A0A077ZHP3_TRITR Loading...

ChlI and AAA 25 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZHP3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 424 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	33.7	Very low	223 Å²	223	169.5 Å²	169.5	100%	1.099	85%	0.85	S	S	*	*				0	92.1	0	-166.9	168.7	155.4	0	0	104.8
2	V	34.3	Very low	34	Very low	140 Å²	140	164.4 Å²	164.4	85%	0.848	83%	0.828	S	S	*	*			trans	-100.4	105.9	-176	-177.9	0	0	0	0	104.5	E4	V2-E4 PolarHBondContact O-N 3.26Å
3	E	34.4	Very low	34.6	Very low	162 Å²	162	160.7 Å²	160.7	76%	0.757	80%	0.798	S	S	*	*			trans	-70.3	110.6	173.7	-77.6	174.4	155.2	0	0	107.7	I5	E3-I5 PolarHBondContact O-N 3.02Å
4	E	31.8	Very low	34.9	Very low	188 Å²	188	164.9 Å²	164.9	88%	0.879	80%	0.8	S	S	*	*			trans	-66.9	109.2	167.4	-84.5	179	146.1	0	0	108.1	V2 E6	V2-E4 PolarHBondContact O-N 3.26Å; E4-E6 PolarHBondContact O-N 3.24Å
5	I	32.5	Very low	35.1	Very low	154 Å²	154	161.1 Å²	161.1	79%	0.79	79%	0.785	S	S	*	*			trans	-71.4	105.5	168.9	-62.3	172.1	0	0	0	106.3	E3 Q7	E3-I5 PolarHBondContact O-N 3.02Å; I5-Q7 PolarHBondContact O-N 2.96Å
6	E	30.1	Very low	35.5	Very low	183 Å²	183	165.6 Å²	165.6	86%	0.855	79%	0.791	S	S	*	*			trans	-53.8	111.2	169.5	-83.1	-175.6	147.1	0	0	109	E4 N8	E4-E6 PolarHBondContact O-N 3.24Å; E6-N8 PolarHBondContact O-N 2.71Å; E6-N8 VanDerWaalsContact O-N 3.17Å
7	Q	29.6	Very low	35.7	Very low	176 Å²	176	160.3 Å²	160.3	82%	0.822	77%	0.772	S	S	*	*			trans	-71.1	108.1	173.1	-73	-179.6	-6.7	0	0	108.3	I5 H9	I5-Q7 PolarHBondContact O-N 2.96Å; Q7-H9 PolarHBondContact O-N 3.15Å
8	N	31.8	Very low	36.3	Very low	161 Å²	161	153.8 Å²	153.8	86%	0.861	75%	0.745	S	S	*	*			trans	-51.9	111	169	-83.9	-31	0	0	0	109.6	E6	E6-N8 PolarHBondContact O-N 2.71Å; E6-N8 VanDerWaalsContact O-N 3.17Å
9	H	30.3	Very low	36.8	Very low	174 Å²	174	152.4 Å²	152.4	81%	0.806	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-60.1	137.3	172.7	-83.8	-68.7	0	0	0	110.1	Q7 E11	Q7-H9 PolarHBondContact O-N 3.15Å; H9-E11 PolarHBondContact O-N 3.34Å
10	P	36.5	Very low	37.5	Very low	121 Å²	121	149.3 Å²	149.3	79%	0.786	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-67.9	119.1	176.3	21.4	-19.6	0	0	0	108.5	D12	P10-D12 PolarHBondContact O-N 3.31Å; P10-D12 VanDerWaalsContact O-N 3.15Å
11	E	40	Very low	38.3	Very low	182 Å²	182	144.4 Å²	144.4	85%	0.85	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-55.2	117.7	179.1	-70.6	-173.6	149.5	0	0	110.5	H9 R13	H9-E11 PolarHBondContact O-N 3.34Å; E11-R13 PolarHBondContact O-N 3.12Å
12	D	37.4	Very low	39	Very low	109 Å²	109	140.7 Å²	140.7	58%	0.583	70%	0.7	S	S	*	*			trans	-63.8	98.6	178.8	-171.4	-4.6	0	0	0	110.1	P10 R14	P10-D12 PolarHBondContact O-N 3.31Å; P10-D12 VanDerWaalsContact O-N 3.15Å; D12-R14 PolarHBondContact O-N 3.1Å
13	R	42.2	Very low	40.3	Very low	116 Å²	116	144 Å²	144	44%	0.438	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-2.9	-174.5	-67.1	-173.8	-176.7	-155.3	2.3	114.7	E11 N15 D150 E167	E11-R13 PolarHBondContact O-N 3.12Å; R13-N15 PolarHBondContact O-N 2.81Å; R13-D150 IonicContact CZ-OD2 3.03Å; R13-D150 IonicContact NH2-OD2 2.7Å; R13-D150 PolarHBondContact NH2-OD2 2.96Å; R13-E167 IonicContact NH1-OE1 3.17Å; R13-E167 PolarHBondContact NH1-OE1 3.18Å; R13-E167 IonicContact NH1-OE2 3.37Å
14	R	38.6	Very low	42.1	Very low	219 Å²	219	141.3 Å²	141.3	83%	0.826	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-5	-179.6	-72.7	-177.7	174	178.3	1.9	115.1	D12 R16	D12-R14 PolarHBondContact O-N 3.1Å; R14-R16 PolarHBondContact O-N 2.9Å
15	N	37.5	Very low	44.5	Very low	108 Å²	108	140.1 Å²	140.1	58%	0.578	70%	0.697	S	S	*	*			trans	-79	108.2	-176.6	-74.3	-28.6	0	0	0	112.5	R13 V17 K170	R13-N15 PolarHBondContact O-N 2.81Å; N15-V17 HydrophobicContact CB-CG2 4.23Å; N15-V17 PolarHBondContact O-N 2.83Å; N15-V17 VanDerWaalsContact O-N 3.13Å; N15-K170 PolarHBondContact O-NZ 2.74Å
16	R	42.4	Very low	47	Very low	233 Å²	233	139.4 Å²	139.4	88%	0.879	70%	0.703	S	S	*	*			trans	-71.8	88.8	167.4	-80.5	179	168	172.8	-3.1	109.4	R14	R14-R16 PolarHBondContact O-N 2.9Å
17	V	38.3	Very low	49.8	Very low	76 Å²	76	135 Å²	135	46%	0.461	69%	0.688	S	S	.	*			trans	-124.4	119.2	172.8	-167.3	0	0	0	0	107.5	N15	N15-V17 HydrophobicContact CB-CG2 4.23Å; N15-V17 PolarHBondContact O-N 2.83Å; N15-V17 VanDerWaalsContact O-N 3.13Å
18	S	46.2	Very low	52.5	Low	43 Å²	43	133.4 Å²	133.4	30%	0.301	68%	0.678	S	S	.	*			trans	-62.5	157.5	166.2	159.5	0	0	0	0	109.5	T20 G21	S18-T20 PolarHBondContact O-N 2.76Å; S18-T20 PolarHBondContact OG-N 3.26Å; S18-T20 PolarHBondContact OG-OG1 2.91Å; S18-G21 PolarHBondContact O-N 3.17Å
19	L	46.1	Very low	55.1	Low	127 Å²	127	132.7 Å²	132.7	67%	0.665	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.7	-27.3	169	-101.1	166.2	0	0	0	113.2	G21 T174 N175	L19-G21 VanDerWaalsContact C-N 3.32Å; L19-T174 HydrophobicContact CB-CG2 4.47Å; L19-T174 HydrophobicContact CG-CG2 4.44Å; L19-N175 WeakPolarHBondContact CD1-OD1 3.29Å
20	T	50.8	Low	58	Low	90 Å²	90	132.5 Å²	132.5	55%	0.552	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-2.6	177.8	56.8	0	0	0	0	114.3	S18 E22	S18-T20 PolarHBondContact O-N 2.76Å; S18-T20 PolarHBondContact OG-N 3.26Å; S18-T20 PolarHBondContact OG-OG1 2.91Å; T20-E22 PolarHBondContact O-N 3.11Å; T20-E22 WeakPolarHBondContact OG1-CB 3.44Å; T20-E22 PolarHBondContact OG1-N 3.47Å
21	G	53.5	Low	60.4	Low	47 Å²	47	130.9 Å²	130.9	49%	0.485	66%	0.655	S	S	.	*			trans	67.9	-5.3	-170.4	0	0	0	0	0	113.7	S18 L19 R23	S18-G21 PolarHBondContact O-N 3.17Å; L19-G21 VanDerWaalsContact C-N 3.32Å; G21-R23 PolarHBondContact O-N 3Å
22	E	54.1	Low	62.4	Low	146 Å²	146	125.7 Å²	125.7	68%	0.682	64%	0.636	S	S	*	*			trans	-73.5	115.4	-175.6	-68.4	-175.9	153.4	0	0	110.1	T20 A24	T20-E22 PolarHBondContact O-N 3.11Å; T20-E22 WeakPolarHBondContact OG1-CB 3.44Å; T20-E22 PolarHBondContact OG1-N 3.47Å; E22-A24 PolarHBondContact O-N 3.39Å
23	R	61.6	Low	64.3	Low	210 Å²	210	126.3 Å²	126.3	79%	0.792	64%	0.644	S	S	*	*			trans	-71.7	121	167.5	-69.4	-178.3	178.3	-177.9	-0.4	108	G21 Q25	G21-R23 PolarHBondContact O-N 3Å; R23-Q25 PolarHBondContact O-N 2.92Å
24	A	73.5	Confident	65.6	Low	105 Å²	105	130.2 Å²	130.2	87%	0.868	66%	0.664	S	S	*	*			trans	-55.2	115.1	170.7	0	0	0	0	0	109.3	E22	E22-A24 PolarHBondContact O-N 3.39Å
25	Q	81.2	Confident	66.9	Low	162 Å²	162	128.7 Å²	128.7	76%	0.757	66%	0.663	S	S	*	*			trans	-85.6	147	174.7	-64.2	-164.7	13.6	0	0	109.8	R23 T27	R23-Q25 PolarHBondContact O-N 2.92Å; Q25-T27 PolarHBondContact O-N 3.18Å; Q25-T27 VanDerWaalsContact O-N 3.15Å; Q25-T27 PolarHBondContact O-OG1 3.4Å
26	P	85.8	Confident	68.3	Low	140 Å²	140	133.2 Å²	133.2	91%	0.909	68%	0.678	S	S	*	*			trans	-58.7	118.9	172.2	-21.8	32.8	0	0	0	110.8
27	T	87.9	Confident	69.7	Low	89 Å²	89	126.6 Å²	126.6	55%	0.546	66%	0.657	S	S	.	*			trans	-109.2	140.2	178.1	-53.5	0	0	0	0	109.3	Q25 D31 V32	Q25-T27 PolarHBondContact O-N 3.18Å; Q25-T27 VanDerWaalsContact O-N 3.15Å; Q25-T27 PolarHBondContact O-OG1 3.4Å; T27-D31 HydrophobicContact CG2-CB 3.71Å; T27-V32 HydrophobicContact CG2-CG2 4.26Å
28	K	88	Confident	71.9	Confident	143 Å²	143	128 Å²	128	62%	0.622	67%	0.666	S	S	*	*			trans	-65.7	142.7	173.9	-59.8	176.9	176.8	172.6	0	108.6	K30 D31 V32	K28-K30 HydrophobicContact CB-CG 4.09Å; K28-K30 PolarHBondContact O-N 3.26Å; K28-K30 VanDerWaalsContact O-N 3.07Å; K28-D31 WeakPolarHBondContact CB-OD2 3.47Å; K28-D31 WeakPolarHBondContact O-CA 3.42Å; K28-D31 PolarHBondContact O-N 3.5Å; K28-V32 PolarHBondContact O-N 2.82Å
29	L	86.4	Confident	74	Confident	147 Å²	147	129.7 Å²	129.7	77%	0.77	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-51.6	-39.1	-177.7	-179.2	61.7	0	0	0	113.1	D31 V32	L29-D31 PolarHBondContact O-N 3.47Å; L29-V32 WeakPolarHBondContact O-CB 3.47Å; L29-V32 PolarHBondContact O-N 2.85Å
30	K	90.5	Very high	76.3	Confident	169 Å²	169	125.5 Å²	125.5	74%	0.735	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-66.1	-20.7	177.8	62.5	167.1	-166.2	170.8	0	114.9	K28	K28-K30 HydrophobicContact CB-CG 4.09Å; K28-K30 PolarHBondContact O-N 3.26Å; K28-K30 VanDerWaalsContact O-N 3.07Å
31	D	87.5	Confident	78.3	Confident	87 Å²	87	127.4 Å²	127.4	47%	0.465	65%	0.646	S	S	.	*	G	3₁₀ helix	trans	-97	-2.9	-178.6	-53.6	-34	0	0	0	110.7	T27 K28 L29 V33	T27-D31 HydrophobicContact CG2-CB 3.71Å; K28-D31 WeakPolarHBondContact CB-OD2 3.47Å; K28-D31 WeakPolarHBondContact O-CA 3.42Å; K28-D31 PolarHBondContact O-N 3.5Å; L29-D31 PolarHBondContact O-N 3.47Å; D31-V33 PolarHBondContact O-N 3.39Å
32	V	80.8	Confident	80.2	Confident	74 Å²	74	125.4 Å²	125.4	45%	0.448	63%	0.625	S	S	.	*			trans	-75.8	111.8	173.4	-179.2	0	0	0	0	108.9	T27 K28 L29 F34	T27-V32 HydrophobicContact CG2-CG2 4.26Å; K28-V32 PolarHBondContact O-N 2.82Å; L29-V32 WeakPolarHBondContact O-CB 3.47Å; L29-V32 PolarHBondContact O-N 2.85Å; V32-F34 PolarHBondContact O-N 2.94Å
33	V	77.3	Confident	81.9	Confident	122 Å²	122	124.7 Å²	124.7	74%	0.739	63%	0.625	S	S	*	*			trans	-73.7	116.6	175	-177.5	0	0	0	0	108.9	D31 K35	D31-V33 PolarHBondContact O-N 3.39Å; V33-K35 PolarHBondContact O-N 2.88Å
34	F	68.9	Low	83.4	Confident	197 Å²	197	115 Å²	115	86%	0.864	59%	0.59	S	S	*	*			trans	-62.3	107.6	171.7	-81.9	-88.5	0	0	0	109.7	V32	V32-F34 PolarHBondContact O-N 2.94Å
35	K	67.4	Low	84.3	Confident	187 Å²	187	112.7 Å²	112.7	81%	0.813	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-91.5	119.6	162.4	-72.3	-174.5	179.1	-179.4	0	107.5	V33 E37	V33-K35 PolarHBondContact O-N 2.88Å; K35-E37 PolarHBondContact O-N 2.8Å
36	K	66.8	Low	84.9	Confident	204 Å²	204	105.2 Å²	105.2	89%	0.887	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-59.6	124	170.5	-172.3	177.6	-179.2	-177.5	0	107.4	T38	K36-T38 PolarHBondContact O-N 3.05Å
37	E	70.4	Confident	85.4	Confident	94 Å²	94	98.6 Å²	98.6	44%	0.439	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-58	122.5	177.8	-64.8	157.9	169	0	0	109.2	K35 R39	K35-E37 PolarHBondContact O-N 2.8Å; E37-R39 PolarHBondContact O-N 2.85Å; E37-R39 IonicContact OE2-CZ 2.63Å; E37-R39 IonicContact OE2-NH2 3.22Å; E37-R39 PolarHBondContact OE2-NH2 3.03Å
38	T	84.5	Confident	85.7	Confident	105 Å²	105	95 Å²	95	64%	0.644	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-66.3	129.9	169.2	2.4	0	0	0	0	108.3	K36 P57	K36-T38 PolarHBondContact O-N 3.05Å; T38-P57 WeakPolarHBondContact O-CD 3.48Å
39	R	91.5	Very high	85.9	Confident	78 Å²	78	93 Å²	93	29%	0.294	46%	0.458	S	S	.	.			trans	-119.5	125.2	176.8	-66	-176.2	-174.8	-118.3	-2.2	108.8	E37 L51 G52 V55 V56 F225	E37-R39 PolarHBondContact O-N 2.85Å; E37-R39 IonicContact OE2-CZ 2.63Å; E37-R39 IonicContact OE2-NH2 3.22Å; E37-R39 PolarHBondContact OE2-NH2 3.03Å; R39-L51 PolarHBondContact NH1-O 2.93Å; R39-G52 VanDerWaalsContact NH1-C 3.27Å; R39-G52 PolarHBondContact NH1-O 3.29Å; R39-V55 WeakPolarHBondContact CA-O 3.41Å; R39-V56 HydrophobicContact CG-CG2 4.18Å; R39-F225 VanDerWaalsContact CZ-O 3.25Å; R39-F225 PolarHBondContact NH1-O 2.9Å; R39-F225 PolarHBondContact NH2-O 2.78Å
40	I	93.7	Very high	86.2	Confident	39 Å²	39	86 Å²	86	20%	0.2	42%	0.422	C	S	.	.	B	Isolated β-bridge	trans	-95.1	119.1	175.5	-58.2	90.4	0	0	0	107.5	G54 V55 P57 L82 T85 Y137	I40-G54 CarbonylContact O-C 3.48Å; I40-G54 VanDerWaalsContact O-CA 3.31Å; I40-G54 WeakPolarHBondContact O-CA 3.33Å; I40-V55 PolarHBondContact N-O 3.03Å; I40-V55 PolarHBondContact O-N 2.92Å; I40-P57 HydrophobicContact CD1-CG 3.51Å; I40-L82 HydrophobicContact CG2-CD2 4.16Å; I40-T85 HydrophobicContact CG2-CG2 4.38Å; I40-Y137 WeakPolarHBondContact CG1-OH 3.49Å; I40-Y137 WeakPolarHBondContact CG2-OH 3.29Å
41	Q	93.4	Very high	86.4	Confident	130 Å²	130	78.3 Å²	78.3	61%	0.607	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-82.8	137	176.8	-70.6	-172.3	-32.9	0	0	109.7	G53	Q41-G53 VanDerWaalsContact CG-O 3.28Å; Q41-G53 WeakPolarHBondContact CG-O 3.37Å; Q41-G53 PolarHBondContact NE2-O 3.25Å
42	T	92.8	Very high	86.6	Confident	6 Å²	6	75.7 Å²	75.7	4%	0.037	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-86.6	171.2	164	66.7	0	0	0	0	109.1	L44 L47 N48 V55 V78 L82	T42-L44 PolarHBondContact O-N 3.13Å; T42-L44 PolarHBondContact OG1-N 3.24Å; T42-L44 PolarHBondContact OG1-O 2.98Å; T42-L47 HydrophobicContact CG2-CD2 4.25Å; T42-N48 PolarHBondContact N-ND2 3.25Å; T42-N48 PolarHBondContact N-OD1 3.29Å; T42-N48 PolarHBondContact O-ND2 3.39Å; T42-N48 PolarHBondContact OG1-OD1 3.23Å; T42-V55 HydrophobicContact CG2-CG2 4.12Å; T42-V78 HydrophobicContact CG2-CG1 4.45Å; T42-L82 HydrophobicContact CG2-CD2 3.9Å; T42-L82 HydrophobicContact CG2-CG 4.26Å
43	D	90.7	Very high	87.1	Confident	130 Å²	130	73.3 Å²	73.3	70%	0.695	37%	0.372	S	S	*	.	S	Bend	trans	-76.9	-5.9	171.1	-64.3	-33.9	0	0	0	112.2	A45 Q81	D43-A45 PolarHBondContact O-N 3.03Å; D43-Q81 HydrophobicContact CB-CG 4.29Å
44	L	92.1	Very high	88	Confident	8 Å²	8	67.5 Å²	67.5	4%	0.042	34%	0.337	C	S	.	.			trans	-85.3	96.6	173.5	-63.5	174.5	0	0	0	110.9	T42 E46 L47 N48 L74 V78 F234 E243	T42-L44 PolarHBondContact O-N 3.13Å; T42-L44 PolarHBondContact OG1-N 3.24Å; T42-L44 PolarHBondContact OG1-O 2.98Å; L44-E46 VanDerWaalsContact C-N 3.34Å; L44-E46 PolarHBondContact O-N 3.47Å; L44-L47 HydrophobicContact CB-CB 3.68Å; L44-L47 HydrophobicContact CB-CD2 4.47Å; L44-L47 HydrophobicContact CD1-CB 4.42Å; L44-L47 HydrophobicContact CD1-CD2 4.25Å; L44-L47 PolarHBondContact O-N 3.32Å; L44-N48 WeakPolarHBondContact O-CB 3.41Å; L44-N48 PolarHBondContact O-N 3.44Å; L44-N48 PolarHBondContact O-ND2 2.86Å; L44-L74 HydrophobicContact CD1-CD1 3.92Å; L44-V78 HydrophobicContact CD1-CG2 3.99Å; L44-F234 HydrophobicContact CD2-CE1 4.42Å; L44-E243 VanDerWaalsContact CA-CD 3.46Å; L44-E243 WeakPolarHBondContact CA-OE1 3.35Å; L44-E243 WeakPolarHBondContact CB-OE1 3.42Å; L44-E243 HydrophobicContact CD2-CG 3.72Å
45	A	93.4	Very high	89.3	Confident	56 Å²	56	58.2 Å²	58.2	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-60.8	-37.8	178.7	0	0	0	0	0	113.7	D43 R49 E243	D43-A45 PolarHBondContact O-N 3.03Å; A45-R49 WeakPolarHBondContact O-CB 3.48Å; A45-R49 PolarHBondContact O-N 3.41Å; A45-E243 PolarHBondContact N-OE1 3.23Å; A45-E243 PolarHBondContact N-OE2 2.85Å
46	E	93.2	Very high	90.6	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.019	26%	0.261	C	S	.	.	H	α-helix	trans	-68.2	-40.3	176.4	-64.6	-70.9	161.1	0	0	110.9	L44 R49 V50 G232 I233 F234 E243 R272	L44-E46 VanDerWaalsContact C-N 3.34Å; L44-E46 PolarHBondContact O-N 3.47Å; E46-R49 PolarHBondContact O-N 3.32Å; E46-R49 IonicContact OE1-NH1 2.94Å; E46-R49 IonicContact OE2-NH1 2.71Å; E46-V50 VanDerWaalsContact O-CG2 3.31Å; E46-V50 WeakPolarHBondContact O-CG2 3.35Å; E46-V50 PolarHBondContact O-N 2.89Å; E46-V50 VanDerWaalsContact O-N 3.17Å; E46-G232 VanDerWaalsContact OE2-CA 3.28Å; E46-G232 WeakPolarHBondContact OE2-CA 3.42Å; E46-I233 PolarHBondContact OE2-N 3.07Å; E46-F234 HydrophobicContact CB-CE1 4.07Å; E46-F234 HydrophobicContact CB-CE2 4.14Å; E46-F234 HydrophobicContact CB-CZ 3.66Å; E46-E243 WeakPolarHBondContact CA-OE1 3.13Å; E46-E243 HydrophobicContact CB-CG 4.45Å; E46-E243 WeakPolarHBondContact CB-OE1 3.46Å; E46-E243 HydrophobicContact CG-CB 3.91Å; E46-E243 HydrophobicContact CG-CG 4.24Å; E46-E243 PolarHBondContact N-OE1 3.29Å; E46-R272 IonicContact OE1-CZ 2.85Å; E46-R272 IonicContact OE1-NH1 3.36Å; E46-R272 PolarHBondContact OE1-NH1 2.86Å; E46-R272 IonicContact OE1-NH2 3.65Å; E46-R272 PolarHBondContact OE1-NH2 3.14Å; E46-R272 IonicContact OE2-CZ 3.21Å; E46-R272 IonicContact OE2-NH1 2.64Å; E46-R272 PolarHBondContact OE2-NH1 2.9Å; E46-R272 IonicContact OE2-NH2 3.6Å
47	L	95.4	Very high	91.9	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-48.9	172.7	176.7	65.5	0	0	0	111.1	T42 L44 R49 V50 L51 V78 L205 L218 F234	T42-L47 HydrophobicContact CG2-CD2 4.25Å; L44-L47 HydrophobicContact CB-CB 3.68Å; L44-L47 HydrophobicContact CB-CD2 4.47Å; L44-L47 HydrophobicContact CD1-CB 4.42Å; L44-L47 HydrophobicContact CD1-CD2 4.25Å; L44-L47 PolarHBondContact O-N 3.32Å; L47-R49 PolarHBondContact O-N 2.92Å; L47-V50 PolarHBondContact O-N 2.88Å; L47-V50 VanDerWaalsContact O-N 3.14Å; L47-L51 HydrophobicContact CD1-CD1 3.96Å; L47-L51 HydrophobicContact CD1-CG 4.11Å; L47-L51 HydrophobicContact CD2-CD1 4.4Å; L47-L51 HydrophobicContact CG-CD1 3.85Å; L47-L51 HydrophobicContact CG-CG 4.35Å; L47-L51 WeakPolarHBondContact O-CG 3.29Å; L47-L51 PolarHBondContact O-N 3.26Å; L47-V78 HydrophobicContact CD2-CB 4.44Å; L47-V78 HydrophobicContact CD2-CG1 4.36Å; L47-V78 HydrophobicContact CD2-CG2 3.22Å; L47-L205 HydrophobicContact CD1-CD1 4.44Å; L47-L218 HydrophobicContact CD1-CD2 3.63Å; L47-F234 HydrophobicContact CB-CZ 4.44Å
48	N	95.3	Very high	93	Very high	13 Å²	13	38.4 Å²	38.4	7%	0.07	22%	0.217	C	C	.	.	H	α-helix	trans	-55.9	-42.8	178.3	-69.7	-28	0	0	0	110.7	T42 L44 L51 G52 G53 G54	T42-N48 PolarHBondContact N-ND2 3.25Å; T42-N48 PolarHBondContact N-OD1 3.29Å; T42-N48 PolarHBondContact O-ND2 3.39Å; T42-N48 PolarHBondContact OG1-OD1 3.23Å; L44-N48 WeakPolarHBondContact O-CB 3.41Å; L44-N48 PolarHBondContact O-N 3.44Å; L44-N48 PolarHBondContact O-ND2 2.86Å; N48-L51 CarbonylContact O-C 3.56Å; N48-L51 PolarHBondContact O-N 3.46Å; N48-G52 PolarHBondContact O-N 3.25Å; N48-G52 VanDerWaalsContact O-N 3.17Å; N48-G53 WeakPolarHBondContact O-CA 3.47Å; N48-G53 PolarHBondContact O-N 3.32Å; N48-G54 PolarHBondContact O-N 2.99Å
49	R	92.3	Very high	93.6	Very high	103 Å²	103	33.5 Å²	33.5	39%	0.389	19%	0.187	S	C	.	.	H	α-helix	trans	-56.8	-51.2	176	178.8	179.1	-65.1	165.2	3.8	111.6	A45 E46 L47 L51 G52 E230	A45-R49 WeakPolarHBondContact O-CB 3.48Å; A45-R49 PolarHBondContact O-N 3.41Å; E46-R49 PolarHBondContact O-N 3.32Å; E46-R49 IonicContact OE1-NH1 2.94Å; E46-R49 IonicContact OE2-NH1 2.71Å; L47-R49 PolarHBondContact O-N 2.92Å; R49-L51 VanDerWaalsContact C-N 3.29Å; R49-L51 PolarHBondContact O-N 3.48Å; R49-G52 PolarHBondContact O-N 2.91Å; R49-E230 WeakPolarHBondContact CD-OE2 3.14Å; R49-E230 HydrophobicContact CG-CB 4.31Å; R49-E230 HydrophobicContact CG-CG 4.41Å; R49-E230 WeakPolarHBondContact CG-OE2 3.34Å
50	V	92.9	Very high	93.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-34	-178.8	177.5	0	0	0	0	112	E46 L47 G52 L205 L218 A220 N223	E46-V50 VanDerWaalsContact O-CG2 3.31Å; E46-V50 WeakPolarHBondContact O-CG2 3.35Å; E46-V50 PolarHBondContact O-N 2.89Å; E46-V50 VanDerWaalsContact O-N 3.17Å; L47-V50 PolarHBondContact O-N 2.88Å; L47-V50 VanDerWaalsContact O-N 3.14Å; V50-G52 PolarHBondContact O-N 2.98Å; V50-L205 HydrophobicContact CG1-CD1 3.94Å; V50-L205 HydrophobicContact CG1-CD2 3.41Å; V50-L205 VanDerWaalsContact CG1-CD2 3.41Å; V50-L205 HydrophobicContact CG1-CG 4.24Å; V50-L218 HydrophobicContact CB-CD2 4.42Å; V50-L218 HydrophobicContact CG1-CD2 4.36Å; V50-L218 HydrophobicContact CG1-CG 4.29Å; V50-L218 HydrophobicContact CG2-CD2 4.49Å; V50-L218 WeakPolarHBondContact CG2-O 3.43Å; V50-A220 HydrophobicContact CG1-CB 3.99Å; V50-N223 PolarHBondContact O-ND2 3.43Å
51	L	94.7	Very high	94.1	Very high	6 Å²	6	28 Å²	28	3%	0.031	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.8	173.5	-66.8	176.2	0	0	0	113.5	R39 L47 N48 R49 G54 V55 V61 F180 T203 L205	R39-L51 PolarHBondContact NH1-O 2.93Å; L47-L51 HydrophobicContact CD1-CD1 3.96Å; L47-L51 HydrophobicContact CD1-CG 4.11Å; L47-L51 HydrophobicContact CD2-CD1 4.4Å; L47-L51 HydrophobicContact CG-CD1 3.85Å; L47-L51 HydrophobicContact CG-CG 4.35Å; L47-L51 WeakPolarHBondContact O-CG 3.29Å; L47-L51 PolarHBondContact O-N 3.26Å; N48-L51 CarbonylContact O-C 3.56Å; N48-L51 PolarHBondContact O-N 3.46Å; R49-L51 VanDerWaalsContact C-N 3.29Å; R49-L51 PolarHBondContact O-N 3.48Å; L51-G54 WeakPolarHBondContact CB-O 3.24Å; L51-V55 HydrophobicContact CD1-CG2 3.94Å; L51-V61 HydrophobicContact CD2-CG1 4.17Å; L51-V61 HydrophobicContact CD2-CG2 4.39Å; L51-F180 HydrophobicContact CD1-CZ 4.39Å; L51-T203 HydrophobicContact CD2-CG2 4.33Å; L51-L205 HydrophobicContact CD2-CD1 3.91Å
52	G	91	Very high	94.2	Very high	32 Å²	32	21.9 Å²	21.9	33%	0.33	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	19.3	-178.9	0	0	0	0	0	114.1	R39 N48 R49 V50	R39-G52 VanDerWaalsContact NH1-C 3.27Å; R39-G52 PolarHBondContact NH1-O 3.29Å; N48-G52 PolarHBondContact O-N 3.25Å; N48-G52 VanDerWaalsContact O-N 3.17Å; R49-G52 PolarHBondContact O-N 2.91Å; V50-G52 PolarHBondContact O-N 2.98Å
53	G	92.4	Very high	94.4	Very high	24 Å²	24	21.6 Å²	21.6	25%	0.247	13%	0.134	C	C	.	.	S	Bend	trans	130.6	-5.5	172.9	0	0	0	0	0	115.1	Q41 N48	Q41-G53 VanDerWaalsContact CG-O 3.28Å; Q41-G53 WeakPolarHBondContact CG-O 3.37Å; Q41-G53 PolarHBondContact NE2-O 3.25Å; N48-G53 WeakPolarHBondContact O-CA 3.47Å; N48-G53 PolarHBondContact O-N 3.32Å
54	G	94.9	Very high	94.6	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.01	10%	0.101	C	C	.	.	S	Bend	trans	148.4	178.3	-179.6	0	0	0	0	0	112.8	I40 N48 L51	I40-G54 CarbonylContact O-C 3.48Å; I40-G54 VanDerWaalsContact O-CA 3.31Å; I40-G54 WeakPolarHBondContact O-CA 3.33Å; N48-G54 PolarHBondContact O-N 2.99Å; L51-G54 WeakPolarHBondContact CB-O 3.24Å
55	V	95.9	Very high	94.5	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.012	10%	0.1	C	C	.	.	B	Isolated β-bridge	trans	-73.5	133.8	177.7	-172	0	0	0	0	110.1	R39 I40 T42 L51 L82 Y137 A178 F180	R39-V55 WeakPolarHBondContact CA-O 3.41Å; I40-V55 PolarHBondContact N-O 3.03Å; I40-V55 PolarHBondContact O-N 2.92Å; T42-V55 HydrophobicContact CG2-CG2 4.12Å; L51-V55 HydrophobicContact CD1-CG2 3.94Å; V55-L82 HydrophobicContact CG2-CD2 4.1Å; V55-Y137 HydrophobicContact CG1-CD1 4.33Å; V55-Y137 HydrophobicContact CG1-CE1 4.14Å; V55-A178 HydrophobicContact CG1-CB 3.51Å; V55-F180 HydrophobicContact CG1-CE2 3.89Å; V55-F180 HydrophobicContact CG1-CZ 4.01Å; V55-F180 HydrophobicContact CG2-CE2 4.27Å; V55-F180 HydrophobicContact CG2-CZ 3.87Å
56	V	94.9	Very high	94.1	Very high	10 Å²	10	17.1 Å²	17.1	6%	0.061	10%	0.103	C	C	.	.			trans	-104.3	123	-178.8	-179.9	0	0	0	0	109.6	R39 S59 A178 F225	R39-V56 HydrophobicContact CG-CG2 4.18Å; V56-S59 WeakPolarHBondContact O-CB 3.24Å; V56-S59 PolarHBondContact O-N 3.49Å; V56-S59 PolarHBondContact O-OG 3.23Å; V56-A178 WeakPolarHBondContact O-CB 3.18Å; V56-F225 HydrophobicContact CB-CD2 4.4Å; V56-F225 HydrophobicContact CB-CE2 4.46Å; V56-F225 HydrophobicContact CB-CG 4.46Å; V56-F225 HydrophobicContact CG1-CD1 4.21Å; V56-F225 HydrophobicContact CG1-CE1 4.04Å; V56-F225 HydrophobicContact CG1-CZ 4.22Å; V56-F225 HydrophobicContact CG2-CB 4.09Å; V56-F225 HydrophobicContact CG2-CD1 4.28Å; V56-F225 HydrophobicContact CG2-CD2 4.2Å; V56-F225 HydrophobicContact CG2-CG 3.94Å
57	P	94	Very high	93.7	Very high	52 Å²	52	21.3 Å²	21.3	34%	0.338	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	141.4	173.3	-27.1	37	0	0	0	112.3	T38 I40 S59 G176	T38-P57 WeakPolarHBondContact O-CD 3.48Å; I40-P57 HydrophobicContact CD1-CG 3.51Å; P57-S59 PolarHBondContact O-N 3.34Å; P57-G176 WeakPolarHBondContact CB-O 3.4Å
58	G	94.2	Very high	93.3	Very high	7 Å²	7	25.1 Å²	25.1	7%	0.072	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	15.4	-176.5	0	0	0	0	0	114.6	A172 K173 G176 I177	G58-A172 VanDerWaalsContact CA-O 3.28Å; G58-A172 WeakPolarHBondContact CA-O 2.98Å; G58-K173 VanDerWaalsContact O-CD 3.28Å; G58-K173 WeakPolarHBondContact O-CD 3.29Å; G58-K173 VanDerWaalsContact O-CE 3.25Å; G58-K173 WeakPolarHBondContact O-CE 3.49Å; G58-K173 PolarHBondContact O-NZ 3.18Å; G58-G176 VanDerWaalsContact N-C 3.26Å; G58-G176 PolarHBondContact N-O 2.97Å; G58-I177 WeakPolarHBondContact CA-O 3.46Å; G58-I177 PolarHBondContact N-O 3.38Å; G58-I177 VanDerWaalsContact N-O 3.17Å
59	S	96	Very high	92.9	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	17%	0.17	C	C	.	.			trans	-94	152.7	174.3	69.4	0	0	0	0	112.3	V56 P57 I179	V56-S59 WeakPolarHBondContact O-CB 3.24Å; V56-S59 PolarHBondContact O-N 3.49Å; V56-S59 PolarHBondContact O-OG 3.23Å; P57-S59 PolarHBondContact O-N 3.34Å; S59-I179 PolarHBondContact O-N 3.45Å
60	L	98	Very high	92.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.8	168.5	-175.7	63.7	0	0	0	109.7	T165 L168 L169 I179 I181 V201 D202 T203	L60-T165 HydrophobicContact CD2-CG2 3.91Å; L60-L168 HydrophobicContact CD1-CB 4.35Å; L60-L169 HydrophobicContact CB-CD1 3.79Å; L60-L169 HydrophobicContact CD2-CB 3.74Å; L60-L169 HydrophobicContact CD2-CD1 4.08Å; L60-L169 HydrophobicContact CD2-CG 4.47Å; L60-I179 WeakPolarHBondContact CA-O 3.13Å; L60-I179 HydrophobicContact CD1-CB 3.69Å; L60-I179 HydrophobicContact CD1-CG2 3.64Å; L60-I181 HydrophobicContact CD1-CD1 4.4Å; L60-I181 HydrophobicContact CD1-CG2 3.83Å; L60-V201 HydrophobicContact CD2-CB 4.32Å; L60-V201 HydrophobicContact CD2-CG1 3.73Å; L60-V201 HydrophobicContact CG-CB 4.21Å; L60-V201 HydrophobicContact CG-CG1 3.92Å; L60-D202 PolarHBondContact N-OD2 2.82Å; L60-D202 PolarHBondContact O-N 2.82Å; L60-T203 PolarHBondContact O-N 2.79Å
61	V	97.8	Very high	92.9	Very high	2 Å²	2	21 Å²	21	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120	-177.3	-174.6	0	0	0	0	109.8	L51 I179 F180 I181 T203 L205	L51-V61 HydrophobicContact CD2-CG1 4.17Å; L51-V61 HydrophobicContact CD2-CG2 4.39Å; V61-I179 PolarHBondContact N-O 3.06Å; V61-F180 HydrophobicContact CB-CD1 3.7Å; V61-F180 HydrophobicContact CB-CE1 3.88Å; V61-F180 HydrophobicContact CB-CG 4.39Å; V61-F180 HydrophobicContact CG1-CD1 3.83Å; V61-F180 HydrophobicContact CG1-CE1 3.85Å; V61-F180 HydrophobicContact CG2-CD1 4.34Å; V61-F180 HydrophobicContact CG2-CE1 4.08Å; V61-F180 HydrophobicContact CG2-CZ 4.48Å; V61-F180 CarbonylContact O-C 3.51Å; V61-F180 WeakPolarHBondContact O-CA 3.39Å; V61-I181 PolarHBondContact O-N 2.9Å; V61-T203 WeakPolarHBondContact CA-O 3.35Å; V61-T203 HydrophobicContact CG1-CG2 4.15Å; V61-L205 HydrophobicContact CG1-CD1 4.24Å; V61-L205 HydrophobicContact CG1-CG 4.25Å
62	L	97.1	Very high	92.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.1	172.3	172.8	63.1	0	0	0	110.2	I181 P194 L197 V201 T203 V204 L205	L62-I181 WeakPolarHBondContact CA-O 3.29Å; L62-I181 HydrophobicContact CB-CD1 4.37Å; L62-I181 HydrophobicContact CB-CG1 4.06Å; L62-I181 HydrophobicContact CD1-CD1 4.03Å; L62-I181 HydrophobicContact CD1-CG1 3.75Å; L62-P194 HydrophobicContact CD2-CB 3.97Å; L62-P194 HydrophobicContact CG-CB 4.5Å; L62-L197 HydrophobicContact CD2-CB 3.92Å; L62-V201 HydrophobicContact CB-CB 4.43Å; L62-V201 HydrophobicContact CB-CG1 4.16Å; L62-V201 HydrophobicContact CB-CG2 3.91Å; L62-T203 PolarHBondContact N-O 2.93Å; L62-V204 HydrophobicContact CD2-CG1 4.32Å; L62-V204 HydrophobicContact CD2-CG2 4.46Å; L62-L205 PolarHBondContact O-N 2.84Å
63	I	96.6	Very high	93	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	103.3	168	-53.7	-174	0	0	0	108.7	K71 L74 L75 F180 I181 G183 L205 F207	I63-K71 HydrophobicContact CG2-CB 4.44Å; I63-K71 HydrophobicContact CG2-CD 4.22Å; I63-K71 HydrophobicContact CG2-CG 4.08Å; I63-L74 HydrophobicContact CD1-CD2 4.21Å; I63-L75 HydrophobicContact CD1-CD1 4.43Å; I63-L75 HydrophobicContact CD1-CD2 3.7Å; I63-L75 HydrophobicContact CD1-CG 4.05Å; I63-F180 HydrophobicContact CD1-CD1 4.17Å; I63-I181 PolarHBondContact N-O 2.73Å; I63-G183 PolarHBondContact O-N 2.8Å; I63-L205 CarbonylContact C-O 3.47Å; I63-L205 WeakPolarHBondContact CA-O 3.26Å; I63-F207 HydrophobicContact CG2-CB 4.4Å
64	G	94	Very high	93.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	156.5	173.6	0	0	0	0	0	112.3	G183 L205 Y206 F207	G64-G183 WeakPolarHBondContact CA-O 3.37Å; G64-L205 PolarHBondContact N-O 3.06Å; G64-Y206 CarbonylContact O-C 3.52Å; G64-Y206 WeakPolarHBondContact O-CA 3.31Å; G64-F207 PolarHBondContact O-N 3.28Å
65	G	90.1	Very high	93.1	Very high	3 Å²	3	19.6 Å²	19.6	3%	0.031	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.3	166.4	169.7	0	0	0	0	0	113.7	K71 G183 V185	G65-K71 PolarHBondContact O-NZ 3.13Å; G65-G183 PolarHBondContact N-O 2.63Å; G65-V185 PolarHBondContact O-N 3.22Å
66	D	85.7	Confident	93	Very high	96 Å²	96	19.7 Å²	19.7	51%	0.513	14%	0.139	S	C	.	.			trans	-60.4	149.6	-177.8	-74.3	-17.4	0	0	0	112.2	G68 I69 K71	D66-G68 PolarHBondContact O-N 2.92Å; D66-I69 WeakPolarHBondContact O-CB 3.46Å; D66-I69 WeakPolarHBondContact O-CG2 3.39Å; D66-I69 PolarHBondContact O-N 2.78Å; D66-K71 PolarHBondContact O-NZ 3.15Å
67	P	85.4	Confident	93	Very high	92 Å²	92	20.3 Å²	20.3	60%	0.597	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	137.6	171.6	-26.1	35.4	0	0	0	111.9	I69	P67-I69 VanDerWaalsContact C-N 3.28Å; P67-I69 PolarHBondContact O-N 3.47Å
68	G	86.3	Confident	93	Very high	82 Å²	82	17.9 Å²	17.9	85%	0.845	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.9	0.8	178.6	0	0	0	0	0	116.2	D66 G70	D66-G68 PolarHBondContact O-N 2.92Å; G68-G70 PolarHBondContact O-N 3.44Å
69	I	86.9	Confident	93.1	Very high	14 Å²	14	17.6 Å²	17.6	7%	0.072	12%	0.122	C	C	.	.	S	Bend	trans	-69.3	-19.6	-178.5	-162.8	62.3	0	0	0	114	D66 P67 K71 F207 G209 R216	D66-I69 WeakPolarHBondContact O-CB 3.46Å; D66-I69 WeakPolarHBondContact O-CG2 3.39Å; D66-I69 PolarHBondContact O-N 2.78Å; P67-I69 VanDerWaalsContact C-N 3.28Å; P67-I69 PolarHBondContact O-N 3.47Å; I69-K71 HydrophobicContact CG2-CD 4.35Å; I69-K71 HydrophobicContact CG2-CG 3.73Å; I69-F207 HydrophobicContact CG1-CD1 4.45Å; I69-F207 HydrophobicContact CG2-CB 4.3Å; I69-F207 HydrophobicContact CG2-CD1 3.87Å; I69-F207 HydrophobicContact CG2-CG 4.41Å; I69-G209 WeakPolarHBondContact CD1-O 3.23Å; I69-R216 WeakPolarHBondContact O-CD 3.48Å; I69-R216 PolarHBondContact O-NE 2.93Å
70	G	91.8	Very high	92.9	Very high	8 Å²	8	20.2 Å²	20.2	8%	0.082	13%	0.134	C	C	.	.	S	Bend	trans	118.6	13.4	178.1	0	0	0	0	0	115.8	G68 S72 T73 L74	G68-G70 PolarHBondContact O-N 3.44Å; G70-S72 PolarHBondContact O-N 2.53Å; G70-T73 WeakPolarHBondContact O-CB 3.3Å; G70-T73 PolarHBondContact O-N 3.41Å; G70-L74 PolarHBondContact O-N 3.1Å
71	K	93.2	Very high	92.6	Very high	6 Å²	6	21.5 Å²	21.5	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-56.1	-52.1	-178.4	-60.8	-177.6	-58.2	-69.6	0	113.3	I63 G65 D66 I69 T73 L74 L75 V182 H184 F207	I63-K71 HydrophobicContact CG2-CB 4.44Å; I63-K71 HydrophobicContact CG2-CD 4.22Å; I63-K71 HydrophobicContact CG2-CG 4.08Å; G65-K71 PolarHBondContact O-NZ 3.13Å; D66-K71 PolarHBondContact O-NZ 3.15Å; I69-K71 HydrophobicContact CG2-CD 4.35Å; I69-K71 HydrophobicContact CG2-CG 3.73Å; K71-T73 VanDerWaalsContact C-N 3.27Å; K71-T73 PolarHBondContact O-N 3.37Å; K71-L74 WeakPolarHBondContact O-CB 3.46Å; K71-L74 PolarHBondContact O-N 2.78Å; K71-L75 PolarHBondContact O-N 3.32Å; K71-V182 HydrophobicContact CB-CG1 4.32Å; K71-V182 HydrophobicContact CD-CG1 3.93Å; K71-H184 VanDerWaalsContact CE-CD2 3.42Å; K71-H184 WeakPolarHBondContact CE-CD2 3.47Å; K71-H184 PolarHBondContact NZ-CD2 3.44Å; K71-H184 PolarHBondContact NZ-NE2 3.27Å; K71-F207 HydrophobicContact CG-CB 4.29Å; K71-F207 HydrophobicContact CG-CD1 4.22Å
72	S	93.5	Very high	92.4	Very high	19 Å²	19	21.4 Å²	21.4	13%	0.133	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-34.9	177.5	-43.8	0	0	0	0	111.9	G70 L75 L76 D141	G70-S72 PolarHBondContact O-N 2.53Å; S72-L75 PolarHBondContact O-N 3.38Å; S72-L76 WeakPolarHBondContact O-CB 3.42Å; S72-L76 VanDerWaalsContact O-CG 3.27Å; S72-L76 WeakPolarHBondContact O-CG 3.31Å; S72-L76 PolarHBondContact O-N 2.9Å; S72-D141 WeakPolarHBondContact CB-OD2 3.18Å; S72-D141 PolarHBondContact OG-OD1 3.41Å; S72-D141 PolarHBondContact OG-OD2 3.19Å
73	T	93.9	Very high	92.2	Very high	16 Å²	16	22.2 Å²	22.2	10%	0.098	15%	0.146	C	C	.	.	H	α-helix	trans	-63.1	-46.4	174.6	-59.6	0	0	0	0	111.1	G70 K71 L75 L76 Q77 R104 L108 M236 L241	G70-T73 WeakPolarHBondContact O-CB 3.3Å; G70-T73 PolarHBondContact O-N 3.41Å; K71-T73 VanDerWaalsContact C-N 3.27Å; K71-T73 PolarHBondContact O-N 3.37Å; T73-L75 VanDerWaalsContact C-N 3.34Å; T73-L75 PolarHBondContact O-N 2.96Å; T73-L76 PolarHBondContact O-N 2.8Å; T73-Q77 PolarHBondContact O-N 3.2Å; T73-Q77 VanDerWaalsContact O-N 3.09Å; T73-R104 PolarHBondContact OG1-NH2 2.93Å; T73-L108 HydrophobicContact CG2-CD1 4.25Å; T73-L108 HydrophobicContact CG2-CD2 3.85Å; T73-M236 HydrophobicContact CG2-CE 4.31Å; T73-M236 HydrophobicContact CG2-SD 4.43Å; T73-L241 HydrophobicContact CG2-CD1 4.37Å; T73-L241 HydrophobicContact CG2-CG 4.22Å
