2	0	0	0	0	0	113.3	S283 Q284 A289	S283-A287 WeakPolarHBondContact O-CB 3.24Å; S283-A287 PolarHBondContact O-N 2.87Å; Q284-A287 PolarHBondContact O-N 3.02Å; A287-A289 PolarHBondContact O-N 3.06Å
288	A	52	Low	52.5	Low	82 Å²	82	101.4 Å²	101.4	68%	0.678	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-3.8	172.9	0	0	0	0	0	113.4	Q284 A286	Q284-A288 WeakPolarHBondContact O-CB 3.46Å; Q284-A288 PolarHBondContact O-N 3.45Å; A286-A288 VanDerWaalsContact C-N 3.32Å
289	A	44.6	Very low	51.4	Low	50 Å²	50	105 Å²	105	41%	0.413	64%	0.644	S	S	.	*	S	Bend	trans	-67.7	132.5	168.8	0	0	0	0	0	109.5	A286 A287 T291	A286-A289 WeakPolarHBondContact O-CB 3.43Å; A286-A289 PolarHBondContact O-N 2.59Å; A287-A289 PolarHBondContact O-N 3.06Å; A289-T291 PolarHBondContact O-N 2.92Å; A289-T291 PolarHBondContact O-OG1 3.46Å
290	P	46.7	Very low	50.3	Low	129 Å²	129	110.1 Å²	110.1	84%	0.838	66%	0.657	S	S	*	*			trans	-68.1	92.6	-175	27.3	-32.3	0	0	0	109.6	L292	P290-L292 PolarHBondContact O-N 3.1Å
291	T	45.3	Very low	49.1	Very low	120 Å²	120	113.8 Å²	113.8	74%	0.736	67%	0.669	S	S	*	*			trans	-84.6	110.9	172.4	-45.1	0	0	0	0	106.9	A289 L293	A289-T291 PolarHBondContact O-N 2.92Å; A289-T291 PolarHBondContact O-OG1 3.46Å; T291-L293 PolarHBondContact O-N 3.34Å; T291-L293 VanDerWaalsContact O-N 3.12Å
292	L	44	Very low	48.3	Very low	166 Å²	166	117.7 Å²	117.7	87%	0.869	68%	0.679	S	S	*	*			trans	-48.9	114.6	177	-67.1	164.8	0	0	0	110	P290	P290-L292 PolarHBondContact O-N 3.1Å
293	L	41	Very low	47	Very low	153 Å²	153	120.7 Å²	120.7	80%	0.801	69%	0.691	S	S	*	*			trans	-62.1	133.2	172	-77.1	164.4	0	0	0	109.2	T291 T295	T291-L293 PolarHBondContact O-N 3.34Å; T291-L293 VanDerWaalsContact O-N 3.12Å; L293-T295 PolarHBondContact O-N 3.28Å
294	P	41.7	Very low	45.7	Very low	109 Å²	109	124 Å²	124	71%	0.708	71%	0.708	S	S	*	*			trans	-62.7	125.7	174.6	-15.1	27.9	0	0	0	109.9	N296	P294-N296 VanDerWaalsContact C-N 3.3Å; P294-N296 PolarHBondContact O-N 3.28Å
295	T	45.8	Very low	44.7	Very low	142 Å²	142	128.6 Å²	128.6	87%	0.871	72%	0.72	S	S	*	*			trans	-88.2	20.2	-174.1	53.2	0	0	0	0	114	L293	L293-T295 PolarHBondContact O-N 3.28Å
296	N	39.5	Very low	43.6	Very low	97 Å²	97	131.5 Å²	131.5	52%	0.519	72%	0.722	S	S	.	*			trans	-109.5	113.3	-174.3	-153.2	-2.5	0	0	0	112.4	P294 S298	P294-N296 VanDerWaalsContact C-N 3.3Å; P294-N296 PolarHBondContact O-N 3.28Å; N296-S298 VanDerWaalsContact CG-OG 3.32Å; N296-S298 PolarHBondContact ND2-OG 3.29Å; N296-S298 PolarHBondContact O-N 3.48Å; N296-S298 PolarHBondContact OD1-OG 3.07Å
297	P	47.6	Very low	42.5	Very low	109 Å²	109	140.4 Å²	140.4	71%	0.708	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-63.9	-8.2	-178.2	-22	32.9	0	0	0	115.7
298	S	49	Very low	41.9	Very low	82 Å²	82	141.8 Å²	141.8	57%	0.573	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-83.9	-7.5	-176.4	43.9	0	0	0	0	115.6	N296	N296-S298 VanDerWaalsContact CG-OG 3.32Å; N296-S298 PolarHBondContact ND2-OG 3.29Å; N296-S298 PolarHBondContact O-N 3.48Å; N296-S298 PolarHBondContact OD1-OG 3.07Å
299	D	45.3	Very low	41.2	Very low	119 Å²	119	144.7 Å²	144.7	64%	0.636	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-86.2	-2.4	-177.9	-74.2	-22.8	0	0	0	114.5	K301	D299-K301 PolarHBondContact O-N 2.88Å
300	Y	39.4	Very low	40.8	Very low	206 Å²	206	154.5 Å²	154.5	81%	0.808	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	52.1	177.5	-75.4	-83	0	0	0	113.6
301	K	41.8	Very low	40.2	Very low	182 Å²	182	159.6 Å²	159.6	79%	0.791	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	8.9	178.2	-120.3	179.9	-176.6	178.5	0	117.1	D299	D299-K301 PolarHBondContact O-N 2.88Å
302	Y	40	Very low	40	Very low	219 Å²	219	163.1 Å²	163.1	86%	0.859	78%	0.779	S	S	*	*	S	Bend	trans	-130.3	14	179.9	-70.3	-73.5	0	0	0	116.9
303	L	37.8	Very low	39.8	Very low	158 Å²	158	161.6 Å²	161.6	83%	0.827	78%	0.777	S	S	*	*	S	Bend	trans	-107.9	91	171.6	-64.8	174.6	0	0	0	109.2
304	V	34.4	Very low	39.3	Very low	142 Å²	142	166.5 Å²	166.5	86%	0.861	79%	0.785	S	S	*	*			trans	158.2	95	153	164.8	0	0	0	0	108.1
305	R	35	Very low	39	Very low	219 Å²	219	166.9 Å²	166.9	83%	0.826	79%	0.79	S	S	*	*			trans	-179.3	132.2	159.4	-109.5	-177.9	161.8	142.7	-3.2	107
306	E	33.5	Very low	38.2	Very low	129 Å²	129	171.6 Å²	171.6	60%	0.603	79%	0.792	S	S	*	*			cis	-165.8	127.9	-1.1	-132.5	166	-137.6	0	0	104
307	R	34.3	Very low	38.2	Very low	255 Å²	255	173.6 Å²	173.6	96%	0.962	81%	0.808	S	S	*	*			trans	-78.3	109.3	158.6	-87.9	179.3	170.7	171.1	-2.5	106.2
308	T	41.9	Very low	37.6	Very low	109 Å²	109	175.1 Å²	175.1	67%	0.669	82%	0.815	S	S	*	*			trans	-147.3	147.9	164.3	47.1	0	0	0	0	111.8
309	D	36	Very low	36.9	Very low	144 Å²	144	175.7 Å²	175.7	77%	0.77	82%	0.824	S	S	*	*			trans	-60.8	140.1	-162.4	-64.4	-78.8	0	0	0	117.3
310	R	36.7	Very low	36.4	Very low	256 Å²	256	176.3 Å²	176.3	97%	0.966	83%	0.833	S	S	*	*			trans	-132.3	80	145.8	-82.6	-169.4	172.6	171.7	-0.9	110.6	K312	R310-K312 PolarHBondContact O-N 3.42Å
311	R	34.6	Very low	36	Very low	236 Å²	236	173.7 Å²	173.7	89%	0.891	83%	0.833	S	S	*	*			trans	-71.4	111.1	150.1	-87.7	-179.7	172.7	176.1	-0.7	107.9
312	K	41.9	Very low	35.6	Very low	193 Å²	193	170.4 Å²	170.4	84%	0.839	83%	0.833	S	S	*	*			trans	-151.3	109.3	153.7	-108.1	174.1	-172.4	-177.9	0	110.6	R310	R310-K312 PolarHBondContact O-N 3.42Å
313	T	38	Very low	35.2	Very low	135 Å²	135	162.5 Å²	162.5	83%	0.828	82%	0.818	S	S	*	*			trans	62.1	104.1	143	39.4	0	0	0	0	120
314	R	31.6	Very low	34.9	Very low	255 Å²	255	165.4 Å²	165.4	96%	0.962	82%	0.819	S	S	*	*			trans	-37.8	131.1	161.5	-73.8	167.9	155.9	170.9	-7.1	114.4
315	S	35.1	Very low	35	Very low	117 Å²	117	164 Å²	164	82%	0.818	82%	0.816	S	S	*	*			trans	-138.7	125.1	139.5	-159.8	0	0	0	0	109.4	T317	S315-T317 PolarHBondContact O-N 3.06Å
316	R	29.7	Very low	35.2	Very low	242 Å²	242	160.3 Å²	160.3	91%	0.913	82%	0.818	S	S	*	*			trans	-56.6	119.6	178.2	-84.1	164.1	121.9	139.4	-5.4	109.9
317	T	38	Very low	35.4	Very low	138 Å²	138	160 Å²	160	85%	0.847	82%	0.82	S	S	*	*			trans	-136.6	131.5	149	35.3	0	0	0	0	108.6	S315 A319	S315-T317 PolarHBondContact O-N 3.06Å; T317-A319 PolarHBondContact O-N 3.5Å
318	V	35.2	Very low	35.9	Very low	141 Å²	141	150.3 Å²	150.3	86%	0.855	79%	0.791	S	S	*	*			trans	-62.2	113	-171	173.5	0	0	0	0	109	T320	V318-T320 PolarHBondContact O-N 2.69Å
319	A	34.4	Very low	35.9	Very low	94 Å²	94	151.6 Å²	151.6	78%	0.777	79%	0.789	S	S	*	*			trans	-72.7	122.2	167.6	0	0	0	0	0	108.5	T317 D321	T317-A319 PolarHBondContact O-N 3.5Å; A319-D321 PolarHBondContact O-N 3.31Å
320	T	35.2	Very low	36.1	Very low	133 Å²	133	151.5 Å²	151.5	82%	0.816	78%	0.784	S	S	*	*			trans	-60.8	110.3	169	47.2	0	0	0	0	109.7	V318 S322	V318-T320 PolarHBondContact O-N 2.69Å; T320-S322 PolarHBondContact O-N 2.94Å
321	D	30.4	Very low	36.4	Very low	151 Å²	151	142 Å²	142	81%	0.807	75%	0.753	S	S	*	*			trans	-72.4	98.7	168.7	-172.7	4	0	0	0	108.9	A319 G323	A319-D321 PolarHBondContact O-N 3.31Å; D321-G323 PolarHBondContact O-N 2.96Å; D321-G323 VanDerWaalsContact O-N 3.1Å; D321-G323 PolarHBondContact OD1-N 3.37Å
