A0A077Z3P2_TRITR Loading...

Tyrosine protein phosphatase non receptor type

AlphaFold DB , UniProt , Accession A0A077Z3P2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 302 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	33.2	Very low	37.6	Very low	239 Å²	239	145.7 Å²	145.7	100%	1.177	79%	0.786	S	S	*	*				0	90.4	0	-79.6	-175.7	-113.5	0	0	109.2
2	L	33.1	Very low	37.9	Very low	176 Å²	176	153.3 Å²	153.3	92%	0.921	79%	0.794	S	S	*	*			trans	-105.1	93.8	171.1	-77.2	163	0	0	0	107.3	G4	L2-G4 VanDerWaalsContact C-N 3.28Å; L2-G4 PolarHBondContact O-N 3.36Å
3	K	33.4	Very low	38.7	Very low	209 Å²	209	147.5 Å²	147.5	91%	0.909	76%	0.76	S	S	*	*			trans	-75.4	86.6	167.2	-77.1	-175.2	176.4	179.3	0	107.4
4	G	34.3	Very low	39.4	Very low	53 Å²	53	145 Å²	145	55%	0.546	75%	0.747	S	S	.	*			trans	-70.2	143.9	172.7	0	0	0	0	0	111.3	L2 C6	L2-G4 VanDerWaalsContact C-N 3.28Å; L2-G4 PolarHBondContact O-N 3.36Å; G4-C6 VanDerWaalsContact C-N 3.28Å; G4-C6 PolarHBondContact O-N 2.86Å
5	P	42.5	Very low	40.3	Very low	122 Å²	122	138.6 Å²	138.6	79%	0.792	72%	0.72	S	S	*	*	S	Bend	trans	-81.5	67.4	-174.3	34.3	-34.2	0	0	0	111.3
6	C	40.8	Very low	41.4	Very low	119 Å²	119	141.4 Å²	141.4	80%	0.804	73%	0.732	S	S	*	*			trans	-91.8	-5.5	175.5	-85.7	0	0	0	0	114.4	G4	G4-C6 VanDerWaalsContact C-N 3.28Å; G4-C6 PolarHBondContact O-N 2.86Å
7	A	40.2	Very low	42.8	Very low	87 Å²	87	134.5 Å²	134.5	72%	0.719	70%	0.695	S	S	*	*	S	Bend	trans	-87.3	-16.3	-176.3	0	0	0	0	0	114.6
8	H	35.7	Very low	44.5	Very low	157 Å²	157	133.8 Å²	133.8	73%	0.727	69%	0.687	S	S	*	*	S	Bend	trans	-86.1	-14.3	-174.8	-92.6	-62.1	0	0	0	114.9	N10	H8-N10 VanDerWaalsContact C-N 3.35Å; H8-N10 PolarHBondContact O-N 3.11Å
9	F	44.5	Very low	46.7	Very low	156 Å²	156	133.2 Å²	133.2	68%	0.684	68%	0.676	S	S	*	*	S	Bend	trans	-73.2	-26.7	-176.3	-148.4	-98.5	0	0	0	112.9	F13	F9-F13 AromaticContact CD1-CE2 3.89Å; F9-F13 HydrophobicContact CD1-CE2 3.89Å; F9-F13 AromaticContact CE1-CE2 3.66Å; F9-F13 HydrophobicContact CE1-CE2 3.66Å; F9-F13 HydrophobicContact CE1-CZ 4.16Å; F9-F13 HydrophobicContact CZ-CE2 4.36Å; F9-F13 WeakPolarHBondContact O-CD2 3.42Å
10	N	38.2	Very low	49	Very low	122 Å²	122	126.7 Å²	126.7	65%	0.652	64%	0.642	S	S	*	*	S	Bend	trans	-81	-25	-174.7	-83.1	-5.7	0	0	0	115	H8 R12	H8-N10 VanDerWaalsContact C-N 3.35Å; H8-N10 PolarHBondContact O-N 3.11Å; N10-R12 PolarHBondContact O-N 2.68Å
11	K	38.2	Very low	51.2	Low	163 Å²	163	121.8 Å²	121.8	71%	0.709	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-73.8	-25.6	-172	-81.7	-170.3	176.9	-175.8	0	114.5	L14	K11-L14 HydrophobicContact CG-CD1 4.48Å
12	R	40.4	Very low	54	Low	236 Å²	236	113.2 Å²	113.2	89%	0.891	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-77.4	-21.4	-175.8	-120.9	178	-178.2	167.3	-0.4	113.7	N10	N10-R12 PolarHBondContact O-N 2.68Å
13	F	48.8	Very low	56.9	Low	79 Å²	79	108.1 Å²	108.1	35%	0.346	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-91.7	-3.4	179.4	-61.8	-76.4	0	0	0	113.8	F9 S15 P27	F9-F13 AromaticContact CD1-CE2 3.89Å; F9-F13 HydrophobicContact CD1-CE2 3.89Å; F9-F13 AromaticContact CE1-CE2 3.66Å; F9-F13 HydrophobicContact CE1-CE2 3.66Å; F9-F13 HydrophobicContact CE1-CZ 4.16Å; F9-F13 HydrophobicContact CZ-CE2 4.36Å; F9-F13 WeakPolarHBondContact O-CD2 3.42Å; F13-S15 PolarHBondContact O-N 2.69Å; F13-P27 HydrophobicContact CD1-CB 4.07Å; F13-P27 HydrophobicContact CE1-CB 4.18Å; F13-P27 HydrophobicContact CG-CB 4.46Å
14	L	48.1	Very low	59.6	Low	112 Å²	112	100.4 Å²	100.4	59%	0.586	53%	0.526	S	S	*	.			trans	-79.6	49.3	179.4	-66	169.5	0	0	0	111.2	K11 F18	K11-L14 HydrophobicContact CG-CD1 4.48Å; L14-F18 HydrophobicContact CD2-CE2 4.38Å
15	S	52.7	Low	62.3	Low	49 Å²	49	103.4 Å²	103.4	34%	0.343	53%	0.529	S	S	.	.			trans	-58	151.7	168.3	66.6	0	0	0	0	108.9	F13 E17	F13-S15 PolarHBondContact O-N 2.69Å; S15-E17 WeakPolarHBondContact CB-OE2 3.29Å; S15-E17 PolarHBondContact O-N 3.05Å; S15-E17 PolarHBondContact OG-OE2 2.66Å
16	M	57.8	Low	64.8	Low	183 Å²	183	97.9 Å²	97.9	90%	0.901	49%	0.493	S	S	*	.	S	Bend	trans	-61.2	9.4	-178.2	-61.3	-177.5	-61.2	0	0	114.3
17	E	66.2	Low	67.4	Low	24 Å²	24	93.7 Å²	93.7	11%	0.112	46%	0.464	C	S	.	.			trans	-97.1	19.3	-169.6	-70.3	147	-176.4	0	0	113.1	S15 Y19 K20 N21 N43 Y45	S15-E17 WeakPolarHBondContact CB-OE2 3.29Å; S15-E17 PolarHBondContact O-N 3.05Å; S15-E17 PolarHBondContact OG-OE2 2.66Å; E17-Y19 PolarHBondContact O-N 3.35Å; E17-K20 WeakPolarHBondContact O-CA 3.25Å; E17-K20 PolarHBondContact O-N 3.42Å; E17-N21 PolarHBondContact O-N 2.81Å; E17-N43 WeakPolarHBondContact CG-ND2 3.28Å; E17-N43 PolarHBondContact OE1-ND2 2.73Å; E17-N43 PolarHBondContact OE1-OD1 2.71Å; E17-Y45 HydrophobicContact CB-CD1 3.73Å; E17-Y45 HydrophobicContact CB-CE1 3.83Å; E17-Y45 HydrophobicContact CB-CG 4.24Å; E17-Y45 HydrophobicContact CG-CD1 3.75Å; E17-Y45 HydrophobicContact CG-CE1 4.34Å; E17-Y45 HydrophobicContact CG-CG 3.85Å; E17-Y45 WeakPolarHBondContact OE1-CB 3.44Å; E17-Y45 WeakPolarHBondContact OE2-CD2 3.29Å; E17-Y45 WeakPolarHBondContact OE2-CE2 3.39Å
18	F	73.1	Confident	70.1	Confident	123 Å²	123	90.1 Å²	90.1	54%	0.539	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-54.9	-31.7	-175.8	-140.3	-91.9	0	0	0	112.5	L14 K20 N21	L14-F18 HydrophobicContact CD2-CE2 4.38Å; F18-K20 VanDerWaalsContact C-N 3.32Å; F18-K20 PolarHBondContact O-N 3.42Å; F18-N21 PolarHBondContact O-N 3.09Å
19	Y	86.5	Confident	73	Confident	122 Å²	122	84 Å²	84	48%	0.478	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-70.4	-23.8	175.8	74.1	-85.4	0	0	0	114	E17 N21 D41	E17-Y19 PolarHBondContact O-N 3.35Å; Y19-N21 VanDerWaalsContact C-N 3.33Å; Y19-D41 PolarHBondContact OH-OD2 3.42Å
20	K	93.1	Very high	75.4	Confident	2 Å²	2	82 Å²	82	1%	0.009	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-85.9	-3.4	174.9	-63.5	-166.6	179.4	-170.3	0	112.4	E17 F18 D41 N43 Y45 Q64 L67 T70 D73	E17-K20 WeakPolarHBondContact O-CA 3.25Å; E17-K20 PolarHBondContact O-N 3.42Å; F18-K20 VanDerWaalsContact C-N 3.32Å; F18-K20 PolarHBondContact O-N 3.42Å; K20-D41 WeakPolarHBondContact CE-OD2 3.44Å; K20-D41 IonicContact NZ-OD1 3.01Å; K20-D41 PolarHBondContact NZ-OD1 3.49Å; K20-D41 IonicContact NZ-OD2 3.74Å; K20-D41 PolarHBondContact NZ-OD2 3.06Å; K20-N43 PolarHBondContact NZ-O 3.39Å; K20-Y45 HydrophobicContact CB-CD1 3.92Å; K20-Y45 HydrophobicContact CB-CE1 3.92Å; K20-Y45 HydrophobicContact CD-CD1 3.96Å; K20-Q64 PolarHBondContact O-NE2 3.18Å; K20-L67 WeakPolarHBondContact O-CD1 3.34Å; K20-T70 HydrophobicContact CB-CG2 4.05Å; K20-T70 HydrophobicContact CG-CG2 4.07Å; K20-D73 IonicContact NZ-OD2 2.68Å
21	N	94.3	Very high	78.2	Confident	25 Å²	25	84 Å²	84	13%	0.134	40%	0.401	C	S	.	.			trans	-105	125.2	-178.2	-63.9	-14.3	0	0	0	110.9	E17 F18 Y19 Y23 Y45 H47	E17-N21 PolarHBondContact O-N 2.81Å; F18-N21 PolarHBondContact O-N 3.09Å; Y19-N21 VanDerWaalsContact C-N 3.33Å; N21-Y23 VanDerWaalsContact C-N 3.31Å; N21-Y45 WeakPolarHBondContact OD1-CE1 3.42Å; N21-Y45 VanDerWaalsContact OD1-CZ 3.31Å; N21-Y45 PolarHBondContact OD1-OH 3.33Å; N21-H47 PolarHBondContact OD1-CD2 3.01Å; N21-H47 VanDerWaalsContact OD1-CD2 3.31Å
22	L	93.4	Very high	81	Confident	58 Å²	58	77.5 Å²	77.5	30%	0.304	38%	0.375	S	S	.	.	S	Bend	trans	-69.1	-33.5	175.8	-176.7	62.2	0	0	0	112	A65 L67	L22-A65 HydrophobicContact CD2-CB 4.05Å; L22-L67 HydrophobicContact CB-CD1 4.23Å; L22-L67 HydrophobicContact CB-CD2 4.28Å; L22-L67 HydrophobicContact CB-CG 4.3Å; L22-L67 HydrophobicContact CD1-CD2 4.04Å; L22-L67 HydrophobicContact CD1-CG 4.24Å
23	Y	92.8	Very high	83.8	Confident	70 Å²	70	68.2 Å²	68.2	28%	0.275	34%	0.34	S	S	.	.			trans	-134.4	119.3	-179.8	-64.5	-69.6	0	0	0	109.1	N21 D25 I26 S197 A198	N21-Y23 VanDerWaalsContact C-N 3.31Å; Y23-D25 WeakPolarHBondContact CB-OD1 3.49Å; Y23-D25 PolarHBondContact O-N 3.12Å; Y23-I26 VanDerWaalsContact CB-CG1 3.43Å; Y23-I26 HydrophobicContact CD2-CG1 4.35Å; Y23-I26 HydrophobicContact CG-CG1 4.2Å; Y23-I26 PolarHBondContact O-N 3.17Å; Y23-S197 WeakPolarHBondContact CE2-OG 3.33Å; Y23-S197 PolarHBondContact OH-OG 3.43Å; Y23-A198 HydrophobicContact CD2-CB 3.68Å; Y23-A198 HydrophobicContact CE2-CB 3.9Å
24	G	90.5	Very high	86.1	Confident	47 Å²	47	64.6 Å²	64.6	49%	0.485	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-14.9	-176.5	0	0	0	0	0	114.6
25	D	91.2	Very high	88.5	Confident	115 Å²	115	64.8 Å²	64.8	62%	0.615	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-2	178.5	64.7	-36.3	0	0	0	113.4	Y23 P27 M237	Y23-D25 WeakPolarHBondContact CB-OD1 3.49Å; Y23-D25 PolarHBondContact O-N 3.12Å; D25-P27 WeakPolarHBondContact O-CD 3.46Å; D25-M237 WeakPolarHBondContact O-CE 3.12Å
26	I	94.8	Very high	90.6	Very high	7 Å²	7	62.8 Å²	62.8	4%	0.036	31%	0.306	C	S	.	.	S	Bend	trans	-98.3	108.9	176.9	-49.6	-65	0	0	0	109.5	Y23 H47 A198 V200 M237	Y23-I26 VanDerWaalsContact CB-CG1 3.43Å; Y23-I26 HydrophobicContact CD2-CG1 4.35Å; Y23-I26 HydrophobicContact CG-CG1 4.2Å; Y23-I26 PolarHBondContact O-N 3.17Å; I26-H47 PolarHBondContact O-NE2 2.74Å; I26-A198 HydrophobicContact CD1-CB 4.04Å; I26-A198 HydrophobicContact CG1-CB 3.99Å; I26-V200 HydrophobicContact CD1-CG2 4.26Å; I26-V200 HydrophobicContact CG2-CG1 3.69Å; I26-M237 HydrophobicContact CB-CE 4.1Å; I26-M237 HydrophobicContact CD1-CE 3.16Å; I26-M237 HydrophobicContact CG1-CE 4.12Å; I26-M237 HydrophobicContact CG2-CE 4.04Å
27	P	94.7	Very high	92.5	Very high	31 Å²	31	57.7 Å²	57.7	20%	0.201	29%	0.293	C	S	.	.			trans	-73.3	142.1	179.9	26.7	-30.3	0	0	0	112	F13 D25 A236	F13-P27 HydrophobicContact CD1-CB 4.07Å; F13-P27 HydrophobicContact CE1-CB 4.18Å; F13-P27 HydrophobicContact CG-CB 4.46Å; D25-P27 WeakPolarHBondContact O-CD 3.46Å; P27-A236 HydrophobicContact CG-CB 3.71Å
28	C	96.3	Very high	93.7	Very high	12 Å²	12	61.1 Å²	61.1	8%	0.081	31%	0.309	C	S	.	.			trans	-98.4	125.4	164.1	-170.2	0	0	0	0	108.2	D30 Y45	C28-D30 PolarHBondContact O-N 2.87Å; C28-Y45 HydrophobicContact CB-CE2 3.94Å; C28-Y45 WeakPolarHBondContact CB-OH 3.49Å
29	L	96.7	Very high	94.6	Very high	28 Å²	28	57.2 Å²	57.2	15%	0.147	30%	0.296	C	S	.	.			trans	-82.5	116	-176.7	-64.4	179.2	0	0	0	111.1	R31 T32 R33 N49 L233 A236	L29-R31 HydrophobicContact CB-CG 4.28Å; L29-R31 PolarHBondContact O-N 2.79Å; L29-R31 VanDerWaalsContact O-N 3.12Å; L29-T32 PolarHBondContact O-N 3.09Å; L29-T32 VanDerWaalsContact O-N 3.16Å; L29-R33 WeakPolarHBondContact O-CB 3.45Å; L29-R33 PolarHBondContact O-N 2.95Å; L29-N49 PolarHBondContact N-ND2 2.9Å; L29-N49 PolarHBondContact O-ND2 2.67Å; L29-L233 WeakPolarHBondContact CD1-O 3.2Å; L29-A236 HydrophobicContact CD1-CB 4.06Å; L29-A236 HydrophobicContact CD2-CB 3.98Å; L29-A236 HydrophobicContact CG-CB 3.94Å
30	D	95.6	Very high	94.8	Very high	114 Å²	114	56.5 Å²	56.5	61%	0.61	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-35.8	179.7	-76.6	-33.2	0	0	0	113.9	C28 T32 R33	C28-D30 PolarHBondContact O-N 2.87Å; D30-T32 VanDerWaalsContact C-N 3.25Å; D30-T32 PolarHBondContact O-N 3.44Å; D30-R33 IonicContact OD1-NE 3.66Å
31	R	96.8	Very high	94.5	Very high	164 Å²	164	60.1 Å²	60.1	62%	0.619	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-27	-176.9	62.1	154.8	173.1	-170.9	-17.6	114.6	L29 L233	L29-R31 HydrophobicContact CB-CG 4.28Å; L29-R31 PolarHBondContact O-N 2.79Å; L29-R31 VanDerWaalsContact O-N 3.12Å; R31-L233 PolarHBondContact NE-O 3.43Å; R31-L233 VanDerWaalsContact NH2-CD2 3.31Å; R31-L233 PolarHBondContact NH2-O 2.65Å
32	T	97.9	Very high	94.3	Very high	26 Å²	26	62.2 Å²	62.2	16%	0.16	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	4.1	-173.5	52.9	0	0	0	0	111.5	L29 D30 N49 V50 Q234	L29-T32 PolarHBondContact O-N 3.09Å; L29-T32 VanDerWaalsContact O-N 3.16Å; D30-T32 VanDerWaalsContact C-N 3.25Å; D30-T32 PolarHBondContact O-N 3.44Å; T32-N49 CarbonylContact O-C 3.53Å; T32-N49 VanDerWaalsContact O-CA 3.25Å; T32-N49 WeakPolarHBondContact O-CA 3.49Å; T32-N49 PolarHBondContact OG1-ND2 3.39Å; T32-V50 PolarHBondContact O-N 3.07Å; T32-Q234 HydrophobicContact CG2-CB 4.31Å; T32-Q234 HydrophobicContact CG2-CG 4.46Å; T32-Q234 PolarHBondContact OG1-O 2.8Å
33	R	97.8	Very high	94.3	Very high	41 Å²	41	61.2 Å²	61.2	16%	0.155	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	142.3	-179	74.6	178.2	180	84.6	-3.6	110.3	L29 D30 D44 A48 N49	L29-R33 WeakPolarHBondContact O-CB 3.45Å; L29-R33 PolarHBondContact O-N 2.95Å; D30-R33 IonicContact OD1-NE 3.66Å; R33-D44 IonicContact CZ-OD1 2.75Å; R33-D44 VanDerWaalsContact CZ-OD1 3.26Å; R33-D44 IonicContact NH1-OD1 3.33Å; R33-D44 PolarHBondContact NH1-OD1 3.02Å; R33-D44 IonicContact NH1-OD2 3.93Å; R33-D44 IonicContact NH2-OD1 3.74Å; R33-D44 PolarHBondContact NH2-OD1 3.26Å; R33-D44 IonicContact NH2-OD2 3.13Å; R33-A48 CarbonylContact C-O 3.58Å; R33-A48 WeakPolarHBondContact CA-O 3.34Å; R33-N49 WeakPolarHBondContact CA-ND2 3.39Å; R33-N49 PolarHBondContact N-ND2 3.42Å
34	V	98.3	Very high	94.4	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	137.2	166.6	-178	0	0	0	0	107.9	I46 A48 V50 I61 M77 E81	V34-I46 HydrophobicContact CB-CG2 3.99Å; V34-I46 HydrophobicContact CG1-CG2 4.26Å; V34-I46 WeakPolarHBondContact O-CG2 3.44Å; V34-A48 HydrophobicContact CB-CB 4.33Å; V34-A48 HydrophobicContact CG2-CB 4.18Å; V34-A48 PolarHBondContact N-O 3.18Å; V34-V50 HydrophobicContact CG2-CG2 3.79Å; V34-I61 HydrophobicContact CG2-CD1 4.15Å; V34-I61 HydrophobicContact CG2-CG1 4.28Å; V34-I61 HydrophobicContact CG2-CG2 4.08Å; V34-M77 HydrophobicContact CB-SD 4.07Å; V34-M77 HydrophobicContact CG1-CG 3.95Å; V34-M77 HydrophobicContact CG1-SD 3.99Å; V34-M77 HydrophobicContact CG2-SD 4.06Å; V34-E81 HydrophobicContact CG1-CG 4.28Å
35	K	97.7	Very high	94.7	Very high	117 Å²	117	58.3 Å²	58.3	51%	0.509	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.8	174.5	-58	-170.9	172.8	-175.9	0	107.9	A37 D44 Q80	K35-A37 PolarHBondContact O-N 2.94Å; K35-D44 WeakPolarHBondContact CA-O 3.26Å; K35-D44 HydrophobicContact CB-CB 4.38Å; K35-Q80 PolarHBondContact O-NE2 3.2Å
36	L	97.9	Very high	94.9	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.031	29%	0.285	C	S	.	.			trans	-66.3	124.9	176.4	-61	172.2	0	0	0	109	E38 P39 D44 I46 D73 A76 M77	L36-E38 VanDerWaalsContact C-N 3.28Å; L36-E38 PolarHBondContact O-N 3.42Å; L36-P39 HydrophobicContact CB-CB 4.45Å; L36-D44 PolarHBondContact N-O 3.27Å; L36-D44 WeakPolarHBondContact O-CB 3.49Å; L36-I46 HydrophobicContact CD1-CB 4.3Å; L36-I46 HydrophobicContact CD2-CB 4.29Å; L36-I46 HydrophobicContact CD2-CD1 4.36Å; L36-I46 HydrophobicContact CD2-CG2 4Å; L36-I46 HydrophobicContact CG-CB 4.21Å; L36-I46 HydrophobicContact CG-CG2 4.05Å; L36-D73 HydrophobicContact CD1-CB 3.71Å; L36-D73 WeakPolarHBondContact CD2-O 3.32Å; L36-A76 HydrophobicContact CD2-CB 4.36Å; L36-M77 HydrophobicContact CD2-CB 3.99Å
37	A	96.6	Very high	95.1	Very high	76 Å²	76	53 Å²	53	63%	0.628	28%	0.283	S	S	*	.	S	Bend	trans	-68.4	-31.5	179.4	0	0	0	0	0	111.9	K35	K35-A37 PolarHBondContact O-N 2.94Å
38	E	92.2	Very high	95.2	Very high	96 Å²	96	51.6 Å²	51.6	45%	0.449	27%	0.274	S	S	.	.	S	Bend	trans	-130.6	72.9	-178.6	-61.8	-176.5	-153.6	0	0	110.5	L36 R143	L36-E38 VanDerWaalsContact C-N 3.28Å; L36-E38 PolarHBondContact O-N 3.42Å; E38-R143 IonicContact OE1-NH1 2.72Å; E38-R143 IonicContact OE2-CZ 3.57Å; E38-R143 IonicContact OE2-NH1 3.05Å; E38-R143 PolarHBondContact OE2-NH1 2.86Å; E38-R143 IonicContact OE2-NH2 2.58Å
39	P	92.5	Very high	95.4	Very high	41 Å²	41	51 Å²	51	27%	0.266	27%	0.27	S	S	.	.			trans	-68.2	137.5	-178.5	28.1	-33.1	0	0	0	111.5	L36 D41 N43 D44	L36-P39 HydrophobicContact CB-CB 4.45Å; P39-D41 PolarHBondContact O-N 3.39Å; P39-N43 WeakPolarHBondContact CB-O 3.47Å; P39-D44 HydrophobicContact CG-CB 4.48Å
40	R	89.2	Confident	95.4	Very high	108 Å²	108	51.2 Å²	51.2	41%	0.408	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-30.3	-176.7	-60.3	175.4	-66.4	140.8	6.3	113.4	D69 Q72 D73	R40-D69 PolarHBondContact NH2-O 3.16Å; R40-Q72 VanDerWaalsContact NH1-CD 3.3Å; R40-D73 IonicContact CZ-OD1 2.99Å; R40-D73 VanDerWaalsContact CZ-OD1 3.26Å; R40-D73 IonicContact CZ-OD2 3.84Å; R40-D73 IonicContact NE-OD1 3.36Å; R40-D73 PolarHBondContact NE-OD1 3.24Å; R40-D73 IonicContact NH2-OD1 2.72Å; R40-D73 PolarHBondContact NH2-OD1 3.01Å; R40-D73 IonicContact NH2-OD2 2.83Å; R40-D73 PolarHBondContact NH2-OD2 3.29Å
41	D	88.2	Confident	95.6	Very high	77 Å²	77	45.8 Å²	45.8	41%	0.412	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	16.1	-175.5	58	-0.6	0	0	0	112.3	Y19 K20 P39 N43	Y19-D41 PolarHBondContact OH-OD2 3.42Å; K20-D41 WeakPolarHBondContact CE-OD2 3.44Å; K20-D41 IonicContact NZ-OD1 3.01Å; K20-D41 PolarHBondContact NZ-OD1 3.49Å; K20-D41 IonicContact NZ-OD2 3.74Å; K20-D41 PolarHBondContact NZ-OD2 3.06Å; P39-D41 PolarHBondContact O-N 3.39Å; D41-N43 PolarHBondContact O-N 3.31Å; D41-N43 WeakPolarHBondContact OD1-CB 3.41Å; D41-N43 PolarHBondContact OD1-N 3.2Å; D41-N43 VanDerWaalsContact OD1-N 3.12Å
42	G	90.1	Very high	95.6	Very high	69 Å²	69	41.4 Å²	41.4	71%	0.711	23%	0.234	S	C	*	.	S	Bend	trans	73	-1.6	-173.7	0	0	0	0	0	114.1
43	N	91.6	Very high	95.4	Very high	37 Å²	37	40.2 Å²	40.2	20%	0.198	23%	0.227	C	C	.	.			trans	-102.1	110.2	176.4	-174.5	-11	0	0	0	111.4	E17 K20 P39 D41 Y45	E17-N43 WeakPolarHBondContact CG-ND2 3.28Å; E17-N43 PolarHBondContact OE1-ND2 2.73Å; E17-N43 PolarHBondContact OE1-OD1 2.71Å; K20-N43 PolarHBondContact NZ-O 3.39Å; P39-N43 WeakPolarHBondContact CB-O 3.47Å; D41-N43 PolarHBondContact O-N 3.31Å; D41-N43 WeakPolarHBondContact OD1-CB 3.41Å; D41-N43 PolarHBondContact OD1-N 3.2Å; D41-N43 VanDerWaalsContact OD1-N 3.12Å; N43-Y45 PolarHBondContact O-N 2.96Å; N43-Y45 VanDerWaalsContact O-N 3.1Å; N43-Y45 WeakPolarHBondContact OD1-CB 3.28Å; N43-Y45 PolarHBondContact OD1-N 3.45Å
44	D	95.7	Very high	94.9	Very high	48 Å²	48	43.2 Å²	43.2	26%	0.257	25%	0.252	S	S	.	.			trans	-68.9	-0.5	179.9	79.1	1.5	0	0	0	115	R33 K35 L36 P39	R33-D44 IonicContact CZ-OD1 2.75Å; R33-D44 VanDerWaalsContact CZ-OD1 3.26Å; R33-D44 IonicContact NH1-OD1 3.33Å; R33-D44 PolarHBondContact NH1-OD1 3.02Å; R33-D44 IonicContact NH1-OD2 3.93Å; R33-D44 IonicContact NH2-OD1 3.74Å; R33-D44 PolarHBondContact NH2-OD1 3.26Å; R33-D44 IonicContact NH2-OD2 3.13Å; K35-D44 WeakPolarHBondContact CA-O 3.26Å; K35-D44 HydrophobicContact CB-CB 4.38Å; L36-D44 PolarHBondContact N-O 3.27Å; L36-D44 WeakPolarHBondContact O-CB 3.49Å; P39-D44 HydrophobicContact CG-CB 4.48Å
45	Y	96.1	Very high	94.2	Very high	8 Å²	8	46.8 Å²	46.8	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	129	-177.7	-180	-97.1	0	0	0	113.5	E17 K20 N21 C28 N43 H47	E17-Y45 HydrophobicContact CB-CD1 3.73Å; E17-Y45 HydrophobicContact CB-CE1 3.83Å; E17-Y45 HydrophobicContact CB-CG 4.24Å; E17-Y45 HydrophobicContact CG-CD1 3.75Å; E17-Y45 HydrophobicContact CG-CE1 4.34Å; E17-Y45 HydrophobicContact CG-CG 3.85Å; E17-Y45 WeakPolarHBondContact OE1-CB 3.44Å; E17-Y45 WeakPolarHBondContact OE2-CD2 3.29Å; E17-Y45 WeakPolarHBondContact OE2-CE2 3.39Å; K20-Y45 HydrophobicContact CB-CD1 3.92Å; K20-Y45 HydrophobicContact CB-CE1 3.92Å; K20-Y45 HydrophobicContact CD-CD1 3.96Å; N21-Y45 WeakPolarHBondContact OD1-CE1 3.42Å; N21-Y45 VanDerWaalsContact OD1-CZ 3.31Å; N21-Y45 PolarHBondContact OD1-OH 3.33Å; C28-Y45 HydrophobicContact CB-CE2 3.94Å; C28-Y45 WeakPolarHBondContact CB-OH 3.49Å; N43-Y45 PolarHBondContact O-N 2.96Å; N43-Y45 VanDerWaalsContact O-N 3.1Å; N43-Y45 WeakPolarHBondContact OD1-CB 3.28Å; N43-Y45 PolarHBondContact OD1-N 3.45Å; Y45-H47 HydrophobicContact CE1-CB 4.22Å; Y45-H47 PolarHBondContact OH-CD2 3.47Å
46	I	97.1	Very high	93.3	Very high	11 Å²	11	42 Å²	42	6%	0.056	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	140.6	160.3	-176.6	164.8	0	0	0	108.1	V34 L36 A48 D73 M77	V34-I46 HydrophobicContact CB-CG2 3.99Å; V34-I46 HydrophobicContact CG1-CG2 4.26Å; V34-I46 WeakPolarHBondContact O-CG2 3.44Å; L36-I46 HydrophobicContact CD1-CB 4.3Å; L36-I46 HydrophobicContact CD2-CB 4.29Å; L36-I46 HydrophobicContact CD2-CD1 4.36Å; L36-I46 HydrophobicContact CD2-CG2 4Å; L36-I46 HydrophobicContact CG-CB 4.21Å; L36-I46 HydrophobicContact CG-CG2 4.05Å; I46-A48 HydrophobicContact CG1-CB 4.29Å; I46-A48 HydrophobicContact CG2-CB 4.24Å; I46-A48 PolarHBondContact O-N 2.81Å; I46-D73 HydrophobicContact CD1-CB 4.21Å; I46-M77 HydrophobicContact CD1-CB 3.97Å; I46-M77 HydrophobicContact CD1-CE 3.91Å; I46-M77 HydrophobicContact CD1-SD 3.84Å; I46-M77 HydrophobicContact CG2-SD 4.23Å
47	H	97.3	Very high	92.5	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	66.5	-179.9	-164	-44.4	0	0	0	111.7	N21 I26 Y45 T63 Q64 R235	N21-H47 PolarHBondContact OD1-CD2 3.01Å; N21-H47 VanDerWaalsContact OD1-CD2 3.31Å; I26-H47 PolarHBondContact O-NE2 2.74Å; Y45-H47 HydrophobicContact CE1-CB 4.22Å; Y45-H47 PolarHBondContact OH-CD2 3.47Å; H47-T63 WeakPolarHBondContact O-CA 3.4Å; H47-T63 PolarHBondContact O-OG1 2.85Å; H47-Q64 VanDerWaalsContact CB-CD 3.48Å; H47-Q64 HydrophobicContact CB-CG 3.95Å; H47-Q64 PolarHBondContact O-N 3.39Å; H47-R235 PolarHBondContact CE1-NH1 3.01Å; H47-R235 VanDerWaalsContact CE1-NH1 3.32Å; H47-R235 PolarHBondContact CE1-NH2 2.91Å; H47-R235 PolarHBondContact ND1-NH1 2.61Å; H47-R235 PolarHBondContact ND1-NH2 2.77Å; H47-R235 PolarHBondContact O-NH1 3.31Å
48	A	98.5	Very high	92.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	138.8	-177.7	0	0	0	0	0	109.7	R33 V34 I46 I61 L62 M77	R33-A48 CarbonylContact C-O 3.58Å; R33-A48 WeakPolarHBondContact CA-O 3.34Å; V34-A48 HydrophobicContact CB-CB 4.33Å; V34-A48 HydrophobicContact CG2-CB 4.18Å; V34-A48 PolarHBondContact N-O 3.18Å; I46-A48 HydrophobicContact CG1-CB 4.29Å; I46-A48 HydrophobicContact CG2-CB 4.24Å; I46-A48 PolarHBondContact O-N 2.81Å; A48-I61 HydrophobicContact CB-CG2 3.89Å; A48-L62 CarbonylContact C-O 3.6Å; A48-L62 WeakPolarHBondContact CA-O 3.32Å; A48-M77 HydrophobicContact CB-CE 4.07Å; A48-M77 HydrophobicContact CB-SD 3.53Å; A48-M77 VanDerWaalsContact CB-SD 3.53Å
49	N	98.7	Very high	92.5	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.4	175.5	-62.5	96.4	0	0	0	111	L29 T32 R33 I61 L62 Q234 R235	L29-N49 PolarHBondContact N-ND2 2.9Å; L29-N49 PolarHBondContact O-ND2 2.67Å; T32-N49 CarbonylContact O-C 3.53Å; T32-N49 VanDerWaalsContact O-CA 3.25Å; T32-N49 WeakPolarHBondContact O-CA 3.49Å; T32-N49 PolarHBondContact OG1-ND2 3.39Å; R33-N49 WeakPolarHBondContact CA-ND2 3.39Å; R33-N49 PolarHBondContact N-ND2 3.42Å; N49-I61 WeakPolarHBondContact O-CA 3.46Å; N49-L62 PolarHBondContact N-O 2.86Å; N49-L62 PolarHBondContact O-N 3.03Å; N49-Q234 VanDerWaalsContact CB-O 3.25Å; N49-Q234 WeakPolarHBondContact CB-O 3.19Å; N49-R235 HydrophobicContact CB-CB 4.34Å; N49-R235 VanDerWaalsContact OD1-CD 3.23Å; N49-R235 WeakPolarHBondContact OD1-CD 3.2Å; N49-R235 PolarHBondContact OD1-NH1 3.26Å
50	V	98.5	Very high	92.7	Very high	33 Å²	33	43 Å²	43	20%	0.2	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	133.1	166.6	-177.8	0	0	0	0	108.7	T32 V34 V52 R59 Y60 I61	T32-V50 PolarHBondContact O-N 3.07Å; V34-V50 HydrophobicContact CG2-CG2 3.79Å; V50-V52 HydrophobicContact CG1-CG2 4.01Å; V50-R59 HydrophobicContact CG1-CG 3.67Å; V50-Y60 CarbonylContact C-O 3.55Å; V50-Y60 WeakPolarHBondContact CA-O 3.43Å; V50-I61 HydrophobicContact CG2-CG1 4.46Å
51	V	98.4	Very high	93.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	117.7	174	-178.5	0	0	0	0	108.4	M53 Y60 L62 V207 V231 Q234 R235	V51-M53 HydrophobicContact CG1-CG 4.42Å; V51-M53 HydrophobicContact CG1-SD 3.99Å; V51-Y60 PolarHBondContact N-O 3.29Å; V51-Y60 WeakPolarHBondContact O-CB 3.22Å; V51-Y60 PolarHBondContact O-N 3.19Å; V51-L62 HydrophobicContact CB-CD1 4.03Å; V51-L62 HydrophobicContact CG2-CB 4.4Å; V51-L62 HydrophobicContact CG2-CD1 3.78Å; V51-L62 HydrophobicContact CG2-CD2 4.31Å; V51-L62 HydrophobicContact CG2-CG 4.38Å; V51-V207 HydrophobicContact CG1-CG1 4.11Å; V51-V231 HydrophobicContact CG1-CG1 4.38Å; V51-Q234 HydrophobicContact CB-CB 4.3Å; V51-Q234 HydrophobicContact CG1-CB 4.19Å; V51-Q234 HydrophobicContact CG2-CB 3.89Å; V51-R235 HydrophobicContact CG2-CB 3.89Å