74	L	95.2	Very high	91.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57	-48.9	174.3	178.6	62.8	0	0	0	110.6	L44 I63 G70 K71 L76 Q77 V78 L218 F234 L241	L44-L74 HydrophobicContact CD1-CD1 3.92Å; I63-L74 HydrophobicContact CD1-CD2 4.21Å; G70-L74 PolarHBondContact O-N 3.1Å; K71-L74 WeakPolarHBondContact O-CB 3.46Å; K71-L74 PolarHBondContact O-N 2.78Å; L74-L76 PolarHBondContact O-N 3.47Å; L74-Q77 PolarHBondContact O-N 3.48Å; L74-V78 HydrophobicContact CD1-CG2 4.26Å; L74-V78 HydrophobicContact CG-CG2 4.42Å; L74-V78 VanDerWaalsContact O-CG2 3.24Å; L74-V78 WeakPolarHBondContact O-CG2 3.43Å; L74-V78 PolarHBondContact O-N 2.89Å; L74-L218 HydrophobicContact CD2-CD1 4.21Å; L74-L218 HydrophobicContact CD2-CD2 4.16Å; L74-F234 HydrophobicContact CD1-CZ 4.49Å; L74-L241 HydrophobicContact CB-CD1 3.62Å; L74-L241 HydrophobicContact CD1-CD1 4.27Å; L74-L241 HydrophobicContact CG-CD1 4.5Å
75	L	95.3	Very high	91.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-33.9	-177.3	-74.8	170.6	0	0	0	113.5	I63 K71 S72 T73 V78 S79 Y91 I139 F180 V182	I63-L75 HydrophobicContact CD1-CD1 4.43Å; I63-L75 HydrophobicContact CD1-CD2 3.7Å; I63-L75 HydrophobicContact CD1-CG 4.05Å; K71-L75 PolarHBondContact O-N 3.32Å; S72-L75 PolarHBondContact O-N 3.38Å; T73-L75 VanDerWaalsContact C-N 3.34Å; T73-L75 PolarHBondContact O-N 2.96Å; L75-V78 PolarHBondContact O-N 3.47Å; L75-S79 VanDerWaalsContact O-CB 3.27Å; L75-S79 WeakPolarHBondContact O-CB 3.37Å; L75-S79 PolarHBondContact O-N 3.14Å; L75-S79 PolarHBondContact O-OG 3.19Å; L75-Y91 HydrophobicContact CB-CE2 4.08Å; L75-I139 HydrophobicContact CB-CG2 4.16Å; L75-I139 HydrophobicContact CD1-CG2 3.89Å; L75-I139 HydrophobicContact CD2-CG1 4.33Å; L75-I139 HydrophobicContact CD2-CG2 4.32Å; L75-I139 HydrophobicContact CG-CG2 4.36Å; L75-F180 HydrophobicContact CD2-CB 3.72Å; L75-F180 HydrophobicContact CD2-CD1 4.07Å; L75-F180 HydrophobicContact CD2-CG 3.97Å; L75-V182 HydrophobicContact CD1-CG2 3.08Å
76	L	94.2	Very high	91.4	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-45.1	172.2	-73.9	171.4	0	0	0	111.4	S72 T73 L74 V78 S79 H80 Y91 I101 R104 L108 F115	S72-L76 WeakPolarHBondContact O-CB 3.42Å; S72-L76 VanDerWaalsContact O-CG 3.27Å; S72-L76 WeakPolarHBondContact O-CG 3.31Å; S72-L76 PolarHBondContact O-N 2.9Å; T73-L76 PolarHBondContact O-N 2.8Å; L74-L76 PolarHBondContact O-N 3.47Å; L76-V78 VanDerWaalsContact C-N 3.34Å; L76-V78 PolarHBondContact O-N 3Å; L76-S79 PolarHBondContact O-N 3.42Å; L76-H80 PolarHBondContact O-N 3.15Å; L76-Y91 HydrophobicContact CD2-CD2 3.98Å; L76-Y91 HydrophobicContact CD2-CE2 3.58Å; L76-Y91 HydrophobicContact CG-CE2 3.99Å; L76-I101 HydrophobicContact CD1-CG2 4.43Å; L76-I101 HydrophobicContact CD2-CG2 3.6Å; L76-R104 HydrophobicContact CD1-CB 3.99Å; L76-L108 HydrophobicContact CB-CD1 3.96Å; L76-L108 HydrophobicContact CD1-CD1 4.34Å; L76-F115 HydrophobicContact CD2-CZ 3.98Å
77	Q	94.1	Very high	91.6	Very high	23 Å²	23	28.1 Å²	28.1	11%	0.107	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-41.8	175.4	-71.6	177.8	-114.2	0	0	111.9	T73 L74 H80 Q81 L108 L241	T73-Q77 PolarHBondContact O-N 3.2Å; T73-Q77 VanDerWaalsContact O-N 3.09Å; L74-Q77 PolarHBondContact O-N 3.48Å; Q77-H80 PolarHBondContact O-N 3.29Å; Q77-Q81 WeakPolarHBondContact O-CG 3.46Å; Q77-Q81 PolarHBondContact O-N 3Å; Q77-L108 HydrophobicContact CG-CD1 4.21Å; Q77-L241 PolarHBondContact NE2-O 3.39Å
78	V	94.4	Very high	92.1	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-63.8	-43.5	175.8	170.5	0	0	0	0	111.2	T42 L44 L47 L74 L75 L76 H80 Q81 L82	T42-V78 HydrophobicContact CG2-CG1 4.45Å; L44-V78 HydrophobicContact CD1-CG2 3.99Å; L47-V78 HydrophobicContact CD2-CB 4.44Å; L47-V78 HydrophobicContact CD2-CG1 4.36Å; L47-V78 HydrophobicContact CD2-CG2 3.22Å; L74-V78 HydrophobicContact CD1-CG2 4.26Å; L74-V78 HydrophobicContact CG-CG2 4.42Å; L74-V78 VanDerWaalsContact O-CG2 3.24Å; L74-V78 WeakPolarHBondContact O-CG2 3.43Å; L74-V78 PolarHBondContact O-N 2.89Å; L75-V78 PolarHBondContact O-N 3.47Å; L76-V78 VanDerWaalsContact C-N 3.34Å; L76-V78 PolarHBondContact O-N 3Å; V78-H80 VanDerWaalsContact C-N 3.33Å; V78-H80 PolarHBondContact O-N 3.41Å; V78-Q81 PolarHBondContact O-N 2.85Å; V78-L82 HydrophobicContact CG1-CD1 3.58Å; V78-L82 HydrophobicContact CG1-CG 4.12Å; V78-L82 WeakPolarHBondContact O-CB 3.27Å; V78-L82 VanDerWaalsContact O-CG 3.28Å; V78-L82 WeakPolarHBondContact O-CG 3.42Å; V78-L82 PolarHBondContact O-N 3.1Å
79	S	94.9	Very high	92.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-43.2	178.7	-60.4	0	0	0	0	111.3	L75 L76 A83 Y91 I139	L75-S79 VanDerWaalsContact O-CB 3.27Å; L75-S79 WeakPolarHBondContact O-CB 3.37Å; L75-S79 PolarHBondContact O-N 3.14Å; L75-S79 PolarHBondContact O-OG 3.19Å; L76-S79 PolarHBondContact O-N 3.42Å; S79-A83 WeakPolarHBondContact O-CB 3.5Å; S79-A83 PolarHBondContact O-N 3.32Å; S79-Y91 WeakPolarHBondContact OG-CD2 3.36Å; S79-I139 WeakPolarHBondContact OG-CD1 3.44Å; S79-I139 WeakPolarHBondContact OG-CG1 3.24Å
80	H	92.6	Very high	93.1	Very high	58 Å²	58	22.8 Å²	22.8	27%	0.269	16%	0.155	S	C	.	.	H	α-helix	trans	-58.5	-48.9	173.8	174.6	37	0	0	0	112.2	L76 Q77 V78 A83 A84 S110 T113	L76-H80 PolarHBondContact O-N 3.15Å; Q77-H80 PolarHBondContact O-N 3.29Å; V78-H80 VanDerWaalsContact C-N 3.33Å; V78-H80 PolarHBondContact O-N 3.41Å; H80-A83 PolarHBondContact O-N 2.96Å; H80-A84 WeakPolarHBondContact O-CB 3.45Å; H80-A84 PolarHBondContact O-N 3.37Å; H80-S110 PolarHBondContact CD2-OG 2.89Å; H80-T113 HydrophobicContact CB-CG2 3.43Å; H80-T113 VanDerWaalsContact CB-CG2 3.43Å; H80-T113 WeakPolarHBondContact ND1-CG2 3.33Å
81	Q	91.7	Very high	93.4	Very high	27 Å²	27	22.4 Å²	22.4	13%	0.126	15%	0.151	C	C	.	.	H	α-helix	trans	-67.8	-39.7	-177.5	-70.2	174.7	12.6	0	0	112.1	D43 Q77 V78 A83 A84 T85	D43-Q81 HydrophobicContact CB-CG 4.29Å; Q77-Q81 WeakPolarHBondContact O-CG 3.46Å; Q77-Q81 PolarHBondContact O-N 3Å; V78-Q81 PolarHBondContact O-N 2.85Å; Q81-A83 VanDerWaalsContact C-N 3.35Å; Q81-A84 WeakPolarHBondContact O-CB 3.37Å; Q81-A84 PolarHBondContact O-N 3.29Å; Q81-T85 WeakPolarHBondContact O-CG2 3.47Å; Q81-T85 PolarHBondContact O-N 2.8Å; Q81-T85 VanDerWaalsContact O-N 3.11Å
82	L	93.3	Very high	93.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.7	-39.1	175.6	-68.2	172.5	0	0	0	111.4	I40 T42 V55 V78 A84 T85 G87 V89 Y137 F180	I40-L82 HydrophobicContact CG2-CD2 4.16Å; T42-L82 HydrophobicContact CG2-CD2 3.9Å; T42-L82 HydrophobicContact CG2-CG 4.26Å; V55-L82 HydrophobicContact CG2-CD2 4.1Å; V78-L82 HydrophobicContact CG1-CD1 3.58Å; V78-L82 HydrophobicContact CG1-CG 4.12Å; V78-L82 WeakPolarHBondContact O-CB 3.27Å; V78-L82 VanDerWaalsContact O-CG 3.28Å; V78-L82 WeakPolarHBondContact O-CG 3.42Å; V78-L82 PolarHBondContact O-N 3.1Å; L82-A84 VanDerWaalsContact C-N 3.33Å; L82-A84 PolarHBondContact O-N 2.93Å; L82-T85 PolarHBondContact O-N 2.97Å; L82-T85 PolarHBondContact O-OG1 3.2Å; L82-G87 PolarHBondContact O-N 2.96Å; L82-V89 HydrophobicContact CB-CG2 3.75Å; L82-Y137 HydrophobicContact CB-CD2 3.88Å; L82-Y137 HydrophobicContact CB-CE2 3.94Å; L82-Y137 HydrophobicContact CB-CG 4.27Å; L82-Y137 HydrophobicContact CD1-CD1 3.75Å; L82-Y137 HydrophobicContact CD1-CD2 4.32Å; L82-Y137 HydrophobicContact CD1-CE1 4.18Å; L82-Y137 HydrophobicContact CD1-CG 3.85Å; L82-Y137 HydrophobicContact CD2-CD1 4.32Å; L82-Y137 HydrophobicContact CD2-CE1 3.89Å; L82-Y137 HydrophobicContact CD2-CE2 4.23Å; L82-Y137 HydrophobicContact CG-CD1 4.48Å; L82-Y137 HydrophobicContact CG-CE2 4.49Å; L82-F180 HydrophobicContact CD1-CE2 4.37Å
83	A	92.7	Very high	93.7	Very high	16 Å²	16	21.4 Å²	21.4	13%	0.132	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-41.1	172	0	0	0	0	0	111.8	S79 H80 Q81 T85 G86 G87 V89 F115	S79-A83 WeakPolarHBondContact O-CB 3.5Å; S79-A83 PolarHBondContact O-N 3.32Å; H80-A83 PolarHBondContact O-N 2.96Å; Q81-A83 VanDerWaalsContact C-N 3.35Å; A83-T85 PolarHBondContact O-N 2.67Å; A83-G86 WeakPolarHBondContact O-CA 3.18Å; A83-G86 PolarHBondContact O-N 3.03Å; A83-G87 WeakPolarHBondContact CA-O 3.35Å; A83-V89 HydrophobicContact CB-CG2 4.1Å; A83-F115 HydrophobicContact CB-CB 4.22Å
84	A	89.1	Confident	93.5	Very high	73 Å²	73	21.6 Å²	21.6	60%	0.603	15%	0.15	S	C	*	.	H	α-helix	trans	-64.2	-22.2	176.6	0	0	0	0	0	113.6	H80 Q81 L82 G86	H80-A84 WeakPolarHBondContact O-CB 3.45Å; H80-A84 PolarHBondContact O-N 3.37Å; Q81-A84 WeakPolarHBondContact O-CB 3.37Å; Q81-A84 PolarHBondContact O-N 3.29Å; L82-A84 VanDerWaalsContact C-N 3.33Å; L82-A84 PolarHBondContact O-N 2.93Å; A84-G86 PolarHBondContact O-N 2.88Å
85	T	87	Confident	93	Very high	76 Å²	76	26.6 Å²	26.6	47%	0.466	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-2.4	170	69	0	0	0	0	113.6	I40 Q81 L82 A83	I40-T85 HydrophobicContact CG2-CG2 4.38Å; Q81-T85 WeakPolarHBondContact O-CG2 3.47Å; Q81-T85 PolarHBondContact O-N 2.8Å; Q81-T85 VanDerWaalsContact O-N 3.11Å; L82-T85 PolarHBondContact O-N 2.97Å; L82-T85 PolarHBondContact O-OG1 3.2Å; A83-T85 PolarHBondContact O-N 2.67Å
86	G	87.4	Confident	92.6	Very high	66 Å²	66	28.9 Å²	28.9	68%	0.68	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.2	9.5	-176.7	0	0	0	0	0	114.2	A83 A84	A83-G86 WeakPolarHBondContact O-CA 3.18Å; A83-G86 PolarHBondContact O-N 3.03Å; A84-G86 PolarHBondContact O-N 2.88Å
87	G	90.6	Very high	92.5	Very high	10 Å²	10	31 Å²	31	10%	0.103	20%	0.2	C	C	.	.			trans	-91	146.4	177.7	0	0	0	0	0	112.8	L82 A83 V89 D136	L82-G87 PolarHBondContact O-N 2.96Å; A83-G87 WeakPolarHBondContact CA-O 3.35Å; G87-V89 PolarHBondContact O-N 2.82Å; G87-D136 WeakPolarHBondContact CA-OD2 3.46Å
88	N	95.2	Very high	92.3	Very high	74 Å²	74	32 Å²	32	40%	0.396	21%	0.212	S	C	.	.			trans	-79.7	115.4	-179.6	-71.3	-27	0	0	0	110.2	P135 D136 Y137	N88-P135 CarbonylContact O-C 3.57Å; N88-P135 WeakPolarHBondContact O-CB 3.49Å; N88-D136 PolarHBondContact N-OD2 3.34Å; N88-D136 PolarHBondContact O-N 2.8Å; N88-Y137 PolarHBondContact O-N 2.97Å; N88-Y137 VanDerWaalsContact O-N 3.12Å
89	V	97.3	Very high	92.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.2	-179.4	-179.1	0	0	0	0	110.1	L82 A83 G87 F115 Y116 Y137 I139	L82-V89 HydrophobicContact CB-CG2 3.75Å; A83-V89 HydrophobicContact CB-CG2 4.1Å; G87-V89 PolarHBondContact O-N 2.82Å; V89-F115 HydrophobicContact CB-CB 3.74Å; V89-F115 HydrophobicContact CG1-CB 4.15Å; V89-Y116 WeakPolarHBondContact O-CD2 3.25Å; V89-Y116 PolarHBondContact O-N 3.03Å; V89-Y137 WeakPolarHBondContact CA-O 3.4Å; V89-Y137 HydrophobicContact CG2-CD2 3.67Å; V89-Y137 HydrophobicContact CG2-CG 4.23Å; V89-I139 HydrophobicContact CG1-CD1 3.5Å; V89-I139 VanDerWaalsContact CG1-CD1 3.5Å
90	L	98	Very high	92.1	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	109.9	169.7	177.4	64.7	0	0	0	109.9	V92 T129 I130 L133 P135 Y137 V138 I139	L90-V92 HydrophobicContact CD2-CG2 4.14Å; L90-V92 HydrophobicContact CG-CG2 3.94Å; L90-T129 HydrophobicContact CD2-CG2 4.11Å; L90-I130 HydrophobicContact CD2-CG1 3.82Å; L90-L133 HydrophobicContact CB-CD2 4.17Å; L90-L133 HydrophobicContact CD1-CD2 4.08Å; L90-L133 HydrophobicContact CD2-CD2 4.38Å; L90-L133 HydrophobicContact CG-CD2 4.44Å; L90-P135 HydrophobicContact CB-CB 4.02Å; L90-P135 HydrophobicContact CB-CG 4.09Å; L90-P135 HydrophobicContact CD2-CG 4.45Å; L90-Y137 PolarHBondContact N-O 3.08Å; L90-V138 HydrophobicContact CB-CG2 4.35Å; L90-V138 CarbonylContact O-C 3.57Å; L90-V138 WeakPolarHBondContact O-CA 3.42Å; L90-I139 PolarHBondContact O-N 2.94Å
91	Y	97.4	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	110.4	173.3	-161.9	-68.5	0	0	0	110	L75 L76 S79 I101 F115 Y116 L117 Y118 I139 D141	L75-Y91 HydrophobicContact CB-CE2 4.08Å; L76-Y91 HydrophobicContact CD2-CD2 3.98Å; L76-Y91 HydrophobicContact CD2-CE2 3.58Å; L76-Y91 HydrophobicContact CG-CE2 3.99Å; S79-Y91 WeakPolarHBondContact OG-CD2 3.36Å; Y91-I101 HydrophobicContact CE1-CD1 4.35Å; Y91-F115 HydrophobicContact CD2-CE2 4.35Å; Y91-F115 HydrophobicContact CG-CE2 4.21Å; Y91-Y116 PolarHBondContact N-O 3.42Å; Y91-L117 HydrophobicContact CD1-CD1 3.87Å; Y91-L117 HydrophobicContact CG-CD1 4.25Å; Y91-Y118 PolarHBondContact O-N 3.25Å; Y91-I139 HydrophobicContact CD2-CB 3.85Å; Y91-I139 HydrophobicContact CD2-CG1 4.15Å; Y91-I139 HydrophobicContact CD2-CG2 3.85Å; Y91-I139 HydrophobicContact CE1-CG2 4.3Å; Y91-I139 HydrophobicContact CE2-CB 4.15Å; Y91-I139 HydrophobicContact CE2-CG1 4.44Å; Y91-I139 HydrophobicContact CE2-CG2 3.61Å; Y91-I139 HydrophobicContact CG-CB 4.19Å; Y91-I139 HydrophobicContact CG-CG2 4.29Å; Y91-D141 HydrophobicContact CE1-CB 3.87Å; Y91-D141 PolarHBondContact OH-OD2 3.38Å
92	V	98	Very high	91.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.3	175.7	-172.1	0	0	0	0	109.5	L90 Y118 I126 I139 I140 D141	L90-V92 HydrophobicContact CD2-CG2 4.14Å; L90-V92 HydrophobicContact CG-CG2 3.94Å; V92-Y118 CarbonylContact C-O 3.6Å; V92-Y118 VanDerWaalsContact CA-O 3.25Å; V92-Y118 WeakPolarHBondContact CA-O 3.38Å; V92-I126 HydrophobicContact CG1-CD1 3.72Å; V92-I126 HydrophobicContact CG1-CG1 3.96Å; V92-I126 HydrophobicContact CG2-CG2 4.25Å; V92-I139 WeakPolarHBondContact CA-O 3.39Å; V92-I139 WeakPolarHBondContact CB-O 3.25Å; V92-I139 PolarHBondContact N-O 3.28Å; V92-I140 HydrophobicContact CB-CD1 3.8Å; V92-I140 HydrophobicContact CG1-CD1 4.38Å; V92-I140 HydrophobicContact CG2-CD1 3.89Å; V92-D141 PolarHBondContact O-N 2.71Å
93	S	95.3	Very high	91.8	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.6	173.1	-169.1	0	0	0	0	111.6	E95 E96 Y118 A119 E120 D141	S93-E95 PolarHBondContact OG-N 3.42Å; S93-E96 PolarHBondContact OG-N 2.85Å; S93-E96 PolarHBondContact OG-O 2.98Å; S93-Y118 PolarHBondContact N-O 3.04Å; S93-A119 WeakPolarHBondContact O-CA 3.37Å; S93-E120 PolarHBondContact O-N 2.55Å; S93-E120 VanDerWaalsContact O-N 3.13Å; S93-D141 VanDerWaalsContact CA-O 3.32Å; S93-D141 WeakPolarHBondContact CA-O 3.34Å; S93-D141 PolarHBondContact OG-O 3.39Å
94	G	89.9	Confident	91.6	Very high	21 Å²	21	52.7 Å²	52.7	22%	0.216	30%	0.304	C	S	.	.	S	Bend	trans	-106.2	-0.7	171.9	0	0	0	0	0	114.3	D141 T145	G94-D141 PolarHBondContact N-O 3.3Å; G94-T145 WeakPolarHBondContact CA-OG1 3.32Å
95	E	84.2	Confident	91.5	Very high	105 Å²	105	49.6 Å²	49.6	49%	0.491	28%	0.278	S	S	.	.	S	Bend	trans	-112.5	-45.4	-179.5	-68.7	-177.8	-154.4	0	0	112.5	S93 S142 T145 H184	S93-E95 PolarHBondContact OG-N 3.42Å; E95-S142 PolarHBondContact OE1-OG 3.37Å; E95-T145 HydrophobicContact CG-CG2 3.41Å; E95-T145 VanDerWaalsContact CG-CG2 3.41Å; E95-H184 IonicContact OE1-CE1 3.5Å; E95-H184 PolarHBondContact OE1-CE1 2.97Å; E95-H184 IonicContact OE1-ND1 3.42Å; E95-H184 PolarHBondContact OE1-ND1 3.13Å; E95-H184 IonicContact OE2-CE1 3.43Å
96	E	88.4	Confident	91.6	Very high	47 Å²	47	50.4 Å²	50.4	22%	0.22	28%	0.276	C	S	.	.	S	Bend	trans	-104.2	143.6	-175.1	-68.5	-173.7	108.1	0	0	111.3	S93 Q100 I101 R104	S93-E96 PolarHBondContact OG-N 2.85Å; S93-E96 PolarHBondContact OG-O 2.98Å; E96-Q100 HydrophobicContact CB-CB 4.26Å; E96-I101 HydrophobicContact CB-CD1 3.96Å; E96-I101 HydrophobicContact CB-CG1 3.75Å; E96-R104 IonicContact OE1-NH1 3.77Å; E96-R104 IonicContact OE2-CZ 3.75Å; E96-R104 IonicContact OE2-NH1 2.77Å; E96-R104 PolarHBondContact OE2-NH1 3.23Å
97	S	90.9	Very high	91.5	Very high	49 Å²	49	55.8 Å²	55.8	34%	0.343	28%	0.276	S	S	.	.			trans	-69.6	158.4	171.7	66.2	0	0	0	0	111.6	Q99 Q100 I101	S97-Q99 PolarHBondContact O-N 3.47Å; S97-Q99 VanDerWaalsContact O-N 3.14Å; S97-Q100 PolarHBondContact O-N 3.34Å; S97-Q100 VanDerWaalsContact O-N 3.07Å; S97-Q100 WeakPolarHBondContact OG-CG 3.27Å; S97-Q100 PolarHBondContact OG-N 3.49Å; S97-Q100 PolarHBondContact OG-OE1 2.88Å; S97-I101 PolarHBondContact O-N 2.87Å; S97-I101 VanDerWaalsContact O-N 3.14Å
98	A	90.9	Very high	91.3	Very high	44 Å²	44	56.7 Å²	56.7	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-55	-35.8	177.1	0	0	0	0	0	113.1	K102 L117	A98-K102 WeakPolarHBondContact O-CB 3.47Å; A98-K102 PolarHBondContact O-N 2.72Å; A98-L117 HydrophobicContact CB-CD2 3.78Å; A98-L117 HydrophobicContact CB-CG 4.31Å; A98-L117 WeakPolarHBondContact O-CD2 3.16Å
99	Q	92.1	Very high	90.6	Very high	164 Å²	164	56.1 Å²	56.1	77%	0.766	29%	0.29	S	S	*	.	H	α-helix	trans	-67.5	-41.2	178.4	-68.1	-179.5	-18.8	0	0	112.5	S97 K102 L103	S97-Q99 PolarHBondContact O-N 3.47Å; S97-Q99 VanDerWaalsContact O-N 3.14Å; Q99-K102 PolarHBondContact O-N 3.21Å; Q99-L103 PolarHBondContact O-N 2.93Å
100	Q	91.8	Very high	89.4	Confident	96 Å²	96	56.4 Å²	56.4	45%	0.449	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-44.1	178.5	-72.8	165.9	-65.7	0	0	111	E96 S97 L103 R104	E96-Q100 HydrophobicContact CB-CB 4.26Å; S97-Q100 PolarHBondContact O-N 3.34Å; S97-Q100 VanDerWaalsContact O-N 3.07Å; S97-Q100 WeakPolarHBondContact OG-CG 3.27Å; S97-Q100 PolarHBondContact OG-N 3.49Å; S97-Q100 PolarHBondContact OG-OE1 2.88Å; Q100-L103 PolarHBondContact O-N 2.78Å; Q100-R104 WeakPolarHBondContact O-CG 3.27Å; Q100-R104 PolarHBondContact O-N 2.89Å
101	I	91.3	Very high	87.8	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-65.3	-42.3	178.1	-67.1	167.9	0	0	0	110.8	L76 Y91 E96 S97 L103 R104 A105 L117	L76-I101 HydrophobicContact CD1-CG2 4.43Å; L76-I101 HydrophobicContact CD2-CG2 3.6Å; Y91-I101 HydrophobicContact CE1-CD1 4.35Å; E96-I101 HydrophobicContact CB-CD1 3.96Å; E96-I101 HydrophobicContact CB-CG1 3.75Å; S97-I101 PolarHBondContact O-N 2.87Å; S97-I101 VanDerWaalsContact O-N 3.14Å; I101-L103 VanDerWaalsContact C-N 3.35Å; I101-L103 PolarHBondContact O-N 3.37Å; I101-R104 WeakPolarHBondContact O-CB 3.45Å; I101-R104 PolarHBondContact O-N 3.33Å; I101-R104 VanDerWaalsContact O-N 3.11Å; I101-A105 PolarHBondContact O-N 3.44Å; I101-L117 HydrophobicContact CB-CD1 4.23Å; I101-L117 HydrophobicContact CB-CD2 3.92Å; I101-L117 HydrophobicContact CD1-CD1 3.74Å; I101-L117 HydrophobicContact CG2-CD1 3.74Å; I101-L117 HydrophobicContact CG2-CD2 3.84Å; I101-L117 HydrophobicContact CG2-CG 4.47Å
102	K	90.2	Very high	86.4	Confident	131 Å²	131	69.3 Å²	69.3	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-57.4	-46.8	174.7	-178	172.1	179.6	173.2	0	111.9	A98 Q99 R104 A105 E106	A98-K102 WeakPolarHBondContact O-CB 3.47Å; A98-K102 PolarHBondContact O-N 2.72Å; Q99-K102 PolarHBondContact O-N 3.21Å; K102-R104 VanDerWaalsContact C-N 3.26Å; K102-R104 PolarHBondContact O-N 2.98Å; K102-A105 PolarHBondContact O-N 2.68Å; K102-E106 VanDerWaalsContact CE-OE1 3.25Å; K102-E106 WeakPolarHBondContact CE-OE1 3.34Å; K102-E106 WeakPolarHBondContact O-CG 3.11Å; K102-E106 PolarHBondContact O-N 3.07Å
103	L	89.6	Confident	85.1	Confident	85 Å²	85	71 Å²	71	45%	0.445	37%	0.372	S	S	.	.	H	α-helix	trans	-59.9	-37.8	176.7	-168.7	82	0	0	0	111.9	Q99 Q100 I101 R107	Q99-L103 PolarHBondContact O-N 2.93Å; Q100-L103 PolarHBondContact O-N 2.78Å; I101-L103 VanDerWaalsContact C-N 3.35Å; I101-L103 PolarHBondContact O-N 3.37Å; L103-R107 WeakPolarHBondContact O-CG 3.22Å; L103-R107 PolarHBondContact O-N 3.27Å
104	R	88.2	Confident	84.4	Confident	60 Å²	60	77.7 Å²	77.7	23%	0.226	41%	0.408	C	S	.	.	H	α-helix	trans	-66.9	-45.8	174.9	-70	-179.8	68.2	177	2.4	111.4	T73 L76 E96 Q100 I101 K102 E106 R107 L108	T73-R104 PolarHBondContact OG1-NH2 2.93Å; L76-R104 HydrophobicContact CD1-CB 3.99Å; E96-R104 IonicContact OE1-NH1 3.77Å; E96-R104 IonicContact OE2-CZ 3.75Å; E96-R104 IonicContact OE2-NH1 2.77Å; E96-R104 PolarHBondContact OE2-NH1 3.23Å; Q100-R104 WeakPolarHBondContact O-CG 3.27Å; Q100-R104 PolarHBondContact O-N 2.89Å; I101-R104 WeakPolarHBondContact O-CB 3.45Å; I101-R104 PolarHBondContact O-N 3.33Å; I101-R104 VanDerWaalsContact O-N 3.11Å; K102-R104 VanDerWaalsContact C-N 3.26Å; K102-R104 PolarHBondContact O-N 2.98Å; R104-E106 VanDerWaalsContact C-N 3.32Å; R104-E106 PolarHBondContact O-N 3.44Å; R104-R107 PolarHBondContact O-N 3.21Å; R104-L108 WeakPolarHBondContact O-CG 3.35Å; R104-L108 PolarHBondContact O-N 2.87Å
105	A	88.4	Confident	84.5	Confident	7 Å²	7	78 Å²	78	6%	0.058	40%	0.403	C	S	.	.	H	α-helix	trans	-60.5	-40.6	177.8	0	0	0	0	0	112.1	I101 K102 R107 L108 S110	I101-A105 PolarHBondContact O-N 3.44Å; K102-A105 PolarHBondContact O-N 2.68Å; A105-R107 PolarHBondContact O-N 3.41Å; A105-L108 PolarHBondContact O-N 3.06Å; A105-L108 VanDerWaalsContact O-N 3.16Å; A105-S110 WeakPolarHBondContact O-CB 3.49Å; A105-S110 PolarHBondContact O-N 2.97Å
106	E	87.7	Confident	85	Confident	93 Å²	93	78.1 Å²	78.1	44%	0.435	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-42.8	175.3	-74.9	174.3	-177.8	0	0	112.1	K102 R104 L108 G109	K102-E106 VanDerWaalsContact CE-OE1 3.25Å; K102-E106 WeakPolarHBondContact CE-OE1 3.34Å; K102-E106 WeakPolarHBondContact O-CG 3.11Å; K102-E106 PolarHBondContact O-N 3.07Å; R104-E106 VanDerWaalsContact C-N 3.32Å; R104-E106 PolarHBondContact O-N 3.44Å; E106-L108 VanDerWaalsContact C-N 3.26Å; E106-L108 PolarHBondContact O-N 2.9Å; E106-G109 PolarHBondContact O-N 2.92Å; E106-G109 VanDerWaalsContact O-N 3.09Å
107	R	86.5	Confident	85.3	Confident	180 Å²	180	78.5 Å²	78.5	68%	0.679	40%	0.403	S	S	*	.	H	α-helix	trans	-64.9	-30	176.5	-70.8	176.1	-176.7	176.9	1	113.4	L103 R104 A105 G109	L103-R107 WeakPolarHBondContact O-CG 3.22Å; L103-R107 PolarHBondContact O-N 3.27Å; R104-R107 PolarHBondContact O-N 3.21Å; A105-R107 PolarHBondContact O-N 3.41Å; R107-G109 PolarHBondContact O-N 3.46Å
108	L	86.3	Confident	85.6	Confident	29 Å²	29	79 Å²	79	15%	0.152	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	5.2	176.6	-61.9	171.5	0	0	0	112.6	T73 L76 Q77 R104 A105 E106 S110 S239	T73-L108 HydrophobicContact CG2-CD1 4.25Å; T73-L108 HydrophobicContact CG2-CD2 3.85Å; L76-L108 HydrophobicContact CB-CD1 3.96Å; L76-L108 HydrophobicContact CD1-CD1 4.34Å; Q77-L108 HydrophobicContact CG-CD1 4.21Å; R104-L108 WeakPolarHBondContact O-CG 3.35Å; R104-L108 PolarHBondContact O-N 2.87Å; A105-L108 PolarHBondContact O-N 3.06Å; A105-L108 VanDerWaalsContact O-N 3.16Å; E106-L108 VanDerWaalsContact C-N 3.26Å; E106-L108 PolarHBondContact O-N 2.9Å; L108-S110 PolarHBondContact O-N 2.66Å; L108-S110 PolarHBondContact O-OG 2.93Å; L108-S239 WeakPolarHBondContact CD2-O 3.39Å
109	G	79.8	Confident	85.8	Confident	62 Å²	62	79.5 Å²	79.5	64%	0.639	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	15.9	-177.7	0	0	0	0	0	113.1	E106 R107	E106-G109 PolarHBondContact O-N 2.92Å; E106-G109 VanDerWaalsContact O-N 3.09Å; R107-G109 PolarHBondContact O-N 3.46Å
110	S	72.9	Confident	86	Confident	6 Å²	6	74 Å²	74	4%	0.042	38%	0.376	C	S	.	.			trans	-102.3	33.6	-174	-47	0	0	0	0	111.6	H80 A105 L108 E112 T113	H80-S110 PolarHBondContact CD2-OG 2.89Å; A105-S110 WeakPolarHBondContact O-CB 3.49Å; A105-S110 PolarHBondContact O-N 2.97Å; L108-S110 PolarHBondContact O-N 2.66Å; L108-S110 PolarHBondContact O-OG 2.93Å; S110-E112 PolarHBondContact O-N 2.84Å; S110-T113 WeakPolarHBondContact O-CB 3.23Å; S110-T113 WeakPolarHBondContact O-CG2 3.31Å; S110-T113 PolarHBondContact O-N 2.98Å; S110-T113 VanDerWaalsContact O-N 3.1Å; S110-T113 PolarHBondContact O-OG1 3.5Å
111	S	64.2	Low	86.1	Confident	89 Å²	89	71.8 Å²	71.8	62%	0.622	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.7	-173.6	51.7	0	0	0	0	114.6
112	E	68.6	Low	86.3	Confident	183 Å²	183	73.6 Å²	73.6	86%	0.855	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	19.8	177.1	-61.8	-172.4	169.4	0	0	112.7	S110 D114	S110-E112 PolarHBondContact O-N 2.84Å; E112-D114 PolarHBondContact O-N 3.43Å
113	T	69.4	Low	86.5	Confident	35 Å²	35	67.4 Å²	67.4	22%	0.215	35%	0.352	C	S	.	.			trans	-63.7	124.5	176	36.4	0	0	0	0	113	H80 S110 F115	H80-T113 HydrophobicContact CB-CG2 3.43Å; H80-T113 VanDerWaalsContact CB-CG2 3.43Å; H80-T113 WeakPolarHBondContact ND1-CG2 3.33Å; S110-T113 WeakPolarHBondContact O-CB 3.23Å; S110-T113 WeakPolarHBondContact O-CG2 3.31Å; S110-T113 PolarHBondContact O-N 2.98Å; S110-T113 VanDerWaalsContact O-N 3.1Å; S110-T113 PolarHBondContact O-OG1 3.5Å; T113-F115 HydrophobicContact CG2-CD1 3.87Å; T113-F115 HydrophobicContact CG2-CE1 3.73Å
114	D	80.3	Confident	86.7	Confident	144 Å²	144	64.5 Å²	64.5	77%	0.77	34%	0.343	S	S	*	.			trans	-102.7	64.3	174	-162.3	19	0	0	0	110.9	E112	E112-D114 PolarHBondContact O-N 3.43Å
115	F	92.6	Very high	87	Confident	27 Å²	27	65 Å²	65	12%	0.118	35%	0.348	C	S	.	.			trans	-120.7	152.1	169	69.1	-103.7	0	0	0	111.5	L76 A83 V89 Y91 T113 L117	L76-F115 HydrophobicContact CD2-CZ 3.98Å; A83-F115 HydrophobicContact CB-CB 4.22Å; V89-F115 HydrophobicContact CB-CB 3.74Å; V89-F115 HydrophobicContact CG1-CB 4.15Å; Y91-F115 HydrophobicContact CD2-CE2 4.35Å; Y91-F115 HydrophobicContact CG-CE2 4.21Å; T113-F115 HydrophobicContact CG2-CD1 3.87Å; T113-F115 HydrophobicContact CG2-CE1 3.73Å; F115-L117 HydrophobicContact CE2-CD1 4.5Å
116	Y	95.6	Very high	87.4	Confident	109 Å²	109	64.7 Å²	64.7	43%	0.427	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	127.3	179.4	-61.9	-83.4	0	0	0	110.3	V89 Y91 L133	V89-Y116 WeakPolarHBondContact O-CD2 3.25Å; V89-Y116 PolarHBondContact O-N 3.03Å; Y91-Y116 PolarHBondContact N-O 3.42Å; Y116-L133 HydrophobicContact CD1-CD1 4.43Å; Y116-L133 HydrophobicContact CD1-CD2 4.42Å; Y116-L133 HydrophobicContact CD2-CD1 4.13Å; Y116-L133 HydrophobicContact CD2-CD2 3.72Å; Y116-L133 HydrophobicContact CD2-CG 4.4Å; Y116-L133 HydrophobicContact CE1-CD1 4.09Å; Y116-L133 HydrophobicContact CE2-CD1 3.75Å; Y116-L133 HydrophobicContact CE2-CD2 4.19Å; Y116-L133 HydrophobicContact CE2-CG 4.4Å; Y116-L133 HydrophobicContact CG-CD1 4.45Å; Y116-L133 HydrophobicContact CG-CD2 3.84Å
117	L	94.6	Very high	87.8	Confident	55 Å²	55	60.8 Å²	60.8	29%	0.288	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125	175.1	-176.7	62.6	0	0	0	109.8	Y91 A98 I101 F115	Y91-L117 HydrophobicContact CD1-CD1 3.87Å; Y91-L117 HydrophobicContact CG-CD1 4.25Å; A98-L117 HydrophobicContact CB-CD2 3.78Å; A98-L117 HydrophobicContact CB-CG 4.31Å; A98-L117 WeakPolarHBondContact O-CD2 3.16Å; I101-L117 HydrophobicContact CB-CD1 4.23Å; I101-L117 HydrophobicContact CB-CD2 3.92Å; I101-L117 HydrophobicContact CD1-CD1 3.74Å; I101-L117 HydrophobicContact CG2-CD1 3.74Å; I101-L117 HydrophobicContact CG2-CD2 3.84Å; I101-L117 HydrophobicContact CG2-CG 4.47Å; F115-L117 HydrophobicContact CE2-CD1 4.5Å
118	Y	96.6	Very high	88.2	Confident	59 Å²	59	59 Å²	59	23%	0.231	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	107.9	-177.5	-169.7	-154	0	0	0	110.8	Y91 V92 S93 E120 I126 T129	Y91-Y118 PolarHBondContact O-N 3.25Å; V92-Y118 CarbonylContact C-O 3.6Å; V92-Y118 VanDerWaalsContact CA-O 3.25Å; V92-Y118 WeakPolarHBondContact CA-O 3.38Å; S93-Y118 PolarHBondContact N-O 3.04Å; Y118-E120 HydrophobicContact CD1-CB 3.91Å; Y118-E120 HydrophobicContact CD2-CB 3.97Å; Y118-E120 HydrophobicContact CE1-CB 3.62Å; Y118-E120 HydrophobicContact CE1-CG 3.83Å; Y118-E120 HydrophobicContact CE2-CB 3.65Å; Y118-E120 HydrophobicContact CE2-CG 4.2Å; Y118-E120 HydrophobicContact CG-CB 4.07Å; Y118-E120 VanDerWaalsContact CZ-CB 3.46Å; Y118-E120 PolarHBondContact O-N 3.34Å; Y118-E120 WeakPolarHBondContact OH-CG 3.23Å; Y118-E120 PolarHBondContact OH-OE2 3.16Å; Y118-I126 HydrophobicContact CE1-CG1 4.26Å; Y118-T129 HydrophobicContact CD1-CG2 4.16Å; Y118-T129 HydrophobicContact CE1-CG2 4.17Å; Y118-T129 WeakPolarHBondContact CE1-OG1 3.31Å
119	A	95.3	Very high	88.8	Confident	54 Å²	54	59.4 Å²	59.4	45%	0.446	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	92.3	174.9	0	0	0	0	0	108.7	S93	S93-A119 WeakPolarHBondContact O-CA 3.37Å
120	E	95.7	Very high	89.6	Confident	49 Å²	49	56.5 Å²	56.5	23%	0.229	30%	0.295	C	S	.	.			trans	-149.3	151	-175.1	-175.6	55.1	-97.5	0	0	110.5	S93 Y118 D122 E125 I126	S93-E120 PolarHBondContact O-N 2.55Å; S93-E120 VanDerWaalsContact O-N 3.13Å; Y118-E120 HydrophobicContact CD1-CB 3.91Å; Y118-E120 HydrophobicContact CD2-CB 3.97Å; Y118-E120 HydrophobicContact CE1-CB 3.62Å; Y118-E120 HydrophobicContact CE1-CG 3.83Å; Y118-E120 HydrophobicContact CE2-CB 3.65Å; Y118-E120 HydrophobicContact CE2-CG 4.2Å; Y118-E120 HydrophobicContact CG-CB 4.07Å; Y118-E120 VanDerWaalsContact CZ-CB 3.46Å; Y118-E120 PolarHBondContact O-N 3.34Å; Y118-E120 WeakPolarHBondContact OH-CG 3.23Å; Y118-E120 PolarHBondContact OH-OE2 3.16Å; E120-D122 PolarHBondContact OE1-N 3.16Å; E120-E125 HydrophobicContact CG-CB 4.35Å; E120-I126 HydrophobicContact CB-CG1 4.17Å; E120-I126 HydrophobicContact CG-CD1 4.28Å; E120-I126 HydrophobicContact CG-CG1 3.85Å
121	T	94.5	Very high	90.6	Very high	49 Å²	49	61.4 Å²	61.4	30%	0.301	32%	0.317	S	S	.	.			trans	-124.4	-16.1	178	58.6	0	0	0	0	113.1	M123 T145 M146 T147	T121-M123 PolarHBondContact O-N 3.12Å; T121-T145 WeakPolarHBondContact CB-O 3.28Å; T121-T145 WeakPolarHBondContact CG2-O 3.42Å; T121-M146 CarbonylContact O-C 3.55Å; T121-M146 WeakPolarHBondContact O-CA 3.37Å; T121-T147 PolarHBondContact O-N 3.13Å; T121-T147 PolarHBondContact O-OG1 3.02Å; T121-T147 VanDerWaalsContact O-OG1 3.11Å
122	D	94.3	Very high	92.2	Very high	40 Å²	40	63.6 Å²	63.6	21%	0.214	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-78.3	114.2	177.6	-169.1	-48.6	0	0	0	111.4	E120 G124 E125 I126 P149	E120-D122 PolarHBondContact OE1-N 3.16Å; D122-G124 VanDerWaalsContact C-N 3.26Å; D122-G124 PolarHBondContact O-N 3.2Å; D122-G124 VanDerWaalsContact OD1-CA 3.31Å; D122-G124 WeakPolarHBondContact OD1-CA 3.38Å; D122-G124 PolarHBondContact OD1-N 2.99Å; D122-E125 HydrophobicContact CB-CB 4.29Å; D122-E125 HydrophobicContact CB-CG 4.21Å; D122-E125 PolarHBondContact O-N 3.03Å; D122-E125 PolarHBondContact OD1-N 3.33Å; D122-I126 WeakPolarHBondContact O-CD1 3.39Å; D122-I126 VanDerWaalsContact O-CG1 3.23Å; D122-I126 WeakPolarHBondContact O-CG1 3.4Å; D122-I126 PolarHBondContact O-N 3.03Å; D122-P149 VanDerWaalsContact OD2-CG 3.23Å; D122-P149 WeakPolarHBondContact OD2-CG 3.42Å
123	M	94.5	Very high	93.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-25.4	-179.7	-78	-60.6	-49.4	0	0	114.3	T121 I126 S127 M146 T147 Q148 T164 L168	T121-M123 PolarHBondContact O-N 3.12Å; M123-I126 HydrophobicContact SD-CD1 3.93Å; M123-S127 VanDerWaalsContact O-CB 3.24Å; M123-S127 WeakPolarHBondContact O-CB 3.46Å; M123-S127 PolarHBondContact O-N 3.34Å; M123-S127 PolarHBondContact O-OG 2.85Å; M123-M146 HydrophobicContact CG-CB 3.96Å; M123-M146 HydrophobicContact SD-CB 4.03Å; M123-M146 HydrophobicContact SD-CG 4.02Å; M123-M146 HydrophobicContact SD-SD 4.04Å; M123-T147 WeakPolarHBondContact CB-O 3.27Å; M123-T147 WeakPolarHBondContact CG-O 3.33Å; M123-T147 PolarHBondContact N-O 3.17Å; M123-Q148 HydrophobicContact CB-CG 3.72Å; M123-Q148 HydrophobicContact CG-CG 4.07Å; M123-T164 HydrophobicContact CE-CG2 3.96Å; M123-T164 HydrophobicContact CG-CG2 3.57Å; M123-T164 HydrophobicContact SD-CG2 3.49Å; M123-T164 WeakPolarHBondContact SD-CG2 3.48Å; M123-L168 HydrophobicContact CE-CD2 3.76Å; M123-L168 HydrophobicContact CE-CG 3.95Å
124	G	93.7	Very high	94.7	Very high	25 Å²	25	62.7 Å²	62.7	26%	0.258	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-47.7	172.8	0	0	0	0	0	111.2	D122 S127 R128	D122-G124 VanDerWaalsContact C-N 3.26Å; D122-G124 PolarHBondContact O-N 3.2Å; D122-G124 VanDerWaalsContact OD1-CA 3.31Å; D122-G124 WeakPolarHBondContact OD1-CA 3.38Å; D122-G124 PolarHBondContact OD1-N 2.99Å; G124-S127 PolarHBondContact O-N 3.27Å; G124-R128 WeakPolarHBondContact O-CG 3.43Å; G124-R128 PolarHBondContact O-N 3.13Å
125	E	95.6	Very high	95.5	Very high	70 Å²	70	55.9 Å²	55.9	33%	0.327	28%	0.278	S	S	.	.	H	α-helix	trans	-69.2	-38.5	177.5	-63.4	-53.9	142.3	0	0	112.3	E120 D122 S127 R128 T129	E120-E125 HydrophobicContact CG-CB 4.35Å; D122-E125 HydrophobicContact CB-CB 4.29Å; D122-E125 HydrophobicContact CB-CG 4.21Å; D122-E125 PolarHBondContact O-N 3.03Å; D122-E125 PolarHBondContact OD1-N 3.33Å; E125-S127 PolarHBondContact O-N 2.95Å; E125-R128 PolarHBondContact O-N 2.72Å; E125-R128 IonicContact OE1-CZ 3.77Å; E125-R128 IonicContact OE1-NH1 3.55Å; E125-R128 PolarHBondContact OE1-NH1 2.9Å; E125-R128 IonicContact OE2-NH1 3.63Å; E125-T129 WeakPolarHBondContact O-CB 3.28Å; E125-T129 PolarHBondContact O-N 3.3Å; E125-T129 PolarHBondContact O-OG1 2.82Å