322	S	35	Very low	36.9	Very low	113 Å²	113	133.1 Å²	133.1	79%	0.79	73%	0.729	S	S	*	*			trans	-79.3	78.8	165.9	62.2	0	0	0	0	108.5	T320 Y324	T320-S322 PolarHBondContact O-N 2.94Å; S322-Y324 PolarHBondContact O-N 3.42Å
323	G	30.6	Very low	37	Very low	53 Å²	53	130.9 Å²	130.9	55%	0.546	72%	0.716	S	S	.	*			trans	-67	91.8	179	0	0	0	0	0	112.6	D321	D321-G323 PolarHBondContact O-N 2.96Å; D321-G323 VanDerWaalsContact O-N 3.1Å; D321-G323 PolarHBondContact OD1-N 3.37Å
324	Y	32.4	Very low	37.2	Very low	218 Å²	218	126.2 Å²	126.2	86%	0.855	69%	0.691	S	S	*	*			trans	-151.4	84.9	160.5	-87.8	-78.5	0	0	0	109.5	S322	S322-Y324 PolarHBondContact O-N 3.42Å
325	S	35.6	Very low	37.8	Very low	114 Å²	114	117.1 Å²	117.1	80%	0.797	66%	0.661	S	S	*	*			trans	-169.1	104.5	159.1	-81.9	0	0	0	0	109.4
326	T	38.9	Very low	38.5	Very low	140 Å²	140	116 Å²	116	86%	0.859	65%	0.649	S	S	*	*			trans	168	111	131.7	49.1	0	0	0	0	107.8	S328	T326-S328 PolarHBondContact O-N 2.78Å
327	L	38.1	Very low	39.3	Very low	124 Å²	124	112.2 Å²	112.2	65%	0.649	64%	0.641	S	S	*	*			trans	-57	129.5	155.3	-90.8	94.3	0	0	0	106.5	N331 L335	L327-N331 HydrophobicContact CD2-CB 4.11Å; L327-L335 HydrophobicContact CD2-CD1 4.32Å
328	S	44.2	Very low	39.4	Very low	50 Å²	50	109.8 Å²	109.8	35%	0.35	63%	0.629	S	S	.	*			trans	-58.3	144.6	169.5	59	0	0	0	0	109.3	T326 E330 N331 A332	T326-S328 PolarHBondContact O-N 2.78Å; S328-E330 PolarHBondContact O-N 3.49Å; S328-E330 VanDerWaalsContact O-N 3.08Å; S328-N331 PolarHBondContact O-N 3.33Å; S328-N331 PolarHBondContact OG-N 2.78Å; S328-A332 PolarHBondContact O-N 2.73Å
329	E	42	Very low	39.6	Very low	136 Å²	136	110.2 Å²	110.2	64%	0.636	62%	0.62	S	S	*	*	H	α-helix	trans	-53.6	-29	177	-154.9	-178.6	160.2	0	0	111.9	A332 R333	E329-A332 PolarHBondContact O-N 3.44Å; E329-R333 WeakPolarHBondContact O-CG 3.25Å; E329-R333 PolarHBondContact O-N 3.31Å; E329-R333 IonicContact OE1-CZ 3.77Å; E329-R333 IonicContact OE1-NH2 2.83Å; E329-R333 PolarHBondContact OE1-NH2 3.36Å
330	E	40.2	Very low	39.7	Very low	143 Å²	143	109.9 Å²	109.9	67%	0.668	61%	0.612	S	S	*	*	H	α-helix	trans	-65.3	-40.1	173.1	-73.9	170.5	153.4	0	0	113.6	S328 A332 R333 A334	S328-E330 PolarHBondContact O-N 3.49Å; S328-E330 VanDerWaalsContact O-N 3.08Å; E330-A332 VanDerWaalsContact C-N 3.32Å; E330-R333 PolarHBondContact O-N 3.39Å; E330-A334 PolarHBondContact O-N 2.99Å
331	N	43.5	Very low	39.6	Very low	57 Å²	57	112.5 Å²	112.5	31%	0.305	61%	0.612	S	S	.	*	H	α-helix	trans	-72.7	-28.7	176.3	-74	-11.6	0	0	0	111.8	L327 S328 L335	L327-N331 HydrophobicContact CD2-CB 4.11Å; S328-N331 PolarHBondContact O-N 3.33Å; S328-N331 PolarHBondContact OG-N 2.78Å; N331-L335 PolarHBondContact O-N 3.43Å
332	A	45.5	Very low	39.5	Very low	48 Å²	48	111.4 Å²	111.4	40%	0.397	61%	0.613	S	S	.	*	H	α-helix	trans	-69.1	-38	170.7	0	0	0	0	0	111.6	S328 E329 E330 L335 V336	S328-A332 PolarHBondContact O-N 2.73Å; E329-A332 PolarHBondContact O-N 3.44Å; E330-A332 VanDerWaalsContact C-N 3.32Å; A332-L335 PolarHBondContact O-N 2.86Å; A332-V336 WeakPolarHBondContact O-CG2 3.31Å; A332-V336 PolarHBondContact O-N 2.94Å
333	R	42.6	Very low	39.4	Very low	146 Å²	146	113.6 Å²	113.6	55%	0.551	61%	0.611	S	S	*	*	H	α-helix	trans	-66.2	-42.4	175.2	-74.4	178.9	-175.1	146.2	8.8	112.7	E329 E330 L335 V336 E337	E329-R333 WeakPolarHBondContact O-CG 3.25Å; E329-R333 PolarHBondContact O-N 3.31Å; E329-R333 IonicContact OE1-CZ 3.77Å; E329-R333 IonicContact OE1-NH2 2.83Å; E329-R333 PolarHBondContact OE1-NH2 3.36Å; E330-R333 PolarHBondContact O-N 3.39Å; R333-L335 VanDerWaalsContact C-N 3.26Å; R333-L335 PolarHBondContact O-N 3.28Å; R333-V336 PolarHBondContact O-N 3.47Å; R333-E337 PolarHBondContact O-N 3.47Å
334	A	41.9	Very low	39.3	Very low	37 Å²	37	121 Å²	121	31%	0.306	62%	0.622	S	S	.	*	H	α-helix	trans	-60.4	-35.9	175.1	0	0	0	0	0	112.5	E330 V336 C338	E330-A334 PolarHBondContact O-N 2.99Å; A334-V336 VanDerWaalsContact C-N 3.31Å; A334-V336 PolarHBondContact O-N 2.91Å; A334-C338 PolarHBondContact O-N 2.85Å; A334-C338 PolarHBondContact O-SG 3.36Å; A334-C338 VanDerWaalsContact O-SG 3.4Å
335	L	44.6	Very low	39.3	Very low	64 Å²	64	114.3 Å²	114.3	34%	0.335	62%	0.62	S	S	.	*	H	α-helix	trans	-72.2	-17.6	173.1	-77.5	168.6	0	0	0	113.9	V245 L327 N331 A332 R333 F339	V245-L335 HydrophobicContact CG1-CD1 4.13Å; V245-L335 HydrophobicContact CG1-CD2 4.18Å; V245-L335 HydrophobicContact CG1-CG 4.07Å; L327-L335 HydrophobicContact CD2-CD1 4.32Å; N331-L335 PolarHBondContact O-N 3.43Å; A332-L335 PolarHBondContact O-N 2.86Å; R333-L335 VanDerWaalsContact C-N 3.26Å; R333-L335 PolarHBondContact O-N 3.28Å; L335-F339 HydrophobicContact CD2-CE2 4.29Å; L335-F339 WeakPolarHBondContact O-CD2 3.22Å
336	V	50.4	Low	39.1	Very low	93 Å²	93	116.4 Å²	116.4	56%	0.564	62%	0.622	S	S	*	*	H	α-helix	trans	-89.4	-35.8	176.4	172.2	0	0	0	0	111.1	A332 R333 A334 F339 S340	A332-V336 WeakPolarHBondContact O-CG2 3.31Å; A332-V336 PolarHBondContact O-N 2.94Å; R333-V336 PolarHBondContact O-N 3.47Å; A334-V336 VanDerWaalsContact C-N 3.31Å; A334-V336 PolarHBondContact O-N 2.91Å; V336-F339 PolarHBondContact O-N 2.89Å; V336-S340 PolarHBondContact O-N 2.84Å; V336-S340 PolarHBondContact O-OG 3Å
337	E	46	Very low	38.6	Very low	163 Å²	163	118.7 Å²	118.7	76%	0.762	62%	0.623	S	S	*	*	H	α-helix	trans	-67.2	-35.9	175.6	-81.8	-176.4	156.2	0	0	112.7	R333 F339	R333-E337 PolarHBondContact O-N 3.47Å; E337-F339 PolarHBondContact O-N 3.42Å
338	C	40.5	Very low	38.4	Very low	87 Å²	87	122.2 Å²	122.2	59%	0.588	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-15.4	176.8	-68.6	0	0	0	0	114.5	A334	A334-C338 PolarHBondContact O-N 2.85Å; A334-C338 PolarHBondContact O-SG 3.36Å; A334-C338 VanDerWaalsContact O-SG 3.4Å
339	F	39.3	Very low	37.8	Very low	150 Å²	150	128.7 Å²	128.7	66%	0.658	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	1.8	-173.4	-72.5	-93.4	0	0	0	114.2	L335 V336 E337 K341	L335-F339 HydrophobicContact CD2-CE2 4.29Å; L335-F339 WeakPolarHBondContact O-CD2 3.22Å; V336-F339 PolarHBondContact O-N 2.89Å; E337-F339 PolarHBondContact O-N 3.42Å; F339-K341 PolarHBondContact O-N 3.18Å
340	S	37.2	Very low	37.5	Very low	87 Å²	87	126.7 Å²	126.7	61%	0.608	66%	0.66	S	S	*	*			trans	-86	106.6	179.4	-64.5	0	0	0	0	111.2	V336	V336-S340 PolarHBondContact O-N 2.84Å; V336-S340 PolarHBondContact O-OG 3Å
341	K	32.5	Very low	37.4	Very low	189 Å²	189	127.5 Å²	127.5	82%	0.822	67%	0.669	S	S	*	*			trans	-61	161.1	-179.3	-73.5	177.8	176	179.7	0	114.5	F339	F339-K341 PolarHBondContact O-N 3.18Å
342	P	28.4	Very low	36.7	Very low	128 Å²	128	135.9 Å²	135.9	83%	0.831	70%	0.696	S	S	*	*			trans	-79.1	137.2	168.4	34.2	-31.4	0	0	0	111.1
343	Q	32.7	Very low	36.1	Very low	158 Å²	158	137.5 Å²	137.5	74%	0.738	71%	0.71	S	S	*	*			trans	-150.3	139.3	167.7	-83.7	-158	-13.9	0	0	106.5
344	R	29.4	Very low	35.5	Very low	208 Å²	208	136 Å²	136	79%	0.785	72%	0.717	S	S	*	*			cis	-157.4	140.5	-4.3	-92.2	172.9	-172.2	-168.8	0.6	103.2