52	V	96.9	Very high	93.7	Very high	71 Å²	71	34.2 Å²	34.2	43%	0.43	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	122.4	177.5	-177.5	0	0	0	0	108	V50 R59 Q234	V50-V52 HydrophobicContact CG1-CG2 4.01Å; V52-R59 HydrophobicContact CG2-CG 4.11Å; V52-Q234 PolarHBondContact O-NE2 3.33Å; V52-Q234 PolarHBondContact O-OE1 2.93Å
53	M	94.2	Very high	94.1	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.16	C	C	.	.			trans	-107	122	176.5	-59.3	-55.6	-56.5	0	0	107.8	V51 Q55 H56 V207 A211 T227 D230 V231	V51-M53 HydrophobicContact CG1-CG 4.42Å; V51-M53 HydrophobicContact CG1-SD 3.99Å; M53-Q55 PolarHBondContact O-N 2.98Å; M53-H56 HydrophobicContact CB-CB 4.46Å; M53-H56 PolarHBondContact O-N 3.49Å; M53-V207 HydrophobicContact CG-CG1 4.04Å; M53-A211 HydrophobicContact CB-CB 3.98Å; M53-A211 HydrophobicContact CE-CB 3.82Å; M53-A211 HydrophobicContact CG-CB 4.02Å; M53-T227 HydrophobicContact CE-CG2 3.94Å; M53-D230 HydrophobicContact CE-CB 4.13Å; M53-V231 HydrophobicContact CE-CG2 3.99Å; M53-V231 HydrophobicContact SD-CG2 3.58Å; M53-V231 VanDerWaalsContact SD-CG2 3.58Å
54	P	87.2	Confident	94.4	Very high	104 Å²	104	29.7 Å²	29.7	68%	0.675	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.1	-174	21.4	-29.8	0	0	0	113.3	H56	P54-H56 VanDerWaalsContact C-N 3.35Å
55	Q	83.4	Confident	94.5	Very high	78 Å²	78	27.5 Å²	27.5	36%	0.364	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-9.6	-179.6	-48.5	88.2	-2.2	0	0	113.1	M53 A214 V215	M53-Q55 PolarHBondContact O-N 2.98Å; Q55-A214 HydrophobicContact CB-CB 4.31Å; Q55-A214 VanDerWaalsContact O-CB 3.23Å; Q55-A214 WeakPolarHBondContact O-CB 3.37Å; Q55-V215 HydrophobicContact CB-CG2 3.89Å; Q55-V215 HydrophobicContact CG-CG2 3.52Å
56	H	78.8	Confident	94.6	Very high	16 Å²	16	27.4 Å²	27.4	7%	0.074	14%	0.14	C	C	.	.	S	Bend	trans	-127	132.7	-176	-152.5	-70.2	0	0	0	110.4	M53 P54 C58 Y60 D178 L181	M53-H56 HydrophobicContact CB-CB 4.46Å; M53-H56 PolarHBondContact O-N 3.49Å; P54-H56 VanDerWaalsContact C-N 3.35Å; H56-C58 PolarHBondContact ND1-SG 3.19Å; H56-C58 PolarHBondContact O-N 2.92Å; H56-Y60 PolarHBondContact CE1-OH 3.03Å; H56-D178 IonicContact CE1-OD1 2.96Å; H56-D178 IonicContact NE2-OD1 2.71Å; H56-D178 PolarHBondContact NE2-OD1 3.37Å; H56-L181 WeakPolarHBondContact CE1-CD2 3.38Å
57	K	82.2	Confident	94.5	Very high	180 Å²	180	28.1 Å²	28.1	78%	0.783	14%	0.144	S	C	*	.	S	Bend	trans	-79.8	4.4	-170.6	-63.2	-178.4	178.4	178.5	0	114.2	L181	K57-L181 HydrophobicContact CB-CD2 4.26Å
58	C	91	Very high	94.3	Very high	5 Å²	5	32 Å²	32	3%	0.034	17%	0.169	C	C	.	.	S	Bend	trans	-108.7	160.1	178.1	78.7	0	0	0	0	111.6	H56 Y60 L181 M190	H56-C58 PolarHBondContact ND1-SG 3.19Å; H56-C58 PolarHBondContact O-N 2.92Å; C58-Y60 WeakPolarHBondContact SG-CE1 3.5Å; C58-Y60 VanDerWaalsContact SG-CE2 3.57Å; C58-Y60 PolarHBondContact SG-OH 3.36Å; C58-L181 HydrophobicContact CB-CD1 4.02Å; C58-L181 HydrophobicContact CB-CD2 4.34Å; C58-M190 WeakPolarHBondContact CA-O 3.5Å; C58-M190 HydrophobicContact CB-CB 4.26Å; C58-M190 VanDerWaalsContact CB-O 3.31Å; C58-M190 WeakPolarHBondContact CB-O 3.36Å
59	R	95.9	Very high	94.1	Very high	56 Å²	56	37.2 Å²	37.2	21%	0.211	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.5	173.4	-179.7	173.5	67.1	96.6	-4	109.1	V50 V52 E81 M190 C191 V192	V50-R59 HydrophobicContact CG1-CG 3.67Å; V52-R59 HydrophobicContact CG2-CG 4.11Å; R59-E81 IonicContact CZ-OE2 3.64Å; R59-E81 IonicContact NH1-OE2 3.59Å; R59-E81 PolarHBondContact NH1-OE2 3.46Å; R59-E81 PolarHBondContact NH2-O 2.93Å; R59-E81 IonicContact NH2-OE2 2.86Å; R59-E81 PolarHBondContact NH2-OE2 2.94Å; R59-M190 PolarHBondContact N-O 3.08Å; R59-C191 PolarHBondContact NH2-SG 2.77Å; R59-C191 WeakPolarHBondContact O-CA 3.46Å; R59-V192 PolarHBondContact O-N 2.92Å
60	Y	98.4	Very high	93.9	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	150.2	175.4	-59.7	-76.5	0	0	0	111.4	V50 V51 H56 C58 M177 V192 V194 V207	V50-Y60 CarbonylContact C-O 3.55Å; V50-Y60 WeakPolarHBondContact CA-O 3.43Å; V51-Y60 PolarHBondContact N-O 3.29Å; V51-Y60 WeakPolarHBondContact O-CB 3.22Å; V51-Y60 PolarHBondContact O-N 3.19Å; H56-Y60 PolarHBondContact CE1-OH 3.03Å; C58-Y60 WeakPolarHBondContact SG-CE1 3.5Å; C58-Y60 VanDerWaalsContact SG-CE2 3.57Å; C58-Y60 PolarHBondContact SG-OH 3.36Å; Y60-M177 HydrophobicContact CE1-CE 3.65Å; Y60-V192 CarbonylContact C-O 3.59Å; Y60-V192 VanDerWaalsContact CA-O 3.27Å; Y60-V192 WeakPolarHBondContact CA-O 3.47Å; Y60-V192 HydrophobicContact CD1-CB 3.83Å; Y60-V192 HydrophobicContact CD1-CG1 4.17Å; Y60-V192 HydrophobicContact CE1-CB 4.1Å; Y60-V192 HydrophobicContact CE1-CG1 4.31Å; Y60-V192 HydrophobicContact CE1-CG2 4.49Å; Y60-V194 HydrophobicContact CD1-CG2 4.01Å; Y60-V207 HydrophobicContact CD1-CG2 3.91Å; Y60-V207 HydrophobicContact CD2-CG1 3.64Å; Y60-V207 HydrophobicContact CD2-CG2 4.21Å; Y60-V207 HydrophobicContact CE1-CG2 4.28Å; Y60-V207 HydrophobicContact CE2-CG1 3.91Å; Y60-V207 HydrophobicContact CG-CG1 4.12Å; Y60-V207 HydrophobicContact CG-CG2 3.87Å
61	I	98.8	Very high	93.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	114.3	162.7	-65.6	173.4	0	0	0	107.3	V34 A48 N49 V50 M77 E81 V192 I193 V194	V34-I61 HydrophobicContact CG2-CD1 4.15Å; V34-I61 HydrophobicContact CG2-CG1 4.28Å; V34-I61 HydrophobicContact CG2-CG2 4.08Å; A48-I61 HydrophobicContact CB-CG2 3.89Å; N49-I61 WeakPolarHBondContact O-CA 3.46Å; V50-I61 HydrophobicContact CG2-CG1 4.46Å; I61-M77 HydrophobicContact CG2-CE 4.07Å; I61-M77 HydrophobicContact CG2-SD 3.85Å; I61-E81 HydrophobicContact CD1-CB 3.78Å; I61-E81 HydrophobicContact CD1-CG 3.58Å; I61-V192 PolarHBondContact N-O 2.82Å; I61-I193 HydrophobicContact CB-CG1 3.94Å; I61-I193 HydrophobicContact CD1-CG1 4.46Å; I61-I193 HydrophobicContact CG2-CG1 4.22Å; I61-I193 CarbonylContact O-C 3.49Å; I61-I193 WeakPolarHBondContact O-CA 3.49Å; I61-V194 PolarHBondContact O-N 3.02Å
62	L	98.8	Very high	93.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.8	172.8	-81.9	64.2	0	0	0	108.7	A48 N49 V51 V194 V207 V231 R235	A48-L62 CarbonylContact C-O 3.6Å; A48-L62 WeakPolarHBondContact CA-O 3.32Å; N49-L62 PolarHBondContact N-O 2.86Å; N49-L62 PolarHBondContact O-N 3.03Å; V51-L62 HydrophobicContact CB-CD1 4.03Å; V51-L62 HydrophobicContact CG2-CB 4.4Å; V51-L62 HydrophobicContact CG2-CD1 3.78Å; V51-L62 HydrophobicContact CG2-CD2 4.31Å; V51-L62 HydrophobicContact CG2-CG 4.38Å; L62-V194 WeakPolarHBondContact CA-O 3.23Å; L62-V207 HydrophobicContact CD1-CB 4.5Å; L62-V207 HydrophobicContact CD1-CG2 3.74Å; L62-V231 HydrophobicContact CD2-CG1 4.46Å; L62-R235 HydrophobicContact CB-CB 4.27Å; L62-R235 HydrophobicContact CB-CG 3.83Å; L62-R235 HydrophobicContact CD2-CB 4.1Å; L62-R235 HydrophobicContact CD2-CG 3.95Å
63	T	98.7	Very high	93.8	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.025	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.8	-176.4	-179.1	0	0	0	0	110.8	H47 F74 M77 I193 V194 H195 G199	H47-T63 WeakPolarHBondContact O-CA 3.4Å; H47-T63 PolarHBondContact O-OG1 2.85Å; T63-F74 HydrophobicContact CG2-CD2 4.43Å; T63-F74 HydrophobicContact CG2-CE2 4.01Å; T63-M77 HydrophobicContact CG2-CE 4.23Å; T63-I193 HydrophobicContact CG2-CG2 3.82Å; T63-V194 PolarHBondContact N-O 3.36Å; T63-H195 HydrophobicContact CG2-CB 3.72Å; T63-H195 WeakPolarHBondContact O-CB 3.42Å; T63-G199 WeakPolarHBondContact O-CA 3.33Å
64	Q	98	Very high	94	Very high	7 Å²	7	37.6 Å²	37.6	3%	0.033	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-64.1	164.9	164.4	68.8	-177.6	4.2	0	0	111	K20 H47 S197	K20-Q64 PolarHBondContact O-NE2 3.18Å; H47-Q64 VanDerWaalsContact CB-CD 3.48Å; H47-Q64 HydrophobicContact CB-CG 3.95Å; H47-Q64 PolarHBondContact O-N 3.39Å; Q64-S197 CarbonylContact C-O 3.58Å; Q64-S197 WeakPolarHBondContact CA-O 3.44Å
65	A	97.6	Very high	94.5	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.008	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-59.9	137.6	168.8	0	0	0	0	0	110.9	L22 L67 K99 T100 C196 S197	L22-A65 HydrophobicContact CD2-CB 4.05Å; A65-L67 PolarHBondContact O-N 3.23Å; A65-K99 VanDerWaalsContact CB-O 3.23Å; A65-K99 WeakPolarHBondContact CB-O 3.46Å; A65-T100 WeakPolarHBondContact CB-OG1 3.15Å; A65-C196 WeakPolarHBondContact CB-O 3.14Å; A65-S197 PolarHBondContact N-O 2.79Å
66	P	97.5	Very high	95.2	Very high	6 Å²	6	29.3 Å²	29.3	4%	0.039	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-57.2	132.8	174.6	-27.4	37.7	0	0	0	111.9	I71 F74 Q101 Y103	P66-I71 HydrophobicContact CB-CG1 3.84Å; P66-F74 HydrophobicContact CB-CB 4.28Å; P66-F74 HydrophobicContact CB-CG 4.39Å; P66-F74 HydrophobicContact CG-CB 3.99Å; P66-F74 HydrophobicContact CG-CD1 4.04Å; P66-F74 HydrophobicContact CG-CD2 3.58Å; P66-F74 HydrophobicContact CG-CE1 4.44Å; P66-F74 HydrophobicContact CG-CE2 4Å; P66-F74 HydrophobicContact CG-CG 3.59Å; P66-F74 HydrophobicContact CG-CZ 4.41Å; P66-Q101 WeakPolarHBondContact O-CG 3.25Å; P66-Y103 HydrophobicContact CB-CD1 4.2Å; P66-Y103 HydrophobicContact CB-CG 4.32Å; P66-Y103 HydrophobicContact CG-CD1 3.59Å; P66-Y103 HydrophobicContact CG-CD2 4.46Å; P66-Y103 HydrophobicContact CG-CE1 4.05Å; P66-Y103 HydrophobicContact CG-CG 3.83Å
67	L	95.3	Very high	96.2	Very high	27 Å²	27	28.5 Å²	28.5	14%	0.141	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-89.1	158.9	169.8	-57.9	98.1	0	0	0	109.4	K20 L22 A65 D69 T70 I71	K20-L67 WeakPolarHBondContact O-CD1 3.34Å; L22-L67 HydrophobicContact CB-CD1 4.23Å; L22-L67 HydrophobicContact CB-CD2 4.28Å; L22-L67 HydrophobicContact CB-CG 4.3Å; L22-L67 HydrophobicContact CD1-CD2 4.04Å; L22-L67 HydrophobicContact CD1-CG 4.24Å; A65-L67 PolarHBondContact O-N 3.23Å; L67-D69 PolarHBondContact O-N 3.01Å; L67-D69 VanDerWaalsContact O-N 3.1Å; L67-T70 WeakPolarHBondContact CB-OG1 3.43Å; L67-T70 HydrophobicContact CD1-CG2 4.13Å; L67-T70 VanDerWaalsContact CD1-OG1 3.25Å; L67-T70 WeakPolarHBondContact CD1-OG1 3.28Å; L67-T70 PolarHBondContact N-OG1 3.44Å; L67-T70 CarbonylContact O-C 3.54Å; L67-T70 PolarHBondContact O-N 3.46Å; L67-T70 PolarHBondContact O-OG1 2.89Å; L67-I71 WeakPolarHBondContact O-CG1 3.31Å; L67-I71 PolarHBondContact O-N 3.36Å
68	P	94.3	Very high	97	Very high	81 Å²	81	20 Å²	20	53%	0.526	11%	0.106	S	C	.	.	G	3₁₀ helix	trans	-46.1	-44.8	175.6	-30.1	37.1	0	0	0	113.7	T70 Q101	P68-T70 PolarHBondContact O-N 2.94Å; P68-Q101 HydrophobicContact CG-CG 4.11Å
69	D	92.8	Very high	97.3	Very high	111 Å²	111	20.7 Å²	20.7	59%	0.594	11%	0.108	S	C	*	.	G	3₁₀ helix	trans	-79.9	-13.4	-178	-59.7	-37	0	0	0	114.3	R40 L67	R40-D69 PolarHBondContact NH2-O 3.16Å; L67-D69 PolarHBondContact O-N 3.01Å; L67-D69 VanDerWaalsContact O-N 3.1Å
70	T	95.5	Very high	97.4	Very high	10 Å²	10	20.9 Å²	20.9	6%	0.061	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-113.5	2.7	-177.2	61.9	0	0	0	0	113.8	K20 L67 P68 Q72 D73 F74	K20-T70 HydrophobicContact CB-CG2 4.05Å; K20-T70 HydrophobicContact CG-CG2 4.07Å; L67-T70 WeakPolarHBondContact CB-OG1 3.43Å; L67-T70 HydrophobicContact CD1-CG2 4.13Å; L67-T70 VanDerWaalsContact CD1-OG1 3.25Å; L67-T70 WeakPolarHBondContact CD1-OG1 3.28Å; L67-T70 PolarHBondContact N-OG1 3.44Å; L67-T70 CarbonylContact O-C 3.54Å; L67-T70 PolarHBondContact O-N 3.46Å; L67-T70 PolarHBondContact O-OG1 2.89Å; P68-T70 PolarHBondContact O-N 2.94Å; T70-Q72 VanDerWaalsContact C-N 3.27Å; T70-Q72 PolarHBondContact O-N 3.33Å; T70-D73 WeakPolarHBondContact O-CB 3.39Å; T70-D73 PolarHBondContact O-N 3.37Å; T70-D73 VanDerWaalsContact O-N 3.15Å; T70-F74 PolarHBondContact O-N 2.99Å
71	I	97.1	Very high	97.3	Very high	21 Å²	21	22.5 Å²	22.5	11%	0.108	12%	0.119	C	C	.	.	H	α-helix	trans	-57.5	-41.2	174.7	-73.1	167.2	0	0	0	111.2	P66 L67 F74 W75 Q101 Y116	P66-I71 HydrophobicContact CB-CG1 3.84Å; L67-I71 WeakPolarHBondContact O-CG1 3.31Å; L67-I71 PolarHBondContact O-N 3.36Å; I71-F74 WeakPolarHBondContact O-CB 3.38Å; I71-F74 PolarHBondContact O-N 3.45Å; I71-W75 VanDerWaalsContact O-CD1 3.24Å; I71-W75 PolarHBondContact O-N 3.25Å; I71-Q101 HydrophobicContact CD1-CB 3.99Å; I71-Q101 HydrophobicContact CD1-CG 4.47Å; I71-Y116 HydrophobicContact CG2-CD1 3.34Å; I71-Y116 HydrophobicContact CG2-CE1 3.52Å; I71-Y116 HydrophobicContact CG2-CG 3.9Å
72	Q	96.9	Very high	97.3	Very high	77 Å²	77	25.5 Å²	25.5	36%	0.36	14%	0.135	S	C	.	.	H	α-helix	trans	-68.2	-37	178.9	-56.6	-179.8	7.5	0	0	111.8	R40 T70 F74 W75 A76	R40-Q72 VanDerWaalsContact NH1-CD 3.3Å; T70-Q72 VanDerWaalsContact C-N 3.27Å; T70-Q72 PolarHBondContact O-N 3.33Å; Q72-F74 VanDerWaalsContact C-N 3.34Å; Q72-W75 PolarHBondContact O-N 3.43Å; Q72-A76 WeakPolarHBondContact O-CB 3.43Å; Q72-A76 PolarHBondContact O-N 3.3Å
73	D	97.2	Very high	97.2	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-64.9	-40.8	174.1	-66.9	-21.6	0	0	0	111	K20 L36 R40 I46 T70 W75 A76 M77	K20-D73 IonicContact NZ-OD2 2.68Å; L36-D73 HydrophobicContact CD1-CB 3.71Å; L36-D73 WeakPolarHBondContact CD2-O 3.32Å; R40-D73 IonicContact CZ-OD1 2.99Å; R40-D73 VanDerWaalsContact CZ-OD1 3.26Å; R40-D73 IonicContact CZ-OD2 3.84Å; R40-D73 IonicContact NE-OD1 3.36Å; R40-D73 PolarHBondContact NE-OD1 3.24Å; R40-D73 IonicContact NH2-OD1 2.72Å; R40-D73 PolarHBondContact NH2-OD1 3.01Å; R40-D73 IonicContact NH2-OD2 2.83Å; R40-D73 PolarHBondContact NH2-OD2 3.29Å; I46-D73 HydrophobicContact CD1-CB 4.21Å; T70-D73 WeakPolarHBondContact O-CB 3.39Å; T70-D73 PolarHBondContact O-N 3.37Å; T70-D73 VanDerWaalsContact O-N 3.15Å; D73-W75 VanDerWaalsContact C-N 3.35Å; D73-W75 PolarHBondContact O-N 3Å; D73-A76 PolarHBondContact O-N 3.27Å; D73-M77 WeakPolarHBondContact O-CB 3.2Å; D73-M77 PolarHBondContact O-N 3.19Å
74	F	98.3	Very high	97.2	Very high	3 Å²	3	26.8 Å²	26.8	1%	0.013	14%	0.144	C	C	.	.	H	α-helix	trans	-58.5	-45.6	174	177.1	-91.8	0	0	0	111.5	T63 P66 T70 I71 Q72 M77 V78 I86 Y103 I193	T63-F74 HydrophobicContact CG2-CD2 4.43Å; T63-F74 HydrophobicContact CG2-CE2 4.01Å; P66-F74 HydrophobicContact CB-CB 4.28Å; P66-F74 HydrophobicContact CB-CG 4.39Å; P66-F74 HydrophobicContact CG-CB 3.99Å; P66-F74 HydrophobicContact CG-CD1 4.04Å; P66-F74 HydrophobicContact CG-CD2 3.58Å; P66-F74 HydrophobicContact CG-CE1 4.44Å; P66-F74 HydrophobicContact CG-CE2 4Å; P66-F74 HydrophobicContact CG-CG 3.59Å; P66-F74 HydrophobicContact CG-CZ 4.41Å; T70-F74 PolarHBondContact O-N 2.99Å; I71-F74 WeakPolarHBondContact O-CB 3.38Å; I71-F74 PolarHBondContact O-N 3.45Å; Q72-F74 VanDerWaalsContact C-N 3.34Å; F74-M77 HydrophobicContact CD2-CE 3.93Å; F74-M77 HydrophobicContact CE2-CE 4.22Å; F74-M77 WeakPolarHBondContact O-CB 3.45Å; F74-M77 PolarHBondContact O-N 2.94Å; F74-V78 HydrophobicContact CD1-CG2 4.03Å; F74-V78 HydrophobicContact CE1-CG2 3.68Å; F74-V78 HydrophobicContact CZ-CG2 4.06Å; F74-V78 VanDerWaalsContact O-CG2 3.28Å; F74-V78 WeakPolarHBondContact O-CG2 3.1Å; F74-V78 PolarHBondContact O-N 3.44Å; F74-I86 HydrophobicContact CE1-CD1 4.18Å; F74-I86 HydrophobicContact CZ-CD1 4.19Å; F74-I86 HydrophobicContact CZ-CG2 4.31Å; F74-Y103 AromaticContact CD1-CD2 3.95Å; F74-Y103 HydrophobicContact CD1-CD2 3.95Å; F74-Y103 HydrophobicContact CD1-CE2 4.31Å; F74-Y103 AromaticContact CE1-CD2 3.5Å; F74-Y103 HydrophobicContact CE1-CD2 3.5Å; F74-Y103 AromaticContact CE1-CE2 3.42Å; F74-Y103 HydrophobicContact CE1-CE2 3.42Å; F74-Y103 VanDerWaalsContact CE1-CE2 3.42Å; F74-Y103 HydrophobicContact CE1-CG 4.39Å; F74-Y103 HydrophobicContact CZ-CD2 4.22Å; F74-Y103 AromaticContact CZ-CE2 3.76Å; F74-Y103 HydrophobicContact CZ-CE2 3.76Å; F74-I193 HydrophobicContact CE2-CD1 4.18Å; F74-I193 HydrophobicContact CE2-CG2 4.11Å; F74-I193 HydrophobicContact CZ-CD1 4.2Å; F74-I193 HydrophobicContact CZ-CG2 4.31Å
75	W	98.4	Very high	97.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-72.4	-32.3	177.9	-77.8	107.9	0	0	0	113.9	I71 Q72 D73 M77 V78 W79 I86 Y103 W104 Y116 V119 V121 L137 I139 L150	I71-W75 VanDerWaalsContact O-CD1 3.24Å; I71-W75 PolarHBondContact O-N 3.25Å; Q72-W75 PolarHBondContact O-N 3.43Å; D73-W75 VanDerWaalsContact C-N 3.35Å; D73-W75 PolarHBondContact O-N 3Å; W75-M77 VanDerWaalsContact C-N 3.32Å; W75-V78 HydrophobicContact CE3-CB 3.89Å; W75-V78 HydrophobicContact CE3-CG1 3.73Å; W75-V78 HydrophobicContact CE3-CG2 4.11Å; W75-V78 HydrophobicContact CZ3-CB 4.31Å; W75-V78 HydrophobicContact CZ3-CG1 3.71Å; W75-V78 HydrophobicContact CZ3-CG2 4.39Å; W75-V78 PolarHBondContact O-N 3.16Å; W75-W79 WeakPolarHBondContact O-CB 3.39Å; W75-W79 PolarHBondContact O-N 3.29Å; W75-I86 HydrophobicContact CH2-CD1 4.35Å; W75-Y103 VanDerWaalsContact CE2-O 3.25Å; W75-Y103 HydrophobicContact CZ2-CD2 4.09Å; W75-Y103 VanDerWaalsContact CZ2-O 3.28Å; W75-Y103 WeakPolarHBondContact CZ2-O 3.2Å; W75-Y103 PolarHBondContact NE1-O 2.95Å; W75-W104 HydrophobicContact CZ2-CB 4.09Å; W75-Y116 AromaticContact CD1-CD2 3.13Å; W75-Y116 AromaticContact CD1-CE2 3.7Å; W75-Y116 AromaticContact CD1-CG 3.41Å; W75-Y116 VanDerWaalsContact CD1-CG 3.41Å; W75-Y116 HydrophobicContact CD2-CD2 4.14Å; W75-Y116 AromaticContact CE2-CD2 3.85Å; W75-Y116 AromaticContact CE2-CE2 3.85Å; W75-Y116 AromaticContact CG-CD2 3.74Å; W75-Y116 HydrophobicContact CG-CD2 3.74Å; W75-Y116 HydrophobicContact CG-CE2 4.49Å; W75-Y116 HydrophobicContact CG-CG 4.14Å; W75-Y116 HydrophobicContact CZ2-CE2 4.39Å; W75-Y116 AromaticContact NE1-CD2 3.18Å; W75-Y116 AromaticContact NE1-CE2 3.22Å; W75-Y116 AromaticContact NE1-CG 3.86Å; W75-Y116 AromaticContact NE1-CZ 3.94Å; W75-V119 HydrophobicContact CB-CB 4.17Å; W75-V119 HydrophobicContact CB-CG1 4.37Å; W75-V119 HydrophobicContact CB-CG2 4.41Å; W75-V119 HydrophobicContact CE3-CG1 4.26Å; W75-V121 HydrophobicContact CD2-CG2 3.71Å; W75-V121 HydrophobicContact CE3-CG2 3.74Å; W75-V121 HydrophobicContact CG-CG2 4.4Å; W75-V121 HydrophobicContact CH2-CB 4.45Å; W75-V121 HydrophobicContact CH2-CG1 3.66Å; W75-V121 HydrophobicContact CH2-CG2 3.9Å; W75-V121 HydrophobicContact CZ2-CB 4.41Å; W75-V121 HydrophobicContact CZ2-CG1 3.83Å; W75-V121 HydrophobicContact CZ2-CG2 3.85Å; W75-V121 HydrophobicContact CZ3-CG1 4.24Å; W75-V121 HydrophobicContact CZ3-CG2 3.83Å; W75-L137 HydrophobicContact CH2-CD1 3.77Å; W75-L137 HydrophobicContact CZ2-CD1 4.44Å; W75-I139 HydrophobicContact CE3-CG2 4.22Å; W75-I139 HydrophobicContact CH2-CG2 4.38Å; W75-I139 HydrophobicContact CZ3-CG2 3.63Å; W75-L150 HydrophobicContact CZ3-CD2 4.33Å
76	A	98	Very high	97.3	Very high	8 Å²	8	26.4 Å²	26.4	7%	0.066	14%	0.142	C	C	.	.	H	α-helix	trans	-61.1	-43.5	169.6	0	0	0	0	0	110.9	L36 Q72 D73 W79 Q80 F118	L36-A76 HydrophobicContact CD2-CB 4.36Å; Q72-A76 WeakPolarHBondContact O-CB 3.43Å; Q72-A76 PolarHBondContact O-N 3.3Å; D73-A76 PolarHBondContact O-N 3.27Å; A76-W79 PolarHBondContact O-N 3.14Å; A76-Q80 PolarHBondContact O-N 2.89Å; A76-F118 HydrophobicContact CB-CE1 4.13Å; A76-F118 HydrophobicContact CB-CZ 3.93Å
77	M	98.6	Very high	97.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.7	-47.7	172.3	175.9	177.1	73.3	0	0	111.9	V34 L36 I46 A48 I61 T63 D73 F74 W75 W79 Q80 E81 I193	V34-M77 HydrophobicContact CB-SD 4.07Å; V34-M77 HydrophobicContact CG1-CG 3.95Å; V34-M77 HydrophobicContact CG1-SD 3.99Å; V34-M77 HydrophobicContact CG2-SD 4.06Å; L36-M77 HydrophobicContact CD2-CB 3.99Å; I46-M77 HydrophobicContact CD1-CB 3.97Å; I46-M77 HydrophobicContact CD1-CE 3.91Å; I46-M77 HydrophobicContact CD1-SD 3.84Å; I46-M77 HydrophobicContact CG2-SD 4.23Å; A48-M77 HydrophobicContact CB-CE 4.07Å; A48-M77 HydrophobicContact CB-SD 3.53Å; A48-M77 VanDerWaalsContact CB-SD 3.53Å; I61-M77 HydrophobicContact CG2-CE 4.07Å; I61-M77 HydrophobicContact CG2-SD 3.85Å; T63-M77 HydrophobicContact CG2-CE 4.23Å; D73-M77 WeakPolarHBondContact O-CB 3.2Å; D73-M77 PolarHBondContact O-N 3.19Å; F74-M77 HydrophobicContact CD2-CE 3.93Å; F74-M77 HydrophobicContact CE2-CE 4.22Å; F74-M77 WeakPolarHBondContact O-CB 3.45Å; F74-M77 PolarHBondContact O-N 2.94Å; W75-M77 VanDerWaalsContact C-N 3.32Å; M77-W79 VanDerWaalsContact C-N 3.26Å; M77-W79 PolarHBondContact O-N 3.27Å; M77-Q80 PolarHBondContact O-N 2.9Å; M77-E81 HydrophobicContact CG-CG 3.94Å; M77-E81 VanDerWaalsContact O-CB 3.24Å; M77-E81 WeakPolarHBondContact O-CB 3.29Å; M77-E81 VanDerWaalsContact O-CG 3.23Å; M77-E81 WeakPolarHBondContact O-CG 3.33Å; M77-E81 PolarHBondContact O-N 2.69Å; M77-I193 HydrophobicContact CE-CD1 3.78Å; M77-I193 HydrophobicContact CE-CG1 4.45Å
78	V	98.7	Very high	97.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-55.1	-44.2	177.1	168	0	0	0	0	111.3	F74 W75 V83 I86 I139 L150 I193	F74-V78 HydrophobicContact CD1-CG2 4.03Å; F74-V78 HydrophobicContact CE1-CG2 3.68Å; F74-V78 HydrophobicContact CZ-CG2 4.06Å; F74-V78 VanDerWaalsContact O-CG2 3.28Å; F74-V78 WeakPolarHBondContact O-CG2 3.1Å; F74-V78 PolarHBondContact O-N 3.44Å; W75-V78 HydrophobicContact CE3-CB 3.89Å; W75-V78 HydrophobicContact CE3-CG1 3.73Å; W75-V78 HydrophobicContact CE3-CG2 4.11Å; W75-V78 HydrophobicContact CZ3-CB 4.31Å; W75-V78 HydrophobicContact CZ3-CG1 3.71Å; W75-V78 HydrophobicContact CZ3-CG2 4.39Å; W75-V78 PolarHBondContact O-N 3.16Å; V78-V83 HydrophobicContact CG1-CB 4.15Å; V78-V83 PolarHBondContact O-N 3.44Å; V78-I86 HydrophobicContact CG2-CD1 4.01Å; V78-I139 HydrophobicContact CG1-CD1 4.13Å; V78-L150 HydrophobicContact CG1-CD2 3.6Å; V78-I193 HydrophobicContact CG2-CD1 3.59Å
79	W	98.2	Very high	97.6	Very high	20 Å²	20	21 Å²	21	8%	0.076	11%	0.108	C	C	.	.	H	α-helix	trans	-67.3	-52.2	179.2	-176.3	-89.2	0	0	0	112.3	W75 A76 M77 E81 N82 F118 V119 I139 N141 E146 R148	W75-W79 WeakPolarHBondContact O-CB 3.39Å; W75-W79 PolarHBondContact O-N 3.29Å; A76-W79 PolarHBondContact O-N 3.14Å; M77-W79 VanDerWaalsContact C-N 3.26Å; M77-W79 PolarHBondContact O-N 3.27Å; W79-E81 VanDerWaalsContact C-N 3.33Å; W79-E81 PolarHBondContact O-N 3.21Å; W79-N82 PolarHBondContact O-N 3.42Å; W79-F118 HydrophobicContact CB-CE2 4.3Å; W79-F118 HydrophobicContact CG-CE2 4.09Å; W79-V119 HydrophobicContact CB-CG2 3.92Å; W79-V119 HydrophobicContact CG-CG2 4.36Å; W79-I139 HydrophobicContact CE3-CD1 3.75Å; W79-I139 HydrophobicContact CE3-CG1 4.07Å; W79-I139 HydrophobicContact CZ3-CD1 4.09Å; W79-I139 HydrophobicContact CZ3-CG1 3.94Å; W79-N141 HydrophobicContact CD2-CB 3.89Å; W79-N141 VanDerWaalsContact CE2-CB 3.43Å; W79-N141 VanDerWaalsContact CE2-ND2 3.34Å; W79-N141 HydrophobicContact CE3-CB 3.99Å; W79-N141 HydrophobicContact CH2-CB 3.36Å; W79-N141 HydrophobicContact CZ2-CB 3.18Å; W79-N141 HydrophobicContact CZ3-CB 3.75Å; W79-N141 PolarHBondContact NE1-ND2 3.47Å; W79-E146 HydrophobicContact CH2-CB 3.85Å; W79-E146 HydrophobicContact CH2-CG 4.17Å; W79-E146 VanDerWaalsContact CH2-O 3.28Å; W79-E146 WeakPolarHBondContact CH2-O 3.23Å; W79-E146 HydrophobicContact CZ2-CB 3.97Å; W79-E146 HydrophobicContact CZ2-CG 4.36Å; W79-E146 WeakPolarHBondContact CZ2-OE2 3.41Å; W79-R148 HydrophobicContact CH2-CG 4.24Å; W79-R148 HydrophobicContact CZ3-CG 4.35Å; W79-R148 PolarHBondContact O-NH1 2.69Å
80	Q	97.7	Very high	97.7	Very high	60 Å²	60	15.7 Å²	15.7	28%	0.28	8%	0.08	S	C	.	.	H	α-helix	trans	-66.7	-36	-174.7	82.6	179.1	40.4	0	0	112	K35 A76 M77 N82	K35-Q80 PolarHBondContact O-NE2 3.2Å; A76-Q80 PolarHBondContact O-N 2.89Å; M77-Q80 PolarHBondContact O-N 2.9Å; Q80-N82 PolarHBondContact O-N 3.21Å
