A0A087YNK0_POEFO Loading...

Leucine rich repeat containing 24

AlphaFold DB , UniProt , Accession A0A087YNK0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 459 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	36.1	Very low	38.1	Very low	246 Å²	246	153.1 Å²	153.1	100%	1.212	82%	0.818	S	S	*	*				0	131.6	0	-98.8	140.2	69.4	0	0	108.6
2	T	37.3	Very low	38.4	Very low	122 Å²	122	156.2 Å²	156.2	75%	0.748	82%	0.82	S	S	*	*			trans	-55	159.6	-177.9	42.8	0	0	0	0	115.9
3	L	34.2	Very low	39	Very low	146 Å²	146	155.1 Å²	155.1	76%	0.764	81%	0.813	S	S	*	*				170.8	99.1	122.6	-85	157	0	0	0	109.2
4	L	37.1	Very low	39.3	Very low	130 Å²	130	151.1 Å²	151.1	68%	0.681	80%	0.804	S	S	*	*				73.8	100	103.7	-73	-179.5	0	0	0	115.1
5	W	32.5	Very low	39.7	Very low	258 Å²	258	146 Å²	146	98%	0.977	79%	0.792	S	S	*	*			trans	-114.4	117.1	151.5	-93.6	41.1	0	0	0	108.1	S7	W5-S7 PolarHBondContact O-N 3.5Å
6	F	36.3	Very low	40.2	Very low	187 Å²	187	147.2 Å²	147.2	82%	0.82	80%	0.796	S	S	*	*			trans	-67.6	119.9	179.1	-93.5	-99.7	0	0	0	110.5	G8	F6-G8 PolarHBondContact O-N 3.45Å
7	S	39.8	Very low	40.7	Very low	105 Å²	105	146.3 Å²	146.3	73%	0.734	79%	0.789	S	S	*	*			trans	-76.7	115.1	160	42.4	0	0	0	0	108.7	W5 L9	W5-S7 PolarHBondContact O-N 3.5Å; S7-L9 PolarHBondContact O-N 3.07Å
8	G	41.2	Very low	41	Very low	77 Å²	77	144.1 Å²	144.1	79%	0.794	78%	0.784	S	S	*	*			trans	-66.6	102.2	172.2	0	0	0	0	0	110.3	F6 T10	F6-G8 PolarHBondContact O-N 3.45Å; G8-T10 PolarHBondContact O-N 3.01Å
9	L	39.9	Very low	41.3	Very low	153 Å²	153	145.4 Å²	145.4	80%	0.801	79%	0.789	S	S	*	*			trans	-82.9	96.1	166.4	-142.3	92.4	0	0	0	107.4	S7 L11	S7-L9 PolarHBondContact O-N 3.07Å; L9-L11 PolarHBondContact O-N 3.34Å
10	T	42.3	Very low	41.5	Very low	122 Å²	122	149.7 Å²	149.7	75%	0.748	79%	0.793	S	S	*	*			trans	-66	101.5	166.8	44.3	0	0	0	0	108.3	G8 F12	G8-T10 PolarHBondContact O-N 3.01Å; T10-F12 PolarHBondContact O-N 2.92Å
11	L	42.4	Very low	42.1	Very low	138 Å²	138	145.5 Å²	145.5	72%	0.723	78%	0.776	S	S	*	*			trans	-68.7	95.6	171.1	-133.7	131.4	0	0	0	107.4	L9 I13	L9-L11 PolarHBondContact O-N 3.34Å; L11-I13 HydrophobicContact CD2-CG1 3.93Å; L11-I13 PolarHBondContact O-N 3.03Å
12	F	41.5	Very low	43.3	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.833	76%	0.763	S	S	*	*			trans	-65.7	93.1	161.9	-99.8	-85.3	0	0	0	106.7	T10 S14	T10-F12 PolarHBondContact O-N 2.92Å; F12-S14 PolarHBondContact O-N 2.9Å
13	I	46.8	Very low	45.2	Very low	142 Å²	142	138.2 Å²	138.2	73%	0.728	75%	0.746	S	S	*	*			trans	-65.3	95.6	159.4	-61.8	173.1	0	0	0	104.2	L11 A15	L11-I13 HydrophobicContact CD2-CG1 3.93Å; L11-I13 PolarHBondContact O-N 3.03Å; I13-A15 PolarHBondContact O-N 2.87Å
14	S	42.8	Very low	47.8	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	72%	0.722	S	S	*	*			trans	-58.4	98.4	162.7	41.9	0	0	0	0	106.1	F12 L16	F12-S14 PolarHBondContact O-N 2.9Å; S14-L16 VanDerWaalsContact C-N 3.35Å; S14-L16 PolarHBondContact O-N 2.73Å
15	A	44.9	Very low	50.5	Low	75 Å²	75	127.4 Å²	127.4	62%	0.62	69%	0.692	S	S	*	*			trans	-52.1	110.7	159.3	0	0	0	0	0	105.5	I13 I17	I13-A15 PolarHBondContact O-N 2.87Å; A15-I17 HydrophobicContact CB-CG1 4.41Å; A15-I17 PolarHBondContact O-N 2.92Å
16	L	48.2	Very low	53.2	Low	165 Å²	165	126.4 Å²	126.4	86%	0.864	69%	0.69	S	S	*	*			trans	-61.3	79.9	161	-82.3	149.3	0	0	0	105.8	S14 P18	S14-L16 VanDerWaalsContact C-N 3.35Å; S14-L16 PolarHBondContact O-N 2.73Å; L16-P18 WeakPolarHBondContact O-CD 3.32Å
17	I	48.2	Very low	55.8	Low	132 Å²	132	120 Å²	120	68%	0.677	68%	0.677	S	S	*	*			trans	-60.1	115.3	160.6	-59.3	169.8	0	0	0	102.6	A15 L19	A15-I17 HydrophobicContact CB-CG1 4.41Å; A15-I17 PolarHBondContact O-N 2.92Å; I17-L19 PolarHBondContact O-N 2.78Å; I17-L19 VanDerWaalsContact O-N 3.07Å
18	P	46.6	Very low	58.4	Low	106 Å²	106	115.8 Å²	115.8	69%	0.688	65%	0.647	S	S	*	*			trans	-54.7	126.2	171.6	-10.3	23	0	0	0	105	L16 R20	L16-P18 WeakPolarHBondContact O-CD 3.32Å; P18-R20 PolarHBondContact O-N 3.07Å
19	L	45.7	Very low	61	Low	169 Å²	169	120.7 Å²	120.7	89%	0.885	64%	0.641	S	S	*	*			trans	-45.8	109.5	168.9	-104.1	75.8	0	0	0	105.8	I17 S21	I17-L19 PolarHBondContact O-N 2.78Å; I17-L19 VanDerWaalsContact O-N 3.07Å; L19-S21 VanDerWaalsContact C-N 3.34Å; L19-S21 PolarHBondContact O-N 2.96Å
20	R	46	Very low	63.5	Low	232 Å²	232	115.1 Å²	115.1	88%	0.875	62%	0.615	S	S	*	*			trans	-57	110.6	166.2	-80.4	-177.7	173.1	-179.4	-2.1	103.5	P18 L22	P18-R20 PolarHBondContact O-N 3.07Å; R20-L22 PolarHBondContact O-N 3.46Å
21	S	54.6	Low	65.9	Low	62 Å²	62	115.2 Å²	115.2	43%	0.434	60%	0.602	S	S	.	*			trans	-50.8	112.7	173.1	53.5	0	0	0	0	106.5	L19 G23 C24	L19-S21 VanDerWaalsContact C-N 3.34Å; L19-S21 PolarHBondContact O-N 2.96Å; S21-G23 PolarHBondContact O-N 2.97Å; S21-C24 PolarHBondContact O-N 3Å; S21-C24 VanDerWaalsContact OG-CB 3.26Å; S21-C24 WeakPolarHBondContact OG-CB 3.31Å
22	L	60.1	Low	68.3	Low	177 Å²	177	114.2 Å²	114.2	93%	0.927	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	108.1	177.2	-134.3	79.2	0	0	0	106.2	R20	R20-L22 PolarHBondContact O-N 3.46Å
23	G	77.6	Confident	70.9	Confident	38 Å²	38	107.4 Å²	107.4	39%	0.392	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	85	52.1	-177.6	0	0	0	0	0	115.4	S21 G48 P50	S21-G23 PolarHBondContact O-N 2.97Å; G23-G48 CarbonylContact C-O 3.56Å; G23-G48 WeakPolarHBondContact CA-O 3.07Å; G23-P50 WeakPolarHBondContact O-CD 3.24Å; G23-P50 VanDerWaalsContact O-CG 3.26Å; G23-P50 WeakPolarHBondContact O-CG 3.28Å
24	C	90.3	Very high	73.2	Confident	39 Å²	39	101.8 Å²	101.8	26%	0.264	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-95.8	132.1	154.8	-171.6	0	0	0	0	108.9	S21 C28 C30	S21-C24 PolarHBondContact O-N 3Å; S21-C24 VanDerWaalsContact OG-CB 3.26Å; S21-C24 WeakPolarHBondContact OG-CB 3.31Å; C24-C28 PolarHBondContact SG-O 3.16Å; C24-C30 WeakPolarHBondContact CA-SG 3.37Å; C24-C30 HydrophobicContact CB-CB 3.71Å; C24-C30 WeakPolarHBondContact CB-SG 3.08Å; C24-C30 WeakPolarHBondContact SG-CB 3.26Å; C24-C30 PolarHBondContact SG-N 2.89Å; C24-C30 CovalentContact SG-SG 2.03Å; C24-C30 PolarHBondContact SG-SG 2.91Å
25	P	92.5	Very high	75.8	Confident	10 Å²	10	97.1 Å²	97.1	7%	0.065	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-56.1	148.7	175.5	-27.6	36.2	0	0	0	113.5	G27 C28 V35 P46 A49	P25-G27 PolarHBondContact O-N 2.84Å; P25-C28 HydrophobicContact CB-CB 4.07Å; P25-C28 PolarHBondContact O-N 3.49Å; P25-C28 VanDerWaalsContact O-N 3.16Å; P25-V35 HydrophobicContact CG-CG1 4.24Å; P25-P46 HydrophobicContact CB-CB 3.55Å; P25-P46 HydrophobicContact CB-CG 3.96Å; P25-P46 HydrophobicContact CG-CB 3.76Å; P25-P46 HydrophobicContact CG-CG 3.91Å; P25-A49 HydrophobicContact CG-CB 4.24Å
26	Y	89.6	Confident	78.3	Confident	237 Å²	237	97 Å²	97	93%	0.929	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	131.6	178.4	-175.6	-94.2	0	0	0	111.2	C28	Y26-C28 PolarHBondContact O-N 3.29Å
27	G	90.1	Very high	80.6	Confident	52 Å²	52	89.1 Å²	89.1	54%	0.536	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-15.7	-178.7	0	0	0	0	0	114.8	P25 L40	P25-G27 PolarHBondContact O-N 2.84Å; G27-L40 VanDerWaalsContact O-CD1 3.24Å; G27-L40 WeakPolarHBondContact O-CD1 2.98Å
28	C	95.3	Very high	82.9	Confident	16 Å²	16	83.8 Å²	83.8	11%	0.108	44%	0.442	C	S	.	.			trans	-86.8	160.5	179.2	-58.9	0	0	0	0	112.7	C24 P25 Y26 V35 E36 C37	C24-C28 PolarHBondContact SG-O 3.16Å; P25-C28 HydrophobicContact CB-CB 4.07Å; P25-C28 PolarHBondContact O-N 3.49Å; P25-C28 VanDerWaalsContact O-N 3.16Å; Y26-C28 PolarHBondContact O-N 3.29Å; C28-V35 HydrophobicContact CB-CG1 4.26Å; C28-E36 CarbonylContact C-O 3.59Å; C28-E36 VanDerWaalsContact CA-O 3.31Å; C28-E36 WeakPolarHBondContact CA-O 3.16Å; C28-E36 WeakPolarHBondContact CB-O 2.99Å; C28-C37 HydrophobicContact CB-CB 4.14Å; C28-C37 WeakPolarHBondContact CB-SG 3.43Å; C28-C37 WeakPolarHBondContact SG-CB 3.05Å; C28-C37 CovalentContact SG-SG 2.02Å; C28-C37 PolarHBondContact SG-SG 3.03Å
29	R	94.9	Very high	85.3	Confident	180 Å²	180	82.8 Å²	82.8	68%	0.679	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.7	171.6	-71.3	179	161.4	-177.7	-4.1	109.6	E36	R29-E36 HydrophobicContact CB-CB 4.3Å; R29-E36 PolarHBondContact N-O 3.38Å; R29-E36 PolarHBondContact O-N 3.15Å
30	C	94.1	Very high	87.7	Confident	37 Å²	37	78.7 Å²	78.7	25%	0.25	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.9	178.3	-57.1	0	0	0	0	110.2	C24 T34	C24-C30 WeakPolarHBondContact CA-SG 3.37Å; C24-C30 HydrophobicContact CB-CB 3.71Å; C24-C30 WeakPolarHBondContact CB-SG 3.08Å; C24-C30 WeakPolarHBondContact SG-CB 3.26Å; C24-C30 PolarHBondContact SG-N 2.89Å; C24-C30 CovalentContact SG-SG 2.03Å; C24-C30 PolarHBondContact SG-SG 2.91Å; C30-T34 WeakPolarHBondContact CA-O 3.26Å
31	Y	92.6	Very high	90	Very high	123 Å²	123	70.1 Å²	70.1	48%	0.482	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	140.1	177	55.2	-91.6	0	0	0	110.2	L33 T34 E36	Y31-L33 PolarHBondContact O-N 3.04Å; Y31-L33 VanDerWaalsContact O-N 3.09Å; Y31-T34 HydrophobicContact CE1-CG2 4.37Å; Y31-T34 HydrophobicContact CE2-CG2 4.02Å; Y31-T34 PolarHBondContact N-O 2.86Å; Y31-T34 WeakPolarHBondContact O-CB 3.3Å; Y31-T34 PolarHBondContact O-N 3.4Å; Y31-E36 HydrophobicContact CE1-CB 4.44Å
32	S	91.8	Very high	92	Very high	118 Å²	118	68.6 Å²	68.6	83%	0.825	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	-117.2	-174	-171	0	0	0	0	111
33	L	95.4	Very high	93.6	Very high	46 Å²	46	67.5 Å²	67.5	24%	0.241	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	20.1	177.6	-53.4	178.8	0	0	0	112.2	Y31 I52 T53 E54 T55	Y31-L33 PolarHBondContact O-N 3.04Å; Y31-L33 VanDerWaalsContact O-N 3.09Å; L33-I52 HydrophobicContact CD2-CB 4.46Å; L33-I52 HydrophobicContact CD2-CD1 3.83Å; L33-I52 HydrophobicContact CD2-CG1 3.74Å; L33-I52 HydrophobicContact CD2-CG2 4.14Å; L33-T53 WeakPolarHBondContact O-CG2 3.31Å; L33-E54 HydrophobicContact CB-CB 3.98Å; L33-E54 HydrophobicContact CB-CG 3.94Å; L33-E54 HydrophobicContact CD1-CG 3.78Å; L33-E54 WeakPolarHBondContact CD1-OE1 3.32Å; L33-E54 WeakPolarHBondContact CD1-OE2 3.04Å; L33-E54 HydrophobicContact CG-CG 4.44Å; L33-E54 PolarHBondContact O-N 3.48Å; L33-T55 PolarHBondContact O-N 2.74Å; L33-T55 VanDerWaalsContact O-N 3.08Å
34	T	96.8	Very high	94.4	Very high	24 Å²	24	70.7 Å²	70.7	15%	0.147	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.5	-175.5	-55.9	0	0	0	0	111.3	C30 Y31 T55 F57	C30-T34 WeakPolarHBondContact CA-O 3.26Å; Y31-T34 HydrophobicContact CE1-CG2 4.37Å; Y31-T34 HydrophobicContact CE2-CG2 4.02Å; Y31-T34 PolarHBondContact N-O 2.86Å; Y31-T34 WeakPolarHBondContact O-CB 3.3Å; Y31-T34 PolarHBondContact O-N 3.4Å; T34-T55 WeakPolarHBondContact CA-O 3.46Å; T34-T55 HydrophobicContact CG2-CG2 4.18Å; T34-F57 HydrophobicContact CG2-CD2 3.82Å; T34-F57 HydrophobicContact CG2-CE2 3.75Å
35	V	96.7	Very high	94.6	Very high	2 Å²	2	69 Å²	69	1%	0.012	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	116.6	170.9	178.3	0	0	0	0	108.7	P25 C28 C37 A49 T53 T55 I56 F57	P25-V35 HydrophobicContact CG-CG1 4.24Å; C28-V35 HydrophobicContact CB-CG1 4.26Å; V35-C37 VanDerWaalsContact CG1-SG 3.6Å; V35-A49 HydrophobicContact CG2-CB 4.29Å; V35-T53 HydrophobicContact CB-CG2 4.24Å; V35-T53 HydrophobicContact CG2-CG2 3.65Å; V35-T55 PolarHBondContact N-O 2.96Å; V35-I56 HydrophobicContact CB-CG1 4.26Å; V35-I56 WeakPolarHBondContact O-CA 3.08Å; V35-F57 PolarHBondContact O-N 3.38Å
36	E	97.2	Very high	94.5	Very high	72 Å²	72	70 Å²	70	34%	0.336	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	114.3	-178.1	-174.6	178.6	-147.9	0	0	111	C28 R29 Y31 F57	C28-E36 CarbonylContact C-O 3.59Å; C28-E36 VanDerWaalsContact CA-O 3.31Å; C28-E36 WeakPolarHBondContact CA-O 3.16Å; C28-E36 WeakPolarHBondContact CB-O 2.99Å; R29-E36 HydrophobicContact CB-CB 4.3Å; R29-E36 PolarHBondContact N-O 3.38Å; R29-E36 PolarHBondContact O-N 3.15Å; Y31-E36 HydrophobicContact CE1-CB 4.44Å; E36-F57 HydrophobicContact CG-CB 4.32Å
37	C	96.7	Very high	94.4	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.351	C	S	.	.			trans	-132.2	21.8	-173.9	-63	0	0	0	0	112.2	C28 V35 L40 I42 F57 L58 N61	C28-C37 HydrophobicContact CB-CB 4.14Å; C28-C37 WeakPolarHBondContact CB-SG 3.43Å; C28-C37 WeakPolarHBondContact SG-CB 3.05Å; C28-C37 CovalentContact SG-SG 2.02Å; C28-C37 PolarHBondContact SG-SG 3.03Å; V35-C37 VanDerWaalsContact CG1-SG 3.6Å; C37-L40 HydrophobicContact CB-CD1 4.31Å; C37-I42 HydrophobicContact CB-CD1 3.75Å; C37-F57 CarbonylContact C-O 2.99Å; C37-F57 VanDerWaalsContact CA-O 3.3Å; C37-F57 WeakPolarHBondContact CA-O 3.34Å; C37-F57 WeakPolarHBondContact CB-O 3.4Å; C37-F57 PolarHBondContact N-O 3.36Å; C37-L58 HydrophobicContact CB-CD2 3.5Å; C37-L58 HydrophobicContact CB-CG 4.31Å; C37-N61 PolarHBondContact O-ND2 3.41Å
38	G	95.9	Very high	94.1	Very high	19 Å²	19	62.7 Å²	62.7	20%	0.196	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	145.8	-176.1	0	0	0	0	0	113.6	L40 F57 Q59	G38-L40 VanDerWaalsContact C-N 3.31Å; G38-L40 PolarHBondContact O-N 3.46Å; G38-F57 PolarHBondContact N-O 3.28Å; G38-Q59 VanDerWaalsContact CA-O 3.26Å; G38-Q59 WeakPolarHBondContact CA-O 3.26Å
39	S	96.9	Very high	93.8	Very high	85 Å²	85	62.8 Å²	62.8	59%	0.594	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	32.1	173.8	-47.3	0	0	0	0	115.8	Q59 D60	S39-Q59 PolarHBondContact N-O 3.45Å; S39-D60 VanDerWaalsContact CA-O 3.28Å; S39-D60 WeakPolarHBondContact CA-O 2.86Å
40	L	96.3	Very high	93.7	Very high	84 Å²	84	56 Å²	56	44%	0.44	32%	0.324	S	S	.	.	S	Bend	trans	-102.6	-1.2	-177.3	-66.9	179.1	0	0	0	113.8	G27 C37 G38 I42 N61	G27-L40 VanDerWaalsContact O-CD1 3.24Å; G27-L40 WeakPolarHBondContact O-CD1 2.98Å; C37-L40 HydrophobicContact CB-CD1 4.31Å; G38-L40 VanDerWaalsContact C-N 3.31Å; G38-L40 PolarHBondContact O-N 3.46Å; L40-I42 VanDerWaalsContact C-N 3.26Å; L40-I42 HydrophobicContact CB-CD1 3.89Å; L40-I42 HydrophobicContact CB-CG1 3.84Å; L40-I42 HydrophobicContact CD1-CD1 4Å; L40-I42 PolarHBondContact O-N 3.36Å; L40-N61 PolarHBondContact N-OD1 3Å
41	G	95.8	Very high	93.5	Very high	51 Å²	51	58 Å²	58	53%	0.526	34%	0.339	S	S	.	.			trans	68.9	26.1	-175.9	0	0	0	0	0	113.2	N61	G41-N61 PolarHBondContact N-OD1 3.29Å
42	I	95	Very high	93.5	Very high	30 Å²	30	57 Å²	57	15%	0.154	34%	0.341	C	S	.	.			trans	-67.3	134.8	-179.7	-68.6	168.9	0	0	0	109.8	C37 L40 E44 L58 N61 A62 I63	C37-I42 HydrophobicContact CB-CD1 3.75Å; L40-I42 VanDerWaalsContact C-N 3.26Å; L40-I42 HydrophobicContact CB-CD1 3.89Å; L40-I42 HydrophobicContact CB-CG1 3.84Å; L40-I42 HydrophobicContact CD1-CD1 4Å; L40-I42 PolarHBondContact O-N 3.36Å; I42-E44 WeakPolarHBondContact CG2-O 3.26Å; I42-L58 HydrophobicContact CD1-CD2 4.31Å; I42-N61 HydrophobicContact CB-CB 4.3Å; I42-N61 PolarHBondContact N-OD1 2.85Å; I42-A62 CarbonylContact O-C 3.23Å; I42-A62 VanDerWaalsContact O-C 3.23Å; I42-A62 WeakPolarHBondContact O-CA 3.45Å; I42-A62 PolarHBondContact O-N 3.47Å; I42-I63 HydrophobicContact CG2-CG1 4.37Å; I42-I63 PolarHBondContact O-N 3.05Å
43	K	94.9	Very high	93.7	Very high	155 Å²	155	51.5 Å²	51.5	67%	0.674	30%	0.302	S	S	*	.			trans	-99.5	-17.7	-179.4	-63.4	-175.2	178.8	-176.3	0	114.3	A62 I63	K43-A62 HydrophobicContact CG-CB 4.37Å; K43-I63 WeakPolarHBondContact O-CA 3.47Å
44	E	93.9	Very high	93.8	Very high	104 Å²	104	52.7 Å²	52.7	49%	0.486	31%	0.306	S	S	.	.	S	Bend	trans	-144.1	149.4	-177.4	-61.8	-171	-173.9	0	0	110.2	I42 R67	I42-E44 WeakPolarHBondContact CG2-O 3.26Å; E44-R67 IonicContact OE1-NH1 3.9Å; E44-R67 IonicContact OE2-CZ 3.95Å; E44-R67 VanDerWaalsContact OE2-CZ 3.26Å; E44-R67 IonicContact OE2-NH1 2.93Å; E44-R67 PolarHBondContact OE2-NH1 3.32Å; E44-R67 IonicContact OE2-NH2 3.76Å; E44-R67 PolarHBondContact OE2-NH2 2.96Å
45	I	94.3	Very high	93.9	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.026	31%	0.305	C	S	.	.			trans	-61.1	126	176.7	-62.2	176.3	0	0	0	109.5	Q47 L58 I63 I66 D70 L71	I45-Q47 PolarHBondContact O-N 2.82Å; I45-L58 HydrophobicContact CG1-CD1 4.24Å; I45-L58 HydrophobicContact CG2-CD1 4.17Å; I45-I63 HydrophobicContact CG1-CD1 4.19Å; I45-I63 HydrophobicContact CG1-CG2 4.45Å; I45-I66 HydrophobicContact CD1-CG1 4.22Å; I45-I66 HydrophobicContact CD1-CG2 3.99Å; I45-D70 HydrophobicContact CB-CB 3.97Å; I45-D70 HydrophobicContact CD1-CB 3.95Å; I45-D70 HydrophobicContact CG1-CB 4.46Å; I45-D70 HydrophobicContact CG2-CB 4.25Å; I45-L71 HydrophobicContact CD1-CD2 4.27Å; I45-L71 HydrophobicContact CG2-CD2 4.27Å
46	P	90.5	Very high	93.9	Very high	30 Å²	30	52.6 Å²	52.6	20%	0.195	31%	0.306	C	S	.	.			trans	-71.8	124.8	-174.2	24.3	-31.3	0	0	0	113.1	P25 G48 L58	P25-P46 HydrophobicContact CB-CB 3.55Å; P25-P46 HydrophobicContact CB-CG 3.96Å; P25-P46 HydrophobicContact CG-CB 3.76Å; P25-P46 HydrophobicContact CG-CG 3.91Å; P46-G48 PolarHBondContact O-N 2.02Å; P46-G48 VanDerWaalsContact O-N 3.15Å; P46-L58 HydrophobicContact CG-CD2 4.29Å
47	Q	86.5	Confident	94	Very high	100 Å²	100	51.7 Å²	51.7	47%	0.467	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-7.2	-178.9	-65.1	-67	-37.1	0	0	114.9	I45 D70	I45-Q47 PolarHBondContact O-N 2.82Å; Q47-D70 PolarHBondContact NE2-OD1 2.91Å
48	G	84.2	Confident	94	Very high	35 Å²	35	51.7 Å²	51.7	36%	0.361	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-2	-171.7	0	0	0	0	0	115.3	G23 P46	G23-G48 CarbonylContact C-O 3.56Å; G23-G48 WeakPolarHBondContact CA-O 3.07Å; P46-G48 PolarHBondContact O-N 2.02Å; P46-G48 VanDerWaalsContact O-N 3.15Å
49	A	90.3	Very high	94.1	Very high	18 Å²	18	52.3 Å²	52.3	15%	0.149	30%	0.298	C	S	.	.	S	Bend	trans	-69.1	143	-174.5	0	0	0	0	0	112.7	P25 V35 L74	P25-A49 HydrophobicContact CG-CB 4.24Å; V35-A49 HydrophobicContact CG2-CB 4.29Å; A49-L74 HydrophobicContact CB-CD2 4Å
50	P	91	Very high	94.2	Very high	37 Å²	37	51.8 Å²	51.8	24%	0.24	29%	0.289	C	S	.	.			trans	-62.6	142.2	178.5	-20.9	33.4	0	0	0	111.8	G23 I52 T53 L74	G23-P50 WeakPolarHBondContact O-CD 3.24Å; G23-P50 VanDerWaalsContact O-CG 3.26Å; G23-P50 WeakPolarHBondContact O-CG 3.28Å; P50-I52 HydrophobicContact CB-CG2 4.05Å; P50-I52 PolarHBondContact O-N 2.78Å; P50-I52 VanDerWaalsContact O-N 3.15Å; P50-T53 WeakPolarHBondContact CD-OG1 3.25Å; P50-T53 VanDerWaalsContact O-CB 3.25Å; P50-T53 WeakPolarHBondContact O-CB 3.26Å; P50-T53 PolarHBondContact O-N 2.77Å; P50-T53 PolarHBondContact O-OG1 3.02Å; P50-L74 VanDerWaalsContact O-CD2 3.31Å; P50-L74 WeakPolarHBondContact O-CD2 3.35Å
51	S	91.6	Very high	94.3	Very high	80 Å²	80	48.4 Å²	48.4	56%	0.559	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-20	-179.5	57.4	0	0	0	0	114.4	T53	S51-T53 VanDerWaalsContact C-N 3.29Å
52	I	92.9	Very high	94.4	Very high	102 Å²	102	47.7 Å²	47.7	52%	0.523	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-4.6	176.1	-166.3	177.8	0	0	0	112.7	L33 P50 E54	L33-I52 HydrophobicContact CD2-CB 4.46Å; L33-I52 HydrophobicContact CD2-CD1 3.83Å; L33-I52 HydrophobicContact CD2-CG1 3.74Å; L33-I52 HydrophobicContact CD2-CG2 4.14Å; P50-I52 HydrophobicContact CB-CG2 4.05Å; P50-I52 PolarHBondContact O-N 2.78Å; P50-I52 VanDerWaalsContact O-N 3.15Å; I52-E54 PolarHBondContact O-N 2.03Å
53	T	95.4	Very high	94.5	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.018	25%	0.253	C	S	.	.			trans	-58.6	129.2	-178.4	-55.2	0	0	0	0	111.2	L33 V35 P50 S51 T55 I56 S76	L33-T53 WeakPolarHBondContact O-CG2 3.31Å; V35-T53 HydrophobicContact CB-CG2 4.24Å; V35-T53 HydrophobicContact CG2-CG2 3.65Å; P50-T53 WeakPolarHBondContact CD-OG1 3.25Å; P50-T53 VanDerWaalsContact O-CB 3.25Å; P50-T53 WeakPolarHBondContact O-CB 3.26Å; P50-T53 PolarHBondContact O-N 2.77Å; P50-T53 PolarHBondContact O-OG1 3.02Å; S51-T53 VanDerWaalsContact C-N 3.29Å; T53-T55 VanDerWaalsContact CG2-O 3.32Å; T53-T55 WeakPolarHBondContact CG2-O 3.31Å; T53-I56 HydrophobicContact CG2-CD1 4.04Å; T53-I56 HydrophobicContact CG2-CG1 3.53Å; T53-S76 CarbonylContact O-C 3.54Å
54	E	97.4	Very high	94.7	Very high	71 Å²	71	42.4 Å²	42.4	33%	0.332	24%	0.242	S	C	.	.			trans	-102.7	-27.8	178	-67.6	-175.4	170	0	0	112.3	L33 I52 S76 H78 Y79	L33-E54 HydrophobicContact CB-CB 3.98Å; L33-E54 HydrophobicContact CB-CG 3.94Å; L33-E54 HydrophobicContact CD1-CG 3.78Å; L33-E54 WeakPolarHBondContact CD1-OE1 3.32Å; L33-E54 WeakPolarHBondContact CD1-OE2 3.04Å; L33-E54 HydrophobicContact CG-CG 4.44Å; L33-E54 PolarHBondContact O-N 3.48Å; I52-E54 PolarHBondContact O-N 2.03Å; E54-S76 WeakPolarHBondContact CA-O 3.24Å; E54-H78 PolarHBondContact O-N 3.32Å; E54-H78 IonicContact OE1-CE1 2.96Å; E54-Y79 PolarHBondContact O-N 2.93Å
55	T	98.3	Very high	94.8	Very high	20 Å²	20	41.4 Å²	41.4	12%	0.123	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	129.6	-176.9	-57.3	0	0	0	0	110.9	L33 T34 V35 T53 F57 Y79 Y81	L33-T55 PolarHBondContact O-N 2.74Å; L33-T55 VanDerWaalsContact O-N 3.08Å; T34-T55 WeakPolarHBondContact CA-O 3.46Å; T34-T55 HydrophobicContact CG2-CG2 4.18Å; V35-T55 PolarHBondContact N-O 2.96Å; T53-T55 VanDerWaalsContact CG2-O 3.32Å; T53-T55 WeakPolarHBondContact CG2-O 3.31Å; T55-F57 HydrophobicContact CG2-CD2 3.95Å; T55-F57 HydrophobicContact CG2-CE2 3.39Å; T55-F57 HydrophobicContact CG2-CZ 3.81Å; T55-Y79 WeakPolarHBondContact CA-O 3.25Å; T55-Y79 WeakPolarHBondContact OG1-CD2 3.39Å; T55-Y81 HydrophobicContact CG2-CE2 4.34Å
56	I	97.5	Very high	94.9	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.2	175.1	-64	-179.5	0	0	0	110.2	V35 T53 L58 L74 L77 Y79 L80 Y81	V35-I56 HydrophobicContact CB-CG1 4.26Å; V35-I56 WeakPolarHBondContact O-CA 3.08Å; T53-I56 HydrophobicContact CG2-CD1 4.04Å; T53-I56 HydrophobicContact CG2-CG1 3.53Å; I56-L58 HydrophobicContact CG2-CD1 3.5Å; I56-L58 VanDerWaalsContact CG2-CD1 3.5Å; I56-L58 HydrophobicContact CG2-CG 3.61Å; I56-L74 HydrophobicContact CD1-CD1 3.45Å; I56-L74 VanDerWaalsContact CD1-CD1 3.45Å; I56-L74 HydrophobicContact CD1-CD2 4.47Å; I56-L77 HydrophobicContact CB-CD1 4.25Å; I56-L77 HydrophobicContact CD1-CD1 3.77Å; I56-L77 HydrophobicContact CG1-CD1 3.66Å; I56-Y79 PolarHBondContact N-O 3.38Å; I56-L80 HydrophobicContact CB-CD1 4Å; I56-L80 HydrophobicContact CG2-CD1 4.1Å; I56-Y81 PolarHBondContact O-N 2.9Å
57	F	98.3	Very high	95.1	Very high	53 Å²	53	41.5 Å²	41.5	23%	0.232	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	108.7	173.2	-68.5	-79.4	0	0	0	109.9	T34 V35 E36 C37 G38 T55 Y81	T34-F57 HydrophobicContact CG2-CD2 3.82Å; T34-F57 HydrophobicContact CG2-CE2 3.75Å; V35-F57 PolarHBondContact O-N 3.38Å; E36-F57 HydrophobicContact CG-CB 4.32Å; C37-F57 CarbonylContact C-O 2.99Å; C37-F57 VanDerWaalsContact CA-O 3.3Å; C37-F57 WeakPolarHBondContact CA-O 3.34Å; C37-F57 WeakPolarHBondContact CB-O 3.4Å; C37-F57 PolarHBondContact N-O 3.36Å; G38-F57 PolarHBondContact N-O 3.28Å; T55-F57 HydrophobicContact CG2-CD2 3.95Å; T55-F57 HydrophobicContact CG2-CE2 3.39Å; T55-F57 HydrophobicContact CG2-CZ 3.81Å; F57-Y81 AromaticContact CD1-CD2 3.4Å; F57-Y81 HydrophobicContact CD1-CD2 3.4Å; F57-Y81 HydrophobicContact CD1-CE2 4.15Å; F57-Y81 AromaticContact CD1-CG 3.92Å; F57-Y81 HydrophobicContact CD1-CG 3.92Å; F57-Y81 AromaticContact CE1-CD2 3.22Å; F57-Y81 HydrophobicContact CE1-CD2 3.22Å; F57-Y81 AromaticContact CE1-CE2 3.48Å; F57-Y81 HydrophobicContact CE1-CE2 3.48Å; F57-Y81 VanDerWaalsContact CE1-CE2 3.48Å; F57-Y81 AromaticContact CE1-CG 4Å; F57-Y81 HydrophobicContact CE1-CG 4Å; F57-Y81 HydrophobicContact CG-CD2 4.2Å; F57-Y81 AromaticContact CZ-CD2 3.91Å; F57-Y81 HydrophobicContact CZ-CD2 3.91Å; F57-Y81 AromaticContact CZ-CE2 3.86Å; F57-Y81 HydrophobicContact CZ-CE2 3.86Å
58	L	97.9	Very high	95.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.			trans	-124.2	19.7	178.9	-76.6	163.6	0	0	0	111.9	C37 I42 I45 P46 I56 N61 I63 L80 Y81 L82 N85	C37-L58 HydrophobicContact CB-CD2 3.5Å; C37-L58 HydrophobicContact CB-CG 4.31Å; I42-L58 HydrophobicContact CD1-CD2 4.31Å; I45-L58 HydrophobicContact CG1-CD1 4.24Å; I45-L58 HydrophobicContact CG2-CD1 4.17Å; P46-L58 HydrophobicContact CG-CD2 4.29Å; I56-L58 HydrophobicContact CG2-CD1 3.5Å; I56-L58 VanDerWaalsContact CG2-CD1 3.5Å; I56-L58 HydrophobicContact CG2-CG 3.61Å; L58-N61 PolarHBondContact O-ND2 2.96Å; L58-I63 HydrophobicContact CB-CD1 4.16Å; L58-I63 HydrophobicContact CD1-CD1 4.4Å; L58-I63 HydrophobicContact CD2-CD1 4.26Å; L58-L80 HydrophobicContact CD1-CD1 4.47Å; L58-Y81 CarbonylContact C-O 3.4Å; L58-Y81 WeakPolarHBondContact CA-O 3.31Å; L58-Y81 WeakPolarHBondContact CB-O 3.4Å; L58-Y81 PolarHBondContact N-O 3.31Å; L58-L82 HydrophobicContact CB-CD2 3.62Å; L58-L82 HydrophobicContact CB-CG 4.43Å; L58-L82 HydrophobicContact CD1-CD2 3.87Å; L58-L82 HydrophobicContact CG-CD2 4.4Å; L58-N85 PolarHBondContact O-ND2 3.43Å
59	Q	98.3	Very high	95.7	Very high	31 Å²	31	44.9 Å²	44.9	15%	0.145	24%	0.242	C	C	.	.			trans	-64.5	157.3	-179.5	69.9	-82.8	6	0	0	114	G38 S39 N61 Y81 Q83	G38-Q59 VanDerWaalsContact CA-O 3.26Å; G38-Q59 WeakPolarHBondContact CA-O 3.26Å; S39-Q59 PolarHBondContact N-O 3.45Å; Q59-N61 VanDerWaalsContact C-N 3.32Å; Q59-N61 PolarHBondContact O-N 3.48Å; Q59-N61 PolarHBondContact O-ND2 3.32Å; Q59-N61 VanDerWaalsContact O-ND2 3.15Å; Q59-Y81 PolarHBondContact N-O 3.15Å; Q59-Q83 VanDerWaalsContact CA-O 3.24Å; Q59-Q83 WeakPolarHBondContact CA-O 3.18Å; Q59-Q83 HydrophobicContact CB-CG 3.74Å
60	D	98.4	Very high	95.9	Very high	74 Å²	74	44.3 Å²	44.3	40%	0.396	24%	0.237	S	C	.	.	S	Bend	trans	56.6	43.8	173.5	-52	-58.7	0	0	0	112.4	S39 Q83 N84	S39-D60 VanDerWaalsContact CA-O 3.28Å; S39-D60 WeakPolarHBondContact CA-O 2.86Å; D60-Q83 PolarHBondContact N-O 3.49Å; D60-N84 VanDerWaalsContact CA-O 3.26Å; D60-N84 WeakPolarHBondContact CA-O 3.32Å; D60-N84 PolarHBondContact N-O 3.43Å; D60-N84 WeakPolarHBondContact OD1-CB 3.37Å; D60-N84 PolarHBondContact OD1-ND2 2.97Å