345	G	30.9	Very low	35.1	Very low	79 Å²	79	140.9 Å²	140.9	81%	0.814	74%	0.737	S	S	*	*			trans	-117	113.9	166.8	0	0	0	0	0	107.9
346	D	32.5	Very low	34.4	Very low	158 Å²	158	144 Å²	144	85%	0.845	76%	0.759	S	S	*	*			trans	-61.5	145.3	-178.8	-71.7	-46.7	0	0	0	112.4
347	E	28.1	Very low	33.5	Very low	187 Å²	187	145.1 Å²	145.1	87%	0.874	77%	0.768	S	S	*	*			trans	-58.7	130.5	172.5	-68	172.8	119.2	0	0	111.6
348	Q	33.3	Very low	32.9	Very low	199 Å²	199	144.1 Å²	144.1	93%	0.93	77%	0.773	S	S	*	*			trans	-166	113.2	133.9	-104.8	167.1	24.9	0	0	110
349	Q	31.9	Very low	32.3	Very low	185 Å²	185	144 Å²	144	86%	0.864	78%	0.779	S	S	*	*			trans	-93.9	174.1	174.4	-118.3	-173.4	4.5	0	0	109.3
350	P	37	Very low	31.9	Very low	95 Å²	95	143.1 Å²	143.1	62%	0.617	79%	0.791	S	S	*	*				-126.9	170.1	-69.1	29.5	-9	0	0	0	110.6
351	N	36.2	Very low	31.5	Very low	159 Å²	159	142.5 Å²	142.5	85%	0.85	80%	0.798	S	S	*	*			trans	-178	120.3	144.3	-94.7	-30.2	0	0	0	114.2
352	R	30.7	Very low	31.4	Very low	233 Å²	233	138.6 Å²	138.6	88%	0.879	80%	0.801	S	S	*	*				71.3	121.2	128.9	-138.5	-177.9	178.8	159	-0.2	120.5
353	A	31.7	Very low	31.4	Very low	83 Å²	83	135.9 Å²	135.9	69%	0.686	80%	0.796	S	S	*	*			trans	69.2	138.6	137.6	0	0	0	0	0	118
354	T	30.5	Very low	31.4	Very low	115 Å²	115	138 Å²	138	71%	0.706	80%	0.803	S	S	*	*			cis	-171.4	162.7	-3	-26.3	0	0	0	0	106.2
355	L	32.4	Very low	31.3	Very low	139 Å²	139	138.1 Å²	138.1	73%	0.728	81%	0.809	S	S	*	*			trans	73	98.7	149.1	-64.4	166.2	0	0	0	118.9
356	T	31.6	Very low	31.2	Very low	129 Å²	129	143.5 Å²	143.5	79%	0.791	81%	0.811	S	S	*	*				97.5	149.8	91.1	47.9	0	0	0	0	115.2
357	P	31.6	Very low	31.1	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	81%	0.805	S	S	*	*			trans	-114.8	152.5	-150.7	38.9	-26.3	0	0	0	115.2
358	V	31.5	Very low	31	Very low	141 Å²	141	140.9 Å²	140.9	86%	0.855	80%	0.803	S	S	*	*			trans	-153	105.3	167.5	-179.2	0	0	0	0	106.8
359	A	29.4	Very low	30.9	Very low	86 Å²	86	138.1 Å²	138.1	71%	0.711	80%	0.799	S	S	*	*				74.6	128.6	86.8	0	0	0	0	0	116.3
360	S	29.4	Very low	30.7	Very low	131 Å²	131	136.1 Å²	136.1	92%	0.916	80%	0.795	S	S	*	*			trans	88.2	136.8	150.3	77.7	0	0	0	0	120.4
361	G	30.7	Very low	30.3	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	79%	0.792	S	S	*	*			trans	129	67.8	167.6	0	0	0	0	0	113.8
362	A	29.8	Very low	29.8	Very low	108 Å²	108	133.1 Å²	133.1	89%	0.893	79%	0.792	S	S	*	*				75.9	115.4	92.6	0	0	0	0	0	115.6
363	G	27.9	Very low	30.1	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	79%	0.788	S	S	*	*			trans	106.9	97.9	139.9	0	0	0	0	0	117.9
364	K	32.6	Very low	30.1	Very low	203 Å²	203	135.3 Å²	135.3	88%	0.883	80%	0.795	S	S	*	*				-179.8	118	109.6	-95.2	167.5	-175.5	179.6	0	111.3
365	K	27.1	Very low	30.3	Very low	210 Å²	210	132.5 Å²	132.5	91%	0.913	79%	0.789	S	S	*	*			trans	-66.3	137.3	167.5	-76.6	177.1	171.2	-179.3	0	110
366	F	29.5	Very low	30.6	Very low	191 Å²	191	129.5 Å²	129.5	84%	0.838	78%	0.779	S	S	*	*			trans	-124.4	144.9	150.5	-87.5	-83.2	0	0	0	108.3
367	P	31.1	Very low	30.7	Very low	113 Å²	113	130 Å²	130	73%	0.734	77%	0.771	S	S	*	*			trans	-81.3	151	-161	32.6	-33.2	0	0	0	113.1
368	E	24.5	Very low	31	Very low	178 Å²	178	128.2 Å²	128.2	83%	0.832	76%	0.757	S	S	*	*			trans	-54.5	130.7	166.9	-70.4	168.7	137	0	0	111.5
369	V	32.2	Very low	31.4	Very low	140 Å²	140	127.3 Å²	127.3	85%	0.848	74%	0.744	S	S	*	*			trans	-106.1	99	158.8	177.2	0	0	0	0	107
370	N	28.2	Very low	31.9	Very low	143 Å²	143	129.4 Å²	129.4	77%	0.765	74%	0.739	S	S	*	*			trans	-46.3	133.6	153.4	-62.9	-45.4	0	0	0	108
371	G	26.8	Very low	32.4	Very low	55 Å²	55	126.8 Å²	126.8	57%	0.567	72%	0.718	S	S	*	*			cis	123.5	131.4	43.1	0	0	0	0	0	107
372	T	27.3	Very low	33.2	Very low	137 Å²	137	126.4 Å²	126.4	84%	0.84	70%	0.697	S	S	*	*			trans	76.2	108.6	161.7	70.7	0	0	0	0	118
373	K	35.6	Very low	33.9	Very low	184 Å²	184	125 Å²	125	80%	0.8	68%	0.68	S	S	*	*	S	Bend	trans	151	-4.3	134.7	-80.9	-178.2	-179.8	-176.1	0	117
374	E	33.4	Very low	34.5	Very low	178 Å²	178	123.5 Å²	123.5	83%	0.832	66%	0.661	S	S	*	*	H	α-helix	trans	-90.3	-14.9	-177.9	-72.6	-175.5	156.3	0	0	115.2
375	G	34	Very low	34.9	Very low	56 Å²	56	118.1 Å²	118.1	58%	0.577	64%	0.636	S	S	*	*	H	α-helix	trans	-73.7	-29.4	179.3	0	0	0	0	0	115.1
376	S	38.3	Very low	36.1	Very low	75 Å²	75	113.4 Å²	113.4	52%	0.524	62%	0.619	S	S	.	*	H	α-helix	trans	-82.4	-28.1	-176.3	84.2	0	0	0	0	113.2	E379 E380	S376-E379 PolarHBondContact O-N 3.19Å; S376-E380 VanDerWaalsContact O-CB 3.28Å; S376-E380 WeakPolarHBondContact O-CB 3.38Å; S376-E380 PolarHBondContact O-N 3.26Å
377	F	34.1	Very low	37.4	Very low	139 Å²	139	110.6 Å²	110.6	61%	0.61	61%	0.608	S	S	*	*	H	α-helix	trans	-68.5	-36.9	-179.6	-170.6	-104.3	0	0	0	111.6	E380 V381	F377-E380 PolarHBondContact O-N 2.97Å; F377-V381 HydrophobicContact CD1-CG2 4.14Å; F377-V381 HydrophobicContact CE1-CG2 3.85Å; F377-V381 HydrophobicContact CE2-CG2 4.3Å; F377-V381 HydrophobicContact CG-CG2 4.49Å; F377-V381 HydrophobicContact CZ-CG2 3.94Å; F377-V381 WeakPolarHBondContact O-CB 3.42Å; F377-V381 WeakPolarHBondContact O-CG2 3.49Å; F377-V381 PolarHBondContact O-N 3.33Å
378	V	37.6	Very low	38.1	Very low	80 Å²	80	114.2 Å²	114.2	49%	0.485	61%	0.607	S	S	.	*	H	α-helix	trans	-70.5	-36.7	176.1	-176.9	0	0	0	0	111.1	M382	V378-M382 HydrophobicContact CG1-CG 4.37Å; V378-M382 VanDerWaalsContact O-CB 3.26Å; V378-M382 WeakPolarHBondContact O-CB 3.45Å; V378-M382 WeakPolarHBondContact O-CG 3.33Å; V378-M382 PolarHBondContact O-N 2.93Å
379	E	40.9	Very low	39.2	Very low	122 Å²	122	108.7 Å²	108.7	57%	0.57	58%	0.583	S	S	*	*	H	α-helix	trans	-69	-37.4	174.4	-74.5	-176.1	158.1	0	0	112.6	S376 S383	S376-E379 PolarHBondContact O-N 3.19Å; E379-S383 VanDerWaalsContact O-CB 3.23Å; E379-S383 WeakPolarHBondContact O-CB 3.37Å; E379-S383 PolarHBondContact O-N 3.32Å; E379-S383 PolarHBondContact O-OG 2.92Å
380	E	39.6	Very low	40	Very low	130 Å²	130	105.2 Å²	105.2	61%	0.607	57%	0.565	S	S	*	*	H	α-helix	trans	-70.2	-44.6	178.2	-168.5	173	-170	0	0	111.6	S376 F377 M382 S383 A384	S376-E380 VanDerWaalsContact O-CB 3.28Å; S376-E380 WeakPolarHBondContact O-CB 3.38Å; S376-E380 PolarHBondContact O-N 3.26Å; F377-E380 PolarHBondContact O-N 2.97Å; E380-M382 PolarHBondContact O-N 3.4Å; E380-S383 PolarHBondContact O-N 3.29Å; E380-A384 WeakPolarHBondContact O-CB 3.29Å; E380-A384 PolarHBondContact O-N 3.17Å
381	V	39.5	Very low	41.1	Very low	77 Å²	77	101.3 Å²	101.3	47%	0.467	55%	0.546	S	S	.	.	H	α-helix	trans	-66.4	-38.5	176.9	173	0	0	0	0	111.5	F377 Y385	F377-V381 HydrophobicContact CD1-CG2 4.14Å; F377-V381 HydrophobicContact CE1-CG2 3.85Å; F377-V381 HydrophobicContact CE2-CG2 4.3Å; F377-V381 HydrophobicContact CG-CG2 4.49Å; F377-V381 HydrophobicContact CZ-CG2 3.94Å; F377-V381 WeakPolarHBondContact O-CB 3.42Å; F377-V381 WeakPolarHBondContact O-CG2 3.49Å; F377-V381 PolarHBondContact O-N 3.33Å; V381-Y385 WeakPolarHBondContact O-CB 3.08Å; V381-Y385 PolarHBondContact O-N 2.85Å