81	E	97.6	Very high	97.5	Very high	36 Å²	36	19.6 Å²	19.6	17%	0.168	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	2.8	-175.7	-61.7	-62.9	142.2	0	0	112.5	V34 R59 I61 M77 W79 V83 C191	V34-E81 HydrophobicContact CG1-CG 4.28Å; R59-E81 IonicContact CZ-OE2 3.64Å; R59-E81 IonicContact NH1-OE2 3.59Å; R59-E81 PolarHBondContact NH1-OE2 3.46Å; R59-E81 PolarHBondContact NH2-O 2.93Å; R59-E81 IonicContact NH2-OE2 2.86Å; R59-E81 PolarHBondContact NH2-OE2 2.94Å; I61-E81 HydrophobicContact CD1-CB 3.78Å; I61-E81 HydrophobicContact CD1-CG 3.58Å; M77-E81 HydrophobicContact CG-CG 3.94Å; M77-E81 VanDerWaalsContact O-CB 3.24Å; M77-E81 WeakPolarHBondContact O-CB 3.29Å; M77-E81 VanDerWaalsContact O-CG 3.23Å; M77-E81 WeakPolarHBondContact O-CG 3.33Å; M77-E81 PolarHBondContact O-N 2.69Å; W79-E81 VanDerWaalsContact C-N 3.33Å; W79-E81 PolarHBondContact O-N 3.21Å; E81-V83 VanDerWaalsContact C-N 3.28Å; E81-V83 HydrophobicContact CB-CG2 3.91Å; E81-V83 PolarHBondContact O-N 3.39Å; E81-C191 WeakPolarHBondContact O-CB 3.37Å
82	N	96.9	Very high	97.2	Very high	62 Å²	62	20.9 Å²	20.9	33%	0.332	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	47.3	-178.1	-166	30.8	0	0	0	112.7	W79 Q80 S84 R148	W79-N82 PolarHBondContact O-N 3.42Å; Q80-N82 PolarHBondContact O-N 3.21Å; N82-S84 PolarHBondContact O-N 3.38Å; N82-R148 WeakPolarHBondContact OD1-CD 3.46Å; N82-R148 PolarHBondContact OD1-NH1 2.91Å
83	V	98.3	Very high	96.8	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.042	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	131.2	-173.9	176.8	0	0	0	0	110.8	V78 E81 L85 I86 L150 I193	V78-V83 HydrophobicContact CG1-CB 4.15Å; V78-V83 PolarHBondContact O-N 3.44Å; E81-V83 VanDerWaalsContact C-N 3.28Å; E81-V83 HydrophobicContact CB-CG2 3.91Å; E81-V83 PolarHBondContact O-N 3.39Å; V83-L85 VanDerWaalsContact CG1-O 3.31Å; V83-L85 WeakPolarHBondContact CG1-O 3.21Å; V83-I86 HydrophobicContact CG1-CG1 3.96Å; V83-L150 WeakPolarHBondContact O-CB 3.32Å; V83-I193 HydrophobicContact CB-CD1 4.4Å; V83-I193 HydrophobicContact CG1-CB 4.36Å; V83-I193 HydrophobicContact CG1-CD1 4.06Å; V83-I193 HydrophobicContact CG1-CG1 4.04Å; V83-I193 HydrophobicContact CG2-CD1 3.7Å; V83-I193 HydrophobicContact CG2-CG1 3.91Å
84	S	97.8	Very high	96.4	Very high	24 Å²	24	23 Å²	23	17%	0.168	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-24.8	-179.4	-56.1	0	0	0	0	113.1	N82 L150 T151 Y184 C191	N82-S84 PolarHBondContact O-N 3.38Å; S84-L150 WeakPolarHBondContact O-CA 3.37Å; S84-L150 WeakPolarHBondContact O-CB 3.21Å; S84-T151 PolarHBondContact O-N 2.86Å; S84-Y184 WeakPolarHBondContact OG-CE2 3.43Å; S84-C191 PolarHBondContact N-O 2.92Å
85	L	98.6	Very high	95.8	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	132.5	179	175.6	62.9	0	0	0	110.6	V83 V87 T151 F176 M177 Q180 V192 I193	V83-L85 VanDerWaalsContact CG1-O 3.31Å; V83-L85 WeakPolarHBondContact CG1-O 3.21Å; L85-V87 HydrophobicContact CD1-CG2 4.31Å; L85-V87 HydrophobicContact CD2-CG2 3.93Å; L85-V87 HydrophobicContact CG-CG2 3.9Å; L85-T151 CarbonylContact C-O 3.53Å; L85-T151 WeakPolarHBondContact CA-O 3.48Å; L85-T151 HydrophobicContact CD1-CG2 3.92Å; L85-T151 WeakPolarHBondContact CD1-O 3.4Å; L85-F176 HydrophobicContact CD1-CE1 4.09Å; L85-F176 HydrophobicContact CD2-CE1 4.44Å; L85-M177 HydrophobicContact CD2-CB 4.46Å; L85-M177 HydrophobicContact CD2-CG 3.91Å; L85-Q180 HydrophobicContact CD2-CG 4.45Å; L85-V192 HydrophobicContact CB-CG1 4.12Å; L85-V192 HydrophobicContact CB-CG2 4.26Å; L85-V192 HydrophobicContact CD2-CG1 3.97Å; L85-V192 HydrophobicContact CD2-CG2 4.48Å; L85-V192 HydrophobicContact CG-CG1 4.01Å; L85-V192 CarbonylContact O-C 3.58Å; L85-V192 WeakPolarHBondContact O-CA 3.49Å; L85-I193 PolarHBondContact O-N 3.34Å
86	I	98.8	Very high	95.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121	168.3	-59.8	170.9	0	0	0	107.8	F74 W75 V78 V83 Y103 L150 T151 H152 Y153 I193	F74-I86 HydrophobicContact CE1-CD1 4.18Å; F74-I86 HydrophobicContact CZ-CD1 4.19Å; F74-I86 HydrophobicContact CZ-CG2 4.31Å; W75-I86 HydrophobicContact CH2-CD1 4.35Å; V78-I86 HydrophobicContact CG2-CD1 4.01Å; V83-I86 HydrophobicContact CG1-CG1 3.96Å; I86-Y103 WeakPolarHBondContact CG2-OH 3.4Å; I86-L150 HydrophobicContact CD1-CD1 3.68Å; I86-L150 HydrophobicContact CG1-CD1 3.96Å; I86-T151 PolarHBondContact N-O 3.02Å; I86-H152 CarbonylContact O-C 3.57Å; I86-H152 WeakPolarHBondContact O-CA 3.5Å; I86-Y153 PolarHBondContact O-N 3.23Å; I86-I193 CarbonylContact C-O 3.5Å; I86-I193 HydrophobicContact CG1-CB 4.27Å; I86-I193 HydrophobicContact CG2-CB 4.47Å; I86-I193 HydrophobicContact CG2-CG2 4.18Å
87	V	98.6	Very high	94.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	109.8	173	-174.2	0	0	0	0	109.2	L85 L89 Y153 L173 M177 V192 I193 V194 H195 L206	L85-V87 HydrophobicContact CD1-CG2 4.31Å; L85-V87 HydrophobicContact CD2-CG2 3.93Å; L85-V87 HydrophobicContact CG-CG2 3.9Å; V87-L89 HydrophobicContact CG1-CD2 3.75Å; V87-L89 HydrophobicContact CG1-CG 4.07Å; V87-Y153 CarbonylContact C-O 3.55Å; V87-Y153 WeakPolarHBondContact CA-O 3.48Å; V87-L173 HydrophobicContact CG1-CD1 4.07Å; V87-L173 HydrophobicContact CG1-CD2 4.11Å; V87-M177 HydrophobicContact CG2-CE 4.44Å; V87-M177 HydrophobicContact CG2-CG 4.36Å; V87-M177 HydrophobicContact CG2-SD 4.24Å; V87-V192 HydrophobicContact CG2-CG1 4.22Å; V87-I193 PolarHBondContact N-O 3.32Å; V87-V194 HydrophobicContact CB-CG1 4.46Å; V87-V194 HydrophobicContact CB-CG2 4.35Å; V87-V194 WeakPolarHBondContact O-CA 3.48Å; V87-H195 PolarHBondContact O-N 3.42Å; V87-L206 HydrophobicContact CG1-CD2 3.86Å
88	C	98.2	Very high	94.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.2	173.8	-179	0	0	0	0	109.7	T90 Y153 L154 Y155 H195	C88-T90 PolarHBondContact SG-O 3.14Å; C88-Y153 PolarHBondContact N-O 3.1Å; C88-L154 HydrophobicContact CB-CD1 3.89Å; C88-L154 VanDerWaalsContact SG-CD1 3.53Å; C88-Y155 PolarHBondContact O-N 3.46Å; C88-H195 VanDerWaalsContact CB-NE2 3.33Å; C88-H195 WeakPolarHBondContact CB-NE2 3.48Å; C88-H195 PolarHBondContact SG-CE1 2.89Å; C88-H195 PolarHBondContact SG-NE2 2.77Å; C88-H195 VanDerWaalsContact SG-NE2 3.38Å
89	L	97.1	Very high	94	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.			trans	-101.4	18.4	-177.3	-61.6	176.1	0	0	0	113	V87 Y155 W158 L173 V194 H195 C196 R202 L206	V87-L89 HydrophobicContact CG1-CD2 3.75Å; V87-L89 HydrophobicContact CG1-CG 4.07Å; L89-Y155 HydrophobicContact CD2-CG 4.31Å; L89-W158 HydrophobicContact CD1-CZ3 4.32Å; L89-L173 HydrophobicContact CD2-CD2 3.72Å; L89-V194 HydrophobicContact CD1-CG1 3.83Å; L89-V194 HydrophobicContact CG-CG1 4.46Å; L89-H195 WeakPolarHBondContact CB-O 3.33Å; L89-H195 PolarHBondContact N-O 2.96Å; L89-C196 HydrophobicContact CB-CB 4.04Å; L89-R202 HydrophobicContact CB-CB 4.08Å; L89-R202 HydrophobicContact CD1-CB 3.93Å; L89-R202 VanDerWaalsContact O-CD 3.22Å; L89-R202 WeakPolarHBondContact O-CD 3.49Å; L89-R202 PolarHBondContact O-NH1 3.13Å; L89-L206 HydrophobicContact CD1-CB 4.06Å; L89-L206 HydrophobicContact CD1-CD2 3.96Å; L89-L206 HydrophobicContact CD2-CD2 4.18Å; L89-L206 HydrophobicContact CG-CD2 4.48Å
90	T	94.5	Very high	93.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-137.8	141.7	179.4	-171.6	0	0	0	0	110.9	C88 E94 K99 T100 L154 C196	C88-T90 PolarHBondContact SG-O 3.14Å; T90-E94 PolarHBondContact OG1-OE1 2.95Å; T90-K99 HydrophobicContact CG2-CB 4.46Å; T90-K99 WeakPolarHBondContact OG1-CB 3.47Å; T90-T100 HydrophobicContact CG2-CG2 3.78Å; T90-L154 WeakPolarHBondContact O-CD1 3.43Å; T90-C196 WeakPolarHBondContact CG2-O 3.04Å
91	K	92.1	Very high	93.6	Very high	91 Å²	91	44.8 Å²	44.8	40%	0.396	23%	0.233	S	C	.	.			trans	-73	159.6	166.6	-61.3	175.7	-174.4	174.1	0	109.1	L93 E94 K99 L156	K91-L93 VanDerWaalsContact C-N 3.31Å; K91-L93 PolarHBondContact O-N 3.28Å; K91-E94 HydrophobicContact CB-CG 3.84Å; K91-E94 PolarHBondContact N-OE1 3.32Å; K91-K99 WeakPolarHBondContact O-CB 3.44Å; K91-L156 WeakPolarHBondContact CE-O 3.23Å; K91-L156 HydrophobicContact CG-CD2 4Å; K91-L156 PolarHBondContact NZ-O 2.7Å
92	I	90.1	Very high	93.4	Very high	49 Å²	49	47.7 Å²	47.7	25%	0.251	25%	0.247	S	C	.	.	S	Bend	trans	-58.5	-47.7	173.5	-63.7	154.6	0	0	0	109.8	T98 K99 T100 E102	I92-T98 CarbonylContact O-C 3.51Å; I92-T98 WeakPolarHBondContact O-CA 3.31Å; I92-K99 PolarHBondContact O-N 3.47Å; I92-T100 HydrophobicContact CB-CG2 4.48Å; I92-T100 HydrophobicContact CG1-CG2 4.13Å; I92-T100 WeakPolarHBondContact CG2-O 3.36Å; I92-E102 HydrophobicContact CD1-CG 3.35Å; I92-E102 WeakPolarHBondContact CD1-OE1 3.48Å; I92-E102 HydrophobicContact CG1-CG 4.15Å
93	L	89.9	Confident	93.4	Very high	106 Å²	106	44.8 Å²	44.8	56%	0.555	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.5	177.5	-71.8	165.9	0	0	0	110.4	K91 K97	K91-L93 VanDerWaalsContact C-N 3.31Å; K91-L93 PolarHBondContact O-N 3.28Å; L93-K97 WeakPolarHBondContact CA-O 3.41Å
94	E	88.4	Confident	93.3	Very high	15 Å²	15	44.8 Å²	44.8	7%	0.07	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	122.8	172.3	-62	-175.4	174.8	0	0	109.6	T90 K91 G96 K97 K99 D160 R202	T90-E94 PolarHBondContact OG1-OE1 2.95Å; K91-E94 HydrophobicContact CB-CG 3.84Å; K91-E94 PolarHBondContact N-OE1 3.32Å; E94-G96 VanDerWaalsContact C-N 3.25Å; E94-G96 PolarHBondContact O-N 2.8Å; E94-K97 PolarHBondContact N-O 3.12Å; E94-K97 PolarHBondContact O-N 3.25Å; E94-K99 HydrophobicContact CB-CG 3.8Å; E94-K99 HydrophobicContact CG-CG 3.97Å; E94-D160 VanDerWaalsContact OE2-CB 3.28Å; E94-D160 WeakPolarHBondContact OE2-CB 3.37Å; E94-R202 IonicContact OE1-CZ 3.26Å; E94-R202 IonicContact OE1-NH1 3.55Å; E94-R202 PolarHBondContact OE1-NH1 2.78Å; E94-R202 IonicContact OE1-NH2 3.93Å; E94-R202 IonicContact OE2-CZ 2.8Å; E94-R202 IonicContact OE2-NH1 2.79Å; E94-R202 PolarHBondContact OE2-NH1 2.97Å; E94-R202 IonicContact OE2-NH2 3.51Å; E94-R202 PolarHBondContact OE2-NH2 2.81Å
95	R	85.9	Confident	93.2	Very high	169 Å²	169	43.8 Å²	43.8	64%	0.638	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	43.4	-177.4	-55.7	-174.7	-175.3	167.7	11	113.1	K97 D160	R95-K97 PolarHBondContact O-N 3.14Å; R95-D160 PolarHBondContact NH2-O 2.91Å
96	G	85.8	Confident	92.9	Very high	76 Å²	76	46.4 Å²	46.4	78%	0.784	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.9	4.5	179.6	0	0	0	0	0	115.1	E94	E94-G96 VanDerWaalsContact C-N 3.25Å; E94-G96 PolarHBondContact O-N 2.8Å
97	K	88	Confident	92.6	Very high	143 Å²	143	49.1 Å²	49.1	62%	0.622	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.5	176.6	-62.9	-174.1	179.6	-175.2	0	110.3	L93 E94 R95 K99	L93-K97 WeakPolarHBondContact CA-O 3.41Å; E94-K97 PolarHBondContact N-O 3.12Å; E94-K97 PolarHBondContact O-N 3.25Å; R95-K97 PolarHBondContact O-N 3.14Å; K97-K99 PolarHBondContact O-N 3.39Å
98	T	91.1	Very high	92	Very high	77 Å²	77	51.9 Å²	51.9	47%	0.472	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	121.1	170.3	-53.4	0	0	0	0	109.3	I92 T100	I92-T98 CarbonylContact O-C 3.51Å; I92-T98 WeakPolarHBondContact O-CA 3.31Å; T98-T100 VanDerWaalsContact CG2-O 3.3Å; T98-T100 WeakPolarHBondContact CG2-O 3.41Å
99	K	91.3	Very high	91.3	Very high	17 Å²	17	53 Å²	53	7%	0.074	29%	0.288	C	S	.	.			trans	-105.5	-23.7	-178.7	-64.6	-56.1	-165.4	164.7	0	113.6	A65 T90 K91 I92 E94 K97 D160 S197	A65-K99 VanDerWaalsContact CB-O 3.23Å; A65-K99 WeakPolarHBondContact CB-O 3.46Å; T90-K99 HydrophobicContact CG2-CB 4.46Å; T90-K99 WeakPolarHBondContact OG1-CB 3.47Å; K91-K99 WeakPolarHBondContact O-CB 3.44Å; I92-K99 PolarHBondContact O-N 3.47Å; E94-K99 HydrophobicContact CB-CG 3.8Å; E94-K99 HydrophobicContact CG-CG 3.97Å; K97-K99 PolarHBondContact O-N 3.39Å; K99-D160 WeakPolarHBondContact CE-OD2 3.49Å; K99-D160 IonicContact NZ-OD2 3.7Å; K99-D160 PolarHBondContact NZ-OD2 3.48Å; K99-S197 PolarHBondContact O-OG 3.37Å
100	T	92.9	Very high	90.6	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.018	33%	0.328	C	S	.	.	S	Bend	trans	-154.6	167.5	174.6	-173.1	0	0	0	0	109.6	A65 T90 I92 T98	A65-T100 WeakPolarHBondContact CB-OG1 3.15Å; T90-T100 HydrophobicContact CG2-CG2 3.78Å; I92-T100 HydrophobicContact CB-CG2 4.48Å; I92-T100 HydrophobicContact CG1-CG2 4.13Å; I92-T100 WeakPolarHBondContact CG2-O 3.36Å; T98-T100 VanDerWaalsContact CG2-O 3.3Å; T98-T100 WeakPolarHBondContact CG2-O 3.41Å
101	Q	93.4	Very high	90.2	Very high	65 Å²	65	68.6 Å²	68.6	30%	0.304	36%	0.358	S	S	.	.			trans	-96.5	163.2	170.2	-57.7	-57.9	-37	0	0	111.8	P66 P68 I71 Y103	P66-Q101 WeakPolarHBondContact O-CG 3.25Å; P68-Q101 HydrophobicContact CG-CG 4.11Å; I71-Q101 HydrophobicContact CD1-CB 3.99Å; I71-Q101 HydrophobicContact CD1-CG 4.47Å; Q101-Y103 VanDerWaalsContact C-N 3.26Å; Q101-Y103 WeakPolarHBondContact O-CD1 3.31Å; Q101-Y103 PolarHBondContact O-N 3.28Å
102	E	93.7	Very high	89.8	Confident	97 Å²	97	69 Å²	69	45%	0.453	36%	0.358	S	S	.	.			trans	-74.8	79.4	164	-69.6	-171.8	177.5	0	0	109.8	I92 W104 T106	I92-E102 HydrophobicContact CD1-CG 3.35Å; I92-E102 WeakPolarHBondContact CD1-OE1 3.48Å; I92-E102 HydrophobicContact CG1-CG 4.15Å; E102-W104 PolarHBondContact O-N 2.94Å; E102-T106 HydrophobicContact CG-CG2 4.13Å
103	Y	96.8	Very high	89.9	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.365	C	S	.	.			trans	-83.3	7.4	179.2	64.9	-97	0	0	0	112.9	P66 F74 W75 I86 Q101 Y116 H152 H195	P66-Y103 HydrophobicContact CB-CD1 4.2Å; P66-Y103 HydrophobicContact CB-CG 4.32Å; P66-Y103 HydrophobicContact CG-CD1 3.59Å; P66-Y103 HydrophobicContact CG-CD2 4.46Å; P66-Y103 HydrophobicContact CG-CE1 4.05Å; P66-Y103 HydrophobicContact CG-CG 3.83Å; F74-Y103 AromaticContact CD1-CD2 3.95Å; F74-Y103 HydrophobicContact CD1-CD2 3.95Å; F74-Y103 HydrophobicContact CD1-CE2 4.31Å; F74-Y103 AromaticContact CE1-CD2 3.5Å; F74-Y103 HydrophobicContact CE1-CD2 3.5Å; F74-Y103 AromaticContact CE1-CE2 3.42Å; F74-Y103 HydrophobicContact CE1-CE2 3.42Å; F74-Y103 VanDerWaalsContact CE1-CE2 3.42Å; F74-Y103 HydrophobicContact CE1-CG 4.39Å; F74-Y103 HydrophobicContact CZ-CD2 4.22Å; F74-Y103 AromaticContact CZ-CE2 3.76Å; F74-Y103 HydrophobicContact CZ-CE2 3.76Å; W75-Y103 VanDerWaalsContact CE2-O 3.25Å; W75-Y103 HydrophobicContact CZ2-CD2 4.09Å; W75-Y103 VanDerWaalsContact CZ2-O 3.28Å; W75-Y103 WeakPolarHBondContact CZ2-O 3.2Å; W75-Y103 PolarHBondContact NE1-O 2.95Å; I86-Y103 WeakPolarHBondContact CG2-OH 3.4Å; Q101-Y103 VanDerWaalsContact C-N 3.26Å; Q101-Y103 WeakPolarHBondContact O-CD1 3.31Å; Q101-Y103 PolarHBondContact O-N 3.28Å; Y103-Y116 WeakPolarHBondContact O-CE2 3.37Å; Y103-Y116 PolarHBondContact O-OH 3.41Å; Y103-Y116 VanDerWaalsContact O-OH 3.1Å; Y103-H152 AromaticContact CE2-NE2 3.85Å; Y103-H152 AromaticContact CZ-NE2 3.53Å; Y103-H152 PolarHBondContact OH-NE2 2.92Å; Y103-H195 AromaticContact CE1-CE1 3.69Å; Y103-H195 AromaticContact CE1-NE2 3.45Å; Y103-H195 WeakPolarHBondContact CE1-NE2 3.42Å; Y103-H195 AromaticContact CZ-NE2 3.39Å; Y103-H195 PolarHBondContact OH-CD2 3.18Å; Y103-H195 PolarHBondContact OH-NE2 2.85Å
104	W	96.7	Very high	90.1	Very high	8 Å²	8	69 Å²	69	3%	0.03	35%	0.353	C	S	.	.	S	Bend	trans	-141.1	157.9	176.6	73.2	99	0	0	0	110.6	W75 E102 T106 Y116 L137 H152 L154	W75-W104 HydrophobicContact CZ2-CB 4.09Å; E102-W104 PolarHBondContact O-N 2.94Å; W104-T106 HydrophobicContact CZ2-CG2 4.27Å; W104-T106 PolarHBondContact O-N 3.3Å; W104-T106 VanDerWaalsContact O-N 3.16Å; W104-Y116 PolarHBondContact N-OH 2.95Å; W104-L137 HydrophobicContact CB-CD1 3.97Å; W104-L137 HydrophobicContact CG-CD1 4.43Å; W104-H152 AromaticContact CD2-CE1 3.74Å; W104-H152 AromaticContact CD2-NE2 3.65Å; W104-H152 AromaticContact CE2-CE1 3.43Å; W104-H152 VanDerWaalsContact CE2-CE1 3.43Å; W104-H152 AromaticContact CE2-ND1 3.9Å; W104-H152 AromaticContact CE2-NE2 3.86Å; W104-H152 AromaticContact CE3-CE1 3.91Å; W104-H152 AromaticContact CE3-NE2 3.55Å; W104-H152 AromaticContact CH2-CE1 3.59Å; W104-H152 AromaticContact CH2-NE2 3.94Å; W104-H152 AromaticContact CZ2-CE1 3.37Å; W104-H152 WeakPolarHBondContact CZ2-CE1 3.36Å; W104-H152 AromaticContact CZ3-CE1 3.85Å; W104-H152 AromaticContact CZ3-NE2 3.7Å; W104-L154 HydrophobicContact CH2-CD2 4.39Å; W104-L154 HydrophobicContact CZ2-CD2 4.17Å
105	P	95	Very high	90.5	Very high	3 Å²	3	73.2 Å²	73.2	2%	0.019	37%	0.372	C	S	.	.			trans	-65	114.3	171.7	-16.1	28.7	0	0	0	111.2	C107 Q114 V121 N123	P105-C107 VanDerWaalsContact C-N 3.31Å; P105-C107 PolarHBondContact O-N 3.23Å; P105-Q114 HydrophobicContact CG-CB 4.25Å; P105-Q114 HydrophobicContact CG-CG 4.11Å; P105-V121 HydrophobicContact CG-CG1 4.32Å; P105-V121 WeakPolarHBondContact CG-O 3.48Å; P105-N123 HydrophobicContact CB-CB 4.01Å; P105-N123 VanDerWaalsContact O-CB 3.27Å; P105-N123 WeakPolarHBondContact O-CB 3.29Å; P105-N123 PolarHBondContact O-ND2 3.18Å
106	T	92.7	Very high	91	Very high	56 Å²	56	66.1 Å²	66.1	34%	0.344	35%	0.345	S	S	.	.	S	Bend	trans	-79.9	-11.2	-176.7	50	0	0	0	0	113.8	E102 W104 I126	E102-T106 HydrophobicContact CG-CG2 4.13Å; W104-T106 HydrophobicContact CZ2-CG2 4.27Å; W104-T106 PolarHBondContact O-N 3.3Å; W104-T106 VanDerWaalsContact O-N 3.16Å; T106-I126 WeakPolarHBondContact O-CD1 3.17Å
107	C	91.6	Very high	91.4	Very high	57 Å²	57	63.8 Å²	63.8	39%	0.385	32%	0.321	S	S	.	.	S	Bend	trans	-115.2	146.7	173.8	-66.3	0	0	0	0	110.7	P105 Y112 N123	P105-C107 VanDerWaalsContact C-N 3.31Å; P105-C107 PolarHBondContact O-N 3.23Å; C107-Y112 HydrophobicContact CB-CD1 3.7Å; C107-Y112 HydrophobicContact CB-CD2 3.8Å; C107-Y112 HydrophobicContact CB-CE1 3.67Å; C107-Y112 HydrophobicContact CB-CE2 3.75Å; C107-Y112 HydrophobicContact CB-CG 3.76Å; C107-Y112 WeakPolarHBondContact O-CB 3.02Å; C107-N123 WeakPolarHBondContact O-CB 3.32Å
108	C	87.5	Confident	91.8	Very high	58 Å²	58	58 Å²	58	39%	0.392	30%	0.296	S	S	.	.			trans	-97.6	145.5	176.2	63.5	0	0	0	0	112.3	Y112 N123 I126	C108-Y112 VanDerWaalsContact C-CD2 3.44Å; C108-Y112 VanDerWaalsContact O-CD2 3.28Å; C108-Y112 WeakPolarHBondContact O-CD2 3.41Å; C108-Y112 WeakPolarHBondContact O-CE2 3.48Å; C108-N123 WeakPolarHBondContact CA-O 3.39Å; C108-I126 HydrophobicContact CB-CD1 4.05Å; C108-I126 HydrophobicContact CB-CG1 4.08Å
109	G	82.2	Confident	92.2	Very high	24 Å²	24	54.3 Å²	54.3	25%	0.247	27%	0.273	C	S	.	.	S	Bend	trans	147.8	164.3	-178.2	0	0	0	0	0	111.7	Q111 Y112 N123	G109-Q111 PolarHBondContact O-N 3.45Å; G109-Y112 PolarHBondContact O-N 2.96Å; G109-N123 PolarHBondContact N-O 3.5Å
110	K	82.2	Confident	92.5	Very high	193 Å²	193	55.6 Å²	55.6	84%	0.839	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-29.4	-177.4	-71.6	-175	178.4	179.4	0	112.8
111	Q	86	Confident	92.7	Very high	134 Å²	134	55.5 Å²	55.5	63%	0.626	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-20.5	179.6	70	-82.8	29.9	0	0	113.9	G109 H113	G109-Q111 PolarHBondContact O-N 3.45Å; Q111-H113 PolarHBondContact O-N 3.36Å; Q111-H113 VanDerWaalsContact O-N 3.13Å
112	Y	85.6	Confident	92.9	Very high	98 Å²	98	55.7 Å²	55.7	38%	0.384	28%	0.277	S	S	.	.			trans	-91.1	77.4	-176.6	-58.3	-71.9	0	0	0	110.4	C107 C108 G109	C107-Y112 HydrophobicContact CB-CD1 3.7Å; C107-Y112 HydrophobicContact CB-CD2 3.8Å; C107-Y112 HydrophobicContact CB-CE1 3.67Å; C107-Y112 HydrophobicContact CB-CE2 3.75Å; C107-Y112 HydrophobicContact CB-CG 3.76Å; C107-Y112 WeakPolarHBondContact O-CB 3.02Å; C108-Y112 VanDerWaalsContact C-CD2 3.44Å; C108-Y112 VanDerWaalsContact O-CD2 3.28Å; C108-Y112 WeakPolarHBondContact O-CD2 3.41Å; C108-Y112 WeakPolarHBondContact O-CE2 3.48Å; G109-Y112 PolarHBondContact O-N 2.96Å
113	H	90.2	Very high	93	Very high	86 Å²	86	51 Å²	51	40%	0.398	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.7	178.8	157.1	-90.2	0	0	0	109.4	Q111 H120 V121	Q111-H113 PolarHBondContact O-N 3.36Å; Q111-H113 VanDerWaalsContact O-N 3.13Å; H113-H120 AromaticContact CE1-ND1 3.3Å; H113-H120 PolarHBondContact CE1-ND1 2.99Å; H113-H120 VanDerWaalsContact CE1-ND1 3.3Å; H113-H120 WeakPolarHBondContact NE2-CB 3.28Å; H113-H120 AromaticContact NE2-CG 3.48Å; H113-H120 AromaticContact NE2-ND1 2.85Å; H113-H120 PolarHBondContact NE2-ND1 3.29Å; H113-V121 WeakPolarHBondContact CA-O 3.43Å
114	Q	95.5	Very high	93	Very high	69 Å²	69	53.4 Å²	53.4	32%	0.322	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.7	177.5	-67	-176.9	53.1	0	0	110	P105 Y116 V121	P105-Q114 HydrophobicContact CG-CB 4.25Å; P105-Q114 HydrophobicContact CG-CG 4.11Å; Q114-Y116 HydrophobicContact CB-CE1 4.24Å; Q114-Y116 HydrophobicContact CB-CE2 3.86Å; Q114-Y116 PolarHBondContact OE1-OH 2.95Å; Q114-V121 PolarHBondContact N-O 3.03Å; Q114-V121 PolarHBondContact O-N 3.34Å
115	K	96	Very high	93	Very high	104 Å²	104	54.1 Å²	54.1	45%	0.452	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.3	177.1	-179.7	178.6	-179.8	169.7	0	109.4	G117 E142	K115-G117 WeakPolarHBondContact CE-O 3.31Å; K115-G117 WeakPolarHBondContact CG-O 3.43Å; K115-E142 WeakPolarHBondContact CE-OE2 3.46Å; K115-E142 IonicContact NZ-OE1 2.7Å; K115-E142 PolarHBondContact NZ-OE1 2.81Å; K115-E142 IonicContact NZ-OE2 2.74Å; K115-E142 PolarHBondContact NZ-OE2 3.5Å
116	Y	96.3	Very high	93	Very high	20 Å²	20	56.5 Å²	56.5	8%	0.078	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	99	175.3	-50.7	-69.8	0	0	0	109.4	I71 W75 Y103 W104 Q114 F118 V119 V121	I71-Y116 HydrophobicContact CG2-CD1 3.34Å; I71-Y116 HydrophobicContact CG2-CE1 3.52Å; I71-Y116 HydrophobicContact CG2-CG 3.9Å; W75-Y116 AromaticContact CD1-CD2 3.13Å; W75-Y116 AromaticContact CD1-CE2 3.7Å; W75-Y116 AromaticContact CD1-CG 3.41Å; W75-Y116 VanDerWaalsContact CD1-CG 3.41Å; W75-Y116 HydrophobicContact CD2-CD2 4.14Å; W75-Y116 AromaticContact CE2-CD2 3.85Å; W75-Y116 AromaticContact CE2-CE2 3.85Å; W75-Y116 AromaticContact CG-CD2 3.74Å; W75-Y116 HydrophobicContact CG-CD2 3.74Å; W75-Y116 HydrophobicContact CG-CE2 4.49Å; W75-Y116 HydrophobicContact CG-CG 4.14Å; W75-Y116 HydrophobicContact CZ2-CE2 4.39Å; W75-Y116 AromaticContact NE1-CD2 3.18Å; W75-Y116 AromaticContact NE1-CE2 3.22Å; W75-Y116 AromaticContact NE1-CG 3.86Å; W75-Y116 AromaticContact NE1-CZ 3.94Å; Y103-Y116 WeakPolarHBondContact O-CE2 3.37Å; Y103-Y116 PolarHBondContact O-OH 3.41Å; Y103-Y116 VanDerWaalsContact O-OH 3.1Å; W104-Y116 PolarHBondContact N-OH 2.95Å; Q114-Y116 HydrophobicContact CB-CE1 4.24Å; Q114-Y116 HydrophobicContact CB-CE2 3.86Å; Q114-Y116 PolarHBondContact OE1-OH 2.95Å; Y116-F118 PolarHBondContact O-N 3.46Å; Y116-V119 PolarHBondContact N-O 3.26Å; Y116-V119 PolarHBondContact O-N 3.4Å; Y116-V121 HydrophobicContact CD2-CB 4.3Å; Y116-V121 HydrophobicContact CD2-CG2 3.63Å; Y116-V121 HydrophobicContact CE2-CB 4.06Å; Y116-V121 HydrophobicContact CE2-CG2 3.83Å
117	G	95.3	Very high	93.2	Very high	27 Å²	27	61.6 Å²	61.6	28%	0.278	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	-128.2	-170.3	0	0	0	0	0	110.5	K115 V119	K115-G117 WeakPolarHBondContact CE-O 3.31Å; K115-G117 WeakPolarHBondContact CG-O 3.43Å; G117-V119 VanDerWaalsContact C-N 3.31Å
118	F	96.3	Very high	93.4	Very high	22 Å²	22	64.3 Å²	64.3	10%	0.096	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	0.5	176.9	59.5	-97.3	0	0	0	113.8	A76 W79 Y116 E142	A76-F118 HydrophobicContact CB-CE1 4.13Å; A76-F118 HydrophobicContact CB-CZ 3.93Å; W79-F118 HydrophobicContact CB-CE2 4.3Å; W79-F118 HydrophobicContact CG-CE2 4.09Å; Y116-F118 PolarHBondContact O-N 3.46Å; F118-E142 HydrophobicContact CB-CB 4.39Å; F118-E142 WeakPolarHBondContact O-CB 3.32Å; F118-E142 PolarHBondContact O-N 2.92Å
119	V	98.1	Very high	93.7	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121	-178	-174.8	0	0	0	0	109.8	W75 W79 Y116 G117 V121 I139	W75-V119 HydrophobicContact CB-CB 4.17Å; W75-V119 HydrophobicContact CB-CG1 4.37Å; W75-V119 HydrophobicContact CB-CG2 4.41Å; W75-V119 HydrophobicContact CE3-CG1 4.26Å; W79-V119 HydrophobicContact CB-CG2 3.92Å; W79-V119 HydrophobicContact CG-CG2 4.36Å; Y116-V119 PolarHBondContact N-O 3.26Å; Y116-V119 PolarHBondContact O-N 3.4Å; G117-V119 VanDerWaalsContact C-N 3.31Å; V119-V121 HydrophobicContact CG1-CG2 4.05Å; V119-I139 HydrophobicContact CG1-CB 4.17Å; V119-I139 HydrophobicContact CG1-CG2 4.43Å
