A0A3Q0KMV0_SCHMA Loading...

Protein BCCIP homolog AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KMV0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 267 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.7	Very low	41.3	Very low	238 Å²	238	154.3 Å²	154.3	100%	1.172	82%	0.821	S	S	*	*				0	124.8	0	-77.3	175.6	140.2	0	0	108.2
2	P	40.6	Very low	41.3	Very low	127 Å²	127	154.3 Å²	154.3	83%	0.825	82%	0.822	S	S	*	*			trans	-82.4	134.1	-167.6	32.3	-30.5	0	0	0	111.4	K4	P2-K4 PolarHBondContact O-N 3.14Å
3	K	42.2	Very low	41.4	Very low	203 Å²	203	150.5 Å²	150.5	88%	0.883	81%	0.808	S	S	*	*			trans	-67	114	171.9	-71.1	176.9	173.4	-179.7	0	108.8	V5	K3-V5 PolarHBondContact O-N 2.96Å
4	K	44.9	Very low	41.6	Very low	213 Å²	213	146.7 Å²	146.7	93%	0.926	80%	0.799	S	S	*	*			trans	-78.1	109.8	168.9	-98.1	-178	173.8	-179.3	0	108.5	P2	P2-K4 PolarHBondContact O-N 3.14Å
5	V	41.9	Very low	42.5	Very low	134 Å²	134	149.5 Å²	149.5	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.5	120.2	167.7	178.1	0	0	0	0	107.1	K3 K7	K3-V5 PolarHBondContact O-N 2.96Å; V5-K7 PolarHBondContact O-N 2.85Å
6	A	42.6	Very low	43.3	Very low	85 Å²	85	151.6 Å²	151.6	70%	0.702	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-67.9	119.1	170.6	0	0	0	0	0	108.3	V8	A6-V8 PolarHBondContact O-N 2.75Å
7	K	36.9	Very low	44.4	Very low	184 Å²	184	151.1 Å²	151.1	80%	0.8	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-62.2	120.2	164.5	-84.4	178.6	169.6	-175.7	0	107.3	V5 D9	V5-K7 PolarHBondContact O-N 2.85Å; K7-D9 PolarHBondContact O-N 2.68Å
8	V	40.2	Very low	45.5	Very low	129 Å²	129	152 Å²	152	78%	0.782	80%	0.796	S	S	*	*			trans	-77.2	94.9	163.2	-180	0	0	0	0	105.3	A6 N10	A6-V8 PolarHBondContact O-N 2.75Å; V8-N10 PolarHBondContact O-N 3.19Å
9	D	41.4	Very low	46.9	Very low	127 Å²	127	151.6 Å²	151.6	68%	0.679	80%	0.795	S	S	*	*			trans	-72.2	106.4	165.2	-76.1	-27.8	0	0	0	106.7	K7 V11	K7-D9 PolarHBondContact O-N 2.68Å; D9-V11 HydrophobicContact CB-CG2 4.38Å; D9-V11 PolarHBondContact O-N 3.16Å
10	N	35.1	Very low	48.5	Very low	150 Å²	150	146.8 Å²	146.8	80%	0.802	77%	0.769	S	S	*	*			trans	-74.8	80	175.7	-153.7	35.6	0	0	0	107.5	V8 D12	V8-N10 PolarHBondContact O-N 3.19Å; N10-D12 PolarHBondContact O-N 3.14Å
11	V	45.4	Very low	50.3	Low	107 Å²	107	146.8 Å²	146.8	65%	0.648	77%	0.765	S	S	*	*			trans	-85.2	100.1	170.7	-173.1	0	0	0	0	106.5	D9 T13	D9-V11 HydrophobicContact CB-CG2 4.38Å; D9-V11 PolarHBondContact O-N 3.16Å; V11-T13 PolarHBondContact O-N 2.88Å; V11-T13 PolarHBondContact O-OG1 3.09Å
12	D	41.4	Very low	52.4	Low	155 Å²	155	137.6 Å²	137.6	83%	0.829	72%	0.721	S	S	*	*			trans	-58	85.1	160.8	-106.8	-27.4	0	0	0	107.2	N10 S14	N10-D12 PolarHBondContact O-N 3.14Å; D12-S14 VanDerWaalsContact C-N 3.31Å; D12-S14 PolarHBondContact O-N 2.78Å
13	T	42.6	Very low	54.8	Low	105 Å²	105	136.4 Å²	136.4	64%	0.644	70%	0.704	S	S	*	*			trans	-84.8	89.4	169.9	-37.6	0	0	0	0	103.9	V11 K15	V11-T13 PolarHBondContact O-N 2.88Å; V11-T13 PolarHBondContact O-OG1 3.09Å; T13-K15 VanDerWaalsContact C-N 3.3Å; T13-K15 PolarHBondContact O-N 2.73Å
14	S	44	Very low	57.2	Low	97 Å²	97	128.8 Å²	128.8	68%	0.678	68%	0.683	S	S	*	*			trans	-53	104.4	162	48.1	0	0	0	0	106	D12 E16	D12-S14 VanDerWaalsContact C-N 3.31Å; D12-S14 PolarHBondContact O-N 2.78Å; S14-E16 VanDerWaalsContact C-N 3.34Å; S14-E16 PolarHBondContact O-N 3.01Å
15	K	54.3	Low	59.4	Low	188 Å²	188	121.7 Å²	121.7	82%	0.817	65%	0.652	S	S	*	*			trans	-58.8	104	172.8	-71.1	-177.3	176.9	-173.9	0	105.6	T13 I17	T13-K15 VanDerWaalsContact C-N 3.3Å; T13-K15 PolarHBondContact O-N 2.73Å; K15-I17 PolarHBondContact O-N 2.87Å
16	E	55.6	Low	61.8	Low	184 Å²	184	120 Å²	120	86%	0.86	64%	0.644	S	S	*	*			trans	-60.4	109.2	170.2	-75.3	-178.4	165.9	0	0	106.2	S14 F18	S14-E16 VanDerWaalsContact C-N 3.34Å; S14-E16 PolarHBondContact O-N 3.01Å; E16-F18 PolarHBondContact O-N 2.86Å
17	I	61.4	Low	64.3	Low	142 Å²	142	116.6 Å²	116.6	73%	0.728	62%	0.615	S	S	*	*			trans	-80.2	104.2	174.3	-60.3	174.4	0	0	0	105.1	K15 N19	K15-I17 PolarHBondContact O-N 2.87Å; I17-N19 WeakPolarHBondContact CG2-OD1 3.35Å
18	F	65.1	Low	67	Low	168 Å²	168	112 Å²	112	74%	0.737	60%	0.599	S	S	*	*			trans	-82.9	112.7	171.5	-166.3	-105.6	0	0	0	108.2	E16 L20	E16-F18 PolarHBondContact O-N 2.86Å; F18-L20 HydrophobicContact CD1-CB 3.91Å; F18-L20 HydrophobicContact CE1-CB 3.89Å; F18-L20 HydrophobicContact CE1-CD1 3.73Å; F18-L20 HydrophobicContact CE1-CD2 4.41Å; F18-L20 HydrophobicContact CE1-CG 4.23Å; F18-L20 HydrophobicContact CZ-CD1 4.49Å; F18-L20 PolarHBondContact O-N 2.92Å
19	N	72	Confident	69.5	Low	144 Å²	144	110.8 Å²	110.8	77%	0.77	59%	0.587	S	S	*	*			trans	-88.1	104.4	174.2	-69.5	-26.5	0	0	0	107.4	I17	I17-N19 WeakPolarHBondContact CG2-OD1 3.35Å
20	L	78.9	Confident	72	Confident	55 Å²	55	107.6 Å²	107.6	29%	0.288	57%	0.574	S	S	.	*			trans	-106.6	125.3	176.5	-173	61.1	0	0	0	109	F18 L22 P70 F87	F18-L20 HydrophobicContact CD1-CB 3.91Å; F18-L20 HydrophobicContact CE1-CB 3.89Å; F18-L20 HydrophobicContact CE1-CD1 3.73Å; F18-L20 HydrophobicContact CE1-CD2 4.41Å; F18-L20 HydrophobicContact CE1-CG 4.23Å; F18-L20 HydrophobicContact CZ-CD1 4.49Å; F18-L20 PolarHBondContact O-N 2.92Å; L20-L22 HydrophobicContact CD2-CD2 3.42Å; L20-L22 VanDerWaalsContact CD2-CD2 3.42Å; L20-L22 HydrophobicContact CD2-CG 4.06Å; L20-L22 HydrophobicContact CG-CD2 3.78Å; L20-L22 HydrophobicContact CG-CG 4.09Å; L20-P70 HydrophobicContact CD1-CB 3.52Å; L20-P70 HydrophobicContact CD1-CG 3.87Å; L20-P70 HydrophobicContact CD2-CB 4.41Å; L20-P70 HydrophobicContact CD2-CG 3.95Å; L20-P70 HydrophobicContact CG-CB 4.28Å; L20-P70 HydrophobicContact CG-CG 4.36Å; L20-F87 HydrophobicContact CD2-CD2 4.31Å; L20-F87 HydrophobicContact CD2-CE1 4.06Å; L20-F87 HydrophobicContact CD2-CE2 3.63Å; L20-F87 HydrophobicContact CD2-CZ 3.48Å; L20-F87 VanDerWaalsContact CD2-CZ 3.48Å
21	E	85.8	Confident	74.8	Confident	147 Å²	147	100.4 Å²	100.4	69%	0.687	54%	0.536	S	S	*	.			trans	-82	124.1	165.5	-66.9	-170.1	-176.6	0	0	107.8	P70 T71	E21-P70 WeakPolarHBondContact O-CA 3.11Å; E21-T71 HydrophobicContact CB-CG2 4.38Å; E21-T71 WeakPolarHBondContact CB-OG1 3.35Å; E21-T71 PolarHBondContact O-N 3.22Å; E21-T71 PolarHBondContact O-OG1 3.5Å
22	L	88.9	Confident	77.1	Confident	45 Å²	45	99.9 Å²	99.9	24%	0.236	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.6	-174.6	-74	177.4	0	0	0	109.2	L20 V68 K69 F87 L152 I156	L20-L22 HydrophobicContact CD2-CD2 3.42Å; L20-L22 VanDerWaalsContact CD2-CD2 3.42Å; L20-L22 HydrophobicContact CD2-CG 4.06Å; L20-L22 HydrophobicContact CG-CD2 3.78Å; L20-L22 HydrophobicContact CG-CG 4.09Å; L22-V68 HydrophobicContact CB-CG1 3.74Å; L22-V68 HydrophobicContact CD1-CG1 4.12Å; L22-V68 HydrophobicContact CD2-CG1 4.14Å; L22-V68 HydrophobicContact CG-CG1 4.22Å; L22-K69 WeakPolarHBondContact CA-O 3.36Å; L22-F87 HydrophobicContact CD2-CD2 3.9Å; L22-F87 HydrophobicContact CD2-CE2 4.34Å; L22-F87 HydrophobicContact CD2-CG 4.21Å; L22-L152 HydrophobicContact CD1-CD2 3.75Å; L22-I156 HydrophobicContact CB-CD1 4.47Å; L22-I156 HydrophobicContact CD1-CD1 3.59Å
23	E	90.4	Very high	79.7	Confident	103 Å²	103	97 Å²	97	48%	0.481	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.5	177.6	-176.8	170	-165.2	0	0	110.8	F25 V68 K69 T71	E23-F25 HydrophobicContact CB-CE2 3.7Å; E23-F25 HydrophobicContact CB-CZ 3.75Å; E23-F25 HydrophobicContact CG-CE1 4.24Å; E23-F25 HydrophobicContact CG-CE2 4.01Å; E23-F25 HydrophobicContact CG-CZ 3.75Å; E23-F25 WeakPolarHBondContact O-CD2 3.28Å; E23-F25 WeakPolarHBondContact O-CE2 3.13Å; E23-V68 WeakPolarHBondContact O-CA 3.3Å; E23-K69 PolarHBondContact N-O 2.85Å; E23-K69 PolarHBondContact O-N 3.27Å; E23-T71 HydrophobicContact CB-CG2 3.7Å
24	G	91.5	Very high	82.2	Confident	42 Å²	42	93.1 Å²	93.1	43%	0.433	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	127	177.1	0	0	0	0	0	111.9	V67	G24-V67 CarbonylContact C-O 3.55Å; G24-V67 WeakPolarHBondContact CA-O 3.36Å
25	F	91.9	Very high	84.7	Confident	65 Å²	65	88.5 Å²	88.5	29%	0.285	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153.1	177.7	-58.1	-84.6	0	0	0	110.8	E23 T66 V67 K69	E23-F25 HydrophobicContact CB-CE2 3.7Å; E23-F25 HydrophobicContact CB-CZ 3.75Å; E23-F25 HydrophobicContact CG-CE1 4.24Å; E23-F25 HydrophobicContact CG-CE2 4.01Å; E23-F25 HydrophobicContact CG-CZ 3.75Å; E23-F25 WeakPolarHBondContact O-CD2 3.28Å; E23-F25 WeakPolarHBondContact O-CE2 3.13Å; F25-T66 CarbonylContact O-C 3.49Å; F25-T66 WeakPolarHBondContact O-CA 3.33Å; F25-V67 HydrophobicContact CB-CG2 4.1Å; F25-V67 PolarHBondContact N-O 3.16Å; F25-V67 WeakPolarHBondContact O-CG2 3.41Å; F25-V67 PolarHBondContact O-N 3.44Å; F25-K69 HydrophobicContact CD2-CB 4.07Å; F25-K69 HydrophobicContact CE2-CB 4.13Å
26	P	93.3	Very high	86.7	Confident	98 Å²	98	80 Å²	80	64%	0.636	42%	0.416	S	S	*	.			trans	-58.7	139.9	165.7	-21.2	33.5	0	0	0	110.5	D28	P26-D28 PolarHBondContact O-N 3.11Å
27	P	94.2	Very high	88.5	Confident	13 Å²	13	75.5 Å²	75.5	8%	0.084	40%	0.397	C	S	.	.			trans	-57.4	133.9	175	-19.2	26.3	0	0	0	111.8	I35 I58 V59 G65 V67	P27-I35 HydrophobicContact CB-CD1 4.34Å; P27-I58 HydrophobicContact CB-CG2 4.29Å; P27-I58 HydrophobicContact CG-CG2 4.22Å; P27-V59 HydrophobicContact CB-CG1 4.4Å; P27-G65 WeakPolarHBondContact CD-O 3.48Å; P27-V67 HydrophobicContact CB-CG1 3.98Å; P27-V67 HydrophobicContact CG-CG1 4Å
28	D	93.5	Very high	90.1	Very high	88 Å²	88	68.8 Å²	68.8	47%	0.471	36%	0.362	S	S	.	.			trans	-122.9	167.3	174.2	-173.6	48.5	0	0	0	112.2	P26 S30 D31 V59	P26-D28 PolarHBondContact O-N 3.11Å; D28-S30 PolarHBondContact O-N 2.96Å; D28-D31 PolarHBondContact N-OD2 3.48Å; D28-D31 VanDerWaalsContact O-CB 3.3Å; D28-D31 WeakPolarHBondContact O-CB 3.06Å; D28-D31 PolarHBondContact O-N 3.31Å; D28-V59 WeakPolarHBondContact O-CG1 3.49Å
29	I	93.4	Very high	91.6	Very high	104 Å²	104	60.8 Å²	60.8	53%	0.533	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-57.5	-30.1	179.3	-167.3	61.4	0	0	0	113	D31 R32 V59	I29-D31 PolarHBondContact O-N 3.19Å; I29-R32 WeakPolarHBondContact O-CB 3.49Å; I29-R32 PolarHBondContact O-N 3.19Å; I29-V59 HydrophobicContact CD1-CG2 4.02Å
30	S	92.7	Very high	92.6	Very high	59 Å²	59	59.2 Å²	59.2	41%	0.413	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-62.8	-26.6	174.4	60.6	0	0	0	0	113	D28	D28-S30 PolarHBondContact O-N 2.96Å
31	D	93.9	Very high	93.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-85.5	-10.4	-174.3	-58	-36.2	0	0	0	112.7	D28 I29 D33 S34 I35 K69 V86	D28-D31 PolarHBondContact N-OD2 3.48Å; D28-D31 VanDerWaalsContact O-CB 3.3Å; D28-D31 WeakPolarHBondContact O-CB 3.06Å; D28-D31 PolarHBondContact O-N 3.31Å; I29-D31 PolarHBondContact O-N 3.19Å; D31-D33 VanDerWaalsContact C-N 3.3Å; D31-D33 PolarHBondContact O-N 2.99Å; D31-S34 PolarHBondContact O-N 2.86Å; D31-I35 HydrophobicContact CB-CD1 3.85Å; D31-I35 HydrophobicContact CB-CG1 4.32Å; D31-I35 VanDerWaalsContact O-CG1 3.31Å; D31-I35 WeakPolarHBondContact O-CG1 3.41Å; D31-I35 PolarHBondContact O-N 3.22Å; D31-K69 IonicContact OD1-NZ 3.01Å; D31-K69 PolarHBondContact OD1-NZ 3.21Å; D31-K69 IonicContact OD2-NZ 2.76Å; D31-K69 PolarHBondContact OD2-NZ 3.49Å; D31-V86 HydrophobicContact CB-CG2 3.84Å
32	R	95.1	Very high	93.5	Very high	95 Å²	95	53.9 Å²	53.9	36%	0.358	29%	0.287	S	S	.	.	H	α-helix	trans	-52.5	-44.7	-171.8	-173.7	-161.3	68.6	178.7	-2.9	112.9	I29 T36 A55 V59	I29-R32 WeakPolarHBondContact O-CB 3.49Å; I29-R32 PolarHBondContact O-N 3.19Å; R32-T36 WeakPolarHBondContact O-CB 3.37Å; R32-T36 PolarHBondContact O-N 3.13Å; R32-T36 PolarHBondContact O-OG1 3.38Å; R32-A55 HydrophobicContact CG-CB 4.03Å; R32-A55 WeakPolarHBondContact O-CB 3.18Å; R32-V59 HydrophobicContact CB-CG1 4.28Å; R32-V59 HydrophobicContact CB-CG2 4.48Å
33	D	95	Very high	93.7	Very high	94 Å²	94	52 Å²	52	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-72.9	-40.3	-174.8	-68.7	-2	0	0	0	110.7	D31 T36 I37	D31-D33 VanDerWaalsContact C-N 3.3Å; D31-D33 PolarHBondContact O-N 2.99Å; D33-T36 WeakPolarHBondContact O-CB 3.26Å; D33-T36 PolarHBondContact O-N 3.39Å; D33-I37 WeakPolarHBondContact O-CG1 3.3Å; D33-I37 PolarHBondContact O-N 3.26Å; D33-I37 VanDerWaalsContact O-N 3.1Å
34	S	95.3	Very high	93.8	Very high	25 Å²	25	47.5 Å²	47.5	18%	0.175	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-43.5	173.9	-58.9	0	0	0	0	112	D31 T36 I37 L38 N84	D31-S34 PolarHBondContact O-N 2.86Å; S34-T36 VanDerWaalsContact C-N 3.32Å; S34-T36 PolarHBondContact O-N 3.41Å; S34-I37 WeakPolarHBondContact O-CB 3.47Å; S34-I37 PolarHBondContact O-N 3.18Å; S34-L38 PolarHBondContact O-N 3.14Å; S34-N84 PolarHBondContact OG-O 3.31Å; S34-N84 VanDerWaalsContact OG-O 3.06Å
35	I	96.3	Very high	93.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-41.7	173.3	-67.1	166.4	0	0	0	110.5	P27 D31 I37 L38 L39 A55 I58 V59 V67 V89	P27-I35 HydrophobicContact CB-CD1 4.34Å; D31-I35 HydrophobicContact CB-CD1 3.85Å; D31-I35 HydrophobicContact CB-CG1 4.32Å; D31-I35 VanDerWaalsContact O-CG1 3.31Å; D31-I35 WeakPolarHBondContact O-CG1 3.41Å; D31-I35 PolarHBondContact O-N 3.22Å; I35-I37 VanDerWaalsContact C-N 3.26Å; I35-I37 PolarHBondContact O-N 3.07Å; I35-L38 PolarHBondContact O-N 2.9Å; I35-L39 HydrophobicContact CG2-CD1 3.75Å; I35-L39 HydrophobicContact CG2-CG 4.07Å; I35-L39 WeakPolarHBondContact O-CB 3.43Å; I35-L39 VanDerWaalsContact O-CG 3.29Å; I35-L39 WeakPolarHBondContact O-CG 3.22Å; I35-L39 PolarHBondContact O-N 3.07Å; I35-A55 HydrophobicContact CB-CB 4.21Å; I35-A55 HydrophobicContact CG2-CB 3.82Å; I35-I58 HydrophobicContact CD1-CG2 4.28Å; I35-I58 HydrophobicContact CG2-CD1 4.19Å; I35-V59 HydrophobicContact CD1-CG1 3.61Å; I35-V67 HydrophobicContact CD1-CG1 3.97Å; I35-V67 HydrophobicContact CG1-CG1 4.28Å; I35-V89 HydrophobicContact CD1-CG2 4.42Å; I35-V89 HydrophobicContact CG1-CB 4.4Å; I35-V89 HydrophobicContact CG1-CG2 4.22Å; I35-V89 HydrophobicContact CG2-CG2 4.41Å
36	T	95.8	Very high	93.1	Very high	9 Å²	9	50.4 Å²	50.4	6%	0.055	27%	0.265	C	S	.	.	H	α-helix	trans	-58.2	-40.2	177.1	-61.1	0	0	0	0	111.3	R32 D33 S34 K40 V51 E52 A55	R32-T36 WeakPolarHBondContact O-CB 3.37Å; R32-T36 PolarHBondContact O-N 3.13Å; R32-T36 PolarHBondContact O-OG1 3.38Å; D33-T36 WeakPolarHBondContact O-CB 3.26Å; D33-T36 PolarHBondContact O-N 3.39Å; S34-T36 VanDerWaalsContact C-N 3.32Å; S34-T36 PolarHBondContact O-N 3.41Å; T36-K40 WeakPolarHBondContact O-CG 3.47Å; T36-K40 PolarHBondContact O-N 3.06Å; T36-V51 HydrophobicContact CG2-CG2 4Å; T36-E52 HydrophobicContact CG2-CG 3.73Å; T36-A55 WeakPolarHBondContact OG1-CB 3.37Å
37	I	94.2	Very high	92.8	Very high	90 Å²	90	46.6 Å²	46.6	46%	0.462	24%	0.241	S	C	.	.	H	α-helix	trans	-63.3	-47.3	176.9	-67.1	165.8	0	0	0	110.8	D33 S34 I35 L39 K40	D33-I37 WeakPolarHBondContact O-CG1 3.3Å; D33-I37 PolarHBondContact O-N 3.26Å; D33-I37 VanDerWaalsContact O-N 3.1Å; S34-I37 WeakPolarHBondContact O-CB 3.47Å; S34-I37 PolarHBondContact O-N 3.18Å; I35-I37 VanDerWaalsContact C-N 3.26Å; I35-I37 PolarHBondContact O-N 3.07Å; I37-L39 PolarHBondContact O-N 3.27Å; I37-K40 WeakPolarHBondContact O-CB 3.47Å; I37-K40 PolarHBondContact O-N 2.66Å
38	L	94.8	Very high	92.7	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-59.8	-46.3	177.4	-69.8	175.8	0	0	0	111.8	S34 I35 K40 H41 V86 V89 E147 F149	S34-L38 PolarHBondContact O-N 3.14Å; I35-L38 PolarHBondContact O-N 2.9Å; L38-K40 PolarHBondContact O-N 3.28Å; L38-H41 PolarHBondContact O-N 3.36Å; L38-V86 HydrophobicContact CD1-CG1 3.88Å; L38-V89 HydrophobicContact CB-CG1 4.31Å; L38-V89 HydrophobicContact CD1-CB 4.27Å; L38-V89 HydrophobicContact CD1-CG1 3.85Å; L38-E147 HydrophobicContact CB-CB 4.01Å; L38-F149 HydrophobicContact CD2-CD1 3.47Å; L38-F149 VanDerWaalsContact CD2-CD1 3.47Å; L38-F149 HydrophobicContact CD2-CE1 3.53Å; L38-F149 HydrophobicContact CG-CE1 4.49Å
39	L	95.6	Very high	92.7	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-23.5	-178.7	-70.7	175.4	0	0	0	114.1	I35 I37 H41 L42 F43 V51 L54 A55 I58 I145	I35-L39 HydrophobicContact CG2-CD1 3.75Å; I35-L39 HydrophobicContact CG2-CG 4.07Å; I35-L39 WeakPolarHBondContact O-CB 3.43Å; I35-L39 VanDerWaalsContact O-CG 3.29Å; I35-L39 WeakPolarHBondContact O-CG 3.22Å; I35-L39 PolarHBondContact O-N 3.07Å; I37-L39 PolarHBondContact O-N 3.27Å; L39-H41 PolarHBondContact O-N 2.97Å; L39-L42 HydrophobicContact CD2-CD2 4.45Å; L39-L42 WeakPolarHBondContact O-CB 3.4Å; L39-L42 PolarHBondContact O-N 3.29Å; L39-F43 WeakPolarHBondContact O-CD2 3.46Å; L39-V51 HydrophobicContact CB-CB 4.22Å; L39-V51 HydrophobicContact CB-CG1 4.3Å; L39-L54 HydrophobicContact CD1-CB 4.05Å; L39-L54 HydrophobicContact CD1-CD2 4Å; L39-L54 HydrophobicContact CD1-CG 3.79Å; L39-L54 HydrophobicContact CD2-CD2 4.08Å; L39-A55 HydrophobicContact CD1-CB 4.08Å; L39-I58 HydrophobicContact CD1-CD1 4.07Å; L39-I58 HydrophobicContact CD2-CD1 4.39Å; L39-I145 HydrophobicContact CD2-CG2 3.65Å
40	K	93.2	Very high	92.7	Very high	111 Å²	111	42.9 Å²	42.9	48%	0.483	22%	0.223	S	C	.	.	H	α-helix	trans	-61.3	-30.9	176.4	-78.1	172.3	-177.5	174.9	0	112.3	T36 I37 L38 V51	T36-K40 WeakPolarHBondContact O-CG 3.47Å; T36-K40 PolarHBondContact O-N 3.06Å; I37-K40 WeakPolarHBondContact O-CB 3.47Å; I37-K40 PolarHBondContact O-N 2.66Å; L38-K40 PolarHBondContact O-N 3.28Å; K40-V51 HydrophobicContact CG-CG2 3.94Å
41	H	90.8	Very high	92.8	Very high	86 Å²	86	41.1 Å²	41.1	40%	0.398	21%	0.209	S	C	.	.	H	α-helix	trans	-76.3	-24.2	179.6	-56.5	128.9	0	0	0	113	L38 L39 W183	L38-H41 PolarHBondContact O-N 3.36Å; L39-H41 PolarHBondContact O-N 2.97Å; H41-W183 PolarHBondContact O-NE1 3.49Å
42	L	93.6	Very high	92.9	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-70	-35.6	-178.1	179.7	51.6	0	0	0	113	L39 I145 E147 L181 W183	L39-L42 HydrophobicContact CD2-CD2 4.45Å; L39-L42 WeakPolarHBondContact O-CB 3.4Å; L39-L42 PolarHBondContact O-N 3.29Å; L42-I145 HydrophobicContact CD2-CD1 3.73Å; L42-E147 HydrophobicContact CB-CG 4.07Å; L42-E147 WeakPolarHBondContact CD1-OE1 3.43Å; L42-E147 HydrophobicContact CD2-CG 4.26Å; L42-L181 HydrophobicContact CD1-CB 3.58Å; L42-L181 HydrophobicContact CG-CB 4.49Å; L42-W183 PolarHBondContact O-NE1 3.42Å
43	F	93.5	Very high	92.9	Very high	7 Å²	7	44.8 Å²	44.8	3%	0.031	23%	0.233	C	C	.	.	S	Bend	trans	-104.1	151.7	-174.7	-58.8	-78.1	0	0	0	112.5	L39 C47 I49 V51 L54 L109 F112 L181	L39-F43 WeakPolarHBondContact O-CD2 3.46Å; F43-C47 VanDerWaalsContact CB-SG 3.52Å; F43-I49 HydrophobicContact CD1-CB 4.35Å; F43-I49 HydrophobicContact CD1-CG1 3.97Å; F43-I49 HydrophobicContact CD2-CG2 4.23Å; F43-I49 HydrophobicContact CE1-CG1 4Å; F43-I49 HydrophobicContact CE1-CG2 4.34Å; F43-I49 HydrophobicContact CE2-CG2 3.99Å; F43-I49 HydrophobicContact CG-CB 4.38Å; F43-I49 HydrophobicContact CG-CG1 4.48Å; F43-I49 HydrophobicContact CZ-CG2 4.06Å; F43-V51 HydrophobicContact CD2-CG1 3.83Å; F43-V51 HydrophobicContact CE2-CG1 4.32Å; F43-L54 HydrophobicContact CE2-CD2 3.76Å; F43-L54 HydrophobicContact CZ-CD2 3.9Å; F43-L109 HydrophobicContact CE1-CD2 3.79Å; F43-L109 HydrophobicContact CZ-CD2 3.6Å; F43-F112 HydrophobicContact CD1-CD1 4.49Å; F43-F112 AromaticContact CD1-CE1 3.92Å; F43-F112 HydrophobicContact CD1-CE1 3.92Å; F43-F112 HydrophobicContact CD1-CE2 4.17Å; F43-F112 AromaticContact CD1-CZ 3.73Å; F43-F112 HydrophobicContact CD1-CZ 3.73Å; F43-F112 HydrophobicContact CE1-CD1 4.44Å; F43-F112 HydrophobicContact CE1-CE1 4.15Å; F43-F112 HydrophobicContact CE1-CZ 4.42Å; F43-L181 HydrophobicContact CE1-CD1 3.92Å