61	N	98.2	Very high	96	Very high	14 Å²	14	42.6 Å²	42.6	8%	0.075	23%	0.226	C	C	.	.	S	Bend	trans	-117.9	-166.5	178.6	-81.1	-63.9	0	0	0	110.6	C37 L40 G41 I42 L58 Q59 I63 N84 N85	C37-N61 PolarHBondContact O-ND2 3.41Å; L40-N61 PolarHBondContact N-OD1 3Å; G41-N61 PolarHBondContact N-OD1 3.29Å; I42-N61 HydrophobicContact CB-CB 4.3Å; I42-N61 PolarHBondContact N-OD1 2.85Å; L58-N61 PolarHBondContact O-ND2 2.96Å; Q59-N61 VanDerWaalsContact C-N 3.32Å; Q59-N61 PolarHBondContact O-N 3.48Å; Q59-N61 PolarHBondContact O-ND2 3.32Å; Q59-N61 VanDerWaalsContact O-ND2 3.15Å; N61-I63 HydrophobicContact CB-CG1 4.36Å; N61-N84 PolarHBondContact N-O 3.42Å; N61-N85 VanDerWaalsContact CA-OD1 3.31Å; N61-N85 WeakPolarHBondContact CA-OD1 3.4Å; N61-N85 WeakPolarHBondContact CB-OD1 3.38Å; N61-N85 PolarHBondContact O-OD1 3.3Å
62	A	97.8	Very high	96	Very high	35 Å²	35	42.1 Å²	42.1	29%	0.289	22%	0.217	S	C	.	.			trans	-120	33.2	-178.1	0	0	0	0	0	111.9	I42 K43 N85	I42-A62 CarbonylContact O-C 3.23Å; I42-A62 VanDerWaalsContact O-C 3.23Å; I42-A62 WeakPolarHBondContact O-CA 3.45Å; I42-A62 PolarHBondContact O-N 3.47Å; K43-A62 HydrophobicContact CG-CB 4.37Å; A62-N85 PolarHBondContact N-OD1 3.27Å
63	I	97.9	Very high	96	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.226	C	C	.	.			trans	-70.9	130.7	-179.8	-57.6	170.2	0	0	0	109.1	I42 K43 I45 L58 N61 Q65 L82 N85 S86 I87	I42-I63 HydrophobicContact CG2-CG1 4.37Å; I42-I63 PolarHBondContact O-N 3.05Å; K43-I63 WeakPolarHBondContact O-CA 3.47Å; I45-I63 HydrophobicContact CG1-CD1 4.19Å; I45-I63 HydrophobicContact CG1-CG2 4.45Å; L58-I63 HydrophobicContact CB-CD1 4.16Å; L58-I63 HydrophobicContact CD1-CD1 4.4Å; L58-I63 HydrophobicContact CD2-CD1 4.26Å; N61-I63 HydrophobicContact CB-CG1 4.36Å; I63-Q65 WeakPolarHBondContact CG2-O 3.33Å; I63-L82 HydrophobicContact CD1-CD2 3.77Å; I63-N85 HydrophobicContact CB-CB 4.35Å; I63-N85 WeakPolarHBondContact CB-OD1 3.2Å; I63-N85 WeakPolarHBondContact CG1-OD1 3.39Å; I63-N85 PolarHBondContact N-OD1 2.93Å; I63-S86 CarbonylContact O-C 3.55Å; I63-S86 VanDerWaalsContact O-CA 3.31Å; I63-S86 WeakPolarHBondContact O-CA 3.28Å; I63-S86 PolarHBondContact O-N 3.28Å; I63-I87 HydrophobicContact CB-CG1 4.28Å; I63-I87 HydrophobicContact CG2-CD1 4.41Å; I63-I87 HydrophobicContact CG2-CG1 4.1Å; I63-I87 WeakPolarHBondContact O-CG1 3.38Å; I63-I87 PolarHBondContact O-N 2.96Å
64	V	97.2	Very high	95.9	Very high	74 Å²	74	46.6 Å²	46.6	45%	0.448	23%	0.227	S	C	.	.			trans	-103.5	-26.8	-174.3	-177.7	0	0	0	0	113	S86 I87 S88	V64-S86 WeakPolarHBondContact CA-O 3.27Å; V64-I87 CarbonylContact O-C 3.49Å; V64-I87 VanDerWaalsContact O-CA 3.31Å; V64-I87 WeakPolarHBondContact O-CA 3.04Å; V64-S88 PolarHBondContact O-N 3.08Å
65	Q	96.4	Very high	95.8	Very high	83 Å²	83	50.8 Å²	50.8	39%	0.388	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	155.9	-176.9	60.3	-177.2	-12	0	0	111.6	I63 R67 A89	I63-Q65 WeakPolarHBondContact CG2-O 3.33Å; Q65-R67 HydrophobicContact CG-CG 4.23Å; Q65-A89 VanDerWaalsContact CA-O 3.26Å; Q65-A89 WeakPolarHBondContact CA-O 3.15Å
66	I	96.1	Very high	95.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	115.9	169.5	-52.1	180	0	0	0	107.8	I45 L71 L82 I87 A89 L90 E91 A94 F95 L106	I45-I66 HydrophobicContact CD1-CG1 4.22Å; I45-I66 HydrophobicContact CD1-CG2 3.99Å; I66-L71 HydrophobicContact CG2-CD1 4.23Å; I66-L82 HydrophobicContact CD1-CD1 3.65Å; I66-I87 HydrophobicContact CD1-CD1 4.24Å; I66-I87 HydrophobicContact CG1-CD1 4.24Å; I66-I87 HydrophobicContact CG1-CG2 4.31Å; I66-A89 PolarHBondContact N-O 3.06Å; I66-L90 HydrophobicContact CB-CG 4.28Å; I66-L90 HydrophobicContact CD1-CD2 3.89Å; I66-L90 HydrophobicContact CD1-CG 4.07Å; I66-L90 HydrophobicContact CG1-CG 4.3Å; I66-E91 PolarHBondContact O-N 2.93Å; I66-A94 HydrophobicContact CG2-CB 4.04Å; I66-F95 HydrophobicContact CD1-CZ 4Å; I66-L106 HydrophobicContact CD1-CD2 3.98Å
67	R	94.9	Very high	95.7	Very high	38 Å²	38	52 Å²	52	14%	0.143	25%	0.25	C	C	.	.			trans	-94.9	158.2	-178.9	-57.2	172.2	-64.9	-154.9	-4.1	111.4	E44 Q65 Q69 D70 E91	E44-R67 IonicContact OE1-NH1 3.9Å; E44-R67 IonicContact OE2-CZ 3.95Å; E44-R67 VanDerWaalsContact OE2-CZ 3.26Å; E44-R67 IonicContact OE2-NH1 2.93Å; E44-R67 PolarHBondContact OE2-NH1 3.32Å; E44-R67 IonicContact OE2-NH2 3.76Å; E44-R67 PolarHBondContact OE2-NH2 2.96Å; Q65-R67 HydrophobicContact CG-CG 4.23Å; R67-Q69 HydrophobicContact CB-CG 4.28Å; R67-Q69 PolarHBondContact O-N 3.02Å; R67-Q69 VanDerWaalsContact O-N 3.12Å; R67-D70 WeakPolarHBondContact CB-OD2 3.34Å; R67-D70 IonicContact CZ-OD1 3.89Å; R67-D70 PolarHBondContact N-OD2 3.09Å; R67-D70 IonicContact NE-OD1 3.01Å; R67-D70 PolarHBondContact NE-OD1 2.92Å; R67-D70 VanDerWaalsContact NE-OD1 3.11Å; R67-D70 IonicContact NE-OD2 3.88Å; R67-D70 PolarHBondContact NE-OD2 3.15Å; R67-D70 IonicContact NH2-OD1 3.68Å; R67-D70 PolarHBondContact NH2-OD1 2.89Å; R67-D70 WeakPolarHBondContact O-CB 3.32Å; R67-D70 PolarHBondContact O-N 2.8Å; R67-E91 VanDerWaalsContact CA-OE2 3.31Å; R67-E91 WeakPolarHBondContact CA-OE2 3.41Å
68	L	92.1	Very high	95.7	Very high	87 Å²	87	51.5 Å²	51.5	46%	0.455	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-40.1	178.3	-174.8	72.3	0	0	0	113.1	E91 G93	L68-E91 PolarHBondContact N-OE2 3.08Å; L68-G93 VanDerWaalsContact CD1-C 3.49Å; L68-G93 WeakPolarHBondContact CD1-O 3.39Å
69	Q	91.7	Very high	95.7	Very high	118 Å²	118	55.6 Å²	55.6	55%	0.551	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-18.2	-176.1	64.2	-166.1	9.6	0	0	114.2	R67 L71	R67-Q69 HydrophobicContact CB-CG 4.28Å; R67-Q69 PolarHBondContact O-N 3.02Å; R67-Q69 VanDerWaalsContact O-N 3.12Å; Q69-L71 PolarHBondContact O-N 2.93Å
70	D	94.1	Very high	95.7	Very high	7 Å²	7	54.1 Å²	54.1	4%	0.037	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-38.5	-169.2	-71	-21.8	0	0	0	112.7	I45 Q47 R67	I45-D70 HydrophobicContact CB-CB 3.97Å; I45-D70 HydrophobicContact CD1-CB 3.95Å; I45-D70 HydrophobicContact CG1-CB 4.46Å; I45-D70 HydrophobicContact CG2-CB 4.25Å; Q47-D70 PolarHBondContact NE2-OD1 2.91Å; R67-D70 WeakPolarHBondContact CB-OD2 3.34Å; R67-D70 IonicContact CZ-OD1 3.89Å; R67-D70 PolarHBondContact N-OD2 3.09Å; R67-D70 IonicContact NE-OD1 3.01Å; R67-D70 PolarHBondContact NE-OD1 2.92Å; R67-D70 VanDerWaalsContact NE-OD1 3.11Å; R67-D70 IonicContact NE-OD2 3.88Å; R67-D70 PolarHBondContact NE-OD2 3.15Å; R67-D70 IonicContact NH2-OD1 3.68Å; R67-D70 PolarHBondContact NH2-OD1 2.89Å; R67-D70 WeakPolarHBondContact O-CB 3.32Å; R67-D70 PolarHBondContact O-N 2.8Å
71	L	93.7	Very high	95.7	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	25%	0.246	C	C	.	.	S	Bend	trans	-108	-8.3	-175.7	-59.5	175.3	0	0	0	113.5	I45 I66 Q69 R73 L74 L80 F95 Q98	I45-L71 HydrophobicContact CD1-CD2 4.27Å; I45-L71 HydrophobicContact CG2-CD2 4.27Å; I66-L71 HydrophobicContact CG2-CD1 4.23Å; Q69-L71 PolarHBondContact O-N 2.93Å; L71-R73 PolarHBondContact O-N 3.02Å; L71-L74 HydrophobicContact CD2-CD1 3.99Å; L71-L74 WeakPolarHBondContact O-CB 3.45Å; L71-L74 PolarHBondContact O-N 2.8Å; L71-L80 HydrophobicContact CD1-CD2 3.68Å; L71-L80 HydrophobicContact CD2-CD2 4.15Å; L71-F95 HydrophobicContact CD1-CD1 3.71Å; L71-F95 HydrophobicContact CD1-CE1 3.44Å; L71-F95 VanDerWaalsContact CD1-CE1 3.44Å; L71-Q98 HydrophobicContact CB-CG 4.14Å; L71-Q98 HydrophobicContact CD1-CG 4.48Å; L71-Q98 PolarHBondContact O-NE2 2.63Å
72	N	91.8	Very high	95.7	Very high	69 Å²	69	51.8 Å²	51.8	37%	0.369	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-30.9	-166.5	-169.2	17	0	0	0	115.1	N97	N72-N97 PolarHBondContact OD1-ND2 3.12Å
73	R	91.9	Very high	95.8	Very high	192 Å²	192	52 Å²	52	73%	0.725	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-16.7	179.5	-63.8	-175.8	177.9	-164.1	-0.4	114.2	L71 R75	L71-R73 PolarHBondContact O-N 3.02Å; R73-R75 VanDerWaalsContact C-N 3.35Å; R73-R75 PolarHBondContact O-N 3.15Å
74	L	93.9	Very high	95.8	Very high	8 Å²	8	55.8 Å²	55.8	4%	0.042	26%	0.257	C	S	.	.			trans	-93.2	62.8	-172.3	-58.3	170.6	0	0	0	110.6	A49 P50 I56 L71 S76 L77	A49-L74 HydrophobicContact CB-CD2 4Å; P50-L74 VanDerWaalsContact O-CD2 3.31Å; P50-L74 WeakPolarHBondContact O-CD2 3.35Å; I56-L74 HydrophobicContact CD1-CD1 3.45Å; I56-L74 VanDerWaalsContact CD1-CD1 3.45Å; I56-L74 HydrophobicContact CD1-CD2 4.47Å; L71-L74 HydrophobicContact CD2-CD1 3.99Å; L71-L74 WeakPolarHBondContact O-CB 3.45Å; L71-L74 PolarHBondContact O-N 2.8Å; L74-S76 VanDerWaalsContact C-N 3.29Å; L74-S76 PolarHBondContact O-N 3.46Å; L74-L77 HydrophobicContact CB-CB 4.43Å; L74-L77 WeakPolarHBondContact O-CB 3.48Å; L74-L77 PolarHBondContact O-N 2.92Å
75	R	94.6	Very high	95.9	Very high	159 Å²	159	52.8 Å²	52.8	60%	0.6	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.9	-174	-61.4	-175.9	-177.9	-177.3	-1.4	113.9	R73	R73-R75 VanDerWaalsContact C-N 3.35Å; R73-R75 PolarHBondContact O-N 3.15Å
76	S	96.4	Very high	95.9	Very high	49 Å²	49	51 Å²	51	34%	0.343	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	8.3	179.3	-62.3	0	0	0	0	113.3	T53 E54 L74 H78	T53-S76 CarbonylContact O-C 3.54Å; E54-S76 WeakPolarHBondContact CA-O 3.24Å; L74-S76 VanDerWaalsContact C-N 3.29Å; L74-S76 PolarHBondContact O-N 3.46Å; S76-H78 PolarHBondContact O-N 3.25Å; S76-H78 PolarHBondContact O-ND1 3.37Å
77	L	97.3	Very high	96.1	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.236	C	C	.	.			trans	-68.7	126.2	-175.8	-161.9	68.9	0	0	0	110.7	I56 L74 L80 Q100 L101	I56-L77 HydrophobicContact CB-CD1 4.25Å; I56-L77 HydrophobicContact CD1-CD1 3.77Å; I56-L77 HydrophobicContact CG1-CD1 3.66Å; L74-L77 HydrophobicContact CB-CB 4.43Å; L74-L77 WeakPolarHBondContact O-CB 3.48Å; L74-L77 PolarHBondContact O-N 2.92Å; L77-L80 HydrophobicContact CD2-CB 3.93Å; L77-L80 HydrophobicContact CD2-CD1 4.3Å; L77-L80 HydrophobicContact CD2-CD2 4.05Å; L77-L80 HydrophobicContact CD2-CG 4.32Å; L77-Q100 CarbonylContact O-C 3.42Å; L77-L101 HydrophobicContact CB-CD1 4.16Å; L77-L101 HydrophobicContact CD2-CD1 3.88Å; L77-L101 HydrophobicContact CG-CD1 3.74Å; L77-L101 WeakPolarHBondContact O-CA 3.33Å; L77-L101 PolarHBondContact O-N 3.11Å; L77-L101 VanDerWaalsContact O-N 3.1Å
78	H	98.5	Very high	96.1	Very high	43 Å²	43	51.2 Å²	51.2	20%	0.199	24%	0.243	C	C	.	.			trans	-107.5	-36.4	176.2	-67.5	98	0	0	0	111.9	E54 S76 Q100 L102 E103	E54-H78 PolarHBondContact O-N 3.32Å; E54-H78 IonicContact OE1-CE1 2.96Å; S76-H78 PolarHBondContact O-N 3.25Å; S76-H78 PolarHBondContact O-ND1 3.37Å; H78-Q100 PolarHBondContact CD2-O 3.43Å; H78-L102 HydrophobicContact CB-CD1 4.4Å; H78-L102 HydrophobicContact CB-CG 4.44Å; H78-L102 PolarHBondContact O-N 2.74Å; H78-E103 PolarHBondContact O-N 2.77Å; H78-E103 VanDerWaalsContact O-N 3.11Å
79	Y	98.7	Very high	96.2	Very high	85 Å²	85	49.2 Å²	49.2	33%	0.333	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.5	-175.7	-52.4	-86.9	0	0	0	110.5	E54 T55 I56 E103	E54-Y79 PolarHBondContact O-N 2.93Å; T55-Y79 WeakPolarHBondContact CA-O 3.25Å; T55-Y79 WeakPolarHBondContact OG1-CD2 3.39Å; I56-Y79 PolarHBondContact N-O 3.38Å; Y79-E103 HydrophobicContact CD1-CB 3.82Å; Y79-E103 HydrophobicContact CE1-CB 4.37Å
80	L	98.5	Very high	96.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	112.1	178.1	-179.8	55.8	0	0	0	110.7	I56 L58 L71 L77 L82 F95 L101 E103 L104 A105	I56-L80 HydrophobicContact CB-CD1 4Å; I56-L80 HydrophobicContact CG2-CD1 4.1Å; L58-L80 HydrophobicContact CD1-CD1 4.47Å; L71-L80 HydrophobicContact CD1-CD2 3.68Å; L71-L80 HydrophobicContact CD2-CD2 4.15Å; L77-L80 HydrophobicContact CD2-CB 3.93Å; L77-L80 HydrophobicContact CD2-CD1 4.3Å; L77-L80 HydrophobicContact CD2-CD2 4.05Å; L77-L80 HydrophobicContact CD2-CG 4.32Å; L80-L82 HydrophobicContact CD1-CD1 4.05Å; L80-L82 HydrophobicContact CD1-CG 4.08Å; L80-L82 HydrophobicContact CD2-CD1 3.79Å; L80-L82 HydrophobicContact CG-CD1 3.76Å; L80-L82 HydrophobicContact CG-CG 4.13Å; L80-F95 HydrophobicContact CD2-CE1 4.26Å; L80-L101 HydrophobicContact CB-CD1 3.93Å; L80-L101 HydrophobicContact CB-CD2 4.49Å; L80-E103 PolarHBondContact N-O 3.24Å; L80-L104 HydrophobicContact CB-CD1 4.06Å; L80-L104 HydrophobicContact CD2-CD1 3.89Å; L80-L104 HydrophobicContact CG-CD1 4.01Å; L80-A105 PolarHBondContact O-N 3.24Å
81	Y	98.7	Very high	96.3	Very high	40 Å²	40	47.6 Å²	47.6	16%	0.157	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	108.1	-177.5	-64.7	-68.6	0	0	0	110.9	T55 I56 F57 L58 Q59 Q83 E103 A105	T55-Y81 HydrophobicContact CG2-CE2 4.34Å; I56-Y81 PolarHBondContact O-N 2.9Å; F57-Y81 AromaticContact CD1-CD2 3.4Å; F57-Y81 HydrophobicContact CD1-CD2 3.4Å; F57-Y81 HydrophobicContact CD1-CE2 4.15Å; F57-Y81 AromaticContact CD1-CG 3.92Å; F57-Y81 HydrophobicContact CD1-CG 3.92Å; F57-Y81 AromaticContact CE1-CD2 3.22Å; F57-Y81 HydrophobicContact CE1-CD2 3.22Å; F57-Y81 AromaticContact CE1-CE2 3.48Å; F57-Y81 HydrophobicContact CE1-CE2 3.48Å; F57-Y81 VanDerWaalsContact CE1-CE2 3.48Å; F57-Y81 AromaticContact CE1-CG 4Å; F57-Y81 HydrophobicContact CE1-CG 4Å; F57-Y81 HydrophobicContact CG-CD2 4.2Å; F57-Y81 AromaticContact CZ-CD2 3.91Å; F57-Y81 HydrophobicContact CZ-CD2 3.91Å; F57-Y81 AromaticContact CZ-CE2 3.86Å; F57-Y81 HydrophobicContact CZ-CE2 3.86Å; L58-Y81 CarbonylContact C-O 3.4Å; L58-Y81 WeakPolarHBondContact CA-O 3.31Å; L58-Y81 WeakPolarHBondContact CB-O 3.4Å; L58-Y81 PolarHBondContact N-O 3.31Å; Q59-Y81 PolarHBondContact N-O 3.15Å; Y81-Q83 VanDerWaalsContact CB-OE1 3.3Å; Y81-E103 HydrophobicContact CE1-CG 4.47Å; Y81-E103 VanDerWaalsContact CE1-OE1 3.24Å; Y81-E103 WeakPolarHBondContact CE1-OE1 3.49Å; Y81-E103 PolarHBondContact OH-OE1 2.93Å; Y81-E103 VanDerWaalsContact OH-OE1 3.08Å; Y81-A105 HydrophobicContact CD1-CB 3.75Å; Y81-A105 HydrophobicContact CE1-CB 4.38Å
82	L	98.5	Very high	96.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.261	C	S	.	.			trans	-125	19.3	-177.8	-74.9	162.1	0	0	0	112	L58 I63 I66 L80 N85 I87 A105 L106 N109	L58-L82 HydrophobicContact CB-CD2 3.62Å; L58-L82 HydrophobicContact CB-CG 4.43Å; L58-L82 HydrophobicContact CD1-CD2 3.87Å; L58-L82 HydrophobicContact CG-CD2 4.4Å; I63-L82 HydrophobicContact CD1-CD2 3.77Å; I66-L82 HydrophobicContact CD1-CD1 3.65Å; L80-L82 HydrophobicContact CD1-CD1 4.05Å; L80-L82 HydrophobicContact CD1-CG 4.08Å; L80-L82 HydrophobicContact CD2-CD1 3.79Å; L80-L82 HydrophobicContact CG-CD1 3.76Å; L80-L82 HydrophobicContact CG-CG 4.13Å; L82-N85 PolarHBondContact O-ND2 3.19Å; L82-N85 VanDerWaalsContact O-ND2 3.08Å; L82-I87 HydrophobicContact CB-CD1 4Å; L82-I87 HydrophobicContact CD1-CD1 4.4Å; L82-I87 HydrophobicContact CD2-CD1 4.25Å; L82-I87 HydrophobicContact CG-CD1 4.47Å; L82-A105 CarbonylContact C-O 3.08Å; L82-A105 WeakPolarHBondContact CA-O 3.36Å; L82-A105 WeakPolarHBondContact CB-O 3.45Å; L82-A105 PolarHBondContact N-O 3.4Å; L82-L106 HydrophobicContact CB-CD2 3.97Å; L82-L106 HydrophobicContact CD1-CD2 4.04Å; L82-N109 PolarHBondContact O-ND2 2.94Å
83	Q	98.5	Very high	96	Very high	39 Å²	39	49.2 Å²	49.2	18%	0.182	25%	0.247	C	C	.	.			trans	-63.2	152.7	-179.4	68.1	-83.6	16	0	0	112.7	Q59 D60 Y81 N85 A105 N107	Q59-Q83 VanDerWaalsContact CA-O 3.24Å; Q59-Q83 WeakPolarHBondContact CA-O 3.18Å; Q59-Q83 HydrophobicContact CB-CG 3.74Å; D60-Q83 PolarHBondContact N-O 3.49Å; Y81-Q83 VanDerWaalsContact CB-OE1 3.3Å; Q83-N85 PolarHBondContact O-N 2.88Å; Q83-N85 PolarHBondContact O-ND2 2.98Å; Q83-A105 PolarHBondContact N-O 3.3Å; Q83-N107 CarbonylContact C-O 3.38Å; Q83-N107 WeakPolarHBondContact CA-O 3.48Å; Q83-N107 WeakPolarHBondContact CB-ND2 3.48Å; Q83-N107 WeakPolarHBondContact CB-O 3.45Å; Q83-N107 WeakPolarHBondContact CB-OD1 3.35Å
84	N	98.4	Very high	96.1	Very high	79 Å²	79	40.1 Å²	40.1	42%	0.422	21%	0.213	S	C	.	.	S	Bend	trans	54.4	53	178.6	-57.8	-17.5	0	0	0	112.6	D60 N61 N107 G108	D60-N84 VanDerWaalsContact CA-O 3.26Å; D60-N84 WeakPolarHBondContact CA-O 3.32Å; D60-N84 PolarHBondContact N-O 3.43Å; D60-N84 WeakPolarHBondContact OD1-CB 3.37Å; D60-N84 PolarHBondContact OD1-ND2 2.97Å; N61-N84 PolarHBondContact N-O 3.42Å; N84-N107 PolarHBondContact N-O 2.86Å; N84-G108 VanDerWaalsContact CA-O 3.25Å; N84-G108 WeakPolarHBondContact CA-O 3.26Å; N84-G108 PolarHBondContact N-O 3.18Å
85	N	98.6	Very high	96.2	Very high	11 Å²	11	39.7 Å²	39.7	6%	0.059	21%	0.211	C	C	.	.	S	Bend	trans	-116	-165.5	171.1	-87	-87.2	0	0	0	109.3	L58 N61 A62 I63 L82 Q83 I87 G108 N109	L58-N85 PolarHBondContact O-ND2 3.43Å; N61-N85 VanDerWaalsContact CA-OD1 3.31Å; N61-N85 WeakPolarHBondContact CA-OD1 3.4Å; N61-N85 WeakPolarHBondContact CB-OD1 3.38Å; N61-N85 PolarHBondContact O-OD1 3.3Å; A62-N85 PolarHBondContact N-OD1 3.27Å; I63-N85 HydrophobicContact CB-CB 4.35Å; I63-N85 WeakPolarHBondContact CB-OD1 3.2Å; I63-N85 WeakPolarHBondContact CG1-OD1 3.39Å; I63-N85 PolarHBondContact N-OD1 2.93Å; L82-N85 PolarHBondContact O-ND2 3.19Å; L82-N85 VanDerWaalsContact O-ND2 3.08Å; Q83-N85 PolarHBondContact O-N 2.88Å; Q83-N85 PolarHBondContact O-ND2 2.98Å; N85-I87 HydrophobicContact CB-CD1 4.14Å; N85-I87 HydrophobicContact CB-CG1 3.96Å; N85-G108 PolarHBondContact N-O 3.05Å; N85-N109 VanDerWaalsContact CA-OD1 3.26Å; N85-N109 WeakPolarHBondContact CA-OD1 3.43Å; N85-N109 WeakPolarHBondContact CB-OD1 3.31Å; N85-N109 PolarHBondContact N-OD1 3.02Å; N85-N109 PolarHBondContact O-OD1 3.24Å
86	S	98.1	Very high	96.2	Very high	47 Å²	47	36.2 Å²	36.2	33%	0.329	20%	0.204	S	C	.	.			trans	-113.1	30.4	175.3	-60.5	0	0	0	0	111.7	I63 V64 S88 N109	I63-S86 CarbonylContact O-C 3.55Å; I63-S86 VanDerWaalsContact O-CA 3.31Å; I63-S86 WeakPolarHBondContact O-CA 3.28Å; I63-S86 PolarHBondContact O-N 3.28Å; V64-S86 WeakPolarHBondContact CA-O 3.27Å; S86-S88 PolarHBondContact O-N 2.87Å; S86-S88 VanDerWaalsContact O-N 3.15Å; S86-N109 PolarHBondContact N-OD1 2.9Å
87	I	98.3	Very high	96	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.			trans	-69	114.7	-171.8	-59.5	168.4	0	0	0	109	I63 V64 I66 L82 N85 L90 L106 N109 L110 I111	I63-I87 HydrophobicContact CB-CG1 4.28Å; I63-I87 HydrophobicContact CG2-CD1 4.41Å; I63-I87 HydrophobicContact CG2-CG1 4.1Å; I63-I87 WeakPolarHBondContact O-CG1 3.38Å; I63-I87 PolarHBondContact O-N 2.96Å; V64-I87 CarbonylContact O-C 3.49Å; V64-I87 VanDerWaalsContact O-CA 3.31Å; V64-I87 WeakPolarHBondContact O-CA 3.04Å; I66-I87 HydrophobicContact CD1-CD1 4.24Å; I66-I87 HydrophobicContact CG1-CD1 4.24Å; I66-I87 HydrophobicContact CG1-CG2 4.31Å; L82-I87 HydrophobicContact CB-CD1 4Å; L82-I87 HydrophobicContact CD1-CD1 4.4Å; L82-I87 HydrophobicContact CD2-CD1 4.25Å; L82-I87 HydrophobicContact CG-CD1 4.47Å; N85-I87 HydrophobicContact CB-CD1 4.14Å; N85-I87 HydrophobicContact CB-CG1 3.96Å; I87-L90 HydrophobicContact CG2-CD1 3.8Å; I87-L90 HydrophobicContact CG2-CG 4.38Å; I87-L106 HydrophobicContact CD1-CD2 4.05Å; I87-N109 HydrophobicContact CB-CB 4.17Å; I87-N109 WeakPolarHBondContact CB-OD1 3.45Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.33Å; I87-N109 PolarHBondContact N-OD1 2.85Å; I87-L110 CarbonylContact O-C 3.49Å; I87-L110 VanDerWaalsContact O-C 3.23Å; I87-L110 WeakPolarHBondContact O-CA 3.36Å; I87-L110 PolarHBondContact O-N 2.94Å; I87-I111 HydrophobicContact CG2-CG1 4.42Å; I87-I111 WeakPolarHBondContact O-CG1 3.33Å; I87-I111 PolarHBondContact O-N 2.84Å
88	S	96.8	Very high	95.9	Very high	42 Å²	42	37.4 Å²	37.4	29%	0.294	21%	0.206	S	C	.	.			trans	-109.3	-19.3	178.2	62.6	0	0	0	0	113.5	V64 S86 L110	V64-S88 PolarHBondContact O-N 3.08Å; S86-S88 PolarHBondContact O-N 2.87Å; S86-S88 VanDerWaalsContact O-N 3.15Å; S88-L110 WeakPolarHBondContact CA-O 3.45Å
89	A	93.6	Very high	95.8	Very high	45 Å²	45	36.3 Å²	36.3	37%	0.372	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	141.5	-176.6	0	0	0	0	0	112	Q65 I66	Q65-A89 VanDerWaalsContact CA-O 3.26Å; Q65-A89 WeakPolarHBondContact CA-O 3.15Å; I66-A89 PolarHBondContact N-O 3.06Å
90	L	94.8	Very high	95.7	Very high	11 Å²	11	36.8 Å²	36.8	6%	0.058	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.4	171.5	-65.6	79.2	0	0	0	107	I66 I87 F95 L106 I111 M118	I66-L90 HydrophobicContact CB-CG 4.28Å; I66-L90 HydrophobicContact CD1-CD2 3.89Å; I66-L90 HydrophobicContact CD1-CG 4.07Å; I66-L90 HydrophobicContact CG1-CG 4.3Å; I87-L90 HydrophobicContact CG2-CD1 3.8Å; I87-L90 HydrophobicContact CG2-CG 4.38Å; L90-F95 HydrophobicContact CD2-CE2 3.63Å; L90-F95 HydrophobicContact CD2-CZ 3.95Å; L90-L106 HydrophobicContact CD2-CD1 4.01Å; L90-I111 HydrophobicContact CD1-CD1 3.74Å; L90-I111 HydrophobicContact CD1-CG1 3.92Å; L90-M118 HydrophobicContact CB-CE 3.93Å; L90-M118 HydrophobicContact CB-CG 3.93Å; L90-M118 HydrophobicContact CB-SD 3.98Å; L90-M118 HydrophobicContact CD1-CE 4.38Å; L90-M118 HydrophobicContact CD1-SD 4.04Å; L90-M118 HydrophobicContact CD2-CG 4.15Å; L90-M118 HydrophobicContact CD2-SD 4.16Å; L90-M118 HydrophobicContact CG-SD 4.28Å
91	E	92.8	Very high	95.7	Very high	80 Å²	80	36.8 Å²	36.8	37%	0.374	21%	0.212	S	C	.	.			trans	-64.2	140.2	179.5	-74.4	-177.2	176.4	0	0	110.7	I66 R67 L68 G93 A94	I66-E91 PolarHBondContact O-N 2.93Å; R67-E91 VanDerWaalsContact CA-OE2 3.31Å; R67-E91 WeakPolarHBondContact CA-OE2 3.41Å; L68-E91 PolarHBondContact N-OE2 3.08Å; E91-G93 PolarHBondContact O-N 2.99Å; E91-A94 VanDerWaalsContact O-CB 3.28Å; E91-A94 WeakPolarHBondContact O-CB 3.33Å; E91-A94 PolarHBondContact O-N 2.86Å
92	P	90.2	Very high	95.7	Very high	95 Å²	95	36.3 Å²	36.3	62%	0.617	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	127.2	175.6	-26.2	34.6	0	0	0	111.5	A94	P92-A94 VanDerWaalsContact C-N 3.35Å
93	G	89.8	Confident	95.8	Very high	8 Å²	8	37.8 Å²	37.8	8%	0.082	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	10.3	179.7	0	0	0	0	0	115.9	L68 E91 F95 L96	L68-G93 VanDerWaalsContact CD1-C 3.49Å; L68-G93 WeakPolarHBondContact CD1-O 3.39Å; E91-G93 PolarHBondContact O-N 2.99Å; G93-F95 PolarHBondContact O-N 3Å; G93-L96 WeakPolarHBondContact O-CB 3.32Å; G93-L96 VanDerWaalsContact O-CG 3.24Å; G93-L96 WeakPolarHBondContact O-CG 3.36Å; G93-L96 PolarHBondContact O-N 2.78Å
94	A	94.1	Very high	95.8	Very high	1 Å²	1	36 Å²	36	1%	0.008	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-20	174.3	0	0	0	0	0	114.7	I66 E91 P92 Q98	I66-A94 HydrophobicContact CG2-CB 4.04Å; E91-A94 VanDerWaalsContact O-CB 3.28Å; E91-A94 WeakPolarHBondContact O-CB 3.33Å; E91-A94 PolarHBondContact O-N 2.86Å; P92-A94 VanDerWaalsContact C-N 3.35Å; A94-Q98 PolarHBondContact O-OE1 3.03Å
95	F	95.5	Very high	95.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	11.9	177.6	-57.4	-68.4	0	0	0	115.4	I66 L71 L80 L90 G93 N97 Q98 L104 M118 F119 R120 L122	I66-F95 HydrophobicContact CD1-CZ 4Å; L71-F95 HydrophobicContact CD1-CD1 3.71Å; L71-F95 HydrophobicContact CD1-CE1 3.44Å; L71-F95 VanDerWaalsContact CD1-CE1 3.44Å; L80-F95 HydrophobicContact CD2-CE1 4.26Å; L90-F95 HydrophobicContact CD2-CE2 3.63Å; L90-F95 HydrophobicContact CD2-CZ 3.95Å; G93-F95 PolarHBondContact O-N 3Å; F95-N97 PolarHBondContact O-N 3.17Å; F95-N97 VanDerWaalsContact O-N 3.09Å; F95-Q98 HydrophobicContact CB-CB 4.4Å; F95-Q98 HydrophobicContact CD1-CG 4.41Å; F95-Q98 PolarHBondContact O-N 3.3Å; F95-Q98 VanDerWaalsContact O-N 3.09Å; F95-Q98 PolarHBondContact O-OE1 2.93Å; F95-Q98 VanDerWaalsContact O-OE1 3.13Å; F95-L104 HydrophobicContact CE1-CD1 4.42Å; F95-L104 HydrophobicContact CE1-CD2 4.15Å; F95-L104 HydrophobicContact CE2-CD2 4.17Å; F95-L104 HydrophobicContact CZ-CD1 4.45Å; F95-L104 HydrophobicContact CZ-CD2 3.82Å; F95-M118 VanDerWaalsContact CD2-O 3.31Å; F95-M118 WeakPolarHBondContact CD2-O 3.44Å; F95-F119 HydrophobicContact CE2-CD1 4.5Å; F95-R120 CarbonylContact C-O 3.39Å; F95-L122 HydrophobicContact CB-CD1 4.09Å; F95-L122 HydrophobicContact CB-CD2 3.63Å; F95-L122 HydrophobicContact CB-CG 3.67Å; F95-L122 HydrophobicContact CD1-CD2 4.2Å; F95-L122 HydrophobicContact CD2-CD1 4.09Å; F95-L122 HydrophobicContact CG-CD1 4.01Å; F95-L122 HydrophobicContact CG-CD2 4.02Å; F95-L122 HydrophobicContact CG-CG 4.12Å
96	L	93.4	Very high	95.8	Very high	86 Å²	86	31.8 Å²	31.8	45%	0.45	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.7	-174.5	-80.4	168.9	0	0	0	113.9	G93 R120	G93-L96 WeakPolarHBondContact O-CB 3.32Å; G93-L96 VanDerWaalsContact O-CG 3.24Å; G93-L96 WeakPolarHBondContact O-CG 3.36Å; G93-L96 PolarHBondContact O-N 2.78Å; L96-R120 HydrophobicContact CD2-CG 4.15Å
97	N	93.4	Very high	95.8	Very high	70 Å²	70	31.7 Å²	31.7	37%	0.374	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	14	-176.5	-71.3	-41.2	0	0	0	113	N72 F95	N72-N97 PolarHBondContact OD1-ND2 3.12Å; F95-N97 PolarHBondContact O-N 3.17Å; F95-N97 VanDerWaalsContact O-N 3.09Å
98	Q	95.9	Very high	95.8	Very high	3 Å²	3	33 Å²	33	1%	0.014	20%	0.197	C	C	.	.			trans	-105.7	38.9	-175.9	-71.5	64	37.9	0	0	110.7	L71 A94 F95 Q100 L101 L122	L71-Q98 HydrophobicContact CB-CG 4.14Å; L71-Q98 HydrophobicContact CD1-CG 4.48Å; L71-Q98 PolarHBondContact O-NE2 2.63Å; A94-Q98 PolarHBondContact O-OE1 3.03Å; F95-Q98 HydrophobicContact CB-CB 4.4Å; F95-Q98 HydrophobicContact CD1-CG 4.41Å; F95-Q98 PolarHBondContact O-N 3.3Å; F95-Q98 VanDerWaalsContact O-N 3.09Å; F95-Q98 PolarHBondContact O-OE1 2.93Å; F95-Q98 VanDerWaalsContact O-OE1 3.13Å; Q98-Q100 PolarHBondContact O-N 2.85Å; Q98-Q100 VanDerWaalsContact O-N 3.12Å; Q98-L101 HydrophobicContact CB-CB 4.39Å; Q98-L101 VanDerWaalsContact O-CB 3.26Å; Q98-L101 WeakPolarHBondContact O-CB 3.33Å; Q98-L101 PolarHBondContact O-N 2.94Å; Q98-L122 HydrophobicContact CB-CD2 3.93Å
99	G	95.4	Very high	95.9	Very high	20 Å²	20	31.2 Å²	31.2	21%	0.206	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-18.8	-175.9	0	0	0	0	0	115.2	G121 H124	G99-G121 VanDerWaalsContact CA-O 3.24Å; G99-G121 WeakPolarHBondContact CA-O 3.43Å; G99-H124 WeakPolarHBondContact O-CB 3.44Å; G99-H124 PolarHBondContact O-ND1 3.37Å