126	I	96.7	Very high	95.7	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-46.1	172.9	-66.9	160.7	0	0	0	110.5	V92 Y118 E120 D122 M123 T129 I130 I140 M146	V92-I126 HydrophobicContact CG1-CD1 3.72Å; V92-I126 HydrophobicContact CG1-CG1 3.96Å; V92-I126 HydrophobicContact CG2-CG2 4.25Å; Y118-I126 HydrophobicContact CE1-CG1 4.26Å; E120-I126 HydrophobicContact CB-CG1 4.17Å; E120-I126 HydrophobicContact CG-CD1 4.28Å; E120-I126 HydrophobicContact CG-CG1 3.85Å; D122-I126 WeakPolarHBondContact O-CD1 3.39Å; D122-I126 VanDerWaalsContact O-CG1 3.23Å; D122-I126 WeakPolarHBondContact O-CG1 3.4Å; D122-I126 PolarHBondContact O-N 3.03Å; M123-I126 HydrophobicContact SD-CD1 3.93Å; I126-T129 WeakPolarHBondContact O-CB 3.36Å; I126-T129 PolarHBondContact O-N 3.47Å; I126-I130 HydrophobicContact CG2-CD1 3.8Å; I126-I130 HydrophobicContact CG2-CG1 4.47Å; I126-I130 VanDerWaalsContact O-CG1 3.31Å; I126-I130 WeakPolarHBondContact O-CG1 3.5Å; I126-I130 PolarHBondContact O-N 3.01Å; I126-I140 HydrophobicContact CG2-CD1 4.39Å; I126-M146 HydrophobicContact CD1-SD 3.48Å; I126-M146 WeakPolarHBondContact CD1-SD 3.45Å
127	S	95.9	Very high	95.9	Very high	11 Å²	11	53.7 Å²	53.7	8%	0.077	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-45.3	179.8	-61.4	0	0	0	0	111.8	M123 G124 E125 T129 I130 E131	M123-S127 VanDerWaalsContact O-CB 3.24Å; M123-S127 WeakPolarHBondContact O-CB 3.46Å; M123-S127 PolarHBondContact O-N 3.34Å; M123-S127 PolarHBondContact O-OG 2.85Å; G124-S127 PolarHBondContact O-N 3.27Å; E125-S127 PolarHBondContact O-N 2.95Å; S127-T129 VanDerWaalsContact C-N 3.29Å; S127-T129 PolarHBondContact O-N 3.42Å; S127-I130 PolarHBondContact O-N 3.13Å; S127-E131 WeakPolarHBondContact O-CG 3.38Å; S127-E131 PolarHBondContact O-N 3.21Å
128	R	96.1	Very high	96	Very high	142 Å²	142	51.1 Å²	51.1	54%	0.536	26%	0.261	S	S	.	.	H	α-helix	trans	-60.3	-40.4	174.6	-72	177.3	-171.4	158.9	8	112	G124 E125 E131 N132	G124-R128 WeakPolarHBondContact O-CG 3.43Å; G124-R128 PolarHBondContact O-N 3.13Å; E125-R128 PolarHBondContact O-N 2.72Å; E125-R128 IonicContact OE1-CZ 3.77Å; E125-R128 IonicContact OE1-NH1 3.55Å; E125-R128 PolarHBondContact OE1-NH1 2.9Å; E125-R128 IonicContact OE2-NH1 3.63Å; R128-E131 PolarHBondContact O-N 2.81Å; R128-N132 WeakPolarHBondContact O-CB 3.3Å; R128-N132 VanDerWaalsContact O-CG 3.26Å; R128-N132 PolarHBondContact O-N 2.64Å; R128-N132 PolarHBondContact O-ND2 2.95Å; R128-N132 VanDerWaalsContact O-ND2 3.15Å
129	T	97.6	Very high	96.1	Very high	39 Å²	39	48.3 Å²	48.3	24%	0.239	25%	0.25	C	C	.	.	H	α-helix	trans	-63.8	-43.5	177.4	-61.8	0	0	0	0	110.8	L90 Y118 E125 I126 S127 E131 N132 L133	L90-T129 HydrophobicContact CD2-CG2 4.11Å; Y118-T129 HydrophobicContact CD1-CG2 4.16Å; Y118-T129 HydrophobicContact CE1-CG2 4.17Å; Y118-T129 WeakPolarHBondContact CE1-OG1 3.31Å; E125-T129 WeakPolarHBondContact O-CB 3.28Å; E125-T129 PolarHBondContact O-N 3.3Å; E125-T129 PolarHBondContact O-OG1 2.82Å; I126-T129 WeakPolarHBondContact O-CB 3.36Å; I126-T129 PolarHBondContact O-N 3.47Å; S127-T129 VanDerWaalsContact C-N 3.29Å; S127-T129 PolarHBondContact O-N 3.42Å; T129-E131 PolarHBondContact O-N 2.89Å; T129-N132 PolarHBondContact O-N 2.71Å; T129-L133 WeakPolarHBondContact O-CB 3.44Å; T129-L133 PolarHBondContact O-N 3.17Å
130	I	97.3	Very high	96.2	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-44.1	175.5	-70.5	166.2	0	0	0	111.2	L90 I126 S127 N132 K134 P135 V138 L171 I177	L90-I130 HydrophobicContact CD2-CG1 3.82Å; I126-I130 HydrophobicContact CG2-CD1 3.8Å; I126-I130 HydrophobicContact CG2-CG1 4.47Å; I126-I130 VanDerWaalsContact O-CG1 3.31Å; I126-I130 WeakPolarHBondContact O-CG1 3.5Å; I126-I130 PolarHBondContact O-N 3.01Å; S127-I130 PolarHBondContact O-N 3.13Å; I130-N132 VanDerWaalsContact C-N 3.34Å; I130-N132 PolarHBondContact O-N 2.84Å; I130-K134 VanDerWaalsContact O-CA 3.31Å; I130-K134 WeakPolarHBondContact O-CA 3.32Å; I130-K134 PolarHBondContact O-N 3.2Å; I130-P135 HydrophobicContact CG2-CG 4.41Å; I130-P135 WeakPolarHBondContact O-CD 3.32Å; I130-V138 HydrophobicContact CD1-CG1 4.19Å; I130-V138 HydrophobicContact CD1-CG2 4.07Å; I130-V138 HydrophobicContact CG1-CG2 4.04Å; I130-L171 HydrophobicContact CD1-CD1 4.18Å; I130-I177 HydrophobicContact CG2-CD1 3.49Å; I130-I177 VanDerWaalsContact CG2-CD1 3.49Å
131	E	94.4	Very high	96.2	Very high	108 Å²	108	43.5 Å²	43.5	51%	0.505	22%	0.218	S	C	.	.	H	α-helix	trans	-65.4	-36.8	179.7	-72.3	175.7	174.2	0	0	112.9	S127 R128 T129 K134	S127-E131 WeakPolarHBondContact O-CG 3.38Å; S127-E131 PolarHBondContact O-N 3.21Å; R128-E131 PolarHBondContact O-N 2.81Å; T129-E131 PolarHBondContact O-N 2.89Å; E131-K134 WeakPolarHBondContact O-CE 3.4Å; E131-K134 VanDerWaalsContact O-CG 3.29Å; E131-K134 WeakPolarHBondContact O-CG 3.36Å
132	N	96.1	Very high	96.1	Very high	135 Å²	135	41.2 Å²	41.2	72%	0.722	20%	0.204	S	C	*	.	H	α-helix	trans	-77.8	-48.8	179.1	-72.3	-30.4	0	0	0	112.4	R128 T129 I130	R128-N132 WeakPolarHBondContact O-CB 3.3Å; R128-N132 VanDerWaalsContact O-CG 3.26Å; R128-N132 PolarHBondContact O-N 2.64Å; R128-N132 PolarHBondContact O-ND2 2.95Å; R128-N132 VanDerWaalsContact O-ND2 3.15Å; T129-N132 PolarHBondContact O-N 2.71Å; I130-N132 VanDerWaalsContact C-N 3.34Å; I130-N132 PolarHBondContact O-N 2.84Å
133	L	95.8	Very high	96.1	Very high	48 Å²	48	39.3 Å²	39.3	25%	0.251	19%	0.194	S	C	.	.	H	α-helix	trans	-74.3	-30.4	-176.5	-177.4	63.3	0	0	0	112.1	L90 Y116 T129 P135	L90-L133 HydrophobicContact CB-CD2 4.17Å; L90-L133 HydrophobicContact CD1-CD2 4.08Å; L90-L133 HydrophobicContact CD2-CD2 4.38Å; L90-L133 HydrophobicContact CG-CD2 4.44Å; Y116-L133 HydrophobicContact CD1-CD1 4.43Å; Y116-L133 HydrophobicContact CD1-CD2 4.42Å; Y116-L133 HydrophobicContact CD2-CD1 4.13Å; Y116-L133 HydrophobicContact CD2-CD2 3.72Å; Y116-L133 HydrophobicContact CD2-CG 4.4Å; Y116-L133 HydrophobicContact CE1-CD1 4.09Å; Y116-L133 HydrophobicContact CE2-CD1 3.75Å; Y116-L133 HydrophobicContact CE2-CD2 4.19Å; Y116-L133 HydrophobicContact CE2-CG 4.4Å; Y116-L133 HydrophobicContact CG-CD1 4.45Å; Y116-L133 HydrophobicContact CG-CD2 3.84Å; T129-L133 WeakPolarHBondContact O-CB 3.44Å; T129-L133 PolarHBondContact O-N 3.17Å; L133-P135 HydrophobicContact CD2-CB 4.44Å
134	K	96	Very high	95.8	Very high	151 Å²	151	40.2 Å²	40.2	66%	0.657	20%	0.198	S	C	*	.			trans	49.5	56.2	-175.2	-57.8	-179.9	-178.4	176.4	0	112.4	I130 E131	I130-K134 VanDerWaalsContact O-CA 3.31Å; I130-K134 WeakPolarHBondContact O-CA 3.32Å; I130-K134 PolarHBondContact O-N 3.2Å; E131-K134 WeakPolarHBondContact O-CE 3.4Å; E131-K134 VanDerWaalsContact O-CG 3.29Å; E131-K134 WeakPolarHBondContact O-CG 3.36Å
135	P	97.6	Very high	95.6	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.013	20%	0.196	C	C	.	.			trans	-68.1	152.1	179.1	32.3	-35.6	0	0	0	110.9	N88 L90 I130 L133 V138 I177	N88-P135 CarbonylContact O-C 3.57Å; N88-P135 WeakPolarHBondContact O-CB 3.49Å; L90-P135 HydrophobicContact CB-CB 4.02Å; L90-P135 HydrophobicContact CB-CG 4.09Å; L90-P135 HydrophobicContact CD2-CG 4.45Å; I130-P135 HydrophobicContact CG2-CG 4.41Å; I130-P135 WeakPolarHBondContact O-CD 3.32Å; L133-P135 HydrophobicContact CD2-CB 4.44Å; P135-V138 HydrophobicContact CB-CG2 4.4Å; P135-V138 HydrophobicContact CG-CG2 3.62Å; P135-I177 VanDerWaalsContact O-CG1 3.31Å; P135-I177 WeakPolarHBondContact O-CG1 3.43Å
136	D	96.6	Very high	95.5	Very high	77 Å²	77	37.3 Å²	37.3	41%	0.412	18%	0.18	S	C	.	.	S	Bend	trans	-77.6	-30.2	171.4	-60	-67.8	0	0	0	111.4	G87 N88 I177 A178	G87-D136 WeakPolarHBondContact CA-OD2 3.46Å; N88-D136 PolarHBondContact N-OD2 3.34Å; N88-D136 PolarHBondContact O-N 2.8Å; D136-I177 WeakPolarHBondContact O-CG2 3.4Å; D136-A178 PolarHBondContact O-N 3.06Å
137	Y	98	Very high	95.2	Very high	13 Å²	13	39.3 Å²	39.3	5%	0.051	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138	-176.4	-48.7	-77.8	0	0	0	111.7	I40 V55 L82 N88 V89 L90 A178	I40-Y137 WeakPolarHBondContact CG1-OH 3.49Å; I40-Y137 WeakPolarHBondContact CG2-OH 3.29Å; V55-Y137 HydrophobicContact CG1-CD1 4.33Å; V55-Y137 HydrophobicContact CG1-CE1 4.14Å; L82-Y137 HydrophobicContact CB-CD2 3.88Å; L82-Y137 HydrophobicContact CB-CE2 3.94Å; L82-Y137 HydrophobicContact CB-CG 4.27Å; L82-Y137 HydrophobicContact CD1-CD1 3.75Å; L82-Y137 HydrophobicContact CD1-CD2 4.32Å; L82-Y137 HydrophobicContact CD1-CE1 4.18Å; L82-Y137 HydrophobicContact CD1-CG 3.85Å; L82-Y137 HydrophobicContact CD2-CD1 4.32Å; L82-Y137 HydrophobicContact CD2-CE1 3.89Å; L82-Y137 HydrophobicContact CD2-CE2 4.23Å; L82-Y137 HydrophobicContact CG-CD1 4.48Å; L82-Y137 HydrophobicContact CG-CE2 4.49Å; N88-Y137 PolarHBondContact O-N 2.97Å; N88-Y137 VanDerWaalsContact O-N 3.12Å; V89-Y137 WeakPolarHBondContact CA-O 3.4Å; V89-Y137 HydrophobicContact CG2-CD2 3.67Å; V89-Y137 HydrophobicContact CG2-CG 4.23Å; L90-Y137 PolarHBondContact N-O 3.08Å; Y137-A178 VanDerWaalsContact CA-O 3.3Å; Y137-A178 WeakPolarHBondContact CA-O 3.13Å; Y137-A178 HydrophobicContact CD1-CB 3.84Å; Y137-A178 HydrophobicContact CE1-CB 4.22Å
138	V	98.5	Very high	94.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.5	173.9	176.7	0	0	0	0	109.8	L90 I130 P135 I140 I177 A178 I179 F180	L90-V138 HydrophobicContact CB-CG2 4.35Å; L90-V138 CarbonylContact O-C 3.57Å; L90-V138 WeakPolarHBondContact O-CA 3.42Å; I130-V138 HydrophobicContact CD1-CG1 4.19Å; I130-V138 HydrophobicContact CD1-CG2 4.07Å; I130-V138 HydrophobicContact CG1-CG2 4.04Å; P135-V138 HydrophobicContact CB-CG2 4.4Å; P135-V138 HydrophobicContact CG-CG2 3.62Å; V138-I140 HydrophobicContact CG1-CD1 3.67Å; V138-I140 HydrophobicContact CG1-CG1 4.21Å; V138-I177 HydrophobicContact CB-CG2 4.36Å; V138-I177 HydrophobicContact CG2-CG2 3.75Å; V138-A178 PolarHBondContact N-O 3.5Å; V138-I179 HydrophobicContact CB-CD1 4.49Å; V138-I179 HydrophobicContact CB-CG1 4.11Å; V138-I179 HydrophobicContact CB-CG2 4.28Å; V138-I179 HydrophobicContact CG1-CG2 4.37Å; V138-I179 CarbonylContact O-C 3.54Å; V138-I179 VanDerWaalsContact O-CA 3.3Å; V138-I179 WeakPolarHBondContact O-CA 3.46Å; V138-F180 PolarHBondContact O-N 3.35Å
139	I	98	Very high	93.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.8	171.4	-65.4	76	0	0	0	107.8	L75 S79 V89 L90 Y91 V92 D141 F180	L75-I139 HydrophobicContact CB-CG2 4.16Å; L75-I139 HydrophobicContact CD1-CG2 3.89Å; L75-I139 HydrophobicContact CD2-CG1 4.33Å; L75-I139 HydrophobicContact CD2-CG2 4.32Å; L75-I139 HydrophobicContact CG-CG2 4.36Å; S79-I139 WeakPolarHBondContact OG-CD1 3.44Å; S79-I139 WeakPolarHBondContact OG-CG1 3.24Å; V89-I139 HydrophobicContact CG1-CD1 3.5Å; V89-I139 VanDerWaalsContact CG1-CD1 3.5Å; L90-I139 PolarHBondContact O-N 2.94Å; Y91-I139 HydrophobicContact CD2-CB 3.85Å; Y91-I139 HydrophobicContact CD2-CG1 4.15Å; Y91-I139 HydrophobicContact CD2-CG2 3.85Å; Y91-I139 HydrophobicContact CE1-CG2 4.3Å; Y91-I139 HydrophobicContact CE2-CB 4.15Å; Y91-I139 HydrophobicContact CE2-CG1 4.44Å; Y91-I139 HydrophobicContact CE2-CG2 3.61Å; Y91-I139 HydrophobicContact CG-CB 4.19Å; Y91-I139 HydrophobicContact CG-CG2 4.29Å; V92-I139 WeakPolarHBondContact CA-O 3.39Å; V92-I139 WeakPolarHBondContact CB-O 3.25Å; V92-I139 PolarHBondContact N-O 3.28Å; I139-D141 HydrophobicContact CG2-CB 4.44Å; I139-F180 CarbonylContact C-O 3.48Å; I139-F180 WeakPolarHBondContact CA-O 3.32Å; I139-F180 HydrophobicContact CG1-CB 4.35Å
140	I	97.6	Very high	92.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	108.8	171.3	-51.5	-60.1	0	0	0	109	V92 I126 V138 I143 M146 L168 I179 F180 I181 V182	V92-I140 HydrophobicContact CB-CD1 3.8Å; V92-I140 HydrophobicContact CG1-CD1 4.38Å; V92-I140 HydrophobicContact CG2-CD1 3.89Å; I126-I140 HydrophobicContact CG2-CD1 4.39Å; V138-I140 HydrophobicContact CG1-CD1 3.67Å; V138-I140 HydrophobicContact CG1-CG1 4.21Å; I140-I143 HydrophobicContact CG2-CD1 4.38Å; I140-M146 HydrophobicContact CG2-CE 4.17Å; I140-M146 HydrophobicContact CG2-CG 3.67Å; I140-M146 HydrophobicContact CG2-SD 3.78Å; I140-L168 HydrophobicContact CD1-CD2 4.32Å; I140-L168 HydrophobicContact CG1-CD1 3.94Å; I140-L168 HydrophobicContact CG1-CD2 4.14Å; I140-I179 HydrophobicContact CG1-CG2 4.47Å; I140-F180 PolarHBondContact N-O 2.96Å; I140-I181 HydrophobicContact CB-CB 4.47Å; I140-I181 HydrophobicContact CB-CG2 4.01Å; I140-I181 HydrophobicContact CG1-CG2 4.1Å; I140-I181 WeakPolarHBondContact O-CA 3.43Å; I140-V182 PolarHBondContact O-N 2.89Å
141	D	95.5	Very high	91.9	Very high	3 Å²	3	43 Å²	43	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	93.8	-178.4	-168	13.5	0	0	0	111.4	S72 Y91 V92 S93 G94 I139 V182	S72-D141 WeakPolarHBondContact CB-OD2 3.18Å; S72-D141 PolarHBondContact OG-OD1 3.41Å; S72-D141 PolarHBondContact OG-OD2 3.19Å; Y91-D141 HydrophobicContact CE1-CB 3.87Å; Y91-D141 PolarHBondContact OH-OD2 3.38Å; V92-D141 PolarHBondContact O-N 2.71Å; S93-D141 VanDerWaalsContact CA-O 3.32Å; S93-D141 WeakPolarHBondContact CA-O 3.34Å; S93-D141 PolarHBondContact OG-O 3.39Å; G94-D141 PolarHBondContact N-O 3.3Å; I139-D141 HydrophobicContact CG2-CB 4.44Å; D141-V182 HydrophobicContact CB-CG2 4.19Å; D141-V182 WeakPolarHBondContact OD1-CG2 3.2Å
142	S	92.5	Very high	91	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.			cis	-118.2	166	3.7	69.4	0	0	0	0	112.2	E95 Q144 T145	E95-S142 PolarHBondContact OE1-OG 3.37Å; S142-Q144 PolarHBondContact O-N 3.35Å; S142-T145 PolarHBondContact O-N 2.84Å; S142-T145 PolarHBondContact O-OG1 3.34Å
143	I	93.1	Very high	90	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-63.9	-25.2	-179.8	-163.8	62.2	0	0	0	112.3	I140 T145 M146 V161 T164 L168 V182 L197	I140-I143 HydrophobicContact CG2-CD1 4.38Å; I143-T145 VanDerWaalsContact C-N 3.3Å; I143-T145 PolarHBondContact O-N 3.3Å; I143-M146 HydrophobicContact CD1-CG 4.38Å; I143-M146 PolarHBondContact O-N 3.26Å; I143-V161 HydrophobicContact CG1-CG1 4.13Å; I143-V161 HydrophobicContact CG2-CG1 3.95Å; I143-T164 HydrophobicContact CD1-CG2 3.58Å; I143-L168 HydrophobicContact CD1-CD1 3.57Å; I143-V182 VanDerWaalsContact CG2-O 3.31Å; I143-V182 WeakPolarHBondContact CG2-O 3.47Å; I143-V182 PolarHBondContact N-O 3.18Å; I143-L197 HydrophobicContact CG2-CD1 4.21Å
144	Q	89	Confident	89.1	Confident	20 Å²	20	43.9 Å²	43.9	9%	0.093	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-71.3	-23.5	-178.9	-73	92.3	-6.1	0	0	113.7	S142 G156 H184 I191 A192	S142-Q144 PolarHBondContact O-N 3.35Å; Q144-G156 WeakPolarHBondContact O-CA 3.14Å; Q144-G156 PolarHBondContact O-N 3.32Å; Q144-G156 VanDerWaalsContact O-N 3.17Å; Q144-H184 PolarHBondContact NE2-O 3.36Å; Q144-H184 VanDerWaalsContact OE1-N 3.11Å; Q144-I191 HydrophobicContact CG-CG2 4.27Å; Q144-A192 PolarHBondContact NE2-O 2.99Å
145	T	90.1	Very high	88.2	Confident	33 Å²	33	39.2 Å²	39.2	20%	0.202	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-88.3	-9.1	179.7	54	0	0	0	0	113.5	G94 E95 T121 S142 I143	G94-T145 WeakPolarHBondContact CA-OG1 3.32Å; E95-T145 HydrophobicContact CG-CG2 3.41Å; E95-T145 VanDerWaalsContact CG-CG2 3.41Å; T121-T145 WeakPolarHBondContact CB-O 3.28Å; T121-T145 WeakPolarHBondContact CG2-O 3.42Å; S142-T145 PolarHBondContact O-N 2.84Å; S142-T145 PolarHBondContact O-OG1 3.34Å; I143-T145 VanDerWaalsContact C-N 3.3Å; I143-T145 PolarHBondContact O-N 3.3Å
146	M	93.2	Very high	87.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.238	C	C	.	.			trans	-73.1	142.7	179	-58.5	-60.8	106.7	0	0	111.5	T121 M123 I126 I140 I143 T164	T121-M146 CarbonylContact O-C 3.55Å; T121-M146 WeakPolarHBondContact O-CA 3.37Å; M123-M146 HydrophobicContact CG-CB 3.96Å; M123-M146 HydrophobicContact SD-CB 4.03Å; M123-M146 HydrophobicContact SD-CG 4.02Å; M123-M146 HydrophobicContact SD-SD 4.04Å; I126-M146 HydrophobicContact CD1-SD 3.48Å; I126-M146 WeakPolarHBondContact CD1-SD 3.45Å; I140-M146 HydrophobicContact CG2-CE 4.17Å; I140-M146 HydrophobicContact CG2-CG 3.67Å; I140-M146 HydrophobicContact CG2-SD 3.78Å; I143-M146 HydrophobicContact CD1-CG 4.38Å; I143-M146 PolarHBondContact O-N 3.26Å; M146-T164 HydrophobicContact CB-CG2 3.85Å; M146-T164 HydrophobicContact CG-CG2 4.31Å
147	T	90.8	Very high	86.7	Confident	43 Å²	43	37 Å²	37	26%	0.264	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-125.4	145.7	-177.8	67	0	0	0	0	110.6	T121 M123 A155	T121-T147 PolarHBondContact O-N 3.13Å; T121-T147 PolarHBondContact O-OG1 3.02Å; T121-T147 VanDerWaalsContact O-OG1 3.11Å; M123-T147 WeakPolarHBondContact CB-O 3.27Å; M123-T147 WeakPolarHBondContact CG-O 3.33Å; M123-T147 PolarHBondContact N-O 3.17Å; T147-A155 HydrophobicContact CG2-CB 3.88Å
148	Q	86	Confident	86	Confident	6 Å²	6	38.4 Å²	38.4	3%	0.028	24%	0.237	C	C	.	.			trans	-124.5	104.5	168.7	-73	167.3	-46.1	0	0	106.8	M123 D150 I151 Q160 T164 E167	M123-Q148 HydrophobicContact CB-CG 3.72Å; M123-Q148 HydrophobicContact CG-CG 4.07Å; Q148-D150 PolarHBondContact O-N 2.99Å; Q148-I151 HydrophobicContact CB-CB 4.5Å; Q148-I151 HydrophobicContact CB-CD1 3.87Å; Q148-I151 HydrophobicContact CB-CG1 3.88Å; Q148-I151 HydrophobicContact CG-CD1 4.47Å; Q148-I151 PolarHBondContact O-N 3.09Å; Q148-Q160 VanDerWaalsContact CB-NE2 3.27Å; Q148-Q160 VanDerWaalsContact CG-NE2 3.33Å; Q148-T164 PolarHBondContact OE1-OG1 2.9Å; Q148-E167 PolarHBondContact NE2-OE2 3.44Å
149	P	76.5	Confident	85.4	Confident	88 Å²	88	42.2 Å²	42.2	57%	0.571	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-28.6	-174.9	-28	34.1	0	0	0	114.5	D122 I151	D122-P149 VanDerWaalsContact OD2-CG 3.23Å; D122-P149 WeakPolarHBondContact OD2-CG 3.42Å; P149-I151 PolarHBondContact O-N 2.94Å
150	D	78.9	Confident	84.9	Confident	125 Å²	125	42.3 Å²	42.3	67%	0.668	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-10.7	179.2	-60	-29	0	0	0	113.7	R13 Q148	R13-D150 IonicContact CZ-OD2 3.03Å; R13-D150 IonicContact NH2-OD2 2.7Å; R13-D150 PolarHBondContact NH2-OD2 2.96Å; Q148-D150 PolarHBondContact O-N 2.99Å
151	I	76.7	Confident	84.6	Confident	50 Å²	50	42.3 Å²	42.3	26%	0.256	26%	0.264	S	S	.	.	S	Bend	trans	-103.9	122.8	-179.1	-50.8	-173.2	0	0	0	109.1	Q148 P149 S153 E163	Q148-I151 HydrophobicContact CB-CB 4.5Å; Q148-I151 HydrophobicContact CB-CD1 3.87Å; Q148-I151 HydrophobicContact CB-CG1 3.88Å; Q148-I151 HydrophobicContact CG-CD1 4.47Å; Q148-I151 PolarHBondContact O-N 3.09Å; P149-I151 PolarHBondContact O-N 2.94Å; I151-S153 WeakPolarHBondContact CG2-OG 3.3Å; I151-S153 PolarHBondContact O-N 3.3Å; I151-E163 HydrophobicContact CD1-CB 3.77Å; I151-E163 HydrophobicContact CD1-CG 3.58Å
152	T	74.5	Confident	84.3	Confident	156 Å²	156	47.3 Å²	47.3	96%	0.957	28%	0.282	S	S	*	.			trans	-68.3	0.4	179.9	53.6	0	0	0	0	114.5
153	S	76	Confident	84.2	Confident	36 Å²	36	51.6 Å²	51.6	25%	0.252	30%	0.303	S	S	.	.	S	Bend	trans	-88.5	147.1	-178.9	64.4	0	0	0	0	112	I151 S157	I151-S153 WeakPolarHBondContact CG2-OG 3.3Å; I151-S153 PolarHBondContact O-N 3.3Å; S153-S157 WeakPolarHBondContact CB-OG 3.29Å; S153-S157 PolarHBondContact OG-OG 3.18Å
154	V	76.5	Confident	84.3	Confident	119 Å²	119	51.6 Å²	51.6	72%	0.721	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-65.2	145.9	177.8	-172.4	0	0	0	0	110.8	S157	V154-S157 WeakPolarHBondContact O-CB 3.28Å; V154-S157 PolarHBondContact O-N 3.05Å; V154-S157 VanDerWaalsContact O-N 3.13Å; V154-S157 PolarHBondContact O-OG 3.41Å
155	A	76.9	Confident	84.6	Confident	52 Å²	52	50.7 Å²	50.7	43%	0.43	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	140.9	171.2	0	0	0	0	0	111.8	T147 S157	T147-A155 HydrophobicContact CG2-CB 3.88Å; A155-S157 PolarHBondContact O-N 3.46Å
156	G	80	Confident	84.8	Confident	7 Å²	7	50.8 Å²	50.8	7%	0.072	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	-6.2	-177.1	0	0	0	0	0	115.7	Q144 A192	Q144-G156 WeakPolarHBondContact O-CA 3.14Å; Q144-G156 PolarHBondContact O-N 3.32Å; Q144-G156 VanDerWaalsContact O-N 3.17Å; G156-A192 PolarHBondContact O-N 2.92Å
157	S	83	Confident	84.8	Confident	27 Å²	27	52.7 Å²	52.7	19%	0.189	31%	0.311	C	S	.	.			trans	-64.8	155.7	172.4	71.5	0	0	0	0	111.7	S153 V154 A155 S159 Q160 V161	S153-S157 WeakPolarHBondContact CB-OG 3.29Å; S153-S157 PolarHBondContact OG-OG 3.18Å; V154-S157 WeakPolarHBondContact O-CB 3.28Å; V154-S157 PolarHBondContact O-N 3.05Å; V154-S157 VanDerWaalsContact O-N 3.13Å; V154-S157 PolarHBondContact O-OG 3.41Å; A155-S157 PolarHBondContact O-N 3.46Å; S157-S159 VanDerWaalsContact C-N 3.3Å; S157-S159 PolarHBondContact O-N 2.63Å; S157-Q160 PolarHBondContact O-N 3.45Å; S157-Q160 WeakPolarHBondContact OG-CB 3.44Å; S157-Q160 PolarHBondContact OG-N 3.37Å; S157-V161 WeakPolarHBondContact O-CB 3.44Å; S157-V161 WeakPolarHBondContact O-CG2 2.88Å; S157-V161 PolarHBondContact O-N 3.41Å
158	V	83.4	Confident	85.1	Confident	41 Å²	41	50.6 Å²	50.6	25%	0.248	30%	0.299	C	S	.	.	H	α-helix	trans	-57.3	-41.8	-178.6	179.7	0	0	0	0	112.6	R162 A192 M196	V158-R162 WeakPolarHBondContact O-CB 3.27Å; V158-R162 VanDerWaalsContact O-CG 3.29Å; V158-R162 WeakPolarHBondContact O-CG 3.46Å; V158-R162 PolarHBondContact O-N 3.42Å; V158-R162 VanDerWaalsContact O-N 3.12Å; V158-A192 HydrophobicContact CG2-CB 4.22Å; V158-M196 HydrophobicContact CG1-CE 4.09Å
159	S	85.7	Confident	85.6	Confident	80 Å²	80	52.3 Å²	52.3	56%	0.559	31%	0.308	S	S	*	.	H	α-helix	trans	-65.5	-48.3	179	-58.5	0	0	0	0	111.5	S157 R162 E163	S157-S159 VanDerWaalsContact C-N 3.3Å; S157-S159 PolarHBondContact O-N 2.63Å; S159-R162 PolarHBondContact O-N 3.22Å; S159-E163 PolarHBondContact O-N 3.07Å
160	Q	86.8	Confident	86.5	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	30%	0.3	C	S	.	.	H	α-helix	trans	-58.1	-52.2	178.9	-176.4	56.1	44.2	0	0	111.6	Q148 S157 R162 E163 T164	Q148-Q160 VanDerWaalsContact CB-NE2 3.27Å; Q148-Q160 VanDerWaalsContact CG-NE2 3.33Å; S157-Q160 PolarHBondContact O-N 3.45Å; S157-Q160 WeakPolarHBondContact OG-CB 3.44Å; S157-Q160 PolarHBondContact OG-N 3.37Å; Q160-R162 VanDerWaalsContact C-N 3.3Å; Q160-R162 PolarHBondContact O-N 3.31Å; Q160-E163 PolarHBondContact O-N 2.87Å; Q160-T164 PolarHBondContact NE2-OG1 3.46Å; Q160-T164 VanDerWaalsContact NE2-OG1 3.08Å; Q160-T164 WeakPolarHBondContact O-CB 3.48Å; Q160-T164 PolarHBondContact O-N 2.78Å; Q160-T164 PolarHBondContact O-OG1 3.09Å
161	V	90.9	Very high	87.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-36.7	-176.6	170.2	0	0	0	0	111.5	I143 S157 T165 A192 L197	I143-V161 HydrophobicContact CG1-CG1 4.13Å; I143-V161 HydrophobicContact CG2-CG1 3.95Å; S157-V161 WeakPolarHBondContact O-CB 3.44Å; S157-V161 WeakPolarHBondContact O-CG2 2.88Å; S157-V161 PolarHBondContact O-N 3.41Å; V161-T165 WeakPolarHBondContact O-CB 3.33Å; V161-T165 PolarHBondContact O-N 2.94Å; V161-T165 PolarHBondContact O-OG1 2.82Å; V161-A192 HydrophobicContact CB-CB 3.74Å; V161-A192 HydrophobicContact CG1-CB 3.77Å; V161-A192 HydrophobicContact CG2-CB 3.91Å; V161-L197 HydrophobicContact CG1-CD1 3.69Å; V161-L197 HydrophobicContact CG1-CD2 4.03Å; V161-L197 HydrophobicContact CG1-CG 4.14Å
162	R	90.7	Very high	88.2	Confident	107 Å²	107	44.9 Å²	44.9	40%	0.404	26%	0.259	S	S	.	.	H	α-helix	trans	-66.2	-46.9	174.3	-79.7	179.8	166.1	-178	-3.9	112.4	V158 S159 Q160 T165 A166 M196 L197 M200	V158-R162 WeakPolarHBondContact O-CB 3.27Å; V158-R162 VanDerWaalsContact O-CG 3.29Å; V158-R162 WeakPolarHBondContact O-CG 3.46Å; V158-R162 PolarHBondContact O-N 3.42Å; V158-R162 VanDerWaalsContact O-N 3.12Å; S159-R162 PolarHBondContact O-N 3.22Å; Q160-R162 VanDerWaalsContact C-N 3.3Å; Q160-R162 PolarHBondContact O-N 3.31Å; R162-T165 PolarHBondContact O-N 3.46Å; R162-A166 PolarHBondContact O-N 2.76Å; R162-M196 VanDerWaalsContact NH2-CE 3.34Å; R162-L197 HydrophobicContact CG-CD2 4.02Å; R162-M200 HydrophobicContact CB-SD 4.19Å; R162-M200 HydrophobicContact CG-SD 3.94Å; R162-M200 VanDerWaalsContact O-CE 3.22Å; R162-M200 WeakPolarHBondContact O-CE 3.42Å
163	E	90.7	Very high	89.1	Confident	91 Å²	91	42.4 Å²	42.4	43%	0.425	24%	0.235	S	C	.	.	H	α-helix	trans	-65.9	-43	-178.5	-169.4	59.6	-151.6	0	0	111.2	I151 S159 Q160 T165 A166 E167	I151-E163 HydrophobicContact CD1-CB 3.77Å; I151-E163 HydrophobicContact CD1-CG 3.58Å; S159-E163 PolarHBondContact O-N 3.07Å; Q160-E163 PolarHBondContact O-N 2.87Å; E163-T165 VanDerWaalsContact C-N 3.32Å; E163-T165 PolarHBondContact O-N 3.35Å; E163-A166 WeakPolarHBondContact O-CB 3.33Å; E163-A166 PolarHBondContact O-N 3.18Å; E163-A166 VanDerWaalsContact O-N 3.11Å; E163-E167 PolarHBondContact O-N 2.84Å
164	T	93.8	Very high	89.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-42.1	173.7	-57.3	0	0	0	0	111.8	M123 I143 M146 Q148 Q160 A166 E167 L168	M123-T164 HydrophobicContact CE-CG2 3.96Å; M123-T164 HydrophobicContact CG-CG2 3.57Å; M123-T164 HydrophobicContact SD-CG2 3.49Å; M123-T164 WeakPolarHBondContact SD-CG2 3.48Å; I143-T164 HydrophobicContact CD1-CG2 3.58Å; M146-T164 HydrophobicContact CB-CG2 3.85Å; M146-T164 HydrophobicContact CG-CG2 4.31Å; Q148-T164 PolarHBondContact OE1-OG1 2.9Å; Q160-T164 PolarHBondContact NE2-OG1 3.46Å; Q160-T164 VanDerWaalsContact NE2-OG1 3.08Å; Q160-T164 WeakPolarHBondContact O-CB 3.48Å; Q160-T164 PolarHBondContact O-N 2.78Å; Q160-T164 PolarHBondContact O-OG1 3.09Å; T164-A166 VanDerWaalsContact C-N 3.32Å; T164-A166 PolarHBondContact O-N 2.85Å; T164-E167 PolarHBondContact O-N 3.28Å; T164-L168 HydrophobicContact CG2-CD1 4.19Å; T164-L168 WeakPolarHBondContact O-CG 3.34Å; T164-L168 PolarHBondContact O-N 2.96Å
165	T	94.9	Very high	90.6	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-37.6	175.5	-57.9	0	0	0	0	112	L60 V161 R162 E163 L169 I181 L197 M200 V201	L60-T165 HydrophobicContact CD2-CG2 3.91Å; V161-T165 WeakPolarHBondContact O-CB 3.33Å; V161-T165 PolarHBondContact O-N 2.94Å; V161-T165 PolarHBondContact O-OG1 2.82Å; R162-T165 PolarHBondContact O-N 3.46Å; E163-T165 VanDerWaalsContact C-N 3.32Å; E163-T165 PolarHBondContact O-N 3.35Å; T165-L169 WeakPolarHBondContact O-CB 3.01Å; T165-L169 PolarHBondContact O-N 3.33Å; T165-I181 HydrophobicContact CG2-CD1 4.13Å; T165-L197 HydrophobicContact CG2-CD2 4.14Å; T165-L197 WeakPolarHBondContact OG1-CD1 3.08Å; T165-L197 WeakPolarHBondContact OG1-CD2 3.5Å; T165-M200 HydrophobicContact CG2-CB 4.26Å; T165-M200 HydrophobicContact CG2-CE 4.41Å; T165-V201 HydrophobicContact CG2-CG1 3.84Å
166	A	94.1	Very high	91.3	Very high	35 Å²	35	38.8 Å²	38.8	29%	0.289	21%	0.212	S	C	.	.	H	α-helix	trans	-66.7	-41.2	177.3	0	0	0	0	0	112	R162 E163 T164 L169 K170 M200	R162-A166 PolarHBondContact O-N 2.76Å; E163-A166 WeakPolarHBondContact O-CB 3.33Å; E163-A166 PolarHBondContact O-N 3.18Å; E163-A166 VanDerWaalsContact O-N 3.11Å; T164-A166 VanDerWaalsContact C-N 3.32Å; T164-A166 PolarHBondContact O-N 2.85Å; A166-L169 PolarHBondContact O-N 3.31Å; A166-K170 PolarHBondContact O-N 3.18Å; A166-M200 HydrophobicContact CB-CE 3.83Å
167	E	94.8	Very high	92	Very high	39 Å²	39	38.7 Å²	38.7	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-47.7	174.5	-178.8	164.4	-131.4	0	0	111.4	R13 Q148 E163 T164 L169 K170 L171	R13-E167 IonicContact NH1-OE1 3.17Å; R13-E167 PolarHBondContact NH1-OE1 3.18Å; R13-E167 IonicContact NH1-OE2 3.37Å; Q148-E167 PolarHBondContact NE2-OE2 3.44Å; E163-E167 PolarHBondContact O-N 2.84Å; T164-E167 PolarHBondContact O-N 3.28Å; E167-L169 VanDerWaalsContact C-N 3.33Å; E167-L169 PolarHBondContact O-N 3.35Å; E167-K170 WeakPolarHBondContact O-CB 3.48Å; E167-K170 PolarHBondContact O-N 2.81Å; E167-K170 VanDerWaalsContact O-N 3.11Å; E167-L171 HydrophobicContact CG-CD1 4.43Å; E167-L171 PolarHBondContact O-N 3.28Å
168	L	96.9	Very high	92.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.6	-40.8	175.6	-71.1	171.2	0	0	0	112.3	L60 M123 I140 I143 T164 K170 L171 A172 I179 I181	L60-L168 HydrophobicContact CD1-CB 4.35Å; M123-L168 HydrophobicContact CE-CD2 3.76Å; M123-L168 HydrophobicContact CE-CG 3.95Å; I140-L168 HydrophobicContact CD1-CD2 4.32Å; I140-L168 HydrophobicContact CG1-CD1 3.94Å; I140-L168 HydrophobicContact CG1-CD2 4.14Å; I143-L168 HydrophobicContact CD1-CD1 3.57Å; T164-L168 HydrophobicContact CG2-CD1 4.19Å; T164-L168 WeakPolarHBondContact O-CG 3.34Å; T164-L168 PolarHBondContact O-N 2.96Å; L168-K170 VanDerWaalsContact C-N 3.31Å; L168-K170 PolarHBondContact O-N 2.77Å; L168-L171 HydrophobicContact CD2-CD1 4.47Å; L168-L171 PolarHBondContact O-N 3.16Å; L168-A172 WeakPolarHBondContact O-CB 3Å; L168-A172 PolarHBondContact O-N 3.02Å; L168-I179 HydrophobicContact CD2-CD1 4.31Å; L168-I179 WeakPolarHBondContact O-CD1 3.33Å; L168-I181 HydrophobicContact CD1-CG2 3.79Å
169	L	95.8	Very high	93.5	Very high	42 Å²	42	35.5 Å²	35.5	22%	0.22	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-41.1	175.3	-177.2	63.4	0	0	0	111.5	L60 T165 A166 E167 A172 K173 M200	L60-L169 HydrophobicContact CB-CD1 3.79Å; L60-L169 HydrophobicContact CD2-CB 3.74Å; L60-L169 HydrophobicContact CD2-CD1 4.08Å; L60-L169 HydrophobicContact CD2-CG 4.47Å; T165-L169 WeakPolarHBondContact O-CB 3.01Å; T165-L169 PolarHBondContact O-N 3.33Å; A166-L169 PolarHBondContact O-N 3.31Å; E167-L169 VanDerWaalsContact C-N 3.33Å; E167-L169 PolarHBondContact O-N 3.35Å; L169-A172 PolarHBondContact O-N 3.46Å; L169-K173 HydrophobicContact CD1-CG 4.3Å; L169-K173 VanDerWaalsContact O-CG 3.3Å; L169-K173 WeakPolarHBondContact O-CG 3.43Å; L169-K173 PolarHBondContact O-N 3.33Å; L169-M200 WeakPolarHBondContact CD2-O 3.31Å
170	K	94.7	Very high	94.1	Very high	92 Å²	92	31.7 Å²	31.7	40%	0.4	16%	0.163	S	C	.	.	H	α-helix	trans	-61.5	-47.9	175.3	-174.8	-175.4	179.5	-175.9	0	110.3	N15 A166 E167 L168 A172 K173 T174	N15-K170 PolarHBondContact O-NZ 2.74Å; A166-K170 PolarHBondContact O-N 3.18Å; E167-K170 WeakPolarHBondContact O-CB 3.48Å; E167-K170 PolarHBondContact O-N 2.81Å; E167-K170 VanDerWaalsContact O-N 3.11Å; L168-K170 VanDerWaalsContact C-N 3.31Å; L168-K170 PolarHBondContact O-N 2.77Å; K170-A172 PolarHBondContact O-N 3.22Å; K170-K173 PolarHBondContact O-N 2.82Å; K170-T174 VanDerWaalsContact O-CB 3.3Å; K170-T174 WeakPolarHBondContact O-CB 3.39Å; K170-T174 PolarHBondContact O-N 3.48Å; K170-T174 PolarHBondContact O-OG1 2.88Å
171	L	95.3	Very high	94.6	Very high	15 Å²	15	31.6 Å²	31.6	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-46	177.1	-72.6	171.6	0	0	0	111.8	I130 E167 L168 N175 I179	I130-L171 HydrophobicContact CD1-CD1 4.18Å; E167-L171 HydrophobicContact CG-CD1 4.43Å; E167-L171 PolarHBondContact O-N 3.28Å; L168-L171 HydrophobicContact CD2-CD1 4.47Å; L168-L171 PolarHBondContact O-N 3.16Å; L171-N175 VanDerWaalsContact O-CB 3.31Å; L171-N175 WeakPolarHBondContact O-CB 3.36Å; L171-N175 PolarHBondContact O-N 2.86Å; L171-N175 PolarHBondContact O-ND2 3.33Å; L171-I179 HydrophobicContact CB-CD1 4.37Å
172	A	96.2	Very high	94.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.4	-54.1	176.8	0	0	0	0	0	111.2	G58 L168 L169 K170 G176 I177 I179	G58-A172 VanDerWaalsContact CA-O 3.28Å; G58-A172 WeakPolarHBondContact CA-O 2.98Å; L168-A172 WeakPolarHBondContact O-CB 3Å; L168-A172 PolarHBondContact O-N 3.02Å; L169-A172 PolarHBondContact O-N 3.46Å; K170-A172 PolarHBondContact O-N 3.22Å; A172-G176 WeakPolarHBondContact O-CA 3.25Å; A172-G176 PolarHBondContact O-N 2.98Å; A172-I177 WeakPolarHBondContact CA-O 3.39Å; A172-I177 WeakPolarHBondContact CB-O 3.23Å; A172-I177 PolarHBondContact O-N 3.27Å; A172-I177 VanDerWaalsContact O-N 3.13Å; A172-I179 HydrophobicContact CB-CD1 3.84Å; A172-I179 HydrophobicContact CB-CG1 3.91Å
173	K	93.3	Very high	94.8	Very high	104 Å²	104	26.5 Å²	26.5	45%	0.452	14%	0.143	S	C	.	.	H	α-helix	trans	-67.3	-40.8	-175.5	-64.2	-66.1	172.3	-156	0	113.1	G58 L169 K170 D202	G58-K173 VanDerWaalsContact O-CD 3.28Å; G58-K173 WeakPolarHBondContact O-CD 3.29Å; G58-K173 VanDerWaalsContact O-CE 3.25Å; G58-K173 WeakPolarHBondContact O-CE 3.49Å; G58-K173 PolarHBondContact O-NZ 3.18Å; L169-K173 HydrophobicContact CD1-CG 4.3Å; L169-K173 VanDerWaalsContact O-CG 3.3Å; L169-K173 WeakPolarHBondContact O-CG 3.43Å; L169-K173 PolarHBondContact O-N 3.33Å; K170-K173 PolarHBondContact O-N 2.82Å; K173-D202 VanDerWaalsContact CE-OD2 3.32Å; K173-D202 WeakPolarHBondContact CE-OD2 3.22Å; K173-D202 IonicContact NZ-OD1 3.98Å; K173-D202 IonicContact NZ-OD2 3.29Å; K173-D202 PolarHBondContact NZ-OD2 3.42Å
174	T	91.6	Very high	94.5	Very high	44 Å²	44	23.5 Å²	23.5	27%	0.27	13%	0.129	S	C	.	.	H	α-helix	trans	-71.5	-37.9	-176.9	-63	0	0	0	0	112.2	L19 K170	L19-T174 HydrophobicContact CB-CG2 4.47Å; L19-T174 HydrophobicContact CG-CG2 4.44Å; K170-T174 VanDerWaalsContact O-CB 3.3Å; K170-T174 WeakPolarHBondContact O-CB 3.39Å; K170-T174 PolarHBondContact O-N 3.48Å; K170-T174 PolarHBondContact O-OG1 2.88Å