44	P	91	Very high	93	Very high	8 Å²	8	40.3 Å²	40.3	5%	0.052	21%	0.209	C	C	.	.			trans	-58.2	148.1	173.1	-21	30.9	0	0	0	111.4	N46 C47 F112 W183 H218 L221 T222 L246	P44-N46 PolarHBondContact O-N 3.15Å; P44-C47 VanDerWaalsContact O-CB 3.26Å; P44-C47 WeakPolarHBondContact O-CB 3.26Å; P44-C47 PolarHBondContact O-N 3.16Å; P44-C47 PolarHBondContact O-SG 3.14Å; P44-F112 HydrophobicContact CG-CE2 4.46Å; P44-F112 HydrophobicContact CG-CZ 4.31Å; P44-W183 HydrophobicContact CB-CH2 4.2Å; P44-W183 HydrophobicContact CB-CZ2 4.26Å; P44-W183 HydrophobicContact CG-CH2 3.84Å; P44-W183 HydrophobicContact CG-CZ2 3.82Å; P44-H218 HydrophobicContact CG-CB 4.06Å; P44-L221 HydrophobicContact CG-CB 4.22Å; P44-T222 HydrophobicContact CB-CG2 4.1Å; P44-L246 HydrophobicContact CG-CD2 4.26Å
45	N	85	Confident	93.1	Very high	65 Å²	65	39.1 Å²	39.1	35%	0.348	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	142.1	171.2	-77.1	-14.2	0	0	0	111.2	C47 T222 E238 T240	N45-C47 PolarHBondContact O-N 3.29Å; N45-T222 WeakPolarHBondContact O-CG2 3.39Å; N45-E238 PolarHBondContact ND2-O 3.18Å; N45-T240 WeakPolarHBondContact ND2-CG2 3.28Å; N45-T240 PolarHBondContact ND2-N 3.2Å; N45-T240 PolarHBondContact ND2-OG1 2.67Å; N45-T240 PolarHBondContact OD1-OG1 2.86Å
46	N	84.8	Confident	93.1	Very high	103 Å²	103	43.7 Å²	43.7	55%	0.551	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	28.7	-178.6	-61	-19	0	0	0	114.3	P44 R223	P44-N46 PolarHBondContact O-N 3.15Å; N46-R223 WeakPolarHBondContact O-CB 3.38Å; N46-R223 VanDerWaalsContact O-CG 3.26Å; N46-R223 WeakPolarHBondContact O-CG 3.39Å; N46-R223 PolarHBondContact O-N 3.34Å
47	C	87.8	Confident	93.2	Very high	17 Å²	17	44.2 Å²	44.2	12%	0.115	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-69.8	172.5	173	73.5	0	0	0	0	112.8	F43 P44 N45 I49 F112 L221 R223	F43-C47 VanDerWaalsContact CB-SG 3.52Å; P44-C47 VanDerWaalsContact O-CB 3.26Å; P44-C47 WeakPolarHBondContact O-CB 3.26Å; P44-C47 PolarHBondContact O-N 3.16Å; P44-C47 PolarHBondContact O-SG 3.14Å; N45-C47 PolarHBondContact O-N 3.29Å; C47-I49 VanDerWaalsContact C-N 3.34Å; C47-F112 HydrophobicContact CB-CE2 4.04Å; C47-L221 WeakPolarHBondContact CA-O 3.29Å; C47-L221 WeakPolarHBondContact CB-O 3.49Å; C47-R223 PolarHBondContact O-NE 2.83Å
48	V	90.2	Very high	93.3	Very high	56 Å²	56	40 Å²	40	34%	0.339	20%	0.201	S	C	.	.	S	Bend	trans	-76.2	-20.3	177.8	-68.3	0	0	0	0	113.7	N50 F112 R223	V48-N50 PolarHBondContact O-N 2.9Å; V48-F112 HydrophobicContact CG2-CB 4.49Å; V48-F112 HydrophobicContact CG2-CD2 4.3Å; V48-R223 HydrophobicContact CG1-CG 3.99Å
49	I	93.6	Very high	93.4	Very high	12 Å²	12	40.7 Å²	40.7	6%	0.062	21%	0.205	C	C	.	.			trans	-71.1	125.1	-174.3	-57.3	-56.3	0	0	0	110.6	F43 C47 V51 D108 L109 F112	F43-I49 HydrophobicContact CD1-CB 4.35Å; F43-I49 HydrophobicContact CD1-CG1 3.97Å; F43-I49 HydrophobicContact CD2-CG2 4.23Å; F43-I49 HydrophobicContact CE1-CG1 4Å; F43-I49 HydrophobicContact CE1-CG2 4.34Å; F43-I49 HydrophobicContact CE2-CG2 3.99Å; F43-I49 HydrophobicContact CG-CB 4.38Å; F43-I49 HydrophobicContact CG-CG1 4.48Å; F43-I49 HydrophobicContact CZ-CG2 4.06Å; C47-I49 VanDerWaalsContact C-N 3.34Å; I49-V51 PolarHBondContact O-N 2.81Å; I49-D108 VanDerWaalsContact CD1-C 3.42Å; I49-D108 HydrophobicContact CD1-CB 3.91Å; I49-D108 WeakPolarHBondContact CD1-O 3.46Å; I49-L109 HydrophobicContact CD1-CD2 3.99Å; I49-L109 HydrophobicContact CD1-CG 4.31Å; I49-L109 HydrophobicContact CG1-CD2 4.32Å; I49-L109 HydrophobicContact CG2-CD2 4.25Å; I49-F112 HydrophobicContact CD1-CB 3.69Å; I49-F112 HydrophobicContact CD1-CD2 4.35Å; I49-F112 HydrophobicContact CD1-CG 4.12Å; I49-F112 HydrophobicContact CG1-CB 4.13Å; I49-F112 HydrophobicContact CG1-CD2 3.86Å; I49-F112 HydrophobicContact CG1-CE2 4.43Å; I49-F112 HydrophobicContact CG1-CG 4Å
50	N	94.1	Very high	93.3	Very high	60 Å²	60	45 Å²	45	32%	0.321	23%	0.232	S	C	.	.			trans	-83.2	101.3	167.5	-174.9	-16.1	0	0	0	109.4	V48 E52 N53 L54	V48-N50 PolarHBondContact O-N 2.9Å; N50-E52 VanDerWaalsContact C-N 3.29Å; N50-E52 PolarHBondContact O-N 3.42Å; N50-E52 WeakPolarHBondContact OD1-CB 3.39Å; N50-E52 PolarHBondContact OD1-N 3.21Å; N50-N53 HydrophobicContact CB-CB 4.13Å; N50-N53 VanDerWaalsContact ND2-CG 3.34Å; N50-N53 PolarHBondContact ND2-ND2 2.92Å; N50-N53 PolarHBondContact ND2-OD1 2.99Å; N50-N53 PolarHBondContact O-N 3.36Å; N50-N53 PolarHBondContact OD1-N 3.17Å; N50-L54 PolarHBondContact O-N 2.92Å; N50-L54 VanDerWaalsContact O-N 3.14Å
51	V	95.1	Very high	93.1	Very high	21 Å²	21	41.1 Å²	41.1	13%	0.127	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-29.4	179.7	-66.2	0	0	0	0	113.5	T36 L39 K40 F43 I49 L54 A55	T36-V51 HydrophobicContact CG2-CG2 4Å; L39-V51 HydrophobicContact CB-CB 4.22Å; L39-V51 HydrophobicContact CB-CG1 4.3Å; K40-V51 HydrophobicContact CG-CG2 3.94Å; F43-V51 HydrophobicContact CD2-CG1 3.83Å; F43-V51 HydrophobicContact CE2-CG1 4.32Å; I49-V51 PolarHBondContact O-N 2.81Å; V51-L54 PolarHBondContact O-N 3.2Å; V51-A55 PolarHBondContact O-N 3.03Å
52	E	95.5	Very high	92.6	Very high	115 Å²	115	44.3 Å²	44.3	54%	0.537	24%	0.235	S	C	.	.	H	α-helix	trans	-67.7	-43.5	176.3	-66.2	172.8	-174.3	0	0	110.6	T36 N50 L54 A55 E56	T36-E52 HydrophobicContact CG2-CG 3.73Å; N50-E52 VanDerWaalsContact C-N 3.29Å; N50-E52 PolarHBondContact O-N 3.42Å; N50-E52 WeakPolarHBondContact OD1-CB 3.39Å; N50-E52 PolarHBondContact OD1-N 3.21Å; E52-L54 PolarHBondContact O-N 2.81Å; E52-A55 PolarHBondContact O-N 3.16Å; E52-E56 WeakPolarHBondContact O-CB 3.4Å; E52-E56 PolarHBondContact O-N 3.47Å
53	N	96.2	Very high	92.1	Very high	57 Å²	57	47 Å²	47	31%	0.305	26%	0.255	S	S	.	.	H	α-helix	trans	-65.6	-30.1	174.7	-70.5	-2.3	0	0	0	111.9	N50 Y57 V105	N50-N53 HydrophobicContact CB-CB 4.13Å; N50-N53 VanDerWaalsContact ND2-CG 3.34Å; N50-N53 PolarHBondContact ND2-ND2 2.92Å; N50-N53 PolarHBondContact ND2-OD1 2.99Å; N50-N53 PolarHBondContact O-N 3.36Å; N50-N53 PolarHBondContact OD1-N 3.17Å; N53-Y57 WeakPolarHBondContact O-CB 3.28Å; N53-Y57 PolarHBondContact O-N 3.24Å; N53-V105 HydrophobicContact CB-CB 4.33Å; N53-V105 HydrophobicContact CB-CG2 4.41Å
54	L	97.2	Very high	92.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-72.3	-43.1	175.2	-178.1	55.2	0	0	0	111.2	L39 F43 N50 V51 E52 E56 Y57 I58 V93 V105 L109	L39-L54 HydrophobicContact CD1-CB 4.05Å; L39-L54 HydrophobicContact CD1-CD2 4Å; L39-L54 HydrophobicContact CD1-CG 3.79Å; L39-L54 HydrophobicContact CD2-CD2 4.08Å; F43-L54 HydrophobicContact CE2-CD2 3.76Å; F43-L54 HydrophobicContact CZ-CD2 3.9Å; N50-L54 PolarHBondContact O-N 2.92Å; N50-L54 VanDerWaalsContact O-N 3.14Å; V51-L54 PolarHBondContact O-N 3.2Å; E52-L54 PolarHBondContact O-N 2.81Å; L54-E56 VanDerWaalsContact C-N 3.33Å; L54-Y57 HydrophobicContact CD1-CD1 4.5Å; L54-Y57 WeakPolarHBondContact O-CB 3.37Å; L54-Y57 PolarHBondContact O-N 2.84Å; L54-I58 HydrophobicContact CD1-CD1 4.46Å; L54-I58 HydrophobicContact CG-CD1 4.27Å; L54-I58 WeakPolarHBondContact O-CG1 3.49Å; L54-I58 PolarHBondContact O-N 2.9Å; L54-V93 HydrophobicContact CD1-CG2 4.04Å; L54-V105 HydrophobicContact CB-CG2 3.76Å; L54-V105 HydrophobicContact CD1-CG2 4.06Å; L54-V105 HydrophobicContact CG-CG2 4.47Å; L54-L109 HydrophobicContact CD1-CD1 3.83Å; L54-L109 HydrophobicContact CD2-CD1 4.45Å; L54-L109 HydrophobicContact CD2-CD2 4.38Å
55	A	97.1	Very high	92.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-44	172.6	0	0	0	0	0	111.3	R32 I35 T36 L39 V51 E52 Y57 I58 V59	R32-A55 HydrophobicContact CG-CB 4.03Å; R32-A55 WeakPolarHBondContact O-CB 3.18Å; I35-A55 HydrophobicContact CB-CB 4.21Å; I35-A55 HydrophobicContact CG2-CB 3.82Å; T36-A55 WeakPolarHBondContact OG1-CB 3.37Å; L39-A55 HydrophobicContact CD1-CB 4.08Å; V51-A55 PolarHBondContact O-N 3.03Å; E52-A55 PolarHBondContact O-N 3.16Å; A55-Y57 VanDerWaalsContact C-N 3.31Å; A55-Y57 PolarHBondContact O-N 3Å; A55-I58 PolarHBondContact O-N 2.84Å; A55-I58 VanDerWaalsContact O-N 3.16Å; A55-V59 WeakPolarHBondContact O-CG1 3.35Å; A55-V59 WeakPolarHBondContact O-CG2 3.3Å; A55-V59 PolarHBondContact O-N 3.09Å
56	E	96.8	Very high	92.7	Very high	96 Å²	96	44.7 Å²	44.7	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-60.3	-40.4	174.3	-173.1	172	-162	0	0	111.9	E52 L54 V59 T60	E52-E56 WeakPolarHBondContact O-CB 3.4Å; E52-E56 PolarHBondContact O-N 3.47Å; L54-E56 VanDerWaalsContact C-N 3.33Å; E56-V59 WeakPolarHBondContact O-CG2 3.28Å; E56-T60 WeakPolarHBondContact O-CB 3.3Å; E56-T60 WeakPolarHBondContact O-CG2 3.16Å; E56-T60 PolarHBondContact O-N 2.52Å; E56-T60 PolarHBondContact O-OG1 3.27Å
57	Y	96.7	Very high	93.2	Very high	21 Å²	21	39.8 Å²	39.8	8%	0.082	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-43.5	173.3	176.7	-87.4	0	0	0	112	N53 L54 A55 T60 Q61 V93 H103 V105 V106	N53-Y57 WeakPolarHBondContact O-CB 3.28Å; N53-Y57 PolarHBondContact O-N 3.24Å; L54-Y57 HydrophobicContact CD1-CD1 4.5Å; L54-Y57 WeakPolarHBondContact O-CB 3.37Å; L54-Y57 PolarHBondContact O-N 2.84Å; A55-Y57 VanDerWaalsContact C-N 3.31Å; A55-Y57 PolarHBondContact O-N 3Å; Y57-T60 WeakPolarHBondContact CA-OG1 3.11Å; Y57-T60 PolarHBondContact O-N 3.26Å; Y57-T60 PolarHBondContact O-OG1 3.24Å; Y57-Q61 HydrophobicContact CE1-CG 4.11Å; Y57-Q61 VanDerWaalsContact CE1-NE2 3.33Å; Y57-Q61 WeakPolarHBondContact O-CG 3.5Å; Y57-Q61 PolarHBondContact O-N 3.34Å; Y57-Q61 PolarHBondContact OH-NE2 3.27Å; Y57-Q61 VanDerWaalsContact OH-NE2 3.16Å; Y57-V93 HydrophobicContact CD1-CG1 4.48Å; Y57-V93 HydrophobicContact CD1-CG2 4.27Å; Y57-V93 HydrophobicContact CE1-CB 4.26Å; Y57-V93 HydrophobicContact CE1-CG1 3.84Å; Y57-V93 HydrophobicContact CE1-CG2 3.99Å; Y57-H103 HydrophobicContact CD2-CB 4.16Å; Y57-H103 AromaticContact CD2-CG 3.9Å; Y57-H103 AromaticContact CD2-ND1 3.87Å; Y57-H103 HydrophobicContact CE2-CB 4.09Å; Y57-H103 AromaticContact CE2-CD2 3.73Å; Y57-H103 AromaticContact CE2-CG 3.63Å; Y57-H103 AromaticContact CE2-ND1 3.88Å; Y57-V105 HydrophobicContact CD2-CG1 4.04Å; Y57-V105 HydrophobicContact CG-CG1 3.94Å; Y57-V106 HydrophobicContact CD2-CG2 4.44Å; Y57-V106 HydrophobicContact CE2-CG2 3.96Å
58	I	96.8	Very high	93.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-47.7	179.6	-70.5	168	0	0	0	111.3	P27 I35 L39 L54 A55 T60 Q61 V89 I145	P27-I58 HydrophobicContact CB-CG2 4.29Å; P27-I58 HydrophobicContact CG-CG2 4.22Å; I35-I58 HydrophobicContact CD1-CG2 4.28Å; I35-I58 HydrophobicContact CG2-CD1 4.19Å; L39-I58 HydrophobicContact CD1-CD1 4.07Å; L39-I58 HydrophobicContact CD2-CD1 4.39Å; L54-I58 HydrophobicContact CD1-CD1 4.46Å; L54-I58 HydrophobicContact CG-CD1 4.27Å; L54-I58 WeakPolarHBondContact O-CG1 3.49Å; L54-I58 PolarHBondContact O-N 2.9Å; A55-I58 PolarHBondContact O-N 2.84Å; A55-I58 VanDerWaalsContact O-N 3.16Å; I58-T60 PolarHBondContact O-N 2.61Å; I58-Q61 WeakPolarHBondContact O-CB 3.39Å; I58-Q61 PolarHBondContact O-N 3.37Å; I58-Q61 VanDerWaalsContact O-N 3.1Å; I58-V89 HydrophobicContact CG2-CG2 4.34Å; I58-I145 HydrophobicContact CD1-CG1 4.5Å; I58-I145 HydrophobicContact CD1-CG2 4.3Å
59	V	95.9	Very high	93.6	Very high	16 Å²	16	38 Å²	38	10%	0.097	20%	0.204	C	C	.	.	H	α-helix	trans	-70.9	-15.5	-178.6	-57.1	0	0	0	0	113.4	P27 D28 I29 R32 I35 A55 E56	P27-V59 HydrophobicContact CB-CG1 4.4Å; D28-V59 WeakPolarHBondContact O-CG1 3.49Å; I29-V59 HydrophobicContact CD1-CG2 4.02Å; R32-V59 HydrophobicContact CB-CG1 4.28Å; R32-V59 HydrophobicContact CB-CG2 4.48Å; I35-V59 HydrophobicContact CD1-CG1 3.61Å; A55-V59 WeakPolarHBondContact O-CG1 3.35Å; A55-V59 WeakPolarHBondContact O-CG2 3.3Å; A55-V59 PolarHBondContact O-N 3.09Å; E56-V59 WeakPolarHBondContact O-CG2 3.28Å
60	T	94.3	Very high	93.3	Very high	92 Å²	92	38 Å²	38	56%	0.564	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-8.3	173.7	54	0	0	0	0	113	E56 Y57 I58 D62	E56-T60 WeakPolarHBondContact O-CB 3.3Å; E56-T60 WeakPolarHBondContact O-CG2 3.16Å; E56-T60 PolarHBondContact O-N 2.52Å; E56-T60 PolarHBondContact O-OG1 3.27Å; Y57-T60 WeakPolarHBondContact CA-OG1 3.11Å; Y57-T60 PolarHBondContact O-N 3.26Å; Y57-T60 PolarHBondContact O-OG1 3.24Å; I58-T60 PolarHBondContact O-N 2.61Å; T60-D62 PolarHBondContact O-N 3.29Å
61	Q	89.3	Confident	92.8	Very high	28 Å²	28	37 Å²	37	13%	0.131	20%	0.201	C	C	.	.			trans	-82.9	97.7	172.5	-67.9	179.7	-57.5	0	0	110	Y57 I58 S63 I64 S91 V92	Y57-Q61 HydrophobicContact CE1-CG 4.11Å; Y57-Q61 VanDerWaalsContact CE1-NE2 3.33Å; Y57-Q61 WeakPolarHBondContact O-CG 3.5Å; Y57-Q61 PolarHBondContact O-N 3.34Å; Y57-Q61 PolarHBondContact OH-NE2 3.27Å; Y57-Q61 VanDerWaalsContact OH-NE2 3.16Å; I58-Q61 WeakPolarHBondContact O-CB 3.39Å; I58-Q61 PolarHBondContact O-N 3.37Å; I58-Q61 VanDerWaalsContact O-N 3.1Å; Q61-S63 VanDerWaalsContact C-N 3.25Å; Q61-S63 PolarHBondContact O-N 3.45Å; Q61-I64 HydrophobicContact CB-CG2 4.46Å; Q61-S91 PolarHBondContact OE1-OG 3.33Å; Q61-V92 PolarHBondContact NE2-O 3.43Å; Q61-V92 PolarHBondContact OE1-O 2.94Å
62	D	79.5	Confident	91.4	Very high	153 Å²	153	39.4 Å²	39.4	82%	0.818	22%	0.219	S	C	*	.	S	Bend	trans	-71.5	-14.3	-177.9	63.4	-8.7	0	0	0	115.2	T60	T60-D62 PolarHBondContact O-N 3.29Å
63	S	84.1	Confident	89.6	Confident	60 Å²	60	39.7 Å²	39.7	42%	0.42	22%	0.224	S	C	.	.	S	Bend	trans	-114.5	-14.9	-164.9	54	0	0	0	0	114.2	Q61 S171	Q61-S63 VanDerWaalsContact C-N 3.25Å; Q61-S63 PolarHBondContact O-N 3.45Å; S63-S171 WeakPolarHBondContact CB-OG 3.4Å; S63-S171 PolarHBondContact O-OG 3.48Å
64	I	93.2	Very high	87.6	Confident	5 Å²	5	45 Å²	45	3%	0.026	25%	0.252	C	S	.	.	S	Bend	trans	-146.8	139.9	-176.2	-170.3	151.7	0	0	0	111.7	Q61 V92 E167 F168 L173	Q61-I64 HydrophobicContact CB-CG2 4.46Å; I64-V92 HydrophobicContact CB-CG2 4.46Å; I64-V92 HydrophobicContact CD1-CG2 3.34Å; I64-V92 HydrophobicContact CG1-CG2 3.74Å; I64-V92 HydrophobicContact CG2-CG2 3.91Å; I64-E167 HydrophobicContact CD1-CB 4.13Å; I64-E167 HydrophobicContact CG1-CB 3.93Å; I64-E167 WeakPolarHBondContact CG1-OE2 3.46Å; I64-F168 HydrophobicContact CD1-CD1 3.48Å; I64-F168 VanDerWaalsContact CD1-CD1 3.48Å; I64-F168 HydrophobicContact CD1-CE1 3.66Å; I64-F168 HydrophobicContact CD1-CG 4.06Å; I64-F168 HydrophobicContact CD1-CZ 4.34Å; I64-L173 HydrophobicContact CD1-CD1 3.99Å; I64-L173 HydrophobicContact CG2-CD1 4.24Å
65	G	94.4	Very high	85.3	Confident	6 Å²	6	54.1 Å²	54.1	6%	0.062	30%	0.295	C	S	.	.			trans	113.6	154.2	-178.6	0	0	0	0	0	112.7	P27 T90 E167	P27-G65 WeakPolarHBondContact CD-O 3.48Å; G65-T90 CarbonylContact C-O 3.59Å; G65-T90 WeakPolarHBondContact CA-O 3.32Å; G65-E167 PolarHBondContact N-OE2 2.92Å
66	T	94.8	Very high	83.1	Confident	20 Å²	20	57.7 Å²	57.7	12%	0.123	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.2	-179.4	-71.4	0	0	0	0	108.4	F25 T90 E167	F25-T66 CarbonylContact O-C 3.49Å; F25-T66 WeakPolarHBondContact O-CA 3.33Å; T66-T90 PolarHBondContact N-O 3.4Å; T66-T90 PolarHBondContact O-N 2.97Å; T66-E167 PolarHBondContact OG1-OE1 2.84Å
67	V	94.7	Very high	81	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.5	165.9	-61.9	0	0	0	0	109.5	G24 F25 P27 I35 K69 V86 A88 V89	G24-V67 CarbonylContact C-O 3.55Å; G24-V67 WeakPolarHBondContact CA-O 3.36Å; F25-V67 HydrophobicContact CB-CG2 4.1Å; F25-V67 PolarHBondContact N-O 3.16Å; F25-V67 WeakPolarHBondContact O-CG2 3.41Å; F25-V67 PolarHBondContact O-N 3.44Å; P27-V67 HydrophobicContact CB-CG1 3.98Å; P27-V67 HydrophobicContact CG-CG1 4Å; I35-V67 HydrophobicContact CD1-CG1 3.97Å; I35-V67 HydrophobicContact CG1-CG1 4.28Å; V67-K69 HydrophobicContact CG2-CD 4.29Å; V67-K69 HydrophobicContact CG2-CG 4.34Å; V67-V86 HydrophobicContact CB-CG1 3.81Å; V67-V86 HydrophobicContact CB-CG2 4.24Å; V67-V86 HydrophobicContact CG1-CG1 4.07Å; V67-V86 HydrophobicContact CG1-CG2 4.46Å; V67-A88 CarbonylContact C-O 3.51Å; V67-A88 VanDerWaalsContact CA-O 3.28Å; V67-A88 WeakPolarHBondContact CA-O 3.44Å; V67-V89 HydrophobicContact CG1-CB 4.47Å; V67-V89 HydrophobicContact CG1-CG2 4.2Å
68	V	94	Very high	79.1	Confident	9 Å²	9	66.3 Å²	66.3	6%	0.055	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121	177.3	-179.1	0	0	0	0	109	L22 E23 F87 A88 I156 A160	L22-V68 HydrophobicContact CB-CG1 3.74Å; L22-V68 HydrophobicContact CD1-CG1 4.12Å; L22-V68 HydrophobicContact CD2-CG1 4.14Å; L22-V68 HydrophobicContact CG-CG1 4.22Å; E23-V68 WeakPolarHBondContact O-CA 3.3Å; V68-F87 PolarHBondContact O-N 2.75Å; V68-A88 HydrophobicContact CB-CB 3.97Å; V68-A88 HydrophobicContact CG2-CB 3.98Å; V68-A88 PolarHBondContact N-O 2.9Å; V68-I156 HydrophobicContact CG1-CG2 4.21Å; V68-A160 HydrophobicContact CG2-CB 4.35Å
69	K	91.8	Very high	77.1	Confident	26 Å²	26	74.5 Å²	74.5	11%	0.113	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	159	-176.1	-68.4	-171.9	-71	-165.5	0	111	L22 E23 F25 D31 V67 V86	L22-K69 WeakPolarHBondContact CA-O 3.36Å; E23-K69 PolarHBondContact N-O 2.85Å; E23-K69 PolarHBondContact O-N 3.27Å; F25-K69 HydrophobicContact CD2-CB 4.07Å; F25-K69 HydrophobicContact CE2-CB 4.13Å; D31-K69 IonicContact OD1-NZ 3.01Å; D31-K69 PolarHBondContact OD1-NZ 3.21Å; D31-K69 IonicContact OD2-NZ 2.76Å; D31-K69 PolarHBondContact OD2-NZ 3.49Å; V67-K69 HydrophobicContact CG2-CD 4.29Å; V67-K69 HydrophobicContact CG2-CG 4.34Å; K69-V86 HydrophobicContact CD-CG2 4.01Å; K69-V86 HydrophobicContact CG-CG2 4.02Å
70	P	88.6	Confident	75.2	Confident	14 Å²	14	76 Å²	76	9%	0.091	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50	141.7	165.4	-24.6	34.1	0	0	0	111.2	L20 E21 C72 F87	L20-P70 HydrophobicContact CD1-CB 3.52Å; L20-P70 HydrophobicContact CD1-CG 3.87Å; L20-P70 HydrophobicContact CD2-CB 4.41Å; L20-P70 HydrophobicContact CD2-CG 3.95Å; L20-P70 HydrophobicContact CG-CB 4.28Å; L20-P70 HydrophobicContact CG-CG 4.36Å; E21-P70 WeakPolarHBondContact O-CA 3.11Å; P70-C72 PolarHBondContact O-N 3.01Å; P70-F87 HydrophobicContact CG-CD2 4.42Å; P70-F87 HydrophobicContact CG-CE2 3.71Å
71	T	82.8	Confident	73.6	Confident	37 Å²	37	78.6 Å²	78.6	23%	0.227	44%	0.435	C	S	.	.			trans	-70.5	124.8	161.7	53.4	0	0	0	0	108.6	E21 E23 D73	E21-T71 HydrophobicContact CB-CG2 4.38Å; E21-T71 WeakPolarHBondContact CB-OG1 3.35Å; E21-T71 PolarHBondContact O-N 3.22Å; E21-T71 PolarHBondContact O-OG1 3.5Å; E23-T71 HydrophobicContact CB-CG2 3.7Å; T71-D73 PolarHBondContact O-N 3.03Å
72	C	65.8	Low	72.2	Confident	73 Å²	73	82.2 Å²	82.2	49%	0.493	46%	0.456	S	S	.	.			trans	-74.4	109.1	169.6	-55	0	0	0	0	107.9	P70 D74	P70-C72 PolarHBondContact O-N 3.01Å; C72-D74 PolarHBondContact O-N 2.86Å; C72-D74 VanDerWaalsContact O-N 3.15Å
73	D	58.1	Low	71.2	Confident	120 Å²	120	77.5 Å²	77.5	64%	0.642	43%	0.431	S	S	*	.			trans	-68.9	108.5	162.9	-81.6	-23.2	0	0	0	106.5	T71 E75 S76	T71-D73 PolarHBondContact O-N 3.03Å; D73-E75 PolarHBondContact O-N 3.06Å; D73-S76 PolarHBondContact O-N 3.29Å; D73-S76 PolarHBondContact O-OG 3.25Å
74	D	54.3	Low	70.8	Confident	168 Å²	168	78.4 Å²	78.4	90%	0.898	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	10.6	-177.9	-79.7	-34	0	0	0	115.7	C72	C72-D74 PolarHBondContact O-N 2.86Å; C72-D74 VanDerWaalsContact O-N 3.15Å
75	E	48.6	Very low	70.7	Confident	193 Å²	193	80.8 Å²	80.8	90%	0.902	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-3.9	-177.4	-66.8	-100.9	158.8	0	0	114	D73	D73-E75 PolarHBondContact O-N 3.06Å
76	S	51.6	Low	70.7	Confident	74 Å²	74	80.6 Å²	80.6	52%	0.517	44%	0.441	S	S	.	.			trans	-103.7	102.6	173.4	47.1	0	0	0	0	112	D73 D78	D73-S76 PolarHBondContact O-N 3.29Å; D73-S76 PolarHBondContact O-OG 3.25Å; S76-D78 PolarHBondContact O-N 3.14Å
77	D	52.6	Low	70.6	Confident	173 Å²	173	81.3 Å²	81.3	93%	0.925	44%	0.442	S	S	*	.			trans	-65.3	20.1	168.2	-82.1	-31.8	0	0	0	113.4	D79	D77-D79 PolarHBondContact O-N 3.16Å
78	D	55.5	Low	70.6	Confident	125 Å²	125	81.4 Å²	81.4	67%	0.668	44%	0.443	S	S	*	.			trans	-86.2	100.4	173.9	-94	-29.6	0	0	0	107.9	S76 S80	S76-D78 PolarHBondContact O-N 3.14Å; D78-S80 PolarHBondContact O-N 3.01Å