120	H	97.7	Very high	94.2	Very high	44 Å²	44	71.2 Å²	71.2	20%	0.204	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.7	172.8	-70.6	-99.7	0	0	0	109.2	H113 I139 A140 E142	H113-H120 AromaticContact CE1-ND1 3.3Å; H113-H120 PolarHBondContact CE1-ND1 2.99Å; H113-H120 VanDerWaalsContact CE1-ND1 3.3Å; H113-H120 WeakPolarHBondContact NE2-CB 3.28Å; H113-H120 AromaticContact NE2-CG 3.48Å; H113-H120 AromaticContact NE2-ND1 2.85Å; H113-H120 PolarHBondContact NE2-ND1 3.29Å; H120-I139 CarbonylContact O-C 3.56Å; H120-I139 WeakPolarHBondContact O-CA 3.36Å; H120-A140 HydrophobicContact CB-CB 4.22Å; H120-A140 PolarHBondContact N-O 3.13Å; H120-A140 PolarHBondContact O-N 3.46Å; H120-E142 IonicContact NE2-OE1 3.94Å; H120-E142 IonicContact NE2-OE2 3.95Å
121	V	98.2	Very high	94.7	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.1	-176.3	-173.2	0	0	0	0	109.5	W75 P105 H113 Q114 Y116 V119 L137 I139	W75-V121 HydrophobicContact CD2-CG2 3.71Å; W75-V121 HydrophobicContact CE3-CG2 3.74Å; W75-V121 HydrophobicContact CG-CG2 4.4Å; W75-V121 HydrophobicContact CH2-CB 4.45Å; W75-V121 HydrophobicContact CH2-CG1 3.66Å; W75-V121 HydrophobicContact CH2-CG2 3.9Å; W75-V121 HydrophobicContact CZ2-CB 4.41Å; W75-V121 HydrophobicContact CZ2-CG1 3.83Å; W75-V121 HydrophobicContact CZ2-CG2 3.85Å; W75-V121 HydrophobicContact CZ3-CG1 4.24Å; W75-V121 HydrophobicContact CZ3-CG2 3.83Å; P105-V121 HydrophobicContact CG-CG1 4.32Å; P105-V121 WeakPolarHBondContact CG-O 3.48Å; H113-V121 WeakPolarHBondContact CA-O 3.43Å; Q114-V121 PolarHBondContact N-O 3.03Å; Q114-V121 PolarHBondContact O-N 3.34Å; Y116-V121 HydrophobicContact CD2-CB 4.3Å; Y116-V121 HydrophobicContact CD2-CG2 3.63Å; Y116-V121 HydrophobicContact CE2-CB 4.06Å; Y116-V121 HydrophobicContact CE2-CG2 3.83Å; V119-V121 HydrophobicContact CG1-CG2 4.05Å; V121-L137 HydrophobicContact CG1-CB 4.44Å; V121-L137 HydrophobicContact CG1-CD1 4.39Å; V121-I139 HydrophobicContact CB-CG2 4.47Å; V121-I139 HydrophobicContact CG1-CG2 4.22Å; V121-I139 HydrophobicContact CG2-CG2 4.01Å
122	R	96.9	Very high	95.1	Very high	69 Å²	69	59.3 Å²	59.3	26%	0.26	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132.8	176.5	-175.1	173.9	67.4	97.8	-4.4	110	V124 L137 E138	R122-V124 HydrophobicContact CG-CG1 4.35Å; R122-L137 WeakPolarHBondContact O-CA 3.35Å; R122-E138 IonicContact CZ-OE1 2.61Å; R122-E138 PolarHBondContact N-O 3.3Å; R122-E138 IonicContact NE-OE1 3.79Å; R122-E138 PolarHBondContact NE-OE1 3.45Å; R122-E138 VanDerWaalsContact NH2-CD 3.27Å; R122-E138 IonicContact NH2-OE1 3.27Å; R122-E138 PolarHBondContact NH2-OE1 2.6Å; R122-E138 IonicContact NH2-OE2 3.42Å; R122-E138 PolarHBondContact NH2-OE2 2.98Å; R122-E138 PolarHBondContact O-N 2.96Å
123	N	97	Very high	95.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	119.1	172.1	-171.6	-25.1	0	0	0	109.6	P105 C107 C108 G109 G125 I126 S135 I136 L137	P105-N123 HydrophobicContact CB-CB 4.01Å; P105-N123 VanDerWaalsContact O-CB 3.27Å; P105-N123 WeakPolarHBondContact O-CB 3.29Å; P105-N123 PolarHBondContact O-ND2 3.18Å; C107-N123 WeakPolarHBondContact O-CB 3.32Å; C108-N123 WeakPolarHBondContact CA-O 3.39Å; G109-N123 PolarHBondContact N-O 3.5Å; N123-G125 PolarHBondContact OD1-N 3.04Å; N123-G125 VanDerWaalsContact OD1-N 3.13Å; N123-G125 PolarHBondContact OD1-O 3.43Å; N123-G125 VanDerWaalsContact OD1-O 3.07Å; N123-I126 WeakPolarHBondContact ND2-CG1 3.47Å; N123-S135 WeakPolarHBondContact ND2-CB 3.22Å; N123-S135 PolarHBondContact ND2-OG 3.01Å; N123-S135 VanDerWaalsContact ND2-OG 3.08Å; N123-I136 PolarHBondContact OD1-O 3.28Å; N123-L137 HydrophobicContact CB-CD2 3.84Å
124	V	96.3	Very high	96	Very high	49 Å²	49	52.2 Å²	52.2	30%	0.297	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-5.6	-173.8	-51	0	0	0	0	113.4	R122 I136 E138	R122-V124 HydrophobicContact CG-CG1 4.35Å; V124-I136 HydrophobicContact CG2-CB 3.8Å; V124-I136 HydrophobicContact CG2-CG2 3.6Å; V124-I136 WeakPolarHBondContact CG2-O 3.41Å; V124-I136 PolarHBondContact N-O 3.06Å; V124-E138 HydrophobicContact CG1-CB 3.69Å
125	G	95.6	Very high	96.1	Very high	23 Å²	23	49 Å²	49	24%	0.237	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.8	143.5	177.6	0	0	0	0	0	111.9	N123 S135 I136	N123-G125 PolarHBondContact OD1-N 3.04Å; N123-G125 VanDerWaalsContact OD1-N 3.13Å; N123-G125 PolarHBondContact OD1-O 3.43Å; N123-G125 VanDerWaalsContact OD1-O 3.07Å; G125-S135 CarbonylContact O-C 3.53Å; G125-S135 WeakPolarHBondContact O-CA 3.45Å; G125-I136 PolarHBondContact O-N 2.89Å
126	I	96.1	Very high	96.2	Very high	53 Å²	53	47 Å²	47	27%	0.272	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.8	-179.1	-59.8	167.2	0	0	0	109	T106 C108 N123 N128 I134	T106-I126 WeakPolarHBondContact O-CD1 3.17Å; C108-I126 HydrophobicContact CB-CD1 4.05Å; C108-I126 HydrophobicContact CB-CG1 4.08Å; N123-I126 WeakPolarHBondContact ND2-CG1 3.47Å; I126-N128 WeakPolarHBondContact CG2-OD1 3.22Å; I126-I134 CarbonylContact C-O 3.58Å; I126-I134 WeakPolarHBondContact CA-O 3.4Å
127	R	96.5	Very high	96.3	Very high	163 Å²	163	46.1 Å²	46.1	62%	0.615	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.7	167	-179.8	-176.5	175.1	-168.5	-0.3	108.8	Y132 I134	R127-Y132 PolarHBondContact NH2-OH 2.85Å; R127-I134 HydrophobicContact CB-CB 4.49Å; R127-I134 PolarHBondContact N-O 3.28Å; R127-I134 PolarHBondContact O-N 2.95Å
128	N	95.5	Very high	96.4	Very high	115 Å²	115	46.5 Å²	46.5	62%	0.615	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.7	178.3	-66.6	-40.2	0	0	0	111.1	I126 S133	I126-N128 WeakPolarHBondContact CG2-OD1 3.22Å; N128-S133 VanDerWaalsContact OD1-CB 3.29Å; N128-S133 WeakPolarHBondContact OD1-CB 3.4Å; N128-S133 PolarHBondContact OD1-OG 3.46Å
129	A	94.3	Very high	96.5	Very high	36 Å²	36	45.6 Å²	45.6	30%	0.298	22%	0.223	S	C	.	.			trans	-132.1	174.6	165.1	0	0	0	0	0	108.5	Q131 Y132	A129-Q131 PolarHBondContact O-N 3.3Å; A129-Y132 CarbonylContact C-O 3.58Å; A129-Y132 HydrophobicContact CB-CD1 3.97Å; A129-Y132 HydrophobicContact CB-CD2 4Å; A129-Y132 HydrophobicContact CB-CE1 3.68Å; A129-Y132 HydrophobicContact CB-CE2 3.71Å; A129-Y132 HydrophobicContact CB-CG 4.13Å; A129-Y132 PolarHBondContact N-O 2.9Å
130	K	91.9	Very high	96.5	Very high	190 Å²	190	46.5 Å²	46.5	83%	0.826	23%	0.231	S	C	*	.	S	Bend	trans	-63.3	-33.8	178.1	-178.4	178.7	178.4	-179.2	0	112.1
131	Q	92.7	Very high	96.5	Very high	50 Å²	50	44.9 Å²	44.9	23%	0.234	22%	0.224	C	C	.	.	S	Bend	trans	-97.3	-17.1	-171.1	-55	78.8	-1.5	0	0	113.2	A129 L156 D157 N169	A129-Q131 PolarHBondContact O-N 3.3Å; Q131-L156 WeakPolarHBondContact O-CA 3.4Å; Q131-L156 WeakPolarHBondContact O-CB 3.42Å; Q131-L156 PolarHBondContact O-N 2.9Å; Q131-D157 HydrophobicContact CB-CB 4.23Å; Q131-D157 HydrophobicContact CG-CB 4.5Å; Q131-N169 HydrophobicContact CG-CB 4.16Å; Q131-N169 VanDerWaalsContact CG-ND2 3.26Å; Q131-N169 WeakPolarHBondContact CG-ND2 3.31Å
132	Y	95.9	Very high	96.4	Very high	28 Å²	28	49.1 Å²	49.1	11%	0.11	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	162.1	-175.1	63.8	-104.4	0	0	0	113	R127 A129 I134 Y153 L154	R127-Y132 PolarHBondContact NH2-OH 2.85Å; A129-Y132 CarbonylContact C-O 3.58Å; A129-Y132 HydrophobicContact CB-CD1 3.97Å; A129-Y132 HydrophobicContact CB-CD2 4Å; A129-Y132 HydrophobicContact CB-CE1 3.68Å; A129-Y132 HydrophobicContact CB-CE2 3.71Å; A129-Y132 HydrophobicContact CB-CG 4.13Å; A129-Y132 PolarHBondContact N-O 2.9Å; Y132-I134 HydrophobicContact CD2-CD1 3.79Å; Y132-I134 HydrophobicContact CD2-CG1 3.68Å; Y132-I134 HydrophobicContact CE2-CD1 3.54Å; Y132-I134 HydrophobicContact CE2-CG1 3.91Å; Y132-Y153 VanDerWaalsContact CB-CE1 3.48Å; Y132-Y153 WeakPolarHBondContact CB-OH 3.43Å; Y132-Y153 AromaticContact CD1-CZ 3.99Å; Y132-Y153 WeakPolarHBondContact CD1-OH 3.31Å; Y132-Y153 HydrophobicContact CG-CE1 4.21Å; Y132-Y153 HydrophobicContact CG-CE2 4.31Å; Y132-Y153 AromaticContact CG-CZ 3.72Å; Y132-L154 CarbonylContact C-O 3.52Å; Y132-L154 WeakPolarHBondContact CA-O 3.45Å; Y132-L154 WeakPolarHBondContact CB-O 3.27Å
133	S	96.8	Very high	96.3	Very high	19 Å²	19	53.7 Å²	53.7	13%	0.133	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130	162.1	-177.5	0	0	0	0	108.7	N128 L154	N128-S133 VanDerWaalsContact OD1-CB 3.29Å; N128-S133 WeakPolarHBondContact OD1-CB 3.4Å; N128-S133 PolarHBondContact OD1-OG 3.46Å; S133-L154 PolarHBondContact N-O 2.98Å; S133-L154 PolarHBondContact O-N 3.27Å
134	I	97.9	Very high	96.3	Very high	16 Å²	16	57.8 Å²	57.8	8%	0.082	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.7	176.5	-64	168.7	0	0	0	107.9	I126 R127 Y132 T151 H152 Y153 F176	I126-I134 CarbonylContact C-O 3.58Å; I126-I134 WeakPolarHBondContact CA-O 3.4Å; R127-I134 HydrophobicContact CB-CB 4.49Å; R127-I134 PolarHBondContact N-O 3.28Å; R127-I134 PolarHBondContact O-N 2.95Å; Y132-I134 HydrophobicContact CD2-CD1 3.79Å; Y132-I134 HydrophobicContact CD2-CG1 3.68Å; Y132-I134 HydrophobicContact CE2-CD1 3.54Å; Y132-I134 HydrophobicContact CE2-CG1 3.91Å; I134-T151 HydrophobicContact CG2-CG2 3.65Å; I134-H152 CarbonylContact C-O 3.53Å; I134-H152 WeakPolarHBondContact CA-O 3.25Å; I134-Y153 HydrophobicContact CD1-CD2 3.8Å; I134-Y153 HydrophobicContact CD1-CE2 3.77Å; I134-Y153 HydrophobicContact CG1-CD2 3.59Å; I134-Y153 HydrophobicContact CG1-CE2 3.9Å; I134-Y153 HydrophobicContact CG1-CG 4.21Å; I134-F176 HydrophobicContact CD1-CD2 4.47Å; I134-F176 HydrophobicContact CD1-CE2 3.98Å; I134-F176 HydrophobicContact CD1-CZ 4.27Å
135	S	97.5	Very high	96.2	Very high	2 Å²	2	62 Å²	62	1%	0.014	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	140	172.8	-64	0	0	0	0	110.5	N123 G125 H152	N123-S135 WeakPolarHBondContact ND2-CB 3.22Å; N123-S135 PolarHBondContact ND2-OG 3.01Å; N123-S135 VanDerWaalsContact ND2-OG 3.08Å; G125-S135 CarbonylContact O-C 3.53Å; G125-S135 WeakPolarHBondContact O-CA 3.45Å; S135-H152 PolarHBondContact N-O 2.83Å; S135-H152 PolarHBondContact O-N 2.84Å
136	I	97.4	Very high	96.4	Very high	62 Å²	62	65 Å²	65	32%	0.318	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	117.6	166.6	-53.1	-56.8	0	0	0	107.2	N123 V124 G125 K149 T151	N123-I136 PolarHBondContact OD1-O 3.28Å; V124-I136 HydrophobicContact CG2-CB 3.8Å; V124-I136 HydrophobicContact CG2-CG2 3.6Å; V124-I136 WeakPolarHBondContact CG2-O 3.41Å; V124-I136 PolarHBondContact N-O 3.06Å; G125-I136 PolarHBondContact O-N 2.89Å; I136-K149 HydrophobicContact CG2-CD 4.47Å; I136-T151 HydrophobicContact CD1-CG2 4.28Å
137	L	98	Very high	96.4	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.8	-178.1	-54.9	-175	0	0	0	109	W75 W104 V121 R122 N123 K149 L150 H152	W75-L137 HydrophobicContact CH2-CD1 3.77Å; W75-L137 HydrophobicContact CZ2-CD1 4.44Å; W104-L137 HydrophobicContact CB-CD1 3.97Å; W104-L137 HydrophobicContact CG-CD1 4.43Å; V121-L137 HydrophobicContact CG1-CB 4.44Å; V121-L137 HydrophobicContact CG1-CD1 4.39Å; R122-L137 WeakPolarHBondContact O-CA 3.35Å; N123-L137 HydrophobicContact CB-CD2 3.84Å; L137-K149 CarbonylContact O-C 3.49Å; L137-K149 VanDerWaalsContact O-CA 3.29Å; L137-K149 WeakPolarHBondContact O-CA 3.33Å; L137-L150 HydrophobicContact CB-CD1 4.15Å; L137-L150 HydrophobicContact CB-CG 4.23Å; L137-L150 HydrophobicContact CD1-CD1 4.15Å; L137-L150 HydrophobicContact CG-CD1 4.44Å; L137-L150 PolarHBondContact N-O 3.4Å; L137-L150 PolarHBondContact O-N 3.37Å; L137-H152 HydrophobicContact CD1-CB 3.71Å; L137-H152 HydrophobicContact CG-CB 4.05Å
138	E	97.6	Very high	96.5	Very high	36 Å²	36	63.7 Å²	63.7	17%	0.168	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.9	166	-177.2	178.2	85.7	0	0	107.9	R122 V124 R148 K149	R122-E138 IonicContact CZ-OE1 2.61Å; R122-E138 PolarHBondContact N-O 3.3Å; R122-E138 IonicContact NE-OE1 3.79Å; R122-E138 PolarHBondContact NE-OE1 3.45Å; R122-E138 VanDerWaalsContact NH2-CD 3.27Å; R122-E138 IonicContact NH2-OE1 3.27Å; R122-E138 PolarHBondContact NH2-OE1 2.6Å; R122-E138 IonicContact NH2-OE2 3.42Å; R122-E138 PolarHBondContact NH2-OE2 2.98Å; R122-E138 PolarHBondContact O-N 2.96Å; V124-E138 HydrophobicContact CG1-CB 3.69Å; E138-R148 WeakPolarHBondContact CA-O 3.44Å; E138-K149 HydrophobicContact CB-CG 4.43Å
139	I	98.1	Very high	96.5	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.6	174.8	63	174.7	0	0	0	110.4	W75 V78 W79 V119 H120 V121 K147 R148 L150	W75-I139 HydrophobicContact CE3-CG2 4.22Å; W75-I139 HydrophobicContact CH2-CG2 4.38Å; W75-I139 HydrophobicContact CZ3-CG2 3.63Å; V78-I139 HydrophobicContact CG1-CD1 4.13Å; W79-I139 HydrophobicContact CE3-CD1 3.75Å; W79-I139 HydrophobicContact CE3-CG1 4.07Å; W79-I139 HydrophobicContact CZ3-CD1 4.09Å; W79-I139 HydrophobicContact CZ3-CG1 3.94Å; V119-I139 HydrophobicContact CG1-CB 4.17Å; V119-I139 HydrophobicContact CG1-CG2 4.43Å; H120-I139 CarbonylContact O-C 3.56Å; H120-I139 WeakPolarHBondContact O-CA 3.36Å; V121-I139 HydrophobicContact CB-CG2 4.47Å; V121-I139 HydrophobicContact CG1-CG2 4.22Å; V121-I139 HydrophobicContact CG2-CG2 4.01Å; I139-K147 CarbonylContact O-C 3.58Å; I139-K147 VanDerWaalsContact O-CA 3.27Å; I139-K147 WeakPolarHBondContact O-CA 3.46Å; I139-R148 HydrophobicContact CD1-CB 4.3Å; I139-R148 HydrophobicContact CG1-CB 3.88Å; I139-R148 PolarHBondContact N-O 3.1Å; I139-R148 PolarHBondContact O-N 2.79Å; I139-L150 HydrophobicContact CD1-CD2 3.81Å; I139-L150 HydrophobicContact CG1-CD2 4.4Å; I139-L150 HydrophobicContact CG2-CD2 4.19Å
140	A	97.9	Very high	96.7	Very high	20 Å²	20	63.3 Å²	63.3	17%	0.165	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	139.2	175.4	0	0	0	0	0	110.4	H120 E146 K147	H120-A140 HydrophobicContact CB-CB 4.22Å; H120-A140 PolarHBondContact N-O 3.13Å; H120-A140 PolarHBondContact O-N 3.46Å; A140-E146 VanDerWaalsContact CA-O 3.31Å; A140-E146 WeakPolarHBondContact CA-O 3.43Å; A140-K147 HydrophobicContact CB-CG 3.86Å
141	N	98	Very high	97	Very high	9 Å²	9	55 Å²	55	5%	0.048	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123.4	173.3	178.8	-48.6	0	0	0	109.7	W79 R143 T144 M145 E146	W79-N141 HydrophobicContact CD2-CB 3.89Å; W79-N141 VanDerWaalsContact CE2-CB 3.43Å; W79-N141 VanDerWaalsContact CE2-ND2 3.34Å; W79-N141 HydrophobicContact CE3-CB 3.99Å; W79-N141 HydrophobicContact CH2-CB 3.36Å; W79-N141 HydrophobicContact CZ2-CB 3.18Å; W79-N141 HydrophobicContact CZ3-CB 3.75Å; W79-N141 PolarHBondContact NE1-ND2 3.47Å; N141-R143 PolarHBondContact O-N 2.77Å; N141-R143 WeakPolarHBondContact OD1-CA 3.49Å; N141-R143 WeakPolarHBondContact OD1-CB 3.48Å; N141-R143 PolarHBondContact OD1-N 3.3Å; N141-T144 WeakPolarHBondContact CB-OG1 3.43Å; N141-T144 PolarHBondContact OD1-N 2.9Å; N141-T144 VanDerWaalsContact OD1-N 3.09Å; N141-M145 VanDerWaalsContact O-CA 3.23Å; N141-M145 WeakPolarHBondContact O-CA 3.25Å; N141-M145 PolarHBondContact O-N 3.49Å; N141-E146 PolarHBondContact N-O 3.43Å
142	E	96.1	Very high	97.3	Very high	89 Å²	89	52.7 Å²	52.7	42%	0.416	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.4	-175.9	-172.3	171.3	-156.8	0	0	113.3	K115 F118 H120	K115-E142 WeakPolarHBondContact CE-OE2 3.46Å; K115-E142 IonicContact NZ-OE1 2.7Å; K115-E142 PolarHBondContact NZ-OE1 2.81Å; K115-E142 IonicContact NZ-OE2 2.74Å; K115-E142 PolarHBondContact NZ-OE2 3.5Å; F118-E142 HydrophobicContact CB-CB 4.39Å; F118-E142 WeakPolarHBondContact O-CB 3.32Å; F118-E142 PolarHBondContact O-N 2.92Å; H120-E142 IonicContact NE2-OE1 3.94Å; H120-E142 IonicContact NE2-OE2 3.95Å
143	R	95	Very high	97.4	Very high	165 Å²	165	51.6 Å²	51.6	62%	0.623	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-43.4	-174.8	-55.1	-178.3	-172.3	165.8	9.4	112.2	E38 N141	E38-R143 IonicContact OE1-NH1 2.72Å; E38-R143 IonicContact OE2-CZ 3.57Å; E38-R143 IonicContact OE2-NH1 3.05Å; E38-R143 PolarHBondContact OE2-NH1 2.86Å; E38-R143 IonicContact OE2-NH2 2.58Å; N141-R143 PolarHBondContact O-N 2.77Å; N141-R143 WeakPolarHBondContact OD1-CA 3.49Å; N141-R143 WeakPolarHBondContact OD1-CB 3.48Å; N141-R143 PolarHBondContact OD1-N 3.3Å
144	T	96.6	Very high	97.4	Very high	86 Å²	86	51.7 Å²	51.7	53%	0.528	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-14.3	-177.1	62.5	0	0	0	0	113	N141 E146	N141-T144 WeakPolarHBondContact CB-OG1 3.43Å; N141-T144 PolarHBondContact OD1-N 2.9Å; N141-T144 VanDerWaalsContact OD1-N 3.09Å; T144-E146 PolarHBondContact O-N 3.21Å; T144-E146 WeakPolarHBondContact OG1-CB 3.25Å; T144-E146 PolarHBondContact OG1-N 3.18Å
145	M	95.9	Very high	97.4	Very high	138 Å²	138	51.1 Å²	51.1	68%	0.68	24%	0.24	S	C	*	.			trans	58.7	7.2	-171.6	-58.5	-59.5	-64.8	0	0	114.4	N141	N141-M145 VanDerWaalsContact O-CA 3.23Å; N141-M145 WeakPolarHBondContact O-CA 3.25Å; N141-M145 PolarHBondContact O-N 3.49Å
146	E	98	Very high	97.1	Very high	86 Å²	86	53.2 Å²	53.2	40%	0.402	25%	0.25	S	S	.	.			trans	-65.4	143.3	175.2	-169.3	-166	161.5	0	0	109.4	W79 A140 N141 T144 R148	W79-E146 HydrophobicContact CH2-CB 3.85Å; W79-E146 HydrophobicContact CH2-CG 4.17Å; W79-E146 VanDerWaalsContact CH2-O 3.28Å; W79-E146 WeakPolarHBondContact CH2-O 3.23Å; W79-E146 HydrophobicContact CZ2-CB 3.97Å; W79-E146 HydrophobicContact CZ2-CG 4.36Å; W79-E146 WeakPolarHBondContact CZ2-OE2 3.41Å; A140-E146 VanDerWaalsContact CA-O 3.31Å; A140-E146 WeakPolarHBondContact CA-O 3.43Å; N141-E146 PolarHBondContact N-O 3.43Å; T144-E146 PolarHBondContact O-N 3.21Å; T144-E146 WeakPolarHBondContact OG1-CB 3.25Å; T144-E146 PolarHBondContact OG1-N 3.18Å; E146-R148 VanDerWaalsContact CD-NH2 3.32Å; E146-R148 IonicContact OE1-CZ 2.7Å; E146-R148 IonicContact OE1-NE 2.84Å; E146-R148 PolarHBondContact OE1-NE 2.88Å; E146-R148 IonicContact OE1-NH2 3.7Å; E146-R148 PolarHBondContact OE1-NH2 3.06Å; E146-R148 VanDerWaalsContact OE1-NH2 3.13Å; E146-R148 IonicContact OE2-CZ 3.15Å; E146-R148 IonicContact OE2-NE 3.35Å; E146-R148 IonicContact OE2-NH2 2.73Å; E146-R148 PolarHBondContact OE2-NH2 3.28Å
147	K	97.7	Very high	96.7	Very high	134 Å²	134	51.6 Å²	51.6	58%	0.583	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.9	176.5	-62.3	-174.1	179.5	179.6	0	110.6	I139 A140	I139-K147 CarbonylContact O-C 3.58Å; I139-K147 VanDerWaalsContact O-CA 3.27Å; I139-K147 WeakPolarHBondContact O-CA 3.46Å; A140-K147 HydrophobicContact CB-CG 3.86Å
148	R	97	Very high	96.2	Very high	55 Å²	55	51.8 Å²	51.8	21%	0.208	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	156.6	176	-54.9	-179.8	-169.7	157.9	8.5	109.7	W79 N82 E138 I139 E146	W79-R148 HydrophobicContact CH2-CG 4.24Å; W79-R148 HydrophobicContact CZ3-CG 4.35Å; W79-R148 PolarHBondContact O-NH1 2.69Å; N82-R148 WeakPolarHBondContact OD1-CD 3.46Å; N82-R148 PolarHBondContact OD1-NH1 2.91Å; E138-R148 WeakPolarHBondContact CA-O 3.44Å; I139-R148 HydrophobicContact CD1-CB 4.3Å; I139-R148 HydrophobicContact CG1-CB 3.88Å; I139-R148 PolarHBondContact N-O 3.1Å; I139-R148 PolarHBondContact O-N 2.79Å; E146-R148 VanDerWaalsContact CD-NH2 3.32Å; E146-R148 IonicContact OE1-CZ 2.7Å; E146-R148 IonicContact OE1-NE 2.84Å; E146-R148 PolarHBondContact OE1-NE 2.88Å; E146-R148 IonicContact OE1-NH2 3.7Å; E146-R148 PolarHBondContact OE1-NH2 3.06Å; E146-R148 VanDerWaalsContact OE1-NH2 3.13Å; E146-R148 IonicContact OE2-CZ 3.15Å; E146-R148 IonicContact OE2-NE 3.35Å; E146-R148 IonicContact OE2-NH2 2.73Å; E146-R148 PolarHBondContact OE2-NH2 3.28Å
149	K	96.8	Very high	95.2	Very high	138 Å²	138	51.8 Å²	51.8	60%	0.6	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	140.8	169.7	-71.5	-177.7	-178.6	175.7	0	109.1	I136 L137 E138	I136-K149 HydrophobicContact CG2-CD 4.47Å; L137-K149 CarbonylContact O-C 3.49Å; L137-K149 VanDerWaalsContact O-CA 3.29Å; L137-K149 WeakPolarHBondContact O-CA 3.33Å; E138-K149 HydrophobicContact CB-CG 4.43Å
150	L	97.9	Very high	93.8	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.026	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.5	172.8	67.9	92.1	0	0	0	109.9	W75 V78 V83 S84 I86 L137 I139	W75-L150 HydrophobicContact CZ3-CD2 4.33Å; V78-L150 HydrophobicContact CG1-CD2 3.6Å; V83-L150 WeakPolarHBondContact O-CB 3.32Å; S84-L150 WeakPolarHBondContact O-CA 3.37Å; S84-L150 WeakPolarHBondContact O-CB 3.21Å; I86-L150 HydrophobicContact CD1-CD1 3.68Å; I86-L150 HydrophobicContact CG1-CD1 3.96Å; L137-L150 HydrophobicContact CB-CD1 4.15Å; L137-L150 HydrophobicContact CB-CG 4.23Å; L137-L150 HydrophobicContact CD1-CD1 4.15Å; L137-L150 HydrophobicContact CG-CD1 4.44Å; L137-L150 PolarHBondContact N-O 3.4Å; L137-L150 PolarHBondContact O-N 3.37Å; I139-L150 HydrophobicContact CD1-CD2 3.81Å; I139-L150 HydrophobicContact CG1-CD2 4.4Å; I139-L150 HydrophobicContact CG2-CD2 4.19Å
151	T	98.3	Very high	92.3	Very high	16 Å²	16	57.9 Å²	57.9	10%	0.098	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	134.9	175.4	-59	0	0	0	0	109.5	S84 L85 I86 I134 I136 F176 Q180	S84-T151 PolarHBondContact O-N 2.86Å; L85-T151 CarbonylContact C-O 3.53Å; L85-T151 WeakPolarHBondContact CA-O 3.48Å; L85-T151 HydrophobicContact CD1-CG2 3.92Å; L85-T151 WeakPolarHBondContact CD1-O 3.4Å; I86-T151 PolarHBondContact N-O 3.02Å; I134-T151 HydrophobicContact CG2-CG2 3.65Å; I136-T151 HydrophobicContact CD1-CG2 4.28Å; T151-F176 HydrophobicContact CG2-CE1 4.46Å; T151-F176 HydrophobicContact CG2-CZ 4.05Å; T151-Q180 PolarHBondContact OG1-OE1 2.89Å
152	H	98.5	Very high	91.5	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.3	168.1	-179.7	-79.2	0	0	0	108.5	I86 Y103 W104 I134 S135 L137	I86-H152 CarbonylContact O-C 3.57Å; I86-H152 WeakPolarHBondContact O-CA 3.5Å; Y103-H152 AromaticContact CE2-NE2 3.85Å; Y103-H152 AromaticContact CZ-NE2 3.53Å; Y103-H152 PolarHBondContact OH-NE2 2.92Å; W104-H152 AromaticContact CD2-CE1 3.74Å; W104-H152 AromaticContact CD2-NE2 3.65Å; W104-H152 AromaticContact CE2-CE1 3.43Å; W104-H152 VanDerWaalsContact CE2-CE1 3.43Å; W104-H152 AromaticContact CE2-ND1 3.9Å; W104-H152 AromaticContact CE2-NE2 3.86Å; W104-H152 AromaticContact CE3-CE1 3.91Å; W104-H152 AromaticContact CE3-NE2 3.55Å; W104-H152 AromaticContact CH2-CE1 3.59Å; W104-H152 AromaticContact CH2-NE2 3.94Å; W104-H152 AromaticContact CZ2-CE1 3.37Å; W104-H152 WeakPolarHBondContact CZ2-CE1 3.36Å; W104-H152 AromaticContact CZ3-CE1 3.85Å; W104-H152 AromaticContact CZ3-NE2 3.7Å; I134-H152 CarbonylContact C-O 3.53Å; I134-H152 WeakPolarHBondContact CA-O 3.25Å; S135-H152 PolarHBondContact N-O 2.83Å; S135-H152 PolarHBondContact O-N 2.84Å; L137-H152 HydrophobicContact CD1-CB 3.71Å; L137-H152 HydrophobicContact CG-CB 4.05Å
153	Y	98.4	Very high	91.2	Very high	4 Å²	4	62.6 Å²	62.6	2%	0.016	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	110.8	178.4	-168.8	-62.7	0	0	0	108.7	I86 V87 C88 Y132 I134 Y155 L173 F176	I86-Y153 PolarHBondContact O-N 3.23Å; V87-Y153 CarbonylContact C-O 3.55Å; V87-Y153 WeakPolarHBondContact CA-O 3.48Å; C88-Y153 PolarHBondContact N-O 3.1Å; Y132-Y153 VanDerWaalsContact CB-CE1 3.48Å; Y132-Y153 WeakPolarHBondContact CB-OH 3.43Å; Y132-Y153 AromaticContact CD1-CZ 3.99Å; Y132-Y153 WeakPolarHBondContact CD1-OH 3.31Å; Y132-Y153 HydrophobicContact CG-CE1 4.21Å; Y132-Y153 HydrophobicContact CG-CE2 4.31Å; Y132-Y153 AromaticContact CG-CZ 3.72Å; I134-Y153 HydrophobicContact CD1-CD2 3.8Å; I134-Y153 HydrophobicContact CD1-CE2 3.77Å; I134-Y153 HydrophobicContact CG1-CD2 3.59Å; I134-Y153 HydrophobicContact CG1-CE2 3.9Å; I134-Y153 HydrophobicContact CG1-CG 4.21Å; Y153-Y155 AromaticContact CE1-CD2 3.91Å; Y153-Y155 HydrophobicContact CE1-CD2 3.91Å; Y153-Y155 HydrophobicContact CE1-CG 4.43Å; Y153-L173 HydrophobicContact CD1-CD1 3.74Å; Y153-L173 HydrophobicContact CD2-CD1 4.07Å; Y153-L173 HydrophobicContact CE1-CD1 3.67Å; Y153-L173 HydrophobicContact CE2-CD1 3.95Å; Y153-L173 HydrophobicContact CG-CD1 3.97Å; Y153-F176 AromaticContact CD2-CD1 3.58Å; Y153-F176 HydrophobicContact CD2-CD1 3.58Å; Y153-F176 AromaticContact CD2-CE1 3.59Å; Y153-F176 HydrophobicContact CD2-CE1 3.59Å; Y153-F176 HydrophobicContact CD2-CG 4.13Å; Y153-F176 HydrophobicContact CD2-CZ 4.12Å; Y153-F176 HydrophobicContact CE2-CB 4.45Å; Y153-F176 AromaticContact CE2-CD1 3.88Å; Y153-F176 HydrophobicContact CE2-CD1 3.88Å; Y153-F176 HydrophobicContact CE2-CD2 4.42Å; Y153-F176 HydrophobicContact CE2-CE1 4.28Å; Y153-F176 AromaticContact CE2-CG 3.98Å; Y153-F176 HydrophobicContact CE2-CG 3.98Å