175	N	92.1	Very high	93.7	Very high	48 Å²	48	26 Å²	26	26%	0.257	15%	0.145	S	C	.	.	H	α-helix	trans	-101.5	-5	-172.8	-59.2	-72.4	0	0	0	113.1	L19 L171 I177	L19-N175 WeakPolarHBondContact CD1-OD1 3.29Å; L171-N175 VanDerWaalsContact O-CB 3.31Å; L171-N175 WeakPolarHBondContact O-CB 3.36Å; L171-N175 PolarHBondContact O-N 2.86Å; L171-N175 PolarHBondContact O-ND2 3.33Å; N175-I177 HydrophobicContact CB-CD1 3.46Å; N175-I177 VanDerWaalsContact CB-CD1 3.46Å; N175-I177 HydrophobicContact CB-CG1 3.54Å; N175-I177 PolarHBondContact O-N 3.11Å
176	G	92.4	Very high	92.5	Very high	38 Å²	38	28 Å²	28	39%	0.392	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	19.4	-175.7	0	0	0	0	0	113.7	P57 G58 A172	P57-G176 WeakPolarHBondContact CB-O 3.4Å; G58-G176 VanDerWaalsContact N-C 3.26Å; G58-G176 PolarHBondContact N-O 2.97Å; A172-G176 WeakPolarHBondContact O-CA 3.25Å; A172-G176 PolarHBondContact O-N 2.98Å
177	I	95.8	Very high	91.1	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	19%	0.187	C	C	.	.			trans	-85.6	134.6	-175	-55.5	174.6	0	0	0	109.5	G58 I130 P135 D136 V138 A172 N175 I179	G58-I177 WeakPolarHBondContact CA-O 3.46Å; G58-I177 PolarHBondContact N-O 3.38Å; G58-I177 VanDerWaalsContact N-O 3.17Å; I130-I177 HydrophobicContact CG2-CD1 3.49Å; I130-I177 VanDerWaalsContact CG2-CD1 3.49Å; P135-I177 VanDerWaalsContact O-CG1 3.31Å; P135-I177 WeakPolarHBondContact O-CG1 3.43Å; D136-I177 WeakPolarHBondContact O-CG2 3.4Å; V138-I177 HydrophobicContact CB-CG2 4.36Å; V138-I177 HydrophobicContact CG2-CG2 3.75Å; A172-I177 WeakPolarHBondContact CA-O 3.39Å; A172-I177 WeakPolarHBondContact CB-O 3.23Å; A172-I177 PolarHBondContact O-N 3.27Å; A172-I177 VanDerWaalsContact O-N 3.13Å; N175-I177 HydrophobicContact CB-CD1 3.46Å; N175-I177 VanDerWaalsContact CB-CD1 3.46Å; N175-I177 HydrophobicContact CB-CG1 3.54Å; N175-I177 PolarHBondContact O-N 3.11Å; I177-I179 HydrophobicContact CB-CG1 4.39Å; I177-I179 HydrophobicContact CG2-CD1 4.5Å; I177-I179 HydrophobicContact CG2-CG1 3.91Å
178	A	97.6	Very high	89.3	Confident	1 Å²	1	41 Å²	41	1%	0.008	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	121.3	169.5	0	0	0	0	0	110	V55 V56 D136 Y137 V138	V55-A178 HydrophobicContact CG1-CB 3.51Å; V56-A178 WeakPolarHBondContact O-CB 3.18Å; D136-A178 PolarHBondContact O-N 3.06Å; Y137-A178 VanDerWaalsContact CA-O 3.3Å; Y137-A178 WeakPolarHBondContact CA-O 3.13Å; Y137-A178 HydrophobicContact CD1-CB 3.84Å; Y137-A178 HydrophobicContact CE1-CB 4.22Å; V138-A178 PolarHBondContact N-O 3.5Å
179	I	98.4	Very high	87.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.4	-175.2	-53.1	-169.3	0	0	0	110.2	S59 L60 V61 V138 I140 L168 L171 A172 I177 I181	S59-I179 PolarHBondContact O-N 3.45Å; L60-I179 WeakPolarHBondContact CA-O 3.13Å; L60-I179 HydrophobicContact CD1-CB 3.69Å; L60-I179 HydrophobicContact CD1-CG2 3.64Å; V61-I179 PolarHBondContact N-O 3.06Å; V138-I179 HydrophobicContact CB-CD1 4.49Å; V138-I179 HydrophobicContact CB-CG1 4.11Å; V138-I179 HydrophobicContact CB-CG2 4.28Å; V138-I179 HydrophobicContact CG1-CG2 4.37Å; V138-I179 CarbonylContact O-C 3.54Å; V138-I179 VanDerWaalsContact O-CA 3.3Å; V138-I179 WeakPolarHBondContact O-CA 3.46Å; I140-I179 HydrophobicContact CG1-CG2 4.47Å; L168-I179 HydrophobicContact CD2-CD1 4.31Å; L168-I179 WeakPolarHBondContact O-CD1 3.33Å; L171-I179 HydrophobicContact CB-CD1 4.37Å; A172-I179 HydrophobicContact CB-CD1 3.84Å; A172-I179 HydrophobicContact CB-CG1 3.91Å; I177-I179 HydrophobicContact CB-CG1 4.39Å; I177-I179 HydrophobicContact CG2-CD1 4.5Å; I177-I179 HydrophobicContact CG2-CG1 3.91Å; I179-I181 HydrophobicContact CG2-CG2 3.97Å
180	F	98.3	Very high	85.3	Confident	1 Å²	1	49.3 Å²	49.3	0%	0.004	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.9	168.1	-68.2	-94	0	0	0	109.9	L51 V55 V61 I63 L75 L82 V138 I139 I140	L51-F180 HydrophobicContact CD1-CZ 4.39Å; V55-F180 HydrophobicContact CG1-CE2 3.89Å; V55-F180 HydrophobicContact CG1-CZ 4.01Å; V55-F180 HydrophobicContact CG2-CE2 4.27Å; V55-F180 HydrophobicContact CG2-CZ 3.87Å; V61-F180 HydrophobicContact CB-CD1 3.7Å; V61-F180 HydrophobicContact CB-CE1 3.88Å; V61-F180 HydrophobicContact CB-CG 4.39Å; V61-F180 HydrophobicContact CG1-CD1 3.83Å; V61-F180 HydrophobicContact CG1-CE1 3.85Å; V61-F180 HydrophobicContact CG2-CD1 4.34Å; V61-F180 HydrophobicContact CG2-CE1 4.08Å; V61-F180 HydrophobicContact CG2-CZ 4.48Å; V61-F180 CarbonylContact O-C 3.51Å; V61-F180 WeakPolarHBondContact O-CA 3.39Å; I63-F180 HydrophobicContact CD1-CD1 4.17Å; L75-F180 HydrophobicContact CD2-CB 3.72Å; L75-F180 HydrophobicContact CD2-CD1 4.07Å; L75-F180 HydrophobicContact CD2-CG 3.97Å; L82-F180 HydrophobicContact CD1-CE2 4.37Å; V138-F180 PolarHBondContact O-N 3.35Å; I139-F180 CarbonylContact C-O 3.48Å; I139-F180 WeakPolarHBondContact CA-O 3.32Å; I139-F180 HydrophobicContact CG1-CB 4.35Å; I140-F180 PolarHBondContact N-O 2.96Å
181	I	97.3	Very high	83.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.6	175.3	65.8	175.3	0	0	0	110.1	L60 V61 L62 I63 I140 T165 L168 I179 L197 V201	L60-I181 HydrophobicContact CD1-CD1 4.4Å; L60-I181 HydrophobicContact CD1-CG2 3.83Å; V61-I181 PolarHBondContact O-N 2.9Å; L62-I181 WeakPolarHBondContact CA-O 3.29Å; L62-I181 HydrophobicContact CB-CD1 4.37Å; L62-I181 HydrophobicContact CB-CG1 4.06Å; L62-I181 HydrophobicContact CD1-CD1 4.03Å; L62-I181 HydrophobicContact CD1-CG1 3.75Å; I63-I181 PolarHBondContact N-O 2.73Å; I140-I181 HydrophobicContact CB-CB 4.47Å; I140-I181 HydrophobicContact CB-CG2 4.01Å; I140-I181 HydrophobicContact CG1-CG2 4.1Å; I140-I181 WeakPolarHBondContact O-CA 3.43Å; T165-I181 HydrophobicContact CG2-CD1 4.13Å; L168-I181 HydrophobicContact CD1-CG2 3.79Å; I179-I181 HydrophobicContact CG2-CG2 3.97Å; I181-L197 HydrophobicContact CD1-CD1 4.45Å; I181-V201 HydrophobicContact CD1-CG1 4.09Å
182	V	95.5	Very high	81.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131	172.9	178.1	0	0	0	0	109.9	K71 L75 I140 D141 I143	K71-V182 HydrophobicContact CB-CG1 4.32Å; K71-V182 HydrophobicContact CD-CG1 3.93Å; L75-V182 HydrophobicContact CD1-CG2 3.08Å; I140-V182 PolarHBondContact O-N 2.89Å; D141-V182 HydrophobicContact CB-CG2 4.19Å; D141-V182 WeakPolarHBondContact OD1-CG2 3.2Å; I143-V182 VanDerWaalsContact CG2-O 3.31Å; I143-V182 WeakPolarHBondContact CG2-O 3.47Å; I143-V182 PolarHBondContact N-O 3.18Å
183	G	91.6	Very high	80.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	112.4	171.5	0	0	0	0	0	111.9	I63 G64 G65	I63-G183 PolarHBondContact O-N 2.8Å; G64-G183 WeakPolarHBondContact CA-O 3.37Å; G65-G183 PolarHBondContact N-O 2.63Å
184	H	83.6	Confident	80.1	Confident	29 Å²	29	43.7 Å²	43.7	13%	0.134	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.4	173.4	-72.5	132.5	0	0	0	113	K71 E95 Q144 T186 P194	K71-H184 VanDerWaalsContact CE-CD2 3.42Å; K71-H184 WeakPolarHBondContact CE-CD2 3.47Å; K71-H184 PolarHBondContact NZ-CD2 3.44Å; K71-H184 PolarHBondContact NZ-NE2 3.27Å; E95-H184 IonicContact OE1-CE1 3.5Å; E95-H184 PolarHBondContact OE1-CE1 2.97Å; E95-H184 IonicContact OE1-ND1 3.42Å; E95-H184 PolarHBondContact OE1-ND1 3.13Å; E95-H184 IonicContact OE2-CE1 3.43Å; Q144-H184 PolarHBondContact NE2-O 3.36Å; Q144-H184 VanDerWaalsContact OE1-N 3.11Å; H184-T186 PolarHBondContact O-N 3.22Å; H184-P194 WeakPolarHBondContact O-CD 3.38Å
185	V	77.4	Confident	79.7	Confident	53 Å²	53	50.9 Å²	50.9	32%	0.321	28%	0.276	S	S	.	.			trans	-71.1	125.2	168.9	178	0	0	0	0	108.4	G65 P194	G65-V185 PolarHBondContact O-N 3.22Å; V185-P194 HydrophobicContact CG2-CG 3.88Å
186	T	69.7	Low	79.3	Confident	42 Å²	42	52.7 Å²	52.7	26%	0.258	28%	0.284	S	S	.	.			trans	-110.9	144.7	177.7	59.1	0	0	0	0	110.1	H184 I191	H184-T186 PolarHBondContact O-N 3.22Å; T186-I191 HydrophobicContact CG2-CB 3.77Å; T186-I191 HydrophobicContact CG2-CG2 3.51Å; T186-I191 PolarHBondContact OG1-O 3.46Å
187	K	64.1	Low	79.1	Confident	215 Å²	215	51 Å²	51	94%	0.935	27%	0.266	S	S	*	.	S	Bend	trans	-86.2	-15.3	173.6	-65.8	-175.2	-179.7	-178.8	0	112.3
188	E	57.9	Low	78.9	Confident	132 Å²	132	52.5 Å²	52.5	62%	0.617	27%	0.273	S	S	*	.	S	Bend	trans	-103.7	132.8	-174	-61.4	-175	-179	0	0	110.8	N190 I191	E188-N190 PolarHBondContact O-N 3.03Å; E188-N190 VanDerWaalsContact O-N 3.13Å; E188-I191 PolarHBondContact O-N 3.08Å
189	G	54.8	Low	78.5	Confident	77 Å²	77	60 Å²	60	79%	0.794	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-9.8	-174.8	0	0	0	0	0	115.7
190	N	53.7	Low	78.2	Confident	140 Å²	140	62.7 Å²	62.7	75%	0.749	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-24	-179	-67.4	-20.2	0	0	0	113.3	E188	E188-N190 PolarHBondContact O-N 3.03Å; E188-N190 VanDerWaalsContact O-N 3.13Å
191	I	58.5	Low	78	Confident	71 Å²	71	62.6 Å²	62.6	36%	0.364	32%	0.32	S	S	.	.	S	Bend	trans	-103	133.3	-179.2	-56.3	173.9	0	0	0	108.9	Q144 T186 E188 G193	Q144-I191 HydrophobicContact CG-CG2 4.27Å; T186-I191 HydrophobicContact CG2-CB 3.77Å; T186-I191 HydrophobicContact CG2-CG2 3.51Å; T186-I191 PolarHBondContact OG1-O 3.46Å; E188-I191 PolarHBondContact O-N 3.08Å; I191-G193 PolarHBondContact O-N 3.43Å; I191-G193 VanDerWaalsContact O-N 3.09Å
192	A	60.3	Low	77.9	Confident	2 Å²	2	62.8 Å²	62.8	2%	0.017	32%	0.321	C	S	.	.			trans	-62.1	113.5	-179.2	0	0	0	0	0	111.6	Q144 G156 V158 V161	Q144-A192 PolarHBondContact NE2-O 2.99Å; G156-A192 PolarHBondContact O-N 2.92Å; V158-A192 HydrophobicContact CG2-CB 4.22Å; V161-A192 HydrophobicContact CB-CB 3.74Å; V161-A192 HydrophobicContact CG1-CB 3.77Å; V161-A192 HydrophobicContact CG2-CB 3.91Å
193	G	74.7	Confident	78	Confident	15 Å²	15	63 Å²	63	16%	0.155	32%	0.322	C	S	.	.			trans	-78.6	158.3	166.3	0	0	0	0	0	111.7	I191 R195 M196	I191-G193 PolarHBondContact O-N 3.43Å; I191-G193 VanDerWaalsContact O-N 3.09Å; G193-R195 PolarHBondContact O-N 3.3Å; G193-R195 VanDerWaalsContact O-N 3.08Å; G193-M196 PolarHBondContact O-N 2.93Å
194	P	77.3	Confident	78.2	Confident	4 Å²	4	63 Å²	63	3%	0.026	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-56	-30.6	-178.9	21.2	-33.7	0	0	0	113.3	L62 H184 V185 M196 L197 E198 Y206	L62-P194 HydrophobicContact CD2-CB 3.97Å; L62-P194 HydrophobicContact CG-CB 4.5Å; H184-P194 WeakPolarHBondContact O-CD 3.38Å; V185-P194 HydrophobicContact CG2-CG 3.88Å; P194-M196 PolarHBondContact O-N 3.49Å; P194-M196 VanDerWaalsContact O-N 3.11Å; P194-L197 PolarHBondContact O-N 2.6Å; P194-E198 PolarHBondContact O-N 2.76Å; P194-Y206 HydrophobicContact CB-CE1 4.13Å; P194-Y206 HydrophobicContact CG-CE1 3.64Å
195	R	82.6	Confident	78.7	Confident	196 Å²	196	61.6 Å²	61.6	74%	0.74	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-52.2	-33.9	176.3	-70.5	-173.4	177.3	179.4	0.2	113.9	G193 L197 E198 Y206	G193-R195 PolarHBondContact O-N 3.3Å; G193-R195 VanDerWaalsContact O-N 3.08Å; R195-L197 PolarHBondContact O-N 3.12Å; R195-E198 PolarHBondContact O-N 3.23Å; R195-Y206 WeakPolarHBondContact CG-OH 3.41Å; R195-Y206 PolarHBondContact N-OH 3.02Å
196	M	84.3	Confident	79.5	Confident	85 Å²	85	60.1 Å²	60.1	42%	0.419	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-73.5	-17.1	-177.5	-63.8	-58.6	-75.4	0	0	113.5	V158 R162 G193 P194	V158-M196 HydrophobicContact CG1-CE 4.09Å; R162-M196 VanDerWaalsContact NH2-CE 3.34Å; G193-M196 PolarHBondContact O-N 2.93Å; P194-M196 PolarHBondContact O-N 3.49Å; P194-M196 VanDerWaalsContact O-N 3.11Å
197	L	88.6	Confident	80.5	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.01	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-102	-10.3	-178.5	-63.3	-178.3	0	0	0	113.2	L62 I143 V161 R162 T165 I181 P194 R195 H199 M200 V201	L62-L197 HydrophobicContact CD2-CB 3.92Å; I143-L197 HydrophobicContact CG2-CD1 4.21Å; V161-L197 HydrophobicContact CG1-CD1 3.69Å; V161-L197 HydrophobicContact CG1-CD2 4.03Å; V161-L197 HydrophobicContact CG1-CG 4.14Å; R162-L197 HydrophobicContact CG-CD2 4.02Å; T165-L197 HydrophobicContact CG2-CD2 4.14Å; T165-L197 WeakPolarHBondContact OG1-CD1 3.08Å; T165-L197 WeakPolarHBondContact OG1-CD2 3.5Å; I181-L197 HydrophobicContact CD1-CD1 4.45Å; P194-L197 PolarHBondContact O-N 2.6Å; R195-L197 PolarHBondContact O-N 3.12Å; L197-H199 PolarHBondContact O-N 2.78Å; L197-H199 VanDerWaalsContact O-N 3.1Å; L197-M200 HydrophobicContact CD2-SD 4.07Å; L197-M200 WeakPolarHBondContact O-CB 3.41Å; L197-M200 PolarHBondContact O-N 2.79Å; L197-V201 PolarHBondContact O-N 3.17Å
198	E	90.7	Very high	81.6	Confident	38 Å²	38	51.6 Å²	51.6	18%	0.178	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-38.4	-170.7	-69.7	-177.5	-177.9	0	0	113.2	P194 R195 M200 V204 Y206 K222	P194-E198 PolarHBondContact O-N 2.76Å; R195-E198 PolarHBondContact O-N 3.23Å; E198-M200 VanDerWaalsContact C-N 3.33Å; E198-M200 PolarHBondContact O-N 3.21Å; E198-V204 HydrophobicContact CB-CG2 3.99Å; E198-V204 HydrophobicContact CG-CG1 4.03Å; E198-V204 HydrophobicContact CG-CG2 3.98Å; E198-Y206 WeakPolarHBondContact OE1-CE2 3.39Å; E198-Y206 PolarHBondContact OE1-OH 3.43Å; E198-K222 WeakPolarHBondContact O-CD 3.42Å; E198-K222 WeakPolarHBondContact O-CE 3.39Å; E198-K222 PolarHBondContact O-NZ 2.95Å
199	H	88.7	Confident	82.5	Confident	159 Å²	159	46.8 Å²	46.8	74%	0.736	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-23.2	-179.7	-64.2	-63.9	0	0	0	113.6	L197 K222	L197-H199 PolarHBondContact O-N 2.78Å; L197-H199 VanDerWaalsContact O-N 3.1Å; H199-K222 VanDerWaalsContact C-NZ 3.27Å; H199-K222 PolarHBondContact O-NZ 3.18Å
200	M	92.1	Very high	83.1	Confident	55 Å²	55	46.6 Å²	46.6	27%	0.271	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-40.2	-174.6	-60.8	-178.1	63.6	0	0	112.7	R162 T165 A166 L169 L197 E198	R162-M200 HydrophobicContact CB-SD 4.19Å; R162-M200 HydrophobicContact CG-SD 3.94Å; R162-M200 VanDerWaalsContact O-CE 3.22Å; R162-M200 WeakPolarHBondContact O-CE 3.42Å; T165-M200 HydrophobicContact CG2-CB 4.26Å; T165-M200 HydrophobicContact CG2-CE 4.41Å; A166-M200 HydrophobicContact CB-CE 3.83Å; L169-M200 WeakPolarHBondContact CD2-O 3.31Å; L197-M200 HydrophobicContact CD2-SD 4.07Å; L197-M200 WeakPolarHBondContact O-CB 3.41Å; L197-M200 PolarHBondContact O-N 2.79Å; E198-M200 VanDerWaalsContact C-N 3.33Å; E198-M200 PolarHBondContact O-N 3.21Å
201	V	95.1	Very high	83.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	-81.7	165.1	-176.1	-55.6	0	0	0	0	112.2	L60 L62 T165 I181 L197 T203 V204 K222	L60-V201 HydrophobicContact CD2-CB 4.32Å; L60-V201 HydrophobicContact CD2-CG1 3.73Å; L60-V201 HydrophobicContact CG-CB 4.21Å; L60-V201 HydrophobicContact CG-CG1 3.92Å; L62-V201 HydrophobicContact CB-CB 4.43Å; L62-V201 HydrophobicContact CB-CG1 4.16Å; L62-V201 HydrophobicContact CB-CG2 3.91Å; T165-V201 HydrophobicContact CG2-CG1 3.84Å; I181-V201 HydrophobicContact CD1-CG1 4.09Å; L197-V201 PolarHBondContact O-N 3.17Å; V201-T203 WeakPolarHBondContact CG2-O 3.19Å; V201-V204 HydrophobicContact CG2-CG2 3.37Å; V201-K222 WeakPolarHBondContact O-CE 3.47Å; V201-K222 PolarHBondContact O-NZ 2.88Å
202	D	95.5	Very high	83.4	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.021	26%	0.256	C	S	.	.	S	Bend	trans	-81.9	-37.4	178.1	-66.7	-57	0	0	0	112.4	L60 K173 R224 F225	L60-D202 PolarHBondContact N-OD2 2.82Å; L60-D202 PolarHBondContact O-N 2.82Å; K173-D202 VanDerWaalsContact CE-OD2 3.32Å; K173-D202 WeakPolarHBondContact CE-OD2 3.22Å; K173-D202 IonicContact NZ-OD1 3.98Å; K173-D202 IonicContact NZ-OD2 3.29Å; K173-D202 PolarHBondContact NZ-OD2 3.42Å; D202-R224 HydrophobicContact CB-CB 4.48Å; D202-R224 WeakPolarHBondContact O-CG 3.4Å; D202-R224 PolarHBondContact O-N 3.39Å; D202-R224 VanDerWaalsContact O-N 3.12Å; D202-R224 WeakPolarHBondContact OD1-CD 3.48Å; D202-R224 IonicContact OD1-CZ 3.3Å; D202-R224 IonicContact OD1-NH1 3.84Å; D202-R224 PolarHBondContact OD1-NH1 2.87Å; D202-R224 VanDerWaalsContact OD1-NH1 3.16Å; D202-F225 HydrophobicContact CB-CD2 4.44Å; D202-F225 HydrophobicContact CB-CE2 3.49Å; D202-F225 VanDerWaalsContact CB-CE2 3.49Å; D202-F225 HydrophobicContact CB-CZ 3.99Å
203	T	96.3	Very high	83.6	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.2	180	-61.7	0	0	0	0	110.2	L51 L60 V61 L62 V201 L205 K222 N223	L51-T203 HydrophobicContact CD2-CG2 4.33Å; L60-T203 PolarHBondContact O-N 2.79Å; V61-T203 WeakPolarHBondContact CA-O 3.35Å; V61-T203 HydrophobicContact CG1-CG2 4.15Å; L62-T203 PolarHBondContact N-O 2.93Å; V201-T203 WeakPolarHBondContact CG2-O 3.19Å; T203-L205 HydrophobicContact CG2-CD2 3.57Å; T203-L205 HydrophobicContact CG2-CG 4.02Å; T203-K222 CarbonylContact C-O 3.51Å; T203-K222 VanDerWaalsContact CA-O 3.29Å; T203-K222 WeakPolarHBondContact CA-O 3.31Å; T203-K222 WeakPolarHBondContact CG2-O 3.42Å; T203-N223 HydrophobicContact CG2-CB 4.26Å; T203-N223 PolarHBondContact OG1-OD1 2.7Å
204	V	95.6	Very high	83.4	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119	175.5	-179.4	0	0	0	0	108	L62 E198 V201 Y206 V221 K222	L62-V204 HydrophobicContact CD2-CG1 4.32Å; L62-V204 HydrophobicContact CD2-CG2 4.46Å; E198-V204 HydrophobicContact CB-CG2 3.99Å; E198-V204 HydrophobicContact CG-CG1 4.03Å; E198-V204 HydrophobicContact CG-CG2 3.98Å; V201-V204 HydrophobicContact CG2-CG2 3.37Å; V204-Y206 HydrophobicContact CG1-CD2 4.2Å; V204-Y206 HydrophobicContact CG1-CE2 3.84Å; V204-V221 PolarHBondContact O-N 2.94Å; V204-K222 HydrophobicContact CB-CB 3.91Å; V204-K222 HydrophobicContact CG2-CB 3.82Å; V204-K222 HydrophobicContact CG2-CD 4.15Å; V204-K222 PolarHBondContact N-O 2.76Å; V204-K222 PolarHBondContact O-N 3.38Å
205	L	95.3	Very high	83.6	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.6	174.3	-49.7	-172.8	0	0	0	109.3	L47 V50 L51 V61 L62 I63 G64 T203 L218 R219 A220	L47-L205 HydrophobicContact CD1-CD1 4.44Å; V50-L205 HydrophobicContact CG1-CD1 3.94Å; V50-L205 HydrophobicContact CG1-CD2 3.41Å; V50-L205 VanDerWaalsContact CG1-CD2 3.41Å; V50-L205 HydrophobicContact CG1-CG 4.24Å; L51-L205 HydrophobicContact CD2-CD1 3.91Å; V61-L205 HydrophobicContact CG1-CD1 4.24Å; V61-L205 HydrophobicContact CG1-CG 4.25Å; L62-L205 PolarHBondContact O-N 2.84Å; I63-L205 CarbonylContact C-O 3.47Å; I63-L205 WeakPolarHBondContact CA-O 3.26Å; G64-L205 PolarHBondContact N-O 3.06Å; T203-L205 HydrophobicContact CG2-CD2 3.57Å; T203-L205 HydrophobicContact CG2-CG 4.02Å; L205-L218 HydrophobicContact CB-CD1 3.87Å; L205-L218 HydrophobicContact CB-CG 4.35Å; L205-L218 HydrophobicContact CD1-CD1 4.3Å; L205-L218 HydrophobicContact CD1-CD2 4.03Å; L205-L218 HydrophobicContact CD1-CG 4.24Å; L205-R219 CarbonylContact C-O 3.59Å; L205-R219 VanDerWaalsContact CA-O 3.24Å; L205-R219 WeakPolarHBondContact CA-O 3.48Å; L205-A220 HydrophobicContact CD2-CB 3.84Å
206	Y	92.9	Very high	83.8	Confident	22 Å²	22	51.7 Å²	51.7	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.2	168.7	-79.4	-79.7	0	0	0	109.8	G64 P194 R195 E198 V204 L218 R219 V221	G64-Y206 CarbonylContact O-C 3.52Å; G64-Y206 WeakPolarHBondContact O-CA 3.31Å; P194-Y206 HydrophobicContact CB-CE1 4.13Å; P194-Y206 HydrophobicContact CG-CE1 3.64Å; R195-Y206 WeakPolarHBondContact CG-OH 3.41Å; R195-Y206 PolarHBondContact N-OH 3.02Å; E198-Y206 WeakPolarHBondContact OE1-CE2 3.39Å; E198-Y206 PolarHBondContact OE1-OH 3.43Å; V204-Y206 HydrophobicContact CG1-CD2 4.2Å; V204-Y206 HydrophobicContact CG1-CE2 3.84Å; Y206-L218 CarbonylContact O-C 3.58Å; Y206-L218 WeakPolarHBondContact O-CA 3.22Å; Y206-R219 PolarHBondContact N-O 3.21Å; Y206-R219 PolarHBondContact O-N 3.47Å; Y206-V221 HydrophobicContact CD2-CB 4.06Å; Y206-V221 HydrophobicContact CD2-CG2 3.5Å; Y206-V221 HydrophobicContact CE2-CB 4.22Å; Y206-V221 HydrophobicContact CE2-CG1 4.49Å; Y206-V221 HydrophobicContact CE2-CG2 4.01Å
207	F	92.3	Very high	84	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	110.5	172.8	-158.4	-146.9	0	0	0	109.3	I63 G64 I69 K71 R216 I217 L218 F234 L241	I63-F207 HydrophobicContact CG2-CB 4.4Å; G64-F207 PolarHBondContact O-N 3.28Å; I69-F207 HydrophobicContact CG1-CD1 4.45Å; I69-F207 HydrophobicContact CG2-CB 4.3Å; I69-F207 HydrophobicContact CG2-CD1 3.87Å; I69-F207 HydrophobicContact CG2-CG 4.41Å; K71-F207 HydrophobicContact CG-CB 4.29Å; K71-F207 HydrophobicContact CG-CD1 4.22Å; F207-R216 HydrophobicContact CD2-CB 4.32Å; F207-R216 HydrophobicContact CE1-CB 4.3Å; F207-R216 HydrophobicContact CE2-CB 3.44Å; F207-R216 VanDerWaalsContact CE2-CB 3.44Å; F207-R216 HydrophobicContact CZ-CB 3.42Å; F207-R216 VanDerWaalsContact CZ-CB 3.42Å; F207-R216 HydrophobicContact CZ-CG 4.08Å; F207-I217 WeakPolarHBondContact CA-O 3.14Å; F207-L218 HydrophobicContact CB-CD1 4Å; F207-L218 HydrophobicContact CD2-CB 3.91Å; F207-L218 HydrophobicContact CD2-CD1 3.88Å; F207-L218 HydrophobicContact CE2-CB 4.26Å; F207-L218 HydrophobicContact CG-CD1 4.19Å; F207-F234 AromaticContact CE2-CD2 3.94Å; F207-F234 HydrophobicContact CE2-CD2 3.94Å; F207-F234 HydrophobicContact CZ-CD2 4.45Å; F207-L241 HydrophobicContact CE1-CD1 3.79Å; F207-L241 HydrophobicContact CE1-CD2 4.32Å; F207-L241 HydrophobicContact CZ-CD1 3.71Å; F207-L241 HydrophobicContact CZ-CD2 3.83Å; F207-L241 HydrophobicContact CZ-CG 4.45Å
208	E	86.3	Confident	84.2	Confident	77 Å²	77	49.3 Å²	49.3	36%	0.36	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.2	-167.1	-59.4	176.7	159.3	0	0	109.9	R216 I217 R219	E208-R216 CarbonylContact O-C 3.52Å; E208-R216 VanDerWaalsContact O-CA 3.31Å; E208-R216 WeakPolarHBondContact O-CA 3.34Å; E208-I217 PolarHBondContact N-O 2.69Å; E208-I217 PolarHBondContact O-N 3.28Å; E208-R219 IonicContact OE2-CZ 2.7Å; E208-R219 IonicContact OE2-NE 3.02Å; E208-R219 PolarHBondContact OE2-NE 2.91Å; E208-R219 IonicContact OE2-NH2 3.56Å; E208-R219 PolarHBondContact OE2-NH2 2.71Å
209	G	77.6	Confident	84.2	Confident	31 Å²	31	49.6 Å²	49.6	32%	0.32	24%	0.24	S	C	.	.			trans	169.1	147	173.4	0	0	0	0	0	110.7	I69	I69-G209 WeakPolarHBondContact CD1-O 3.23Å
210	E	67.5	Low	84.3	Confident	73 Å²	73	42.1 Å²	42.1	34%	0.341	21%	0.205	S	C	.	.			trans	-82.8	150.2	177.2	-56.9	-151.8	142.2	0	0	111.3	H212 H213 R216 K331	E210-H212 PolarHBondContact O-N 3.23Å; E210-H212 VanDerWaalsContact O-N 3.16Å; E210-H213 HydrophobicContact CB-CB 4.34Å; E210-H213 PolarHBondContact O-N 2.78Å; E210-H213 VanDerWaalsContact O-N 3.16Å; E210-H213 IonicContact OE2-CD2 3.06Å; E210-H213 PolarHBondContact OE2-CD2 3.06Å; E210-H213 VanDerWaalsContact OE2-CD2 3.25Å; E210-H213 IonicContact OE2-NE2 2.67Å; E210-H213 PolarHBondContact OE2-NE2 2.88Å; E210-R216 PolarHBondContact O-NH1 2.67Å; E210-K331 WeakPolarHBondContact OE1-CE 3.47Å; E210-K331 IonicContact OE1-NZ 2.72Å; E210-K331 PolarHBondContact OE1-NZ 2.73Å
211	K	60.6	Low	84.1	Confident	198 Å²	198	42.6 Å²	42.6	86%	0.861	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.1	-177.1	-72.1	-174.6	176	-175.6	0	113.9
212	H	56.8	Low	84	Confident	177 Å²	177	44.4 Å²	44.4	82%	0.819	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98	-1.1	-175.2	-60.5	-61.8	0	0	0	113.8	E210	E210-H212 PolarHBondContact O-N 3.23Å; E210-H212 VanDerWaalsContact O-N 3.16Å
213	H	64.9	Low	83.9	Confident	52 Å²	52	44.9 Å²	44.9	24%	0.241	22%	0.222	C	C	.	.			trans	-102.7	142.3	178.1	-65.3	-44.6	0	0	0	109.7	E210 F215 R216 G329	E210-H213 HydrophobicContact CB-CB 4.34Å; E210-H213 PolarHBondContact O-N 2.78Å; E210-H213 VanDerWaalsContact O-N 3.16Å; E210-H213 IonicContact OE2-CD2 3.06Å; E210-H213 PolarHBondContact OE2-CD2 3.06Å; E210-H213 VanDerWaalsContact OE2-CD2 3.25Å; E210-H213 IonicContact OE2-NE2 2.67Å; E210-H213 PolarHBondContact OE2-NE2 2.88Å; H213-F215 VanDerWaalsContact C-N 3.27Å; H213-R216 PolarHBondContact O-NH1 3.46Å; H213-G329 WeakPolarHBondContact CD2-CA 3.33Å; H213-G329 PolarHBondContact CD2-O 2.83Å; H213-G329 WeakPolarHBondContact CE1-CA 3.27Å; H213-G329 VanDerWaalsContact ND1-CA 3.33Å; H213-G329 WeakPolarHBondContact ND1-CA 3.33Å; H213-G329 WeakPolarHBondContact NE2-CA 3.4Å
214	S	70.2	Confident	83.5	Confident	54 Å²	54	52.3 Å²	52.3	38%	0.378	25%	0.249	S	C	.	.	S	Bend	trans	-71.6	-28.3	-179.7	54.1	0	0	0	0	111.4	M236	S214-M236 PolarHBondContact O-N 3.07Å
215	F	81.7	Confident	83.2	Confident	22 Å²	22	53.9 Å²	53.9	10%	0.096	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	146.4	-176.3	-61.3	-60.4	0	0	0	114.2	H213 I233 F234 E235 V244 V250 F251	H213-F215 VanDerWaalsContact C-N 3.27Å; F215-I233 HydrophobicContact CB-CG2 4.49Å; F215-I233 HydrophobicContact CD1-CG2 4.06Å; F215-I233 HydrophobicContact CG-CG2 4.48Å; F215-F234 CarbonylContact C-O 3.58Å; F215-F234 VanDerWaalsContact CA-O 3.31Å; F215-F234 WeakPolarHBondContact CA-O 3.44Å; F215-E235 HydrophobicContact CD1-CB 4.35Å; F215-E235 HydrophobicContact CE1-CB 4.41Å; F215-V244 HydrophobicContact CD1-CG1 4.42Å; F215-V244 HydrophobicContact CD1-CG2 3.87Å; F215-V244 HydrophobicContact CE1-CB 4.23Å; F215-V244 HydrophobicContact CE1-CG1 3.75Å; F215-V244 HydrophobicContact CE1-CG2 3.64Å; F215-V244 HydrophobicContact CZ-CG1 4.47Å; F215-V250 HydrophobicContact CE2-CG1 4.37Å; F215-V250 HydrophobicContact CZ-CB 3.92Å; F215-V250 HydrophobicContact CZ-CG1 3.74Å; F215-V250 HydrophobicContact CZ-CG2 4.27Å; F215-F251 AromaticContact CD2-CE1 3.59Å; F215-F251 HydrophobicContact CD2-CE1 3.59Å; F215-F251 AromaticContact CD2-CZ 3.59Å; F215-F251 HydrophobicContact CD2-CZ 3.59Å; F215-F251 HydrophobicContact CE2-CD1 4.06Å; F215-F251 AromaticContact CE2-CE1 3.23Å; F215-F251 HydrophobicContact CE2-CE1 3.23Å; F215-F251 AromaticContact CE2-CZ 3.5Å; F215-F251 HydrophobicContact CE2-CZ 3.5Å; F215-F251 VanDerWaalsContact CE2-CZ 3.5Å; F215-F251 HydrophobicContact CZ-CE1 4.31Å; F215-F251 HydrophobicContact CZ-CZ 4.41Å
216	R	87.5	Confident	82.8	Confident	31 Å²	31	55.5 Å²	55.5	12%	0.117	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.3	173.6	-57.1	-68.7	178.8	-93.9	1	108	I69 F207 E208 E210 H213 F234 L241	I69-R216 WeakPolarHBondContact O-CD 3.48Å; I69-R216 PolarHBondContact O-NE 2.93Å; F207-R216 HydrophobicContact CD2-CB 4.32Å; F207-R216 HydrophobicContact CE1-CB 4.3Å; F207-R216 HydrophobicContact CE2-CB 3.44Å; F207-R216 VanDerWaalsContact CE2-CB 3.44Å; F207-R216 HydrophobicContact CZ-CB 3.42Å; F207-R216 VanDerWaalsContact CZ-CB 3.42Å; F207-R216 HydrophobicContact CZ-CG 4.08Å; E208-R216 CarbonylContact O-C 3.52Å; E208-R216 VanDerWaalsContact O-CA 3.31Å; E208-R216 WeakPolarHBondContact O-CA 3.34Å; E210-R216 PolarHBondContact O-NH1 2.67Å; H213-R216 PolarHBondContact O-NH1 3.46Å; R216-F234 HydrophobicContact CB-CB 4.44Å; R216-F234 PolarHBondContact N-O 3.04Å; R216-F234 PolarHBondContact O-N 2.87Å; R216-L241 HydrophobicContact CG-CD2 4.33Å
217	I	88.1	Confident	82.4	Confident	37 Å²	37	56.8 Å²	56.8	19%	0.19	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.6	-177.3	-58.4	174.4	0	0	0	108.2	F207 E208 I231 G232 E269	F207-I217 WeakPolarHBondContact CA-O 3.14Å; E208-I217 PolarHBondContact N-O 2.69Å; E208-I217 PolarHBondContact O-N 3.28Å; I217-I231 HydrophobicContact CG2-CB 4.16Å; I217-I231 HydrophobicContact CG2-CD1 4.34Å; I217-I231 HydrophobicContact CG2-CG2 4.34Å; I217-G232 CarbonylContact C-O 3.5Å; I217-G232 WeakPolarHBondContact CA-O 3.42Å; I217-E269 HydrophobicContact CD1-CG 4.23Å
218	L	92.6	Very high	82.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113	169.3	-171.8	68.7	0	0	0	108.5	L47 V50 L74 L205 Y206 F207 I231 G232 F234	L47-L218 HydrophobicContact CD1-CD2 3.63Å; V50-L218 HydrophobicContact CB-CD2 4.42Å; V50-L218 HydrophobicContact CG1-CD2 4.36Å; V50-L218 HydrophobicContact CG1-CG 4.29Å; V50-L218 HydrophobicContact CG2-CD2 4.49Å; V50-L218 WeakPolarHBondContact CG2-O 3.43Å; L74-L218 HydrophobicContact CD2-CD1 4.21Å; L74-L218 HydrophobicContact CD2-CD2 4.16Å; L205-L218 HydrophobicContact CB-CD1 3.87Å; L205-L218 HydrophobicContact CB-CG 4.35Å; L205-L218 HydrophobicContact CD1-CD1 4.3Å; L205-L218 HydrophobicContact CD1-CD2 4.03Å; L205-L218 HydrophobicContact CD1-CG 4.24Å; Y206-L218 CarbonylContact O-C 3.58Å; Y206-L218 WeakPolarHBondContact O-CA 3.22Å; F207-L218 HydrophobicContact CB-CD1 4Å; F207-L218 HydrophobicContact CD2-CB 3.91Å; F207-L218 HydrophobicContact CD2-CD1 3.88Å; F207-L218 HydrophobicContact CE2-CB 4.26Å; F207-L218 HydrophobicContact CG-CD1 4.19Å; L218-I231 CarbonylContact O-C 3.59Å; L218-I231 VanDerWaalsContact O-CA 3.31Å; L218-I231 WeakPolarHBondContact O-CA 3.48Å; L218-G232 PolarHBondContact N-O 3.05Å; L218-G232 PolarHBondContact O-N 2.76Å; L218-F234 HydrophobicContact CB-CD2 4.35Å; L218-F234 HydrophobicContact CB-CE2 3.8Å; L218-F234 HydrophobicContact CD2-CE2 4.15Å
219	R	90.3	Very high	81.7	Confident	45 Å²	45	60.5 Å²	60.5	17%	0.17	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.6	-175.5	-176.6	-175.3	-47.1	-78.1	-6.9	111.3	L205 Y206 E208 I231 E269	L205-R219 CarbonylContact C-O 3.59Å; L205-R219 VanDerWaalsContact CA-O 3.24Å; L205-R219 WeakPolarHBondContact CA-O 3.48Å; Y206-R219 PolarHBondContact N-O 3.21Å; Y206-R219 PolarHBondContact O-N 3.47Å; E208-R219 IonicContact OE2-CZ 2.7Å; E208-R219 IonicContact OE2-NE 3.02Å; E208-R219 PolarHBondContact OE2-NE 2.91Å; E208-R219 IonicContact OE2-NH2 3.56Å; E208-R219 PolarHBondContact OE2-NH2 2.71Å; R219-I231 HydrophobicContact CB-CG2 4.31Å; R219-I231 HydrophobicContact CG-CG2 4.12Å; R219-E269 IonicContact CZ-OE1 3.5Å; R219-E269 IonicContact NH1-OE1 2.93Å; R219-E269 PolarHBondContact NH1-OE1 3.5Å; R219-E269 IonicContact NH2-OE1 3.66Å; R219-E269 PolarHBondContact NH2-OE1 3.33Å
220	A	91.3	Very high	81.9	Confident	2 Å²	2	61.6 Å²	61.6	2%	0.017	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	127.3	167.2	0	0	0	0	0	110.4	V50 L205 N223 E230	V50-A220 HydrophobicContact CG1-CB 3.99Å; L205-A220 HydrophobicContact CD2-CB 3.84Å; A220-N223 HydrophobicContact CB-CB 4.43Å; A220-E230 PolarHBondContact N-O 3.32Å
221	V	88.2	Confident	82.9	Confident	64 Å²	64	58.1 Å²	58.1	39%	0.388	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-26.4	170.2	173.7	0	0	0	0	110.9	V204 Y206	V204-V221 PolarHBondContact O-N 2.94Å; Y206-V221 HydrophobicContact CD2-CB 4.06Å; Y206-V221 HydrophobicContact CD2-CG2 3.5Å; Y206-V221 HydrophobicContact CE2-CB 4.22Å; Y206-V221 HydrophobicContact CE2-CG1 4.49Å; Y206-V221 HydrophobicContact CE2-CG2 4.01Å
222	K	92.6	Very high	84.3	Confident	39 Å²	39	48.7 Å²	48.7	17%	0.17	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.6	168.9	-178.3	-175	-177.3	-172.2	0	108.1	E198 H199 V201 T203 V204	E198-K222 WeakPolarHBondContact O-CD 3.42Å; E198-K222 WeakPolarHBondContact O-CE 3.39Å; E198-K222 PolarHBondContact O-NZ 2.95Å; H199-K222 VanDerWaalsContact C-NZ 3.27Å; H199-K222 PolarHBondContact O-NZ 3.18Å; V201-K222 WeakPolarHBondContact O-CE 3.47Å; V201-K222 PolarHBondContact O-NZ 2.88Å; T203-K222 CarbonylContact C-O 3.51Å; T203-K222 VanDerWaalsContact CA-O 3.29Å; T203-K222 WeakPolarHBondContact CA-O 3.31Å; T203-K222 WeakPolarHBondContact CG2-O 3.42Å; V204-K222 HydrophobicContact CB-CB 3.91Å; V204-K222 HydrophobicContact CG2-CB 3.82Å; V204-K222 HydrophobicContact CG2-CD 4.15Å; V204-K222 PolarHBondContact N-O 2.76Å; V204-K222 PolarHBondContact O-N 3.38Å
223	N	92.6	Very high	85.9	Confident	14 Å²	14	40.5 Å²	40.5	8%	0.075	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	107.5	172.8	-171.7	-14.3	0	0	0	108.5	V50 T203 A220 F225 G226 T228	V50-N223 PolarHBondContact O-ND2 3.43Å; T203-N223 HydrophobicContact CG2-CB 4.26Å; T203-N223 PolarHBondContact OG1-OD1 2.7Å; A220-N223 HydrophobicContact CB-CB 4.43Å; N223-F225 PolarHBondContact O-N 3.32Å; N223-F225 WeakPolarHBondContact OD1-CA 3.45Å; N223-F225 PolarHBondContact OD1-N 2.92Å; N223-G226 PolarHBondContact OD1-N 3.09Å; N223-G226 VanDerWaalsContact OD1-N 3.08Å; N223-T228 HydrophobicContact CB-CG2 4.4Å
224	R	89.5	Confident	87.1	Confident	158 Å²	158	38 Å²	38	60%	0.596	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.6	177.2	-78.5	-175.5	172	-177.2	-5.4	113.6	D202	D202-R224 HydrophobicContact CB-CB 4.48Å; D202-R224 WeakPolarHBondContact O-CG 3.4Å; D202-R224 PolarHBondContact O-N 3.39Å; D202-R224 VanDerWaalsContact O-N 3.12Å; D202-R224 WeakPolarHBondContact OD1-CD 3.48Å; D202-R224 IonicContact OD1-CZ 3.3Å; D202-R224 IonicContact OD1-NH1 3.84Å; D202-R224 PolarHBondContact OD1-NH1 2.87Å; D202-R224 VanDerWaalsContact OD1-NH1 3.16Å