79	D	54.3	Low	70.7	Confident	172 Å²	172	81 Å²	81	92%	0.92	44%	0.441	S	S	*	.			trans	-62.1	55.7	162.9	-76.1	-42.9	0	0	0	110.1	D77	D77-D79 PolarHBondContact O-N 3.16Å
80	S	56.9	Low	71	Confident	47 Å²	47	79.9 Å²	79.9	33%	0.329	44%	0.436	S	S	.	.			trans	-83.6	130.6	175.8	81.4	0	0	0	0	108.3	D78 D82 D83	D78-S80 PolarHBondContact O-N 3.01Å; S80-D82 PolarHBondContact O-N 3.4Å; S80-D83 PolarHBondContact O-N 3.5Å
81	D	59.7	Low	71.4	Confident	147 Å²	147	79.2 Å²	79.2	79%	0.786	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-57.9	-10.5	177.8	-69.5	-39.8	0	0	0	112.8	D83 N84	D81-D83 VanDerWaalsContact C-N 3.33Å; D81-D83 PolarHBondContact O-N 2.91Å; D81-N84 PolarHBondContact O-N 3.24Å
82	D	60.1	Low	72	Confident	105 Å²	105	77.4 Å²	77.4	56%	0.561	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-69	-25.5	-177.7	-69	-17.4	0	0	0	113.3	S80 N84 I85	S80-D82 PolarHBondContact O-N 3.4Å; D82-N84 PolarHBondContact O-N 2.99Å; D82-N84 VanDerWaalsContact O-N 3.15Å; D82-I85 HydrophobicContact CB-CD1 4.21Å; D82-I85 WeakPolarHBondContact O-CG1 3.5Å; D82-I85 PolarHBondContact O-N 3.39Å
83	D	60	Low	73.5	Confident	53 Å²	53	74 Å²	74	28%	0.283	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-67.8	-15.2	-180	-67.8	-25.7	0	0	0	113.2	S80 D81	S80-D83 PolarHBondContact O-N 3.5Å; D81-D83 VanDerWaalsContact C-N 3.33Å; D81-D83 PolarHBondContact O-N 2.91Å
84	N	75.2	Confident	75.3	Confident	80 Å²	80	70.2 Å²	70.2	43%	0.428	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-102.1	10.2	179.7	-67.8	-49.4	0	0	0	113.6	S34 D81 D82 V86	S34-N84 PolarHBondContact OG-O 3.31Å; S34-N84 VanDerWaalsContact OG-O 3.06Å; D81-N84 PolarHBondContact O-N 3.24Å; D82-N84 PolarHBondContact O-N 2.99Å; D82-N84 VanDerWaalsContact O-N 3.15Å; N84-V86 PolarHBondContact O-N 3.47Å
85	I	90.4	Very high	77.2	Confident	54 Å²	54	62.2 Å²	62.2	28%	0.277	33%	0.334	S	S	.	.			trans	-75.3	117.8	177.4	-61.7	173.7	0	0	0	109.6	D82 F87 F149	D82-I85 HydrophobicContact CB-CD1 4.21Å; D82-I85 WeakPolarHBondContact O-CG1 3.5Å; D82-I85 PolarHBondContact O-N 3.39Å; I85-F87 HydrophobicContact CB-CE2 4.19Å; I85-F87 HydrophobicContact CG2-CD2 4.29Å; I85-F87 HydrophobicContact CG2-CE2 3.94Å; I85-F87 HydrophobicContact CG2-CZ 4.25Å; I85-F87 WeakPolarHBondContact O-CD2 3.1Å; I85-F149 HydrophobicContact CG2-CE2 4.21Å; I85-F149 HydrophobicContact CG2-CZ 4.3Å
86	V	94	Very high	79.4	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.012	30%	0.297	C	S	.	.			trans	-85.1	117.6	171.9	178.3	0	0	0	0	109.3	D31 L38 V67 K69 N84 A88	D31-V86 HydrophobicContact CB-CG2 3.84Å; L38-V86 HydrophobicContact CD1-CG1 3.88Å; V67-V86 HydrophobicContact CB-CG1 3.81Å; V67-V86 HydrophobicContact CB-CG2 4.24Å; V67-V86 HydrophobicContact CG1-CG1 4.07Å; V67-V86 HydrophobicContact CG1-CG2 4.46Å; K69-V86 HydrophobicContact CD-CG2 4.01Å; K69-V86 HydrophobicContact CG-CG2 4.02Å; N84-V86 PolarHBondContact O-N 3.47Å; V86-A88 WeakPolarHBondContact CG1-O 3.44Å
87	F	93.8	Very high	81.3	Confident	35 Å²	35	54.5 Å²	54.5	15%	0.154	29%	0.292	C	S	.	.			trans	-85.8	-28.8	179.5	-74.2	-96.7	0	0	0	112.8	L20 L22 V68 P70 I85 R148 F149 L152	L20-F87 HydrophobicContact CD2-CD2 4.31Å; L20-F87 HydrophobicContact CD2-CE1 4.06Å; L20-F87 HydrophobicContact CD2-CE2 3.63Å; L20-F87 HydrophobicContact CD2-CZ 3.48Å; L20-F87 VanDerWaalsContact CD2-CZ 3.48Å; L22-F87 HydrophobicContact CD2-CD2 3.9Å; L22-F87 HydrophobicContact CD2-CE2 4.34Å; L22-F87 HydrophobicContact CD2-CG 4.21Å; V68-F87 PolarHBondContact O-N 2.75Å; P70-F87 HydrophobicContact CG-CD2 4.42Å; P70-F87 HydrophobicContact CG-CE2 3.71Å; I85-F87 HydrophobicContact CB-CE2 4.19Å; I85-F87 HydrophobicContact CG2-CD2 4.29Å; I85-F87 HydrophobicContact CG2-CE2 3.94Å; I85-F87 HydrophobicContact CG2-CZ 4.25Å; I85-F87 WeakPolarHBondContact O-CD2 3.1Å; F87-R148 CarbonylContact O-C 3.51Å; F87-R148 VanDerWaalsContact O-CA 3.26Å; F87-R148 WeakPolarHBondContact O-CA 3.24Å; F87-F149 AromaticContact CD1-CD2 3.64Å; F87-F149 HydrophobicContact CD1-CD2 3.64Å; F87-F149 HydrophobicContact CD1-CE2 4.02Å; F87-F149 HydrophobicContact CE1-CD2 4.06Å; F87-F149 HydrophobicContact CE1-CE2 4.19Å; F87-F149 HydrophobicContact CG-CD2 4.43Å; F87-F149 PolarHBondContact O-N 2.68Å; F87-L152 HydrophobicContact CB-CD1 4.17Å; F87-L152 HydrophobicContact CB-CD2 4.33Å; F87-L152 HydrophobicContact CD1-CD2 4.36Å
88	A	95.5	Very high	83.2	Confident	3 Å²	3	52.3 Å²	52.3	3%	0.025	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	151.5	175.2	0	0	0	0	0	111.4	V67 V68 V86 E147 R148 L152	V67-A88 CarbonylContact C-O 3.51Å; V67-A88 VanDerWaalsContact CA-O 3.28Å; V67-A88 WeakPolarHBondContact CA-O 3.44Å; V68-A88 HydrophobicContact CB-CB 3.97Å; V68-A88 HydrophobicContact CG2-CB 3.98Å; V68-A88 PolarHBondContact N-O 2.9Å; V86-A88 WeakPolarHBondContact CG1-O 3.44Å; A88-E147 CarbonylContact C-O 3.49Å; A88-E147 VanDerWaalsContact CA-O 3.28Å; A88-E147 WeakPolarHBondContact CA-O 3.23Å; A88-R148 HydrophobicContact CB-CB 3.58Å; A88-L152 HydrophobicContact CB-CD1 3.87Å
89	V	96.1	Very high	85	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	125.3	172.4	60.5	0	0	0	0	109.3	I35 L38 I58 V67 I145 N146 E147	I35-V89 HydrophobicContact CD1-CG2 4.42Å; I35-V89 HydrophobicContact CG1-CB 4.4Å; I35-V89 HydrophobicContact CG1-CG2 4.22Å; I35-V89 HydrophobicContact CG2-CG2 4.41Å; L38-V89 HydrophobicContact CB-CG1 4.31Å; L38-V89 HydrophobicContact CD1-CB 4.27Å; L38-V89 HydrophobicContact CD1-CG1 3.85Å; I58-V89 HydrophobicContact CG2-CG2 4.34Å; V67-V89 HydrophobicContact CG1-CB 4.47Å; V67-V89 HydrophobicContact CG1-CG2 4.2Å; V89-I145 HydrophobicContact CG1-CG2 4.41Å; V89-N146 CarbonylContact O-C 3.56Å; V89-N146 VanDerWaalsContact O-CA 3.32Å; V89-N146 WeakPolarHBondContact O-CA 3.38Å; V89-E147 HydrophobicContact CG1-CB 3.99Å; V89-E147 PolarHBondContact N-O 3.3Å; V89-E147 PolarHBondContact O-N 2.85Å
90	T	96.6	Very high	86.9	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	123.5	167	-58.7	0	0	0	0	107.6	G65 T66 L144 I145 N146 A160 V161 L164	G65-T90 CarbonylContact C-O 3.59Å; G65-T90 WeakPolarHBondContact CA-O 3.32Å; T66-T90 PolarHBondContact N-O 3.4Å; T66-T90 PolarHBondContact O-N 2.97Å; T90-L144 HydrophobicContact CG2-CD1 4.14Å; T90-I145 CarbonylContact C-O 3.59Å; T90-I145 VanDerWaalsContact CA-O 3.26Å; T90-I145 WeakPolarHBondContact CA-O 3.48Å; T90-N146 PolarHBondContact OG1-ND2 3.34Å; T90-A160 WeakPolarHBondContact CB-O 3.33Å; T90-A160 WeakPolarHBondContact CG2-O 3.28Å; T90-A160 PolarHBondContact OG1-O 3.4Å; T90-V161 HydrophobicContact CG2-CG1 4.3Å; T90-L164 HydrophobicContact CG2-CD1 3.6Å; T90-L164 HydrophobicContact CG2-CD2 3.93Å; T90-L164 HydrophobicContact CG2-CG 3.77Å
91	S	96.7	Very high	88.7	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	172	175.8	-175.4	0	0	0	0	110.4	Q61 I145	Q61-S91 PolarHBondContact OE1-OG 3.33Å; S91-I145 PolarHBondContact N-O 2.96Å; S91-I145 PolarHBondContact O-N 3.49Å
92	V	96.8	Very high	90.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.4	179.8	-55	0	0	0	0	112.1	Q61 I64 F142 L143 L144 L164 F168	Q61-V92 PolarHBondContact NE2-O 3.43Å; Q61-V92 PolarHBondContact OE1-O 2.94Å; I64-V92 HydrophobicContact CB-CG2 4.46Å; I64-V92 HydrophobicContact CD1-CG2 3.34Å; I64-V92 HydrophobicContact CG1-CG2 3.74Å; I64-V92 HydrophobicContact CG2-CG2 3.91Å; V92-F142 HydrophobicContact CB-CD1 4.13Å; V92-F142 HydrophobicContact CG2-CD1 3.93Å; V92-F142 HydrophobicContact CG2-CE1 4.43Å; V92-L143 CarbonylContact C-O 3.41Å; V92-L143 VanDerWaalsContact CA-O 3.26Å; V92-L143 WeakPolarHBondContact CA-O 3.34Å; V92-L144 HydrophobicContact CG1-CD1 4.04Å; V92-L164 HydrophobicContact CG1-CD2 3.86Å; V92-F168 HydrophobicContact CB-CE1 4.36Å; V92-F168 HydrophobicContact CB-CZ 4.38Å; V92-F168 HydrophobicContact CG1-CE1 4.15Å; V92-F168 HydrophobicContact CG1-CZ 3.73Å; V92-F168 HydrophobicContact CG2-CE1 3.81Å; V92-F168 HydrophobicContact CG2-CZ 4.27Å
93	V	96.6	Very high	92.1	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	122	178.3	-174.5	0	0	0	0	109.2	L54 Y57 L95 V106 L109 F142 L143 I145	L54-V93 HydrophobicContact CD1-CG2 4.04Å; Y57-V93 HydrophobicContact CD1-CG1 4.48Å; Y57-V93 HydrophobicContact CD1-CG2 4.27Å; Y57-V93 HydrophobicContact CE1-CB 4.26Å; Y57-V93 HydrophobicContact CE1-CG1 3.84Å; Y57-V93 HydrophobicContact CE1-CG2 3.99Å; V93-L95 PolarHBondContact O-N 2.81Å; V93-V106 HydrophobicContact CG1-CG1 4.49Å; V93-V106 HydrophobicContact CG1-CG2 3.71Å; V93-L109 HydrophobicContact CB-CD1 4.46Å; V93-L109 HydrophobicContact CG1-CD1 3.95Å; V93-L109 HydrophobicContact CG2-CD1 4.37Å; V93-F142 CarbonylContact O-C 3.52Å; V93-F142 VanDerWaalsContact O-CA 3.28Å; V93-F142 WeakPolarHBondContact O-CA 3.31Å; V93-L143 HydrophobicContact CB-CB 4.24Å; V93-L143 PolarHBondContact N-O 3.32Å; V93-L143 PolarHBondContact O-N 3.4Å; V93-I145 HydrophobicContact CG2-CG1 4.21Å
94	D	95.3	Very high	93.7	Very high	41 Å²	41	42.1 Å²	42.1	22%	0.219	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	116.7	173.4	179.1	9.7	0	0	0	109.8	S96 S99 V106 F142	D94-S96 VanDerWaalsContact C-N 3.3Å; D94-S96 VanDerWaalsContact CG-OG 3.24Å; D94-S96 WeakPolarHBondContact OD1-CB 3.19Å; D94-S96 PolarHBondContact OD1-N 3.44Å; D94-S96 PolarHBondContact OD1-OG 3.44Å; D94-S96 VanDerWaalsContact OD1-OG 3.14Å; D94-S96 PolarHBondContact OD2-OG 3.05Å; D94-S99 VanDerWaalsContact O-CB 3.23Å; D94-S99 WeakPolarHBondContact O-CB 3.46Å; D94-S99 PolarHBondContact O-OG 3.45Å; D94-V106 WeakPolarHBondContact O-CG1 3.48Å; D94-F142 HydrophobicContact CB-CD1 4.13Å; D94-F142 HydrophobicContact CB-CE1 3.59Å; D94-F142 HydrophobicContact CB-CZ 3.87Å
95	L	95.6	Very high	94.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.203	C	C	.	.			trans	-88.7	7	-178.8	-60.9	176.9	0	0	0	113.5	V93 L109 R110 I113 L133 S141 L143 F179	V93-L95 PolarHBondContact O-N 2.81Å; L95-L109 HydrophobicContact CD2-CB 4.49Å; L95-R110 PolarHBondContact O-NH1 3.39Å; L95-I113 HydrophobicContact CD1-CD1 3.99Å; L95-I113 HydrophobicContact CD2-CD1 4.35Å; L95-L133 HydrophobicContact CB-CD2 4.5Å; L95-L133 HydrophobicContact CD1-CD2 4.04Å; L95-S141 WeakPolarHBondContact CB-O 3.39Å; L95-S141 PolarHBondContact N-O 3.03Å; L95-L143 HydrophobicContact CD1-CB 4.04Å; L95-L143 HydrophobicContact CD2-CB 4.01Å; L95-L143 HydrophobicContact CG-CB 4.1Å; L95-F179 HydrophobicContact CD1-CB 4.35Å; L95-F179 HydrophobicContact CD1-CD1 4.47Å; L95-F179 HydrophobicContact CD1-CD2 4.39Å; L95-F179 HydrophobicContact CD1-CG 4.17Å
96	S	93.8	Very high	95	Very high	18 Å²	18	36 Å²	36	13%	0.126	19%	0.19	C	C	.	.	S	Bend	trans	-58.6	150.5	176.6	72	0	0	0	0	112.3	D94 E98 S99 A100	D94-S96 VanDerWaalsContact C-N 3.3Å; D94-S96 VanDerWaalsContact CG-OG 3.24Å; D94-S96 WeakPolarHBondContact OD1-CB 3.19Å; D94-S96 PolarHBondContact OD1-N 3.44Å; D94-S96 PolarHBondContact OD1-OG 3.44Å; D94-S96 VanDerWaalsContact OD1-OG 3.14Å; D94-S96 PolarHBondContact OD2-OG 3.05Å; S96-E98 PolarHBondContact O-N 2.98Å; S96-S99 PolarHBondContact O-N 3.3Å; S96-S99 VanDerWaalsContact O-N 3.16Å; S96-S99 WeakPolarHBondContact OG-CB 3.49Å; S96-S99 PolarHBondContact OG-N 2.88Å; S96-S99 VanDerWaalsContact OG-N 3.15Å; S96-A100 WeakPolarHBondContact O-CB 3.4Å; S96-A100 PolarHBondContact O-N 2.87Å
97	H	92.5	Very high	95.1	Very high	88 Å²	88	41.4 Å²	41.4	41%	0.407	21%	0.213	S	C	.	.	H	α-helix	trans	-56.8	-35	171.5	-74.9	-61.6	0	0	0	111.6	A100 V101 R110 D136	H97-A100 PolarHBondContact O-N 2.87Å; H97-V101 VanDerWaalsContact O-CG2 3.26Å; H97-V101 WeakPolarHBondContact O-CG2 3.34Å; H97-V101 PolarHBondContact O-N 2.94Å; H97-R110 PolarHBondContact CE1-NH2 2.77Å; H97-R110 PolarHBondContact NE2-NH2 2.95Å; H97-R110 VanDerWaalsContact NE2-NH2 3.19Å; H97-D136 WeakPolarHBondContact CA-OD2 3.45Å; H97-D136 WeakPolarHBondContact CB-OD2 3.42Å; H97-D136 IonicContact CD2-OD2 2.66Å; H97-D136 PolarHBondContact CD2-OD2 3.16Å; H97-D136 IonicContact CG-OD2 2.81Å; H97-D136 PolarHBondContact N-OD2 3.22Å
98	E	92.4	Very high	95.2	Very high	127 Å²	127	42.3 Å²	42.3	59%	0.593	22%	0.219	S	C	*	.	H	α-helix	trans	-62.5	-46.9	176	-175.7	179.5	165.4	0	0	111.1	S96 V101 K102	S96-E98 PolarHBondContact O-N 2.98Å; E98-V101 PolarHBondContact O-N 2.85Å; E98-K102 WeakPolarHBondContact O-CG 3.5Å; E98-K102 PolarHBondContact O-N 2.76Å; E98-K102 WeakPolarHBondContact OE1-CE 3.11Å; E98-K102 IonicContact OE1-NZ 2.85Å; E98-K102 PolarHBondContact OE1-NZ 3Å
99	S	93.5	Very high	95.2	Very high	8 Å²	8	42.1 Å²	42.1	6%	0.056	22%	0.218	C	C	.	.	H	α-helix	trans	-63.9	-43.5	176	-174.5	0	0	0	0	111.6	D94 S96 V101 K102 H103	D94-S99 VanDerWaalsContact O-CB 3.23Å; D94-S99 WeakPolarHBondContact O-CB 3.46Å; D94-S99 PolarHBondContact O-OG 3.45Å; S96-S99 PolarHBondContact O-N 3.3Å; S96-S99 VanDerWaalsContact O-N 3.16Å; S96-S99 WeakPolarHBondContact OG-CB 3.49Å; S96-S99 PolarHBondContact OG-N 2.88Å; S96-S99 VanDerWaalsContact OG-N 3.15Å; S99-V101 VanDerWaalsContact C-N 3.28Å; S99-V101 PolarHBondContact O-N 3.44Å; S99-K102 PolarHBondContact O-N 3.34Å; S99-H103 PolarHBondContact O-N 3.01Å
100	A	93.9	Very high	95.1	Very high	11 Å²	11	42.7 Å²	42.7	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-28.2	177.1	0	0	0	0	0	113.9	S96 H97 V106 K107	S96-A100 WeakPolarHBondContact O-CB 3.4Å; S96-A100 PolarHBondContact O-N 2.87Å; H97-A100 PolarHBondContact O-N 2.87Å; A100-V106 HydrophobicContact CB-CG1 4.05Å; A100-K107 HydrophobicContact CB-CB 4.22Å
101	V	94.7	Very high	95	Very high	130 Å²	130	46.2 Å²	46.2	79%	0.788	24%	0.239	S	C	*	.	H	α-helix	trans	-74.5	-35	173.6	168.8	0	0	0	0	111.3	H97 E98 S99	H97-V101 VanDerWaalsContact O-CG2 3.26Å; H97-V101 WeakPolarHBondContact O-CG2 3.34Å; H97-V101 PolarHBondContact O-N 2.94Å; E98-V101 PolarHBondContact O-N 2.85Å; S99-V101 VanDerWaalsContact C-N 3.28Å; S99-V101 PolarHBondContact O-N 3.44Å
102	K	94.7	Very high	94.9	Very high	132 Å²	132	46.2 Å²	46.2	57%	0.574	24%	0.239	S	C	*	.	H	α-helix	trans	-80.2	-37.2	-178.7	-68.4	175.4	-171.4	170.1	0	112.8	E98 S99	E98-K102 WeakPolarHBondContact O-CG 3.5Å; E98-K102 PolarHBondContact O-N 2.76Å; E98-K102 WeakPolarHBondContact OE1-CE 3.11Å; E98-K102 IonicContact OE1-NZ 2.85Å; E98-K102 PolarHBondContact OE1-NZ 3Å; S99-K102 PolarHBondContact O-N 3.34Å
103	H	95.2	Very high	94.8	Very high	78 Å²	78	46.2 Å²	46.2	36%	0.361	24%	0.239	S	C	.	.			trans	-123.7	116.6	-171.7	-57.6	-76.5	0	0	0	110.6	Y57 S99 V105 V106 K107	Y57-H103 HydrophobicContact CD2-CB 4.16Å; Y57-H103 AromaticContact CD2-CG 3.9Å; Y57-H103 AromaticContact CD2-ND1 3.87Å; Y57-H103 HydrophobicContact CE2-CB 4.09Å; Y57-H103 AromaticContact CE2-CD2 3.73Å; Y57-H103 AromaticContact CE2-CG 3.63Å; Y57-H103 AromaticContact CE2-ND1 3.88Å; S99-H103 PolarHBondContact O-N 3.01Å; H103-V105 VanDerWaalsContact C-N 3.26Å; H103-V105 HydrophobicContact CB-CG1 4.46Å; H103-V105 PolarHBondContact O-N 3.21Å; H103-V106 HydrophobicContact CB-CB 4.17Å; H103-V106 HydrophobicContact CB-CG2 3.68Å; H103-V106 WeakPolarHBondContact O-CB 3.4Å; H103-V106 PolarHBondContact O-N 3.01Å; H103-V106 VanDerWaalsContact O-N 3.14Å; H103-K107 PolarHBondContact O-N 3.32Å
104	S	95.4	Very high	94.7	Very high	75 Å²	75	47.8 Å²	47.8	52%	0.524	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-35.8	-179	56.6	0	0	0	0	112.6	V106 K107 D108	S104-V106 VanDerWaalsContact C-N 3.3Å; S104-V106 PolarHBondContact O-N 2.84Å; S104-K107 WeakPolarHBondContact O-CB 3.43Å; S104-K107 PolarHBondContact O-N 2.79Å; S104-D108 VanDerWaalsContact O-CG 3.29Å; S104-D108 PolarHBondContact O-N 2.83Å
105	V	96.1	Very high	94.6	Very high	7 Å²	7	50.2 Å²	50.2	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-36.3	178	67.2	0	0	0	0	112.4	N53 L54 Y57 H103 D108 L109	N53-V105 HydrophobicContact CB-CB 4.33Å; N53-V105 HydrophobicContact CB-CG2 4.41Å; L54-V105 HydrophobicContact CB-CG2 3.76Å; L54-V105 HydrophobicContact CD1-CG2 4.06Å; L54-V105 HydrophobicContact CG-CG2 4.47Å; Y57-V105 HydrophobicContact CD2-CG1 4.04Å; Y57-V105 HydrophobicContact CG-CG1 3.94Å; H103-V105 VanDerWaalsContact C-N 3.26Å; H103-V105 HydrophobicContact CB-CG1 4.46Å; H103-V105 PolarHBondContact O-N 3.21Å; V105-D108 PolarHBondContact O-N 2.88Å; V105-L109 WeakPolarHBondContact O-CB 3.24Å; V105-L109 VanDerWaalsContact O-CG 3.31Å; V105-L109 WeakPolarHBondContact O-CG 3.1Å; V105-L109 PolarHBondContact O-N 2.98Å
106	V	96.2	Very high	94.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-40.3	176.2	178.1	0	0	0	0	110.4	Y57 V93 D94 A100 H103 S104 D108 L109 R110	Y57-V106 HydrophobicContact CD2-CG2 4.44Å; Y57-V106 HydrophobicContact CE2-CG2 3.96Å; V93-V106 HydrophobicContact CG1-CG1 4.49Å; V93-V106 HydrophobicContact CG1-CG2 3.71Å; D94-V106 WeakPolarHBondContact O-CG1 3.48Å; A100-V106 HydrophobicContact CB-CG1 4.05Å; H103-V106 HydrophobicContact CB-CB 4.17Å; H103-V106 HydrophobicContact CB-CG2 3.68Å; H103-V106 WeakPolarHBondContact O-CB 3.4Å; H103-V106 PolarHBondContact O-N 3.01Å; H103-V106 VanDerWaalsContact O-N 3.14Å; S104-V106 VanDerWaalsContact C-N 3.3Å; S104-V106 PolarHBondContact O-N 2.84Å; V106-D108 VanDerWaalsContact C-N 3.34Å; V106-D108 PolarHBondContact O-N 2.61Å; V106-L109 PolarHBondContact O-N 3.32Å; V106-R110 WeakPolarHBondContact O-CB 3.33Å; V106-R110 PolarHBondContact O-N 2.81Å
107	K	95.6	Very high	94.4	Very high	115 Å²	115	49.4 Å²	49.4	50%	0.5	25%	0.251	S	S	.	.	H	α-helix	trans	-60.3	-44.5	173	-177.3	-176	175.4	-174.1	0	111.7	A100 H103 S104 R110 N111	A100-K107 HydrophobicContact CB-CB 4.22Å; H103-K107 PolarHBondContact O-N 3.32Å; S104-K107 WeakPolarHBondContact O-CB 3.43Å; S104-K107 PolarHBondContact O-N 2.79Å; K107-R110 PolarHBondContact O-N 2.98Å; K107-N111 VanDerWaalsContact O-CG 3.23Å; K107-N111 PolarHBondContact O-N 3.41Å; K107-N111 PolarHBondContact O-ND2 3.2Å
108	D	95.6	Very high	94.5	Very high	53 Å²	53	49.5 Å²	49.5	28%	0.283	26%	0.255	S	S	.	.	H	α-helix	trans	-65.2	-43	179.3	-65.7	-22.2	0	0	0	110.9	I49 S104 V105 V106 R110 N111 F112	I49-D108 VanDerWaalsContact CD1-C 3.42Å; I49-D108 HydrophobicContact CD1-CB 3.91Å; I49-D108 WeakPolarHBondContact CD1-O 3.46Å; S104-D108 VanDerWaalsContact O-CG 3.29Å; S104-D108 PolarHBondContact O-N 2.83Å; V105-D108 PolarHBondContact O-N 2.88Å; V106-D108 VanDerWaalsContact C-N 3.34Å; V106-D108 PolarHBondContact O-N 2.61Å; D108-R110 PolarHBondContact O-N 3.34Å; D108-N111 PolarHBondContact O-N 3.35Å; D108-F112 WeakPolarHBondContact O-CB 3.1Å; D108-F112 PolarHBondContact O-N 2.89Å
109	L	96.1	Very high	94.4	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.3	-46	173.7	-75.6	171.6	0	0	0	112.3	F43 I49 L54 V93 L95 V105 V106 N111 F112 I113 L143	F43-L109 HydrophobicContact CE1-CD2 3.79Å; F43-L109 HydrophobicContact CZ-CD2 3.6Å; I49-L109 HydrophobicContact CD1-CD2 3.99Å; I49-L109 HydrophobicContact CD1-CG 4.31Å; I49-L109 HydrophobicContact CG1-CD2 4.32Å; I49-L109 HydrophobicContact CG2-CD2 4.25Å; L54-L109 HydrophobicContact CD1-CD1 3.83Å; L54-L109 HydrophobicContact CD2-CD1 4.45Å; L54-L109 HydrophobicContact CD2-CD2 4.38Å; V93-L109 HydrophobicContact CB-CD1 4.46Å; V93-L109 HydrophobicContact CG1-CD1 3.95Å; V93-L109 HydrophobicContact CG2-CD1 4.37Å; L95-L109 HydrophobicContact CD2-CB 4.49Å; V105-L109 WeakPolarHBondContact O-CB 3.24Å; V105-L109 VanDerWaalsContact O-CG 3.31Å; V105-L109 WeakPolarHBondContact O-CG 3.1Å; V105-L109 PolarHBondContact O-N 2.98Å; V106-L109 PolarHBondContact O-N 3.32Å; L109-N111 VanDerWaalsContact C-N 3.35Å; L109-N111 PolarHBondContact O-N 2.96Å; L109-F112 PolarHBondContact O-N 2.88Å; L109-I113 WeakPolarHBondContact O-CG1 3.06Å; L109-I113 PolarHBondContact O-N 2.98Å; L109-L143 HydrophobicContact CD1-CD2 4.09Å; L109-L143 HydrophobicContact CD2-CD2 4.01Å