382	M	46.7	Very low	41.7	Very low	65 Å²	65	101.2 Å²	101.2	32%	0.32	54%	0.54	S	S	.	.	H	α-helix	trans	-76.6	-31.6	178.1	-67.7	-60.2	-65.2	0	0	112.6	V378 E380 Y385 M386	V378-M382 HydrophobicContact CG1-CG 4.37Å; V378-M382 VanDerWaalsContact O-CB 3.26Å; V378-M382 WeakPolarHBondContact O-CB 3.45Å; V378-M382 WeakPolarHBondContact O-CG 3.33Å; V378-M382 PolarHBondContact O-N 2.93Å; E380-M382 PolarHBondContact O-N 3.4Å; M382-Y385 PolarHBondContact O-N 2.86Å; M382-M386 VanDerWaalsContact O-CG 3.28Å; M382-M386 WeakPolarHBondContact O-CG 3.29Å; M382-M386 PolarHBondContact O-N 2.86Å
383	S	44.2	Very low	42.5	Very low	77 Å²	77	102.1 Å²	102.1	54%	0.538	53%	0.533	S	S	.	.	H	α-helix	trans	-65.4	-43	170.9	-60.8	0	0	0	0	110.8	E379 E380 Y385 M386 E387	E379-S383 VanDerWaalsContact O-CB 3.23Å; E379-S383 WeakPolarHBondContact O-CB 3.37Å; E379-S383 PolarHBondContact O-N 3.32Å; E379-S383 PolarHBondContact O-OG 2.92Å; E380-S383 PolarHBondContact O-N 3.29Å; S383-Y385 VanDerWaalsContact C-N 3.31Å; S383-Y385 PolarHBondContact O-N 3.3Å; S383-M386 PolarHBondContact O-N 3.24Å; S383-E387 WeakPolarHBondContact O-CB 3.4Å; S383-E387 PolarHBondContact O-N 3.45Å
384	A	40.5	Very low	42.9	Very low	41 Å²	41	98 Å²	98	34%	0.339	52%	0.523	S	S	.	.	H	α-helix	trans	-64.4	-32.5	174.3	0	0	0	0	0	112.9	E380 R388	E380-A384 WeakPolarHBondContact O-CB 3.29Å; E380-A384 PolarHBondContact O-N 3.17Å; A384-R388 WeakPolarHBondContact O-CG 3.08Å; A384-R388 PolarHBondContact O-N 2.88Å; A384-R388 VanDerWaalsContact O-N 3.09Å
385	Y	42.3	Very low	43.2	Very low	90 Å²	90	96 Å²	96	35%	0.353	51%	0.513	S	S	.	.	H	α-helix	trans	-70.7	-43.8	174.3	-174.6	-102.4	0	0	0	112.2	V381 M382 S383 E387 R388 L389	V381-Y385 WeakPolarHBondContact O-CB 3.08Å; V381-Y385 PolarHBondContact O-N 2.85Å; M382-Y385 PolarHBondContact O-N 2.86Å; S383-Y385 VanDerWaalsContact C-N 3.31Å; S383-Y385 PolarHBondContact O-N 3.3Å; Y385-E387 VanDerWaalsContact C-N 3.33Å; Y385-R388 PolarHBondContact O-N 2.98Å; Y385-L389 HydrophobicContact CD1-CD1 3.79Å; Y385-L389 HydrophobicContact CE1-CD1 3.36Å; Y385-L389 HydrophobicContact CE1-CG 4.25Å; Y385-L389 PolarHBondContact O-N 3.37Å
386	M	51.8	Low	43.5	Very low	110 Å²	110	101.4 Å²	101.4	54%	0.542	52%	0.524	S	S	.	.	H	α-helix	trans	-66.9	-35.1	176	-66.2	-62.8	-88	0	0	111.9	M382 S383 L389 S390	M382-M386 VanDerWaalsContact O-CG 3.28Å; M382-M386 WeakPolarHBondContact O-CG 3.29Å; M382-M386 PolarHBondContact O-N 2.86Å; S383-M386 PolarHBondContact O-N 3.24Å; M386-L389 PolarHBondContact O-N 3.22Å; M386-L389 HydrophobicContact SD-CD1 4.38Å; M386-S390 PolarHBondContact O-N 3.06Å; M386-S390 VanDerWaalsContact O-N 3.11Å
387	E	57.7	Low	43.6	Very low	133 Å²	133	108.8 Å²	108.8	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-63.9	-46.7	173.7	-165.6	175.1	-167.8	0	0	110.8	S383 Y385 L389 S390 T391	S383-E387 WeakPolarHBondContact O-CB 3.4Å; S383-E387 PolarHBondContact O-N 3.45Å; Y385-E387 VanDerWaalsContact C-N 3.33Å; E387-L389 VanDerWaalsContact C-N 3.34Å; E387-L389 PolarHBondContact O-N 2.88Å; E387-S390 PolarHBondContact O-N 3.49Å; E387-S390 VanDerWaalsContact O-N 3.08Å; E387-S390 PolarHBondContact O-OG 3.3Å; E387-T391 PolarHBondContact O-N 3.48Å; E387-T391 PolarHBondContact O-OG1 2.94Å
388	R	44.5	Very low	43.9	Very low	188 Å²	188	105.9 Å²	105.9	71%	0.709	54%	0.542	S	S	*	.	H	α-helix	trans	-62.2	-34.6	175.2	-76.2	178.9	-175.1	175.5	3.3	113.9	A384 Y385 S390 T391 A392	A384-R388 WeakPolarHBondContact O-CG 3.08Å; A384-R388 PolarHBondContact O-N 2.88Å; A384-R388 VanDerWaalsContact O-N 3.09Å; Y385-R388 PolarHBondContact O-N 2.98Å; R388-S390 VanDerWaalsContact C-N 3.32Å; R388-T391 WeakPolarHBondContact CA-OG1 3.3Å; R388-T391 PolarHBondContact O-OG1 3.36Å; R388-T391 VanDerWaalsContact O-OG1 3.09Å; R388-A392 VanDerWaalsContact O-CB 3.29Å; R388-A392 WeakPolarHBondContact O-CB 3.22Å; R388-A392 PolarHBondContact O-N 3.49Å
389	L	48.6	Very low	43.9	Very low	63 Å²	63	110.6 Å²	110.6	33%	0.33	56%	0.559	S	S	.	*	H	α-helix	trans	-70.6	-29	174.6	-81.3	169.9	0	0	0	112.7	Y385 M386 E387	Y385-L389 HydrophobicContact CD1-CD1 3.79Å; Y385-L389 HydrophobicContact CE1-CD1 3.36Å; Y385-L389 HydrophobicContact CE1-CG 4.25Å; Y385-L389 PolarHBondContact O-N 3.37Å; M386-L389 PolarHBondContact O-N 3.22Å; M386-L389 HydrophobicContact SD-CD1 4.38Å; E387-L389 VanDerWaalsContact C-N 3.34Å; E387-L389 PolarHBondContact O-N 2.88Å
390	S	48.8	Very low	43.8	Very low	67 Å²	67	112.5 Å²	112.5	47%	0.469	57%	0.573	S	S	.	*	H	α-helix	trans	-77.7	-39.2	175.3	74.1	0	0	0	0	112	M386 E387 R388 K393 T394	M386-S390 PolarHBondContact O-N 3.06Å; M386-S390 VanDerWaalsContact O-N 3.11Å; E387-S390 PolarHBondContact O-N 3.49Å; E387-S390 VanDerWaalsContact O-N 3.08Å; E387-S390 PolarHBondContact O-OG 3.3Å; R388-S390 VanDerWaalsContact C-N 3.32Å; S390-K393 PolarHBondContact O-N 3.23Å; S390-T394 PolarHBondContact O-OG1 3.41Å
391	T	51.1	Low	43.5	Very low	60 Å²	60	109.6 Å²	109.6	37%	0.368	58%	0.578	S	S	.	*	H	α-helix	trans	-69.2	-38.9	176	58.8	0	0	0	0	112.5	E387 R388 K393 T394 E395	E387-T391 PolarHBondContact O-N 3.48Å; E387-T391 PolarHBondContact O-OG1 2.94Å; R388-T391 WeakPolarHBondContact CA-OG1 3.3Å; R388-T391 PolarHBondContact O-OG1 3.36Å; R388-T391 VanDerWaalsContact O-OG1 3.09Å; T391-K393 VanDerWaalsContact C-N 3.28Å; T391-K393 PolarHBondContact O-N 2.89Å; T391-T394 WeakPolarHBondContact O-CA 3.34Å; T391-T394 WeakPolarHBondContact O-CB 3.11Å; T391-T394 PolarHBondContact O-N 3.29Å; T391-E395 PolarHBondContact O-N 2.78Å
392	A	40.2	Very low	43.3	Very low	53 Å²	53	114 Å²	114	44%	0.438	60%	0.599	S	S	.	*	H	α-helix	trans	-63.3	-30.5	177.2	0	0	0	0	0	113.5	R388 T394 E396	R388-A392 VanDerWaalsContact O-CB 3.29Å; R388-A392 WeakPolarHBondContact O-CB 3.22Å; R388-A392 PolarHBondContact O-N 3.49Å; A392-T394 PolarHBondContact O-N 3.4Å; A392-E396 PolarHBondContact O-N 3.13Å
393	K	43.7	Very low	42.6	Very low	157 Å²	157	114.7 Å²	114.7	68%	0.683	62%	0.622	S	S	*	*	H	α-helix	trans	-73.4	-14.2	171.9	-77	178.5	179.8	171.6	0	113.4	S390 T391	S390-K393 PolarHBondContact O-N 3.23Å; T391-K393 VanDerWaalsContact C-N 3.28Å; T391-K393 PolarHBondContact O-N 2.89Å
394	T	43.4	Very low	42.2	Very low	98 Å²	98	121 Å²	121	60%	0.601	64%	0.64	S	S	*	*	H	α-helix	trans	-98.5	-30.4	-177.9	-36.6	0	0	0	0	111.1	S390 T391 A392	S390-T394 PolarHBondContact O-OG1 3.41Å; T391-T394 WeakPolarHBondContact O-CA 3.34Å; T391-T394 WeakPolarHBondContact O-CB 3.11Å; T391-T394 PolarHBondContact O-N 3.29Å; A392-T394 PolarHBondContact O-N 3.4Å
395	E	40.9	Very low	41.9	Very low	134 Å²	134	125.1 Å²	125.1	63%	0.626	66%	0.661	S	S	*	*	H	α-helix	trans	-78.9	-30.6	178.2	-71.3	175.3	166.7	0	0	113.3	T391 R397 A398	T391-E395 PolarHBondContact O-N 2.78Å; E395-R397 PolarHBondContact O-N 2.93Å; E395-R397 VanDerWaalsContact O-N 3.09Å; E395-A398 PolarHBondContact O-N 2.91Å; E395-A398 VanDerWaalsContact O-N 3.13Å
396	E	40.1	Very low	41.5	Very low	170 Å²	170	130.1 Å²	130.1	79%	0.794	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-8.3	175.9	-146	-178.9	-169	0	0	113.4	A392	A392-E396 PolarHBondContact O-N 3.13Å
