A0AA82N800_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N800, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 363 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	39.2	Very low	45.5	Very low	236 Å²	236	150.6 Å²	150.6	100%	1.163	71%	0.714	S	S	*	*				0	86.6	0	-158.2	178.2	-164.8	0	0	107.9	R3	M1-R3 PolarHBondContact O-N 3.37Å; M1-R3 VanDerWaalsContact O-N 3.17Å
2	M	38.4	Very low	46.3	Very low	178 Å²	178	146.7 Å²	146.7	88%	0.877	70%	0.698	S	S	*	*			trans	-73.8	105.2	179.4	-99	175.5	166.6	0	0	108.7	Y4	M2-Y4 PolarHBondContact O-N 3.35Å
3	R	38.4	Very low	46.6	Very low	217 Å²	217	142.7 Å²	142.7	82%	0.819	68%	0.683	S	S	*	*			trans	-71.8	104.6	167.9	-83.1	-179.9	169	175.1	-3.1	107.7	M1 N5	M1-R3 PolarHBondContact O-N 3.37Å; M1-R3 VanDerWaalsContact O-N 3.17Å; R3-N5 PolarHBondContact O-N 3.27Å
4	Y	44.4	Very low	47.1	Very low	188 Å²	188	137.1 Å²	137.1	74%	0.737	66%	0.662	S	S	*	*			trans	-67.2	100.2	167.2	-89.9	-93.2	0	0	0	108.5	M2 F6	M2-Y4 PolarHBondContact O-N 3.35Å; Y4-F6 PolarHBondContact O-N 3.39Å; Y4-F6 VanDerWaalsContact O-N 3.12Å
5	N	42.9	Very low	47.5	Very low	143 Å²	143	139.9 Å²	139.9	77%	0.765	67%	0.665	S	S	*	*			trans	-74.4	95.8	167.7	-72.4	-28.2	0	0	0	107.7	R3 L7	R3-N5 PolarHBondContact O-N 3.27Å; N5-L7 PolarHBondContact O-N 3.35Å
6	F	42.1	Very low	47.9	Very low	147 Å²	147	133.8 Å²	133.8	65%	0.645	64%	0.639	S	S	*	*			trans	-64.6	118.2	171	-79.4	-89.4	0	0	0	109.1	Y4 L10	Y4-F6 PolarHBondContact O-N 3.39Å; Y4-F6 VanDerWaalsContact O-N 3.12Å; F6-L10 HydrophobicContact CD1-CD1 4.45Å
7	L	48.2	Very low	48.3	Very low	115 Å²	115	131.8 Å²	131.8	60%	0.602	63%	0.632	S	S	*	*			trans	-64.4	140.8	178.6	-83.8	101	0	0	0	110.9	N5 S9 L10	N5-L7 PolarHBondContact O-N 3.35Å; L7-S9 PolarHBondContact O-N 3.44Å; L7-L10 PolarHBondContact O-N 3.13Å; L7-L10 VanDerWaalsContact O-N 3.1Å
8	P	56.1	Low	48.4	Very low	99 Å²	99	132.7 Å²	132.7	64%	0.643	63%	0.633	S	S	*	*	H	α-helix	trans	-53.3	-25.7	179.2	-26.5	32.9	0	0	0	114.9	L10 W11 I12	P8-L10 VanDerWaalsContact C-N 3.28Å; P8-L10 PolarHBondContact O-N 3.11Å; P8-W11 PolarHBondContact O-N 2.93Å; P8-I12 PolarHBondContact O-N 3.47Å
9	S	51.3	Low	48.6	Very low	65 Å²	65	127.8 Å²	127.8	46%	0.455	62%	0.617	S	S	.	*	H	α-helix	trans	-63	-30.2	179.4	55.9	0	0	0	0	113.7	L7 I12 L13	L7-S9 PolarHBondContact O-N 3.44Å; S9-I12 PolarHBondContact O-N 3.35Å; S9-L13 PolarHBondContact O-N 3.4Å
10	L	48.8	Very low	48.3	Very low	90 Å²	90	128.4 Å²	128.4	47%	0.471	61%	0.612	S	S	.	*	H	α-helix	trans	-68.6	-34.8	175.9	-91.3	145.8	0	0	0	111.9	F6 L7 P8 I12 L13 V14	F6-L10 HydrophobicContact CD1-CD1 4.45Å; L7-L10 PolarHBondContact O-N 3.13Å; L7-L10 VanDerWaalsContact O-N 3.1Å; P8-L10 VanDerWaalsContact C-N 3.28Å; P8-L10 PolarHBondContact O-N 3.11Å; L10-I12 VanDerWaalsContact C-N 3.33Å; L10-I12 PolarHBondContact O-N 3.3Å; L10-L13 PolarHBondContact O-N 2.94Å; L10-V14 VanDerWaalsContact O-CG2 3.29Å; L10-V14 WeakPolarHBondContact O-CG2 3.41Å; L10-V14 PolarHBondContact O-N 3.17Å
11	W	51	Low	48.1	Very low	179 Å²	179	124.6 Å²	124.6	68%	0.678	60%	0.598	S	S	*	*	H	α-helix	trans	-66.7	-35	176.6	-71.8	94.2	0	0	0	112.3	P8 V14 Y15	P8-W11 PolarHBondContact O-N 2.93Å; W11-V14 PolarHBondContact O-N 3.2Å; W11-Y15 WeakPolarHBondContact O-CB 3.41Å; W11-Y15 PolarHBondContact O-N 2.91Å
12	I	55.1	Low	48.5	Very low	103 Å²	103	119.8 Å²	119.8	53%	0.528	57%	0.568	S	S	.	*	H	α-helix	trans	-66.7	-43.2	176.8	-59.8	172.1	0	0	0	110.4	P8 S9 L10 Y15 V16	P8-I12 PolarHBondContact O-N 3.47Å; S9-I12 PolarHBondContact O-N 3.35Å; L10-I12 VanDerWaalsContact C-N 3.33Å; L10-I12 PolarHBondContact O-N 3.3Å; I12-Y15 PolarHBondContact O-N 3.33Å; I12-V16 WeakPolarHBondContact O-CG2 3.5Å; I12-V16 PolarHBondContact O-N 3.1Å
13	L	50.4	Low	49	Very low	95 Å²	95	119.4 Å²	119.4	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-62.1	-43.8	176.6	-113.1	158.4	0	0	0	111.6	S9 L10 V16 I17	S9-L13 PolarHBondContact O-N 3.4Å; L10-L13 PolarHBondContact O-N 2.94Å; L13-V16 PolarHBondContact O-N 3.17Å; L13-I17 HydrophobicContact CD2-CD1 3.91Å; L13-I17 HydrophobicContact CD2-CG1 4.48Å; L13-I17 WeakPolarHBondContact O-CB 3.37Å; L13-I17 WeakPolarHBondContact O-CD1 3.3Å; L13-I17 WeakPolarHBondContact O-CG1 3.34Å; L13-I17 PolarHBondContact O-N 3.47Å
14	V	52.8	Low	49.3	Very low	64 Å²	64	116.5 Å²	116.5	39%	0.388	55%	0.551	S	S	.	*	H	α-helix	trans	-60	-46.5	173	170.6	0	0	0	0	110.2	L10 W11 V16 I17 F18	L10-V14 VanDerWaalsContact O-CG2 3.29Å; L10-V14 WeakPolarHBondContact O-CG2 3.41Å; L10-V14 PolarHBondContact O-N 3.17Å; W11-V14 PolarHBondContact O-N 3.2Å; V14-V16 VanDerWaalsContact C-N 3.34Å; V14-V16 PolarHBondContact O-N 3.29Å; V14-I17 PolarHBondContact O-N 2.96Å; V14-F18 HydrophobicContact CB-CD2 4.43Å; V14-F18 HydrophobicContact CG1-CD2 3.55Å; V14-F18 HydrophobicContact CG1-CE2 3.81Å; V14-F18 WeakPolarHBondContact O-CD2 3.29Å; V14-F18 PolarHBondContact O-N 2.9Å
15	Y	53.5	Low	49.1	Very low	179 Å²	179	114.4 Å²	114.4	70%	0.702	55%	0.546	S	S	*	.	H	α-helix	trans	-61.8	-40.3	179.4	-143.3	-88.7	0	0	0	112.4	W11 I12 A19	W11-Y15 WeakPolarHBondContact O-CB 3.41Å; W11-Y15 PolarHBondContact O-N 2.91Å; I12-Y15 PolarHBondContact O-N 3.33Å; Y15-A19 HydrophobicContact CD1-CB 3.93Å; Y15-A19 HydrophobicContact CE1-CB 4.04Å; Y15-A19 WeakPolarHBondContact O-CA 3.44Å; Y15-A19 WeakPolarHBondContact O-CB 3.43Å; Y15-A19 PolarHBondContact O-N 3.42Å
16	V	54.7	Low	49.3	Very low	42 Å²	42	111.5 Å²	111.5	26%	0.255	53%	0.53	S	S	.	.	H	α-helix	trans	-67	-44	175.7	174.5	0	0	0	0	111.1	I12 L13 V14 F18 W20	I12-V16 WeakPolarHBondContact O-CG2 3.5Å; I12-V16 PolarHBondContact O-N 3.1Å; L13-V16 PolarHBondContact O-N 3.17Å; V14-V16 VanDerWaalsContact C-N 3.34Å; V14-V16 PolarHBondContact O-N 3.29Å; V16-F18 PolarHBondContact O-N 3.25Å; V16-W20 HydrophobicContact CG1-CE3 4.11Å; V16-W20 WeakPolarHBondContact O-CB 3.42Å; V16-W20 PolarHBondContact O-N 3.29Å
17	I	53.9	Low	49.8	Very low	101 Å²	101	106 Å²	106	52%	0.518	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-36.6	-179.2	-68.8	166.4	0	0	0	111.8	L13 V14 P21	L13-I17 HydrophobicContact CD2-CD1 3.91Å; L13-I17 HydrophobicContact CD2-CG1 4.48Å; L13-I17 WeakPolarHBondContact O-CB 3.37Å; L13-I17 WeakPolarHBondContact O-CD1 3.3Å; L13-I17 WeakPolarHBondContact O-CG1 3.34Å; L13-I17 PolarHBondContact O-N 3.47Å; V14-I17 PolarHBondContact O-N 2.96Å; I17-P21 WeakPolarHBondContact O-CD 3.22Å; I17-P21 WeakPolarHBondContact O-CG 3.42Å
18	F	49.4	Very low	49.9	Very low	147 Å²	147	103.9 Å²	103.9	65%	0.645	50%	0.499	S	S	*	.	H	α-helix	trans	-92.6	-40.6	-177.5	-73.1	-76.4	0	0	0	113.5	V14 V16 Y22	V14-F18 HydrophobicContact CB-CD2 4.43Å; V14-F18 HydrophobicContact CG1-CD2 3.55Å; V14-F18 HydrophobicContact CG1-CE2 3.81Å; V14-F18 WeakPolarHBondContact O-CD2 3.29Å; V14-F18 PolarHBondContact O-N 2.9Å; V16-F18 PolarHBondContact O-N 3.25Å; F18-Y22 WeakPolarHBondContact O-CB 3.32Å; F18-Y22 PolarHBondContact O-N 3.28Å
19	A	52.3	Low	49.9	Very low	41 Å²	41	104.3 Å²	104.3	34%	0.339	50%	0.496	S	S	.	.	H	α-helix	trans	-77.3	-32.9	-176.7	0	0	0	0	0	112.9	Y15 Y22 K23	Y15-A19 HydrophobicContact CD1-CB 3.93Å; Y15-A19 HydrophobicContact CE1-CB 4.04Å; Y15-A19 WeakPolarHBondContact O-CA 3.44Å; Y15-A19 WeakPolarHBondContact O-CB 3.43Å; Y15-A19 PolarHBondContact O-N 3.42Å; A19-Y22 PolarHBondContact O-N 2.89Å; A19-K23 PolarHBondContact O-N 2.92Å
20	W	43.8	Very low	50.1	Low	138 Å²	138	103.2 Å²	103.2	52%	0.523	49%	0.485	S	S	.	.	H	α-helix	trans	-63.1	-53	179.9	-167	-49.5	0	0	0	112.9	V16 Y22 K23 R24	V16-W20 HydrophobicContact CG1-CE3 4.11Å; V16-W20 WeakPolarHBondContact O-CB 3.42Å; V16-W20 PolarHBondContact O-N 3.29Å; W20-Y22 VanDerWaalsContact C-N 3.27Å; W20-Y22 PolarHBondContact O-N 3.39Å; W20-K23 PolarHBondContact O-N 3.12Å; W20-R24 PolarHBondContact O-N 2.93Å
21	P	42.8	Very low	50.7	Low	49 Å²	49	101 Å²	101	32%	0.318	48%	0.476	S	S	.	.	H	α-helix	trans	-63.4	-35.7	176.7	23.3	-31.7	0	0	0	111.3	I17 K23 R24 F25	I17-P21 WeakPolarHBondContact O-CD 3.22Å; I17-P21 WeakPolarHBondContact O-CG 3.42Å; P21-K23 PolarHBondContact O-N 3.04Å; P21-R24 CarbonylContact O-C 3.55Å; P21-R24 WeakPolarHBondContact O-CA 3.47Å; P21-R24 WeakPolarHBondContact O-CB 3.2Å; P21-R24 PolarHBondContact O-N 2.98Å; P21-F25 HydrophobicContact CB-CD2 4.37Å; P21-F25 HydrophobicContact CB-CE2 4.3Å; P21-F25 WeakPolarHBondContact O-CD2 3.29Å; P21-F25 PolarHBondContact O-N 3.16Å
22	Y	47.9	Very low	51.4	Low	136 Å²	136	100.4 Å²	100.4	53%	0.533	48%	0.478	S	S	.	.	H	α-helix	trans	-60.5	-44.5	179.4	-153.5	-91.9	0	0	0	112.3	F18 A19 W20 R24 F25 N26 N227	F18-Y22 WeakPolarHBondContact O-CB 3.32Å; F18-Y22 PolarHBondContact O-N 3.28Å; A19-Y22 PolarHBondContact O-N 2.89Å; W20-Y22 VanDerWaalsContact C-N 3.27Å; W20-Y22 PolarHBondContact O-N 3.39Å; Y22-R24 VanDerWaalsContact C-N 3.27Å; Y22-R24 PolarHBondContact O-N 3.43Å; Y22-F25 PolarHBondContact O-N 3.44Å; Y22-N26 PolarHBondContact O-N 3.21Å; Y22-N227 PolarHBondContact OH-ND2 3.27Å
23	K	48.6	Very low	51.8	Low	170 Å²	170	98 Å²	98	74%	0.739	47%	0.466	S	S	*	.	H	α-helix	trans	-63.7	-32.3	173.7	-165.5	170.3	-176	171.6	0	112.5	A19 W20 P21	A19-K23 PolarHBondContact O-N 2.92Å; W20-K23 PolarHBondContact O-N 3.12Å; P21-K23 PolarHBondContact O-N 3.04Å
24	R	45.5	Very low	52.9	Low	155 Å²	155	96.3 Å²	96.3	59%	0.585	46%	0.461	S	S	*	.	H	α-helix	trans	-72.8	-34.1	176.8	-165.5	176.1	-173.7	170.7	1.7	112.8	W20 P21 Y22	W20-R24 PolarHBondContact O-N 2.93Å; P21-R24 CarbonylContact O-C 3.55Å; P21-R24 WeakPolarHBondContact O-CA 3.47Å; P21-R24 WeakPolarHBondContact O-CB 3.2Å; P21-R24 PolarHBondContact O-N 2.98Å; Y22-R24 VanDerWaalsContact C-N 3.27Å; Y22-R24 PolarHBondContact O-N 3.43Å
25	F	40	Very low	54.6	Low	144 Å²	144	96.7 Å²	96.7	63%	0.632	46%	0.459	S	S	*	.	H	α-helix	trans	-71.3	-38.4	177.4	-83	-73.3	0	0	0	112.3	P21 Y22 C27 N28	P21-F25 HydrophobicContact CB-CD2 4.37Å; P21-F25 HydrophobicContact CB-CE2 4.3Å; P21-F25 WeakPolarHBondContact O-CD2 3.29Å; P21-F25 PolarHBondContact O-N 3.16Å; Y22-F25 PolarHBondContact O-N 3.44Å; F25-C27 PolarHBondContact O-N 3.34Å; F25-N28 VanDerWaalsContact O-CB 3.31Å; F25-N28 WeakPolarHBondContact O-CB 3.4Å; F25-N28 PolarHBondContact O-N 2.93Å
26	N	47.9	Very low	56.4	Low	83 Å²	83	91.3 Å²	91.3	44%	0.444	44%	0.441	S	S	.	.	H	α-helix	trans	-61.5	-31	176.3	-82.9	-5.4	0	0	0	113.3	Y22 N28 D29 I30	Y22-N26 PolarHBondContact O-N 3.21Å; N26-N28 PolarHBondContact O-N 3.26Å; N26-N28 VanDerWaalsContact O-N 3.1Å; N26-D29 PolarHBondContact O-N 3.31Å; N26-I30 HydrophobicContact CB-CD1 4.3Å; N26-I30 WeakPolarHBondContact O-CD1 3.36Å; N26-I30 WeakPolarHBondContact O-CG1 3.17Å; N26-I30 PolarHBondContact O-N 2.96Å
27	C	52.1	Low	58.2	Low	31 Å²	31	91 Å²	91	21%	0.209	44%	0.44	C	S	.	.	H	α-helix	trans	-56.1	-29.1	174.5	-78.7	0	0	0	0	112.4	F25 I30 C31	F25-C27 PolarHBondContact O-N 3.34Å; C27-I30 PolarHBondContact O-N 3.27Å; C27-C31 PolarHBondContact O-N 3.35Å; C27-C31 VanDerWaalsContact O-N 3.07Å; C27-C31 PolarHBondContact O-SG 3.46Å
28	N	50.5	Low	60	Low	70 Å²	70	86.2 Å²	86.2	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-68	-41.8	-172.7	-119.6	17	0	0	0	113.7	F25 N26 K193	F25-N28 VanDerWaalsContact O-CB 3.31Å; F25-N28 WeakPolarHBondContact O-CB 3.4Å; F25-N28 PolarHBondContact O-N 2.93Å; N26-N28 PolarHBondContact O-N 3.26Å; N26-N28 VanDerWaalsContact O-N 3.1Å; N28-K193 VanDerWaalsContact CG-NZ 3.34Å; N28-K193 PolarHBondContact ND2-NZ 3.15Å; N28-K193 WeakPolarHBondContact OD1-CE 3.39Å; N28-K193 PolarHBondContact OD1-NZ 2.83Å
29	D	56.5	Low	62.1	Low	109 Å²	109	81 Å²	81	58%	0.583	39%	0.394	S	S	*	.	H	α-helix	trans	-76.1	-34.3	176.7	-70.1	-30	0	0	0	111.1	N26 C31 K32 P34	N26-D29 PolarHBondContact O-N 3.31Å; D29-C31 VanDerWaalsContact C-N 3.35Å; D29-C31 PolarHBondContact O-N 3.02Å; D29-K32 WeakPolarHBondContact O-CB 3.36Å; D29-K32 PolarHBondContact O-N 3.49Å; D29-P34 WeakPolarHBondContact O-CD 3.17Å
30	I	55.3	Low	64.1	Low	42 Å²	42	82.4 Å²	82.4	22%	0.215	39%	0.393	C	S	.	.	H	α-helix	trans	-59.6	-41.4	177.6	-73.5	166.9	0	0	0	112.3	N26 C27 K32 N33 Y50	N26-I30 HydrophobicContact CB-CD1 4.3Å; N26-I30 WeakPolarHBondContact O-CD1 3.36Å; N26-I30 WeakPolarHBondContact O-CG1 3.17Å; N26-I30 PolarHBondContact O-N 2.96Å; C27-I30 PolarHBondContact O-N 3.27Å; I30-K32 PolarHBondContact O-N 3.34Å; I30-K32 VanDerWaalsContact O-N 3.13Å; I30-N33 PolarHBondContact O-N 3.06Å; I30-Y50 HydrophobicContact CB-CD2 4.2Å; I30-Y50 HydrophobicContact CB-CE2 4.29Å; I30-Y50 HydrophobicContact CD1-CD2 4.06Å; I30-Y50 HydrophobicContact CD1-CE2 3.64Å; I30-Y50 HydrophobicContact CG1-CD2 3.95Å; I30-Y50 HydrophobicContact CG1-CE2 4.03Å; I30-Y50 HydrophobicContact CG2-CD1 3.67Å; I30-Y50 HydrophobicContact CG2-CD2 3.27Å; I30-Y50 HydrophobicContact CG2-CE1 3.62Å; I30-Y50 HydrophobicContact CG2-CE2 3.34Å; I30-Y50 HydrophobicContact CG2-CG 3.44Å; I30-Y50 VanDerWaalsContact CG2-CG 3.44Å; I30-Y50 VanDerWaalsContact CG2-CZ 3.48Å
31	C	61.1	Low	66.5	Low	43 Å²	43	79.7 Å²	79.7	29%	0.291	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.1	-177	-57.2	0	0	0	0	113.5	C27 D29 N33 C192	C27-C31 PolarHBondContact O-N 3.35Å; C27-C31 VanDerWaalsContact O-N 3.07Å; C27-C31 PolarHBondContact O-SG 3.46Å; D29-C31 VanDerWaalsContact C-N 3.35Å; D29-C31 PolarHBondContact O-N 3.02Å; C31-N33 PolarHBondContact O-N 3.3Å; C31-C192 HydrophobicContact CB-CB 4.07Å; C31-C192 WeakPolarHBondContact CB-SG 3.4Å; C31-C192 WeakPolarHBondContact SG-CB 3.06Å; C31-C192 CovalentContact SG-SG 2.02Å; C31-C192 PolarHBondContact SG-SG 3.05Å
32	K	65.1	Low	68.9	Low	166 Å²	166	84.6 Å²	84.6	72%	0.722	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-0.6	171.8	-65.8	-178.6	179.1	172.6	0	113.1	D29 I30	D29-K32 WeakPolarHBondContact O-CB 3.36Å; D29-K32 PolarHBondContact O-N 3.49Å; I30-K32 PolarHBondContact O-N 3.34Å; I30-K32 VanDerWaalsContact O-N 3.13Å
33	N	64.7	Low	71.2	Confident	52 Å²	52	81 Å²	81	28%	0.278	40%	0.404	S	S	.	.			trans	50.4	54.6	-175.2	-168.3	12.3	0	0	0	112.9	I30 C31 E35 H199 E200	I30-N33 PolarHBondContact O-N 3.06Å; C31-N33 PolarHBondContact O-N 3.3Å; N33-E35 PolarHBondContact O-N 3.13Å; N33-E35 VanDerWaalsContact O-N 3.11Å; N33-H199 PolarHBondContact OD1-CD2 2.82Å; N33-H199 PolarHBondContact OD1-NE2 2.96Å; N33-E200 PolarHBondContact ND2-O 3.04Å
34	P	72.3	Confident	73.5	Confident	60 Å²	60	74.4 Å²	74.4	39%	0.39	38%	0.375	S	S	.	.			trans	-69.9	112.1	177.7	29.4	-32.1	0	0	0	109.4	D29	D29-P34 WeakPolarHBondContact O-CD 3.17Å
35	E	88.4	Confident	75.9	Confident	72 Å²	72	67.9 Å²	67.9	34%	0.336	35%	0.35	S	S	.	.			trans	-72.2	129.4	159.2	175.3	176.7	-162.2	0	0	108.8	N33 V37 R45 S47 H49	N33-E35 PolarHBondContact O-N 3.13Å; N33-E35 VanDerWaalsContact O-N 3.11Å; E35-V37 HydrophobicContact CG-CG2 4.16Å; E35-R45 IonicContact OE1-CZ 3.99Å; E35-R45 IonicContact OE1-NE 2.68Å; E35-R45 PolarHBondContact OE1-NE 3.44Å; E35-R45 IonicContact OE1-NH2 3.48Å; E35-R45 PolarHBondContact OE1-NH2 3.49Å; E35-R45 IonicContact OE2-NH2 3.5Å; E35-R45 PolarHBondContact OE2-NH2 3.1Å; E35-R45 VanDerWaalsContact OE2-NH2 3.08Å; E35-S47 WeakPolarHBondContact OE1-CB 3.01Å; E35-S47 PolarHBondContact OE1-OG 3.34Å; E35-S47 VanDerWaalsContact OE1-OG 3.08Å; E35-H49 WeakPolarHBondContact CG-CE1 2.95Å; E35-H49 IonicContact OE1-CE1 3.08Å; E35-H49 IonicContact OE1-NE2 3.83Å; E35-H49 IonicContact OE2-CE1 2.8Å
36	I	90.7	Very high	78.6	Confident	66 Å²	66	61.1 Å²	61.1	34%	0.338	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	105.6	173.7	-51.3	173.1	0	0	0	108.9	I38 S47 L48	I36-I38 HydrophobicContact CG2-CD1 4.09Å; I36-I38 PolarHBondContact O-N 3.31Å; I36-S47 CarbonylContact O-C 3.51Å; I36-S47 VanDerWaalsContact O-CA 3.24Å; I36-S47 WeakPolarHBondContact O-CA 3.39Å; I36-S47 WeakPolarHBondContact O-CB 3.43Å; I36-L48 PolarHBondContact N-O 3.22Å; I36-L48 PolarHBondContact O-N 2.88Å
37	V	93	Very high	80.9	Confident	36 Å²	36	57.1 Å²	57.1	22%	0.218	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	114.1	177.6	-176.6	0	0	0	0	109.9	E35 E40 R45 K247	E35-V37 HydrophobicContact CG-CG2 4.16Å; V37-E40 HydrophobicContact CG1-CB 3.79Å; V37-R45 HydrophobicContact CG1-CG 4.35Å; V37-K247 WeakPolarHBondContact O-CE 3.47Å; V37-K247 PolarHBondContact O-NZ 3.42Å; V37-K247 VanDerWaalsContact O-NZ 3.12Å
38	I	92.6	Very high	82.8	Confident	1 Å²	1	56 Å²	56	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-56	-179.6	-48.7	-60.6	0	0	0	109.5	I36 Y46 L48 K247 D266	I36-I38 HydrophobicContact CG2-CD1 4.09Å; I36-I38 PolarHBondContact O-N 3.31Å; I38-Y46 HydrophobicContact CB-CD1 3.96Å; I38-Y46 HydrophobicContact CG1-CD1 3.91Å; I38-Y46 HydrophobicContact CG1-CE1 4.27Å; I38-Y46 PolarHBondContact N-O 3Å; I38-L48 HydrophobicContact CD1-CD1 3.85Å; I38-L48 HydrophobicContact CD1-CG 3.98Å; I38-L48 HydrophobicContact CG1-CD1 4.24Å; I38-L48 HydrophobicContact CG1-CG 3.92Å; I38-K247 HydrophobicContact CG2-CB 4.48Å; I38-K247 WeakPolarHBondContact O-CD 3.47Å; I38-K247 PolarHBondContact O-NZ 2.86Å; I38-D266 WeakPolarHBondContact CG2-O 3.29Å
39	I	93	Very high	84.7	Confident	38 Å²	38	53.2 Å²	53.2	20%	0.195	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	140.5	178	-68.1	173.9	0	0	0	108.5	Y44 R45 Y46 D266 V269	I39-Y44 HydrophobicContact CG2-CD1 4.3Å; I39-R45 CarbonylContact O-C 3.56Å; I39-R45 VanDerWaalsContact O-CA 3.31Å; I39-R45 WeakPolarHBondContact O-CA 3.44Å; I39-Y46 PolarHBondContact N-O 3.49Å; I39-Y46 PolarHBondContact O-N 2.99Å; I39-D266 VanDerWaalsContact CD1-O 3.29Å; I39-D266 WeakPolarHBondContact CD1-O 3.35Å; I39-V269 HydrophobicContact CD1-CG2 3.98Å; I39-V269 HydrophobicContact CG1-CG2 3.59Å
40	E	94.4	Very high	86	Confident	69 Å²	69	50.9 Å²	50.9	32%	0.322	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	131.9	172.4	-177.6	162.8	-154.8	0	0	109.8	V37 Y44 R45 K206 W207	V37-E40 HydrophobicContact CG1-CB 3.79Å; E40-Y44 CarbonylContact C-O 3.54Å; E40-Y44 WeakPolarHBondContact CA-O 3.49Å; E40-R45 HydrophobicContact CB-CG 4.31Å; E40-R45 HydrophobicContact CG-CB 4.31Å; E40-R45 HydrophobicContact CG-CG 4.29Å; E40-R45 IonicContact OE1-CZ 3.63Å; E40-R45 IonicContact OE1-NH1 3.79Å; E40-R45 PolarHBondContact OE1-NH1 3.28Å; E40-R45 IonicContact OE2-CZ 3.54Å; E40-R45 IonicContact OE2-NH1 3.7Å; E40-R45 PolarHBondContact OE2-NH1 3.04Å; E40-K206 WeakPolarHBondContact OE1-CE 3.04Å; E40-K206 IonicContact OE1-NZ 3.46Å; E40-K206 PolarHBondContact OE1-NZ 2.83Å; E40-K206 IonicContact OE2-NZ 2.81Å; E40-W207 HydrophobicContact CG-CZ2 4.06Å; E40-W207 PolarHBondContact OE1-NE1 3.45Å
41	N	94	Very high	87.4	Confident	82 Å²	82	52.1 Å²	52.1	44%	0.439	26%	0.262	S	S	.	.			trans	-139	-164.2	166.8	65.1	34.6	0	0	0	108.5	T43 Y44 W207	N41-T43 VanDerWaalsContact C-N 3.28Å; N41-T43 PolarHBondContact O-N 3.04Å; N41-T43 PolarHBondContact OD1-N 3.19Å; N41-T43 PolarHBondContact OD1-OG1 3.47Å; N41-Y44 PolarHBondContact N-O 3.42Å; N41-Y44 WeakPolarHBondContact OD1-CA 3.04Å; N41-Y44 WeakPolarHBondContact OD1-CB 3.42Å; N41-Y44 PolarHBondContact OD1-N 3.29Å; N41-Y44 PolarHBondContact OD1-O 2.95Å; N41-W207 WeakPolarHBondContact O-CH2 3.44Å; N41-W207 WeakPolarHBondContact O-CZ2 3.46Å
42	D	93.9	Very high	89	Confident	151 Å²	151	50.1 Å²	50.1	81%	0.807	25%	0.248	S	C	*	.	S	Bend	trans	-72.1	-19.9	-176.6	-65.8	-31.2	0	0	0	114.5
43	T	96.1	Very high	90.4	Very high	60 Å²	60	42.5 Å²	42.5	37%	0.368	22%	0.216	S	C	.	.	S	Bend	trans	-120.8	-14.3	-171.8	67.2	0	0	0	0	113.9	N41 Q57 R58 Y59	N41-T43 VanDerWaalsContact C-N 3.28Å; N41-T43 PolarHBondContact O-N 3.04Å; N41-T43 PolarHBondContact OD1-N 3.19Å; N41-T43 PolarHBondContact OD1-OG1 3.47Å; T43-Q57 CarbonylContact O-C 3.52Å; T43-Q57 WeakPolarHBondContact O-CA 3.37Å; T43-R58 PolarHBondContact O-N 3.46Å; T43-Y59 HydrophobicContact CG2-CD2 4.2Å; T43-Y59 HydrophobicContact CG2-CE2 3.66Å
44	Y	96.4	Very high	91.9	Very high	32 Å²	32	40 Å²	40	13%	0.125	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	137.8	-172	-165.6	-94.8	0	0	0	111.7	I39 E40 N41 R55 I56 Q57 D266	I39-Y44 HydrophobicContact CG2-CD1 4.3Å; E40-Y44 CarbonylContact C-O 3.54Å; E40-Y44 WeakPolarHBondContact CA-O 3.49Å; N41-Y44 PolarHBondContact N-O 3.42Å; N41-Y44 WeakPolarHBondContact OD1-CA 3.04Å; N41-Y44 WeakPolarHBondContact OD1-CB 3.42Å; N41-Y44 PolarHBondContact OD1-N 3.29Å; N41-Y44 PolarHBondContact OD1-O 2.95Å; Y44-R55 HydrophobicContact CE2-CG 3.94Å; Y44-R55 WeakPolarHBondContact OH-CD 3.32Å; Y44-R55 WeakPolarHBondContact OH-CG 3.2Å; Y44-R55 PolarHBondContact OH-NE 2.84Å; Y44-I56 CarbonylContact C-O 3.44Å; Y44-I56 WeakPolarHBondContact CA-O 3.26Å; Y44-Q57 HydrophobicContact CD2-CG 3.72Å; Y44-Q57 HydrophobicContact CE2-CG 3.59Å; Y44-D266 WeakPolarHBondContact CE1-OD1 3.34Å; Y44-D266 VanDerWaalsContact CZ-OD1 3.25Å; Y44-D266 PolarHBondContact OH-OD1 3.43Å; Y44-D266 PolarHBondContact OH-OD2 2.88Å
45	R	96.4	Very high	93.1	Very high	18 Å²	18	37.6 Å²	37.6	7%	0.068	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	136.2	168.9	178.3	178.6	175.6	138.6	-11.3	110.3	E35 V37 I39 E40 R55 I56 W207	E35-R45 IonicContact OE1-CZ 3.99Å; E35-R45 IonicContact OE1-NE 2.68Å; E35-R45 PolarHBondContact OE1-NE 3.44Å; E35-R45 IonicContact OE1-NH2 3.48Å; E35-R45 PolarHBondContact OE1-NH2 3.49Å; E35-R45 IonicContact OE2-NH2 3.5Å; E35-R45 PolarHBondContact OE2-NH2 3.1Å; E35-R45 VanDerWaalsContact OE2-NH2 3.08Å; V37-R45 HydrophobicContact CG1-CG 4.35Å; I39-R45 CarbonylContact O-C 3.56Å; I39-R45 VanDerWaalsContact O-CA 3.31Å; I39-R45 WeakPolarHBondContact O-CA 3.44Å; E40-R45 HydrophobicContact CB-CG 4.31Å; E40-R45 HydrophobicContact CG-CB 4.31Å; E40-R45 HydrophobicContact CG-CG 4.29Å; E40-R45 IonicContact OE1-CZ 3.63Å; E40-R45 IonicContact OE1-NH1 3.79Å; E40-R45 PolarHBondContact OE1-NH1 3.28Å; E40-R45 IonicContact OE2-CZ 3.54Å; E40-R45 IonicContact OE2-NH1 3.7Å; E40-R45 PolarHBondContact OE2-NH1 3.04Å; R45-R55 CarbonylContact O-C 3.6Å; R45-R55 WeakPolarHBondContact O-CA 3.46Å; R45-I56 HydrophobicContact CB-CB 4.19Å; R45-I56 HydrophobicContact CB-CG1 4.48Å; R45-I56 PolarHBondContact N-O 3.34Å; R45-I56 PolarHBondContact O-N 2.87Å; R45-W207 HydrophobicContact CB-CH2 4.11Å; R45-W207 HydrophobicContact CB-CZ2 3.63Å
46	Y	96.3	Very high	93.6	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.5	168.9	-174.6	-110.2	0	0	0	109.9	I38 I39 L48 S53 M54 R55 D266	I38-Y46 HydrophobicContact CB-CD1 3.96Å; I38-Y46 HydrophobicContact CG1-CD1 3.91Å; I38-Y46 HydrophobicContact CG1-CE1 4.27Å; I38-Y46 PolarHBondContact N-O 3Å; I39-Y46 PolarHBondContact N-O 3.49Å; I39-Y46 PolarHBondContact O-N 2.99Å; Y46-L48 HydrophobicContact CE1-CD2 3.84Å; Y46-S53 WeakPolarHBondContact OH-CB 3.12Å; Y46-S53 PolarHBondContact OH-OG 3.38Å; Y46-M54 WeakPolarHBondContact CA-O 3.25Å; Y46-R55 HydrophobicContact CD2-CB 4.05Å; Y46-R55 HydrophobicContact CD2-CG 4.47Å; Y46-D266 HydrophobicContact CD1-CB 3.62Å; Y46-D266 HydrophobicContact CD2-CB 4.37Å; Y46-D266 HydrophobicContact CE1-CB 3.87Å; Y46-D266 HydrophobicContact CG-CB 3.87Å
47	S	95.4	Very high	93.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	150.8	179.3	54.9	0	0	0	0	111.7	E35 I36 H49 S53 M54	E35-S47 WeakPolarHBondContact OE1-CB 3.01Å; E35-S47 PolarHBondContact OE1-OG 3.34Å; E35-S47 VanDerWaalsContact OE1-OG 3.08Å; I36-S47 CarbonylContact O-C 3.51Å; I36-S47 VanDerWaalsContact O-CA 3.24Å; I36-S47 WeakPolarHBondContact O-CA 3.39Å; I36-S47 WeakPolarHBondContact O-CB 3.43Å; S47-H49 PolarHBondContact OG-NE2 3.36Å; S47-H49 VanDerWaalsContact OG-NE2 3.1Å; S47-S53 CarbonylContact O-C 3.6Å; S47-S53 WeakPolarHBondContact O-CA 3.39Å; S47-M54 PolarHBondContact N-O 3.01Å; S47-M54 PolarHBondContact O-N 3.5Å; S47-M54 WeakPolarHBondContact OG-CE 3.49Å
48	L	92.8	Very high	94.1	Very high	8 Å²	8	32.9 Å²	32.9	4%	0.042	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130	172.4	-57.8	-179.8	0	0	0	108.7	I36 I38 Y46 I219 C245 A250 I252	I36-L48 PolarHBondContact N-O 3.22Å; I36-L48 PolarHBondContact O-N 2.88Å; I38-L48 HydrophobicContact CD1-CD1 3.85Å; I38-L48 HydrophobicContact CD1-CG 3.98Å; I38-L48 HydrophobicContact CG1-CD1 4.24Å; I38-L48 HydrophobicContact CG1-CG 3.92Å; Y46-L48 HydrophobicContact CE1-CD2 3.84Å; L48-I219 HydrophobicContact CD2-CD1 4.03Å; L48-C245 HydrophobicContact CD1-CB 4.43Å; L48-A250 HydrophobicContact CD1-CB 3.78Å; L48-I252 HydrophobicContact CD1-CG2 4.33Å; L48-I252 HydrophobicContact CD2-CG2 4.22Å
49	H	91.3	Very high	94.3	Very high	10 Å²	10	41.1 Å²	41.1	5%	0.046	19%	0.191	C	C	.	.			trans	-118	169.8	169.6	-59.7	-98.4	0	0	0	108.1	E35 S47 Y51 Y52 I201	E35-H49 WeakPolarHBondContact CG-CE1 2.95Å; E35-H49 IonicContact OE1-CE1 3.08Å; E35-H49 IonicContact OE1-NE2 3.83Å; E35-H49 IonicContact OE2-CE1 2.8Å; S47-H49 PolarHBondContact OG-NE2 3.36Å; S47-H49 VanDerWaalsContact OG-NE2 3.1Å; H49-Y51 PolarHBondContact O-N 3.25Å; H49-Y52 CarbonylContact C-O 3.6Å; H49-Y52 VanDerWaalsContact CA-O 3.32Å; H49-Y52 WeakPolarHBondContact CA-O 3.31Å; H49-Y52 WeakPolarHBondContact CB-O 3.23Å; H49-Y52 PolarHBondContact N-O 2.92Å; H49-Y52 PolarHBondContact O-N 3.49Å; H49-I201 HydrophobicContact CB-CD1 3.72Å; H49-I201 HydrophobicContact CB-CG1 4.03Å; H49-I201 HydrophobicContact CB-CG2 4.38Å