110	R	94.7	Very high	94.3	Very high	11 Å²	11	44.8 Å²	44.8	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-45.7	177.5	-173.8	-177.6	172.9	103.1	4.5	111.2	L95 H97 V106 K107 D108 I113 L114 L133 D134 D136	L95-R110 PolarHBondContact O-NH1 3.39Å; H97-R110 PolarHBondContact CE1-NH2 2.77Å; H97-R110 PolarHBondContact NE2-NH2 2.95Å; H97-R110 VanDerWaalsContact NE2-NH2 3.19Å; V106-R110 WeakPolarHBondContact O-CB 3.33Å; V106-R110 PolarHBondContact O-N 2.81Å; K107-R110 PolarHBondContact O-N 2.98Å; D108-R110 PolarHBondContact O-N 3.34Å; R110-I113 PolarHBondContact O-N 3.13Å; R110-L114 HydrophobicContact CG-CD1 3.98Å; R110-L114 WeakPolarHBondContact O-CB 3.39Å; R110-L114 VanDerWaalsContact O-CG 3.3Å; R110-L114 WeakPolarHBondContact O-CG 3.44Å; R110-L114 PolarHBondContact O-N 2.92Å; R110-L133 PolarHBondContact NH1-O 3.41Å; R110-L133 PolarHBondContact NH2-O 3.18Å; R110-D134 IonicContact NH2-OD1 3.37Å; R110-D134 PolarHBondContact NH2-OD1 2.97Å; R110-D136 IonicContact NH1-OD1 2.79Å
111	N	94	Very high	94.1	Very high	76 Å²	76	52.4 Å²	52.4	41%	0.406	27%	0.269	S	S	.	.	H	α-helix	trans	-63.2	-42.8	177.7	-69.3	-24.8	0	0	0	111.6	K107 D108 L109 L114 E115	K107-N111 VanDerWaalsContact O-CG 3.23Å; K107-N111 PolarHBondContact O-N 3.41Å; K107-N111 PolarHBondContact O-ND2 3.2Å; D108-N111 PolarHBondContact O-N 3.35Å; L109-N111 VanDerWaalsContact C-N 3.35Å; L109-N111 PolarHBondContact O-N 2.96Å; N111-L114 PolarHBondContact O-N 2.83Å; N111-E115 VanDerWaalsContact O-CB 3.31Å; N111-E115 WeakPolarHBondContact O-CB 3.4Å; N111-E115 PolarHBondContact O-N 2.94Å
112	F	95	Very high	93.8	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	25%	0.25	C	S	.	.	H	α-helix	trans	-58.8	-48.8	176.4	173.3	-87.1	0	0	0	111.6	F43 P44 C47 V48 I49 D108 L109 L114 E115 G116 L181 L221 L246	F43-F112 HydrophobicContact CD1-CD1 4.49Å; F43-F112 AromaticContact CD1-CE1 3.92Å; F43-F112 HydrophobicContact CD1-CE1 3.92Å; F43-F112 HydrophobicContact CD1-CE2 4.17Å; F43-F112 AromaticContact CD1-CZ 3.73Å; F43-F112 HydrophobicContact CD1-CZ 3.73Å; F43-F112 HydrophobicContact CE1-CD1 4.44Å; F43-F112 HydrophobicContact CE1-CE1 4.15Å; F43-F112 HydrophobicContact CE1-CZ 4.42Å; P44-F112 HydrophobicContact CG-CE2 4.46Å; P44-F112 HydrophobicContact CG-CZ 4.31Å; C47-F112 HydrophobicContact CB-CE2 4.04Å; V48-F112 HydrophobicContact CG2-CB 4.49Å; V48-F112 HydrophobicContact CG2-CD2 4.3Å; I49-F112 HydrophobicContact CD1-CB 3.69Å; I49-F112 HydrophobicContact CD1-CD2 4.35Å; I49-F112 HydrophobicContact CD1-CG 4.12Å; I49-F112 HydrophobicContact CG1-CB 4.13Å; I49-F112 HydrophobicContact CG1-CD2 3.86Å; I49-F112 HydrophobicContact CG1-CE2 4.43Å; I49-F112 HydrophobicContact CG1-CG 4Å; D108-F112 WeakPolarHBondContact O-CB 3.1Å; D108-F112 PolarHBondContact O-N 2.89Å; L109-F112 PolarHBondContact O-N 2.88Å; F112-L114 PolarHBondContact O-N 3.27Å; F112-E115 PolarHBondContact O-N 3.3Å; F112-G116 PolarHBondContact O-N 3.25Å; F112-L181 HydrophobicContact CE1-CD1 3.99Å; F112-L221 HydrophobicContact CD2-CB 4.21Å; F112-L221 HydrophobicContact CD2-CD2 3.92Å; F112-L221 HydrophobicContact CD2-CG 4.45Å; F112-L221 HydrophobicContact CE1-CD1 3.98Å; F112-L221 HydrophobicContact CE2-CB 3.63Å; F112-L221 HydrophobicContact CE2-CD1 3.86Å; F112-L221 HydrophobicContact CE2-CD2 4.01Å; F112-L221 HydrophobicContact CE2-CG 4.05Å; F112-L221 HydrophobicContact CG-CD2 4.25Å; F112-L221 HydrophobicContact CZ-CB 4.16Å; F112-L221 HydrophobicContact CZ-CD1 3.54Å; F112-L221 HydrophobicContact CZ-CD2 4.39Å; F112-L221 HydrophobicContact CZ-CG 4.24Å; F112-L221 WeakPolarHBondContact O-CD2 3.48Å; F112-L246 HydrophobicContact CE1-CD2 4.4Å; F112-L246 HydrophobicContact CZ-CD2 4.13Å
113	I	94.4	Very high	93.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-47.6	177.7	-65.7	168	0	0	0	109.9	L95 L109 R110 E115 G116 V117 L133 L143 L248	L95-I113 HydrophobicContact CD1-CD1 3.99Å; L95-I113 HydrophobicContact CD2-CD1 4.35Å; L109-I113 WeakPolarHBondContact O-CG1 3.06Å; L109-I113 PolarHBondContact O-N 2.98Å; R110-I113 PolarHBondContact O-N 3.13Å; I113-E115 PolarHBondContact O-N 3.1Å; I113-G116 PolarHBondContact O-N 3.42Å; I113-V117 HydrophobicContact CG2-CG2 4.13Å; I113-V117 WeakPolarHBondContact O-CB 3.23Å; I113-V117 WeakPolarHBondContact O-CG2 3.43Å; I113-V117 PolarHBondContact O-N 2.89Å; I113-L133 HydrophobicContact CG2-CD1 3.79Å; I113-L143 HydrophobicContact CD1-CD1 4.43Å; I113-L248 HydrophobicContact CG2-CD1 4.47Å; I113-L248 HydrophobicContact CG2-CD2 3.86Å
114	L	93.3	Very high	93.3	Very high	32 Å²	32	47.9 Å²	47.9	17%	0.168	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-40.3	179.6	-74	170.9	0	0	0	112.7	R110 N111 F112 V117 N118 E130 L133	R110-L114 HydrophobicContact CG-CD1 3.98Å; R110-L114 WeakPolarHBondContact O-CB 3.39Å; R110-L114 VanDerWaalsContact O-CG 3.3Å; R110-L114 WeakPolarHBondContact O-CG 3.44Å; R110-L114 PolarHBondContact O-N 2.92Å; N111-L114 PolarHBondContact O-N 2.83Å; F112-L114 PolarHBondContact O-N 3.27Å; L114-V117 PolarHBondContact O-N 3.4Å; L114-N118 VanDerWaalsContact O-CB 3.28Å; L114-N118 WeakPolarHBondContact O-CB 3.48Å; L114-N118 PolarHBondContact O-N 3.19Å; L114-N118 PolarHBondContact O-ND2 3.22Å; L114-E130 HydrophobicContact CD2-CG 4.33Å; L114-L133 HydrophobicContact CD2-CB 4.38Å; L114-L133 HydrophobicContact CD2-CD1 3.65Å; L114-L133 HydrophobicContact CG-CD1 4.05Å
115	E	93.4	Very high	93.1	Very high	93 Å²	93	46.1 Å²	46.1	44%	0.435	24%	0.241	S	C	.	.	H	α-helix	trans	-62.7	-47	177	-177.8	165.8	-164.4	0	0	111	N111 F112 I113 V117 N118 A119 L221	N111-E115 VanDerWaalsContact O-CB 3.31Å; N111-E115 WeakPolarHBondContact O-CB 3.4Å; N111-E115 PolarHBondContact O-N 2.94Å; F112-E115 PolarHBondContact O-N 3.3Å; I113-E115 PolarHBondContact O-N 3.1Å; E115-V117 VanDerWaalsContact C-N 3.35Å; E115-V117 PolarHBondContact O-N 3.29Å; E115-N118 PolarHBondContact O-N 3.3Å; E115-A119 WeakPolarHBondContact O-CB 3.46Å; E115-A119 PolarHBondContact O-N 3.3Å; E115-L221 HydrophobicContact CB-CD2 4.1Å; E115-L221 HydrophobicContact CG-CD2 4.2Å
116	G	93.2	Very high	92.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.4	-39.4	177.8	0	0	0	0	0	112.5	F112 I113 A119 S120	F112-G116 PolarHBondContact O-N 3.25Å; I113-G116 PolarHBondContact O-N 3.42Å; G116-A119 PolarHBondContact O-N 2.88Å; G116-S120 PolarHBondContact O-N 3.34Å
117	V	93.4	Very high	92.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-49.6	175.3	170.8	0	0	0	0	109.8	I113 L114 E115 A119 S120 R126 V129 E130 L214 L216 L248	I113-V117 HydrophobicContact CG2-CG2 4.13Å; I113-V117 WeakPolarHBondContact O-CB 3.23Å; I113-V117 WeakPolarHBondContact O-CG2 3.43Å; I113-V117 PolarHBondContact O-N 2.89Å; L114-V117 PolarHBondContact O-N 3.4Å; E115-V117 VanDerWaalsContact C-N 3.35Å; E115-V117 PolarHBondContact O-N 3.29Å; V117-A119 PolarHBondContact O-N 2.86Å; V117-S120 VanDerWaalsContact O-CB 3.3Å; V117-S120 WeakPolarHBondContact O-CB 3.43Å; V117-S120 PolarHBondContact O-N 3.5Å; V117-R126 HydrophobicContact CG1-CB 3.9Å; V117-R126 HydrophobicContact CG1-CG 4.29Å; V117-R126 WeakPolarHBondContact O-CD 3.09Å; V117-R126 WeakPolarHBondContact O-CG 3.49Å; V117-V129 HydrophobicContact CG1-CB 4.13Å; V117-V129 HydrophobicContact CG1-CG1 4.25Å; V117-V129 HydrophobicContact CG2-CB 4.31Å; V117-V129 HydrophobicContact CG2-CG1 3.62Å; V117-E130 HydrophobicContact CG1-CG 4Å; V117-L214 HydrophobicContact CB-CD2 4.25Å; V117-L214 HydrophobicContact CG1-CD2 4.02Å; V117-L214 HydrophobicContact CG2-CD2 3.92Å; V117-L216 HydrophobicContact CG2-CD2 3.99Å; V117-L248 HydrophobicContact CG2-CD2 3.94Å
118	N	92.9	Very high	92.5	Very high	90 Å²	90	51 Å²	51	48%	0.481	27%	0.267	S	S	.	.	H	α-helix	trans	-59	-35.2	179.1	-86.6	-66.7	0	0	0	112.7	L114 E115 R126 E130	L114-N118 VanDerWaalsContact O-CB 3.28Å; L114-N118 WeakPolarHBondContact O-CB 3.48Å; L114-N118 PolarHBondContact O-N 3.19Å; L114-N118 PolarHBondContact O-ND2 3.22Å; E115-N118 PolarHBondContact O-N 3.3Å; N118-R126 PolarHBondContact O-NH1 3Å; N118-E130 PolarHBondContact OD1-OE1 3Å
119	A	92.1	Very high	92.4	Very high	34 Å²	34	48.5 Å²	48.5	28%	0.281	25%	0.254	S	S	.	.	H	α-helix	trans	-84.9	-23.2	-179.9	0	0	0	0	0	114.6	E115 G116 V117 D217 S220	E115-A119 WeakPolarHBondContact O-CB 3.46Å; E115-A119 PolarHBondContact O-N 3.3Å; G116-A119 PolarHBondContact O-N 2.88Å; V117-A119 PolarHBondContact O-N 2.86Å; A119-D217 HydrophobicContact CB-CB 3.78Å; A119-S220 VanDerWaalsContact CB-OG 3.24Å; A119-S220 WeakPolarHBondContact CB-OG 3.37Å
120	S	91.1	Very high	92.2	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.021	26%	0.264	C	S	.	.	S	Bend	trans	-48.9	150	179.5	176.6	0	0	0	0	112.6	G116 V117 N122 R126 L214 E215	G116-S120 PolarHBondContact O-N 3.34Å; V117-S120 VanDerWaalsContact O-CB 3.3Å; V117-S120 WeakPolarHBondContact O-CB 3.43Å; V117-S120 PolarHBondContact O-N 3.5Å; S120-N122 PolarHBondContact O-N 2.87Å; S120-R126 PolarHBondContact O-NE 3.49Å; S120-R126 PolarHBondContact O-NH2 3.23Å; S120-L214 WeakPolarHBondContact OG-CD1 3.46Å; S120-E215 WeakPolarHBondContact CB-O 3.3Å; S120-E215 PolarHBondContact OG-O 3.22Å
121	K	89	Confident	92	Very high	170 Å²	170	54.9 Å²	54.9	74%	0.739	28%	0.284	S	S	*	.	S	Bend	trans	-75.2	-17	-179.9	-65.7	172	-174.6	168.9	0	115.2	V123	K121-V123 PolarHBondContact O-N 3.28Å
122	N	88.5	Confident	91.9	Very high	73 Å²	73	52.1 Å²	52.1	39%	0.39	27%	0.269	S	S	.	.			trans	-93	80.4	-168.7	-171.9	-21.3	0	0	0	113.8	S120 P124 M125 R126 L214	S120-N122 PolarHBondContact O-N 2.87Å; N122-P124 WeakPolarHBondContact OD1-CD 3.47Å; N122-M125 HydrophobicContact CB-CB 4.19Å; N122-M125 PolarHBondContact O-N 2.94Å; N122-M125 PolarHBondContact OD1-N 2.85Å; N122-R126 WeakPolarHBondContact O-CG 3.4Å; N122-R126 PolarHBondContact O-N 2.79Å; N122-R126 VanDerWaalsContact O-N 3.09Å; N122-L214 HydrophobicContact CB-CD1 3.86Å
123	V	88.9	Confident	91.7	Very high	81 Å²	81	52.1 Å²	52.1	49%	0.491	27%	0.269	S	S	.	.	H	α-helix	trans	-50.3	-48.7	-174.7	-178.4	0	0	0	0	114.5	K121 M125 R126 C127	K121-V123 PolarHBondContact O-N 3.28Å; V123-M125 PolarHBondContact O-N 2.82Å; V123-R126 WeakPolarHBondContact O-CB 3.31Å; V123-R126 PolarHBondContact O-N 3.12Å; V123-C127 PolarHBondContact O-N 3.12Å
124	P	90.3	Very high	91.4	Very high	92 Å²	92	56.7 Å²	56.7	60%	0.597	29%	0.294	S	S	*	.	H	α-helix	trans	-61	-31.7	179.7	-24.3	34.1	0	0	0	114.2	N122	N122-P124 WeakPolarHBondContact OD1-CD 3.47Å
125	M	90.8	Very high	90.8	Very high	38 Å²	38	60.1 Å²	60.1	19%	0.187	31%	0.307	C	S	.	.	H	α-helix	trans	-76.8	-37.1	177.6	-162.3	71.9	76.2	0	0	111.2	N122 V123 C127 K128 V129 H212 L214	N122-M125 HydrophobicContact CB-CB 4.19Å; N122-M125 PolarHBondContact O-N 2.94Å; N122-M125 PolarHBondContact OD1-N 2.85Å; V123-M125 PolarHBondContact O-N 2.82Å; M125-C127 PolarHBondContact O-N 2.68Å; M125-K128 PolarHBondContact O-N 3.31Å; M125-K128 VanDerWaalsContact O-N 3.13Å; M125-V129 HydrophobicContact CG-CG2 4.49Å; M125-V129 WeakPolarHBondContact O-CG2 3.45Å; M125-V129 PolarHBondContact O-N 2.93Å; M125-V129 VanDerWaalsContact O-N 3.07Å; M125-H212 HydrophobicContact CG-CB 4.43Å; M125-H212 HydrophobicContact SD-CB 3.68Å; M125-H212 PolarHBondContact SD-ND1 3.22Å; M125-L214 HydrophobicContact CB-CD1 3.84Å; M125-L214 HydrophobicContact CG-CB 4.32Å; M125-L214 HydrophobicContact CG-CD1 3.89Å
126	R	91.9	Very high	89.9	Confident	57 Å²	57	57.2 Å²	57.2	22%	0.215	30%	0.295	C	S	.	.	H	α-helix	trans	-53.1	-52.1	177.3	-56.7	-178.1	-157.8	169	5.9	112	V117 N118 S120 N122 V123 K128 V129 E130	V117-R126 HydrophobicContact CG1-CB 3.9Å; V117-R126 HydrophobicContact CG1-CG 4.29Å; V117-R126 WeakPolarHBondContact O-CD 3.09Å; V117-R126 WeakPolarHBondContact O-CG 3.49Å; N118-R126 PolarHBondContact O-NH1 3Å; S120-R126 PolarHBondContact O-NE 3.49Å; S120-R126 PolarHBondContact O-NH2 3.23Å; N122-R126 WeakPolarHBondContact O-CG 3.4Å; N122-R126 PolarHBondContact O-N 2.79Å; N122-R126 VanDerWaalsContact O-N 3.09Å; V123-R126 WeakPolarHBondContact O-CB 3.31Å; V123-R126 PolarHBondContact O-N 3.12Å; R126-K128 PolarHBondContact O-N 2.6Å; R126-V129 PolarHBondContact O-N 3Å; R126-E130 WeakPolarHBondContact O-CG 3.33Å; R126-E130 PolarHBondContact O-N 2.81Å
127	C	91.5	Very high	88.7	Confident	59 Å²	59	63.5 Å²	63.5	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-58.9	-36.6	-178.3	-61.1	0	0	0	0	112.1	V123 M125 E131	V123-C127 PolarHBondContact O-N 3.12Å; M125-C127 PolarHBondContact O-N 2.68Å; C127-E131 WeakPolarHBondContact O-CB 3.49Å; C127-E131 VanDerWaalsContact O-CG 3.28Å; C127-E131 WeakPolarHBondContact O-CG 3.49Å; C127-E131 PolarHBondContact O-N 2.81Å
128	K	92.7	Very high	88	Confident	109 Å²	109	69.7 Å²	69.7	47%	0.474	37%	0.366	S	S	.	.	H	α-helix	trans	-68.5	-41.4	177.2	-64	-179	-175.9	178.8	0	112.1	M125 R126 E131 L132 H212	M125-K128 PolarHBondContact O-N 3.31Å; M125-K128 VanDerWaalsContact O-N 3.13Å; R126-K128 PolarHBondContact O-N 2.6Å; K128-E131 PolarHBondContact O-N 3.35Å; K128-L132 WeakPolarHBondContact O-CG 3.01Å; K128-L132 PolarHBondContact O-N 2.97Å; K128-H212 VanDerWaalsContact CD-CE1 3.47Å; K128-H212 WeakPolarHBondContact CD-CE1 3.41Å
129	V	92.4	Very high	87.8	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-67.9	-42.5	177.7	178.9	0	0	0	0	111.2	V117 M125 R126 E131 L132 L133 F179 L214 L248 I250	V117-V129 HydrophobicContact CG1-CB 4.13Å; V117-V129 HydrophobicContact CG1-CG1 4.25Å; V117-V129 HydrophobicContact CG2-CB 4.31Å; V117-V129 HydrophobicContact CG2-CG1 3.62Å; M125-V129 HydrophobicContact CG-CG2 4.49Å; M125-V129 WeakPolarHBondContact O-CG2 3.45Å; M125-V129 PolarHBondContact O-N 2.93Å; M125-V129 VanDerWaalsContact O-N 3.07Å; R126-V129 PolarHBondContact O-N 3Å; V129-E131 VanDerWaalsContact C-N 3.35Å; V129-E131 PolarHBondContact O-N 2.68Å; V129-L132 PolarHBondContact O-N 3.17Å; V129-L133 HydrophobicContact CG1-CD1 4.38Å; V129-L133 PolarHBondContact O-N 2.83Å; V129-L133 VanDerWaalsContact O-N 3.16Å; V129-F179 HydrophobicContact CG1-CE1 4.05Å; V129-L214 HydrophobicContact CG2-CD2 4.16Å; V129-L248 HydrophobicContact CG1-CD2 3.77Å; V129-I250 HydrophobicContact CB-CD1 4.21Å; V129-I250 HydrophobicContact CG1-CD1 3.87Å; V129-I250 HydrophobicContact CG2-CD1 3.62Å
130	E	92.1	Very high	87.8	Confident	44 Å²	44	69.4 Å²	69.4	21%	0.206	36%	0.357	C	S	.	.	H	α-helix	trans	-59	-45.2	174.4	-73.7	167.9	179.8	0	0	111.4	L114 V117 N118 R126 L132 L133 D134	L114-E130 HydrophobicContact CD2-CG 4.33Å; V117-E130 HydrophobicContact CG1-CG 4Å; N118-E130 PolarHBondContact OD1-OE1 3Å; R126-E130 WeakPolarHBondContact O-CG 3.33Å; R126-E130 PolarHBondContact O-N 2.81Å; E130-L132 VanDerWaalsContact C-N 3.28Å; E130-L132 PolarHBondContact O-N 2.81Å; E130-L133 PolarHBondContact O-N 2.96Å; E130-L133 VanDerWaalsContact O-N 3.11Å; E130-D134 WeakPolarHBondContact O-CB 3.26Å; E130-D134 PolarHBondContact O-N 3.1Å
131	E	91.5	Very high	88	Confident	101 Å²	101	69.3 Å²	69.3	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-59.5	-36.5	175.9	-79.4	-174.8	-143.5	0	0	113.2	C127 K128 V129 L133 K135	C127-E131 WeakPolarHBondContact O-CB 3.49Å; C127-E131 VanDerWaalsContact O-CG 3.28Å; C127-E131 WeakPolarHBondContact O-CG 3.49Å; C127-E131 PolarHBondContact O-N 2.81Å; K128-E131 PolarHBondContact O-N 3.35Å; V129-E131 VanDerWaalsContact C-N 3.35Å; V129-E131 PolarHBondContact O-N 2.68Å; E131-L133 VanDerWaalsContact C-N 3.32Å; E131-K135 VanDerWaalsContact O-CB 3.3Å; E131-K135 WeakPolarHBondContact O-CB 3.49Å; E131-K135 WeakPolarHBondContact O-CG 3.4Å; E131-K135 PolarHBondContact O-N 3.3Å; E131-K135 VanDerWaalsContact O-N 3.09Å; E131-K135 IonicContact OE2-NZ 2.75Å; E131-K135 PolarHBondContact OE2-NZ 3.11Å
132	L	92.6	Very high	88.4	Confident	18 Å²	18	61.7 Å²	61.7	9%	0.094	32%	0.323	C	S	.	.	H	α-helix	trans	-70.6	-27.9	177.2	-71.4	173	0	0	0	113.1	K128 V129 E130 C139 S141 F179 I250	K128-L132 WeakPolarHBondContact O-CG 3.01Å; K128-L132 PolarHBondContact O-N 2.97Å; V129-L132 PolarHBondContact O-N 3.17Å; E130-L132 VanDerWaalsContact C-N 3.28Å; E130-L132 PolarHBondContact O-N 2.81Å; L132-C139 HydrophobicContact CD2-CB 4.4Å; L132-S141 PolarHBondContact O-OG 2.79Å; L132-F179 HydrophobicContact CB-CZ 4.02Å; L132-I250 HydrophobicContact CD1-CD1 3.98Å; L132-I250 HydrophobicContact CD1-CG2 4.04Å
133	L	89.9	Confident	88.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-84.3	-35.7	175.4	-68.9	170.6	0	0	0	111.4	L95 R110 I113 L114 V129 E130 E131 D136 F179	L95-L133 HydrophobicContact CB-CD2 4.5Å; L95-L133 HydrophobicContact CD1-CD2 4.04Å; R110-L133 PolarHBondContact NH1-O 3.41Å; R110-L133 PolarHBondContact NH2-O 3.18Å; I113-L133 HydrophobicContact CG2-CD1 3.79Å; L114-L133 HydrophobicContact CD2-CB 4.38Å; L114-L133 HydrophobicContact CD2-CD1 3.65Å; L114-L133 HydrophobicContact CG-CD1 4.05Å; V129-L133 HydrophobicContact CG1-CD1 4.38Å; V129-L133 PolarHBondContact O-N 2.83Å; V129-L133 VanDerWaalsContact O-N 3.16Å; E130-L133 PolarHBondContact O-N 2.96Å; E130-L133 VanDerWaalsContact O-N 3.11Å; E131-L133 VanDerWaalsContact C-N 3.32Å; L133-D136 VanDerWaalsContact O-OD1 3.07Å; L133-F179 HydrophobicContact CD1-CE1 4.32Å; L133-F179 HydrophobicContact CD2-CD1 4.44Å; L133-F179 HydrophobicContact CD2-CE1 3.76Å; L133-F179 HydrophobicContact CD2-CZ 3.84Å; L133-F179 HydrophobicContact CG-CE1 3.96Å; L133-F179 HydrophobicContact CG-CZ 4.09Å
134	D	87.5	Confident	89.2	Confident	97 Å²	97	54.9 Å²	54.9	52%	0.519	28%	0.284	S	S	.	.	H	α-helix	trans	-80.7	-29.5	-176.8	-75.6	-13.8	0	0	0	113.6	R110 E130 D136	R110-D134 IonicContact NH2-OD1 3.37Å; R110-D134 PolarHBondContact NH2-OD1 2.97Å; E130-D134 WeakPolarHBondContact O-CB 3.26Å; E130-D134 PolarHBondContact O-N 3.1Å; D134-D136 VanDerWaalsContact C-N 3.3Å; D134-D136 PolarHBondContact O-N 3.14Å; D134-D136 VanDerWaalsContact O-N 3.14Å
135	K	82.1	Confident	89.6	Confident	103 Å²	103	50.5 Å²	50.5	45%	0.448	26%	0.255	S	S	.	.			trans	-88.5	54	-177.7	-66	174.6	-179.5	165	0	113	E131 T137 D138 C139	E131-K135 VanDerWaalsContact O-CB 3.3Å; E131-K135 WeakPolarHBondContact O-CB 3.49Å; E131-K135 WeakPolarHBondContact O-CG 3.4Å; E131-K135 PolarHBondContact O-N 3.3Å; E131-K135 VanDerWaalsContact O-N 3.09Å; E131-K135 IonicContact OE2-NZ 2.75Å; E131-K135 PolarHBondContact OE2-NZ 3.11Å; K135-T137 PolarHBondContact O-N 2.8Å; K135-D138 PolarHBondContact O-N 2.71Å; K135-D138 VanDerWaalsContact O-N 3.14Å; K135-C139 WeakPolarHBondContact O-CB 3.42Å; K135-C139 PolarHBondContact O-N 3.25Å
136	D	73.7	Confident	89.8	Confident	33 Å²	33	50 Å²	50	18%	0.176	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-27.8	-178.4	-77.3	-8.3	0	0	0	115.1	H97 R110 L133 D134	H97-D136 WeakPolarHBondContact CA-OD2 3.45Å; H97-D136 WeakPolarHBondContact CB-OD2 3.42Å; H97-D136 IonicContact CD2-OD2 2.66Å; H97-D136 PolarHBondContact CD2-OD2 3.16Å; H97-D136 IonicContact CG-OD2 2.81Å; H97-D136 PolarHBondContact N-OD2 3.22Å; R110-D136 IonicContact NH1-OD1 2.79Å; L133-D136 VanDerWaalsContact O-OD1 3.07Å; D134-D136 VanDerWaalsContact C-N 3.3Å; D134-D136 PolarHBondContact O-N 3.14Å; D134-D136 VanDerWaalsContact O-N 3.14Å
137	T	68.6	Low	89.9	Confident	131 Å²	131	47.8 Å²	47.8	80%	0.804	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-37.1	-176.4	-50.3	0	0	0	0	112.5	K135	K135-T137 PolarHBondContact O-N 2.8Å
138	D	79.1	Confident	90	Very high	131 Å²	131	45.4 Å²	45.4	70%	0.701	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-25.5	-178.7	-63.2	-34.8	0	0	0	111.8	K135	K135-D138 PolarHBondContact O-N 2.71Å; K135-D138 VanDerWaalsContact O-N 3.14Å