397	R	39.2	Very low	40.6	Very low	230 Å²	230	133.4 Å²	133.4	87%	0.868	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-8.3	174.3	-98.4	-179.1	174.8	173.9	-0.4	114.5	E395	E395-R397 PolarHBondContact O-N 2.93Å; E395-R397 VanDerWaalsContact O-N 3.09Å
398	A	41.2	Very low	39.4	Very low	79 Å²	79	139 Å²	139	65%	0.653	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-8.9	-173.2	0	0	0	0	0	114.7	E395	E395-A398 PolarHBondContact O-N 2.91Å; E395-A398 VanDerWaalsContact O-N 3.13Å
399	E	38	Very low	38.8	Very low	178 Å²	178	135.3 Å²	135.3	83%	0.832	72%	0.72	S	S	*	*	S	Bend	trans	-100	4.8	-176.2	-74.8	-170.2	149.5	0	0	115.9
400	N	37.5	Very low	38.2	Very low	163 Å²	163	137.4 Å²	137.4	87%	0.872	74%	0.737	S	S	*	*	S	Bend	trans	-105.9	72	172.6	-81.5	-30.1	0	0	0	111.1
401	G	32.9	Very low	37.6	Very low	69 Å²	69	140.6 Å²	140.6	71%	0.711	75%	0.754	S	S	*	*			trans	-171.7	51.1	-176.6	0	0	0	0	0	115.2
402	N	35.6	Very low	36.7	Very low	170 Å²	170	143.6 Å²	143.6	91%	0.909	78%	0.775	S	S	*	*			trans	-135.9	85.5	166.2	-139.9	4.5	0	0	0	110.6
403	G	32.9	Very low	36.6	Very low	78 Å²	78	148.2 Å²	148.2	80%	0.804	80%	0.797	S	S	*	*			trans	-90.1	122.4	174.7	0	0	0	0	0	111.2
404	K	35.4	Very low	36	Very low	209 Å²	209	145.3 Å²	145.3	91%	0.909	80%	0.802	S	S	*	*			trans	-112.5	107.6	162	-124.2	-178.7	-177.1	-179	0	108.9
405	V	34.4	Very low	35.6	Very low	129 Å²	129	145.5 Å²	145.5	78%	0.782	81%	0.814	S	S	*	*			trans	9.8	118.3	148.2	-173.5	0	0	0	0	117
406	E	33.9	Very low	35.2	Very low	195 Å²	195	149.6 Å²	149.6	91%	0.911	83%	0.83	S	S	*	*				-162.4	133.6	123.1	-114.7	178.1	177.1	0	0	112.4
407	Q	32.7	Very low	34.8	Very low	179 Å²	179	145 Å²	145	84%	0.836	83%	0.828	S	S	*	*			trans	-82.1	139	-176.8	-65.8	172.8	-11	0	0	111.1
408	R	33.2	Very low	34.3	Very low	250 Å²	250	140.1 Å²	140.1	94%	0.943	83%	0.829	S	S	*	*			trans	-178.4	114.8	136.8	-98.6	160.3	-170.5	-139	4	110.5
409	S	30.6	Very low	33.8	Very low	111 Å²	111	141.9 Å²	141.9	78%	0.776	83%	0.834	S	S	*	*			trans	-75.8	172.4	161.4	53.6	0	0	0	0	109.3
410	P	36.8	Very low	33.5	Very low	107 Å²	107	145.3 Å²	145.3	70%	0.695	84%	0.839	S	S	*	*			cis	-152	177	30.2	41.7	-18.5	0	0	0	120.2
411	T	36.7	Very low	33	Very low	134 Å²	134	143.7 Å²	143.7	82%	0.822	84%	0.835	S	S	*	*			trans	81	125.6	151.1	40.9	0	0	0	0	122.1
412	P	31.7	Very low	32.9	Very low	123 Å²	123	146.2 Å²	146.2	80%	0.799	84%	0.839	S	S	*	*			trans	-104.2	153.3	177.1	38.9	-30	0	0	0	113.6
413	V	36.9	Very low	32.5	Very low	149 Å²	149	145.2 Å²	145.2	90%	0.903	84%	0.839	S	S	*	*			trans	-120.7	127.9	164.6	176.8	0	0	0	0	109.1
414	A	32.1	Very low	32.3	Very low	96 Å²	96	144.7 Å²	144.7	79%	0.793	83%	0.834	S	S	*	*			trans	-74.7	141.6	-178.3	0	0	0	0	0	113
415	A	34.4	Very low	32.3	Very low	103 Å²	103	141.3 Å²	141.3	85%	0.851	83%	0.831	S	S	*	*			trans	-144.9	123.1	154.6	0	0	0	0	0	110.1
416	K	32.2	Very low	32.4	Very low	220 Å²	220	140.8 Å²	140.8	96%	0.957	83%	0.83	S	S	*	*			trans	-70.3	141.1	-178	-69.2	170.8	173.5	175.8	0	111.6
417	G	31.8	Very low	33	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	82%	0.816	S	S	*	*			trans	-175.3	98.5	164.7	0	0	0	0	0	111.7
418	S	28.4	Very low	34	Very low	127 Å²	127	132.3 Å²	132.3	89%	0.888	79%	0.794	S	S	*	*			trans	-61.8	143.9	176.7	-73.8	0	0	0	0	113.4
419	P	32.6	Very low	34.8	Very low	116 Å²	116	125.6 Å²	125.6	75%	0.753	78%	0.781	S	S	*	*			trans	-115.6	132.8	145.7	19.7	-1.4	0	0	0	111	T421	P419-T421 PolarHBondContact O-N 3.29Å
420	R	30.8	Very low	35.7	Very low	250 Å²	250	125.1 Å²	125.1	94%	0.943	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-55.8	129	171	-71.6	174	169.8	-167.4	-4	110.4
421	T	27.4	Very low	36.2	Very low	128 Å²	128	120.9 Å²	120.9	79%	0.785	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-79.6	134.8	170.8	43.1	0	0	0	0	110.5	P419	P419-T421 PolarHBondContact O-N 3.29Å
422	P	30.2	Very low	37	Very low	123 Å²	123	121.2 Å²	121.2	80%	0.799	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-81.4	129.4	162.3	24.6	-14.8	0	0	0	109.1	G424	P422-G424 PolarHBondContact O-N 2.89Å; P422-G424 VanDerWaalsContact O-N 3.12Å
423	T	27.4	Very low	38	Very low	149 Å²	149	117.4 Å²	117.4	91%	0.914	70%	0.702	S	S	*	*			trans	-60	103.4	175.7	47.4	0	0	0	0	111.2
424	G	29.5	Very low	38.9	Very low	67 Å²	67	112 Å²	112	69%	0.691	67%	0.668	S	S	*	*			trans	-108.4	122.2	162.9	0	0	0	0	0	108.9	P422	P422-G424 PolarHBondContact O-N 2.89Å; P422-G424 VanDerWaalsContact O-N 3.12Å
425	T	34.5	Very low	39.7	Very low	138 Å²	138	113.8 Å²	113.8	85%	0.847	66%	0.66	S	S	*	*			trans	-56.7	129.8	175.5	41.4	0	0	0	0	110.3	K427	T425-K427 PolarHBondContact O-N 2.88Å
426	P	36.9	Very low	40.3	Very low	117 Å²	117	111.1 Å²	111.1	76%	0.76	64%	0.637	S	S	*	*			trans	-68	129.3	-176.7	26	-30.9	0	0	0	110.2	S428	P426-S428 PolarHBondContact O-N 2.84Å
427	K	45.7	Very low	41.2	Very low	143 Å²	143	103 Å²	103	62%	0.622	60%	0.604	S	S	*	*			trans	-44.6	127.7	166.9	-66.2	-168	171.9	-154.7	0	108.1	E125 T425 V429	E125-K427 IonicContact OE1-NZ 3.55Å; E125-K427 PolarHBondContact OE1-NZ 3.01Å; T425-K427 PolarHBondContact O-N 2.88Å; K427-V429 PolarHBondContact O-N 3.34Å
428	S	53.8	Low	41.9	Very low	53 Å²	53	105.4 Å²	105.4	37%	0.371	59%	0.591	S	S	.	*			trans	-55.4	126.6	-169.5	89.1	0	0	0	0	109.7	P426 K430 S431	P426-S428 PolarHBondContact O-N 2.84Å; S428-K430 PolarHBondContact O-N 2.81Å; S428-S431 PolarHBondContact O-N 3.41Å; S428-S431 PolarHBondContact OG-N 3.09Å; S428-S431 VanDerWaalsContact OG-N 3.14Å
429	V	50.1	Low	43	Very low	110 Å²	110	104.7 Å²	104.7	67%	0.667	58%	0.582	S	S	*	*	H	α-helix	trans	-52.7	-30.1	175.6	171.8	0	0	0	0	110.3	K427 K432 V433	K427-V429 PolarHBondContact O-N 3.34Å; V429-K432 PolarHBondContact O-N 3.06Å; V429-V433 HydrophobicContact CG1-CG2 4.35Å; V429-V433 VanDerWaalsContact O-CG2 3.26Å; V429-V433 WeakPolarHBondContact O-CG2 3.06Å; V429-V433 PolarHBondContact O-N 2.87Å; V429-V433 VanDerWaalsContact O-N 3.15Å
430	K	49.5	Very low	43.7	Very low	100 Å²	100	103.4 Å²	103.4	44%	0.435	57%	0.572	S	S	.	*	H	α-helix	trans	-60.1	-45.5	175.6	-64.3	-174.3	178	-176.7	0	113.2	S428 K432 V433 I434 C455	S428-K430 PolarHBondContact O-N 2.81Å; K430-K432 PolarHBondContact O-N 2.85Å; K430-V433 PolarHBondContact O-N 3.29Å; K430-I434 VanDerWaalsContact O-CG1 3.31Å; K430-I434 WeakPolarHBondContact O-CG1 3.31Å; K430-I434 PolarHBondContact O-N 3.09Å; K430-C455 WeakPolarHBondContact CE-O 3.34Å; K430-C455 HydrophobicContact CG-CB 4.39Å
431	S	48.1	Very low	44	Very low	19 Å²	19	94.4 Å²	94.4	13%	0.133	56%	0.557	C	S	.	*	H	α-helix	trans	-61.9	-43.8	179.5	167.4	0	0	0	0	112.3	E80 S428 V433 I434 Q435	E80-S431 VanDerWaalsContact OE1-CB 3.25Å; E80-S431 WeakPolarHBondContact OE1-CB 3.4Å; E80-S431 PolarHBondContact OE1-OG 3.35Å; E80-S431 WeakPolarHBondContact OE2-CB 3.31Å; E80-S431 PolarHBondContact OE2-OG 3.48Å; S428-S431 PolarHBondContact O-N 3.41Å; S428-S431 PolarHBondContact OG-N 3.09Å; S428-S431 VanDerWaalsContact OG-N 3.14Å; S431-V433 VanDerWaalsContact C-N 3.32Å; S431-V433 PolarHBondContact O-N 3.29Å; S431-I434 PolarHBondContact O-N 3.24Å; S431-Q435 VanDerWaalsContact O-CB 3.3Å; S431-Q435 WeakPolarHBondContact O-CB 3.45Å; S431-Q435 PolarHBondContact O-N 2.99Å