100	Q	97.3	Very high	96.1	Very high	95 Å²	95	32.5 Å²	32.5	44%	0.444	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.3	176.9	-60	-57.8	-49.6	0	0	113.5	L77 H78 Q98 L102	L77-Q100 CarbonylContact O-C 3.42Å; H78-Q100 PolarHBondContact CD2-O 3.43Å; Q98-Q100 PolarHBondContact O-N 2.85Å; Q98-Q100 VanDerWaalsContact O-N 3.12Å; Q100-L102 PolarHBondContact O-N 3.19Å
101	L	98.4	Very high	96.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.182	C	C	.	.			trans	-65.7	126.8	-176.7	-161.3	73.2	0	0	0	109.9	L77 L80 Q98 L104 L122 H124 L125	L77-L101 HydrophobicContact CB-CD1 4.16Å; L77-L101 HydrophobicContact CD2-CD1 3.88Å; L77-L101 HydrophobicContact CG-CD1 3.74Å; L77-L101 WeakPolarHBondContact O-CA 3.33Å; L77-L101 PolarHBondContact O-N 3.11Å; L77-L101 VanDerWaalsContact O-N 3.1Å; L80-L101 HydrophobicContact CB-CD1 3.93Å; L80-L101 HydrophobicContact CB-CD2 4.49Å; Q98-L101 HydrophobicContact CB-CB 4.39Å; Q98-L101 VanDerWaalsContact O-CB 3.26Å; Q98-L101 WeakPolarHBondContact O-CB 3.33Å; Q98-L101 PolarHBondContact O-N 2.94Å; L101-L104 HydrophobicContact CD2-CB 3.95Å; L101-L104 HydrophobicContact CD2-CD1 4.32Å; L101-L104 HydrophobicContact CD2-CD2 4.41Å; L101-L104 HydrophobicContact CD2-CG 4.46Å; L101-L122 HydrophobicContact CB-CD2 3.9Å; L101-L122 HydrophobicContact CD2-CD2 3.64Å; L101-L122 HydrophobicContact CG-CD2 4.4Å; L101-H124 CarbonylContact O-C 3.35Å; L101-H124 VanDerWaalsContact O-C 3.23Å; L101-L125 HydrophobicContact CB-CD1 4.36Å; L101-L125 HydrophobicContact CD2-CD1 4.04Å; L101-L125 HydrophobicContact CG-CD1 4.05Å; L101-L125 WeakPolarHBondContact O-CA 3.24Å; L101-L125 PolarHBondContact O-N 2.72Å
102	L	98.8	Very high	96.4	Very high	31 Å²	31	33.1 Å²	33.1	16%	0.162	19%	0.187	C	C	.	.			trans	-103.1	-35	-179.5	-59.1	-180	0	0	0	111.3	H78 Q100 H124 R126 I127	H78-L102 HydrophobicContact CB-CD1 4.4Å; H78-L102 HydrophobicContact CB-CG 4.44Å; H78-L102 PolarHBondContact O-N 2.74Å; Q100-L102 PolarHBondContact O-N 3.19Å; L102-H124 HydrophobicContact CD2-CB 4.09Å; L102-H124 WeakPolarHBondContact CD2-O 3.38Å; L102-R126 WeakPolarHBondContact O-CA 3.35Å; L102-R126 PolarHBondContact O-N 3.05Å; L102-I127 PolarHBondContact O-N 3.22Å; L102-I127 VanDerWaalsContact O-N 3.1Å
103	E	98.9	Very high	96.6	Very high	31 Å²	31	32.7 Å²	32.7	15%	0.145	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	129.8	-176.6	-174.8	170.7	149.8	0	0	111	H78 Y79 L80 Y81 I127 Y129	H78-E103 PolarHBondContact O-N 2.77Å; H78-E103 VanDerWaalsContact O-N 3.11Å; Y79-E103 HydrophobicContact CD1-CB 3.82Å; Y79-E103 HydrophobicContact CE1-CB 4.37Å; L80-E103 PolarHBondContact N-O 3.24Å; Y81-E103 HydrophobicContact CE1-CG 4.47Å; Y81-E103 VanDerWaalsContact CE1-OE1 3.24Å; Y81-E103 WeakPolarHBondContact CE1-OE1 3.49Å; Y81-E103 PolarHBondContact OH-OE1 2.93Å; Y81-E103 VanDerWaalsContact OH-OE1 3.08Å; E103-I127 WeakPolarHBondContact CA-O 3.12Å; E103-I127 HydrophobicContact CG-CB 4.1Å; E103-I127 HydrophobicContact CG-CG2 4.41Å; E103-Y129 HydrophobicContact CG-CE2 4.11Å
104	L	98.8	Very high	96.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	114.8	177.8	177.8	56.7	0	0	0	109.5	L80 F95 L101 L106 L122 L125 I127 L128 Y129	L80-L104 HydrophobicContact CB-CD1 4.06Å; L80-L104 HydrophobicContact CD2-CD1 3.89Å; L80-L104 HydrophobicContact CG-CD1 4.01Å; F95-L104 HydrophobicContact CE1-CD1 4.42Å; F95-L104 HydrophobicContact CE1-CD2 4.15Å; F95-L104 HydrophobicContact CE2-CD2 4.17Å; F95-L104 HydrophobicContact CZ-CD1 4.45Å; F95-L104 HydrophobicContact CZ-CD2 3.82Å; L101-L104 HydrophobicContact CD2-CB 3.95Å; L101-L104 HydrophobicContact CD2-CD1 4.32Å; L101-L104 HydrophobicContact CD2-CD2 4.41Å; L101-L104 HydrophobicContact CD2-CG 4.46Å; L104-L106 HydrophobicContact CD1-CD1 4.37Å; L104-L106 HydrophobicContact CD1-CG 4.11Å; L104-L106 HydrophobicContact CD2-CD1 3.89Å; L104-L106 HydrophobicContact CD2-CG 4.48Å; L104-L106 HydrophobicContact CG-CD1 4Å; L104-L106 HydrophobicContact CG-CG 4.05Å; L104-L122 HydrophobicContact CD2-CD1 3.94Å; L104-L125 HydrophobicContact CB-CD1 3.88Å; L104-I127 PolarHBondContact N-O 3.25Å; L104-L128 HydrophobicContact CB-CD1 4.08Å; L104-L128 HydrophobicContact CD2-CD1 3.95Å; L104-L128 HydrophobicContact CG-CD1 4.03Å; L104-Y129 PolarHBondContact O-N 3.27Å
105	A	98.8	Very high	96.6	Very high	3 Å²	3	34.1 Å²	34.1	3%	0.025	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	111.7	176.7	0	0	0	0	0	111.4	L80 Y81 L82 Q83 Y129	L80-A105 PolarHBondContact O-N 3.24Å; Y81-A105 HydrophobicContact CD1-CB 3.75Å; Y81-A105 HydrophobicContact CE1-CB 4.38Å; L82-A105 CarbonylContact C-O 3.08Å; L82-A105 WeakPolarHBondContact CA-O 3.36Å; L82-A105 WeakPolarHBondContact CB-O 3.45Å; L82-A105 PolarHBondContact N-O 3.4Å; Q83-A105 PolarHBondContact N-O 3.3Å; A105-Y129 HydrophobicContact CB-CD2 3.93Å
106	L	98.6	Very high	96.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.2	C	C	.	.			trans	-122.3	16	176.7	-68.8	167.6	0	0	0	111.7	I66 L82 I87 L90 L104 N109 I111 F119 Y129 L130 N133	I66-L106 HydrophobicContact CD1-CD2 3.98Å; L82-L106 HydrophobicContact CB-CD2 3.97Å; L82-L106 HydrophobicContact CD1-CD2 4.04Å; I87-L106 HydrophobicContact CD1-CD2 4.05Å; L90-L106 HydrophobicContact CD2-CD1 4.01Å; L104-L106 HydrophobicContact CD1-CD1 4.37Å; L104-L106 HydrophobicContact CD1-CG 4.11Å; L104-L106 HydrophobicContact CD2-CD1 3.89Å; L104-L106 HydrophobicContact CD2-CG 4.48Å; L104-L106 HydrophobicContact CG-CD1 4Å; L104-L106 HydrophobicContact CG-CG 4.05Å; L106-N109 PolarHBondContact O-ND2 3.39Å; L106-I111 HydrophobicContact CB-CD1 4.11Å; L106-I111 HydrophobicContact CD1-CD1 4.24Å; L106-F119 HydrophobicContact CD1-CE1 4.25Å; L106-Y129 CarbonylContact C-O 3.57Å; L106-Y129 VanDerWaalsContact CA-O 3.32Å; L106-Y129 WeakPolarHBondContact CA-O 3.31Å; L106-Y129 WeakPolarHBondContact CB-O 3.39Å; L106-Y129 PolarHBondContact N-O 2.98Å; L106-L130 HydrophobicContact CB-CD2 4.01Å; L106-L130 HydrophobicContact CD1-CD2 4.1Å; L106-N133 PolarHBondContact O-ND2 3.08Å
107	N	98.6	Very high	96	Very high	44 Å²	44	36 Å²	36	24%	0.235	20%	0.199	C	C	.	.			trans	-67.5	149.7	-179.6	56.7	-75.7	0	0	0	112.7	Q83 N84 Y129 A131	Q83-N107 CarbonylContact C-O 3.38Å; Q83-N107 WeakPolarHBondContact CA-O 3.48Å; Q83-N107 WeakPolarHBondContact CB-ND2 3.48Å; Q83-N107 WeakPolarHBondContact CB-O 3.45Å; Q83-N107 WeakPolarHBondContact CB-OD1 3.35Å; N84-N107 PolarHBondContact N-O 2.86Å; N107-Y129 PolarHBondContact N-O 2.99Å; N107-A131 CarbonylContact C-O 3.23Å; N107-A131 WeakPolarHBondContact CA-O 3.48Å; N107-A131 HydrophobicContact CB-CB 4.24Å; N107-A131 WeakPolarHBondContact CB-O 3.41Å
108	G	98.6	Very high	95.9	Very high	27 Å²	27	33.1 Å²	33.1	28%	0.278	18%	0.184	S	C	.	.	S	Bend	trans	67.3	43.3	-179	0	0	0	0	0	113	N84 N85 A131 G132	N84-G108 VanDerWaalsContact CA-O 3.25Å; N84-G108 WeakPolarHBondContact CA-O 3.26Å; N84-G108 PolarHBondContact N-O 3.18Å; N85-G108 PolarHBondContact N-O 3.05Å; G108-A131 PolarHBondContact N-O 3.16Å; G108-G132 VanDerWaalsContact CA-O 3.27Å; G108-G132 WeakPolarHBondContact CA-O 3.48Å; G108-G132 PolarHBondContact N-O 3.45Å
109	N	98.8	Very high	95.8	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.027	18%	0.183	C	C	.	.	S	Bend	trans	-121.5	-168.8	177.3	-83.9	-72.1	0	0	0	110.5	L82 N85 S86 I87 L106 I111 G132 N133	L82-N109 PolarHBondContact O-ND2 2.94Å; N85-N109 VanDerWaalsContact CA-OD1 3.26Å; N85-N109 WeakPolarHBondContact CA-OD1 3.43Å; N85-N109 WeakPolarHBondContact CB-OD1 3.31Å; N85-N109 PolarHBondContact N-OD1 3.02Å; N85-N109 PolarHBondContact O-OD1 3.24Å; S86-N109 PolarHBondContact N-OD1 2.9Å; I87-N109 HydrophobicContact CB-CB 4.17Å; I87-N109 WeakPolarHBondContact CB-OD1 3.45Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.33Å; I87-N109 PolarHBondContact N-OD1 2.85Å; L106-N109 PolarHBondContact O-ND2 3.39Å; N109-I111 HydrophobicContact CB-CG1 4.33Å; N109-G132 PolarHBondContact N-O 2.91Å; N109-N133 WeakPolarHBondContact CA-OD1 3.45Å; N109-N133 WeakPolarHBondContact CB-OD1 3.21Å; N109-N133 PolarHBondContact O-OD1 3.4Å
110	L	98.4	Very high	95.7	Very high	72 Å²	72	39 Å²	39	38%	0.377	20%	0.2	S	C	.	.			trans	-114	26.4	-175.9	-52.4	175.8	0	0	0	111.9	I87 S88 H112 N133	I87-L110 CarbonylContact O-C 3.49Å; I87-L110 VanDerWaalsContact O-C 3.23Å; I87-L110 WeakPolarHBondContact O-CA 3.36Å; I87-L110 PolarHBondContact O-N 2.94Å; S88-L110 WeakPolarHBondContact CA-O 3.45Å; L110-H112 PolarHBondContact O-N 3.14Å; L110-N133 PolarHBondContact N-OD1 3.45Å
111	I	98	Very high	95.5	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.186	C	C	.	.			trans	-70.3	120.1	-177.2	-57.1	170.1	0	0	0	108.6	I87 L90 L106 N109 V114 L130 N133 Q134 I135	I87-I111 HydrophobicContact CG2-CG1 4.42Å; I87-I111 WeakPolarHBondContact O-CG1 3.33Å; I87-I111 PolarHBondContact O-N 2.84Å; L90-I111 HydrophobicContact CD1-CD1 3.74Å; L90-I111 HydrophobicContact CD1-CG1 3.92Å; L106-I111 HydrophobicContact CB-CD1 4.11Å; L106-I111 HydrophobicContact CD1-CD1 4.24Å; N109-I111 HydrophobicContact CB-CG1 4.33Å; I111-V114 HydrophobicContact CG2-CG1 4.23Å; I111-L130 HydrophobicContact CD1-CD2 3.99Å; I111-N133 HydrophobicContact CB-CB 4.29Å; I111-N133 WeakPolarHBondContact CB-OD1 3.39Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.31Å; I111-N133 PolarHBondContact N-OD1 3.09Å; I111-Q134 CarbonylContact O-C 3.48Å; I111-Q134 VanDerWaalsContact O-C 3.22Å; I111-Q134 WeakPolarHBondContact O-CA 3.4Å; I111-Q134 PolarHBondContact O-N 2.62Å; I111-I135 HydrophobicContact CG2-CG1 4.38Å; I111-I135 WeakPolarHBondContact O-CG1 3.22Å; I111-I135 PolarHBondContact O-N 3.24Å
112	H	95.8	Very high	95.4	Very high	104 Å²	104	35.3 Å²	35.3	48%	0.481	19%	0.187	S	C	.	.			trans	-110.7	-24.5	-178.2	66.6	-78.2	0	0	0	113.5	L110 Q134	L110-H112 PolarHBondContact O-N 3.14Å; H112-Q134 WeakPolarHBondContact CA-O 3.28Å; H112-Q134 HydrophobicContact CB-CB 4.18Å
113	L	93.5	Very high	95.2	Very high	85 Å²	85	39.4 Å²	39.4	45%	0.445	21%	0.205	S	C	.	.			trans	-126	131.2	-179.8	-176.8	68.8	0	0	0	109.8	T115 M118	L113-T115 HydrophobicContact CD2-CG2 3.88Å; L113-T115 HydrophobicContact CG-CG2 3.94Å; L113-M118 WeakPolarHBondContact O-CE 3.3Å
114	V	94.1	Very high	95.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.			trans	-119.1	125.1	170	-82.5	0	0	0	0	108.4	I111 M118 F119 I135 I138 T142	I111-V114 HydrophobicContact CG2-CG1 4.23Å; V114-M118 HydrophobicContact CG1-SD 4.09Å; V114-F119 HydrophobicContact CG1-CE2 4.04Å; V114-F119 HydrophobicContact CG1-CZ 4.23Å; V114-I135 HydrophobicContact CG1-CD1 4.02Å; V114-I135 HydrophobicContact CG2-CD1 4.47Å; V114-I135 HydrophobicContact CG2-CG2 3.81Å; V114-I138 HydrophobicContact CG2-CG1 4.36Å; V114-T142 HydrophobicContact CB-CG2 3.78Å; V114-T142 HydrophobicContact CG2-CG2 3.86Å
115	T	90.8	Very high	95.1	Very high	39 Å²	39	40.5 Å²	40.5	24%	0.239	21%	0.21	C	C	.	.			trans	-114	155.9	-177.8	60.7	0	0	0	0	110.8	L113 D117 M118	L113-T115 HydrophobicContact CD2-CG2 3.88Å; L113-T115 HydrophobicContact CG-CG2 3.94Å; T115-D117 PolarHBondContact O-N 2.98Å; T115-D117 VanDerWaalsContact O-N 3.1Å; T115-M118 VanDerWaalsContact O-CB 3.3Å; T115-M118 WeakPolarHBondContact O-CB 3.41Å; T115-M118 PolarHBondContact O-N 2.95Å
116	P	88	Confident	95.1	Very high	45 Å²	45	46.1 Å²	46.1	29%	0.292	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.7	-179.7	-28.5	36.5	0	0	0	115.6
117	D	86.8	Confident	95.1	Very high	80 Å²	80	47.4 Å²	47.4	43%	0.428	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-8	-179	-67	-58.3	0	0	0	113.8	T115 F119 R120	T115-D117 PolarHBondContact O-N 2.98Å; T115-D117 VanDerWaalsContact O-N 3.1Å; D117-F119 PolarHBondContact O-N 3.06Å; D117-R120 PolarHBondContact O-N 2.8Å; D117-R120 IonicContact OD1-NH1 3.14Å
118	M	91.8	Very high	95.2	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.049	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-39.6	-173.6	-175.8	169.1	-73.1	0	0	112.5	L90 F95 L113 V114 T115	L90-M118 HydrophobicContact CB-CE 3.93Å; L90-M118 HydrophobicContact CB-CG 3.93Å; L90-M118 HydrophobicContact CB-SD 3.98Å; L90-M118 HydrophobicContact CD1-CE 4.38Å; L90-M118 HydrophobicContact CD1-SD 4.04Å; L90-M118 HydrophobicContact CD2-CG 4.15Å; L90-M118 HydrophobicContact CD2-SD 4.16Å; L90-M118 HydrophobicContact CG-SD 4.28Å; F95-M118 VanDerWaalsContact CD2-O 3.31Å; F95-M118 WeakPolarHBondContact CD2-O 3.44Å; L113-M118 WeakPolarHBondContact O-CE 3.3Å; V114-M118 HydrophobicContact CG1-SD 4.09Å; T115-M118 VanDerWaalsContact O-CB 3.3Å; T115-M118 WeakPolarHBondContact O-CB 3.41Å; T115-M118 PolarHBondContact O-N 2.95Å
119	F	94.3	Very high	95.2	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.013	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	13.6	-177.3	-57	-65.7	0	0	0	113.4	F95 L106 V114 D117 G121 L122 L128 L130 F143 L146	F95-F119 HydrophobicContact CE2-CD1 4.5Å; L106-F119 HydrophobicContact CD1-CE1 4.25Å; V114-F119 HydrophobicContact CG1-CE2 4.04Å; V114-F119 HydrophobicContact CG1-CZ 4.23Å; D117-F119 PolarHBondContact O-N 3.06Å; F119-G121 PolarHBondContact O-N 3.11Å; F119-L122 HydrophobicContact CB-CD1 4.12Å; F119-L122 HydrophobicContact CD1-CD1 4.09Å; F119-L122 WeakPolarHBondContact O-CB 3.1Å; F119-L122 PolarHBondContact O-N 3.32Å; F119-L128 HydrophobicContact CD1-CD2 4.34Å; F119-L128 HydrophobicContact CD2-CD2 4.5Å; F119-L128 HydrophobicContact CE1-CD1 4.17Å; F119-L128 HydrophobicContact CE1-CD2 4.17Å; F119-L128 HydrophobicContact CE2-CD2 4.34Å; F119-L128 HydrophobicContact CZ-CD2 4.18Å; F119-L130 HydrophobicContact CE2-CD1 4.31Å; F119-L130 HydrophobicContact CZ-CD1 3.91Å; F119-L130 HydrophobicContact CZ-CD2 4.2Å; F119-F143 HydrophobicContact CD2-CD1 4.13Å; F119-F143 HydrophobicContact CD2-CE1 4.34Å; F119-F143 HydrophobicContact CE2-CD1 4.28Å; F119-F143 HydrophobicContact CE2-CE1 4.02Å; F119-L146 HydrophobicContact CB-CD1 4.08Å; F119-L146 HydrophobicContact CB-CD2 4.09Å; F119-L146 HydrophobicContact CB-CG 4.38Å; F119-L146 HydrophobicContact CG-CD1 4.46Å
120	R	92.9	Very high	95.2	Very high	145 Å²	145	46.7 Å²	46.7	55%	0.547	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	135.3	-179.1	-170.9	176	175.8	-177	-3.9	110.7	F95 L96 D117	F95-R120 CarbonylContact C-O 3.39Å; L96-R120 HydrophobicContact CD2-CG 4.15Å; D117-R120 PolarHBondContact O-N 2.8Å; D117-R120 IonicContact OD1-NH1 3.14Å
121	G	92.9	Very high	95.2	Very high	16 Å²	16	43.8 Å²	43.8	17%	0.165	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.1	-13.6	-176.6	0	0	0	0	0	114.1	G99 F119 E123	G99-G121 VanDerWaalsContact CA-O 3.24Å; G99-G121 WeakPolarHBondContact CA-O 3.43Å; F119-G121 PolarHBondContact O-N 3.11Å; G121-E123 VanDerWaalsContact C-N 3.26Å; G121-E123 PolarHBondContact O-N 3.39Å
122	L	96.6	Very high	95.2	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.221	C	C	.	.			trans	-83.7	54.8	-179.5	-62.7	-178.5	0	0	0	113.1	F95 Q98 L101 L104 F119 H124 L125 L146	F95-L122 HydrophobicContact CB-CD1 4.09Å; F95-L122 HydrophobicContact CB-CD2 3.63Å; F95-L122 HydrophobicContact CB-CG 3.67Å; F95-L122 HydrophobicContact CD1-CD2 4.2Å; F95-L122 HydrophobicContact CD2-CD1 4.09Å; F95-L122 HydrophobicContact CG-CD1 4.01Å; F95-L122 HydrophobicContact CG-CD2 4.02Å; F95-L122 HydrophobicContact CG-CG 4.12Å; Q98-L122 HydrophobicContact CB-CD2 3.93Å; L101-L122 HydrophobicContact CB-CD2 3.9Å; L101-L122 HydrophobicContact CD2-CD2 3.64Å; L101-L122 HydrophobicContact CG-CD2 4.4Å; L104-L122 HydrophobicContact CD2-CD1 3.94Å; F119-L122 HydrophobicContact CB-CD1 4.12Å; F119-L122 HydrophobicContact CD1-CD1 4.09Å; F119-L122 WeakPolarHBondContact O-CB 3.1Å; F119-L122 PolarHBondContact O-N 3.32Å; L122-H124 VanDerWaalsContact C-N 3.29Å; L122-H124 PolarHBondContact O-N 3.1Å; L122-L125 HydrophobicContact CB-CB 4Å; L122-L125 HydrophobicContact CB-CD2 4.29Å; L122-L125 HydrophobicContact CD1-CD2 3.94Å; L122-L125 WeakPolarHBondContact O-CB 3.32Å; L122-L125 PolarHBondContact O-N 3.07Å; L122-L146 HydrophobicContact CB-CD2 3.62Å; L122-L146 WeakPolarHBondContact O-CD2 3.17Å
123	E	94.6	Very high	95.4	Very high	117 Å²	117	40.4 Å²	40.4	55%	0.547	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-20.3	-169.9	-61.2	-177.8	177.7	0	0	115.5	G121 R148	G121-E123 VanDerWaalsContact C-N 3.26Å; G121-E123 PolarHBondContact O-N 3.39Å; E123-R148 PolarHBondContact O-NH1 3.35Å
124	H	97.8	Very high	95.6	Very high	53 Å²	53	41 Å²	41	25%	0.245	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	4.6	178.9	-63.3	85.7	0	0	0	113.6	G99 L101 L102 L122 R126 R148	G99-H124 WeakPolarHBondContact O-CB 3.44Å; G99-H124 PolarHBondContact O-ND1 3.37Å; L101-H124 CarbonylContact O-C 3.35Å; L101-H124 VanDerWaalsContact O-C 3.23Å; L102-H124 HydrophobicContact CD2-CB 4.09Å; L102-H124 WeakPolarHBondContact CD2-O 3.38Å; L122-H124 VanDerWaalsContact C-N 3.29Å; L122-H124 PolarHBondContact O-N 3.1Å; H124-R126 WeakPolarHBondContact O-CG 3.07Å; H124-R126 PolarHBondContact O-N 2.96Å; H124-R148 PolarHBondContact CD2-NH1 3.46Å; H124-R148 VanDerWaalsContact CD2-NH1 3.33Å; H124-R148 PolarHBondContact NE2-NH1 3.42Å; H124-R148 VanDerWaalsContact NE2-NH1 3.17Å
125	L	98.5	Very high	95.8	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.			trans	-61.3	130.8	-178.2	-163.3	76.3	0	0	0	110.2	L101 L104 L122 L128 L146 R148 L149	L101-L125 HydrophobicContact CB-CD1 4.36Å; L101-L125 HydrophobicContact CD2-CD1 4.04Å; L101-L125 HydrophobicContact CG-CD1 4.05Å; L101-L125 WeakPolarHBondContact O-CA 3.24Å; L101-L125 PolarHBondContact O-N 2.72Å; L104-L125 HydrophobicContact CB-CD1 3.88Å; L122-L125 HydrophobicContact CB-CB 4Å; L122-L125 HydrophobicContact CB-CD2 4.29Å; L122-L125 HydrophobicContact CD1-CD2 3.94Å; L122-L125 WeakPolarHBondContact O-CB 3.32Å; L122-L125 PolarHBondContact O-N 3.07Å; L125-L128 HydrophobicContact CD2-CB 4.03Å; L125-L128 HydrophobicContact CD2-CD1 4.38Å; L125-L128 HydrophobicContact CD2-CD2 4.5Å; L125-L146 HydrophobicContact CB-CD2 4.46Å; L125-L146 HydrophobicContact CD2-CD1 4.46Å; L125-L146 HydrophobicContact CD2-CD2 4.23Å; L125-R148 CarbonylContact O-C 3.45Å; L125-L149 HydrophobicContact CB-CD1 4.46Å; L125-L149 HydrophobicContact CD2-CD1 3.94Å; L125-L149 HydrophobicContact CG-CD1 4.07Å; L125-L149 WeakPolarHBondContact O-CA 3.13Å; L125-L149 PolarHBondContact O-N 3Å
126	R	98.7	Very high	96.1	Very high	122 Å²	122	41.6 Å²	41.6	46%	0.46	21%	0.205	S	C	.	.			trans	-109.5	-37.3	-179.9	-60	-173	-176.6	-176.2	1.5	111.5	L102 H124 Q150 E151	L102-R126 WeakPolarHBondContact O-CA 3.35Å; L102-R126 PolarHBondContact O-N 3.05Å; H124-R126 WeakPolarHBondContact O-CG 3.07Å; H124-R126 PolarHBondContact O-N 2.96Å; R126-Q150 HydrophobicContact CB-CG 4.49Å; R126-Q150 WeakPolarHBondContact O-CA 2.99Å; R126-Q150 PolarHBondContact O-N 2.97Å; R126-E151 PolarHBondContact O-N 2.9Å
127	I	98.9	Very high	96.5	Very high	26 Å²	26	45.9 Å²	45.9	13%	0.133	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.8	-175.6	-54.3	177.7	0	0	0	109.4	L102 E103 L104 Y129 E151	L102-I127 PolarHBondContact O-N 3.22Å; L102-I127 VanDerWaalsContact O-N 3.1Å; E103-I127 WeakPolarHBondContact CA-O 3.12Å; E103-I127 HydrophobicContact CG-CB 4.1Å; E103-I127 HydrophobicContact CG-CG2 4.41Å; L104-I127 PolarHBondContact N-O 3.25Å; I127-Y129 HydrophobicContact CB-CE2 4.47Å; I127-Y129 HydrophobicContact CG2-CD2 3.88Å; I127-Y129 HydrophobicContact CG2-CE1 4.07Å; I127-Y129 HydrophobicContact CG2-CE2 3.31Å; I127-Y129 HydrophobicContact CG2-CG 4.48Å; I127-Y129 VanDerWaalsContact CG2-CZ 3.42Å; I127-E151 HydrophobicContact CB-CB 4.49Å; I127-E151 HydrophobicContact CG1-CB 4.22Å; I127-E151 HydrophobicContact CG1-CG 4.3Å; I127-E151 HydrophobicContact CG2-CB 4.15Å
128	L	98.8	Very high	97	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114.9	175.5	179.4	56.5	0	0	0	109.9	L104 F119 L125 L130 F143 L146 L149 E151 L152 H153	L104-L128 HydrophobicContact CB-CD1 4.08Å; L104-L128 HydrophobicContact CD2-CD1 3.95Å; L104-L128 HydrophobicContact CG-CD1 4.03Å; F119-L128 HydrophobicContact CD1-CD2 4.34Å; F119-L128 HydrophobicContact CD2-CD2 4.5Å; F119-L128 HydrophobicContact CE1-CD1 4.17Å; F119-L128 HydrophobicContact CE1-CD2 4.17Å; F119-L128 HydrophobicContact CE2-CD2 4.34Å; F119-L128 HydrophobicContact CZ-CD2 4.18Å; L125-L128 HydrophobicContact CD2-CB 4.03Å; L125-L128 HydrophobicContact CD2-CD1 4.38Å; L125-L128 HydrophobicContact CD2-CD2 4.5Å; L128-L130 HydrophobicContact CD1-CG 4.24Å; L128-L130 HydrophobicContact CD2-CD1 3.89Å; L128-L130 HydrophobicContact CD2-CG 4.47Å; L128-L130 HydrophobicContact CG-CD1 4.03Å; L128-L130 HydrophobicContact CG-CG 4.09Å; L128-F143 HydrophobicContact CD2-CD1 4.36Å; L128-F143 HydrophobicContact CD2-CE1 4.23Å; L128-L146 HydrophobicContact CD2-CD1 4.11Å; L128-L149 HydrophobicContact CB-CD1 3.86Å; L128-E151 PolarHBondContact N-O 3.15Å; L128-L152 HydrophobicContact CB-CD1 4.19Å; L128-L152 HydrophobicContact CD2-CD1 4Å; L128-L152 HydrophobicContact CG-CD1 4.16Å; L128-H153 PolarHBondContact O-N 3.03Å; L128-H153 VanDerWaalsContact O-N 3.08Å
129	Y	98.9	Very high	97.2	Very high	61 Å²	61	46.5 Å²	46.5	24%	0.239	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.3	173.7	-55.9	-84	0	0	0	111.2	E103 L104 A105 L106 N107 I127 H153	E103-Y129 HydrophobicContact CG-CE2 4.11Å; L104-Y129 PolarHBondContact O-N 3.27Å; A105-Y129 HydrophobicContact CB-CD2 3.93Å; L106-Y129 CarbonylContact C-O 3.57Å; L106-Y129 VanDerWaalsContact CA-O 3.32Å; L106-Y129 WeakPolarHBondContact CA-O 3.31Å; L106-Y129 WeakPolarHBondContact CB-O 3.39Å; L106-Y129 PolarHBondContact N-O 2.98Å; N107-Y129 PolarHBondContact N-O 2.99Å; I127-Y129 HydrophobicContact CB-CE2 4.47Å; I127-Y129 HydrophobicContact CG2-CD2 3.88Å; I127-Y129 HydrophobicContact CG2-CE1 4.07Å; I127-Y129 HydrophobicContact CG2-CE2 3.31Å; I127-Y129 HydrophobicContact CG2-CG 4.48Å; I127-Y129 VanDerWaalsContact CG2-CZ 3.42Å; Y129-H153 HydrophobicContact CD1-CB 3.88Å; Y129-H153 AromaticContact CD1-CD2 3.44Å; Y129-H153 VanDerWaalsContact CD1-CD2 3.44Å; Y129-H153 WeakPolarHBondContact CD1-CD2 3.38Å; Y129-H153 AromaticContact CD1-CG 3.62Å; Y129-H153 AromaticContact CE1-CD2 3.43Å; Y129-H153 VanDerWaalsContact CE1-CD2 3.43Å; Y129-H153 WeakPolarHBondContact CE1-CD2 3.35Å; Y129-H153 AromaticContact CE1-CG 3.88Å; Y129-H153 AromaticContact CE1-NE2 3.54Å
130	L	98.7	Very high	97.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.231	C	C	.	.			trans	-123.5	11.6	173.6	-72.5	167.5	0	0	0	111.8	L106 I111 F119 L128 N133 I135 F143 H153 L154 N157	L106-L130 HydrophobicContact CB-CD2 4.01Å; L106-L130 HydrophobicContact CD1-CD2 4.1Å; I111-L130 HydrophobicContact CD1-CD2 3.99Å; F119-L130 HydrophobicContact CE2-CD1 4.31Å; F119-L130 HydrophobicContact CZ-CD1 3.91Å; F119-L130 HydrophobicContact CZ-CD2 4.2Å; L128-L130 HydrophobicContact CD1-CG 4.24Å; L128-L130 HydrophobicContact CD2-CD1 3.89Å; L128-L130 HydrophobicContact CD2-CG 4.47Å; L128-L130 HydrophobicContact CG-CD1 4.03Å; L128-L130 HydrophobicContact CG-CG 4.09Å; L130-N133 PolarHBondContact O-ND2 3.35Å; L130-I135 HydrophobicContact CB-CD1 4.24Å; L130-I135 HydrophobicContact CD1-CD1 4.39Å; L130-F143 HydrophobicContact CD1-CE1 4.17Å; L130-H153 CarbonylContact C-O 3.07Å; L130-H153 WeakPolarHBondContact CA-O 3.37Å; L130-H153 PolarHBondContact N-O 3.13Å; L130-L154 HydrophobicContact CB-CD2 3.84Å; L130-L154 HydrophobicContact CD1-CD2 3.93Å; L130-N157 PolarHBondContact O-ND2 3.04Å
131	A	98.8	Very high	97.2	Very high	12 Å²	12	46.1 Å²	46.1	10%	0.099	22%	0.222	C	C	.	.			trans	-62.3	147.7	-178.8	0	0	0	0	0	112.7	N107 G108 H153 Q155	N107-A131 CarbonylContact C-O 3.23Å; N107-A131 WeakPolarHBondContact CA-O 3.48Å; N107-A131 HydrophobicContact CB-CB 4.24Å; N107-A131 WeakPolarHBondContact CB-O 3.41Å; G108-A131 PolarHBondContact N-O 3.16Å; A131-H153 PolarHBondContact N-O 2.7Å; A131-H153 VanDerWaalsContact N-O 3.14Å; A131-Q155 CarbonylContact C-O 3.04Å; A131-Q155 WeakPolarHBondContact CA-O 3.27Å; A131-Q155 VanDerWaalsContact CB-CD 3.48Å; A131-Q155 HydrophobicContact CB-CG 3.86Å; A131-Q155 WeakPolarHBondContact CB-O 3.3Å
132	G	98.6	Very high	97.3	Very high	24 Å²	24	45.4 Å²	45.4	25%	0.247	21%	0.214	C	C	.	.	S	Bend	trans	66	40.9	177.8	0	0	0	0	0	113.2	G108 N109 Q155 E156	G108-G132 VanDerWaalsContact CA-O 3.27Å; G108-G132 WeakPolarHBondContact CA-O 3.48Å; G108-G132 PolarHBondContact N-O 3.45Å; N109-G132 PolarHBondContact N-O 2.91Å; G132-Q155 PolarHBondContact N-O 2.76Å; G132-E156 WeakPolarHBondContact CA-O 3.37Å; G132-E156 PolarHBondContact N-O 3.3Å
133	N	98.8	Very high	97.3	Very high	9 Å²	9	45.3 Å²	45.3	5%	0.048	21%	0.213	C	C	.	.	S	Bend	trans	-114.3	-167.1	173.5	-84.4	-81.4	0	0	0	110	L106 N109 L110 I111 L130 I135 N157	L106-N133 PolarHBondContact O-ND2 3.08Å; N109-N133 WeakPolarHBondContact CA-OD1 3.45Å; N109-N133 WeakPolarHBondContact CB-OD1 3.21Å; N109-N133 PolarHBondContact O-OD1 3.4Å; L110-N133 PolarHBondContact N-OD1 3.45Å; I111-N133 HydrophobicContact CB-CB 4.29Å; I111-N133 WeakPolarHBondContact CB-OD1 3.39Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.31Å; I111-N133 PolarHBondContact N-OD1 3.09Å; L130-N133 PolarHBondContact O-ND2 3.35Å; N133-I135 HydrophobicContact CB-CD1 4.49Å; N133-I135 HydrophobicContact CB-CG1 4.28Å; N133-N157 VanDerWaalsContact CA-OD1 3.28Å; N133-N157 WeakPolarHBondContact CA-OD1 3.26Å; N133-N157 WeakPolarHBondContact CB-OD1 3.22Å; N133-N157 PolarHBondContact N-OD1 3.31Å; N133-N157 PolarHBondContact O-OD1 3.1Å
134	Q	98.1	Very high	97.1	Very high	97 Å²	97	48.2 Å²	48.2	45%	0.453	22%	0.219	S	C	.	.			trans	-115.4	26.8	-177.8	-60	179.7	29.2	0	0	112.3	I111 H112 T136 N157	I111-Q134 CarbonylContact O-C 3.48Å; I111-Q134 VanDerWaalsContact O-C 3.22Å; I111-Q134 WeakPolarHBondContact O-CA 3.4Å; I111-Q134 PolarHBondContact O-N 2.62Å; H112-Q134 WeakPolarHBondContact CA-O 3.28Å; H112-Q134 HydrophobicContact CB-CB 4.18Å; Q134-T136 PolarHBondContact O-N 3.05Å; Q134-N157 PolarHBondContact N-OD1 3.44Å