139	C	87.3	Confident	90	Very high	20 Å²	20	43.3 Å²	43.3	14%	0.135	22%	0.219	C	C	.	.			trans	-118	98.2	-177.7	-61.8	0	0	0	0	110	L132 K135 S141 T176	L132-C139 HydrophobicContact CD2-CB 4.4Å; K135-C139 WeakPolarHBondContact O-CB 3.42Å; K135-C139 PolarHBondContact O-N 3.25Å; C139-S141 PolarHBondContact O-N 3.49Å; C139-T176 WeakPolarHBondContact CA-OG1 3.33Å
140	K	93.3	Very high	89.7	Confident	98 Å²	98	50.4 Å²	50.4	43%	0.426	25%	0.252	S	S	.	.			trans	-80.7	99	169.2	-65.2	174.2	175	-175.9	0	109.3	F142 L174 T176 H177	K140-F142 HydrophobicContact CB-CE2 4.28Å; K140-L174 WeakPolarHBondContact CD-O 3.48Å; K140-T176 HydrophobicContact CB-CG2 4.19Å; K140-T176 PolarHBondContact N-OG1 2.72Å; K140-T176 PolarHBondContact O-N 2.95Å; K140-T176 PolarHBondContact O-OG1 2.92Å; K140-H177 PolarHBondContact O-N 3.49Å
141	S	95.3	Very high	89.4	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.007	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.2	-175.8	-66.6	0	0	0	0	110.3	L95 L132 C139 F179	L95-S141 WeakPolarHBondContact CB-O 3.39Å; L95-S141 PolarHBondContact N-O 3.03Å; L132-S141 PolarHBondContact O-OG 2.79Å; C139-S141 PolarHBondContact O-N 3.49Å; S141-F179 VanDerWaalsContact CB-CE2 3.5Å; S141-F179 WeakPolarHBondContact OG-CE2 3.2Å
142	F	96.8	Very high	89.4	Confident	9 Å²	9	50.2 Å²	50.2	4%	0.039	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.2	176.7	-77.6	-106.9	0	0	0	109.6	V92 V93 D94 K140 L173 P175 H177 L178 F179	V92-F142 HydrophobicContact CB-CD1 4.13Å; V92-F142 HydrophobicContact CG2-CD1 3.93Å; V92-F142 HydrophobicContact CG2-CE1 4.43Å; V93-F142 CarbonylContact O-C 3.52Å; V93-F142 VanDerWaalsContact O-CA 3.28Å; V93-F142 WeakPolarHBondContact O-CA 3.31Å; D94-F142 HydrophobicContact CB-CD1 4.13Å; D94-F142 HydrophobicContact CB-CE1 3.59Å; D94-F142 HydrophobicContact CB-CZ 3.87Å; K140-F142 HydrophobicContact CB-CE2 4.28Å; F142-L173 HydrophobicContact CE1-CD1 4.14Å; F142-L173 HydrophobicContact CE1-CD2 4.37Å; F142-L173 HydrophobicContact CZ-CD2 4.11Å; F142-P175 HydrophobicContact CD2-CB 3.68Å; F142-P175 HydrophobicContact CE2-CB 4.15Å; F142-P175 HydrophobicContact CG-CB 4.32Å; F142-H177 PolarHBondContact N-O 2.79Å; F142-L178 HydrophobicContact CB-CD2 3.94Å; F142-L178 CarbonylContact O-C 3.58Å; F142-L178 WeakPolarHBondContact O-CA 3.38Å; F142-F179 PolarHBondContact O-N 3.42Å
143	L	97.6	Very high	89.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	118.8	166.8	178.8	67.7	0	0	0	108.1	V92 V93 L95 L109 I113 I145 F179 L181	V92-L143 CarbonylContact C-O 3.41Å; V92-L143 VanDerWaalsContact CA-O 3.26Å; V92-L143 WeakPolarHBondContact CA-O 3.34Å; V93-L143 HydrophobicContact CB-CB 4.24Å; V93-L143 PolarHBondContact N-O 3.32Å; V93-L143 PolarHBondContact O-N 3.4Å; L95-L143 HydrophobicContact CD1-CB 4.04Å; L95-L143 HydrophobicContact CD2-CB 4.01Å; L95-L143 HydrophobicContact CG-CB 4.1Å; L109-L143 HydrophobicContact CD1-CD2 4.09Å; L109-L143 HydrophobicContact CD2-CD2 4.01Å; I113-L143 HydrophobicContact CD1-CD1 4.43Å; L143-I145 HydrophobicContact CD2-CD1 3.71Å; L143-I145 HydrophobicContact CG-CD1 3.91Å; L143-F179 CarbonylContact C-O 3.5Å; L143-F179 WeakPolarHBondContact CA-O 3.47Å; L143-F179 HydrophobicContact CD1-CB 4.22Å; L143-F179 WeakPolarHBondContact CD1-O 3.24Å; L143-L181 HydrophobicContact CD1-CD1 4.32Å; L143-L181 HydrophobicContact CD1-CG 4.22Å
144	L	97.4	Very high	89.2	Confident	12 Å²	12	54.5 Å²	54.5	6%	0.063	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	117.9	169	172	61.2	0	0	0	108.4	T90 V92 N146 L164 L178 F179 I180	T90-L144 HydrophobicContact CG2-CD1 4.14Å; V92-L144 HydrophobicContact CG1-CD1 4.04Å; L144-N146 HydrophobicContact CG-CB 4.39Å; L144-L164 HydrophobicContact CD1-CD1 3.58Å; L144-L164 HydrophobicContact CD2-CD1 4.48Å; L144-L178 HydrophobicContact CD2-CD1 4.5Å; L144-F179 PolarHBondContact N-O 3.3Å; L144-I180 HydrophobicContact CB-CG1 4.09Å; L144-I180 HydrophobicContact CD2-CD1 4.01Å; L144-I180 HydrophobicContact CD2-CG1 4.03Å; L144-I180 HydrophobicContact CG-CG1 4.44Å
145	I	96.9	Very high	89.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.6	168.4	-57.8	-60.6	0	0	0	106.6	L39 L42 I58 V89 T90 S91 V93 L143 E147	L39-I145 HydrophobicContact CD2-CG2 3.65Å; L42-I145 HydrophobicContact CD2-CD1 3.73Å; I58-I145 HydrophobicContact CD1-CG1 4.5Å; I58-I145 HydrophobicContact CD1-CG2 4.3Å; V89-I145 HydrophobicContact CG1-CG2 4.41Å; T90-I145 CarbonylContact C-O 3.59Å; T90-I145 VanDerWaalsContact CA-O 3.26Å; T90-I145 WeakPolarHBondContact CA-O 3.48Å; S91-I145 PolarHBondContact N-O 2.96Å; S91-I145 PolarHBondContact O-N 3.49Å; V93-I145 HydrophobicContact CG2-CG1 4.21Å; L143-I145 HydrophobicContact CD2-CD1 3.71Å; L143-I145 HydrophobicContact CG-CD1 3.91Å; I145-E147 HydrophobicContact CG2-CG 4.48Å
146	N	95.1	Very high	89.6	Confident	28 Å²	28	49.2 Å²	49.2	15%	0.15	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	82.4	175.1	-175.5	-112.5	0	0	0	108	V89 T90 L144 V161	V89-N146 CarbonylContact O-C 3.56Å; V89-N146 VanDerWaalsContact O-CA 3.32Å; V89-N146 WeakPolarHBondContact O-CA 3.38Å; T90-N146 PolarHBondContact OG1-ND2 3.34Å; L144-N146 HydrophobicContact CG-CB 4.39Å; N146-V161 VanDerWaalsContact ND2-CG1 3.3Å; N146-V161 WeakPolarHBondContact ND2-CG1 3.46Å
147	E	95.1	Very high	90.2	Very high	9 Å²	9	47.9 Å²	47.9	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.5	-177.9	-70.2	-54.3	141.1	0	0	110.6	L38 L42 A88 V89 I145 Y200	L38-E147 HydrophobicContact CB-CB 4.01Å; L42-E147 HydrophobicContact CB-CG 4.07Å; L42-E147 WeakPolarHBondContact CD1-OE1 3.43Å; L42-E147 HydrophobicContact CD2-CG 4.26Å; A88-E147 CarbonylContact C-O 3.49Å; A88-E147 VanDerWaalsContact CA-O 3.28Å; A88-E147 WeakPolarHBondContact CA-O 3.23Å; V89-E147 HydrophobicContact CG1-CB 3.99Å; V89-E147 PolarHBondContact N-O 3.3Å; V89-E147 PolarHBondContact O-N 2.85Å; I145-E147 HydrophobicContact CG2-CG 4.48Å; E147-Y200 PolarHBondContact OE2-OH 2.72Å
148	R	94.3	Very high	91.2	Very high	9 Å²	9	42.3 Å²	42.3	3%	0.034	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	167.9	-175.3	60.4	177.3	-175.3	81.8	-9.4	111.7	F87 A88 E150 L152 C157 Y200 E202	F87-R148 CarbonylContact O-C 3.51Å; F87-R148 VanDerWaalsContact O-CA 3.26Å; F87-R148 WeakPolarHBondContact O-CA 3.24Å; A88-R148 HydrophobicContact CB-CB 3.58Å; R148-E150 PolarHBondContact NH1-O 2.95Å; R148-L152 HydrophobicContact CB-CD1 4.01Å; R148-C157 WeakPolarHBondContact CD-SG 3.4Å; R148-C157 PolarHBondContact NE-SG 3.37Å; R148-Y200 HydrophobicContact CG-CE1 4.04Å; R148-Y200 PolarHBondContact O-OH 3.3Å; R148-Y200 VanDerWaalsContact O-OH 3.14Å; R148-E202 IonicContact CZ-OE1 3.24Å; R148-E202 IonicContact CZ-OE2 3.15Å; R148-E202 IonicContact NE-OE1 2.83Å; R148-E202 PolarHBondContact NE-OE1 2.93Å; R148-E202 IonicContact NH2-OE1 3.87Å; R148-E202 PolarHBondContact NH2-OE1 3.24Å; R148-E202 IonicContact NH2-OE2 3.59Å; R148-E202 PolarHBondContact NH2-OE2 3.19Å
149	F	91.5	Very high	91.7	Very high	65 Å²	65	42.8 Å²	42.8	29%	0.285	22%	0.222	S	C	.	.			trans	-68.3	140.9	163.9	-67	-7.2	0	0	0	110.7	L38 I85 F87 N151 L152	L38-F149 HydrophobicContact CD2-CD1 3.47Å; L38-F149 VanDerWaalsContact CD2-CD1 3.47Å; L38-F149 HydrophobicContact CD2-CE1 3.53Å; L38-F149 HydrophobicContact CG-CE1 4.49Å; I85-F149 HydrophobicContact CG2-CE2 4.21Å; I85-F149 HydrophobicContact CG2-CZ 4.3Å; F87-F149 AromaticContact CD1-CD2 3.64Å; F87-F149 HydrophobicContact CD1-CD2 3.64Å; F87-F149 HydrophobicContact CD1-CE2 4.02Å; F87-F149 HydrophobicContact CE1-CD2 4.06Å; F87-F149 HydrophobicContact CE1-CE2 4.19Å; F87-F149 HydrophobicContact CG-CD2 4.43Å; F87-F149 PolarHBondContact O-N 2.68Å; F149-N151 VanDerWaalsContact CB-OD1 3.24Å; F149-N151 WeakPolarHBondContact CB-OD1 3.29Å; F149-N151 PolarHBondContact O-N 3.25Å; F149-L152 PolarHBondContact O-N 2.98Å
150	E	86.3	Confident	91.7	Very high	149 Å²	149	42.2 Å²	42.2	70%	0.696	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-30.3	-174.8	-64.3	179.6	175.8	0	0	112.8	R148 L152	R148-E150 PolarHBondContact NH1-O 2.95Å; E150-L152 VanDerWaalsContact C-N 3.3Å; E150-L152 PolarHBondContact O-N 3.16Å
151	N	86.7	Confident	91.6	Very high	126 Å²	126	38 Å²	38	67%	0.674	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-2.9	-175.5	67.4	-28	0	0	0	114.7	F149	F149-N151 VanDerWaalsContact CB-OD1 3.24Å; F149-N151 WeakPolarHBondContact CB-OD1 3.29Å; F149-N151 PolarHBondContact O-N 3.25Å
152	L	89.8	Confident	91.4	Very high	15 Å²	15	41.1 Å²	41.1	8%	0.079	22%	0.222	C	C	.	.	S	Bend	trans	-68	134.5	176.5	-69	-172.2	0	0	0	111.4	L22 F87 A88 R148 F149 E150 I156	L22-L152 HydrophobicContact CD1-CD2 3.75Å; F87-L152 HydrophobicContact CB-CD1 4.17Å; F87-L152 HydrophobicContact CB-CD2 4.33Å; F87-L152 HydrophobicContact CD1-CD2 4.36Å; A88-L152 HydrophobicContact CB-CD1 3.87Å; R148-L152 HydrophobicContact CB-CD1 4.01Å; F149-L152 PolarHBondContact O-N 2.98Å; E150-L152 VanDerWaalsContact C-N 3.3Å; E150-L152 PolarHBondContact O-N 3.16Å; L152-I156 HydrophobicContact CD1-CG2 4.3Å
153	P	89.5	Confident	91	Very high	70 Å²	70	42 Å²	42	46%	0.455	23%	0.232	S	C	.	.			trans	-61.5	147.4	173.7	-21.8	32.5	0	0	0	112.4	S155 I156 C157	P153-S155 PolarHBondContact O-N 3.43Å; P153-I156 HydrophobicContact CG-CD1 4.46Å; P153-I156 PolarHBondContact O-N 2.95Å; P153-C157 PolarHBondContact O-N 3.3Å; P153-C157 PolarHBondContact O-SG 3.26Å
154	L	88.8	Confident	90.8	Very high	39 Å²	39	42 Å²	42	20%	0.204	23%	0.232	C	C	.	.	H	α-helix	trans	-54.4	-29	177.7	-175.5	61.3	0	0	0	113.2	I156 C157 A158 E202 F205 H266 V267	L154-I156 VanDerWaalsContact C-N 3.35Å; L154-I156 PolarHBondContact O-N 2.91Å; L154-C157 HydrophobicContact CD1-CB 4.46Å; L154-C157 PolarHBondContact O-N 2.88Å; L154-A158 WeakPolarHBondContact O-CB 3.4Å; L154-A158 PolarHBondContact O-N 3.14Å; L154-E202 HydrophobicContact CD1-CB 3.68Å; L154-F205 HydrophobicContact CD2-CE2 3.93Å; L154-H266 HydrophobicContact CD2-CB 4.24Å; L154-V267 HydrophobicContact CG-CG2 4.13Å
155	S	89.7	Confident	90.6	Very high	53 Å²	53	44.1 Å²	44.1	37%	0.371	25%	0.246	S	C	.	.	H	α-helix	trans	-57.4	-46.4	174.8	58.7	0	0	0	0	112.6	P153 A158 E159 V267	P153-S155 PolarHBondContact O-N 3.43Å; S155-A158 PolarHBondContact O-N 3.22Å; S155-E159 WeakPolarHBondContact O-CB 3.36Å; S155-E159 PolarHBondContact O-N 3.41Å; S155-V267 VanDerWaalsContact CA-CG1 3.41Å
156	I	88.4	Confident	90.4	Very high	35 Å²	35	47.3 Å²	47.3	18%	0.179	27%	0.268	C	S	.	.	H	α-helix	trans	-69.8	-40.6	-179.7	-56.2	-170.3	0	0	0	109.5	L22 V68 L152 P153 L154 A158 E159 A160	L22-I156 HydrophobicContact CB-CD1 4.47Å; L22-I156 HydrophobicContact CD1-CD1 3.59Å; V68-I156 HydrophobicContact CG1-CG2 4.21Å; L152-I156 HydrophobicContact CD1-CG2 4.3Å; P153-I156 HydrophobicContact CG-CD1 4.46Å; P153-I156 PolarHBondContact O-N 2.95Å; L154-I156 VanDerWaalsContact C-N 3.35Å; L154-I156 PolarHBondContact O-N 2.91Å; I156-A158 PolarHBondContact O-N 2.87Å; I156-E159 PolarHBondContact O-N 3.31Å; I156-A160 WeakPolarHBondContact O-CB 3.33Å; I156-A160 PolarHBondContact O-N 3.45Å
157	C	86.8	Confident	90.3	Very high	6 Å²	6	47.2 Å²	47.2	4%	0.041	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-44.7	177.6	-47.7	0	0	0	0	111.8	R148 P153 L154 A160 V161	R148-C157 WeakPolarHBondContact CD-SG 3.4Å; R148-C157 PolarHBondContact NE-SG 3.37Å; P153-C157 PolarHBondContact O-N 3.3Å; P153-C157 PolarHBondContact O-SG 3.26Å; L154-C157 HydrophobicContact CD1-CB 4.46Å; L154-C157 PolarHBondContact O-N 2.88Å; C157-A160 PolarHBondContact O-N 3.34Å; C157-V161 PolarHBondContact O-N 3.09Å
158	A	90.3	Very high	90.3	Very high	14 Å²	14	47.1 Å²	47.1	12%	0.116	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-41	177.7	0	0	0	0	0	111.8	L154 S155 I156 V161 S162 L263 V267	L154-A158 WeakPolarHBondContact O-CB 3.4Å; L154-A158 PolarHBondContact O-N 3.14Å; S155-A158 PolarHBondContact O-N 3.22Å; I156-A158 PolarHBondContact O-N 2.87Å; A158-V161 VanDerWaalsContact O-CG2 3.24Å; A158-V161 WeakPolarHBondContact O-CG2 3.22Å; A158-V161 PolarHBondContact O-N 3.47Å; A158-S162 WeakPolarHBondContact O-CB 3.49Å; A158-S162 PolarHBondContact O-N 2.93Å; A158-L263 HydrophobicContact CB-CB 4.5Å; A158-V267 HydrophobicContact CB-CG2 3.62Å
159	E	90.1	Very high	90.2	Very high	141 Å²	141	54.8 Å²	54.8	66%	0.659	30%	0.3	S	S	*	.	H	α-helix	trans	-64.8	-42.2	176.9	-173	164.6	-166.4	0	0	111.7	S155 I156 V161 S162	S155-E159 WeakPolarHBondContact O-CB 3.36Å; S155-E159 PolarHBondContact O-N 3.41Å; I156-E159 PolarHBondContact O-N 3.31Å; E159-V161 PolarHBondContact O-N 3.06Å; E159-V161 VanDerWaalsContact O-N 3.14Å; E159-S162 WeakPolarHBondContact O-CB 3.5Å; E159-S162 PolarHBondContact O-N 2.81Å; E159-S162 PolarHBondContact O-OG 2.84Å
160	A	86.2	Confident	90.3	Very high	8 Å²	8	56.1 Å²	56.1	7%	0.066	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-25.3	179.8	0	0	0	0	0	114.1	V68 T90 I156 C157	V68-A160 HydrophobicContact CG2-CB 4.35Å; T90-A160 WeakPolarHBondContact CB-O 3.33Å; T90-A160 WeakPolarHBondContact CG2-O 3.28Å; T90-A160 PolarHBondContact OG1-O 3.4Å; I156-A160 WeakPolarHBondContact O-CB 3.33Å; I156-A160 PolarHBondContact O-N 3.45Å; C157-A160 PolarHBondContact O-N 3.34Å
161	V	91.2	Very high	90.6	Very high	10 Å²	10	50.1 Å²	50.1	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-98.3	-13.9	174.6	-62.7	0	0	0	0	113.2	T90 N146 C157 A158 E159 A163 L164 L260 L263	T90-V161 HydrophobicContact CG2-CG1 4.3Å; N146-V161 VanDerWaalsContact ND2-CG1 3.3Å; N146-V161 WeakPolarHBondContact ND2-CG1 3.46Å; C157-V161 PolarHBondContact O-N 3.09Å; A158-V161 VanDerWaalsContact O-CG2 3.24Å; A158-V161 WeakPolarHBondContact O-CG2 3.22Å; A158-V161 PolarHBondContact O-N 3.47Å; E159-V161 PolarHBondContact O-N 3.06Å; E159-V161 VanDerWaalsContact O-N 3.14Å; V161-A163 VanDerWaalsContact C-N 3.27Å; V161-A163 PolarHBondContact O-N 3.34Å; V161-L164 HydrophobicContact CB-CD1 4.19Å; V161-L164 HydrophobicContact CG1-CD1 4.42Å; V161-L164 WeakPolarHBondContact O-CB 3.39Å; V161-L164 PolarHBondContact O-N 3.23Å; V161-L260 HydrophobicContact CB-CD2 4.23Å; V161-L260 HydrophobicContact CG2-CD2 3.65Å; V161-L263 HydrophobicContact CG2-CD1 4.35Å
162	S	91.2	Very high	90.8	Very high	65 Å²	65	50.9 Å²	50.9	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-69	-24.1	-175.9	76	0	0	0	0	113.7	A158 E159 P165	A158-S162 WeakPolarHBondContact O-CB 3.49Å; A158-S162 PolarHBondContact O-N 2.93Å; E159-S162 WeakPolarHBondContact O-CB 3.5Å; E159-S162 PolarHBondContact O-N 2.81Å; E159-S162 PolarHBondContact O-OG 2.84Å; S162-P165 WeakPolarHBondContact O-CD 3.47Å
163	A	89.1	Confident	91	Very high	29 Å²	29	52.4 Å²	52.4	24%	0.24	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-22.6	177.8	0	0	0	0	0	113.5	V161 S166 E167	V161-A163 VanDerWaalsContact C-N 3.27Å; V161-A163 PolarHBondContact O-N 3.34Å; A163-S166 PolarHBondContact O-N 2.75Å; A163-S166 PolarHBondContact O-OG 2.98Å; A163-E167 WeakPolarHBondContact O-CG 3.49Å; A163-E167 PolarHBondContact O-N 2.82Å
164	L	93.3	Very high	91.1	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-52.7	-44.9	-175.7	-79.9	168.3	0	0	0	114.4	T90 V92 L144 V161 S166 E167 F168 F256	T90-L164 HydrophobicContact CG2-CD1 3.6Å; T90-L164 HydrophobicContact CG2-CD2 3.93Å; T90-L164 HydrophobicContact CG2-CG 3.77Å; V92-L164 HydrophobicContact CG1-CD2 3.86Å; L144-L164 HydrophobicContact CD1-CD1 3.58Å; L144-L164 HydrophobicContact CD2-CD1 4.48Å; V161-L164 HydrophobicContact CB-CD1 4.19Å; V161-L164 HydrophobicContact CG1-CD1 4.42Å; V161-L164 WeakPolarHBondContact O-CB 3.39Å; V161-L164 PolarHBondContact O-N 3.23Å; L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 2.93Å; L164-E167 PolarHBondContact O-N 2.81Å; L164-F168 HydrophobicContact CB-CD2 4.36Å; L164-F168 HydrophobicContact CB-CE2 4.18Å; L164-F168 HydrophobicContact CD2-CE2 4.4Å; L164-F168 WeakPolarHBondContact O-CB 3.35Å; L164-F168 WeakPolarHBondContact O-CD2 3.33Å; L164-F168 WeakPolarHBondContact O-CG 3.26Å; L164-F168 PolarHBondContact O-N 2.97Å; L164-F256 HydrophobicContact CB-CE1 4.25Å; L164-F256 HydrophobicContact CB-CZ 4.22Å; L164-F256 HydrophobicContact CD1-CZ 4.03Å
165	P	93.1	Very high	91.4	Very high	55 Å²	55	54 Å²	54	36%	0.357	31%	0.309	S	S	.	.	H	α-helix	trans	-57.2	-40.3	176.8	-24.6	33.9	0	0	0	113.6	S162 K169 F256 L260	S162-P165 WeakPolarHBondContact O-CD 3.47Å; P165-K169 WeakPolarHBondContact O-CB 3.22Å; P165-K169 PolarHBondContact O-N 2.9Å; P165-F256 HydrophobicContact CG-CD1 4.22Å; P165-F256 HydrophobicContact CG-CE1 3.81Å; P165-L260 HydrophobicContact CG-CD1 3.62Å
166	S	92	Very high	91.7	Very high	67 Å²	67	53.5 Å²	53.5	47%	0.469	30%	0.304	S	S	.	.	H	α-helix	trans	-72.7	-35.9	177.4	42.1	0	0	0	0	112.6	A163 L164 K169 S170	A163-S166 PolarHBondContact O-N 2.75Å; A163-S166 PolarHBondContact O-OG 2.98Å; L164-S166 VanDerWaalsContact C-N 3.29Å; L164-S166 PolarHBondContact O-N 2.93Å; S166-K169 PolarHBondContact O-N 2.97Å; S166-S170 WeakPolarHBondContact O-CB 3.47Å; S166-S170 PolarHBondContact O-N 3.02Å; S166-S170 PolarHBondContact O-OG 3.14Å
167	E	93.5	Very high	92.1	Very high	26 Å²	26	53 Å²	53	12%	0.121	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-52	174.6	-67.9	173.3	-172.6	0	0	110.3	I64 G65 T66 A163 L164 K169 S170 S171	I64-E167 HydrophobicContact CD1-CB 4.13Å; I64-E167 HydrophobicContact CG1-CB 3.93Å; I64-E167 WeakPolarHBondContact CG1-OE2 3.46Å; G65-E167 PolarHBondContact N-OE2 2.92Å; T66-E167 PolarHBondContact OG1-OE1 2.84Å; A163-E167 WeakPolarHBondContact O-CG 3.49Å; A163-E167 PolarHBondContact O-N 2.82Å; L164-E167 PolarHBondContact O-N 2.81Å; E167-K169 PolarHBondContact O-N 3Å; E167-K169 VanDerWaalsContact O-N 3.16Å; E167-S170 PolarHBondContact O-N 3.29Å; E167-S171 PolarHBondContact O-N 3.45Å; E167-S171 PolarHBondContact O-OG 2.88Å
168	F	94.5	Very high	92.6	Very high	7 Å²	7	52.7 Å²	52.7	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-50.5	-45.4	175.5	-78.7	-55.4	0	0	0	112.4	I64 V92 L164 N172 L173 P175 L178 M253	I64-F168 HydrophobicContact CD1-CD1 3.48Å; I64-F168 VanDerWaalsContact CD1-CD1 3.48Å; I64-F168 HydrophobicContact CD1-CE1 3.66Å; I64-F168 HydrophobicContact CD1-CG 4.06Å; I64-F168 HydrophobicContact CD1-CZ 4.34Å; V92-F168 HydrophobicContact CB-CE1 4.36Å; V92-F168 HydrophobicContact CB-CZ 4.38Å; V92-F168 HydrophobicContact CG1-CE1 4.15Å; V92-F168 HydrophobicContact CG1-CZ 3.73Å; V92-F168 HydrophobicContact CG2-CE1 3.81Å; V92-F168 HydrophobicContact CG2-CZ 4.27Å; L164-F168 HydrophobicContact CB-CD2 4.36Å; L164-F168 HydrophobicContact CB-CE2 4.18Å; L164-F168 HydrophobicContact CD2-CE2 4.4Å; L164-F168 WeakPolarHBondContact O-CB 3.35Å; L164-F168 WeakPolarHBondContact O-CD2 3.33Å; L164-F168 WeakPolarHBondContact O-CG 3.26Å; L164-F168 PolarHBondContact O-N 2.97Å; F168-N172 PolarHBondContact O-N 3.45Å; F168-L173 HydrophobicContact CD1-CB 3.85Å; F168-L173 HydrophobicContact CD1-CD1 4.37Å; F168-L173 PolarHBondContact O-N 3.04Å; F168-P175 HydrophobicContact CD1-CG 3.79Å; F168-P175 HydrophobicContact CD2-CG 4.2Å; F168-P175 HydrophobicContact CE1-CB 4.34Å; F168-P175 HydrophobicContact CE1-CG 3.66Å; F168-P175 HydrophobicContact CE2-CG 4.1Å; F168-P175 HydrophobicContact CG-CG 4.06Å; F168-P175 HydrophobicContact CZ-CB 4.48Å; F168-P175 HydrophobicContact CZ-CG 3.82Å; F168-L178 HydrophobicContact CE2-CD2 4.35Å; F168-L178 HydrophobicContact CZ-CD2 3.78Å; F168-M253 HydrophobicContact CD2-CE 4.39Å; F168-M253 HydrophobicContact CE2-CE 4.38Å