154	L	97.5	Very high	90.9	Very high	22 Å²	22	55 Å²	55	12%	0.115	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	109.3	170.8	175	61	0	0	0	109.7	C88 T90 W104 Y132 S133 L156	C88-L154 HydrophobicContact CB-CD1 3.89Å; C88-L154 VanDerWaalsContact SG-CD1 3.53Å; T90-L154 WeakPolarHBondContact O-CD1 3.43Å; W104-L154 HydrophobicContact CH2-CD2 4.39Å; W104-L154 HydrophobicContact CZ2-CD2 4.17Å; Y132-L154 CarbonylContact C-O 3.52Å; Y132-L154 WeakPolarHBondContact CA-O 3.45Å; Y132-L154 WeakPolarHBondContact CB-O 3.27Å; S133-L154 PolarHBondContact N-O 2.98Å; S133-L154 PolarHBondContact O-N 3.27Å; L154-L156 HydrophobicContact CD1-CD2 4.29Å; L154-L156 HydrophobicContact CD2-CD2 3.77Å; L154-L156 HydrophobicContact CG-CD2 3.69Å; L154-L156 HydrophobicContact CG-CG 4.3Å
155	Y	96.6	Very high	90.5	Very high	3 Å²	3	56.6 Å²	56.6	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.8	173.6	-168.8	-95.8	0	0	0	110.5	C88 L89 Y153 D157 W158 F170 L173	C88-Y155 PolarHBondContact O-N 3.46Å; L89-Y155 HydrophobicContact CD2-CG 4.31Å; Y153-Y155 AromaticContact CE1-CD2 3.91Å; Y153-Y155 HydrophobicContact CE1-CD2 3.91Å; Y153-Y155 HydrophobicContact CE1-CG 4.43Å; Y155-D157 HydrophobicContact CE1-CB 3.82Å; Y155-W158 HydrophobicContact CD1-CB 3.89Å; Y155-W158 HydrophobicContact CE1-CB 3.79Å; Y155-F170 HydrophobicContact CE1-CD2 4.13Å; Y155-F170 HydrophobicContact CE2-CD2 4.38Å; Y155-F170 AromaticContact CZ-CD2 3.97Å; Y155-F170 PolarHBondContact OH-N 3.31Å; Y155-L173 HydrophobicContact CD2-CB 4.16Å; Y155-L173 HydrophobicContact CD2-CD2 3.84Å; Y155-L173 HydrophobicContact CE2-CB 4.28Å; Y155-L173 HydrophobicContact CE2-CD2 4.46Å; Y155-L173 HydrophobicContact CG-CD2 4.11Å
156	L	92.4	Very high	90.3	Very high	46 Å²	46	52 Å²	52	24%	0.241	25%	0.247	C	C	.	.			trans	-108.5	-10.7	-171	-60.1	172.4	0	0	0	113.7	K91 Q131 L154	K91-L156 WeakPolarHBondContact CE-O 3.23Å; K91-L156 HydrophobicContact CG-CD2 4Å; K91-L156 PolarHBondContact NZ-O 2.7Å; Q131-L156 WeakPolarHBondContact O-CA 3.4Å; Q131-L156 WeakPolarHBondContact O-CB 3.42Å; Q131-L156 PolarHBondContact O-N 2.9Å; L154-L156 HydrophobicContact CD1-CD2 4.29Å; L154-L156 HydrophobicContact CD2-CD2 3.77Å; L154-L156 HydrophobicContact CG-CD2 3.69Å; L154-L156 HydrophobicContact CG-CG 4.3Å
157	D	88.5	Confident	90.1	Very high	28 Å²	28	48.9 Å²	48.9	15%	0.15	23%	0.234	C	C	.	.	S	Bend	trans	-102.8	30.5	-170.6	-161.5	34.1	0	0	0	113.6	Q131 Y155 I165 C166 N169	Q131-D157 HydrophobicContact CB-CB 4.23Å; Q131-D157 HydrophobicContact CG-CB 4.5Å; Y155-D157 HydrophobicContact CE1-CB 3.82Å; D157-I165 PolarHBondContact O-N 3.21Å; D157-C166 WeakPolarHBondContact OD2-CB 3.48Å; D157-N169 PolarHBondContact OD2-ND2 2.84Å
158	W	87.9	Confident	89.9	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.015	23%	0.227	C	C	.	.			trans	-130.8	103.1	174.1	-163.1	-18.1	0	0	0	110.9	L89 Y155 R162 P164 F170 R202 T205	L89-W158 HydrophobicContact CD1-CZ3 4.32Å; Y155-W158 HydrophobicContact CD1-CB 3.89Å; Y155-W158 HydrophobicContact CE1-CB 3.79Å; W158-R162 PolarHBondContact NE1-O 3.19Å; W158-P164 HydrophobicContact CD2-CG 3.69Å; W158-P164 HydrophobicContact CE3-CG 3.84Å; W158-P164 HydrophobicContact CG-CG 4.2Å; W158-P164 HydrophobicContact CH2-CG 4.05Å; W158-P164 HydrophobicContact CZ2-CG 3.99Å; W158-P164 HydrophobicContact CZ3-CG 4.05Å; W158-F170 HydrophobicContact CE3-CD2 4.08Å; W158-F170 AromaticContact CE3-CE2 3.5Å; W158-F170 HydrophobicContact CE3-CE2 3.5Å; W158-F170 VanDerWaalsContact CE3-CE2 3.5Å; W158-F170 HydrophobicContact CE3-CZ 4.03Å; W158-F170 HydrophobicContact CH2-CE1 4.44Å; W158-F170 HydrophobicContact CH2-CE2 4.17Å; W158-F170 AromaticContact CH2-CZ 3.84Å; W158-F170 HydrophobicContact CH2-CZ 3.84Å; W158-F170 HydrophobicContact CZ3-CD2 4.09Å; W158-F170 HydrophobicContact CZ3-CE1 4.17Å; W158-F170 AromaticContact CZ3-CE2 3.18Å; W158-F170 HydrophobicContact CZ3-CE2 3.18Å; W158-F170 AromaticContact CZ3-CZ 3.23Å; W158-F170 HydrophobicContact CZ3-CZ 3.23Å; W158-R202 HydrophobicContact CD2-CB 4.03Å; W158-R202 HydrophobicContact CD2-CG 3.77Å; W158-R202 HydrophobicContact CE3-CB 3.84Å; W158-R202 HydrophobicContact CE3-CG 4.12Å; W158-R202 HydrophobicContact CG-CG 4.27Å; W158-R202 HydrophobicContact CH2-CB 3.87Å; W158-R202 HydrophobicContact CH2-CG 4.31Å; W158-R202 HydrophobicContact CZ2-CB 4Å; W158-R202 HydrophobicContact CZ2-CG 3.92Å; W158-R202 HydrophobicContact CZ3-CB 3.72Å; W158-R202 HydrophobicContact CZ3-CG 4.34Å; W158-R202 PolarHBondContact O-NH1 2.8Å; W158-T205 HydrophobicContact CH2-CG2 3.72Å; W158-T205 HydrophobicContact CZ2-CG2 4.28Å
159	P	76.4	Confident	89.8	Confident	37 Å²	37	45.4 Å²	45.4	24%	0.24	22%	0.223	C	C	.	.			trans	-78.3	158.8	177.8	30.6	-34.1	0	0	0	112.5	R162 I165	P159-R162 HydrophobicContact CG-CB 4.31Å; P159-I165 HydrophobicContact CG-CD1 4.02Å; P159-I165 HydrophobicContact CG-CG1 3.9Å
160	D	68.8	Low	89.8	Confident	20 Å²	20	38.9 Å²	38.9	11%	0.107	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	145.3	-178.6	-146.2	10.6	0	0	0	116.3	E94 R95 K99 R162 R202	E94-D160 VanDerWaalsContact OE2-CB 3.28Å; E94-D160 WeakPolarHBondContact OE2-CB 3.37Å; R95-D160 PolarHBondContact NH2-O 2.91Å; K99-D160 WeakPolarHBondContact CE-OD2 3.49Å; K99-D160 IonicContact NZ-OD2 3.7Å; K99-D160 PolarHBondContact NZ-OD2 3.48Å; D160-R162 PolarHBondContact O-N 2.88Å; D160-R202 IonicContact OD1-CZ 2.77Å; D160-R202 IonicContact OD1-NE 3.26Å; D160-R202 IonicContact OD1-NH2 3.97Å; D160-R202 PolarHBondContact OD1-NH2 3.24Å
161	H	65.1	Low	89.7	Confident	130 Å²	130	38.6 Å²	38.6	60%	0.602	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	33.3	178.9	-55.7	-73.6	0	0	0	113.9
162	R	83	Confident	89.6	Confident	152 Å²	152	41.1 Å²	41.1	57%	0.574	20%	0.203	S	C	*	.	S	Bend	trans	-137.9	-166.3	175.3	-64.4	-168.6	-176.7	-172.3	2.5	110.2	W158 P159 D160	W158-R162 PolarHBondContact NE1-O 3.19Å; P159-R162 HydrophobicContact CG-CB 4.31Å; D160-R162 PolarHBondContact O-N 2.88Å
163	V	88.8	Confident	89.6	Confident	44 Å²	44	41 Å²	41	27%	0.267	20%	0.203	S	C	.	.			trans	-101.9	166.5	169.8	-59.3	0	0	0	0	109.6	E243 F247	V163-E243 HydrophobicContact CG1-CB 3.86Å; V163-E243 VanDerWaalsContact CG1-O 3.22Å; V163-E243 WeakPolarHBondContact CG1-O 3.44Å; V163-F247 HydrophobicContact CB-CB 4.06Å; V163-F247 HydrophobicContact CB-CD2 3.85Å; V163-F247 HydrophobicContact CB-CG 3.94Å; V163-F247 HydrophobicContact CG1-CB 3.57Å; V163-F247 HydrophobicContact CG1-CD2 4.31Å; V163-F247 HydrophobicContact CG1-CG 4.02Å; V163-F247 HydrophobicContact CG2-CD2 4.31Å
164	P	88.7	Confident	89.5	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.032	20%	0.202	C	C	.	.			trans	-53.1	140.3	173.5	-26	36.3	0	0	0	111.6	W158 C166 F170 F247	W158-P164 HydrophobicContact CD2-CG 3.69Å; W158-P164 HydrophobicContact CE3-CG 3.84Å; W158-P164 HydrophobicContact CG-CG 4.2Å; W158-P164 HydrophobicContact CH2-CG 4.05Å; W158-P164 HydrophobicContact CZ2-CG 3.99Å; W158-P164 HydrophobicContact CZ3-CG 4.05Å; P164-C166 VanDerWaalsContact C-N 3.35Å; P164-F170 HydrophobicContact CB-CB 3.83Å; P164-F170 HydrophobicContact CB-CD2 4.26Å; P164-F170 HydrophobicContact CB-CG 4Å; P164-F170 HydrophobicContact CG-CB 3.96Å; P164-F170 HydrophobicContact CG-CD1 3.88Å; P164-F170 HydrophobicContact CG-CD2 3.74Å; P164-F170 HydrophobicContact CG-CE1 4.31Å; P164-F170 HydrophobicContact CG-CE2 4.22Å; P164-F170 HydrophobicContact CG-CG 3.56Å; P164-F170 HydrophobicContact CG-CZ 4.47Å; P164-F247 HydrophobicContact CB-CE2 4.39Å; P164-F247 HydrophobicContact CB-CZ 4.01Å; P164-F247 VanDerWaalsContact CD-CZ 3.47Å; P164-F247 HydrophobicContact CG-CD1 4.45Å; P164-F247 HydrophobicContact CG-CE1 3.65Å; P164-F247 HydrophobicContact CG-CE2 4.12Å; P164-F247 HydrophobicContact CG-CZ 3.46Å; P164-F247 VanDerWaalsContact CG-CZ 3.46Å
165	I	87.5	Confident	89.5	Confident	121 Å²	121	43.4 Å²	43.4	62%	0.621	21%	0.214	S	C	*	.	S	Bend	trans	-66.4	-42.9	-178.2	-65.1	170	0	0	0	110.1	D157 P159	D157-I165 PolarHBondContact O-N 3.21Å; P159-I165 HydrophobicContact CG-CD1 4.02Å; P159-I165 HydrophobicContact CG-CG1 3.9Å
166	C	91.9	Very high	89.5	Confident	41 Å²	41	45.5 Å²	45.5	28%	0.277	22%	0.223	S	C	.	.			trans	-120.2	114.2	178	-178.8	0	0	0	0	109.9	D157 P164 H168 N169 F170	D157-C166 WeakPolarHBondContact OD2-CB 3.48Å; P164-C166 VanDerWaalsContact C-N 3.35Å; C166-H168 VanDerWaalsContact C-N 3.29Å; C166-H168 PolarHBondContact O-N 3.21Å; C166-N169 HydrophobicContact CB-CB 4.01Å; C166-N169 WeakPolarHBondContact CB-ND2 3.24Å; C166-N169 PolarHBondContact O-N 3.33Å; C166-N169 VanDerWaalsContact SG-CG 3.52Å; C166-F170 PolarHBondContact O-N 3.4Å
167	T	93.9	Very high	89.7	Confident	20 Å²	20	43.5 Å²	43.5	12%	0.123	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-36	178.2	-51	0	0	0	0	112.3	F170 L171 F247 Y250 A251 V254	T167-F170 PolarHBondContact O-N 3.46Å; T167-L171 HydrophobicContact CG2-CD1 4.33Å; T167-L171 HydrophobicContact CG2-CG 4.49Å; T167-L171 WeakPolarHBondContact O-CG 3.47Å; T167-L171 PolarHBondContact O-N 3.3Å; T167-F247 HydrophobicContact CG2-CE2 4.05Å; T167-F247 HydrophobicContact CG2-CZ 4.18Å; T167-Y250 HydrophobicContact CG2-CD1 4.01Å; T167-Y250 HydrophobicContact CG2-CE1 4Å; T167-Y250 WeakPolarHBondContact OG1-CE1 3.38Å; T167-A251 HydrophobicContact CG2-CB 3.92Å; T167-V254 HydrophobicContact CG2-CB 4.34Å; T167-V254 HydrophobicContact CG2-CG2 4.27Å
168	H	94.1	Very high	90.1	Very high	93 Å²	93	44.2 Å²	44.2	43%	0.431	22%	0.216	S	C	.	.	H	α-helix	trans	-62.7	-44.8	176.8	-177.3	69	0	0	0	111.9	C166 F170 L171 Q172	C166-H168 VanDerWaalsContact C-N 3.29Å; C166-H168 PolarHBondContact O-N 3.21Å; H168-F170 PolarHBondContact O-N 3.44Å; H168-L171 PolarHBondContact O-N 3.44Å; H168-Q172 PolarHBondContact CD2-NE2 3.18Å; H168-Q172 VanDerWaalsContact CD2-NE2 3.28Å; H168-Q172 PolarHBondContact NE2-NE2 3.24Å; H168-Q172 WeakPolarHBondContact O-CG 3.42Å; H168-Q172 PolarHBondContact O-N 3.45Å
169	N	94.3	Very high	90.5	Very high	24 Å²	24	46 Å²	46	13%	0.128	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-35.2	176.2	-62.3	-17.6	0	0	0	111.6	Q131 D157 C166 Q172 L173	Q131-N169 HydrophobicContact CG-CB 4.16Å; Q131-N169 VanDerWaalsContact CG-ND2 3.26Å; Q131-N169 WeakPolarHBondContact CG-ND2 3.31Å; D157-N169 PolarHBondContact OD2-ND2 2.84Å; C166-N169 HydrophobicContact CB-CB 4.01Å; C166-N169 WeakPolarHBondContact CB-ND2 3.24Å; C166-N169 PolarHBondContact O-N 3.33Å; C166-N169 VanDerWaalsContact SG-CG 3.52Å; N169-Q172 WeakPolarHBondContact O-CB 3.4Å; N169-Q172 PolarHBondContact O-N 3.11Å; N169-L173 PolarHBondContact O-N 3.28Å
170	F	96.5	Very high	91.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-72.9	-37.3	177.7	-167.2	-113.1	0	0	0	112.6	Y155 W158 P164 C166 T167 H168 Q172 L173 A174 L206 L209 F247	Y155-F170 HydrophobicContact CE1-CD2 4.13Å; Y155-F170 HydrophobicContact CE2-CD2 4.38Å; Y155-F170 AromaticContact CZ-CD2 3.97Å; Y155-F170 PolarHBondContact OH-N 3.31Å; W158-F170 HydrophobicContact CE3-CD2 4.08Å; W158-F170 AromaticContact CE3-CE2 3.5Å; W158-F170 HydrophobicContact CE3-CE2 3.5Å; W158-F170 VanDerWaalsContact CE3-CE2 3.5Å; W158-F170 HydrophobicContact CE3-CZ 4.03Å; W158-F170 HydrophobicContact CH2-CE1 4.44Å; W158-F170 HydrophobicContact CH2-CE2 4.17Å; W158-F170 AromaticContact CH2-CZ 3.84Å; W158-F170 HydrophobicContact CH2-CZ 3.84Å; W158-F170 HydrophobicContact CZ3-CD2 4.09Å; W158-F170 HydrophobicContact CZ3-CE1 4.17Å; W158-F170 AromaticContact CZ3-CE2 3.18Å; W158-F170 HydrophobicContact CZ3-CE2 3.18Å; W158-F170 AromaticContact CZ3-CZ 3.23Å; W158-F170 HydrophobicContact CZ3-CZ 3.23Å; P164-F170 HydrophobicContact CB-CB 3.83Å; P164-F170 HydrophobicContact CB-CD2 4.26Å; P164-F170 HydrophobicContact CB-CG 4Å; P164-F170 HydrophobicContact CG-CB 3.96Å; P164-F170 HydrophobicContact CG-CD1 3.88Å; P164-F170 HydrophobicContact CG-CD2 3.74Å; P164-F170 HydrophobicContact CG-CE1 4.31Å; P164-F170 HydrophobicContact CG-CE2 4.22Å; P164-F170 HydrophobicContact CG-CG 3.56Å; P164-F170 HydrophobicContact CG-CZ 4.47Å; C166-F170 PolarHBondContact O-N 3.4Å; T167-F170 PolarHBondContact O-N 3.46Å; H168-F170 PolarHBondContact O-N 3.44Å; F170-Q172 VanDerWaalsContact C-N 3.33Å; F170-L173 HydrophobicContact CD2-CD2 4.3Å; F170-L173 HydrophobicContact CE2-CD2 4.03Å; F170-L173 WeakPolarHBondContact O-CB 3.44Å; F170-L173 PolarHBondContact O-N 3.31Å; F170-A174 PolarHBondContact O-N 3Å; F170-L206 HydrophobicContact CE1-CD1 4.23Å; F170-L206 HydrophobicContact CE2-CD1 4.08Å; F170-L206 HydrophobicContact CZ-CB 3.88Å; F170-L206 HydrophobicContact CZ-CD1 3.61Å; F170-L206 HydrophobicContact CZ-CG 4.29Å; F170-L209 HydrophobicContact CD1-CD2 3.7Å; F170-L209 HydrophobicContact CE1-CD2 3.49Å; F170-L209 VanDerWaalsContact CE1-CD2 3.49Å; F170-F247 HydrophobicContact CB-CZ 4.5Å; F170-F247 AromaticContact CD1-CE1 3.59Å; F170-F247 HydrophobicContact CD1-CE1 3.59Å; F170-F247 AromaticContact CD1-CZ 3.74Å; F170-F247 HydrophobicContact CD1-CZ 3.74Å; F170-F247 AromaticContact CE1-CE1 3.76Å; F170-F247 HydrophobicContact CE1-CE1 3.76Å; F170-F247 HydrophobicContact CE1-CZ 4.38Å; F170-F247 HydrophobicContact CG-CE1 4.49Å; F170-F247 HydrophobicContact CG-CZ 4.36Å
171	L	97	Very high	92.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-37.7	171.5	-71.6	173	0	0	0	111.5	T167 H168 L173 A174 E175 L209 M213 V254 H255	T167-L171 HydrophobicContact CG2-CD1 4.33Å; T167-L171 HydrophobicContact CG2-CG 4.49Å; T167-L171 WeakPolarHBondContact O-CG 3.47Å; T167-L171 PolarHBondContact O-N 3.3Å; H168-L171 PolarHBondContact O-N 3.44Å; L171-L173 PolarHBondContact O-N 3.43Å; L171-A174 WeakPolarHBondContact O-CA 3.4Å; L171-A174 WeakPolarHBondContact O-CB 3.48Å; L171-A174 PolarHBondContact O-N 3.45Å; L171-E175 WeakPolarHBondContact O-CG 3.4Å; L171-E175 PolarHBondContact O-N 3.19Å; L171-L209 HydrophobicContact CD2-CD2 4.21Å; L171-M213 HydrophobicContact CD2-CE 4.38Å; L171-M213 HydrophobicContact CD2-SD 3.85Å; L171-V254 HydrophobicContact CD1-CB 4.08Å; L171-V254 HydrophobicContact CD1-CG1 3.6Å; L171-H255 HydrophobicContact CD1-CB 4.45Å; L171-H255 HydrophobicContact CD2-CB 4.11Å
172	Q	96.4	Very high	94	Very high	68 Å²	68	46.9 Å²	46.9	32%	0.318	24%	0.242	S	C	.	.	H	α-helix	trans	-60	-32.6	172.6	-71.7	178.5	4.5	0	0	113	H168 N169 F170 F176	H168-Q172 PolarHBondContact CD2-NE2 3.18Å; H168-Q172 VanDerWaalsContact CD2-NE2 3.28Å; H168-Q172 PolarHBondContact NE2-NE2 3.24Å; H168-Q172 WeakPolarHBondContact O-CG 3.42Å; H168-Q172 PolarHBondContact O-N 3.45Å; N169-Q172 WeakPolarHBondContact O-CB 3.4Å; N169-Q172 PolarHBondContact O-N 3.11Å; F170-Q172 VanDerWaalsContact C-N 3.33Å; Q172-F176 VanDerWaalsContact O-CB 3.25Å; Q172-F176 WeakPolarHBondContact O-CB 3.19Å; Q172-F176 PolarHBondContact O-N 2.93Å
173	L	97.7	Very high	94.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.7	-43.6	171.3	166	62.9	0	0	0	111.1	V87 L89 Y153 Y155 N169 F170 L171 F176 M177 L206	V87-L173 HydrophobicContact CG1-CD1 4.07Å; V87-L173 HydrophobicContact CG1-CD2 4.11Å; L89-L173 HydrophobicContact CD2-CD2 3.72Å; Y153-L173 HydrophobicContact CD1-CD1 3.74Å; Y153-L173 HydrophobicContact CD2-CD1 4.07Å; Y153-L173 HydrophobicContact CE1-CD1 3.67Å; Y153-L173 HydrophobicContact CE2-CD1 3.95Å; Y153-L173 HydrophobicContact CG-CD1 3.97Å; Y155-L173 HydrophobicContact CD2-CB 4.16Å; Y155-L173 HydrophobicContact CD2-CD2 3.84Å; Y155-L173 HydrophobicContact CE2-CB 4.28Å; Y155-L173 HydrophobicContact CE2-CD2 4.46Å; Y155-L173 HydrophobicContact CG-CD2 4.11Å; N169-L173 PolarHBondContact O-N 3.28Å; F170-L173 HydrophobicContact CD2-CD2 4.3Å; F170-L173 HydrophobicContact CE2-CD2 4.03Å; F170-L173 WeakPolarHBondContact O-CB 3.44Å; F170-L173 PolarHBondContact O-N 3.31Å; L171-L173 PolarHBondContact O-N 3.43Å; L173-F176 WeakPolarHBondContact O-CB 3.14Å; L173-F176 PolarHBondContact O-N 3.26Å; L173-M177 HydrophobicContact CD1-CG 4.24Å; L173-M177 HydrophobicContact CD1-SD 4.27Å; L173-M177 HydrophobicContact CG-SD 4.37Å; L173-M177 WeakPolarHBondContact O-CG 3.38Å; L173-M177 PolarHBondContact O-N 3.16Å; L173-L206 HydrophobicContact CD2-CD1 4.22Å; L173-L206 HydrophobicContact CD2-CD2 3.93Å; L173-L206 HydrophobicContact CG-CD1 4.37Å; L173-L206 HydrophobicContact CG-CD2 4.46Å
174	A	97.1	Very high	94.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-45.7	177.2	0	0	0	0	0	111.5	F170 L171 F176 M177 D178 Q210 M213	F170-A174 PolarHBondContact O-N 3Å; L171-A174 WeakPolarHBondContact O-CA 3.4Å; L171-A174 WeakPolarHBondContact O-CB 3.48Å; L171-A174 PolarHBondContact O-N 3.45Å; A174-F176 VanDerWaalsContact C-N 3.33Å; A174-F176 PolarHBondContact O-N 3.27Å; A174-M177 WeakPolarHBondContact O-CB 3.26Å; A174-M177 PolarHBondContact O-N 3.12Å; A174-D178 PolarHBondContact O-N 3.02Å; A174-Q210 PolarHBondContact O-NE2 3.45Å; A174-M213 HydrophobicContact CB-CE 3.8Å; A174-M213 HydrophobicContact CB-SD 3.75Å
175	E	95.9	Very high	94.9	Very high	75 Å²	75	52.7 Å²	52.7	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-61.6	-38.8	174.8	-69.1	166.5	-174.5	0	0	112.2	L171 M177 D178 A179	L171-E175 WeakPolarHBondContact O-CG 3.4Å; L171-E175 PolarHBondContact O-N 3.19Å; E175-M177 PolarHBondContact O-N 2.88Å; E175-D178 PolarHBondContact O-N 3.31Å; E175-A179 WeakPolarHBondContact O-CB 3.46Å; E175-A179 PolarHBondContact O-N 3.38Å
176	F	97.5	Very high	95	Very high	48 Å²	48	48.7 Å²	48.7	21%	0.211	27%	0.272	C	S	.	.	H	α-helix	trans	-60.4	-45.2	174.1	172.6	-90.2	0	0	0	111.7	L85 I134 T151 Y153 Q172 L173 A174 D178 A179 Q180	L85-F176 HydrophobicContact CD1-CE1 4.09Å; L85-F176 HydrophobicContact CD2-CE1 4.44Å; I134-F176 HydrophobicContact CD1-CD2 4.47Å; I134-F176 HydrophobicContact CD1-CE2 3.98Å; I134-F176 HydrophobicContact CD1-CZ 4.27Å; T151-F176 HydrophobicContact CG2-CE1 4.46Å; T151-F176 HydrophobicContact CG2-CZ 4.05Å; Y153-F176 AromaticContact CD2-CD1 3.58Å; Y153-F176 HydrophobicContact CD2-CD1 3.58Å; Y153-F176 AromaticContact CD2-CE1 3.59Å; Y153-F176 HydrophobicContact CD2-CE1 3.59Å; Y153-F176 HydrophobicContact CD2-CG 4.13Å; Y153-F176 HydrophobicContact CD2-CZ 4.12Å; Y153-F176 HydrophobicContact CE2-CB 4.45Å; Y153-F176 AromaticContact CE2-CD1 3.88Å; Y153-F176 HydrophobicContact CE2-CD1 3.88Å; Y153-F176 HydrophobicContact CE2-CD2 4.42Å; Y153-F176 HydrophobicContact CE2-CE1 4.28Å; Y153-F176 AromaticContact CE2-CG 3.98Å; Y153-F176 HydrophobicContact CE2-CG 3.98Å; Q172-F176 VanDerWaalsContact O-CB 3.25Å; Q172-F176 WeakPolarHBondContact O-CB 3.19Å; Q172-F176 PolarHBondContact O-N 2.93Å; L173-F176 WeakPolarHBondContact O-CB 3.14Å; L173-F176 PolarHBondContact O-N 3.26Å; A174-F176 VanDerWaalsContact C-N 3.33Å; A174-F176 PolarHBondContact O-N 3.27Å; F176-D178 VanDerWaalsContact C-N 3.35Å; F176-A179 PolarHBondContact O-N 3.15Å; F176-Q180 HydrophobicContact CD1-CG 4.18Å; F176-Q180 HydrophobicContact CE1-CG 3.62Å; F176-Q180 HydrophobicContact CE2-CG 4.38Å; F176-Q180 HydrophobicContact CZ-CG 3.73Å; F176-Q180 WeakPolarHBondContact O-CG 3.34Å; F176-Q180 PolarHBondContact O-N 2.94Å
177	M	97.4	Very high	94.7	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.02	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-39.7	177.8	-68.4	168.2	69.8	0	0	111.7	Y60 L85 V87 L173 A174 E175 Q180 L181 V192 V194 L206 Q210	Y60-M177 HydrophobicContact CE1-CE 3.65Å; L85-M177 HydrophobicContact CD2-CB 4.46Å; L85-M177 HydrophobicContact CD2-CG 3.91Å; V87-M177 HydrophobicContact CG2-CE 4.44Å; V87-M177 HydrophobicContact CG2-CG 4.36Å; V87-M177 HydrophobicContact CG2-SD 4.24Å; L173-M177 HydrophobicContact CD1-CG 4.24Å; L173-M177 HydrophobicContact CD1-SD 4.27Å; L173-M177 HydrophobicContact CG-SD 4.37Å; L173-M177 WeakPolarHBondContact O-CG 3.38Å; L173-M177 PolarHBondContact O-N 3.16Å; A174-M177 WeakPolarHBondContact O-CB 3.26Å; A174-M177 PolarHBondContact O-N 3.12Å; E175-M177 PolarHBondContact O-N 2.88Å; M177-Q180 PolarHBondContact O-N 2.66Å; M177-L181 PolarHBondContact O-N 2.81Å; M177-V192 HydrophobicContact CE-CG1 4.18Å; M177-V194 HydrophobicContact CE-CG2 4.48Å; M177-L206 HydrophobicContact CE-CD2 4.31Å; M177-L206 HydrophobicContact SD-CD1 4.03Å; M177-L206 HydrophobicContact SD-CD2 3.76Å; M177-L206 HydrophobicContact SD-CG 4.09Å; M177-Q210 VanDerWaalsContact CB-NE2 3.25Å; M177-Q210 HydrophobicContact CE-CG 4.19Å; M177-Q210 HydrophobicContact SD-CG 4.44Å; M177-Q210 PolarHBondContact SD-NE2 3.48Å
178	D	95.5	Very high	94.6	Very high	42 Å²	42	61.3 Å²	61.3	23%	0.225	33%	0.326	C	S	.	.	H	α-helix	trans	-64.4	-41.1	174.9	-73.7	-19.9	0	0	0	111.3	H56 A174 E175 F176 Q180 L181 V182 Q210	H56-D178 IonicContact CE1-OD1 2.96Å; H56-D178 IonicContact NE2-OD1 2.71Å; H56-D178 PolarHBondContact NE2-OD1 3.37Å; A174-D178 PolarHBondContact O-N 3.02Å; E175-D178 PolarHBondContact O-N 3.31Å; F176-D178 VanDerWaalsContact C-N 3.35Å; D178-Q180 VanDerWaalsContact C-N 3.34Å; D178-Q180 PolarHBondContact O-N 3.08Å; D178-L181 WeakPolarHBondContact O-CB 3.32Å; D178-L181 PolarHBondContact O-N 2.7Å; D178-L181 VanDerWaalsContact O-N 3.16Å; D178-V182 WeakPolarHBondContact O-CG2 3.44Å; D178-V182 PolarHBondContact O-N 2.89Å; D178-Q210 PolarHBondContact OD1-OE1 3.24Å
179	A	96.4	Very high	94.5	Very high	43 Å²	43	60.9 Å²	60.9	36%	0.355	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-38.8	174.5	0	0	0	0	0	112.3	E175 F176 L181 V182 Q183	E175-A179 WeakPolarHBondContact O-CB 3.46Å; E175-A179 PolarHBondContact O-N 3.38Å; F176-A179 PolarHBondContact O-N 3.15Å; A179-L181 VanDerWaalsContact C-N 3.34Å; A179-V182 PolarHBondContact O-N 2.87Å; A179-Q183 VanDerWaalsContact O-CG 3.31Å; A179-Q183 WeakPolarHBondContact O-CG 3.48Å; A179-Q183 PolarHBondContact O-N 3.15Å; A179-Q183 VanDerWaalsContact O-N 3.14Å
180	Q	96.4	Very high	94.6	Very high	42 Å²	42	60 Å²	60	20%	0.196	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-41.2	172.8	-68.3	-62.3	-85.8	0	0	111.6	L85 T151 F176 M177 D178 Q183 Y184 M190	L85-Q180 HydrophobicContact CD2-CG 4.45Å; T151-Q180 PolarHBondContact OG1-OE1 2.89Å; F176-Q180 HydrophobicContact CD1-CG 4.18Å; F176-Q180 HydrophobicContact CE1-CG 3.62Å; F176-Q180 HydrophobicContact CE2-CG 4.38Å; F176-Q180 HydrophobicContact CZ-CG 3.73Å; F176-Q180 WeakPolarHBondContact O-CG 3.34Å; F176-Q180 PolarHBondContact O-N 2.94Å; M177-Q180 PolarHBondContact O-N 2.66Å; D178-Q180 VanDerWaalsContact C-N 3.34Å; D178-Q180 PolarHBondContact O-N 3.08Å; Q180-Q183 PolarHBondContact O-N 3.35Å; Q180-Y184 PolarHBondContact O-N 3.21Å; Q180-M190 HydrophobicContact CB-CE 4.18Å; Q180-M190 HydrophobicContact CB-SD 4.37Å
181	L	94.3	Very high	94.6	Very high	35 Å²	35	60.1 Å²	60.1	18%	0.183	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-41.5	177.5	179.4	59.5	0	0	0	112.1	H56 K57 C58 M177 D178 A179 Q183 Y184 M190	H56-L181 WeakPolarHBondContact CE1-CD2 3.38Å; K57-L181 HydrophobicContact CB-CD2 4.26Å; C58-L181 HydrophobicContact CB-CD1 4.02Å; C58-L181 HydrophobicContact CB-CD2 4.34Å; M177-L181 PolarHBondContact O-N 2.81Å; D178-L181 WeakPolarHBondContact O-CB 3.32Å; D178-L181 PolarHBondContact O-N 2.7Å; D178-L181 VanDerWaalsContact O-N 3.16Å; A179-L181 VanDerWaalsContact C-N 3.34Å; L181-Q183 VanDerWaalsContact C-N 3.29Å; L181-Q183 PolarHBondContact O-N 2.87Å; L181-Y184 WeakPolarHBondContact O-CB 3.46Å; L181-Y184 PolarHBondContact O-N 2.83Å; L181-M190 HydrophobicContact CB-CE 4.06Å; L181-M190 HydrophobicContact CD1-CB 3.91Å; L181-M190 HydrophobicContact CD1-CE 4.47Å