50	Y	82.7	Confident	94.5	Very high	61 Å²	61	42.6 Å²	42.6	24%	0.239	20%	0.196	C	C	.	.	S	Bend	trans	-64.8	131.1	173.4	-174.4	-116.1	0	0	0	110.5	I30 Y52 L190 H199	I30-Y50 HydrophobicContact CB-CD2 4.2Å; I30-Y50 HydrophobicContact CB-CE2 4.29Å; I30-Y50 HydrophobicContact CD1-CD2 4.06Å; I30-Y50 HydrophobicContact CD1-CE2 3.64Å; I30-Y50 HydrophobicContact CG1-CD2 3.95Å; I30-Y50 HydrophobicContact CG1-CE2 4.03Å; I30-Y50 HydrophobicContact CG2-CD1 3.67Å; I30-Y50 HydrophobicContact CG2-CD2 3.27Å; I30-Y50 HydrophobicContact CG2-CE1 3.62Å; I30-Y50 HydrophobicContact CG2-CE2 3.34Å; I30-Y50 HydrophobicContact CG2-CG 3.44Å; I30-Y50 VanDerWaalsContact CG2-CG 3.44Å; I30-Y50 VanDerWaalsContact CG2-CZ 3.48Å; Y50-Y52 PolarHBondContact O-N 3.21Å; Y50-L190 HydrophobicContact CD1-CD1 3.26Å; Y50-L190 HydrophobicContact CD1-CD2 3.64Å; Y50-L190 HydrophobicContact CD1-CG 4.01Å; Y50-L190 HydrophobicContact CE1-CB 4.41Å; Y50-L190 HydrophobicContact CE1-CD1 3.53Å; Y50-L190 HydrophobicContact CE1-CD2 3.47Å; Y50-L190 VanDerWaalsContact CE1-CD2 3.47Å; Y50-L190 HydrophobicContact CE1-CG 3.94Å; Y50-L190 HydrophobicContact CG-CD1 4.39Å; Y50-H199 PolarHBondContact O-CE1 3.36Å
51	Y	86	Confident	94.5	Very high	67 Å²	67	44 Å²	44	26%	0.263	21%	0.214	S	C	.	.	S	Bend	trans	64.4	-17.2	-172.2	-85.2	-76.1	0	0	0	117.9	H49 L190 A218 I219 E221	H49-Y51 PolarHBondContact O-N 3.25Å; Y51-L190 HydrophobicContact CD2-CD2 3.87Å; Y51-L190 HydrophobicContact CE2-CD2 4.12Å; Y51-A218 CarbonylContact O-C 3.55Å; Y51-A218 VanDerWaalsContact O-CA 3.31Å; Y51-A218 WeakPolarHBondContact O-CA 2.92Å; Y51-I219 PolarHBondContact O-N 3.36Å; Y51-E221 HydrophobicContact CE1-CG 4.5Å; Y51-E221 WeakPolarHBondContact CE1-OE1 3.34Å; Y51-E221 PolarHBondContact OH-OE1 2.92Å
52	Y	93.5	Very high	94.3	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	141.6	-172.8	-76.1	-91.1	0	0	0	111.8	H49 Y50 Y88 I186 I201 F216 E217 A218	H49-Y52 CarbonylContact C-O 3.6Å; H49-Y52 VanDerWaalsContact CA-O 3.32Å; H49-Y52 WeakPolarHBondContact CA-O 3.31Å; H49-Y52 WeakPolarHBondContact CB-O 3.23Å; H49-Y52 PolarHBondContact N-O 2.92Å; H49-Y52 PolarHBondContact O-N 3.49Å; Y50-Y52 PolarHBondContact O-N 3.21Å; Y52-Y88 HydrophobicContact CD2-CE1 4.27Å; Y52-Y88 HydrophobicContact CD2-CE2 4.37Å; Y52-Y88 HydrophobicContact CE2-CD1 4.06Å; Y52-Y88 AromaticContact CE2-CD2 3.75Å; Y52-Y88 HydrophobicContact CE2-CD2 3.75Å; Y52-Y88 HydrophobicContact CE2-CE1 4.05Å; Y52-Y88 AromaticContact CE2-CE2 3.75Å; Y52-Y88 HydrophobicContact CE2-CE2 3.75Å; Y52-Y88 AromaticContact CE2-CG 3.93Å; Y52-Y88 HydrophobicContact CE2-CG 3.93Å; Y52-Y88 AromaticContact CE2-CZ 3.91Å; Y52-Y88 PolarHBondContact OH-N 3.48Å; Y52-I186 HydrophobicContact CD1-CD1 3.82Å; Y52-I186 HydrophobicContact CD2-CD1 3.95Å; Y52-I186 HydrophobicContact CE1-CD1 4.04Å; Y52-I186 HydrophobicContact CE2-CD1 4.16Å; Y52-I186 HydrophobicContact CG-CD1 3.79Å; Y52-I201 HydrophobicContact CD2-CD1 4.05Å; Y52-I201 HydrophobicContact CG-CD1 4.12Å; Y52-F216 HydrophobicContact CD1-CB 4.06Å; Y52-E217 CarbonylContact C-O 3.59Å; Y52-E217 VanDerWaalsContact CA-O 3.26Å; Y52-E217 WeakPolarHBondContact CA-O 3.31Å; Y52-A218 HydrophobicContact CD1-CB 4.43Å; Y52-A218 HydrophobicContact CE1-CB 4.11Å
53	S	94.4	Very high	94.1	Very high	5 Å²	5	40.6 Å²	40.6	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145	159.6	62.8	0	0	0	0	109.8	Y46 S47 F216 E217	Y46-S53 WeakPolarHBondContact OH-CB 3.12Å; Y46-S53 PolarHBondContact OH-OG 3.38Å; S47-S53 CarbonylContact O-C 3.6Å; S47-S53 WeakPolarHBondContact O-CA 3.39Å; S53-F216 WeakPolarHBondContact O-CA 3.37Å; S53-E217 PolarHBondContact N-O 3.39Å; S53-E217 PolarHBondContact O-N 3.17Å
54	M	97.1	Very high	94	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.1	174	-178.7	177.8	60.7	0	0	109.4	Y46 S47 I56 P204 V214 E215 F216	Y46-M54 WeakPolarHBondContact CA-O 3.25Å; S47-M54 PolarHBondContact N-O 3.01Å; S47-M54 PolarHBondContact O-N 3.5Å; S47-M54 WeakPolarHBondContact OG-CE 3.49Å; M54-I56 HydrophobicContact CE-CD1 3.97Å; M54-I56 HydrophobicContact CE-CG1 4.45Å; M54-I56 HydrophobicContact CG-CG1 4.1Å; M54-I56 HydrophobicContact SD-CD1 4.06Å; M54-I56 HydrophobicContact SD-CG1 4.27Å; M54-P204 HydrophobicContact CE-CG 4.38Å; M54-V214 HydrophobicContact CG-CG1 3.8Å; M54-V214 HydrophobicContact SD-CG1 3.97Å; M54-E215 WeakPolarHBondContact CA-O 3.39Å; M54-F216 HydrophobicContact CB-CD1 4.15Å; M54-F216 HydrophobicContact CB-CE1 4.2Å; M54-F216 HydrophobicContact CG-CD1 4.14Å; M54-F216 HydrophobicContact CG-CE1 3.82Å; M54-F216 HydrophobicContact CG-CZ 4.47Å; M54-F216 HydrophobicContact SD-CD1 4.5Å; M54-F216 HydrophobicContact SD-CE1 3.63Å; M54-F216 HydrophobicContact SD-CZ 4.09Å
55	R	97	Very high	93.9	Very high	9 Å²	9	39.9 Å²	39.9	3%	0.034	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133	170	-173.1	-176.8	-65.9	115.1	3	109.4	Y44 R45 Y46 Q57 V214 E215 D266	Y44-R55 HydrophobicContact CE2-CG 3.94Å; Y44-R55 WeakPolarHBondContact OH-CD 3.32Å; Y44-R55 WeakPolarHBondContact OH-CG 3.2Å; Y44-R55 PolarHBondContact OH-NE 2.84Å; R45-R55 CarbonylContact O-C 3.6Å; R45-R55 WeakPolarHBondContact O-CA 3.46Å; Y46-R55 HydrophobicContact CD2-CB 4.05Å; Y46-R55 HydrophobicContact CD2-CG 4.47Å; R55-Q57 HydrophobicContact CG-CG 4.09Å; R55-V214 CarbonylContact O-C 3.6Å; R55-V214 VanDerWaalsContact O-CA 3.31Å; R55-V214 WeakPolarHBondContact O-CA 3.2Å; R55-E215 HydrophobicContact CB-CB 4.45Å; R55-E215 PolarHBondContact N-O 3.41Å; R55-E215 IonicContact NH1-OE2 2.64Å; R55-E215 PolarHBondContact NH1-OE2 2.88Å; R55-E215 PolarHBondContact O-N 2.87Å; R55-D266 IonicContact CZ-OD2 3.62Å; R55-D266 IonicContact NE-OD2 3.7Å; R55-D266 PolarHBondContact NE-OD2 3.12Å; R55-D266 VanDerWaalsContact NE-OD2 3.17Å; R55-D266 IonicContact NH2-OD2 3.39Å; R55-D266 PolarHBondContact NH2-OD2 3.36Å
56	I	98.1	Very high	93.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.8	175.3	-49.1	-173.7	0	0	0	108.8	Y44 R45 M54 V203 W207 T212 L213 V214	Y44-I56 CarbonylContact C-O 3.44Å; Y44-I56 WeakPolarHBondContact CA-O 3.26Å; R45-I56 HydrophobicContact CB-CB 4.19Å; R45-I56 HydrophobicContact CB-CG1 4.48Å; R45-I56 PolarHBondContact N-O 3.34Å; R45-I56 PolarHBondContact O-N 2.87Å; M54-I56 HydrophobicContact CE-CD1 3.97Å; M54-I56 HydrophobicContact CE-CG1 4.45Å; M54-I56 HydrophobicContact CG-CG1 4.1Å; M54-I56 HydrophobicContact SD-CD1 4.06Å; M54-I56 HydrophobicContact SD-CG1 4.27Å; I56-V203 HydrophobicContact CD1-CG1 4.29Å; I56-W207 HydrophobicContact CB-CD2 4.34Å; I56-W207 HydrophobicContact CB-CE3 4.26Å; I56-W207 HydrophobicContact CD1-CB 4Å; I56-W207 HydrophobicContact CD1-CD2 4.25Å; I56-W207 HydrophobicContact CD1-CG 3.76Å; I56-W207 HydrophobicContact CG2-CB 3.96Å; I56-W207 HydrophobicContact CG2-CD2 3.72Å; I56-W207 HydrophobicContact CG2-CE3 3.42Å; I56-W207 VanDerWaalsContact CG2-CE3 3.42Å; I56-W207 HydrophobicContact CG2-CG 3.95Å; I56-W207 HydrophobicContact CG2-CZ3 4.14Å; I56-T212 HydrophobicContact CG2-CG2 3.46Å; I56-T212 VanDerWaalsContact CG2-CG2 3.46Å; I56-L213 CarbonylContact C-O 3.51Å; I56-L213 WeakPolarHBondContact CA-O 3.27Å; I56-V214 HydrophobicContact CD1-CG2 4.41Å; I56-V214 HydrophobicContact CG1-CG1 4.25Å; I56-V214 HydrophobicContact CG1-CG2 4.13Å; I56-V214 HydrophobicContact CG2-CG2 4.12Å
57	Q	97.8	Very high	93.5	Very high	38 Å²	38	48 Å²	48	18%	0.178	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.4	-179.8	-58.6	-176.9	97.9	0	0	110	T43 Y44 R55 Q60 T212 L213	T43-Q57 CarbonylContact O-C 3.52Å; T43-Q57 WeakPolarHBondContact O-CA 3.37Å; Y44-Q57 HydrophobicContact CD2-CG 3.72Å; Y44-Q57 HydrophobicContact CE2-CG 3.59Å; R55-Q57 HydrophobicContact CG-CG 4.09Å; Q57-Q60 HydrophobicContact CB-CG 3.65Å; Q57-T212 WeakPolarHBondContact O-CA 3.39Å; Q57-L213 PolarHBondContact N-O 3.28Å; Q57-L213 PolarHBondContact O-N 2.64Å
58	R	97.2	Very high	93.5	Very high	37 Å²	37	52.7 Å²	52.7	14%	0.14	27%	0.27	C	S	.	.	S	Bend	trans	-89.8	161.6	175.1	-65.1	-80.5	-65.7	136.7	7.1	110.6	T43 Q60 W207 S210 G211 T212	T43-R58 PolarHBondContact O-N 3.46Å; R58-Q60 PolarHBondContact O-N 3.47Å; R58-Q60 PolarHBondContact O-NE2 3.07Å; R58-W207 HydrophobicContact CG-CE3 3.85Å; R58-W207 HydrophobicContact CG-CZ3 3.55Å; R58-S210 PolarHBondContact NH1-O 2.86Å; R58-G211 CarbonylContact C-O 3.58Å; R58-T212 VanDerWaalsContact CD-OG1 3.32Å; R58-T212 WeakPolarHBondContact CD-OG1 3.4Å; R58-T212 PolarHBondContact NH1-OG1 3.14Å
59	Y	96.6	Very high	93.7	Very high	175 Å²	175	53.1 Å²	53.1	69%	0.686	27%	0.271	S	S	*	.	S	Bend	trans	58.4	34.1	176.6	-45.5	-68.8	0	0	0	113.7	T43 G211	T43-Y59 HydrophobicContact CG2-CD2 4.2Å; T43-Y59 HydrophobicContact CG2-CE2 3.66Å; Y59-G211 PolarHBondContact N-O 3.46Å
60	Q	97.1	Very high	93.9	Very high	68 Å²	68	60.7 Å²	60.7	32%	0.318	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-87.8	148	175	-57.5	-55.5	-62.7	0	0	109.8	Q57 R58 Y169 G211 L213	Q57-Q60 HydrophobicContact CB-CG 3.65Å; R58-Q60 PolarHBondContact O-N 3.47Å; R58-Q60 PolarHBondContact O-NE2 3.07Å; Q60-Y169 HydrophobicContact CB-CE2 4.42Å; Q60-Y169 WeakPolarHBondContact O-CE2 3.42Å; Q60-Y169 PolarHBondContact O-OH 3.21Å; Q60-Y169 VanDerWaalsContact O-OH 3.08Å; Q60-G211 PolarHBondContact N-O 3.08Å; Q60-L213 HydrophobicContact CB-CB 3.94Å; Q60-L213 HydrophobicContact CG-CB 3.81Å
61	S	94.2	Very high	94.4	Very high	98 Å²	98	64 Å²	64	69%	0.685	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-80.9	165	169.7	52.6	0	0	0	0	111.3	A63	S61-A63 PolarHBondContact O-N 3.44Å
62	E	91	Very high	94.7	Very high	92 Å²	92	61.4 Å²	61.4	43%	0.43	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-62.1	125.6	170.9	17.9	179.8	173.4	0	0	109.9	V64 S66 K140 Y169	E62-V64 PolarHBondContact O-N 3.04Å; E62-S66 PolarHBondContact OE2-OG 2.97Å; E62-K140 IonicContact OE2-NZ 3.16Å; E62-Y169 HydrophobicContact CB-CD1 4.3Å; E62-Y169 HydrophobicContact CB-CE1 3.69Å; E62-Y169 HydrophobicContact CG-CE1 4.43Å; E62-Y169 PolarHBondContact N-OH 2.85Å
63	A	89.1	Confident	94.3	Very high	71 Å²	71	68.6 Å²	68.6	59%	0.587	35%	0.354	S	S	*	.	S	Bend	trans	-71.4	-21.4	178.6	0	0	0	0	0	112.8	S61 L159	S61-A63 PolarHBondContact O-N 3.44Å; A63-L159 HydrophobicContact CB-CD1 4.08Å
64	V	93.8	Very high	94	Very high	9 Å²	9	73 Å²	73	6%	0.055	38%	0.377	C	S	.	.	S	Bend	trans	-136.9	124.6	-178.3	-177.8	0	0	0	0	108.6	E62 R68 F69 L131 L136 L159	E62-V64 PolarHBondContact O-N 3.04Å; V64-R68 HydrophobicContact CG1-CB 4.12Å; V64-F69 HydrophobicContact CB-CE2 3.99Å; V64-F69 HydrophobicContact CB-CZ 4.26Å; V64-F69 HydrophobicContact CG1-CD2 4.47Å; V64-F69 HydrophobicContact CG1-CE2 3.66Å; V64-F69 HydrophobicContact CG1-CZ 4.12Å; V64-L131 HydrophobicContact CG1-CD2 3.87Å; V64-L136 HydrophobicContact CG2-CD2 3.69Å; V64-L159 HydrophobicContact CG2-CD1 3.97Å; V64-L159 HydrophobicContact CG2-CD2 4.1Å
65	P	93.4	Very high	93.7	Very high	67 Å²	67	79.2 Å²	79.2	44%	0.435	40%	0.401	S	S	.	.			trans	-55.8	140.5	174	-28.6	36.7	0	0	0	113.4	D67 R68	P65-D67 VanDerWaalsContact C-N 3.3Å; P65-D67 WeakPolarHBondContact CB-OD1 3.42Å; P65-D67 PolarHBondContact O-N 3.41Å; P65-R68 HydrophobicContact CB-CG 4.4Å; P65-R68 WeakPolarHBondContact O-CB 3.44Å; P65-R68 PolarHBondContact O-N 2.95Å
66	S	91.7	Very high	93.5	Very high	56 Å²	56	84.1 Å²	84.1	39%	0.392	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-61.4	-32.5	-174.1	-66	0	0	0	0	114.4	E62 R68 F69 K140	E62-S66 PolarHBondContact OE2-OG 2.97Å; S66-R68 PolarHBondContact O-N 3.38Å; S66-F69 PolarHBondContact O-N 3.09Å; S66-K140 PolarHBondContact OG-NZ 3.44Å
67	D	92.6	Very high	93.3	Very high	136 Å²	136	85 Å²	85	73%	0.727	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-67	-19.7	179.7	62.4	-52.2	0	0	0	113.5	P65 F69	P65-D67 VanDerWaalsContact C-N 3.3Å; P65-D67 WeakPolarHBondContact CB-OD1 3.42Å; P65-D67 PolarHBondContact O-N 3.41Å; D67-F69 VanDerWaalsContact C-N 3.27Å; D67-F69 PolarHBondContact O-N 3.35Å
68	R	95.8	Very high	93.2	Very high	97 Å²	97	86.7 Å²	86.7	37%	0.366	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-72.3	-21.8	175	-62.3	-175.9	66.3	-166.7	5.3	112.8	V64 P65 S66 L131 E133	V64-R68 HydrophobicContact CG1-CB 4.12Å; P65-R68 HydrophobicContact CB-CG 4.4Å; P65-R68 WeakPolarHBondContact O-CB 3.44Å; P65-R68 PolarHBondContact O-N 2.95Å; S66-R68 PolarHBondContact O-N 3.38Å; R68-L131 HydrophobicContact CB-CD1 4.05Å; R68-L131 WeakPolarHBondContact O-CD1 3.34Å; R68-E133 IonicContact CZ-OE1 3.76Å; R68-E133 IonicContact CZ-OE2 3.52Å; R68-E133 IonicContact NE-OE1 2.71Å; R68-E133 IonicContact NH2-OE1 3.89Å; R68-E133 PolarHBondContact NH2-OE1 3.4Å; R68-E133 IonicContact NH2-OE2 2.61Å; R68-E133 PolarHBondContact NH2-OE2 2.92Å
69	F	96.8	Very high	93	Very high	17 Å²	17	91.5 Å²	91.5	8%	0.075	45%	0.454	C	S	.	.	S	Bend	trans	-81.5	123	178.1	-66.2	-96.3	0	0	0	110.3	V64 S66 D67 L131 K140 T157 L159	V64-F69 HydrophobicContact CB-CE2 3.99Å; V64-F69 HydrophobicContact CB-CZ 4.26Å; V64-F69 HydrophobicContact CG1-CD2 4.47Å; V64-F69 HydrophobicContact CG1-CE2 3.66Å; V64-F69 HydrophobicContact CG1-CZ 4.12Å; S66-F69 PolarHBondContact O-N 3.09Å; D67-F69 VanDerWaalsContact C-N 3.27Å; D67-F69 PolarHBondContact O-N 3.35Å; F69-L131 HydrophobicContact CD1-CB 3.88Å; F69-L131 HydrophobicContact CE1-CB 3.89Å; F69-K140 HydrophobicContact CB-CB 4.47Å; F69-K140 HydrophobicContact CD1-CB 3.6Å; F69-K140 HydrophobicContact CD2-CB 4.25Å; F69-K140 HydrophobicContact CD2-CD 4.1Å; F69-K140 HydrophobicContact CE1-CB 3.76Å; F69-K140 HydrophobicContact CE2-CB 4.4Å; F69-K140 HydrophobicContact CE2-CD 4.25Å; F69-K140 HydrophobicContact CG-CB 3.85Å; F69-K140 HydrophobicContact CG-CD 4.43Å; F69-K140 HydrophobicContact CZ-CB 4.17Å; F69-T157 HydrophobicContact CE1-CG2 4.15Å; F69-T157 HydrophobicContact CZ-CG2 3.67Å; F69-L159 HydrophobicContact CZ-CD2 4.13Å
70	K	96	Very high	92.9	Very high	170 Å²	170	92.9 Å²	92.9	74%	0.739	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.2	176.3	-64	-176.9	-177.9	179	0	109.8	M72 G129 V130	K70-M72 PolarHBondContact O-N 2.65Å; K70-G129 CarbonylContact O-C 3.54Å; K70-G129 WeakPolarHBondContact O-CA 3.29Å; K70-V130 PolarHBondContact N-O 3.33Å; K70-V130 PolarHBondContact O-N 3.4Å
71	N	93.9	Very high	92.5	Very high	129 Å²	129	90.6 Å²	90.6	69%	0.69	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.1	127.3	175.7	-76.3	-21.5	0	0	0	110.6	I73	N71-I73 PolarHBondContact O-N 3.33Å
72	M	91.4	Very high	92.2	Very high	14 Å²	14	91.6 Å²	91.6	7%	0.069	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-71	116.3	179.1	-174.7	175.2	167.9	0	0	109.4	K70 D74 F97 K99 T128 V130	K70-M72 PolarHBondContact O-N 2.65Å; M72-D74 VanDerWaalsContact CE-O 3.24Å; M72-D74 WeakPolarHBondContact CE-O 2.9Å; M72-D74 WeakPolarHBondContact CG-O 3.11Å; M72-F97 HydrophobicContact CE-CD2 4.48Å; M72-F97 HydrophobicContact CE-CE2 4.12Å; M72-F97 HydrophobicContact SD-CD2 4.25Å; M72-F97 HydrophobicContact SD-CE2 3.47Å; M72-F97 WeakPolarHBondContact SD-CE2 3.3Å; M72-F97 HydrophobicContact SD-CZ 4.12Å; M72-K99 HydrophobicContact CB-CG 4.35Å; M72-K99 HydrophobicContact CE-CB 4.05Å; M72-K99 HydrophobicContact CG-CG 4.27Å; M72-K99 WeakPolarHBondContact O-CD 3.43Å; M72-K99 WeakPolarHBondContact O-CE 3.46Å; M72-K99 PolarHBondContact O-NZ 3.36Å; M72-K99 HydrophobicContact SD-CB 4.12Å; M72-K99 HydrophobicContact SD-CG 4.17Å; M72-T128 VanDerWaalsContact CB-O 3.31Å; M72-T128 WeakPolarHBondContact CB-O 3.27Å; M72-T128 PolarHBondContact N-O 3.2Å; M72-T128 HydrophobicContact SD-CG2 4.3Å; M72-V130 HydrophobicContact CB-CG2 4.23Å; M72-V130 HydrophobicContact SD-CG2 4.27Å
73	I	85.3	Confident	92.3	Very high	153 Å²	153	88.3 Å²	88.3	79%	0.785	43%	0.426	S	S	*	.			trans	-84.5	-48.8	178.9	-58.7	172.5	0	0	0	109.5	N71	N71-I73 PolarHBondContact O-N 3.33Å
74	D	88.6	Confident	92.1	Very high	97 Å²	97	88.5 Å²	88.5	52%	0.519	42%	0.423	S	S	.	.	S	Bend	trans	-61.2	147	-179.2	-63.2	-32.1	0	0	0	111.9	M72 K76	M72-D74 VanDerWaalsContact CE-O 3.24Å; M72-D74 WeakPolarHBondContact CE-O 2.9Å; M72-D74 WeakPolarHBondContact CG-O 3.11Å; D74-K76 PolarHBondContact O-N 3.19Å
75	Y	90	Very high	92.1	Very high	130 Å²	130	88.4 Å²	88.4	51%	0.51	42%	0.422	S	S	.	.	S	Bend	trans	-66.8	-26.2	178	174.7	-102.8	0	0	0	113.5	H98 K99 L101	Y75-H98 AromaticContact CD1-ND1 3.9Å; Y75-H98 AromaticContact CE1-CE1 3.73Å; Y75-H98 AromaticContact CE1-ND1 3.29Å; Y75-H98 VanDerWaalsContact CE1-ND1 3.29Å; Y75-H98 WeakPolarHBondContact CE1-ND1 3.18Å; Y75-H98 AromaticContact CZ-ND1 3.79Å; Y75-K99 WeakPolarHBondContact O-CB 3.5Å; Y75-K99 PolarHBondContact O-N 3.27Å; Y75-L101 WeakPolarHBondContact OH-CD1 3.4Å; Y75-L101 WeakPolarHBondContact OH-CG 3.11Å
76	K	93.5	Very high	92.1	Very high	112 Å²	112	88.3 Å²	88.3	49%	0.487	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.2	179.3	66	177.3	-176.5	174.1	0	110.4	D74 Y96 F97	D74-K76 PolarHBondContact O-N 3.19Å; K76-Y96 HydrophobicContact CB-CE2 4.4Å; K76-Y96 HydrophobicContact CD-CE2 4.19Å; K76-F97 CarbonylContact C-O 3.46Å; K76-F97 WeakPolarHBondContact CA-O 3.01Å
77	Y	94.3	Very high	92.2	Very high	19 Å²	19	85.6 Å²	85.6	8%	0.075	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.7	169.4	-176	-82.7	0	0	0	105.9	R79 I95 Y96 F97 V130 D132 F137	Y77-R79 HydrophobicContact CD1-CB 4.48Å; Y77-R79 HydrophobicContact CE1-CB 3.76Å; Y77-R79 HydrophobicContact CE1-CG 4.21Å; Y77-R79 HydrophobicContact CE2-CB 4.43Å; Y77-R79 HydrophobicContact CE2-CG 4.18Å; Y77-I95 HydrophobicContact CE1-CB 4.5Å; Y77-Y96 CarbonylContact O-C 3.58Å; Y77-Y96 WeakPolarHBondContact O-CA 3.22Å; Y77-F97 VanDerWaalsContact CB-CE1 3.44Å; Y77-F97 VanDerWaalsContact CB-CZ 3.46Å; Y77-F97 HydrophobicContact CD1-CD1 4.02Å; Y77-F97 AromaticContact CD1-CE1 3.39Å; Y77-F97 HydrophobicContact CD1-CE1 3.39Å; Y77-F97 HydrophobicContact CD1-CZ 4.09Å; Y77-F97 HydrophobicContact CD2-CE1 4.31Å; Y77-F97 HydrophobicContact CD2-CZ 4.2Å; Y77-F97 HydrophobicContact CE1-CE1 4.19Å; Y77-F97 HydrophobicContact CG-CD1 4.24Å; Y77-F97 AromaticContact CG-CE1 3.46Å; Y77-F97 HydrophobicContact CG-CE1 3.46Å; Y77-F97 VanDerWaalsContact CG-CE1 3.46Å; Y77-F97 AromaticContact CG-CZ 3.67Å; Y77-F97 HydrophobicContact CG-CZ 3.67Å; Y77-F97 PolarHBondContact N-O 3.24Å; Y77-F97 PolarHBondContact O-N 3.37Å; Y77-V130 HydrophobicContact CD2-CG1 4.27Å; Y77-V130 HydrophobicContact CE2-CG1 3.87Å; Y77-D132 PolarHBondContact OH-OD2 3.35Å; Y77-F137 AromaticContact CE1-CE2 3.99Å; Y77-F137 HydrophobicContact CE1-CE2 3.99Å; Y77-F137 HydrophobicContact CE1-CZ 4.31Å; Y77-F137 HydrophobicContact CE2-CE2 4.43Å; Y77-F137 AromaticContact CZ-CE2 3.77Å
78	D	94.5	Very high	92.2	Very high	73 Å²	73	80 Å²	80	39%	0.39	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	86.7	177.8	-169.5	-2.1	0	0	0	107.5	K94 Y96	D78-K94 IonicContact OD1-NZ 3.17Å; D78-Y96 HydrophobicContact CB-CD2 3.78Å; D78-Y96 HydrophobicContact CB-CE2 4.39Å
79	R	93.4	Very high	91.8	Very high	138 Å²	138	78.3 Å²	78.3	52%	0.521	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	153.3	-173.9	-61	-167	179.6	-157.1	0.6	112.2	Y77 K94 I95	Y77-R79 HydrophobicContact CD1-CB 4.48Å; Y77-R79 HydrophobicContact CE1-CB 3.76Å; Y77-R79 HydrophobicContact CE1-CG 4.21Å; Y77-R79 HydrophobicContact CE2-CB 4.43Å; Y77-R79 HydrophobicContact CE2-CG 4.18Å; R79-K94 VanDerWaalsContact O-CA 3.25Å; R79-K94 WeakPolarHBondContact O-CA 3.45Å; R79-K94 WeakPolarHBondContact O-CB 2.94Å; R79-I95 PolarHBondContact N-O 3.49Å; R79-I95 PolarHBondContact O-N 3.16Å
80	R	93.5	Very high	91.6	Very high	205 Å²	205	80.4 Å²	80.4	77%	0.774	40%	0.4	S	S	*	.			trans	-80.5	131.2	162.9	-57.6	-168.9	173.4	114.4	-0.8	107.7	K93 K94	R80-K93 VanDerWaalsContact CA-O 3.3Å; R80-K93 WeakPolarHBondContact CA-O 3.27Å; R80-K93 WeakPolarHBondContact CB-O 3.43Å; R80-K93 VanDerWaalsContact CG-O 3.3Å; R80-K93 WeakPolarHBondContact CG-O 3.38Å; R80-K94 HydrophobicContact CG-CB 4.48Å
81	L	89.9	Confident	91.4	Very high	20 Å²	20	76.9 Å²	76.9	11%	0.105	39%	0.386	C	S	.	.			trans	-70.6	159.8	175.6	-59.1	-172	0	0	0	110.4	F83 F85 I95 F137	L81-F83 HydrophobicContact CB-CD1 4.49Å; L81-F83 HydrophobicContact CB-CE1 4.45Å; L81-F83 HydrophobicContact CD1-CE1 4.19Å; L81-F83 HydrophobicContact CD1-CE2 3.96Å; L81-F83 HydrophobicContact CD1-CZ 3.72Å; L81-F83 PolarHBondContact O-N 3.41Å; L81-F85 HydrophobicContact CD1-CD1 4.19Å; L81-F85 HydrophobicContact CD1-CE1 3.7Å; L81-I95 HydrophobicContact CD1-CD1 3.75Å; L81-I95 HydrophobicContact CD1-CG1 4.36Å; L81-I95 HydrophobicContact CD2-CD1 4.26Å; L81-I95 HydrophobicContact CG-CD1 4.21Å; L81-I95 HydrophobicContact CG-CG1 4.39Å; L81-F137 HydrophobicContact CD1-CB 3.85Å; L81-F137 HydrophobicContact CD1-CG 4.15Å; L81-F137 HydrophobicContact CD2-CB 4.11Å; L81-F137 HydrophobicContact CD2-CD2 3.47Å; L81-F137 VanDerWaalsContact CD2-CD2 3.47Å; L81-F137 HydrophobicContact CD2-CE2 4.02Å; L81-F137 HydrophobicContact CD2-CG 3.8Å
82	Q	87.6	Confident	91.5	Very high	119 Å²	119	70.9 Å²	70.9	56%	0.556	35%	0.354	S	S	*	.	S	Bend	trans	-70.7	-11.8	176.5	-63.4	-179.2	49.6	0	0	113.5	D132	Q82-D132 PolarHBondContact NE2-O 3.21Å
83	F	92.2	Very high	91.5	Very high	23 Å²	23	73.4 Å²	73.4	10%	0.101	37%	0.365	C	S	.	.	S	Bend	trans	-128.7	163.5	175.2	57.6	-86.4	0	0	0	111.3	L81 F85 E133 K134 F137 I160 S162	L81-F83 HydrophobicContact CB-CD1 4.49Å; L81-F83 HydrophobicContact CB-CE1 4.45Å; L81-F83 HydrophobicContact CD1-CE1 4.19Å; L81-F83 HydrophobicContact CD1-CE2 3.96Å; L81-F83 HydrophobicContact CD1-CZ 3.72Å; L81-F83 PolarHBondContact O-N 3.41Å; F83-F85 HydrophobicContact CD2-CB 4.38Å; F83-F85 HydrophobicContact CD2-CD1 4.2Å; F83-F85 HydrophobicContact CE2-CB 4.36Å; F83-F85 AromaticContact CE2-CD1 3.83Å; F83-F85 HydrophobicContact CE2-CD1 3.83Å; F83-F85 HydrophobicContact CE2-CG 4.37Å; F83-E133 WeakPolarHBondContact CD1-O 3.34Å; F83-E133 WeakPolarHBondContact CE1-O 3.44Å; F83-K134 VanDerWaalsContact CB-O 3.3Å; F83-K134 WeakPolarHBondContact CB-O 3.21Å; F83-K134 VanDerWaalsContact CD1-O 3.23Å; F83-K134 WeakPolarHBondContact CD1-O 3.44Å; F83-F137 HydrophobicContact CE1-CB 4.17Å; F83-F137 HydrophobicContact CZ-CB 3.88Å; F83-I160 WeakPolarHBondContact CZ-O 3.38Å; F83-S162 VanDerWaalsContact CD2-CA 3.45Å
84	S	86.7	Confident	91.9	Very high	74 Å²	74	69.2 Å²	69.2	52%	0.517	34%	0.341	S	S	.	.			trans	-105.9	138.5	174.4	-67.4	0	0	0	0	110	H91	S84-H91 WeakPolarHBondContact CB-CE1 3.29Å; S84-H91 VanDerWaalsContact CB-NE2 3.28Å; S84-H91 WeakPolarHBondContact CB-NE2 3.27Å; S84-H91 PolarHBondContact OG-CE1 3.33Å; S84-H91 PolarHBondContact OG-NE2 3.42Å
85	F	93.6	Very high	92.3	Very high	7 Å²	7	64.6 Å²	64.6	3%	0.031	32%	0.316	C	S	.	.			trans	-143.1	165	175.3	74.2	-80.6	0	0	0	110.1	L81 F83 F87 V92 I95 I160	L81-F85 HydrophobicContact CD1-CD1 4.19Å; L81-F85 HydrophobicContact CD1-CE1 3.7Å; F83-F85 HydrophobicContact CD2-CB 4.38Å; F83-F85 HydrophobicContact CD2-CD1 4.2Å; F83-F85 HydrophobicContact CE2-CB 4.36Å; F83-F85 AromaticContact CE2-CD1 3.83Å; F83-F85 HydrophobicContact CE2-CD1 3.83Å; F83-F85 HydrophobicContact CE2-CG 4.37Å; F85-F87 HydrophobicContact CE2-CB 4.01Å; F85-V92 HydrophobicContact CD1-CB 4Å; F85-V92 HydrophobicContact CD1-CG1 4.38Å; F85-V92 HydrophobicContact CD1-CG2 4.42Å; F85-V92 HydrophobicContact CD2-CG2 4.09Å; F85-V92 HydrophobicContact CE1-CB 3.61Å; F85-V92 HydrophobicContact CE1-CG1 3.56Å; F85-V92 HydrophobicContact CE1-CG2 3.97Å; F85-V92 HydrophobicContact CE2-CB 4.22Å; F85-V92 HydrophobicContact CE2-CG2 3.63Å; F85-V92 HydrophobicContact CG-CB 4.45Å; F85-V92 HydrophobicContact CG-CG2 4.47Å; F85-V92 HydrophobicContact CZ-CB 3.74Å; F85-V92 HydrophobicContact CZ-CG1 3.69Å; F85-V92 HydrophobicContact CZ-CG2 3.56Å; F85-V92 PolarHBondContact O-N 2.91Å; F85-I95 HydrophobicContact CE1-CD1 4.4Å; F85-I95 HydrophobicContact CZ-CD1 4.37Å; F85-I160 HydrophobicContact CD1-CG2 4.15Å; F85-I160 HydrophobicContact CD2-CG2 3.94Å; F85-I160 HydrophobicContact CE1-CG2 3.88Å; F85-I160 HydrophobicContact CE2-CG2 3.62Å; F85-I160 HydrophobicContact CG-CG2 4.18Å; F85-I160 HydrophobicContact CZ-CD1 4.27Å; F85-I160 HydrophobicContact CZ-CG2 3.6Å
86	S	92.7	Very high	92.5	Very high	65 Å²	65	60.8 Å²	60.8	46%	0.455	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.5	176	-65.9	0	0	0	0	111.4	T90	S86-T90 WeakPolarHBondContact CA-O 3.38Å
87	F	94.6	Very high	92.6	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.5	173.3	-175.5	-111	0	0	0	108.8	F85 G89 T90 V92 I107 I113 R114 I116 I186 F187	F85-F87 HydrophobicContact CE2-CB 4.01Å; F87-G89 VanDerWaalsContact C-N 3.28Å; F87-G89 PolarHBondContact O-N 3.05Å; F87-T90 PolarHBondContact N-O 3.24Å; F87-T90 PolarHBondContact O-N 3.25Å; F87-V92 HydrophobicContact CB-CG2 3.59Å; F87-I107 HydrophobicContact CB-CG2 4.21Å; F87-I107 HydrophobicContact CD1-CB 4.12Å; F87-I107 HydrophobicContact CD1-CG1 4.27Å; F87-I107 HydrophobicContact CD1-CG2 3.95Å; F87-I107 HydrophobicContact CE1-CB 4.41Å; F87-I107 HydrophobicContact CE1-CG1 4.26Å; F87-I107 HydrophobicContact CG-CG2 4.26Å; F87-I113 HydrophobicContact CD1-CG2 3.87Å; F87-I113 HydrophobicContact CE1-CG2 4.41Å; F87-R114 HydrophobicContact CE1-CB 4.43Å; F87-I116 HydrophobicContact CE2-CD1 4.07Å; F87-I116 HydrophobicContact CE2-CG1 3.96Å; F87-I116 HydrophobicContact CZ-CD1 4.41Å; F87-I116 HydrophobicContact CZ-CG1 3.87Å; F87-I186 HydrophobicContact CE2-CB 4.23Å; F87-I186 HydrophobicContact CE2-CG2 4.42Å; F87-I186 HydrophobicContact CZ-CB 4.33Å; F87-F187 VanDerWaalsContact CE1-O 3.3Å; F87-F187 WeakPolarHBondContact CE1-O 3.4Å; F87-F187 WeakPolarHBondContact CZ-O 3.42Å
88	Y	91.3	Very high	92.5	Very high	18 Å²	18	56.2 Å²	56.2	7%	0.071	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	49.9	-171.7	-80.6	-91.9	0	0	0	112.6	Y52 T90 I186 G188 L190 H199	Y52-Y88 HydrophobicContact CD2-CE1 4.27Å; Y52-Y88 HydrophobicContact CD2-CE2 4.37Å; Y52-Y88 HydrophobicContact CE2-CD1 4.06Å; Y52-Y88 AromaticContact CE2-CD2 3.75Å; Y52-Y88 HydrophobicContact CE2-CD2 3.75Å; Y52-Y88 HydrophobicContact CE2-CE1 4.05Å; Y52-Y88 AromaticContact CE2-CE2 3.75Å; Y52-Y88 HydrophobicContact CE2-CE2 3.75Å; Y52-Y88 AromaticContact CE2-CG 3.93Å; Y52-Y88 HydrophobicContact CE2-CG 3.93Å; Y52-Y88 AromaticContact CE2-CZ 3.91Å; Y52-Y88 PolarHBondContact OH-N 3.48Å; Y88-T90 PolarHBondContact O-N 3.1Å; Y88-I186 HydrophobicContact CE2-CD1 4.32Å; Y88-I186 HydrophobicContact CE2-CG1 4.47Å; Y88-I186 PolarHBondContact OH-O 3Å; Y88-G188 VanDerWaalsContact CE2-CA 3.47Å; Y88-L190 HydrophobicContact CD1-CD2 4.11Å; Y88-L190 HydrophobicContact CE1-CD2 4.28Å; Y88-H199 HydrophobicContact CE1-CB 4.38Å; Y88-H199 AromaticContact CE1-ND1 3.52Å; Y88-H199 AromaticContact CZ-ND1 3.74Å; Y88-H199 PolarHBondContact OH-ND1 2.76Å