432	K	52.8	Low	45	Very low	140 Å²	140	92 Å²	92	61%	0.609	54%	0.542	S	S	*	.	H	α-helix	trans	-63.8	-36.4	175.7	-74.3	-175.7	177.6	178.2	0	113	V429 K430 A436	V429-K432 PolarHBondContact O-N 3.06Å; K430-K432 PolarHBondContact O-N 2.85Å; K432-A436 VanDerWaalsContact O-CB 3.31Å; K432-A436 WeakPolarHBondContact O-CB 3.26Å; K432-A436 PolarHBondContact O-N 3.33Å
433	V	54	Low	45.7	Very low	43 Å²	43	97.6 Å²	97.6	26%	0.261	55%	0.547	S	S	.	.	H	α-helix	trans	-73	-40.1	179	172.7	0	0	0	0	111.1	V429 K430 S431 A436 L437 I451	V429-V433 HydrophobicContact CG1-CG2 4.35Å; V429-V433 VanDerWaalsContact O-CG2 3.26Å; V429-V433 WeakPolarHBondContact O-CG2 3.06Å; V429-V433 PolarHBondContact O-N 2.87Å; V429-V433 VanDerWaalsContact O-N 3.15Å; K430-V433 PolarHBondContact O-N 3.29Å; S431-V433 VanDerWaalsContact C-N 3.32Å; S431-V433 PolarHBondContact O-N 3.29Å; V433-A436 WeakPolarHBondContact O-CB 3.33Å; V433-A436 PolarHBondContact O-N 3.31Å; V433-L437 HydrophobicContact CG1-CD1 4.27Å; V433-L437 VanDerWaalsContact O-CG 3.31Å; V433-L437 WeakPolarHBondContact O-CG 3.35Å; V433-L437 PolarHBondContact O-N 3.48Å; V433-I451 HydrophobicContact CG1-CG2 3.56Å
434	I	54	Low	46.9	Very low	36 Å²	36	95.2 Å²	95.2	19%	0.185	53%	0.529	C	S	.	.	H	α-helix	trans	-68.5	-41.5	176.3	-66.1	165.3	0	0	0	110.9	V57 K430 S431 A436 L437 Y438	V57-I434 HydrophobicContact CG2-CD1 4.2Å; K430-I434 VanDerWaalsContact O-CG1 3.31Å; K430-I434 WeakPolarHBondContact O-CG1 3.31Å; K430-I434 PolarHBondContact O-N 3.09Å; S431-I434 PolarHBondContact O-N 3.24Å; I434-A436 VanDerWaalsContact C-N 3.31Å; I434-A436 PolarHBondContact O-N 3.06Å; I434-L437 PolarHBondContact O-N 2.9Å; I434-Y438 HydrophobicContact CG2-CD2 4.4Å; I434-Y438 PolarHBondContact O-N 3.15Å
435	Q	49.8	Very low	48	Very low	134 Å²	134	95.7 Å²	95.7	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-62.3	-40.1	174.1	-166.5	174.3	23.1	0	0	111.1	S431 Y438 T439	S431-Q435 VanDerWaalsContact O-CB 3.3Å; S431-Q435 WeakPolarHBondContact O-CB 3.45Å; S431-Q435 PolarHBondContact O-N 2.99Å; Q435-Y438 PolarHBondContact O-N 3.47Å; Q435-T439 WeakPolarHBondContact O-CG2 3.34Å; Q435-T439 PolarHBondContact O-N 3.07Å; Q435-T439 VanDerWaalsContact O-N 3.12Å; Q435-T439 PolarHBondContact O-OG1 3.11Å
436	A	46.4	Very low	48.9	Very low	46 Å²	46	92 Å²	92	38%	0.38	51%	0.509	S	S	.	.	H	α-helix	trans	-61.5	-46.9	172.7	0	0	0	0	0	111.6	K432 V433 I434 Y438 T439 T440	K432-A436 VanDerWaalsContact O-CB 3.31Å; K432-A436 WeakPolarHBondContact O-CB 3.26Å; K432-A436 PolarHBondContact O-N 3.33Å; V433-A436 WeakPolarHBondContact O-CB 3.33Å; V433-A436 PolarHBondContact O-N 3.31Å; I434-A436 VanDerWaalsContact C-N 3.31Å; I434-A436 PolarHBondContact O-N 3.06Å; A436-Y438 VanDerWaalsContact C-N 3.34Å; A436-Y438 PolarHBondContact O-N 3.12Å; A436-T439 WeakPolarHBondContact CA-OG1 3.23Å; A436-T439 PolarHBondContact O-N 2.96Å; A436-T439 PolarHBondContact O-OG1 3.36Å; A436-T440 WeakPolarHBondContact O-CG2 3.44Å; A436-T440 PolarHBondContact O-N 3.36Å; A436-T440 PolarHBondContact O-OG1 3.27Å
437	L	51.6	Low	49.6	Very low	49 Å²	49	88 Å²	88	26%	0.257	49%	0.487	S	S	.	.	H	α-helix	trans	-60.1	-39	179	-75.7	168.8	0	0	0	113.4	V433 I434 T440 G441 I451	V433-L437 HydrophobicContact CG1-CD1 4.27Å; V433-L437 VanDerWaalsContact O-CG 3.31Å; V433-L437 WeakPolarHBondContact O-CG 3.35Å; V433-L437 PolarHBondContact O-N 3.48Å; I434-L437 PolarHBondContact O-N 2.9Å; L437-T440 PolarHBondContact O-OG1 3.34Å; L437-G441 PolarHBondContact O-N 3.29Å; L437-I451 HydrophobicContact CD1-CD1 4.39Å; L437-I451 HydrophobicContact CD1-CG2 4.19Å; L437-I451 HydrophobicContact CD2-CD1 3.76Å
438	Y	47.3	Very low	49.8	Very low	125 Å²	125	82.5 Å²	82.5	49%	0.49	47%	0.468	S	S	.	.	H	α-helix	trans	-67.9	-35.3	174.3	-104.7	-85.4	0	0	0	112.7	A33 N35 I434 Q435 A436	A33-Y438 HydrophobicContact CB-CE2 3.63Å; A33-Y438 WeakPolarHBondContact CB-OH 3.24Å; N35-Y438 PolarHBondContact ND2-OH 3.44Å; N35-Y438 VanDerWaalsContact ND2-OH 3.13Å; I434-Y438 HydrophobicContact CG2-CD2 4.4Å; I434-Y438 PolarHBondContact O-N 3.15Å; Q435-Y438 PolarHBondContact O-N 3.47Å; A436-Y438 VanDerWaalsContact C-N 3.34Å; A436-Y438 PolarHBondContact O-N 3.12Å
439	T	50.1	Low	50	Low	112 Å²	112	84.2 Å²	84.2	69%	0.687	47%	0.47	S	S	*	.	H	α-helix	trans	-77.6	-26	177	55.8	0	0	0	0	114	Q435 A436	Q435-T439 WeakPolarHBondContact O-CG2 3.34Å; Q435-T439 PolarHBondContact O-N 3.07Å; Q435-T439 VanDerWaalsContact O-N 3.12Å; Q435-T439 PolarHBondContact O-OG1 3.11Å; A436-T439 WeakPolarHBondContact CA-OG1 3.23Å; A436-T439 PolarHBondContact O-N 2.96Å; A436-T439 PolarHBondContact O-OG1 3.36Å
440	T	46.7	Very low	50.2	Low	90 Å²	90	85.1 Å²	85.1	55%	0.552	47%	0.47	S	S	*	.	H	α-helix	trans	-93.5	-4.5	-174.5	53.5	0	0	0	0	114.8	A436 L437 T442	A436-T440 WeakPolarHBondContact O-CG2 3.44Å; A436-T440 PolarHBondContact O-N 3.36Å; A436-T440 PolarHBondContact O-OG1 3.27Å; L437-T440 PolarHBondContact O-OG1 3.34Å; T440-T442 PolarHBondContact O-N 3.01Å; T440-T442 VanDerWaalsContact O-N 3.08Å
441	G	37.1	Very low	50.5	Low	60 Å²	60	83.1 Å²	83.1	62%	0.619	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	18.8	169.3	0	0	0	0	0	115.8	L437 R443	L437-G441 PolarHBondContact O-N 3.29Å; G441-R443 PolarHBondContact O-N 2.86Å; G441-R443 VanDerWaalsContact O-N 3.15Å
442	T	49.4	Very low	50.6	Low	79 Å²	79	85.3 Å²	85.3	49%	0.485	47%	0.469	S	S	.	.			trans	-69.3	111.7	-178.9	50.9	0	0	0	0	110	T440 D444	T440-T442 PolarHBondContact O-N 3.01Å; T440-T442 VanDerWaalsContact O-N 3.08Å; T442-D444 VanDerWaalsContact C-N 3.3Å
443	R	45.4	Very low	50.8	Low	240 Å²	240	82.1 Å²	82.1	91%	0.906	46%	0.461	S	S	*	.			trans	-86.2	5.3	178.4	-72.5	-177.7	169.9	170.2	0.2	114.1	G441 A445	G441-R443 PolarHBondContact O-N 2.86Å; G441-R443 VanDerWaalsContact O-N 3.15Å; R443-A445 PolarHBondContact O-N 3.49Å
444	D	53.1	Low	50.7	Low	98 Å²	98	82.2 Å²	82.2	52%	0.524	47%	0.467	S	S	.	.			trans	-86.5	111.8	-174.5	-168.7	-2.8	0	0	0	111.4	T442 A446 A447 A448	T442-D444 VanDerWaalsContact C-N 3.3Å; D444-A446 PolarHBondContact O-N 3.43Å; D444-A446 WeakPolarHBondContact OD1-CB 3.36Å; D444-A446 PolarHBondContact OD1-N 2.78Å; D444-A447 HydrophobicContact CB-CB 4.09Å; D444-A447 PolarHBondContact O-N 3.17Å; D444-A448 PolarHBondContact O-N 2.82Å
445	A	51.6	Low	50.5	Low	77 Å²	77	81.9 Å²	81.9	64%	0.636	47%	0.468	S	S	*	.	H	α-helix	trans	-62.7	-29.1	178.6	0	0	0	0	0	112.6	R443 E449	R443-A445 PolarHBondContact O-N 3.49Å; A445-E449 PolarHBondContact O-N 3.41Å
446	A	52.8	Low	50.6	Low	60 Å²	60	82.6 Å²	82.6	50%	0.496	47%	0.469	S	S	.	.	H	α-helix	trans	-71.3	-39.7	178.2	0	0	0	0	0	111.8	D444 E449 L450	D444-A446 PolarHBondContact O-N 3.43Å; D444-A446 WeakPolarHBondContact OD1-CB 3.36Å; D444-A446 PolarHBondContact OD1-N 2.78Å; A446-E449 PolarHBondContact O-N 3.21Å; A446-L450 PolarHBondContact O-N 3.28Å; A446-L450 VanDerWaalsContact O-N 3.11Å