169	K	93.1	Very high	92.9	Very high	170 Å²	170	52 Å²	52	74%	0.739	29%	0.293	S	S	*	.	H	α-helix	trans	-64.4	-42.8	177.8	-175.2	-179.8	177	-175.7	0	112.2	P165 S166 E167 N172	P165-K169 WeakPolarHBondContact O-CB 3.22Å; P165-K169 PolarHBondContact O-N 2.9Å; S166-K169 PolarHBondContact O-N 2.97Å; E167-K169 PolarHBondContact O-N 3Å; E167-K169 VanDerWaalsContact O-N 3.16Å; K169-N172 PolarHBondContact O-N 3.3Å
170	S	92.8	Very high	93.3	Very high	94 Å²	94	46 Å²	46	66%	0.657	27%	0.265	S	S	*	.	H	α-helix	trans	-69.4	-35.1	-178.5	-57.4	0	0	0	0	111.8	S166 E167 N172	S166-S170 WeakPolarHBondContact O-CB 3.47Å; S166-S170 PolarHBondContact O-N 3.02Å; S166-S170 PolarHBondContact O-OG 3.14Å; E167-S170 PolarHBondContact O-N 3.29Å; S170-N172 VanDerWaalsContact C-N 3.27Å; S170-N172 PolarHBondContact O-N 3.04Å
171	S	92.3	Very high	93.8	Very high	22 Å²	22	46 Å²	46	15%	0.154	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	1.1	178.2	-41.1	0	0	0	0	113.4	S63 E167 L173	S63-S171 WeakPolarHBondContact CB-OG 3.4Å; S63-S171 PolarHBondContact O-OG 3.48Å; E167-S171 PolarHBondContact O-N 3.45Å; E167-S171 PolarHBondContact O-OG 2.88Å; S171-L173 PolarHBondContact O-N 2.82Å
172	N	92.3	Very high	94	Very high	142 Å²	142	45.6 Å²	45.6	76%	0.759	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	30.4	-173.2	-61.4	-66.9	0	0	0	113.6	F168 K169 S170	F168-N172 PolarHBondContact O-N 3.45Å; K169-N172 PolarHBondContact O-N 3.3Å; S170-N172 VanDerWaalsContact C-N 3.27Å; S170-N172 PolarHBondContact O-N 3.04Å
173	L	92.4	Very high	94.2	Very high	48 Å²	48	43.4 Å²	43.4	25%	0.251	24%	0.244	S	C	.	.			trans	-89	129.8	174.9	-65.4	177.9	0	0	0	108.7	I64 F142 F168 S171 P175	I64-L173 HydrophobicContact CD1-CD1 3.99Å; I64-L173 HydrophobicContact CG2-CD1 4.24Å; F142-L173 HydrophobicContact CE1-CD1 4.14Å; F142-L173 HydrophobicContact CE1-CD2 4.37Å; F142-L173 HydrophobicContact CZ-CD2 4.11Å; F168-L173 HydrophobicContact CD1-CB 3.85Å; F168-L173 HydrophobicContact CD1-CD1 4.37Å; F168-L173 PolarHBondContact O-N 3.04Å; S171-L173 PolarHBondContact O-N 2.82Å; L173-P175 VanDerWaalsContact O-CD 3.28Å; L173-P175 WeakPolarHBondContact O-CD 3.37Å
174	L	93.2	Very high	94.5	Very high	124 Å²	124	42 Å²	42	65%	0.649	23%	0.232	S	C	*	.			trans	-121	70.3	-177.5	-64.1	175.3	0	0	0	109.3	K140	K140-L174 WeakPolarHBondContact CD-O 3.48Å
175	P	94.6	Very high	94.5	Very high	17 Å²	17	46.2 Å²	46.2	11%	0.11	25%	0.249	C	C	.	.			trans	-59.4	150.5	176.7	26.5	-35	0	0	0	110.5	F142 F168 L173 L178 M253	F142-P175 HydrophobicContact CD2-CB 3.68Å; F142-P175 HydrophobicContact CE2-CB 4.15Å; F142-P175 HydrophobicContact CG-CB 4.32Å; F168-P175 HydrophobicContact CD1-CG 3.79Å; F168-P175 HydrophobicContact CD2-CG 4.2Å; F168-P175 HydrophobicContact CE1-CB 4.34Å; F168-P175 HydrophobicContact CE1-CG 3.66Å; F168-P175 HydrophobicContact CE2-CG 4.1Å; F168-P175 HydrophobicContact CG-CG 4.06Å; F168-P175 HydrophobicContact CZ-CB 4.48Å; F168-P175 HydrophobicContact CZ-CG 3.82Å; L173-P175 VanDerWaalsContact O-CD 3.28Å; L173-P175 WeakPolarHBondContact O-CD 3.37Å; P175-L178 HydrophobicContact CB-CD2 4.25Å; P175-M253 HydrophobicContact CB-CG 3.8Å; P175-M253 HydrophobicContact CB-SD 4.11Å; P175-M253 HydrophobicContact CG-CE 3.88Å; P175-M253 HydrophobicContact CG-CG 3.77Å; P175-M253 HydrophobicContact CG-SD 3.73Å; P175-M253 VanDerWaalsContact O-CG 3.26Å; P175-M253 WeakPolarHBondContact O-CG 3.26Å
176	T	95.4	Very high	94.3	Very high	43 Å²	43	44 Å²	44	26%	0.264	23%	0.234	S	C	.	.	S	Bend	trans	-106.2	-33.1	168.2	61.1	0	0	0	0	110.9	C139 K140 P252 M253	C139-T176 WeakPolarHBondContact CA-OG1 3.33Å; K140-T176 HydrophobicContact CB-CG2 4.19Å; K140-T176 PolarHBondContact N-OG1 2.72Å; K140-T176 PolarHBondContact O-N 2.95Å; K140-T176 PolarHBondContact O-OG1 2.92Å; T176-P252 WeakPolarHBondContact O-CA 3.42Å; T176-M253 PolarHBondContact O-N 2.84Å
177	H	96.2	Very high	93.9	Very high	25 Å²	25	46.8 Å²	46.8	12%	0.116	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	139	-177.6	-61.9	81.7	0	0	0	109.9	K140 F142 F179 I250 I251	K140-H177 PolarHBondContact O-N 3.49Å; F142-H177 PolarHBondContact N-O 2.79Å; H177-F179 HydrophobicContact CB-CD2 4.44Å; H177-F179 HydrophobicContact CB-CE2 4.01Å; H177-I250 HydrophobicContact CB-CG2 4.15Å; H177-I251 CarbonylContact C-O 3.56Å; H177-I251 WeakPolarHBondContact CA-O 3.49Å
178	L	97.1	Very high	92.7	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.1	167.3	-58.9	-179.9	0	0	0	109	F142 L144 F168 P175 I250 I251 M253 F256	F142-L178 HydrophobicContact CB-CD2 3.94Å; F142-L178 CarbonylContact O-C 3.58Å; F142-L178 WeakPolarHBondContact O-CA 3.38Å; L144-L178 HydrophobicContact CD2-CD1 4.5Å; F168-L178 HydrophobicContact CE2-CD2 4.35Å; F168-L178 HydrophobicContact CZ-CD2 3.78Å; P175-L178 HydrophobicContact CB-CD2 4.25Å; L178-I250 CarbonylContact O-C 3.51Å; L178-I250 WeakPolarHBondContact O-CA 3.44Å; L178-I251 PolarHBondContact N-O 3.2Å; L178-I251 PolarHBondContact O-N 3.27Å; L178-M253 HydrophobicContact CD1-SD 3.74Å; L178-M253 HydrophobicContact CD2-SD 4.05Å; L178-M253 HydrophobicContact CG-SD 3.63Å; L178-F256 HydrophobicContact CD1-CD2 3.61Å; L178-F256 HydrophobicContact CD1-CE2 3.43Å; L178-F256 VanDerWaalsContact CD1-CE2 3.43Å; L178-F256 HydrophobicContact CD1-CG 4.26Å; L178-F256 HydrophobicContact CD1-CZ 3.96Å
179	F	97.7	Very high	91.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.8	173.5	-73.6	-121.7	0	0	0	106.6	L95 V129 L132 L133 S141 F142 L143 L144 H177 L248 I249 I250	L95-F179 HydrophobicContact CD1-CB 4.35Å; L95-F179 HydrophobicContact CD1-CD1 4.47Å; L95-F179 HydrophobicContact CD1-CD2 4.39Å; L95-F179 HydrophobicContact CD1-CG 4.17Å; V129-F179 HydrophobicContact CG1-CE1 4.05Å; L132-F179 HydrophobicContact CB-CZ 4.02Å; L133-F179 HydrophobicContact CD1-CE1 4.32Å; L133-F179 HydrophobicContact CD2-CD1 4.44Å; L133-F179 HydrophobicContact CD2-CE1 3.76Å; L133-F179 HydrophobicContact CD2-CZ 3.84Å; L133-F179 HydrophobicContact CG-CE1 3.96Å; L133-F179 HydrophobicContact CG-CZ 4.09Å; S141-F179 VanDerWaalsContact CB-CE2 3.5Å; S141-F179 WeakPolarHBondContact OG-CE2 3.2Å; F142-F179 PolarHBondContact O-N 3.42Å; L143-F179 CarbonylContact C-O 3.5Å; L143-F179 WeakPolarHBondContact CA-O 3.47Å; L143-F179 HydrophobicContact CD1-CB 4.22Å; L143-F179 WeakPolarHBondContact CD1-O 3.24Å; L144-F179 PolarHBondContact N-O 3.3Å; H177-F179 HydrophobicContact CB-CD2 4.44Å; H177-F179 HydrophobicContact CB-CE2 4.01Å; F179-L248 HydrophobicContact CB-CD1 4.27Å; F179-L248 HydrophobicContact CD1-CD1 3.99Å; F179-L248 HydrophobicContact CD1-CD2 4.09Å; F179-L248 HydrophobicContact CD1-CG 4.32Å; F179-L248 HydrophobicContact CE1-CD2 4.36Å; F179-I249 CarbonylContact C-O 3.56Å; F179-I249 WeakPolarHBondContact CA-O 3.47Å; F179-I250 HydrophobicContact CD1-CD1 4.11Å; F179-I250 HydrophobicContact CD1-CG1 4.03Å; F179-I250 HydrophobicContact CD2-CG2 4.44Å; F179-I250 HydrophobicContact CE1-CD1 3.6Å; F179-I250 HydrophobicContact CE1-CG1 4.02Å; F179-I250 HydrophobicContact CE2-CD1 4.49Å; F179-I250 HydrophobicContact CE2-CG2 4.17Å; F179-I250 HydrophobicContact CG-CG1 4.32Å; F179-I250 HydrophobicContact CZ-CD1 3.81Å; F179-I250 HydrophobicContact CZ-CG1 4.3Å; F179-I250 HydrophobicContact CZ-CG2 4.44Å
180	I	97.7	Very high	89.5	Confident	13 Å²	13	57.4 Å²	57.4	7%	0.067	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.9	179.1	-57.5	171.4	0	0	0	106.7	L144 I203 I206 L248 I249 I251	L144-I180 HydrophobicContact CB-CG1 4.09Å; L144-I180 HydrophobicContact CD2-CD1 4.01Å; L144-I180 HydrophobicContact CD2-CG1 4.03Å; L144-I180 HydrophobicContact CG-CG1 4.44Å; I180-I203 HydrophobicContact CG2-CD1 4.45Å; I180-I206 HydrophobicContact CD1-CG2 3.99Å; I180-L248 WeakPolarHBondContact O-CA 3.37Å; I180-I249 HydrophobicContact CB-CB 4.22Å; I180-I249 PolarHBondContact N-O 3.46Å; I180-I249 PolarHBondContact O-N 3.21Å; I180-I251 HydrophobicContact CD1-CD1 3.56Å; I180-I251 HydrophobicContact CD1-CG1 4.33Å
181	L	97	Very high	87.6	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.2	167.1	-70.4	171.9	0	0	0	107.6	L42 F43 F112 L143 L216 L246 L247 L248	L42-L181 HydrophobicContact CD1-CB 3.58Å; L42-L181 HydrophobicContact CG-CB 4.49Å; F43-L181 HydrophobicContact CE1-CD1 3.92Å; F112-L181 HydrophobicContact CE1-CD1 3.99Å; L143-L181 HydrophobicContact CD1-CD1 4.32Å; L143-L181 HydrophobicContact CD1-CG 4.22Å; L181-L216 HydrophobicContact CD2-CD1 3.67Å; L181-L246 HydrophobicContact CB-CD1 4.37Å; L181-L246 HydrophobicContact CD2-CD1 4.41Å; L181-L246 HydrophobicContact CD2-CD2 4.47Å; L181-L246 HydrophobicContact CD2-CG 4.45Å; L181-L247 WeakPolarHBondContact CA-O 3.34Å; L181-L248 HydrophobicContact CD2-CD1 3.73Å; L181-L248 HydrophobicContact CG-CD1 4.34Å
182	S	95.8	Very high	86.1	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.021	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	132.9	179.4	-178.5	0	0	0	0	110.2	I203 L247	S182-I203 WeakPolarHBondContact OG-CG1 3.43Å; S182-L247 PolarHBondContact N-O 3.37Å; S182-L247 WeakPolarHBondContact O-CB 2.8Å; S182-L247 PolarHBondContact O-N 3.39Å
183	W	95.5	Very high	85.1	Confident	19 Å²	19	66.2 Å²	66.2	7%	0.072	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	149.1	169.7	-72.9	104.8	0	0	0	111.5	H41 L42 P44 A199 H218 F243 T245 L246	H41-W183 PolarHBondContact O-NE1 3.49Å; L42-W183 PolarHBondContact O-NE1 3.42Å; P44-W183 HydrophobicContact CB-CH2 4.2Å; P44-W183 HydrophobicContact CB-CZ2 4.26Å; P44-W183 HydrophobicContact CG-CH2 3.84Å; P44-W183 HydrophobicContact CG-CZ2 3.82Å; W183-A199 HydrophobicContact CB-CB 3.86Å; W183-A199 WeakPolarHBondContact O-CB 3.19Å; W183-A199 PolarHBondContact O-N 2.92Å; W183-H218 HydrophobicContact CH2-CB 4Å; W183-H218 HydrophobicContact CZ3-CB 4.29Å; W183-F243 HydrophobicContact CB-CB 3.72Å; W183-F243 HydrophobicContact CB-CD2 3.51Å; W183-F243 HydrophobicContact CB-CE2 4.49Å; W183-F243 HydrophobicContact CB-CG 3.75Å; W183-F243 HydrophobicContact CD2-CB 4.31Å; W183-F243 HydrophobicContact CE3-CB 3.93Å; W183-F243 HydrophobicContact CG-CB 4.28Å; W183-F243 HydrophobicContact CG-CD2 4.26Å; W183-T245 CarbonylContact C-O 3.47Å; W183-T245 WeakPolarHBondContact CA-O 3.26Å; W183-L246 HydrophobicContact CD2-CD1 4.02Å; W183-L246 HydrophobicContact CE3-CB 4.07Å; W183-L246 HydrophobicContact CE3-CD1 4.42Å; W183-L246 HydrophobicContact CG-CD1 4.4Å; W183-L246 HydrophobicContact CH2-CB 4.07Å; W183-L246 HydrophobicContact CZ2-CB 4.48Å; W183-L246 HydrophobicContact CZ2-CD1 4.2Å; W183-L246 HydrophobicContact CZ3-CB 3.84Å
184	A	94.5	Very high	84.6	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	155.4	171.2	0	0	0	0	0	110.3	Y196 E197 F198 N244 T245 L247	A184-Y196 HydrophobicContact CB-CD1 4.19Å; A184-E197 CarbonylContact C-O 3.53Å; A184-E197 WeakPolarHBondContact CA-O 3.5Å; A184-E197 WeakPolarHBondContact CB-O 3.39Å; A184-F198 HydrophobicContact CB-CD1 4.02Å; A184-N244 PolarHBondContact O-N 2.91Å; A184-N244 PolarHBondContact O-OD1 3.48Å; A184-T245 PolarHBondContact N-O 3.39Å; A184-T245 WeakPolarHBondContact O-CA 3.28Å; A184-T245 VanDerWaalsContact O-CB 3.32Å; A184-T245 WeakPolarHBondContact O-CB 3.26Å; A184-T245 PolarHBondContact O-N 2.84Å; A184-L247 HydrophobicContact CB-CD1 4.07Å
185	Y	92.8	Very high	84.4	Confident	87 Å²	87	69.5 Å²	69.5	34%	0.341	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.1	161	-178.4	-100.2	0	0	0	108.5	E187 Y196 E197	Y185-E187 HydrophobicContact CD1-CG 4.36Å; Y185-E187 HydrophobicContact CE1-CG 3.37Å; Y185-E187 WeakPolarHBondContact CE1-OE1 3.3Å; Y185-E187 WeakPolarHBondContact OH-CG 3.32Å; Y185-E187 PolarHBondContact OH-OE1 3.47Å; Y185-Y196 WeakPolarHBondContact O-CA 3.32Å; Y185-E197 PolarHBondContact N-O 2.9Å; Y185-E197 PolarHBondContact O-N 3.17Å
186	S	90.6	Very high	84.3	Confident	8 Å²	8	72.1 Å²	72.1	6%	0.056	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	140.7	168.4	76.6	0	0	0	0	110.2	N244 T245	S186-N244 PolarHBondContact N-OD1 3.46Å; S186-N244 PolarHBondContact O-ND2 2.95Å; S186-N244 PolarHBondContact O-OD1 2.93Å; S186-T245 WeakPolarHBondContact CB-OG1 3.32Å; S186-T245 PolarHBondContact OG-OG1 2.88Å
187	E	83.1	Confident	84.2	Confident	127 Å²	127	76.4 Å²	76.4	59%	0.593	37%	0.369	S	S	*	.			trans	-97.6	138.2	168.7	-62.3	-168.8	164.2	0	0	109.1	Y185 A189	Y185-E187 HydrophobicContact CD1-CG 4.36Å; Y185-E187 HydrophobicContact CE1-CG 3.37Å; Y185-E187 WeakPolarHBondContact CE1-OE1 3.3Å; Y185-E187 WeakPolarHBondContact OH-CG 3.32Å; Y185-E187 PolarHBondContact OH-OE1 3.47Å; E187-A189 VanDerWaalsContact C-N 3.28Å; E187-A189 PolarHBondContact O-N 3.22Å
188	E	68.5	Low	84.1	Confident	157 Å²	157	76.7 Å²	76.7	73%	0.734	37%	0.369	S	S	*	.			trans	-66.2	91.8	170.1	-67.8	-162.9	154.9	0	0	109.2
189	A	62.8	Low	83.9	Confident	54 Å²	54	77.6 Å²	77.6	45%	0.446	38%	0.377	S	S	.	.			trans	-72.5	143.1	169.7	0	0	0	0	0	109.8	E187 D191	E187-A189 VanDerWaalsContact C-N 3.28Å; E187-A189 PolarHBondContact O-N 3.22Å; A189-D191 PolarHBondContact O-N 3.09Å
190	K	57.8	Low	83.7	Confident	215 Å²	215	78.8 Å²	78.8	94%	0.935	38%	0.382	S	S	*	.	S	Bend	trans	-68.1	-16.9	175.3	-69.1	-178.5	179.6	175.7	0	113.1
191	D	52.1	Low	83.4	Confident	130 Å²	130	81.5 Å²	81.5	70%	0.695	40%	0.4	S	S	*	.	S	Bend	trans	-103.7	144.9	173.9	-73.2	-38.2	0	0	0	109.4	A189 D193	A189-D191 PolarHBondContact O-N 3.09Å; D191-D193 PolarHBondContact O-N 2.9Å
192	N	61.2	Low	83.2	Confident	174 Å²	174	81.4 Å²	81.4	93%	0.93	40%	0.4	S	S	*	.	S	Bend	trans	-59.5	-0.6	-175.1	-80	-23.4	0	0	0	115.5	K194	N192-K194 PolarHBondContact O-N 3.12Å
193	D	71.9	Confident	83.1	Confident	139 Å²	139	81.6 Å²	81.6	74%	0.743	40%	0.4	S	S	*	.			trans	-91.5	72.3	176.3	-71.7	-15.9	0	0	0	110.2	D191 K195	D191-D193 PolarHBondContact O-N 2.9Å; D193-K195 PolarHBondContact O-N 2.81Å
194	K	82	Confident	83	Confident	65 Å²	65	86 Å²	86	28%	0.283	42%	0.422	S	S	.	.			trans	-60.3	132.3	167.1	-75.6	-172.7	173	-167.7	0	109.6	N192 E215	N192-K194 PolarHBondContact O-N 3.12Å; K194-E215 VanDerWaalsContact CD-OE1 3.24Å; K194-E215 WeakPolarHBondContact CD-OE1 3.41Å; K194-E215 IonicContact NZ-OE1 2.82Å; K194-E215 PolarHBondContact NZ-OE1 3.31Å; K194-E215 IonicContact NZ-OE2 3.04Å; K194-E215 PolarHBondContact NZ-OE2 2.77Å
195	K	87.9	Confident	83	Confident	176 Å²	176	87.9 Å²	87.9	77%	0.765	43%	0.43	S	S	*	.			trans	-102.5	141.2	170.2	-66	-175.5	178.6	-176.9	0	109.1	D193	D193-K195 PolarHBondContact O-N 2.81Å
196	Y	91.8	Very high	83.1	Confident	71 Å²	71	84.4 Å²	84.4	28%	0.278	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134	176.1	-57.2	-75.9	0	0	0	108.8	A184 Y185 F198 E215 T245 L247	A184-Y196 HydrophobicContact CB-CD1 4.19Å; Y185-Y196 WeakPolarHBondContact O-CA 3.32Å; Y196-F198 HydrophobicContact CD2-CZ 4.47Å; Y196-F198 HydrophobicContact CG-CE1 4.47Å; Y196-F198 HydrophobicContact CG-CZ 4.44Å; Y196-E215 HydrophobicContact CE1-CG 4.23Å; Y196-E215 VanDerWaalsContact CE1-OE1 3.29Å; Y196-E215 WeakPolarHBondContact CE1-OE1 3.14Å; Y196-E215 WeakPolarHBondContact OH-CG 3.18Å; Y196-E215 PolarHBondContact OH-OE1 3Å; Y196-T245 HydrophobicContact CD1-CG2 4.42Å; Y196-T245 HydrophobicContact CE1-CG2 4.04Å; Y196-L247 HydrophobicContact CD1-CD1 4.18Å; Y196-L247 HydrophobicContact CD1-CD2 4.45Å; Y196-L247 HydrophobicContact CE1-CD1 4.48Å; Y196-L247 HydrophobicContact CE1-CD2 3.97Å; Y196-L247 HydrophobicContact CG-CD1 4.32Å
197	E	93.6	Very high	83.3	Confident	133 Å²	133	86 Å²	86	62%	0.621	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	107.6	161.4	179.8	171.8	-164.9	0	0	106.3	A184 Y185	A184-E197 CarbonylContact C-O 3.53Å; A184-E197 WeakPolarHBondContact CA-O 3.5Å; A184-E197 WeakPolarHBondContact CB-O 3.39Å; Y185-E197 PolarHBondContact N-O 2.9Å; Y185-E197 PolarHBondContact O-N 3.17Å
198	F	94.1	Very high	83.9	Confident	31 Å²	31	84.4 Å²	84.4	14%	0.136	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	146	-173	-60	-80.3	0	0	0	111.3	A184 Y196 Y200 I203 E204 V207 L247	A184-F198 HydrophobicContact CB-CD1 4.02Å; Y196-F198 HydrophobicContact CD2-CZ 4.47Å; Y196-F198 HydrophobicContact CG-CE1 4.47Å; Y196-F198 HydrophobicContact CG-CZ 4.44Å; F198-Y200 WeakPolarHBondContact CB-O 3.44Å; F198-Y200 PolarHBondContact O-N 3.31Å; F198-I203 HydrophobicContact CB-CB 3.91Å; F198-I203 HydrophobicContact CB-CG2 4.29Å; F198-I203 HydrophobicContact CD1-CB 3.9Å; F198-I203 HydrophobicContact CD1-CG2 3.29Å; F198-I203 HydrophobicContact CD2-CB 4.37Å; F198-I203 HydrophobicContact CD2-CG2 4.31Å; F198-I203 HydrophobicContact CE1-CG2 3.53Å; F198-I203 HydrophobicContact CG-CB 3.8Å; F198-I203 HydrophobicContact CG-CG2 3.71Å; F198-I203 HydrophobicContact CZ-CG2 4.16Å; F198-E204 HydrophobicContact CD2-CG 3.5Å; F198-E204 HydrophobicContact CE2-CG 3.83Å; F198-V207 HydrophobicContact CE1-CG2 4.07Å; F198-V207 HydrophobicContact CZ-CG2 3.85Å; F198-L247 HydrophobicContact CD1-CD1 4.05Å; F198-L247 HydrophobicContact CE1-CD1 3.49Å; F198-L247 VanDerWaalsContact CE1-CD1 3.49Å
199	A	92.9	Very high	85.3	Confident	20 Å²	20	78.6 Å²	78.6	17%	0.165	40%	0.4	C	S	.	.	S	Bend	trans	-57.4	-40.5	174.2	0	0	0	0	0	112.2	W183 F243	W183-A199 HydrophobicContact CB-CB 3.86Å; W183-A199 WeakPolarHBondContact O-CB 3.19Å; W183-A199 PolarHBondContact O-N 2.92Å; A199-F243 HydrophobicContact CB-CD1 4.31Å; A199-F243 HydrophobicContact CB-CD2 3.54Å; A199-F243 HydrophobicContact CB-CE1 3.92Å; A199-F243 HydrophobicContact CB-CE2 3.16Å; A199-F243 HydrophobicContact CB-CG 4.18Å; A199-F243 HydrophobicContact CB-CZ 3.39Å
200	Y	93.3	Very high	86.9	Confident	25 Å²	25	76.8 Å²	76.8	10%	0.098	39%	0.385	C	S	.	.	S	Bend	trans	-113.6	122.5	176	-61.7	-42.6	0	0	0	109.5	E147 R148 F198 E202 I203	E147-Y200 PolarHBondContact OE2-OH 2.72Å; R148-Y200 HydrophobicContact CG-CE1 4.04Å; R148-Y200 PolarHBondContact O-OH 3.3Å; R148-Y200 VanDerWaalsContact O-OH 3.14Å; F198-Y200 WeakPolarHBondContact CB-O 3.44Å; F198-Y200 PolarHBondContact O-N 3.31Å; Y200-E202 WeakPolarHBondContact CB-OE2 3.44Å; Y200-E202 PolarHBondContact O-N 3Å; Y200-I203 WeakPolarHBondContact O-CB 3.49Å; Y200-I203 VanDerWaalsContact O-CG1 3.29Å; Y200-I203 WeakPolarHBondContact O-CG1 3.2Å; Y200-I203 PolarHBondContact O-N 2.9Å; Y200-I203 VanDerWaalsContact O-N 3.12Å
201	P	92	Very high	88.7	Confident	69 Å²	69	69.9 Å²	69.9	45%	0.448	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.2	-174.7	24.4	-34.7	0	0	0	113.3	I203 E204	P201-I203 PolarHBondContact O-N 3.25Å; P201-I203 VanDerWaalsContact O-N 3.09Å; P201-E204 WeakPolarHBondContact O-CB 3.29Å; P201-E204 PolarHBondContact O-N 3.44Å; P201-E204 VanDerWaalsContact O-N 3.11Å
202	E	92.7	Very high	90.8	Very high	6 Å²	6	64.8 Å²	64.8	3%	0.028	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.3	176.2	54.5	-93	-137	0	0	113.4	R148 L154 Y200 E204 F205 I206 L263	R148-E202 IonicContact CZ-OE1 3.24Å; R148-E202 IonicContact CZ-OE2 3.15Å; R148-E202 IonicContact NE-OE1 2.83Å; R148-E202 PolarHBondContact NE-OE1 2.93Å; R148-E202 IonicContact NH2-OE1 3.87Å; R148-E202 PolarHBondContact NH2-OE1 3.24Å; R148-E202 IonicContact NH2-OE2 3.59Å; R148-E202 PolarHBondContact NH2-OE2 3.19Å; L154-E202 HydrophobicContact CD1-CB 3.68Å; Y200-E202 WeakPolarHBondContact CB-OE2 3.44Å; Y200-E202 PolarHBondContact O-N 3Å; E202-E204 PolarHBondContact O-N 3.45Å; E202-F205 PolarHBondContact O-N 3.33Å; E202-I206 HydrophobicContact CG-CD1 4.41Å; E202-I206 WeakPolarHBondContact O-CG1 3.48Å; E202-I206 PolarHBondContact O-N 2.92Å; E202-L263 HydrophobicContact CB-CD2 3.64Å