182	V	93.9	Very high	94.7	Very high	127 Å²	127	60.2 Å²	60.2	77%	0.77	33%	0.328	S	S	*	.	H	α-helix	trans	-63.9	-35.1	176.6	170.7	0	0	0	0	111.9	D178 A179 Y184	D178-V182 WeakPolarHBondContact O-CG2 3.44Å; D178-V182 PolarHBondContact O-N 2.89Å; A179-V182 PolarHBondContact O-N 2.87Å; V182-Y184 VanDerWaalsContact C-N 3.32Å
183	Q	93.6	Very high	94.8	Very high	143 Å²	143	57 Å²	57	67%	0.668	31%	0.313	S	S	*	.	H	α-helix	trans	-82.2	-10.3	179	-68.9	174.5	4.1	0	0	113.5	A179 Q180 L181 S185	A179-Q183 VanDerWaalsContact O-CG 3.31Å; A179-Q183 WeakPolarHBondContact O-CG 3.48Å; A179-Q183 PolarHBondContact O-N 3.15Å; A179-Q183 VanDerWaalsContact O-N 3.14Å; Q180-Q183 PolarHBondContact O-N 3.35Å; L181-Q183 VanDerWaalsContact C-N 3.29Å; L181-Q183 PolarHBondContact O-N 2.87Å; Q183-S185 PolarHBondContact O-N 2.73Å
184	Y	94.7	Very high	94.9	Very high	59 Å²	59	57 Å²	57	23%	0.231	31%	0.313	C	S	.	.			trans	-73.5	124.9	-176.4	-175.8	-96.2	0	0	0	111.4	S84 Q180 L181 V182 G186 D188 M190	S84-Y184 WeakPolarHBondContact OG-CE2 3.43Å; Q180-Y184 PolarHBondContact O-N 3.21Å; L181-Y184 WeakPolarHBondContact O-CB 3.46Å; L181-Y184 PolarHBondContact O-N 2.83Å; V182-Y184 VanDerWaalsContact C-N 3.32Å; Y184-G186 VanDerWaalsContact CE1-N 3.29Å; Y184-D188 WeakPolarHBondContact CE1-O 3.29Å; Y184-M190 HydrophobicContact CD1-CB 3.81Å; Y184-M190 HydrophobicContact CD1-CG 4.44Å; Y184-M190 HydrophobicContact CD2-CB 3.98Å; Y184-M190 HydrophobicContact CD2-CG 3.69Å; Y184-M190 HydrophobicContact CD2-SD 3.94Å; Y184-M190 HydrophobicContact CE1-CB 4.07Å; Y184-M190 HydrophobicContact CE2-CB 4.23Å; Y184-M190 HydrophobicContact CE2-CG 4.02Å; Y184-M190 HydrophobicContact CG-CB 3.74Å; Y184-M190 HydrophobicContact CG-CG 3.9Å; Y184-M190 HydrophobicContact CG-SD 4.02Å
185	S	91.5	Very high	94.9	Very high	122 Å²	122	57 Å²	57	85%	0.853	31%	0.313	S	S	*	.			trans	-115.3	10.8	-175.5	59.2	0	0	0	0	114.1	Q183	Q183-S185 PolarHBondContact O-N 2.73Å
186	G	88.1	Confident	94.9	Very high	36 Å²	36	53.7 Å²	53.7	37%	0.371	30%	0.298	S	S	.	.			trans	-68.6	158.5	176.2	0	0	0	0	0	112.5	Y184	Y184-G186 VanDerWaalsContact CE1-N 3.29Å
187	K	87.4	Confident	94.8	Very high	214 Å²	214	51.7 Å²	51.7	93%	0.93	29%	0.29	S	S	*	.	S	Bend	trans	-71.7	-38.9	-179.4	-66.9	-177.5	177.7	-179.8	0	112.5
188	D	90.3	Very high	94.7	Very high	112 Å²	112	52 Å²	52	60%	0.599	29%	0.294	S	S	*	.	S	Bend	trans	-91.2	159.1	179.7	-57.8	-52.6	0	0	0	110.7	Y184 M190	Y184-D188 WeakPolarHBondContact CE1-O 3.29Å; D188-M190 PolarHBondContact O-N 2.86Å
189	P	92.5	Very high	94.8	Very high	85 Å²	85	50 Å²	50	55%	0.552	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-53	136.3	174.2	-27	35.6	0	0	0	112.5	C191	P189-C191 PolarHBondContact O-N 2.83Å
190	M	96.1	Very high	94.9	Very high	6 Å²	6	48 Å²	48	3%	0.03	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-53.5	129.1	176.7	-171.3	174.2	87.4	0	0	110.3	C58 R59 Q180 L181 Y184 D188 V192	C58-M190 WeakPolarHBondContact CA-O 3.5Å; C58-M190 HydrophobicContact CB-CB 4.26Å; C58-M190 VanDerWaalsContact CB-O 3.31Å; C58-M190 WeakPolarHBondContact CB-O 3.36Å; R59-M190 PolarHBondContact N-O 3.08Å; Q180-M190 HydrophobicContact CB-CE 4.18Å; Q180-M190 HydrophobicContact CB-SD 4.37Å; L181-M190 HydrophobicContact CB-CE 4.06Å; L181-M190 HydrophobicContact CD1-CB 3.91Å; L181-M190 HydrophobicContact CD1-CE 4.47Å; Y184-M190 HydrophobicContact CD1-CB 3.81Å; Y184-M190 HydrophobicContact CD1-CG 4.44Å; Y184-M190 HydrophobicContact CD2-CB 3.98Å; Y184-M190 HydrophobicContact CD2-CG 3.69Å; Y184-M190 HydrophobicContact CD2-SD 3.94Å; Y184-M190 HydrophobicContact CE1-CB 4.07Å; Y184-M190 HydrophobicContact CE2-CB 4.23Å; Y184-M190 HydrophobicContact CE2-CG 4.02Å; Y184-M190 HydrophobicContact CG-CB 3.74Å; Y184-M190 HydrophobicContact CG-CG 3.9Å; Y184-M190 HydrophobicContact CG-SD 4.02Å; D188-M190 PolarHBondContact O-N 2.86Å; M190-V192 HydrophobicContact CE-CG2 3.37Å; M190-V192 HydrophobicContact CG-CG2 4.32Å
191	C	97.9	Very high	94.8	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.014	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.9	175.6	-172.8	0	0	0	0	110.9	R59 E81 S84 P189	R59-C191 PolarHBondContact NH2-SG 2.77Å; R59-C191 WeakPolarHBondContact O-CA 3.46Å; E81-C191 WeakPolarHBondContact O-CB 3.37Å; S84-C191 PolarHBondContact N-O 2.92Å; P189-C191 PolarHBondContact O-N 2.83Å
192	V	98.5	Very high	94.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119	-178.4	-175.2	0	0	0	0	110.4	R59 Y60 I61 L85 V87 M177 M190 V194	R59-V192 PolarHBondContact O-N 2.92Å; Y60-V192 CarbonylContact C-O 3.59Å; Y60-V192 VanDerWaalsContact CA-O 3.27Å; Y60-V192 WeakPolarHBondContact CA-O 3.47Å; Y60-V192 HydrophobicContact CD1-CB 3.83Å; Y60-V192 HydrophobicContact CD1-CG1 4.17Å; Y60-V192 HydrophobicContact CE1-CB 4.1Å; Y60-V192 HydrophobicContact CE1-CG1 4.31Å; Y60-V192 HydrophobicContact CE1-CG2 4.49Å; I61-V192 PolarHBondContact N-O 2.82Å; L85-V192 HydrophobicContact CB-CG1 4.12Å; L85-V192 HydrophobicContact CB-CG2 4.26Å; L85-V192 HydrophobicContact CD2-CG1 3.97Å; L85-V192 HydrophobicContact CD2-CG2 4.48Å; L85-V192 HydrophobicContact CG-CG1 4.01Å; L85-V192 CarbonylContact O-C 3.58Å; L85-V192 WeakPolarHBondContact O-CA 3.49Å; V87-V192 HydrophobicContact CG2-CG1 4.22Å; M177-V192 HydrophobicContact CE-CG1 4.18Å; M190-V192 HydrophobicContact CE-CG2 3.37Å; M190-V192 HydrophobicContact CG-CG2 4.32Å; V192-V194 HydrophobicContact CG1-CG2 4.04Å
193	I	98.8	Very high	95.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	132.4	167.8	-74.3	172.4	0	0	0	108.7	I61 T63 F74 M77 V78 V83 L85 I86 V87	I61-I193 HydrophobicContact CB-CG1 3.94Å; I61-I193 HydrophobicContact CD1-CG1 4.46Å; I61-I193 HydrophobicContact CG2-CG1 4.22Å; I61-I193 CarbonylContact O-C 3.49Å; I61-I193 WeakPolarHBondContact O-CA 3.49Å; T63-I193 HydrophobicContact CG2-CG2 3.82Å; F74-I193 HydrophobicContact CE2-CD1 4.18Å; F74-I193 HydrophobicContact CE2-CG2 4.11Å; F74-I193 HydrophobicContact CZ-CD1 4.2Å; F74-I193 HydrophobicContact CZ-CG2 4.31Å; M77-I193 HydrophobicContact CE-CD1 3.78Å; M77-I193 HydrophobicContact CE-CG1 4.45Å; V78-I193 HydrophobicContact CG2-CD1 3.59Å; V83-I193 HydrophobicContact CB-CD1 4.4Å; V83-I193 HydrophobicContact CG1-CB 4.36Å; V83-I193 HydrophobicContact CG1-CD1 4.06Å; V83-I193 HydrophobicContact CG1-CG1 4.04Å; V83-I193 HydrophobicContact CG2-CD1 3.7Å; V83-I193 HydrophobicContact CG2-CG1 3.91Å; L85-I193 PolarHBondContact O-N 3.34Å; I86-I193 CarbonylContact C-O 3.5Å; I86-I193 HydrophobicContact CG1-CB 4.27Å; I86-I193 HydrophobicContact CG2-CB 4.47Å; I86-I193 HydrophobicContact CG2-CG2 4.18Å; V87-I193 PolarHBondContact N-O 3.32Å
194	V	98.7	Very high	95.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	116.7	170.4	-174.1	0	0	0	0	109	Y60 I61 L62 T63 V87 L89 M177 V192 S203 L206 V207	Y60-V194 HydrophobicContact CD1-CG2 4.01Å; I61-V194 PolarHBondContact O-N 3.02Å; L62-V194 WeakPolarHBondContact CA-O 3.23Å; T63-V194 PolarHBondContact N-O 3.36Å; V87-V194 HydrophobicContact CB-CG1 4.46Å; V87-V194 HydrophobicContact CB-CG2 4.35Å; V87-V194 WeakPolarHBondContact O-CA 3.48Å; L89-V194 HydrophobicContact CD1-CG1 3.83Å; L89-V194 HydrophobicContact CG-CG1 4.46Å; M177-V194 HydrophobicContact CE-CG2 4.48Å; V192-V194 HydrophobicContact CG1-CG2 4.04Å; V194-S203 PolarHBondContact O-OG 2.75Å; V194-L206 HydrophobicContact CG1-CD2 3.92Å; V194-V207 HydrophobicContact CB-CG2 4.42Å; V194-V207 HydrophobicContact CG2-CG2 4.07Å
195	H	98.3	Very high	95.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	153.8	177.4	84.2	91	0	0	0	111.9	T63 V87 C88 L89 Y103 S203	T63-H195 HydrophobicContact CG2-CB 3.72Å; T63-H195 WeakPolarHBondContact O-CB 3.42Å; V87-H195 PolarHBondContact O-N 3.42Å; C88-H195 VanDerWaalsContact CB-NE2 3.33Å; C88-H195 WeakPolarHBondContact CB-NE2 3.48Å; C88-H195 PolarHBondContact SG-CE1 2.89Å; C88-H195 PolarHBondContact SG-NE2 2.77Å; C88-H195 VanDerWaalsContact SG-NE2 3.38Å; L89-H195 WeakPolarHBondContact CB-O 3.33Å; L89-H195 PolarHBondContact N-O 2.96Å; Y103-H195 AromaticContact CE1-CE1 3.69Å; Y103-H195 AromaticContact CE1-NE2 3.45Å; Y103-H195 WeakPolarHBondContact CE1-NE2 3.42Å; Y103-H195 AromaticContact CZ-NE2 3.39Å; Y103-H195 PolarHBondContact OH-CD2 3.18Å; Y103-H195 PolarHBondContact OH-NE2 2.85Å; H195-S203 VanDerWaalsContact C-OG 3.23Å; H195-S203 VanDerWaalsContact CA-OG 3.31Å; H195-S203 WeakPolarHBondContact CA-OG 3.4Å
196	C	95.8	Very high	95.8	Very high	6 Å²	6	23.3 Å²	23.3	4%	0.041	13%	0.13	C	C	.	.			trans	-123.7	-128.5	164.7	61.3	0	0	0	0	106.9	A65 L89 T90 G199 R202 S203	A65-C196 WeakPolarHBondContact CB-O 3.14Å; L89-C196 HydrophobicContact CB-CB 4.04Å; T90-C196 WeakPolarHBondContact CG2-O 3.04Å; C196-G199 PolarHBondContact SG-N 2.78Å; C196-R202 HydrophobicContact CB-CB 3.88Å; C196-R202 HydrophobicContact CB-CG 4.26Å; C196-S203 PolarHBondContact N-OG 2.85Å; C196-S203 VanDerWaalsContact N-OG 3.15Å
197	S	95.6	Very high	96.3	Very high	6 Å²	6	21.6 Å²	21.6	4%	0.042	11%	0.113	C	C	.	.	S	Bend	trans	-85	-63.5	169.3	-164.2	0	0	0	0	111.3	Y23 Q64 A65 K99	Y23-S197 WeakPolarHBondContact CE2-OG 3.33Å; Y23-S197 PolarHBondContact OH-OG 3.43Å; Q64-S197 CarbonylContact C-O 3.58Å; Q64-S197 WeakPolarHBondContact CA-O 3.44Å; A65-S197 PolarHBondContact N-O 2.79Å; K99-S197 PolarHBondContact O-OG 3.37Å
198	A	95.4	Very high	96.8	Very high	12 Å²	12	11.4 Å²	11.4	10%	0.099	7%	0.068	C	C	.	.	S	Bend	trans	-82.8	-12.9	177.1	0	0	0	0	0	114.5	Y23 I26 V200 R235	Y23-A198 HydrophobicContact CD2-CB 3.68Å; Y23-A198 HydrophobicContact CE2-CB 3.9Å; I26-A198 HydrophobicContact CD1-CB 4.04Å; I26-A198 HydrophobicContact CG1-CB 3.99Å; A198-V200 VanDerWaalsContact C-N 3.33Å; A198-V200 HydrophobicContact CB-CG2 3.87Å; A198-V200 PolarHBondContact O-N 3.33Å; A198-R235 PolarHBondContact O-NH2 3.32Å
199	G	97.3	Very high	97.1	Very high	0 Å²	0	6 Å²	6	0%	0	4%	0.04	C	C	.	.	S	Bend	trans	70.7	25.6	-177	0	0	0	0	0	114.7	T63 C196 R235	T63-G199 WeakPolarHBondContact O-CA 3.33Å; C196-G199 PolarHBondContact SG-N 2.78Å; G199-R235 PolarHBondContact O-NE 3.17Å; G199-R235 VanDerWaalsContact O-NE 3.08Å
200	V	97.3	Very high	97.4	Very high	0 Å²	0	2 Å²	2	0%	0	1%	0.014	C	C	.	.	S	Bend	trans	-128	-57	-176.1	-59.9	0	0	0	0	112.7	I26 A198 G204 R235 A236 S238 V239	I26-V200 HydrophobicContact CD1-CG2 4.26Å; I26-V200 HydrophobicContact CG2-CG1 3.69Å; A198-V200 VanDerWaalsContact C-N 3.33Å; A198-V200 HydrophobicContact CB-CG2 3.87Å; A198-V200 PolarHBondContact O-N 3.33Å; V200-G204 WeakPolarHBondContact O-CA 3.32Å; V200-G204 PolarHBondContact O-N 2.84Å; V200-R235 HydrophobicContact CG1-CG 4.35Å; V200-A236 VanDerWaalsContact CG1-O 3.32Å; V200-A236 WeakPolarHBondContact CG1-O 3.28Å; V200-S238 WeakPolarHBondContact O-CA 3.18Å; V200-V239 PolarHBondContact O-N 2.82Å; V200-V239 VanDerWaalsContact O-N 3.15Å
201	G	96	Very high	97.4	Very high	3 Å²	3	1.8 Å²	1.8	3%	0.031	1%	0.013	C	C	.	.	H	α-helix	trans	-66	-76.1	-174.4	0	0	0	0	0	113.2	T205 Q244	G201-T205 WeakPolarHBondContact O-CB 3.22Å; G201-T205 PolarHBondContact O-N 2.93Å; G201-T205 PolarHBondContact O-OG1 2.92Å; G201-Q244 VanDerWaalsContact CA-OE1 3.32Å
202	R	96.3	Very high	97.4	Very high	6 Å²	6	1.7 Å²	1.7	2%	0.023	1%	0.012	C	C	.	.	H	α-helix	trans	-61.8	-44.5	179.7	-51.2	-176.8	-158.7	165.4	12.6	112.1	L89 E94 W158 D160 C196 T205 L206	L89-R202 HydrophobicContact CB-CB 4.08Å; L89-R202 HydrophobicContact CD1-CB 3.93Å; L89-R202 VanDerWaalsContact O-CD 3.22Å; L89-R202 WeakPolarHBondContact O-CD 3.49Å; L89-R202 PolarHBondContact O-NH1 3.13Å; E94-R202 IonicContact OE1-CZ 3.26Å; E94-R202 IonicContact OE1-NH1 3.55Å; E94-R202 PolarHBondContact OE1-NH1 2.78Å; E94-R202 IonicContact OE1-NH2 3.93Å; E94-R202 IonicContact OE2-CZ 2.8Å; E94-R202 IonicContact OE2-NH1 2.79Å; E94-R202 PolarHBondContact OE2-NH1 2.97Å; E94-R202 IonicContact OE2-NH2 3.51Å; E94-R202 PolarHBondContact OE2-NH2 2.81Å; W158-R202 HydrophobicContact CD2-CB 4.03Å; W158-R202 HydrophobicContact CD2-CG 3.77Å; W158-R202 HydrophobicContact CE3-CB 3.84Å; W158-R202 HydrophobicContact CE3-CG 4.12Å; W158-R202 HydrophobicContact CG-CG 4.27Å; W158-R202 HydrophobicContact CH2-CB 3.87Å; W158-R202 HydrophobicContact CH2-CG 4.31Å; W158-R202 HydrophobicContact CZ2-CB 4Å; W158-R202 HydrophobicContact CZ2-CG 3.92Å; W158-R202 HydrophobicContact CZ3-CB 3.72Å; W158-R202 HydrophobicContact CZ3-CG 4.34Å; W158-R202 PolarHBondContact O-NH1 2.8Å; D160-R202 IonicContact OD1-CZ 2.77Å; D160-R202 IonicContact OD1-NE 3.26Å; D160-R202 IonicContact OD1-NH2 3.97Å; D160-R202 PolarHBondContact OD1-NH2 3.24Å; C196-R202 HydrophobicContact CB-CB 3.88Å; C196-R202 HydrophobicContact CB-CG 4.26Å; R202-T205 PolarHBondContact O-N 2.87Å; R202-L206 PolarHBondContact O-N 3.46Å
203	S	97.7	Very high	97.2	Very high	0 Å²	0	1.7 Å²	1.7	0%	0	1%	0.012	C	C	.	.	H	α-helix	trans	-59.7	-51.2	179.1	-57.4	0	0	0	0	112.7	V194 H195 C196 T205 L206 V207	V194-S203 PolarHBondContact O-OG 2.75Å; H195-S203 VanDerWaalsContact C-OG 3.23Å; H195-S203 VanDerWaalsContact CA-OG 3.31Å; H195-S203 WeakPolarHBondContact CA-OG 3.4Å; C196-S203 PolarHBondContact N-OG 2.85Å; C196-S203 VanDerWaalsContact N-OG 3.15Å; S203-T205 VanDerWaalsContact C-N 3.26Å; S203-T205 PolarHBondContact O-N 3.06Å; S203-L206 PolarHBondContact O-N 3.4Å; S203-V207 PolarHBondContact O-N 2.8Å; S203-V207 VanDerWaalsContact O-N 3.1Å
204	G	98.1	Very high	97	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-63.1	-34.7	178.3	0	0	0	0	0	112.4	V200 A208	V200-G204 WeakPolarHBondContact O-CA 3.32Å; V200-G204 PolarHBondContact O-N 2.84Å; G204-A208 WeakPolarHBondContact O-CB 3.48Å; G204-A208 PolarHBondContact O-N 2.86Å
205	T	97.8	Very high	96.8	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-67.4	-41.7	176.9	-54.9	0	0	0	0	111.8	W158 G201 R202 S203 L209 F247 L248	W158-T205 HydrophobicContact CH2-CG2 3.72Å; W158-T205 HydrophobicContact CZ2-CG2 4.28Å; G201-T205 WeakPolarHBondContact O-CB 3.22Å; G201-T205 PolarHBondContact O-N 2.93Å; G201-T205 PolarHBondContact O-OG1 2.92Å; R202-T205 PolarHBondContact O-N 2.87Å; S203-T205 VanDerWaalsContact C-N 3.26Å; S203-T205 PolarHBondContact O-N 3.06Å; T205-L209 VanDerWaalsContact O-CB 3.32Å; T205-L209 WeakPolarHBondContact O-CB 3.42Å; T205-L209 PolarHBondContact O-N 3.01Å; T205-F247 HydrophobicContact CG2-CD1 4.01Å; T205-L248 HydrophobicContact CG2-CD2 3.85Å; T205-L248 HydrophobicContact CG2-CG 4.3Å; T205-L248 WeakPolarHBondContact O-CD2 3.37Å
206	L	98	Very high	96.6	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-63.1	-47.2	175.2	178.5	58.9	0	0	0	111.7	V87 L89 F170 L173 M177 V194 R202 S203 L209 Q210	V87-L206 HydrophobicContact CG1-CD2 3.86Å; L89-L206 HydrophobicContact CD1-CB 4.06Å; L89-L206 HydrophobicContact CD1-CD2 3.96Å; L89-L206 HydrophobicContact CD2-CD2 4.18Å; L89-L206 HydrophobicContact CG-CD2 4.48Å; F170-L206 HydrophobicContact CE1-CD1 4.23Å; F170-L206 HydrophobicContact CE2-CD1 4.08Å; F170-L206 HydrophobicContact CZ-CB 3.88Å; F170-L206 HydrophobicContact CZ-CD1 3.61Å; F170-L206 HydrophobicContact CZ-CG 4.29Å; L173-L206 HydrophobicContact CD2-CD1 4.22Å; L173-L206 HydrophobicContact CD2-CD2 3.93Å; L173-L206 HydrophobicContact CG-CD1 4.37Å; L173-L206 HydrophobicContact CG-CD2 4.46Å; M177-L206 HydrophobicContact CE-CD2 4.31Å; M177-L206 HydrophobicContact SD-CD1 4.03Å; M177-L206 HydrophobicContact SD-CD2 3.76Å; M177-L206 HydrophobicContact SD-CG 4.09Å; V194-L206 HydrophobicContact CG1-CD2 3.92Å; R202-L206 PolarHBondContact O-N 3.46Å; S203-L206 PolarHBondContact O-N 3.4Å; L206-L209 PolarHBondContact O-N 3.05Å; L206-Q210 HydrophobicContact CD1-CG 4.49Å; L206-Q210 WeakPolarHBondContact O-CG 3.48Å; L206-Q210 PolarHBondContact O-N 3.32Å
207	V	98.3	Very high	96.4	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-67.6	-39	-179.1	173	0	0	0	0	112	V51 M53 Y60 L62 V194 S203 Q210 A211 V231	V51-V207 HydrophobicContact CG1-CG1 4.11Å; M53-V207 HydrophobicContact CG-CG1 4.04Å; Y60-V207 HydrophobicContact CD1-CG2 3.91Å; Y60-V207 HydrophobicContact CD2-CG1 3.64Å; Y60-V207 HydrophobicContact CD2-CG2 4.21Å; Y60-V207 HydrophobicContact CE1-CG2 4.28Å; Y60-V207 HydrophobicContact CE2-CG1 3.91Å; Y60-V207 HydrophobicContact CG-CG1 4.12Å; Y60-V207 HydrophobicContact CG-CG2 3.87Å; L62-V207 HydrophobicContact CD1-CB 4.5Å; L62-V207 HydrophobicContact CD1-CG2 3.74Å; V194-V207 HydrophobicContact CB-CG2 4.42Å; V194-V207 HydrophobicContact CG2-CG2 4.07Å; S203-V207 PolarHBondContact O-N 2.8Å; S203-V207 VanDerWaalsContact O-N 3.1Å; V207-Q210 PolarHBondContact O-N 3.24Å; V207-A211 PolarHBondContact O-N 3.22Å; V207-A211 VanDerWaalsContact O-N 3.12Å; V207-V231 HydrophobicContact CG1-CG2 4.36Å
208	A	98	Very high	96.2	Very high	0 Å²	0	10 Å²	10	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.2	-43.6	172.7	0	0	0	0	0	111.6	G204 Q210 A211 L212 T227 V228 V231 V239 L248	G204-A208 WeakPolarHBondContact O-CB 3.48Å; G204-A208 PolarHBondContact O-N 2.86Å; A208-Q210 VanDerWaalsContact C-N 3.34Å; A208-Q210 PolarHBondContact O-N 2.9Å; A208-A211 PolarHBondContact O-N 2.79Å; A208-L212 WeakPolarHBondContact O-CB 2.91Å; A208-L212 WeakPolarHBondContact O-CD1 3.47Å; A208-L212 WeakPolarHBondContact O-CG 3.28Å; A208-L212 PolarHBondContact O-N 3.29Å; A208-T227 HydrophobicContact CB-CG2 4.18Å; A208-V228 HydrophobicContact CB-CG2 4.23Å; A208-V231 HydrophobicContact CB-CG2 4.31Å; A208-V239 HydrophobicContact CB-CG2 4.33Å; A208-L248 HydrophobicContact CB-CD1 3.95Å; A208-L248 HydrophobicContact CB-CD2 4.07Å
209	L	97.8	Very high	95.8	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-42.9	177	-179	60.6	0	0	0	111.6	F170 L171 T205 L206 A211 L212 M213 L248 A251	F170-L209 HydrophobicContact CD1-CD2 3.7Å; F170-L209 HydrophobicContact CE1-CD2 3.49Å; F170-L209 VanDerWaalsContact CE1-CD2 3.49Å; L171-L209 HydrophobicContact CD2-CD2 4.21Å; T205-L209 VanDerWaalsContact O-CB 3.32Å; T205-L209 WeakPolarHBondContact O-CB 3.42Å; T205-L209 PolarHBondContact O-N 3.01Å; L206-L209 PolarHBondContact O-N 3.05Å; L209-A211 PolarHBondContact O-N 2.88Å; L209-L212 PolarHBondContact O-N 3.18Å; L209-M213 HydrophobicContact CD1-CG 4.06Å; L209-M213 HydrophobicContact CD1-SD 4.04Å; L209-M213 HydrophobicContact CD2-SD 4.26Å; L209-M213 HydrophobicContact CG-CG 4.28Å; L209-M213 HydrophobicContact CG-SD 3.75Å; L209-M213 WeakPolarHBondContact O-CB 3.45Å; L209-M213 WeakPolarHBondContact O-CG 3.33Å; L209-M213 PolarHBondContact O-N 3.32Å; L209-L248 HydrophobicContact CB-CD2 3.86Å; L209-A251 HydrophobicContact CD1-CB 3.9Å; L209-A251 HydrophobicContact CD2-CB 4.03Å
210	Q	97.3	Very high	95.5	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-58.5	-47.6	177	-79	-70.8	24.1	0	0	112.7	A174 M177 D178 L206 V207 A208 L212 M213 A214	A174-Q210 PolarHBondContact O-NE2 3.45Å; M177-Q210 VanDerWaalsContact CB-NE2 3.25Å; M177-Q210 HydrophobicContact CE-CG 4.19Å; M177-Q210 HydrophobicContact SD-CG 4.44Å; M177-Q210 PolarHBondContact SD-NE2 3.48Å; D178-Q210 PolarHBondContact OD1-OE1 3.24Å; L206-Q210 HydrophobicContact CD1-CG 4.49Å; L206-Q210 WeakPolarHBondContact O-CG 3.48Å; L206-Q210 PolarHBondContact O-N 3.32Å; V207-Q210 PolarHBondContact O-N 3.24Å; A208-Q210 VanDerWaalsContact C-N 3.34Å; A208-Q210 PolarHBondContact O-N 2.9Å; Q210-L212 VanDerWaalsContact C-N 3.34Å; Q210-L212 PolarHBondContact O-N 3.48Å; Q210-M213 PolarHBondContact O-N 2.68Å; Q210-A214 PolarHBondContact O-N 3Å
211	A	97.1	Very high	95.2	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-62.4	-41.5	176.8	0	0	0	0	0	112	M53 V207 A208 L209 A214 V215 T227	M53-A211 HydrophobicContact CB-CB 3.98Å; M53-A211 HydrophobicContact CE-CB 3.82Å; M53-A211 HydrophobicContact CG-CB 4.02Å; V207-A211 PolarHBondContact O-N 3.22Å; V207-A211 VanDerWaalsContact O-N 3.12Å; A208-A211 PolarHBondContact O-N 2.79Å; L209-A211 PolarHBondContact O-N 2.88Å; A211-A214 PolarHBondContact O-N 2.82Å; A211-V215 WeakPolarHBondContact O-CG2 3.42Å; A211-V215 PolarHBondContact O-N 2.75Å; A211-V215 VanDerWaalsContact O-N 3.16Å; A211-T227 HydrophobicContact CB-CG2 3.85Å
212	L	96.6	Very high	95.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.3	-42	177.7	-69.7	164.1	0	0	0	112.5	A208 L209 Q210 A214 V215 V216 P222 V224 T227 L248 L252	A208-L212 WeakPolarHBondContact O-CB 2.91Å; A208-L212 WeakPolarHBondContact O-CD1 3.47Å; A208-L212 WeakPolarHBondContact O-CG 3.28Å; A208-L212 PolarHBondContact O-N 3.29Å; L209-L212 PolarHBondContact O-N 3.18Å; Q210-L212 VanDerWaalsContact C-N 3.34Å; Q210-L212 PolarHBondContact O-N 3.48Å; L212-A214 VanDerWaalsContact C-N 3.32Å; L212-V215 PolarHBondContact O-N 3.33Å; L212-V216 WeakPolarHBondContact O-CG2 3.29Å; L212-V216 PolarHBondContact O-N 3.26Å; L212-P222 HydrophobicContact CD2-CB 3.8Å; L212-V224 HydrophobicContact CD1-CB 4.49Å; L212-V224 HydrophobicContact CD1-CG1 4.36Å; L212-V224 HydrophobicContact CD1-CG2 4.03Å; L212-V224 HydrophobicContact CD2-CG2 4.1Å; L212-T227 HydrophobicContact CD2-CG2 4.33Å; L212-T227 HydrophobicContact CG-CG2 4.03Å; L212-L248 HydrophobicContact CD1-CB 4.19Å; L212-L248 HydrophobicContact CD1-CD1 4.46Å; L212-L248 HydrophobicContact CD1-CD2 4.31Å; L212-L252 HydrophobicContact CB-CD1 3.89Å; L212-L252 HydrophobicContact CB-CD2 4.07Å; L212-L252 HydrophobicContact CD1-CD2 4.5Å; L212-L252 HydrophobicContact CD2-CD2 4.36Å
213	M	95.7	Very high	95	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63	-40.3	175.9	-74.6	171.9	56.4	0	0	111.1	L171 A174 L209 Q210 V215 V216 N217 L252 H255	L171-M213 HydrophobicContact CD2-CE 4.38Å; L171-M213 HydrophobicContact CD2-SD 3.85Å; A174-M213 HydrophobicContact CB-CE 3.8Å; A174-M213 HydrophobicContact CB-SD 3.75Å; L209-M213 HydrophobicContact CD1-CG 4.06Å; L209-M213 HydrophobicContact CD1-SD 4.04Å; L209-M213 HydrophobicContact CD2-SD 4.26Å; L209-M213 HydrophobicContact CG-CG 4.28Å; L209-M213 HydrophobicContact CG-SD 3.75Å; L209-M213 WeakPolarHBondContact O-CB 3.45Å; L209-M213 WeakPolarHBondContact O-CG 3.33Å; L209-M213 PolarHBondContact O-N 3.32Å; Q210-M213 PolarHBondContact O-N 2.68Å; M213-V215 PolarHBondContact O-N 3.47Å; M213-V216 PolarHBondContact O-N 3.48Å; M213-N217 VanDerWaalsContact O-CB 3.29Å; M213-N217 WeakPolarHBondContact O-CB 3.37Å; M213-N217 PolarHBondContact O-N 3.22Å; M213-N217 PolarHBondContact O-ND2 2.84Å; M213-N217 PolarHBondContact O-OD1 3Å; M213-L252 HydrophobicContact CG-CD1 4.37Å; M213-H255 HydrophobicContact CG-CB 4.49Å
214	A	94.8	Very high	94.9	Very high	24 Å²	24	27.9 Å²	27.9	20%	0.198	17%	0.166	C	C	.	.	H	α-helix	trans	-62.2	-42.6	177.1	0	0	0	0	0	112.6	Q55 Q210 A211 L212 N217 S218	Q55-A214 HydrophobicContact CB-CB 4.31Å; Q55-A214 VanDerWaalsContact O-CB 3.23Å; Q55-A214 WeakPolarHBondContact O-CB 3.37Å; Q210-A214 PolarHBondContact O-N 3Å; A211-A214 PolarHBondContact O-N 2.82Å; L212-A214 VanDerWaalsContact C-N 3.32Å; A214-N217 PolarHBondContact O-N 3.47Å; A214-S218 PolarHBondContact O-N 2.86Å
215	V	94	Very high	94.8	Very high	12 Å²	12	32.9 Å²	32.9	7%	0.073	19%	0.192	C	C	.	.	H	α-helix	trans	-60.4	-48	173.7	176	0	0	0	0	111.5	Q55 A211 L212 M213 N217 S218 G219 E220 P222	Q55-V215 HydrophobicContact CB-CG2 3.89Å; Q55-V215 HydrophobicContact CG-CG2 3.52Å; A211-V215 WeakPolarHBondContact O-CG2 3.42Å; A211-V215 PolarHBondContact O-N 2.75Å; A211-V215 VanDerWaalsContact O-N 3.16Å; L212-V215 PolarHBondContact O-N 3.33Å; M213-V215 PolarHBondContact O-N 3.47Å; V215-N217 VanDerWaalsContact C-N 3.29Å; V215-N217 PolarHBondContact O-N 2.65Å; V215-S218 PolarHBondContact O-N 3.38Å; V215-S218 PolarHBondContact O-OG 3.37Å; V215-G219 PolarHBondContact O-N 3.33Å; V215-E220 HydrophobicContact CG1-CB 3.63Å; V215-E220 PolarHBondContact O-N 3.31Å; V215-E220 VanDerWaalsContact O-N 3.09Å; V215-P222 HydrophobicContact CG1-CB 4.23Å