447	A	51.9	Low	50.7	Low	34 Å²	34	85.3 Å²	85.3	28%	0.281	48%	0.481	S	S	.	.	H	α-helix	trans	-65.8	-39.5	176	0	0	0	0	0	111.8	D444 E449 L450 I451	D444-A447 HydrophobicContact CB-CB 4.09Å; D444-A447 PolarHBondContact O-N 3.17Å; A447-E449 VanDerWaalsContact C-N 3.32Å; A447-E449 PolarHBondContact O-N 2.72Å; A447-L450 PolarHBondContact O-N 3.08Å; A447-I451 WeakPolarHBondContact O-CD1 3.28Å; A447-I451 VanDerWaalsContact O-CG1 3.26Å; A447-I451 WeakPolarHBondContact O-CG1 3.18Å; A447-I451 PolarHBondContact O-N 3.23Å; A447-I451 VanDerWaalsContact O-N 3.14Å
448	A	50.3	Low	50.1	Low	28 Å²	28	86.4 Å²	86.4	23%	0.231	50%	0.497	C	S	.	.	H	α-helix	trans	-62.2	-38.3	174.9	0	0	0	0	0	112.3	D444 I451 R452	D444-A448 PolarHBondContact O-N 2.82Å; A448-I451 PolarHBondContact O-N 3.23Å; A448-R452 WeakPolarHBondContact O-CG 3.38Å; A448-R452 PolarHBondContact O-N 3.38Å
449	E	57.6	Low	49.9	Very low	88 Å²	88	86.7 Å²	86.7	41%	0.411	51%	0.511	S	S	.	.	H	α-helix	trans	-72.8	-37.6	179.8	-167.1	57.1	-153	0	0	113.2	A445 A446 A447 I451 R452 T453	A445-E449 PolarHBondContact O-N 3.41Å; A446-E449 PolarHBondContact O-N 3.21Å; A447-E449 VanDerWaalsContact C-N 3.32Å; A447-E449 PolarHBondContact O-N 2.72Å; E449-I451 VanDerWaalsContact C-N 3.31Å; E449-I451 PolarHBondContact O-N 3.36Å; E449-R452 PolarHBondContact O-N 2.87Å; E449-R452 IonicContact OE2-CZ 2.83Å; E449-R452 IonicContact OE2-NH1 2.68Å; E449-R452 PolarHBondContact OE2-NH1 3.29Å; E449-T453 WeakPolarHBondContact O-CB 3.27Å; E449-T453 PolarHBondContact O-N 3.34Å; E449-T453 PolarHBondContact O-OG1 2.93Å
450	L	55.7	Low	49.1	Very low	129 Å²	129	84.8 Å²	84.8	68%	0.675	51%	0.507	S	S	*	.	H	α-helix	trans	-60.8	-42	171.9	-78.3	167.1	0	0	0	111.5	A446 A447 T453 A454	A446-L450 PolarHBondContact O-N 3.28Å; A446-L450 VanDerWaalsContact O-N 3.11Å; A447-L450 PolarHBondContact O-N 3.08Å; L450-T453 PolarHBondContact O-N 3.04Å; L450-A454 WeakPolarHBondContact O-CB 3.34Å; L450-A454 PolarHBondContact O-N 2.98Å
451	I	53.8	Low	48.5	Very low	58 Å²	58	86.7 Å²	86.7	30%	0.297	52%	0.521	S	S	.	.	H	α-helix	trans	-69.6	-40	178.4	-65.2	167.1	0	0	0	111	V433 L437 A447 A448 E449 T453 A454 C455	V433-I451 HydrophobicContact CG1-CG2 3.56Å; L437-I451 HydrophobicContact CD1-CD1 4.39Å; L437-I451 HydrophobicContact CD1-CG2 4.19Å; L437-I451 HydrophobicContact CD2-CD1 3.76Å; A447-I451 WeakPolarHBondContact O-CD1 3.28Å; A447-I451 VanDerWaalsContact O-CG1 3.26Å; A447-I451 WeakPolarHBondContact O-CG1 3.18Å; A447-I451 PolarHBondContact O-N 3.23Å; A447-I451 VanDerWaalsContact O-N 3.14Å; A448-I451 PolarHBondContact O-N 3.23Å; E449-I451 VanDerWaalsContact C-N 3.31Å; E449-I451 PolarHBondContact O-N 3.36Å; I451-T453 VanDerWaalsContact C-N 3.34Å; I451-T453 PolarHBondContact O-N 3.4Å; I451-A454 PolarHBondContact O-N 3.49Å; I451-C455 WeakPolarHBondContact O-CB 3.49Å; I451-C455 PolarHBondContact O-N 3.1Å; I451-C455 PolarHBondContact O-SG 3.39Å; I451-C455 VanDerWaalsContact O-SG 3.34Å
452	R	51.1	Low	48.4	Very low	66 Å²	66	90.5 Å²	90.5	25%	0.249	53%	0.532	C	S	.	.	H	α-helix	trans	-59.5	-44.4	172.4	-78.4	-174.7	-154.7	107.7	11.1	112.2	L30 A448 E449 C455 K456	L30-R452 VanDerWaalsContact C-NH2 3.33Å; L30-R452 PolarHBondContact O-NE 3.35Å; L30-R452 PolarHBondContact O-NH2 3.46Å; A448-R452 WeakPolarHBondContact O-CG 3.38Å; A448-R452 PolarHBondContact O-N 3.38Å; E449-R452 PolarHBondContact O-N 2.87Å; E449-R452 IonicContact OE2-CZ 2.83Å; E449-R452 IonicContact OE2-NH1 2.68Å; E449-R452 PolarHBondContact OE2-NH1 3.29Å; R452-C455 PolarHBondContact O-N 3.22Å; R452-K456 WeakPolarHBondContact O-CB 3.48Å; R452-K456 WeakPolarHBondContact O-CG 3.5Å; R452-K456 PolarHBondContact O-N 3.19Å
453	T	58.1	Low	47.8	Very low	72 Å²	72	88.7 Å²	88.7	44%	0.442	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-44.1	179.6	-52.8	0	0	0	0	110.5	E449 L450 I451 K456 T457	E449-T453 WeakPolarHBondContact O-CB 3.27Å; E449-T453 PolarHBondContact O-N 3.34Å; E449-T453 PolarHBondContact O-OG1 2.93Å; L450-T453 PolarHBondContact O-N 3.04Å; I451-T453 VanDerWaalsContact C-N 3.34Å; I451-T453 PolarHBondContact O-N 3.4Å; T453-K456 PolarHBondContact O-N 3.25Å; T453-T457 WeakPolarHBondContact O-CG2 3.29Å; T453-T457 PolarHBondContact O-N 3.45Å; T453-T457 PolarHBondContact O-OG1 3.35Å; T453-T457 VanDerWaalsContact O-OG1 3.13Å
454	A	51	Low	47.4	Very low	45 Å²	45	81.5 Å²	81.5	37%	0.372	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-38.3	175.1	0	0	0	0	0	113	L450 I451 T457 A458	L450-A454 WeakPolarHBondContact O-CB 3.34Å; L450-A454 PolarHBondContact O-N 2.98Å; I451-A454 PolarHBondContact O-N 3.49Å; A454-T457 PolarHBondContact O-N 3.26Å; A454-T457 PolarHBondContact O-OG1 2.81Å; A454-T457 VanDerWaalsContact O-OG1 3.14Å; A454-A458 WeakPolarHBondContact O-CB 3.41Å; A454-A458 PolarHBondContact O-N 3.28Å
455	C	49.2	Very low	46.9	Very low	30 Å²	30	85.4 Å²	85.4	20%	0.203	53%	0.533	C	S	.	.	H	α-helix	trans	-75.2	-23.8	177.6	-72.4	0	0	0	0	113.8	K430 I451 R452	K430-C455 WeakPolarHBondContact CE-O 3.34Å; K430-C455 HydrophobicContact CG-CB 4.39Å; I451-C455 WeakPolarHBondContact O-CB 3.49Å; I451-C455 PolarHBondContact O-N 3.1Å; I451-C455 PolarHBondContact O-SG 3.39Å; I451-C455 VanDerWaalsContact O-SG 3.34Å; R452-C455 PolarHBondContact O-N 3.22Å
456	K	52.1	Low	46.4	Very low	149 Å²	149	89 Å²	89	65%	0.648	54%	0.537	S	S	*	.	H	α-helix	trans	-75.5	-31.9	172.2	-79.3	178.5	178.5	177	0	112.2	R452 T453	R452-K456 WeakPolarHBondContact O-CB 3.48Å; R452-K456 WeakPolarHBondContact O-CG 3.5Å; R452-K456 PolarHBondContact O-N 3.19Å; T453-K456 PolarHBondContact O-N 3.25Å
457	T	48.4	Very low	45.9	Very low	103 Å²	103	89.8 Å²	89.8	63%	0.632	54%	0.535	S	S	*	.	H	α-helix	trans	-88.5	-14.8	-179.7	55	0	0	0	0	114.1	T453 A454 T459	T453-T457 WeakPolarHBondContact O-CG2 3.29Å; T453-T457 PolarHBondContact O-N 3.45Å; T453-T457 PolarHBondContact O-OG1 3.35Å; T453-T457 VanDerWaalsContact O-OG1 3.13Å; A454-T457 PolarHBondContact O-N 3.26Å; A454-T457 PolarHBondContact O-OG1 2.81Å; A454-T457 VanDerWaalsContact O-OG1 3.14Å; T457-T459 PolarHBondContact O-N 3.32Å
458	A	39.9	Very low	45.4	Very low	72 Å²	72	95.3 Å²	95.3	60%	0.595	55%	0.553	S	S	*	*			trans	-77.1	24.8	-175.9	0	0	0	0	0	116.2	A454 A460	A454-A458 WeakPolarHBondContact O-CB 3.41Å; A454-A458 PolarHBondContact O-N 3.28Å; A458-A460 PolarHBondContact O-N 3.06Å
459	T	41.7	Very low	45.2	Very low	130 Å²	130	98.7 Å²	98.7	80%	0.798	57%	0.568	S	S	*	*			trans	-78.9	13.8	178.1	44.7	0	0	0	0	114.7	T457	T457-T459 PolarHBondContact O-N 3.32Å
460	A	33.7	Very low	44.6	Very low	72 Å²	72	100.8 Å²	100.8	60%	0.595	58%	0.577	S	S	*	*	S	Bend	trans	-129	128.7	178.4	0	0	0	0	0	112.6	A458 V462	A458-A460 PolarHBondContact O-N 3.06Å; A460-V462 PolarHBondContact O-N 3.24Å; A460-V462 VanDerWaalsContact O-N 3.11Å
461	P	33.8	Very low	44.2	Very low	130 Å²	130	99.1 Å²	99.1	84%	0.844	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	61.1	-170.4	37.7	-35.4	0	0	0	112
462	V	36.3	Very low	43.8	Very low	141 Å²	141	102.8 Å²	102.8	86%	0.855	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.4	-12.3	177.5	-165.9	0	0	0	0	116.3	A460	A460-V462 PolarHBondContact O-N 3.24Å; A460-V462 VanDerWaalsContact O-N 3.11Å