135	I	98.3	Very high	96.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.224	C	C	.	.			trans	-67.2	126	-175.5	-58.3	169.5	0	0	0	109.2	I111 V114 L130 N133 I138 L154 N157 S158 I159	I111-I135 HydrophobicContact CG2-CG1 4.38Å; I111-I135 WeakPolarHBondContact O-CG1 3.22Å; I111-I135 PolarHBondContact O-N 3.24Å; V114-I135 HydrophobicContact CG1-CD1 4.02Å; V114-I135 HydrophobicContact CG2-CD1 4.47Å; V114-I135 HydrophobicContact CG2-CG2 3.81Å; L130-I135 HydrophobicContact CB-CD1 4.24Å; L130-I135 HydrophobicContact CD1-CD1 4.39Å; N133-I135 HydrophobicContact CB-CD1 4.49Å; N133-I135 HydrophobicContact CB-CG1 4.28Å; I135-I138 HydrophobicContact CG2-CG1 4.15Å; I135-L154 HydrophobicContact CD1-CD2 4.02Å; I135-N157 HydrophobicContact CB-CB 4.33Å; I135-N157 WeakPolarHBondContact CB-OD1 3.3Å; I135-N157 WeakPolarHBondContact CG1-OD1 3.36Å; I135-N157 PolarHBondContact N-OD1 3.37Å; I135-S158 CarbonylContact O-C 3.05Å; I135-S158 WeakPolarHBondContact O-CA 3.45Å; I135-S158 PolarHBondContact O-N 3.49Å; I135-I159 HydrophobicContact CB-CG1 4.29Å; I135-I159 HydrophobicContact CG2-CG1 4.07Å; I135-I159 WeakPolarHBondContact O-CA 3.3Å; I135-I159 WeakPolarHBondContact O-CG1 3.42Å; I135-I159 PolarHBondContact O-N 3.37Å
136	T	97.3	Very high	96.7	Very high	53 Å²	53	47.3 Å²	47.3	33%	0.325	22%	0.224	S	C	.	.			trans	-105.4	-31.1	-177.8	54.8	0	0	0	0	114	Q134 S158 I159 E160	Q134-T136 PolarHBondContact O-N 3.05Å; T136-S158 WeakPolarHBondContact CA-O 3.11Å; T136-I159 CarbonylContact O-C 3.13Å; T136-I159 WeakPolarHBondContact O-CA 3.32Å; T136-E160 PolarHBondContact O-N 3.44Å
137	R	96.6	Very high	96.5	Very high	135 Å²	135	47.4 Å²	47.4	51%	0.509	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	142	-177.7	-58.6	-172.5	177.6	101.8	11.6	110.1	E160 L161	R137-E160 IonicContact NH2-OE2 3.43Å; R137-L161 WeakPolarHBondContact CA-O 3.41Å; R137-L161 HydrophobicContact CG-CB 4.26Å
138	I	96.9	Very high	96.4	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	114.3	171.6	-56.8	179.5	0	0	0	107.5	V114 I135 T142 F143 L154 I159 L161 L162 A163 A166	V114-I138 HydrophobicContact CG2-CG1 4.36Å; I135-I138 HydrophobicContact CG2-CG1 4.15Å; I138-T142 HydrophobicContact CG2-CG2 4.12Å; I138-F143 HydrophobicContact CD1-CE2 4.29Å; I138-F143 HydrophobicContact CD1-CZ 4.39Å; I138-F143 HydrophobicContact CG2-CD2 4.49Å; I138-F143 HydrophobicContact CG2-CE2 3.77Å; I138-F143 HydrophobicContact CG2-CZ 4.42Å; I138-L154 HydrophobicContact CD1-CD1 3.69Å; I138-L154 HydrophobicContact CD1-CD2 4.27Å; I138-I159 HydrophobicContact CD1-CD1 3.75Å; I138-I159 HydrophobicContact CD1-CG1 4.45Å; I138-I159 HydrophobicContact CG1-CD1 4.41Å; I138-I159 HydrophobicContact CG1-CG2 4.46Å; I138-L161 PolarHBondContact N-O 3.12Å; I138-L162 HydrophobicContact CB-CD1 3.8Å; I138-L162 HydrophobicContact CD1-CD1 4.11Å; I138-L162 HydrophobicContact CG1-CD1 4.46Å; I138-L162 HydrophobicContact CG2-CD1 4Å; I138-A163 WeakPolarHBondContact O-CB 3.24Å; I138-A163 PolarHBondContact O-N 3.3Å; I138-A166 HydrophobicContact CB-CB 4.46Å; I138-A166 HydrophobicContact CG2-CB 3.76Å
139	Q	95.2	Very high	96.4	Very high	103 Å²	103	51.9 Å²	51.9	48%	0.481	25%	0.245	S	C	.	.			trans	-83	166.9	-177	-64.5	-179.1	-7.7	0	0	111.5	H141 T142 A166	Q139-H141 PolarHBondContact O-N 3.02Å; Q139-T142 PolarHBondContact N-OG1 3.13Å; Q139-T142 VanDerWaalsContact N-OG1 3.14Å; Q139-T142 WeakPolarHBondContact O-CB 3.28Å; Q139-T142 PolarHBondContact O-N 3.01Å; Q139-T142 PolarHBondContact O-OG1 3.47Å; Q139-A166 WeakPolarHBondContact O-CA 3.41Å
140	D	94.6	Very high	96.4	Very high	63 Å²	63	53 Å²	53	34%	0.337	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	137.4	176.2	-70.3	-28.5	0	0	0	111.3	T142 A163 E164 H165 A166	D140-T142 PolarHBondContact O-N 3.39Å; D140-A163 WeakPolarHBondContact OD1-CB 3.5Å; D140-E164 PolarHBondContact OD1-N 3.09Å; D140-H165 HydrophobicContact CB-CB 4.07Å; D140-H165 VanDerWaalsContact OD1-CA 3.31Å; D140-H165 WeakPolarHBondContact OD1-CA 3.37Å; D140-H165 WeakPolarHBondContact OD1-CB 3.39Å; D140-H165 PolarHBondContact OD1-N 3.36Å; D140-A166 PolarHBondContact OD1-N 3.11Å
141	H	93.9	Very high	96.4	Very high	77 Å²	77	55.9 Å²	55.9	36%	0.356	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	18.5	177.5	-41.7	94.9	0	0	0	115.3	Q139 F143 R144 H165	Q139-H141 PolarHBondContact O-N 3.02Å; H141-F143 PolarHBondContact O-N 2.98Å; H141-R144 HydrophobicContact CB-CB 4.16Å; H141-R144 WeakPolarHBondContact O-CB 3.39Å; H141-R144 PolarHBondContact O-N 2.94Å; H141-H165 PolarHBondContact N-O 2.98Å
142	T	95.1	Very high	96.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-37.8	179	-64.7	0	0	0	0	112.8	V114 I138 Q139 D140	V114-T142 HydrophobicContact CB-CG2 3.78Å; V114-T142 HydrophobicContact CG2-CG2 3.86Å; I138-T142 HydrophobicContact CG2-CG2 4.12Å; Q139-T142 PolarHBondContact N-OG1 3.13Å; Q139-T142 VanDerWaalsContact N-OG1 3.14Å; Q139-T142 WeakPolarHBondContact O-CB 3.28Å; Q139-T142 PolarHBondContact O-N 3.01Å; Q139-T142 PolarHBondContact O-OG1 3.47Å; D140-T142 PolarHBondContact O-N 3.39Å
143	F	95.8	Very high	96.4	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	23.2	-178.5	-56	-70.9	0	0	0	113.5	F119 L128 L130 I138 H141 G145 L146 L152 L154 L167 L170	F119-F143 HydrophobicContact CD2-CD1 4.13Å; F119-F143 HydrophobicContact CD2-CE1 4.34Å; F119-F143 HydrophobicContact CE2-CD1 4.28Å; F119-F143 HydrophobicContact CE2-CE1 4.02Å; L128-F143 HydrophobicContact CD2-CD1 4.36Å; L128-F143 HydrophobicContact CD2-CE1 4.23Å; L130-F143 HydrophobicContact CD1-CE1 4.17Å; I138-F143 HydrophobicContact CD1-CE2 4.29Å; I138-F143 HydrophobicContact CD1-CZ 4.39Å; I138-F143 HydrophobicContact CG2-CD2 4.49Å; I138-F143 HydrophobicContact CG2-CE2 3.77Å; I138-F143 HydrophobicContact CG2-CZ 4.42Å; H141-F143 PolarHBondContact O-N 2.98Å; F143-G145 PolarHBondContact O-N 2.95Å; F143-L146 HydrophobicContact CB-CD1 4.11Å; F143-L146 HydrophobicContact CD1-CD1 4.06Å; F143-L146 WeakPolarHBondContact O-CB 3.23Å; F143-L146 PolarHBondContact O-N 3.24Å; F143-L152 HydrophobicContact CD2-CD2 4.13Å; F143-L152 HydrophobicContact CE1-CD1 4.14Å; F143-L152 HydrophobicContact CE1-CD2 4.31Å; F143-L152 HydrophobicContact CE2-CD2 3.84Å; F143-L152 HydrophobicContact CG-CD2 4.47Å; F143-L152 HydrophobicContact CZ-CD1 4.28Å; F143-L152 HydrophobicContact CZ-CD2 3.95Å; F143-L154 HydrophobicContact CE2-CD1 4.43Å; F143-L154 HydrophobicContact CZ-CD1 4.17Å; F143-L154 HydrophobicContact CZ-CD2 4.46Å; F143-L167 HydrophobicContact CD2-CD2 3.86Å; F143-L167 HydrophobicContact CE2-CD2 3.95Å; F143-L170 HydrophobicContact CB-CD1 3.99Å; F143-L170 HydrophobicContact CB-CD2 3.86Å; F143-L170 HydrophobicContact CB-CG 4.14Å; F143-L170 HydrophobicContact CD2-CD1 4.21Å; F143-L170 HydrophobicContact CG-CD1 4.31Å
144	R	91.8	Very high	96.4	Very high	178 Å²	178	54.6 Å²	54.6	67%	0.672	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	134.9	-179.1	-177.9	179.6	179.4	-176.7	0.7	110.7	H141	H141-R144 HydrophobicContact CB-CB 4.16Å; H141-R144 WeakPolarHBondContact O-CB 3.39Å; H141-R144 PolarHBondContact O-N 2.94Å
145	G	90.3	Very high	96.4	Very high	33 Å²	33	51.7 Å²	51.7	34%	0.34	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	-13.7	179.7	0	0	0	0	0	113.9	F143 Q147	F143-G145 PolarHBondContact O-N 2.95Å; G145-Q147 PolarHBondContact O-N 3.24Å
146	L	96.4	Very high	96.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.259	C	S	.	.			trans	-82.4	51.4	175.5	-53.1	-173.6	0	0	0	112	F119 L122 L125 L128 F143 R148 L149 L170	F119-L146 HydrophobicContact CB-CD1 4.08Å; F119-L146 HydrophobicContact CB-CD2 4.09Å; F119-L146 HydrophobicContact CB-CG 4.38Å; F119-L146 HydrophobicContact CG-CD1 4.46Å; L122-L146 HydrophobicContact CB-CD2 3.62Å; L122-L146 WeakPolarHBondContact O-CD2 3.17Å; L125-L146 HydrophobicContact CB-CD2 4.46Å; L125-L146 HydrophobicContact CD2-CD1 4.46Å; L125-L146 HydrophobicContact CD2-CD2 4.23Å; L128-L146 HydrophobicContact CD2-CD1 4.11Å; F143-L146 HydrophobicContact CB-CD1 4.11Å; F143-L146 HydrophobicContact CD1-CD1 4.06Å; F143-L146 WeakPolarHBondContact O-CB 3.23Å; F143-L146 PolarHBondContact O-N 3.24Å; L146-R148 PolarHBondContact O-N 2.94Å; L146-L149 HydrophobicContact CB-CB 4.01Å; L146-L149 HydrophobicContact CB-CD2 4.36Å; L146-L149 HydrophobicContact CD1-CD2 4.1Å; L146-L149 VanDerWaalsContact O-CB 3.26Å; L146-L149 WeakPolarHBondContact O-CB 3.27Å; L146-L149 PolarHBondContact O-N 2.82Å; L146-L149 VanDerWaalsContact O-N 3.1Å; L146-L170 HydrophobicContact CB-CD2 3.88Å; L146-L170 WeakPolarHBondContact O-CD2 3.45Å
147	Q	94	Very high	96.5	Very high	125 Å²	125	54 Å²	54	58%	0.584	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.3	-171.1	-64.3	-179.8	-0.8	0	0	113.8	G145 S172	G145-Q147 PolarHBondContact O-N 3.24Å; Q147-S172 VanDerWaalsContact O-CB 3.24Å; Q147-S172 WeakPolarHBondContact O-CB 3.3Å; Q147-S172 PolarHBondContact O-OG 3.43Å
148	R	97.7	Very high	96.6	Very high	119 Å²	119	49.8 Å²	49.8	45%	0.449	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	3.6	178.9	-67.2	-166.2	174.1	93.3	-6.2	113.7	E123 H124 L125 L146 Q150	E123-R148 PolarHBondContact O-NH1 3.35Å; H124-R148 PolarHBondContact CD2-NH1 3.46Å; H124-R148 VanDerWaalsContact CD2-NH1 3.33Å; H124-R148 PolarHBondContact NE2-NH1 3.42Å; H124-R148 VanDerWaalsContact NE2-NH1 3.17Å; L125-R148 CarbonylContact O-C 3.45Å; L146-R148 PolarHBondContact O-N 2.94Å; R148-Q150 PolarHBondContact O-N 3.08Å
149	L	98.6	Very high	96.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.236	C	C	.	.			trans	-64	127.9	-179.7	-163.6	72.2	0	0	0	109.7	L125 L128 L146 L152 L170 S172 L173	L125-L149 HydrophobicContact CB-CD1 4.46Å; L125-L149 HydrophobicContact CD2-CD1 3.94Å; L125-L149 HydrophobicContact CG-CD1 4.07Å; L125-L149 WeakPolarHBondContact O-CA 3.13Å; L125-L149 PolarHBondContact O-N 3Å; L128-L149 HydrophobicContact CB-CD1 3.86Å; L146-L149 HydrophobicContact CB-CB 4.01Å; L146-L149 HydrophobicContact CB-CD2 4.36Å; L146-L149 HydrophobicContact CD1-CD2 4.1Å; L146-L149 VanDerWaalsContact O-CB 3.26Å; L146-L149 WeakPolarHBondContact O-CB 3.27Å; L146-L149 PolarHBondContact O-N 2.82Å; L146-L149 VanDerWaalsContact O-N 3.1Å; L149-L152 HydrophobicContact CD2-CB 4.08Å; L149-L152 HydrophobicContact CD2-CD1 4.41Å; L149-L170 HydrophobicContact CB-CD2 4.2Å; L149-L170 HydrophobicContact CD2-CD2 3.98Å; L149-S172 CarbonylContact O-C 3.6Å; L149-L173 HydrophobicContact CB-CD1 4.42Å; L149-L173 HydrophobicContact CD2-CD1 4Å; L149-L173 HydrophobicContact CG-CD1 4.01Å; L149-L173 WeakPolarHBondContact O-CA 3.4Å; L149-L173 PolarHBondContact O-N 3.2Å
150	Q	98.7	Very high	96.7	Very high	85 Å²	85	50 Å²	50	40%	0.397	24%	0.237	S	C	.	.			trans	-107.5	-34.8	-178.9	-65.6	178.9	-24.3	0	0	110.8	R126 R148 A174 L175	R126-Q150 HydrophobicContact CB-CG 4.49Å; R126-Q150 WeakPolarHBondContact O-CA 2.99Å; R126-Q150 PolarHBondContact O-N 2.97Å; R148-Q150 PolarHBondContact O-N 3.08Å; Q150-A174 WeakPolarHBondContact O-CA 3.28Å; Q150-A174 PolarHBondContact O-N 2.99Å; Q150-L175 PolarHBondContact O-N 3.03Å
151	E	98.8	Very high	96.7	Very high	61 Å²	61	51.1 Å²	51.1	29%	0.285	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	129.7	-179.1	-55.5	-170.1	-162.1	0	0	111.7	R126 I127 L128 H153 L175	R126-E151 PolarHBondContact O-N 2.9Å; I127-E151 HydrophobicContact CB-CB 4.49Å; I127-E151 HydrophobicContact CG1-CB 4.22Å; I127-E151 HydrophobicContact CG1-CG 4.3Å; I127-E151 HydrophobicContact CG2-CB 4.15Å; L128-E151 PolarHBondContact N-O 3.15Å; E151-H153 IonicContact OE2-CE1 3.95Å; E151-H153 IonicContact OE2-NE2 3.11Å; E151-H153 PolarHBondContact OE2-NE2 3.03Å; E151-L175 WeakPolarHBondContact CA-O 3.46Å; E151-L175 HydrophobicContact CB-CB 4.44Å; E151-L175 HydrophobicContact CG-CB 4.12Å
152	L	98.8	Very high	96.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	112.8	175	180	56.3	0	0	0	109.6	L128 F143 L149 L154 L167 L170 L173 L175 L176 D177	L128-L152 HydrophobicContact CB-CD1 4.19Å; L128-L152 HydrophobicContact CD2-CD1 4Å; L128-L152 HydrophobicContact CG-CD1 4.16Å; F143-L152 HydrophobicContact CD2-CD2 4.13Å; F143-L152 HydrophobicContact CE1-CD1 4.14Å; F143-L152 HydrophobicContact CE1-CD2 4.31Å; F143-L152 HydrophobicContact CE2-CD2 3.84Å; F143-L152 HydrophobicContact CG-CD2 4.47Å; F143-L152 HydrophobicContact CZ-CD1 4.28Å; F143-L152 HydrophobicContact CZ-CD2 3.95Å; L149-L152 HydrophobicContact CD2-CB 4.08Å; L149-L152 HydrophobicContact CD2-CD1 4.41Å; L152-L154 HydrophobicContact CD1-CD1 4.22Å; L152-L154 HydrophobicContact CD1-CG 4.09Å; L152-L154 HydrophobicContact CD2-CD1 3.81Å; L152-L154 HydrophobicContact CG-CD1 3.81Å; L152-L154 HydrophobicContact CG-CG 4.05Å; L152-L167 HydrophobicContact CD2-CD2 4.29Å; L152-L170 HydrophobicContact CD2-CD1 4.1Å; L152-L173 HydrophobicContact CB-CD1 3.8Å; L152-L173 HydrophobicContact CB-CD2 4.44Å; L152-L175 PolarHBondContact N-O 3.23Å; L152-L176 HydrophobicContact CB-CD1 4.12Å; L152-L176 HydrophobicContact CD2-CD1 3.94Å; L152-L176 HydrophobicContact CG-CD1 4.06Å; L152-D177 PolarHBondContact O-N 2.82Å
153	H	98.8	Very high	96.7	Very high	17 Å²	17	49.8 Å²	49.8	8%	0.079	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	106.8	-178	-63.4	-95	0	0	0	109.7	L128 Y129 L130 A131 E151	L128-H153 PolarHBondContact O-N 3.03Å; L128-H153 VanDerWaalsContact O-N 3.08Å; Y129-H153 HydrophobicContact CD1-CB 3.88Å; Y129-H153 AromaticContact CD1-CD2 3.44Å; Y129-H153 VanDerWaalsContact CD1-CD2 3.44Å; Y129-H153 WeakPolarHBondContact CD1-CD2 3.38Å; Y129-H153 AromaticContact CD1-CG 3.62Å; Y129-H153 AromaticContact CE1-CD2 3.43Å; Y129-H153 VanDerWaalsContact CE1-CD2 3.43Å; Y129-H153 WeakPolarHBondContact CE1-CD2 3.35Å; Y129-H153 AromaticContact CE1-CG 3.88Å; Y129-H153 AromaticContact CE1-NE2 3.54Å; L130-H153 CarbonylContact C-O 3.07Å; L130-H153 WeakPolarHBondContact CA-O 3.37Å; L130-H153 PolarHBondContact N-O 3.13Å; A131-H153 PolarHBondContact N-O 2.7Å; A131-H153 VanDerWaalsContact N-O 3.14Å; E151-H153 IonicContact OE2-CE1 3.95Å; E151-H153 IonicContact OE2-NE2 3.11Å; E151-H153 PolarHBondContact OE2-NE2 3.03Å
154	L	98.8	Very high	96.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.265	C	S	.	.			trans	-121	9	-178.2	-74.2	163.7	0	0	0	112.4	L130 I135 I138 F143 L152 N157 I159 L176 D177 L178 N181	L130-L154 HydrophobicContact CB-CD2 3.84Å; L130-L154 HydrophobicContact CD1-CD2 3.93Å; I135-L154 HydrophobicContact CD1-CD2 4.02Å; I138-L154 HydrophobicContact CD1-CD1 3.69Å; I138-L154 HydrophobicContact CD1-CD2 4.27Å; F143-L154 HydrophobicContact CE2-CD1 4.43Å; F143-L154 HydrophobicContact CZ-CD1 4.17Å; F143-L154 HydrophobicContact CZ-CD2 4.46Å; L152-L154 HydrophobicContact CD1-CD1 4.22Å; L152-L154 HydrophobicContact CD1-CG 4.09Å; L152-L154 HydrophobicContact CD2-CD1 3.81Å; L152-L154 HydrophobicContact CG-CD1 3.81Å; L152-L154 HydrophobicContact CG-CG 4.05Å; L154-N157 PolarHBondContact O-ND2 3.1Å; L154-I159 HydrophobicContact CB-CD1 4.1Å; L154-I159 HydrophobicContact CD2-CD1 4.38Å; L154-L176 HydrophobicContact CD1-CD1 4.45Å; L154-D177 CarbonylContact C-O 3.21Å; L154-D177 VanDerWaalsContact CA-O 3.3Å; L154-D177 WeakPolarHBondContact CA-O 3.35Å; L154-D177 WeakPolarHBondContact CB-O 3.16Å; L154-D177 PolarHBondContact N-O 3.26Å; L154-L178 HydrophobicContact CB-CD2 3.92Å; L154-L178 HydrophobicContact CD1-CD2 3.79Å; L154-N181 PolarHBondContact O-ND2 3.11Å
155	Q	98.6	Very high	96.6	Very high	36 Å²	36	50.7 Å²	50.7	17%	0.168	25%	0.252	C	S	.	.			trans	-61.7	155.6	179.7	68.5	-81.1	15.9	0	0	112.8	A131 G132 N157 D177 S179	A131-Q155 CarbonylContact C-O 3.04Å; A131-Q155 WeakPolarHBondContact CA-O 3.27Å; A131-Q155 VanDerWaalsContact CB-CD 3.48Å; A131-Q155 HydrophobicContact CB-CG 3.86Å; A131-Q155 WeakPolarHBondContact CB-O 3.3Å; G132-Q155 PolarHBondContact N-O 2.76Å; Q155-N157 VanDerWaalsContact C-N 3.31Å; Q155-N157 PolarHBondContact O-N 3.06Å; Q155-N157 PolarHBondContact O-ND2 3.35Å; Q155-D177 PolarHBondContact N-O 2.75Å; Q155-S179 WeakPolarHBondContact CA-O 3.45Å; Q155-S179 WeakPolarHBondContact CB-O 3.27Å; Q155-S179 WeakPolarHBondContact CB-OG 3.06Å
156	E	98.5	Very high	96.8	Very high	98 Å²	98	49.2 Å²	49.2	46%	0.458	24%	0.236	S	C	.	.	S	Bend	trans	60.1	40.7	178.4	-51.3	-173.8	172.8	0	0	112.9	G132 S179 R180	G132-E156 WeakPolarHBondContact CA-O 3.37Å; G132-E156 PolarHBondContact N-O 3.3Å; E156-S179 PolarHBondContact N-O 2.67Å; E156-R180 VanDerWaalsContact CA-O 3.3Å; E156-R180 WeakPolarHBondContact CA-O 3.38Å; E156-R180 HydrophobicContact CG-CB 4.03Å; E156-R180 HydrophobicContact CG-CG 4.47Å; E156-R180 PolarHBondContact N-O 2.8Å; E156-R180 IonicContact OE1-CZ 2.9Å; E156-R180 IonicContact OE1-NH1 3.26Å; E156-R180 PolarHBondContact OE1-NH1 3.17Å; E156-R180 IonicContact OE2-NH1 2.74Å
157	N	98.8	Very high	96.8	Very high	5 Å²	5	49.4 Å²	49.4	3%	0.027	24%	0.238	C	C	.	.	S	Bend	trans	-110.9	-170.5	169.5	-85.4	-86.8	0	0	0	109.8	L130 N133 Q134 I135 L154 Q155 I159 N181	L130-N157 PolarHBondContact O-ND2 3.04Å; N133-N157 VanDerWaalsContact CA-OD1 3.28Å; N133-N157 WeakPolarHBondContact CA-OD1 3.26Å; N133-N157 WeakPolarHBondContact CB-OD1 3.22Å; N133-N157 PolarHBondContact N-OD1 3.31Å; N133-N157 PolarHBondContact O-OD1 3.1Å; Q134-N157 PolarHBondContact N-OD1 3.44Å; I135-N157 HydrophobicContact CB-CB 4.33Å; I135-N157 WeakPolarHBondContact CB-OD1 3.3Å; I135-N157 WeakPolarHBondContact CG1-OD1 3.36Å; I135-N157 PolarHBondContact N-OD1 3.37Å; L154-N157 PolarHBondContact O-ND2 3.1Å; Q155-N157 VanDerWaalsContact C-N 3.31Å; Q155-N157 PolarHBondContact O-N 3.06Å; Q155-N157 PolarHBondContact O-ND2 3.35Å; N157-I159 HydrophobicContact CB-CD1 4.16Å; N157-I159 HydrophobicContact CB-CG1 3.96Å; N157-N181 WeakPolarHBondContact CA-OD1 3.29Å; N157-N181 WeakPolarHBondContact CB-OD1 3.41Å; N157-N181 PolarHBondContact O-OD1 3.03Å
158	S	98.2	Very high	96.8	Very high	45 Å²	45	45.5 Å²	45.5	32%	0.315	22%	0.224	S	C	.	.			trans	-111.9	33	176.2	-63	0	0	0	0	112.7	I135 T136 E160 H182	I135-S158 CarbonylContact O-C 3.05Å; I135-S158 WeakPolarHBondContact O-CA 3.45Å; I135-S158 PolarHBondContact O-N 3.49Å; T136-S158 WeakPolarHBondContact CA-O 3.11Å; S158-E160 PolarHBondContact O-N 3.01Å; S158-E160 VanDerWaalsContact O-N 3.15Å; S158-H182 WeakPolarHBondContact CA-ND1 3.32Å
159	I	98.5	Very high	96.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.			trans	-69.2	115.8	-169.9	-57.3	163.1	0	0	0	109.8	I135 T136 I138 L154 N157 L178 N181 H182 L183	I135-I159 HydrophobicContact CB-CG1 4.29Å; I135-I159 HydrophobicContact CG2-CG1 4.07Å; I135-I159 WeakPolarHBondContact O-CA 3.3Å; I135-I159 WeakPolarHBondContact O-CG1 3.42Å; I135-I159 PolarHBondContact O-N 3.37Å; T136-I159 CarbonylContact O-C 3.13Å; T136-I159 WeakPolarHBondContact O-CA 3.32Å; I138-I159 HydrophobicContact CD1-CD1 3.75Å; I138-I159 HydrophobicContact CD1-CG1 4.45Å; I138-I159 HydrophobicContact CG1-CD1 4.41Å; I138-I159 HydrophobicContact CG1-CG2 4.46Å; L154-I159 HydrophobicContact CB-CD1 4.1Å; L154-I159 HydrophobicContact CD2-CD1 4.38Å; N157-I159 HydrophobicContact CB-CD1 4.16Å; N157-I159 HydrophobicContact CB-CG1 3.96Å; I159-L178 HydrophobicContact CD1-CD2 4.07Å; I159-N181 HydrophobicContact CB-CB 4.29Å; I159-N181 VanDerWaalsContact CB-OD1 3.3Å; I159-N181 WeakPolarHBondContact CB-OD1 3.27Å; I159-N181 WeakPolarHBondContact CD1-OD1 2.95Å; I159-N181 VanDerWaalsContact CG1-OD1 3.22Å; I159-N181 WeakPolarHBondContact CG1-OD1 3.37Å; I159-N181 PolarHBondContact N-OD1 3.35Å; I159-H182 CarbonylContact O-C 3.57Å; I159-H182 VanDerWaalsContact O-CA 3.27Å; I159-H182 WeakPolarHBondContact O-CA 3.47Å; I159-H182 PolarHBondContact O-N 3.04Å; I159-L183 HydrophobicContact CG2-CD2 3.87Å; I159-L183 HydrophobicContact CG2-CG 4.48Å; I159-L183 PolarHBondContact O-N 2.89Å
160	E	96.7	Very high	96.4	Very high	108 Å²	108	41.4 Å²	41.4	51%	0.505	22%	0.219	S	C	.	.			trans	-97.9	-32.6	177.1	-62.5	178.7	167.2	0	0	111.9	T136 R137 S158 H182	T136-E160 PolarHBondContact O-N 3.44Å; R137-E160 IonicContact NH2-OE2 3.43Å; S158-E160 PolarHBondContact O-N 3.01Å; S158-E160 VanDerWaalsContact O-N 3.15Å; E160-H182 HydrophobicContact CG-CB 4.01Å
161	L	94.5	Very high	96.2	Very high	87 Å²	87	39.9 Å²	39.9	46%	0.455	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	124.8	-173.7	-173.7	150.2	0	0	0	111.1	R137 I138 A163	R137-L161 WeakPolarHBondContact CA-O 3.41Å; R137-L161 HydrophobicContact CG-CB 4.26Å; I138-L161 PolarHBondContact N-O 3.12Å; L161-A163 HydrophobicContact CD2-CB 4.29Å
162	L	95.9	Very high	96.2	Very high	28 Å²	28	39.1 Å²	39.1	15%	0.147	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	113.3	167.6	-176.6	67.6	0	0	0	108.1	I138 A166 L167 L178 L183 L186 F190	I138-L162 HydrophobicContact CB-CD1 3.8Å; I138-L162 HydrophobicContact CD1-CD1 4.11Å; I138-L162 HydrophobicContact CG1-CD1 4.46Å; I138-L162 HydrophobicContact CG2-CD1 4Å; L162-A166 HydrophobicContact CD1-CB 3.48Å; L162-A166 VanDerWaalsContact CD1-CB 3.48Å; L162-A166 HydrophobicContact CG-CB 4.11Å; L162-L167 HydrophobicContact CD2-CD1 4.37Å; L162-L178 HydrophobicContact CD2-CD1 4.26Å; L162-L183 HydrophobicContact CB-CD2 4.31Å; L162-L186 HydrophobicContact CB-CD2 4.42Å; L162-L186 HydrophobicContact CD2-CD2 3.87Å; L162-F190 HydrophobicContact CD2-CD2 4.31Å
163	A	93.8	Very high	96.2	Very high	20 Å²	20	39.1 Å²	39.1	17%	0.165	22%	0.219	C	C	.	.			trans	-67.2	157.2	-179.4	0	0	0	0	0	111.9	I138 D140 L161 H165 A166	I138-A163 WeakPolarHBondContact O-CB 3.24Å; I138-A163 PolarHBondContact O-N 3.3Å; D140-A163 WeakPolarHBondContact OD1-CB 3.5Å; L161-A163 HydrophobicContact CD2-CB 4.29Å; A163-H165 PolarHBondContact O-N 2.72Å; A163-A166 HydrophobicContact CB-CB 4.31Å; A163-A166 WeakPolarHBondContact O-CB 3.41Å; A163-A166 PolarHBondContact O-N 3.44Å; A163-A166 VanDerWaalsContact O-N 3.12Å
164	E	90.5	Very high	96.1	Very high	112 Å²	112	39.4 Å²	39.4	52%	0.523	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.3	-170	-172.8	171.5	-179.3	0	0	113.2	D140 S189	D140-E164 PolarHBondContact OD1-N 3.09Å; E164-S189 WeakPolarHBondContact OE1-CB 3.38Å; E164-S189 PolarHBondContact OE1-OG 3.09Å
165	H	93.6	Very high	96.1	Very high	86 Å²	86	40.5 Å²	40.5	40%	0.398	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112	19.1	-179.4	-53.5	-48.2	0	0	0	112.4	D140 H141 A163 L167 S168	D140-H165 HydrophobicContact CB-CB 4.07Å; D140-H165 VanDerWaalsContact OD1-CA 3.31Å; D140-H165 WeakPolarHBondContact OD1-CA 3.37Å; D140-H165 WeakPolarHBondContact OD1-CB 3.39Å; D140-H165 PolarHBondContact OD1-N 3.36Å; H141-H165 PolarHBondContact N-O 2.98Å; A163-H165 PolarHBondContact O-N 2.72Å; H165-L167 VanDerWaalsContact C-N 3.26Å; H165-L167 PolarHBondContact O-N 2.97Å; H165-S168 VanDerWaalsContact O-CB 3.22Å; H165-S168 WeakPolarHBondContact O-CB 3.48Å; H165-S168 PolarHBondContact O-N 3.24Å; H165-S168 VanDerWaalsContact O-N 3.13Å
166	A	95.4	Very high	96.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.008	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-38.6	-179.4	0	0	0	0	0	113.6	I138 Q139 D140 L162 A163	I138-A166 HydrophobicContact CB-CB 4.46Å; I138-A166 HydrophobicContact CG2-CB 3.76Å; Q139-A166 WeakPolarHBondContact O-CA 3.41Å; D140-A166 PolarHBondContact OD1-N 3.11Å; L162-A166 HydrophobicContact CD1-CB 3.48Å; L162-A166 VanDerWaalsContact CD1-CB 3.48Å; L162-A166 HydrophobicContact CG-CB 4.11Å; A163-A166 HydrophobicContact CB-CB 4.31Å; A163-A166 WeakPolarHBondContact O-CB 3.41Å; A163-A166 PolarHBondContact O-N 3.44Å; A163-A166 VanDerWaalsContact O-N 3.12Å
167	L	95.8	Very high	96	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.026	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	13.9	-177.8	-53.5	179.7	0	0	0	113	F143 L152 L162 H165 G169 L170 L176 F190 P193 L194	F143-L167 HydrophobicContact CD2-CD2 3.86Å; F143-L167 HydrophobicContact CE2-CD2 3.95Å; L152-L167 HydrophobicContact CD2-CD2 4.29Å; L162-L167 HydrophobicContact CD2-CD1 4.37Å; H165-L167 VanDerWaalsContact C-N 3.26Å; H165-L167 PolarHBondContact O-N 2.97Å; L167-G169 PolarHBondContact O-N 2.82Å; L167-L170 HydrophobicContact CB-CD1 4.15Å; L167-L170 HydrophobicContact CD2-CD1 3.92Å; L167-L170 WeakPolarHBondContact O-CB 3.18Å; L167-L170 PolarHBondContact O-N 2.86Å; L167-L176 HydrophobicContact CD1-CD2 3.61Å; L167-F190 HydrophobicContact CD1-CD2 4.21Å; L167-P193 HydrophobicContact CB-CG 4.48Å; L167-L194 HydrophobicContact CB-CD2 4.11Å; L167-L194 HydrophobicContact CD1-CD1 3.88Å
168	S	94.4	Very high	96	Very high	43 Å²	43	34.1 Å²	34.1	30%	0.301	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	129.6	178.8	-171	0	0	0	0	111	H165	H165-S168 VanDerWaalsContact O-CB 3.22Å; H165-S168 WeakPolarHBondContact O-CB 3.48Å; H165-S168 PolarHBondContact O-N 3.24Å; H165-S168 VanDerWaalsContact O-N 3.13Å
169	G	91.4	Very high	96	Very high	33 Å²	33	32.6 Å²	32.6	34%	0.34	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.2	-5.4	-178.4	0	0	0	0	0	115.4	L167 S171	L167-G169 PolarHBondContact O-N 2.82Å; G169-S171 VanDerWaalsContact C-N 3.27Å; G169-S171 PolarHBondContact O-N 2.93Å; G169-S171 VanDerWaalsContact O-N 3.13Å
170	L	96.4	Very high	96	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.			trans	-86.2	53.4	177.4	-61.4	-175.7	0	0	0	112.7	F143 L146 L149 L152 L167 S172 L173 L194	F143-L170 HydrophobicContact CB-CD1 3.99Å; F143-L170 HydrophobicContact CB-CD2 3.86Å; F143-L170 HydrophobicContact CB-CG 4.14Å; F143-L170 HydrophobicContact CD2-CD1 4.21Å; F143-L170 HydrophobicContact CG-CD1 4.31Å; L146-L170 HydrophobicContact CB-CD2 3.88Å; L146-L170 WeakPolarHBondContact O-CD2 3.45Å; L149-L170 HydrophobicContact CB-CD2 4.2Å; L149-L170 HydrophobicContact CD2-CD2 3.98Å; L152-L170 HydrophobicContact CD2-CD1 4.1Å; L167-L170 HydrophobicContact CB-CD1 4.15Å; L167-L170 HydrophobicContact CD2-CD1 3.92Å; L167-L170 WeakPolarHBondContact O-CB 3.18Å; L167-L170 PolarHBondContact O-N 2.86Å; L170-S172 VanDerWaalsContact C-N 3.3Å; L170-S172 PolarHBondContact O-N 3.3Å; L170-L173 HydrophobicContact CB-CB 4.13Å; L170-L173 HydrophobicContact CB-CD2 4.48Å; L170-L173 HydrophobicContact CD1-CD2 4.16Å; L170-L173 WeakPolarHBondContact O-CB 3.24Å; L170-L173 PolarHBondContact O-N 3.27Å; L170-L194 HydrophobicContact CB-CD2 3.83Å