89	G	88.7	Confident	92.1	Very high	61 Å²	61	55.5 Å²	55.5	63%	0.629	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	1.5	179.5	0	0	0	0	0	115.5	F87	F87-G89 VanDerWaalsContact C-N 3.28Å; F87-G89 PolarHBondContact O-N 3.05Å
90	T	90.9	Very high	91.6	Very high	62 Å²	62	52.3 Å²	52.3	38%	0.38	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132	-179.3	-55.4	0	0	0	0	111	S86 F87 Y88 V92 I113	S86-T90 WeakPolarHBondContact CA-O 3.38Å; F87-T90 PolarHBondContact N-O 3.24Å; F87-T90 PolarHBondContact O-N 3.25Å; Y88-T90 PolarHBondContact O-N 3.1Å; T90-V92 PolarHBondContact O-N 2.97Å; T90-I113 HydrophobicContact CG2-CD1 3.6Å; T90-I113 HydrophobicContact CG2-CG1 3.84Å
91	H	92.9	Very high	90.8	Very high	95 Å²	95	47.8 Å²	47.8	44%	0.44	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	120.9	174.4	-173.1	-59.3	0	0	0	110.8	S84 G109	S84-H91 WeakPolarHBondContact CB-CE1 3.29Å; S84-H91 VanDerWaalsContact CB-NE2 3.28Å; S84-H91 WeakPolarHBondContact CB-NE2 3.27Å; S84-H91 PolarHBondContact OG-CE1 3.33Å; S84-H91 PolarHBondContact OG-NE2 3.42Å; H91-G109 VanDerWaalsContact O-CA 3.27Å; H91-G109 WeakPolarHBondContact O-CA 3.46Å
92	V	95.2	Very high	90.4	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.024	28%	0.278	C	S	.	.			trans	-80.4	140.9	179.7	-178.9	0	0	0	0	109.9	F85 F87 T90 I107 I113	F85-V92 HydrophobicContact CD1-CB 4Å; F85-V92 HydrophobicContact CD1-CG1 4.38Å; F85-V92 HydrophobicContact CD1-CG2 4.42Å; F85-V92 HydrophobicContact CD2-CG2 4.09Å; F85-V92 HydrophobicContact CE1-CB 3.61Å; F85-V92 HydrophobicContact CE1-CG1 3.56Å; F85-V92 HydrophobicContact CE1-CG2 3.97Å; F85-V92 HydrophobicContact CE2-CB 4.22Å; F85-V92 HydrophobicContact CE2-CG2 3.63Å; F85-V92 HydrophobicContact CG-CB 4.45Å; F85-V92 HydrophobicContact CG-CG2 4.47Å; F85-V92 HydrophobicContact CZ-CB 3.74Å; F85-V92 HydrophobicContact CZ-CG1 3.69Å; F85-V92 HydrophobicContact CZ-CG2 3.56Å; F85-V92 PolarHBondContact O-N 2.91Å; F87-V92 HydrophobicContact CB-CG2 3.59Å; T90-V92 PolarHBondContact O-N 2.97Å; V92-I107 HydrophobicContact CB-CG2 4.2Å; V92-I107 HydrophobicContact CG1-CG2 3.63Å; V92-I107 HydrophobicContact CG2-CG2 3.46Å; V92-I107 VanDerWaalsContact CG2-CG2 3.46Å; V92-I113 HydrophobicContact CG2-CD1 4.05Å
93	K	91.6	Very high	90.4	Very high	67 Å²	67	46.5 Å²	46.5	29%	0.291	25%	0.253	S	S	.	.			trans	-117.1	-35.5	177.7	-67.6	-167.5	171.4	-153.4	0	112.8	R80 F108 W110	R80-K93 VanDerWaalsContact CA-O 3.3Å; R80-K93 WeakPolarHBondContact CA-O 3.27Å; R80-K93 WeakPolarHBondContact CB-O 3.43Å; R80-K93 VanDerWaalsContact CG-O 3.3Å; R80-K93 WeakPolarHBondContact CG-O 3.38Å; K93-F108 PolarHBondContact N-O 3.36Å; K93-W110 HydrophobicContact CD-CD2 4.3Å; K93-W110 HydrophobicContact CD-CE3 4.34Å; K93-W110 VanDerWaalsContact NZ-CD2 3.28Å; K93-W110 VanDerWaalsContact NZ-CE3 3.29Å
94	K	94.4	Very high	90.5	Very high	65 Å²	65	46.6 Å²	46.6	28%	0.283	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	152.8	-177.7	68.4	175.2	-168.7	162.7	0	111.7	D78 R79 R80 F108	D78-K94 IonicContact OD1-NZ 3.17Å; R79-K94 VanDerWaalsContact O-CA 3.25Å; R79-K94 WeakPolarHBondContact O-CA 3.45Å; R79-K94 WeakPolarHBondContact O-CB 2.94Å; R80-K94 HydrophobicContact CG-CB 4.48Å; K94-F108 HydrophobicContact CD-CB 4.16Å; K94-F108 HydrophobicContact CD-CG 4.34Å; K94-F108 HydrophobicContact CG-CB 3.47Å; K94-F108 VanDerWaalsContact CG-CB 3.47Å; K94-F108 HydrophobicContact CG-CD2 4.18Å; K94-F108 HydrophobicContact CG-CG 4.03Å; K94-F108 PolarHBondContact N-O 3.04Å; K94-F108 VanDerWaalsContact N-O 3.14Å; K94-F108 PolarHBondContact O-N 2.85Å
95	I	95.8	Very high	91	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	137.4	170.4	-63	-172.2	0	0	0	108.4	Y77 R79 L81 F85 F97 L105 I107 F137 I160	Y77-I95 HydrophobicContact CE1-CB 4.5Å; R79-I95 PolarHBondContact N-O 3.49Å; R79-I95 PolarHBondContact O-N 3.16Å; L81-I95 HydrophobicContact CD1-CD1 3.75Å; L81-I95 HydrophobicContact CD1-CG1 4.36Å; L81-I95 HydrophobicContact CD2-CD1 4.26Å; L81-I95 HydrophobicContact CG-CD1 4.21Å; L81-I95 HydrophobicContact CG-CG1 4.39Å; F85-I95 HydrophobicContact CE1-CD1 4.4Å; F85-I95 HydrophobicContact CZ-CD1 4.37Å; I95-F97 HydrophobicContact CG2-CD1 3.99Å; I95-F97 HydrophobicContact CG2-CE1 4.25Å; I95-L105 HydrophobicContact CG2-CD2 4.44Å; I95-I107 HydrophobicContact CD1-CD1 3.98Å; I95-I107 HydrophobicContact CG1-CD1 3.9Å; I95-I107 HydrophobicContact CG2-CD1 4.37Å; I95-F137 HydrophobicContact CD1-CD1 3.83Å; I95-F137 HydrophobicContact CD1-CE1 3.83Å; I95-F137 HydrophobicContact CD1-CG 4.45Å; I95-F137 HydrophobicContact CD1-CZ 4.47Å; I95-F137 HydrophobicContact CG2-CE1 4.3Å; I95-F137 HydrophobicContact CG2-CZ 4.31Å; I95-I160 HydrophobicContact CD1-CD1 3.67Å
96	Y	95.4	Very high	91.2	Very high	50 Å²	50	44.4 Å²	44.4	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.2	178.7	173.3	-91.6	0	0	0	111.4	K76 Y77 D78 H98 H106	K76-Y96 HydrophobicContact CB-CE2 4.4Å; K76-Y96 HydrophobicContact CD-CE2 4.19Å; Y77-Y96 CarbonylContact O-C 3.58Å; Y77-Y96 WeakPolarHBondContact O-CA 3.22Å; D78-Y96 HydrophobicContact CB-CD2 3.78Å; D78-Y96 HydrophobicContact CB-CE2 4.39Å; Y96-H98 AromaticContact CE1-NE2 3.94Å; Y96-H98 AromaticContact CZ-NE2 3.77Å; Y96-H98 PolarHBondContact OH-CE1 3.15Å; Y96-H98 PolarHBondContact OH-NE2 3.5Å; Y96-H106 HydrophobicContact CD1-CB 4.12Å; Y96-H106 AromaticContact CD1-CD2 3.85Å; Y96-H106 PolarHBondContact N-O 3.06Å; Y96-H106 WeakPolarHBondContact O-CA 3.07Å; Y96-H106 WeakPolarHBondContact O-CB 3.49Å; Y96-H106 PolarHBondContact O-N 2.7Å
97	F	95.7	Very high	91.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	159.8	168.3	58.2	-82.6	0	0	0	111.7	M72 K76 Y77 I95 I104 L105 T128 V130 F137 V139	M72-F97 HydrophobicContact CE-CD2 4.48Å; M72-F97 HydrophobicContact CE-CE2 4.12Å; M72-F97 HydrophobicContact SD-CD2 4.25Å; M72-F97 HydrophobicContact SD-CE2 3.47Å; M72-F97 WeakPolarHBondContact SD-CE2 3.3Å; M72-F97 HydrophobicContact SD-CZ 4.12Å; K76-F97 CarbonylContact C-O 3.46Å; K76-F97 WeakPolarHBondContact CA-O 3.01Å; Y77-F97 VanDerWaalsContact CB-CE1 3.44Å; Y77-F97 VanDerWaalsContact CB-CZ 3.46Å; Y77-F97 HydrophobicContact CD1-CD1 4.02Å; Y77-F97 AromaticContact CD1-CE1 3.39Å; Y77-F97 HydrophobicContact CD1-CE1 3.39Å; Y77-F97 HydrophobicContact CD1-CZ 4.09Å; Y77-F97 HydrophobicContact CD2-CE1 4.31Å; Y77-F97 HydrophobicContact CD2-CZ 4.2Å; Y77-F97 HydrophobicContact CE1-CE1 4.19Å; Y77-F97 HydrophobicContact CG-CD1 4.24Å; Y77-F97 AromaticContact CG-CE1 3.46Å; Y77-F97 HydrophobicContact CG-CE1 3.46Å; Y77-F97 VanDerWaalsContact CG-CE1 3.46Å; Y77-F97 AromaticContact CG-CZ 3.67Å; Y77-F97 HydrophobicContact CG-CZ 3.67Å; Y77-F97 PolarHBondContact N-O 3.24Å; Y77-F97 PolarHBondContact O-N 3.37Å; I95-F97 HydrophobicContact CG2-CD1 3.99Å; I95-F97 HydrophobicContact CG2-CE1 4.25Å; F97-I104 WeakPolarHBondContact CB-O 3.16Å; F97-L105 HydrophobicContact CB-CD2 4.01Å; F97-L105 HydrophobicContact CD1-CD2 3.32Å; F97-L105 HydrophobicContact CD2-CD2 4.29Å; F97-L105 HydrophobicContact CE1-CD2 3.77Å; F97-L105 HydrophobicContact CG-CD2 3.63Å; F97-L105 HydrophobicContact CZ-CD2 4.41Å; F97-T128 HydrophobicContact CE2-CG2 4Å; F97-V130 HydrophobicContact CE2-CG2 4.3Å; F97-V130 HydrophobicContact CZ-CG2 3.78Å; F97-F137 AromaticContact CE1-CZ 3.94Å; F97-F137 HydrophobicContact CE1-CZ 3.94Å; F97-F137 HydrophobicContact CZ-CZ 4.48Å; F97-V139 HydrophobicContact CE1-CG2 4.15Å; F97-V139 HydrophobicContact CZ-CG2 3.91Å
98	H	92.2	Very high	91.4	Very high	34 Å²	34	43.3 Å²	43.3	16%	0.157	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	150.2	170.6	-70.3	-81.4	0	0	0	111.1	Y75 Y96 L101	Y75-H98 AromaticContact CD1-ND1 3.9Å; Y75-H98 AromaticContact CE1-CE1 3.73Å; Y75-H98 AromaticContact CE1-ND1 3.29Å; Y75-H98 VanDerWaalsContact CE1-ND1 3.29Å; Y75-H98 WeakPolarHBondContact CE1-ND1 3.18Å; Y75-H98 AromaticContact CZ-ND1 3.79Å; Y96-H98 AromaticContact CE1-NE2 3.94Å; Y96-H98 AromaticContact CZ-NE2 3.77Å; Y96-H98 PolarHBondContact OH-CE1 3.15Å; Y96-H98 PolarHBondContact OH-NE2 3.5Å; H98-L101 HydrophobicContact CB-CB 4.35Å
99	K	86.7	Confident	91.4	Very high	58 Å²	58	42.8 Å²	42.8	25%	0.252	22%	0.223	S	C	.	.	S	Bend	trans	-61.1	-46.4	175	-165.9	-174.9	163.9	165.1	0	111.8	M72 Y75 T128	M72-K99 HydrophobicContact CB-CG 4.35Å; M72-K99 HydrophobicContact CE-CB 4.05Å; M72-K99 HydrophobicContact CG-CG 4.27Å; M72-K99 WeakPolarHBondContact O-CD 3.43Å; M72-K99 WeakPolarHBondContact O-CE 3.46Å; M72-K99 PolarHBondContact O-NZ 3.36Å; M72-K99 HydrophobicContact SD-CB 4.12Å; M72-K99 HydrophobicContact SD-CG 4.17Å; Y75-K99 WeakPolarHBondContact O-CB 3.5Å; Y75-K99 PolarHBondContact O-N 3.27Å; K99-T128 PolarHBondContact O-OG1 3.35Å; K99-T128 VanDerWaalsContact O-OG1 3.12Å
100	N	81.9	Confident	91.4	Very high	72 Å²	72	51 Å²	51	39%	0.385	24%	0.235	S	C	.	.	S	Bend	trans	-129.2	-27.3	-167	-64.7	-3.2	0	0	0	117.5	Y123 I126	N100-Y123 PolarHBondContact O-OH 3.07Å; N100-I126 VanDerWaalsContact CA-CG2 3.49Å; N100-I126 HydrophobicContact CB-CG2 3.83Å; N100-I126 PolarHBondContact OD1-O 2.93Å
101	L	76.3	Confident	91.4	Very high	110 Å²	110	52 Å²	52	58%	0.576	25%	0.245	S	C	*	.	S	Bend	trans	-77.4	-41.2	-169.9	-80.4	-172	0	0	0	114.1	Y75 H98 Y123	Y75-L101 WeakPolarHBondContact OH-CD1 3.4Å; Y75-L101 WeakPolarHBondContact OH-CG 3.11Å; H98-L101 HydrophobicContact CB-CB 4.35Å; L101-Y123 PolarHBondContact O-OH 3Å
102	Q	81.6	Confident	91.4	Very high	106 Å²	106	51.4 Å²	51.4	50%	0.495	24%	0.24	S	C	.	.			trans	-147.2	108.9	-177.8	-71.2	-174.9	-16.7	0	0	107.7	I104	Q102-I104 PolarHBondContact O-N 3.34Å
103	P	87.9	Confident	91.2	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.039	24%	0.242	C	C	.	.			trans	-76.4	41.4	-178.5	32.7	-38	0	0	0	112.2	Y119 Y123 I126 R141 F143	P103-Y119 HydrophobicContact CB-CG 4.45Å; P103-Y119 HydrophobicContact CG-CD1 4.08Å; P103-Y119 HydrophobicContact CG-CD2 3.94Å; P103-Y119 HydrophobicContact CG-CG 3.52Å; P103-Y123 WeakPolarHBondContact CD-OH 3.11Å; P103-Y123 HydrophobicContact CG-CE1 4.16Å; P103-I126 HydrophobicContact CB-CD1 3.82Å; P103-R141 PolarHBondContact O-NH1 3.25Å; P103-F143 HydrophobicContact CB-CE1 3.96Å; P103-F143 HydrophobicContact CB-CZ 4.14Å; P103-F143 HydrophobicContact CG-CE1 4Å; P103-F143 HydrophobicContact CG-CZ 4.47Å
104	I	95.2	Very high	91.3	Very high	24 Å²	24	50.5 Å²	50.5	12%	0.123	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.2	-179.7	-62.3	177.3	0	0	0	108	F97 Q102 H106 N115 Y119	F97-I104 WeakPolarHBondContact CB-O 3.16Å; Q102-I104 PolarHBondContact O-N 3.34Å; I104-H106 PolarHBondContact O-CD2 3.38Å; I104-N115 HydrophobicContact CG2-CB 3.4Å; I104-N115 VanDerWaalsContact CG2-CB 3.4Å; I104-N115 WeakPolarHBondContact CG2-ND2 3.47Å; I104-Y119 HydrophobicContact CG1-CE1 4.39Å
105	L	96.7	Very high	91.4	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.3	172.4	-59.7	173.1	0	0	0	108.6	I95 F97 I107 N115 I116 V139 T158	I95-L105 HydrophobicContact CG2-CD2 4.44Å; F97-L105 HydrophobicContact CB-CD2 4.01Å; F97-L105 HydrophobicContact CD1-CD2 3.32Å; F97-L105 HydrophobicContact CD2-CD2 4.29Å; F97-L105 HydrophobicContact CE1-CD2 3.77Å; F97-L105 HydrophobicContact CG-CD2 3.63Å; F97-L105 HydrophobicContact CZ-CD2 4.41Å; L105-I107 HydrophobicContact CB-CD1 4.37Å; L105-N115 CarbonylContact O-C 3.5Å; L105-N115 WeakPolarHBondContact O-CA 3.35Å; L105-N115 WeakPolarHBondContact O-CB 3.41Å; L105-I116 HydrophobicContact CB-CB 4.14Å; L105-I116 HydrophobicContact CD1-CB 4.34Å; L105-I116 HydrophobicContact CD1-CG2 4.35Å; L105-I116 PolarHBondContact N-O 2.84Å; L105-I116 PolarHBondContact O-N 3.48Å; L105-V139 HydrophobicContact CD2-CG2 3.96Å; L105-T158 HydrophobicContact CD1-CG2 3.81Å
106	H	96.7	Very high	91.5	Very high	34 Å²	34	48.1 Å²	48.1	16%	0.157	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.2	176.1	-59.9	-100.7	0	0	0	109.9	Y96 I104 F108 Y112	Y96-H106 HydrophobicContact CD1-CB 4.12Å; Y96-H106 AromaticContact CD1-CD2 3.85Å; Y96-H106 PolarHBondContact N-O 3.06Å; Y96-H106 WeakPolarHBondContact O-CA 3.07Å; Y96-H106 WeakPolarHBondContact O-CB 3.49Å; Y96-H106 PolarHBondContact O-N 2.7Å; I104-H106 PolarHBondContact O-CD2 3.38Å; H106-F108 HydrophobicContact CB-CD2 4.31Å; H106-F108 HydrophobicContact CB-CE2 3.55Å; H106-F108 HydrophobicContact CB-CZ 4.32Å; H106-Y112 HydrophobicContact CB-CE2 3.92Å; H106-Y112 AromaticContact ND1-CE2 3.76Å; H106-Y112 AromaticContact ND1-CZ 3.95Å
107	I	96.2	Very high	91.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.1	-175.5	-48.7	-57.5	0	0	0	108.9	F87 V92 I95 L105 I113 R114 I116	F87-I107 HydrophobicContact CB-CG2 4.21Å; F87-I107 HydrophobicContact CD1-CB 4.12Å; F87-I107 HydrophobicContact CD1-CG1 4.27Å; F87-I107 HydrophobicContact CD1-CG2 3.95Å; F87-I107 HydrophobicContact CE1-CB 4.41Å; F87-I107 HydrophobicContact CE1-CG1 4.26Å; F87-I107 HydrophobicContact CG-CG2 4.26Å; V92-I107 HydrophobicContact CB-CG2 4.2Å; V92-I107 HydrophobicContact CG1-CG2 3.63Å; V92-I107 HydrophobicContact CG2-CG2 3.46Å; V92-I107 VanDerWaalsContact CG2-CG2 3.46Å; I95-I107 HydrophobicContact CD1-CD1 3.98Å; I95-I107 HydrophobicContact CG1-CD1 3.9Å; I95-I107 HydrophobicContact CG2-CD1 4.37Å; L105-I107 HydrophobicContact CB-CD1 4.37Å; I107-I113 HydrophobicContact CG2-CD1 4.16Å; I107-I113 WeakPolarHBondContact O-CB 3.46Å; I107-I113 PolarHBondContact O-N 3.42Å; I107-R114 PolarHBondContact N-O 3.25Å; I107-I116 HydrophobicContact CD1-CD1 4.01Å; I107-I116 HydrophobicContact CD1-CG1 4.43Å; I107-I116 HydrophobicContact CG1-CD1 4.15Å; I107-I116 HydrophobicContact CG1-CG1 4.17Å
108	F	95.4	Very high	91.6	Very high	42 Å²	42	46.5 Å²	46.5	18%	0.184	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.7	-178.1	-66.7	-102.5	0	0	0	110.7	K93 K94 H106 S111 Y112	K93-F108 PolarHBondContact N-O 3.36Å; K94-F108 HydrophobicContact CD-CB 4.16Å; K94-F108 HydrophobicContact CD-CG 4.34Å; K94-F108 HydrophobicContact CG-CB 3.47Å; K94-F108 VanDerWaalsContact CG-CB 3.47Å; K94-F108 HydrophobicContact CG-CD2 4.18Å; K94-F108 HydrophobicContact CG-CG 4.03Å; K94-F108 PolarHBondContact N-O 3.04Å; K94-F108 VanDerWaalsContact N-O 3.14Å; K94-F108 PolarHBondContact O-N 2.85Å; H106-F108 HydrophobicContact CB-CD2 4.31Å; H106-F108 HydrophobicContact CB-CE2 3.55Å; H106-F108 HydrophobicContact CB-CZ 4.32Å; F108-S111 WeakPolarHBondContact CA-O 3.48Å; F108-Y112 VanDerWaalsContact CD1-CA 3.48Å; F108-Y112 HydrophobicContact CD1-CD2 4.09Å; F108-Y112 HydrophobicContact CD2-CD2 4.35Å; F108-Y112 AromaticContact CE1-CD2 3.7Å; F108-Y112 HydrophobicContact CE1-CD2 3.7Å; F108-Y112 HydrophobicContact CE1-CG 4.09Å; F108-Y112 AromaticContact CE2-CD2 3.98Å; F108-Y112 HydrophobicContact CE2-CD2 3.98Å; F108-Y112 HydrophobicContact CE2-CE2 4.47Å; F108-Y112 HydrophobicContact CG-CD2 4.39Å; F108-Y112 AromaticContact CZ-CD2 3.64Å; F108-Y112 HydrophobicContact CZ-CD2 3.64Å; F108-Y112 HydrophobicContact CZ-CE2 4.36Å; F108-Y112 HydrophobicContact CZ-CG 4.39Å
109	G	92.3	Very high	91.8	Very high	7 Å²	7	46.8 Å²	46.8	7%	0.072	22%	0.22	C	C	.	.	S	Bend	trans	-93.7	-121.9	161.7	0	0	0	0	0	109	H91 S111	H91-G109 VanDerWaalsContact O-CA 3.27Å; H91-G109 WeakPolarHBondContact O-CA 3.46Å; G109-S111 PolarHBondContact N-O 3.48Å
110	W	88.8	Confident	92.1	Very high	233 Å²	233	44 Å²	44	88%	0.883	21%	0.208	S	C	*	.	S	Bend	trans	-70.3	-36	165.5	-72.9	115	0	0	0	112.5	K93	K93-W110 HydrophobicContact CD-CD2 4.3Å; K93-W110 HydrophobicContact CD-CE3 4.34Å; K93-W110 VanDerWaalsContact NZ-CD2 3.28Å; K93-W110 VanDerWaalsContact NZ-CE3 3.29Å
111	S	90.3	Very high	92.6	Very high	84 Å²	84	45.4 Å²	45.4	59%	0.587	21%	0.21	S	C	*	.	S	Bend	trans	-118.2	173.8	171.9	61.1	0	0	0	0	110	F108 G109 I113	F108-S111 WeakPolarHBondContact CA-O 3.48Å; G109-S111 PolarHBondContact N-O 3.48Å; S111-I113 PolarHBondContact O-N 3.3Å
112	Y	92.4	Very high	93.3	Very high	83 Å²	83	49.4 Å²	49.4	33%	0.325	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	123.2	167.6	-178.5	-125.6	0	0	0	109.5	H106 F108 R114 N115	H106-Y112 HydrophobicContact CB-CE2 3.92Å; H106-Y112 AromaticContact ND1-CE2 3.76Å; H106-Y112 AromaticContact ND1-CZ 3.95Å; F108-Y112 VanDerWaalsContact CD1-CA 3.48Å; F108-Y112 HydrophobicContact CD1-CD2 4.09Å; F108-Y112 HydrophobicContact CD2-CD2 4.35Å; F108-Y112 AromaticContact CE1-CD2 3.7Å; F108-Y112 HydrophobicContact CE1-CD2 3.7Å; F108-Y112 HydrophobicContact CE1-CG 4.09Å; F108-Y112 AromaticContact CE2-CD2 3.98Å; F108-Y112 HydrophobicContact CE2-CD2 3.98Å; F108-Y112 HydrophobicContact CE2-CE2 4.47Å; F108-Y112 HydrophobicContact CG-CD2 4.39Å; F108-Y112 AromaticContact CZ-CD2 3.64Å; F108-Y112 HydrophobicContact CZ-CD2 3.64Å; F108-Y112 HydrophobicContact CZ-CE2 4.36Å; F108-Y112 HydrophobicContact CZ-CG 4.39Å; Y112-R114 WeakPolarHBondContact CE2-O 3.48Å; Y112-N115 PolarHBondContact OH-ND2 3.32Å
113	I	91.9	Very high	93.8	Very high	14 Å²	14	47.1 Å²	47.1	7%	0.072	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-79.7	174.7	-60.8	164	0	0	0	106	F87 T90 V92 I107 S111	F87-I113 HydrophobicContact CD1-CG2 3.87Å; F87-I113 HydrophobicContact CE1-CG2 4.41Å; T90-I113 HydrophobicContact CG2-CD1 3.6Å; T90-I113 HydrophobicContact CG2-CG1 3.84Å; V92-I113 HydrophobicContact CG2-CD1 4.05Å; I107-I113 HydrophobicContact CG2-CD1 4.16Å; I107-I113 WeakPolarHBondContact O-CB 3.46Å; I107-I113 PolarHBondContact O-N 3.42Å; S111-I113 PolarHBondContact O-N 3.3Å
114	R	94.3	Very high	94.1	Very high	37 Å²	37	51.1 Å²	51.1	14%	0.14	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	-147.3	177.2	-81	-40.5	-178.1	-104.2	6.5	109.6	F87 I107 Y112 F187 Q189 N198	F87-R114 HydrophobicContact CE1-CB 4.43Å; I107-R114 PolarHBondContact N-O 3.25Å; Y112-R114 WeakPolarHBondContact CE2-O 3.48Å; R114-F187 HydrophobicContact CB-CB 4.48Å; R114-F187 HydrophobicContact CB-CD1 3.8Å; R114-F187 HydrophobicContact CB-CG 4.44Å; R114-F187 WeakPolarHBondContact CB-O 3.24Å; R114-F187 VanDerWaalsContact CD-CE1 3.49Å; R114-F187 HydrophobicContact CG-CD1 3.63Å; R114-F187 HydrophobicContact CG-CE1 4.03Å; R114-F187 HydrophobicContact CG-CG 4.43Å; R114-Q189 HydrophobicContact CG-CB 4.31Å; R114-N198 PolarHBondContact NE-OD1 3.02Å; R114-N198 PolarHBondContact NH2-OD1 3.17Å; R114-N198 VanDerWaalsContact NH2-OD1 3.08Å
115	N	96	Very high	94.1	Very high	16 Å²	16	54.9 Å²	54.9	9%	0.086	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	163.2	-171.4	50.5	18.6	0	0	0	113.5	I104 L105 Y112 H117 F187	I104-N115 HydrophobicContact CG2-CB 3.4Å; I104-N115 VanDerWaalsContact CG2-CB 3.4Å; I104-N115 WeakPolarHBondContact CG2-ND2 3.47Å; L105-N115 CarbonylContact O-C 3.5Å; L105-N115 WeakPolarHBondContact O-CA 3.35Å; L105-N115 WeakPolarHBondContact O-CB 3.41Å; Y112-N115 PolarHBondContact OH-ND2 3.32Å; N115-H117 PolarHBondContact ND2-NE2 3Å; N115-H117 PolarHBondContact OD1-CD2 3.14Å; N115-H117 PolarHBondContact OD1-NE2 3.01Å; N115-F187 VanDerWaalsContact O-CB 3.3Å; N115-F187 WeakPolarHBondContact O-CB 3.46Å; N115-F187 PolarHBondContact O-N 3.18Å; N115-F187 WeakPolarHBondContact OD1-CB 3.39Å; N115-F187 WeakPolarHBondContact OD1-CD1 3.31Å; N115-F187 WeakPolarHBondContact OD1-CG 3.43Å
116	I	97.8	Very high	94	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.2	174.2	-61.4	171.3	0	0	0	107	F87 L105 I107 T158 I160 V166 F168 I186	F87-I116 HydrophobicContact CE2-CD1 4.07Å; F87-I116 HydrophobicContact CE2-CG1 3.96Å; F87-I116 HydrophobicContact CZ-CD1 4.41Å; F87-I116 HydrophobicContact CZ-CG1 3.87Å; L105-I116 HydrophobicContact CB-CB 4.14Å; L105-I116 HydrophobicContact CD1-CB 4.34Å; L105-I116 HydrophobicContact CD1-CG2 4.35Å; L105-I116 PolarHBondContact N-O 2.84Å; L105-I116 PolarHBondContact O-N 3.48Å; I107-I116 HydrophobicContact CD1-CD1 4.01Å; I107-I116 HydrophobicContact CD1-CG1 4.43Å; I107-I116 HydrophobicContact CG1-CD1 4.15Å; I107-I116 HydrophobicContact CG1-CG1 4.17Å; I116-T158 HydrophobicContact CG2-CG2 4.11Å; I116-I160 HydrophobicContact CD1-CD1 3.84Å; I116-I160 HydrophobicContact CD1-CG1 4.44Å; I116-V166 HydrophobicContact CD1-CG1 4.07Å; I116-V166 HydrophobicContact CD1-CG2 4.06Å; I116-V166 HydrophobicContact CG2-CG1 4.34Å; I116-F168 HydrophobicContact CG2-CE1 3.46Å; I116-F168 VanDerWaalsContact CG2-CE1 3.46Å; I116-F168 HydrophobicContact CG2-CZ 3.59Å; I116-I186 HydrophobicContact CG1-CG2 4.3Å; I116-I186 HydrophobicContact CG2-CG2 4.38Å
117	H	96.8	Very high	93.9	Very high	14 Å²	14	57.7 Å²	57.7	7%	0.065	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130	-176.7	-62.2	-147.8	0	0	0	107.5	N115 Y119 F168 K183 S184 E185	N115-H117 PolarHBondContact ND2-NE2 3Å; N115-H117 PolarHBondContact OD1-CD2 3.14Å; N115-H117 PolarHBondContact OD1-NE2 3.01Å; H117-Y119 HydrophobicContact CB-CD1 4.13Å; H117-Y119 HydrophobicContact CB-CE1 3.93Å; H117-Y119 AromaticContact ND1-CE1 3.69Å; H117-F168 WeakPolarHBondContact O-CZ 3.22Å; H117-K183 CarbonylContact C-O 3.57Å; H117-S184 CarbonylContact O-C 3.52Å; H117-S184 VanDerWaalsContact O-CA 3.26Å; H117-S184 WeakPolarHBondContact O-CA 3.23Å; H117-E185 HydrophobicContact CB-CG 3.86Å; H117-E185 IonicContact CE1-OE1 3.91Å; H117-E185 PolarHBondContact N-O 3.24Å; H117-E185 IonicContact ND1-OE1 3.64Å; H117-E185 PolarHBondContact O-N 3.23Å
118	N	96.9	Very high	93.9	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	85.7	169.2	-170.1	22.5	0	0	0	107.3	T157 T158 F168 K183 S184	N118-T157 PolarHBondContact ND2-O 2.02Å; N118-T158 VanDerWaalsContact CB-OG1 3.28Å; N118-T158 WeakPolarHBondContact CB-OG1 3.32Å; N118-T158 PolarHBondContact ND2-OG1 3.43Å; N118-F168 HydrophobicContact CB-CD1 4.25Å; N118-F168 HydrophobicContact CB-CE1 4.25Å; N118-F168 HydrophobicContact CB-CG 4.5Å; N118-F168 HydrophobicContact CB-CZ 4.48Å; N118-K183 WeakPolarHBondContact CA-O 3.49Å; N118-S184 PolarHBondContact OD1-OG 2.97Å
119	Y	95.3	Very high	93.9	Very high	41 Å²	41	56.1 Å²	56.1	16%	0.161	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	158.3	-174.7	68.9	-88.2	0	0	0	112.4	P103 I104 H117 K121 L182 K183	P103-Y119 HydrophobicContact CB-CG 4.45Å; P103-Y119 HydrophobicContact CG-CD1 4.08Å; P103-Y119 HydrophobicContact CG-CD2 3.94Å; P103-Y119 HydrophobicContact CG-CG 3.52Å; I104-Y119 HydrophobicContact CG1-CE1 4.39Å; H117-Y119 HydrophobicContact CB-CD1 4.13Å; H117-Y119 HydrophobicContact CB-CE1 3.93Å; H117-Y119 AromaticContact ND1-CE1 3.69Å; Y119-K121 HydrophobicContact CE2-CG 4.4Å; Y119-L182 CarbonylContact O-C 3.59Å; Y119-L182 WeakPolarHBondContact O-CA 3.32Å; Y119-K183 HydrophobicContact CE1-CB 4.08Å; Y119-K183 HydrophobicContact CE1-CD 4.45Å; Y119-K183 HydrophobicContact CE1-CG 4.31Å; Y119-K183 HydrophobicContact CE2-CB 4.36Å; Y119-K183 PolarHBondContact N-O 2.81Å; Y119-K183 VanDerWaalsContact N-O 3.11Å; Y119-K183 PolarHBondContact O-N 3.48Å
120	I	94.6	Very high	94.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	140.1	170.6	-164.2	169.8	0	0	0	111	Y123 F143 I145 T154 I177 Q181 L182	I120-Y123 VanDerWaalsContact O-CD1 3.3Å; I120-Y123 WeakPolarHBondContact O-CD1 3.28Å; I120-F143 HydrophobicContact CG2-CB 3.44Å; I120-F143 VanDerWaalsContact CG2-CB 3.44Å; I120-F143 HydrophobicContact CG2-CD1 3.92Å; I120-F143 HydrophobicContact CG2-CD2 4.18Å; I120-F143 HydrophobicContact CG2-CG 3.61Å; I120-I145 HydrophobicContact CD1-CD1 3.75Å; I120-I145 HydrophobicContact CD1-CG2 4.32Å; I120-I145 HydrophobicContact CG1-CD1 4.24Å; I120-T154 HydrophobicContact CB-CG2 4.13Å; I120-T154 HydrophobicContact CD1-CG2 3.83Å; I120-T154 HydrophobicContact CG2-CG2 3.88Å; I120-I177 HydrophobicContact CD1-CD1 3.88Å; I120-I177 HydrophobicContact CD1-CG2 3.59Å; I120-Q181 HydrophobicContact CD1-CB 4.44Å; I120-Q181 HydrophobicContact CG1-CB 4.15Å; I120-L182 HydrophobicContact CB-CG 4.09Å; I120-L182 HydrophobicContact CD1-CD1 4.16Å; I120-L182 HydrophobicContact CD1-CG 4.49Å; I120-L182 HydrophobicContact CG1-CD1 4.23Å; I120-L182 HydrophobicContact CG1-CG 4.12Å
121	K	92.2	Very high	94.4	Very high	100 Å²	100	45.9 Å²	45.9	44%	0.435	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	154.9	174	-62.9	165.3	-170.7	160.9	0	110.2	Y119 Y123 S180 Q181	Y119-K121 HydrophobicContact CE2-CG 4.4Å; K121-Y123 VanDerWaalsContact C-N 3.26Å; K121-Y123 PolarHBondContact O-N 3.13Å; K121-S180 PolarHBondContact NZ-O 3.22Å; K121-Q181 WeakPolarHBondContact CB-O 3.05Å; K121-Q181 WeakPolarHBondContact CG-O 3.36Å; K121-Q181 PolarHBondContact N-O 2.92Å
122	K	89.9	Confident	94.6	Very high	195 Å²	195	44 Å²	44	85%	0.848	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	29.6	173.4	-54.1	-179.8	178.5	179.5	0	115.1
123	Y	93.3	Very high	94.7	Very high	58 Å²	58	43.1 Å²	43.1	23%	0.227	20%	0.202	C	C	.	.			trans	-65.2	149.5	171.3	65.6	-87.2	0	0	0	111.3	N100 L101 P103 I120 K121 I126 F143 S144	N100-Y123 PolarHBondContact O-OH 3.07Å; L101-Y123 PolarHBondContact O-OH 3Å; P103-Y123 WeakPolarHBondContact CD-OH 3.11Å; P103-Y123 HydrophobicContact CG-CE1 4.16Å; I120-Y123 VanDerWaalsContact O-CD1 3.3Å; I120-Y123 WeakPolarHBondContact O-CD1 3.28Å; K121-Y123 VanDerWaalsContact C-N 3.26Å; K121-Y123 PolarHBondContact O-N 3.13Å; Y123-I126 HydrophobicContact CD2-CB 4.15Å; Y123-I126 HydrophobicContact CD2-CG2 4.27Å; Y123-I126 HydrophobicContact CE2-CB 4.1Å; Y123-I126 HydrophobicContact CE2-CG2 3.77Å; Y123-F143 HydrophobicContact CD1-CD1 4.2Å; Y123-F143 HydrophobicContact CD2-CD1 4.47Å; Y123-F143 HydrophobicContact CG-CD1 4.02Å; Y123-S144 CarbonylContact C-O 3.57Å; Y123-S144 WeakPolarHBondContact CA-O 3.12Å; Y123-S144 WeakPolarHBondContact CB-O 3.34Å