203	I	94.6	Very high	92.4	Very high	8 Å²	8	58.6 Å²	58.6	4%	0.041	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-27.9	-179.1	-58.3	-73.1	0	0	0	111.1	I180 S182 F198 Y200 P201 F205 I206 V207 I249	I180-I203 HydrophobicContact CG2-CD1 4.45Å; S182-I203 WeakPolarHBondContact OG-CG1 3.43Å; F198-I203 HydrophobicContact CB-CB 3.91Å; F198-I203 HydrophobicContact CB-CG2 4.29Å; F198-I203 HydrophobicContact CD1-CB 3.9Å; F198-I203 HydrophobicContact CD1-CG2 3.29Å; F198-I203 HydrophobicContact CD2-CB 4.37Å; F198-I203 HydrophobicContact CD2-CG2 4.31Å; F198-I203 HydrophobicContact CE1-CG2 3.53Å; F198-I203 HydrophobicContact CG-CB 3.8Å; F198-I203 HydrophobicContact CG-CG2 3.71Å; F198-I203 HydrophobicContact CZ-CG2 4.16Å; Y200-I203 WeakPolarHBondContact O-CB 3.49Å; Y200-I203 VanDerWaalsContact O-CG1 3.29Å; Y200-I203 WeakPolarHBondContact O-CG1 3.2Å; Y200-I203 PolarHBondContact O-N 2.9Å; Y200-I203 VanDerWaalsContact O-N 3.12Å; P201-I203 PolarHBondContact O-N 3.25Å; P201-I203 VanDerWaalsContact O-N 3.09Å; I203-F205 PolarHBondContact O-N 3.19Å; I203-I206 HydrophobicContact CD1-CD1 4.01Å; I203-I206 PolarHBondContact O-N 3.24Å; I203-I206 VanDerWaalsContact O-N 3.1Å; I203-V207 HydrophobicContact CG2-CG2 3.82Å; I203-V207 WeakPolarHBondContact O-CG2 3.49Å; I203-V207 PolarHBondContact O-N 3.19Å; I203-I249 HydrophobicContact CG2-CD1 3.58Å
204	E	93.8	Very high	93.5	Very high	110 Å²	110	52 Å²	52	51%	0.514	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-32.5	172.4	-65.6	-169.9	168.9	0	0	112.7	F198 P201 E202 P208	F198-E204 HydrophobicContact CD2-CG 3.5Å; F198-E204 HydrophobicContact CE2-CG 3.83Å; P201-E204 WeakPolarHBondContact O-CB 3.29Å; P201-E204 PolarHBondContact O-N 3.44Å; P201-E204 VanDerWaalsContact O-N 3.11Å; E202-E204 PolarHBondContact O-N 3.45Å; E204-P208 WeakPolarHBondContact O-CD 3.47Å; E204-P208 WeakPolarHBondContact O-CG 3.32Å
205	F	93	Very high	94.1	Very high	41 Å²	41	51 Å²	51	18%	0.18	26%	0.259	C	S	.	.	H	α-helix	trans	-87.5	-18.6	177.5	-47.9	-59.6	0	0	0	112.3	L154 E202 I203 H209 L263 H266	L154-F205 HydrophobicContact CD2-CE2 3.93Å; E202-F205 PolarHBondContact O-N 3.33Å; I203-F205 PolarHBondContact O-N 3.19Å; F205-H209 PolarHBondContact O-CD2 2.75Å; F205-H209 VanDerWaalsContact O-CD2 3.25Å; F205-L263 HydrophobicContact CB-CD2 3.83Å; F205-L263 HydrophobicContact CB-CG 4.38Å; F205-L263 HydrophobicContact CD2-CD2 3.94Å; F205-L263 HydrophobicContact CG-CD2 4.35Å; F205-H266 AromaticContact CD1-CD2 3.98Å; F205-H266 AromaticContact CD1-CE1 3.74Å; F205-H266 AromaticContact CD1-CG 3.86Å; F205-H266 AromaticContact CD1-ND1 3.69Å; F205-H266 AromaticContact CD1-NE2 3.93Å; F205-H266 HydrophobicContact CD2-CB 4.42Å; F205-H266 HydrophobicContact CE1-CB 4.15Å; F205-H266 AromaticContact CE1-CD2 3.33Å; F205-H266 WeakPolarHBondContact CE1-CD2 3.37Å; F205-H266 AromaticContact CE1-CE1 3.86Å; F205-H266 AromaticContact CE1-CG 3.51Å; F205-H266 AromaticContact CE1-ND1 3.83Å; F205-H266 AromaticContact CE1-NE2 3.58Å; F205-H266 HydrophobicContact CE2-CB 4Å; F205-H266 HydrophobicContact CZ-CB 3.85Å; F205-H266 AromaticContact CZ-CD2 3.74Å; F205-H266 AromaticContact CZ-CG 3.74Å
206	I	94.9	Very high	94.4	Very high	13 Å²	13	43 Å²	43	7%	0.067	23%	0.225	C	C	.	.	H	α-helix	trans	-85.1	-45.9	179.9	-68	171.1	0	0	0	111.5	I180 E202 I203 P208 H209 I249 I251 M259 L263	I180-I206 HydrophobicContact CD1-CG2 3.99Å; E202-I206 HydrophobicContact CG-CD1 4.41Å; E202-I206 WeakPolarHBondContact O-CG1 3.48Å; E202-I206 PolarHBondContact O-N 2.92Å; I203-I206 HydrophobicContact CD1-CD1 4.01Å; I203-I206 PolarHBondContact O-N 3.24Å; I203-I206 VanDerWaalsContact O-N 3.1Å; I206-P208 VanDerWaalsContact C-CD 3.42Å; I206-H209 PolarHBondContact O-N 3.2Å; I206-I249 HydrophobicContact CG2-CG2 4.43Å; I206-I251 HydrophobicContact CG2-CD1 3.34Å; I206-I251 HydrophobicContact CG2-CG1 4.46Å; I206-M259 HydrophobicContact CB-CG 4.42Å; I206-M259 HydrophobicContact CB-SD 4.38Å; I206-M259 HydrophobicContact CG1-CG 4.04Å; I206-M259 HydrophobicContact CG1-SD 3.93Å; I206-M259 HydrophobicContact CG2-CG 4.43Å; I206-M259 HydrophobicContact CG2-SD 3.9Å; I206-L263 HydrophobicContact CD1-CD1 4.34Å; I206-L263 HydrophobicContact CG1-CD1 4.11Å; I206-L263 HydrophobicContact CG1-CD2 4.38Å
207	V	95.8	Very high	94.1	Very high	42 Å²	42	42.6 Å²	42.6	26%	0.255	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-52.3	-41	-176.5	162.3	0	0	0	0	114	F198 I203 H209 A210 V213 I249	F198-V207 HydrophobicContact CE1-CG2 4.07Å; F198-V207 HydrophobicContact CZ-CG2 3.85Å; I203-V207 HydrophobicContact CG2-CG2 3.82Å; I203-V207 WeakPolarHBondContact O-CG2 3.49Å; I203-V207 PolarHBondContact O-N 3.19Å; V207-H209 PolarHBondContact O-N 3.49Å; V207-H209 VanDerWaalsContact O-N 3.13Å; V207-A210 VanDerWaalsContact O-CB 3.23Å; V207-A210 WeakPolarHBondContact O-CB 3.4Å; V207-A210 PolarHBondContact O-N 2.83Å; V207-V213 HydrophobicContact CG1-CG2 4.23Å; V207-I249 HydrophobicContact CG2-CD1 3.84Å; V207-I249 HydrophobicContact CG2-CG1 4.41Å
208	P	95.9	Very high	93.6	Very high	94 Å²	94	38.3 Å²	38.3	61%	0.61	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-58.9	-24.3	177.2	-27.4	36.6	0	0	0	114.8	E204 I206	E204-P208 WeakPolarHBondContact O-CD 3.47Å; E204-P208 WeakPolarHBondContact O-CG 3.32Å; I206-P208 VanDerWaalsContact C-CD 3.42Å
209	H	96.5	Very high	93	Very high	35 Å²	35	40.9 Å²	40.9	16%	0.162	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-90.2	-12.7	178.9	-62.9	-90.5	0	0	0	112.8	F205 I206 V207 R255 M259	F205-H209 PolarHBondContact O-CD2 2.75Å; F205-H209 VanDerWaalsContact O-CD2 3.25Å; I206-H209 PolarHBondContact O-N 3.2Å; V207-H209 PolarHBondContact O-N 3.49Å; V207-H209 VanDerWaalsContact O-N 3.13Å; H209-R255 WeakPolarHBondContact O-CD 3.48Å; H209-R255 PolarHBondContact O-NH1 2.8Å; H209-M259 HydrophobicContact CB-CB 4.06Å; H209-M259 HydrophobicContact CB-CG 4.43Å
210	A	96.9	Very high	92.6	Very high	16 Å²	16	41.1 Å²	41.1	13%	0.132	22%	0.223	C	C	.	.			trans	-61.9	140.8	-177.2	0	0	0	0	0	112.2	V207 V213 I249 I250 R255	V207-A210 VanDerWaalsContact O-CB 3.23Å; V207-A210 WeakPolarHBondContact O-CB 3.4Å; V207-A210 PolarHBondContact O-N 2.83Å; A210-V213 HydrophobicContact CB-CG2 3.73Å; A210-I249 HydrophobicContact CB-CG2 3.65Å; A210-I250 CarbonylContact C-O 3.51Å; A210-I250 WeakPolarHBondContact CA-O 3.35Å; A210-R255 PolarHBondContact O-NH1 3.45Å
211	L	95.8	Very high	92.3	Very high	70 Å²	70	40 Å²	40	37%	0.366	22%	0.219	S	C	.	.	S	Bend	trans	-73.2	-44.2	166.2	177.5	63	0	0	0	109.9	I250 P252	L211-I250 PolarHBondContact N-O 3.44Å; L211-P252 HydrophobicContact CB-CG 4.25Å
212	H	95.5	Very high	91.9	Very high	22 Å²	22	37.8 Å²	37.8	10%	0.102	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141.7	-179	-62.3	-33	0	0	0	110.7	M125 K128 I250	M125-H212 HydrophobicContact CG-CB 4.43Å; M125-H212 HydrophobicContact SD-CB 3.68Å; M125-H212 PolarHBondContact SD-ND1 3.22Å; K128-H212 VanDerWaalsContact CD-CE1 3.47Å; K128-H212 WeakPolarHBondContact CD-CE1 3.41Å; H212-I250 HydrophobicContact CB-CB 4.29Å; H212-I250 HydrophobicContact CB-CD1 4.24Å; H212-I250 HydrophobicContact CB-CG1 4.48Å; H212-I250 PolarHBondContact N-O 3.15Å; H212-I250 PolarHBondContact O-N 3.47Å
213	V	95.3	Very high	91.2	Very high	44 Å²	44	46 Å²	46	27%	0.267	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.9	168.5	-178	0	0	0	0	107	V207 A210 L247 L248 I249	V207-V213 HydrophobicContact CG1-CG2 4.23Å; A210-V213 HydrophobicContact CB-CG2 3.73Å; V213-L247 HydrophobicContact CG1-CD2 4.37Å; V213-L248 WeakPolarHBondContact CA-O 3.44Å; V213-I249 HydrophobicContact CG1-CG1 4.23Å; V213-I249 HydrophobicContact CG2-CG1 4.38Å; V213-I249 HydrophobicContact CG2-CG2 4.36Å
214	L	95.2	Very high	89.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.7	-174.9	-174.4	63.6	0	0	0	110.4	V117 S120 N122 M125 V129 L216 L247 L248	V117-L214 HydrophobicContact CB-CD2 4.25Å; V117-L214 HydrophobicContact CG1-CD2 4.02Å; V117-L214 HydrophobicContact CG2-CD2 3.92Å; S120-L214 WeakPolarHBondContact OG-CD1 3.46Å; N122-L214 HydrophobicContact CB-CD1 3.86Å; M125-L214 HydrophobicContact CB-CD1 3.84Å; M125-L214 HydrophobicContact CG-CB 4.32Å; M125-L214 HydrophobicContact CG-CD1 3.89Å; V129-L214 HydrophobicContact CG2-CD2 4.16Å; L214-L216 HydrophobicContact CD2-CD2 4.21Å; L214-L216 HydrophobicContact CG-CD2 4.4Å; L214-L216 PolarHBondContact O-N 3.32Å; L214-L247 WeakPolarHBondContact O-CA 3.38Å; L214-L248 HydrophobicContact CB-CB 4.48Å; L214-L248 PolarHBondContact N-O 3.29Å; L214-L248 PolarHBondContact O-N 3.2Å
215	E	94.5	Very high	87.9	Confident	43 Å²	43	44.7 Å²	44.7	20%	0.201	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	118.5	166.3	-67.3	-176.9	161.7	0	0	109.3	S120 K194 Y196 T245 L247	S120-E215 WeakPolarHBondContact CB-O 3.3Å; S120-E215 PolarHBondContact OG-O 3.22Å; K194-E215 VanDerWaalsContact CD-OE1 3.24Å; K194-E215 WeakPolarHBondContact CD-OE1 3.41Å; K194-E215 IonicContact NZ-OE1 2.82Å; K194-E215 PolarHBondContact NZ-OE1 3.31Å; K194-E215 IonicContact NZ-OE2 3.04Å; K194-E215 PolarHBondContact NZ-OE2 2.77Å; Y196-E215 HydrophobicContact CE1-CG 4.23Å; Y196-E215 VanDerWaalsContact CE1-OE1 3.29Å; Y196-E215 WeakPolarHBondContact CE1-OE1 3.14Å; Y196-E215 WeakPolarHBondContact OH-CG 3.18Å; Y196-E215 PolarHBondContact OH-OE1 3Å; E215-T245 HydrophobicContact CG-CG2 3.93Å; E215-L247 HydrophobicContact CB-CD2 4.31Å; E215-L247 HydrophobicContact CG-CD2 3.63Å
216	L	93.4	Very high	85.5	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	142.1	170.6	-55	-174.5	0	0	0	109.4	V117 L181 L214 H218 L221 L246 L248	V117-L216 HydrophobicContact CG2-CD2 3.99Å; L181-L216 HydrophobicContact CD2-CD1 3.67Å; L214-L216 HydrophobicContact CD2-CD2 4.21Å; L214-L216 HydrophobicContact CG-CD2 4.4Å; L214-L216 PolarHBondContact O-N 3.32Å; L216-H218 PolarHBondContact O-N 3.45Å; L216-L221 HydrophobicContact CB-CD1 4.2Å; L216-L221 HydrophobicContact CD1-CD1 4.31Å; L216-L246 HydrophobicContact CB-CB 4.48Å; L216-L246 HydrophobicContact CB-CD2 4.41Å; L216-L246 HydrophobicContact CB-CG 4.42Å; L216-L246 HydrophobicContact CD1-CD2 4.04Å; L216-L246 HydrophobicContact CD1-CG 4.24Å; L216-L246 PolarHBondContact N-O 3.38Å; L216-L248 HydrophobicContact CD1-CB 4.08Å; L216-L248 HydrophobicContact CD2-CB 3.89Å; L216-L248 HydrophobicContact CD2-CD2 4.39Å; L216-L248 HydrophobicContact CG-CB 3.97Å
217	D	85.8	Confident	83	Confident	63 Å²	63	55 Å²	55	34%	0.337	30%	0.301	S	S	.	.			trans	-77.2	88.8	171.6	-175.7	0.7	0	0	0	109.5	A119 N219 S220	A119-D217 HydrophobicContact CB-CB 3.78Å; D217-N219 PolarHBondContact O-N 3.14Å; D217-N219 VanDerWaalsContact O-N 3.12Å; D217-N219 WeakPolarHBondContact OD1-CB 3.39Å; D217-N219 PolarHBondContact OD1-N 2.71Å; D217-S220 WeakPolarHBondContact O-CB 3.31Å; D217-S220 PolarHBondContact O-N 3.46Å; D217-S220 PolarHBondContact O-OG 3.13Å
218	H	83.1	Confident	80.5	Confident	44 Å²	44	58.2 Å²	58.2	20%	0.204	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.1	-177.4	72.7	-87.3	0	0	0	113.5	P44 W183 L216 S220 L221 N244 L246	P44-H218 HydrophobicContact CG-CB 4.06Å; W183-H218 HydrophobicContact CH2-CB 4Å; W183-H218 HydrophobicContact CZ3-CB 4.29Å; L216-H218 PolarHBondContact O-N 3.45Å; H218-S220 VanDerWaalsContact C-N 3.31Å; H218-S220 PolarHBondContact O-N 3.25Å; H218-L221 WeakPolarHBondContact O-CB 3.45Å; H218-L221 PolarHBondContact O-N 3.31Å; H218-L221 VanDerWaalsContact O-N 3.12Å; H218-N244 PolarHBondContact CE1-O 3.26Å; H218-N244 PolarHBondContact ND1-O 3.4Å; H218-L246 HydrophobicContact CB-CB 4.12Å
219	N	83	Confident	77.9	Confident	85 Å²	85	63 Å²	63	46%	0.455	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-38.6	175.3	-63.6	-65.7	0	0	0	111	D217 L221 T222 G225	D217-N219 PolarHBondContact O-N 3.14Å; D217-N219 VanDerWaalsContact O-N 3.12Å; D217-N219 WeakPolarHBondContact OD1-CB 3.39Å; D217-N219 PolarHBondContact OD1-N 2.71Å; N219-L221 PolarHBondContact O-N 3.32Å; N219-T222 PolarHBondContact O-N 2.83Å; N219-T222 PolarHBondContact O-OG1 3.17Å; N219-G225 WeakPolarHBondContact O-CA 3.32Å
220	S	83.5	Confident	74.9	Confident	25 Å²	25	69.9 Å²	69.9	18%	0.175	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.8	174.8	74.5	0	0	0	0	113	A119 D217 H218	A119-S220 VanDerWaalsContact CB-OG 3.24Å; A119-S220 WeakPolarHBondContact CB-OG 3.37Å; D217-S220 WeakPolarHBondContact O-CB 3.31Å; D217-S220 PolarHBondContact O-N 3.46Å; D217-S220 PolarHBondContact O-OG 3.13Å; H218-S220 VanDerWaalsContact C-N 3.31Å; H218-S220 PolarHBondContact O-N 3.25Å
221	L	86.3	Confident	71.8	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.005	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.1	-177.2	-62.4	176.7	0	0	0	113.8	P44 C47 F112 E115 L216 H218 N219 L246	P44-L221 HydrophobicContact CG-CB 4.22Å; C47-L221 WeakPolarHBondContact CA-O 3.29Å; C47-L221 WeakPolarHBondContact CB-O 3.49Å; F112-L221 HydrophobicContact CD2-CB 4.21Å; F112-L221 HydrophobicContact CD2-CD2 3.92Å; F112-L221 HydrophobicContact CD2-CG 4.45Å; F112-L221 HydrophobicContact CE1-CD1 3.98Å; F112-L221 HydrophobicContact CE2-CB 3.63Å; F112-L221 HydrophobicContact CE2-CD1 3.86Å; F112-L221 HydrophobicContact CE2-CD2 4.01Å; F112-L221 HydrophobicContact CE2-CG 4.05Å; F112-L221 HydrophobicContact CG-CD2 4.25Å; F112-L221 HydrophobicContact CZ-CB 4.16Å; F112-L221 HydrophobicContact CZ-CD1 3.54Å; F112-L221 HydrophobicContact CZ-CD2 4.39Å; F112-L221 HydrophobicContact CZ-CG 4.24Å; F112-L221 WeakPolarHBondContact O-CD2 3.48Å; E115-L221 HydrophobicContact CB-CD2 4.1Å; E115-L221 HydrophobicContact CG-CD2 4.2Å; L216-L221 HydrophobicContact CB-CD1 4.2Å; L216-L221 HydrophobicContact CD1-CD1 4.31Å; H218-L221 WeakPolarHBondContact O-CB 3.45Å; H218-L221 PolarHBondContact O-N 3.31Å; H218-L221 VanDerWaalsContact O-N 3.12Å; N219-L221 PolarHBondContact O-N 3.32Å; L221-L246 HydrophobicContact CD1-CD2 3.82Å
222	T	84.6	Confident	68.7	Low	23 Å²	23	77.1 Å²	77.1	14%	0.141	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-88.8	143.6	173.3	67.2	0	0	0	0	110	P44 N45 N219 D224 G225	P44-T222 HydrophobicContact CB-CG2 4.1Å; N45-T222 WeakPolarHBondContact O-CG2 3.39Å; N219-T222 PolarHBondContact O-N 2.83Å; N219-T222 PolarHBondContact O-OG1 3.17Å; T222-D224 PolarHBondContact O-N 2.97Å; T222-D224 VanDerWaalsContact O-N 3.09Å; T222-G225 PolarHBondContact O-N 3.04Å; T222-G225 WeakPolarHBondContact OG1-CA 3.4Å; T222-G225 PolarHBondContact OG1-N 2.87Å
223	R	76.6	Confident	65.7	Low	177 Å²	177	83.7 Å²	83.7	67%	0.668	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.5	175.9	-74.9	175.4	172.5	-161.2	-2.5	112.6	N46 C47 V48	N46-R223 WeakPolarHBondContact O-CB 3.38Å; N46-R223 VanDerWaalsContact O-CG 3.26Å; N46-R223 WeakPolarHBondContact O-CG 3.39Å; N46-R223 PolarHBondContact O-N 3.34Å; C47-R223 PolarHBondContact O-NE 2.83Å; V48-R223 HydrophobicContact CG1-CG 3.99Å
224	D	66.7	Low	62.8	Low	66 Å²	66	85.3 Å²	85.3	35%	0.353	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	5.2	178.9	-65.4	-51.3	0	0	0	114	T222 A226 K227 I228	T222-D224 PolarHBondContact O-N 2.97Å; T222-D224 VanDerWaalsContact O-N 3.09Å; D224-A226 PolarHBondContact O-N 3.33Å; D224-K227 PolarHBondContact O-N 3.39Å; D224-I228 HydrophobicContact CB-CD1 4.19Å; D224-I228 HydrophobicContact CB-CG1 4.34Å; D224-I228 PolarHBondContact O-N 3.2Å
225	G	52.9	Low	60	Low	26 Å²	26	92.5 Å²	92.5	27%	0.268	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.2	179.2	0	0	0	0	0	114.2	N219 T222	N219-G225 WeakPolarHBondContact O-CA 3.32Å; T222-G225 PolarHBondContact O-N 3.04Å; T222-G225 WeakPolarHBondContact OG1-CA 3.4Å; T222-G225 PolarHBondContact OG1-N 2.87Å
226	A	42.9	Very low	57.4	Low	101 Å²	101	98.4 Å²	98.4	84%	0.835	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-18	172.2	0	0	0	0	0	114.6	D224	D224-A226 PolarHBondContact O-N 3.33Å
227	K	42.1	Very low	55.2	Low	168 Å²	168	104.3 Å²	104.3	73%	0.73	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-22	-175	-69.5	-176.4	-178.5	172.2	0	114.1	D224 K229	D224-K227 PolarHBondContact O-N 3.39Å; K227-K229 PolarHBondContact O-N 3.31Å
228	I	44.6	Very low	53.3	Low	111 Å²	111	109.7 Å²	109.7	57%	0.569	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	58.5	179.3	-47.7	173.1	0	0	0	110.8	D224	D224-I228 HydrophobicContact CB-CD1 4.19Å; D224-I228 HydrophobicContact CB-CG1 4.34Å; D224-I228 PolarHBondContact O-N 3.2Å
229	K	40	Very low	51.8	Low	195 Å²	195	117.5 Å²	117.5	85%	0.848	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	-5.2	165.5	-98.4	-178.4	179.2	171.2	0	114	K227	K227-K229 PolarHBondContact O-N 3.31Å
230	Q	33.1	Very low	50.5	Low	179 Å²	179	117.7 Å²	117.7	84%	0.836	63%	0.633	S	S	*	*	S	Bend	trans	-157.3	69.2	178.1	-66.1	-173.2	21.9	0	0	112.8
231	C	31.9	Very low	49.5	Very low	121 Å²	121	118 Å²	118	82%	0.818	63%	0.632	S	S	*	*			trans	-146.5	74.8	160	-80.1	0	0	0	0	109.5	D233	C231-D233 VanDerWaalsContact C-N 3.32Å; C231-D233 PolarHBondContact O-N 3.06Å
232	S	31.6	Very low	49.2	Very low	117 Å²	117	125 Å²	125	82%	0.818	67%	0.67	S	S	*	*			trans	-77	87.1	156.6	46	0	0	0	0	107.7
233	D	33.2	Very low	49.4	Very low	159 Å²	159	126 Å²	126	85%	0.85	67%	0.672	S	S	*	*	S	Bend	trans	177.9	107	158.5	-97.5	-19.3	0	0	0	110.1	C231	C231-D233 VanDerWaalsContact C-N 3.32Å; C231-D233 PolarHBondContact O-N 3.06Å
234	G	33.7	Very low	50	Low	78 Å²	78	120.3 Å²	120.3	80%	0.804	66%	0.655	S	S	*	*				94.6	-1	126.7	0	0	0	0	0	122.3
235	D	36.9	Very low	51.2	Low	154 Å²	154	117.6 Å²	117.6	82%	0.824	64%	0.641	S	S	*	*			trans	-115.2	115.5	173.4	-75.8	-31.4	0	0	0	110.5	D237	D235-D237 PolarHBondContact O-N 2.76Å
236	D	38.7	Very low	53.3	Low	166 Å²	166	116.4 Å²	116.4	89%	0.888	63%	0.628	S	S	*	*			trans	-65	81.4	171.4	-75.3	-40.4	0	0	0	109	E238	D236-E238 PolarHBondContact O-N 2.87Å
237	D	48.2	Very low	55.8	Low	131 Å²	131	111.6 Å²	111.6	70%	0.701	59%	0.589	S	S	*	*			trans	-64	104.6	157.4	-90.7	-24.8	0	0	0	106.1	D235 R239	D235-D237 PolarHBondContact O-N 2.76Å; D237-R239 VanDerWaalsContact C-N 3.31Å; D237-R239 PolarHBondContact O-N 3.1Å
238	E	45.3	Very low	58.4	Low	176 Å²	176	103.6 Å²	103.6	82%	0.822	55%	0.554	S	S	*	*			trans	-51.7	95.7	172.9	-78.9	-179.8	162.6	0	0	108.7	N45 D236 T240	N45-E238 PolarHBondContact ND2-O 3.18Å; D236-E238 PolarHBondContact O-N 2.87Å; E238-T240 PolarHBondContact O-N 3.18Å; E238-T240 VanDerWaalsContact O-N 3.1Å
239	R	51.9	Low	61	Low	208 Å²	208	98.3 Å²	98.3	79%	0.785	53%	0.527	S	S	*	.			trans	-63.2	115.3	166.4	-68.9	-175.6	-178.7	179.9	-0.7	105.5	D237 N241	D237-R239 VanDerWaalsContact C-N 3.31Å; D237-R239 PolarHBondContact O-N 3.1Å; R239-N241 PolarHBondContact O-N 3.1Å
240	T	55.7	Low	63.7	Low	89 Å²	89	89 Å²	89	55%	0.546	49%	0.486	S	S	.	.	S	Bend	trans	-73.9	-14.1	177.3	49.7	0	0	0	0	111.4	N45 E238	N45-T240 WeakPolarHBondContact ND2-CG2 3.28Å; N45-T240 PolarHBondContact ND2-N 3.2Å; N45-T240 PolarHBondContact ND2-OG1 2.67Å; N45-T240 PolarHBondContact OD1-OG1 2.86Å; E238-T240 PolarHBondContact O-N 3.18Å; E238-T240 VanDerWaalsContact O-N 3.1Å
241	N	62.5	Low	66.7	Low	32 Å²	32	80.5 Å²	80.5	17%	0.171	45%	0.447	C	S	.	.			trans	-129	127.5	-176.2	-152.6	-15.5	0	0	0	111.1	R239 F243	R239-N241 PolarHBondContact O-N 3.1Å; N241-F243 PolarHBondContact O-N 3.24Å; N241-F243 WeakPolarHBondContact OD1-CD2 3.09Å; N241-F243 WeakPolarHBondContact OD1-CE2 3.4Å; N241-F243 PolarHBondContact OD1-N 2.76Å
242	D	79.8	Confident	69.8	Low	147 Å²	147	75.4 Å²	75.4	79%	0.786	41%	0.412	S	S	*	.	S	Bend	trans	-74.7	-10.6	178.4	-72.9	-26.7	0	0	0	112.2
243	F	89.1	Confident	72.8	Confident	46 Å²	46	72.1 Å²	72.1	20%	0.202	38%	0.384	C	S	.	.			trans	-80.2	144.6	176.6	-54.9	-57.5	0	0	0	112.5	W183 A199 N241	W183-F243 HydrophobicContact CB-CB 3.72Å; W183-F243 HydrophobicContact CB-CD2 3.51Å; W183-F243 HydrophobicContact CB-CE2 4.49Å; W183-F243 HydrophobicContact CB-CG 3.75Å; W183-F243 HydrophobicContact CD2-CB 4.31Å; W183-F243 HydrophobicContact CE3-CB 3.93Å; W183-F243 HydrophobicContact CG-CB 4.28Å; W183-F243 HydrophobicContact CG-CD2 4.26Å; A199-F243 HydrophobicContact CB-CD1 4.31Å; A199-F243 HydrophobicContact CB-CD2 3.54Å; A199-F243 HydrophobicContact CB-CE1 3.92Å; A199-F243 HydrophobicContact CB-CE2 3.16Å; A199-F243 HydrophobicContact CB-CG 4.18Å; A199-F243 HydrophobicContact CB-CZ 3.39Å; N241-F243 PolarHBondContact O-N 3.24Å; N241-F243 WeakPolarHBondContact OD1-CD2 3.09Å; N241-F243 WeakPolarHBondContact OD1-CE2 3.4Å; N241-F243 PolarHBondContact OD1-N 2.76Å