171	S	95	Very high	96	Very high	53 Å²	53	33.3 Å²	33.3	37%	0.371	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-23.8	-173.8	53.3	0	0	0	0	114.5	G169 V195 S196	G169-S171 VanDerWaalsContact C-N 3.27Å; G169-S171 PolarHBondContact O-N 2.93Å; G169-S171 VanDerWaalsContact O-N 3.13Å; S171-V195 WeakPolarHBondContact O-CG2 3.5Å; S171-S196 VanDerWaalsContact O-CB 3.29Å; S171-S196 WeakPolarHBondContact O-CB 3.46Å; S171-S196 PolarHBondContact O-OG 3.32Å
172	S	97.8	Very high	96.2	Very high	44 Å²	44	33.6 Å²	33.6	31%	0.308	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-0.8	178.8	-55.3	0	0	0	0	113.8	Q147 L149 L170 A174	Q147-S172 VanDerWaalsContact O-CB 3.24Å; Q147-S172 WeakPolarHBondContact O-CB 3.3Å; Q147-S172 PolarHBondContact O-OG 3.43Å; L149-S172 CarbonylContact O-C 3.6Å; L170-S172 VanDerWaalsContact C-N 3.3Å; L170-S172 PolarHBondContact O-N 3.3Å; S172-A174 PolarHBondContact O-N 3.32Å
173	L	98.3	Very high	96.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.18	C	C	.	.			trans	-67.5	121.4	-172.5	-164	74.8	0	0	0	110.3	L149 L152 L170 L176 L194 S196 L197	L149-L173 HydrophobicContact CB-CD1 4.42Å; L149-L173 HydrophobicContact CD2-CD1 4Å; L149-L173 HydrophobicContact CG-CD1 4.01Å; L149-L173 WeakPolarHBondContact O-CA 3.4Å; L149-L173 PolarHBondContact O-N 3.2Å; L152-L173 HydrophobicContact CB-CD1 3.8Å; L152-L173 HydrophobicContact CB-CD2 4.44Å; L170-L173 HydrophobicContact CB-CB 4.13Å; L170-L173 HydrophobicContact CB-CD2 4.48Å; L170-L173 HydrophobicContact CD1-CD2 4.16Å; L170-L173 WeakPolarHBondContact O-CB 3.24Å; L170-L173 PolarHBondContact O-N 3.27Å; L173-L176 HydrophobicContact CD2-CB 3.98Å; L173-L176 HydrophobicContact CD2-CD1 4.39Å; L173-L194 HydrophobicContact CB-CD2 4.26Å; L173-L194 HydrophobicContact CD2-CD1 4.45Å; L173-L194 HydrophobicContact CD2-CD2 3.88Å; L173-S196 CarbonylContact O-C 3.6Å; L173-L197 HydrophobicContact CD2-CD1 4.37Å; L173-L197 HydrophobicContact CG-CD1 4.43Å; L173-L197 WeakPolarHBondContact O-CA 3.44Å; L173-L197 PolarHBondContact O-N 3.06Å; L173-L197 VanDerWaalsContact O-N 3.08Å
174	A	97.9	Very high	96.4	Very high	23 Å²	23	37 Å²	37	19%	0.19	19%	0.194	C	C	.	.			trans	-102.1	-33	179.7	0	0	0	0	0	111.9	Q150 S172 Q198 V199	Q150-A174 WeakPolarHBondContact O-CA 3.28Å; Q150-A174 PolarHBondContact O-N 2.99Å; S172-A174 PolarHBondContact O-N 3.32Å; A174-Q198 WeakPolarHBondContact O-CA 3.26Å; A174-Q198 PolarHBondContact O-N 2.98Å; A174-V199 PolarHBondContact O-N 2.63Å
175	L	97.9	Very high	96.6	Very high	23 Å²	23	34.7 Å²	34.7	12%	0.12	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	128.4	178.5	-174.4	153.4	0	0	0	111	Q150 E151 L152 D177 V199	Q150-L175 PolarHBondContact O-N 3.03Å; E151-L175 WeakPolarHBondContact CA-O 3.46Å; E151-L175 HydrophobicContact CB-CB 4.44Å; E151-L175 HydrophobicContact CG-CB 4.12Å; L152-L175 PolarHBondContact N-O 3.23Å; L175-D177 HydrophobicContact CD2-CB 4.18Å; L175-V199 WeakPolarHBondContact CA-O 3.39Å; L175-V199 HydrophobicContact CB-CB 4.34Å; L175-V199 HydrophobicContact CD1-CB 4.23Å; L175-V199 HydrophobicContact CD1-CG1 4.17Å; L175-V199 HydrophobicContact CG-CB 4.07Å; L175-V199 HydrophobicContact CG-CG1 4.18Å
176	L	98.1	Very high	96.7	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120	169.9	177.1	60.6	0	0	0	109.8	L152 L154 L167 L173 L178 L194 L197 V199 L200 R201	L152-L176 HydrophobicContact CB-CD1 4.12Å; L152-L176 HydrophobicContact CD2-CD1 3.94Å; L152-L176 HydrophobicContact CG-CD1 4.06Å; L154-L176 HydrophobicContact CD1-CD1 4.45Å; L167-L176 HydrophobicContact CD1-CD2 3.61Å; L173-L176 HydrophobicContact CD2-CB 3.98Å; L173-L176 HydrophobicContact CD2-CD1 4.39Å; L176-L178 HydrophobicContact CD1-CD1 4.4Å; L176-L178 HydrophobicContact CD1-CG 4.1Å; L176-L178 HydrophobicContact CD2-CD1 3.87Å; L176-L178 HydrophobicContact CD2-CG 4.41Å; L176-L178 HydrophobicContact CG-CD1 4.1Å; L176-L178 HydrophobicContact CG-CG 4.1Å; L176-L194 HydrophobicContact CD2-CD1 4.01Å; L176-L197 HydrophobicContact CB-CD1 4.03Å; L176-V199 PolarHBondContact N-O 3.18Å; L176-L200 HydrophobicContact CB-CD1 4.2Å; L176-L200 HydrophobicContact CD2-CD1 3.97Å; L176-L200 HydrophobicContact CG-CD1 4.21Å; L176-R201 PolarHBondContact O-N 3.28Å
177	D	98.2	Very high	96.5	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.027	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	109.5	175.4	-159.5	-21.4	0	0	0	111.3	L152 L154 Q155 L175 S179 R201	L152-D177 PolarHBondContact O-N 2.82Å; L154-D177 CarbonylContact C-O 3.21Å; L154-D177 VanDerWaalsContact CA-O 3.3Å; L154-D177 WeakPolarHBondContact CA-O 3.35Å; L154-D177 WeakPolarHBondContact CB-O 3.16Å; L154-D177 PolarHBondContact N-O 3.26Å; Q155-D177 PolarHBondContact N-O 2.75Å; L175-D177 HydrophobicContact CD2-CB 4.18Å; D177-S179 VanDerWaalsContact OD1-CB 3.27Å; D177-S179 WeakPolarHBondContact OD1-CB 3.07Å; D177-S179 PolarHBondContact OD1-N 2.97Å; D177-S179 PolarHBondContact OD1-OG 3.1Å; D177-R201 HydrophobicContact CB-CB 4.23Å; D177-R201 VanDerWaalsContact CG-CD 3.47Å; D177-R201 VanDerWaalsContact OD1-CB 3.28Å; D177-R201 WeakPolarHBondContact OD1-CB 3.44Å; D177-R201 WeakPolarHBondContact OD2-CD 3.47Å; D177-R201 IonicContact OD2-CZ 3.54Å; D177-R201 IonicContact OD2-NE 2.92Å; D177-R201 IonicContact OD2-NH1 3.46Å; D177-R201 PolarHBondContact OD2-NH1 3.19Å
178	L	98	Very high	96.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	21%	0.209	C	C	.	.			trans	-116	15.7	176	-71.1	167.2	0	0	0	110.9	L154 I159 L162 L176 N181 L183 R201 I202 N205	L154-L178 HydrophobicContact CB-CD2 3.92Å; L154-L178 HydrophobicContact CD1-CD2 3.79Å; I159-L178 HydrophobicContact CD1-CD2 4.07Å; L162-L178 HydrophobicContact CD2-CD1 4.26Å; L176-L178 HydrophobicContact CD1-CD1 4.4Å; L176-L178 HydrophobicContact CD1-CG 4.1Å; L176-L178 HydrophobicContact CD2-CD1 3.87Å; L176-L178 HydrophobicContact CD2-CG 4.41Å; L176-L178 HydrophobicContact CG-CD1 4.1Å; L176-L178 HydrophobicContact CG-CG 4.1Å; L178-N181 PolarHBondContact O-ND2 2.84Å; L178-L183 HydrophobicContact CB-CD1 4.28Å; L178-L183 HydrophobicContact CD1-CD1 4.44Å; L178-R201 CarbonylContact C-O 3.23Å; L178-R201 WeakPolarHBondContact CA-O 3.44Å; L178-R201 PolarHBondContact N-O 3.4Å; L178-I202 HydrophobicContact CB-CG2 4.22Å; L178-I202 HydrophobicContact CD1-CG2 4.42Å; L178-N205 PolarHBondContact O-ND2 3.14Å
179	S	97.6	Very high	95.9	Very high	12 Å²	12	34.2 Å²	34.2	8%	0.084	20%	0.203	C	C	.	.			trans	-63.7	159.2	-179.6	62.4	0	0	0	0	112	Q155 E156 D177 N181 R201 T203	Q155-S179 WeakPolarHBondContact CA-O 3.45Å; Q155-S179 WeakPolarHBondContact CB-O 3.27Å; Q155-S179 WeakPolarHBondContact CB-OG 3.06Å; E156-S179 PolarHBondContact N-O 2.67Å; D177-S179 VanDerWaalsContact OD1-CB 3.27Å; D177-S179 WeakPolarHBondContact OD1-CB 3.07Å; D177-S179 PolarHBondContact OD1-N 2.97Å; D177-S179 PolarHBondContact OD1-OG 3.1Å; S179-N181 PolarHBondContact O-N 2.95Å; S179-N181 PolarHBondContact O-ND2 2.87Å; S179-R201 PolarHBondContact N-O 3.07Å; S179-T203 CarbonylContact C-O 3.43Å; S179-T203 WeakPolarHBondContact CA-O 3.48Å; S179-T203 WeakPolarHBondContact CB-O 3.49Å
180	R	97.9	Very high	95.8	Very high	117 Å²	117	33 Å²	33	44%	0.442	19%	0.188	S	C	.	.	S	Bend	trans	56.1	50.8	174.2	-44.4	-172.4	83	-124.9	-5.3	112.4	E156 T203 E204	E156-R180 VanDerWaalsContact CA-O 3.3Å; E156-R180 WeakPolarHBondContact CA-O 3.38Å; E156-R180 HydrophobicContact CG-CB 4.03Å; E156-R180 HydrophobicContact CG-CG 4.47Å; E156-R180 PolarHBondContact N-O 2.8Å; E156-R180 IonicContact OE1-CZ 2.9Å; E156-R180 IonicContact OE1-NH1 3.26Å; E156-R180 PolarHBondContact OE1-NH1 3.17Å; E156-R180 IonicContact OE2-NH1 2.74Å; R180-T203 PolarHBondContact N-O 3.27Å; R180-T203 VanDerWaalsContact N-O 3.09Å; R180-E204 VanDerWaalsContact CA-O 3.23Å; R180-E204 WeakPolarHBondContact CA-O 3.39Å; R180-E204 HydrophobicContact CB-CB 4.42Å; R180-E204 HydrophobicContact CG-CB 3.85Å; R180-E204 HydrophobicContact CG-CG 4.36Å; R180-E204 WeakPolarHBondContact CG-OE2 3.3Å; R180-E204 IonicContact CZ-OE2 3.64Å; R180-E204 PolarHBondContact N-O 3.26Å; R180-E204 IonicContact NE-OE2 3.58Å; R180-E204 PolarHBondContact NE-OE2 3.17Å
181	N	98.7	Very high	95.5	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.032	20%	0.195	C	C	.	.	S	Bend	trans	-127.2	-170.4	178.5	-89.4	-77.5	0	0	0	110.1	L154 N157 I159 L178 S179 E204 N205 P206	L154-N181 PolarHBondContact O-ND2 3.11Å; N157-N181 WeakPolarHBondContact CA-OD1 3.29Å; N157-N181 WeakPolarHBondContact CB-OD1 3.41Å; N157-N181 PolarHBondContact O-OD1 3.03Å; I159-N181 HydrophobicContact CB-CB 4.29Å; I159-N181 VanDerWaalsContact CB-OD1 3.3Å; I159-N181 WeakPolarHBondContact CB-OD1 3.27Å; I159-N181 WeakPolarHBondContact CD1-OD1 2.95Å; I159-N181 VanDerWaalsContact CG1-OD1 3.22Å; I159-N181 WeakPolarHBondContact CG1-OD1 3.37Å; I159-N181 PolarHBondContact N-OD1 3.35Å; L178-N181 PolarHBondContact O-ND2 2.84Å; S179-N181 PolarHBondContact O-N 2.95Å; S179-N181 PolarHBondContact O-ND2 2.87Å; N181-E204 PolarHBondContact N-O 3.24Å; N181-N205 VanDerWaalsContact CA-OD1 3.27Å; N181-N205 WeakPolarHBondContact CA-OD1 3.41Å; N181-N205 WeakPolarHBondContact CB-OD1 3.49Å; N181-N205 PolarHBondContact N-OD1 2.73Å; N181-N205 PolarHBondContact O-OD1 3.25Å; N181-N205 VanDerWaalsContact O-OD1 3.13Å; N181-P206 VanDerWaalsContact O-CD 3.28Å; N181-P206 WeakPolarHBondContact O-CD 3.21Å
182	H	98.2	Very high	95.3	Very high	94 Å²	94	39 Å²	39	44%	0.435	21%	0.209	S	C	.	.			trans	-111.4	25.6	-177.7	-66.2	81.4	0	0	0	113	S158 I159 E160 R184 N205	S158-H182 WeakPolarHBondContact CA-ND1 3.32Å; I159-H182 CarbonylContact O-C 3.57Å; I159-H182 VanDerWaalsContact O-CA 3.27Å; I159-H182 WeakPolarHBondContact O-CA 3.47Å; I159-H182 PolarHBondContact O-N 3.04Å; E160-H182 HydrophobicContact CG-CB 4.01Å; H182-R184 PolarHBondContact O-N 2.77Å; H182-N205 PolarHBondContact N-OD1 3.45Å
183	L	97.6	Very high	95.1	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.205	C	C	.	.			trans	-68.5	126.2	-179.5	-65.1	167.9	0	0	0	110.1	I159 L162 L178 L186 N205 P206 W207	I159-L183 HydrophobicContact CG2-CD2 3.87Å; I159-L183 HydrophobicContact CG2-CG 4.48Å; I159-L183 PolarHBondContact O-N 2.89Å; L162-L183 HydrophobicContact CB-CD2 4.31Å; L178-L183 HydrophobicContact CB-CD1 4.28Å; L178-L183 HydrophobicContact CD1-CD1 4.44Å; L183-L186 HydrophobicContact CD1-CD2 4.37Å; L183-N205 HydrophobicContact CB-CB 4.23Å; L183-N205 VanDerWaalsContact CB-OD1 3.3Å; L183-N205 WeakPolarHBondContact CB-OD1 3.44Å; L183-N205 PolarHBondContact N-OD1 3.21Å; L183-P206 CarbonylContact O-C 3.57Å; L183-P206 WeakPolarHBondContact O-CD 3.37Å; L183-W207 HydrophobicContact CB-CH2 3.71Å; L183-W207 HydrophobicContact CB-CZ2 4.41Å; L183-W207 HydrophobicContact CB-CZ3 3.97Å; L183-W207 HydrophobicContact CD1-CH2 4.15Å
184	R	96.1	Very high	94.9	Very high	119 Å²	119	39 Å²	39	45%	0.449	21%	0.208	S	C	.	.			trans	-97.3	-26.7	174.2	-61.4	-171.5	-171.5	-161.2	10.7	112.8	H182 P206 R208 E240	H182-R184 PolarHBondContact O-N 2.77Å; R184-P206 WeakPolarHBondContact CA-O 3.43Å; R184-P206 HydrophobicContact CG-CG 4.33Å; R184-R208 HydrophobicContact CB-CB 4.33Å; R184-R208 WeakPolarHBondContact O-CB 3.43Å; R184-R208 PolarHBondContact O-N 3.41Å; R184-E240 IonicContact CZ-OE1 2.73Å; R184-E240 IonicContact NE-OE1 3.85Å; R184-E240 IonicContact NH1-OE1 3.86Å; R184-E240 PolarHBondContact NH1-OE1 2.99Å; R184-E240 IonicContact NH1-OE2 3.49Å
185	T	95.1	Very high	94.7	Very high	63 Å²	63	43 Å²	43	39%	0.387	23%	0.229	S	C	.	.			trans	-152.5	163.2	-178.8	-168	0	0	0	0	110.7
186	L	94.3	Very high	94.6	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.042	24%	0.241	C	C	.	.			trans	-138.8	141.1	173.2	-75	171.9	0	0	0	108.3	L162 L183 F190 I202 W207 W215	L162-L186 HydrophobicContact CB-CD2 4.42Å; L162-L186 HydrophobicContact CD2-CD2 3.87Å; L183-L186 HydrophobicContact CD1-CD2 4.37Å; L186-F190 HydrophobicContact CB-CD1 3.91Å; L186-F190 HydrophobicContact CB-CE1 3.78Å; L186-F190 HydrophobicContact CD1-CD1 4.4Å; L186-F190 HydrophobicContact CD1-CE1 3.65Å; L186-F190 HydrophobicContact CD1-CZ 3.8Å; L186-F190 HydrophobicContact CD2-CD1 4.26Å; L186-F190 HydrophobicContact CD2-CE1 4.3Å; L186-F190 HydrophobicContact CG-CD1 4.42Å; L186-F190 HydrophobicContact CG-CE1 4.12Å; L186-I202 HydrophobicContact CD1-CD1 4.49Å; L186-I202 HydrophobicContact CD1-CG2 4.34Å; L186-W207 HydrophobicContact CB-CZ3 4.48Å; L186-W207 HydrophobicContact CD1-CH2 3.41Å; L186-W207 VanDerWaalsContact CD1-CH2 3.41Å; L186-W207 HydrophobicContact CD1-CZ2 4.33Å; L186-W207 HydrophobicContact CD1-CZ3 3.92Å; L186-W207 HydrophobicContact CG-CH2 3.68Å; L186-W207 HydrophobicContact CG-CZ3 3.76Å; L186-W215 HydrophobicContact CB-CZ2 4.1Å; L186-W215 PolarHBondContact O-NE1 3.44Å
187	G	91.9	Very high	94.5	Very high	48 Å²	48	44.5 Å²	44.5	50%	0.495	24%	0.241	S	C	.	.			trans	-92	138.4	176.7	0	0	0	0	0	112	S189 F190	G187-S189 PolarHBondContact O-N 3.02Å; G187-F190 WeakPolarHBondContact O-CD1 3.43Å; G187-F190 PolarHBondContact O-N 2.85Å
188	A	88.6	Confident	94.3	Very high	44 Å²	44	50.3 Å²	50.3	36%	0.364	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-52.4	-26.3	-176.1	0	0	0	0	0	115	F190 W215	A188-F190 VanDerWaalsContact C-N 3.26Å; A188-F190 PolarHBondContact O-N 3.11Å; A188-W215 HydrophobicContact CB-CB 4.44Å; A188-W215 HydrophobicContact CB-CD2 3.63Å; A188-W215 HydrophobicContact CB-CE3 3.94Å; A188-W215 HydrophobicContact CB-CG 3.83Å
189	S	88.6	Confident	94.1	Very high	24 Å²	24	52.6 Å²	52.6	17%	0.168	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-66	-21.5	177.4	-67.3	0	0	0	0	114.2	E164 G187 L191 K192 P193	E164-S189 WeakPolarHBondContact OE1-CB 3.38Å; E164-S189 PolarHBondContact OE1-OG 3.09Å; G187-S189 PolarHBondContact O-N 3.02Å; S189-L191 PolarHBondContact O-N 2.73Å; S189-K192 WeakPolarHBondContact O-CB 3.5Å; S189-K192 PolarHBondContact O-N 2.99Å; S189-K192 VanDerWaalsContact O-N 3.11Å; S189-K192 PolarHBondContact OG-NZ 2.93Å; S189-K192 VanDerWaalsContact OG-NZ 3.14Å; S189-P193 WeakPolarHBondContact O-CD 3.19Å
190	F	88.9	Confident	94	Very high	8 Å²	8	52 Å²	52	4%	0.035	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-64.7	-27.9	-172.1	94.6	-97.4	0	0	0	113.4	L162 L167 L186 G187 A188 P193 L200 W215	L162-F190 HydrophobicContact CD2-CD2 4.31Å; L167-F190 HydrophobicContact CD1-CD2 4.21Å; L186-F190 HydrophobicContact CB-CD1 3.91Å; L186-F190 HydrophobicContact CB-CE1 3.78Å; L186-F190 HydrophobicContact CD1-CD1 4.4Å; L186-F190 HydrophobicContact CD1-CE1 3.65Å; L186-F190 HydrophobicContact CD1-CZ 3.8Å; L186-F190 HydrophobicContact CD2-CD1 4.26Å; L186-F190 HydrophobicContact CD2-CE1 4.3Å; L186-F190 HydrophobicContact CG-CD1 4.42Å; L186-F190 HydrophobicContact CG-CE1 4.12Å; G187-F190 WeakPolarHBondContact O-CD1 3.43Å; G187-F190 PolarHBondContact O-N 2.85Å; A188-F190 VanDerWaalsContact C-N 3.26Å; A188-F190 PolarHBondContact O-N 3.11Å; F190-P193 WeakPolarHBondContact O-CD 3.43Å; F190-L200 HydrophobicContact CZ-CD2 4.3Å; F190-W215 HydrophobicContact CD1-CH2 4.06Å; F190-W215 HydrophobicContact CD1-CZ2 4.03Å; F190-W215 AromaticContact CE1-CH2 3.54Å; F190-W215 HydrophobicContact CE1-CH2 3.54Å; F190-W215 AromaticContact CE1-CZ2 3.75Å; F190-W215 HydrophobicContact CE1-CZ2 3.75Å
191	L	90.6	Very high	93.9	Very high	28 Å²	28	50.7 Å²	50.7	15%	0.147	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-83.4	-20.6	178.5	-69.5	174.6	0	0	0	113.4	S189 P193 L194 L197 L200 W215 W219	S189-L191 PolarHBondContact O-N 2.73Å; L191-P193 VanDerWaalsContact C-CD 3.48Å; L191-L194 HydrophobicContact CD2-CD1 4.33Å; L191-L194 PolarHBondContact O-N 3.06Å; L191-L197 HydrophobicContact CD2-CD2 3.9Å; L191-L200 HydrophobicContact CD2-CD2 4.09Å; L191-W215 HydrophobicContact CD1-CH2 3.98Å; L191-W215 HydrophobicContact CD1-CZ3 4.07Å; L191-W219 HydrophobicContact CD1-CD2 4.24Å; L191-W219 HydrophobicContact CD1-CH2 4.14Å; L191-W219 HydrophobicContact CD1-CZ2 3.73Å
192	K	91.4	Very high	93.7	Very high	152 Å²	152	50.4 Å²	50.4	66%	0.661	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-43.3	-177.1	-67.5	178	-179.4	161.5	0	114.4	S189 L194	S189-K192 WeakPolarHBondContact O-CB 3.5Å; S189-K192 PolarHBondContact O-N 2.99Å; S189-K192 VanDerWaalsContact O-N 3.11Å; S189-K192 PolarHBondContact OG-NZ 2.93Å; S189-K192 VanDerWaalsContact OG-NZ 3.14Å; K192-L194 VanDerWaalsContact C-N 3.25Å; K192-L194 PolarHBondContact O-N 2.92Å
193	P	92.5	Very high	93.6	Very high	34 Å²	34	46.5 Å²	46.5	22%	0.221	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-17.4	179.5	26.9	-33.9	0	0	0	113.9	L167 S189 F190 L191 V195	L167-P193 HydrophobicContact CB-CG 4.48Å; S189-P193 WeakPolarHBondContact O-CD 3.19Å; F190-P193 WeakPolarHBondContact O-CD 3.43Å; L191-P193 VanDerWaalsContact C-CD 3.48Å; P193-V195 VanDerWaalsContact C-N 3.35Å; P193-V195 PolarHBondContact O-N 2.77Å; P193-V195 VanDerWaalsContact O-N 3.12Å
194	L	94.1	Very high	93.5	Very high	10 Å²	10	51.6 Å²	51.6	5%	0.052	28%	0.278	C	S	.	.			trans	-91.9	60.8	-168.7	-52.6	-178.7	0	0	0	112	L167 L170 L173 L176 L191 K192 S196 L197	L167-L194 HydrophobicContact CB-CD2 4.11Å; L167-L194 HydrophobicContact CD1-CD1 3.88Å; L170-L194 HydrophobicContact CB-CD2 3.83Å; L173-L194 HydrophobicContact CB-CD2 4.26Å; L173-L194 HydrophobicContact CD2-CD1 4.45Å; L173-L194 HydrophobicContact CD2-CD2 3.88Å; L176-L194 HydrophobicContact CD2-CD1 4.01Å; L191-L194 HydrophobicContact CD2-CD1 4.33Å; L191-L194 PolarHBondContact O-N 3.06Å; K192-L194 VanDerWaalsContact C-N 3.25Å; K192-L194 PolarHBondContact O-N 2.92Å; L194-S196 VanDerWaalsContact C-N 3.27Å; L194-S196 PolarHBondContact O-N 3Å; L194-L197 HydrophobicContact CB-CB 4Å; L194-L197 HydrophobicContact CB-CD2 4.18Å; L194-L197 HydrophobicContact CD1-CD1 4.47Å; L194-L197 HydrophobicContact CD1-CD2 3.88Å; L194-L197 WeakPolarHBondContact O-CB 3.45Å; L194-L197 PolarHBondContact O-N 3.1Å
195	V	93.5	Very high	93.6	Very high	106 Å²	106	46.4 Å²	46.4	64%	0.642	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-27.2	-172.6	-62.8	0	0	0	0	114.3	S171 P193	S171-V195 WeakPolarHBondContact O-CG2 3.5Å; P193-V195 VanDerWaalsContact C-N 3.35Å; P193-V195 PolarHBondContact O-N 2.77Å; P193-V195 VanDerWaalsContact O-N 3.12Å
196	S	95.9	Very high	93.7	Very high	52 Å²	52	45.2 Å²	45.2	36%	0.364	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	5.5	-179	-55.1	0	0	0	0	113.6	S171 L173 L194 Q198	S171-S196 VanDerWaalsContact O-CB 3.29Å; S171-S196 WeakPolarHBondContact O-CB 3.46Å; S171-S196 PolarHBondContact O-OG 3.32Å; L173-S196 CarbonylContact O-C 3.6Å; L194-S196 VanDerWaalsContact C-N 3.27Å; L194-S196 PolarHBondContact O-N 3Å; S196-Q198 WeakPolarHBondContact O-CG 3.49Å; S196-Q198 PolarHBondContact O-N 3.14Å
197	L	95.9	Very high	93.8	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	25%	0.251	C	S	.	.			trans	-64.1	133.8	-172.4	-162	67.3	0	0	0	111.2	L173 L176 L191 L194 L200 L227	L173-L197 HydrophobicContact CD2-CD1 4.37Å; L173-L197 HydrophobicContact CG-CD1 4.43Å; L173-L197 WeakPolarHBondContact O-CA 3.44Å; L173-L197 PolarHBondContact O-N 3.06Å; L173-L197 VanDerWaalsContact O-N 3.08Å; L176-L197 HydrophobicContact CB-CD1 4.03Å; L191-L197 HydrophobicContact CD2-CD2 3.9Å; L194-L197 HydrophobicContact CB-CB 4Å; L194-L197 HydrophobicContact CB-CD2 4.18Å; L194-L197 HydrophobicContact CD1-CD1 4.47Å; L194-L197 HydrophobicContact CD1-CD2 3.88Å; L194-L197 WeakPolarHBondContact O-CB 3.45Å; L194-L197 PolarHBondContact O-N 3.1Å; L197-L200 HydrophobicContact CD2-CB 4.28Å; L197-L200 HydrophobicContact CD2-CD1 4.46Å; L197-L227 HydrophobicContact CB-CD1 4.45Å; L197-L227 HydrophobicContact CD2-CD1 3.89Å; L197-L227 HydrophobicContact CG-CD1 4.25Å; L197-L227 WeakPolarHBondContact O-CD2 3.47Å
198	Q	94.1	Very high	94.1	Very high	128 Å²	128	44.9 Å²	44.9	60%	0.598	24%	0.236	S	C	*	.			trans	-122.2	-34.5	-179	-62.4	176.9	18.6	0	0	111.7	A174 S196 L227	A174-Q198 WeakPolarHBondContact O-CA 3.26Å; A174-Q198 PolarHBondContact O-N 2.98Å; S196-Q198 WeakPolarHBondContact O-CG 3.49Å; S196-Q198 PolarHBondContact O-N 3.14Å; Q198-L227 WeakPolarHBondContact O-CD2 3.21Å
199	V	94.4	Very high	94.5	Very high	48 Å²	48	42.8 Å²	42.8	29%	0.291	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125	-178.7	-178.3	0	0	0	0	109.4	A174 L175 L176 R201	A174-V199 PolarHBondContact O-N 2.63Å; L175-V199 WeakPolarHBondContact CA-O 3.39Å; L175-V199 HydrophobicContact CB-CB 4.34Å; L175-V199 HydrophobicContact CD1-CB 4.23Å; L175-V199 HydrophobicContact CD1-CG1 4.17Å; L175-V199 HydrophobicContact CG-CB 4.07Å; L175-V199 HydrophobicContact CG-CG1 4.18Å; L176-V199 PolarHBondContact N-O 3.18Å; V199-R201 HydrophobicContact CG1-CG 4.42Å
200	L	95.2	Very high	94.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.9	173.7	177.2	65	0	0	0	109.2	L176 F190 L191 L197 I202 W219 L227 L228	L176-L200 HydrophobicContact CB-CD1 4.2Å; L176-L200 HydrophobicContact CD2-CD1 3.97Å; L176-L200 HydrophobicContact CG-CD1 4.21Å; F190-L200 HydrophobicContact CZ-CD2 4.3Å; L191-L200 HydrophobicContact CD2-CD2 4.09Å; L197-L200 HydrophobicContact CD2-CB 4.28Å; L197-L200 HydrophobicContact CD2-CD1 4.46Å; L200-I202 HydrophobicContact CD1-CG2 3.73Å; L200-I202 HydrophobicContact CD2-CD1 4.25Å; L200-I202 HydrophobicContact CD2-CG2 4.32Å; L200-I202 HydrophobicContact CG-CG1 4.49Å; L200-I202 HydrophobicContact CG-CG2 3.9Å; L200-W219 HydrophobicContact CD2-CH2 3.89Å; L200-W219 HydrophobicContact CD2-CZ3 4.17Å; L200-L227 HydrophobicContact CB-CB 4.17Å; L200-L227 PolarHBondContact N-O 2.85Å; L200-L228 WeakPolarHBondContact O-CD2 3.19Å
201	R	95.8	Very high	95.2	Very high	90 Å²	90	43.6 Å²	43.6	34%	0.34	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116	173.5	-71.1	170.7	-179.7	163.9	5.6	110.2	L176 D177 L178 S179 V199 E232	L176-R201 PolarHBondContact O-N 3.28Å; D177-R201 HydrophobicContact CB-CB 4.23Å; D177-R201 VanDerWaalsContact CG-CD 3.47Å; D177-R201 VanDerWaalsContact OD1-CB 3.28Å; D177-R201 WeakPolarHBondContact OD1-CB 3.44Å; D177-R201 WeakPolarHBondContact OD2-CD 3.47Å; D177-R201 IonicContact OD2-CZ 3.54Å; D177-R201 IonicContact OD2-NE 2.92Å; D177-R201 IonicContact OD2-NH1 3.46Å; D177-R201 PolarHBondContact OD2-NH1 3.19Å; L178-R201 CarbonylContact C-O 3.23Å; L178-R201 WeakPolarHBondContact CA-O 3.44Å; L178-R201 PolarHBondContact N-O 3.4Å; S179-R201 PolarHBondContact N-O 3.07Å; V199-R201 HydrophobicContact CG1-CG 4.42Å; R201-E232 WeakPolarHBondContact CG-OE1 3.39Å; R201-E232 IonicContact NE-OE1 3.46Å
202	I	95.4	Very high	95.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.228	C	C	.	.			trans	-134.8	17.8	-177.2	55.5	168.7	0	0	0	111.5	L178 L186 L200 N205 W207 L216 L228 L236	L178-I202 HydrophobicContact CB-CG2 4.22Å; L178-I202 HydrophobicContact CD1-CG2 4.42Å; L186-I202 HydrophobicContact CD1-CD1 4.49Å; L186-I202 HydrophobicContact CD1-CG2 4.34Å; L200-I202 HydrophobicContact CD1-CG2 3.73Å; L200-I202 HydrophobicContact CD2-CD1 4.25Å; L200-I202 HydrophobicContact CD2-CG2 4.32Å; L200-I202 HydrophobicContact CG-CG1 4.49Å; L200-I202 HydrophobicContact CG-CG2 3.9Å; I202-N205 PolarHBondContact O-ND2 3.16Å; I202-W207 HydrophobicContact CB-CZ2 3.93Å; I202-W207 WeakPolarHBondContact O-CZ2 3.5Å; I202-W207 PolarHBondContact O-NE1 2.95Å; I202-L216 HydrophobicContact CD1-CD1 4.14Å; I202-L216 HydrophobicContact CD1-CD2 4.06Å; I202-L228 HydrophobicContact CG1-CD2 4.37Å; I202-L236 HydrophobicContact CD1-CD1 3.6Å; I202-L236 HydrophobicContact CG1-CD1 3.79Å
203	T	95	Very high	95.6	Very high	11 Å²	11	36.3 Å²	36.3	7%	0.067	20%	0.197	C	C	.	.			trans	-74.3	167.8	179.9	53.3	0	0	0	0	111.4	S179 R180 N205 E232 R235	S179-T203 CarbonylContact C-O 3.43Å; S179-T203 WeakPolarHBondContact CA-O 3.48Å; S179-T203 WeakPolarHBondContact CB-O 3.49Å; R180-T203 PolarHBondContact N-O 3.27Å; R180-T203 VanDerWaalsContact N-O 3.09Å; T203-N205 VanDerWaalsContact C-N 3.3Å; T203-N205 PolarHBondContact O-N 3.33Å; T203-N205 PolarHBondContact O-ND2 3.35Å; T203-N205 VanDerWaalsContact O-ND2 3.16Å; T203-E232 HydrophobicContact CG2-CB 4.18Å; T203-E232 WeakPolarHBondContact CG2-O 3.32Å; T203-R235 HydrophobicContact CG2-CB 3.74Å
204	E	96.1	Very high	95.7	Very high	108 Å²	108	35.4 Å²	35.4	51%	0.505	19%	0.194	S	C	.	.	S	Bend	trans	56.9	42	176.7	-62.4	173.3	-108.1	0	0	113.3	R180 N181	R180-E204 VanDerWaalsContact CA-O 3.23Å; R180-E204 WeakPolarHBondContact CA-O 3.39Å; R180-E204 HydrophobicContact CB-CB 4.42Å; R180-E204 HydrophobicContact CG-CB 3.85Å; R180-E204 HydrophobicContact CG-CG 4.36Å; R180-E204 WeakPolarHBondContact CG-OE2 3.3Å; R180-E204 IonicContact CZ-OE2 3.64Å; R180-E204 PolarHBondContact N-O 3.26Å; R180-E204 IonicContact NE-OE2 3.58Å; R180-E204 PolarHBondContact NE-OE2 3.17Å; N181-E204 PolarHBondContact N-O 3.24Å
205	N	98	Very high	95.8	Very high	11 Å²	11	37 Å²	37	6%	0.059	20%	0.199	C	C	.	.	S	Bend	trans	-119.1	149.9	170.2	-82.9	-88.2	0	0	0	108.9	L178 N181 H182 L183 I202 T203 W207	L178-N205 PolarHBondContact O-ND2 3.14Å; N181-N205 VanDerWaalsContact CA-OD1 3.27Å; N181-N205 WeakPolarHBondContact CA-OD1 3.41Å; N181-N205 WeakPolarHBondContact CB-OD1 3.49Å; N181-N205 PolarHBondContact N-OD1 2.73Å; N181-N205 PolarHBondContact O-OD1 3.25Å; N181-N205 VanDerWaalsContact O-OD1 3.13Å; H182-N205 PolarHBondContact N-OD1 3.45Å; L183-N205 HydrophobicContact CB-CB 4.23Å; L183-N205 VanDerWaalsContact CB-OD1 3.3Å; L183-N205 WeakPolarHBondContact CB-OD1 3.44Å; L183-N205 PolarHBondContact N-OD1 3.21Å; I202-N205 PolarHBondContact O-ND2 3.16Å; T203-N205 VanDerWaalsContact C-N 3.3Å; T203-N205 PolarHBondContact O-N 3.33Å; T203-N205 PolarHBondContact O-ND2 3.35Å; T203-N205 VanDerWaalsContact O-ND2 3.16Å; N205-W207 HydrophobicContact CB-CD2 4.19Å; N205-W207 HydrophobicContact CB-CH2 4.33Å; N205-W207 HydrophobicContact CB-CZ2 3.59Å; N205-W207 VanDerWaalsContact O-CD1 3.27Å; N205-W207 PolarHBondContact O-N 3.35Å