225	F	87.7	Confident	88	Confident	34 Å²	34	37.3 Å²	37.3	15%	0.149	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	8.3	-174.1	-50.3	-70.4	0	0	0	112.1	R39 V56 D202 N223	R39-F225 VanDerWaalsContact CZ-O 3.25Å; R39-F225 PolarHBondContact NH1-O 2.9Å; R39-F225 PolarHBondContact NH2-O 2.78Å; V56-F225 HydrophobicContact CB-CD2 4.4Å; V56-F225 HydrophobicContact CB-CE2 4.46Å; V56-F225 HydrophobicContact CB-CG 4.46Å; V56-F225 HydrophobicContact CG1-CD1 4.21Å; V56-F225 HydrophobicContact CG1-CE1 4.04Å; V56-F225 HydrophobicContact CG1-CZ 4.22Å; V56-F225 HydrophobicContact CG2-CB 4.09Å; V56-F225 HydrophobicContact CG2-CD1 4.28Å; V56-F225 HydrophobicContact CG2-CD2 4.2Å; V56-F225 HydrophobicContact CG2-CG 3.94Å; D202-F225 HydrophobicContact CB-CD2 4.44Å; D202-F225 HydrophobicContact CB-CE2 3.49Å; D202-F225 VanDerWaalsContact CB-CE2 3.49Å; D202-F225 HydrophobicContact CB-CZ 3.99Å; N223-F225 PolarHBondContact O-N 3.32Å; N223-F225 WeakPolarHBondContact OD1-CA 3.45Å; N223-F225 PolarHBondContact OD1-N 2.92Å
226	G	87.5	Confident	88.3	Confident	34 Å²	34	39.4 Å²	39.4	35%	0.351	20%	0.202	S	C	.	.	S	Bend	trans	-172.6	-173.4	-172.4	0	0	0	0	0	113.1	N223	N223-G226 PolarHBondContact OD1-N 3.09Å; N223-G226 VanDerWaalsContact OD1-N 3.08Å
227	S	84.9	Confident	88.4	Confident	49 Å²	49	44.6 Å²	44.6	34%	0.343	22%	0.221	S	C	.	.			trans	-78.4	141.3	177.8	169.5	0	0	0	0	110.9	N229	S227-N229 VanDerWaalsContact C-N 3.28Å; S227-N229 PolarHBondContact OG-N 3.45Å
228	T	84.9	Confident	88.3	Confident	61 Å²	61	52.2 Å²	52.2	37%	0.374	26%	0.256	S	S	.	.	S	Bend	trans	-83.9	-4.5	169.3	55.7	0	0	0	0	112.7	N223	N223-T228 HydrophobicContact CB-CG2 4.4Å
229	N	78.3	Confident	88	Confident	95 Å²	95	55.5 Å²	55.5	51%	0.508	28%	0.279	S	S	.	.	S	Bend	trans	-89.3	-11	-179.5	-61.4	-22.7	0	0	0	111.6	S227 G270 S271	S227-N229 VanDerWaalsContact C-N 3.28Å; S227-N229 PolarHBondContact OG-N 3.45Å; N229-G270 CarbonylContact O-C 3.58Å; N229-G270 WeakPolarHBondContact O-CA 3.24Å; N229-S271 WeakPolarHBondContact O-CB 3.22Å; N229-S271 PolarHBondContact O-N 3.11Å; N229-S271 PolarHBondContact O-OG 3.14Å
230	E	83.2	Confident	88.1	Confident	54 Å²	54	53.5 Å²	53.5	25%	0.252	27%	0.272	S	S	.	.			trans	-74.8	142.8	-178.9	-62.9	-56.7	126.9	0	0	112.3	R49 A220 S271	R49-E230 WeakPolarHBondContact CD-OE2 3.14Å; R49-E230 HydrophobicContact CG-CB 4.31Å; R49-E230 HydrophobicContact CG-CG 4.41Å; R49-E230 WeakPolarHBondContact CG-OE2 3.34Å; A220-E230 PolarHBondContact N-O 3.32Å; E230-S271 VanDerWaalsContact CD-OG 3.24Å; E230-S271 PolarHBondContact OE1-OG 2.91Å
231	I	87.9	Confident	88.1	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.3	174.5	66.1	164.2	0	0	0	111.1	I217 L218 R219 I233 E269 R272 I274	I217-I231 HydrophobicContact CG2-CB 4.16Å; I217-I231 HydrophobicContact CG2-CD1 4.34Å; I217-I231 HydrophobicContact CG2-CG2 4.34Å; L218-I231 CarbonylContact O-C 3.59Å; L218-I231 VanDerWaalsContact O-CA 3.31Å; L218-I231 WeakPolarHBondContact O-CA 3.48Å; R219-I231 HydrophobicContact CB-CG2 4.31Å; R219-I231 HydrophobicContact CG-CG2 4.12Å; I231-I233 HydrophobicContact CD1-CD1 4.01Å; I231-I233 HydrophobicContact CD1-CG1 4.08Å; I231-E269 HydrophobicContact CD1-CB 3.63Å; I231-E269 HydrophobicContact CD1-CG 3.51Å; I231-E269 WeakPolarHBondContact CD1-O 3.45Å; I231-R272 HydrophobicContact CD1-CB 3.79Å; I231-R272 HydrophobicContact CD1-CG 4.47Å; I231-R272 HydrophobicContact CG1-CB 3.7Å; I231-R272 HydrophobicContact CG1-CG 4.48Å; I231-I274 HydrophobicContact CD1-CD1 4.41Å
232	G	90.6	Very high	88.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135	171.5	0	0	0	0	0	109.1	E46 I217 L218	E46-G232 VanDerWaalsContact OE2-CA 3.28Å; E46-G232 WeakPolarHBondContact OE2-CA 3.42Å; I217-G232 CarbonylContact C-O 3.5Å; I217-G232 WeakPolarHBondContact CA-O 3.42Å; L218-G232 PolarHBondContact N-O 3.05Å; L218-G232 PolarHBondContact O-N 2.76Å
233	I	89.3	Confident	88.3	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.8	179.1	-56	172.8	0	0	0	109.4	E46 F215 I231 V244 P247 I274	E46-I233 PolarHBondContact OE2-N 3.07Å; F215-I233 HydrophobicContact CB-CG2 4.49Å; F215-I233 HydrophobicContact CD1-CG2 4.06Å; F215-I233 HydrophobicContact CG-CG2 4.48Å; I231-I233 HydrophobicContact CD1-CD1 4.01Å; I231-I233 HydrophobicContact CD1-CG1 4.08Å; I233-V244 HydrophobicContact CB-CB 4.29Å; I233-V244 HydrophobicContact CG2-CB 3.87Å; I233-V244 HydrophobicContact CG2-CG1 4.37Å; I233-V244 HydrophobicContact CG2-CG2 4.29Å; I233-V244 PolarHBondContact O-N 3.45Å; I233-P247 HydrophobicContact CD1-CB 3.94Å; I233-P247 HydrophobicContact CD1-CG 3.7Å; I233-I274 HydrophobicContact CD1-CD1 3.7Å
234	F	91.2	Very high	88	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	156.8	-178.3	-56.6	-93.4	0	0	0	110.3	L44 E46 L47 L74 F207 F215 R216 L218 L241 V242 E243	L44-F234 HydrophobicContact CD2-CE1 4.42Å; E46-F234 HydrophobicContact CB-CE1 4.07Å; E46-F234 HydrophobicContact CB-CE2 4.14Å; E46-F234 HydrophobicContact CB-CZ 3.66Å; L47-F234 HydrophobicContact CB-CZ 4.44Å; L74-F234 HydrophobicContact CD1-CZ 4.49Å; F207-F234 AromaticContact CE2-CD2 3.94Å; F207-F234 HydrophobicContact CE2-CD2 3.94Å; F207-F234 HydrophobicContact CZ-CD2 4.45Å; F215-F234 CarbonylContact C-O 3.58Å; F215-F234 VanDerWaalsContact CA-O 3.31Å; F215-F234 WeakPolarHBondContact CA-O 3.44Å; R216-F234 HydrophobicContact CB-CB 4.44Å; R216-F234 PolarHBondContact N-O 3.04Å; R216-F234 PolarHBondContact O-N 2.87Å; L218-F234 HydrophobicContact CB-CD2 4.35Å; L218-F234 HydrophobicContact CB-CE2 3.8Å; L218-F234 HydrophobicContact CD2-CE2 4.15Å; F234-L241 HydrophobicContact CB-CB 4.4Å; F234-L241 HydrophobicContact CB-CD2 3.97Å; F234-L241 HydrophobicContact CD1-CB 4.31Å; F234-V242 CarbonylContact C-O 3.58Å; F234-V242 VanDerWaalsContact CA-O 3.22Å; F234-V242 WeakPolarHBondContact CA-O 3.36Å; F234-E243 HydrophobicContact CD1-CG 4.14Å; F234-E243 HydrophobicContact CE1-CG 3.89Å
235	E	88.8	Confident	87.6	Confident	38 Å²	38	49.4 Å²	49.4	18%	0.178	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.5	169.2	-177.6	178.2	-152	0	0	108.7	F215 R237 L241 V242 V244	F215-E235 HydrophobicContact CD1-CB 4.35Å; F215-E235 HydrophobicContact CE1-CB 4.41Å; E235-R237 HydrophobicContact CG-CG 4.21Å; E235-R237 PolarHBondContact O-N 3.11Å; E235-R237 IonicContact OE2-CZ 3.99Å; E235-R237 VanDerWaalsContact OE2-CZ 3.23Å; E235-R237 IonicContact OE2-NE 3.16Å; E235-R237 PolarHBondContact OE2-NE 3.18Å; E235-R237 IonicContact OE2-NH2 3.25Å; E235-R237 PolarHBondContact OE2-NH2 3.33Å; E235-L241 WeakPolarHBondContact O-CA 3.43Å; E235-V242 PolarHBondContact N-O 3.14Å; E235-V242 PolarHBondContact O-N 2.85Å; E235-V244 HydrophobicContact CB-CG2 3.8Å
236	M	88.4	Confident	87.2	Confident	67 Å²	67	49.5 Å²	49.5	33%	0.33	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	117.8	173.4	-174.1	65	75.9	0	0	109.6	T73 S214 L241	T73-M236 HydrophobicContact CG2-CE 4.31Å; T73-M236 HydrophobicContact CG2-SD 4.43Å; S214-M236 PolarHBondContact O-N 3.07Å; M236-L241 HydrophobicContact CB-CD2 4.35Å; M236-L241 HydrophobicContact CE-CD2 3.61Å; M236-L241 HydrophobicContact CE-CG 3.85Å; M236-L241 HydrophobicContact SD-CD2 4.12Å; M236-L241 HydrophobicContact SD-CG 4.24Å
237	R	88.9	Confident	86.5	Confident	140 Å²	140	48 Å²	48	53%	0.528	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	175.1	174.3	-59.7	-169.5	-179.1	-178.3	-4	110.2	E235 S239 G240 V242	E235-R237 HydrophobicContact CG-CG 4.21Å; E235-R237 PolarHBondContact O-N 3.11Å; E235-R237 IonicContact OE2-CZ 3.99Å; E235-R237 VanDerWaalsContact OE2-CZ 3.23Å; E235-R237 IonicContact OE2-NE 3.16Å; E235-R237 PolarHBondContact OE2-NE 3.18Å; E235-R237 IonicContact OE2-NH2 3.25Å; E235-R237 PolarHBondContact OE2-NH2 3.33Å; R237-S239 PolarHBondContact O-N 3.18Å; R237-G240 PolarHBondContact N-O 3.44Å; R237-G240 PolarHBondContact O-N 3.16Å; R237-V242 HydrophobicContact CB-CG2 4.38Å; R237-V242 HydrophobicContact CG-CG2 4.21Å
238	E	85.5	Confident	86.2	Confident	197 Å²	197	45.6 Å²	45.6	92%	0.921	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-33.6	175.4	-66.7	-171.2	162.1	0	0	112.4	G240	E238-G240 PolarHBondContact O-N 3.36Å
239	S	87.6	Confident	85.6	Confident	68 Å²	68	47.6 Å²	47.6	48%	0.476	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	4.3	175.6	62	0	0	0	0	114.3	L108 R237	L108-S239 WeakPolarHBondContact CD2-O 3.39Å; R237-S239 PolarHBondContact O-N 3.18Å
240	G	90.7	Very high	85.2	Confident	3 Å²	3	45.9 Å²	45.9	3%	0.031	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.5	-155.2	-176.1	0	0	0	0	0	114.2	R237 E238	R237-G240 PolarHBondContact N-O 3.44Å; R237-G240 PolarHBondContact O-N 3.16Å; E238-G240 PolarHBondContact O-N 3.36Å
241	L	92.6	Very high	84.3	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.9	178.5	-69.5	165.8	0	0	0	110.3	T73 L74 Q77 F207 R216 F234 E235 M236	T73-L241 HydrophobicContact CG2-CD1 4.37Å; T73-L241 HydrophobicContact CG2-CG 4.22Å; L74-L241 HydrophobicContact CB-CD1 3.62Å; L74-L241 HydrophobicContact CD1-CD1 4.27Å; L74-L241 HydrophobicContact CG-CD1 4.5Å; Q77-L241 PolarHBondContact NE2-O 3.39Å; F207-L241 HydrophobicContact CE1-CD1 3.79Å; F207-L241 HydrophobicContact CE1-CD2 4.32Å; F207-L241 HydrophobicContact CZ-CD1 3.71Å; F207-L241 HydrophobicContact CZ-CD2 3.83Å; F207-L241 HydrophobicContact CZ-CG 4.45Å; R216-L241 HydrophobicContact CG-CD2 4.33Å; F234-L241 HydrophobicContact CB-CB 4.4Å; F234-L241 HydrophobicContact CB-CD2 3.97Å; F234-L241 HydrophobicContact CD1-CB 4.31Å; E235-L241 WeakPolarHBondContact O-CA 3.43Å; M236-L241 HydrophobicContact CB-CD2 4.35Å; M236-L241 HydrophobicContact CE-CD2 3.61Å; M236-L241 HydrophobicContact CE-CG 3.85Å; M236-L241 HydrophobicContact SD-CD2 4.12Å; M236-L241 HydrophobicContact SD-CG 4.24Å
242	V	92.3	Very high	83.6	Confident	46 Å²	46	45.6 Å²	45.6	28%	0.279	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.3	175.8	178.5	0	0	0	0	109.4	F234 E235 R237	F234-V242 CarbonylContact C-O 3.58Å; F234-V242 VanDerWaalsContact CA-O 3.22Å; F234-V242 WeakPolarHBondContact CA-O 3.36Å; E235-V242 PolarHBondContact N-O 3.14Å; E235-V242 PolarHBondContact O-N 2.85Å; R237-V242 HydrophobicContact CB-CG2 4.38Å; R237-V242 HydrophobicContact CG-CG2 4.21Å
243	E	92	Very high	82.4	Confident	53 Å²	53	51.9 Å²	51.9	25%	0.248	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	137.8	-179.4	-55.1	-161.4	115	0	0	111.9	L44 A45 E46 F234	L44-E243 VanDerWaalsContact CA-CD 3.46Å; L44-E243 WeakPolarHBondContact CA-OE1 3.35Å; L44-E243 WeakPolarHBondContact CB-OE1 3.42Å; L44-E243 HydrophobicContact CD2-CG 3.72Å; A45-E243 PolarHBondContact N-OE1 3.23Å; A45-E243 PolarHBondContact N-OE2 2.85Å; E46-E243 WeakPolarHBondContact CA-OE1 3.13Å; E46-E243 HydrophobicContact CB-CG 4.45Å; E46-E243 WeakPolarHBondContact CB-OE1 3.46Å; E46-E243 HydrophobicContact CG-CB 3.91Å; E46-E243 HydrophobicContact CG-CG 4.24Å; E46-E243 PolarHBondContact N-OE1 3.29Å; F234-E243 HydrophobicContact CD1-CG 4.14Å; F234-E243 HydrophobicContact CE1-CG 3.89Å
244	V	86.6	Confident	81.2	Confident	12 Å²	12	60.2 Å²	60.2	7%	0.073	31%	0.308	C	S	.	.			trans	-109.5	86.2	179.5	-174.6	0	0	0	0	108	F215 I233 E235 N246 P247 R272	F215-V244 HydrophobicContact CD1-CG1 4.42Å; F215-V244 HydrophobicContact CD1-CG2 3.87Å; F215-V244 HydrophobicContact CE1-CB 4.23Å; F215-V244 HydrophobicContact CE1-CG1 3.75Å; F215-V244 HydrophobicContact CE1-CG2 3.64Å; F215-V244 HydrophobicContact CZ-CG1 4.47Å; I233-V244 HydrophobicContact CB-CB 4.29Å; I233-V244 HydrophobicContact CG2-CB 3.87Å; I233-V244 HydrophobicContact CG2-CG1 4.37Å; I233-V244 HydrophobicContact CG2-CG2 4.29Å; I233-V244 PolarHBondContact O-N 3.45Å; E235-V244 HydrophobicContact CB-CG2 3.8Å; V244-N246 PolarHBondContact O-N 3.27Å; V244-P247 HydrophobicContact CG1-CB 4.04Å; V244-R272 PolarHBondContact O-NH2 3.17Å; V244-R272 VanDerWaalsContact O-NH2 3.07Å
245	A	80.3	Confident	80.3	Confident	77 Å²	77	62 Å²	62	64%	0.636	31%	0.314	S	S	*	.	S	Bend	trans	-62.5	-33	-179.2	0	0	0	0	0	112.4	R272	A245-R272 PolarHBondContact O-NH2 3.3Å
246	N	80.1	Confident	79.3	Confident	36 Å²	36	66.5 Å²	66.5	19%	0.193	34%	0.339	C	S	.	.			trans	-130.2	75.9	-177	-164.6	-6.6	0	0	0	111.8	V244 S248 Q249 L386	V244-N246 PolarHBondContact O-N 3.27Å; N246-S248 PolarHBondContact O-N 3.09Å; N246-Q249 HydrophobicContact CB-CB 4.25Å; N246-Q249 PolarHBondContact ND2-OE1 3.43Å; N246-Q249 PolarHBondContact O-N 3.31Å; N246-Q249 PolarHBondContact OD1-N 3.1Å; N246-L386 WeakPolarHBondContact ND2-CD2 3.35Å; N246-L386 WeakPolarHBondContact OD1-CD2 3.31Å
247	P	73.5	Confident	78.5	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.006	36%	0.362	C	S	.	.	H	α-helix	trans	-60.4	-37.3	-178.5	28.4	-38.6	0	0	0	111.7	I233 V244 Q249 V250 F251 I274	I233-P247 HydrophobicContact CD1-CB 3.94Å; I233-P247 HydrophobicContact CD1-CG 3.7Å; V244-P247 HydrophobicContact CG1-CB 4.04Å; P247-Q249 VanDerWaalsContact C-N 3.29Å; P247-Q249 PolarHBondContact O-N 2.72Å; P247-V250 PolarHBondContact O-N 3.49Å; P247-F251 HydrophobicContact CB-CD2 4.49Å; P247-F251 HydrophobicContact CB-CE2 3.9Å; P247-F251 WeakPolarHBondContact O-CD2 3.35Å; P247-F251 WeakPolarHBondContact O-CG 3.33Å; P247-F251 PolarHBondContact O-N 2.99Å; P247-I274 HydrophobicContact CB-CG2 4.33Å; P247-I274 HydrophobicContact CG-CD1 4.4Å; P247-I274 HydrophobicContact CG-CG1 4.14Å; P247-I274 HydrophobicContact CG-CG2 4.19Å
248	S	77.5	Confident	77.7	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-55.8	-40.4	179	-55.9	0	0	0	0	112.9	N246 F251 L252 L275	N246-S248 PolarHBondContact O-N 3.09Å; S248-F251 PolarHBondContact O-N 3.34Å; S248-L252 WeakPolarHBondContact O-CD1 3.49Å; S248-L252 WeakPolarHBondContact O-CG 3.47Å; S248-L252 PolarHBondContact O-N 3.12Å; S248-L275 PolarHBondContact OG-N 3.13Å
249	Q	73.3	Confident	77.7	Confident	103 Å²	103	59.7 Å²	59.7	48%	0.481	33%	0.333	S	S	.	.	H	α-helix	trans	-64.7	-43.2	179.8	-174.9	173.1	-9.5	0	0	111.4	N246 P247 F251 L252 E253	N246-Q249 HydrophobicContact CB-CB 4.25Å; N246-Q249 PolarHBondContact ND2-OE1 3.43Å; N246-Q249 PolarHBondContact O-N 3.31Å; N246-Q249 PolarHBondContact OD1-N 3.1Å; P247-Q249 VanDerWaalsContact C-N 3.29Å; P247-Q249 PolarHBondContact O-N 2.72Å; Q249-F251 VanDerWaalsContact C-N 3.3Å; Q249-F251 PolarHBondContact O-N 3.37Å; Q249-L252 PolarHBondContact O-N 2.91Å; Q249-L252 VanDerWaalsContact O-N 3.12Å; Q249-E253 WeakPolarHBondContact O-CG 3.37Å; Q249-E253 PolarHBondContact O-N 3.01Å; Q249-E253 VanDerWaalsContact O-N 3.13Å
250	V	68.7	Low	77.9	Confident	59 Å²	59	59.1 Å²	59.1	36%	0.358	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-38.9	178.3	-172.7	0	0	0	0	111.4	F215 P247 L252	F215-V250 HydrophobicContact CE2-CG1 4.37Å; F215-V250 HydrophobicContact CZ-CB 3.92Å; F215-V250 HydrophobicContact CZ-CG1 3.74Å; F215-V250 HydrophobicContact CZ-CG2 4.27Å; P247-V250 PolarHBondContact O-N 3.49Å; V250-L252 PolarHBondContact O-N 3.22Å
251	F	65	Low	78.1	Confident	16 Å²	16	59.1 Å²	59.1	7%	0.07	33%	0.326	C	S	.	.	H	α-helix	trans	-69.3	-20.3	178	-62.4	-48.1	0	0	0	114.4	F215 P247 S248 Q249 I274 L275 V330	F215-F251 AromaticContact CD2-CE1 3.59Å; F215-F251 HydrophobicContact CD2-CE1 3.59Å; F215-F251 AromaticContact CD2-CZ 3.59Å; F215-F251 HydrophobicContact CD2-CZ 3.59Å; F215-F251 HydrophobicContact CE2-CD1 4.06Å; F215-F251 AromaticContact CE2-CE1 3.23Å; F215-F251 HydrophobicContact CE2-CE1 3.23Å; F215-F251 AromaticContact CE2-CZ 3.5Å; F215-F251 HydrophobicContact CE2-CZ 3.5Å; F215-F251 VanDerWaalsContact CE2-CZ 3.5Å; F215-F251 HydrophobicContact CZ-CE1 4.31Å; F215-F251 HydrophobicContact CZ-CZ 4.41Å; P247-F251 HydrophobicContact CB-CD2 4.49Å; P247-F251 HydrophobicContact CB-CE2 3.9Å; P247-F251 WeakPolarHBondContact O-CD2 3.35Å; P247-F251 WeakPolarHBondContact O-CG 3.33Å; P247-F251 PolarHBondContact O-N 2.99Å; S248-F251 PolarHBondContact O-N 3.34Å; Q249-F251 VanDerWaalsContact C-N 3.3Å; Q249-F251 PolarHBondContact O-N 3.37Å; F251-I274 HydrophobicContact CD2-CG2 3.82Å; F251-I274 HydrophobicContact CE2-CG2 3.56Å; F251-L275 WeakPolarHBondContact CD2-O 3.49Å; F251-V330 HydrophobicContact CE1-CG2 3.89Å; F251-V330 HydrophobicContact CE2-CG2 3.94Å; F251-V330 HydrophobicContact CZ-CG2 3.45Å; F251-V330 VanDerWaalsContact CZ-CG2 3.45Å
252	L	72.3	Confident	78.2	Confident	33 Å²	33	59 Å²	59	17%	0.173	33%	0.326	C	S	.	.	H	α-helix	trans	-100.5	-16.3	-175.9	-65.7	171.5	0	0	0	113.1	S248 Q249 V250 E254 R255 I264 L275 F388	S248-L252 WeakPolarHBondContact O-CD1 3.49Å; S248-L252 WeakPolarHBondContact O-CG 3.47Å; S248-L252 PolarHBondContact O-N 3.12Å; Q249-L252 PolarHBondContact O-N 2.91Å; Q249-L252 VanDerWaalsContact O-N 3.12Å; V250-L252 PolarHBondContact O-N 3.22Å; L252-E254 VanDerWaalsContact C-N 3.27Å; L252-E254 PolarHBondContact O-N 3.02Å; L252-R255 WeakPolarHBondContact O-CB 3.31Å; L252-R255 PolarHBondContact O-N 2.7Å; L252-I264 HydrophobicContact CD2-CD1 3.47Å; L252-I264 VanDerWaalsContact CD2-CD1 3.47Å; L252-I264 HydrophobicContact CD2-CG1 4.07Å; L252-I264 HydrophobicContact CD2-CG2 4.32Å; L252-L275 HydrophobicContact CD1-CB 4.2Å; L252-L275 HydrophobicContact CD1-CD2 4.2Å; L252-F388 HydrophobicContact CD1-CE2 3.61Å; L252-F388 HydrophobicContact CD1-CZ 3.81Å; L252-F388 HydrophobicContact CD2-CZ 4.23Å
253	E	65.5	Low	78.3	Confident	132 Å²	132	56.8 Å²	56.8	62%	0.617	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.4	-177	-85.8	172.5	-167.4	0	0	113.8	Q249 R255	Q249-E253 WeakPolarHBondContact O-CG 3.37Å; Q249-E253 PolarHBondContact O-N 3.01Å; Q249-E253 VanDerWaalsContact O-N 3.13Å; E253-R255 VanDerWaalsContact C-N 3.31Å; E253-R255 PolarHBondContact O-N 3.02Å
254	E	65.6	Low	78.4	Confident	180 Å²	180	54.3 Å²	54.3	84%	0.841	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	2	-179.3	-62.1	-172.4	166	0	0	113.9	L252 L256	L252-E254 VanDerWaalsContact C-N 3.27Å; L252-E254 PolarHBondContact O-N 3.02Å; E254-L256 PolarHBondContact O-N 3.36Å
255	R	70.8	Confident	78.9	Confident	36 Å²	36	53.7 Å²	53.7	14%	0.136	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-73.3	127.1	-174.3	-172.4	-178.5	170	111.4	-2	111.2	L252 E253 S262 T354	L252-R255 WeakPolarHBondContact O-CB 3.31Å; L252-R255 PolarHBondContact O-N 2.7Å; E253-R255 VanDerWaalsContact C-N 3.31Å; E253-R255 PolarHBondContact O-N 3.02Å; R255-S262 PolarHBondContact NH1-OG 3.45Å; R255-T354 PolarHBondContact NH2-O 2.88Å; R255-T354 PolarHBondContact NH2-OG1 3.34Å
256	L	68.3	Low	79.6	Confident	134 Å²	134	50 Å²	50	70%	0.702	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-80.8	127.7	168.3	-66.8	171.5	0	0	0	110	E254 G258 A259	E254-L256 PolarHBondContact O-N 3.36Å; L256-G258 PolarHBondContact O-N 2.77Å; L256-A259 HydrophobicContact CB-CB 4.17Å; L256-A259 WeakPolarHBondContact O-CB 3.23Å; L256-A259 PolarHBondContact O-N 3.34Å
257	E	71.7	Confident	80.2	Confident	174 Å²	174	48.7 Å²	48.7	81%	0.813	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	134.6	173.4	-167.2	172.3	-165.9	0	0	110.2	A259	E257-A259 VanDerWaalsContact C-N 3.28Å; E257-A259 PolarHBondContact O-N 2.89Å
258	G	72.9	Confident	81	Confident	58 Å²	58	50 Å²	50	60%	0.598	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	5.2	-178.4	0	0	0	0	0	115.8	L256 T260	L256-G258 PolarHBondContact O-N 2.77Å; G258-T260 PolarHBondContact O-N 3.02Å
259	A	83.9	Confident	81.2	Confident	29 Å²	29	52 Å²	52	24%	0.24	28%	0.276	C	S	.	.			trans	-60.2	132.5	175.9	0	0	0	0	0	112	L256 E257	L256-A259 HydrophobicContact CB-CB 4.17Å; L256-A259 WeakPolarHBondContact O-CB 3.23Å; L256-A259 PolarHBondContact O-N 3.34Å; E257-A259 VanDerWaalsContact C-N 3.28Å; E257-A259 PolarHBondContact O-N 2.89Å
260	T	92.9	Very high	81.7	Confident	56 Å²	56	49 Å²	49	34%	0.344	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	156.4	170.9	63.5	0	0	0	0	109.9	G258 S262 E351	G258-T260 PolarHBondContact O-N 3.02Å; T260-S262 VanDerWaalsContact C-N 3.33Å; T260-S262 PolarHBondContact O-N 3.08Å; T260-E351 WeakPolarHBondContact CB-OE2 3.48Å; T260-E351 PolarHBondContact OG1-OE2 2.89Å
261	G	94.8	Very high	82.3	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.021	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	17.5	178.1	0	0	0	0	0	114.8	Q279 A280 A344 S347	G261-Q279 CarbonylContact O-C 3.59Å; G261-Q279 WeakPolarHBondContact O-CA 3.32Å; G261-A280 VanDerWaalsContact CA-O 3.23Å; G261-A280 WeakPolarHBondContact CA-O 3.05Å; G261-A280 PolarHBondContact O-N 3.34Å; G261-A344 WeakPolarHBondContact CA-O 3.34Å; G261-S347 PolarHBondContact N-OG 2.71Å
262	S	94.1	Very high	83.2	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.014	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.6	-177.5	177.3	0	0	0	0	111.5	R255 T260 E277 V278 T354	R255-S262 PolarHBondContact NH1-OG 3.45Å; T260-S262 VanDerWaalsContact C-N 3.33Å; T260-S262 PolarHBondContact O-N 3.08Å; S262-E277 WeakPolarHBondContact CB-OE1 3.37Å; S262-E277 VanDerWaalsContact OG-CD 3.32Å; S262-E277 WeakPolarHBondContact OG-CG 3.35Å; S262-E277 PolarHBondContact OG-OE1 2.93Å; S262-V278 WeakPolarHBondContact CA-O 3.28Å; S262-T354 VanDerWaalsContact O-CG2 3.28Å; S262-T354 WeakPolarHBondContact O-CG2 3.43Å; S262-T354 PolarHBondContact O-OG1 3.46Å
263	A	95.4	Very high	84.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	142.5	172.1	0	0	0	0	0	110.9	V278 A340 V343 A344 F360	A263-V278 PolarHBondContact N-O 3.23Å; A263-V278 PolarHBondContact O-N 3.5Å; A263-A340 HydrophobicContact CB-CB 4.25Å; A263-A340 VanDerWaalsContact CB-O 3.25Å; A263-A340 WeakPolarHBondContact CB-O 3.46Å; A263-V343 HydrophobicContact CB-CB 4.15Å; A263-V343 HydrophobicContact CB-CG1 4.01Å; A263-A344 HydrophobicContact CB-CB 3.92Å; A263-F360 HydrophobicContact CB-CD2 3.82Å; A263-F360 HydrophobicContact CB-CE2 4.11Å
264	I	94.7	Very high	85.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.9	178	-53.7	-52.7	0	0	0	110.5	L252 L275 E277 C359 F360 F388	L252-I264 HydrophobicContact CD2-CD1 3.47Å; L252-I264 VanDerWaalsContact CD2-CD1 3.47Å; L252-I264 HydrophobicContact CD2-CG1 4.07Å; L252-I264 HydrophobicContact CD2-CG2 4.32Å; I264-L275 HydrophobicContact CG2-CB 4.1Å; I264-L275 HydrophobicContact CG2-CD2 4Å; I264-L275 HydrophobicContact CG2-CG 4.24Å; I264-E277 HydrophobicContact CD1-CB 3.59Å; I264-E277 HydrophobicContact CD1-CG 3.8Å; I264-C359 VanDerWaalsContact CG2-SG 3.58Å; I264-F360 PolarHBondContact O-N 2.83Å; I264-F388 HydrophobicContact CB-CE1 4.04Å; I264-F388 HydrophobicContact CB-CZ 4.3Å; I264-F388 HydrophobicContact CG1-CE1 3.92Å; I264-F388 HydrophobicContact CG1-CZ 4.04Å; I264-F388 HydrophobicContact CG2-CE1 4.02Å; I264-F388 HydrophobicContact CG2-CZ 3.89Å
265	V	95.8	Very high	86.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	147.6	167.2	63	0	0	0	0	109.9	L275 V276 V278 L332 I337 A340	V265-L275 VanDerWaalsContact O-CA 3.32Å; V265-L275 WeakPolarHBondContact O-CA 3.33Å; V265-V276 HydrophobicContact CG1-CB 4.33Å; V265-V276 WeakPolarHBondContact CG1-O 3.35Å; V265-V276 PolarHBondContact N-O 3.31Å; V265-V276 PolarHBondContact O-N 2.82Å; V265-V278 HydrophobicContact CG1-CG2 4.14Å; V265-L332 HydrophobicContact CG1-CD1 3.95Å; V265-I337 HydrophobicContact CG1-CG2 4.33Å; V265-I337 HydrophobicContact CG2-CB 4.24Å; V265-I337 HydrophobicContact CG2-CG2 4.01Å; V265-A340 HydrophobicContact CB-CB 3.62Å; V265-A340 HydrophobicContact CG1-CB 4.45Å; V265-A340 HydrophobicContact CG2-CB 4.34Å
266	V	94.7	Very high	87.3	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	100.7	161.4	-173.3	0	0	0	0	107.7	P273 I274 L275 I361 R379 A383	V266-P273 HydrophobicContact CG1-CB 3.68Å; V266-I274 CarbonylContact C-O 3.59Å; V266-L275 HydrophobicContact CB-CD1 4.43Å; V266-L275 HydrophobicContact CB-CG 4.49Å; V266-L275 HydrophobicContact CG1-CD1 4.07Å; V266-L275 HydrophobicContact CG2-CD1 3.84Å; V266-L275 HydrophobicContact CG2-CD2 4.34Å; V266-L275 HydrophobicContact CG2-CG 3.76Å; V266-I361 HydrophobicContact CB-CD1 4.07Å; V266-I361 HydrophobicContact CB-CG1 4.46Å; V266-I361 HydrophobicContact CG2-CD1 4.07Å; V266-R379 HydrophobicContact CB-CB 3.94Å; V266-R379 HydrophobicContact CB-CG 4.25Å; V266-R379 HydrophobicContact CG1-CB 3.7Å; V266-R379 HydrophobicContact CG1-CG 3.89Å; V266-R379 PolarHBondContact O-NH1 3.26Å; V266-A383 HydrophobicContact CG2-CB 3.8Å
267	A	92.8	Very high	88.5	Confident	7 Å²	7	24.5 Å²	24.5	6%	0.058	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	154.4	176.9	0	0	0	0	0	111.1	P273 I274 L332 E334	A267-P273 CarbonylContact O-C 3.53Å; A267-P273 WeakPolarHBondContact O-CA 3.43Å; A267-I274 PolarHBondContact N-O 3.02Å; A267-I274 PolarHBondContact O-N 3.48Å; A267-L332 HydrophobicContact CB-CD2 3.48Å; A267-L332 VanDerWaalsContact CB-CD2 3.48Å; A267-E334 WeakPolarHBondContact CA-OE1 3.46Å
268	M	90.3	Very high	89.6	Confident	29 Å²	29	16.2 Å²	16.2	14%	0.143	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.1	175	-66.6	-65.5	-59.5	0	0	109.8	S271 P273 E334 R379	M268-S271 VanDerWaalsContact CE-C 3.5Å; M268-S271 VanDerWaalsContact CE-O 3.31Å; M268-S271 WeakPolarHBondContact CE-O 3.39Å; M268-P273 HydrophobicContact SD-CB 3.76Å; M268-E334 PolarHBondContact N-OE1 3.26Å; M268-R379 HydrophobicContact CG-CG 4.27Å; M268-R379 HydrophobicContact SD-CG 3.89Å
269	E	82.8	Confident	90.6	Very high	41 Å²	41	16.2 Å²	16.2	19%	0.192	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	95.4	170	-164.8	59.5	-121.7	0	0	108	I217 R219 I231 S271 R272 I274	I217-E269 HydrophobicContact CD1-CG 4.23Å; R219-E269 IonicContact CZ-OE1 3.5Å; R219-E269 IonicContact NH1-OE1 2.93Å; R219-E269 PolarHBondContact NH1-OE1 3.5Å; R219-E269 IonicContact NH2-OE1 3.66Å; R219-E269 PolarHBondContact NH2-OE1 3.33Å; I231-E269 HydrophobicContact CD1-CB 3.63Å; I231-E269 HydrophobicContact CD1-CG 3.51Å; I231-E269 WeakPolarHBondContact CD1-O 3.45Å; E269-S271 PolarHBondContact O-N 2.77Å; E269-R272 PolarHBondContact N-O 2.86Å; E269-R272 PolarHBondContact O-N 2.92Å; E269-I274 HydrophobicContact CB-CD1 3.66Å; E269-I274 HydrophobicContact CB-CG1 4.42Å; E269-I274 HydrophobicContact CG-CD1 4.33Å
270	G	83	Confident	91.2	Very high	40 Å²	40	15.3 Å²	15.3	41%	0.412	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-122.3	-165.4	0	0	0	0	0	111.3	N229	N229-G270 CarbonylContact O-C 3.58Å; N229-G270 WeakPolarHBondContact O-CA 3.24Å
271	S	81.4	Confident	91.4	Very high	24 Å²	24	17.5 Å²	17.5	17%	0.168	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-7.4	174	62.6	0	0	0	0	113.6	N229 E230 M268 E269 P273	N229-S271 WeakPolarHBondContact O-CB 3.22Å; N229-S271 PolarHBondContact O-N 3.11Å; N229-S271 PolarHBondContact O-OG 3.14Å; E230-S271 VanDerWaalsContact CD-OG 3.24Å; E230-S271 PolarHBondContact OE1-OG 2.91Å; M268-S271 VanDerWaalsContact CE-C 3.5Å; M268-S271 VanDerWaalsContact CE-O 3.31Å; M268-S271 WeakPolarHBondContact CE-O 3.39Å; E269-S271 PolarHBondContact O-N 2.77Å; S271-P273 WeakPolarHBondContact O-CD 3.31Å
272	R	84.2	Confident	91.5	Very high	23 Å²	23	17.9 Å²	17.9	9%	0.087	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	116.9	-174.4	-165.9	174.2	-170.9	157.9	3.4	111.2	E46 I231 V244 A245 E269 I274	E46-R272 IonicContact OE1-CZ 2.85Å; E46-R272 IonicContact OE1-NH1 3.36Å; E46-R272 PolarHBondContact OE1-NH1 2.86Å; E46-R272 IonicContact OE1-NH2 3.65Å; E46-R272 PolarHBondContact OE1-NH2 3.14Å; E46-R272 IonicContact OE2-CZ 3.21Å; E46-R272 IonicContact OE2-NH1 2.64Å; E46-R272 PolarHBondContact OE2-NH1 2.9Å; E46-R272 IonicContact OE2-NH2 3.6Å; I231-R272 HydrophobicContact CD1-CB 3.79Å; I231-R272 HydrophobicContact CD1-CG 4.47Å; I231-R272 HydrophobicContact CG1-CB 3.7Å; I231-R272 HydrophobicContact CG1-CG 4.48Å; V244-R272 PolarHBondContact O-NH2 3.17Å; V244-R272 VanDerWaalsContact O-NH2 3.07Å; A245-R272 PolarHBondContact O-NH2 3.3Å; E269-R272 PolarHBondContact N-O 2.86Å; E269-R272 PolarHBondContact O-N 2.92Å; R272-I274 HydrophobicContact CG-CG1 4.27Å
273	P	90.1	Very high	91.5	Very high	17 Å²	17	20.6 Å²	20.6	11%	0.11	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134.5	166.2	29.2	-33.4	0	0	0	110	V266 A267 M268 S271 Q378 E382	V266-P273 HydrophobicContact CG1-CB 3.68Å; A267-P273 CarbonylContact O-C 3.53Å; A267-P273 WeakPolarHBondContact O-CA 3.43Å; M268-P273 HydrophobicContact SD-CB 3.76Å; S271-P273 WeakPolarHBondContact O-CD 3.31Å; P273-Q378 HydrophobicContact CG-CB 4.47Å; P273-E382 HydrophobicContact CB-CB 3.7Å; P273-E382 HydrophobicContact CB-CG 3.97Å; P273-E382 HydrophobicContact CG-CB 3.49Å; P273-E382 VanDerWaalsContact CG-CB 3.49Å; P273-E382 HydrophobicContact CG-CG 3.83Å
274	I	88.9	Confident	91.4	Very high	6 Å²	6	24.6 Å²	24.6	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.8	178.2	-57.2	178.9	0	0	0	107.6	I231 I233 P247 F251 V266 A267 E269 R272 V276	I231-I274 HydrophobicContact CD1-CD1 4.41Å; I233-I274 HydrophobicContact CD1-CD1 3.7Å; P247-I274 HydrophobicContact CB-CG2 4.33Å; P247-I274 HydrophobicContact CG-CD1 4.4Å; P247-I274 HydrophobicContact CG-CG1 4.14Å; P247-I274 HydrophobicContact CG-CG2 4.19Å; F251-I274 HydrophobicContact CD2-CG2 3.82Å; F251-I274 HydrophobicContact CE2-CG2 3.56Å; V266-I274 CarbonylContact C-O 3.59Å; A267-I274 PolarHBondContact N-O 3.02Å; A267-I274 PolarHBondContact O-N 3.48Å; E269-I274 HydrophobicContact CB-CD1 3.66Å; E269-I274 HydrophobicContact CB-CG1 4.42Å; E269-I274 HydrophobicContact CG-CD1 4.33Å; R272-I274 HydrophobicContact CG-CG1 4.27Å; I274-V276 HydrophobicContact CG2-CG2 3.95Å
275	L	91.3	Very high	91.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	129.3	172.9	-75.1	70.2	0	0	0	109.5	S248 F251 L252 I264 V265 V266 E382 A383 L386 F388	S248-L275 PolarHBondContact OG-N 3.13Å; F251-L275 WeakPolarHBondContact CD2-O 3.49Å; L252-L275 HydrophobicContact CD1-CB 4.2Å; L252-L275 HydrophobicContact CD1-CD2 4.2Å; I264-L275 HydrophobicContact CG2-CB 4.1Å; I264-L275 HydrophobicContact CG2-CD2 4Å; I264-L275 HydrophobicContact CG2-CG 4.24Å; V265-L275 VanDerWaalsContact O-CA 3.32Å; V265-L275 WeakPolarHBondContact O-CA 3.33Å; V266-L275 HydrophobicContact CB-CD1 4.43Å; V266-L275 HydrophobicContact CB-CG 4.49Å; V266-L275 HydrophobicContact CG1-CD1 4.07Å; V266-L275 HydrophobicContact CG2-CD1 3.84Å; V266-L275 HydrophobicContact CG2-CD2 4.34Å; V266-L275 HydrophobicContact CG2-CG 3.76Å; L275-E382 HydrophobicContact CD1-CB 4.34Å; L275-E382 HydrophobicContact CD1-CG 3.62Å; L275-A383 HydrophobicContact CD2-CB 4.36Å; L275-L386 HydrophobicContact CB-CD1 4.43Å; L275-L386 HydrophobicContact CD1-CD1 3.44Å; L275-L386 VanDerWaalsContact CD1-CD1 3.44Å; L275-L386 HydrophobicContact CD2-CD1 3.85Å; L275-L386 HydrophobicContact CG-CD1 4.09Å; L275-F388 HydrophobicContact CD2-CD2 3.46Å; L275-F388 VanDerWaalsContact CD2-CD2 3.46Å; L275-F388 HydrophobicContact CD2-CE1 4.42Å; L275-F388 HydrophobicContact CD2-CE2 3.12Å; L275-F388 HydrophobicContact CD2-CG 4.27Å; L275-F388 HydrophobicContact CD2-CZ 3.67Å
276	V	90.6	Very high	90.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	135.2	-179.5	-175.3	0	0	0	0	108.3	V265 I274 A326 V330 L332	V265-V276 HydrophobicContact CG1-CB 4.33Å; V265-V276 WeakPolarHBondContact CG1-O 3.35Å; V265-V276 PolarHBondContact N-O 3.31Å; V265-V276 PolarHBondContact O-N 2.82Å; I274-V276 HydrophobicContact CG2-CG2 3.95Å; V276-A326 HydrophobicContact CG1-CB 4.23Å; V276-V330 HydrophobicContact CG1-CB 4.43Å; V276-V330 HydrophobicContact CG2-CB 4.32Å; V276-V330 HydrophobicContact CG2-CG1 4.41Å; V276-V330 HydrophobicContact CG2-CG2 4.24Å; V276-L332 HydrophobicContact CB-CD1 4.21Å; V276-L332 HydrophobicContact CB-CD2 4.11Å; V276-L332 HydrophobicContact CG1-CD1 3.88Å; V276-L332 HydrophobicContact CG1-CD2 4.2Å; V276-L332 HydrophobicContact CG1-CG 4.28Å; V276-L332 HydrophobicContact CG2-CD2 4.02Å
277	E	92.2	Very high	90.2	Very high	7 Å²	7	42.3 Å²	42.3	3%	0.033	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	129.3	171.3	-176.4	-172.1	-174.5	0	0	110.1	S262 I264 Q279 A327	S262-E277 WeakPolarHBondContact CB-OE1 3.37Å; S262-E277 VanDerWaalsContact OG-CD 3.32Å; S262-E277 WeakPolarHBondContact OG-CG 3.35Å; S262-E277 PolarHBondContact OG-OE1 2.93Å; I264-E277 HydrophobicContact CD1-CB 3.59Å; I264-E277 HydrophobicContact CD1-CG 3.8Å; E277-Q279 HydrophobicContact CG-CG 3.88Å; E277-Q279 WeakPolarHBondContact OE1-CG 3.36Å; E277-Q279 PolarHBondContact OE1-NE2 2.95Å; E277-Q279 PolarHBondContact OE2-NE2 3.46Å; E277-A327 HydrophobicContact CB-CB 3.79Å; E277-A327 WeakPolarHBondContact O-CB 3.42Å; E277-A327 PolarHBondContact O-N 2.94Å