124	T	93.9	Very high	94.8	Very high	90 Å²	90	50.2 Å²	50.2	55%	0.552	23%	0.232	S	C	*	.	S	Bend	trans	-96.1	-35.4	175.6	53.9	0	0	0	0	111.7	S144	T124-S144 PolarHBondContact N-O 3.4Å; T124-S144 PolarHBondContact OG1-O 3.42Å; T124-S144 VanDerWaalsContact OG1-O 3.13Å
125	K	94.2	Very high	94.7	Very high	103 Å²	103	55 Å²	55	45%	0.448	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151	-179.3	-175.3	-175.9	169	-159.2	0	109.8	E127 F143 S144	K125-E127 VanDerWaalsContact CE-OE1 3.25Å; K125-E127 WeakPolarHBondContact CE-OE1 3.24Å; K125-E127 IonicContact NZ-OE1 3.44Å; K125-E127 PolarHBondContact NZ-OE1 3.03Å; K125-F143 WeakPolarHBondContact O-CA 3.48Å; K125-S144 PolarHBondContact O-N 3.39Å
126	I	94.5	Very high	94.8	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.041	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	135.1	176	178.9	-179.5	0	0	0	109.5	N100 P103 Y123 R141 N142 F143	N100-I126 VanDerWaalsContact CA-CG2 3.49Å; N100-I126 HydrophobicContact CB-CG2 3.83Å; N100-I126 PolarHBondContact OD1-O 2.93Å; P103-I126 HydrophobicContact CB-CD1 3.82Å; Y123-I126 HydrophobicContact CD2-CB 4.15Å; Y123-I126 HydrophobicContact CD2-CG2 4.27Å; Y123-I126 HydrophobicContact CE2-CB 4.1Å; Y123-I126 HydrophobicContact CE2-CG2 3.77Å; I126-R141 HydrophobicContact CD1-CG 4.17Å; I126-R141 HydrophobicContact CG1-CG 4.46Å; I126-N142 CarbonylContact C-O 3.57Å; I126-N142 WeakPolarHBondContact CA-O 3.1Å; I126-F143 HydrophobicContact CB-CD1 4.2Å; I126-F143 HydrophobicContact CD1-CD1 4.06Å; I126-F143 HydrophobicContact CD1-CE1 3.53Å; I126-F143 HydrophobicContact CD1-CZ 4.16Å; I126-F143 HydrophobicContact CG1-CD1 4.02Å; I126-F143 HydrophobicContact CG1-CE1 3.98Å
127	E	94.4	Very high	94.7	Very high	86 Å²	86	55.4 Å²	55.4	40%	0.402	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.5	169.3	-63.1	178.1	173.8	0	0	108.4	K125 R141 N142	K125-E127 VanDerWaalsContact CE-OE1 3.25Å; K125-E127 WeakPolarHBondContact CE-OE1 3.24Å; K125-E127 IonicContact NZ-OE1 3.44Å; K125-E127 PolarHBondContact NZ-OE1 3.03Å; E127-R141 VanDerWaalsContact O-CA 3.27Å; E127-R141 WeakPolarHBondContact O-CA 3.43Å; E127-N142 HydrophobicContact CB-CB 4.34Å; E127-N142 PolarHBondContact N-O 2.98Å; E127-N142 PolarHBondContact O-N 2.85Å
128	T	95.9	Very high	94.7	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.018	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	122.1	-174.7	-60.5	0	0	0	0	110.4	M72 F97 K99 V130 V139 K140 R141	M72-T128 VanDerWaalsContact CB-O 3.31Å; M72-T128 WeakPolarHBondContact CB-O 3.27Å; M72-T128 PolarHBondContact N-O 3.2Å; M72-T128 HydrophobicContact SD-CG2 4.3Å; F97-T128 HydrophobicContact CE2-CG2 4Å; K99-T128 PolarHBondContact O-OG1 3.35Å; K99-T128 VanDerWaalsContact O-OG1 3.12Å; T128-V130 HydrophobicContact CG2-CG2 4.37Å; T128-V139 HydrophobicContact CG2-CG1 3.72Å; T128-K140 WeakPolarHBondContact CA-O 3.12Å; T128-R141 HydrophobicContact CG2-CG 4.11Å
129	G	95.8	Very high	94.7	Very high	6 Å²	6	54.7 Å²	54.7	6%	0.062	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	143.9	168.3	0	0	0	0	0	111.2	K70 V139 K140	K70-G129 CarbonylContact O-C 3.54Å; K70-G129 WeakPolarHBondContact O-CA 3.29Å; G129-V139 WeakPolarHBondContact O-CA 3.47Å; G129-K140 PolarHBondContact N-O 3.32Å; G129-K140 PolarHBondContact O-N 2.02Å
130	V	96.2	Very high	94.8	Very high	17 Å²	17	53.9 Å²	53.9	10%	0.103	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.9	-178	-178.9	0	0	0	0	110.6	K70 M72 Y77 F97 T128 F137 G138	K70-V130 PolarHBondContact N-O 3.33Å; K70-V130 PolarHBondContact O-N 3.4Å; M72-V130 HydrophobicContact CB-CG2 4.23Å; M72-V130 HydrophobicContact SD-CG2 4.27Å; Y77-V130 HydrophobicContact CD2-CG1 4.27Å; Y77-V130 HydrophobicContact CE2-CG1 3.87Å; F97-V130 HydrophobicContact CE2-CG2 4.3Å; F97-V130 HydrophobicContact CZ-CG2 3.78Å; T128-V130 HydrophobicContact CG2-CG2 4.37Å; V130-F137 HydrophobicContact CG1-CE2 3.83Å; V130-F137 HydrophobicContact CG1-CZ 4.43Å; V130-G138 WeakPolarHBondContact CA-O 3.49Å
131	L	95.9	Very high	94.9	Very high	8 Å²	8	54 Å²	54	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.5	168.9	-177.8	73.4	0	0	0	107.9	V64 R68 F69 E133 L136 F137 G138	V64-L131 HydrophobicContact CG1-CD2 3.87Å; R68-L131 HydrophobicContact CB-CD1 4.05Å; R68-L131 WeakPolarHBondContact O-CD1 3.34Å; F69-L131 HydrophobicContact CD1-CB 3.88Å; F69-L131 HydrophobicContact CE1-CB 3.89Å; L131-E133 HydrophobicContact CD1-CG 3.84Å; L131-E133 WeakPolarHBondContact CD1-OE1 3.45Å; L131-E133 HydrophobicContact CG-CG 4.04Å; L131-L136 HydrophobicContact CD2-CD2 3.94Å; L131-L136 HydrophobicContact CD2-CG 4.31Å; L131-F137 CarbonylContact O-C 3.59Å; L131-F137 WeakPolarHBondContact O-CA 3.35Å; L131-F137 VanDerWaalsContact O-CD2 3.23Å; L131-F137 WeakPolarHBondContact O-CD2 3.45Å; L131-G138 PolarHBondContact N-O 3.47Å; L131-G138 PolarHBondContact O-N 2.87Å
132	D	94.8	Very high	95.1	Very high	43 Å²	43	51.8 Å²	51.8	23%	0.23	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	94	-178.5	-177	0.6	0	0	0	108.7	Y77 Q82 F137	Y77-D132 PolarHBondContact OH-OD2 3.35Å; Q82-D132 PolarHBondContact NE2-O 3.21Å; D132-F137 HydrophobicContact CB-CD2 4.23Å
133	E	94	Very high	95.4	Very high	65 Å²	65	42.5 Å²	42.5	30%	0.304	21%	0.205	S	C	.	.			trans	-122	176.2	-174.2	-61	-175.3	154.5	0	0	111.4	R68 F83 L131 E135 L136	R68-E133 IonicContact CZ-OE1 3.76Å; R68-E133 IonicContact CZ-OE2 3.52Å; R68-E133 IonicContact NE-OE1 2.71Å; R68-E133 IonicContact NH2-OE1 3.89Å; R68-E133 PolarHBondContact NH2-OE1 3.4Å; R68-E133 IonicContact NH2-OE2 2.61Å; R68-E133 PolarHBondContact NH2-OE2 2.92Å; F83-E133 WeakPolarHBondContact CD1-O 3.34Å; F83-E133 WeakPolarHBondContact CE1-O 3.44Å; L131-E133 HydrophobicContact CD1-CG 3.84Å; L131-E133 WeakPolarHBondContact CD1-OE1 3.45Å; L131-E133 HydrophobicContact CG-CG 4.04Å; E133-E135 VanDerWaalsContact C-N 3.27Å; E133-E135 PolarHBondContact O-N 3.41Å; E133-L136 WeakPolarHBondContact CB-O 3.24Å; E133-L136 PolarHBondContact N-O 3.05Å
134	K	93.5	Very high	95.5	Very high	164 Å²	164	40.3 Å²	40.3	71%	0.713	20%	0.198	S	C	*	.	S	Bend	trans	-60.6	-30.1	-175.8	-70.2	-174.8	178.2	-178.5	0	114.6	F83	F83-K134 VanDerWaalsContact CB-O 3.3Å; F83-K134 WeakPolarHBondContact CB-O 3.21Å; F83-K134 VanDerWaalsContact CD1-O 3.23Å; F83-K134 WeakPolarHBondContact CD1-O 3.44Å
135	E	93.8	Very high	95.5	Very high	138 Å²	138	36.4 Å²	36.4	65%	0.645	17%	0.174	S	C	*	.	S	Bend	trans	-129.6	-1.5	-175.8	-61.6	-171.9	162.1	0	0	113.8	E133 S162	E133-E135 VanDerWaalsContact C-N 3.27Å; E133-E135 PolarHBondContact O-N 3.41Å; E135-S162 PolarHBondContact O-N 3.16Å
136	L	96.2	Very high	95.4	Very high	22 Å²	22	35.9 Å²	35.9	12%	0.115	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	128	-173.2	-170.1	65.1	0	0	0	110.2	V64 L131 E133 L159 H161	V64-L136 HydrophobicContact CG2-CD2 3.69Å; L131-L136 HydrophobicContact CD2-CD2 3.94Å; L131-L136 HydrophobicContact CD2-CG 4.31Å; E133-L136 WeakPolarHBondContact CB-O 3.24Å; E133-L136 PolarHBondContact N-O 3.05Å; L136-L159 HydrophobicContact CD1-CB 4.23Å; L136-H161 WeakPolarHBondContact CD1-ND1 3.31Å
137	F	96.9	Very high	95.3	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.7	166.3	173.2	-98.9	0	0	0	108.5	Y77 L81 F83 I95 F97 V130 L131 D132 V139 L159 I160	Y77-F137 AromaticContact CE1-CE2 3.99Å; Y77-F137 HydrophobicContact CE1-CE2 3.99Å; Y77-F137 HydrophobicContact CE1-CZ 4.31Å; Y77-F137 HydrophobicContact CE2-CE2 4.43Å; Y77-F137 AromaticContact CZ-CE2 3.77Å; L81-F137 HydrophobicContact CD1-CB 3.85Å; L81-F137 HydrophobicContact CD1-CG 4.15Å; L81-F137 HydrophobicContact CD2-CB 4.11Å; L81-F137 HydrophobicContact CD2-CD2 3.47Å; L81-F137 VanDerWaalsContact CD2-CD2 3.47Å; L81-F137 HydrophobicContact CD2-CE2 4.02Å; L81-F137 HydrophobicContact CD2-CG 3.8Å; F83-F137 HydrophobicContact CE1-CB 4.17Å; F83-F137 HydrophobicContact CZ-CB 3.88Å; I95-F137 HydrophobicContact CD1-CD1 3.83Å; I95-F137 HydrophobicContact CD1-CE1 3.83Å; I95-F137 HydrophobicContact CD1-CG 4.45Å; I95-F137 HydrophobicContact CD1-CZ 4.47Å; I95-F137 HydrophobicContact CG2-CE1 4.3Å; I95-F137 HydrophobicContact CG2-CZ 4.31Å; F97-F137 AromaticContact CE1-CZ 3.94Å; F97-F137 HydrophobicContact CE1-CZ 3.94Å; F97-F137 HydrophobicContact CZ-CZ 4.48Å; V130-F137 HydrophobicContact CG1-CE2 3.83Å; V130-F137 HydrophobicContact CG1-CZ 4.43Å; L131-F137 CarbonylContact O-C 3.59Å; L131-F137 WeakPolarHBondContact O-CA 3.35Å; L131-F137 VanDerWaalsContact O-CD2 3.23Å; L131-F137 WeakPolarHBondContact O-CD2 3.45Å; D132-F137 HydrophobicContact CB-CD2 4.23Å; F137-V139 HydrophobicContact CE1-CG2 3.52Å; F137-V139 HydrophobicContact CE2-CG2 4.4Å; F137-V139 HydrophobicContact CZ-CG2 3.4Å; F137-V139 VanDerWaalsContact CZ-CG2 3.4Å; F137-L159 CarbonylContact O-C 3.51Å; F137-L159 WeakPolarHBondContact O-CA 3.29Å; F137-I160 HydrophobicContact CB-CB 4.38Å; F137-I160 HydrophobicContact CD1-CB 4.33Å; F137-I160 HydrophobicContact CD1-CD1 3.95Å; F137-I160 HydrophobicContact CD1-CG1 4.26Å; F137-I160 HydrophobicContact CE1-CD1 4.41Å; F137-I160 PolarHBondContact N-O 3.38Å; F137-I160 PolarHBondContact O-N 3.38Å
138	G	96.9	Very high	95.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	142.7	-176.9	0	0	0	0	0	112.3	V130 L131 T158	V130-G138 WeakPolarHBondContact CA-O 3.49Å; L131-G138 PolarHBondContact N-O 3.47Å; L131-G138 PolarHBondContact O-N 2.87Å; G138-T158 CarbonylContact C-O 3.53Å; G138-T158 VanDerWaalsContact CA-O 3.28Å; G138-T158 WeakPolarHBondContact CA-O 2.98Å
139	V	96.8	Very high	94.8	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	115.8	171.5	179.9	0	0	0	0	108.3	F97 L105 T128 G129 F137 R141 T157 T158	F97-V139 HydrophobicContact CE1-CG2 4.15Å; F97-V139 HydrophobicContact CZ-CG2 3.91Å; L105-V139 HydrophobicContact CD2-CG2 3.96Å; T128-V139 HydrophobicContact CG2-CG1 3.72Å; G129-V139 WeakPolarHBondContact O-CA 3.47Å; F137-V139 HydrophobicContact CE1-CG2 3.52Å; F137-V139 HydrophobicContact CE2-CG2 4.4Å; F137-V139 HydrophobicContact CZ-CG2 3.4Å; F137-V139 VanDerWaalsContact CZ-CG2 3.4Å; V139-R141 HydrophobicContact CG1-CG 4.15Å; V139-T157 WeakPolarHBondContact O-CA 3.36Å; V139-T158 PolarHBondContact N-O 3.26Å; V139-T158 PolarHBondContact O-N 3.11Å
140	K	96.9	Very high	94.6	Very high	24 Å²	24	46.5 Å²	46.5	10%	0.104	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.9	175.2	-178.4	160.7	-179	148.1	0	109.1	E62 S66 F69 T128 G129 T155 T157 D171	E62-K140 IonicContact OE2-NZ 3.16Å; S66-K140 PolarHBondContact OG-NZ 3.44Å; F69-K140 HydrophobicContact CB-CB 4.47Å; F69-K140 HydrophobicContact CD1-CB 3.6Å; F69-K140 HydrophobicContact CD2-CB 4.25Å; F69-K140 HydrophobicContact CD2-CD 4.1Å; F69-K140 HydrophobicContact CE1-CB 3.76Å; F69-K140 HydrophobicContact CE2-CB 4.4Å; F69-K140 HydrophobicContact CE2-CD 4.25Å; F69-K140 HydrophobicContact CG-CB 3.85Å; F69-K140 HydrophobicContact CG-CD 4.43Å; F69-K140 HydrophobicContact CZ-CB 4.17Å; T128-K140 WeakPolarHBondContact CA-O 3.12Å; G129-K140 PolarHBondContact N-O 3.32Å; G129-K140 PolarHBondContact O-N 2.02Å; K140-T155 VanDerWaalsContact CE-CG2 3.49Å; K140-T155 HydrophobicContact CG-CG2 4.24Å; K140-T157 HydrophobicContact CB-CG2 4.4Å; K140-T157 WeakPolarHBondContact CG-OG1 3.36Å; K140-D171 WeakPolarHBondContact CE-OD1 3.47Å; K140-D171 IonicContact NZ-OD1 2.65Å; K140-D171 PolarHBondContact NZ-OD1 3.42Å
141	R	96.2	Very high	94.6	Very high	3 Å²	3	51.7 Å²	51.7	1%	0.011	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130	-176.9	-74.3	171.6	176.3	144.1	-0.7	111.5	P103 I126 E127 T128 V139 F143 T155 T156	P103-R141 PolarHBondContact O-NH1 3.25Å; I126-R141 HydrophobicContact CD1-CG 4.17Å; I126-R141 HydrophobicContact CG1-CG 4.46Å; E127-R141 VanDerWaalsContact O-CA 3.27Å; E127-R141 WeakPolarHBondContact O-CA 3.43Å; T128-R141 HydrophobicContact CG2-CG 4.11Å; V139-R141 HydrophobicContact CG1-CG 4.15Å; R141-F143 HydrophobicContact CB-CD2 4.17Å; R141-F143 HydrophobicContact CB-CE2 3.5Å; R141-F143 VanDerWaalsContact CB-CE2 3.5Å; R141-F143 HydrophobicContact CB-CZ 3.72Å; R141-F143 HydrophobicContact CG-CZ 4.29Å; R141-T155 VanDerWaalsContact O-CA 3.3Å; R141-T155 WeakPolarHBondContact O-CA 3.49Å; R141-T156 PolarHBondContact N-O 3.37Å; R141-T156 PolarHBondContact O-N 3.43Å
142	N	96.1	Very high	94.5	Very high	53 Å²	53	52.7 Å²	52.7	28%	0.283	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120	166	-59.8	-34.3	0	0	0	107.9	I126 E127 T153 T154 T155	I126-N142 CarbonylContact C-O 3.57Å; I126-N142 WeakPolarHBondContact CA-O 3.1Å; E127-N142 HydrophobicContact CB-CB 4.34Å; E127-N142 PolarHBondContact N-O 2.98Å; E127-N142 PolarHBondContact O-N 2.85Å; N142-T153 HydrophobicContact CB-CG2 4.12Å; N142-T154 CarbonylContact C-O 3.53Å; N142-T154 WeakPolarHBondContact CA-O 3.06Å; N142-T155 WeakPolarHBondContact OD1-CB 3.34Å; N142-T155 WeakPolarHBondContact OD1-CG2 3.26Å; N142-T155 PolarHBondContact OD1-OG1 3.28Å
143	F	96.3	Very high	94.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	127.6	175	-56.1	-94	0	0	0	109.1	P103 I120 Y123 K125 I126 R141 T153 T154	P103-F143 HydrophobicContact CB-CE1 3.96Å; P103-F143 HydrophobicContact CB-CZ 4.14Å; P103-F143 HydrophobicContact CG-CE1 4Å; P103-F143 HydrophobicContact CG-CZ 4.47Å; I120-F143 HydrophobicContact CG2-CB 3.44Å; I120-F143 VanDerWaalsContact CG2-CB 3.44Å; I120-F143 HydrophobicContact CG2-CD1 3.92Å; I120-F143 HydrophobicContact CG2-CD2 4.18Å; I120-F143 HydrophobicContact CG2-CG 3.61Å; Y123-F143 HydrophobicContact CD1-CD1 4.2Å; Y123-F143 HydrophobicContact CD2-CD1 4.47Å; Y123-F143 HydrophobicContact CG-CD1 4.02Å; K125-F143 WeakPolarHBondContact O-CA 3.48Å; I126-F143 HydrophobicContact CB-CD1 4.2Å; I126-F143 HydrophobicContact CD1-CD1 4.06Å; I126-F143 HydrophobicContact CD1-CE1 3.53Å; I126-F143 HydrophobicContact CD1-CZ 4.16Å; I126-F143 HydrophobicContact CG1-CD1 4.02Å; I126-F143 HydrophobicContact CG1-CE1 3.98Å; R141-F143 HydrophobicContact CB-CD2 4.17Å; R141-F143 HydrophobicContact CB-CE2 3.5Å; R141-F143 VanDerWaalsContact CB-CE2 3.5Å; R141-F143 HydrophobicContact CB-CZ 3.72Å; R141-F143 HydrophobicContact CG-CZ 4.29Å; F143-T153 CarbonylContact O-C 3.58Å; F143-T153 VanDerWaalsContact O-CA 3.29Å; F143-T153 WeakPolarHBondContact O-CA 3.31Å; F143-T154 HydrophobicContact CB-CG2 3.76Å; F143-T154 HydrophobicContact CD2-CG2 4.17Å; F143-T154 HydrophobicContact CG-CG2 4.39Å; F143-T154 PolarHBondContact N-O 2.91Å; F143-T154 PolarHBondContact O-N 2.89Å
144	S	95.8	Very high	94.7	Very high	12 Å²	12	50.2 Å²	50.2	8%	0.084	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	135.7	165.7	-56.1	0	0	0	0	109.2	Y123 T124 K125 V152	Y123-S144 CarbonylContact C-O 3.57Å; Y123-S144 WeakPolarHBondContact CA-O 3.12Å; Y123-S144 WeakPolarHBondContact CB-O 3.34Å; T124-S144 PolarHBondContact N-O 3.4Å; T124-S144 PolarHBondContact OG1-O 3.42Å; T124-S144 VanDerWaalsContact OG1-O 3.13Å; K125-S144 PolarHBondContact O-N 3.39Å; S144-V152 WeakPolarHBondContact CA-O 3.29Å
145	I	94.1	Very high	94.9	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.036	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143.7	177.4	-176.4	164.9	0	0	0	109.7	I120 V147 E151 V152 I177	I120-I145 HydrophobicContact CD1-CD1 3.75Å; I120-I145 HydrophobicContact CD1-CG2 4.32Å; I120-I145 HydrophobicContact CG1-CD1 4.24Å; I145-V147 HydrophobicContact CG2-CG2 4.13Å; I145-E151 WeakPolarHBondContact O-CA 3.38Å; I145-V152 HydrophobicContact CG2-CB 4.44Å; I145-V152 WeakPolarHBondContact CG2-O 3.17Å; I145-V152 PolarHBondContact N-O 3.24Å; I145-V152 PolarHBondContact O-N 3.3Å; I145-I177 HydrophobicContact CG2-CD1 3.61Å; I145-I177 HydrophobicContact CG2-CG1 4.47Å
146	N	93.2	Very high	95	Very high	92 Å²	92	36.6 Å²	36.6	49%	0.492	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	119.6	172.5	-168.8	-74.5	0	0	0	110	G149 S150	N146-G149 PolarHBondContact ND2-O 3.4Å; N146-G149 VanDerWaalsContact OD1-CA 3.24Å; N146-G149 WeakPolarHBondContact OD1-CA 3.45Å; N146-G149 PolarHBondContact OD1-N 2.99Å; N146-S150 CarbonylContact C-O 3.58Å; N146-S150 WeakPolarHBondContact CA-O 3.36Å
147	V	90.7	Very high	95.1	Very high	25 Å²	25	35.9 Å²	35.9	15%	0.152	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	113	174.7	-176.5	0	0	0	0	107.9	I145 G149 S150 V152 E176 I177	I145-V147 HydrophobicContact CG2-CG2 4.13Å; V147-G149 PolarHBondContact O-N 3.26Å; V147-S150 PolarHBondContact N-O 2.97Å; V147-S150 PolarHBondContact O-N 3.08Å; V147-V152 HydrophobicContact CB-CG2 4.06Å; V147-V152 HydrophobicContact CG2-CB 4.35Å; V147-V152 HydrophobicContact CG2-CG2 4.11Å; V147-E176 HydrophobicContact CG1-CB 4.1Å; V147-I177 HydrophobicContact CG2-CG1 4.35Å
148	N	90.1	Very high	95.2	Very high	166 Å²	166	35.9 Å²	35.9	89%	0.888	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	38.2	179.4	-58.2	-25.9	0	0	0	113.9	S150	N148-S150 VanDerWaalsContact C-N 3.34Å
149	G	90.3	Very high	95.2	Very high	60 Å²	60	36.2 Å²	36.2	62%	0.619	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.9	-17	-179.8	0	0	0	0	0	114.5	N146 V147	N146-G149 PolarHBondContact ND2-O 3.4Å; N146-G149 VanDerWaalsContact OD1-CA 3.24Å; N146-G149 WeakPolarHBondContact OD1-CA 3.45Å; N146-G149 PolarHBondContact OD1-N 2.99Å; V147-G149 PolarHBondContact O-N 3.26Å
150	S	92.8	Very high	95.3	Very high	76 Å²	76	36.1 Å²	36.1	53%	0.531	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.6	179.5	-63.3	0	0	0	0	111.6	N146 V147 N148	N146-S150 CarbonylContact C-O 3.58Å; N146-S150 WeakPolarHBondContact CA-O 3.36Å; V147-S150 PolarHBondContact N-O 2.97Å; V147-S150 PolarHBondContact O-N 3.08Å; N148-S150 VanDerWaalsContact C-N 3.34Å
151	E	94.4	Very high	95.2	Very high	125 Å²	125	37.1 Å²	37.1	58%	0.584	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77	126.4	170.5	-173	171.9	92.4	0	0	110.1	I145	I145-E151 WeakPolarHBondContact O-CA 3.38Å
152	V	95.2	Very high	95.1	Very high	29 Å²	29	39.2 Å²	39.2	18%	0.176	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.1	178	-171.7	0	0	0	0	108.5	S144 I145 V147 P174	S144-V152 WeakPolarHBondContact CA-O 3.29Å; I145-V152 HydrophobicContact CG2-CB 4.44Å; I145-V152 WeakPolarHBondContact CG2-O 3.17Å; I145-V152 PolarHBondContact N-O 3.24Å; I145-V152 PolarHBondContact O-N 3.3Å; V147-V152 HydrophobicContact CB-CG2 4.06Å; V147-V152 HydrophobicContact CG2-CB 4.35Å; V147-V152 HydrophobicContact CG2-CG2 4.11Å; V152-P174 HydrophobicContact CG1-CB 3.81Å; V152-P174 HydrophobicContact CG1-CG 3.33Å
153	T	96.1	Very high	94.9	Very high	56 Å²	56	41.4 Å²	41.4	34%	0.344	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.7	179	-56.3	0	0	0	0	111	N142 F143 Y172 P174	N142-T153 HydrophobicContact CB-CG2 4.12Å; F143-T153 CarbonylContact O-C 3.58Å; F143-T153 VanDerWaalsContact O-CA 3.29Å; F143-T153 WeakPolarHBondContact O-CA 3.31Å; T153-Y172 WeakPolarHBondContact O-CD1 3.33Å; T153-Y172 WeakPolarHBondContact O-CE1 3.42Å; T153-P174 VanDerWaalsContact O-CG 3.29Å; T153-P174 WeakPolarHBondContact O-CG 2.8Å
154	T	96.3	Very high	94.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.2	166.9	-178.1	0	0	0	0	110.4	I120 N142 F143 Y172 I173 I177	I120-T154 HydrophobicContact CB-CG2 4.13Å; I120-T154 HydrophobicContact CD1-CG2 3.83Å; I120-T154 HydrophobicContact CG2-CG2 3.88Å; N142-T154 CarbonylContact C-O 3.53Å; N142-T154 WeakPolarHBondContact CA-O 3.06Å; F143-T154 HydrophobicContact CB-CG2 3.76Å; F143-T154 HydrophobicContact CD2-CG2 4.17Å; F143-T154 HydrophobicContact CG-CG2 4.39Å; F143-T154 PolarHBondContact N-O 2.91Å; F143-T154 PolarHBondContact O-N 2.89Å; T154-Y172 CarbonylContact C-O 3.57Å; T154-Y172 VanDerWaalsContact CA-O 3.27Å; T154-Y172 WeakPolarHBondContact CA-O 3.16Å; T154-Y172 PolarHBondContact OG1-O 2.03Å; T154-I173 WeakPolarHBondContact OG1-CD1 3.3Å; T154-I177 HydrophobicContact CG2-CD1 4.4Å
155	T	96.9	Very high	94.7	Very high	16 Å²	16	43 Å²	43	10%	0.098	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.8	-177.5	-56.5	0	0	0	0	110.4	K140 R141 N142 D171 Y172	K140-T155 VanDerWaalsContact CE-CG2 3.49Å; K140-T155 HydrophobicContact CG-CG2 4.24Å; R141-T155 VanDerWaalsContact O-CA 3.3Å; R141-T155 WeakPolarHBondContact O-CA 3.49Å; N142-T155 WeakPolarHBondContact OD1-CB 3.34Å; N142-T155 WeakPolarHBondContact OD1-CG2 3.26Å; N142-T155 PolarHBondContact OD1-OG1 3.28Å; T155-D171 HydrophobicContact CG2-CB 3.64Å; T155-D171 PolarHBondContact O-N 3.28Å; T155-D171 VanDerWaalsContact O-N 3.16Å; T155-Y172 PolarHBondContact N-O 2.79Å; T155-Y172 PolarHBondContact O-N 2.87Å; T155-Y172 VanDerWaalsContact O-N 3.13Å
156	T	97.1	Very high	94.9	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	143.7	177	68.9	0	0	0	0	110.7	R141 Y170 I173 L182	R141-T156 PolarHBondContact N-O 3.37Å; R141-T156 PolarHBondContact O-N 3.43Å; T156-Y170 HydrophobicContact CG2-CD1 4.09Å; T156-I173 HydrophobicContact CG2-CD1 4.28Å; T156-L182 HydrophobicContact CG2-CD2 3.89Å
157	T	97.9	Very high	95.2	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.6	176.4	-57.6	0	0	0	0	110.4	F69 N118 V139 K140 L159 F168 Y169 D171	F69-T157 HydrophobicContact CE1-CG2 4.15Å; F69-T157 HydrophobicContact CZ-CG2 3.67Å; N118-T157 PolarHBondContact ND2-O 2.02Å; V139-T157 WeakPolarHBondContact O-CA 3.36Å; K140-T157 HydrophobicContact CB-CG2 4.4Å; K140-T157 WeakPolarHBondContact CG-OG1 3.36Å; T157-L159 HydrophobicContact CG2-CD2 3.91Å; T157-L159 HydrophobicContact CG2-CG 4.12Å; T157-F168 CarbonylContact O-C 3.59Å; T157-F168 WeakPolarHBondContact O-CA 2.96Å; T157-Y169 PolarHBondContact N-O 2.79Å; T157-Y169 PolarHBondContact O-N 3.47Å; T157-D171 WeakPolarHBondContact CB-OD2 3.45Å; T157-D171 PolarHBondContact N-OD2 3.08Å; T157-D171 VanDerWaalsContact N-OD2 3.11Å; T157-D171 PolarHBondContact OG1-OD1 3.49Å; T157-D171 PolarHBondContact OG1-OD2 2.79Å
158	T	98.2	Very high	95.5	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.7	170.3	-65.4	0	0	0	0	108.8	L105 I116 N118 G138 V139 S167 F168	L105-T158 HydrophobicContact CD1-CG2 3.81Å; I116-T158 HydrophobicContact CG2-CG2 4.11Å; N118-T158 VanDerWaalsContact CB-OG1 3.28Å; N118-T158 WeakPolarHBondContact CB-OG1 3.32Å; N118-T158 PolarHBondContact ND2-OG1 3.43Å; G138-T158 CarbonylContact C-O 3.53Å; G138-T158 VanDerWaalsContact CA-O 3.28Å; G138-T158 WeakPolarHBondContact CA-O 2.98Å; V139-T158 PolarHBondContact N-O 3.26Å; V139-T158 PolarHBondContact O-N 3.11Å; T158-S167 CarbonylContact C-O 3.55Å; T158-S167 WeakPolarHBondContact CA-O 3.13Å; T158-F168 HydrophobicContact CG2-CD1 3.96Å; T158-F168 HydrophobicContact CG2-CE1 3.8Å
159	L	98	Very high	95.9	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.9	176.6	-58.5	176.4	0	0	0	110.1	A63 V64 F69 L136 F137 T157 V166 S167	A63-L159 HydrophobicContact CB-CD1 4.08Å; V64-L159 HydrophobicContact CG2-CD1 3.97Å; V64-L159 HydrophobicContact CG2-CD2 4.1Å; F69-L159 HydrophobicContact CZ-CD2 4.13Å; L136-L159 HydrophobicContact CD1-CB 4.23Å; F137-L159 CarbonylContact O-C 3.51Å; F137-L159 WeakPolarHBondContact O-CA 3.29Å; T157-L159 HydrophobicContact CG2-CD2 3.91Å; T157-L159 HydrophobicContact CG2-CG 4.12Å; L159-V166 CarbonylContact O-C 3.55Å; L159-V166 WeakPolarHBondContact O-CA 3.39Å; L159-S167 PolarHBondContact N-O 3.29Å; L159-S167 PolarHBondContact O-N 3.36Å
160	I	97.8	Very high	96.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	118.2	174.1	-57.4	179	0	0	0	107.1	F83 F85 I95 I116 F137 V166	F83-I160 WeakPolarHBondContact CZ-O 3.38Å; F85-I160 HydrophobicContact CD1-CG2 4.15Å; F85-I160 HydrophobicContact CD2-CG2 3.94Å; F85-I160 HydrophobicContact CE1-CG2 3.88Å; F85-I160 HydrophobicContact CE2-CG2 3.62Å; F85-I160 HydrophobicContact CG-CG2 4.18Å; F85-I160 HydrophobicContact CZ-CD1 4.27Å; F85-I160 HydrophobicContact CZ-CG2 3.6Å; I95-I160 HydrophobicContact CD1-CD1 3.67Å; I116-I160 HydrophobicContact CD1-CD1 3.84Å; I116-I160 HydrophobicContact CD1-CG1 4.44Å; F137-I160 HydrophobicContact CB-CB 4.38Å; F137-I160 HydrophobicContact CD1-CB 4.33Å; F137-I160 HydrophobicContact CD1-CD1 3.95Å; F137-I160 HydrophobicContact CD1-CG1 4.26Å; F137-I160 HydrophobicContact CE1-CD1 4.41Å; F137-I160 PolarHBondContact N-O 3.38Å; F137-I160 PolarHBondContact O-N 3.38Å; I160-V166 HydrophobicContact CG1-CG2 4.45Å
161	H	95.8	Very high	96.5	Very high	44 Å²	44	25.2 Å²	25.2	20%	0.204	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	155.9	-178.5	-61.3	-96.3	0	0	0	110.9	L136 N163 G164 K165 S167	L136-H161 WeakPolarHBondContact CD1-ND1 3.31Å; H161-N163 VanDerWaalsContact CB-OD1 3.27Å; H161-N163 WeakPolarHBondContact CB-OD1 3.39Å; H161-N163 PolarHBondContact O-N 2.78Å; H161-N163 VanDerWaalsContact O-N 3.17Å; H161-G164 PolarHBondContact O-N 2.82Å; H161-K165 HydrophobicContact CB-CB 4.22Å; H161-K165 PolarHBondContact CD2-O 3.11Å; H161-K165 PolarHBondContact N-O 2.91Å; H161-S167 PolarHBondContact NE2-OG 2.94Å
162	S	94.2	Very high	96.6	Very high	47 Å²	47	25.2 Å²	25.2	33%	0.329	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-28.4	177.1	57.4	0	0	0	0	114.6	F83 E135 G164	F83-S162 VanDerWaalsContact CD2-CA 3.45Å; E135-S162 PolarHBondContact O-N 3.16Å; S162-G164 PolarHBondContact O-N 3.4Å
163	N	91.5	Very high	96.6	Very high	100 Å²	100	24.4 Å²	24.4	54%	0.535	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	2.2	174.4	69.5	-0.4	0	0	0	114.3	H161 K165	H161-N163 VanDerWaalsContact CB-OD1 3.27Å; H161-N163 WeakPolarHBondContact CB-OD1 3.39Å; H161-N163 PolarHBondContact O-N 2.78Å; H161-N163 VanDerWaalsContact O-N 3.17Å; N163-K165 WeakPolarHBondContact OD1-CB 3.49Å; N163-K165 PolarHBondContact OD1-N 3.27Å