216	V	93.7	Very high	94.8	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-40.9	178.5	164.6	0	0	0	0	111.4	L212 M213 S218 G219 P222 L252 I256 I260	L212-V216 WeakPolarHBondContact O-CG2 3.29Å; L212-V216 PolarHBondContact O-N 3.26Å; M213-V216 PolarHBondContact O-N 3.48Å; V216-S218 VanDerWaalsContact C-N 3.27Å; V216-S218 PolarHBondContact O-N 2.8Å; V216-G219 PolarHBondContact O-N 3.35Å; V216-P222 HydrophobicContact CG2-CB 3.97Å; V216-P222 HydrophobicContact CG2-CG 3.57Å; V216-L252 HydrophobicContact CB-CD1 4.47Å; V216-L252 HydrophobicContact CG2-CD1 3.73Å; V216-L252 HydrophobicContact CG2-CD2 4.46Å; V216-L252 HydrophobicContact CG2-CG 4.23Å; V216-I256 HydrophobicContact CG1-CD1 4.17Å; V216-I256 HydrophobicContact CG1-CG1 3.51Å; V216-I256 HydrophobicContact CG2-CD1 4.03Å; V216-I256 HydrophobicContact CG2-CG1 4.24Å; V216-I260 HydrophobicContact CG1-CD1 3.93Å; V216-I260 HydrophobicContact CG1-CG1 3.75Å
217	N	92.1	Very high	94.7	Very high	82 Å²	82	35.6 Å²	35.6	44%	0.439	21%	0.213	S	C	.	.	H	α-helix	trans	-69.6	-23.6	179.8	-68.5	-17.1	0	0	0	112.6	M213 A214 V215 H255	M213-N217 VanDerWaalsContact O-CB 3.29Å; M213-N217 WeakPolarHBondContact O-CB 3.37Å; M213-N217 PolarHBondContact O-N 3.22Å; M213-N217 PolarHBondContact O-ND2 2.84Å; M213-N217 PolarHBondContact O-OD1 3Å; A214-N217 PolarHBondContact O-N 3.47Å; V215-N217 VanDerWaalsContact C-N 3.29Å; V215-N217 PolarHBondContact O-N 2.65Å; N217-H255 PolarHBondContact OD1-NE2 2.91Å
218	S	90.6	Very high	94.7	Very high	68 Å²	68	35.7 Å²	35.7	48%	0.476	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.9	169.9	72.6	0	0	0	0	113.2	A214 V215 V216 E220	A214-S218 PolarHBondContact O-N 2.86Å; V215-S218 PolarHBondContact O-N 3.38Å; V215-S218 PolarHBondContact O-OG 3.37Å; V216-S218 VanDerWaalsContact C-N 3.27Å; V216-S218 PolarHBondContact O-N 2.8Å; S218-E220 VanDerWaalsContact C-N 3.31Å; S218-E220 WeakPolarHBondContact OG-CG 3.42Å; S218-E220 PolarHBondContact OG-OE1 2.94Å
219	G	88.1	Confident	94.7	Very high	59 Å²	59	38.8 Å²	38.8	61%	0.608	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.4	6.5	-176.3	0	0	0	0	0	113.8	V215 V216	V215-G219 PolarHBondContact O-N 3.33Å; V216-G219 PolarHBondContact O-N 3.35Å
220	E	89.7	Confident	94.7	Very high	124 Å²	124	40.9 Å²	40.9	58%	0.579	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-86.6	163.2	178.8	-72.1	173	-109.3	0	0	112.1	V215 S218 P222	V215-E220 HydrophobicContact CG1-CB 3.63Å; V215-E220 PolarHBondContact O-N 3.31Å; V215-E220 VanDerWaalsContact O-N 3.09Å; S218-E220 VanDerWaalsContact C-N 3.31Å; S218-E220 WeakPolarHBondContact OG-CG 3.42Å; S218-E220 PolarHBondContact OG-OE1 2.94Å; E220-P222 WeakPolarHBondContact O-CD 3.31Å
221	E	91	Very high	94.8	Very high	106 Å²	106	40.9 Å²	40.9	50%	0.495	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-83.3	121.3	178.5	-176.1	172.4	165.2	0	0	110.9	K269	E221-K269 HydrophobicContact CG-CB 4.36Å; E221-K269 HydrophobicContact CG-CD 4.11Å; E221-K269 VanDerWaalsContact OE2-CD 3.28Å; E221-K269 WeakPolarHBondContact OE2-CD 3.47Å; E221-K269 VanDerWaalsContact OE2-CE 3.25Å; E221-K269 WeakPolarHBondContact OE2-CE 3.28Å; E221-K269 IonicContact OE2-NZ 3.56Å; E221-K269 PolarHBondContact OE2-NZ 3.32Å
222	P	93.6	Very high	94.8	Very high	12 Å²	12	46 Å²	46	8%	0.078	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-77.1	140.8	-179.6	32.5	-36.2	0	0	0	111.8	L212 V215 V216 E220 L252 I270	L212-P222 HydrophobicContact CD2-CB 3.8Å; V215-P222 HydrophobicContact CG1-CB 4.23Å; V216-P222 HydrophobicContact CG2-CB 3.97Å; V216-P222 HydrophobicContact CG2-CG 3.57Å; E220-P222 WeakPolarHBondContact O-CD 3.31Å; P222-L252 HydrophobicContact CB-CD2 3.78Å; P222-L252 HydrophobicContact CG-CD2 3.61Å; P222-I270 HydrophobicContact CG-CD1 3.41Å; P222-I270 VanDerWaalsContact CG-CD1 3.41Å; P222-I270 HydrophobicContact CG-CG1 3.69Å
223	N	94.6	Very high	94.9	Very high	92 Å²	92	50 Å²	50	49%	0.492	29%	0.285	S	S	.	.			trans	-117.7	98.3	173.4	-174.6	-29.9	0	0	0	110.4	L225 A226 T227	N223-L225 VanDerWaalsContact C-N 3.32Å; N223-L225 PolarHBondContact O-N 2.87Å; N223-L225 PolarHBondContact OD1-N 2.81Å; N223-A226 HydrophobicContact CB-CB 3.95Å; N223-A226 VanDerWaalsContact CG-CB 3.48Å; N223-A226 PolarHBondContact O-N 2.89Å; N223-A226 WeakPolarHBondContact OD1-CB 3.46Å; N223-A226 PolarHBondContact OD1-N 3.05Å; N223-T227 WeakPolarHBondContact O-CB 3.27Å; N223-T227 PolarHBondContact O-N 2.84Å; N223-T227 PolarHBondContact O-OG1 2.89Å; N223-T227 VanDerWaalsContact O-OG1 3.08Å
224	V	95.7	Very high	95	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.024	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-41.8	-177.3	-178.2	0	0	0	0	111.8	L212 T227 V228 Y245 L248 Y249 L252	L212-V224 HydrophobicContact CD1-CB 4.49Å; L212-V224 HydrophobicContact CD1-CG1 4.36Å; L212-V224 HydrophobicContact CD1-CG2 4.03Å; L212-V224 HydrophobicContact CD2-CG2 4.1Å; V224-T227 PolarHBondContact O-N 2.67Å; V224-V228 HydrophobicContact CG1-CG2 4.23Å; V224-V228 WeakPolarHBondContact O-CB 3.39Å; V224-V228 VanDerWaalsContact O-CG2 3.28Å; V224-V228 WeakPolarHBondContact O-CG2 3.37Å; V224-V228 PolarHBondContact O-N 2.87Å; V224-Y245 HydrophobicContact CG1-CE2 4.05Å; V224-L248 HydrophobicContact CG1-CB 3.98Å; V224-L248 HydrophobicContact CG1-CD1 3.94Å; V224-Y249 HydrophobicContact CB-CD2 4.43Å; V224-Y249 HydrophobicContact CB-CE1 4.21Å; V224-Y249 HydrophobicContact CB-CE2 3.73Å; V224-Y249 HydrophobicContact CG1-CD2 4.12Å; V224-Y249 HydrophobicContact CG1-CE2 3.59Å; V224-Y249 HydrophobicContact CG2-CD1 4.07Å; V224-Y249 HydrophobicContact CG2-CD2 4.2Å; V224-Y249 HydrophobicContact CG2-CE1 3.76Å; V224-Y249 HydrophobicContact CG2-CE2 3.89Å; V224-Y249 HydrophobicContact CG2-CG 4.27Å; V224-L252 HydrophobicContact CG2-CD2 4.48Å
225	L	96.5	Very high	95.2	Very high	104 Å²	104	50.1 Å²	50.1	55%	0.545	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-48.5	-179	177.3	61	0	0	0	111.4	N223 T229 Y245	N223-L225 VanDerWaalsContact C-N 3.32Å; N223-L225 PolarHBondContact O-N 2.87Å; N223-L225 PolarHBondContact OD1-N 2.81Å; L225-T229 VanDerWaalsContact O-CB 3.25Å; L225-T229 WeakPolarHBondContact O-CB 3.33Å; L225-T229 PolarHBondContact O-N 3.09Å; L225-T229 PolarHBondContact O-OG1 2.84Å; L225-Y245 VanDerWaalsContact CA-OH 3.31Å; L225-Y245 WeakPolarHBondContact CA-OH 3.4Å; L225-Y245 WeakPolarHBondContact CB-OH 3.19Å
226	A	96.7	Very high	95.4	Very high	49 Å²	49	50.3 Å²	50.3	41%	0.405	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-45.9	179.1	0	0	0	0	0	111	N223 T229 D230	N223-A226 HydrophobicContact CB-CB 3.95Å; N223-A226 VanDerWaalsContact CG-CB 3.48Å; N223-A226 PolarHBondContact O-N 2.89Å; N223-A226 WeakPolarHBondContact OD1-CB 3.46Å; N223-A226 PolarHBondContact OD1-N 3.05Å; A226-T229 WeakPolarHBondContact O-CB 3.34Å; A226-T229 PolarHBondContact O-N 2.85Å; A226-D230 PolarHBondContact O-N 3.47Å
227	T	97.5	Very high	95.5	Very high	8 Å²	8	53.5 Å²	53.5	5%	0.049	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-48.3	178.5	-62.5	0	0	0	0	112.1	M53 A208 A211 L212 N223 V224 T229 D230 V231	M53-T227 HydrophobicContact CE-CG2 3.94Å; A208-T227 HydrophobicContact CB-CG2 4.18Å; A211-T227 HydrophobicContact CB-CG2 3.85Å; L212-T227 HydrophobicContact CD2-CG2 4.33Å; L212-T227 HydrophobicContact CG-CG2 4.03Å; N223-T227 WeakPolarHBondContact O-CB 3.27Å; N223-T227 PolarHBondContact O-N 2.84Å; N223-T227 PolarHBondContact O-OG1 2.89Å; N223-T227 VanDerWaalsContact O-OG1 3.08Å; V224-T227 PolarHBondContact O-N 2.67Å; T227-T229 VanDerWaalsContact C-N 3.27Å; T227-T229 PolarHBondContact O-N 3.01Å; T227-D230 PolarHBondContact O-N 2.88Å; T227-V231 WeakPolarHBondContact O-CG2 3.4Å; T227-V231 PolarHBondContact O-N 3.13Å
228	V	98.1	Very high	95.8	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-64.2	-36.2	177.6	172.7	0	0	0	0	111.1	A208 V224 V231 R232 V239 Y245 L248	A208-V228 HydrophobicContact CB-CG2 4.23Å; V224-V228 HydrophobicContact CG1-CG2 4.23Å; V224-V228 WeakPolarHBondContact O-CB 3.39Å; V224-V228 VanDerWaalsContact O-CG2 3.28Å; V224-V228 WeakPolarHBondContact O-CG2 3.37Å; V224-V228 PolarHBondContact O-N 2.87Å; V228-V231 PolarHBondContact O-N 3.44Å; V228-R232 HydrophobicContact CG1-CG 4.37Å; V228-R232 WeakPolarHBondContact O-CB 3.37Å; V228-R232 VanDerWaalsContact O-CG 3.28Å; V228-R232 WeakPolarHBondContact O-CG 3.38Å; V228-R232 PolarHBondContact O-N 3.07Å; V228-V239 HydrophobicContact CG1-CB 4.01Å; V228-V239 HydrophobicContact CG1-CG2 4.06Å; V228-V239 HydrophobicContact CG2-CG2 4.09Å; V228-Y245 HydrophobicContact CB-CD2 4.39Å; V228-Y245 HydrophobicContact CB-CE2 4.03Å; V228-Y245 HydrophobicContact CG1-CD2 4.18Å; V228-Y245 HydrophobicContact CG1-CE2 4.16Å; V228-Y245 HydrophobicContact CG2-CD2 4Å; V228-Y245 HydrophobicContact CG2-CE2 3.87Å; V228-L248 HydrophobicContact CG2-CD1 3.4Å; V228-L248 VanDerWaalsContact CG2-CD1 3.4Å
229	T	98.1	Very high	96.1	Very high	65 Å²	65	46.4 Å²	46.4	40%	0.399	26%	0.256	S	S	.	.	H	α-helix	trans	-62.9	-45.3	176.1	-61.2	0	0	0	0	110.9	L225 A226 T227 R232 L233	L225-T229 VanDerWaalsContact O-CB 3.25Å; L225-T229 WeakPolarHBondContact O-CB 3.33Å; L225-T229 PolarHBondContact O-N 3.09Å; L225-T229 PolarHBondContact O-OG1 2.84Å; A226-T229 WeakPolarHBondContact O-CB 3.34Å; A226-T229 PolarHBondContact O-N 2.85Å; T227-T229 VanDerWaalsContact C-N 3.27Å; T227-T229 PolarHBondContact O-N 3.01Å; T229-R232 PolarHBondContact O-N 2.87Å; T229-L233 HydrophobicContact CG2-CD1 4.39Å; T229-L233 WeakPolarHBondContact O-CG 3.18Å; T229-L233 PolarHBondContact O-N 2.87Å
230	D	97.9	Very high	96.4	Very high	45 Å²	45	48 Å²	48	24%	0.241	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-47.4	177	-170	11.8	0	0	0	111.9	M53 A226 T227 R232 L233 Q234	M53-D230 HydrophobicContact CE-CB 4.13Å; A226-D230 PolarHBondContact O-N 3.47Å; T227-D230 PolarHBondContact O-N 2.88Å; D230-R232 VanDerWaalsContact C-N 3.29Å; D230-R232 PolarHBondContact O-N 3.08Å; D230-L233 WeakPolarHBondContact O-CB 3.01Å; D230-L233 PolarHBondContact O-N 2.72Å; D230-L233 VanDerWaalsContact O-N 3.13Å; D230-Q234 PolarHBondContact O-N 2.87Å; D230-Q234 PolarHBondContact OD1-NE2 3.32Å
231	V	98.3	Very high	96.5	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.9	-41.7	174.2	-177.8	0	0	0	0	111	V51 M53 L62 V207 A208 T227 V228 L233 Q234 R235	V51-V231 HydrophobicContact CG1-CG1 4.38Å; M53-V231 HydrophobicContact CE-CG2 3.99Å; M53-V231 HydrophobicContact SD-CG2 3.58Å; M53-V231 VanDerWaalsContact SD-CG2 3.58Å; L62-V231 HydrophobicContact CD2-CG1 4.46Å; V207-V231 HydrophobicContact CG1-CG2 4.36Å; A208-V231 HydrophobicContact CB-CG2 4.31Å; T227-V231 WeakPolarHBondContact O-CG2 3.4Å; T227-V231 PolarHBondContact O-N 3.13Å; V228-V231 PolarHBondContact O-N 3.44Å; V231-L233 VanDerWaalsContact C-N 3.33Å; V231-L233 PolarHBondContact O-N 3.27Å; V231-Q234 PolarHBondContact O-N 2.91Å; V231-Q234 VanDerWaalsContact O-N 3.1Å; V231-R235 PolarHBondContact O-N 3.18Å
232	R	98.3	Very high	96.7	Very high	109 Å²	109	42.1 Å²	42.1	41%	0.411	23%	0.233	S	C	.	.	H	α-helix	trans	-67.3	-31.1	178.3	-78.6	176.9	175.4	-175.8	-0.2	113.5	V228 T229 D230 Q234 R235 A236 S238 V239	V228-R232 HydrophobicContact CG1-CG 4.37Å; V228-R232 WeakPolarHBondContact O-CB 3.37Å; V228-R232 VanDerWaalsContact O-CG 3.28Å; V228-R232 WeakPolarHBondContact O-CG 3.38Å; V228-R232 PolarHBondContact O-N 3.07Å; T229-R232 PolarHBondContact O-N 2.87Å; D230-R232 VanDerWaalsContact C-N 3.29Å; D230-R232 PolarHBondContact O-N 3.08Å; R232-Q234 PolarHBondContact O-N 2.8Å; R232-R235 WeakPolarHBondContact CA-O 3.33Å; R232-R235 CarbonylContact O-C 3.5Å; R232-A236 WeakPolarHBondContact O-CA 3.5Å; R232-A236 PolarHBondContact O-N 3.01Å; R232-S238 VanDerWaalsContact CG-O 3.31Å; R232-S238 WeakPolarHBondContact CG-O 3.23Å; R232-S238 PolarHBondContact NE-O 3.38Å; R232-V239 PolarHBondContact NH2-O 3.33Å
233	L	98	Very high	96.7	Very high	85 Å²	85	46.9 Å²	46.9	45%	0.445	25%	0.254	S	S	.	.	H	α-helix	trans	-63.6	-35.6	172.3	-73.4	171.3	0	0	0	109.8	L29 R31 T229 D230 V231	L29-L233 WeakPolarHBondContact CD1-O 3.2Å; R31-L233 PolarHBondContact NE-O 3.43Å; R31-L233 VanDerWaalsContact NH2-CD2 3.31Å; R31-L233 PolarHBondContact NH2-O 2.65Å; T229-L233 HydrophobicContact CG2-CD1 4.39Å; T229-L233 WeakPolarHBondContact O-CG 3.18Å; T229-L233 PolarHBondContact O-N 2.87Å; D230-L233 WeakPolarHBondContact O-CB 3.01Å; D230-L233 PolarHBondContact O-N 2.72Å; D230-L233 VanDerWaalsContact O-N 3.13Å; V231-L233 VanDerWaalsContact C-N 3.33Å; V231-L233 PolarHBondContact O-N 3.27Å
234	Q	98.4	Very high	96.8	Very high	26 Å²	26	43.1 Å²	43.1	12%	0.121	23%	0.233	C	C	.	.	H	α-helix	trans	-93.4	-31.1	-175.2	-58.6	-178.5	62.3	0	0	113.4	T32 N49 V51 V52 D230 V231 R232	T32-Q234 HydrophobicContact CG2-CB 4.31Å; T32-Q234 HydrophobicContact CG2-CG 4.46Å; T32-Q234 PolarHBondContact OG1-O 2.8Å; N49-Q234 VanDerWaalsContact CB-O 3.25Å; N49-Q234 WeakPolarHBondContact CB-O 3.19Å; V51-Q234 HydrophobicContact CB-CB 4.3Å; V51-Q234 HydrophobicContact CG1-CB 4.19Å; V51-Q234 HydrophobicContact CG2-CB 3.89Å; V52-Q234 PolarHBondContact O-NE2 3.33Å; V52-Q234 PolarHBondContact O-OE1 2.93Å; D230-Q234 PolarHBondContact O-N 2.87Å; D230-Q234 PolarHBondContact OD1-NE2 3.32Å; V231-Q234 PolarHBondContact O-N 2.91Å; V231-Q234 VanDerWaalsContact O-N 3.1Å; R232-Q234 PolarHBondContact O-N 2.8Å
235	R	98.2	Very high	96.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-136.5	103.4	172.2	177.9	72.1	174.1	177.6	2	108.9	H47 N49 V51 L62 A198 G199 V200 V231 R232 S238	H47-R235 PolarHBondContact CE1-NH1 3.01Å; H47-R235 VanDerWaalsContact CE1-NH1 3.32Å; H47-R235 PolarHBondContact CE1-NH2 2.91Å; H47-R235 PolarHBondContact ND1-NH1 2.61Å; H47-R235 PolarHBondContact ND1-NH2 2.77Å; H47-R235 PolarHBondContact O-NH1 3.31Å; N49-R235 HydrophobicContact CB-CB 4.34Å; N49-R235 VanDerWaalsContact OD1-CD 3.23Å; N49-R235 WeakPolarHBondContact OD1-CD 3.2Å; N49-R235 PolarHBondContact OD1-NH1 3.26Å; V51-R235 HydrophobicContact CG2-CB 3.89Å; L62-R235 HydrophobicContact CB-CB 4.27Å; L62-R235 HydrophobicContact CB-CG 3.83Å; L62-R235 HydrophobicContact CD2-CB 4.1Å; L62-R235 HydrophobicContact CD2-CG 3.95Å; A198-R235 PolarHBondContact O-NH2 3.32Å; G199-R235 PolarHBondContact O-NE 3.17Å; G199-R235 VanDerWaalsContact O-NE 3.08Å; V200-R235 HydrophobicContact CG1-CG 4.35Å; V231-R235 PolarHBondContact O-N 3.18Å; R232-R235 WeakPolarHBondContact CA-O 3.33Å; R232-R235 CarbonylContact O-C 3.5Å; R235-S238 WeakPolarHBondContact CB-OG 3.49Å; R235-S238 WeakPolarHBondContact CG-OG 2.97Å; R235-S238 VanDerWaalsContact O-CB 3.29Å; R235-S238 WeakPolarHBondContact O-CB 3.49Å; R235-S238 PolarHBondContact O-N 2.71Å; R235-S238 PolarHBondContact O-OG 2.63Å
236	A	97.4	Very high	96.7	Very high	15 Å²	15	46 Å²	46	12%	0.124	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	145.5	-176.2	0	0	0	0	0	112.8	P27 L29 V200 R232 S238	P27-A236 HydrophobicContact CG-CB 3.71Å; L29-A236 HydrophobicContact CD1-CB 4.06Å; L29-A236 HydrophobicContact CD2-CB 3.98Å; L29-A236 HydrophobicContact CG-CB 3.94Å; V200-A236 VanDerWaalsContact CG1-O 3.32Å; V200-A236 WeakPolarHBondContact CG1-O 3.28Å; R232-A236 WeakPolarHBondContact O-CA 3.5Å; R232-A236 PolarHBondContact O-N 3.01Å; A236-S238 PolarHBondContact O-N 3.1Å; A236-S238 VanDerWaalsContact O-N 3.11Å
237	M	97.2	Very high	96.7	Very high	69 Å²	69	44.1 Å²	44.1	34%	0.34	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	13.3	179.7	-46.8	-164.5	-51.3	0	0	115.8	D25 I26	D25-M237 WeakPolarHBondContact O-CE 3.12Å; I26-M237 HydrophobicContact CB-CE 4.1Å; I26-M237 HydrophobicContact CD1-CE 3.16Å; I26-M237 HydrophobicContact CG1-CE 4.12Å; I26-M237 HydrophobicContact CG2-CE 4.04Å
238	S	98.2	Very high	96.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.225	C	C	.	.			trans	-54.2	140.4	170.6	-71.5	0	0	0	0	111.8	V200 R232 R235 A236	V200-S238 WeakPolarHBondContact O-CA 3.18Å; R232-S238 VanDerWaalsContact CG-O 3.31Å; R232-S238 WeakPolarHBondContact CG-O 3.23Å; R232-S238 PolarHBondContact NE-O 3.38Å; R235-S238 WeakPolarHBondContact CB-OG 3.49Å; R235-S238 WeakPolarHBondContact CG-OG 2.97Å; R235-S238 VanDerWaalsContact O-CB 3.29Å; R235-S238 WeakPolarHBondContact O-CB 3.49Å; R235-S238 PolarHBondContact O-N 2.71Å; R235-S238 PolarHBondContact O-OG 2.63Å; A236-S238 PolarHBondContact O-N 3.1Å; A236-S238 VanDerWaalsContact O-N 3.11Å
239	V	97	Very high	96.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	57.1	78.7	-169.5	-168.3	0	0	0	0	109.9	V200 A208 V228 R232 Q244 Y245 L248	V200-V239 PolarHBondContact O-N 2.82Å; V200-V239 VanDerWaalsContact O-N 3.15Å; A208-V239 HydrophobicContact CB-CG2 4.33Å; V228-V239 HydrophobicContact CG1-CB 4.01Å; V228-V239 HydrophobicContact CG1-CG2 4.06Å; V228-V239 HydrophobicContact CG2-CG2 4.09Å; R232-V239 PolarHBondContact NH2-O 3.33Å; V239-Q244 HydrophobicContact CG1-CB 3.87Å; V239-Y245 HydrophobicContact CG1-CD2 4.37Å; V239-L248 HydrophobicContact CG1-CD1 4.35Å; V239-L248 HydrophobicContact CG2-CD1 4.31Å
240	Q	94	Very high	96.4	Very high	92 Å²	92	50.8 Å²	50.8	43%	0.43	25%	0.246	S	C	.	.			trans	-78.7	-38.8	-162.1	-168.8	179.6	32.2	0	0	112.7
241	G	92.7	Very high	96.3	Very high	20 Å²	20	48.6 Å²	48.6	21%	0.206	23%	0.234	C	C	.	.	S	Bend	trans	-105.9	155.1	-175.3	0	0	0	0	0	113.8	E243 Q244 Y245	G241-E243 VanDerWaalsContact C-N 3.27Å; G241-E243 PolarHBondContact O-N 2.99Å; G241-Q244 WeakPolarHBondContact O-CB 3.47Å; G241-Q244 PolarHBondContact O-N 2.72Å; G241-Y245 PolarHBondContact O-N 2.87Å
242	P	94.2	Very high	96.2	Very high	88 Å²	88	48.6 Å²	48.6	57%	0.571	23%	0.234	S	C	*	.	H	α-helix	trans	-62	-33.9	175.7	25.8	-32.9	0	0	0	112.4	Q244 Y245 L246	P242-Q244 VanDerWaalsContact C-N 3.31Å; P242-Q244 PolarHBondContact O-N 2.9Å; P242-Y245 WeakPolarHBondContact O-CB 3.48Å; P242-Y245 PolarHBondContact O-N 3.33Å; P242-L246 WeakPolarHBondContact O-CG 3.22Å; P242-L246 PolarHBondContact O-N 2.9Å
243	E	94.1	Very high	96.1	Very high	112 Å²	112	43.9 Å²	43.9	52%	0.523	22%	0.219	S	C	.	.	H	α-helix	trans	-64.8	-37.3	177	-57.8	81.4	178.8	0	0	111.4	V163 G241 Y245 F247	V163-E243 HydrophobicContact CG1-CB 3.86Å; V163-E243 VanDerWaalsContact CG1-O 3.22Å; V163-E243 WeakPolarHBondContact CG1-O 3.44Å; G241-E243 VanDerWaalsContact C-N 3.27Å; G241-E243 PolarHBondContact O-N 2.99Å; E243-Y245 VanDerWaalsContact C-N 3.34Å; E243-F247 WeakPolarHBondContact O-CB 3.44Å; E243-F247 PolarHBondContact O-N 3.33Å
244	Q	95.6	Very high	95.9	Very high	12 Å²	12	41.2 Å²	41.2	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-38.6	175.2	-68.8	170.9	-6.9	0	0	111.4	G201 V239 G241 P242 F247 L248	G201-Q244 VanDerWaalsContact CA-OE1 3.32Å; V239-Q244 HydrophobicContact CG1-CB 3.87Å; G241-Q244 WeakPolarHBondContact O-CB 3.47Å; G241-Q244 PolarHBondContact O-N 2.72Å; P242-Q244 VanDerWaalsContact C-N 3.31Å; P242-Q244 PolarHBondContact O-N 2.9Å; Q244-F247 WeakPolarHBondContact O-CB 3.33Å; Q244-F247 PolarHBondContact O-N 3.15Å; Q244-L248 PolarHBondContact O-N 2.97Å
245	Y	96.2	Very high	95.8	Very high	55 Å²	55	40.2 Å²	40.2	22%	0.216	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-46.9	175.9	-171.3	-92.7	0	0	0	111.8	V224 L225 V228 V239 G241 P242 E243 F247 L248 Y249	V224-Y245 HydrophobicContact CG1-CE2 4.05Å; L225-Y245 VanDerWaalsContact CA-OH 3.31Å; L225-Y245 WeakPolarHBondContact CA-OH 3.4Å; L225-Y245 WeakPolarHBondContact CB-OH 3.19Å; V228-Y245 HydrophobicContact CB-CD2 4.39Å; V228-Y245 HydrophobicContact CB-CE2 4.03Å; V228-Y245 HydrophobicContact CG1-CD2 4.18Å; V228-Y245 HydrophobicContact CG1-CE2 4.16Å; V228-Y245 HydrophobicContact CG2-CD2 4Å; V228-Y245 HydrophobicContact CG2-CE2 3.87Å; V239-Y245 HydrophobicContact CG1-CD2 4.37Å; G241-Y245 PolarHBondContact O-N 2.87Å; P242-Y245 WeakPolarHBondContact O-CB 3.48Å; P242-Y245 PolarHBondContact O-N 3.33Å; E243-Y245 VanDerWaalsContact C-N 3.34Å; Y245-F247 VanDerWaalsContact C-N 3.28Å; Y245-F247 PolarHBondContact O-N 3.32Å; Y245-L248 WeakPolarHBondContact O-CB 3.5Å; Y245-L248 PolarHBondContact O-N 3.46Å; Y245-Y249 HydrophobicContact CD1-CE2 4.14Å; Y245-Y249 AromaticContact CE1-CE2 3.65Å; Y245-Y249 HydrophobicContact CE1-CE2 3.65Å
246	L	95.1	Very high	95.7	Very high	114 Å²	114	40.2 Å²	40.2	60%	0.597	20%	0.201	S	C	*	.	H	α-helix	trans	-64.1	-34.6	174.8	-69.5	174.8	0	0	0	112.2	P242 L248 Y249 Y250	P242-L246 WeakPolarHBondContact O-CG 3.22Å; P242-L246 PolarHBondContact O-N 2.9Å; L246-L248 PolarHBondContact O-N 2.58Å; L246-Y249 WeakPolarHBondContact O-CB 3.23Å; L246-Y249 PolarHBondContact O-N 3.33Å; L246-Y249 VanDerWaalsContact O-N 3.14Å; L246-Y250 PolarHBondContact O-N 3.33Å; L246-Y250 VanDerWaalsContact O-N 3.14Å
247	F	96	Very high	95.5	Very high	9 Å²	9	43.8 Å²	43.8	4%	0.039	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-31.5	175.7	176.3	-100.5	0	0	0	112.8	V163 P164 T167 F170 T205 E243 Q244 Y245 Y249 Y250 A251	V163-F247 HydrophobicContact CB-CB 4.06Å; V163-F247 HydrophobicContact CB-CD2 3.85Å; V163-F247 HydrophobicContact CB-CG 3.94Å; V163-F247 HydrophobicContact CG1-CB 3.57Å; V163-F247 HydrophobicContact CG1-CD2 4.31Å; V163-F247 HydrophobicContact CG1-CG 4.02Å; V163-F247 HydrophobicContact CG2-CD2 4.31Å; P164-F247 HydrophobicContact CB-CE2 4.39Å; P164-F247 HydrophobicContact CB-CZ 4.01Å; P164-F247 VanDerWaalsContact CD-CZ 3.47Å; P164-F247 HydrophobicContact CG-CD1 4.45Å; P164-F247 HydrophobicContact CG-CE1 3.65Å; P164-F247 HydrophobicContact CG-CE2 4.12Å; P164-F247 HydrophobicContact CG-CZ 3.46Å; P164-F247 VanDerWaalsContact CG-CZ 3.46Å; T167-F247 HydrophobicContact CG2-CE2 4.05Å; T167-F247 HydrophobicContact CG2-CZ 4.18Å; F170-F247 HydrophobicContact CB-CZ 4.5Å; F170-F247 AromaticContact CD1-CE1 3.59Å; F170-F247 HydrophobicContact CD1-CE1 3.59Å; F170-F247 AromaticContact CD1-CZ 3.74Å; F170-F247 HydrophobicContact CD1-CZ 3.74Å; F170-F247 AromaticContact CE1-CE1 3.76Å; F170-F247 HydrophobicContact CE1-CE1 3.76Å; F170-F247 HydrophobicContact CE1-CZ 4.38Å; F170-F247 HydrophobicContact CG-CE1 4.49Å; F170-F247 HydrophobicContact CG-CZ 4.36Å; T205-F247 HydrophobicContact CG2-CD1 4.01Å; E243-F247 WeakPolarHBondContact O-CB 3.44Å; E243-F247 PolarHBondContact O-N 3.33Å; Q244-F247 WeakPolarHBondContact O-CB 3.33Å; Q244-F247 PolarHBondContact O-N 3.15Å; Y245-F247 VanDerWaalsContact C-N 3.28Å; Y245-F247 PolarHBondContact O-N 3.32Å; F247-Y249 VanDerWaalsContact C-N 3.34Å; F247-Y249 PolarHBondContact O-N 3.03Å; F247-Y250 HydrophobicContact CD2-CD1 4.47Å; F247-Y250 HydrophobicContact CE2-CD1 4.49Å; F247-Y250 PolarHBondContact O-N 3.5Å; F247-A251 HydrophobicContact CD1-CB 4.45Å; F247-A251 HydrophobicContact CE1-CB 3.97Å; F247-A251 HydrophobicContact CE2-CB 4.33Å; F247-A251 HydrophobicContact CZ-CB 3.9Å; F247-A251 VanDerWaalsContact O-CB 3.29Å; F247-A251 WeakPolarHBondContact O-CB 3.36Å; F247-A251 PolarHBondContact O-N 3.2Å
248	L	97	Very high	95.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.5	-44.9	173.7	-67.1	171.7	0	0	0	111.4	T205 A208 L209 L212 V224 V228 V239 Q244 Y245 L246 L252	T205-L248 HydrophobicContact CG2-CD2 3.85Å; T205-L248 HydrophobicContact CG2-CG 4.3Å; T205-L248 WeakPolarHBondContact O-CD2 3.37Å; A208-L248 HydrophobicContact CB-CD1 3.95Å; A208-L248 HydrophobicContact CB-CD2 4.07Å; L209-L248 HydrophobicContact CB-CD2 3.86Å; L212-L248 HydrophobicContact CD1-CB 4.19Å; L212-L248 HydrophobicContact CD1-CD1 4.46Å; L212-L248 HydrophobicContact CD1-CD2 4.31Å; V224-L248 HydrophobicContact CG1-CB 3.98Å; V224-L248 HydrophobicContact CG1-CD1 3.94Å; V228-L248 HydrophobicContact CG2-CD1 3.4Å; V228-L248 VanDerWaalsContact CG2-CD1 3.4Å; V239-L248 HydrophobicContact CG1-CD1 4.35Å; V239-L248 HydrophobicContact CG2-CD1 4.31Å; Q244-L248 PolarHBondContact O-N 2.97Å; Y245-L248 WeakPolarHBondContact O-CB 3.5Å; Y245-L248 PolarHBondContact O-N 3.46Å; L246-L248 PolarHBondContact O-N 2.58Å; L248-L252 WeakPolarHBondContact O-CB 3.28Å; L248-L252 PolarHBondContact O-N 2.89Å