278	V	94.8	Very high	89.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.5	165.5	178.4	0	0	0	0	108.1	S262 A263 V265 L297 L332 A340 V341 A344	S262-V278 WeakPolarHBondContact CA-O 3.28Å; A263-V278 PolarHBondContact N-O 3.23Å; A263-V278 PolarHBondContact O-N 3.5Å; V265-V278 HydrophobicContact CG1-CG2 4.14Å; V278-L297 HydrophobicContact CG1-CD1 4.1Å; V278-L332 HydrophobicContact CG2-CD1 3.83Å; V278-A340 HydrophobicContact CG2-CB 4.37Å; V278-V341 HydrophobicContact CG1-CG2 4.05Å; V278-V341 HydrophobicContact CG2-CG2 4.42Å; V278-A344 HydrophobicContact CB-CB 4.47Å; V278-A344 HydrophobicContact CG1-CB 4.04Å
279	Q	94.6	Very high	89.7	Confident	58 Å²	58	50.5 Å²	50.5	27%	0.271	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.6	177.3	-64.6	-178.2	-19.1	0	0	109.7	G261 E277 L324 K325	G261-Q279 CarbonylContact O-C 3.59Å; G261-Q279 WeakPolarHBondContact O-CA 3.32Å; E277-Q279 HydrophobicContact CG-CG 3.88Å; E277-Q279 WeakPolarHBondContact OE1-CG 3.36Å; E277-Q279 PolarHBondContact OE1-NE2 2.95Å; E277-Q279 PolarHBondContact OE2-NE2 3.46Å; Q279-L324 CarbonylContact O-C 3.55Å; Q279-L324 VanDerWaalsContact O-CA 3.22Å; Q279-L324 WeakPolarHBondContact O-CA 3.44Å; Q279-K325 HydrophobicContact CB-CG 4.13Å; Q279-K325 PolarHBondContact N-O 3.32Å; Q279-K325 PolarHBondContact O-N 3.25Å
280	A	96.8	Very high	90	Very high	9 Å²	9	49.4 Å²	49.4	7%	0.074	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.7	177.2	0	0	0	0	0	109.4	G261 Y323 L324 A344 I345 S348	G261-A280 VanDerWaalsContact CA-O 3.23Å; G261-A280 WeakPolarHBondContact CA-O 3.05Å; G261-A280 PolarHBondContact O-N 3.34Å; A280-Y323 CarbonylContact C-O 3.53Å; A280-Y323 WeakPolarHBondContact CA-O 3.27Å; A280-L324 HydrophobicContact CB-CD2 4.23Å; A280-L324 HydrophobicContact CB-CG 3.93Å; A280-A344 HydrophobicContact CB-CB 3.86Å; A280-I345 HydrophobicContact CB-CG1 4.15Å; A280-S348 WeakPolarHBondContact O-CB 3.42Å
281	L	96.5	Very high	90.4	Very high	103 Å²	103	53.7 Å²	53.7	54%	0.539	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	111.1	169.8	177.2	66.1	0	0	0	107.5	A322 Y323	L281-A322 WeakPolarHBondContact O-CA 3.09Å; L281-Y323 PolarHBondContact N-O 3.26Å; L281-Y323 PolarHBondContact O-N 3.42Å
282	V	96.9	Very high	90.9	Very high	9 Å²	9	56.4 Å²	56.4	6%	0.055	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.7	179.6	-176	0	0	0	0	107.7	L317 Q320 D321 I345 S348 Y349	V282-L317 HydrophobicContact CG1-CD2 4.18Å; V282-Q320 HydrophobicContact CG1-CB 3.53Å; V282-Q320 HydrophobicContact CG1-CG 3.89Å; V282-D321 CarbonylContact C-O 3.51Å; V282-D321 WeakPolarHBondContact CA-O 3.2Å; V282-I345 HydrophobicContact CG2-CG2 3.98Å; V282-S348 PolarHBondContact N-OG 2.77Å; V282-Y349 HydrophobicContact CG1-CD2 4.04Å
283	T	94.6	Very high	91.4	Very high	59 Å²	59	58.4 Å²	58.4	36%	0.362	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	148.4	-176.1	-169.9	0	0	0	0	111.2	T285 Q320 D321 Y323	T283-T285 PolarHBondContact O-N 3.46Å; T283-Q320 CarbonylContact O-C 3.56Å; T283-Q320 WeakPolarHBondContact O-CA 3.24Å; T283-Q320 PolarHBondContact O-OE1 3.38Å; T283-D321 HydrophobicContact CG2-CB 3.91Å; T283-D321 PolarHBondContact N-O 2.94Å; T283-D321 PolarHBondContact O-N 3.31Å; T283-Y323 HydrophobicContact CG2-CE2 4.21Å
284	P	93.8	Very high	91.7	Very high	85 Å²	85	59.1 Å²	59.1	55%	0.552	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.7	131.8	-179.8	-27.1	35.7	0	0	0	112.6	V286 Q320	P284-V286 PolarHBondContact O-N 2.85Å; P284-Q320 VanDerWaalsContact CA-OE1 3.31Å; P284-Q320 VanDerWaalsContact N-OE1 3.08Å
285	T	92.1	Very high	91.9	Very high	32 Å²	32	63.1 Å²	63.1	20%	0.196	35%	0.351	C	S	.	.			trans	-69.5	120	174.8	-57	0	0	0	0	109.9	T283 A290 N319 D321	T283-T285 PolarHBondContact O-N 3.46Å; T285-A290 WeakPolarHBondContact OG1-CA 3.43Å; T285-A290 WeakPolarHBondContact OG1-CB 3.27Å; T285-N319 WeakPolarHBondContact CB-O 3.32Å; T285-N319 PolarHBondContact N-O 2.82Å; T285-N319 PolarHBondContact OG1-O 3.17Å; T285-D321 WeakPolarHBondContact CB-OD1 3.4Å; T285-D321 WeakPolarHBondContact CG2-OD1 3.4Å; T285-D321 PolarHBondContact OG1-N 2.89Å; T285-D321 VanDerWaalsContact OG1-N 3.15Å; T285-D321 PolarHBondContact OG1-OD1 2.68Å
286	V	83.7	Confident	91.9	Very high	141 Å²	141	64.2 Å²	64.2	86%	0.855	36%	0.362	S	S	*	.			trans	-80.9	-33.2	-176.7	-178.3	0	0	0	0	112.4	P284	P284-V286 PolarHBondContact O-N 2.85Å
287	F	83.4	Confident	92.1	Very high	198 Å²	198	64.9 Å²	64.9	87%	0.868	37%	0.365	S	S	*	.	S	Bend	trans	-158	138.7	179	-174.6	-100	0	0	0	112.7
288	G	84.1	Confident	92.2	Very high	56 Å²	56	67.7 Å²	67.7	58%	0.577	38%	0.381	S	S	*	.	S	Bend	trans	80.2	-151.4	174.5	0	0	0	0	0	113.9
289	N	87.7	Confident	92.3	Very high	152 Å²	152	72 Å²	72	81%	0.813	40%	0.4	S	S	*	.	S	Bend	trans	-79.5	137.1	179.5	-65.4	-34.5	0	0	0	110.4	K291	N289-K291 PolarHBondContact O-N 3.27Å
290	A	88.8	Confident	92.3	Very high	18 Å²	18	74.6 Å²	74.6	15%	0.149	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-51.9	125.3	174.4	0	0	0	0	0	111.5	T285 Q318 Q320 D321	T285-A290 WeakPolarHBondContact OG1-CA 3.43Å; T285-A290 WeakPolarHBondContact OG1-CB 3.27Å; A290-Q318 VanDerWaalsContact CB-O 3.29Å; A290-Q318 WeakPolarHBondContact CB-O 3.37Å; A290-Q320 WeakPolarHBondContact CB-O 3.39Å; A290-D321 WeakPolarHBondContact CA-OD1 3.35Å
291	K	91.3	Very high	92.3	Very high	131 Å²	131	76.9 Å²	76.9	57%	0.57	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-86	138.3	-179.7	-70.4	-178.7	-179.8	175.7	0	110.3	N289 D321 A322	N289-K291 PolarHBondContact O-N 3.27Å; K291-D321 HydrophobicContact CB-CB 4.49Å; K291-D321 PolarHBondContact N-OD1 3.38Å; K291-D321 CarbonylContact O-C 3.5Å; K291-D321 VanDerWaalsContact O-CA 3.24Å; K291-D321 WeakPolarHBondContact O-CA 3.43Å; K291-A322 PolarHBondContact O-N 3.42Å
292	R	93	Very high	92.4	Very high	80 Å²	80	72 Å²	72	30%	0.302	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.3	172.3	-62.6	176	-172.8	88.9	5	107.6	F299 S303 M306 A322	R292-F299 HydrophobicContact CB-CD2 4.34Å; R292-F299 HydrophobicContact CB-CE2 3.59Å; R292-F299 HydrophobicContact CB-CZ 4.16Å; R292-F299 VanDerWaalsContact O-CE2 3.31Å; R292-F299 WeakPolarHBondContact O-CE2 3.37Å; R292-S303 WeakPolarHBondContact CD-OG 3.44Å; R292-M306 HydrophobicContact CG-SD 4.19Å; R292-A322 CarbonylContact C-O 3.59Å; R292-A322 VanDerWaalsContact CA-O 3.3Å; R292-A322 WeakPolarHBondContact CA-O 3.43Å
293	T	94.9	Very high	92.3	Very high	66 Å²	66	72.9 Å²	72.9	41%	0.405	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.3	179.8	-52.6	0	0	0	0	108.2	A322 Y323 L324	T293-A322 PolarHBondContact N-O 2.94Å; T293-Y323 HydrophobicContact CG2-CD1 4.39Å; T293-Y323 CarbonylContact O-C 3.48Å; T293-Y323 WeakPolarHBondContact O-CA 3.36Å; T293-L324 PolarHBondContact O-N 3.32Å
294	T	95.6	Very high	92.4	Very high	32 Å²	32	73.8 Å²	73.8	20%	0.196	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.1	-179.3	64	0	0	0	0	111.5	L297 V302 L324	T294-L297 WeakPolarHBondContact CB-O 3.32Å; T294-L297 PolarHBondContact OG1-O 2.9Å; T294-V302 HydrophobicContact CG2-CB 3.97Å; T294-V302 HydrophobicContact CG2-CG1 4.14Å; T294-V302 HydrophobicContact CG2-CG2 3.79Å; T294-L324 CarbonylContact C-O 3.52Å; T294-L324 VanDerWaalsContact CA-O 3.27Å; T294-L324 WeakPolarHBondContact CA-O 3.45Å; T294-L324 HydrophobicContact CG2-CB 4.45Å
295	T	93	Very high	92.6	Very high	90 Å²	90	69.8 Å²	69.8	55%	0.552	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	122.9	172.3	-56.6	0	0	0	0	109.4	L297 L324 K325 A326	T295-L297 PolarHBondContact O-N 3.37Å; T295-L324 PolarHBondContact N-O 2.74Å; T295-K325 CarbonylContact O-C 3.49Å; T295-K325 WeakPolarHBondContact O-CA 3.35Å; T295-A326 PolarHBondContact O-N 2.95Å
296	G	91.2	Very high	92.8	Very high	22 Å²	22	68.3 Å²	68.3	23%	0.227	37%	0.37	C	S	.	.	S	Bend	trans	74.3	3.2	-175.1	0	0	0	0	0	114.9	L332	G296-L332 PolarHBondContact O-N 3.43Å
297	L	95.1	Very high	93.4	Very high	14 Å²	14	64.3 Å²	64.3	7%	0.073	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-131	145.4	178.7	-69.2	162.8	0	0	0	110.2	V278 T294 T295 F299 V302 L324 A326 L332 I337 V341	V278-L297 HydrophobicContact CG1-CD1 4.1Å; T294-L297 WeakPolarHBondContact CB-O 3.32Å; T294-L297 PolarHBondContact OG1-O 2.9Å; T295-L297 PolarHBondContact O-N 3.37Å; L297-F299 PolarHBondContact O-N 2.96Å; L297-V302 HydrophobicContact CB-CG2 4.21Å; L297-L324 HydrophobicContact CD1-CB 3.93Å; L297-L324 HydrophobicContact CD1-CD2 4.48Å; L297-A326 HydrophobicContact CG-CB 4.49Å; L297-L332 HydrophobicContact CD2-CB 3.87Å; L297-L332 HydrophobicContact CD2-CD1 4.25Å; L297-I337 HydrophobicContact CD2-CD1 3.76Å; L297-V341 HydrophobicContact CD2-CG2 4.03Å
298	D	95.4	Very high	94.1	Very high	67 Å²	67	55.2 Å²	55.2	36%	0.358	31%	0.312	S	S	.	.			trans	-69.4	128	175.1	175.6	-113.5	0	0	0	111.8	N300 R301 V302	D298-N300 PolarHBondContact O-N 3.47Å; D298-N300 WeakPolarHBondContact OD1-CB 3.46Å; D298-N300 PolarHBondContact OD1-N 2.66Å; D298-R301 HydrophobicContact CB-CB 3.96Å; D298-R301 PolarHBondContact O-N 2.97Å; D298-R301 WeakPolarHBondContact OD1-CB 3.16Å; D298-R301 PolarHBondContact OD1-N 3.43Å; D298-V302 WeakPolarHBondContact O-CG2 3.29Å; D298-V302 PolarHBondContact O-N 3.36Å; D298-V302 VanDerWaalsContact O-N 3.1Å
299	F	95.5	Very high	94.7	Very high	91 Å²	91	52.5 Å²	52.5	40%	0.399	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-41.4	-177.9	174.1	-86.4	0	0	0	112.5	R292 L297 V302 S303	R292-F299 HydrophobicContact CB-CD2 4.34Å; R292-F299 HydrophobicContact CB-CE2 3.59Å; R292-F299 HydrophobicContact CB-CZ 4.16Å; R292-F299 VanDerWaalsContact O-CE2 3.31Å; R292-F299 WeakPolarHBondContact O-CE2 3.37Å; L297-F299 PolarHBondContact O-N 2.96Å; F299-V302 PolarHBondContact O-N 3.29Å; F299-S303 WeakPolarHBondContact O-CB 3.38Å; F299-S303 PolarHBondContact O-N 3.45Å; F299-S303 PolarHBondContact O-OG 2.93Å
300	N	96	Very high	95.1	Very high	111 Å²	111	47.9 Å²	47.9	59%	0.594	26%	0.258	S	S	*	.	H	α-helix	trans	-69.6	-41.4	-177.1	-66.6	-45.6	0	0	0	110.9	D298 S303 L304	D298-N300 PolarHBondContact O-N 3.47Å; D298-N300 WeakPolarHBondContact OD1-CB 3.46Å; D298-N300 PolarHBondContact OD1-N 2.66Å; N300-S303 PolarHBondContact O-N 2.82Å; N300-L304 WeakPolarHBondContact O-CB 3.02Å; N300-L304 PolarHBondContact O-N 3.45Å
301	R	96.9	Very high	95.4	Very high	57 Å²	57	54.9 Å²	54.9	22%	0.215	29%	0.285	C	S	.	.	H	α-helix	trans	-57.1	-51	173	179.6	-177.9	-66	-80.4	-1.8	111.4	D298 S303 L304 I305 D338	D298-R301 HydrophobicContact CB-CB 3.96Å; D298-R301 PolarHBondContact O-N 2.97Å; D298-R301 WeakPolarHBondContact OD1-CB 3.16Å; D298-R301 PolarHBondContact OD1-N 3.43Å; R301-S303 VanDerWaalsContact C-N 3.33Å; R301-S303 PolarHBondContact O-N 3.43Å; R301-L304 PolarHBondContact O-N 3.1Å; R301-I305 HydrophobicContact CG-CD1 3.86Å; R301-I305 VanDerWaalsContact O-CG1 3.31Å; R301-I305 WeakPolarHBondContact O-CG1 3.34Å; R301-I305 PolarHBondContact O-N 2.94Å; R301-D338 VanDerWaalsContact CD-OD1 3.32Å; R301-D338 WeakPolarHBondContact CD-OD1 3.46Å; R301-D338 IonicContact CZ-OD1 3.68Å; R301-D338 IonicContact NE-OD1 3.9Å; R301-D338 IonicContact NH1-OD1 2.74Å; R301-D338 PolarHBondContact NH1-OD1 2.72Å; R301-D338 IonicContact NH1-OD2 3.31Å; R301-D338 PolarHBondContact NH1-OD2 3.49Å
302	V	96.9	Very high	95.6	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-45.1	177.9	170.1	0	0	0	0	111.1	T294 L297 D298 F299 L304 I305 M306 L324 V341	T294-V302 HydrophobicContact CG2-CB 3.97Å; T294-V302 HydrophobicContact CG2-CG1 4.14Å; T294-V302 HydrophobicContact CG2-CG2 3.79Å; L297-V302 HydrophobicContact CB-CG2 4.21Å; D298-V302 WeakPolarHBondContact O-CG2 3.29Å; D298-V302 PolarHBondContact O-N 3.36Å; D298-V302 VanDerWaalsContact O-N 3.1Å; F299-V302 PolarHBondContact O-N 3.29Å; V302-L304 VanDerWaalsContact C-N 3.31Å; V302-L304 PolarHBondContact O-N 3.17Å; V302-I305 PolarHBondContact O-N 2.68Å; V302-M306 HydrophobicContact CG1-SD 4.35Å; V302-M306 WeakPolarHBondContact O-CG 3.44Å; V302-M306 PolarHBondContact O-N 3.29Å; V302-L324 HydrophobicContact CG1-CD1 3.68Å; V302-L324 HydrophobicContact CG1-CD2 3.8Å; V302-L324 HydrophobicContact CG1-CG 4.31Å; V302-L324 HydrophobicContact CG2-CD2 4.04Å; V302-V341 HydrophobicContact CG2-CG1 4.19Å
303	S	95.7	Very high	95.6	Very high	28 Å²	28	52.5 Å²	52.5	20%	0.196	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-40.7	178.3	-61.8	0	0	0	0	112.3	R292 F299 N300 R301 A307	R292-S303 WeakPolarHBondContact CD-OG 3.44Å; F299-S303 WeakPolarHBondContact O-CB 3.38Å; F299-S303 PolarHBondContact O-N 3.45Å; F299-S303 PolarHBondContact O-OG 2.93Å; N300-S303 PolarHBondContact O-N 2.82Å; R301-S303 VanDerWaalsContact C-N 3.33Å; R301-S303 PolarHBondContact O-N 3.43Å; S303-A307 PolarHBondContact O-N 2.95Å; S303-A307 VanDerWaalsContact O-N 3.11Å
304	L	96	Very high	95.4	Very high	77 Å²	77	52.3 Å²	52.3	40%	0.403	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-44.6	176.2	-174.9	157.9	0	0	0	111.5	N300 R301 V302 M306 A307 V308 L366	N300-L304 WeakPolarHBondContact O-CB 3.02Å; N300-L304 PolarHBondContact O-N 3.45Å; R301-L304 PolarHBondContact O-N 3.1Å; V302-L304 VanDerWaalsContact C-N 3.31Å; V302-L304 PolarHBondContact O-N 3.17Å; L304-M306 VanDerWaalsContact C-N 3.33Å; L304-M306 PolarHBondContact O-N 3.04Å; L304-A307 WeakPolarHBondContact O-CB 3.31Å; L304-A307 PolarHBondContact O-N 2.95Å; L304-A307 VanDerWaalsContact O-N 3.17Å; L304-V308 HydrophobicContact CD2-CG2 4.16Å; L304-V308 WeakPolarHBondContact O-CG2 3.45Å; L304-V308 PolarHBondContact O-N 2.9Å; L304-L366 HydrophobicContact CD1-CD2 3.94Å; L304-L366 HydrophobicContact CD2-CD2 3.57Å; L304-L366 HydrophobicContact CG-CD2 3.73Å
305	I	97.7	Very high	95.4	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-42.9	176.6	-69.6	166.4	0	0	0	111	R301 V302 A307 V308 L309 D338 V341 A342 I345 I364	R301-I305 HydrophobicContact CG-CD1 3.86Å; R301-I305 VanDerWaalsContact O-CG1 3.31Å; R301-I305 WeakPolarHBondContact O-CG1 3.34Å; R301-I305 PolarHBondContact O-N 2.94Å; V302-I305 PolarHBondContact O-N 2.68Å; I305-A307 VanDerWaalsContact C-N 3.34Å; I305-A307 PolarHBondContact O-N 3.11Å; I305-V308 PolarHBondContact O-N 3.39Å; I305-L309 HydrophobicContact CG2-CD1 4.14Å; I305-L309 PolarHBondContact O-N 2.93Å; I305-D338 HydrophobicContact CD1-CB 3.83Å; I305-D338 HydrophobicContact CG1-CB 4.38Å; I305-V341 HydrophobicContact CD1-CB 3.94Å; I305-V341 HydrophobicContact CD1-CG1 3.74Å; I305-V341 HydrophobicContact CG2-CG1 4.24Å; I305-A342 HydrophobicContact CG2-CB 3.66Å; I305-I345 HydrophobicContact CG2-CD1 4.23Å; I305-I364 HydrophobicContact CG2-CD1 4.41Å
306	M	97.1	Very high	95.4	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-59.8	-43.8	174.7	-71.8	-177.6	76.8	0	0	111.8	R292 V302 L304 V308 L309 E310 L317 A322 I345	R292-M306 HydrophobicContact CG-SD 4.19Å; V302-M306 HydrophobicContact CG1-SD 4.35Å; V302-M306 WeakPolarHBondContact O-CG 3.44Å; V302-M306 PolarHBondContact O-N 3.29Å; L304-M306 VanDerWaalsContact C-N 3.33Å; L304-M306 PolarHBondContact O-N 3.04Å; M306-V308 VanDerWaalsContact C-N 3.31Å; M306-V308 PolarHBondContact O-N 3.29Å; M306-L309 WeakPolarHBondContact O-CB 3.29Å; M306-L309 PolarHBondContact O-N 3.43Å; M306-E310 WeakPolarHBondContact O-CB 3.39Å; M306-E310 PolarHBondContact O-N 2.95Å; M306-L317 HydrophobicContact CB-CD1 4.22Å; M306-L317 HydrophobicContact CE-CB 3.93Å; M306-L317 HydrophobicContact CE-CD1 4.35Å; M306-L317 HydrophobicContact CG-CD1 4.35Å; M306-A322 HydrophobicContact CE-CB 3.67Å; M306-A322 HydrophobicContact SD-CB 3.74Å; M306-I345 HydrophobicContact CG-CD1 3.82Å
307	A	95.9	Very high	95.5	Very high	57 Å²	57	51.3 Å²	51.3	47%	0.471	28%	0.275	S	S	.	.	H	α-helix	trans	-62.9	-37.2	177.1	0	0	0	0	0	112.4	S303 L304 I305 K311	S303-A307 PolarHBondContact O-N 2.95Å; S303-A307 VanDerWaalsContact O-N 3.11Å; L304-A307 WeakPolarHBondContact O-CB 3.31Å; L304-A307 PolarHBondContact O-N 2.95Å; L304-A307 VanDerWaalsContact O-N 3.17Å; I305-A307 VanDerWaalsContact C-N 3.34Å; I305-A307 PolarHBondContact O-N 3.11Å; A307-K311 WeakPolarHBondContact O-CB 3.33Å; A307-K311 PolarHBondContact O-N 2.95Å
308	V	97.8	Very high	95.2	Very high	6 Å²	6	57.3 Å²	57.3	4%	0.036	30%	0.303	C	S	.	.	H	α-helix	trans	-68.8	-44.6	174.8	177.8	0	0	0	0	111.2	L304 I305 M306 E310 K311 R312 I364 L366 L415	L304-V308 HydrophobicContact CD2-CG2 4.16Å; L304-V308 WeakPolarHBondContact O-CG2 3.45Å; L304-V308 PolarHBondContact O-N 2.9Å; I305-V308 PolarHBondContact O-N 3.39Å; M306-V308 VanDerWaalsContact C-N 3.31Å; M306-V308 PolarHBondContact O-N 3.29Å; V308-E310 VanDerWaalsContact C-N 3.29Å; V308-E310 PolarHBondContact O-N 3.27Å; V308-K311 PolarHBondContact O-N 3.12Å; V308-R312 HydrophobicContact CG1-CB 4.32Å; V308-R312 HydrophobicContact CG1-CG 3.86Å; V308-R312 WeakPolarHBondContact O-CA 3.48Å; V308-R312 WeakPolarHBondContact O-CB 3.38Å; V308-R312 WeakPolarHBondContact O-CG 3.4Å; V308-R312 PolarHBondContact O-N 3.34Å; V308-I364 HydrophobicContact CB-CG2 4.38Å; V308-I364 HydrophobicContact CG1-CG2 3.75Å; V308-L366 HydrophobicContact CG2-CD2 4.12Å; V308-L415 HydrophobicContact CG1-CD2 4.02Å
309	L	97.6	Very high	95	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-55.7	-45.6	174.2	-83.2	168.3	0	0	0	111.3	I305 M306 A313 G314 L315 L317 A342 I345 L415 L419	I305-L309 HydrophobicContact CG2-CD1 4.14Å; I305-L309 PolarHBondContact O-N 2.93Å; M306-L309 WeakPolarHBondContact O-CB 3.29Å; M306-L309 PolarHBondContact O-N 3.43Å; L309-A313 HydrophobicContact CD2-CB 4.43Å; L309-A313 CarbonylContact O-C 3.47Å; L309-A313 VanDerWaalsContact O-CA 3.29Å; L309-A313 WeakPolarHBondContact O-CA 3.31Å; L309-A313 VanDerWaalsContact O-CB 3.23Å; L309-A313 WeakPolarHBondContact O-CB 3.48Å; L309-A313 PolarHBondContact O-N 3.08Å; L309-G314 PolarHBondContact O-N 3.38Å; L309-L315 HydrophobicContact CB-CD1 4.06Å; L309-L315 HydrophobicContact CD2-CD1 3.64Å; L309-L315 HydrophobicContact CG-CD1 4.33Å; L309-L317 HydrophobicContact CB-CD1 3.73Å; L309-L317 HydrophobicContact CD1-CD1 4.03Å; L309-A342 HydrophobicContact CD1-CB 4.14Å; L309-A342 HydrophobicContact CD2-CB 4.19Å; L309-A342 HydrophobicContact CG-CB 4.26Å; L309-I345 HydrophobicContact CD1-CB 3.86Å; L309-I345 HydrophobicContact CD1-CD1 4.07Å; L309-I345 HydrophobicContact CD1-CG2 3.67Å; L309-L415 HydrophobicContact CD2-CD1 4.22Å; L309-L415 HydrophobicContact CD2-CD2 3.66Å; L309-L415 HydrophobicContact CD2-CG 4.13Å; L309-L415 HydrophobicContact CG-CD2 4Å; L309-L419 HydrophobicContact CD2-CD1 3.87Å
310	E	95.9	Very high	95	Very high	55 Å²	55	55.1 Å²	55.1	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-64.1	-52.2	178.8	177.1	164.5	179.9	0	0	112	M306 V308 R312 G314 L315 Q318	M306-E310 WeakPolarHBondContact O-CB 3.39Å; M306-E310 PolarHBondContact O-N 2.95Å; V308-E310 VanDerWaalsContact C-N 3.29Å; V308-E310 PolarHBondContact O-N 3.27Å; E310-R312 PolarHBondContact O-N 2.92Å; E310-G314 WeakPolarHBondContact O-CA 3.43Å; E310-G314 PolarHBondContact O-N 3.06Å; E310-L315 WeakPolarHBondContact CA-O 3.41Å; E310-L315 VanDerWaalsContact CB-O 3.24Å; E310-L315 WeakPolarHBondContact CB-O 3.48Å; E310-L315 VanDerWaalsContact CG-O 3.29Å; E310-L315 WeakPolarHBondContact CG-O 3.46Å; E310-Q318 PolarHBondContact OE2-N 3.22Å; E310-Q318 VanDerWaalsContact OE2-N 3.12Å
311	K	95.9	Very high	95	Very high	164 Å²	164	50.7 Å²	50.7	71%	0.713	27%	0.271	S	S	*	.	H	α-helix	trans	-73.6	-31.2	-175	-170.3	57.7	174.3	-177.3	0	113.9	A307 V308	A307-K311 WeakPolarHBondContact O-CB 3.33Å; A307-K311 PolarHBondContact O-N 2.95Å; V308-K311 PolarHBondContact O-N 3.12Å
312	R	94.5	Very high	95	Very high	127 Å²	127	48 Å²	48	48%	0.479	26%	0.261	S	S	.	.	H	α-helix	trans	-108.4	-25.4	-170.4	-52.3	-58.9	-179.4	-178.2	1	114	V308 E310 L366 T367	V308-R312 HydrophobicContact CG1-CB 4.32Å; V308-R312 HydrophobicContact CG1-CG 3.86Å; V308-R312 WeakPolarHBondContact O-CA 3.48Å; V308-R312 WeakPolarHBondContact O-CB 3.38Å; V308-R312 WeakPolarHBondContact O-CG 3.4Å; V308-R312 PolarHBondContact O-N 3.34Å; E310-R312 PolarHBondContact O-N 2.92Å; R312-L366 PolarHBondContact NE-O 3.22Å; R312-L366 PolarHBondContact NH2-O 2.7Å; R312-T367 WeakPolarHBondContact CD-O 3.49Å
313	A	92.4	Very high	95	Very high	35 Å²	35	52.2 Å²	52.2	29%	0.289	28%	0.278	S	S	.	.	H	α-helix	trans	-110.9	-4.3	176.7	0	0	0	0	0	113.7	L309 L315 L419	L309-A313 HydrophobicContact CD2-CB 4.43Å; L309-A313 CarbonylContact O-C 3.47Å; L309-A313 VanDerWaalsContact O-CA 3.29Å; L309-A313 WeakPolarHBondContact O-CA 3.31Å; L309-A313 VanDerWaalsContact O-CB 3.23Å; L309-A313 WeakPolarHBondContact O-CB 3.48Å; L309-A313 PolarHBondContact O-N 3.08Å; A313-L315 VanDerWaalsContact C-N 3.35Å; A313-L315 HydrophobicContact CB-CD1 4.27Å; A313-L315 HydrophobicContact CB-CG 4.48Å; A313-L419 HydrophobicContact CB-CD1 3.56Å
314	G	92.2	Very high	95	Very high	62 Å²	62	51.1 Å²	51.1	64%	0.639	27%	0.269	S	S	*	.			trans	73.9	23	174.8	0	0	0	0	0	114.2	L309 E310	L309-G314 PolarHBondContact O-N 3.38Å; E310-G314 WeakPolarHBondContact O-CA 3.43Å; E310-G314 PolarHBondContact O-N 3.06Å
315	L	93.9	Very high	94.9	Very high	9 Å²	9	52.4 Å²	52.4	5%	0.047	27%	0.272	C	S	.	.			trans	-84.7	121.8	176.6	-66	161.8	0	0	0	109.6	L309 E310 A313 L317 A346 Y349 K350 L419	L309-L315 HydrophobicContact CB-CD1 4.06Å; L309-L315 HydrophobicContact CD2-CD1 3.64Å; L309-L315 HydrophobicContact CG-CD1 4.33Å; E310-L315 WeakPolarHBondContact CA-O 3.41Å; E310-L315 VanDerWaalsContact CB-O 3.24Å; E310-L315 WeakPolarHBondContact CB-O 3.48Å; E310-L315 VanDerWaalsContact CG-O 3.29Å; E310-L315 WeakPolarHBondContact CG-O 3.46Å; A313-L315 VanDerWaalsContact C-N 3.35Å; A313-L315 HydrophobicContact CB-CD1 4.27Å; A313-L315 HydrophobicContact CB-CG 4.48Å; L315-L317 VanDerWaalsContact C-N 3.3Å; L315-L317 HydrophobicContact CB-CD1 4.23Å; L315-L317 HydrophobicContact CB-CD2 4.32Å; L315-L317 HydrophobicContact CB-CG 3.9Å; L315-L317 PolarHBondContact O-N 2.66Å; L315-A346 HydrophobicContact CD1-CB 4.13Å; L315-Y349 HydrophobicContact CD2-CD1 3.34Å; L315-Y349 HydrophobicContact CD2-CE1 3.57Å; L315-Y349 HydrophobicContact CD2-CG 4.23Å; L315-K350 HydrophobicContact CD2-CG 4.45Å; L315-L419 HydrophobicContact CD1-CD1 4.27Å
316	L	93	Very high	94.6	Very high	112 Å²	112	52.6 Å²	52.6	59%	0.586	27%	0.274	S	S	*	.			trans	-79	79.3	179.7	-65.2	171.5	0	0	0	110.2	N319 Y349	L316-N319 PolarHBondContact O-OD1 2.96Å; L316-Y349 WeakPolarHBondContact O-CE2 3.34Å
317	L	94	Very high	93.8	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	28%	0.279	C	S	.	.			trans	-93.4	-13.4	-174.9	-63.3	178.1	0	0	0	113.7	V282 M306 L309 L315 N319 Q320 I345 Y349	V282-L317 HydrophobicContact CG1-CD2 4.18Å; M306-L317 HydrophobicContact CB-CD1 4.22Å; M306-L317 HydrophobicContact CE-CB 3.93Å; M306-L317 HydrophobicContact CE-CD1 4.35Å; M306-L317 HydrophobicContact CG-CD1 4.35Å; L309-L317 HydrophobicContact CB-CD1 3.73Å; L309-L317 HydrophobicContact CD1-CD1 4.03Å; L315-L317 VanDerWaalsContact C-N 3.3Å; L315-L317 HydrophobicContact CB-CD1 4.23Å; L315-L317 HydrophobicContact CB-CD2 4.32Å; L315-L317 HydrophobicContact CB-CG 3.9Å; L315-L317 PolarHBondContact O-N 2.66Å; L317-N319 PolarHBondContact O-N 2.85Å; L317-Q320 HydrophobicContact CD2-CG 4.36Å; L317-Q320 PolarHBondContact O-N 2.98Å; L317-Q320 VanDerWaalsContact O-N 3.1Å; L317-I345 HydrophobicContact CD1-CG2 3.85Å; L317-I345 HydrophobicContact CD2-CG2 4.24Å; L317-Y349 HydrophobicContact CD2-CD2 3.49Å; L317-Y349 VanDerWaalsContact CD2-CD2 3.49Å; L317-Y349 HydrophobicContact CD2-CE2 4.01Å; L317-Y349 HydrophobicContact CD2-CG 3.94Å
318	Q	89.4	Confident	92.7	Very high	141 Å²	141	52.2 Å²	52.2	66%	0.659	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.3	-179.3	-175.9	179.2	-9	0	0	113.5	A290 E310	A290-Q318 VanDerWaalsContact CB-O 3.29Å; A290-Q318 WeakPolarHBondContact CB-O 3.37Å; E310-Q318 PolarHBondContact OE2-N 3.22Å; E310-Q318 VanDerWaalsContact OE2-N 3.12Å
319	N	91.3	Very high	91.4	Very high	92 Å²	92	52.6 Å²	52.6	49%	0.492	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	23.3	-179.4	68.8	-17.8	0	0	0	113.2	T285 L316 L317	T285-N319 WeakPolarHBondContact CB-O 3.32Å; T285-N319 PolarHBondContact N-O 2.82Å; T285-N319 PolarHBondContact OG1-O 3.17Å; L316-N319 PolarHBondContact O-OD1 2.96Å; L317-N319 PolarHBondContact O-N 2.85Å
320	Q	94.6	Very high	90.4	Very high	19 Å²	19	53.8 Å²	53.8	9%	0.089	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.1	-179.5	-54	-64.2	-39.1	0	0	110.6	V282 T283 P284 A290 L317 Y349	V282-Q320 HydrophobicContact CG1-CB 3.53Å; V282-Q320 HydrophobicContact CG1-CG 3.89Å; T283-Q320 CarbonylContact O-C 3.56Å; T283-Q320 WeakPolarHBondContact O-CA 3.24Å; T283-Q320 PolarHBondContact O-OE1 3.38Å; P284-Q320 VanDerWaalsContact CA-OE1 3.31Å; P284-Q320 VanDerWaalsContact N-OE1 3.08Å; A290-Q320 WeakPolarHBondContact CB-O 3.39Å; L317-Q320 HydrophobicContact CD2-CG 4.36Å; L317-Q320 PolarHBondContact O-N 2.98Å; L317-Q320 VanDerWaalsContact O-N 3.1Å; Q320-Y349 HydrophobicContact CG-CD2 4.07Å; Q320-Y349 HydrophobicContact CG-CE2 3.94Å
321	D	95.4	Very high	89.9	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.102	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	136.8	163.5	-68.5	-8.9	0	0	0	108.6	V282 T283 T285 A290 K291 Y323	V282-D321 CarbonylContact C-O 3.51Å; V282-D321 WeakPolarHBondContact CA-O 3.2Å; T283-D321 HydrophobicContact CG2-CB 3.91Å; T283-D321 PolarHBondContact N-O 2.94Å; T283-D321 PolarHBondContact O-N 3.31Å; T285-D321 WeakPolarHBondContact CB-OD1 3.4Å; T285-D321 WeakPolarHBondContact CG2-OD1 3.4Å; T285-D321 PolarHBondContact OG1-N 2.89Å; T285-D321 VanDerWaalsContact OG1-N 3.15Å; T285-D321 PolarHBondContact OG1-OD1 2.68Å; A290-D321 WeakPolarHBondContact CA-OD1 3.35Å; K291-D321 HydrophobicContact CB-CB 4.49Å; K291-D321 PolarHBondContact N-OD1 3.38Å; K291-D321 CarbonylContact O-C 3.5Å; K291-D321 VanDerWaalsContact O-CA 3.24Å; K291-D321 WeakPolarHBondContact O-CA 3.43Å; D321-Y323 HydrophobicContact CB-CE2 3.88Å
322	A	97	Very high	89.6	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.1	-178.8	0	0	0	0	0	110.8	L281 K291 R292 T293 M306 L324	L281-A322 WeakPolarHBondContact O-CA 3.09Å; K291-A322 PolarHBondContact O-N 3.42Å; R292-A322 CarbonylContact C-O 3.59Å; R292-A322 VanDerWaalsContact CA-O 3.3Å; R292-A322 WeakPolarHBondContact CA-O 3.43Å; T293-A322 PolarHBondContact N-O 2.94Å; M306-A322 HydrophobicContact CE-CB 3.67Å; M306-A322 HydrophobicContact SD-CB 3.74Å; A322-L324 HydrophobicContact CB-CD1 3.83Å
323	Y	96.9	Very high	89.4	Confident	89 Å²	89	50 Å²	50	35%	0.349	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118.4	174.7	-54.9	-93.9	0	0	0	108.1	A280 L281 T283 T293 D321	A280-Y323 CarbonylContact C-O 3.53Å; A280-Y323 WeakPolarHBondContact CA-O 3.27Å; L281-Y323 PolarHBondContact N-O 3.26Å; L281-Y323 PolarHBondContact O-N 3.42Å; T283-Y323 HydrophobicContact CG2-CE2 4.21Å; T293-Y323 HydrophobicContact CG2-CD1 4.39Å; T293-Y323 CarbonylContact O-C 3.48Å; T293-Y323 WeakPolarHBondContact O-CA 3.36Å; D321-Y323 HydrophobicContact CB-CE2 3.88Å
324	L	97	Very high	89.5	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142.9	-179.3	-66.9	83.9	0	0	0	111.3	Q279 A280 T293 T294 T295 L297 V302 A322 V341 I345	Q279-L324 CarbonylContact O-C 3.55Å; Q279-L324 VanDerWaalsContact O-CA 3.22Å; Q279-L324 WeakPolarHBondContact O-CA 3.44Å; A280-L324 HydrophobicContact CB-CD2 4.23Å; A280-L324 HydrophobicContact CB-CG 3.93Å; T293-L324 PolarHBondContact O-N 3.32Å; T294-L324 CarbonylContact C-O 3.52Å; T294-L324 VanDerWaalsContact CA-O 3.27Å; T294-L324 WeakPolarHBondContact CA-O 3.45Å; T294-L324 HydrophobicContact CG2-CB 4.45Å; T295-L324 PolarHBondContact N-O 2.74Å; L297-L324 HydrophobicContact CD1-CB 3.93Å; L297-L324 HydrophobicContact CD1-CD2 4.48Å; V302-L324 HydrophobicContact CG1-CD1 3.68Å; V302-L324 HydrophobicContact CG1-CD2 3.8Å; V302-L324 HydrophobicContact CG1-CG 4.31Å; V302-L324 HydrophobicContact CG2-CD2 4.04Å; A322-L324 HydrophobicContact CB-CD1 3.83Å; L324-V341 HydrophobicContact CD2-CG1 3.8Å; L324-I345 HydrophobicContact CD2-CD1 3.93Å; L324-I345 HydrophobicContact CD2-CG1 3.81Å
325	K	93.6	Very high	89.7	Confident	104 Å²	104	49.2 Å²	49.2	45%	0.452	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	150.7	168.8	66.9	178.2	-172.6	175.2	0	112.4	Q279 T295	Q279-K325 HydrophobicContact CB-CG 4.13Å; Q279-K325 PolarHBondContact N-O 3.32Å; Q279-K325 PolarHBondContact O-N 3.25Å; T295-K325 CarbonylContact O-C 3.49Å; T295-K325 WeakPolarHBondContact O-CA 3.35Å
326	A	90.9	Very high	89.9	Confident	6 Å²	6	48.9 Å²	48.9	5%	0.05	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.9	161.2	0	0	0	0	0	108.7	V276 T295 L297 V330 L332	V276-A326 HydrophobicContact CG1-CB 4.23Å; T295-A326 PolarHBondContact O-N 2.95Å; L297-A326 HydrophobicContact CG-CB 4.49Å; A326-V330 VanDerWaalsContact CB-O 3.29Å; A326-V330 WeakPolarHBondContact CB-O 3.25Å; A326-L332 HydrophobicContact CB-CD1 3.75Å; A326-L332 HydrophobicContact CB-CG 3.87Å
327	A	81.4	Confident	90.1	Very high	13 Å²	13	43.5 Å²	43.5	11%	0.107	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-66	157.7	176.7	0	0	0	0	0	111.2	E277 G329	E277-A327 HydrophobicContact CB-CB 3.79Å; E277-A327 WeakPolarHBondContact O-CB 3.42Å; E277-A327 PolarHBondContact O-N 2.94Å; A327-G329 PolarHBondContact O-N 2.83Å
328	G	71.8	Confident	90.3	Very high	37 Å²	37	43.9 Å²	43.9	38%	0.381	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	69.7	-0.9	178.9	0	0	0	0	0	115.8
329	G	70.3	Confident	90.7	Very high	15 Å²	15	37.1 Å²	37.1	16%	0.155	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	82.2	11.8	176.3	0	0	0	0	0	117.4	H213 A327	H213-G329 WeakPolarHBondContact CD2-CA 3.33Å; H213-G329 PolarHBondContact CD2-O 2.83Å; H213-G329 WeakPolarHBondContact CE1-CA 3.27Å; H213-G329 VanDerWaalsContact ND1-CA 3.33Å; H213-G329 WeakPolarHBondContact ND1-CA 3.33Å; H213-G329 WeakPolarHBondContact NE2-CA 3.4Å; A327-G329 PolarHBondContact O-N 2.83Å
330	V	76.5	Confident	91	Very high	24 Å²	24	32.8 Å²	32.8	15%	0.145	18%	0.175	C	C	.	.			trans	-74.3	138.5	179.8	-172.8	0	0	0	0	109	F251 V276 A326 L332	F251-V330 HydrophobicContact CE1-CG2 3.89Å; F251-V330 HydrophobicContact CE2-CG2 3.94Å; F251-V330 HydrophobicContact CZ-CG2 3.45Å; F251-V330 VanDerWaalsContact CZ-CG2 3.45Å; V276-V330 HydrophobicContact CG1-CB 4.43Å; V276-V330 HydrophobicContact CG2-CB 4.32Å; V276-V330 HydrophobicContact CG2-CG1 4.41Å; V276-V330 HydrophobicContact CG2-CG2 4.24Å; A326-V330 VanDerWaalsContact CB-O 3.29Å; A326-V330 WeakPolarHBondContact CB-O 3.25Å; V330-L332 HydrophobicContact CG1-CD2 4.08Å; V330-L332 PolarHBondContact O-N 2.9Å
331	K	85	Confident	91.2	Very high	135 Å²	135	31.9 Å²	31.9	59%	0.587	17%	0.171	S	C	*	.			trans	-84.7	110.7	167.9	-73.2	-170.9	177.9	150.4	0	109.5	E210 N333	E210-K331 WeakPolarHBondContact OE1-CE 3.47Å; E210-K331 IonicContact OE1-NZ 2.72Å; E210-K331 PolarHBondContact OE1-NZ 2.73Å; K331-N333 PolarHBondContact O-N 2.92Å
332	L	90.5	Very high	91.4	Very high	5 Å²	5	31 Å²	31	3%	0.026	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-89.9	101	176.4	-64	-175.7	0	0	0	109.2	V265 A267 V276 V278 G296 L297 A326 V330 I337	V265-L332 HydrophobicContact CG1-CD1 3.95Å; A267-L332 HydrophobicContact CB-CD2 3.48Å; A267-L332 VanDerWaalsContact CB-CD2 3.48Å; V276-L332 HydrophobicContact CB-CD1 4.21Å; V276-L332 HydrophobicContact CB-CD2 4.11Å; V276-L332 HydrophobicContact CG1-CD1 3.88Å; V276-L332 HydrophobicContact CG1-CD2 4.2Å; V276-L332 HydrophobicContact CG1-CG 4.28Å; V276-L332 HydrophobicContact CG2-CD2 4.02Å; V278-L332 HydrophobicContact CG2-CD1 3.83Å; G296-L332 PolarHBondContact O-N 3.43Å; L297-L332 HydrophobicContact CD2-CB 3.87Å; L297-L332 HydrophobicContact CD2-CD1 4.25Å; A326-L332 HydrophobicContact CB-CD1 3.75Å; A326-L332 HydrophobicContact CB-CG 3.87Å; V330-L332 HydrophobicContact CG1-CD2 4.08Å; V330-L332 PolarHBondContact O-N 2.9Å; L332-I337 HydrophobicContact CB-CD1 3.64Å; L332-I337 HydrophobicContact CB-CG2 4.18Å; L332-I337 HydrophobicContact CD1-CG2 4.49Å; L332-I337 VanDerWaalsContact O-CD1 3.28Å; L332-I337 WeakPolarHBondContact O-CD1 3.43Å
333	N	90.3	Very high	91.4	Very high	128 Å²	128	31 Å²	31	68%	0.684	17%	0.166	S	C	*	.			trans	-128.2	65.4	-178.7	-171.5	27.6	0	0	0	112.3	K331	K331-N333 PolarHBondContact O-N 2.92Å