206	P	97.4	Very high	95.8	Very high	38 Å²	38	32 Å²	32	25%	0.247	17%	0.169	C	C	.	.			trans	-76.3	64.8	179.9	33.3	-37.1	0	0	0	111.9	N181 L183 R184 R208 A239	N181-P206 VanDerWaalsContact O-CD 3.28Å; N181-P206 WeakPolarHBondContact O-CD 3.21Å; L183-P206 CarbonylContact O-C 3.57Å; L183-P206 WeakPolarHBondContact O-CD 3.37Å; R184-P206 WeakPolarHBondContact CA-O 3.43Å; R184-P206 HydrophobicContact CG-CG 4.33Å; P206-R208 PolarHBondContact O-N 3.07Å; P206-A239 HydrophobicContact CB-CB 3.93Å
207	W	97.5	Very high	95.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	128.3	-174.9	-66.3	113.1	0	0	0	112.6	L183 L186 I202 N205 L213 L236 A239 E240	L183-W207 HydrophobicContact CB-CH2 3.71Å; L183-W207 HydrophobicContact CB-CZ2 4.41Å; L183-W207 HydrophobicContact CB-CZ3 3.97Å; L183-W207 HydrophobicContact CD1-CH2 4.15Å; L186-W207 HydrophobicContact CB-CZ3 4.48Å; L186-W207 HydrophobicContact CD1-CH2 3.41Å; L186-W207 VanDerWaalsContact CD1-CH2 3.41Å; L186-W207 HydrophobicContact CD1-CZ2 4.33Å; L186-W207 HydrophobicContact CD1-CZ3 3.92Å; L186-W207 HydrophobicContact CG-CH2 3.68Å; L186-W207 HydrophobicContact CG-CZ3 3.76Å; I202-W207 HydrophobicContact CB-CZ2 3.93Å; I202-W207 WeakPolarHBondContact O-CZ2 3.5Å; I202-W207 PolarHBondContact O-NE1 2.95Å; N205-W207 HydrophobicContact CB-CD2 4.19Å; N205-W207 HydrophobicContact CB-CH2 4.33Å; N205-W207 HydrophobicContact CB-CZ2 3.59Å; N205-W207 VanDerWaalsContact O-CD1 3.27Å; N205-W207 PolarHBondContact O-N 3.35Å; W207-L213 HydrophobicContact CB-CD2 3.93Å; W207-L213 HydrophobicContact CD2-CD2 4.36Å; W207-L213 HydrophobicContact CE3-CD1 4.03Å; W207-L213 HydrophobicContact CE3-CD2 4.01Å; W207-L213 HydrophobicContact CG-CD2 4.37Å; W207-L213 HydrophobicContact CZ3-CD1 4.32Å; W207-L236 HydrophobicContact CD2-CD2 4.47Å; W207-L236 HydrophobicContact CG-CD2 4.01Å; W207-A239 PolarHBondContact O-N 2.91Å; W207-E240 PolarHBondContact O-N 3.05Å; W207-E240 VanDerWaalsContact O-N 3.11Å
208	R	97.1	Very high	95.6	Very high	48 Å²	48	35.2 Å²	35.2	18%	0.181	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	104.3	168.1	-177.1	-174.5	-68.4	156.8	-0	109.2	R184 P206 D210 L213 E240 Y288	R184-R208 HydrophobicContact CB-CB 4.33Å; R184-R208 WeakPolarHBondContact O-CB 3.43Å; R184-R208 PolarHBondContact O-N 3.41Å; P206-R208 PolarHBondContact O-N 3.07Å; R208-D210 VanDerWaalsContact C-N 3.26Å; R208-D210 WeakPolarHBondContact CD-OD2 3.42Å; R208-D210 HydrophobicContact CG-CB 4.13Å; R208-D210 PolarHBondContact O-N 2.89Å; R208-L213 WeakPolarHBondContact O-CB 3.23Å; R208-L213 WeakPolarHBondContact O-CD2 3.43Å; R208-E240 CarbonylContact C-O 3.59Å; R208-E240 WeakPolarHBondContact CA-O 3.21Å; R208-E240 HydrophobicContact CB-CB 4.09Å; R208-E240 HydrophobicContact CG-CB 3.92Å; R208-E240 IonicContact CZ-OE2 2.85Å; R208-E240 IonicContact NE-OE2 3.11Å; R208-E240 PolarHBondContact NE-OE2 3.4Å; R208-E240 IonicContact NH2-OE2 3.98Å; R208-E240 PolarHBondContact NH2-OE2 2.89Å; R208-E240 VanDerWaalsContact NH2-OE2 3.11Å; R208-Y288 WeakPolarHBondContact CG-OH 3.3Å
209	C	97.3	Very high	95.5	Very high	1 Å²	1	31 Å²	31	1%	0.007	16%	0.157	C	C	.	.			trans	-81.8	72.1	177.7	-64.2	0	0	0	0	110.6	C238 E240 P241 L244 L249 L257	C209-C238 HydrophobicContact CB-CB 3.8Å; C209-C238 WeakPolarHBondContact CB-SG 3.45Å; C209-C238 WeakPolarHBondContact SG-CA 3.46Å; C209-C238 WeakPolarHBondContact SG-CB 3.06Å; C209-C238 CovalentContact SG-SG 2.01Å; C209-C238 PolarHBondContact SG-SG 3.43Å; C209-E240 PolarHBondContact N-O 3.43Å; C209-P241 WeakPolarHBondContact O-CD 3.22Å; C209-L244 HydrophobicContact CB-CD1 4.04Å; C209-L244 WeakPolarHBondContact O-CD1 3.32Å; C209-L249 HydrophobicContact CB-CD1 4.35Å; C209-L257 VanDerWaalsContact C-CD2 3.45Å; C209-L257 HydrophobicContact CB-CD2 3.74Å; C209-L257 WeakPolarHBondContact O-CD2 3.48Å
210	D	96.4	Very high	95.4	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.011	14%	0.144	C	C	.	.	S	Bend	trans	-113.2	-170.6	172.3	66.8	14.1	0	0	0	110.9	R208 A212 L213 G214 L257 Y288 P289	R208-D210 VanDerWaalsContact C-N 3.26Å; R208-D210 WeakPolarHBondContact CD-OD2 3.42Å; R208-D210 HydrophobicContact CG-CB 4.13Å; R208-D210 PolarHBondContact O-N 2.89Å; D210-A212 PolarHBondContact O-N 2.01Å; D210-A212 WeakPolarHBondContact OD1-CA 3.38Å; D210-A212 WeakPolarHBondContact OD1-CB 3.02Å; D210-A212 PolarHBondContact OD1-N 2.94Å; D210-L213 PolarHBondContact O-N 3.31Å; D210-L213 PolarHBondContact OD1-N 2.9Å; D210-G214 PolarHBondContact O-N 3.13Å; D210-L257 WeakPolarHBondContact O-CB 3.42Å; D210-Y288 HydrophobicContact CB-CE1 3.73Å; D210-P289 WeakPolarHBondContact OD2-CD 2.96Å
211	C	95.6	Very high	95	Very high	47 Å²	47	31 Å²	31	32%	0.318	17%	0.166	S	C	.	.	S	Bend	trans	-61.6	-28.4	179.1	78	0	0	0	0	113.5	L213 G214 L257 C259	C211-L213 VanDerWaalsContact C-N 3.33Å; C211-G214 PolarHBondContact O-N 2.74Å; C211-G214 VanDerWaalsContact O-N 3.13Å; C211-L257 WeakPolarHBondContact CA-O 3.32Å; C211-L257 WeakPolarHBondContact CB-O 3.27Å; C211-C259 HydrophobicContact CB-CB 3.85Å; C211-C259 WeakPolarHBondContact CB-SG 3.43Å; C211-C259 PolarHBondContact N-SG 2.8Å; C211-C259 WeakPolarHBondContact SG-CB 3.19Å; C211-C259 CovalentContact SG-SG 2.02Å; C211-C259 PolarHBondContact SG-SG 3.27Å
212	A	95	Very high	94.7	Very high	27 Å²	27	32.7 Å²	32.7	22%	0.223	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-35.8	-177.2	0	0	0	0	0	111	D210 G214 P391	D210-A212 PolarHBondContact O-N 2.01Å; D210-A212 WeakPolarHBondContact OD1-CA 3.38Å; D210-A212 WeakPolarHBondContact OD1-CB 3.02Å; D210-A212 PolarHBondContact OD1-N 2.94Å; A212-G214 PolarHBondContact O-N 2.99Å; A212-P391 HydrophobicContact CB-CB 3.6Å; A212-P391 HydrophobicContact CB-CG 3.69Å
213	L	95.8	Very high	94.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-2.5	175.2	-154.5	63.6	0	0	0	112.9	W207 R208 D210 C211 W215 L216 R217 L249	W207-L213 HydrophobicContact CB-CD2 3.93Å; W207-L213 HydrophobicContact CD2-CD2 4.36Å; W207-L213 HydrophobicContact CE3-CD1 4.03Å; W207-L213 HydrophobicContact CE3-CD2 4.01Å; W207-L213 HydrophobicContact CG-CD2 4.37Å; W207-L213 HydrophobicContact CZ3-CD1 4.32Å; R208-L213 WeakPolarHBondContact O-CB 3.23Å; R208-L213 WeakPolarHBondContact O-CD2 3.43Å; D210-L213 PolarHBondContact O-N 3.31Å; D210-L213 PolarHBondContact OD1-N 2.9Å; C211-L213 VanDerWaalsContact C-N 3.33Å; L213-W215 VanDerWaalsContact C-N 3.27Å; L213-W215 PolarHBondContact O-N 3.17Å; L213-L216 HydrophobicContact CD1-CB 4.04Å; L213-L216 HydrophobicContact CD1-CD2 3.67Å; L213-L216 HydrophobicContact CG-CB 4.22Å; L213-L216 HydrophobicContact CG-CD2 4.15Å; L213-L216 WeakPolarHBondContact O-CB 3.03Å; L213-L216 PolarHBondContact O-N 3.02Å; L213-R217 PolarHBondContact O-N 3.25Å; L213-L249 HydrophobicContact CD2-CD1 4.23Å; L213-L249 HydrophobicContact CD2-CD2 3.96Å; L213-L249 HydrophobicContact CG-CD2 4.12Å
214	G	95.2	Very high	93.6	Very high	15 Å²	15	37.8 Å²	37.8	16%	0.155	21%	0.205	C	C	.	.	H	α-helix	trans	-56.6	-36.1	-178.6	0	0	0	0	0	114.3	D210 C211 A212 L216 R217 T218	D210-G214 PolarHBondContact O-N 3.13Å; C211-G214 PolarHBondContact O-N 2.74Å; C211-G214 VanDerWaalsContact O-N 3.13Å; A212-G214 PolarHBondContact O-N 2.99Å; G214-L216 VanDerWaalsContact C-N 3.32Å; G214-L216 PolarHBondContact O-N 2.79Å; G214-R217 PolarHBondContact O-N 3.05Å; G214-T218 PolarHBondContact O-N 2.9Å; G214-T218 PolarHBondContact O-OG1 2.83Å
215	W	94.4	Very high	93.2	Very high	44 Å²	44	38.7 Å²	38.7	17%	0.167	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-39.8	175.9	78.5	-92.5	0	0	0	111.4	L186 A188 F190 L191 L213 T218 W219	L186-W215 HydrophobicContact CB-CZ2 4.1Å; L186-W215 PolarHBondContact O-NE1 3.44Å; A188-W215 HydrophobicContact CB-CB 4.44Å; A188-W215 HydrophobicContact CB-CD2 3.63Å; A188-W215 HydrophobicContact CB-CE3 3.94Å; A188-W215 HydrophobicContact CB-CG 3.83Å; F190-W215 HydrophobicContact CD1-CH2 4.06Å; F190-W215 HydrophobicContact CD1-CZ2 4.03Å; F190-W215 AromaticContact CE1-CH2 3.54Å; F190-W215 HydrophobicContact CE1-CH2 3.54Å; F190-W215 AromaticContact CE1-CZ2 3.75Å; F190-W215 HydrophobicContact CE1-CZ2 3.75Å; L191-W215 HydrophobicContact CD1-CH2 3.98Å; L191-W215 HydrophobicContact CD1-CZ3 4.07Å; L213-W215 VanDerWaalsContact C-N 3.27Å; L213-W215 PolarHBondContact O-N 3.17Å; W215-T218 PolarHBondContact O-N 3.3Å; W215-W219 HydrophobicContact CE3-CB 3.98Å; W215-W219 HydrophobicContact CE3-CG 4.44Å; W215-W219 HydrophobicContact CZ3-CB 4.01Å; W215-W219 HydrophobicContact CZ3-CD2 4.35Å; W215-W219 HydrophobicContact CZ3-CG 4.03Å; W215-W219 VanDerWaalsContact O-CB 3.26Å; W215-W219 WeakPolarHBondContact O-CB 3.43Å; W215-W219 PolarHBondContact O-N 3.19Å
216	L	94.6	Very high	92.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.1	-40.8	-176.5	-179.8	65.3	0	0	0	109.8	I202 L213 G214 T218 W219 I220 L249	I202-L216 HydrophobicContact CD1-CD1 4.14Å; I202-L216 HydrophobicContact CD1-CD2 4.06Å; L213-L216 HydrophobicContact CD1-CB 4.04Å; L213-L216 HydrophobicContact CD1-CD2 3.67Å; L213-L216 HydrophobicContact CG-CB 4.22Å; L213-L216 HydrophobicContact CG-CD2 4.15Å; L213-L216 WeakPolarHBondContact O-CB 3.03Å; L213-L216 PolarHBondContact O-N 3.02Å; G214-L216 VanDerWaalsContact C-N 3.32Å; G214-L216 PolarHBondContact O-N 2.79Å; L216-T218 VanDerWaalsContact C-N 3.33Å; L216-T218 PolarHBondContact O-N 3.39Å; L216-W219 HydrophobicContact CD1-CE3 3.78Å; L216-W219 HydrophobicContact CD1-CZ3 4.22Å; L216-W219 PolarHBondContact O-N 3.08Å; L216-I220 HydrophobicContact CD1-CD1 4.37Å; L216-I220 HydrophobicContact CD1-CG1 4.4Å; L216-I220 HydrophobicContact CG-CD1 3.98Å; L216-I220 HydrophobicContact CG-CG1 4.47Å; L216-I220 WeakPolarHBondContact O-CB 3.5Å; L216-I220 WeakPolarHBondContact O-CD1 3.38Å; L216-I220 WeakPolarHBondContact O-CG1 3.49Å; L216-I220 PolarHBondContact O-N 3.22Å; L216-L249 HydrophobicContact CB-CD2 4.34Å; L216-L249 HydrophobicContact CD2-CD2 3.97Å; L216-L249 HydrophobicContact CG-CD2 4.04Å
217	R	94.1	Very high	92.2	Very high	66 Å²	66	45.7 Å²	45.7	25%	0.249	23%	0.231	C	C	.	.	H	α-helix	trans	-55.5	-48.8	172.3	179.2	-91.5	174.6	-152	-4.7	111.5	L213 G214 G221 L249 V252 P254 L257	L213-R217 PolarHBondContact O-N 3.25Å; G214-R217 PolarHBondContact O-N 3.05Å; R217-G221 PolarHBondContact O-N 2.69Å; R217-L249 HydrophobicContact CB-CD1 3.9Å; R217-L249 HydrophobicContact CB-CD2 4.29Å; R217-L249 HydrophobicContact CB-CG 3.85Å; R217-L249 HydrophobicContact CG-CD1 4.38Å; R217-L249 HydrophobicContact CG-CG 4.31Å; R217-L249 VanDerWaalsContact CG-O 3.27Å; R217-L249 WeakPolarHBondContact CG-O 3.41Å; R217-V252 PolarHBondContact NE-O 3.26Å; R217-P254 VanDerWaalsContact CZ-CG 3.49Å; R217-L257 HydrophobicContact CB-CD1 3.86Å; R217-L257 HydrophobicContact CG-CD1 4.1Å
218	T	92.9	Very high	91.7	Very high	56 Å²	56	45.8 Å²	45.8	34%	0.344	23%	0.231	S	C	.	.	H	α-helix	trans	-66.3	-45	-179.8	-59.3	0	0	0	0	110.9	G214 W215 L216 I220 G221 E222	G214-T218 PolarHBondContact O-N 2.9Å; G214-T218 PolarHBondContact O-OG1 2.83Å; W215-T218 PolarHBondContact O-N 3.3Å; L216-T218 VanDerWaalsContact C-N 3.33Å; L216-T218 PolarHBondContact O-N 3.39Å; T218-I220 VanDerWaalsContact C-N 3.35Å; T218-I220 PolarHBondContact O-N 3.13Å; T218-G221 PolarHBondContact O-N 3.36Å; T218-E222 PolarHBondContact O-N 3.46Å
219	W	93.3	Very high	91	Very high	38 Å²	38	46.2 Å²	46.2	14%	0.144	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-42.1	178.3	178.7	81.3	0	0	0	112.5	L191 L200 W215 L216 G221 E222 D223 G224 L227 L228	L191-W219 HydrophobicContact CD1-CD2 4.24Å; L191-W219 HydrophobicContact CD1-CH2 4.14Å; L191-W219 HydrophobicContact CD1-CZ2 3.73Å; L200-W219 HydrophobicContact CD2-CH2 3.89Å; L200-W219 HydrophobicContact CD2-CZ3 4.17Å; W215-W219 HydrophobicContact CE3-CB 3.98Å; W215-W219 HydrophobicContact CE3-CG 4.44Å; W215-W219 HydrophobicContact CZ3-CB 4.01Å; W215-W219 HydrophobicContact CZ3-CD2 4.35Å; W215-W219 HydrophobicContact CZ3-CG 4.03Å; W215-W219 VanDerWaalsContact O-CB 3.26Å; W215-W219 WeakPolarHBondContact O-CB 3.43Å; W215-W219 PolarHBondContact O-N 3.19Å; L216-W219 HydrophobicContact CD1-CE3 3.78Å; L216-W219 HydrophobicContact CD1-CZ3 4.22Å; L216-W219 PolarHBondContact O-N 3.08Å; W219-G221 VanDerWaalsContact C-N 3.26Å; W219-G221 PolarHBondContact O-N 3.12Å; W219-E222 CarbonylContact O-C 3.5Å; W219-E222 PolarHBondContact O-N 3.01Å; W219-E222 VanDerWaalsContact O-N 3.1Å; W219-D223 PolarHBondContact O-N 3.39Å; W219-G224 WeakPolarHBondContact O-CA 3.39Å; W219-G224 PolarHBondContact O-N 3.32Å; W219-L227 HydrophobicContact CH2-CB 4.05Å; W219-L227 HydrophobicContact CH2-CD1 3.88Å; W219-L227 HydrophobicContact CH2-CG 4.31Å; W219-L227 HydrophobicContact CZ2-CB 4.46Å; W219-L227 HydrophobicContact CZ2-CD1 3.65Å; W219-L227 HydrophobicContact CZ2-CG 4.22Å; W219-L228 HydrophobicContact CH2-CD1 4.39Å; W219-L228 HydrophobicContact CZ3-CD1 3.69Å; W219-L228 HydrophobicContact CZ3-CG 4.43Å
220	I	91.4	Very high	90.1	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-58.5	-38.8	174.8	-70.6	162.1	0	0	0	111.6	L216 T218 E222 L228 Q233 L236 L249 A250	L216-I220 HydrophobicContact CD1-CD1 4.37Å; L216-I220 HydrophobicContact CD1-CG1 4.4Å; L216-I220 HydrophobicContact CG-CD1 3.98Å; L216-I220 HydrophobicContact CG-CG1 4.47Å; L216-I220 WeakPolarHBondContact O-CB 3.5Å; L216-I220 WeakPolarHBondContact O-CD1 3.38Å; L216-I220 WeakPolarHBondContact O-CG1 3.49Å; L216-I220 PolarHBondContact O-N 3.22Å; T218-I220 VanDerWaalsContact C-N 3.35Å; T218-I220 PolarHBondContact O-N 3.13Å; I220-E222 VanDerWaalsContact C-N 3.26Å; I220-E222 PolarHBondContact O-N 3.34Å; I220-L228 HydrophobicContact CG1-CD1 3.84Å; I220-Q233 HydrophobicContact CG2-CB 4.42Å; I220-Q233 HydrophobicContact CG2-CG 3.96Å; I220-L236 HydrophobicContact CD1-CD1 3.82Å; I220-L249 HydrophobicContact CD1-CD2 3.92Å; I220-A250 HydrophobicContact CG2-CB 4.3Å
221	G	86.7	Confident	89.4	Confident	45 Å²	45	51.6 Å²	51.6	46%	0.464	28%	0.282	S	S	.	.	H	α-helix	trans	-70.6	-20.7	178.8	0	0	0	0	0	114.1	R217 T218 W219 Q225	R217-G221 PolarHBondContact O-N 2.69Å; T218-G221 PolarHBondContact O-N 3.36Å; W219-G221 VanDerWaalsContact C-N 3.26Å; W219-G221 PolarHBondContact O-N 3.12Å; G221-Q225 PolarHBondContact O-NE2 2.77Å
222	E	89.2	Confident	88.8	Confident	126 Å²	126	50.6 Å²	50.6	59%	0.589	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-104.9	-174.6	-63.2	176.3	173.3	0	0	110.5	T218 W219 I220 G224 Q225	T218-E222 PolarHBondContact O-N 3.46Å; W219-E222 CarbonylContact O-C 3.5Å; W219-E222 PolarHBondContact O-N 3.01Å; W219-E222 VanDerWaalsContact O-N 3.1Å; I220-E222 VanDerWaalsContact C-N 3.26Å; I220-E222 PolarHBondContact O-N 3.34Å; E222-G224 PolarHBondContact O-N 3.13Å; E222-Q225 WeakPolarHBondContact O-CG 3.19Å; E222-Q225 PolarHBondContact O-N 3.27Å
223	D	84.7	Confident	88.2	Confident	118 Å²	118	51.2 Å²	51.2	63%	0.631	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-65	-25.1	-173.9	-63.9	-35.4	0	0	0	114.1	W219 Q225 R226	W219-D223 PolarHBondContact O-N 3.39Å; D223-Q225 PolarHBondContact O-N 3.2Å; D223-R226 PolarHBondContact O-N 3.44Å
224	G	84.2	Confident	87.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-67.6	-17.8	-175.5	0	0	0	0	0	114.1	W219 E222 R226 L227 L228	W219-G224 WeakPolarHBondContact O-CA 3.39Å; W219-G224 PolarHBondContact O-N 3.32Å; E222-G224 PolarHBondContact O-N 3.13Å; G224-R226 PolarHBondContact O-N 3.28Å; G224-R226 VanDerWaalsContact O-N 3.13Å; G224-L227 PolarHBondContact O-N 2.97Å; G224-L228 PolarHBondContact O-N 3.2Å
225	Q	85.6	Confident	87.3	Confident	127 Å²	127	65.6 Å²	65.6	59%	0.593	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-60.5	-23.3	176.3	-61.4	-176.2	16.8	0	0	113.1	G221 E222 D223	G221-Q225 PolarHBondContact O-NE2 2.77Å; E222-Q225 WeakPolarHBondContact O-CG 3.19Å; E222-Q225 PolarHBondContact O-N 3.27Å; D223-Q225 PolarHBondContact O-N 3.2Å
226	R	87.6	Confident	87.2	Confident	182 Å²	182	63.6 Å²	63.6	69%	0.687	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-74.7	-33.3	175.4	-172.9	178	68.3	127.7	4.7	112.7	D223 G224	D223-R226 PolarHBondContact O-N 3.44Å; G224-R226 PolarHBondContact O-N 3.28Å; G224-R226 VanDerWaalsContact O-N 3.13Å
227	L	87.9	Confident	87.2	Confident	14 Å²	14	67.4 Å²	67.4	7%	0.073	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-24.4	-170.7	-56.3	-169.1	0	0	0	113.8	L197 Q198 L200 W219 G224	L197-L227 HydrophobicContact CB-CD1 4.45Å; L197-L227 HydrophobicContact CD2-CD1 3.89Å; L197-L227 HydrophobicContact CG-CD1 4.25Å; L197-L227 WeakPolarHBondContact O-CD2 3.47Å; Q198-L227 WeakPolarHBondContact O-CD2 3.21Å; L200-L227 HydrophobicContact CB-CB 4.17Å; L200-L227 PolarHBondContact N-O 2.85Å; W219-L227 HydrophobicContact CH2-CB 4.05Å; W219-L227 HydrophobicContact CH2-CD1 3.88Å; W219-L227 HydrophobicContact CH2-CG 4.31Å; W219-L227 HydrophobicContact CZ2-CB 4.46Å; W219-L227 HydrophobicContact CZ2-CD1 3.65Å; W219-L227 HydrophobicContact CZ2-CG 4.22Å; G224-L227 PolarHBondContact O-N 2.97Å
228	L	86.6	Confident	87.4	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	32%	0.321	C	S	.	.	S	Bend	trans	-115.8	120.6	-179.6	-69.3	165.8	0	0	0	109.5	L200 I202 W219 I220 G224 E232 Q233	L200-L228 WeakPolarHBondContact O-CD2 3.19Å; I202-L228 HydrophobicContact CG1-CD2 4.37Å; W219-L228 HydrophobicContact CH2-CD1 4.39Å; W219-L228 HydrophobicContact CZ3-CD1 3.69Å; W219-L228 HydrophobicContact CZ3-CG 4.43Å; I220-L228 HydrophobicContact CG1-CD1 3.84Å; G224-L228 PolarHBondContact O-N 3.2Å; L228-E232 HydrophobicContact CD2-CB 4.22Å; L228-Q233 HydrophobicContact CB-CG 3.85Å; L228-Q233 PolarHBondContact O-NE2 2.98Å
229	S	82.4	Confident	87.6	Confident	57 Å²	57	63.8 Å²	63.8	40%	0.399	32%	0.322	S	S	.	.			trans	-61.6	154.3	171.3	68.3	0	0	0	0	111.2	A231 E232 Q233	S229-A231 PolarHBondContact O-N 2.82Å; S229-E232 VanDerWaalsContact CB-OE2 3.27Å; S229-E232 WeakPolarHBondContact CB-OE2 3.48Å; S229-E232 PolarHBondContact N-OE2 3.09Å; S229-E232 PolarHBondContact O-N 2.88Å; S229-E232 VanDerWaalsContact OG-CG 3.29Å; S229-E232 WeakPolarHBondContact OG-CG 3.2Å; S229-E232 PolarHBondContact OG-N 3.15Å; S229-E232 PolarHBondContact OG-OE2 2.89Å; S229-Q233 WeakPolarHBondContact O-CG 2.97Å; S229-Q233 PolarHBondContact O-N 3.06Å
230	S	78.8	Confident	87.7	Confident	74 Å²	74	64.2 Å²	64.2	52%	0.517	33%	0.326	S	S	.	.	H	α-helix	trans	-59.8	-22.6	177.2	70.3	0	0	0	0	113.5	R234	S230-R234 WeakPolarHBondContact O-CG 3.2Å; S230-R234 PolarHBondContact O-NH1 3.3Å
231	A	80.8	Confident	87.9	Confident	42 Å²	42	65.4 Å²	65.4	35%	0.347	33%	0.334	S	S	.	.	H	α-helix	trans	-75	-39.6	173.4	0	0	0	0	0	111.9	S229 R235	S229-A231 PolarHBondContact O-N 2.82Å; A231-R235 WeakPolarHBondContact O-CG 3.24Å; A231-R235 PolarHBondContact O-N 2.86Å
232	E	84.3	Confident	88.3	Confident	27 Å²	27	68.6 Å²	68.6	13%	0.126	35%	0.346	C	S	.	.	H	α-helix	trans	-69.3	-39.8	177.4	-73.7	159.1	149.1	0	0	111.9	R201 T203 L228 S229 R234 R235 L236	R201-E232 WeakPolarHBondContact CG-OE1 3.39Å; R201-E232 IonicContact NE-OE1 3.46Å; T203-E232 HydrophobicContact CG2-CB 4.18Å; T203-E232 WeakPolarHBondContact CG2-O 3.32Å; L228-E232 HydrophobicContact CD2-CB 4.22Å; S229-E232 VanDerWaalsContact CB-OE2 3.27Å; S229-E232 WeakPolarHBondContact CB-OE2 3.48Å; S229-E232 PolarHBondContact N-OE2 3.09Å; S229-E232 PolarHBondContact O-N 2.88Å; S229-E232 VanDerWaalsContact OG-CG 3.29Å; S229-E232 WeakPolarHBondContact OG-CG 3.2Å; S229-E232 PolarHBondContact OG-N 3.15Å; S229-E232 PolarHBondContact OG-OE2 2.89Å; E232-R234 VanDerWaalsContact C-N 3.28Å; E232-R234 PolarHBondContact O-N 3.15Å; E232-R235 CarbonylContact O-C 3.57Å; E232-R235 WeakPolarHBondContact O-CA 3.49Å; E232-R235 PolarHBondContact O-N 3.33Å; E232-L236 PolarHBondContact O-N 2.84Å
233	Q	81.6	Confident	88.6	Confident	39 Å²	39	73.9 Å²	73.9	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-56.8	-42.8	176.6	-65.1	171.2	14.3	0	0	111.8	I220 L228 S229 R235 L236 S248	I220-Q233 HydrophobicContact CG2-CB 4.42Å; I220-Q233 HydrophobicContact CG2-CG 3.96Å; L228-Q233 HydrophobicContact CB-CG 3.85Å; L228-Q233 PolarHBondContact O-NE2 2.98Å; S229-Q233 WeakPolarHBondContact O-CG 2.97Å; S229-Q233 PolarHBondContact O-N 3.06Å; Q233-R235 PolarHBondContact O-N 3.21Å; Q233-L236 PolarHBondContact O-N 2.97Å; Q233-S248 PolarHBondContact O-OG 2.84Å
234	R	84	Confident	89.2	Confident	161 Å²	161	69.2 Å²	69.2	61%	0.608	34%	0.336	S	S	*	.	H	α-helix	trans	-67.9	-19.1	176	-69.2	-177	-173	100.2	-7.8	113.7	S230 E232	S230-R234 WeakPolarHBondContact O-CG 3.2Å; S230-R234 PolarHBondContact O-NH1 3.3Å; E232-R234 VanDerWaalsContact C-N 3.28Å; E232-R234 PolarHBondContact O-N 3.15Å
235	R	87.8	Confident	89.7	Confident	157 Å²	157	71.1 Å²	71.1	59%	0.592	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-1.2	178.9	-69.3	175.1	-176.3	157.4	0.6	113.2	T203 A231 E232 Q233 M237	T203-R235 HydrophobicContact CG2-CB 3.74Å; A231-R235 WeakPolarHBondContact O-CG 3.24Å; A231-R235 PolarHBondContact O-N 2.86Å; E232-R235 CarbonylContact O-C 3.57Å; E232-R235 WeakPolarHBondContact O-CA 3.49Å; E232-R235 PolarHBondContact O-N 3.33Å; Q233-R235 PolarHBondContact O-N 3.21Å; R235-M237 PolarHBondContact O-N 3Å
236	L	92.4	Very high	90.1	Very high	1 Å²	1	72.2 Å²	72.2	1%	0.005	35%	0.354	C	S	.	.			trans	-86.4	84.9	175.1	-154.2	158.4	0	0	0	109.2	I202 W207 I220 E232 Q233 S248 L249	I202-L236 HydrophobicContact CD1-CD1 3.6Å; I202-L236 HydrophobicContact CG1-CD1 3.79Å; W207-L236 HydrophobicContact CD2-CD2 4.47Å; W207-L236 HydrophobicContact CG-CD2 4.01Å; I220-L236 HydrophobicContact CD1-CD1 3.82Å; E232-L236 PolarHBondContact O-N 2.84Å; Q233-L236 PolarHBondContact O-N 2.97Å; L236-S248 WeakPolarHBondContact O-CA 3.44Å; L236-L249 HydrophobicContact CD2-CB 3.58Å; L236-L249 HydrophobicContact CD2-CD2 3.56Å; L236-L249 HydrophobicContact CD2-CG 4.2Å; L236-L249 PolarHBondContact O-N 3.26Å
237	M	95.2	Very high	90.5	Very high	80 Å²	80	67.1 Å²	67.1	39%	0.394	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-96.1	140.8	-173.1	-57.9	-62.7	-112.4	0	0	111.6	R235 H246 L247	R235-M237 PolarHBondContact O-N 3Å; M237-H246 WeakPolarHBondContact CE-O 3.41Å; M237-L247 WeakPolarHBondContact CA-O 3.12Å
238	C	97.3	Very high	90.8	Very high	3 Å²	3	66.7 Å²	66.7	2%	0.02	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.4	169.6	-62.3	0	0	0	0	110.9	C209 L244 S245 H246 L247	C209-C238 HydrophobicContact CB-CB 3.8Å; C209-C238 WeakPolarHBondContact CB-SG 3.45Å; C209-C238 WeakPolarHBondContact SG-CA 3.46Å; C209-C238 WeakPolarHBondContact SG-CB 3.06Å; C209-C238 CovalentContact SG-SG 2.01Å; C209-C238 PolarHBondContact SG-SG 3.43Å; C238-L244 HydrophobicContact CB-CB 4.32Å; C238-L244 WeakPolarHBondContact CB-O 3.31Å; C238-S245 CarbonylContact O-C 3.52Å; C238-S245 WeakPolarHBondContact O-CA 3.38Å; C238-H246 PolarHBondContact O-N 3.05Å; C238-L247 PolarHBondContact N-O 3.14Å
239	A	97.7	Very high	91.2	Very high	44 Å²	44	66.6 Å²	66.6	36%	0.364	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-38.1	169.2	0	0	0	0	0	111.7	P206 W207	P206-A239 HydrophobicContact CB-CB 3.93Å; W207-A239 PolarHBondContact O-N 2.91Å
240	E	95.6	Very high	91.6	Very high	47 Å²	47	65.9 Å²	65.9	22%	0.22	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	151.7	174.9	-70.9	173.6	-141.1	0	0	109.8	R184 W207 R208 C209	R184-E240 IonicContact CZ-OE1 2.73Å; R184-E240 IonicContact NE-OE1 3.85Å; R184-E240 IonicContact NH1-OE1 3.86Å; R184-E240 PolarHBondContact NH1-OE1 2.99Å; R184-E240 IonicContact NH1-OE2 3.49Å; W207-E240 PolarHBondContact O-N 3.05Å; W207-E240 VanDerWaalsContact O-N 3.11Å; R208-E240 CarbonylContact C-O 3.59Å; R208-E240 WeakPolarHBondContact CA-O 3.21Å; R208-E240 HydrophobicContact CB-CB 4.09Å; R208-E240 HydrophobicContact CG-CB 3.92Å; R208-E240 IonicContact CZ-OE2 2.85Å; R208-E240 IonicContact NE-OE2 3.11Å; R208-E240 PolarHBondContact NE-OE2 3.4Å; R208-E240 IonicContact NH2-OE2 3.98Å; R208-E240 PolarHBondContact NH2-OE2 2.89Å; R208-E240 VanDerWaalsContact NH2-OE2 3.11Å; C209-E240 PolarHBondContact N-O 3.43Å
241	P	95.9	Very high	92.2	Very high	28 Å²	28	69.3 Å²	69.3	18%	0.182	34%	0.343	C	S	.	.	S	Bend	cis	-72.6	166.7	-11.6	31.5	-33.1	0	0	0	111.6	C209 R243 L244 S245 Y288	C209-P241 WeakPolarHBondContact O-CD 3.22Å; P241-R243 PolarHBondContact O-N 3.37Å; P241-L244 HydrophobicContact CG-CB 4.41Å; P241-L244 HydrophobicContact CG-CD1 4.21Å; P241-L244 HydrophobicContact CG-CG 4.17Å; P241-L244 PolarHBondContact O-N 3.11Å; P241-S245 PolarHBondContact O-N 3.3Å; P241-S245 VanDerWaalsContact O-N 3.1Å; P241-Y288 HydrophobicContact CB-CE2 4.28Å; P241-Y288 WeakPolarHBondContact CB-OH 3.32Å; P241-Y288 VanDerWaalsContact CD-OH 3.23Å; P241-Y288 WeakPolarHBondContact CD-OH 3.42Å
242	P	95.4	Very high	92.8	Very high	112 Å²	112	67.5 Å²	67.5	73%	0.727	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-22.3	-179.9	-28.1	35.2	0	0	0	115.4	L244 S245	P242-L244 VanDerWaalsContact C-N 3.34Å; P242-S245 PolarHBondContact O-OG 2.96Å
243	R	95.1	Very high	93.3	Very high	236 Å²	236	68.2 Å²	68.2	89%	0.891	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-25.3	175.8	-66.8	-176.8	178.5	155.5	-0.1	113.7	P241	P241-R243 PolarHBondContact O-N 3.37Å