249	Y	95.7	Very high	95	Very high	74 Å²	74	49.5 Å²	49.5	29%	0.29	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-46	175.1	-72.8	-92.3	0	0	0	111.6	V224 Y245 L246 F247 L252 A253 I270	V224-Y249 HydrophobicContact CB-CD2 4.43Å; V224-Y249 HydrophobicContact CB-CE1 4.21Å; V224-Y249 HydrophobicContact CB-CE2 3.73Å; V224-Y249 HydrophobicContact CG1-CD2 4.12Å; V224-Y249 HydrophobicContact CG1-CE2 3.59Å; V224-Y249 HydrophobicContact CG2-CD1 4.07Å; V224-Y249 HydrophobicContact CG2-CD2 4.2Å; V224-Y249 HydrophobicContact CG2-CE1 3.76Å; V224-Y249 HydrophobicContact CG2-CE2 3.89Å; V224-Y249 HydrophobicContact CG2-CG 4.27Å; Y245-Y249 HydrophobicContact CD1-CE2 4.14Å; Y245-Y249 AromaticContact CE1-CE2 3.65Å; Y245-Y249 HydrophobicContact CE1-CE2 3.65Å; L246-Y249 WeakPolarHBondContact O-CB 3.23Å; L246-Y249 PolarHBondContact O-N 3.33Å; L246-Y249 VanDerWaalsContact O-N 3.14Å; F247-Y249 VanDerWaalsContact C-N 3.34Å; F247-Y249 PolarHBondContact O-N 3.03Å; Y249-L252 PolarHBondContact O-N 3.07Å; Y249-A253 WeakPolarHBondContact O-CB 3.45Å; Y249-A253 PolarHBondContact O-N 2.84Å; Y249-I270 HydrophobicContact CD1-CG2 3.79Å; Y249-I270 WeakPolarHBondContact CD1-O 3.39Å; Y249-I270 HydrophobicContact CE1-CG2 4.46Å
250	Y	95	Very high	94.7	Very high	141 Å²	141	51 Å²	51	55%	0.553	26%	0.257	S	S	*	.	H	α-helix	trans	-62.8	-51	-179.5	-177.1	-100.9	0	0	0	112	T167 L246 F247 L252 A253 V254	T167-Y250 HydrophobicContact CG2-CD1 4.01Å; T167-Y250 HydrophobicContact CG2-CE1 4Å; T167-Y250 WeakPolarHBondContact OG1-CE1 3.38Å; L246-Y250 PolarHBondContact O-N 3.33Å; L246-Y250 VanDerWaalsContact O-N 3.14Å; F247-Y250 HydrophobicContact CD2-CD1 4.47Å; F247-Y250 HydrophobicContact CE2-CD1 4.49Å; F247-Y250 PolarHBondContact O-N 3.5Å; Y250-L252 VanDerWaalsContact C-N 3.31Å; Y250-L252 PolarHBondContact O-N 2.7Å; Y250-A253 PolarHBondContact O-N 3.45Å; Y250-V254 HydrophobicContact CD1-CG2 4.39Å; Y250-V254 HydrophobicContact CE1-CG2 4.01Å; Y250-V254 WeakPolarHBondContact O-CG2 3.1Å; Y250-V254 PolarHBondContact O-N 3.23Å
251	A	96.7	Very high	94.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-39.6	179	0	0	0	0	0	111.8	T167 L209 F247 V254 H255	T167-A251 HydrophobicContact CG2-CB 3.92Å; L209-A251 HydrophobicContact CD1-CB 3.9Å; L209-A251 HydrophobicContact CD2-CB 4.03Å; F247-A251 HydrophobicContact CD1-CB 4.45Å; F247-A251 HydrophobicContact CE1-CB 3.97Å; F247-A251 HydrophobicContact CE2-CB 4.33Å; F247-A251 HydrophobicContact CZ-CB 3.9Å; F247-A251 VanDerWaalsContact O-CB 3.29Å; F247-A251 WeakPolarHBondContact O-CB 3.36Å; F247-A251 PolarHBondContact O-N 3.2Å; A251-V254 PolarHBondContact O-N 2.89Å; A251-H255 WeakPolarHBondContact O-CB 3.36Å; A251-H255 PolarHBondContact O-N 2.87Å
252	L	95.7	Very high	94.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.4	-40.5	176.9	-167.2	62.1	0	0	0	112.2	L212 M213 V216 P222 V224 L248 Y249 Y250 H255 I256 I270	L212-L252 HydrophobicContact CB-CD1 3.89Å; L212-L252 HydrophobicContact CB-CD2 4.07Å; L212-L252 HydrophobicContact CD1-CD2 4.5Å; L212-L252 HydrophobicContact CD2-CD2 4.36Å; M213-L252 HydrophobicContact CG-CD1 4.37Å; V216-L252 HydrophobicContact CB-CD1 4.47Å; V216-L252 HydrophobicContact CG2-CD1 3.73Å; V216-L252 HydrophobicContact CG2-CD2 4.46Å; V216-L252 HydrophobicContact CG2-CG 4.23Å; P222-L252 HydrophobicContact CB-CD2 3.78Å; P222-L252 HydrophobicContact CG-CD2 3.61Å; V224-L252 HydrophobicContact CG2-CD2 4.48Å; L248-L252 WeakPolarHBondContact O-CB 3.28Å; L248-L252 PolarHBondContact O-N 2.89Å; Y249-L252 PolarHBondContact O-N 3.07Å; Y250-L252 VanDerWaalsContact C-N 3.31Å; Y250-L252 PolarHBondContact O-N 2.7Å; L252-H255 WeakPolarHBondContact O-CB 3.47Å; L252-H255 PolarHBondContact O-N 3.1Å; L252-I256 HydrophobicContact CG-CD1 4.22Å; L252-I256 WeakPolarHBondContact O-CD1 3.36Å; L252-I256 VanDerWaalsContact O-CG1 3.28Å; L252-I256 WeakPolarHBondContact O-CG1 3.13Å; L252-I256 PolarHBondContact O-N 3.16Å; L252-I270 HydrophobicContact CD2-CD1 4.06Å; L252-I270 HydrophobicContact CD2-CG2 4.41Å; L252-I270 HydrophobicContact CG-CD1 4.3Å
253	A	94.8	Very high	93.8	Very high	10 Å²	10	63 Å²	63	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-43	174.1	0	0	0	0	0	111.7	Y249 Y250 I256 L257 L267 I271	Y249-A253 WeakPolarHBondContact O-CB 3.45Å; Y249-A253 PolarHBondContact O-N 2.84Å; Y250-A253 PolarHBondContact O-N 3.45Å; A253-I256 PolarHBondContact O-N 2.85Å; A253-L257 WeakPolarHBondContact O-CB 3.27Å; A253-L257 VanDerWaalsContact O-CG 3.26Å; A253-L257 WeakPolarHBondContact O-CG 3.46Å; A253-L257 PolarHBondContact O-N 2.9Å; A253-L267 HydrophobicContact CB-CD2 4.07Å; A253-I271 HydrophobicContact CB-CD1 4.13Å
254	V	95.5	Very high	93.3	Very high	29 Å²	29	64.9 Å²	64.9	18%	0.176	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-45.5	174.7	175.6	0	0	0	0	110.7	T167 L171 Y250 A251 I256 L257 L258	T167-V254 HydrophobicContact CG2-CB 4.34Å; T167-V254 HydrophobicContact CG2-CG2 4.27Å; L171-V254 HydrophobicContact CD1-CB 4.08Å; L171-V254 HydrophobicContact CD1-CG1 3.6Å; Y250-V254 HydrophobicContact CD1-CG2 4.39Å; Y250-V254 HydrophobicContact CE1-CG2 4.01Å; Y250-V254 WeakPolarHBondContact O-CG2 3.1Å; Y250-V254 PolarHBondContact O-N 3.23Å; A251-V254 PolarHBondContact O-N 2.89Å; V254-I256 PolarHBondContact O-N 2.83Å; V254-L257 PolarHBondContact O-N 2.84Å; V254-L258 HydrophobicContact CG1-CD1 3.87Å; V254-L258 HydrophobicContact CG1-CG 4.41Å; V254-L258 WeakPolarHBondContact O-CG 3.28Å; V254-L258 PolarHBondContact O-N 3.39Å
255	H	96	Very high	92.7	Very high	5 Å²	5	65.9 Å²	65.9	2%	0.023	32%	0.317	C	S	.	.	H	α-helix	trans	-56.6	-47.8	175.7	178.3	64.4	0	0	0	112	L171 M213 N217 A251 L252 L257 L258 N259	L171-H255 HydrophobicContact CD1-CB 4.45Å; L171-H255 HydrophobicContact CD2-CB 4.11Å; M213-H255 HydrophobicContact CG-CB 4.49Å; N217-H255 PolarHBondContact OD1-NE2 2.91Å; A251-H255 WeakPolarHBondContact O-CB 3.36Å; A251-H255 PolarHBondContact O-N 2.87Å; L252-H255 WeakPolarHBondContact O-CB 3.47Å; L252-H255 PolarHBondContact O-N 3.1Å; H255-L257 PolarHBondContact O-N 3.49Å; H255-L258 PolarHBondContact O-N 3.24Å; H255-N259 PolarHBondContact CE1-ND2 3.47Å; H255-N259 VanDerWaalsContact CE1-ND2 3.29Å; H255-N259 PolarHBondContact ND1-ND2 3.46Å; H255-N259 WeakPolarHBondContact O-CB 3.45Å; H255-N259 PolarHBondContact O-N 2.76Å; H255-N259 PolarHBondContact O-ND2 3.27Å
256	I	94.8	Very high	92.2	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-43.6	178.3	-71.7	163.4	0	0	0	111.7	V216 L252 A253 V254 L258 I260 R263 L266 L267 I270	V216-I256 HydrophobicContact CG1-CD1 4.17Å; V216-I256 HydrophobicContact CG1-CG1 3.51Å; V216-I256 HydrophobicContact CG2-CD1 4.03Å; V216-I256 HydrophobicContact CG2-CG1 4.24Å; L252-I256 HydrophobicContact CG-CD1 4.22Å; L252-I256 WeakPolarHBondContact O-CD1 3.36Å; L252-I256 VanDerWaalsContact O-CG1 3.28Å; L252-I256 WeakPolarHBondContact O-CG1 3.13Å; L252-I256 PolarHBondContact O-N 3.16Å; A253-I256 PolarHBondContact O-N 2.85Å; V254-I256 PolarHBondContact O-N 2.83Å; I256-L258 VanDerWaalsContact C-N 3.28Å; I256-L258 PolarHBondContact O-N 3.29Å; I256-I260 HydrophobicContact CB-CG1 4.45Å; I256-I260 HydrophobicContact CG1-CG1 4.35Å; I256-I260 HydrophobicContact CG2-CB 4.2Å; I256-I260 HydrophobicContact CG2-CG1 4.4Å; I256-I260 WeakPolarHBondContact O-CB 3.38Å; I256-I260 PolarHBondContact O-N 2.8Å; I256-R263 HydrophobicContact CG2-CB 3.52Å; I256-L266 HydrophobicContact CD1-CB 4.31Å; I256-L266 HydrophobicContact CG2-CB 4.46Å; I256-L267 HydrophobicContact CB-CD2 4.12Å; I256-L267 HydrophobicContact CG2-CD1 4.28Å; I256-L267 HydrophobicContact CG2-CD2 3.81Å; I256-L267 HydrophobicContact CG2-CG 3.71Å; I256-I270 HydrophobicContact CD1-CD1 3.09Å
257	L	93.7	Very high	91.7	Very high	90 Å²	90	60.3 Å²	60.3	47%	0.471	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-37.6	178.6	-75.9	165	0	0	0	112.4	A253 V254 H255 L267	A253-L257 WeakPolarHBondContact O-CB 3.27Å; A253-L257 VanDerWaalsContact O-CG 3.26Å; A253-L257 WeakPolarHBondContact O-CG 3.46Å; A253-L257 PolarHBondContact O-N 2.9Å; V254-L257 PolarHBondContact O-N 2.84Å; H255-L257 PolarHBondContact O-N 3.49Å; L257-L267 HydrophobicContact CD2-CD1 3.68Å; L257-L267 HydrophobicContact CG-CD1 4.12Å; L257-L267 HydrophobicContact CG-CD2 4.39Å
258	L	93.2	Very high	91.1	Very high	105 Å²	105	65.3 Å²	65.3	55%	0.55	31%	0.314	S	S	.	.	H	α-helix	trans	-81.9	-39.5	-177.7	-67	175.7	0	0	0	113.1	V254 H255 I256	V254-L258 HydrophobicContact CG1-CD1 3.87Å; V254-L258 HydrophobicContact CG1-CG 4.41Å; V254-L258 WeakPolarHBondContact O-CG 3.28Å; V254-L258 PolarHBondContact O-N 3.39Å; H255-L258 PolarHBondContact O-N 3.24Å; I256-L258 VanDerWaalsContact C-N 3.28Å; I256-L258 PolarHBondContact O-N 3.29Å
259	N	92.8	Very high	90.4	Very high	83 Å²	83	70.9 Å²	70.9	44%	0.444	34%	0.338	S	S	.	.	H	α-helix	trans	-113.5	-17	-163.6	-66.2	-57.1	0	0	0	114.6	H255	H255-N259 PolarHBondContact CE1-ND2 3.47Å; H255-N259 VanDerWaalsContact CE1-ND2 3.29Å; H255-N259 PolarHBondContact ND1-ND2 3.46Å; H255-N259 WeakPolarHBondContact O-CB 3.45Å; H255-N259 PolarHBondContact O-N 2.76Å; H255-N259 PolarHBondContact O-ND2 3.27Å
260	I	90.4	Very high	89.8	Confident	33 Å²	33	67.7 Å²	67.7	17%	0.169	33%	0.326	C	S	.	.			trans	-108.1	123.6	-175.1	-51.9	-61.5	0	0	0	111	V216 I256 R263 L266	V216-I260 HydrophobicContact CG1-CD1 3.93Å; V216-I260 HydrophobicContact CG1-CG1 3.75Å; I256-I260 HydrophobicContact CB-CG1 4.45Å; I256-I260 HydrophobicContact CG1-CG1 4.35Å; I256-I260 HydrophobicContact CG2-CB 4.2Å; I256-I260 HydrophobicContact CG2-CG1 4.4Å; I256-I260 WeakPolarHBondContact O-CB 3.38Å; I256-I260 PolarHBondContact O-N 2.8Å; I260-R263 HydrophobicContact CB-CB 4.4Å; I260-R263 HydrophobicContact CG2-CB 4.5Å; I260-R263 WeakPolarHBondContact O-CB 3.15Å; I260-L266 HydrophobicContact CG2-CD1 4.07Å
261	K	87.3	Confident	88.9	Confident	203 Å²	203	64.4 Å²	64.4	88%	0.883	32%	0.318	S	S	*	.	S	Bend	trans	-68.9	-53.9	179.4	-70.2	-176.6	178.7	178.5	0	111.7	R263	K261-R263 VanDerWaalsContact C-N 3.27Å; K261-R263 PolarHBondContact O-N 3.03Å; K261-R263 VanDerWaalsContact O-N 3.12Å
262	D	86.4	Confident	87.2	Confident	136 Å²	136	69.8 Å²	69.8	73%	0.727	35%	0.352	S	S	*	.	S	Bend	trans	-89.1	62.4	177.7	-168.8	14	0	0	0	111.9
263	R	87.6	Confident	85.2	Confident	112 Å²	112	75.7 Å²	75.7	42%	0.423	38%	0.383	S	S	.	.	H	α-helix	trans	-81	-19.1	-170.4	52.3	178.1	-177.8	-96.3	-1	115.2	I256 I260 K261 G265 L266 L267	I256-R263 HydrophobicContact CG2-CB 3.52Å; I260-R263 HydrophobicContact CB-CB 4.4Å; I260-R263 HydrophobicContact CG2-CB 4.5Å; I260-R263 WeakPolarHBondContact O-CB 3.15Å; K261-R263 VanDerWaalsContact C-N 3.27Å; K261-R263 PolarHBondContact O-N 3.03Å; K261-R263 VanDerWaalsContact O-N 3.12Å; R263-G265 PolarHBondContact O-N 3.22Å; R263-L266 PolarHBondContact O-N 3.01Å; R263-L267 HydrophobicContact CB-CD1 4.06Å; R263-L267 HydrophobicContact CB-CG 4.48Å; R263-L267 HydrophobicContact CG-CD1 4.24Å; R263-L267 WeakPolarHBondContact O-CB 3.25Å; R263-L267 WeakPolarHBondContact O-CG 3.39Å; R263-L267 PolarHBondContact O-N 2.78Å
264	K	83.2	Confident	83	Confident	151 Å²	151	82.5 Å²	82.5	66%	0.657	41%	0.413	S	S	*	.	H	α-helix	trans	-63	-45.4	-166.9	-170.1	179.1	179.3	-176.7	0	111.9	Q268	K264-Q268 WeakPolarHBondContact O-CG 3.33Å; K264-Q268 PolarHBondContact O-N 3.12Å
265	G	84.1	Confident	81	Confident	34 Å²	34	86 Å²	86	35%	0.351	44%	0.437	S	S	.	.	H	α-helix	trans	-65	-44.5	178.7	0	0	0	0	0	112.7	R263 Q268 K269	R263-G265 PolarHBondContact O-N 3.22Å; G265-Q268 PolarHBondContact O-N 3.05Å; G265-K269 WeakPolarHBondContact O-CD 3.38Å; G265-K269 WeakPolarHBondContact O-CG 3.5Å; G265-K269 PolarHBondContact O-N 3.37Å
266	L	85	Confident	78.7	Confident	22 Å²	22	90.6 Å²	90.6	12%	0.115	47%	0.47	C	S	.	.	H	α-helix	trans	-64.3	-43.6	178.3	-73.1	169.9	0	0	0	112.3	I256 I260 R263 Q268 K269 I270	I256-L266 HydrophobicContact CD1-CB 4.31Å; I256-L266 HydrophobicContact CG2-CB 4.46Å; I260-L266 HydrophobicContact CG2-CD1 4.07Å; R263-L266 PolarHBondContact O-N 3.01Å; L266-Q268 VanDerWaalsContact C-N 3.33Å; L266-Q268 PolarHBondContact O-N 2.83Å; L266-K269 PolarHBondContact O-N 2.95Å; L266-I270 WeakPolarHBondContact O-CD1 3.38Å; L266-I270 WeakPolarHBondContact O-CG1 3.48Å; L266-I270 PolarHBondContact O-N 3.01Å; L266-I270 VanDerWaalsContact O-N 3.09Å
267	L	85.4	Confident	76.3	Confident	29 Å²	29	99.1 Å²	99.1	15%	0.152	51%	0.507	C	S	.	.	H	α-helix	trans	-63	-38.8	178.4	-72.7	169.8	0	0	0	112.4	A253 I256 L257 R263 K269 I270 I271	A253-L267 HydrophobicContact CB-CD2 4.07Å; I256-L267 HydrophobicContact CB-CD2 4.12Å; I256-L267 HydrophobicContact CG2-CD1 4.28Å; I256-L267 HydrophobicContact CG2-CD2 3.81Å; I256-L267 HydrophobicContact CG2-CG 3.71Å; L257-L267 HydrophobicContact CD2-CD1 3.68Å; L257-L267 HydrophobicContact CG-CD1 4.12Å; L257-L267 HydrophobicContact CG-CD2 4.39Å; R263-L267 HydrophobicContact CB-CD1 4.06Å; R263-L267 HydrophobicContact CB-CG 4.48Å; R263-L267 HydrophobicContact CG-CD1 4.24Å; R263-L267 WeakPolarHBondContact O-CB 3.25Å; R263-L267 WeakPolarHBondContact O-CG 3.39Å; R263-L267 PolarHBondContact O-N 2.78Å; L267-K269 VanDerWaalsContact C-N 3.27Å; L267-K269 PolarHBondContact O-N 3.24Å; L267-I270 PolarHBondContact O-N 3.26Å; L267-I271 HydrophobicContact CD2-CD1 4.35Å; L267-I271 WeakPolarHBondContact O-CB 2.91Å; L267-I271 PolarHBondContact O-N 3.48Å
268	Q	83.7	Confident	73.9	Confident	114 Å²	114	102.7 Å²	102.7	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-29.4	176.4	-75.8	176.4	-18	0	0	113.2	K264 G265 L266 I271	K264-Q268 WeakPolarHBondContact O-CG 3.33Å; K264-Q268 PolarHBondContact O-N 3.12Å; G265-Q268 PolarHBondContact O-N 3.05Å; L266-Q268 VanDerWaalsContact C-N 3.33Å; L266-Q268 PolarHBondContact O-N 2.83Å; Q268-I271 VanDerWaalsContact O-O 3.06Å
269	K	82.1	Confident	71.4	Confident	117 Å²	117	107.4 Å²	107.4	51%	0.509	53%	0.531	S	S	.	.	H	α-helix	trans	-78.6	-37	178.1	-71.5	164.6	162.1	-149.7	0	112.4	E221 G265 L266 L267	E221-K269 HydrophobicContact CG-CB 4.36Å; E221-K269 HydrophobicContact CG-CD 4.11Å; E221-K269 VanDerWaalsContact OE2-CD 3.28Å; E221-K269 WeakPolarHBondContact OE2-CD 3.47Å; E221-K269 VanDerWaalsContact OE2-CE 3.25Å; E221-K269 WeakPolarHBondContact OE2-CE 3.28Å; E221-K269 IonicContact OE2-NZ 3.56Å; E221-K269 PolarHBondContact OE2-NZ 3.32Å; G265-K269 WeakPolarHBondContact O-CD 3.38Å; G265-K269 WeakPolarHBondContact O-CG 3.5Å; G265-K269 PolarHBondContact O-N 3.37Å; L266-K269 PolarHBondContact O-N 2.95Å; L267-K269 VanDerWaalsContact C-N 3.27Å; L267-K269 PolarHBondContact O-N 3.24Å
270	I	81.9	Confident	68.8	Low	7 Å²	7	109.5 Å²	109.5	4%	0.036	54%	0.541	C	S	.	.	H	α-helix	trans	-85	-39.4	-175.2	-64.8	162.9	0	0	0	111.9	P222 Y249 L252 I256 L266 L267 P272	P222-I270 HydrophobicContact CG-CD1 3.41Å; P222-I270 VanDerWaalsContact CG-CD1 3.41Å; P222-I270 HydrophobicContact CG-CG1 3.69Å; Y249-I270 HydrophobicContact CD1-CG2 3.79Å; Y249-I270 WeakPolarHBondContact CD1-O 3.39Å; Y249-I270 HydrophobicContact CE1-CG2 4.46Å; L252-I270 HydrophobicContact CD2-CD1 4.06Å; L252-I270 HydrophobicContact CD2-CG2 4.41Å; L252-I270 HydrophobicContact CG-CD1 4.3Å; I256-I270 HydrophobicContact CD1-CD1 3.09Å; L266-I270 WeakPolarHBondContact O-CD1 3.38Å; L266-I270 WeakPolarHBondContact O-CG1 3.48Å; L266-I270 PolarHBondContact O-N 3.01Å; L266-I270 VanDerWaalsContact O-N 3.09Å; L267-I270 PolarHBondContact O-N 3.26Å; I270-P272 WeakPolarHBondContact O-CD 3.3Å
271	I	76	Confident	66.4	Low	72 Å²	72	116.1 Å²	116.1	37%	0.369	57%	0.569	S	S	.	*	S	Bend	trans	-96.8	103.9	174.1	-58.3	164.1	0	0	0	104.8	A253 L267 Q268 L273	A253-I271 HydrophobicContact CB-CD1 4.13Å; L267-I271 HydrophobicContact CD2-CD1 4.35Å; L267-I271 WeakPolarHBondContact O-CB 2.91Å; L267-I271 PolarHBondContact O-N 3.48Å; Q268-I271 VanDerWaalsContact O-O 3.06Å; I271-L273 HydrophobicContact CG2-CD2 4.02Å; I271-L273 HydrophobicContact CG2-CG 4.05Å; I271-L273 PolarHBondContact O-N 2.77Å
272	P	61.3	Low	64	Low	113 Å²	113	111.6 Å²	111.6	73%	0.734	56%	0.559	S	S	*	*			trans	-66.1	84.4	169	27.5	-31.8	0	0	0	106.9	I270 H274	I270-P272 WeakPolarHBondContact O-CD 3.3Å; P272-H274 PolarHBondContact O-N 2.83Å
273	L	53.3	Low	61.7	Low	124 Å²	124	111.1 Å²	111.1	65%	0.649	56%	0.556	S	S	*	*			trans	-63.1	97.6	160	-68.7	172.6	0	0	0	102.9	I271 P275	I271-L273 HydrophobicContact CG2-CD2 4.02Å; I271-L273 HydrophobicContact CG2-CG 4.05Å; I271-L273 PolarHBondContact O-N 2.77Å; L273-P275 VanDerWaalsContact O-CD 3.29Å; L273-P275 WeakPolarHBondContact O-CD 3.38Å
274	H	50.3	Low	59.7	Low	153 Å²	153	111.7 Å²	111.7	71%	0.708	57%	0.574	S	S	*	*			trans	-48.6	118.3	165.2	-150.5	-10.1	0	0	0	103.8	P272 S276	P272-H274 PolarHBondContact O-N 2.83Å; H274-S276 PolarHBondContact O-N 3Å
275	P	51.5	Low	57.6	Low	104 Å²	104	111.4 Å²	111.4	68%	0.675	58%	0.575	S	S	*	*			trans	-51.1	116.4	174.6	17.8	-29.3	0	0	0	103.4	L273 K277	L273-P275 VanDerWaalsContact O-CD 3.29Å; L273-P275 WeakPolarHBondContact O-CD 3.38Å; P275-K277 VanDerWaalsContact C-N 3.31Å; P275-K277 PolarHBondContact O-N 3.34Å
276	S	47.7	Very low	55.2	Low	101 Å²	101	118.2 Å²	118.2	71%	0.706	60%	0.6	S	S	*	*			trans	-44.1	111.1	177.9	45.1	0	0	0	0	103.1	H274 E278	H274-S276 PolarHBondContact O-N 3Å; S276-E278 PolarHBondContact O-N 2.96Å
277	K	45	Very low	52.9	Low	179 Å²	179	122.9 Å²	122.9	78%	0.778	64%	0.635	S	S	*	*			trans	-49.3	107.1	169.3	-83.2	-175.7	175.3	-178.5	0	101.3	P275 R279	P275-K277 VanDerWaalsContact C-N 3.31Å; P275-K277 PolarHBondContact O-N 3.34Å; K277-R279 PolarHBondContact O-N 2.9Å
278	E	43.7	Very low	50.5	Low	164 Å²	164	125.5 Å²	125.5	77%	0.766	67%	0.668	S	S	*	*			trans	-47.8	109.6	170.5	-77.4	175.8	157.6	0	0	100.6	S276 I280	S276-E278 PolarHBondContact O-N 2.96Å; E278-I280 PolarHBondContact O-N 3.46Å
279	R	39.6	Very low	48	Very low	204 Å²	204	126.3 Å²	126.3	77%	0.77	69%	0.685	S	S	*	*			trans	-65.9	94.2	170.4	-75.8	-172.9	-161.6	-169.8	7.2	100.3	K277 F281	K277-R279 PolarHBondContact O-N 2.9Å; R279-F281 HydrophobicContact CB-CD2 3.63Å; R279-F281 HydrophobicContact CB-CE2 3.64Å; R279-F281 HydrophobicContact CG-CE2 4.29Å; R279-F281 PolarHBondContact O-N 3.02Å
280	I	39.9	Very low	45.7	Very low	128 Å²	128	129.7 Å²	129.7	66%	0.656	70%	0.7	S	S	*	*			trans	-58.4	78.4	161.3	-61.8	173.4	0	0	0	102.6	E278 T282	E278-I280 PolarHBondContact O-N 3.46Å; I280-T282 HydrophobicContact CG2-CG2 3.3Å; I280-T282 WeakPolarHBondContact CG2-OG1 3.15Å; I280-T282 PolarHBondContact O-N 3.1Å
281	F	38.4	Very low	43.4	Very low	171 Å²	171	134.7 Å²	134.7	75%	0.75	74%	0.735	S	S	*	*			trans	-74.1	66.7	152	-75.3	-77.6	0	0	0	104.3	R279 D283	R279-F281 HydrophobicContact CB-CD2 3.63Å; R279-F281 HydrophobicContact CB-CE2 3.64Å; R279-F281 HydrophobicContact CG-CE2 4.29Å; R279-F281 PolarHBondContact O-N 3.02Å; F281-D283 VanDerWaalsContact C-N 3.28Å; F281-D283 PolarHBondContact O-N 3.38Å; F281-D283 VanDerWaalsContact O-N 3.11Å
282	T	38.3	Very low	41.4	Very low	109 Å²	109	136.8 Å²	136.8	67%	0.669	76%	0.757	S	S	*	*			trans	-70.3	103.2	156.2	44.4	0	0	0	0	104.6	I280	I280-T282 HydrophobicContact CG2-CG2 3.3Å; I280-T282 WeakPolarHBondContact CG2-OG1 3.15Å; I280-T282 PolarHBondContact O-N 3.1Å
283	D	37.3	Very low	40	Very low	125 Å²	125	136.5 Å²	136.5	67%	0.668	76%	0.757	S	S	*	*			trans	-40.1	119.4	167.9	-155.2	-9.1	0	0	0	109.4	F281 Q285	F281-D283 VanDerWaalsContact C-N 3.28Å; F281-D283 PolarHBondContact O-N 3.38Å; F281-D283 VanDerWaalsContact O-N 3.11Å; D283-Q285 PolarHBondContact O-N 2.62Å
284	P	45.7	Very low	39.1	Very low	125 Å²	125	137.4 Å²	137.4	81%	0.812	76%	0.763	S	S	*	*			trans	-79.5	71.8	179.9	32.7	-31.7	0	0	0	108.2
285	Q	39.5	Very low	38.3	Very low	144 Å²	144	137.9 Å²	137.9	67%	0.673	77%	0.77	S	S	*	*			trans	-124.3	119	167.2	-72.2	-157.5	8.3	0	0	110.4	D283	D283-Q285 PolarHBondContact O-N 2.62Å
286	M	33.9	Very low	37.5	Very low	177 Å²	177	141.6 Å²	141.6	87%	0.872	78%	0.776	S	S	*	*			trans	77.2	76.8	154.8	-55.7	-152.7	-91.5	0	0	116.9
287	S	36.1	Very low	36.9	Very low	121 Å²	121	141.7 Å²	141.7	85%	0.846	77%	0.772	S	S	*	*			trans	-133	109	133.1	57	0	0	0	0	108.7	C289	S287-C289 PolarHBondContact O-N 2.74Å
288	G	34.4	Very low	36.4	Very low	83 Å²	83	141 Å²	141	86%	0.856	78%	0.775	S	S	*	*			trans	-63	124.2	-177.7	0	0	0	0	0	111.1
289	C	31.8	Very low	36	Very low	132 Å²	132	140 Å²	140	89%	0.892	77%	0.771	S	S	*	*			trans	-112.4	103.5	157.9	-148.3	0	0	0	0	107.2	S287	S287-C289 PolarHBondContact O-N 2.74Å
290	K	34.4	Very low	36.2	Very low	188 Å²	188	135.5 Å²	135.5	82%	0.817	77%	0.768	S	S	*	*			trans	-63	141.3	172.2	-73.9	176.9	173.2	178.4	0	109.3
291	S	32.4	Very low	35.8	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	78%	0.775	S	S	*	*			trans	53.1	107.2	144.3	63.8	0	0	0	0	118.2
292	S	34.5	Very low	36.1	Very low	117 Å²	117	140.7 Å²	140.7	82%	0.818	80%	0.8	S	S	*	*				-167.8	115	116.1	52.7	0	0	0	0	109.6
293	S	33.3	Very low	36	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	81%	0.806	S	S	*	*			trans	-41.4	129.5	163	44.9	0	0	0	0	113
294	N	34.1	Very low	35.9	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	81%	0.814	S	S	*	*			trans	-158	89.4	140.8	-93	-22.6	0	0	0	108	F296	N294-F296 HydrophobicContact CB-CD2 4.43Å; N294-F296 HydrophobicContact CB-CE2 4.33Å; N294-F296 PolarHBondContact O-N 2.7Å; N294-F296 VanDerWaalsContact O-N 3.17Å
295	L	32.7	Very low	35.4	Very low	162 Å²	162	144.2 Å²	144.2	85%	0.848	81%	0.814	S	S	*	*			trans	-75.2	91	175.2	-150.3	90	0	0	0	107.4	V297	L295-V297 HydrophobicContact CD2-CG2 3.86Å; L295-V297 HydrophobicContact CG-CG2 4.35Å; L295-V297 PolarHBondContact O-N 3.3Å
296	F	33.9	Very low	35.1	Very low	183 Å²	183	144.2 Å²	144.2	80%	0.803	82%	0.822	S	S	*	*			trans	-81.4	93.8	166.3	-83.8	-83.1	0	0	0	108.4	N294 L298	N294-F296 HydrophobicContact CB-CD2 4.43Å; N294-F296 HydrophobicContact CB-CE2 4.33Å; N294-F296 PolarHBondContact O-N 2.7Å; N294-F296 VanDerWaalsContact O-N 3.17Å; F296-L298 PolarHBondContact O-N 2.85Å
297	V	36.2	Very low	35.2	Very low	102 Å²	102	142.2 Å²	142.2	62%	0.618	82%	0.819	S	S	*	*			trans	-67.6	109.2	167.8	178.4	0	0	0	0	107.5	L295 E299	L295-V297 HydrophobicContact CD2-CG2 3.86Å; L295-V297 HydrophobicContact CG-CG2 4.35Å; L295-V297 PolarHBondContact O-N 3.3Å; V297-E299 HydrophobicContact CG1-CG 4.15Å; V297-E299 PolarHBondContact O-N 3.13Å
298	L	34.6	Very low	35.2	Very low	164 Å²	164	143.6 Å²	143.6	86%	0.859	82%	0.817	S	S	*	*			trans	-81	95.4	164.7	-68.9	173	0	0	0	107.2	F296	F296-L298 PolarHBondContact O-N 2.85Å
299	E	34.8	Very low	35.2	Very low	144 Å²	144	147.9 Å²	147.9	67%	0.673	81%	0.814	S	S	*	*			trans	-68.9	134.8	163.6	-77.6	-161.5	180	0	0	109.9	V297 R301	V297-E299 HydrophobicContact CG1-CG 4.15Å; V297-E299 PolarHBondContact O-N 3.13Å; E299-R301 IonicContact OE2-NH2 3.47Å
300	P	43.6	Very low	35.5	Very low	110 Å²	110	149.2 Å²	149.2	71%	0.714	81%	0.808	S	S	*	*			trans	-87.4	138.5	168.9	34	-28.4	0	0	0	109.4
301	R	32.1	Very low	35.6	Very low	213 Å²	213	145.9 Å²	145.9	80%	0.804	81%	0.808	S	S	*	*			trans	176.8	156	154.8	-104.8	176	-80	-161.7	5.5	111.8	E299	E299-R301 IonicContact OE2-NH2 3.47Å
302	P	44.8	Very low	35.9	Very low	195 Å²	195	149.1 Å²	149.1	100%	1.266	81%	0.811	S	S	*	*			cis	-107.9	0	-15.7	36.6	-23.9	0	0	0	113.1

Retrieved 302 of 302 residues in 91.6 ms (Link to these results)

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