164	G	93.4	Very high	96.6	Very high	5 Å²	5	22 Å²	22	5%	0.052	11%	0.11	C	C	.	.	S	Bend	trans	85.1	1.6	-180	0	0	0	0	0	115.3	H161 S162 V166	H161-G164 PolarHBondContact O-N 2.82Å; S162-G164 PolarHBondContact O-N 3.4Å; G164-V166 PolarHBondContact O-N 3.03Å
165	K	95.6	Very high	96.4	Very high	41 Å²	41	32 Å²	32	18%	0.178	15%	0.154	C	C	.	.			trans	-64.5	132.8	170.8	-173.6	174.1	68.3	168.1	0	109.9	H161 N163 E215 F216	H161-K165 HydrophobicContact CB-CB 4.22Å; H161-K165 PolarHBondContact CD2-O 3.11Å; H161-K165 PolarHBondContact N-O 2.91Å; N163-K165 WeakPolarHBondContact OD1-CB 3.49Å; N163-K165 PolarHBondContact OD1-N 3.27Å; K165-E215 HydrophobicContact CD-CB 4.3Å; K165-E215 WeakPolarHBondContact CE-OE1 3.42Å; K165-E215 IonicContact NZ-OE1 3.67Å; K165-E215 PolarHBondContact NZ-OE1 2.92Å; K165-F216 WeakPolarHBondContact CA-O 3.48Å; K165-F216 WeakPolarHBondContact CG-O 3.5Å
166	V	98	Very high	96.1	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.9	172.9	179.9	0	0	0	0	108	I116 L159 I160 G164 F168 I186 F216	I116-V166 HydrophobicContact CD1-CG1 4.07Å; I116-V166 HydrophobicContact CD1-CG2 4.06Å; I116-V166 HydrophobicContact CG2-CG1 4.34Å; L159-V166 CarbonylContact O-C 3.55Å; L159-V166 WeakPolarHBondContact O-CA 3.39Å; I160-V166 HydrophobicContact CG1-CG2 4.45Å; G164-V166 PolarHBondContact O-N 3.03Å; V166-F168 HydrophobicContact CG1-CD1 4.44Å; V166-F168 HydrophobicContact CG1-CE1 3.85Å; V166-F168 HydrophobicContact CG1-CZ 4.5Å; V166-I186 HydrophobicContact CB-CG2 4.48Å; V166-I186 HydrophobicContact CG1-CG2 4.12Å; V166-F216 HydrophobicContact CB-CB 4.39Å; V166-F216 HydrophobicContact CB-CD2 4.35Å; V166-F216 HydrophobicContact CG1-CD2 4.39Å; V166-F216 PolarHBondContact N-O 2.88Å; V166-F216 WeakPolarHBondContact O-CD2 3.42Å; V166-F216 PolarHBondContact O-N 3.4Å
167	S	98.2	Very high	95.9	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.1	-178.9	-45.1	0	0	0	0	110.7	T158 L159 H161 V214	T158-S167 CarbonylContact C-O 3.55Å; T158-S167 WeakPolarHBondContact CA-O 3.13Å; L159-S167 PolarHBondContact N-O 3.29Å; L159-S167 PolarHBondContact O-N 3.36Å; H161-S167 PolarHBondContact NE2-OG 2.94Å; S167-V214 CarbonylContact C-O 3.53Å; S167-V214 WeakPolarHBondContact CA-O 3.49Å
168	F	98.6	Very high	95.6	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.7	166.3	-56.1	-25	0	0	0	109.1	I116 H117 N118 T157 T158 V166 I186 V203 L213 V214 F216	I116-F168 HydrophobicContact CG2-CE1 3.46Å; I116-F168 VanDerWaalsContact CG2-CE1 3.46Å; I116-F168 HydrophobicContact CG2-CZ 3.59Å; H117-F168 WeakPolarHBondContact O-CZ 3.22Å; N118-F168 HydrophobicContact CB-CD1 4.25Å; N118-F168 HydrophobicContact CB-CE1 4.25Å; N118-F168 HydrophobicContact CB-CG 4.5Å; N118-F168 HydrophobicContact CB-CZ 4.48Å; T157-F168 CarbonylContact O-C 3.59Å; T157-F168 WeakPolarHBondContact O-CA 2.96Å; T158-F168 HydrophobicContact CG2-CD1 3.96Å; T158-F168 HydrophobicContact CG2-CE1 3.8Å; V166-F168 HydrophobicContact CG1-CD1 4.44Å; V166-F168 HydrophobicContact CG1-CE1 3.85Å; V166-F168 HydrophobicContact CG1-CZ 4.5Å; F168-I186 HydrophobicContact CZ-CG2 4.07Å; F168-V203 HydrophobicContact CD2-CG2 3.91Å; F168-V203 HydrophobicContact CE2-CG2 4.24Å; F168-L213 CarbonylContact O-C 3.55Å; F168-L213 WeakPolarHBondContact O-CA 3.22Å; F168-V214 HydrophobicContact CB-CB 4.3Å; F168-V214 PolarHBondContact N-O 3.41Å; F168-V214 PolarHBondContact O-N 2.85Å; F168-F216 AromaticContact CD2-CE2 3.71Å; F168-F216 HydrophobicContact CD2-CE2 3.71Å; F168-F216 HydrophobicContact CD2-CZ 4.3Å; F168-F216 AromaticContact CE2-CE2 3.49Å; F168-F216 HydrophobicContact CE2-CE2 3.49Å; F168-F216 VanDerWaalsContact CE2-CE2 3.49Å; F168-F216 AromaticContact CE2-CZ 3.99Å; F168-F216 HydrophobicContact CE2-CZ 3.99Å; F168-F216 HydrophobicContact CG-CE2 4.31Å; F168-F216 AromaticContact CZ-CE2 3.92Å; F168-F216 HydrophobicContact CZ-CE2 3.92Å
169	Y	98.4	Very high	95.1	Very high	21 Å²	21	43.5 Å²	43.5	8%	0.082	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.8	171.4	-178.4	-112	0	0	0	108.7	Q60 E62 T157 D171 T212 L213	Q60-Y169 HydrophobicContact CB-CE2 4.42Å; Q60-Y169 WeakPolarHBondContact O-CE2 3.42Å; Q60-Y169 PolarHBondContact O-OH 3.21Å; Q60-Y169 VanDerWaalsContact O-OH 3.08Å; E62-Y169 HydrophobicContact CB-CD1 4.3Å; E62-Y169 HydrophobicContact CB-CE1 3.69Å; E62-Y169 HydrophobicContact CG-CE1 4.43Å; E62-Y169 PolarHBondContact N-OH 2.85Å; T157-Y169 PolarHBondContact N-O 2.79Å; T157-Y169 PolarHBondContact O-N 3.47Å; Y169-D171 HydrophobicContact CD1-CB 4.22Å; Y169-D171 VanDerWaalsContact CD1-CG 3.47Å; Y169-D171 HydrophobicContact CE1-CB 4.02Å; Y169-T212 WeakPolarHBondContact CA-O 3.08Å; Y169-T212 WeakPolarHBondContact CD2-O 3.48Å; Y169-L213 HydrophobicContact CD2-CB 4.38Å
170	Y	98	Very high	94.8	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	87.6	177	-57.4	-77.3	0	0	0	108.2	T156 Y172 I173 L182 S184 I208 S210 G211 T212 V214	T156-Y170 HydrophobicContact CG2-CD1 4.09Å; Y170-Y172 PolarHBondContact O-N 2.87Å; Y170-I173 HydrophobicContact CD1-CD1 4.08Å; Y170-I173 HydrophobicContact CD1-CG1 4.44Å; Y170-I173 HydrophobicContact CG-CG1 4.45Å; Y170-L182 HydrophobicContact CD1-CD2 4.3Å; Y170-L182 HydrophobicContact CE1-CD2 4.3Å; Y170-S184 WeakPolarHBondContact OH-CB 3.26Å; Y170-S184 PolarHBondContact OH-OG 3.25Å; Y170-I208 HydrophobicContact CD1-CG2 3.74Å; Y170-I208 HydrophobicContact CE1-CB 4.35Å; Y170-I208 HydrophobicContact CE1-CG1 4.23Å; Y170-I208 HydrophobicContact CE1-CG2 3.53Å; Y170-I208 HydrophobicContact CE2-CG1 4.27Å; Y170-I208 HydrophobicContact CE2-CG2 4.47Å; Y170-I208 HydrophobicContact CG-CG2 4.3Å; Y170-S210 CarbonylContact O-C 3.53Å; Y170-S210 WeakPolarHBondContact O-CA 3.26Å; Y170-G211 PolarHBondContact O-N 2.81Å; Y170-T212 HydrophobicContact CD2-CG2 4.48Å; Y170-T212 WeakPolarHBondContact CD2-O 3.29Å; Y170-T212 PolarHBondContact N-O 3.26Å; Y170-V214 HydrophobicContact CE2-CG2 3.88Å
171	D	96.6	Very high	94.7	Very high	27 Å²	27	49 Å²	49	14%	0.144	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	-50.4	-176.7	-54.3	-117.2	0	0	0	111.2	K140 T155 T157 Y169	K140-D171 WeakPolarHBondContact CE-OD1 3.47Å; K140-D171 IonicContact NZ-OD1 2.65Å; K140-D171 PolarHBondContact NZ-OD1 3.42Å; T155-D171 HydrophobicContact CG2-CB 3.64Å; T155-D171 PolarHBondContact O-N 3.28Å; T155-D171 VanDerWaalsContact O-N 3.16Å; T157-D171 WeakPolarHBondContact CB-OD2 3.45Å; T157-D171 PolarHBondContact N-OD2 3.08Å; T157-D171 VanDerWaalsContact N-OD2 3.11Å; T157-D171 PolarHBondContact OG1-OD1 3.49Å; T157-D171 PolarHBondContact OG1-OD2 2.79Å; Y169-D171 HydrophobicContact CD1-CB 4.22Å; Y169-D171 VanDerWaalsContact CD1-CG 3.47Å; Y169-D171 HydrophobicContact CE1-CB 4.02Å
172	Y	96.3	Very high	94.7	Very high	125 Å²	125	47.3 Å²	47.3	49%	0.49	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	111	-178.6	-176.3	-111.2	0	0	0	111.9	T153 T154 T155 Y170 P174	T153-Y172 WeakPolarHBondContact O-CD1 3.33Å; T153-Y172 WeakPolarHBondContact O-CE1 3.42Å; T154-Y172 CarbonylContact C-O 3.57Å; T154-Y172 VanDerWaalsContact CA-O 3.27Å; T154-Y172 WeakPolarHBondContact CA-O 3.16Å; T154-Y172 PolarHBondContact OG1-O 2.03Å; T155-Y172 PolarHBondContact N-O 2.79Å; T155-Y172 PolarHBondContact O-N 2.87Å; T155-Y172 VanDerWaalsContact O-N 3.13Å; Y170-Y172 PolarHBondContact O-N 2.87Å; Y172-P174 HydrophobicContact CD1-CG 4.23Å; Y172-P174 HydrophobicContact CE1-CB 4.47Å; Y172-P174 HydrophobicContact CE1-CG 3.63Å
173	I	96.4	Very high	94.8	Very high	12 Å²	12	47.8 Å²	47.8	6%	0.062	23%	0.23	C	C	.	.			trans	-118.2	104.8	170.6	-46.1	-58.5	0	0	0	107.9	T154 T156 Y170 I177 L182 S210	T154-I173 WeakPolarHBondContact OG1-CD1 3.3Å; T156-I173 HydrophobicContact CG2-CD1 4.28Å; Y170-I173 HydrophobicContact CD1-CD1 4.08Å; Y170-I173 HydrophobicContact CD1-CG1 4.44Å; Y170-I173 HydrophobicContact CG-CG1 4.45Å; I173-I177 HydrophobicContact CG2-CB 4.34Å; I173-I177 HydrophobicContact CG2-CG2 4.33Å; I173-L182 HydrophobicContact CD1-CD2 3.69Å; I173-L182 HydrophobicContact CG2-CD1 4.4Å; I173-S210 PolarHBondContact N-OG 2.68Å; I173-S210 PolarHBondContact O-OG 2.98Å
174	P	94.8	Very high	95	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.032	21%	0.206	C	C	.	.			trans	-53.3	152.1	172.5	-16.5	19.4	0	0	0	112.6	V152 T153 Y172 E176 I177	V152-P174 HydrophobicContact CG1-CB 3.81Å; V152-P174 HydrophobicContact CG1-CG 3.33Å; T153-P174 VanDerWaalsContact O-CG 3.29Å; T153-P174 WeakPolarHBondContact O-CG 2.8Å; Y172-P174 HydrophobicContact CD1-CG 4.23Å; Y172-P174 HydrophobicContact CE1-CB 4.47Å; Y172-P174 HydrophobicContact CE1-CG 3.63Å; P174-E176 WeakPolarHBondContact CB-OE2 3.36Å; P174-E176 PolarHBondContact O-N 3.14Å; P174-I177 HydrophobicContact CB-CD1 4.48Å; P174-I177 HydrophobicContact CB-CG1 4.42Å; P174-I177 HydrophobicContact CG-CD1 3.89Å; P174-I177 HydrophobicContact CG-CG1 4.36Å; P174-I177 PolarHBondContact O-N 3.38Å
175	K	92.9	Very high	95.2	Very high	211 Å²	211	43.5 Å²	43.5	92%	0.917	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.8	-177.5	-69.6	-177.4	-178.6	176.8	0	112.8	I177	K175-I177 PolarHBondContact O-N 2.84Å
176	E	91.1	Very high	95.3	Very high	120 Å²	120	41.6 Å²	41.6	56%	0.561	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.5	178.8	-50.8	76.6	-167.8	0	0	112	V147 P174	V147-E176 HydrophobicContact CG1-CB 4.1Å; P174-E176 WeakPolarHBondContact CB-OE2 3.36Å; P174-E176 PolarHBondContact O-N 3.14Å
177	I	92	Very high	95.1	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.036	20%	0.203	C	C	.	.	S	Bend	trans	-98.6	117	177.4	-61.5	-178.6	0	0	0	109	I120 I145 V147 T154 I173 P174 K175 Q181 L182	I120-I177 HydrophobicContact CD1-CD1 3.88Å; I120-I177 HydrophobicContact CD1-CG2 3.59Å; I145-I177 HydrophobicContact CG2-CD1 3.61Å; I145-I177 HydrophobicContact CG2-CG1 4.47Å; V147-I177 HydrophobicContact CG2-CG1 4.35Å; T154-I177 HydrophobicContact CG2-CD1 4.4Å; I173-I177 HydrophobicContact CG2-CB 4.34Å; I173-I177 HydrophobicContact CG2-CG2 4.33Å; P174-I177 HydrophobicContact CB-CD1 4.48Å; P174-I177 HydrophobicContact CB-CG1 4.42Å; P174-I177 HydrophobicContact CG-CD1 3.89Å; P174-I177 HydrophobicContact CG-CG1 4.36Å; P174-I177 PolarHBondContact O-N 3.38Å; K175-I177 PolarHBondContact O-N 2.84Å; I177-Q181 HydrophobicContact CG2-CB 4.43Å; I177-L182 HydrophobicContact CG2-CD1 3.77Å
178	E	92	Very high	94.8	Very high	128 Å²	128	42.6 Å²	42.6	60%	0.598	20%	0.202	S	C	*	.			trans	-71.7	137.9	170.4	-65	-178.4	-173.3	0	0	110.9	S180 Q181	E178-S180 WeakPolarHBondContact CB-OG 3.3Å; E178-S180 PolarHBondContact O-N 3.36Å; E178-S180 PolarHBondContact OE2-OG 2.84Å; E178-S180 VanDerWaalsContact OE2-OG 3.07Å; E178-Q181 HydrophobicContact CB-CG 4.39Å; E178-Q181 WeakPolarHBondContact O-CB 3.44Å; E178-Q181 PolarHBondContact O-N 3.12Å
179	G	88.7	Confident	94.2	Very high	12 Å²	12	46.3 Å²	46.3	12%	0.124	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-55.9	-24.1	175.3	0	0	0	0	0	114.1	Q181 L182	G179-Q181 PolarHBondContact O-N 2.03Å; G179-L182 PolarHBondContact O-N 2.86Å; G179-L182 VanDerWaalsContact O-N 3.08Å
180	S	91.5	Very high	93.4	Very high	58 Å²	58	45.8 Å²	45.8	41%	0.406	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-63.6	-22.4	175.8	62.8	0	0	0	0	113.7	K121 E178 L182	K121-S180 PolarHBondContact NZ-O 3.22Å; E178-S180 WeakPolarHBondContact CB-OG 3.3Å; E178-S180 PolarHBondContact O-N 3.36Å; E178-S180 PolarHBondContact OE2-OG 2.84Å; E178-S180 VanDerWaalsContact OE2-OG 3.07Å; S180-L182 VanDerWaalsContact C-N 3.33Å
181	Q	94.5	Very high	92.4	Very high	63 Å²	63	49.8 Å²	49.8	29%	0.294	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-76.7	-23.8	175.8	-59.1	-174	16.4	0	0	111.8	I120 K121 I177 E178 G179	I120-Q181 HydrophobicContact CD1-CB 4.44Å; I120-Q181 HydrophobicContact CG1-CB 4.15Å; K121-Q181 WeakPolarHBondContact CB-O 3.05Å; K121-Q181 WeakPolarHBondContact CG-O 3.36Å; K121-Q181 PolarHBondContact N-O 2.92Å; I177-Q181 HydrophobicContact CG2-CB 4.43Å; E178-Q181 HydrophobicContact CB-CG 4.39Å; E178-Q181 WeakPolarHBondContact O-CB 3.44Å; E178-Q181 PolarHBondContact O-N 3.12Å; G179-Q181 PolarHBondContact O-N 2.03Å
182	L	95.8	Very high	91.3	Very high	9 Å²	9	49.1 Å²	49.1	5%	0.047	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	138.2	172.8	-70.3	90.4	0	0	0	110.2	Y119 I120 T156 Y170 I173 I177 G179 S180 I208	Y119-L182 CarbonylContact O-C 3.59Å; Y119-L182 WeakPolarHBondContact O-CA 3.32Å; I120-L182 HydrophobicContact CB-CG 4.09Å; I120-L182 HydrophobicContact CD1-CD1 4.16Å; I120-L182 HydrophobicContact CD1-CG 4.49Å; I120-L182 HydrophobicContact CG1-CD1 4.23Å; I120-L182 HydrophobicContact CG1-CG 4.12Å; T156-L182 HydrophobicContact CG2-CD2 3.89Å; Y170-L182 HydrophobicContact CD1-CD2 4.3Å; Y170-L182 HydrophobicContact CE1-CD2 4.3Å; I173-L182 HydrophobicContact CD1-CD2 3.69Å; I173-L182 HydrophobicContact CG2-CD1 4.4Å; I177-L182 HydrophobicContact CG2-CD1 3.77Å; G179-L182 PolarHBondContact O-N 2.86Å; G179-L182 VanDerWaalsContact O-N 3.08Å; S180-L182 VanDerWaalsContact C-N 3.33Å; L182-I208 HydrophobicContact CB-CD1 4.09Å; L182-I208 HydrophobicContact CB-CG2 3.94Å; L182-I208 HydrophobicContact CD1-CG2 4Å; L182-I208 HydrophobicContact CD2-CG2 3.8Å; L182-I208 HydrophobicContact CG-CG2 4.11Å
183	K	95.8	Very high	90.3	Very high	57 Å²	57	49 Å²	49	25%	0.248	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	105.4	170.2	-175	164.5	178.5	174.4	0	108.3	H117 N118 Y119 E185	H117-K183 CarbonylContact C-O 3.57Å; N118-K183 WeakPolarHBondContact CA-O 3.49Å; Y119-K183 HydrophobicContact CE1-CB 4.08Å; Y119-K183 HydrophobicContact CE1-CD 4.45Å; Y119-K183 HydrophobicContact CE1-CG 4.31Å; Y119-K183 HydrophobicContact CE2-CB 4.36Å; Y119-K183 PolarHBondContact N-O 2.81Å; Y119-K183 VanDerWaalsContact N-O 3.11Å; Y119-K183 PolarHBondContact O-N 3.48Å; K183-E185 WeakPolarHBondContact CE-OE1 3.35Å; K183-E185 WeakPolarHBondContact CE-OE2 3.39Å; K183-E185 IonicContact NZ-OE1 3.95Å; K183-E185 PolarHBondContact NZ-OE1 3.07Å; K183-E185 IonicContact NZ-OE2 3.26Å
184	S	97.5	Very high	89.4	Confident	5 Å²	5	51.6 Å²	51.6	4%	0.035	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	109.7	-179.6	-58.1	0	0	0	0	109	H117 N118 Y170 V203	H117-S184 CarbonylContact O-C 3.52Å; H117-S184 VanDerWaalsContact O-CA 3.26Å; H117-S184 WeakPolarHBondContact O-CA 3.23Å; N118-S184 PolarHBondContact OD1-OG 2.97Å; Y170-S184 WeakPolarHBondContact OH-CB 3.26Å; Y170-S184 PolarHBondContact OH-OG 3.25Å; S184-V203 WeakPolarHBondContact O-CG2 3.28Å; S184-V203 PolarHBondContact O-N 3.08Å
185	E	96.7	Very high	88.6	Confident	10 Å²	10	55.9 Å²	55.9	5%	0.047	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	152.8	-176.8	65.3	-174.3	-162.1	0	0	111.6	H117 K183 I201 P202	H117-E185 HydrophobicContact CB-CG 3.86Å; H117-E185 IonicContact CE1-OE1 3.91Å; H117-E185 PolarHBondContact N-O 3.24Å; H117-E185 IonicContact ND1-OE1 3.64Å; H117-E185 PolarHBondContact O-N 3.23Å; K183-E185 WeakPolarHBondContact CE-OE1 3.35Å; K183-E185 WeakPolarHBondContact CE-OE2 3.39Å; K183-E185 IonicContact NZ-OE1 3.95Å; K183-E185 PolarHBondContact NZ-OE1 3.07Å; K183-E185 IonicContact NZ-OE2 3.26Å; E185-I201 VanDerWaalsContact CA-O 3.26Å; E185-I201 WeakPolarHBondContact CA-O 3.41Å; E185-I201 WeakPolarHBondContact CB-O 3.12Å; E185-P202 HydrophobicContact CB-CB 4.42Å
186	I	96.9	Very high	88.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128.4	161.2	59.7	169.1	0	0	0	109.4	Y52 F87 Y88 I116 V166 F168 I201 F216	Y52-I186 HydrophobicContact CD1-CD1 3.82Å; Y52-I186 HydrophobicContact CD2-CD1 3.95Å; Y52-I186 HydrophobicContact CE1-CD1 4.04Å; Y52-I186 HydrophobicContact CE2-CD1 4.16Å; Y52-I186 HydrophobicContact CG-CD1 3.79Å; F87-I186 HydrophobicContact CE2-CB 4.23Å; F87-I186 HydrophobicContact CE2-CG2 4.42Å; F87-I186 HydrophobicContact CZ-CB 4.33Å; Y88-I186 HydrophobicContact CE2-CD1 4.32Å; Y88-I186 HydrophobicContact CE2-CG1 4.47Å; Y88-I186 PolarHBondContact OH-O 3Å; I116-I186 HydrophobicContact CG1-CG2 4.3Å; I116-I186 HydrophobicContact CG2-CG2 4.38Å; V166-I186 HydrophobicContact CB-CG2 4.48Å; V166-I186 HydrophobicContact CG1-CG2 4.12Å; F168-I186 HydrophobicContact CZ-CG2 4.07Å; I186-I201 HydrophobicContact CD1-CD1 3.86Å; I186-I201 HydrophobicContact CG1-CB 3.8Å; I186-I201 HydrophobicContact CG1-CD1 4.01Å; I186-I201 HydrophobicContact CG1-CG1 4.27Å; I186-I201 PolarHBondContact N-O 3.44Å; I186-I201 PolarHBondContact O-N 2.78Å; I186-F216 HydrophobicContact CD1-CB 3.76Å; I186-F216 HydrophobicContact CD1-CD1 3.69Å; I186-F216 HydrophobicContact CD1-CD2 4.47Å; I186-F216 HydrophobicContact CD1-CE1 4.42Å; I186-F216 HydrophobicContact CD1-CG 3.72Å; I186-F216 HydrophobicContact CG1-CD1 3.93Å; I186-F216 HydrophobicContact CG1-CE1 4.16Å; I186-F216 HydrophobicContact CG1-CG 4.16Å; I186-F216 HydrophobicContact CG2-CD2 3.92Å; I186-F216 HydrophobicContact CG2-CE2 4.11Å; I186-F216 HydrophobicContact CG2-CG 4.23Å
187	F	94.2	Very high	87.7	Confident	25 Å²	25	46.6 Å²	46.6	11%	0.11	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.2	-177.6	-170.7	-120.9	0	0	0	110.1	F87 R114 N115 N198 H199 E200	F87-F187 VanDerWaalsContact CE1-O 3.3Å; F87-F187 WeakPolarHBondContact CE1-O 3.4Å; F87-F187 WeakPolarHBondContact CZ-O 3.42Å; R114-F187 HydrophobicContact CB-CB 4.48Å; R114-F187 HydrophobicContact CB-CD1 3.8Å; R114-F187 HydrophobicContact CB-CG 4.44Å; R114-F187 WeakPolarHBondContact CB-O 3.24Å; R114-F187 VanDerWaalsContact CD-CE1 3.49Å; R114-F187 HydrophobicContact CG-CD1 3.63Å; R114-F187 HydrophobicContact CG-CE1 4.03Å; R114-F187 HydrophobicContact CG-CG 4.43Å; N115-F187 VanDerWaalsContact O-CB 3.3Å; N115-F187 WeakPolarHBondContact O-CB 3.46Å; N115-F187 PolarHBondContact O-N 3.18Å; N115-F187 WeakPolarHBondContact OD1-CB 3.39Å; N115-F187 WeakPolarHBondContact OD1-CD1 3.31Å; N115-F187 WeakPolarHBondContact OD1-CG 3.43Å; F187-N198 HydrophobicContact CE2-CB 3.64Å; F187-N198 HydrophobicContact CZ-CB 3.49Å; F187-N198 VanDerWaalsContact CZ-CB 3.49Å; F187-H199 CarbonylContact C-O 3.37Å; F187-H199 WeakPolarHBondContact CA-O 3.4Å; F187-H199 WeakPolarHBondContact CD2-O 3.48Å; F187-E200 HydrophobicContact CD2-CB 4.44Å; F187-E200 HydrophobicContact CD2-CG 3.29Å; F187-E200 HydrophobicContact CE2-CG 3.46Å; F187-E200 VanDerWaalsContact CE2-CG 3.46Å; F187-E200 VanDerWaalsContact CE2-OE1 3.29Å; F187-E200 WeakPolarHBondContact CE2-OE1 3.27Å
188	G	91.6	Very high	87.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	-176.6	-179.8	0	0	0	0	0	112.7	Y88 H199	Y88-G188 VanDerWaalsContact CE2-CA 3.47Å; G188-H199 PolarHBondContact N-O 3.48Å; G188-H199 PolarHBondContact O-N 3.05Å
189	Q	86	Confident	87.3	Confident	77 Å²	77	44.6 Å²	44.6	36%	0.36	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.3	178.1	-167.3	-167.5	-70.6	0	0	109.1	R114 V196 T197	R114-Q189 HydrophobicContact CG-CB 4.31Å; Q189-V196 HydrophobicContact CG-CG1 3.4Å; Q189-V196 VanDerWaalsContact CG-CG1 3.4Å; Q189-V196 VanDerWaalsContact NE2-CG2 3.26Å; Q189-T197 WeakPolarHBondContact CA-O 3.34Å
190	L	81.9	Confident	87.5	Confident	11 Å²	11	47.9 Å²	47.9	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.7	179.4	-50.6	175	0	0	0	109.7	Y50 Y51 Y88 V196 T197 H199	Y50-L190 HydrophobicContact CD1-CD1 3.26Å; Y50-L190 HydrophobicContact CD1-CD2 3.64Å; Y50-L190 HydrophobicContact CD1-CG 4.01Å; Y50-L190 HydrophobicContact CE1-CB 4.41Å; Y50-L190 HydrophobicContact CE1-CD1 3.53Å; Y50-L190 HydrophobicContact CE1-CD2 3.47Å; Y50-L190 VanDerWaalsContact CE1-CD2 3.47Å; Y50-L190 HydrophobicContact CE1-CG 3.94Å; Y50-L190 HydrophobicContact CG-CD1 4.39Å; Y51-L190 HydrophobicContact CD2-CD2 3.87Å; Y51-L190 HydrophobicContact CE2-CD2 4.12Å; Y88-L190 HydrophobicContact CD1-CD2 4.11Å; Y88-L190 HydrophobicContact CE1-CD2 4.28Å; L190-V196 WeakPolarHBondContact O-CA 3.13Å; L190-T197 PolarHBondContact N-O 2.99Å; L190-T197 PolarHBondContact O-N 2.84Å; L190-H199 HydrophobicContact CD1-CB 3.57Å; L190-H199 VanDerWaalsContact CD1-CD2 3.48Å; L190-H199 WeakPolarHBondContact CD1-CD2 3.41Å; L190-H199 HydrophobicContact CD2-CB 4.39Å; L190-H199 HydrophobicContact CG-CB 3.69Å
191	S	77.3	Confident	87.7	Confident	84 Å²	84	45.1 Å²	45.1	59%	0.587	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	109	170.3	-174.7	0	0	0	0	109.5
192	C	72.4	Confident	87.7	Confident	12 Å²	12	45.3 Å²	45.3	8%	0.081	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	104.2	-178.4	-78.4	0	0	0	0	109.1	C31 G194 V195 T197	C31-C192 HydrophobicContact CB-CB 4.07Å; C31-C192 WeakPolarHBondContact CB-SG 3.4Å; C31-C192 WeakPolarHBondContact SG-CB 3.06Å; C31-C192 CovalentContact SG-SG 2.02Å; C31-C192 PolarHBondContact SG-SG 3.05Å; C192-G194 PolarHBondContact O-N 2.95Å; C192-G194 VanDerWaalsContact O-N 3.14Å; C192-V195 PolarHBondContact N-O 3.35Å; C192-V195 WeakPolarHBondContact O-CA 3.34Å; C192-V195 WeakPolarHBondContact O-CB 3.2Å; C192-V195 PolarHBondContact O-N 3.06Å; C192-T197 WeakPolarHBondContact CB-OG1 3.13Å
193	K	75.4	Confident	87.8	Confident	122 Å²	122	45.3 Å²	45.3	53%	0.53	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	32.5	-179.3	-64.6	174.2	159.7	174.4	0	114.2	N28 V195	N28-K193 VanDerWaalsContact CG-NZ 3.34Å; N28-K193 PolarHBondContact ND2-NZ 3.15Å; N28-K193 WeakPolarHBondContact OD1-CE 3.39Å; N28-K193 PolarHBondContact OD1-NZ 2.83Å; K193-V195 VanDerWaalsContact C-N 3.25Å; K193-V195 PolarHBondContact O-N 3.15Å
194	G	77.7	Confident	87.9	Confident	68 Å²	68	43.9 Å²	43.9	70%	0.701	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-6.2	-175.8	0	0	0	0	0	114.2	C192	C192-G194 PolarHBondContact O-N 2.95Å; C192-G194 VanDerWaalsContact O-N 3.14Å
195	V	79.3	Confident	87.8	Confident	95 Å²	95	45.7 Å²	45.7	58%	0.576	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	124	170.4	-175.7	0	0	0	0	109.1	C192 K193 T197	C192-V195 PolarHBondContact N-O 3.35Å; C192-V195 WeakPolarHBondContact O-CA 3.34Å; C192-V195 WeakPolarHBondContact O-CB 3.2Å; C192-V195 PolarHBondContact O-N 3.06Å; K193-V195 VanDerWaalsContact C-N 3.25Å; K193-V195 PolarHBondContact O-N 3.15Å; V195-T197 PolarHBondContact O-N 3.31Å; V195-T197 PolarHBondContact O-OG1 3.44Å
196	V	81.6	Confident	87.8	Confident	83 Å²	83	51.1 Å²	51.1	50%	0.503	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	119.5	171	157.9	0	0	0	0	109.2	Q189 L190	Q189-V196 HydrophobicContact CG-CG1 3.4Å; Q189-V196 VanDerWaalsContact CG-CG1 3.4Å; Q189-V196 VanDerWaalsContact NE2-CG2 3.26Å; L190-V196 WeakPolarHBondContact O-CA 3.13Å
197	T	83.4	Confident	87.8	Confident	53 Å²	53	51.5 Å²	51.5	33%	0.325	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.6	179.6	-38.7	0	0	0	0	109.7	Q189 L190 C192 V195	Q189-T197 WeakPolarHBondContact CA-O 3.34Å; L190-T197 PolarHBondContact N-O 2.99Å; L190-T197 PolarHBondContact O-N 2.84Å; C192-T197 WeakPolarHBondContact CB-OG1 3.13Å; V195-T197 PolarHBondContact O-N 3.31Å; V195-T197 PolarHBondContact O-OG1 3.44Å
198	N	86.2	Confident	88	Confident	89 Å²	89	50.5 Å²	50.5	48%	0.476	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	146	173.2	-70.2	-28.9	0	0	0	110.1	R114 F187	R114-N198 PolarHBondContact NE-OD1 3.02Å; R114-N198 PolarHBondContact NH2-OD1 3.17Å; R114-N198 VanDerWaalsContact NH2-OD1 3.08Å; F187-N198 HydrophobicContact CE2-CB 3.64Å; F187-N198 HydrophobicContact CZ-CB 3.49Å; F187-N198 VanDerWaalsContact CZ-CB 3.49Å
199	H	89.2	Confident	88.2	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.019	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.5	179.7	-177.3	-100.8	0	0	0	110.3	N33 Y50 Y88 F187 G188 L190 I201	N33-H199 PolarHBondContact OD1-CD2 2.82Å; N33-H199 PolarHBondContact OD1-NE2 2.96Å; Y50-H199 PolarHBondContact O-CE1 3.36Å; Y88-H199 HydrophobicContact CE1-CB 4.38Å; Y88-H199 AromaticContact CE1-ND1 3.52Å; Y88-H199 AromaticContact CZ-ND1 3.74Å; Y88-H199 PolarHBondContact OH-ND1 2.76Å; F187-H199 CarbonylContact C-O 3.37Å; F187-H199 WeakPolarHBondContact CA-O 3.4Å; F187-H199 WeakPolarHBondContact CD2-O 3.48Å; G188-H199 PolarHBondContact N-O 3.48Å; G188-H199 PolarHBondContact O-N 3.05Å; L190-H199 HydrophobicContact CD1-CB 3.57Å; L190-H199 VanDerWaalsContact CD1-CD2 3.48Å; L190-H199 WeakPolarHBondContact CD1-CD2 3.41Å; L190-H199 HydrophobicContact CD2-CB 4.39Å; L190-H199 HydrophobicContact CG-CB 3.69Å; H199-I201 VanDerWaalsContact CE1-CG1 3.49Å; H199-I201 WeakPolarHBondContact CE1-CG1 3.46Å
200	E	92.1	Very high	88.7	Confident	81 Å²	81	54 Å²	54	38%	0.379	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.8	-176.6	-74.3	168.2	-155.2	0	0	108.8	N33 F187 P202	N33-E200 PolarHBondContact ND2-O 3.04Å; F187-E200 HydrophobicContact CD2-CB 4.44Å; F187-E200 HydrophobicContact CD2-CG 3.29Å; F187-E200 HydrophobicContact CE2-CG 3.46Å; F187-E200 VanDerWaalsContact CE2-CG 3.46Å; F187-E200 VanDerWaalsContact CE2-OE1 3.29Å; F187-E200 WeakPolarHBondContact CE2-OE1 3.27Å; E200-P202 WeakPolarHBondContact O-CD 3.37Å
201	I	95.2	Very high	89.5	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	90.2	168.5	-55.7	173	0	0	0	107.2	H49 Y52 E185 I186 H199 F216	H49-I201 HydrophobicContact CB-CD1 3.72Å; H49-I201 HydrophobicContact CB-CG1 4.03Å; H49-I201 HydrophobicContact CB-CG2 4.38Å; Y52-I201 HydrophobicContact CD2-CD1 4.05Å; Y52-I201 HydrophobicContact CG-CD1 4.12Å; E185-I201 VanDerWaalsContact CA-O 3.26Å; E185-I201 WeakPolarHBondContact CA-O 3.41Å; E185-I201 WeakPolarHBondContact CB-O 3.12Å; I186-I201 HydrophobicContact CD1-CD1 3.86Å; I186-I201 HydrophobicContact CG1-CB 3.8Å; I186-I201 HydrophobicContact CG1-CD1 4.01Å; I186-I201 HydrophobicContact CG1-CG1 4.27Å; I186-I201 PolarHBondContact N-O 3.44Å; I186-I201 PolarHBondContact O-N 2.78Å; H199-I201 VanDerWaalsContact CE1-CG1 3.49Å; H199-I201 WeakPolarHBondContact CE1-CG1 3.46Å; I201-F216 HydrophobicContact CB-CE1 4.33Å; I201-F216 HydrophobicContact CG2-CD1 4.09Å; I201-F216 HydrophobicContact CG2-CE1 3.63Å