244	L	96.3	Very high	93.9	Very high	21 Å²	21	69.9 Å²	69.9	11%	0.11	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-1.6	179.8	-58.9	-179.3	0	0	0	111.9	C209 C238 P241 P242 H246 L247 V252 L257	C209-L244 HydrophobicContact CB-CD1 4.04Å; C209-L244 WeakPolarHBondContact O-CD1 3.32Å; C238-L244 HydrophobicContact CB-CB 4.32Å; C238-L244 WeakPolarHBondContact CB-O 3.31Å; P241-L244 HydrophobicContact CG-CB 4.41Å; P241-L244 HydrophobicContact CG-CD1 4.21Å; P241-L244 HydrophobicContact CG-CG 4.17Å; P241-L244 PolarHBondContact O-N 3.11Å; P242-L244 VanDerWaalsContact C-N 3.34Å; L244-H246 PolarHBondContact O-N 3.33Å; L244-L247 HydrophobicContact CD2-CD1 4.04Å; L244-L247 WeakPolarHBondContact O-CB 3.21Å; L244-L247 PolarHBondContact O-N 3.39Å; L244-L247 VanDerWaalsContact O-N 3.11Å; L244-V252 HydrophobicContact CD1-CG1 3.97Å; L244-V252 HydrophobicContact CD2-CG1 4.31Å; L244-L257 HydrophobicContact CD1-CD2 4.36Å
245	S	96.1	Very high	94.3	Very high	40 Å²	40	68.3 Å²	68.3	28%	0.28	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	138.5	-179.1	61.3	0	0	0	0	111.1	C238 P241 P242 L247	C238-S245 CarbonylContact O-C 3.52Å; C238-S245 WeakPolarHBondContact O-CA 3.38Å; P241-S245 PolarHBondContact O-N 3.3Å; P241-S245 VanDerWaalsContact O-N 3.1Å; P242-S245 PolarHBondContact O-OG 2.96Å; S245-L247 PolarHBondContact O-N 3.43Å
246	H	94.5	Very high	94.7	Very high	149 Å²	149	63.4 Å²	63.4	69%	0.69	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	4.3	-178.7	-46.5	-70.4	0	0	0	115.8	M237 C238 L244	M237-H246 WeakPolarHBondContact CE-O 3.41Å; C238-H246 PolarHBondContact O-N 3.05Å; L244-H246 PolarHBondContact O-N 3.33Å
247	L	94.9	Very high	94.9	Very high	76 Å²	76	64 Å²	64	40%	0.398	35%	0.349	S	S	.	.	S	Bend	trans	-83.5	144.2	166.9	-59.5	-179.7	0	0	0	110	M237 C238 L244 S245 V252	M237-L247 WeakPolarHBondContact CA-O 3.12Å; C238-L247 PolarHBondContact N-O 3.14Å; L244-L247 HydrophobicContact CD2-CD1 4.04Å; L244-L247 WeakPolarHBondContact O-CB 3.21Å; L244-L247 PolarHBondContact O-N 3.39Å; L244-L247 VanDerWaalsContact O-N 3.11Å; S245-L247 PolarHBondContact O-N 3.43Å; L247-V252 HydrophobicContact CB-CG2 4.15Å
248	S	93.9	Very high	94.9	Very high	5 Å²	5	64 Å²	64	4%	0.035	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-68.8	134.4	169.7	174.9	0	0	0	0	109.5	Q233 L236 A250 E251 V252	Q233-S248 PolarHBondContact O-OG 2.84Å; L236-S248 WeakPolarHBondContact O-CA 3.44Å; S248-A250 PolarHBondContact O-N 3.35Å; S248-A250 VanDerWaalsContact O-N 3.13Å; S248-E251 WeakPolarHBondContact O-CB 3.19Å; S248-E251 PolarHBondContact O-N 3.35Å; S248-V252 PolarHBondContact O-N 3.45Å
249	L	94.9	Very high	94.8	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-34.1	178.9	-179.4	62.8	0	0	0	112.5	C209 L213 L216 R217 I220 L236 E251 V252 L257	C209-L249 HydrophobicContact CB-CD1 4.35Å; L213-L249 HydrophobicContact CD2-CD1 4.23Å; L213-L249 HydrophobicContact CD2-CD2 3.96Å; L213-L249 HydrophobicContact CG-CD2 4.12Å; L216-L249 HydrophobicContact CB-CD2 4.34Å; L216-L249 HydrophobicContact CD2-CD2 3.97Å; L216-L249 HydrophobicContact CG-CD2 4.04Å; R217-L249 HydrophobicContact CB-CD1 3.9Å; R217-L249 HydrophobicContact CB-CD2 4.29Å; R217-L249 HydrophobicContact CB-CG 3.85Å; R217-L249 HydrophobicContact CG-CD1 4.38Å; R217-L249 HydrophobicContact CG-CG 4.31Å; R217-L249 VanDerWaalsContact CG-O 3.27Å; R217-L249 WeakPolarHBondContact CG-O 3.41Å; I220-L249 HydrophobicContact CD1-CD2 3.92Å; L236-L249 HydrophobicContact CD2-CB 3.58Å; L236-L249 HydrophobicContact CD2-CD2 3.56Å; L236-L249 HydrophobicContact CD2-CG 4.2Å; L236-L249 PolarHBondContact O-N 3.26Å; L249-E251 VanDerWaalsContact C-N 3.27Å; L249-E251 PolarHBondContact O-N 3.44Å; L249-V252 PolarHBondContact O-N 3.39Å; L249-L257 HydrophobicContact CD1-CD1 4.48Å; L249-L257 HydrophobicContact CD1-CD2 4.39Å
250	A	91.3	Very high	94.7	Very high	42 Å²	42	67.4 Å²	67.4	35%	0.347	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-28.8	179	0	0	0	0	0	112.9	I220 S248	I220-A250 HydrophobicContact CG2-CB 4.3Å; S248-A250 PolarHBondContact O-N 3.35Å; S248-A250 VanDerWaalsContact O-N 3.13Å
251	E	90.8	Very high	94.7	Very high	145 Å²	145	67.8 Å²	67.8	68%	0.678	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-17.7	-179.4	-63.1	174.8	174.2	0	0	112.4	S248 L249 A253	S248-E251 WeakPolarHBondContact O-CB 3.19Å; S248-E251 PolarHBondContact O-N 3.35Å; L249-E251 VanDerWaalsContact C-N 3.27Å; L249-E251 PolarHBondContact O-N 3.44Å; E251-A253 PolarHBondContact O-N 2.88Å
252	V	94.6	Very high	94.6	Very high	5 Å²	5	66.5 Å²	66.5	3%	0.03	36%	0.363	C	S	.	.	S	Bend	trans	-67.9	128.3	177.5	179.6	0	0	0	0	110.2	R217 L244 L247 S248 L249 L257	R217-V252 PolarHBondContact NE-O 3.26Å; L244-V252 HydrophobicContact CD1-CG1 3.97Å; L244-V252 HydrophobicContact CD2-CG1 4.31Å; L247-V252 HydrophobicContact CB-CG2 4.15Å; S248-V252 PolarHBondContact O-N 3.45Å; L249-V252 PolarHBondContact O-N 3.39Å; V252-L257 HydrophobicContact CG1-CD2 3.75Å; V252-L257 HydrophobicContact CG1-CG 3.97Å
253	A	94.2	Very high	94.5	Very high	41 Å²	41	62.9 Å²	62.9	34%	0.339	34%	0.339	S	S	.	.			trans	-65.7	136.8	175.8	0	0	0	0	0	110.6	E251 N255 S256	E251-A253 PolarHBondContact O-N 2.88Å; A253-N255 WeakPolarHBondContact CB-OD1 3.34Å; A253-N255 PolarHBondContact O-N 2.8Å; A253-N255 VanDerWaalsContact O-N 3.11Å; A253-S256 VanDerWaalsContact O-CB 3.32Å; A253-S256 WeakPolarHBondContact O-CB 3.49Å; A253-S256 PolarHBondContact O-N 3.13Å
254	P	93.2	Very high	94.3	Very high	75 Å²	75	51.6 Å²	51.6	49%	0.487	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-54.4	-35.9	-176.2	-28.3	34.4	0	0	0	114.6	R217 S256 L257	R217-P254 VanDerWaalsContact CZ-CG 3.49Å; P254-S256 PolarHBondContact O-N 3.34Å; P254-L257 PolarHBondContact O-N 3.24Å
255	N	93.9	Very high	93.9	Very high	127 Å²	127	55.2 Å²	55.2	68%	0.679	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-72.4	-11.8	178.8	63.6	-17.3	0	0	0	114	A253 V258	A253-N255 WeakPolarHBondContact CB-OD1 3.34Å; A253-N255 PolarHBondContact O-N 2.8Å; A253-N255 VanDerWaalsContact O-N 3.11Å; N255-V258 WeakPolarHBondContact O-CG2 3.48Å
256	S	95.9	Very high	93.4	Very high	55 Å²	55	53.5 Å²	53.5	39%	0.385	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-87	-15.1	176.4	-57.7	0	0	0	0	112.5	A253 P254 V258	A253-S256 VanDerWaalsContact O-CB 3.32Å; A253-S256 WeakPolarHBondContact O-CB 3.49Å; A253-S256 PolarHBondContact O-N 3.13Å; P254-S256 PolarHBondContact O-N 3.34Å; S256-V258 PolarHBondContact O-N 2.87Å; S256-V258 VanDerWaalsContact O-N 3.14Å
257	L	96.1	Very high	92.8	Very high	14 Å²	14	54.7 Å²	54.7	7%	0.073	31%	0.306	C	S	.	.			trans	-83.1	83.6	176	-63.7	180	0	0	0	109.7	C209 D210 C211 R217 L244 L249 V252 P254	C209-L257 VanDerWaalsContact C-CD2 3.45Å; C209-L257 HydrophobicContact CB-CD2 3.74Å; C209-L257 WeakPolarHBondContact O-CD2 3.48Å; D210-L257 WeakPolarHBondContact O-CB 3.42Å; C211-L257 WeakPolarHBondContact CA-O 3.32Å; C211-L257 WeakPolarHBondContact CB-O 3.27Å; R217-L257 HydrophobicContact CB-CD1 3.86Å; R217-L257 HydrophobicContact CG-CD1 4.1Å; L244-L257 HydrophobicContact CD1-CD2 4.36Å; L249-L257 HydrophobicContact CD1-CD1 4.48Å; L249-L257 HydrophobicContact CD1-CD2 4.39Å; V252-L257 HydrophobicContact CG1-CD2 3.75Å; V252-L257 HydrophobicContact CG1-CG 3.97Å; P254-L257 PolarHBondContact O-N 3.24Å
258	V	95.3	Very high	92.3	Very high	79 Å²	79	53.9 Å²	53.9	48%	0.479	31%	0.306	S	S	.	.			trans	-111.8	143.2	-170.3	-178.6	0	0	0	0	111.3	N255 S256	N255-V258 WeakPolarHBondContact O-CG2 3.48Å; S256-V258 PolarHBondContact O-N 2.87Å; S256-V258 VanDerWaalsContact O-N 3.14Å
259	C	96.3	Very high	91.8	Very high	18 Å²	18	55.8 Å²	55.8	12%	0.122	32%	0.315	C	S	.	.			trans	-116.2	147	163.4	-62.9	0	0	0	0	110	C211 Y288	C211-C259 HydrophobicContact CB-CB 3.85Å; C211-C259 WeakPolarHBondContact CB-SG 3.43Å; C211-C259 PolarHBondContact N-SG 2.8Å; C211-C259 WeakPolarHBondContact SG-CB 3.19Å; C211-C259 CovalentContact SG-SG 2.02Å; C211-C259 PolarHBondContact SG-SG 3.27Å; C259-Y288 CarbonylContact C-O 3.54Å; C259-Y288 WeakPolarHBondContact CA-O 3.44Å; C259-Y288 VanDerWaalsContact CB-O 3.23Å; C259-Y288 WeakPolarHBondContact CB-O 3.42Å
260	I	95	Very high	91.4	Very high	101 Å²	101	58.9 Å²	58.9	52%	0.518	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	114.8	174.2	-54.7	170.6	0	0	0	106.3	Y288 N390	I260-Y288 PolarHBondContact N-O 3.11Å; I260-Y288 PolarHBondContact O-N 3.21Å; I260-N390 PolarHBondContact O-ND2 2.84Å
261	P	95.1	Very high	91.2	Very high	55 Å²	55	59.5 Å²	59.5	36%	0.357	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	153.1	-179.4	-22.5	31.5	0	0	0	112.3	A331	P261-A331 HydrophobicContact CB-CB 3.61Å
262	P	94.6	Very high	91.1	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	141.4	-177	25.1	-30.4	0	0	0	111.8	S286 P291 A331 A388 N390 G393 A395	P262-S286 CarbonylContact C-O 3.35Å; P262-S286 VanDerWaalsContact CA-O 3.24Å; P262-S286 WeakPolarHBondContact CA-O 3.41Å; P262-P291 HydrophobicContact CB-CB 3.9Å; P262-P291 HydrophobicContact CB-CG 4.11Å; P262-A331 HydrophobicContact CG-CB 4.03Å; P262-A331 WeakPolarHBondContact O-CB 3.41Å; P262-A331 PolarHBondContact O-N 3.33Å; P262-A388 HydrophobicContact CB-CB 4.06Å; P262-A388 WeakPolarHBondContact CG-O 3.4Å; P262-N390 WeakPolarHBondContact CD-OD1 3.28Å; P262-G393 WeakPolarHBondContact CD-O 3.48Å; P262-G393 WeakPolarHBondContact CG-O 3.44Å; P262-A395 HydrophobicContact CB-CB 4.17Å; P262-A395 HydrophobicContact CG-CB 3.95Å; P262-A395 WeakPolarHBondContact O-CB 3.5Å
263	V	92.8	Very high	90.7	Very high	36 Å²	36	55.8 Å²	55.8	22%	0.218	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.7	170.2	-177.6	0	0	0	0	107.7	A285 S286 V328 T330	V263-A285 WeakPolarHBondContact O-CA 3.19Å; V263-S286 PolarHBondContact N-O 2.94Å; V263-S286 PolarHBondContact O-N 2.73Å; V263-S286 PolarHBondContact O-OG 2.91Å; V263-V328 HydrophobicContact CG1-CG1 3.39Å; V263-T330 HydrophobicContact CG1-CG2 4.26Å; V263-T330 HydrophobicContact CG2-CG2 4.13Å
264	V	90.4	Very high	90.5	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.6	-174	-177.2	0	0	0	0	110.3	C283 Q284 A285 V328 V329 A388 A395 V397	V264-C283 WeakPolarHBondContact CG1-SG 3.2Å; V264-Q284 CarbonylContact C-O 3.22Å; V264-Q284 WeakPolarHBondContact CA-O 3.5Å; V264-A285 HydrophobicContact CG2-CB 4.15Å; V264-V328 WeakPolarHBondContact O-CA 3.05Å; V264-V329 PolarHBondContact N-O 3.16Å; V264-V329 PolarHBondContact O-N 2.9Å; V264-A388 HydrophobicContact CG2-CB 3.38Å; V264-A395 HydrophobicContact CB-CB 4.46Å; V264-A395 HydrophobicContact CG2-CB 3.58Å; V264-V397 HydrophobicContact CB-CG1 4.44Å; V264-V397 HydrophobicContact CG1-CB 4.31Å; V264-V397 HydrophobicContact CG1-CG1 3.49Å; V264-V397 VanDerWaalsContact CG1-CG1 3.49Å
265	Q	87.6	Confident	90.2	Very high	97 Å²	97	60.7 Å²	60.7	45%	0.453	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.3	174.5	-61.9	-177.3	-10	0	0	108.4	Q284 V328	Q265-Q284 PolarHBondContact N-O 2.02Å; Q265-Q284 PolarHBondContact O-N 2.79Å; Q265-V328 HydrophobicContact CG-CG2 4.3Å
266	L	86.6	Confident	89.7	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	114	179.8	177.1	73.3	0	0	0	109.6	N269 V281 C283 W295 V397 F399	L266-N269 HydrophobicContact CD2-CB 4.33Å; L266-V281 HydrophobicContact CD1-CG1 3.68Å; L266-C283 HydrophobicContact CD1-CB 4.43Å; L266-W295 HydrophobicContact CD1-CH2 3.56Å; L266-W295 HydrophobicContact CD1-CZ2 3.96Å; L266-V397 HydrophobicContact CB-CG1 3.77Å; L266-V397 HydrophobicContact CB-CG2 3.97Å; L266-V397 HydrophobicContact CD2-CG1 3.94Å; L266-V397 HydrophobicContact CD2-CG2 3.85Å; L266-V397 HydrophobicContact CG-CG1 4.37Å; L266-F399 HydrophobicContact CD2-CB 3.85Å
267	E	80.8	Confident	89.4	Confident	173 Å²	173	58 Å²	58	81%	0.808	31%	0.307	S	S	*	.	S	Bend	trans	-138.4	122.7	175.1	-65.5	-172.2	168.5	0	0	109.9
268	P	84.6	Confident	89	Confident	60 Å²	60	60.9 Å²	60.9	39%	0.39	33%	0.329	S	S	.	.			cis	-79.3	154.1	-4.6	33.6	-34.6	0	0	0	113.2	L271 F399	P268-L271 HydrophobicContact CG-CD1 4.32Å; P268-F399 WeakPolarHBondContact O-CD2 3.43Å
269	N	82.9	Confident	88.7	Confident	44 Å²	44	57.6 Å²	57.6	24%	0.235	31%	0.308	C	S	.	.	S	Bend	trans	-84.3	-10.5	174.3	69	-16.4	0	0	0	113.8	L266 G324 G326 F399 H400	L266-N269 HydrophobicContact CD2-CB 4.33Å; N269-G324 PolarHBondContact ND2-O 3.25Å; N269-G326 VanDerWaalsContact ND2-CA 3.27Å; N269-G326 WeakPolarHBondContact ND2-CA 3.35Å; N269-G326 PolarHBondContact ND2-N 2.65Å; N269-F399 WeakPolarHBondContact O-CA 3.45Å; N269-H400 PolarHBondContact O-N 3.31Å
270	H	87.4	Confident	88.3	Confident	65 Å²	65	64 Å²	64	30%	0.301	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	135.6	175.4	170.6	-83.7	0	0	0	110.1	T272 H400	H270-T272 PolarHBondContact CE1-OG1 3.46Å; H270-H400 CarbonylContact C-O 3.04Å; H270-H400 VanDerWaalsContact CA-O 3.29Å; H270-H400 WeakPolarHBondContact CA-O 3.45Å; H270-H400 HydrophobicContact CB-CB 4.33Å
271	L	88.3	Confident	87.9	Confident	56 Å²	56	59.2 Å²	59.2	29%	0.293	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.8	175.4	-165.2	66	0	0	0	110.7	P268 V273 L279 F399 H400 A402	P268-L271 HydrophobicContact CG-CD1 4.32Å; L271-V273 HydrophobicContact CD2-CG2 3.54Å; L271-V273 HydrophobicContact CG-CG2 3.73Å; L271-L279 HydrophobicContact CD2-CB 4.13Å; L271-F399 HydrophobicContact CB-CE2 3.85Å; L271-F399 HydrophobicContact CB-CZ 3.63Å; L271-H400 PolarHBondContact N-O 2.94Å; L271-A402 PolarHBondContact O-N 3.34Å
272	T	87.3	Confident	87.6	Confident	64 Å²	64	58.6 Å²	58.6	39%	0.393	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.2	169	-55.1	0	0	0	0	109	H270 L310 A402 N404	H270-T272 PolarHBondContact CE1-OG1 3.46Å; T272-L310 HydrophobicContact CG2-CD2 3.56Å; T272-A402 CarbonylContact C-O 3.59Å; T272-A402 VanDerWaalsContact CA-O 3.28Å; T272-A402 WeakPolarHBondContact CA-O 3.26Å; T272-A402 HydrophobicContact CG2-CB 4.19Å; T272-N404 HydrophobicContact CG2-CB 4.02Å
273	V	87.4	Confident	87.3	Confident	8 Å²	8	58.8 Å²	58.8	5%	0.048	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.7	-173.3	-179.4	0	0	0	0	110	L271 E277 L279 V376 L401 A402 V403 N404	L271-V273 HydrophobicContact CD2-CG2 3.54Å; L271-V273 HydrophobicContact CG-CG2 3.73Å; V273-E277 HydrophobicContact CG1-CB 3.6Å; V273-L279 HydrophobicContact CB-CD2 4.33Å; V273-L279 HydrophobicContact CG1-CD2 4.48Å; V273-L279 HydrophobicContact CG2-CB 4.06Å; V273-L279 HydrophobicContact CG2-CD2 3.69Å; V273-V376 HydrophobicContact CG1-CB 4.21Å; V273-V376 HydrophobicContact CG1-CG1 4.31Å; V273-V376 HydrophobicContact CG1-CG2 4.15Å; V273-L401 HydrophobicContact CB-CD1 4.19Å; V273-L401 HydrophobicContact CG2-CD1 3.76Å; V273-A402 PolarHBondContact N-O 2.91Å; V273-V403 CarbonylContact O-C 3.6Å; V273-V403 WeakPolarHBondContact O-CA 3.47Å; V273-N404 PolarHBondContact O-N 3.13Å
274	R	88.3	Confident	87.2	Confident	130 Å²	130	63.1 Å²	63.1	49%	0.491	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	156.4	177.6	-57.2	180	178.2	-112.1	1.6	110.9	G276 E277	R274-G276 PolarHBondContact O-N 3.24Å; R274-E277 HydrophobicContact CB-CG 3.98Å; R274-E277 WeakPolarHBondContact CB-OE2 3.35Å; R274-E277 WeakPolarHBondContact CD-OE1 3.36Å; R274-E277 PolarHBondContact N-OE2 2.89Å; R274-E277 WeakPolarHBondContact O-CB 3.42Å; R274-E277 PolarHBondContact O-N 3.48Å; R274-E277 VanDerWaalsContact O-N 3.15Å
275	L	86.9	Confident	87.2	Confident	89 Å²	89	63.8 Å²	63.8	47%	0.466	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	127.4	176.2	-148.9	150.6	0	0	0	110.1	V376 V378 N404 M405	L275-V376 WeakPolarHBondContact CA-O 3.5Å; L275-V378 HydrophobicContact CD1-CG2 3.86Å; L275-N404 PolarHBondContact N-O 3.46Å; L275-M405 HydrophobicContact CD1-CE 4.04Å; L275-M405 HydrophobicContact CD1-CG 3.91Å
276	G	85.1	Confident	87.5	Confident	36 Å²	36	62 Å²	62	37%	0.371	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	-7.9	-178.1	0	0	0	0	0	115.9	R274 N375 V376	R274-G276 PolarHBondContact O-N 3.24Å; G276-N375 WeakPolarHBondContact CA-OD1 3.27Å; G276-V376 PolarHBondContact N-O 3Å
277	E	88.7	Confident	87.8	Confident	89 Å²	89	62.6 Å²	62.6	42%	0.416	33%	0.333	S	S	.	.			trans	-72.9	165.5	173.2	-75.5	179	167.2	0	0	111.7	V273 R274 N375 V376	V273-E277 HydrophobicContact CG1-CB 3.6Å; R274-E277 HydrophobicContact CB-CG 3.98Å; R274-E277 WeakPolarHBondContact CB-OE2 3.35Å; R274-E277 WeakPolarHBondContact CD-OE1 3.36Å; R274-E277 PolarHBondContact N-OE2 2.89Å; R274-E277 WeakPolarHBondContact O-CB 3.42Å; R274-E277 PolarHBondContact O-N 3.48Å; R274-E277 VanDerWaalsContact O-N 3.15Å; E277-N375 PolarHBondContact O-N 2.84Å; E277-V376 WeakPolarHBondContact O-CB 3.23Å; E277-V376 WeakPolarHBondContact O-CG2 3.29Å; E277-V376 PolarHBondContact O-N 2.87Å
278	S	88.1	Confident	88.4	Confident	75 Å²	75	57 Å²	57	52%	0.524	30%	0.304	S	S	.	.			trans	-111	144.6	172.1	-55.5	0	0	0	0	109.7	L373 S374	S278-L373 CarbonylContact C-O 3.2Å; S278-L373 WeakPolarHBondContact CA-O 3.24Å; S278-S374 WeakPolarHBondContact OG-CA 3.37Å
279	L	87.7	Confident	88.9	Confident	9 Å²	9	54.3 Å²	54.3	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.3	177.4	73.9	90.1	0	0	0	111.7	L271 V273 V281 F372 L373 V376 L401	L271-L279 HydrophobicContact CD2-CB 4.13Å; V273-L279 HydrophobicContact CB-CD2 4.33Å; V273-L279 HydrophobicContact CG1-CD2 4.48Å; V273-L279 HydrophobicContact CG2-CB 4.06Å; V273-L279 HydrophobicContact CG2-CD2 3.69Å; L279-V281 HydrophobicContact CD1-CG2 3.84Å; L279-F372 WeakPolarHBondContact O-CD2 3.42Å; L279-L373 HydrophobicContact CD1-CD1 4.43Å; L279-L373 HydrophobicContact CD1-CG 4.45Å; L279-L373 HydrophobicContact CD2-CB 4.43Å; L279-L373 HydrophobicContact CD2-CD1 4.15Å; L279-L373 HydrophobicContact CG-CB 4.08Å; L279-L373 HydrophobicContact CG-CD1 4.43Å; L279-L373 HydrophobicContact CG-CG 4.48Å; L279-L373 PolarHBondContact N-O 3.4Å; L279-L373 PolarHBondContact O-N 2.92Å; L279-V376 HydrophobicContact CD2-CG2 3.95Å; L279-V376 HydrophobicContact CG-CG2 4.42Å; L279-L401 HydrophobicContact CD2-CD1 3.45Å; L279-L401 VanDerWaalsContact CD2-CD1 3.45Å; L279-L401 HydrophobicContact CD2-CD2 3.61Å; L279-L401 HydrophobicContact CD2-CG 4.2Å
280	R	88.2	Confident	89.4	Confident	152 Å²	152	58.1 Å²	58.1	57%	0.574	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	122.3	176.3	-179.1	177.5	-67.8	-84.3	-0.2	108.9	M370 L371 F372	R280-M370 HydrophobicContact CG-CE 3.21Å; R280-L371 CarbonylContact C-O 3.56Å; R280-L371 WeakPolarHBondContact CA-O 3.4Å; R280-F372 HydrophobicContact CB-CD2 4.22Å
281	V	87.9	Confident	89.6	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.9	179.4	178.6	0	0	0	0	108.9	L266 L279 W295 M370 L371 F399	L266-V281 HydrophobicContact CD1-CG1 3.68Å; L279-V281 HydrophobicContact CD1-CG2 3.84Å; V281-W295 HydrophobicContact CG1-CH2 3.98Å; V281-W295 HydrophobicContact CG1-CZ2 4.05Å; V281-M370 CarbonylContact O-C 3.5Å; V281-M370 WeakPolarHBondContact O-CA 3.35Å; V281-L371 HydrophobicContact CB-CB 4.33Å; V281-L371 PolarHBondContact N-O 3.04Å; V281-L371 PolarHBondContact O-N 3.17Å; V281-F399 HydrophobicContact CG1-CD2 4.14Å; V281-F399 HydrophobicContact CG1-CE2 4.22Å; V281-F399 HydrophobicContact CG2-CD2 4.49Å; V281-F399 HydrophobicContact CG2-CE1 4.08Å; V281-F399 HydrophobicContact CG2-CE2 3.82Å; V281-F399 HydrophobicContact CG2-CZ 3.59Å
282	S	87.4	Confident	89.8	Confident	41 Å²	41	58.2 Å²	58.2	29%	0.287	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.4	178.1	-167.3	0	0	0	0	110.6	M370	S282-M370 WeakPolarHBondContact CA-SD 3.1Å; S282-M370 WeakPolarHBondContact CB-SD 3.49Å; S282-M370 PolarHBondContact OG-SD 3.14Å
283	C	88.6	Confident	90	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.027	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	104.4	166.4	-174.2	0	0	0	0	108.4	V264 L266 V293 W295 G369 C386	V264-C283 WeakPolarHBondContact CG1-SG 3.2Å; L266-C283 HydrophobicContact CD1-CB 4.43Å; C283-V293 HydrophobicContact CB-CG1 4.02Å; C283-W295 HydrophobicContact CB-CH2 4.35Å; C283-W295 HydrophobicContact CB-CZ2 3.48Å; C283-W295 VanDerWaalsContact CB-CZ2 3.48Å; C283-G369 PolarHBondContact N-O 2.96Å; C283-C386 HydrophobicContact CB-CB 3.78Å; C283-C386 WeakPolarHBondContact CB-SG 3.2Å; C283-C386 WeakPolarHBondContact SG-CB 3.35Å; C283-C386 CovalentContact SG-SG 2.01Å; C283-C386 PolarHBondContact SG-SG 2.86Å
284	Q	90	Very high	90.2	Very high	127 Å²	127	58.5 Å²	58.5	59%	0.593	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.5	176.8	-77.9	-175.3	6.2	0	0	109.9	V264 Q265	V264-Q284 CarbonylContact C-O 3.22Å; V264-Q284 WeakPolarHBondContact CA-O 3.5Å; Q265-Q284 PolarHBondContact N-O 2.02Å; Q265-Q284 PolarHBondContact O-N 2.79Å
285	A	91.8	Very high	90.2	Very high	15 Å²	15	53 Å²	53	12%	0.124	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134.6	175	0	0	0	0	0	110.4	V263 V264 Q290 P291 V293 A388	V263-A285 WeakPolarHBondContact O-CA 3.19Å; V264-A285 HydrophobicContact CG2-CB 4.15Å; A285-Q290 PolarHBondContact O-NE2 3.26Å; A285-P291 HydrophobicContact CB-CB 4.41Å; A285-P291 HydrophobicContact CB-CG 3.58Å; A285-V293 HydrophobicContact CB-CG2 3.53Å; A285-A388 HydrophobicContact CB-CB 3.55Å
286	S	93.1	Very high	90.2	Very high	60 Å²	60	52.2 Å²	52.2	42%	0.42	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.2	172.9	62.2	0	0	0	0	109.4	P262 V263	P262-S286 CarbonylContact C-O 3.35Å; P262-S286 VanDerWaalsContact CA-O 3.24Å; P262-S286 WeakPolarHBondContact CA-O 3.41Å; V263-S286 PolarHBondContact N-O 2.94Å; V263-S286 PolarHBondContact O-N 2.73Å; V263-S286 PolarHBondContact O-OG 2.91Å
287	G	93.7	Very high	90.2	Very high	16 Å²	16	53.2 Å²	53.2	17%	0.165	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.4	161.4	-177.2	0	0	0	0	0	112.8	P289 Q290	G287-P289 CarbonylContact C-O 3.44Å; G287-P289 CarbonylContact O-C 3.5Å; G287-Q290 PolarHBondContact O-N 3.02Å
288	Y	93.4	Very high	89.7	Confident	55 Å²	55	51.1 Å²	51.1	22%	0.216	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	104	178	-175	-38.1	0	0	0	115.7	R208 D210 P241 C259 I260 N390	R208-Y288 WeakPolarHBondContact CG-OH 3.3Å; D210-Y288 HydrophobicContact CB-CE1 3.73Å; P241-Y288 HydrophobicContact CB-CE2 4.28Å; P241-Y288 WeakPolarHBondContact CB-OH 3.32Å; P241-Y288 VanDerWaalsContact CD-OH 3.23Å; P241-Y288 WeakPolarHBondContact CD-OH 3.42Å; C259-Y288 CarbonylContact C-O 3.54Å; C259-Y288 WeakPolarHBondContact CA-O 3.44Å; C259-Y288 VanDerWaalsContact CB-O 3.23Å; C259-Y288 WeakPolarHBondContact CB-O 3.42Å; I260-Y288 PolarHBondContact N-O 3.11Å; I260-Y288 PolarHBondContact O-N 3.21Å; Y288-N390 PolarHBondContact N-ND2 3.35Å; Y288-N390 PolarHBondContact O-ND2 3.04Å
289	P	94.3	Very high	88.9	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.019	25%	0.249	C	C	.	.	S	Bend	cis	-65.7	171.7	-12	28.7	-36.1	0	0	0	113.2	D210 G287 P291 N390 P391	D210-P289 WeakPolarHBondContact OD2-CD 2.96Å; G287-P289 CarbonylContact C-O 3.44Å; G287-P289 CarbonylContact O-C 3.5Å; P289-P291 WeakPolarHBondContact O-CD 3.33Å; P289-P291 VanDerWaalsContact O-N 3.12Å; P289-N390 HydrophobicContact CG-CB 4.42Å; P289-N390 WeakPolarHBondContact O-CB 3.08Å; P289-N390 PolarHBondContact O-ND2 2.85Å; P289-P391 HydrophobicContact CG-CG 4.18Å
290	Q	93	Very high	87.5	Confident	124 Å²	124	56.6 Å²	56.6	58%	0.579	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-52.1	118.4	179.8	-174.9	61.6	23.4	0	0	110.3	A285 G287	A285-Q290 PolarHBondContact O-NE2 3.26Å; G287-Q290 PolarHBondContact O-N 3.02Å
291	P	93.3	Very high	85.8	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.039	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-71.8	148.3	-174.6	27.9	-35	0	0	0	112.2	P262 A285 P289 A388 W389 N390	P262-P291 HydrophobicContact CB-CB 3.9Å; P262-P291 HydrophobicContact CB-CG 4.11Å; A285-P291 HydrophobicContact CB-CB 4.41Å; A285-P291 HydrophobicContact CB-CG 3.58Å; P289-P291 WeakPolarHBondContact O-CD 3.33Å; P289-P291 VanDerWaalsContact O-N 3.12Å; P291-A388 HydrophobicContact CB-CB 4.31Å; P291-W389 CarbonylContact C-O 3.59Å; P291-W389 WeakPolarHBondContact CA-O 3.42Å; P291-W389 WeakPolarHBondContact CB-O 3.48Å; P291-N390 HydrophobicContact CB-CB 4.15Å
292	Q	92.1	Very high	83.9	Confident	118 Å²	118	61.9 Å²	61.9	55%	0.551	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.1	170.5	-63	-58	-61.4	0	0	108.9	A388 W389	Q292-A388 WeakPolarHBondContact O-CA 3.44Å; Q292-W389 PolarHBondContact N-O 3.1Å; Q292-W389 PolarHBondContact O-N 2.67Å
293	V	91.6	Very high	82.1	Confident	15 Å²	15	61.2 Å²	61.2	9%	0.091	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.8	-176.7	-176.4	0	0	0	0	109.8	C283 A285 C386 E387 A388	C283-V293 HydrophobicContact CB-CG1 4.02Å; A285-V293 HydrophobicContact CB-CG2 3.53Å; V293-C386 WeakPolarHBondContact CG1-SG 3.17Å; V293-E387 WeakPolarHBondContact CA-O 3.43Å; V293-A388 HydrophobicContact CG2-CB 4.22Å
294	T	90.9	Very high	80.3	Confident	63 Å²	63	67 Å²	67	39%	0.387	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.7	-179.5	56.5	0	0	0	0	110.7	C386 E387	T294-C386 CarbonylContact O-C 3.2Å; T294-C386 WeakPolarHBondContact O-CA 3.41Å; T294-E387 PolarHBondContact N-O 2.81Å; T294-E387 PolarHBondContact O-N 2.96Å; T294-E387 PolarHBondContact OG1-O 2.74Å
295	W	88.7	Confident	78.6	Confident	14 Å²	14	66 Å²	66	5%	0.053	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.3	176	-77.1	100.7	0	0	0	110	L266 V281 C283 G369 L371 C386 F399	L266-W295 HydrophobicContact CD1-CH2 3.56Å; L266-W295 HydrophobicContact CD1-CZ2 3.96Å; V281-W295 HydrophobicContact CG1-CH2 3.98Å; V281-W295 HydrophobicContact CG1-CZ2 4.05Å; C283-W295 HydrophobicContact CB-CH2 4.35Å; C283-W295 HydrophobicContact CB-CZ2 3.48Å; C283-W295 VanDerWaalsContact CB-CZ2 3.48Å; W295-G369 PolarHBondContact NE1-O 2.74Å; W295-L371 HydrophobicContact CD2-CB 3.82Å; W295-L371 HydrophobicContact CE3-CB 4.3Å; W295-L371 HydrophobicContact CE3-CD2 4.3Å; W295-L371 HydrophobicContact CG-CB 4.07Å; W295-L371 HydrophobicContact CH2-CB 4.45Å; W295-L371 HydrophobicContact CZ2-CB 4Å; W295-L371 HydrophobicContact CZ3-CD2 4.32Å; W295-C386 HydrophobicContact CD2-CB 3.9Å; W295-C386 HydrophobicContact CE3-CB 3.74Å; W295-C386 HydrophobicContact CH2-CB 3.83Å; W295-C386 HydrophobicContact CZ2-CB 3.96Å; W295-C386 HydrophobicContact CZ3-CB 3.69Å; W295-F399 HydrophobicContact CH2-CB 3.89Å; W295-F399 HydrophobicContact CH2-CG 4.38Å; W295-F399 HydrophobicContact CZ3-CB 3.68Å; W295-F399 HydrophobicContact CZ3-CG 4.4Å