463	G	35.5	Very low	43.5	Very low	40 Å²	40	104.5 Å²	104.5	41%	0.412	60%	0.596	S	S	.	*			trans	-115.9	-4.9	-169.3	0	0	0	0	0	118.7	K465 E466 T467	G463-K465 PolarHBondContact O-N 3.47Å; G463-E466 PolarHBondContact O-N 2.96Å; G463-T467 PolarHBondContact O-OG1 3.38Å
464	A	38.6	Very low	43	Very low	89 Å²	89	106.6 Å²	106.6	74%	0.736	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	0.2	-158.8	0	0	0	0	0	117.2
465	K	40.8	Very low	42.6	Very low	181 Å²	181	109.2 Å²	109.2	79%	0.787	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-36.9	176.8	-121.7	-178.3	178.9	-174.5	0	112.6	G463	G463-K465 PolarHBondContact O-N 3.47Å
466	E	41.8	Very low	42.4	Very low	153 Å²	153	114.3 Å²	114.3	72%	0.715	63%	0.633	S	S	*	*	H	α-helix	trans	-77.4	-28.8	-177.8	-69.1	175.9	165.8	0	0	112.3	G463 Q470	G463-E466 PolarHBondContact O-N 2.96Å; E466-Q470 PolarHBondContact O-N 3.3Å
467	T	42.4	Very low	42	Very low	76 Å²	76	113 Å²	113	47%	0.466	63%	0.633	S	S	.	*	H	α-helix	trans	-75.2	-25.3	179.3	-19.5	0	0	0	0	112.9	G463 I471	G463-T467 PolarHBondContact O-OG1 3.38Å; T467-I471 VanDerWaalsContact O-CD1 3.31Å; T467-I471 WeakPolarHBondContact O-CD1 3.4Å; T467-I471 VanDerWaalsContact O-CG1 3.26Å; T467-I471 WeakPolarHBondContact O-CG1 3.41Å; T467-I471 PolarHBondContact O-N 3.33Å
468	F	41.1	Very low	41.7	Very low	150 Å²	150	113.2 Å²	113.2	66%	0.658	63%	0.634	S	S	*	*	H	α-helix	trans	-78.8	-35.8	-179.4	-161.1	-93.8	0	0	0	112.1	K472	F468-K472 PolarHBondContact O-N 3.03Å
469	D	45.8	Very low	41.7	Very low	99 Å²	99	117.6 Å²	117.6	53%	0.529	65%	0.646	S	S	.	*	H	α-helix	trans	-72.5	-37.2	177.5	-69.6	-27	0	0	0	111.5	I471 K472 D473	D469-I471 VanDerWaalsContact C-N 3.34Å; D469-I471 PolarHBondContact O-N 3.37Å; D469-K472 WeakPolarHBondContact O-CB 3.05Å; D469-K472 PolarHBondContact O-N 3.5Å; D469-K472 VanDerWaalsContact O-N 3.17Å; D469-D473 PolarHBondContact O-N 2.99Å
470	Q	46.6	Very low	41.5	Very low	132 Å²	132	115.7 Å²	115.7	62%	0.617	64%	0.639	S	S	*	*	H	α-helix	trans	-65.7	-30.2	174.8	-80	169.9	-3.9	0	0	114.2	E466 K472 N474	E466-Q470 PolarHBondContact O-N 3.3Å; Q470-K472 VanDerWaalsContact C-N 3.34Å; Q470-N474 PolarHBondContact O-N 3.29Å
471	I	46.1	Very low	41.7	Very low	94 Å²	94	116.7 Å²	116.7	48%	0.482	64%	0.641	S	S	.	*	H	α-helix	trans	-76.2	-25.9	176	-67.7	168.1	0	0	0	111.3	T467 D469 N475	T467-I471 VanDerWaalsContact O-CD1 3.31Å; T467-I471 WeakPolarHBondContact O-CD1 3.4Å; T467-I471 VanDerWaalsContact O-CG1 3.26Å; T467-I471 WeakPolarHBondContact O-CG1 3.41Å; T467-I471 PolarHBondContact O-N 3.33Å; D469-I471 VanDerWaalsContact C-N 3.34Å; D469-I471 PolarHBondContact O-N 3.37Å; I471-N475 PolarHBondContact O-ND2 3.23Å
472	K	45.4	Very low	41.9	Very low	135 Å²	135	116 Å²	116	59%	0.587	64%	0.64	S	S	*	*	H	α-helix	trans	-75.9	-38.1	177.9	-154.2	178.2	-177.8	-174.2	0	111.9	F468 D469 Q470	F468-K472 PolarHBondContact O-N 3.03Å; D469-K472 WeakPolarHBondContact O-CB 3.05Å; D469-K472 PolarHBondContact O-N 3.5Å; D469-K472 VanDerWaalsContact O-N 3.17Å; Q470-K472 VanDerWaalsContact C-N 3.34Å
473	D	45.9	Very low	42.1	Very low	101 Å²	101	115.1 Å²	115.1	54%	0.54	64%	0.637	S	S	.	*	H	α-helix	trans	-73.1	-36	178.1	-72.4	-13.9	0	0	0	112.6	D469 N475 Q476	D469-D473 PolarHBondContact O-N 2.99Å; D473-N475 PolarHBondContact O-N 2.91Å; D473-Q476 PolarHBondContact O-N 3.37Å
474	N	45.9	Very low	42.3	Very low	116 Å²	116	119.2 Å²	119.2	62%	0.62	66%	0.656	S	S	*	*	H	α-helix	trans	-71.8	-25.6	178.1	-85.2	-10.8	0	0	0	114	Q470	Q470-N474 PolarHBondContact O-N 3.29Å
475	N	44.6	Very low	42.2	Very low	101 Å²	101	126.9 Å²	126.9	54%	0.54	67%	0.666	S	S	.	*	H	α-helix	trans	-83.8	-15	177.7	-82.9	-38.6	0	0	0	114	I471 D473	I471-N475 PolarHBondContact O-ND2 3.23Å; D473-N475 PolarHBondContact O-N 2.91Å
476	Q	44.5	Very low	42	Very low	137 Å²	137	123.5 Å²	123.5	64%	0.64	67%	0.671	S	S	*	*	H	α-helix	trans	-79.1	-25.3	173	-76	-173.3	-12.6	0	0	112.9	D473	D473-Q476 PolarHBondContact O-N 3.37Å
477	N	43.9	Very low	41.8	Very low	120 Å²	120	119.4 Å²	119.4	64%	0.642	67%	0.671	S	S	*	*	S	Bend	trans	-84	-12.1	179.7	-78.3	-28.1	0	0	0	114.8	S480	N477-S480 PolarHBondContact O-OG 3.46Å
478	V	42	Very low	41.5	Very low	108 Å²	108	125 Å²	125	66%	0.655	69%	0.691	S	S	*	*	S	Bend	trans	-91.2	-16.1	-179.3	179.6	0	0	0	0	112.3
479	L	38.8	Very low	41.5	Very low	164 Å²	164	125.7 Å²	125.7	86%	0.859	70%	0.7	S	S	*	*	S	Bend	trans	-91.6	2.6	179.5	-74.3	164	0	0	0	114.1
480	S	38.9	Very low	41.2	Very low	91 Å²	91	125.2 Å²	125.2	64%	0.636	71%	0.709	S	S	*	*	S	Bend	trans	-114.5	5.1	-176	57.7	0	0	0	0	115.7	N477	N477-S480 PolarHBondContact O-OG 3.46Å
481	S	37.3	Very low	40.7	Very low	93 Å²	93	126.2 Å²	126.2	65%	0.65	72%	0.719	S	S	*	*			trans	-112.7	99.8	179.2	60.7	0	0	0	0	112.2
482	S	36.8	Very low	40.4	Very low	116 Å²	116	128.9 Å²	128.9	81%	0.811	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-61.4	138.9	168.5	-55.1	0	0	0	0	111.2
483	P	42	Very low	40.2	Very low	121 Å²	121	127.8 Å²	127.8	79%	0.786	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-74.7	146.5	179	30.1	-32.6	0	0	0	111.5
484	P	39	Very low	40.1	Very low	126 Å²	126	132.9 Å²	132.9	82%	0.818	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-77.5	142.3	-178.3	31.5	-32.1	0	0	0	111.9	A486	P484-A486 PolarHBondContact O-N 2.83Å
485	R	35.8	Very low	39.8	Very low	251 Å²	251	133.8 Å²	133.8	95%	0.947	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.2	125.5	173.4	-90.9	174.4	163.2	175	-5.6	111.4	G487	R485-G487 PolarHBondContact O-N 3.08Å
486	A	37.8	Very low	39.5	Very low	109 Å²	109	135.5 Å²	135.5	90%	0.901	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.8	119	165.7	0	0	0	0	0	110.1	P484	P484-A486 PolarHBondContact O-N 2.83Å
487	G	37.6	Very low	39.2	Very low	68 Å²	68	135.4 Å²	135.4	70%	0.701	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-103.4	132.8	173.6	0	0	0	0	0	111.8	R485	R485-G487 PolarHBondContact O-N 3.08Å
488	H	36.9	Very low	39	Very low	193 Å²	193	136.3 Å²	136.3	89%	0.894	81%	0.812	S	S	*	*			trans	-9.4	123.9	161.9	-70.4	-81.7	0	0	0	119.3
489	I	40.6	Very low	38.8	Very low	165 Å²	165	138.1 Å²	138.1	85%	0.846	82%	0.822	S	S	*	*			trans	-151.8	91.5	142.1	-53.9	-176.8	0	0	0	105.7
490	A	40	Very low	38.8	Very low	88 Å²	88	136.3 Å²	136.3	73%	0.727	82%	0.82	S	S	*	*				66.2	106.9	88	0	0	0	0	0	113.6
491	D	36.1	Very low	38.8	Very low	154 Å²	154	139.6 Å²	139.6	82%	0.824	83%	0.833	S	S	*	*			trans	-51.5	136.6	166.3	-59.5	-58.3	0	0	0	111.8
492	N	38.2	Very low	38.9	Very low	150 Å²	150	143.2 Å²	143.2	80%	0.802	85%	0.847	S	S	*	*				-176	128.8	127.8	-106.2	-14.5	0	0	0	114.1
493	V	40.8	Very low	39	Very low	111 Å²	111	145.4 Å²	145.4	67%	0.673	85%	0.85	S	S	*	*				94	122	127.4	177.1	0	0	0	0	118.9
494	T	43.8	Very low	38.8	Very low	209 Å²	209	147.6 Å²	147.6	100%	1.282	86%	0.856	S	S	*	*			trans	75.6	0	161.4	39.6	0	0	0	0	119.9

Retrieved 494 of 494 residues in 387.3 ms (Link to these results)

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