202	P	96	Very high	90.5	Very high	66 Å²	66	50 Å²	50	43%	0.429	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	142.7	179.7	32.1	-34.4	0	0	0	111.3	E185 E200	E185-P202 HydrophobicContact CB-CB 4.42Å; E200-P202 WeakPolarHBondContact O-CD 3.37Å
203	V	97.8	Very high	91.7	Very high	9 Å²	9	50.5 Å²	50.5	6%	0.055	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-72.1	125.3	164.8	-177.4	0	0	0	0	108.3	I56 F168 S184 A205 W207 I208 V214 F216	I56-V203 HydrophobicContact CD1-CG1 4.29Å; F168-V203 HydrophobicContact CD2-CG2 3.91Å; F168-V203 HydrophobicContact CE2-CG2 4.24Å; S184-V203 WeakPolarHBondContact O-CG2 3.28Å; S184-V203 PolarHBondContact O-N 3.08Å; V203-A205 PolarHBondContact O-N 3.1Å; V203-W207 HydrophobicContact CG1-CB 4.42Å; V203-I208 HydrophobicContact CB-CD1 4.37Å; V203-I208 HydrophobicContact CB-CG1 4.42Å; V203-I208 HydrophobicContact CG1-CD1 4.38Å; V203-I208 HydrophobicContact CG1-CG1 3.9Å; V203-V214 HydrophobicContact CG1-CG2 3.83Å; V203-V214 HydrophobicContact CG2-CB 4.4Å; V203-V214 HydrophobicContact CG2-CG1 3.92Å; V203-V214 HydrophobicContact CG2-CG2 4.12Å; V203-F216 HydrophobicContact CG2-CE2 4.48Å; V203-F216 HydrophobicContact CG2-CZ 3.82Å
204	P	96.9	Very high	92.8	Very high	28 Å²	28	44.7 Å²	44.7	18%	0.182	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-64.2	128.6	179.5	-13.5	24.1	0	0	0	110.5	M54 K206 W207	M54-P204 HydrophobicContact CE-CG 4.38Å; P204-K206 PolarHBondContact O-N 3.35Å; P204-W207 WeakPolarHBondContact O-CB 3.08Å; P204-W207 PolarHBondContact O-N 2.93Å
205	A	96.6	Very high	93.8	Very high	43 Å²	43	42.5 Å²	42.5	36%	0.355	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-52	-33.3	-170.7	0	0	0	0	0	114.6	V203 W207 I208	V203-A205 PolarHBondContact O-N 3.1Å; A205-W207 PolarHBondContact O-N 2.89Å; A205-W207 VanDerWaalsContact O-N 3.13Å; A205-I208 PolarHBondContact O-N 2.85Å
206	K	95.8	Very high	94.6	Very high	123 Å²	123	38 Å²	38	54%	0.535	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-61	-21.5	178.4	72.9	175.6	-173.2	172.4	0	114	E40 P204 K209	E40-K206 WeakPolarHBondContact OE1-CE 3.04Å; E40-K206 IonicContact OE1-NZ 3.46Å; E40-K206 PolarHBondContact OE1-NZ 2.83Å; E40-K206 IonicContact OE2-NZ 2.81Å; P204-K206 PolarHBondContact O-N 3.35Å; K206-K209 WeakPolarHBondContact O-CE 3.16Å
207	W	97.4	Very high	95.3	Very high	8 Å²	8	35.8 Å²	35.8	3%	0.03	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-90.9	-13.6	178.3	-69.4	102.4	0	0	0	113.1	E40 N41 R45 I56 R58 V203 P204 A205 K209 T212	E40-W207 HydrophobicContact CG-CZ2 4.06Å; E40-W207 PolarHBondContact OE1-NE1 3.45Å; N41-W207 WeakPolarHBondContact O-CH2 3.44Å; N41-W207 WeakPolarHBondContact O-CZ2 3.46Å; R45-W207 HydrophobicContact CB-CH2 4.11Å; R45-W207 HydrophobicContact CB-CZ2 3.63Å; I56-W207 HydrophobicContact CB-CD2 4.34Å; I56-W207 HydrophobicContact CB-CE3 4.26Å; I56-W207 HydrophobicContact CD1-CB 4Å; I56-W207 HydrophobicContact CD1-CD2 4.25Å; I56-W207 HydrophobicContact CD1-CG 3.76Å; I56-W207 HydrophobicContact CG2-CB 3.96Å; I56-W207 HydrophobicContact CG2-CD2 3.72Å; I56-W207 HydrophobicContact CG2-CE3 3.42Å; I56-W207 VanDerWaalsContact CG2-CE3 3.42Å; I56-W207 HydrophobicContact CG2-CG 3.95Å; I56-W207 HydrophobicContact CG2-CZ3 4.14Å; R58-W207 HydrophobicContact CG-CE3 3.85Å; R58-W207 HydrophobicContact CG-CZ3 3.55Å; V203-W207 HydrophobicContact CG1-CB 4.42Å; P204-W207 WeakPolarHBondContact O-CB 3.08Å; P204-W207 PolarHBondContact O-N 2.93Å; A205-W207 PolarHBondContact O-N 2.89Å; A205-W207 VanDerWaalsContact O-N 3.13Å; W207-K209 PolarHBondContact O-N 3.21Å; W207-T212 WeakPolarHBondContact O-CB 3.39Å; W207-T212 WeakPolarHBondContact O-CG2 3.15Å; W207-T212 PolarHBondContact O-OG1 2.87Å; W207-T212 VanDerWaalsContact O-OG1 3.09Å
208	I	97.6	Very high	95.7	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	20%	0.2	C	C	.	.			trans	-79.7	85.5	-178.7	-55.9	-177.8	0	0	0	109.4	Y170 L182 V203 A205	Y170-I208 HydrophobicContact CD1-CG2 3.74Å; Y170-I208 HydrophobicContact CE1-CB 4.35Å; Y170-I208 HydrophobicContact CE1-CG1 4.23Å; Y170-I208 HydrophobicContact CE1-CG2 3.53Å; Y170-I208 HydrophobicContact CE2-CG1 4.27Å; Y170-I208 HydrophobicContact CE2-CG2 4.47Å; Y170-I208 HydrophobicContact CG-CG2 4.3Å; L182-I208 HydrophobicContact CB-CD1 4.09Å; L182-I208 HydrophobicContact CB-CG2 3.94Å; L182-I208 HydrophobicContact CD1-CG2 4Å; L182-I208 HydrophobicContact CD2-CG2 3.8Å; L182-I208 HydrophobicContact CG-CG2 4.11Å; V203-I208 HydrophobicContact CB-CD1 4.37Å; V203-I208 HydrophobicContact CB-CG1 4.42Å; V203-I208 HydrophobicContact CG1-CD1 4.38Å; V203-I208 HydrophobicContact CG1-CG1 3.9Å; A205-I208 PolarHBondContact O-N 2.85Å
209	K	96.7	Very high	95.9	Very high	107 Å²	107	33 Å²	33	47%	0.465	19%	0.185	S	C	.	.	S	Bend	trans	-145	160.9	175.5	-43.8	174.3	177.7	169.4	0	109.7	K206 W207 T212	K206-K209 WeakPolarHBondContact O-CE 3.16Å; W207-K209 PolarHBondContact O-N 3.21Å; K209-T212 WeakPolarHBondContact O-CB 3.5Å; K209-T212 PolarHBondContact O-N 2.93Å; K209-T212 PolarHBondContact O-OG1 3.41Å
210	S	97.1	Very high	95.8	Very high	43 Å²	43	33.7 Å²	33.7	30%	0.301	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	140	178.6	-50.8	0	0	0	0	113.1	R58 Y170 I173 T212	R58-S210 PolarHBondContact NH1-O 2.86Å; Y170-S210 CarbonylContact O-C 3.53Å; Y170-S210 WeakPolarHBondContact O-CA 3.26Å; I173-S210 PolarHBondContact N-OG 2.68Å; I173-S210 PolarHBondContact O-OG 2.98Å; S210-T212 VanDerWaalsContact C-N 3.31Å; S210-T212 PolarHBondContact O-N 3.21Å
211	G	97.1	Very high	95.4	Very high	12 Å²	12	35.1 Å²	35.1	12%	0.124	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	23.3	178.9	0	0	0	0	0	113.9	R58 Y59 Q60 Y170	R58-G211 CarbonylContact C-O 3.58Å; Y59-G211 PolarHBondContact N-O 3.46Å; Q60-G211 PolarHBondContact N-O 3.08Å; Y170-G211 PolarHBondContact O-N 2.81Å
212	T	98.2	Very high	95	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	130.2	173.7	-45.1	0	0	0	0	110	I56 Q57 R58 Y169 Y170 W207 K209 S210	I56-T212 HydrophobicContact CG2-CG2 3.46Å; I56-T212 VanDerWaalsContact CG2-CG2 3.46Å; Q57-T212 WeakPolarHBondContact O-CA 3.39Å; R58-T212 VanDerWaalsContact CD-OG1 3.32Å; R58-T212 WeakPolarHBondContact CD-OG1 3.4Å; R58-T212 PolarHBondContact NH1-OG1 3.14Å; Y169-T212 WeakPolarHBondContact CA-O 3.08Å; Y169-T212 WeakPolarHBondContact CD2-O 3.48Å; Y170-T212 HydrophobicContact CD2-CG2 4.48Å; Y170-T212 WeakPolarHBondContact CD2-O 3.29Å; Y170-T212 PolarHBondContact N-O 3.26Å; W207-T212 WeakPolarHBondContact O-CB 3.39Å; W207-T212 WeakPolarHBondContact O-CG2 3.15Å; W207-T212 PolarHBondContact O-OG1 2.87Å; W207-T212 VanDerWaalsContact O-OG1 3.09Å; K209-T212 WeakPolarHBondContact O-CB 3.5Å; K209-T212 PolarHBondContact O-N 2.93Å; K209-T212 PolarHBondContact O-OG1 3.41Å; S210-T212 VanDerWaalsContact C-N 3.31Å; S210-T212 PolarHBondContact O-N 3.21Å
213	L	98.4	Very high	94.7	Very high	23 Å²	23	36 Å²	36	12%	0.12	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.3	171.2	179.3	64	0	0	0	109.1	I56 Q57 Q60 F168 Y169 E215	I56-L213 CarbonylContact C-O 3.51Å; I56-L213 WeakPolarHBondContact CA-O 3.27Å; Q57-L213 PolarHBondContact N-O 3.28Å; Q57-L213 PolarHBondContact O-N 2.64Å; Q60-L213 HydrophobicContact CB-CB 3.94Å; Q60-L213 HydrophobicContact CG-CB 3.81Å; F168-L213 CarbonylContact O-C 3.55Å; F168-L213 WeakPolarHBondContact O-CA 3.22Å; Y169-L213 HydrophobicContact CD2-CB 4.38Å; L213-E215 HydrophobicContact CD1-CG 4.44Å; L213-E215 HydrophobicContact CD2-CG 4.17Å; L213-E215 HydrophobicContact CG-CG 4.02Å
214	V	98.5	Very high	94.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.9	171.5	-178.2	0	0	0	0	108.1	M54 R55 I56 S167 F168 Y170 V203 F216	M54-V214 HydrophobicContact CG-CG1 3.8Å; M54-V214 HydrophobicContact SD-CG1 3.97Å; R55-V214 CarbonylContact O-C 3.6Å; R55-V214 VanDerWaalsContact O-CA 3.31Å; R55-V214 WeakPolarHBondContact O-CA 3.2Å; I56-V214 HydrophobicContact CD1-CG2 4.41Å; I56-V214 HydrophobicContact CG1-CG1 4.25Å; I56-V214 HydrophobicContact CG1-CG2 4.13Å; I56-V214 HydrophobicContact CG2-CG2 4.12Å; S167-V214 CarbonylContact C-O 3.53Å; S167-V214 WeakPolarHBondContact CA-O 3.49Å; F168-V214 HydrophobicContact CB-CB 4.3Å; F168-V214 PolarHBondContact N-O 3.41Å; F168-V214 PolarHBondContact O-N 2.85Å; Y170-V214 HydrophobicContact CE2-CG2 3.88Å; V203-V214 HydrophobicContact CG1-CG2 3.83Å; V203-V214 HydrophobicContact CG2-CB 4.4Å; V203-V214 HydrophobicContact CG2-CG1 3.92Å; V203-V214 HydrophobicContact CG2-CG2 4.12Å; V214-F216 HydrophobicContact CG1-CD2 4.37Å; V214-F216 HydrophobicContact CG1-CE1 4.29Å; V214-F216 HydrophobicContact CG1-CE2 3.71Å; V214-F216 HydrophobicContact CG1-CZ 3.68Å
215	E	97.9	Very high	93.7	Very high	21 Å²	21	43.1 Å²	43.1	10%	0.098	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	124.5	178.4	-57.7	-176.6	109.5	0	0	110.1	M54 R55 K165 L213	M54-E215 WeakPolarHBondContact CA-O 3.39Å; R55-E215 HydrophobicContact CB-CB 4.45Å; R55-E215 PolarHBondContact N-O 3.41Å; R55-E215 IonicContact NH1-OE2 2.64Å; R55-E215 PolarHBondContact NH1-OE2 2.88Å; R55-E215 PolarHBondContact O-N 2.87Å; K165-E215 HydrophobicContact CD-CB 4.3Å; K165-E215 WeakPolarHBondContact CE-OE1 3.42Å; K165-E215 IonicContact NZ-OE1 3.67Å; K165-E215 PolarHBondContact NZ-OE1 2.92Å; L213-E215 HydrophobicContact CD1-CG 4.44Å; L213-E215 HydrophobicContact CD2-CG 4.17Å; L213-E215 HydrophobicContact CG-CG 4.02Å
216	F	97.6	Very high	93.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121	170.2	-54.7	-84.7	0	0	0	109.1	Y52 S53 M54 K165 V166 F168 I186 I201 V203 V214	Y52-F216 HydrophobicContact CD1-CB 4.06Å; S53-F216 WeakPolarHBondContact O-CA 3.37Å; M54-F216 HydrophobicContact CB-CD1 4.15Å; M54-F216 HydrophobicContact CB-CE1 4.2Å; M54-F216 HydrophobicContact CG-CD1 4.14Å; M54-F216 HydrophobicContact CG-CE1 3.82Å; M54-F216 HydrophobicContact CG-CZ 4.47Å; M54-F216 HydrophobicContact SD-CD1 4.5Å; M54-F216 HydrophobicContact SD-CE1 3.63Å; M54-F216 HydrophobicContact SD-CZ 4.09Å; K165-F216 WeakPolarHBondContact CA-O 3.48Å; K165-F216 WeakPolarHBondContact CG-O 3.5Å; V166-F216 HydrophobicContact CB-CB 4.39Å; V166-F216 HydrophobicContact CB-CD2 4.35Å; V166-F216 HydrophobicContact CG1-CD2 4.39Å; V166-F216 PolarHBondContact N-O 2.88Å; V166-F216 WeakPolarHBondContact O-CD2 3.42Å; V166-F216 PolarHBondContact O-N 3.4Å; F168-F216 AromaticContact CD2-CE2 3.71Å; F168-F216 HydrophobicContact CD2-CE2 3.71Å; F168-F216 HydrophobicContact CD2-CZ 4.3Å; F168-F216 AromaticContact CE2-CE2 3.49Å; F168-F216 HydrophobicContact CE2-CE2 3.49Å; F168-F216 VanDerWaalsContact CE2-CE2 3.49Å; F168-F216 AromaticContact CE2-CZ 3.99Å; F168-F216 HydrophobicContact CE2-CZ 3.99Å; F168-F216 HydrophobicContact CG-CE2 4.31Å; F168-F216 AromaticContact CZ-CE2 3.92Å; F168-F216 HydrophobicContact CZ-CE2 3.92Å; I186-F216 HydrophobicContact CD1-CB 3.76Å; I186-F216 HydrophobicContact CD1-CD1 3.69Å; I186-F216 HydrophobicContact CD1-CD2 4.47Å; I186-F216 HydrophobicContact CD1-CE1 4.42Å; I186-F216 HydrophobicContact CD1-CG 3.72Å; I186-F216 HydrophobicContact CG1-CD1 3.93Å; I186-F216 HydrophobicContact CG1-CE1 4.16Å; I186-F216 HydrophobicContact CG1-CG 4.16Å; I186-F216 HydrophobicContact CG2-CD2 3.92Å; I186-F216 HydrophobicContact CG2-CE2 4.11Å; I186-F216 HydrophobicContact CG2-CG 4.23Å; I201-F216 HydrophobicContact CB-CE1 4.33Å; I201-F216 HydrophobicContact CG2-CD1 4.09Å; I201-F216 HydrophobicContact CG2-CE1 3.63Å; V203-F216 HydrophobicContact CG2-CE2 4.48Å; V203-F216 HydrophobicContact CG2-CZ 3.82Å; V214-F216 HydrophobicContact CG1-CD2 4.37Å; V214-F216 HydrophobicContact CG1-CE1 4.29Å; V214-F216 HydrophobicContact CG1-CE2 3.71Å; V214-F216 HydrophobicContact CG1-CZ 3.68Å
217	E	95.3	Very high	92.9	Very high	37 Å²	37	42.8 Å²	42.8	17%	0.173	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.9	177.9	-166.9	-176.9	165.8	0	0	109.7	Y52 S53 I219 K263	Y52-E217 CarbonylContact C-O 3.59Å; Y52-E217 VanDerWaalsContact CA-O 3.26Å; Y52-E217 WeakPolarHBondContact CA-O 3.31Å; S53-E217 PolarHBondContact N-O 3.39Å; S53-E217 PolarHBondContact O-N 3.17Å; E217-I219 PolarHBondContact O-N 2.48Å; E217-K263 WeakPolarHBondContact OE1-CE 3.32Å; E217-K263 IonicContact OE1-NZ 3.82Å; E217-K263 PolarHBondContact OE1-NZ 3.25Å; E217-K263 WeakPolarHBondContact OE2-CE 3.43Å; E217-K263 IonicContact OE2-NZ 2.98Å; E217-K263 PolarHBondContact OE2-NZ 2.93Å
218	A	92.8	Very high	92.6	Very high	54 Å²	54	44.7 Å²	44.7	45%	0.446	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132	178.2	0	0	0	0	0	110.6	Y51 Y52	Y51-A218 CarbonylContact O-C 3.55Å; Y51-A218 VanDerWaalsContact O-CA 3.31Å; Y51-A218 WeakPolarHBondContact O-CA 2.92Å; Y52-A218 HydrophobicContact CD1-CB 4.43Å; Y52-A218 HydrophobicContact CE1-CB 4.11Å
219	I	90	Very high	92.4	Very high	29 Å²	29	48.9 Å²	48.9	15%	0.149	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-79.7	121.1	171.4	-61.2	171.3	0	0	0	107.2	L48 Y51 E217 I252	L48-I219 HydrophobicContact CD2-CD1 4.03Å; Y51-I219 PolarHBondContact O-N 3.36Å; E217-I219 PolarHBondContact O-N 2.48Å; I219-I252 HydrophobicContact CG2-CB 4.49Å; I219-I252 HydrophobicContact CG2-CG2 4.13Å
220	G	86.8	Confident	92.2	Very high	19 Å²	19	49.2 Å²	49.2	20%	0.196	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-67.1	145.6	179.3	0	0	0	0	0	112.9	I222 S224 E253	G220-I222 PolarHBondContact O-N 3.49Å; G220-S224 WeakPolarHBondContact O-CB 3.48Å; G220-S224 PolarHBondContact O-OG 2.91Å; G220-E253 VanDerWaalsContact CA-CD 3.4Å; G220-E253 VanDerWaalsContact CA-OE1 3.22Å; G220-E253 WeakPolarHBondContact CA-OE1 3.38Å
221	E	84.7	Confident	92.1	Very high	112 Å²	112	48.9 Å²	48.9	52%	0.523	26%	0.261	S	S	.	.	H	α-helix	trans	-76	-22.4	-170.8	-61.9	-170.7	160.2	0	0	113.1	Y51 S224 E253	Y51-E221 HydrophobicContact CE1-CG 4.5Å; Y51-E221 WeakPolarHBondContact CE1-OE1 3.34Å; Y51-E221 PolarHBondContact OH-OE1 2.92Å; E221-S224 WeakPolarHBondContact CA-OG 3.25Å; E221-S224 PolarHBondContact O-OG 2.96Å; E221-E253 PolarHBondContact N-OE1 2.81Å
222	I	86.1	Confident	91.9	Very high	83 Å²	83	48.3 Å²	48.3	43%	0.426	26%	0.255	S	S	.	.	H	α-helix	trans	-71.5	-49.6	-171.6	-57.2	172.3	0	0	0	110.6	G220 Q225 Y226 T240 E253	G220-I222 PolarHBondContact O-N 3.49Å; I222-Q225 VanDerWaalsContact O-CG 3.27Å; I222-Q225 WeakPolarHBondContact O-CG 3.32Å; I222-Q225 PolarHBondContact O-NE2 2.85Å; I222-Y226 VanDerWaalsContact O-CE2 3.27Å; I222-Y226 WeakPolarHBondContact O-CE2 3.44Å; I222-T240 HydrophobicContact CB-CG2 4.27Å; I222-T240 HydrophobicContact CD1-CG2 4.34Å; I222-T240 HydrophobicContact CG2-CG2 4.16Å; I222-E253 WeakPolarHBondContact CA-OE1 3.37Å; I222-E253 VanDerWaalsContact CB-OE1 3.23Å; I222-E253 WeakPolarHBondContact CB-OE1 3.5Å; I222-E253 PolarHBondContact N-OE1 2.9Å
223	C	90.1	Very high	91.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-76	-33.9	179.6	-62.1	0	0	0	0	111.2	Q225 Y226 C242 C251 E253	C223-Q225 PolarHBondContact O-N 3.2Å; C223-Y226 VanDerWaalsContact O-CD2 3.3Å; C223-Y226 WeakPolarHBondContact O-CD2 3.32Å; C223-Y226 PolarHBondContact O-N 3.18Å; C223-C242 HydrophobicContact CB-CB 3.84Å; C223-C242 WeakPolarHBondContact CB-SG 3.34Å; C223-C242 WeakPolarHBondContact SG-CA 3.38Å; C223-C242 WeakPolarHBondContact SG-CB 3.5Å; C223-C242 CovalentContact SG-SG 2.03Å; C223-C242 PolarHBondContact SG-SG 3.4Å; C223-C251 CarbonylContact C-O 3.57Å; C223-C251 VanDerWaalsContact CB-SG 3.59Å; C223-C251 VanDerWaalsContact O-CB 3.22Å; C223-C251 WeakPolarHBondContact O-CB 3.3Å; C223-C251 PolarHBondContact O-SG 2.9Å; C223-E253 HydrophobicContact CB-CG 3.7Å; C223-E253 WeakPolarHBondContact SG-CG 3.23Å
224	S	86.6	Confident	91.4	Very high	64 Å²	64	60.4 Å²	60.4	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-15.8	-176.1	73.4	0	0	0	0	115.3	G220 E221 Y226 C251	G220-S224 WeakPolarHBondContact O-CB 3.48Å; G220-S224 PolarHBondContact O-OG 2.91Å; E221-S224 WeakPolarHBondContact CA-OG 3.25Å; E221-S224 PolarHBondContact O-OG 2.96Å; S224-Y226 VanDerWaalsContact C-N 3.33Å; S224-C251 VanDerWaalsContact CA-O 3.29Å; S224-C251 WeakPolarHBondContact CA-O 3.36Å; S224-C251 PolarHBondContact N-O 3.37Å
225	Q	86	Confident	91.1	Very high	124 Å²	124	61.1 Å²	61.1	58%	0.579	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-18.1	177	77.4	-168.1	-39.1	0	0	113.7	I222 C223	I222-Q225 VanDerWaalsContact O-CG 3.27Å; I222-Q225 WeakPolarHBondContact O-CG 3.32Å; I222-Q225 PolarHBondContact O-NE2 2.85Å; C223-Q225 PolarHBondContact O-N 3.2Å
226	Y	88.9	Confident	90.8	Very high	75 Å²	75	63 Å²	63	29%	0.294	32%	0.323	S	S	.	.			trans	-89.8	127.7	-178.3	-57.1	-70.4	0	0	0	110.6	I222 C223 S224 A235 C251	I222-Y226 VanDerWaalsContact O-CE2 3.27Å; I222-Y226 WeakPolarHBondContact O-CE2 3.44Å; C223-Y226 VanDerWaalsContact O-CD2 3.3Å; C223-Y226 WeakPolarHBondContact O-CD2 3.32Å; C223-Y226 PolarHBondContact O-N 3.18Å; S224-Y226 VanDerWaalsContact C-N 3.33Å; Y226-A235 HydrophobicContact CD2-CB 3.61Å; Y226-A235 HydrophobicContact CE1-CB 4.2Å; Y226-A235 HydrophobicContact CE2-CB 3.06Å; Y226-A235 HydrophobicContact CG-CB 4.38Å; Y226-C251 WeakPolarHBondContact O-CB 3.21Å
227	N	88.2	Confident	90.4	Very high	83 Å²	83	66.8 Å²	66.8	44%	0.444	35%	0.347	S	S	.	.			trans	-109.7	7.8	-173.4	68	-22.5	0	0	0	113.6	Y22 W244	Y22-N227 PolarHBondContact OH-ND2 3.27Å; N227-W244 VanDerWaalsContact C-CH2 3.48Å; N227-W244 WeakPolarHBondContact O-CH2 3.46Å
228	T	90.3	Very high	90	Very high	48 Å²	48	71 Å²	71	29%	0.294	38%	0.381	S	S	.	.	S	Bend	trans	-130.7	153.2	170.9	86.3	0	0	0	0	110.4	E230 T231 C232	T228-E230 VanDerWaalsContact C-N 3.3Å; T228-E230 WeakPolarHBondContact CB-OE2 3.3Å; T228-E230 PolarHBondContact O-N 3.45Å; T228-E230 PolarHBondContact OG1-OE2 2.88Å; T228-E230 VanDerWaalsContact OG1-OE2 3.07Å; T228-T231 PolarHBondContact N-OG1 3.31Å; T228-T231 PolarHBondContact O-N 2.95Å; T228-T231 PolarHBondContact O-OG1 3.06Å; T228-T231 PolarHBondContact OG1-N 2.75Å; T228-T231 PolarHBondContact OG1-OG1 3.3Å; T228-C232 WeakPolarHBondContact O-CB 3.39Å; T228-C232 PolarHBondContact O-N 3.02Å
229	K	93.3	Very high	89.7	Confident	93 Å²	93	77 Å²	77	40%	0.404	40%	0.396	S	S	.	.	H	α-helix	trans	-55.4	-45.2	176.4	-177.2	174.3	-178.1	170.9	0	112.3	T231 C232 L233 W244 E246	K229-T231 PolarHBondContact O-N 3.15Å; K229-C232 WeakPolarHBondContact O-CB 3.28Å; K229-C232 PolarHBondContact O-N 2.78Å; K229-L233 HydrophobicContact CG-CD1 3.89Å; K229-L233 HydrophobicContact CG-CG 4.44Å; K229-L233 WeakPolarHBondContact O-CB 3.48Å; K229-L233 VanDerWaalsContact O-CG 3.25Å; K229-L233 WeakPolarHBondContact O-CG 3.3Å; K229-L233 PolarHBondContact O-N 3.38Å; K229-W244 HydrophobicContact CB-CB 4.49Å; K229-W244 HydrophobicContact CB-CD2 3.92Å; K229-W244 HydrophobicContact CB-CG 3.79Å; K229-W244 HydrophobicContact CD-CG 4.5Å; K229-W244 HydrophobicContact CG-CB 4.1Å; K229-W244 HydrophobicContact CG-CD2 4.45Å; K229-W244 HydrophobicContact CG-CG 3.81Å; K229-E246 IonicContact NZ-OE2 2.84Å
230	E	93.3	Very high	89.7	Confident	114 Å²	114	76.5 Å²	76.5	53%	0.533	40%	0.395	S	S	.	.	H	α-helix	trans	-69.4	-37.9	-175.1	-55.5	68.5	-145.5	0	0	111.5	T228 R234	T228-E230 VanDerWaalsContact C-N 3.3Å; T228-E230 WeakPolarHBondContact CB-OE2 3.3Å; T228-E230 PolarHBondContact O-N 3.45Å; T228-E230 PolarHBondContact OG1-OE2 2.88Å; T228-E230 VanDerWaalsContact OG1-OE2 3.07Å; E230-R234 WeakPolarHBondContact O-CB 3.37Å; E230-R234 WeakPolarHBondContact O-CG 3.48Å; E230-R234 PolarHBondContact O-N 3.03Å; E230-R234 PolarHBondContact O-NE 3.26Å
231	T	93.9	Very high	90	Very high	36 Å²	36	77.9 Å²	77.9	22%	0.221	40%	0.397	C	S	.	.	H	α-helix	trans	-73.1	-40.9	176.8	51.9	0	0	0	0	111.1	T228 K229 R234 A235	T228-T231 PolarHBondContact N-OG1 3.31Å; T228-T231 PolarHBondContact O-N 2.95Å; T228-T231 PolarHBondContact O-OG1 3.06Å; T228-T231 PolarHBondContact OG1-N 2.75Å; T228-T231 PolarHBondContact OG1-OG1 3.3Å; K229-T231 PolarHBondContact O-N 3.15Å; T231-R234 PolarHBondContact O-N 3.08Å; T231-A235 PolarHBondContact O-N 2.95Å; T231-A235 VanDerWaalsContact O-N 3.16Å
232	C	93.9	Very high	90.5	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-56.8	-53.6	174.2	178.6	0	0	0	0	112.2	T228 K229 R234 A235 C242 I243 W244 C251	T228-C232 WeakPolarHBondContact O-CB 3.39Å; T228-C232 PolarHBondContact O-N 3.02Å; K229-C232 WeakPolarHBondContact O-CB 3.28Å; K229-C232 PolarHBondContact O-N 2.78Å; C232-R234 PolarHBondContact O-N 3.01Å; C232-A235 WeakPolarHBondContact O-CB 3.08Å; C232-A235 PolarHBondContact O-N 3.16Å; C232-C242 WeakPolarHBondContact O-CB 3.33Å; C232-I243 VanDerWaalsContact SG-C 3.55Å; C232-I243 PolarHBondContact SG-O 2.8Å; C232-W244 HydrophobicContact CB-CE3 3.65Å; C232-W244 HydrophobicContact CB-CZ3 4.3Å; C232-C251 WeakPolarHBondContact CA-SG 3.49Å; C232-C251 HydrophobicContact CB-CB 3.59Å; C232-C251 WeakPolarHBondContact CB-SG 3.35Å; C232-C251 WeakPolarHBondContact SG-CB 3.46Å; C232-C251 CovalentContact SG-SG 2.02Å; C232-C251 PolarHBondContact SG-SG 2.99Å
233	L	92.6	Very high	90.8	Very high	86 Å²	86	69.4 Å²	69.4	45%	0.45	36%	0.357	S	S	.	.	H	α-helix	trans	-66.8	-37.9	-176.5	-65.9	175.1	0	0	0	112.1	K229 A235 T236	K229-L233 HydrophobicContact CG-CD1 3.89Å; K229-L233 HydrophobicContact CG-CG 4.44Å; K229-L233 WeakPolarHBondContact O-CB 3.48Å; K229-L233 VanDerWaalsContact O-CG 3.25Å; K229-L233 WeakPolarHBondContact O-CG 3.3Å; K229-L233 PolarHBondContact O-N 3.38Å; L233-A235 PolarHBondContact O-N 3.48Å; L233-T236 WeakPolarHBondContact O-CB 3.41Å; L233-T236 PolarHBondContact O-N 3.16Å; L233-T236 PolarHBondContact O-OG1 3.35Å
234	R	93.4	Very high	90.9	Very high	191 Å²	191	70.4 Å²	70.4	72%	0.721	36%	0.36	S	S	*	.	H	α-helix	trans	-67.9	-20.4	176.6	-76.3	-175.2	-63.8	156.6	-3.3	114	E230 T231 C232 T236	E230-R234 WeakPolarHBondContact O-CB 3.37Å; E230-R234 WeakPolarHBondContact O-CG 3.48Å; E230-R234 PolarHBondContact O-N 3.03Å; E230-R234 PolarHBondContact O-NE 3.26Å; T231-R234 PolarHBondContact O-N 3.08Å; C232-R234 PolarHBondContact O-N 3.01Å; R234-T236 PolarHBondContact O-N 3.45Å
235	A	91.2	Very high	91.2	Very high	15 Å²	15	67.4 Å²	67.4	12%	0.124	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.5	177.4	0	0	0	0	0	113.6	Y226 T231 C232 L233 T237	Y226-A235 HydrophobicContact CD2-CB 3.61Å; Y226-A235 HydrophobicContact CE1-CB 4.2Å; Y226-A235 HydrophobicContact CE2-CB 3.06Å; Y226-A235 HydrophobicContact CG-CB 4.38Å; T231-A235 PolarHBondContact O-N 2.95Å; T231-A235 VanDerWaalsContact O-N 3.16Å; C232-A235 WeakPolarHBondContact O-CB 3.08Å; C232-A235 PolarHBondContact O-N 3.16Å; L233-A235 PolarHBondContact O-N 3.48Å; A235-T237 PolarHBondContact O-N 2.95Å
236	T	91.3	Very high	91.4	Very high	60 Å²	60	67.2 Å²	67.2	37%	0.368	34%	0.338	S	S	.	.			trans	-64	129.2	175.1	-64.2	0	0	0	0	110.5	L233 R234 T240 I241 C242	L233-T236 WeakPolarHBondContact O-CB 3.41Å; L233-T236 PolarHBondContact O-N 3.16Å; L233-T236 PolarHBondContact O-OG1 3.35Å; R234-T236 PolarHBondContact O-N 3.45Å; T236-T240 CarbonylContact C-O 3.56Å; T236-T240 WeakPolarHBondContact CA-O 3.48Å; T236-I241 HydrophobicContact CG2-CB 4.47Å; T236-I241 HydrophobicContact CG2-CG1 4.35Å; T236-I241 HydrophobicContact CG2-CG2 4.41Å; T236-C242 PolarHBondContact OG1-N 3.33Å; T236-C242 VanDerWaalsContact OG1-N 3.07Å; T236-C242 PolarHBondContact OG1-O 3.14Å
237	T	90.4	Very high	91.4	Very high	80 Å²	80	69.5 Å²	69.5	49%	0.491	35%	0.35	S	S	.	.			trans	-127.2	179.6	177	65	0	0	0	0	109.7	A235 K239 T240	A235-T237 PolarHBondContact O-N 2.95Å; T237-K239 PolarHBondContact O-N 3.01Å; T237-K239 PolarHBondContact OG1-N 2.84Å; T237-T240 PolarHBondContact N-O 3.42Å; T237-T240 PolarHBondContact OG1-N 2.8Å; T237-T240 VanDerWaalsContact OG1-N 3.14Å
238	S	85.6	Confident	91.3	Very high	126 Å²	126	65.9 Å²	65.9	88%	0.881	33%	0.332	S	S	*	.	S	Bend	trans	-62.4	-21.3	174.1	55.2	0	0	0	0	114.1
239	K	87.5	Confident	91.2	Very high	179 Å²	179	68.9 Å²	68.9	78%	0.778	35%	0.346	S	S	*	.	S	Bend	trans	-106.8	-24	-177.5	-65.3	-175.4	179.1	-178	0	113.8	T237	T237-K239 PolarHBondContact O-N 3.01Å; T237-K239 PolarHBondContact OG1-N 2.84Å
240	T	90.7	Very high	91.1	Very high	18 Å²	18	65.8 Å²	65.8	11%	0.11	34%	0.337	C	S	.	.			trans	-132.3	119.5	-175	-56.4	0	0	0	0	109.4	I222 T236 T237 E253 N255	I222-T240 HydrophobicContact CB-CG2 4.27Å; I222-T240 HydrophobicContact CD1-CG2 4.34Å; I222-T240 HydrophobicContact CG2-CG2 4.16Å; T236-T240 CarbonylContact C-O 3.56Å; T236-T240 WeakPolarHBondContact CA-O 3.48Å; T237-T240 PolarHBondContact N-O 3.42Å; T237-T240 PolarHBondContact OG1-N 2.8Å; T237-T240 VanDerWaalsContact OG1-N 3.14Å; T240-E253 HydrophobicContact CG2-CG 4.07Å; T240-N255 VanDerWaalsContact CA-OD1 3.29Å; T240-N255 WeakPolarHBondContact CA-OD1 3.23Å
241	I	92.8	Very high	91	Very high	48 Å²	48	60.5 Å²	60.5	25%	0.246	31%	0.313	C	S	.	.			trans	-105.2	123.3	178.6	-60.9	169.9	0	0	0	108.3	T236 E253 S254 N255	T236-I241 HydrophobicContact CG2-CB 4.47Å; T236-I241 HydrophobicContact CG2-CG1 4.35Å; T236-I241 HydrophobicContact CG2-CG2 4.41Å; I241-E253 CarbonylContact O-C 3.57Å; I241-E253 WeakPolarHBondContact O-CA 3.42Å; I241-S254 PolarHBondContact O-N 2.94Å; I241-N255 PolarHBondContact N-OD1 2.97Å
242	C	93.4	Very high	90.9	Very high	5 Å²	5	59 Å²	59	3%	0.034	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.3	178.6	-61.8	0	0	0	0	111.2	C223 C232 T236 I252	C223-C242 HydrophobicContact CB-CB 3.84Å; C223-C242 WeakPolarHBondContact CB-SG 3.34Å; C223-C242 WeakPolarHBondContact SG-CA 3.38Å; C223-C242 WeakPolarHBondContact SG-CB 3.5Å; C223-C242 CovalentContact SG-SG 2.03Å; C223-C242 PolarHBondContact SG-SG 3.4Å; C232-C242 WeakPolarHBondContact O-CB 3.33Å; T236-C242 PolarHBondContact OG1-N 3.33Å; T236-C242 VanDerWaalsContact OG1-N 3.07Å; T236-C242 PolarHBondContact OG1-O 3.14Å; C242-I252 WeakPolarHBondContact CA-O 3.4Å