334	E	94.5	Very high	91.4	Very high	26 Å²	26	26.7 Å²	26.7	12%	0.121	15%	0.149	C	C	.	.	S	Bend	trans	-149.6	160.4	173	65.2	164.4	145.1	0	0	111.5	A267 M268 A336 I337 R379	A267-E334 WeakPolarHBondContact CA-OE1 3.46Å; M268-E334 PolarHBondContact N-OE1 3.26Å; E334-A336 VanDerWaalsContact C-N 3.28Å; E334-A336 HydrophobicContact CG-CB 4.33Å; E334-A336 PolarHBondContact O-N 3.36Å; E334-A336 WeakPolarHBondContact OE2-CB 3.45Å; E334-I337 HydrophobicContact CG-CG2 3.73Å; E334-I337 WeakPolarHBondContact O-CG1 3.22Å; E334-R379 IonicContact OE1-CZ 3.8Å; E334-R379 IonicContact OE1-NH1 2.66Å; E334-R379 PolarHBondContact OE1-NH1 2.77Å; E334-R379 IonicContact OE1-NH2 2.87Å; E334-R379 IonicContact OE2-CZ 3.92Å; E334-R379 IonicContact OE2-NH1 2.68Å; E334-R379 PolarHBondContact OE2-NH1 3Å; E334-R379 IonicContact OE2-NH2 3.79Å; E334-R379 PolarHBondContact OE2-NH2 2.78Å
335	P	96.5	Very high	91.5	Very high	54 Å²	54	26.5 Å²	26.5	35%	0.351	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-64.3	-27	179.2	-23.3	34.9	0	0	0	114.9	I337 D338 E363	P335-I337 PolarHBondContact O-N 2.88Å; P335-I337 VanDerWaalsContact O-N 3.07Å; P335-D338 VanDerWaalsContact O-CG 3.23Å; P335-D338 PolarHBondContact O-N 2.93Å; P335-E363 HydrophobicContact CB-CB 3.79Å; P335-E363 HydrophobicContact CB-CG 3.81Å; P335-E363 VanDerWaalsContact O-CA 3.27Å; P335-E363 WeakPolarHBondContact O-CA 3.35Å
336	A	97.4	Very high	91.7	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.008	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-66.9	-13.9	-172.9	0	0	0	0	0	114.6	E334 I361 G362 V373	E334-A336 VanDerWaalsContact C-N 3.28Å; E334-A336 HydrophobicContact CG-CB 4.33Å; E334-A336 PolarHBondContact O-N 3.36Å; E334-A336 WeakPolarHBondContact OE2-CB 3.45Å; A336-I361 HydrophobicContact CB-CG2 4.28Å; A336-G362 PolarHBondContact O-N 2.92Å; A336-V373 HydrophobicContact CB-CB 3.99Å; A336-V373 HydrophobicContact CB-CG1 3.68Å; A336-V373 HydrophobicContact CB-CG2 4.38Å
337	I	97.6	Very high	92	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-82.7	-15.5	-178.8	78.3	-172.8	0	0	0	113.8	V265 L297 L332 E334 P335 L339 A340 V341	V265-I337 HydrophobicContact CG1-CG2 4.33Å; V265-I337 HydrophobicContact CG2-CB 4.24Å; V265-I337 HydrophobicContact CG2-CG2 4.01Å; L297-I337 HydrophobicContact CD2-CD1 3.76Å; L332-I337 HydrophobicContact CB-CD1 3.64Å; L332-I337 HydrophobicContact CB-CG2 4.18Å; L332-I337 HydrophobicContact CD1-CG2 4.49Å; L332-I337 VanDerWaalsContact O-CD1 3.28Å; L332-I337 WeakPolarHBondContact O-CD1 3.43Å; E334-I337 HydrophobicContact CG-CG2 3.73Å; E334-I337 WeakPolarHBondContact O-CG1 3.22Å; P335-I337 PolarHBondContact O-N 2.88Å; P335-I337 VanDerWaalsContact O-N 3.07Å; I337-L339 VanDerWaalsContact C-N 3.25Å; I337-L339 PolarHBondContact O-N 3.37Å; I337-A340 PolarHBondContact O-N 3.36Å; I337-V341 HydrophobicContact CG1-CG2 4.23Å; I337-V341 WeakPolarHBondContact O-CG2 3.49Å; I337-V341 PolarHBondContact O-N 3.46Å
338	D	98.3	Very high	92.7	Very high	8 Å²	8	20.7 Å²	20.7	4%	0.043	12%	0.12	C	C	.	.	H	α-helix	trans	-58.5	-40.2	-169.2	-64.2	-15.1	0	0	0	111.7	R301 I305 P335 V341 A342 G362 I364	R301-D338 VanDerWaalsContact CD-OD1 3.32Å; R301-D338 WeakPolarHBondContact CD-OD1 3.46Å; R301-D338 IonicContact CZ-OD1 3.68Å; R301-D338 IonicContact NE-OD1 3.9Å; R301-D338 IonicContact NH1-OD1 2.74Å; R301-D338 PolarHBondContact NH1-OD1 2.72Å; R301-D338 IonicContact NH1-OD2 3.31Å; R301-D338 PolarHBondContact NH1-OD2 3.49Å; I305-D338 HydrophobicContact CD1-CB 3.83Å; I305-D338 HydrophobicContact CG1-CB 4.38Å; P335-D338 VanDerWaalsContact O-CG 3.23Å; P335-D338 PolarHBondContact O-N 2.93Å; D338-V341 PolarHBondContact O-N 2.96Å; D338-A342 WeakPolarHBondContact O-CB 3.35Å; D338-A342 PolarHBondContact O-N 3.23Å; D338-G362 PolarHBondContact N-O 3.5Å; D338-I364 HydrophobicContact CB-CB 4.01Å; D338-I364 HydrophobicContact CB-CD1 4.05Å; D338-I364 HydrophobicContact CB-CG1 3.8Å; D338-I364 WeakPolarHBondContact O-CD1 3.34Å; D338-I364 PolarHBondContact OD2-N 2.89Å
339	L	98.5	Very high	93.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63	-42.8	178.2	-168	59	0	0	0	112.6	I337 A342 V343 F360 I361 G362 I370 V412 L415 T418	I337-L339 VanDerWaalsContact C-N 3.25Å; I337-L339 PolarHBondContact O-N 3.37Å; L339-A342 PolarHBondContact O-N 3.24Å; L339-V343 WeakPolarHBondContact O-CB 3.43Å; L339-V343 VanDerWaalsContact O-CG2 3.24Å; L339-V343 WeakPolarHBondContact O-CG2 3.39Å; L339-V343 PolarHBondContact O-N 3.32Å; L339-F360 HydrophobicContact CD2-CB 4.42Å; L339-F360 HydrophobicContact CG-CB 4.2Å; L339-I361 WeakPolarHBondContact CD2-O 3.35Å; L339-G362 PolarHBondContact N-O 2.97Å; L339-I370 HydrophobicContact CD1-CD1 3.79Å; L339-I370 HydrophobicContact CD1-CG1 4.46Å; L339-I370 HydrophobicContact CD2-CG2 4.43Å; L339-V412 HydrophobicContact CD2-CG2 4.18Å; L339-L415 HydrophobicContact CD1-CD1 4.15Å; L339-T418 HydrophobicContact CD1-CG2 3.93Å; L339-T418 HydrophobicContact CD2-CG2 4.33Å; L339-T418 HydrophobicContact CG-CG2 4.41Å
340	A	98	Very high	95.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.8	-42.3	177.3	0	0	0	0	0	111.6	A263 V265 V278 I337 A342 V343 A344 F360	A263-A340 HydrophobicContact CB-CB 4.25Å; A263-A340 VanDerWaalsContact CB-O 3.25Å; A263-A340 WeakPolarHBondContact CB-O 3.46Å; V265-A340 HydrophobicContact CB-CB 3.62Å; V265-A340 HydrophobicContact CG1-CB 4.45Å; V265-A340 HydrophobicContact CG2-CB 4.34Å; V278-A340 HydrophobicContact CG2-CB 4.37Å; I337-A340 PolarHBondContact O-N 3.36Å; A340-A342 VanDerWaalsContact C-N 3.31Å; A340-A342 PolarHBondContact O-N 3.06Å; A340-V343 PolarHBondContact O-N 2.82Å; A340-A344 WeakPolarHBondContact O-CB 3.38Å; A340-A344 PolarHBondContact O-N 2.76Å; A340-F360 HydrophobicContact CB-CB 4.01Å
341	V	98.3	Very high	95.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-47	173.5	172.8	0	0	0	0	110.6	V278 L297 V302 I305 L324 I337 D338 V343 A344 I345	V278-V341 HydrophobicContact CG1-CG2 4.05Å; V278-V341 HydrophobicContact CG2-CG2 4.42Å; L297-V341 HydrophobicContact CD2-CG2 4.03Å; V302-V341 HydrophobicContact CG2-CG1 4.19Å; I305-V341 HydrophobicContact CD1-CB 3.94Å; I305-V341 HydrophobicContact CD1-CG1 3.74Å; I305-V341 HydrophobicContact CG2-CG1 4.24Å; L324-V341 HydrophobicContact CD2-CG1 3.8Å; I337-V341 HydrophobicContact CG1-CG2 4.23Å; I337-V341 WeakPolarHBondContact O-CG2 3.49Å; I337-V341 PolarHBondContact O-N 3.46Å; D338-V341 PolarHBondContact O-N 2.96Å; V341-V343 PolarHBondContact O-N 3.43Å; V341-A344 PolarHBondContact O-N 2.96Å; V341-I345 HydrophobicContact CG1-CD1 3.87Å; V341-I345 WeakPolarHBondContact O-CD1 3.31Å; V341-I345 VanDerWaalsContact O-CG1 3.27Å; V341-I345 WeakPolarHBondContact O-CG1 3.35Å; V341-I345 PolarHBondContact O-N 2.92Å
342	A	98.4	Very high	96.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.3	-40.5	-179.5	0	0	0	0	0	112.6	I305 L309 D338 L339 A340 A346 I364 L415	I305-A342 HydrophobicContact CG2-CB 3.66Å; L309-A342 HydrophobicContact CD1-CB 4.14Å; L309-A342 HydrophobicContact CD2-CB 4.19Å; L309-A342 HydrophobicContact CG-CB 4.26Å; D338-A342 WeakPolarHBondContact O-CB 3.35Å; D338-A342 PolarHBondContact O-N 3.23Å; L339-A342 PolarHBondContact O-N 3.24Å; A340-A342 VanDerWaalsContact C-N 3.31Å; A340-A342 PolarHBondContact O-N 3.06Å; A342-A346 WeakPolarHBondContact O-CB 3.45Å; A342-A346 PolarHBondContact O-N 2.86Å; A342-I364 HydrophobicContact CB-CD1 3.44Å; A342-I364 VanDerWaalsContact CB-CD1 3.44Å; A342-L415 HydrophobicContact CB-CD1 3.87Å
343	V	98.1	Very high	96.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.6	-40.8	177	171.2	0	0	0	0	111.2	A263 L339 A340 V341 A346 S347 T354 F360 T418 L419 V422 F423	A263-V343 HydrophobicContact CB-CB 4.15Å; A263-V343 HydrophobicContact CB-CG1 4.01Å; L339-V343 WeakPolarHBondContact O-CB 3.43Å; L339-V343 VanDerWaalsContact O-CG2 3.24Å; L339-V343 WeakPolarHBondContact O-CG2 3.39Å; L339-V343 PolarHBondContact O-N 3.32Å; A340-V343 PolarHBondContact O-N 2.82Å; V341-V343 PolarHBondContact O-N 3.43Å; V343-A346 PolarHBondContact O-N 3.11Å; V343-S347 VanDerWaalsContact O-CB 3.23Å; V343-S347 WeakPolarHBondContact O-CB 3.41Å; V343-S347 PolarHBondContact O-N 3.41Å; V343-T354 HydrophobicContact CG1-CG2 3.5Å; V343-T354 VanDerWaalsContact CG1-CG2 3.5Å; V343-F360 HydrophobicContact CB-CD1 4.38Å; V343-F360 HydrophobicContact CB-CD2 4.48Å; V343-F360 HydrophobicContact CB-CG 4.33Å; V343-F360 HydrophobicContact CG1-CD1 4.25Å; V343-F360 HydrophobicContact CG1-CD2 4.16Å; V343-F360 HydrophobicContact CG1-CE1 4Å; V343-F360 HydrophobicContact CG1-CE2 3.89Å; V343-F360 HydrophobicContact CG1-CG 4.33Å; V343-F360 HydrophobicContact CG1-CZ 3.81Å; V343-F360 HydrophobicContact CG2-CD1 3.83Å; V343-F360 HydrophobicContact CG2-CE1 4.18Å; V343-F360 HydrophobicContact CG2-CG 4.16Å; V343-T418 HydrophobicContact CG2-CG2 4.31Å; V343-L419 HydrophobicContact CG2-CD2 4.38Å; V343-V422 HydrophobicContact CG1-CG1 4.31Å; V343-F423 HydrophobicContact CG1-CZ 4.1Å
344	A	97.4	Very high	96.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.8	-47.6	175.1	0	0	0	0	0	111.3	G261 A263 V278 A280 A340 V341 A346 S347 S348	G261-A344 WeakPolarHBondContact CA-O 3.34Å; A263-A344 HydrophobicContact CB-CB 3.92Å; V278-A344 HydrophobicContact CB-CB 4.47Å; V278-A344 HydrophobicContact CG1-CB 4.04Å; A280-A344 HydrophobicContact CB-CB 3.86Å; A340-A344 WeakPolarHBondContact O-CB 3.38Å; A340-A344 PolarHBondContact O-N 2.76Å; V341-A344 PolarHBondContact O-N 2.96Å; A344-A346 PolarHBondContact O-N 3.35Å; A344-S347 WeakPolarHBondContact O-CB 3.23Å; A344-S347 PolarHBondContact O-N 2.78Å; A344-S348 PolarHBondContact O-N 3.27Å
345	I	98.2	Very high	96.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.4	-48.6	176	-66.8	162.6	0	0	0	110.7	A280 V282 I305 M306 L309 L317 L324 V341 S347 S348 Y349	A280-I345 HydrophobicContact CB-CG1 4.15Å; V282-I345 HydrophobicContact CG2-CG2 3.98Å; I305-I345 HydrophobicContact CG2-CD1 4.23Å; M306-I345 HydrophobicContact CG-CD1 3.82Å; L309-I345 HydrophobicContact CD1-CB 3.86Å; L309-I345 HydrophobicContact CD1-CD1 4.07Å; L309-I345 HydrophobicContact CD1-CG2 3.67Å; L317-I345 HydrophobicContact CD1-CG2 3.85Å; L317-I345 HydrophobicContact CD2-CG2 4.24Å; L324-I345 HydrophobicContact CD2-CD1 3.93Å; L324-I345 HydrophobicContact CD2-CG1 3.81Å; V341-I345 HydrophobicContact CG1-CD1 3.87Å; V341-I345 WeakPolarHBondContact O-CD1 3.31Å; V341-I345 VanDerWaalsContact O-CG1 3.27Å; V341-I345 WeakPolarHBondContact O-CG1 3.35Å; V341-I345 PolarHBondContact O-N 2.92Å; I345-S347 VanDerWaalsContact C-N 3.33Å; I345-S347 PolarHBondContact O-N 3.16Å; I345-S348 PolarHBondContact O-N 3.02Å; I345-Y349 WeakPolarHBondContact O-CB 3.46Å; I345-Y349 PolarHBondContact O-N 3.44Å
346	A	97.7	Very high	95.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.6	-36.7	-179.5	0	0	0	0	0	112.4	L315 A342 V343 A344 K350 L419 F423	L315-A346 HydrophobicContact CD1-CB 4.13Å; A342-A346 WeakPolarHBondContact O-CB 3.45Å; A342-A346 PolarHBondContact O-N 2.86Å; V343-A346 PolarHBondContact O-N 3.11Å; A344-A346 PolarHBondContact O-N 3.35Å; A346-K350 VanDerWaalsContact O-CB 3.27Å; A346-K350 WeakPolarHBondContact O-CB 3.23Å; A346-K350 VanDerWaalsContact O-CG 3.31Å; A346-K350 WeakPolarHBondContact O-CG 3.3Å; A346-K350 PolarHBondContact O-N 3.29Å; A346-L419 HydrophobicContact CB-CD1 4.34Å; A346-L419 HydrophobicContact CB-CD2 3.57Å; A346-F423 HydrophobicContact CB-CE2 3.92Å; A346-F423 HydrophobicContact CB-CZ 4.5Å
347	S	97	Very high	95.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.5	-46.7	175.9	175.7	0	0	0	0	111.2	G261 V343 A344 I345 E351 N352	G261-S347 PolarHBondContact N-OG 2.71Å; V343-S347 VanDerWaalsContact O-CB 3.23Å; V343-S347 WeakPolarHBondContact O-CB 3.41Å; V343-S347 PolarHBondContact O-N 3.41Å; A344-S347 WeakPolarHBondContact O-CB 3.23Å; A344-S347 PolarHBondContact O-N 2.78Å; I345-S347 VanDerWaalsContact C-N 3.33Å; I345-S347 PolarHBondContact O-N 3.16Å; S347-E351 PolarHBondContact O-N 3.27Å; S347-E351 VanDerWaalsContact O-N 3.13Å; S347-N352 VanDerWaalsContact CA-O 3.25Å; S347-N352 WeakPolarHBondContact CA-O 3.34Å; S347-N352 VanDerWaalsContact CB-O 3.31Å; S347-N352 WeakPolarHBondContact CB-O 3.47Å; S347-N352 PolarHBondContact O-N 3.04Å; S347-N352 PolarHBondContact OG-O 2.6Å
348	S	96.9	Very high	95.2	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.014	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-49.8	176.8	177.9	0	0	0	0	111.3	A280 V282 A344 I345 K350 E351	A280-S348 WeakPolarHBondContact O-CB 3.42Å; V282-S348 PolarHBondContact N-OG 2.77Å; A344-S348 PolarHBondContact O-N 3.27Å; I345-S348 PolarHBondContact O-N 3.02Å; S348-K350 VanDerWaalsContact C-N 3.26Å; S348-K350 PolarHBondContact O-N 3.39Å; S348-E351 PolarHBondContact O-N 2.86Å
349	Y	96.7	Very high	95.1	Very high	74 Å²	74	28.9 Å²	28.9	29%	0.29	15%	0.15	S	C	.	.	H	α-helix	trans	-60.1	-36	-178.3	179.5	-88.6	0	0	0	113.2	V282 L315 L316 L317 Q320 I345 E351	V282-Y349 HydrophobicContact CG1-CD2 4.04Å; L315-Y349 HydrophobicContact CD2-CD1 3.34Å; L315-Y349 HydrophobicContact CD2-CE1 3.57Å; L315-Y349 HydrophobicContact CD2-CG 4.23Å; L316-Y349 WeakPolarHBondContact O-CE2 3.34Å; L317-Y349 HydrophobicContact CD2-CD2 3.49Å; L317-Y349 VanDerWaalsContact CD2-CD2 3.49Å; L317-Y349 HydrophobicContact CD2-CE2 4.01Å; L317-Y349 HydrophobicContact CD2-CG 3.94Å; Q320-Y349 HydrophobicContact CG-CD2 4.07Å; Q320-Y349 HydrophobicContact CG-CE2 3.94Å; I345-Y349 WeakPolarHBondContact O-CB 3.46Å; I345-Y349 PolarHBondContact O-N 3.44Å; Y349-E351 VanDerWaalsContact C-N 3.35Å
350	K	94.5	Very high	95.1	Very high	96 Å²	96	28.9 Å²	28.9	42%	0.417	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.3	179.1	-69.1	-175.2	172.7	-166	0	113.7	L315 A346 S348 N352 F423	L315-K350 HydrophobicContact CD2-CG 4.45Å; A346-K350 VanDerWaalsContact O-CB 3.27Å; A346-K350 WeakPolarHBondContact O-CB 3.23Å; A346-K350 VanDerWaalsContact O-CG 3.31Å; A346-K350 WeakPolarHBondContact O-CG 3.3Å; A346-K350 PolarHBondContact O-N 3.29Å; S348-K350 VanDerWaalsContact C-N 3.26Å; S348-K350 PolarHBondContact O-N 3.39Å; K350-N352 HydrophobicContact CB-CB 4.28Å; K350-N352 PolarHBondContact O-N 3.45Å; K350-F423 HydrophobicContact CD-CD2 4.23Å; K350-F423 HydrophobicContact CD-CG 4.39Å
351	E	93.9	Very high	95.1	Very high	125 Å²	125	28.9 Å²	28.9	58%	0.584	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.1	47	-167.5	-67	-61.7	164.7	0	0	112.3	T260 S347 S348 Y349	T260-E351 WeakPolarHBondContact CB-OE2 3.48Å; T260-E351 PolarHBondContact OG1-OE2 2.89Å; S347-E351 PolarHBondContact O-N 3.27Å; S347-E351 VanDerWaalsContact O-N 3.13Å; S348-E351 PolarHBondContact O-N 2.86Å; Y349-E351 VanDerWaalsContact C-N 3.35Å
352	N	94.2	Very high	95.1	Very high	73 Å²	73	28.9 Å²	28.9	39%	0.39	15%	0.15	S	C	.	.			trans	-133.9	118.3	178	-168.8	-4.2	0	0	0	109.3	S347 K350 F423	S347-N352 VanDerWaalsContact CA-O 3.25Å; S347-N352 WeakPolarHBondContact CA-O 3.34Å; S347-N352 VanDerWaalsContact CB-O 3.31Å; S347-N352 WeakPolarHBondContact CB-O 3.47Å; S347-N352 PolarHBondContact O-N 3.04Å; S347-N352 PolarHBondContact OG-O 2.6Å; K350-N352 HydrophobicContact CB-CB 4.28Å; K350-N352 PolarHBondContact O-N 3.45Å; N352-F423 HydrophobicContact CB-CD1 3.98Å; N352-F423 WeakPolarHBondContact O-CE1 3.47Å
353	G	91.7	Very high	95.1	Very high	20 Å²	20	31.6 Å²	31.6	21%	0.206	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-70.6	161.8	-173.4	0	0	0	0	0	113.5
354	T	92.5	Very high	95.1	Very high	6 Å²	6	32 Å²	32	4%	0.037	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-92.4	153.9	164.6	60.3	0	0	0	0	110.3	R255 S262 V343 F360 V422 F423	R255-T354 PolarHBondContact NH2-O 2.88Å; R255-T354 PolarHBondContact NH2-OG1 3.34Å; S262-T354 VanDerWaalsContact O-CG2 3.28Å; S262-T354 WeakPolarHBondContact O-CG2 3.43Å; S262-T354 PolarHBondContact O-OG1 3.46Å; V343-T354 HydrophobicContact CG1-CG2 3.5Å; V343-T354 VanDerWaalsContact CG1-CG2 3.5Å; T354-F360 HydrophobicContact CG2-CE2 3.92Å; T354-F360 HydrophobicContact CG2-CZ 3.92Å; T354-V422 HydrophobicContact CG2-CG1 4.16Å; T354-F423 HydrophobicContact CG2-CE1 4.28Å; T354-F423 HydrophobicContact CG2-CZ 4.34Å
355	E	90.3	Very high	95.1	Very high	112 Å²	112	32.4 Å²	32.4	52%	0.523	17%	0.169	S	C	.	.	P	Polyproline II helix	trans	-74.1	139.1	178.8	-68.3	-79.4	174.6	0	0	110	T357 E358 R390	E355-T357 PolarHBondContact O-N 3.19Å; E355-E358 HydrophobicContact CB-CG 3.83Å; E355-E358 PolarHBondContact N-OE2 3.04Å; E355-E358 WeakPolarHBondContact O-CB 3.21Å; E355-E358 PolarHBondContact O-N 2.74Å; E355-R390 VanDerWaalsContact CB-NH2 3.33Å; E355-R390 VanDerWaalsContact CG-NH2 3.26Å
356	A	86.1	Confident	95	Very high	40 Å²	40	37.9 Å²	37.9	33%	0.331	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.3	-172.3	0	0	0	0	0	114	F388	A356-F388 WeakPolarHBondContact O-CE1 3.46Å
357	T	89.3	Confident	94.9	Very high	56 Å²	56	42.3 Å²	42.3	34%	0.344	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	14.1	-179.5	60.9	0	0	0	0	113.6	E355 F388 K389 R390	E355-T357 PolarHBondContact O-N 3.19Å; T357-F388 WeakPolarHBondContact O-CD1 3.28Å; T357-K389 HydrophobicContact CG2-CG 4.21Å; T357-K389 PolarHBondContact O-N 3.21Å; T357-R390 PolarHBondContact O-N 3.43Å
358	E	94	Very high	94.9	Very high	3 Å²	3	42.5 Å²	42.5	1%	0.014	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	140.3	175.7	-70.8	-179.3	142.3	0	0	112.8	E355 F360 F388 R390 Y392	E355-E358 HydrophobicContact CB-CG 3.83Å; E355-E358 PolarHBondContact N-OE2 3.04Å; E355-E358 WeakPolarHBondContact O-CB 3.21Å; E355-E358 PolarHBondContact O-N 2.74Å; E358-F360 HydrophobicContact CB-CE2 4.05Å; E358-F360 HydrophobicContact CB-CZ 3.77Å; E358-F388 WeakPolarHBondContact O-CE1 3.47Å; E358-R390 WeakPolarHBondContact CA-O 3.25Å; E358-R390 VanDerWaalsContact CD-NH2 3.28Å; E358-R390 HydrophobicContact CG-CB 4.05Å; E358-R390 IonicContact OE1-CZ 2.86Å; E358-R390 IonicContact OE1-NE 3.42Å; E358-R390 PolarHBondContact OE1-NE 2.89Å; E358-R390 IonicContact OE1-NH1 3.71Å; E358-R390 PolarHBondContact OE1-NH1 3.03Å; E358-R390 IonicContact OE1-NH2 3.23Å; E358-R390 PolarHBondContact OE1-NH2 2.85Å; E358-Y392 HydrophobicContact CB-CE2 4.36Å; E358-Y392 HydrophobicContact CG-CE2 4.01Å; E358-Y392 VanDerWaalsContact OE1-CE2 3.27Å; E358-Y392 WeakPolarHBondContact OE1-CE2 3.49Å; E358-Y392 PolarHBondContact OE1-OH 3.49Å
359	C	94.9	Very high	95	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147.2	171.3	-85.3	0	0	0	0	110.7	I264 F388 R390 I391 Y392	I264-C359 VanDerWaalsContact CG2-SG 3.58Å; C359-F388 HydrophobicContact CB-CD1 4.24Å; C359-F388 WeakPolarHBondContact SG-CD1 3.35Å; C359-F388 WeakPolarHBondContact SG-CE1 3.33Å; C359-R390 PolarHBondContact N-O 3.39Å; C359-I391 HydrophobicContact CB-CG1 4.2Å; C359-I391 HydrophobicContact CB-CG2 4.37Å; C359-I391 WeakPolarHBondContact O-CA 3.33Å; C359-Y392 PolarHBondContact O-N 3.15Å
360	F	98.3	Very high	95.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.9	-176.6	-53.1	-81	0	0	0	110	A263 I264 L339 A340 V343 T354 E358 Y392 V422	A263-F360 HydrophobicContact CB-CD2 3.82Å; A263-F360 HydrophobicContact CB-CE2 4.11Å; I264-F360 PolarHBondContact O-N 2.83Å; L339-F360 HydrophobicContact CD2-CB 4.42Å; L339-F360 HydrophobicContact CG-CB 4.2Å; A340-F360 HydrophobicContact CB-CB 4.01Å; V343-F360 HydrophobicContact CB-CD1 4.38Å; V343-F360 HydrophobicContact CB-CD2 4.48Å; V343-F360 HydrophobicContact CB-CG 4.33Å; V343-F360 HydrophobicContact CG1-CD1 4.25Å; V343-F360 HydrophobicContact CG1-CD2 4.16Å; V343-F360 HydrophobicContact CG1-CE1 4Å; V343-F360 HydrophobicContact CG1-CE2 3.89Å; V343-F360 HydrophobicContact CG1-CG 4.33Å; V343-F360 HydrophobicContact CG1-CZ 3.81Å; V343-F360 HydrophobicContact CG2-CD1 3.83Å; V343-F360 HydrophobicContact CG2-CE1 4.18Å; V343-F360 HydrophobicContact CG2-CG 4.16Å; T354-F360 HydrophobicContact CG2-CE2 3.92Å; T354-F360 HydrophobicContact CG2-CZ 3.92Å; E358-F360 HydrophobicContact CB-CE2 4.05Å; E358-F360 HydrophobicContact CB-CZ 3.77Å; F360-Y392 AromaticContact CD1-CD2 3.63Å; F360-Y392 HydrophobicContact CD1-CD2 3.63Å; F360-Y392 HydrophobicContact CD1-CE2 4.41Å; F360-Y392 AromaticContact CD1-CG 3.83Å; F360-Y392 HydrophobicContact CD1-CG 3.83Å; F360-Y392 AromaticContact CE1-CD2 3.28Å; F360-Y392 HydrophobicContact CE1-CD2 3.28Å; F360-Y392 AromaticContact CE1-CE2 3.63Å; F360-Y392 HydrophobicContact CE1-CE2 3.63Å; F360-Y392 AromaticContact CE1-CG 3.82Å; F360-Y392 HydrophobicContact CE1-CG 3.82Å; F360-Y392 HydrophobicContact CZ-CD2 4.16Å; F360-Y392 HydrophobicContact CZ-CE2 4.25Å; F360-V422 HydrophobicContact CD1-CG2 4.44Å; F360-V422 HydrophobicContact CE1-CG1 4.35Å; F360-V422 HydrophobicContact CE1-CG2 3.53Å; F360-V422 HydrophobicContact CZ-CG1 4.25Å; F360-V422 HydrophobicContact CZ-CG2 4.23Å
361	I	98.3	Very high	95.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.			trans	-130.8	128.6	-177.8	-56.9	171	0	0	0	107.9	V266 A336 L339 V373 I376 R379 I391 Y392 L393 P394	V266-I361 HydrophobicContact CB-CD1 4.07Å; V266-I361 HydrophobicContact CB-CG1 4.46Å; V266-I361 HydrophobicContact CG2-CD1 4.07Å; A336-I361 HydrophobicContact CB-CG2 4.28Å; L339-I361 WeakPolarHBondContact CD2-O 3.35Å; I361-V373 HydrophobicContact CG2-CG2 3.61Å; I361-I376 HydrophobicContact CD1-CD1 4.37Å; I361-I376 HydrophobicContact CG2-CD1 4.11Å; I361-R379 HydrophobicContact CD1-CB 3.8Å; I361-I391 HydrophobicContact CD1-CG2 3.9Å; I361-I391 HydrophobicContact CG1-CG2 4.44Å; I361-Y392 PolarHBondContact N-O 2.69Å; I361-L393 WeakPolarHBondContact O-CA 3.42Å; I361-P394 VanDerWaalsContact O-CD 3.29Å; I361-P394 WeakPolarHBondContact O-CD 3.25Å
362	G	98.1	Very high	95.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.			trans	160.4	146.1	172.7	0	0	0	0	0	113.2	A336 D338 L339	A336-G362 PolarHBondContact O-N 2.92Å; D338-G362 PolarHBondContact N-O 3.5Å; L339-G362 PolarHBondContact N-O 2.97Å
363	E	98.3	Very high	95.5	Very high	56 Å²	56	42.4 Å²	42.4	26%	0.262	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	140.3	168.9	171.3	-175.2	-142.4	0	0	109.2	P335 I370 R371 V373	P335-E363 HydrophobicContact CB-CB 3.79Å; P335-E363 HydrophobicContact CB-CG 3.81Å; P335-E363 VanDerWaalsContact O-CA 3.27Å; P335-E363 WeakPolarHBondContact O-CA 3.35Å; E363-I370 CarbonylContact O-C 3.54Å; E363-I370 WeakPolarHBondContact O-CA 3.43Å; E363-R371 HydrophobicContact CB-CB 4Å; E363-R371 HydrophobicContact CG-CB 4.12Å; E363-R371 PolarHBondContact N-O 3.12Å; E363-R371 PolarHBondContact O-N 3.03Å; E363-R371 WeakPolarHBondContact OE2-CB 3.44Å; E363-R371 IonicContact OE2-NE 3.21Å; E363-R371 PolarHBondContact OE2-NE 2.88Å; E363-V373 HydrophobicContact CB-CG1 4.34Å
364	I	98.4	Very high	95.6	Very high	9 Å²	9	45.1 Å²	45.1	5%	0.046	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.1	177.5	-64.9	175.5	0	0	0	109.1	I305 V308 D338 A342 I370 L415	I305-I364 HydrophobicContact CG2-CD1 4.41Å; V308-I364 HydrophobicContact CB-CG2 4.38Å; V308-I364 HydrophobicContact CG1-CG2 3.75Å; D338-I364 HydrophobicContact CB-CB 4.01Å; D338-I364 HydrophobicContact CB-CD1 4.05Å; D338-I364 HydrophobicContact CB-CG1 3.8Å; D338-I364 WeakPolarHBondContact O-CD1 3.34Å; D338-I364 PolarHBondContact OD2-N 2.89Å; A342-I364 HydrophobicContact CB-CD1 3.44Å; A342-I364 VanDerWaalsContact CB-CD1 3.44Å; I364-I370 HydrophobicContact CG1-CD1 3.9Å; I364-L415 HydrophobicContact CD1-CD1 4.05Å; I364-L415 HydrophobicContact CD1-CD2 4.37Å
365	G	97.8	Very high	95.7	Very high	8 Å²	8	47.2 Å²	47.2	8%	0.082	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-81.1	160.8	168.5	0	0	0	0	0	112.8	T367 G368 E369	G365-T367 PolarHBondContact O-N 2.83Å; G365-T367 VanDerWaalsContact O-N 3.13Å; G365-G368 WeakPolarHBondContact O-CA 2.98Å; G365-G368 PolarHBondContact O-N 3.23Å; G365-E369 WeakPolarHBondContact CA-OE2 3.43Å; G365-E369 PolarHBondContact N-O 2.77Å
366	L	96.6	Very high	95.9	Very high	115 Å²	115	42.6 Å²	42.6	60%	0.602	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.5	-179.2	-64.8	177	0	0	0	113.8	L304 V308 R312 G368	L304-L366 HydrophobicContact CD1-CD2 3.94Å; L304-L366 HydrophobicContact CD2-CD2 3.57Å; L304-L366 HydrophobicContact CG-CD2 3.73Å; V308-L366 HydrophobicContact CG2-CD2 4.12Å; R312-L366 PolarHBondContact NE-O 3.22Å; R312-L366 PolarHBondContact NH2-O 2.7Å; L366-G368 VanDerWaalsContact C-N 3.29Å
367	T	96.1	Very high	96.3	Very high	94 Å²	94	44.6 Å²	44.6	58%	0.577	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-1.4	174.3	75.7	0	0	0	0	112.7	R312 G365 E369	R312-T367 WeakPolarHBondContact CD-O 3.49Å; G365-T367 PolarHBondContact O-N 2.83Å; G365-T367 VanDerWaalsContact O-N 3.13Å; T367-E369 WeakPolarHBondContact CA-OE2 3.32Å; T367-E369 WeakPolarHBondContact CB-OE2 3.44Å; T367-E369 PolarHBondContact N-OE2 2.9Å; T367-E369 VanDerWaalsContact N-OE2 3.15Å; T367-E369 VanDerWaalsContact OG1-CD 3.22Å; T367-E369 PolarHBondContact OG1-OE2 2.91Å
368	G	96.8	Very high	96.5	Very high	4 Å²	4	45.8 Å²	45.8	4%	0.041	23%	0.23	C	C	.	.	S	Bend	trans	86.3	10.2	-179.2	0	0	0	0	0	113.4	G365 L366 T414 L415	G365-G368 WeakPolarHBondContact O-CA 2.98Å; G365-G368 PolarHBondContact O-N 3.23Å; L366-G368 VanDerWaalsContact C-N 3.29Å; G368-T414 CarbonylContact O-C 3.53Å; G368-T414 VanDerWaalsContact O-CA 3.3Å; G368-T414 WeakPolarHBondContact O-CA 3.43Å; G368-L415 PolarHBondContact O-N 3.18Å
369	E	97.9	Very high	96.6	Very high	55 Å²	55	45.7 Å²	45.7	26%	0.257	23%	0.229	S	C	.	.	B	Isolated β-bridge	trans	-75.9	144.6	173.7	79.3	-75.9	-165.8	0	0	111.3	G365 T367 R371 A413	G365-E369 WeakPolarHBondContact CA-OE2 3.43Å; G365-E369 PolarHBondContact N-O 2.77Å; T367-E369 WeakPolarHBondContact CA-OE2 3.32Å; T367-E369 WeakPolarHBondContact CB-OE2 3.44Å; T367-E369 PolarHBondContact N-OE2 2.9Å; T367-E369 VanDerWaalsContact N-OE2 3.15Å; T367-E369 VanDerWaalsContact OG1-CD 3.22Å; T367-E369 PolarHBondContact OG1-OE2 2.91Å; E369-R371 HydrophobicContact CG-CG 3.93Å; E369-R371 IonicContact OE1-NH1 3.77Å; E369-A413 WeakPolarHBondContact CA-O 3.46Å
370	I	98.4	Very high	96.6	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.7	175.2	-51.9	-51.4	0	0	0	108.9	L339 E363 I364 P394 V412 A413 L415	L339-I370 HydrophobicContact CD1-CD1 3.79Å; L339-I370 HydrophobicContact CD1-CG1 4.46Å; L339-I370 HydrophobicContact CD2-CG2 4.43Å; E363-I370 CarbonylContact O-C 3.54Å; E363-I370 WeakPolarHBondContact O-CA 3.43Å; I364-I370 HydrophobicContact CG1-CD1 3.9Å; I370-P394 HydrophobicContact CG2-CB 3.89Å; I370-P394 HydrophobicContact CG2-CG 3.88Å; I370-V412 HydrophobicContact CB-CG2 4.41Å; I370-V412 HydrophobicContact CG1-CG2 4.18Å; I370-V412 HydrophobicContact CG2-CG2 4.22Å; I370-A413 PolarHBondContact N-O 2.88Å; I370-L415 HydrophobicContact CD1-CB 4.21Å
371	R	98	Very high	96.3	Very high	118 Å²	118	50.8 Å²	50.8	45%	0.445	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	153.1	-172	-59.5	177.8	60.5	82.7	2.6	111.4	E363 E369 P394	E363-R371 HydrophobicContact CB-CB 4Å; E363-R371 HydrophobicContact CG-CB 4.12Å; E363-R371 PolarHBondContact N-O 3.12Å; E363-R371 PolarHBondContact O-N 3.03Å; E363-R371 WeakPolarHBondContact OE2-CB 3.44Å; E363-R371 IonicContact OE2-NE 3.21Å; E363-R371 PolarHBondContact OE2-NE 2.88Å; E369-R371 HydrophobicContact CG-CG 3.93Å; E369-R371 IonicContact OE1-NH1 3.77Å; R371-P394 VanDerWaalsContact O-CB 3.25Å; R371-P394 WeakPolarHBondContact O-CB 3.37Å; R371-P394 WeakPolarHBondContact O-CG 3.44Å
372	R	96.7	Very high	96	Very high	175 Å²	175	52 Å²	52	66%	0.66	26%	0.257	S	S	*	.			trans	-62.9	144.8	-178.8	65.2	-179.7	-68.7	-174	1	111.7	N396 N397	R372-N396 HydrophobicContact CB-CB 4.42Å; R372-N397 VanDerWaalsContact CA-OD1 3.23Å; R372-N397 WeakPolarHBondContact CA-OD1 3.2Å
373	V	96.6	Very high	95.7	Very high	14 Å²	14	52 Å²	52	9%	0.085	26%	0.257	C	S	.	.			trans	-118.3	160.9	175.3	-58	0	0	0	0	111.6	A336 I361 E363 I376 N397	A336-V373 HydrophobicContact CB-CB 3.99Å; A336-V373 HydrophobicContact CB-CG1 3.68Å; A336-V373 HydrophobicContact CB-CG2 4.38Å; I361-V373 HydrophobicContact CG2-CG2 3.61Å; E363-V373 HydrophobicContact CB-CG1 4.34Å; V373-I376 HydrophobicContact CG2-CD1 4.13Å; V373-N397 PolarHBondContact N-OD1 3.37Å; V373-N397 PolarHBondContact O-ND2 3.34Å
374	S	94.5	Very high	95.4	Very high	78 Å²	78	50.7 Å²	50.7	55%	0.545	25%	0.254	S	S	.	.	S	Bend	trans	-75.3	160.7	173	56.2	0	0	0	0	112.1	I376 R379	S374-I376 VanDerWaalsContact C-N 3.26Å; S374-I376 PolarHBondContact O-N 3.49Å; S374-I376 VanDerWaalsContact O-N 3.17Å; S374-R379 PolarHBondContact O-NE 2.63Å; S374-R379 PolarHBondContact O-NH2 3.2Å
375	S	93.8	Very high	94.9	Very high	50 Å²	50	57.1 Å²	57.1	35%	0.35	28%	0.282	S	S	.	.			trans	57	30.5	171.6	-65.6	0	0	0	0	115.4	E377 Q378 R379	S375-E377 VanDerWaalsContact C-N 3.28Å; S375-E377 PolarHBondContact O-N 3.11Å; S375-Q378 PolarHBondContact O-N 3.29Å; S375-Q378 VanDerWaalsContact O-N 3.12Å; S375-Q378 PolarHBondContact OG-OE1 3.22Å; S375-R379 WeakPolarHBondContact O-CG 3.3Å; S375-R379 PolarHBondContact O-N 3.19Å
376	I	95.7	Very high	94.3	Very high	14 Å²	14	58.8 Å²	58.8	7%	0.072	29%	0.289	C	S	.	.	H	α-helix	trans	-58	-39.1	-175.1	-167.1	67.3	0	0	0	113	I361 V373 S374 Q378 R379 V380 L393 N397 W401	I361-I376 HydrophobicContact CD1-CD1 4.37Å; I361-I376 HydrophobicContact CG2-CD1 4.11Å; V373-I376 HydrophobicContact CG2-CD1 4.13Å; S374-I376 VanDerWaalsContact C-N 3.26Å; S374-I376 PolarHBondContact O-N 3.49Å; S374-I376 VanDerWaalsContact O-N 3.17Å; I376-Q378 PolarHBondContact O-N 3.47Å; I376-R379 PolarHBondContact O-N 3.15Å; I376-V380 HydrophobicContact CD1-CG2 4.31Å; I376-V380 HydrophobicContact CG1-CG2 4.21Å; I376-V380 WeakPolarHBondContact O-CB 3.5Å; I376-V380 WeakPolarHBondContact O-CG2 3.31Å; I376-V380 PolarHBondContact O-N 3.22Å; I376-L393 HydrophobicContact CD1-CB 4.13Å; I376-N397 HydrophobicContact CB-CB 4.28Å; I376-N397 HydrophobicContact CD1-CB 4.44Å; I376-N397 HydrophobicContact CG1-CB 3.96Å; I376-N397 HydrophobicContact CG2-CB 4.25Å; I376-W401 HydrophobicContact CG1-CZ2 4.27Å; I376-W401 HydrophobicContact CG2-CZ2 4.33Å
377	E	94.7	Very high	93.9	Very high	82 Å²	82	54.7 Å²	54.7	38%	0.383	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-44.9	177.5	-68.8	-173.2	-134.1	0	0	112.5	S375 R379 V380 K381 W401	S375-E377 VanDerWaalsContact C-N 3.28Å; S375-E377 PolarHBondContact O-N 3.11Å; E377-R379 VanDerWaalsContact C-N 3.35Å; E377-V380 PolarHBondContact O-N 3.33Å; E377-K381 VanDerWaalsContact O-CB 3.32Å; E377-K381 WeakPolarHBondContact O-CB 3.38Å; E377-K381 VanDerWaalsContact O-CG 3.23Å; E377-K381 WeakPolarHBondContact O-CG 3.24Å; E377-K381 PolarHBondContact O-N 2.88Å; E377-K381 IonicContact OE2-NZ 3.72Å; E377-W401 HydrophobicContact CB-CE3 4.38Å; E377-W401 HydrophobicContact CG-CB 3.75Å; E377-W401 HydrophobicContact CG-CD2 3.64Å; E377-W401 HydrophobicContact CG-CE3 3.66Å; E377-W401 HydrophobicContact CG-CG 3.68Å; E377-W401 HydrophobicContact CG-CZ3 4.44Å; E377-W401 WeakPolarHBondContact OE1-CB 3.28Å
378	Q	92.7	Very high	93.6	Very high	82 Å²	82	50.9 Å²	50.9	38%	0.383	25%	0.25	S	S	.	.	H	α-helix	trans	-64.2	-44.3	179.2	-68	172.5	-35.8	0	0	110	P273 S375 I376 K381 E382	P273-Q378 HydrophobicContact CG-CB 4.47Å; S375-Q378 PolarHBondContact O-N 3.29Å; S375-Q378 VanDerWaalsContact O-N 3.12Å; S375-Q378 PolarHBondContact OG-OE1 3.22Å; I376-Q378 PolarHBondContact O-N 3.47Å; Q378-K381 PolarHBondContact O-N 2.92Å; Q378-E382 PolarHBondContact O-N 3.22Å
379	R	95	Very high	93.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178.2	-64.1	177.6	-163.2	-95.8	0.6	112.2	V266 M268 E334 I361 S374 S375 I376 E377 E382 A383	V266-R379 HydrophobicContact CB-CB 3.94Å; V266-R379 HydrophobicContact CB-CG 4.25Å; V266-R379 HydrophobicContact CG1-CB 3.7Å; V266-R379 HydrophobicContact CG1-CG 3.89Å; V266-R379 PolarHBondContact O-NH1 3.26Å; M268-R379 HydrophobicContact CG-CG 4.27Å; M268-R379 HydrophobicContact SD-CG 3.89Å; E334-R379 IonicContact OE1-CZ 3.8Å; E334-R379 IonicContact OE1-NH1 2.66Å; E334-R379 PolarHBondContact OE1-NH1 2.77Å; E334-R379 IonicContact OE1-NH2 2.87Å; E334-R379 IonicContact OE2-CZ 3.92Å; E334-R379 IonicContact OE2-NH1 2.68Å; E334-R379 PolarHBondContact OE2-NH1 3Å; E334-R379 IonicContact OE2-NH2 3.79Å; E334-R379 PolarHBondContact OE2-NH2 2.78Å; I361-R379 HydrophobicContact CD1-CB 3.8Å; S374-R379 PolarHBondContact O-NE 2.63Å; S374-R379 PolarHBondContact O-NH2 3.2Å; S375-R379 WeakPolarHBondContact O-CG 3.3Å; S375-R379 PolarHBondContact O-N 3.19Å; I376-R379 PolarHBondContact O-N 3.15Å; E377-R379 VanDerWaalsContact C-N 3.35Å; R379-E382 PolarHBondContact O-N 2.93Å; R379-A383 PolarHBondContact O-N 2.93Å; R379-A383 VanDerWaalsContact O-N 3.09Å