244	N	89.5	Confident	75.7	Confident	56 Å²	56	70.5 Å²	70.5	30%	0.299	38%	0.376	S	S	.	.			trans	-116.8	-2.5	-176.1	69.2	6.1	0	0	0	113.6	A184 S186 H218	A184-N244 PolarHBondContact O-N 2.91Å; A184-N244 PolarHBondContact O-OD1 3.48Å; S186-N244 PolarHBondContact N-OD1 3.46Å; S186-N244 PolarHBondContact O-ND2 2.95Å; S186-N244 PolarHBondContact O-OD1 2.93Å; H218-N244 PolarHBondContact CE1-O 3.26Å; H218-N244 PolarHBondContact ND1-O 3.4Å
245	T	92.5	Very high	78.7	Confident	10 Å²	10	71.5 Å²	71.5	6%	0.061	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	122	-175	-54.2	0	0	0	0	109.7	W183 A184 S186 Y196 E215 L247	W183-T245 CarbonylContact C-O 3.47Å; W183-T245 WeakPolarHBondContact CA-O 3.26Å; A184-T245 PolarHBondContact N-O 3.39Å; A184-T245 WeakPolarHBondContact O-CA 3.28Å; A184-T245 VanDerWaalsContact O-CB 3.32Å; A184-T245 WeakPolarHBondContact O-CB 3.26Å; A184-T245 PolarHBondContact O-N 2.84Å; S186-T245 WeakPolarHBondContact CB-OG1 3.32Å; S186-T245 PolarHBondContact OG-OG1 2.88Å; Y196-T245 HydrophobicContact CD1-CG2 4.42Å; Y196-T245 HydrophobicContact CE1-CG2 4.04Å; E215-T245 HydrophobicContact CG-CG2 3.93Å; T245-L247 HydrophobicContact CG2-CD2 3.89Å; T245-L247 HydrophobicContact CG2-CG 4.25Å
246	L	95.2	Very high	81.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.9	171.3	-178.4	62	0	0	0	108.8	P44 F112 L181 W183 L216 H218 L221	P44-L246 HydrophobicContact CG-CD2 4.26Å; F112-L246 HydrophobicContact CE1-CD2 4.4Å; F112-L246 HydrophobicContact CZ-CD2 4.13Å; L181-L246 HydrophobicContact CB-CD1 4.37Å; L181-L246 HydrophobicContact CD2-CD1 4.41Å; L181-L246 HydrophobicContact CD2-CD2 4.47Å; L181-L246 HydrophobicContact CD2-CG 4.45Å; W183-L246 HydrophobicContact CD2-CD1 4.02Å; W183-L246 HydrophobicContact CE3-CB 4.07Å; W183-L246 HydrophobicContact CE3-CD1 4.42Å; W183-L246 HydrophobicContact CG-CD1 4.4Å; W183-L246 HydrophobicContact CH2-CB 4.07Å; W183-L246 HydrophobicContact CZ2-CB 4.48Å; W183-L246 HydrophobicContact CZ2-CD1 4.2Å; W183-L246 HydrophobicContact CZ3-CB 3.84Å; L216-L246 HydrophobicContact CB-CB 4.48Å; L216-L246 HydrophobicContact CB-CD2 4.41Å; L216-L246 HydrophobicContact CB-CG 4.42Å; L216-L246 HydrophobicContact CD1-CD2 4.04Å; L216-L246 HydrophobicContact CD1-CG 4.24Å; L216-L246 PolarHBondContact N-O 3.38Å; H218-L246 HydrophobicContact CB-CB 4.12Å; L221-L246 HydrophobicContact CD1-CD2 3.82Å
247	L	96.2	Very high	84.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	138	179	-60.5	173.9	0	0	0	110.1	L181 S182 A184 Y196 F198 V213 L214 E215 T245 I249	L181-L247 WeakPolarHBondContact CA-O 3.34Å; S182-L247 PolarHBondContact N-O 3.37Å; S182-L247 WeakPolarHBondContact O-CB 2.8Å; S182-L247 PolarHBondContact O-N 3.39Å; A184-L247 HydrophobicContact CB-CD1 4.07Å; Y196-L247 HydrophobicContact CD1-CD1 4.18Å; Y196-L247 HydrophobicContact CD1-CD2 4.45Å; Y196-L247 HydrophobicContact CE1-CD1 4.48Å; Y196-L247 HydrophobicContact CE1-CD2 3.97Å; Y196-L247 HydrophobicContact CG-CD1 4.32Å; F198-L247 HydrophobicContact CD1-CD1 4.05Å; F198-L247 HydrophobicContact CE1-CD1 3.49Å; F198-L247 VanDerWaalsContact CE1-CD1 3.49Å; V213-L247 HydrophobicContact CG1-CD2 4.37Å; L214-L247 WeakPolarHBondContact O-CA 3.38Å; E215-L247 HydrophobicContact CB-CD2 4.31Å; E215-L247 HydrophobicContact CG-CD2 3.63Å; T245-L247 HydrophobicContact CG2-CD2 3.89Å; T245-L247 HydrophobicContact CG2-CG 4.25Å; L247-I249 HydrophobicContact CB-CG1 4.36Å
248	L	97.4	Very high	86.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.6	162.8	-175.4	70.8	0	0	0	109	I113 V117 V129 F179 I180 L181 V213 L214 L216 I250	I113-L248 HydrophobicContact CG2-CD1 4.47Å; I113-L248 HydrophobicContact CG2-CD2 3.86Å; V117-L248 HydrophobicContact CG2-CD2 3.94Å; V129-L248 HydrophobicContact CG1-CD2 3.77Å; F179-L248 HydrophobicContact CB-CD1 4.27Å; F179-L248 HydrophobicContact CD1-CD1 3.99Å; F179-L248 HydrophobicContact CD1-CD2 4.09Å; F179-L248 HydrophobicContact CD1-CG 4.32Å; F179-L248 HydrophobicContact CE1-CD2 4.36Å; I180-L248 WeakPolarHBondContact O-CA 3.37Å; L181-L248 HydrophobicContact CD2-CD1 3.73Å; L181-L248 HydrophobicContact CG-CD1 4.34Å; V213-L248 WeakPolarHBondContact CA-O 3.44Å; L214-L248 HydrophobicContact CB-CB 4.48Å; L214-L248 PolarHBondContact N-O 3.29Å; L214-L248 PolarHBondContact O-N 3.2Å; L216-L248 HydrophobicContact CD1-CB 4.08Å; L216-L248 HydrophobicContact CD2-CB 3.89Å; L216-L248 HydrophobicContact CD2-CD2 4.39Å; L216-L248 HydrophobicContact CG-CB 3.97Å; L248-I250 HydrophobicContact CD2-CD1 4.48Å; L248-I250 HydrophobicContact CG-CG1 4.41Å
249	I	97.7	Very high	88.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128.4	-179.8	-57.5	164.6	0	0	0	107.6	F179 I180 I203 I206 V207 A210 V213 L247 I251	F179-I249 CarbonylContact C-O 3.56Å; F179-I249 WeakPolarHBondContact CA-O 3.47Å; I180-I249 HydrophobicContact CB-CB 4.22Å; I180-I249 PolarHBondContact N-O 3.46Å; I180-I249 PolarHBondContact O-N 3.21Å; I203-I249 HydrophobicContact CG2-CD1 3.58Å; I206-I249 HydrophobicContact CG2-CG2 4.43Å; V207-I249 HydrophobicContact CG2-CD1 3.84Å; V207-I249 HydrophobicContact CG2-CG1 4.41Å; A210-I249 HydrophobicContact CB-CG2 3.65Å; V213-I249 HydrophobicContact CG1-CG1 4.23Å; V213-I249 HydrophobicContact CG2-CG1 4.38Å; V213-I249 HydrophobicContact CG2-CG2 4.36Å; L247-I249 HydrophobicContact CB-CG1 4.36Å; I249-I251 HydrophobicContact CG2-CG1 4.23Å
250	I	97.3	Very high	90.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.8	-178.7	-55.5	178	0	0	0	109.3	V129 L132 H177 L178 F179 A210 L211 H212 L248	V129-I250 HydrophobicContact CB-CD1 4.21Å; V129-I250 HydrophobicContact CG1-CD1 3.87Å; V129-I250 HydrophobicContact CG2-CD1 3.62Å; L132-I250 HydrophobicContact CD1-CD1 3.98Å; L132-I250 HydrophobicContact CD1-CG2 4.04Å; H177-I250 HydrophobicContact CB-CG2 4.15Å; L178-I250 CarbonylContact O-C 3.51Å; L178-I250 WeakPolarHBondContact O-CA 3.44Å; F179-I250 HydrophobicContact CD1-CD1 4.11Å; F179-I250 HydrophobicContact CD1-CG1 4.03Å; F179-I250 HydrophobicContact CD2-CG2 4.44Å; F179-I250 HydrophobicContact CE1-CD1 3.6Å; F179-I250 HydrophobicContact CE1-CG1 4.02Å; F179-I250 HydrophobicContact CE2-CD1 4.49Å; F179-I250 HydrophobicContact CE2-CG2 4.17Å; F179-I250 HydrophobicContact CG-CG1 4.32Å; F179-I250 HydrophobicContact CZ-CD1 3.81Å; F179-I250 HydrophobicContact CZ-CG1 4.3Å; F179-I250 HydrophobicContact CZ-CG2 4.44Å; A210-I250 CarbonylContact C-O 3.51Å; A210-I250 WeakPolarHBondContact CA-O 3.35Å; L211-I250 PolarHBondContact N-O 3.44Å; H212-I250 HydrophobicContact CB-CB 4.29Å; H212-I250 HydrophobicContact CB-CD1 4.24Å; H212-I250 HydrophobicContact CB-CG1 4.48Å; H212-I250 PolarHBondContact N-O 3.15Å; H212-I250 PolarHBondContact O-N 3.47Å; L248-I250 HydrophobicContact CD2-CD1 4.48Å; L248-I250 HydrophobicContact CG-CG1 4.41Å
251	I	96.9	Very high	92.4	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.7	-177.6	-52.9	-179.8	0	0	0	109.1	H177 L178 I180 I206 I249 M259	H177-I251 CarbonylContact C-O 3.56Å; H177-I251 WeakPolarHBondContact CA-O 3.49Å; L178-I251 PolarHBondContact N-O 3.2Å; L178-I251 PolarHBondContact O-N 3.27Å; I180-I251 HydrophobicContact CD1-CD1 3.56Å; I180-I251 HydrophobicContact CD1-CG1 4.33Å; I206-I251 HydrophobicContact CG2-CD1 3.34Å; I206-I251 HydrophobicContact CG2-CG1 4.46Å; I249-I251 HydrophobicContact CG2-CG1 4.23Å; I251-M259 HydrophobicContact CD1-SD 3.4Å; I251-M259 WeakPolarHBondContact CD1-SD 3.45Å
252	P	96.2	Very high	93.8	Very high	13 Å²	13	43 Å²	43	8%	0.084	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	141.9	173.3	34.4	-32.9	0	0	0	109.3	T176 L211 D254 R255 F256	T176-P252 WeakPolarHBondContact O-CA 3.42Å; L211-P252 HydrophobicContact CB-CG 4.25Å; P252-D254 VanDerWaalsContact CB-OD1 3.22Å; P252-D254 WeakPolarHBondContact CB-OD1 3.41Å; P252-D254 VanDerWaalsContact CG-OD1 3.3Å; P252-D254 WeakPolarHBondContact CG-OD1 3.36Å; P252-D254 PolarHBondContact O-N 3.15Å; P252-D254 VanDerWaalsContact O-N 3.14Å; P252-R255 HydrophobicContact CG-CB 4.16Å; P252-R255 HydrophobicContact CG-CG 3.9Å; P252-R255 PolarHBondContact O-N 3.04Å; P252-F256 PolarHBondContact O-N 3.46Å
253	M	95	Very high	94.4	Very high	48 Å²	48	36.2 Å²	36.2	24%	0.236	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-22.2	-171.9	-79	-61.5	-56.1	0	0	114.3	F168 P175 T176 L178 R255 F256	F168-M253 HydrophobicContact CD2-CE 4.39Å; F168-M253 HydrophobicContact CE2-CE 4.38Å; P175-M253 HydrophobicContact CB-CG 3.8Å; P175-M253 HydrophobicContact CB-SD 4.11Å; P175-M253 HydrophobicContact CG-CE 3.88Å; P175-M253 HydrophobicContact CG-CG 3.77Å; P175-M253 HydrophobicContact CG-SD 3.73Å; P175-M253 VanDerWaalsContact O-CG 3.26Å; P175-M253 WeakPolarHBondContact O-CG 3.26Å; T176-M253 PolarHBondContact O-N 2.84Å; L178-M253 HydrophobicContact CD1-SD 3.74Å; L178-M253 HydrophobicContact CD2-SD 4.05Å; L178-M253 HydrophobicContact CG-SD 3.63Å; M253-R255 PolarHBondContact O-N 2.87Å; M253-F256 HydrophobicContact CE-CB 4.1Å; M253-F256 HydrophobicContact CE-CD1 3.82Å; M253-F256 HydrophobicContact CE-CG 4.13Å; M253-F256 WeakPolarHBondContact O-CB 3.5Å; M253-F256 PolarHBondContact O-N 2.71Å; M253-F256 HydrophobicContact SD-CB 4.14Å; M253-F256 HydrophobicContact SD-CD1 4.4Å; M253-F256 HydrophobicContact SD-CG 4.21Å
254	D	94.9	Very high	94.4	Very high	126 Å²	126	37.1 Å²	37.1	67%	0.674	20%	0.2	S	C	*	.	H	α-helix	trans	-67	-23.3	173.5	64.7	-17.8	0	0	0	113.1	P252	P252-D254 VanDerWaalsContact CB-OD1 3.22Å; P252-D254 WeakPolarHBondContact CB-OD1 3.41Å; P252-D254 VanDerWaalsContact CG-OD1 3.3Å; P252-D254 WeakPolarHBondContact CG-OD1 3.36Å; P252-D254 PolarHBondContact O-N 3.15Å; P252-D254 VanDerWaalsContact O-N 3.14Å
255	R	95.9	Very high	94.5	Very high	99 Å²	99	38.4 Å²	38.4	37%	0.374	21%	0.213	S	C	.	.	H	α-helix	trans	-96.5	-7.5	174.9	-64.9	-176.5	-177.7	-170	-2.8	114	H209 A210 P252 M253 H257 D258 M259	H209-R255 WeakPolarHBondContact O-CD 3.48Å; H209-R255 PolarHBondContact O-NH1 2.8Å; A210-R255 PolarHBondContact O-NH1 3.45Å; P252-R255 HydrophobicContact CG-CB 4.16Å; P252-R255 HydrophobicContact CG-CG 3.9Å; P252-R255 PolarHBondContact O-N 3.04Å; M253-R255 PolarHBondContact O-N 2.87Å; R255-H257 VanDerWaalsContact C-N 3.3Å; R255-H257 PolarHBondContact O-N 2.67Å; R255-D258 PolarHBondContact O-N 3.28Å; R255-M259 PolarHBondContact O-N 3.23Å
256	F	94.7	Very high	94.3	Very high	5 Å²	5	42.4 Å²	42.4	2%	0.022	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-38	-175.7	-171.3	-119.1	0	0	0	112	L164 P165 L178 P252 M253 M259 L260	L164-F256 HydrophobicContact CB-CE1 4.25Å; L164-F256 HydrophobicContact CB-CZ 4.22Å; L164-F256 HydrophobicContact CD1-CZ 4.03Å; P165-F256 HydrophobicContact CG-CD1 4.22Å; P165-F256 HydrophobicContact CG-CE1 3.81Å; L178-F256 HydrophobicContact CD1-CD2 3.61Å; L178-F256 HydrophobicContact CD1-CE2 3.43Å; L178-F256 VanDerWaalsContact CD1-CE2 3.43Å; L178-F256 HydrophobicContact CD1-CG 4.26Å; L178-F256 HydrophobicContact CD1-CZ 3.96Å; P252-F256 PolarHBondContact O-N 3.46Å; M253-F256 HydrophobicContact CE-CB 4.1Å; M253-F256 HydrophobicContact CE-CD1 3.82Å; M253-F256 HydrophobicContact CE-CG 4.13Å; M253-F256 WeakPolarHBondContact O-CB 3.5Å; M253-F256 PolarHBondContact O-N 2.71Å; M253-F256 HydrophobicContact SD-CB 4.14Å; M253-F256 HydrophobicContact SD-CD1 4.4Å; M253-F256 HydrophobicContact SD-CG 4.21Å; F256-M259 HydrophobicContact CD2-CE 3.46Å; F256-M259 VanDerWaalsContact CD2-CE 3.46Å; F256-M259 HydrophobicContact CD2-SD 4.1Å; F256-M259 HydrophobicContact CE2-CE 3.24Å; F256-M259 HydrophobicContact CE2-SD 4.24Å; F256-M259 HydrophobicContact CG-CE 4.48Å; F256-M259 HydrophobicContact CZ-CE 4.13Å; F256-M259 WeakPolarHBondContact O-CB 3.41Å; F256-M259 PolarHBondContact O-N 2.9Å; F256-L260 HydrophobicContact CD1-CD1 4.04Å; F256-L260 HydrophobicContact CE1-CD1 3.77Å; F256-L260 HydrophobicContact CE1-CG 4.3Å; F256-L260 HydrophobicContact CZ-CD1 4.24Å; F256-L260 HydrophobicContact CZ-CD2 4.26Å; F256-L260 HydrophobicContact CZ-CG 4.35Å; F256-L260 WeakPolarHBondContact O-CG 3.5Å; F256-L260 PolarHBondContact O-N 3.34Å
257	H	93.7	Very high	93.8	Very high	132 Å²	132	47.6 Å²	47.6	61%	0.611	26%	0.263	S	S	*	.	H	α-helix	trans	-64.6	-41	176.1	-176.8	64.2	0	0	0	112.9	R255 M259 L260 T261	R255-H257 VanDerWaalsContact C-N 3.3Å; R255-H257 PolarHBondContact O-N 2.67Å; H257-M259 VanDerWaalsContact C-N 3.32Å; H257-L260 PolarHBondContact O-N 3.43Å; H257-T261 PolarHBondContact O-N 2.92Å; H257-T261 PolarHBondContact O-OG1 3.33Å
258	D	95	Very high	93.7	Very high	89 Å²	89	50 Å²	50	48%	0.476	28%	0.276	S	S	.	.	H	α-helix	trans	-65.9	-38.7	177.3	-64.3	-21.1	0	0	0	110.9	R255 T261 S262	R255-D258 PolarHBondContact O-N 3.28Å; D258-T261 PolarHBondContact O-N 3.2Å; D258-S262 WeakPolarHBondContact O-CB 3.24Å; D258-S262 PolarHBondContact O-N 3Å
259	M	94.6	Very high	93.5	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.02	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-47.9	174.6	-177.1	-151.5	74.1	0	0	111.5	I206 H209 I251 R255 F256 H257 T261 S262 L263	I206-M259 HydrophobicContact CB-CG 4.42Å; I206-M259 HydrophobicContact CB-SD 4.38Å; I206-M259 HydrophobicContact CG1-CG 4.04Å; I206-M259 HydrophobicContact CG1-SD 3.93Å; I206-M259 HydrophobicContact CG2-CG 4.43Å; I206-M259 HydrophobicContact CG2-SD 3.9Å; H209-M259 HydrophobicContact CB-CB 4.06Å; H209-M259 HydrophobicContact CB-CG 4.43Å; I251-M259 HydrophobicContact CD1-SD 3.4Å; I251-M259 WeakPolarHBondContact CD1-SD 3.45Å; R255-M259 PolarHBondContact O-N 3.23Å; F256-M259 HydrophobicContact CD2-CE 3.46Å; F256-M259 VanDerWaalsContact CD2-CE 3.46Å; F256-M259 HydrophobicContact CD2-SD 4.1Å; F256-M259 HydrophobicContact CE2-CE 3.24Å; F256-M259 HydrophobicContact CE2-SD 4.24Å; F256-M259 HydrophobicContact CG-CE 4.48Å; F256-M259 HydrophobicContact CZ-CE 4.13Å; F256-M259 WeakPolarHBondContact O-CB 3.41Å; F256-M259 PolarHBondContact O-N 2.9Å; H257-M259 VanDerWaalsContact C-N 3.32Å; M259-T261 VanDerWaalsContact C-N 3.3Å; M259-T261 PolarHBondContact O-N 2.75Å; M259-S262 WeakPolarHBondContact O-CB 3.42Å; M259-S262 PolarHBondContact O-N 3.33Å; M259-L263 HydrophobicContact CE-CD1 4.16Å; M259-L263 PolarHBondContact O-N 2.87Å
260	L	93.8	Very high	93.3	Very high	25 Å²	25	55.6 Å²	55.6	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-40	176.2	-69.2	176.5	0	0	0	111.8	V161 P165 F256 H257 S262 L263 A264	V161-L260 HydrophobicContact CB-CD2 4.23Å; V161-L260 HydrophobicContact CG2-CD2 3.65Å; P165-L260 HydrophobicContact CG-CD1 3.62Å; F256-L260 HydrophobicContact CD1-CD1 4.04Å; F256-L260 HydrophobicContact CE1-CD1 3.77Å; F256-L260 HydrophobicContact CE1-CG 4.3Å; F256-L260 HydrophobicContact CZ-CD1 4.24Å; F256-L260 HydrophobicContact CZ-CD2 4.26Å; F256-L260 HydrophobicContact CZ-CG 4.35Å; F256-L260 WeakPolarHBondContact O-CG 3.5Å; F256-L260 PolarHBondContact O-N 3.34Å; H257-L260 PolarHBondContact O-N 3.43Å; L260-S262 VanDerWaalsContact C-N 3.35Å; L260-L263 PolarHBondContact O-N 2.86Å; L260-A264 WeakPolarHBondContact O-CB 3.42Å; L260-A264 PolarHBondContact O-N 3.28Å
261	T	93	Very high	93	Very high	75 Å²	75	58.8 Å²	58.8	46%	0.46	33%	0.325	S	S	.	.	H	α-helix	trans	-65.4	-39.7	176.4	-56.6	0	0	0	0	111.4	H257 D258 M259 S265	H257-T261 PolarHBondContact O-N 2.92Å; H257-T261 PolarHBondContact O-OG1 3.33Å; D258-T261 PolarHBondContact O-N 3.2Å; M259-T261 VanDerWaalsContact C-N 3.3Å; M259-T261 PolarHBondContact O-N 2.75Å; T261-S265 PolarHBondContact O-N 3.31Å; T261-S265 VanDerWaalsContact O-N 3.16Å
262	S	92.3	Very high	92.8	Very high	27 Å²	27	62.4 Å²	62.4	19%	0.189	35%	0.345	C	S	.	.	H	α-helix	trans	-61.9	-48.2	174.9	-170.6	0	0	0	0	111.2	D258 M259 L260 A264 S265 H266	D258-S262 WeakPolarHBondContact O-CB 3.24Å; D258-S262 PolarHBondContact O-N 3Å; M259-S262 WeakPolarHBondContact O-CB 3.42Å; M259-S262 PolarHBondContact O-N 3.33Å; L260-S262 VanDerWaalsContact C-N 3.35Å; S262-A264 PolarHBondContact O-N 3.21Å; S262-S265 PolarHBondContact O-N 3.21Å; S262-S265 PolarHBondContact O-OG 3.37Å; S262-H266 PolarHBondContact O-ND1 3.35Å
263	L	91.5	Very high	92.5	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-57.7	-50.9	176.3	-75.7	167.7	0	0	0	111.8	A158 V161 E202 F205 I206 M259 L260 S265 H266 V267	A158-L263 HydrophobicContact CB-CB 4.5Å; V161-L263 HydrophobicContact CG2-CD1 4.35Å; E202-L263 HydrophobicContact CB-CD2 3.64Å; F205-L263 HydrophobicContact CB-CD2 3.83Å; F205-L263 HydrophobicContact CB-CG 4.38Å; F205-L263 HydrophobicContact CD2-CD2 3.94Å; F205-L263 HydrophobicContact CG-CD2 4.35Å; I206-L263 HydrophobicContact CD1-CD1 4.34Å; I206-L263 HydrophobicContact CG1-CD1 4.11Å; I206-L263 HydrophobicContact CG1-CD2 4.38Å; M259-L263 HydrophobicContact CE-CD1 4.16Å; M259-L263 PolarHBondContact O-N 2.87Å; L260-L263 PolarHBondContact O-N 2.86Å; L263-S265 PolarHBondContact O-N 3.33Å; L263-S265 VanDerWaalsContact O-N 3.14Å; L263-H266 PolarHBondContact O-N 3.41Å; L263-V267 PolarHBondContact O-N 2.97Å
264	A	90	Very high	92.4	Very high	64 Å²	64	67 Å²	67	53%	0.529	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-25.2	-179.4	0	0	0	0	0	113.7	L260 S262 H266	L260-A264 WeakPolarHBondContact O-CB 3.42Å; L260-A264 PolarHBondContact O-N 3.28Å; S262-A264 PolarHBondContact O-N 3.21Å; A264-H266 VanDerWaalsContact C-N 3.32Å
265	S	91.3	Very high	92.2	Very high	83 Å²	83	62.5 Å²	62.5	58%	0.58	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-12.8	177.3	72.8	0	0	0	0	114.8	T261 S262 L263	T261-S265 PolarHBondContact O-N 3.31Å; T261-S265 VanDerWaalsContact O-N 3.16Å; S262-S265 PolarHBondContact O-N 3.21Å; S262-S265 PolarHBondContact O-OG 3.37Å; L263-S265 PolarHBondContact O-N 3.33Å; L263-S265 VanDerWaalsContact O-N 3.14Å
266	H	88.4	Confident	91.9	Very high	95 Å²	95	59.4 Å²	59.4	44%	0.44	35%	0.345	S	S	.	.			trans	-107.3	-0.5	179.9	-65.5	88.4	0	0	0	113.3	L154 F205 S262 L263 A264	L154-H266 HydrophobicContact CD2-CB 4.24Å; F205-H266 AromaticContact CD1-CD2 3.98Å; F205-H266 AromaticContact CD1-CE1 3.74Å; F205-H266 AromaticContact CD1-CG 3.86Å; F205-H266 AromaticContact CD1-ND1 3.69Å; F205-H266 AromaticContact CD1-NE2 3.93Å; F205-H266 HydrophobicContact CD2-CB 4.42Å; F205-H266 HydrophobicContact CE1-CB 4.15Å; F205-H266 AromaticContact CE1-CD2 3.33Å; F205-H266 WeakPolarHBondContact CE1-CD2 3.37Å; F205-H266 AromaticContact CE1-CE1 3.86Å; F205-H266 AromaticContact CE1-CG 3.51Å; F205-H266 AromaticContact CE1-ND1 3.83Å; F205-H266 AromaticContact CE1-NE2 3.58Å; F205-H266 HydrophobicContact CE2-CB 4Å; F205-H266 HydrophobicContact CZ-CB 3.85Å; F205-H266 AromaticContact CZ-CD2 3.74Å; F205-H266 AromaticContact CZ-CG 3.74Å; S262-H266 PolarHBondContact O-ND1 3.35Å; L263-H266 PolarHBondContact O-N 3.41Å; A264-H266 VanDerWaalsContact C-N 3.32Å
267	V	84	Confident	91.6	Very high	109 Å²	109	64.4 Å²	64.4	66%	0.661	38%	0.375	S	S	*	.			trans	-79.9	0	169.1	174.6	0	0	0	0	109.8	L154 S155 A158 L263	L154-V267 HydrophobicContact CG-CG2 4.13Å; S155-V267 VanDerWaalsContact CA-CG1 3.41Å; A158-V267 HydrophobicContact CB-CG2 3.62Å; L263-V267 PolarHBondContact O-N 2.97Å

Retrieved 267 of 267 residues in 658.8 ms (Link to these results)

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