243	I	93.1	Very high	90.8	Very high	13 Å²	13	60.2 Å²	60.2	7%	0.067	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.2	174.1	-60	173.6	0	0	0	108.7	C232 C251 I252 S254 K263 V264 C267	C232-I243 VanDerWaalsContact SG-C 3.55Å; C232-I243 PolarHBondContact SG-O 2.8Å; I243-C251 WeakPolarHBondContact O-CA 3.36Å; I243-I252 HydrophobicContact CB-CG1 4.18Å; I243-I252 PolarHBondContact N-O 2.77Å; I243-I252 PolarHBondContact O-N 3.05Å; I243-S254 WeakPolarHBondContact CD1-OG 3.46Å; I243-K263 HydrophobicContact CD1-CB 3.92Å; I243-V264 HydrophobicContact CD1-CB 4.33Å; I243-V264 HydrophobicContact CD1-CG2 3.43Å; I243-V264 VanDerWaalsContact CD1-CG2 3.43Å; I243-V264 HydrophobicContact CG1-CG2 4.14Å; I243-C267 HydrophobicContact CG2-CB 3.96Å
244	W	93.5	Very high	90.8	Very high	21 Å²	21	56.1 Å²	56.1	8%	0.08	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.2	171.9	-174.7	-106.3	0	0	0	111.1	N227 K229 C232 E246 N249 C251	N227-W244 VanDerWaalsContact C-CH2 3.48Å; N227-W244 WeakPolarHBondContact O-CH2 3.46Å; K229-W244 HydrophobicContact CB-CB 4.49Å; K229-W244 HydrophobicContact CB-CD2 3.92Å; K229-W244 HydrophobicContact CB-CG 3.79Å; K229-W244 HydrophobicContact CD-CG 4.5Å; K229-W244 HydrophobicContact CG-CB 4.1Å; K229-W244 HydrophobicContact CG-CD2 4.45Å; K229-W244 HydrophobicContact CG-CG 3.81Å; C232-W244 HydrophobicContact CB-CE3 3.65Å; C232-W244 HydrophobicContact CB-CZ3 4.3Å; W244-E246 VanDerWaalsContact CD1-OE2 3.25Å; W244-E246 PolarHBondContact NE1-OE2 2.75Å; W244-N249 WeakPolarHBondContact CH2-OD1 3.38Å; W244-N249 WeakPolarHBondContact CZ2-OD1 3.3Å; W244-C251 HydrophobicContact CE3-CB 3.88Å; W244-C251 HydrophobicContact CZ3-CB 4.04Å
245	C	92.1	Very high	90.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	99.7	175.7	-49.8	0	0	0	0	108.9	L48 K247 G248 N249 A250 I252 C267	L48-C245 HydrophobicContact CD1-CB 4.43Å; C245-K247 PolarHBondContact O-N 3.26Å; C245-G248 CarbonylContact O-C 3.57Å; C245-G248 WeakPolarHBondContact O-CA 3.19Å; C245-G248 PolarHBondContact O-N 2.98Å; C245-N249 PolarHBondContact O-N 2.78Å; C245-A250 PolarHBondContact N-O 3.13Å; C245-A250 PolarHBondContact O-N 2.69Å; C245-I252 VanDerWaalsContact SG-CD1 3.57Å; C245-C267 HydrophobicContact CB-CB 3.63Å; C245-C267 WeakPolarHBondContact CB-SG 3.5Å; C245-C267 WeakPolarHBondContact SG-CB 3.34Å; C245-C267 CovalentContact SG-SG 2.03Å; C245-C267 PolarHBondContact SG-SG 2.9Å
246	E	90.8	Very high	90.1	Very high	120 Å²	120	52.5 Å²	52.5	56%	0.561	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-50.6	-168.4	-165.9	73.2	-155.7	0	0	112.2	K229 W244 G248 N249	K229-E246 IonicContact NZ-OE2 2.84Å; W244-E246 VanDerWaalsContact CD1-OE2 3.25Å; W244-E246 PolarHBondContact NE1-OE2 2.75Å; E246-G248 VanDerWaalsContact C-N 3.27Å; E246-G248 PolarHBondContact O-N 3.03Å; E246-N249 PolarHBondContact O-N 3.28Å; E246-N249 VanDerWaalsContact O-N 3.15Å
247	K	88.4	Confident	89.7	Confident	124 Å²	124	57.5 Å²	57.5	54%	0.539	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.9	179.3	-169.2	-178.3	171.9	-171.3	0	112.8	V37 I38 C245 N249	V37-K247 WeakPolarHBondContact O-CE 3.47Å; V37-K247 PolarHBondContact O-NZ 3.42Å; V37-K247 VanDerWaalsContact O-NZ 3.12Å; I38-K247 HydrophobicContact CG2-CB 4.48Å; I38-K247 WeakPolarHBondContact O-CD 3.47Å; I38-K247 PolarHBondContact O-NZ 2.86Å; C245-K247 PolarHBondContact O-N 3.26Å; K247-N249 VanDerWaalsContact C-N 3.32Å
248	G	85.9	Confident	89.4	Confident	6 Å²	6	61 Å²	61	6%	0.062	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-16.9	176.2	0	0	0	0	0	113.8	C245 E246 A250	C245-G248 CarbonylContact O-C 3.57Å; C245-G248 WeakPolarHBondContact O-CA 3.19Å; C245-G248 PolarHBondContact O-N 2.98Å; E246-G248 VanDerWaalsContact C-N 3.27Å; E246-G248 PolarHBondContact O-N 3.03Å; G248-A250 PolarHBondContact O-N 3.03Å
249	N	88.9	Confident	89.4	Confident	112 Å²	112	56.5 Å²	56.5	60%	0.599	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	41.1	-166	-166.5	37.5	0	0	0	112	W244 C245 E246 K247	W244-N249 WeakPolarHBondContact CH2-OD1 3.38Å; W244-N249 WeakPolarHBondContact CZ2-OD1 3.3Å; C245-N249 PolarHBondContact O-N 2.78Å; E246-N249 PolarHBondContact O-N 3.28Å; E246-N249 VanDerWaalsContact O-N 3.15Å; K247-N249 VanDerWaalsContact C-N 3.32Å
250	A	89.8	Confident	89.3	Confident	27 Å²	27	50.8 Å²	50.8	22%	0.223	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.3	-169.9	0	0	0	0	0	111.2	L48 C245 G248	L48-A250 HydrophobicContact CD1-CB 3.78Å; C245-A250 PolarHBondContact N-O 3.13Å; C245-A250 PolarHBondContact O-N 2.69Å; G248-A250 PolarHBondContact O-N 3.03Å
251	C	91.2	Very high	89.1	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.02	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.3	174.9	-172.5	0	0	0	0	110	C223 S224 Y226 C232 I243 W244	C223-C251 CarbonylContact C-O 3.57Å; C223-C251 VanDerWaalsContact CB-SG 3.59Å; C223-C251 VanDerWaalsContact O-CB 3.22Å; C223-C251 WeakPolarHBondContact O-CB 3.3Å; C223-C251 PolarHBondContact O-SG 2.9Å; S224-C251 VanDerWaalsContact CA-O 3.29Å; S224-C251 WeakPolarHBondContact CA-O 3.36Å; S224-C251 PolarHBondContact N-O 3.37Å; Y226-C251 WeakPolarHBondContact O-CB 3.21Å; C232-C251 WeakPolarHBondContact CA-SG 3.49Å; C232-C251 HydrophobicContact CB-CB 3.59Å; C232-C251 WeakPolarHBondContact CB-SG 3.35Å; C232-C251 WeakPolarHBondContact SG-CB 3.46Å; C232-C251 CovalentContact SG-SG 2.02Å; C232-C251 PolarHBondContact SG-SG 2.99Å; I243-C251 WeakPolarHBondContact O-CA 3.36Å; W244-C251 HydrophobicContact CE3-CB 3.88Å; W244-C251 HydrophobicContact CZ3-CB 4.04Å
252	I	92.5	Very high	88.9	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	153.1	-177.2	66.4	170.5	0	0	0	111.9	L48 I219 C242 I243 C245	L48-I252 HydrophobicContact CD1-CG2 4.33Å; L48-I252 HydrophobicContact CD2-CG2 4.22Å; I219-I252 HydrophobicContact CG2-CB 4.49Å; I219-I252 HydrophobicContact CG2-CG2 4.13Å; C242-I252 WeakPolarHBondContact CA-O 3.4Å; I243-I252 HydrophobicContact CB-CG1 4.18Å; I243-I252 PolarHBondContact N-O 2.77Å; I243-I252 PolarHBondContact O-N 3.05Å; C245-I252 VanDerWaalsContact SG-CD1 3.57Å
253	E	92.6	Very high	88.7	Confident	27 Å²	27	52.8 Å²	52.8	13%	0.126	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	141.5	173.1	-76.7	179.9	-143	0	0	112.1	G220 E221 I222 C223 T240 I241 N255 K263	G220-E253 VanDerWaalsContact CA-CD 3.4Å; G220-E253 VanDerWaalsContact CA-OE1 3.22Å; G220-E253 WeakPolarHBondContact CA-OE1 3.38Å; E221-E253 PolarHBondContact N-OE1 2.81Å; I222-E253 WeakPolarHBondContact CA-OE1 3.37Å; I222-E253 VanDerWaalsContact CB-OE1 3.23Å; I222-E253 WeakPolarHBondContact CB-OE1 3.5Å; I222-E253 PolarHBondContact N-OE1 2.9Å; C223-E253 HydrophobicContact CB-CG 3.7Å; C223-E253 WeakPolarHBondContact SG-CG 3.23Å; T240-E253 HydrophobicContact CG2-CG 4.07Å; I241-E253 CarbonylContact O-C 3.57Å; I241-E253 WeakPolarHBondContact O-CA 3.42Å; E253-N255 PolarHBondContact OE2-ND2 3.18Å; E253-K263 PolarHBondContact O-NZ 3.29Å; E253-K263 VanDerWaalsContact O-NZ 3.14Å
254	S	90.9	Very high	88.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.279	C	S	.	.			trans	-139.3	51.5	179.4	-175.6	0	0	0	0	112.2	I241 I243 N256 H260	I241-S254 PolarHBondContact O-N 2.94Å; I243-S254 WeakPolarHBondContact CD1-OG 3.46Å; S254-N256 VanDerWaalsContact C-N 3.33Å; S254-N256 PolarHBondContact O-N 2.73Å; S254-H260 WeakPolarHBondContact OG-CA 3.39Å; S254-H260 PolarHBondContact OG-ND1 3.11Å
255	N	85.7	Confident	88.2	Confident	67 Å²	67	56.7 Å²	56.7	36%	0.358	30%	0.301	S	S	.	.			trans	-72.1	-24.6	-173.3	-52.8	-30.6	0	0	0	113.5	T240 I241 E253 Q257	T240-N255 VanDerWaalsContact CA-OD1 3.29Å; T240-N255 WeakPolarHBondContact CA-OD1 3.23Å; I241-N255 PolarHBondContact N-OD1 2.97Å; E253-N255 PolarHBondContact OE2-ND2 3.18Å; N255-Q257 PolarHBondContact O-N 3.24Å
256	N	85	Confident	88.1	Confident	63 Å²	63	56.9 Å²	56.9	34%	0.337	30%	0.302	S	S	.	.			trans	-79.5	109.3	178.2	178.8	-9.8	0	0	0	110.5	S254 N258 T259 H260	S254-N256 VanDerWaalsContact C-N 3.33Å; S254-N256 PolarHBondContact O-N 2.73Å; N256-N258 VanDerWaalsContact C-N 3.28Å; N256-N258 PolarHBondContact O-N 3.1Å; N256-N258 WeakPolarHBondContact OD1-CB 3.41Å; N256-N258 PolarHBondContact OD1-N 2.98Å; N256-T259 WeakPolarHBondContact CB-OG1 3.36Å; N256-T259 CarbonylContact O-C 3.51Å; N256-T259 PolarHBondContact O-N 3.3Å; N256-T259 VanDerWaalsContact O-N 3.1Å; N256-T259 PolarHBondContact O-OG1 2.89Å; N256-T259 VanDerWaalsContact O-OG1 3.11Å; N256-H260 PolarHBondContact O-N 3.3Å
257	Q	82.5	Confident	88	Confident	164 Å²	164	51.2 Å²	51.2	77%	0.766	28%	0.276	S	S	*	.	H	α-helix	trans	-56.8	-38.5	-178.4	-66.3	-174.2	-2.4	0	0	112.9	N255 T259 H260	N255-Q257 PolarHBondContact O-N 3.24Å; Q257-T259 PolarHBondContact O-N 3.26Å; Q257-H260 PolarHBondContact O-N 3.12Å
258	N	84.1	Confident	87.7	Confident	154 Å²	154	53.7 Å²	53.7	82%	0.824	28%	0.282	S	S	*	.	H	α-helix	trans	-66.1	-27	-178.7	-63.2	-19.5	0	0	0	112.4	N256	N256-N258 VanDerWaalsContact C-N 3.28Å; N256-N258 PolarHBondContact O-N 3.1Å; N256-N258 WeakPolarHBondContact OD1-CB 3.41Å; N256-N258 PolarHBondContact OD1-N 2.98Å
259	T	85.3	Confident	86.6	Confident	31 Å²	31	57.1 Å²	57.1	19%	0.19	30%	0.301	C	S	.	.	H	α-helix	trans	-106.8	-1.4	179.8	59.5	0	0	0	0	113	N256 Q257 L262 K263	N256-T259 WeakPolarHBondContact CB-OG1 3.36Å; N256-T259 CarbonylContact O-C 3.51Å; N256-T259 PolarHBondContact O-N 3.3Å; N256-T259 VanDerWaalsContact O-N 3.1Å; N256-T259 PolarHBondContact O-OG1 2.89Å; N256-T259 VanDerWaalsContact O-OG1 3.11Å; Q257-T259 PolarHBondContact O-N 3.26Å; T259-L262 PolarHBondContact O-N 3.23Å; T259-K263 PolarHBondContact O-N 3.28Å
260	H	86.5	Confident	85	Confident	59 Å²	59	59.7 Å²	59.7	27%	0.273	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-49.9	-173.2	176.4	63.8	0	0	0	111.8	S254 N256 Q257 L262 K263 V264	S254-H260 WeakPolarHBondContact OG-CA 3.39Å; S254-H260 PolarHBondContact OG-ND1 3.11Å; N256-H260 PolarHBondContact O-N 3.3Å; Q257-H260 PolarHBondContact O-N 3.12Å; H260-L262 VanDerWaalsContact C-N 3.27Å; H260-L262 PolarHBondContact O-N 2.93Å; H260-K263 PolarHBondContact O-N 2.83Å; H260-V264 WeakPolarHBondContact O-CG2 3.4Å; H260-V264 PolarHBondContact O-N 2.87Å
261	G	87.2	Confident	82.7	Confident	40 Å²	40	67.4 Å²	67.4	41%	0.412	34%	0.338	S	S	.	.	H	α-helix	trans	-57.3	-40.8	176.9	0	0	0	0	0	112.6	V264 N265	G261-V264 PolarHBondContact O-N 2.89Å; G261-N265 VanDerWaalsContact O-CG 3.25Å; G261-N265 PolarHBondContact O-N 2.91Å; G261-N265 PolarHBondContact O-ND2 2.75Å
262	L	87.7	Confident	80.1	Confident	64 Å²	64	74.5 Å²	74.5	34%	0.335	38%	0.376	S	S	.	.	H	α-helix	trans	-63	-48.3	176.7	-177.9	61.7	0	0	0	111.6	T259 H260 V264 N265 D266	T259-L262 PolarHBondContact O-N 3.23Å; H260-L262 VanDerWaalsContact C-N 3.27Å; H260-L262 PolarHBondContact O-N 2.93Å; L262-V264 VanDerWaalsContact C-N 3.31Å; L262-V264 PolarHBondContact O-N 3.39Å; L262-N265 PolarHBondContact O-N 3.31Å; L262-D266 WeakPolarHBondContact O-CB 3.46Å; L262-D266 PolarHBondContact O-N 3.44Å
263	K	89.4	Confident	77.3	Confident	9 Å²	9	78.6 Å²	78.6	4%	0.039	41%	0.405	C	S	.	.	H	α-helix	trans	-63.6	-35.1	177.2	-74.2	-173.9	174.8	-175.2	0	113	E217 I243 E253 T259 H260 D266 C267	E217-K263 WeakPolarHBondContact OE1-CE 3.32Å; E217-K263 IonicContact OE1-NZ 3.82Å; E217-K263 PolarHBondContact OE1-NZ 3.25Å; E217-K263 WeakPolarHBondContact OE2-CE 3.43Å; E217-K263 IonicContact OE2-NZ 2.98Å; E217-K263 PolarHBondContact OE2-NZ 2.93Å; I243-K263 HydrophobicContact CD1-CB 3.92Å; E253-K263 PolarHBondContact O-NZ 3.29Å; E253-K263 VanDerWaalsContact O-NZ 3.14Å; T259-K263 PolarHBondContact O-N 3.28Å; H260-K263 PolarHBondContact O-N 2.83Å; K263-D266 PolarHBondContact O-N 2.81Å; K263-C267 PolarHBondContact O-N 2.85Å
264	V	88.9	Confident	74.6	Confident	14 Å²	14	84.8 Å²	84.8	9%	0.085	44%	0.439	C	S	.	.	H	α-helix	trans	-61.7	-48	173.5	171.5	0	0	0	0	109.9	I243 H260 G261 L262 C267 R268	I243-V264 HydrophobicContact CD1-CB 4.33Å; I243-V264 HydrophobicContact CD1-CG2 3.43Å; I243-V264 VanDerWaalsContact CD1-CG2 3.43Å; I243-V264 HydrophobicContact CG1-CG2 4.14Å; H260-V264 WeakPolarHBondContact O-CG2 3.4Å; H260-V264 PolarHBondContact O-N 2.87Å; G261-V264 PolarHBondContact O-N 2.89Å; L262-V264 VanDerWaalsContact C-N 3.31Å; L262-V264 PolarHBondContact O-N 3.39Å; V264-C267 PolarHBondContact O-N 3.15Å; V264-R268 HydrophobicContact CG1-CG 4.28Å; V264-R268 VanDerWaalsContact CG1-NE 3.35Å; V264-R268 WeakPolarHBondContact O-CB 3.3Å; V264-R268 WeakPolarHBondContact O-CG 3.28Å; V264-R268 PolarHBondContact O-N 3.39Å
265	N	87.5	Confident	71.7	Confident	102 Å²	102	90.9 Å²	90.9	55%	0.545	48%	0.476	S	S	.	.	H	α-helix	trans	-65.1	-39.7	179.1	-66.6	-13.5	0	0	0	111.9	G261 L262 C267 R268	G261-N265 VanDerWaalsContact O-CG 3.25Å; G261-N265 PolarHBondContact O-N 2.91Å; G261-N265 PolarHBondContact O-ND2 2.75Å; L262-N265 PolarHBondContact O-N 3.31Å; N265-C267 PolarHBondContact O-N 3.48Å; N265-R268 PolarHBondContact O-N 3.3Å
266	D	88.9	Confident	69.2	Low	4 Å²	4	97.6 Å²	97.6	2%	0.021	50%	0.497	C	S	.	.	H	α-helix	trans	-56.6	-32.7	175.4	-73	-19	0	0	0	112.9	I38 I39 Y44 Y46 R55 L262 K263	I38-D266 WeakPolarHBondContact CG2-O 3.29Å; I39-D266 VanDerWaalsContact CD1-O 3.29Å; I39-D266 WeakPolarHBondContact CD1-O 3.35Å; Y44-D266 WeakPolarHBondContact CE1-OD1 3.34Å; Y44-D266 VanDerWaalsContact CZ-OD1 3.25Å; Y44-D266 PolarHBondContact OH-OD1 3.43Å; Y44-D266 PolarHBondContact OH-OD2 2.88Å; Y46-D266 HydrophobicContact CD1-CB 3.62Å; Y46-D266 HydrophobicContact CD2-CB 4.37Å; Y46-D266 HydrophobicContact CE1-CB 3.87Å; Y46-D266 HydrophobicContact CG-CB 3.87Å; R55-D266 IonicContact CZ-OD2 3.62Å; R55-D266 IonicContact NE-OD2 3.7Å; R55-D266 PolarHBondContact NE-OD2 3.12Å; R55-D266 VanDerWaalsContact NE-OD2 3.17Å; R55-D266 IonicContact NH2-OD2 3.39Å; R55-D266 PolarHBondContact NH2-OD2 3.36Å; L262-D266 WeakPolarHBondContact O-CB 3.46Å; L262-D266 PolarHBondContact O-N 3.44Å; K263-D266 PolarHBondContact O-N 2.81Å
267	C	89.1	Confident	66.7	Low	2 Å²	2	101.6 Å²	101.6	1%	0.014	52%	0.519	C	S	.	.	H	α-helix	trans	-97.7	-16.3	-177	-75.9	0	0	0	0	114.3	I243 C245 K263 V264 N265	I243-C267 HydrophobicContact CG2-CB 3.96Å; C245-C267 HydrophobicContact CB-CB 3.63Å; C245-C267 WeakPolarHBondContact CB-SG 3.5Å; C245-C267 WeakPolarHBondContact SG-CB 3.34Å; C245-C267 CovalentContact SG-SG 2.03Å; C245-C267 PolarHBondContact SG-SG 2.9Å; K263-C267 PolarHBondContact O-N 2.85Å; V264-C267 PolarHBondContact O-N 3.15Å; N265-C267 PolarHBondContact O-N 3.48Å
268	R	81.2	Confident	64.1	Low	176 Å²	176	101.3 Å²	101.3	66%	0.664	52%	0.522	S	S	*	.			trans	-95.5	92.4	174.1	-70.9	-177.8	-176.6	173.5	4	109.2	V264 N265 E270	V264-R268 HydrophobicContact CG1-CG 4.28Å; V264-R268 VanDerWaalsContact CG1-NE 3.35Å; V264-R268 WeakPolarHBondContact O-CB 3.3Å; V264-R268 WeakPolarHBondContact O-CG 3.28Å; V264-R268 PolarHBondContact O-N 3.39Å; N265-R268 PolarHBondContact O-N 3.3Å; R268-E270 PolarHBondContact O-N 2.78Å
269	V	64.6	Low	61.5	Low	77 Å²	77	102.2 Å²	102.2	47%	0.467	53%	0.527	S	S	.	.			trans	-77.9	105.2	158.1	-166.4	0	0	0	0	105.5	I39 K271	I39-V269 HydrophobicContact CD1-CG2 3.98Å; I39-V269 HydrophobicContact CG1-CG2 3.59Å; V269-K271 PolarHBondContact O-N 3.11Å
270	E	53.7	Low	58.8	Low	166 Å²	166	104.9 Å²	104.9	78%	0.776	55%	0.547	S	S	*	.			trans	-54.8	115.1	162.6	-76.4	-176.9	175	0	0	106.2	R268 N272	R268-E270 PolarHBondContact O-N 2.78Å; E270-N272 VanDerWaalsContact C-N 3.34Å; E270-N272 PolarHBondContact O-N 2.94Å
271	K	41.9	Very low	56	Low	190 Å²	190	107.7 Å²	107.7	83%	0.826	57%	0.573	S	S	*	*			trans	-57.9	111.4	160.4	-89	-177.8	174.3	179.7	0	103.8	V269 S273	V269-K271 PolarHBondContact O-N 3.11Å; K271-S273 PolarHBondContact O-N 3.49Å
272	N	37.4	Very low	53.1	Low	151 Å²	151	111.2 Å²	111.2	81%	0.807	59%	0.586	S	S	*	*			trans	-60.1	82.5	154.8	-73.8	-5.8	0	0	0	105.4	E270 D274	E270-N272 VanDerWaalsContact C-N 3.34Å; E270-N272 PolarHBondContact O-N 2.94Å; N272-D274 PolarHBondContact O-N 2.96Å
273	S	33.6	Very low	50	Low	91 Å²	91	113.7 Å²	113.7	64%	0.636	61%	0.605	S	S	*	*			trans	-73.8	112.9	167.8	45.6	0	0	0	0	105.8	K271 V275	K271-S273 PolarHBondContact O-N 3.49Å; S273-V275 PolarHBondContact O-N 2.89Å
274	D	35.2	Very low	47.1	Very low	156 Å²	156	122 Å²	122	83%	0.834	65%	0.645	S	S	*	*			trans	-36.2	106.9	169.9	-53.7	-65.3	0	0	0	111.4	N272	N272-D274 PolarHBondContact O-N 2.96Å
275	V	30.3	Very low	44	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	68%	0.682	S	S	*	*			trans	-139.2	96.1	162.5	-176	0	0	0	0	108.2	S273	S273-V275 PolarHBondContact O-N 2.89Å
276	Y	32.3	Very low	41.1	Very low	207 Å²	207	133 Å²	133	81%	0.812	69%	0.689	S	S	*	*			trans	-3.3	140.2	148.7	-87.3	-94.1	0	0	0	118.5	L278	Y276-L278 PolarHBondContact O-N 3.32Å
277	D	33.4	Very low	38.1	Very low	148 Å²	148	138.1 Å²	138.1	79%	0.791	73%	0.726	S	S	*	*			trans	-11.5	116.1	151.5	-76.7	-44.4	0	0	0	114.6
278	L	28	Very low	35.1	Very low	158 Å²	158	144.9 Å²	144.9	83%	0.827	76%	0.757	S	S	*	*			trans	-157.4	105.1	138.8	-105.3	137.6	0	0	0	109.4	Y276 S280	Y276-L278 PolarHBondContact O-N 3.32Å; L278-S280 VanDerWaalsContact C-N 3.26Å; L278-S280 PolarHBondContact O-N 3.17Å
279	N	29.8	Very low	32.5	Very low	173 Å²	173	146 Å²	146	93%	0.925	77%	0.767	S	S	*	*			trans	-40.3	96	143.6	-101.3	-2.9	0	0	0	109.4
280	S	28	Very low	30.7	Very low	87 Å²	87	147.6 Å²	147.6	61%	0.608	78%	0.777	S	S	*	*			trans	-144.1	93.4	151.1	79.2	0	0	0	0	108.7	L278 T282	L278-S280 VanDerWaalsContact C-N 3.26Å; L278-S280 PolarHBondContact O-N 3.17Å; S280-T282 PolarHBondContact O-N 3.07Å; S280-T282 VanDerWaalsContact O-N 3.08Å
281	S	27.2	Very low	29.4	Very low	118 Å²	118	147 Å²	147	83%	0.825	78%	0.778	S	S	*	*			trans	-34.8	111.1	150.1	161.5	0	0	0	0	109.9
282	T	26.4	Very low	28.6	Very low	113 Å²	113	148.4 Å²	148.4	69%	0.693	78%	0.778	S	S	*	*			trans	-146.6	86	158.5	-40.3	0	0	0	0	108.9	S280 M284	S280-T282 PolarHBondContact O-N 3.07Å; S280-T282 VanDerWaalsContact O-N 3.08Å; T282-M284 PolarHBondContact O-N 3.08Å
283	T	23.4	Very low	28.2	Very low	117 Å²	117	148.3 Å²	148.3	72%	0.718	78%	0.776	S	S	*	*			trans	23.7	85	143.3	-45.6	0	0	0	0	116.1	K285	T283-K285 PolarHBondContact O-N 2.96Å
284	M	27.3	Very low	27.9	Very low	182 Å²	182	149.1 Å²	149.1	90%	0.897	78%	0.778	S	S	*	*			trans	-68	98.7	161.2	-77.3	-77.2	-98.9	0	0	108.5	T282 H286	T282-M284 PolarHBondContact O-N 3.08Å; M284-H286 PolarHBondContact O-N 3.27Å
285	K	25.7	Very low	27.5	Very low	194 Å²	194	150.2 Å²	150.2	84%	0.843	78%	0.778	S	S	*	*			trans	-60.4	109.2	165	-86.4	-176.6	174.5	179.2	0	108	T283 S287	T283-K285 PolarHBondContact O-N 2.96Å; K285-S287 PolarHBondContact O-N 3.02Å
286	H	25.4	Very low	27.4	Very low	153 Å²	153	151.1 Å²	151.1	71%	0.708	78%	0.777	S	S	*	*			trans	-55.8	95.1	172.8	-155.1	67	0	0	0	109.4	M284 E288	M284-H286 PolarHBondContact O-N 3.27Å; H286-E288 IonicContact CD2-OE2 3.85Å; H286-E288 IonicContact NE2-OE1 2.72Å; H286-E288 IonicContact NE2-OE2 2.7Å; H286-E288 PolarHBondContact O-N 2.8Å; H286-E288 VanDerWaalsContact O-N 3.15Å
287	S	25.3	Very low	27.1	Very low	113 Å²	113	150.4 Å²	150.4	79%	0.79	78%	0.781	S	S	*	*			trans	-83.8	77.6	165.3	63.4	0	0	0	0	107.7	K285 K289	K285-S287 PolarHBondContact O-N 3.02Å; S287-K289 VanDerWaalsContact C-N 3.28Å; S287-K289 PolarHBondContact O-N 3.22Å
288	E	26.7	Very low	26.8	Very low	144 Å²	144	150.7 Å²	150.7	67%	0.673	79%	0.788	S	S	*	*			trans	-69.3	86.9	172.4	-150.3	172.7	-170.6	0	0	107.8	H286 T290	H286-E288 IonicContact CD2-OE2 3.85Å; H286-E288 IonicContact NE2-OE1 2.72Å; H286-E288 IonicContact NE2-OE2 2.7Å; H286-E288 PolarHBondContact O-N 2.8Å; H286-E288 VanDerWaalsContact O-N 3.15Å; E288-T290 PolarHBondContact O-N 2.81Å; E288-T290 VanDerWaalsContact O-N 3.12Å
289	K	27.8	Very low	26.7	Very low	200 Å²	200	146 Å²	146	87%	0.87	78%	0.778	S	S	*	*			trans	-85.3	79.6	171.7	-148.4	177.7	-171.7	-179.2	0	107.2	S287 L291	S287-K289 VanDerWaalsContact C-N 3.28Å; S287-K289 PolarHBondContact O-N 3.22Å; K289-L291 PolarHBondContact O-N 3.32Å
290	T	26.5	Very low	26.7	Very low	109 Å²	109	146.6 Å²	146.6	67%	0.669	78%	0.775	S	S	*	*			trans	-52.2	97.3	170.7	-53.3	0	0	0	0	109.2	E288 R292	E288-T290 PolarHBondContact O-N 2.81Å; E288-T290 VanDerWaalsContact O-N 3.12Å; T290-R292 VanDerWaalsContact C-N 3.25Å; T290-R292 PolarHBondContact O-N 3.42Å
291	L	26.7	Very low	26.6	Very low	154 Å²	154	150.6 Å²	150.6	81%	0.806	79%	0.79	S	S	*	*			trans	-74.6	88.9	169	-152.9	96.2	0	0	0	106.4	K289 I293	K289-L291 PolarHBondContact O-N 3.32Å; L291-I293 PolarHBondContact O-N 2.83Å
292	R	25.2	Very low	26.7	Very low	220 Å²	220	153.2 Å²	153.2	83%	0.83	79%	0.794	S	S	*	*			trans	-55.8	103.5	172.7	-128	-177.2	-162.8	-179.5	4.4	107.8	T290 T294	T290-R292 VanDerWaalsContact C-N 3.25Å; T290-R292 PolarHBondContact O-N 3.42Å; R292-T294 VanDerWaalsContact C-N 3.32Å; R292-T294 PolarHBondContact O-N 2.92Å
293	I	28.5	Very low	26.8	Very low	149 Å²	149	155.8 Å²	155.8	76%	0.764	80%	0.8	S	S	*	*			trans	-71.3	96.2	166.1	-62.1	171.7	0	0	0	105.1	L291 E295	L291-I293 PolarHBondContact O-N 2.83Å; I293-E295 PolarHBondContact O-N 2.8Å
294	T	26.9	Very low	27	Very low	108 Å²	108	157.3 Å²	157.3	66%	0.663	80%	0.803	S	S	*	*			trans	-74	105.4	166.6	-47.8	0	0	0	0	106.3	R292 L296	R292-T294 VanDerWaalsContact C-N 3.32Å; R292-T294 PolarHBondContact O-N 2.92Å; T294-L296 VanDerWaalsContact C-N 3.3Å; T294-L296 PolarHBondContact O-N 3.03Å
295	E	27.4	Very low	27.1	Very low	179 Å²	179	153.5 Å²	153.5	84%	0.836	79%	0.791	S	S	*	*			trans	-57	93.6	165.6	-70.2	176.5	153.1	0	0	108.5	I293 Q297	I293-E295 PolarHBondContact O-N 2.8Å; E295-Q297 PolarHBondContact O-N 2.88Å
296	L	27.2	Very low	27.5	Very low	148 Å²	148	149.9 Å²	149.9	78%	0.775	79%	0.785	S	S	*	*			trans	-83.9	111	170.4	-118.6	147.3	0	0	0	106.9	T294 V298	T294-L296 VanDerWaalsContact C-N 3.3Å; T294-L296 PolarHBondContact O-N 3.03Å; L296-V298 PolarHBondContact O-N 2.7Å
297	Q	26.4	Very low	28.2	Very low	192 Å²	192	150.3 Å²	150.3	90%	0.897	79%	0.787	S	S	*	*			trans	-49.2	106.3	176.9	-67.1	178.6	-31	0	0	110.8	E295	E295-Q297 PolarHBondContact O-N 2.88Å
298	V	27.5	Very low	28.8	Very low	154 Å²	154	151.7 Å²	151.7	93%	0.933	78%	0.781	S	S	*	*			trans	-97.7	83.1	165.5	-178.8	0	0	0	0	106.5	L296	L296-V298 PolarHBondContact O-N 2.7Å
299	G	26	Very low	29.3	Very low	60 Å²	60	149 Å²	149	62%	0.619	78%	0.775	S	S	*	*			trans	-131.3	122.9	169.5	0	0	0	0	0	108.1
300	E	28.8	Very low	29.7	Very low	185 Å²	185	144.8 Å²	144.8	86%	0.864	76%	0.762	S	S	*	*	S	Bend	trans	67.9	74.6	168.4	-59.1	-175.3	154.8	0	0	116.9
301	N	27.1	Very low	30.3	Very low	170 Å²	170	146.8 Å²	146.8	91%	0.909	76%	0.761	S	S	*	*			trans	-149.5	56.7	140.7	-84.9	-39.4	0	0	0	109	M303	N301-M303 VanDerWaalsContact C-N 3.34Å; N301-M303 PolarHBondContact O-N 3.01Å
302	L	28.5	Very low	31	Very low	174 Å²	174	145.6 Å²	145.6	91%	0.911	75%	0.751	S	S	*	*			trans	-89	73.3	170	-170.2	78.3	0	0	0	108.9
303	M	27.9	Very low	31.5	Very low	167 Å²	167	140.6 Å²	140.6	82%	0.823	74%	0.74	S	S	*	*	S	Bend	trans	-159.2	127.8	157.5	-119.4	159	72.8	0	0	108.7	N301	N301-M303 VanDerWaalsContact C-N 3.34Å; N301-M303 PolarHBondContact O-N 3.01Å
304	N	29.1	Very low	31.6	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	73%	0.732	S	S	*	*	S	Bend	trans	93.2	44.8	175	-53.6	-13.7	0	0	0	118.5
305	T	28.6	Very low	31.6	Very low	102 Å²	102	139.9 Å²	139.9	63%	0.626	73%	0.731	S	S	*	*			trans	-122.9	40.4	157.5	-31.6	0	0	0	0	112.5	E308	T305-E308 HydrophobicContact CG2-CB 4.35Å
306	T	33.6	Very low	32	Very low	118 Å²	118	134.8 Å²	134.8	72%	0.724	71%	0.713	S	S	*	*	S	Bend	trans	-97.4	-2.5	174.5	-29.8	0	0	0	0	113.1
307	E	39.9	Very low	32.2	Very low	163 Å²	163	131.6 Å²	131.6	76%	0.762	70%	0.7	S	S	*	*	S	Bend	trans	-98.9	-11.1	175.9	-88.2	-165.6	153.7	0	0	114.9
308	E	39	Very low	32.2	Very low	141 Å²	141	130.2 Å²	130.2	66%	0.659	69%	0.686	S	S	*	*	H	α-helix	trans	-89.7	-25.7	-176.8	-149.2	171.5	-165.3	0	0	113.1	T305 K311 H312	T305-E308 HydrophobicContact CG2-CB 4.35Å; E308-K311 PolarHBondContact O-N 2.94Å; E308-H312 PolarHBondContact O-N 2.77Å
309	T	37.9	Very low	32.5	Very low	88 Å²	88	126.2 Å²	126.2	54%	0.54	66%	0.662	S	S	.	*	H	α-helix	trans	-70.8	-35.7	-179.8	-12.8	0	0	0	0	112.3	H312 L313	T309-H312 PolarHBondContact O-N 2.69Å; T309-L313 PolarHBondContact O-N 2.88Å
310	D	35.3	Very low	33	Very low	112 Å²	112	127.1 Å²	127.1	60%	0.599	66%	0.656	S	S	*	*	H	α-helix	trans	-72.9	-28.7	176.8	-78.4	-18	0	0	0	112.6	N314	D310-N314 PolarHBondContact O-N 2.82Å; D310-N314 PolarHBondContact O-ND2 3.3Å
311	K	38.6	Very low	33.3	Very low	150 Å²	150	124.7 Å²	124.7	65%	0.652	64%	0.644	S	S	*	*	H	α-helix	trans	-69.4	-34.9	172	-76.4	-178.4	-179	169.4	0	112.1	E308 N314 M315	E308-K311 PolarHBondContact O-N 2.94Å; K311-N314 PolarHBondContact O-N 3.09Å; K311-M315 WeakPolarHBondContact O-CB 3.27Å; K311-M315 PolarHBondContact O-N 2.98Å
312	H	40.8	Very low	33.8	Very low	130 Å²	130	121 Å²	121	60%	0.602	62%	0.621	S	S	*	*	H	α-helix	trans	-73.3	-36.4	-176.6	-153.6	-93	0	0	0	113.2	E308 T309 M315 T316	E308-H312 PolarHBondContact O-N 2.77Å; T309-H312 PolarHBondContact O-N 2.69Å; H312-M315 PolarHBondContact O-N 2.83Å; H312-T316 PolarHBondContact O-N 3.06Å; H312-T316 VanDerWaalsContact O-N 3.15Å; H312-T316 PolarHBondContact O-OG1 2.97Å