380	V	95.7	Very high	93.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68.1	-40.7	-179.8	168.3	0	0	0	0	111.6	I376 E377 E382 S384 I391 L393 W401 P404 I407 L409	I376-V380 HydrophobicContact CD1-CG2 4.31Å; I376-V380 HydrophobicContact CG1-CG2 4.21Å; I376-V380 WeakPolarHBondContact O-CB 3.5Å; I376-V380 WeakPolarHBondContact O-CG2 3.31Å; I376-V380 PolarHBondContact O-N 3.22Å; E377-V380 PolarHBondContact O-N 3.33Å; V380-E382 VanDerWaalsContact C-N 3.32Å; V380-E382 PolarHBondContact O-N 2.93Å; V380-S384 VanDerWaalsContact O-CB 3.27Å; V380-S384 WeakPolarHBondContact O-CB 3.43Å; V380-S384 PolarHBondContact O-N 3.36Å; V380-I391 HydrophobicContact CB-CD1 4.09Å; V380-I391 HydrophobicContact CG1-CD1 3.96Å; V380-I391 HydrophobicContact CG2-CD1 3.86Å; V380-I391 HydrophobicContact CG2-CG2 4.47Å; V380-L393 HydrophobicContact CG2-CD2 4.28Å; V380-W401 HydrophobicContact CB-CH2 3.82Å; V380-W401 HydrophobicContact CB-CZ3 4.13Å; V380-W401 HydrophobicContact CG1-CH2 3.78Å; V380-W401 HydrophobicContact CG1-CZ3 3.97Å; V380-W401 HydrophobicContact CG2-CH2 3.75Å; V380-W401 HydrophobicContact CG2-CZ2 4.46Å; V380-P404 HydrophobicContact CG1-CG 4.23Å; V380-I407 HydrophobicContact CG1-CG2 4.38Å; V380-L409 HydrophobicContact CG1-CD2 3.94Å; V380-L409 HydrophobicContact CG2-CD2 4.3Å
381	K	92.6	Very high	93.3	Very high	108 Å²	108	56.4 Å²	56.4	47%	0.47	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-42.9	175.6	-78.3	169.6	-177.6	164.4	0	111.6	E377 Q378 S384 K385 P404	E377-K381 VanDerWaalsContact O-CB 3.32Å; E377-K381 WeakPolarHBondContact O-CB 3.38Å; E377-K381 VanDerWaalsContact O-CG 3.23Å; E377-K381 WeakPolarHBondContact O-CG 3.24Å; E377-K381 PolarHBondContact O-N 2.88Å; E377-K381 IonicContact OE2-NZ 3.72Å; Q378-K381 PolarHBondContact O-N 2.92Å; K381-S384 PolarHBondContact O-N 3.07Å; K381-K385 WeakPolarHBondContact O-CB 3.49Å; K381-K385 PolarHBondContact O-N 3.17Å; K381-P404 HydrophobicContact CG-CG 3.98Å
382	E	91.3	Very high	93.3	Very high	25 Å²	25	51 Å²	51	12%	0.117	25%	0.25	C	C	.	.	H	α-helix	trans	-68.4	-47.1	179.8	-173.8	63.1	-168.4	0	0	112.4	P273 L275 Q378 R379 V380 S384 K385 L386	P273-E382 HydrophobicContact CB-CB 3.7Å; P273-E382 HydrophobicContact CB-CG 3.97Å; P273-E382 HydrophobicContact CG-CB 3.49Å; P273-E382 VanDerWaalsContact CG-CB 3.49Å; P273-E382 HydrophobicContact CG-CG 3.83Å; L275-E382 HydrophobicContact CD1-CB 4.34Å; L275-E382 HydrophobicContact CD1-CG 3.62Å; Q378-E382 PolarHBondContact O-N 3.22Å; R379-E382 PolarHBondContact O-N 2.93Å; V380-E382 VanDerWaalsContact C-N 3.32Å; V380-E382 PolarHBondContact O-N 2.93Å; E382-S384 VanDerWaalsContact C-N 3.29Å; E382-S384 PolarHBondContact O-N 2.87Å; E382-K385 WeakPolarHBondContact O-CB 3.28Å; E382-K385 PolarHBondContact O-N 3.47Å; E382-L386 HydrophobicContact CG-CD1 4.34Å; E382-L386 WeakPolarHBondContact O-CG 3.5Å; E382-L386 PolarHBondContact O-N 3.23Å; E382-L386 VanDerWaalsContact O-N 3.16Å
383	A	92.5	Very high	93.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-42.8	174.6	0	0	0	0	0	111.9	V266 L275 R379 L386 G387 F388 I391	V266-A383 HydrophobicContact CG2-CB 3.8Å; L275-A383 HydrophobicContact CD2-CB 4.36Å; R379-A383 PolarHBondContact O-N 2.93Å; R379-A383 VanDerWaalsContact O-N 3.09Å; A383-L386 PolarHBondContact O-N 3.49Å; A383-G387 PolarHBondContact O-N 3.13Å; A383-F388 HydrophobicContact CB-CB 4.17Å; A383-F388 WeakPolarHBondContact O-CB 3.49Å; A383-F388 PolarHBondContact O-N 2.95Å; A383-F388 VanDerWaalsContact O-N 3.08Å; A383-I391 HydrophobicContact CB-CD1 3.61Å; A383-I391 HydrophobicContact CB-CG1 4.4Å
384	S	90.6	Very high	93.5	Very high	29 Å²	29	42 Å²	42	20%	0.203	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-43.1	175.9	177.9	0	0	0	0	112.8	V380 K381 E382 L386 G387 P404	V380-S384 VanDerWaalsContact O-CB 3.27Å; V380-S384 WeakPolarHBondContact O-CB 3.43Å; V380-S384 PolarHBondContact O-N 3.36Å; K381-S384 PolarHBondContact O-N 3.07Å; E382-S384 VanDerWaalsContact C-N 3.29Å; E382-S384 PolarHBondContact O-N 2.87Å; S384-L386 PolarHBondContact O-N 3.45Å; S384-G387 PolarHBondContact O-N 3.05Å; S384-P404 WeakPolarHBondContact OG-CB 3.31Å
385	K	88.2	Confident	93.6	Very high	143 Å²	143	44.2 Å²	44.2	62%	0.622	21%	0.214	S	C	*	.	H	α-helix	trans	-59.2	-33.2	177.9	-179.8	-173.8	169.9	-161.8	0	112.2	K381 E382 G387	K381-K385 WeakPolarHBondContact O-CB 3.49Å; K381-K385 PolarHBondContact O-N 3.17Å; E382-K385 WeakPolarHBondContact O-CB 3.28Å; E382-K385 PolarHBondContact O-N 3.47Å; K385-G387 VanDerWaalsContact C-N 3.3Å
386	L	86.1	Confident	93.6	Very high	43 Å²	43	47.5 Å²	47.5	23%	0.225	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	2.9	178.6	-62.4	168.2	0	0	0	113.8	N246 L275 E382 A383 S384 F388	N246-L386 WeakPolarHBondContact ND2-CD2 3.35Å; N246-L386 WeakPolarHBondContact OD1-CD2 3.31Å; L275-L386 HydrophobicContact CB-CD1 4.43Å; L275-L386 HydrophobicContact CD1-CD1 3.44Å; L275-L386 VanDerWaalsContact CD1-CD1 3.44Å; L275-L386 HydrophobicContact CD2-CD1 3.85Å; L275-L386 HydrophobicContact CG-CD1 4.09Å; E382-L386 HydrophobicContact CG-CD1 4.34Å; E382-L386 WeakPolarHBondContact O-CG 3.5Å; E382-L386 PolarHBondContact O-N 3.23Å; E382-L386 VanDerWaalsContact O-N 3.16Å; A383-L386 PolarHBondContact O-N 3.49Å; S384-L386 PolarHBondContact O-N 3.45Å; L386-F388 HydrophobicContact CB-CD2 4.2Å; L386-F388 HydrophobicContact CB-CE2 4.42Å
387	G	87.1	Confident	93.6	Very high	30 Å²	30	47.4 Å²	47.4	31%	0.309	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	6.6	173.2	0	0	0	0	0	115.4	A383 S384 K385 K389	A383-G387 PolarHBondContact O-N 3.13Å; S384-G387 PolarHBondContact O-N 3.05Å; K385-G387 VanDerWaalsContact C-N 3.3Å; G387-K389 WeakPolarHBondContact O-CD 3.41Å; G387-K389 WeakPolarHBondContact O-CE 3.5Å
388	F	91.4	Very high	93.5	Very high	13 Å²	13	47.8 Å²	47.8	6%	0.057	23%	0.23	C	C	.	.			trans	-59.7	141	171.1	-76.5	-100.6	0	0	0	110.4	L252 I264 L275 A356 T357 E358 C359 A383 L386 I407	L252-F388 HydrophobicContact CD1-CE2 3.61Å; L252-F388 HydrophobicContact CD1-CZ 3.81Å; L252-F388 HydrophobicContact CD2-CZ 4.23Å; I264-F388 HydrophobicContact CB-CE1 4.04Å; I264-F388 HydrophobicContact CB-CZ 4.3Å; I264-F388 HydrophobicContact CG1-CE1 3.92Å; I264-F388 HydrophobicContact CG1-CZ 4.04Å; I264-F388 HydrophobicContact CG2-CE1 4.02Å; I264-F388 HydrophobicContact CG2-CZ 3.89Å; L275-F388 HydrophobicContact CD2-CD2 3.46Å; L275-F388 VanDerWaalsContact CD2-CD2 3.46Å; L275-F388 HydrophobicContact CD2-CE1 4.42Å; L275-F388 HydrophobicContact CD2-CE2 3.12Å; L275-F388 HydrophobicContact CD2-CG 4.27Å; L275-F388 HydrophobicContact CD2-CZ 3.67Å; A356-F388 WeakPolarHBondContact O-CE1 3.46Å; T357-F388 WeakPolarHBondContact O-CD1 3.28Å; E358-F388 WeakPolarHBondContact O-CE1 3.47Å; C359-F388 HydrophobicContact CB-CD1 4.24Å; C359-F388 WeakPolarHBondContact SG-CD1 3.35Å; C359-F388 WeakPolarHBondContact SG-CE1 3.33Å; A383-F388 HydrophobicContact CB-CB 4.17Å; A383-F388 WeakPolarHBondContact O-CB 3.49Å; A383-F388 PolarHBondContact O-N 2.95Å; A383-F388 VanDerWaalsContact O-N 3.08Å; L386-F388 HydrophobicContact CB-CD2 4.2Å; L386-F388 HydrophobicContact CB-CE2 4.42Å; F388-I407 WeakPolarHBondContact O-CD1 3.39Å
389	K	92.6	Very high	92.9	Very high	110 Å²	110	46.1 Å²	46.1	48%	0.478	24%	0.235	S	C	.	.			trans	-106.6	-30.6	-170.7	-59.2	-54.8	179.7	-166.7	0	112.7	T357 G387 E408	T357-K389 HydrophobicContact CG2-CG 4.21Å; T357-K389 PolarHBondContact O-N 3.21Å; G387-K389 WeakPolarHBondContact O-CD 3.41Å; G387-K389 WeakPolarHBondContact O-CE 3.5Å; K389-E408 PolarHBondContact O-N 3.39Å
390	R	95.7	Very high	92.4	Very high	71 Å²	71	54.7 Å²	54.7	27%	0.268	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127.7	-176.2	-67.8	-175.8	-62.2	176.1	0.6	110.2	E355 T357 E358 C359 E408 I410	E355-R390 VanDerWaalsContact CB-NH2 3.33Å; E355-R390 VanDerWaalsContact CG-NH2 3.26Å; T357-R390 PolarHBondContact O-N 3.43Å; E358-R390 WeakPolarHBondContact CA-O 3.25Å; E358-R390 VanDerWaalsContact CD-NH2 3.28Å; E358-R390 HydrophobicContact CG-CB 4.05Å; E358-R390 IonicContact OE1-CZ 2.86Å; E358-R390 IonicContact OE1-NE 3.42Å; E358-R390 PolarHBondContact OE1-NE 2.89Å; E358-R390 IonicContact OE1-NH1 3.71Å; E358-R390 PolarHBondContact OE1-NH1 3.03Å; E358-R390 IonicContact OE1-NH2 3.23Å; E358-R390 PolarHBondContact OE1-NH2 2.85Å; C359-R390 PolarHBondContact N-O 3.39Å; R390-E408 WeakPolarHBondContact CA-O 3.5Å; R390-E408 WeakPolarHBondContact CD-OE2 3.43Å; R390-E408 HydrophobicContact CG-CB 4.16Å; R390-E408 WeakPolarHBondContact CG-OE2 3.31Å; R390-I410 HydrophobicContact CB-CD1 4Å; R390-I410 HydrophobicContact CG-CD1 4.25Å
391	I	97.7	Very high	92.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	116.6	176.5	-55.4	-176.7	0	0	0	109.4	C359 I361 V380 A383 L393 I407 E408 L409 I410	C359-I391 HydrophobicContact CB-CG1 4.2Å; C359-I391 HydrophobicContact CB-CG2 4.37Å; C359-I391 WeakPolarHBondContact O-CA 3.33Å; I361-I391 HydrophobicContact CD1-CG2 3.9Å; I361-I391 HydrophobicContact CG1-CG2 4.44Å; V380-I391 HydrophobicContact CB-CD1 4.09Å; V380-I391 HydrophobicContact CG1-CD1 3.96Å; V380-I391 HydrophobicContact CG2-CD1 3.86Å; V380-I391 HydrophobicContact CG2-CG2 4.47Å; A383-I391 HydrophobicContact CB-CD1 3.61Å; A383-I391 HydrophobicContact CB-CG1 4.4Å; I391-L393 HydrophobicContact CB-CD2 4.43Å; I391-L393 HydrophobicContact CG2-CB 4.34Å; I391-L393 HydrophobicContact CG2-CD2 4.03Å; I391-I407 HydrophobicContact CD1-CD1 3.28Å; I391-I407 HydrophobicContact CD1-CG1 4.17Å; I391-I407 HydrophobicContact CG1-CD1 3.6Å; I391-I407 HydrophobicContact CG1-CG1 4.09Å; I391-E408 PolarHBondContact N-O 3.24Å; I391-L409 HydrophobicContact CB-CD2 4.11Å; I391-L409 HydrophobicContact CD1-CD2 4.41Å; I391-I410 PolarHBondContact O-N 3.02Å
392	Y	98.5	Very high	91.9	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	121.5	168.4	-64	-99.6	0	0	0	108.8	E358 C359 F360 I361 I410 V412 T418 K421 V422	E358-Y392 HydrophobicContact CB-CE2 4.36Å; E358-Y392 HydrophobicContact CG-CE2 4.01Å; E358-Y392 VanDerWaalsContact OE1-CE2 3.27Å; E358-Y392 WeakPolarHBondContact OE1-CE2 3.49Å; E358-Y392 PolarHBondContact OE1-OH 3.49Å; C359-Y392 PolarHBondContact O-N 3.15Å; F360-Y392 AromaticContact CD1-CD2 3.63Å; F360-Y392 HydrophobicContact CD1-CD2 3.63Å; F360-Y392 HydrophobicContact CD1-CE2 4.41Å; F360-Y392 AromaticContact CD1-CG 3.83Å; F360-Y392 HydrophobicContact CD1-CG 3.83Å; F360-Y392 AromaticContact CE1-CD2 3.28Å; F360-Y392 HydrophobicContact CE1-CD2 3.28Å; F360-Y392 AromaticContact CE1-CE2 3.63Å; F360-Y392 HydrophobicContact CE1-CE2 3.63Å; F360-Y392 AromaticContact CE1-CG 3.82Å; F360-Y392 HydrophobicContact CE1-CG 3.82Å; F360-Y392 HydrophobicContact CZ-CD2 4.16Å; F360-Y392 HydrophobicContact CZ-CE2 4.25Å; I361-Y392 PolarHBondContact N-O 2.69Å; Y392-I410 WeakPolarHBondContact CA-O 3.43Å; Y392-I410 HydrophobicContact CD1-CB 3.95Å; Y392-I410 HydrophobicContact CD1-CD1 4.32Å; Y392-I410 HydrophobicContact CD1-CG2 3.69Å; Y392-I410 HydrophobicContact CD2-CD1 4.36Å; Y392-I410 HydrophobicContact CE1-CB 4.15Å; Y392-I410 HydrophobicContact CE1-CD1 3.81Å; Y392-I410 HydrophobicContact CE1-CG2 3.69Å; Y392-I410 HydrophobicContact CE2-CD1 3.84Å; Y392-I410 HydrophobicContact CG-CB 4.31Å; Y392-V412 HydrophobicContact CD1-CG1 4.09Å; Y392-T418 HydrophobicContact CD1-CG2 4.18Å; Y392-K421 HydrophobicContact CE1-CB 3.81Å; Y392-V422 HydrophobicContact CD1-CG2 4.22Å; Y392-V422 HydrophobicContact CE1-CG2 3.74Å; Y392-V422 HydrophobicContact CE2-CG2 4.13Å
393	L	98.1	Very high	91.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160.6	-175	64.7	94.4	0	0	0	112.1	I361 I376 V380 I391 K395 N397 M398 L409 I410 P411 V412	I361-L393 WeakPolarHBondContact O-CA 3.42Å; I376-L393 HydrophobicContact CD1-CB 4.13Å; V380-L393 HydrophobicContact CG2-CD2 4.28Å; I391-L393 HydrophobicContact CB-CD2 4.43Å; I391-L393 HydrophobicContact CG2-CB 4.34Å; I391-L393 HydrophobicContact CG2-CD2 4.03Å; L393-K395 PolarHBondContact O-N 3.36Å; L393-N397 HydrophobicContact CD1-CB 4.04Å; L393-M398 HydrophobicContact CD1-CG 4.36Å; L393-M398 HydrophobicContact CD1-SD 3.9Å; L393-L409 HydrophobicContact CD2-CB 4.08Å; L393-L409 HydrophobicContact CD2-CD1 4.17Å; L393-L409 HydrophobicContact CD2-CD2 3.81Å; L393-L409 HydrophobicContact CD2-CG 4.23Å; L393-I410 PolarHBondContact N-O 3.04Å; L393-P411 WeakPolarHBondContact O-CA 3.34Å; L393-V412 VanDerWaalsContact O-CG2 3.3Å; L393-V412 WeakPolarHBondContact O-CG2 3.13Å; L393-V412 PolarHBondContact O-N 3.13Å
394	P	98.3	Very high	91.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	130.9	-176.3	-19.3	34.1	0	0	0	110.3	I361 I370 R371 N396 N397	I361-P394 VanDerWaalsContact O-CD 3.29Å; I361-P394 WeakPolarHBondContact O-CD 3.25Å; I370-P394 HydrophobicContact CG2-CB 3.89Å; I370-P394 HydrophobicContact CG2-CG 3.88Å; R371-P394 VanDerWaalsContact O-CB 3.25Å; R371-P394 WeakPolarHBondContact O-CB 3.37Å; R371-P394 WeakPolarHBondContact O-CG 3.44Å; P394-N396 PolarHBondContact O-N 2.82Å; P394-N397 WeakPolarHBondContact CD-OD1 3.28Å; P394-N397 VanDerWaalsContact CG-OD1 3.29Å; P394-N397 WeakPolarHBondContact CG-OD1 3.3Å; P394-N397 WeakPolarHBondContact O-CB 3.36Å; P394-N397 PolarHBondContact O-N 2.99Å
395	K	97	Very high	91.6	Very high	125 Å²	125	68.3 Å²	68.3	54%	0.543	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-50.7	-35.8	-180	-177.8	178.6	178.7	-178.3	0	112.8	L393 N397 M398 P411 V412 A413	L393-K395 PolarHBondContact O-N 3.36Å; K395-N397 VanDerWaalsContact C-N 3.26Å; K395-N397 PolarHBondContact O-N 2.87Å; K395-M398 VanDerWaalsContact O-CB 3.26Å; K395-M398 WeakPolarHBondContact O-CB 3.3Å; K395-M398 WeakPolarHBondContact O-CG 3.39Å; K395-M398 PolarHBondContact O-N 3.37Å; K395-M398 VanDerWaalsContact O-N 3.13Å; K395-P411 HydrophobicContact CB-CB 4.17Å; K395-P411 HydrophobicContact CG-CB 4.25Å; K395-V412 PolarHBondContact N-O 3.03Å; K395-A413 HydrophobicContact CB-CB 4.47Å; K395-A413 HydrophobicContact CD-CB 4.33Å
396	N	95.1	Very high	91.6	Very high	118 Å²	118	64.8 Å²	64.8	63%	0.631	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-77.9	-1.9	-179.5	-63.7	-18.1	0	0	0	114.6	R372 P394	R372-N396 HydrophobicContact CB-CB 4.42Å; P394-N396 PolarHBondContact O-N 2.82Å
397	N	95.5	Very high	91.9	Very high	12 Å²	12	63.7 Å²	63.7	6%	0.064	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-87.6	-9.8	166.1	-83.6	111	0	0	0	112.6	R372 V373 I376 L393 P394 K395 G399 W401	R372-N397 VanDerWaalsContact CA-OD1 3.23Å; R372-N397 WeakPolarHBondContact CA-OD1 3.2Å; V373-N397 PolarHBondContact N-OD1 3.37Å; V373-N397 PolarHBondContact O-ND2 3.34Å; I376-N397 HydrophobicContact CB-CB 4.28Å; I376-N397 HydrophobicContact CD1-CB 4.44Å; I376-N397 HydrophobicContact CG1-CB 3.96Å; I376-N397 HydrophobicContact CG2-CB 4.25Å; L393-N397 HydrophobicContact CD1-CB 4.04Å; P394-N397 WeakPolarHBondContact CD-OD1 3.28Å; P394-N397 VanDerWaalsContact CG-OD1 3.29Å; P394-N397 WeakPolarHBondContact CG-OD1 3.3Å; P394-N397 WeakPolarHBondContact O-CB 3.36Å; P394-N397 PolarHBondContact O-N 2.99Å; K395-N397 VanDerWaalsContact C-N 3.26Å; K395-N397 PolarHBondContact O-N 2.87Å; N397-G399 PolarHBondContact O-N 2.84Å; N397-W401 PolarHBondContact O-NE1 3.47Å
398	M	91.6	Very high	92.3	Very high	90 Å²	90	67.7 Å²	67.7	44%	0.443	36%	0.363	S	S	.	.			trans	-68.7	110.3	166.5	-58.3	-62.9	-70.8	0	0	107.2	L393 K395 L409 P411	L393-M398 HydrophobicContact CD1-CG 4.36Å; L393-M398 HydrophobicContact CD1-SD 3.9Å; K395-M398 VanDerWaalsContact O-CB 3.26Å; K395-M398 WeakPolarHBondContact O-CB 3.3Å; K395-M398 WeakPolarHBondContact O-CG 3.39Å; K395-M398 PolarHBondContact O-N 3.37Å; K395-M398 VanDerWaalsContact O-N 3.13Å; M398-L409 HydrophobicContact SD-CD1 4.38Å; M398-P411 HydrophobicContact CG-CB 3.88Å; M398-P411 HydrophobicContact CG-CG 4.48Å; M398-P411 HydrophobicContact SD-CB 4.41Å
399	G	80.7	Confident	92.6	Very high	47 Å²	47	68.3 Å²	68.3	49%	0.485	37%	0.367	S	S	.	.	S	Bend	trans	-152.1	-159.1	-178.5	0	0	0	0	0	109.9	N397 W401	N397-G399 PolarHBondContact O-N 2.84Å; G399-W401 PolarHBondContact O-N 2.82Å
400	D	83.2	Confident	92.8	Very high	181 Å²	181	63.9 Å²	63.9	97%	0.968	35%	0.348	S	S	*	.	S	Bend	trans	-81.1	64.5	-173.7	-60.1	-31.3	0	0	0	112.5
401	W	91	Very high	92.9	Very high	32 Å²	32	62.6 Å²	62.6	12%	0.121	35%	0.349	C	S	.	.			trans	-139	152.4	170.6	65.8	-81.7	0	0	0	110.1	I376 E377 V380 N397 G399 P403 L409	I376-W401 HydrophobicContact CG1-CZ2 4.27Å; I376-W401 HydrophobicContact CG2-CZ2 4.33Å; E377-W401 HydrophobicContact CB-CE3 4.38Å; E377-W401 HydrophobicContact CG-CB 3.75Å; E377-W401 HydrophobicContact CG-CD2 3.64Å; E377-W401 HydrophobicContact CG-CE3 3.66Å; E377-W401 HydrophobicContact CG-CG 3.68Å; E377-W401 HydrophobicContact CG-CZ3 4.44Å; E377-W401 WeakPolarHBondContact OE1-CB 3.28Å; V380-W401 HydrophobicContact CB-CH2 3.82Å; V380-W401 HydrophobicContact CB-CZ3 4.13Å; V380-W401 HydrophobicContact CG1-CH2 3.78Å; V380-W401 HydrophobicContact CG1-CZ3 3.97Å; V380-W401 HydrophobicContact CG2-CH2 3.75Å; V380-W401 HydrophobicContact CG2-CZ2 4.46Å; N397-W401 PolarHBondContact O-NE1 3.47Å; G399-W401 PolarHBondContact O-N 2.82Å; W401-P403 HydrophobicContact CE3-CG 4.39Å; W401-P403 HydrophobicContact CH2-CB 4.33Å; W401-P403 HydrophobicContact CH2-CG 4.16Å; W401-P403 HydrophobicContact CZ3-CB 4.06Å; W401-P403 HydrophobicContact CZ3-CG 4.06Å; W401-P403 WeakPolarHBondContact O-CD 3.39Å; W401-L409 HydrophobicContact CH2-CD1 3.61Å; W401-L409 HydrophobicContact CZ2-CD1 3.88Å
402	T	88.7	Confident	92.9	Very high	126 Å²	126	62.6 Å²	62.6	77%	0.773	35%	0.349	S	S	*	.			trans	-97	115.4	-176.2	-52.7	0	0	0	0	110.3
403	P	89.3	Confident	92.9	Very high	51 Å²	51	64.1 Å²	64.1	33%	0.331	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-63.1	148.6	174.2	-23.1	35.7	0	0	0	112.4	W401 L409	W401-P403 HydrophobicContact CE3-CG 4.39Å; W401-P403 HydrophobicContact CH2-CB 4.33Å; W401-P403 HydrophobicContact CH2-CG 4.16Å; W401-P403 HydrophobicContact CZ3-CB 4.06Å; W401-P403 HydrophobicContact CZ3-CG 4.06Å; W401-P403 WeakPolarHBondContact O-CD 3.39Å; P403-L409 HydrophobicContact CB-CD1 3.71Å; P403-L409 HydrophobicContact CB-CG 4.3Å; P403-L409 HydrophobicContact CG-CD1 3.42Å; P403-L409 VanDerWaalsContact CG-CD1 3.42Å; P403-L409 HydrophobicContact CG-CG 4.39Å
404	P	89.4	Confident	92.9	Very high	31 Å²	31	67 Å²	67	20%	0.201	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-53.7	151	167.1	-23	33.3	0	0	0	111.9	V380 K381 S384 I407	V380-P404 HydrophobicContact CG1-CG 4.23Å; K381-P404 HydrophobicContact CG-CG 3.98Å; S384-P404 WeakPolarHBondContact OG-CB 3.31Å; P404-I407 HydrophobicContact CB-CG2 4.38Å; P404-I407 WeakPolarHBondContact O-CG2 3.15Å
405	K	88.2	Confident	92.8	Very high	208 Å²	208	67 Å²	67	90%	0.904	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	146.1	175.1	-66.2	-176.1	-179.6	-179.5	0	110.7
406	G	88.1	Confident	92.8	Very high	69 Å²	69	62.2 Å²	62.2	71%	0.711	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	8.1	173.5	0	0	0	0	0	115.4
407	I	92.6	Very high	92.8	Very high	20 Å²	20	58.9 Å²	58.9	10%	0.103	35%	0.347	C	S	.	.			trans	-114.7	133.3	171.8	-158.7	157.9	0	0	0	110.5	V380 F388 I391 P404 L409	V380-I407 HydrophobicContact CG1-CG2 4.38Å; F388-I407 WeakPolarHBondContact O-CD1 3.39Å; I391-I407 HydrophobicContact CD1-CD1 3.28Å; I391-I407 HydrophobicContact CD1-CG1 4.17Å; I391-I407 HydrophobicContact CG1-CD1 3.6Å; I391-I407 HydrophobicContact CG1-CG1 4.09Å; P404-I407 HydrophobicContact CB-CG2 4.38Å; P404-I407 WeakPolarHBondContact O-CG2 3.15Å; I407-L409 HydrophobicContact CG2-CD2 4.13Å
408	E	96.3	Very high	92.9	Very high	113 Å²	113	58.3 Å²	58.3	53%	0.528	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.4	173.3	-176.4	-174.4	-176.8	0	0	109.1	K389 R390 I391 I410	K389-E408 PolarHBondContact O-N 3.39Å; R390-E408 WeakPolarHBondContact CA-O 3.5Å; R390-E408 WeakPolarHBondContact CD-OE2 3.43Å; R390-E408 HydrophobicContact CG-CB 4.16Å; R390-E408 WeakPolarHBondContact CG-OE2 3.31Å; I391-E408 PolarHBondContact N-O 3.24Å; E408-I410 HydrophobicContact CG-CG1 4.17Å
409	L	96.8	Very high	93.2	Very high	26 Å²	26	54.3 Å²	54.3	14%	0.136	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.9	173.4	-59	-169.7	0	0	0	109.5	V380 I391 L393 M398 W401 P403 I407 P411	V380-L409 HydrophobicContact CG1-CD2 3.94Å; V380-L409 HydrophobicContact CG2-CD2 4.3Å; I391-L409 HydrophobicContact CB-CD2 4.11Å; I391-L409 HydrophobicContact CD1-CD2 4.41Å; L393-L409 HydrophobicContact CD2-CB 4.08Å; L393-L409 HydrophobicContact CD2-CD1 4.17Å; L393-L409 HydrophobicContact CD2-CD2 3.81Å; L393-L409 HydrophobicContact CD2-CG 4.23Å; M398-L409 HydrophobicContact SD-CD1 4.38Å; W401-L409 HydrophobicContact CH2-CD1 3.61Å; W401-L409 HydrophobicContact CZ2-CD1 3.88Å; P403-L409 HydrophobicContact CB-CD1 3.71Å; P403-L409 HydrophobicContact CB-CG 4.3Å; P403-L409 HydrophobicContact CG-CD1 3.42Å; P403-L409 VanDerWaalsContact CG-CD1 3.42Å; P403-L409 HydrophobicContact CG-CG 4.39Å; I407-L409 HydrophobicContact CG2-CD2 4.13Å; L409-P411 WeakPolarHBondContact O-CD 3.1Å
410	I	97.6	Very high	93.9	Very high	17 Å²	17	60.6 Å²	60.6	9%	0.087	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	92.1	-178.2	-54.4	175	0	0	0	108.2	R390 I391 Y392 L393 E408 V412 K421	R390-I410 HydrophobicContact CB-CD1 4Å; R390-I410 HydrophobicContact CG-CD1 4.25Å; I391-I410 PolarHBondContact O-N 3.02Å; Y392-I410 WeakPolarHBondContact CA-O 3.43Å; Y392-I410 HydrophobicContact CD1-CB 3.95Å; Y392-I410 HydrophobicContact CD1-CD1 4.32Å; Y392-I410 HydrophobicContact CD1-CG2 3.69Å; Y392-I410 HydrophobicContact CD2-CD1 4.36Å; Y392-I410 HydrophobicContact CE1-CB 4.15Å; Y392-I410 HydrophobicContact CE1-CD1 3.81Å; Y392-I410 HydrophobicContact CE1-CG2 3.69Å; Y392-I410 HydrophobicContact CE2-CD1 3.84Å; Y392-I410 HydrophobicContact CG-CB 4.31Å; L393-I410 PolarHBondContact N-O 3.04Å; E408-I410 HydrophobicContact CG-CG1 4.17Å; I410-V412 HydrophobicContact CG2-CG1 4.47Å; I410-V412 PolarHBondContact O-N 3.23Å; I410-K421 HydrophobicContact CG2-CD 3.72Å
411	P	97.7	Very high	94.5	Very high	44 Å²	44	54.5 Å²	54.5	29%	0.286	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	133.6	176.7	27.1	-33.6	0	0	0	110.3	L393 K395 M398 L409 K421	L393-P411 WeakPolarHBondContact O-CA 3.34Å; K395-P411 HydrophobicContact CB-CB 4.17Å; K395-P411 HydrophobicContact CG-CB 4.25Å; M398-P411 HydrophobicContact CG-CB 3.88Å; M398-P411 HydrophobicContact CG-CG 4.48Å; M398-P411 HydrophobicContact SD-CB 4.41Å; L409-P411 WeakPolarHBondContact O-CD 3.1Å; P411-K421 PolarHBondContact O-NZ 2.83Å
412	V	98.1	Very high	94.7	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.1	176.9	-70.4	0	0	0	0	110.6	L339 I370 Y392 L393 K395 I410 T418 K421	L339-V412 HydrophobicContact CD2-CG2 4.18Å; I370-V412 HydrophobicContact CB-CG2 4.41Å; I370-V412 HydrophobicContact CG1-CG2 4.18Å; I370-V412 HydrophobicContact CG2-CG2 4.22Å; Y392-V412 HydrophobicContact CD1-CG1 4.09Å; L393-V412 VanDerWaalsContact O-CG2 3.3Å; L393-V412 WeakPolarHBondContact O-CG2 3.13Å; L393-V412 PolarHBondContact O-N 3.13Å; K395-V412 PolarHBondContact N-O 3.03Å; I410-V412 HydrophobicContact CG2-CG1 4.47Å; I410-V412 PolarHBondContact O-N 3.23Å; V412-T418 VanDerWaalsContact CB-OG1 3.32Å; V412-T418 WeakPolarHBondContact CB-OG1 3.4Å; V412-T418 HydrophobicContact CG1-CG2 4.38Å; V412-T418 WeakPolarHBondContact CG1-OG1 2.94Å; V412-T418 WeakPolarHBondContact CG2-OG1 3.48Å; V412-K421 HydrophobicContact CG1-CD 4.21Å
413	A	97.7	Very high	94.9	Very high	36 Å²	36	48.8 Å²	48.8	30%	0.298	27%	0.265	S	S	.	.	S	Bend	trans	-101.6	-27.3	179.2	0	0	0	0	0	112.7	E369 I370 K395 E417	E369-A413 WeakPolarHBondContact CA-O 3.46Å; I370-A413 PolarHBondContact N-O 2.88Å; K395-A413 HydrophobicContact CB-CB 4.47Å; K395-A413 HydrophobicContact CD-CB 4.33Å; A413-E417 PolarHBondContact N-OE2 3.28Å
414	T	97.6	Very high	94.3	Very high	62 Å²	62	58.9 Å²	58.9	38%	0.38	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-139.2	152.9	-176.8	65	0	0	0	0	111.8	G368 G416 E417 T418	G368-T414 CarbonylContact O-C 3.53Å; G368-T414 VanDerWaalsContact O-CA 3.3Å; G368-T414 WeakPolarHBondContact O-CA 3.43Å; T414-G416 VanDerWaalsContact C-N 3.31Å; T414-G416 PolarHBondContact O-N 3.17Å; T414-E417 WeakPolarHBondContact O-CB 3.31Å; T414-E417 PolarHBondContact O-N 3.42Å; T414-E417 VanDerWaalsContact O-N 3.15Å; T414-E417 VanDerWaalsContact OG1-CB 3.28Å; T414-E417 WeakPolarHBondContact OG1-CB 3.39Å; T414-E417 PolarHBondContact OG1-N 3.2Å; T414-T418 PolarHBondContact O-N 3.22Å; T414-T418 PolarHBondContact O-OG1 3.4Å; T414-T418 VanDerWaalsContact O-OG1 3.14Å
415	L	97.2	Very high	94.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57.9	-43	176.7	-177.5	58	0	0	0	111.8	V308 L309 L339 A342 I364 G368 I370 E417 T418 L419	V308-L415 HydrophobicContact CG1-CD2 4.02Å; L309-L415 HydrophobicContact CD2-CD1 4.22Å; L309-L415 HydrophobicContact CD2-CD2 3.66Å; L309-L415 HydrophobicContact CD2-CG 4.13Å; L309-L415 HydrophobicContact CG-CD2 4Å; L339-L415 HydrophobicContact CD1-CD1 4.15Å; A342-L415 HydrophobicContact CB-CD1 3.87Å; I364-L415 HydrophobicContact CD1-CD1 4.05Å; I364-L415 HydrophobicContact CD1-CD2 4.37Å; G368-L415 PolarHBondContact O-N 3.18Å; I370-L415 HydrophobicContact CD1-CB 4.21Å; L415-E417 VanDerWaalsContact C-N 3.33Å; L415-E417 PolarHBondContact O-N 2.83Å; L415-T418 WeakPolarHBondContact O-CB 3.34Å; L415-T418 PolarHBondContact O-N 3.22Å; L415-L419 HydrophobicContact CD1-CG 4.33Å; L415-L419 HydrophobicContact CG-CD1 4.38Å; L415-L419 WeakPolarHBondContact O-CG 3.29Å; L415-L419 PolarHBondContact O-N 3.31Å
416	G	95.7	Very high	94.8	Very high	24 Å²	24	52.5 Å²	52.5	25%	0.247	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-32.8	176.9	0	0	0	0	0	113.7	T414 R420	T414-G416 VanDerWaalsContact C-N 3.31Å; T414-G416 PolarHBondContact O-N 3.17Å; G416-R420 WeakPolarHBondContact O-CG 3.32Å; G416-R420 PolarHBondContact O-N 3.15Å; G416-R420 PolarHBondContact O-NE 3.33Å
417	E	96.1	Very high	95.2	Very high	47 Å²	47	51.6 Å²	51.6	22%	0.22	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-47.4	169.6	-179.1	-169.2	177.1	0	0	111.2	A413 T414 L415 L419 R420 K421	A413-E417 PolarHBondContact N-OE2 3.28Å; T414-E417 WeakPolarHBondContact O-CB 3.31Å; T414-E417 PolarHBondContact O-N 3.42Å; T414-E417 VanDerWaalsContact O-N 3.15Å; T414-E417 VanDerWaalsContact OG1-CB 3.28Å; T414-E417 WeakPolarHBondContact OG1-CB 3.39Å; T414-E417 PolarHBondContact OG1-N 3.2Å; L415-E417 VanDerWaalsContact C-N 3.33Å; L415-E417 PolarHBondContact O-N 2.83Å; E417-L419 PolarHBondContact O-N 3.31Å; E417-R420 PolarHBondContact O-N 3.07Å; E417-K421 HydrophobicContact CG-CD 4.4Å; E417-K421 WeakPolarHBondContact O-CG 3.44Å; E417-K421 PolarHBondContact O-N 3.3Å; E417-K421 VanDerWaalsContact O-N 3.1Å; E417-K421 WeakPolarHBondContact OE1-CE 3.48Å; E417-K421 IonicContact OE1-NZ 3.37Å; E417-K421 PolarHBondContact OE1-NZ 2.99Å
418	T	97.6	Very high	95.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.4	-54.1	178.2	-50.9	0	0	0	0	110.9	L339 V343 Y392 V412 T414 L415 R420 K421 V422	L339-T418 HydrophobicContact CD1-CG2 3.93Å; L339-T418 HydrophobicContact CD2-CG2 4.33Å; L339-T418 HydrophobicContact CG-CG2 4.41Å; V343-T418 HydrophobicContact CG2-CG2 4.31Å; Y392-T418 HydrophobicContact CD1-CG2 4.18Å; V412-T418 VanDerWaalsContact CB-OG1 3.32Å; V412-T418 WeakPolarHBondContact CB-OG1 3.4Å; V412-T418 HydrophobicContact CG1-CG2 4.38Å; V412-T418 WeakPolarHBondContact CG1-OG1 2.94Å; V412-T418 WeakPolarHBondContact CG2-OG1 3.48Å; T414-T418 PolarHBondContact O-N 3.22Å; T414-T418 PolarHBondContact O-OG1 3.4Å; T414-T418 VanDerWaalsContact O-OG1 3.14Å; L415-T418 WeakPolarHBondContact O-CB 3.34Å; L415-T418 PolarHBondContact O-N 3.22Å; T418-R420 VanDerWaalsContact C-N 3.27Å; T418-R420 PolarHBondContact O-N 3.49Å; T418-K421 PolarHBondContact O-N 3.03Å; T418-V422 HydrophobicContact CG2-CG2 4.1Å; T418-V422 WeakPolarHBondContact O-CG2 3.44Å; T418-V422 PolarHBondContact O-N 3.18Å
419	L	97	Very high	95.3	Very high	7 Å²	7	49.8 Å²	49.8	4%	0.037	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-32.8	-175.9	-62.7	179	0	0	0	113.3	L309 A313 L315 V343 A346 L415 E417 F423	L309-L419 HydrophobicContact CD2-CD1 3.87Å; A313-L419 HydrophobicContact CB-CD1 3.56Å; L315-L419 HydrophobicContact CD1-CD1 4.27Å; V343-L419 HydrophobicContact CG2-CD2 4.38Å; A346-L419 HydrophobicContact CB-CD1 4.34Å; A346-L419 HydrophobicContact CB-CD2 3.57Å; L415-L419 HydrophobicContact CD1-CG 4.33Å; L415-L419 HydrophobicContact CG-CD1 4.38Å; L415-L419 WeakPolarHBondContact O-CG 3.29Å; L415-L419 PolarHBondContact O-N 3.31Å; E417-L419 PolarHBondContact O-N 3.31Å; L419-F423 HydrophobicContact CB-CD2 4.47Å; L419-F423 HydrophobicContact CD2-CD2 4.27Å; L419-F423 HydrophobicContact CD2-CE2 3.81Å; L419-F423 WeakPolarHBondContact O-CD2 3.42Å; L419-F423 PolarHBondContact O-N 3Å
420	R	95.2	Very high	95.2	Very high	179 Å²	179	51.3 Å²	51.3	68%	0.675	24%	0.244	S	C	*	.	H	α-helix	trans	-70.8	-31.4	173.6	-76.1	-176.4	-63.3	175.6	3	113	G416 E417 T418 R424	G416-R420 WeakPolarHBondContact O-CG 3.32Å; G416-R420 PolarHBondContact O-N 3.15Å; G416-R420 PolarHBondContact O-NE 3.33Å; E417-R420 PolarHBondContact O-N 3.07Å; T418-R420 VanDerWaalsContact C-N 3.27Å; T418-R420 PolarHBondContact O-N 3.49Å; R420-R424 WeakPolarHBondContact O-CG 3.37Å
421	K	96.2	Very high	95	Very high	53 Å²	53	53.8 Å²	53.8	23%	0.23	26%	0.255	C	S	.	.	H	α-helix	trans	-76.6	-36.8	176.9	-70.4	-176.6	-174.8	174.2	0	111.7	Y392 I410 P411 V412 E417 T418	Y392-K421 HydrophobicContact CE1-CB 3.81Å; I410-K421 HydrophobicContact CG2-CD 3.72Å; P411-K421 PolarHBondContact O-NZ 2.83Å; V412-K421 HydrophobicContact CG1-CD 4.21Å; E417-K421 HydrophobicContact CG-CD 4.4Å; E417-K421 WeakPolarHBondContact O-CG 3.44Å; E417-K421 PolarHBondContact O-N 3.3Å; E417-K421 VanDerWaalsContact O-N 3.1Å; E417-K421 WeakPolarHBondContact OE1-CE 3.48Å; E417-K421 IonicContact OE1-NZ 3.37Å; E417-K421 PolarHBondContact OE1-NZ 2.99Å; T418-K421 PolarHBondContact O-N 3.03Å
422	V	95.5	Very high	94.8	Very high	20 Å²	20	54.5 Å²	54.5	12%	0.121	25%	0.252	C	S	.	.	H	α-helix	trans	-73.2	-52.2	-179.4	179.1	0	0	0	0	111.7	V343 T354 F360 Y392 T418 R424	V343-V422 HydrophobicContact CG1-CG1 4.31Å; T354-V422 HydrophobicContact CG2-CG1 4.16Å; F360-V422 HydrophobicContact CD1-CG2 4.44Å; F360-V422 HydrophobicContact CE1-CG1 4.35Å; F360-V422 HydrophobicContact CE1-CG2 3.53Å; F360-V422 HydrophobicContact CZ-CG1 4.25Å; F360-V422 HydrophobicContact CZ-CG2 4.23Å; Y392-V422 HydrophobicContact CD1-CG2 4.22Å; Y392-V422 HydrophobicContact CE1-CG2 3.74Å; Y392-V422 HydrophobicContact CE2-CG2 4.13Å; T418-V422 HydrophobicContact CG2-CG2 4.1Å; T418-V422 WeakPolarHBondContact O-CG2 3.44Å; T418-V422 PolarHBondContact O-N 3.18Å; V422-R424 PolarHBondContact O-N 2.89Å
423	F	92.4	Very high	94.5	Very high	18 Å²	18	59.1 Å²	59.1	8%	0.079	27%	0.273	C	S	.	.			trans	-105.3	51.2	-171.1	-53.5	-65.8	0	0	0	112.6	V343 A346 K350 N352 T354 L419	V343-F423 HydrophobicContact CG1-CZ 4.1Å; A346-F423 HydrophobicContact CB-CE2 3.92Å; A346-F423 HydrophobicContact CB-CZ 4.5Å; K350-F423 HydrophobicContact CD-CD2 4.23Å; K350-F423 HydrophobicContact CD-CG 4.39Å; N352-F423 HydrophobicContact CB-CD1 3.98Å; N352-F423 WeakPolarHBondContact O-CE1 3.47Å; T354-F423 HydrophobicContact CG2-CE1 4.28Å; T354-F423 HydrophobicContact CG2-CZ 4.34Å; L419-F423 HydrophobicContact CB-CD2 4.47Å; L419-F423 HydrophobicContact CD2-CD2 4.27Å; L419-F423 HydrophobicContact CD2-CE2 3.81Å; L419-F423 WeakPolarHBondContact O-CD2 3.42Å; L419-F423 PolarHBondContact O-N 3Å
424	R	76.4	Confident	94.3	Very high	263 Å²	263	61.2 Å²	61.2	99%	0.992	27%	0.271	S	S	*	.			trans	-60.5	0	-176.7	-78.7	-175.3	178.8	176.9	4	114.1	R420 V422	R420-R424 WeakPolarHBondContact O-CG 3.37Å; V422-R424 PolarHBondContact O-N 2.89Å

Retrieved 424 of 424 residues in 1142.7 ms (Link to these results)

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