313	L	37	Very low	34.3	Very low	114 Å²	114	117.5 Å²	117.5	60%	0.597	60%	0.604	S	S	*	*	H	α-helix	trans	-65.5	-40.8	171.2	-86.5	153.2	0	0	0	111.4	T309 T317	T309-L313 PolarHBondContact O-N 2.88Å; L313-T317 PolarHBondContact O-N 3.32Å; L313-T317 VanDerWaalsContact O-N 3.12Å; L313-T317 PolarHBondContact O-OG1 2.91Å
314	N	29.8	Very low	34.7	Very low	112 Å²	112	116.9 Å²	116.9	60%	0.599	60%	0.596	S	S	*	*	H	α-helix	trans	-68.5	-37	176.7	-75.1	-22.4	0	0	0	112.7	D310 K311 T317 R318	D310-N314 PolarHBondContact O-N 2.82Å; D310-N314 PolarHBondContact O-ND2 3.3Å; K311-N314 PolarHBondContact O-N 3.09Å; N314-T317 PolarHBondContact O-N 2.94Å; N314-R318 WeakPolarHBondContact O-CB 3.5Å; N314-R318 PolarHBondContact O-N 2.77Å
315	M	27.7	Very low	35.1	Very low	130 Å²	130	115.4 Å²	115.4	64%	0.64	59%	0.585	S	S	*	*	H	α-helix	trans	-69	-36.7	178.5	-158.2	179.5	-154	0	0	112.6	K311 H312 T319	K311-M315 WeakPolarHBondContact O-CB 3.27Å; K311-M315 PolarHBondContact O-N 2.98Å; H312-M315 PolarHBondContact O-N 2.83Å; M315-T319 WeakPolarHBondContact O-CB 3.03Å; M315-T319 PolarHBondContact O-N 3.04Å; M315-T319 PolarHBondContact O-OG1 2.78Å
316	T	35.6	Very low	35.9	Very low	72 Å²	72	116.8 Å²	116.8	44%	0.442	58%	0.584	S	S	.	*	H	α-helix	trans	-70	-37.8	176.8	-49.5	0	0	0	0	111.3	H312 T319 T320	H312-T316 PolarHBondContact O-N 3.06Å; H312-T316 VanDerWaalsContact O-N 3.15Å; H312-T316 PolarHBondContact O-OG1 2.97Å; T316-T319 WeakPolarHBondContact CA-OG1 3.29Å; T316-T319 PolarHBondContact O-OG1 3.16Å; T316-T320 PolarHBondContact O-N 3.29Å; T316-T320 VanDerWaalsContact O-N 3.16Å; T316-T320 PolarHBondContact O-OG1 2.8Å
317	T	31.3	Very low	36.5	Very low	82 Å²	82	117.4 Å²	117.4	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-68.5	-44.7	175.5	-44.5	0	0	0	0	110.7	L313 N314 T319 T320 E321	L313-T317 PolarHBondContact O-N 3.32Å; L313-T317 VanDerWaalsContact O-N 3.12Å; L313-T317 PolarHBondContact O-OG1 2.91Å; N314-T317 PolarHBondContact O-N 2.94Å; T317-T319 PolarHBondContact O-N 3.14Å; T317-T320 PolarHBondContact O-N 2.96Å; T317-E321 PolarHBondContact O-N 3.37Å
318	R	27.3	Very low	37.1	Very low	163 Å²	163	113.4 Å²	113.4	62%	0.615	57%	0.567	S	S	*	*	H	α-helix	trans	-61.4	-43.6	176.3	-117.4	-175.9	81	158.8	5.3	113.1	N314 T320 E321 E322	N314-R318 WeakPolarHBondContact O-CB 3.5Å; N314-R318 PolarHBondContact O-N 2.77Å; R318-T320 VanDerWaalsContact C-N 3.31Å; R318-T320 PolarHBondContact O-N 2.83Å; R318-E321 PolarHBondContact O-N 3.31Å; R318-E322 IonicContact CZ-OE1 3.18Å; R318-E322 IonicContact NE-OE1 2.69Å; R318-E322 PolarHBondContact NE-OE1 2.89Å; R318-E322 VanDerWaalsContact NE-OE1 3.16Å; R318-E322 IonicContact NH2-OE1 2.73Å; R318-E322 PolarHBondContact NH2-OE1 3.04Å; R318-E322 VanDerWaalsContact O-CB 3.29Å; R318-E322 WeakPolarHBondContact O-CB 2.85Å; R318-E322 WeakPolarHBondContact O-CG 3.37Å; R318-E322 PolarHBondContact O-N 3.23Å
319	T	32.3	Very low	37.9	Very low	70 Å²	70	112 Å²	112	43%	0.429	56%	0.56	S	S	.	*	H	α-helix	trans	-67.2	-33.6	178.7	41	0	0	0	0	111.9	M315 T316 T317 N323	M315-T319 WeakPolarHBondContact O-CB 3.03Å; M315-T319 PolarHBondContact O-N 3.04Å; M315-T319 PolarHBondContact O-OG1 2.78Å; T316-T319 WeakPolarHBondContact CA-OG1 3.29Å; T316-T319 PolarHBondContact O-OG1 3.16Å; T317-T319 PolarHBondContact O-N 3.14Å; T319-N323 VanDerWaalsContact O-CB 3.24Å; T319-N323 WeakPolarHBondContact O-CB 3.45Å; T319-N323 PolarHBondContact O-N 2.94Å
320	T	36.8	Very low	39.1	Very low	79 Å²	79	113.8 Å²	113.8	49%	0.485	56%	0.557	S	S	.	*	H	α-helix	trans	-70.7	-38.6	175.9	-49.6	0	0	0	0	112	T316 T317 R318 K324	T316-T320 PolarHBondContact O-N 3.29Å; T316-T320 VanDerWaalsContact O-N 3.16Å; T316-T320 PolarHBondContact O-OG1 2.8Å; T317-T320 PolarHBondContact O-N 2.96Å; R318-T320 VanDerWaalsContact C-N 3.31Å; R318-T320 PolarHBondContact O-N 2.83Å; T320-K324 PolarHBondContact O-N 2.89Å; T320-K324 VanDerWaalsContact O-N 3.15Å
321	E	35.7	Very low	40.5	Very low	134 Å²	134	114.6 Å²	114.6	63%	0.626	55%	0.552	S	S	*	*	H	α-helix	trans	-68.6	-46.9	173.8	-113.5	176.5	176.9	0	0	112.2	T317 R318 N323 K324 Q325	T317-E321 PolarHBondContact O-N 3.37Å; R318-E321 PolarHBondContact O-N 3.31Å; E321-N323 VanDerWaalsContact C-N 3.26Å; E321-N323 PolarHBondContact O-N 3.39Å; E321-K324 PolarHBondContact O-N 3.33Å; E321-K324 VanDerWaalsContact O-N 3.15Å; E321-Q325 WeakPolarHBondContact O-CB 3.39Å; E321-Q325 PolarHBondContact O-N 3.25Å
322	E	36.3	Very low	41.9	Very low	91 Å²	91	112.6 Å²	112.6	43%	0.425	55%	0.548	S	S	.	.	H	α-helix	trans	-57.8	-39.5	175.2	-79.7	177	-173.1	0	0	110.9	R318 Q325 H326	R318-E322 IonicContact CZ-OE1 3.18Å; R318-E322 IonicContact NE-OE1 2.69Å; R318-E322 PolarHBondContact NE-OE1 2.89Å; R318-E322 VanDerWaalsContact NE-OE1 3.16Å; R318-E322 IonicContact NH2-OE1 2.73Å; R318-E322 PolarHBondContact NH2-OE1 3.04Å; R318-E322 VanDerWaalsContact O-CB 3.29Å; R318-E322 WeakPolarHBondContact O-CB 2.85Å; R318-E322 WeakPolarHBondContact O-CG 3.37Å; R318-E322 PolarHBondContact O-N 3.23Å; E322-Q325 PolarHBondContact O-N 3.4Å; E322-H326 VanDerWaalsContact O-CB 3.24Å; E322-H326 WeakPolarHBondContact O-CB 3.47Å; E322-H326 PolarHBondContact O-N 2.82Å
323	N	39.7	Very low	43.4	Very low	101 Å²	101	113.9 Å²	113.9	54%	0.54	55%	0.549	S	S	.	.	H	α-helix	trans	-72.4	-32.8	179.6	-144	-8.3	0	0	0	112.4	T319 E321 K327	T319-N323 VanDerWaalsContact O-CB 3.24Å; T319-N323 WeakPolarHBondContact O-CB 3.45Å; T319-N323 PolarHBondContact O-N 2.94Å; E321-N323 VanDerWaalsContact C-N 3.26Å; E321-N323 PolarHBondContact O-N 3.39Å; N323-K327 WeakPolarHBondContact O-CG 3.24Å; N323-K327 PolarHBondContact O-N 2.83Å; N323-K327 VanDerWaalsContact O-N 3.16Å
324	K	36.6	Very low	45.2	Very low	154 Å²	154	109.8 Å²	109.8	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-68.5	-43	169.6	-80.8	-176.3	179.4	175.7	0	111.7	T320 E321 K327 S328	T320-K324 PolarHBondContact O-N 2.89Å; T320-K324 VanDerWaalsContact O-N 3.15Å; E321-K324 PolarHBondContact O-N 3.33Å; E321-K324 VanDerWaalsContact O-N 3.15Å; K324-K327 PolarHBondContact O-N 3.46Å; K324-S328 PolarHBondContact O-N 3.04Å; K324-S328 VanDerWaalsContact O-N 3.08Å
325	Q	37.1	Very low	47.4	Very low	117 Å²	117	108.1 Å²	108.1	55%	0.547	52%	0.522	S	S	.	.	H	α-helix	trans	-64.4	-43	177.8	-170.8	172.7	0.8	0	0	111	E321 E322 K327 S328 H329	E321-Q325 WeakPolarHBondContact O-CB 3.39Å; E321-Q325 PolarHBondContact O-N 3.25Å; E322-Q325 PolarHBondContact O-N 3.4Å; Q325-K327 PolarHBondContact O-N 3.18Å; Q325-S328 WeakPolarHBondContact O-CB 3.45Å; Q325-S328 PolarHBondContact O-N 3.31Å; Q325-S328 VanDerWaalsContact O-N 3.11Å; Q325-H329 PolarHBondContact O-CD2 3.29Å; Q325-H329 VanDerWaalsContact O-CD2 3.24Å; Q325-H329 PolarHBondContact O-N 3.5Å
326	H	44.9	Very low	49.9	Very low	131 Å²	131	106.5 Å²	106.5	61%	0.606	52%	0.515	S	S	*	.	H	α-helix	trans	-62.2	-40.9	177.1	-166.5	-84.4	0	0	0	111.8	E322 S328 W330	E322-H326 VanDerWaalsContact O-CB 3.24Å; E322-H326 WeakPolarHBondContact O-CB 3.47Å; E322-H326 PolarHBondContact O-N 2.82Å; H326-S328 VanDerWaalsContact C-N 3.35Å; H326-S328 PolarHBondContact O-N 3.02Å; H326-W330 VanDerWaalsContact O-CB 3.27Å; H326-W330 WeakPolarHBondContact O-CB 3.33Å; H326-W330 PolarHBondContact O-N 2.89Å
327	K	47.2	Very low	52	Low	132 Å²	132	107.2 Å²	107.2	57%	0.574	52%	0.516	S	S	*	.	H	α-helix	trans	-62.4	-39.3	172.8	-77.1	-177.5	-178.2	178.1	0	112.4	N323 K324 Q325 Y331	N323-K327 WeakPolarHBondContact O-CG 3.24Å; N323-K327 PolarHBondContact O-N 2.83Å; N323-K327 VanDerWaalsContact O-N 3.16Å; K324-K327 PolarHBondContact O-N 3.46Å; Q325-K327 PolarHBondContact O-N 3.18Å; K327-Y331 PolarHBondContact O-N 2.93Å
328	S	52.2	Low	54.4	Low	79 Å²	79	108 Å²	108	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-68.2	-47.2	178.8	-172.1	0	0	0	0	112.5	K324 Q325 H326 W330 Y331 L332	K324-S328 PolarHBondContact O-N 3.04Å; K324-S328 VanDerWaalsContact O-N 3.08Å; Q325-S328 WeakPolarHBondContact O-CB 3.45Å; Q325-S328 PolarHBondContact O-N 3.31Å; Q325-S328 VanDerWaalsContact O-N 3.11Å; H326-S328 VanDerWaalsContact C-N 3.35Å; H326-S328 PolarHBondContact O-N 3.02Å; S328-W330 VanDerWaalsContact C-N 3.3Å; S328-W330 PolarHBondContact O-N 2.82Å; S328-Y331 PolarHBondContact O-N 2.86Å; S328-L332 PolarHBondContact O-N 3.08Å
329	H	56	Low	57	Low	110 Å²	110	103.4 Å²	103.4	51%	0.509	51%	0.506	S	S	.	.	H	α-helix	trans	-63.1	-37.3	177	-81.5	-112.9	0	0	0	112	Q325 L332 Y333	Q325-H329 PolarHBondContact O-CD2 3.29Å; Q325-H329 VanDerWaalsContact O-CD2 3.24Å; Q325-H329 PolarHBondContact O-N 3.5Å; H329-L332 PolarHBondContact O-N 3.23Å; H329-Y333 PolarHBondContact O-N 3.19Å
330	W	63.5	Low	59.5	Low	126 Å²	126	102.3 Å²	102.3	48%	0.477	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-43.5	175.8	-175.2	77.7	0	0	0	112.1	H326 S328 L332 Y333 V334	H326-W330 VanDerWaalsContact O-CB 3.27Å; H326-W330 WeakPolarHBondContact O-CB 3.33Å; H326-W330 PolarHBondContact O-N 2.89Å; S328-W330 VanDerWaalsContact C-N 3.3Å; S328-W330 PolarHBondContact O-N 2.82Å; W330-L332 VanDerWaalsContact C-N 3.35Å; W330-L332 PolarHBondContact O-N 2.89Å; W330-Y333 PolarHBondContact O-N 3.24Å; W330-V334 HydrophobicContact CD2-CG2 4.32Å; W330-V334 HydrophobicContact CZ2-CG2 4.2Å; W330-V334 WeakPolarHBondContact O-CG2 3.46Å; W330-V334 PolarHBondContact O-N 2.98Å; W330-V334 VanDerWaalsContact O-N 3.09Å
331	Y	63.8	Low	61.7	Low	130 Å²	130	101 Å²	101	51%	0.51	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-44.6	173.4	-103.6	-83.7	0	0	0	112.1	K327 S328 Y333 V334 V335	K327-Y331 PolarHBondContact O-N 2.93Å; S328-Y331 PolarHBondContact O-N 2.86Å; Y331-Y333 VanDerWaalsContact C-N 3.33Å; Y331-Y333 PolarHBondContact O-N 3.32Å; Y331-V334 PolarHBondContact O-N 3.22Å; Y331-V335 VanDerWaalsContact O-CG2 3.26Å; Y331-V335 WeakPolarHBondContact O-CG2 3.27Å; Y331-V335 PolarHBondContact O-N 3.01Å
332	L	69.1	Low	64.1	Low	107 Å²	107	99.7 Å²	99.7	56%	0.56	50%	0.495	S	S	*	.	H	α-helix	trans	-59.2	-44.2	178.2	-171.3	71.5	0	0	0	111.5	S328 H329 W330 V335 I336	S328-L332 PolarHBondContact O-N 3.08Å; H329-L332 PolarHBondContact O-N 3.23Å; W330-L332 VanDerWaalsContact C-N 3.35Å; W330-L332 PolarHBondContact O-N 2.89Å; L332-V335 PolarHBondContact O-N 2.96Å; L332-I336 HydrophobicContact CG-CD1 3.96Å; L332-I336 VanDerWaalsContact O-CG1 3.23Å; L332-I336 WeakPolarHBondContact O-CG1 3.37Å; L332-I336 PolarHBondContact O-N 3.28Å
333	Y	70.9	Confident	66.5	Low	157 Å²	157	101.8 Å²	101.8	62%	0.616	50%	0.503	S	S	*	.	H	α-helix	trans	-65.1	-42.6	179.9	-161	-100.4	0	0	0	112.4	H329 W330 Y331 I336 L337	H329-Y333 PolarHBondContact O-N 3.19Å; W330-Y333 PolarHBondContact O-N 3.24Å; Y331-Y333 VanDerWaalsContact C-N 3.33Å; Y331-Y333 PolarHBondContact O-N 3.32Å; Y333-I336 PolarHBondContact O-N 2.82Å; Y333-L337 HydrophobicContact CD1-CD1 3.49Å; Y333-L337 VanDerWaalsContact CD1-CD1 3.49Å; Y333-L337 HydrophobicContact CE1-CD1 3.24Å; Y333-L337 HydrophobicContact CG-CD1 4.44Å; Y333-L337 PolarHBondContact O-N 2.83Å
334	V	75.6	Confident	68.8	Low	29 Å²	29	102.9 Å²	102.9	18%	0.176	51%	0.508	C	S	.	.	H	α-helix	trans	-63.2	-42.3	176.1	173.9	0	0	0	0	111.1	W330 Y331 L337 L338	W330-V334 HydrophobicContact CD2-CG2 4.32Å; W330-V334 HydrophobicContact CZ2-CG2 4.2Å; W330-V334 WeakPolarHBondContact O-CG2 3.46Å; W330-V334 PolarHBondContact O-N 2.98Å; W330-V334 VanDerWaalsContact O-N 3.09Å; Y331-V334 PolarHBondContact O-N 3.22Å; V334-L337 PolarHBondContact O-N 2.79Å; V334-L338 HydrophobicContact CG1-CD1 4.1Å; V334-L338 WeakPolarHBondContact O-CG 3.24Å; V334-L338 PolarHBondContact O-N 2.78Å
335	V	75.6	Confident	71.2	Confident	76 Å²	76	100.5 Å²	100.5	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-43.6	177.4	171.6	0	0	0	0	111.1	Y331 L332 L337 L338 V339	Y331-V335 VanDerWaalsContact O-CG2 3.26Å; Y331-V335 WeakPolarHBondContact O-CG2 3.27Å; Y331-V335 PolarHBondContact O-N 3.01Å; L332-V335 PolarHBondContact O-N 2.96Å; V335-L337 VanDerWaalsContact C-N 3.35Å; V335-L337 PolarHBondContact O-N 2.91Å; V335-L338 PolarHBondContact O-N 2.93Å; V335-V339 HydrophobicContact CG1-CG2 4.4Å; V335-V339 VanDerWaalsContact O-CG2 3.31Å; V335-V339 WeakPolarHBondContact O-CG2 3.49Å; V335-V339 PolarHBondContact O-N 2.8Å
336	I	81.3	Confident	73.5	Confident	96 Å²	96	98.3 Å²	98.3	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-60.6	-44.2	177.3	-70.3	166.4	0	0	0	111	L332 Y333 L338 V339 A340	L332-I336 HydrophobicContact CG-CD1 3.96Å; L332-I336 VanDerWaalsContact O-CG1 3.23Å; L332-I336 WeakPolarHBondContact O-CG1 3.37Å; L332-I336 PolarHBondContact O-N 3.28Å; Y333-I336 PolarHBondContact O-N 2.82Å; I336-L338 PolarHBondContact O-N 3.24Å; I336-V339 PolarHBondContact O-N 3.11Å; I336-A340 WeakPolarHBondContact O-CB 3.29Å; I336-A340 PolarHBondContact O-N 2.95Å
337	L	79.2	Confident	75.6	Confident	88 Å²	88	96.3 Å²	96.3	46%	0.461	49%	0.492	S	S	.	.	H	α-helix	trans	-63.2	-40.2	177.6	-100.9	139.8	0	0	0	112.9	Y333 V334 V335 A340 S341	Y333-L337 HydrophobicContact CD1-CD1 3.49Å; Y333-L337 VanDerWaalsContact CD1-CD1 3.49Å; Y333-L337 HydrophobicContact CE1-CD1 3.24Å; Y333-L337 HydrophobicContact CG-CD1 4.44Å; Y333-L337 PolarHBondContact O-N 2.83Å; V334-L337 PolarHBondContact O-N 2.79Å; V335-L337 VanDerWaalsContact C-N 3.35Å; V335-L337 PolarHBondContact O-N 2.91Å; L337-A340 PolarHBondContact O-N 2.82Å; L337-S341 PolarHBondContact O-N 3.01Å
338	L	80.8	Confident	77.5	Confident	97 Å²	97	91.8 Å²	91.8	51%	0.508	48%	0.482	S	S	.	.	H	α-helix	trans	-66.3	-41.4	175.8	-75.6	168.9	0	0	0	111.9	V334 V335 I336 S341 L342	V334-L338 HydrophobicContact CG1-CD1 4.1Å; V334-L338 WeakPolarHBondContact O-CG 3.24Å; V334-L338 PolarHBondContact O-N 2.78Å; V335-L338 PolarHBondContact O-N 2.93Å; I336-L338 PolarHBondContact O-N 3.24Å; L338-S341 PolarHBondContact O-N 2.81Å; L338-S341 PolarHBondContact O-OG 3.19Å; L338-L342 WeakPolarHBondContact O-CG 3.07Å; L338-L342 PolarHBondContact O-N 2.86Å; L338-L342 VanDerWaalsContact O-N 3.13Å
339	V	81.6	Confident	79	Confident	68 Å²	68	91.3 Å²	91.3	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-65.4	-44.4	176.5	171.5	0	0	0	0	110.5	V335 I336 S341 L342 F343	V335-V339 HydrophobicContact CG1-CG2 4.4Å; V335-V339 VanDerWaalsContact O-CG2 3.31Å; V335-V339 WeakPolarHBondContact O-CG2 3.49Å; V335-V339 PolarHBondContact O-N 2.8Å; I336-V339 PolarHBondContact O-N 3.11Å; V339-S341 VanDerWaalsContact C-N 3.34Å; V339-S341 PolarHBondContact O-N 2.83Å; V339-L342 PolarHBondContact O-N 2.84Å; V339-F343 HydrophobicContact CG1-CD2 3.73Å; V339-F343 HydrophobicContact CG1-CE2 3.46Å; V339-F343 VanDerWaalsContact CG1-CE2 3.46Å; V339-F343 WeakPolarHBondContact O-CD2 3.47Å; V339-F343 PolarHBondContact O-N 2.9Å
340	A	84.8	Confident	80.4	Confident	47 Å²	47	91.5 Å²	91.5	39%	0.388	48%	0.482	S	S	.	.	H	α-helix	trans	-61.7	-39.6	177.2	0	0	0	0	0	112.6	I336 L337 F343 L344	I336-A340 WeakPolarHBondContact O-CB 3.29Å; I336-A340 PolarHBondContact O-N 2.95Å; L337-A340 PolarHBondContact O-N 2.82Å; A340-F343 PolarHBondContact O-N 3.13Å; A340-L344 WeakPolarHBondContact O-CG 3.41Å; A340-L344 PolarHBondContact O-N 2.72Å
341	S	84.1	Confident	81.5	Confident	51 Å²	51	89.9 Å²	89.9	36%	0.357	48%	0.481	S	S	.	.	H	α-helix	trans	-67	-38.7	177.5	77.1	0	0	0	0	112.2	L337 L338 V339 F343 L344 I345	L337-S341 PolarHBondContact O-N 3.01Å; L338-S341 PolarHBondContact O-N 2.81Å; L338-S341 PolarHBondContact O-OG 3.19Å; V339-S341 VanDerWaalsContact C-N 3.34Å; V339-S341 PolarHBondContact O-N 2.83Å; S341-F343 PolarHBondContact O-N 3.5Å; S341-L344 PolarHBondContact O-N 3.16Å; S341-I345 VanDerWaalsContact O-CG1 3.32Å; S341-I345 WeakPolarHBondContact O-CG1 3.47Å; S341-I345 PolarHBondContact O-N 3.24Å
342	L	85.5	Confident	82.5	Confident	107 Å²	107	92.3 Å²	92.3	56%	0.56	49%	0.49	S	S	*	.	H	α-helix	trans	-61.7	-42.1	173.5	-74	168.7	0	0	0	111.7	L338 V339 I345 C346	L338-L342 WeakPolarHBondContact O-CG 3.07Å; L338-L342 PolarHBondContact O-N 2.86Å; L338-L342 VanDerWaalsContact O-N 3.13Å; V339-L342 PolarHBondContact O-N 2.84Å; L342-I345 PolarHBondContact O-N 2.72Å; L342-C346 PolarHBondContact O-N 3.04Å; L342-C346 PolarHBondContact O-SG 3.34Å
343	F	86.7	Confident	82.9	Confident	135 Å²	135	96.3 Å²	96.3	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-62.1	-43	175.3	-83.3	-68.7	0	0	0	112.4	V339 A340 S341 I345 C346 I347	V339-F343 HydrophobicContact CG1-CD2 3.73Å; V339-F343 HydrophobicContact CG1-CE2 3.46Å; V339-F343 VanDerWaalsContact CG1-CE2 3.46Å; V339-F343 WeakPolarHBondContact O-CD2 3.47Å; V339-F343 PolarHBondContact O-N 2.9Å; A340-F343 PolarHBondContact O-N 3.13Å; S341-F343 PolarHBondContact O-N 3.5Å; F343-I345 VanDerWaalsContact C-N 3.34Å; F343-I345 PolarHBondContact O-N 3.41Å; F343-C346 PolarHBondContact O-N 3.46Å; F343-I347 VanDerWaalsContact O-CG1 3.29Å; F343-I347 WeakPolarHBondContact O-CG1 3.41Å; F343-I347 PolarHBondContact O-N 2.88Å
344	L	89.2	Confident	83.6	Confident	124 Å²	124	96.2 Å²	96.2	65%	0.649	50%	0.496	S	S	*	.	H	α-helix	trans	-63.3	-39.8	177.4	-71.7	171.3	0	0	0	112.2	A340 S341 I347 G348	A340-L344 WeakPolarHBondContact O-CG 3.41Å; A340-L344 PolarHBondContact O-N 2.72Å; S341-L344 PolarHBondContact O-N 3.16Å; L344-I347 PolarHBondContact O-N 2.84Å; L344-G348 PolarHBondContact O-N 3.12Å
345	I	85.9	Confident	83.9	Confident	103 Å²	103	99.3 Å²	99.3	53%	0.528	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-45.8	174.8	-68	163.4	0	0	0	110.4	S341 L342 F343 I347 G348 C349	S341-I345 VanDerWaalsContact O-CG1 3.32Å; S341-I345 WeakPolarHBondContact O-CG1 3.47Å; S341-I345 PolarHBondContact O-N 3.24Å; L342-I345 PolarHBondContact O-N 2.72Å; F343-I345 VanDerWaalsContact C-N 3.34Å; F343-I345 PolarHBondContact O-N 3.41Å; I345-I347 PolarHBondContact O-N 3.4Å; I345-G348 PolarHBondContact O-N 3.28Å; I345-C349 PolarHBondContact O-N 2.88Å; I345-C349 PolarHBondContact O-SG 2.95Å; I345-C349 VanDerWaalsContact O-SG 3.34Å
346	C	85.4	Confident	83.8	Confident	72 Å²	72	100.5 Å²	100.5	49%	0.486	52%	0.515	S	S	.	.	H	α-helix	trans	-59.5	-44.4	176.9	-73.3	0	0	0	0	112.2	L342 F343 C349 I350	L342-C346 PolarHBondContact O-N 3.04Å; L342-C346 PolarHBondContact O-SG 3.34Å; F343-C346 PolarHBondContact O-N 3.46Å; C346-C349 PolarHBondContact O-N 2.83Å; C346-I350 VanDerWaalsContact O-CG1 3.3Å; C346-I350 WeakPolarHBondContact O-CG1 3.45Å; C346-I350 PolarHBondContact O-N 2.84Å
347	I	89.9	Confident	83.6	Confident	89 Å²	89	105.7 Å²	105.7	46%	0.456	53%	0.528	S	S	.	.	H	α-helix	trans	-62.1	-45.3	176.2	-67.6	165.1	0	0	0	110.2	F343 L344 I345 C349 I350 I351	F343-I347 VanDerWaalsContact O-CG1 3.29Å; F343-I347 WeakPolarHBondContact O-CG1 3.41Å; F343-I347 PolarHBondContact O-N 2.88Å; L344-I347 PolarHBondContact O-N 2.84Å; I345-I347 PolarHBondContact O-N 3.4Å; I347-C349 VanDerWaalsContact C-N 3.33Å; I347-C349 PolarHBondContact O-N 2.89Å; I347-I350 PolarHBondContact O-N 2.9Å; I347-I350 VanDerWaalsContact O-N 3.16Å; I347-I351 HydrophobicContact CG2-CD1 3.73Å; I347-I351 HydrophobicContact CG2-CG1 4.35Å; I347-I351 WeakPolarHBondContact O-CG1 2.98Å; I347-I351 PolarHBondContact O-N 2.98Å
348	G	86	Confident	83.5	Confident	36 Å²	36	108.7 Å²	108.7	37%	0.371	53%	0.533	S	S	.	.	H	α-helix	trans	-57.1	-43.6	175.1	0	0	0	0	0	112.7	L344 I345 I351 W352	L344-G348 PolarHBondContact O-N 3.12Å; I345-G348 PolarHBondContact O-N 3.28Å; G348-I351 PolarHBondContact O-N 2.64Å; G348-W352 WeakPolarHBondContact O-CB 3.36Å; G348-W352 PolarHBondContact O-N 3.13Å
349	C	83.9	Confident	83.1	Confident	70 Å²	70	111.9 Å²	111.9	47%	0.473	54%	0.543	S	S	.	.	H	α-helix	trans	-64.8	-38	176	-69.7	0	0	0	0	112.9	I345 C346 I347 R353	I345-C349 PolarHBondContact O-N 2.88Å; I345-C349 PolarHBondContact O-SG 2.95Å; I345-C349 VanDerWaalsContact O-SG 3.34Å; C346-C349 PolarHBondContact O-N 2.83Å; I347-C349 VanDerWaalsContact C-N 3.33Å; I347-C349 PolarHBondContact O-N 2.89Å; C349-R353 WeakPolarHBondContact O-CB 3.47Å; C349-R353 WeakPolarHBondContact O-CG 3.31Å; C349-R353 PolarHBondContact O-N 3.22Å
350	I	86	Confident	82.4	Confident	114 Å²	114	118.6 Å²	118.6	59%	0.585	56%	0.561	S	S	*	*	H	α-helix	trans	-65.9	-47.4	176.5	-68.5	165.5	0	0	0	110.1	C346 I347 W352 R353 W354	C346-I350 VanDerWaalsContact O-CG1 3.3Å; C346-I350 WeakPolarHBondContact O-CG1 3.45Å; C346-I350 PolarHBondContact O-N 2.84Å; I347-I350 PolarHBondContact O-N 2.9Å; I347-I350 VanDerWaalsContact O-N 3.16Å; I350-W352 VanDerWaalsContact C-N 3.35Å; I350-W352 PolarHBondContact O-N 2.8Å; I350-R353 PolarHBondContact O-N 2.92Å; I350-W354 WeakPolarHBondContact O-CB 3.44Å; I350-W354 PolarHBondContact O-N 2.94Å
351	I	86.6	Confident	81.5	Confident	91 Å²	91	121 Å²	121	47%	0.467	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-44.5	178.3	-66.2	169.7	0	0	0	110.4	I347 G348 W354 L355	I347-I351 HydrophobicContact CG2-CD1 3.73Å; I347-I351 HydrophobicContact CG2-CG1 4.35Å; I347-I351 WeakPolarHBondContact O-CG1 2.98Å; I347-I351 PolarHBondContact O-N 2.98Å; G348-I351 PolarHBondContact O-N 2.64Å; I351-W354 WeakPolarHBondContact O-CB 3.25Å; I351-W354 PolarHBondContact O-N 2.82Å; I351-L355 HydrophobicContact CG2-CD1 4.08Å; I351-L355 WeakPolarHBondContact O-CG 3.03Å; I351-L355 PolarHBondContact O-N 2.86Å
352	W	84.8	Confident	80.3	Confident	181 Å²	181	125 Å²	125	69%	0.686	59%	0.592	S	S	*	*	H	α-helix	trans	-58.8	-51.1	175.7	-169.9	-39.1	0	0	0	111	G348 I350 W354 L355 L356	G348-W352 WeakPolarHBondContact O-CB 3.36Å; G348-W352 PolarHBondContact O-N 3.13Å; I350-W352 VanDerWaalsContact C-N 3.35Å; I350-W352 PolarHBondContact O-N 2.8Å; W352-W354 PolarHBondContact O-N 2.85Å; W352-L355 PolarHBondContact O-N 2.7Å; W352-L355 VanDerWaalsContact O-N 3.17Å; W352-L356 PolarHBondContact O-N 2.65Å
353	R	78.1	Confident	78.6	Confident	191 Å²	191	130.4 Å²	130.4	72%	0.721	61%	0.614	S	S	*	*	H	α-helix	trans	-58.7	-37.6	178.4	-80.7	-175.5	173	-169.1	-0.6	112.3	C349 I350 R357	C349-R353 WeakPolarHBondContact O-CB 3.47Å; C349-R353 WeakPolarHBondContact O-CG 3.31Å; C349-R353 PolarHBondContact O-N 3.22Å; I350-R353 PolarHBondContact O-N 2.92Å; R353-R357 PolarHBondContact O-N 3.19Å; R353-R357 VanDerWaalsContact O-N 3.11Å
354	W	84.6	Confident	78.2	Confident	155 Å²	155	130.2 Å²	130.2	59%	0.587	62%	0.615	S	S	*	*	H	α-helix	trans	-65.4	-45.3	176.4	-174.7	74	0	0	0	111.9	I350 I351 W352 L356 R357 R358	I350-W354 WeakPolarHBondContact O-CB 3.44Å; I350-W354 PolarHBondContact O-N 2.94Å; I351-W354 WeakPolarHBondContact O-CB 3.25Å; I351-W354 PolarHBondContact O-N 2.82Å; W352-W354 PolarHBondContact O-N 2.85Å; W354-L356 PolarHBondContact O-N 2.61Å; W354-R357 PolarHBondContact O-N 3.2Å; W354-R358 PolarHBondContact O-N 2.72Å; W354-R358 VanDerWaalsContact O-N 3.1Å
355	L	82.8	Confident	77.6	Confident	95 Å²	95	130.5 Å²	130.5	50%	0.497	61%	0.614	S	S	.	*	H	α-helix	trans	-63	-39.8	175.9	-71.1	171.2	0	0	0	112.5	I351 W352 R358 K359	I351-L355 HydrophobicContact CG2-CD1 4.08Å; I351-L355 WeakPolarHBondContact O-CG 3.03Å; I351-L355 PolarHBondContact O-N 2.86Å; W352-L355 PolarHBondContact O-N 2.7Å; W352-L355 VanDerWaalsContact O-N 3.17Å; L355-R358 PolarHBondContact O-N 3.25Å; L355-K359 PolarHBondContact O-N 2.71Å; L355-K359 VanDerWaalsContact O-N 3.13Å
356	L	72.9	Confident	77.2	Confident	101 Å²	101	132 Å²	132	53%	0.529	62%	0.618	S	S	.	*	H	α-helix	trans	-62.4	-41.9	175.3	-86.1	169.6	0	0	0	112.6	W352 W354 R358 K359 R360	W352-L356 PolarHBondContact O-N 2.65Å; W354-L356 PolarHBondContact O-N 2.61Å; L356-R358 VanDerWaalsContact C-N 3.35Å; L356-K359 PolarHBondContact O-N 2.7Å; L356-R360 PolarHBondContact O-N 2.9Å
357	R	76.8	Confident	76.7	Confident	205 Å²	205	135.5 Å²	135.5	77%	0.774	63%	0.626	S	S	*	*	H	α-helix	trans	-64	-40.6	176.2	-79.4	-174.1	-177.3	178.6	0.9	111.9	R353 W354 K359 R360 S361	R353-R357 PolarHBondContact O-N 3.19Å; R353-R357 VanDerWaalsContact O-N 3.11Å; W354-R357 PolarHBondContact O-N 3.2Å; R357-K359 VanDerWaalsContact C-N 3.31Å; R357-K359 PolarHBondContact O-N 3.3Å; R357-R360 PolarHBondContact O-N 3.31Å; R357-S361 PolarHBondContact O-N 3.25Å
358	R	77.8	Confident	75.9	Confident	151 Å²	151	138.4 Å²	138.4	57%	0.57	64%	0.637	S	S	*	*	H	α-helix	trans	-63.7	-37.6	179	-165.3	174.7	-174.4	174.1	0.7	112	W354 L355 L356 S361	W354-R358 PolarHBondContact O-N 2.72Å; W354-R358 VanDerWaalsContact O-N 3.1Å; L355-R358 PolarHBondContact O-N 3.25Å; L356-R358 VanDerWaalsContact C-N 3.35Å; R358-S361 PolarHBondContact O-N 3.46Å
359	K	72	Confident	75.2	Confident	163 Å²	163	145.3 Å²	145.3	71%	0.709	65%	0.654	S	S	*	*	H	α-helix	trans	-65.7	-38.3	178.6	-149.8	177.5	-176.2	-174.3	0	112.5	L355 L356 R357 S361 N362	L355-K359 PolarHBondContact O-N 2.71Å; L355-K359 VanDerWaalsContact O-N 3.13Å; L356-K359 PolarHBondContact O-N 2.7Å; R357-K359 VanDerWaalsContact C-N 3.31Å; R357-K359 PolarHBondContact O-N 3.3Å; K359-S361 VanDerWaalsContact C-N 3.28Å; K359-S361 PolarHBondContact O-N 3.21Å; K359-N362 PolarHBondContact O-N 3.31Å
360	R	66.8	Low	74.6	Confident	210 Å²	210	150.6 Å²	150.6	79%	0.792	67%	0.667	S	S	*	*	H	α-helix	trans	-69.3	-17.9	174.8	-89	-170.4	-169.6	173	3.1	115.3	L356 R357	L356-R360 PolarHBondContact O-N 2.9Å; R357-R360 PolarHBondContact O-N 3.31Å
361	S	65.9	Low	73.7	Confident	96 Å²	96	153.5 Å²	153.5	67%	0.671	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-10.5	177.9	-171.2	0	0	0	0	112.9	R357 R358 K359	R357-S361 PolarHBondContact O-N 3.25Å; R358-S361 PolarHBondContact O-N 3.46Å; K359-S361 VanDerWaalsContact C-N 3.28Å; K359-S361 PolarHBondContact O-N 3.21Å
362	N	57.9	Low	72.6	Confident	136 Å²	136	158.7 Å²	158.7	73%	0.727	69%	0.691	S	S	*	*			trans	-105	-3.9	179.4	-73.4	1.2	0	0	0	112.5	K359	K359-N362 PolarHBondContact O-N 3.31Å
363	E	51	Low	71.5	Confident	220 Å²	220	156.6 Å²	156.6	100%	1.028	69%	0.691	S	S	*	*			trans	-90.9	0	156.6	-85.6	175.4	163.6	0	0	107.7

Retrieved 363 of 363 residues in 495.7 ms (Link to these results)

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