296	K	86.9	Confident	76.8	Confident	73 Å²	73	67.2 Å²	67.2	32%	0.317	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.2	172.4	65.5	-168.5	-179.4	-167.6	0	110.9	A298 Y384 E385 E387	K296-A298 PolarHBondContact O-N 2.72Å; K296-Y384 CarbonylContact O-C 3.59Å; K296-Y384 WeakPolarHBondContact O-CA 3.42Å; K296-E385 WeakPolarHBondContact CE-OE2 3.33Å; K296-E385 HydrophobicContact CG-CB 4.01Å; K296-E385 PolarHBondContact N-O 3.12Å; K296-E385 IonicContact NZ-OE2 2.74Å; K296-E385 PolarHBondContact NZ-OE2 3.49Å; K296-E385 PolarHBondContact O-N 2.93Å; K296-E387 IonicContact NZ-OE2 3.47Å; K296-E387 PolarHBondContact NZ-OE2 2.97Å
297	K	85.1	Confident	74.6	Confident	56 Å²	56	71.2 Å²	71.2	24%	0.243	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115.5	169.5	-164.8	-178	-177.7	-167.7	0	108.1	S299 A379 A381 R383 Y384	K297-S299 VanDerWaalsContact C-N 3.35Å; K297-S299 WeakPolarHBondContact CE-O 3.37Å; K297-A379 PolarHBondContact NZ-O 2.91Å; K297-A381 PolarHBondContact NZ-O 2.83Å; K297-R383 CarbonylContact C-O 3.38Å; K297-Y384 HydrophobicContact CB-CD1 4.13Å; K297-Y384 HydrophobicContact CB-CE1 3.95Å; K297-Y384 HydrophobicContact CD-CE1 4.36Å; K297-Y384 HydrophobicContact CG-CD1 4.28Å; K297-Y384 HydrophobicContact CG-CE1 3.93Å
298	A	78.4	Confident	72.8	Confident	46 Å²	46	80.7 Å²	80.7	38%	0.38	41%	0.413	S	S	.	.			trans	-85	-9.1	-176.4	0	0	0	0	0	113.1	K296 R383 E385	K296-A298 PolarHBondContact O-N 2.72Å; A298-R383 HydrophobicContact CB-CB 4.27Å; A298-R383 HydrophobicContact CB-CG 4.06Å; A298-R383 PolarHBondContact N-O 3.36Å; A298-E385 HydrophobicContact CB-CB 4.49Å
299	S	71.8	Confident	70.9	Confident	15 Å²	15	78.9 Å²	78.9	11%	0.105	41%	0.411	C	S	.	.			trans	-118.8	134.6	-178.4	62.4	0	0	0	0	113.8	K297 E313 G382 R383	K297-S299 VanDerWaalsContact C-N 3.35Å; K297-S299 WeakPolarHBondContact CE-O 3.37Å; S299-E313 VanDerWaalsContact CB-CD 3.46Å; S299-E313 VanDerWaalsContact CB-OE1 3.29Å; S299-E313 WeakPolarHBondContact CB-OE1 3.35Å; S299-E313 WeakPolarHBondContact CB-OE2 3.48Å; S299-E313 PolarHBondContact OG-OE1 2.81Å; S299-E313 PolarHBondContact OG-OE2 3.24Å; S299-G382 WeakPolarHBondContact OG-CA 3.34Å; S299-R383 PolarHBondContact OG-N 3.06Å
300	H	56.9	Low	69	Low	183 Å²	183	81.6 Å²	81.6	85%	0.847	43%	0.425	S	S	*	.			trans	-126.8	18.4	-173.9	-65.4	-78.4	0	0	0	112.7
301	G	52.8	Low	67.2	Low	49 Å²	49	76.9 Å²	76.9	51%	0.505	40%	0.402	S	S	.	.	S	Bend	trans	-132.6	167.7	-165.4	0	0	0	0	0	115.9	A303	G301-A303 PolarHBondContact O-N 3.04Å
302	K	47.5	Very low	65.6	Low	217 Å²	217	79.3 Å²	79.3	94%	0.943	41%	0.413	S	S	*	.			trans	-60.9	116.2	-168.4	-70	-179.9	179.3	178.7	0	112.5
303	A	51	Low	63.8	Low	26 Å²	26	75.2 Å²	75.2	22%	0.215	39%	0.394	C	S	.	.			trans	-87	153.6	171	0	0	0	0	0	112.2	G301 F311 E313	G301-A303 PolarHBondContact O-N 3.04Å; A303-F311 HydrophobicContact CB-CD1 3.66Å; A303-F311 HydrophobicContact CB-CD2 4.4Å; A303-F311 HydrophobicContact CB-CE1 2.96Å; A303-F311 HydrophobicContact CB-CE2 3.81Å; A303-F311 HydrophobicContact CB-CG 4.35Å; A303-F311 HydrophobicContact CB-CZ 3.05Å; A303-F311 WeakPolarHBondContact O-CE2 3.36Å; A303-F311 WeakPolarHBondContact O-CZ 3.18Å; A303-E313 HydrophobicContact CB-CG 3.66Å
304	Q	50.7	Low	61.8	Low	125 Å²	125	78.1 Å²	78.1	58%	0.584	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.6	-172	-171.4	171.6	-1.2	0	0	110.9	S306 L314	Q304-S306 PolarHBondContact O-N 2.87Å; Q304-L314 VanDerWaalsContact OE1-CD1 3.28Å
305	L	53.1	Low	59.7	Low	107 Å²	107	75.8 Å²	75.8	56%	0.56	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	120.7	174.5	-129.8	96.6	0	0	0	109.4	F311 M405	L305-F311 HydrophobicContact CD1-CD2 3.92Å; L305-F311 HydrophobicContact CD1-CE2 4.26Å; L305-M405 HydrophobicContact CD1-SD 4.07Å
306	S	54.8	Low	57.5	Low	40 Å²	40	81.2 Å²	81.2	28%	0.28	43%	0.434	S	S	.	.			trans	-77.4	157.3	169.1	71.9	0	0	0	0	111	Q304 R308 G309 L310	Q304-S306 PolarHBondContact O-N 2.87Å; S306-R308 PolarHBondContact O-N 2.81Å; S306-G309 PolarHBondContact O-N 3.05Å; S306-L310 VanDerWaalsContact CB-O 3.26Å; S306-L310 WeakPolarHBondContact CB-O 3.28Å; S306-L310 PolarHBondContact N-O 2.01Å; S306-L310 WeakPolarHBondContact OG-CA 3.48Å; S306-L310 VanDerWaalsContact OG-CB 3.28Å; S306-L310 WeakPolarHBondContact OG-CB 3.35Å; S306-L310 PolarHBondContact OG-N 2.91Å; S306-L310 VanDerWaalsContact OG-N 3.1Å; S306-L310 PolarHBondContact OG-O 3.39Å
307	P	47.1	Very low	55.3	Low	144 Å²	144	84.6 Å²	84.6	94%	0.935	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-7.6	177.7	-23	32.8	0	0	0	115.5
308	R	54.6	Low	53.4	Low	215 Å²	215	84.2 Å²	84.2	81%	0.811	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	10.4	178.6	-69	-175	173.9	178	-1.6	113.5	S306 L310	S306-R308 PolarHBondContact O-N 2.81Å; R308-L310 HydrophobicContact CB-CD1 4.33Å; R308-L310 PolarHBondContact O-N 2.86Å
309	G	55.5	Low	51.7	Low	17 Å²	17	89 Å²	89	18%	0.175	48%	0.482	C	S	.	.	S	Bend	trans	73	11.7	-176.9	0	0	0	0	0	114	S306 M405	S306-G309 PolarHBondContact O-N 3.05Å; G309-M405 WeakPolarHBondContact O-CB 3.33Å; G309-M405 PolarHBondContact O-N 3.36Å
310	L	53.8	Low	50.4	Low	60 Å²	60	94.8 Å²	94.8	31%	0.314	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.1	170.8	-74.4	148.8	0	0	0	109.2	T272 S306 R308 N404	T272-L310 HydrophobicContact CG2-CD2 3.56Å; S306-L310 VanDerWaalsContact CB-O 3.26Å; S306-L310 WeakPolarHBondContact CB-O 3.28Å; S306-L310 PolarHBondContact N-O 2.01Å; S306-L310 WeakPolarHBondContact OG-CA 3.48Å; S306-L310 VanDerWaalsContact OG-CB 3.28Å; S306-L310 WeakPolarHBondContact OG-CB 3.35Å; S306-L310 PolarHBondContact OG-N 2.91Å; S306-L310 VanDerWaalsContact OG-N 3.1Å; S306-L310 PolarHBondContact OG-O 3.39Å; R308-L310 HydrophobicContact CB-CD1 4.33Å; R308-L310 PolarHBondContact O-N 2.86Å; L310-N404 HydrophobicContact CD2-CB 4.35Å
311	F	54.9	Low	49.9	Very low	25 Å²	25	90 Å²	90	11%	0.11	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.6	174.4	-160.6	-107.7	0	0	0	109.5	A303 L305 V378 A381 A402 V403	A303-F311 HydrophobicContact CB-CD1 3.66Å; A303-F311 HydrophobicContact CB-CD2 4.4Å; A303-F311 HydrophobicContact CB-CE1 2.96Å; A303-F311 HydrophobicContact CB-CE2 3.81Å; A303-F311 HydrophobicContact CB-CG 4.35Å; A303-F311 HydrophobicContact CB-CZ 3.05Å; A303-F311 WeakPolarHBondContact O-CE2 3.36Å; A303-F311 WeakPolarHBondContact O-CZ 3.18Å; L305-F311 HydrophobicContact CD1-CD2 3.92Å; L305-F311 HydrophobicContact CD1-CE2 4.26Å; F311-V378 HydrophobicContact CB-CG1 4.48Å; F311-V378 HydrophobicContact CD1-CB 4.41Å; F311-V378 HydrophobicContact CD1-CG1 3.37Å; F311-V378 WeakPolarHBondContact CD1-O 3.47Å; F311-V378 HydrophobicContact CD2-CG1 3.72Å; F311-V378 HydrophobicContact CE1-CB 4.35Å; F311-V378 HydrophobicContact CE1-CG1 3.12Å; F311-V378 VanDerWaalsContact CE1-O 3.24Å; F311-V378 WeakPolarHBondContact CE1-O 3.32Å; F311-V378 HydrophobicContact CE2-CG1 3.55Å; F311-V378 HydrophobicContact CG-CG1 3.62Å; F311-V378 HydrophobicContact CZ-CG1 3.22Å; F311-A381 HydrophobicContact CD1-CB 3.55Å; F311-A381 HydrophobicContact CE1-CB 4.17Å; F311-A402 WeakPolarHBondContact O-CA 2.86Å; F311-V403 HydrophobicContact CB-CB 4.45Å; F311-V403 WeakPolarHBondContact CB-O 3.29Å; F311-V403 PolarHBondContact N-O 2.85Å; F311-V403 PolarHBondContact O-N 2.86Å
312	Q	59.2	Low	49.5	Very low	57 Å²	57	98.5 Å²	98.5	27%	0.266	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.1	-178.8	-167.6	175.8	26	0	0	108.8
313	E	55.3	Low	49.2	Very low	33 Å²	33	93 Å²	93	15%	0.154	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-73.8	136.9	169.7	-80.3	-178	134.1	0	0	111	S299 A303 G382	S299-E313 VanDerWaalsContact CB-CD 3.46Å; S299-E313 VanDerWaalsContact CB-OE1 3.29Å; S299-E313 WeakPolarHBondContact CB-OE1 3.35Å; S299-E313 WeakPolarHBondContact CB-OE2 3.48Å; S299-E313 PolarHBondContact OG-OE1 2.81Å; S299-E313 PolarHBondContact OG-OE2 3.24Å; A303-E313 HydrophobicContact CB-CG 3.66Å; E313-G382 WeakPolarHBondContact OE2-CA 3.35Å
314	L	49.6	Very low	49	Very low	76 Å²	76	93.9 Å²	93.9	40%	0.398	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-74.2	150.3	169.1	-69.5	170.3	0	0	0	110.4	Q304	Q304-L314 VanDerWaalsContact OE1-CD1 3.28Å
315	G	46.2	Very low	48.6	Very low	13 Å²	13	94.1 Å²	94.1	13%	0.134	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-64.6	169.8	169.5	0	0	0	0	0	112.5	N317 G318 E319	G315-N317 PolarHBondContact O-N 2.83Å; G315-G318 PolarHBondContact O-N 3.22Å; G315-E319 PolarHBondContact N-O 2.96Å
316	P	42.6	Very low	48.5	Very low	129 Å²	129	91.5 Å²	91.5	84%	0.838	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-17.3	177.3	19.4	-30.3	0	0	0	114
317	N	41.6	Very low	48.6	Very low	144 Å²	144	91.2 Å²	91.2	77%	0.77	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	10.9	179.8	-59.6	-11.9	0	0	0	114.4	G315 E319	G315-N317 PolarHBondContact O-N 2.83Å; N317-E319 PolarHBondContact O-N 2.83Å
318	G	43.3	Very low	49.1	Very low	48 Å²	48	88.8 Å²	88.8	50%	0.495	50%	0.5	S	S	.	.	S	Bend	trans	76.7	14	176.2	0	0	0	0	0	116.2	G315	G315-G318 PolarHBondContact O-N 3.22Å
319	E	43.8	Very low	50.1	Low	146 Å²	146	81 Å²	81	68%	0.682	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-90.3	144.3	177.2	-64.6	-172	163.8	0	0	112.8	G315 N317 F321	G315-E319 PolarHBondContact N-O 2.96Å; N317-E319 PolarHBondContact O-N 2.83Å; E319-F321 PolarHBondContact O-N 2.92Å
320	L	45.4	Very low	50.8	Low	137 Å²	137	84.7 Å²	84.7	72%	0.717	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-65.7	121.3	165.9	-101.3	103.1	0	0	0	109.3	R322	L320-R322 PolarHBondContact O-N 2.95Å
321	F	46	Very low	51.4	Low	81 Å²	81	82.5 Å²	82.5	36%	0.355	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-67.2	126.7	180	-81.6	-74.8	0	0	0	112.1	E319	E319-F321 PolarHBondContact O-N 2.92Å
322	R	42.8	Very low	51.6	Low	229 Å²	229	88.4 Å²	88.4	86%	0.864	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-86.4	128.4	161.6	-67.6	-177.9	180	175	1	108.2	L320 G324	L320-R322 PolarHBondContact O-N 2.95Å; R322-G324 PolarHBondContact O-N 2.85Å
323	P	42.4	Very low	50.5	Low	100 Å²	100	90.5 Å²	90.5	65%	0.649	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-60.8	123.9	177.3	23.4	-30.4	0	0	0	109.4
324	G	46.1	Very low	49.8	Very low	46 Å²	46	93 Å²	93	47%	0.474	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-65	154.7	161.9	0	0	0	0	0	109.6	N269 R322 G326	N269-G324 PolarHBondContact ND2-O 3.25Å; R322-G324 PolarHBondContact O-N 2.85Å; G324-G326 PolarHBondContact O-N 2.62Å
325	P	43.3	Very low	49	Very low	129 Å²	129	96 Å²	96	84%	0.838	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-54.8	130	179	21.9	-30.5	0	0	0	109.6	G327	P325-G327 PolarHBondContact O-N 3.06Å; P325-G327 VanDerWaalsContact O-N 3.13Å
326	G	49.7	Very low	48.3	Very low	52 Å²	52	98.2 Å²	98.2	54%	0.536	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-51.2	120.4	167.6	0	0	0	0	0	107.7	N269 G324	N269-G326 VanDerWaalsContact ND2-CA 3.27Å; N269-G326 WeakPolarHBondContact ND2-CA 3.35Å; N269-G326 PolarHBondContact ND2-N 2.65Å; G324-G326 PolarHBondContact O-N 2.62Å
327	G	56.9	Low	47.7	Very low	34 Å²	34	95.3 Å²	95.3	35%	0.351	60%	0.596	S	S	.	*			trans	-129.8	130.8	-164.1	0	0	0	0	0	110.1	P325 V329	P325-G327 PolarHBondContact O-N 3.06Å; P325-G327 VanDerWaalsContact O-N 3.13Å; G327-V329 PolarHBondContact O-N 2.82Å
328	V	59.2	Low	47.2	Very low	94 Å²	94	96 Å²	96	57%	0.57	60%	0.597	S	S	*	*			trans	-56.3	115.4	155.9	-179.7	0	0	0	0	106.8	V263 V264 Q265	V263-V328 HydrophobicContact CG1-CG1 3.39Å; V264-V328 WeakPolarHBondContact O-CA 3.05Å; Q265-V328 HydrophobicContact CG-CG2 4.3Å
329	V	73.8	Confident	46.4	Very low	50 Å²	50	103.1 Å²	103.1	30%	0.303	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.1	118.8	176.2	-175.5	0	0	0	0	108.5	V264 G327 R396 V397	V264-V329 PolarHBondContact N-O 3.16Å; V264-V329 PolarHBondContact O-N 2.9Å; G327-V329 PolarHBondContact O-N 2.82Å; V329-R396 WeakPolarHBondContact CG1-O 3.25Å; V329-V397 HydrophobicContact CG2-CB 4.14Å; V329-V397 HydrophobicContact CG2-CG2 4.08Å
330	T	70.9	Confident	45.7	Very low	95 Å²	95	101 Å²	101	58%	0.583	62%	0.623	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.3	140.7	169.8	53.5	0	0	0	0	109.5	V263 L332	V263-T330 HydrophobicContact CG1-CG2 4.26Å; V263-T330 HydrophobicContact CG2-CG2 4.13Å; T330-L332 PolarHBondContact O-N 3.44Å
331	A	67.4	Low	44.7	Very low	15 Å²	15	98.3 Å²	98.3	12%	0.124	63%	0.628	C	S	.	*	P	Polyproline II helix	trans	-51.8	140.8	173.8	0	0	0	0	0	112	P261 P262 V394 A395	P261-A331 HydrophobicContact CB-CB 3.61Å; P262-A331 HydrophobicContact CG-CB 4.03Å; P262-A331 WeakPolarHBondContact O-CB 3.41Å; P262-A331 PolarHBondContact O-N 3.33Å; A331-V394 WeakPolarHBondContact CA-O 2.93Å; A331-V394 VanDerWaalsContact CB-O 3.3Å; A331-V394 WeakPolarHBondContact CB-O 3.3Å; A331-A395 HydrophobicContact CB-CB 4.11Å
332	L	57.5	Low	43.7	Very low	148 Å²	148	98.3 Å²	98.3	78%	0.775	65%	0.65	S	S	*	*	B	Isolated β-bridge	trans	-72.9	137.1	168.3	-74.3	153.2	0	0	0	108.1	T330 S334	T330-L332 PolarHBondContact O-N 3.44Å; L332-S334 PolarHBondContact O-N 3.29Å
333	P	36.8	Very low	43.1	Very low	102 Å²	102	94.2 Å²	94.2	66%	0.662	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-58.3	126.1	177.6	19.3	-27	0	0	0	109.4	T335	P333-T335 VanDerWaalsContact C-N 3.26Å; P333-T335 PolarHBondContact O-N 2.95Å
334	S	40.6	Very low	42.3	Very low	84 Å²	84	98.4 Å²	98.4	59%	0.587	66%	0.661	S	S	*	*			trans	-67.4	89.4	168.8	59.9	0	0	0	0	108.1	L332 G336	L332-S334 PolarHBondContact O-N 3.29Å; S334-G336 PolarHBondContact O-N 2.83Å
335	T	32.5	Very low	41.4	Very low	141 Å²	141	99.8 Å²	99.8	87%	0.865	68%	0.676	S	S	*	*			trans	-69.1	85.8	165.5	49.4	0	0	0	0	107.7	P333	P333-T335 VanDerWaalsContact C-N 3.26Å; P333-T335 PolarHBondContact O-N 2.95Å
336	G	32.6	Very low	40.6	Very low	59 Å²	59	101.9 Å²	101.9	61%	0.608	68%	0.678	S	S	*	*			trans	-169	68.3	-175.8	0	0	0	0	0	110.5	S334	S334-G336 PolarHBondContact O-N 2.83Å
337	G	28.6	Very low	39.6	Very low	68 Å²	68	107.4 Å²	107.4	70%	0.701	69%	0.69	S	S	*	*			trans	-56.1	139.7	163	0	0	0	0	0	109.8	K339	G337-K339 PolarHBondContact O-N 2.83Å
338	I	32.6	Very low	38.1	Very low	157 Å²	157	109.3 Å²	109.3	81%	0.805	71%	0.71	S	S	*	*			trans	-57	98.9	169.7	-59.7	170.5	0	0	0	107.2
339	K	25.6	Very low	36.5	Very low	199 Å²	199	111 Å²	111	87%	0.865	72%	0.715	S	S	*	*			trans	-91	113.2	164	-82.5	-171.8	175.6	-178.2	0	107.6	G337	G337-K339 PolarHBondContact O-N 2.83Å
340	A	29.7	Very low	34.2	Very low	102 Å²	102	115.3 Å²	115.3	84%	0.843	74%	0.741	S	S	*	*			trans	-67.1	128.9	161.3	0	0	0	0	0	109.1
341	G	24.2	Very low	32	Very low	80 Å²	80	121.7 Å²	121.7	83%	0.825	76%	0.755	S	S	*	*			trans	111.8	119.3	163.3	0	0	0	0	0	115.8
342	G	23.9	Very low	30	Very low	80 Å²	80	124.2 Å²	124.2	83%	0.825	78%	0.782	S	S	*	*			trans	125.5	101.2	158.9	0	0	0	0	0	114.5
343	V	30.9	Very low	28.5	Very low	144 Å²	144	122 Å²	122	87%	0.873	79%	0.785	S	S	*	*			trans	-57.1	125.7	174.3	177.2	0	0	0	0	111.5
344	E	25.4	Very low	28	Very low	187 Å²	187	126.5 Å²	126.5	87%	0.874	80%	0.797	S	S	*	*			trans	-168.8	131.4	139.2	-106.4	173.3	-163.5	0	0	109.9
345	G	26.8	Very low	27.3	Very low	76 Å²	76	131.8 Å²	131.8	78%	0.784	81%	0.812	S	S	*	*			trans	-75.6	138.1	-156.4	0	0	0	0	0	115.9
346	I	28.1	Very low	27.3	Very low	172 Å²	172	129.1 Å²	129.1	88%	0.882	81%	0.813	S	S	*	*			trans	-106.4	94	155.6	-58.5	178.5	0	0	0	106.2	G348	I346-G348 PolarHBondContact O-N 3.39Å
347	Q	26.8	Very low	26.9	Very low	168 Å²	168	129.4 Å²	129.4	79%	0.785	82%	0.816	S	S	*	*			trans	-63.4	110.3	168.4	-79.2	172.9	-21.4	0	0	108.7	L349	Q347-L349 VanDerWaalsContact C-N 3.32Å; Q347-L349 PolarHBondContact O-N 3.24Å
348	G	25.9	Very low	26.9	Very low	75 Å²	75	135.8 Å²	135.8	77%	0.773	83%	0.828	S	S	*	*			trans	-64.1	97.8	152.5	0	0	0	0	0	108	I346 V350	I346-G348 PolarHBondContact O-N 3.39Å; G348-V350 PolarHBondContact O-N 3.34Å
349	L	25.5	Very low	26.8	Very low	130 Å²	130	139.7 Å²	139.7	68%	0.681	83%	0.833	S	S	*	*			trans	-73.6	94.7	171.3	-98.3	158.3	0	0	0	108.8	Q347 R351	Q347-L349 VanDerWaalsContact C-N 3.32Å; Q347-L349 PolarHBondContact O-N 3.24Å; L349-R351 HydrophobicContact CD2-CB 4.39Å; L349-R351 HydrophobicContact CD2-CG 4.28Å
350	V	27	Very low	27.1	Very low	139 Å²	139	137.7 Å²	137.7	84%	0.842	83%	0.831	S	S	*	*			trans	-65.7	118.1	139.7	175.6	0	0	0	0	106.2	G348	G348-V350 PolarHBondContact O-N 3.34Å
351	R	24.5	Very low	27.3	Very low	230 Å²	230	137.7 Å²	137.7	87%	0.868	83%	0.825	S	S	*	*			trans	-128.5	118.9	163.2	-133.7	179.3	177.3	177.1	-2.6	108.1	L349	L349-R351 HydrophobicContact CD2-CB 4.39Å; L349-R351 HydrophobicContact CD2-CG 4.28Å
352	G	23.7	Very low	28.2	Very low	68 Å²	68	138 Å²	138	70%	0.701	80%	0.804	S	S	*	*			trans	-81.7	164.1	-179.5	0	0	0	0	0	113.8
353	A	27.4	Very low	29	Very low	101 Å²	101	141 Å²	141	84%	0.835	80%	0.801	S	S	*	*			trans	52.7	100.4	153.6	0	0	0	0	0	118.2
354	E	25.6	Very low	29.6	Very low	197 Å²	197	136.5 Å²	136.5	92%	0.921	78%	0.775	S	S	*	*			trans	-142.9	158.4	137.9	-78.7	-167.2	166.2	0	0	108.9
355	E	26.2	Very low	30.3	Very low	194 Å²	194	131.9 Å²	131.9	91%	0.907	76%	0.756	S	S	*	*			trans	-76.6	155.9	-145.8	-64.3	159.7	140.5	0	0	117.4
356	G	31.6	Very low	31.2	Very low	85 Å²	85	136.6 Å²	136.6	88%	0.876	76%	0.76	S	S	*	*			trans	51.8	89.3	136.9	0	0	0	0	0	118.9
357	G	24.3	Very low	32.3	Very low	66 Å²	66	130.5 Å²	130.5	68%	0.68	74%	0.74	S	S	*	*			trans	177	110.9	160.8	0	0	0	0	0	110.1	R359	G357-R359 PolarHBondContact O-N 3.1Å
358	E	28.5	Very low	34	Very low	201 Å²	201	125.4 Å²	125.4	94%	0.939	72%	0.723	S	S	*	*			trans	-47.7	109	176.2	-78.5	169.9	138.1	0	0	110.4	D360	E358-D360 PolarHBondContact O-N 3.48Å
359	R	32.3	Very low	36.4	Very low	240 Å²	240	122.3 Å²	122.3	91%	0.906	69%	0.69	S	S	*	*			trans	-76.9	113.5	163.8	-79.1	-177.4	-179.9	-166.4	0.4	106.7	G357 S361	G357-R359 PolarHBondContact O-N 3.1Å; R359-S361 PolarHBondContact O-N 3.24Å
360	D	30.3	Very low	39.2	Very low	157 Å²	157	117.9 Å²	117.9	84%	0.84	67%	0.667	S	S	*	*			trans	-47.7	117.2	160.6	-78.6	-35.8	0	0	0	108.3	E358 F362	E358-D360 PolarHBondContact O-N 3.48Å; D360-F362 PolarHBondContact O-N 3.45Å
361	S	34.8	Very low	42	Very low	102 Å²	102	111.6 Å²	111.6	71%	0.713	63%	0.628	S	S	*	*			trans	-61.5	104	-174.9	-175.9	0	0	0	0	110	R359	R359-S361 PolarHBondContact O-N 3.24Å
362	F	42.4	Very low	45.1	Very low	86 Å²	86	105.3 Å²	105.3	38%	0.377	61%	0.607	S	S	.	*			trans	-96.2	99.6	162	-173.7	-96.5	0	0	0	106.8	D360 P364 L373 Y384	D360-F362 PolarHBondContact O-N 3.45Å; F362-P364 HydrophobicContact CD1-CB 4.35Å; F362-P364 HydrophobicContact CE1-CB 3.93Å; F362-P364 WeakPolarHBondContact O-CD 3.34Å; F362-L373 HydrophobicContact CE2-CD2 3.98Å; F362-Y384 HydrophobicContact CE2-CE1 4.39Å; F362-Y384 HydrophobicContact CZ-CE1 4.22Å
363	D	41.9	Very low	48.2	Very low	143 Å²	143	102.5 Å²	102.5	77%	0.765	58%	0.576	S	S	*	*			trans	-85.3	103.3	166.7	-92.7	-39.7	0	0	0	108.2	D365	D363-D365 PolarHBondContact O-N 3.27Å; D363-D365 VanDerWaalsContact O-N 3.15Å
364	P	43.1	Very low	51.1	Low	50 Å²	50	101.1 Å²	101.1	33%	0.325	56%	0.56	S	S	.	*			trans	-66.3	116	172.4	27.2	-31.2	0	0	0	108	F362 M366	F362-P364 HydrophobicContact CD1-CB 4.35Å; F362-P364 HydrophobicContact CE1-CB 3.93Å; F362-P364 WeakPolarHBondContact O-CD 3.34Å; P364-M366 WeakPolarHBondContact O-CG 3.42Å; P364-M366 PolarHBondContact O-N 3.19Å
365	D	40.7	Very low	54.1	Low	89 Å²	89	96.7 Å²	96.7	48%	0.476	54%	0.543	S	S	.	.			trans	-53.2	102.5	175.1	-150.3	19.7	0	0	0	109.5	D363 G367 S368	D363-D365 PolarHBondContact O-N 3.27Å; D363-D365 VanDerWaalsContact O-N 3.15Å; D365-G367 PolarHBondContact O-N 2.81Å; D365-G367 VanDerWaalsContact O-N 3.09Å; D365-S368 WeakPolarHBondContact OD2-CB 3.37Å; D365-S368 PolarHBondContact OD2-OG 2.82Å
366	M	44.8	Very low	57	Low	175 Å²	175	87.5 Å²	87.5	86%	0.862	50%	0.5	S	S	*	.	S	Bend	trans	-81.8	85.3	-176.1	-68	-170	-175.9	0	0	109.7	P364	P364-M366 WeakPolarHBondContact O-CG 3.42Å; P364-M366 PolarHBondContact O-N 3.19Å
367	G	50.5	Low	59.6	Low	45 Å²	45	86 Å²	86	46%	0.464	47%	0.474	S	S	.	.	S	Bend	trans	119.5	3.4	158.9	0	0	0	0	0	117.6	D365 G369	D365-G367 PolarHBondContact O-N 2.81Å; D365-G367 VanDerWaalsContact O-N 3.09Å; G367-G369 PolarHBondContact O-N 3.24Å
368	S	62.8	Low	62.4	Low	61 Å²	61	84.6 Å²	84.6	43%	0.427	45%	0.452	S	S	.	.	S	Bend	trans	-75	-15.6	173.7	67	0	0	0	0	113.2	D365 M370	D365-S368 WeakPolarHBondContact OD2-CB 3.37Å; D365-S368 PolarHBondContact OD2-OG 2.82Å; S368-M370 PolarHBondContact O-N 3.06Å; S368-M370 PolarHBondContact OG-N 2.93Å; S368-M370 VanDerWaalsContact OG-N 3.16Å; S368-M370 PolarHBondContact OG-O 3.02Å
369	G	76.2	Confident	64.9	Low	9 Å²	9	78.3 Å²	78.3	9%	0.093	43%	0.434	C	S	.	.	S	Bend	trans	68.5	5	-168.1	0	0	0	0	0	113.4	C283 W295 G367	C283-G369 PolarHBondContact N-O 2.96Å; W295-G369 PolarHBondContact NE1-O 2.74Å; G367-G369 PolarHBondContact O-N 3.24Å
370	M	84.2	Confident	67.4	Low	38 Å²	38	69 Å²	69	19%	0.187	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.5	-176.1	-58.6	-62.2	-60.1	0	0	110.7	R280 V281 S282 S368	R280-M370 HydrophobicContact CG-CE 3.21Å; V281-M370 CarbonylContact O-C 3.5Å; V281-M370 WeakPolarHBondContact O-CA 3.35Å; S282-M370 WeakPolarHBondContact CA-SD 3.1Å; S282-M370 WeakPolarHBondContact CB-SD 3.49Å; S282-M370 PolarHBondContact OG-SD 3.14Å; S368-M370 PolarHBondContact O-N 3.06Å; S368-M370 PolarHBondContact OG-N 2.93Å; S368-M370 VanDerWaalsContact OG-N 3.16Å; S368-M370 PolarHBondContact OG-O 3.02Å
371	L	86.6	Confident	70.1	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	116.9	163.4	176.6	65.6	0	0	0	107.9	R280 V281 W295 L373 Y384 F399	R280-L371 CarbonylContact C-O 3.56Å; R280-L371 WeakPolarHBondContact CA-O 3.4Å; V281-L371 HydrophobicContact CB-CB 4.33Å; V281-L371 PolarHBondContact N-O 3.04Å; V281-L371 PolarHBondContact O-N 3.17Å; W295-L371 HydrophobicContact CD2-CB 3.82Å; W295-L371 HydrophobicContact CE3-CB 4.3Å; W295-L371 HydrophobicContact CE3-CD2 4.3Å; W295-L371 HydrophobicContact CG-CB 4.07Å; W295-L371 HydrophobicContact CH2-CB 4.45Å; W295-L371 HydrophobicContact CZ2-CB 4Å; W295-L371 HydrophobicContact CZ3-CD2 4.32Å; L371-L373 HydrophobicContact CD1-CD2 4.34Å; L371-L373 HydrophobicContact CD1-CG 4.37Å; L371-Y384 HydrophobicContact CD1-CD1 4.09Å; L371-Y384 HydrophobicContact CD1-CE1 4.17Å; L371-Y384 HydrophobicContact CD2-CD1 3.83Å; L371-Y384 HydrophobicContact CD2-CD2 4.4Å; L371-Y384 HydrophobicContact CD2-CE1 4.25Å; L371-Y384 HydrophobicContact CD2-CG 3.92Å; L371-F399 HydrophobicContact CD2-CD1 3.85Å; L371-F399 HydrophobicContact CD2-CE1 4Å
372	F	89.6	Confident	72.5	Confident	97 Å²	97	57 Å²	57	43%	0.425	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.9	175.9	-177.3	-106.4	0	0	0	110	L279 R280	L279-F372 WeakPolarHBondContact O-CD2 3.42Å; R280-F372 HydrophobicContact CB-CD2 4.22Å
373	L	87.7	Confident	74.6	Confident	10 Å²	10	56.6 Å²	56.6	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.4	173	-56.3	174.5	0	0	0	108.4	S278 L279 F362 L371 V376 H380 L401	S278-L373 CarbonylContact C-O 3.2Å; S278-L373 WeakPolarHBondContact CA-O 3.24Å; L279-L373 HydrophobicContact CD1-CD1 4.43Å; L279-L373 HydrophobicContact CD1-CG 4.45Å; L279-L373 HydrophobicContact CD2-CB 4.43Å; L279-L373 HydrophobicContact CD2-CD1 4.15Å; L279-L373 HydrophobicContact CG-CB 4.08Å; L279-L373 HydrophobicContact CG-CD1 4.43Å; L279-L373 HydrophobicContact CG-CG 4.48Å; L279-L373 PolarHBondContact N-O 3.4Å; L279-L373 PolarHBondContact O-N 2.92Å; F362-L373 HydrophobicContact CE2-CD2 3.98Å; L371-L373 HydrophobicContact CD1-CD2 4.34Å; L371-L373 HydrophobicContact CD1-CG 4.37Å; L373-V376 HydrophobicContact CB-CG2 4Å; L373-H380 HydrophobicContact CD1-CB 4.21Å; L373-L401 HydrophobicContact CD1-CD2 3.76Å
374	S	89.3	Confident	76.8	Confident	71 Å²	71	49.9 Å²	49.9	50%	0.497	29%	0.29	S	S	.	.	S	Bend	trans	-105.4	147.1	173.7	55.5	0	0	0	0	110.7	S278	S278-S374 WeakPolarHBondContact OG-CA 3.37Å
375	N	88.2	Confident	79	Confident	105 Å²	105	49.3 Å²	49.3	56%	0.561	28%	0.283	S	S	*	.	S	Bend	trans	53.2	57.7	178.4	-166.6	18.8	0	0	0	112.4	G276 E277 T377	G276-N375 WeakPolarHBondContact CA-OD1 3.27Å; E277-N375 PolarHBondContact O-N 2.84Å; N375-T377 PolarHBondContact O-N 2.91Å
376	V	87.4	Confident	81.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.261	C	S	.	.			trans	-60.4	119.9	-172	170.7	0	0	0	0	111.3	V273 L275 G276 E277 L279 L373 H380 V403	V273-V376 HydrophobicContact CG1-CB 4.21Å; V273-V376 HydrophobicContact CG1-CG1 4.31Å; V273-V376 HydrophobicContact CG1-CG2 4.15Å; L275-V376 WeakPolarHBondContact CA-O 3.5Å; G276-V376 PolarHBondContact N-O 3Å; E277-V376 WeakPolarHBondContact O-CB 3.23Å; E277-V376 WeakPolarHBondContact O-CG2 3.29Å; E277-V376 PolarHBondContact O-N 2.87Å; L279-V376 HydrophobicContact CD2-CG2 3.95Å; L279-V376 HydrophobicContact CG-CG2 4.42Å; L373-V376 HydrophobicContact CB-CG2 4Å; V376-H380 HydrophobicContact CG1-CB 4.17Å; V376-V403 HydrophobicContact CG1-CG1 4.45Å; V376-V403 HydrophobicContact CG1-CG2 3.67Å
377	T	86.9	Confident	83.6	Confident	54 Å²	54	38.3 Å²	38.3	33%	0.331	23%	0.227	S	C	.	.			trans	-101.5	167.9	173.2	70.8	0	0	0	0	111.9	N375 A379 H380	N375-T377 PolarHBondContact O-N 2.91Å; T377-A379 PolarHBondContact O-N 2.8Å; T377-A379 VanDerWaalsContact O-N 3.16Å; T377-A379 PolarHBondContact OG1-N 2.84Å; T377-H380 PolarHBondContact N-ND1 3.07Å; T377-H380 WeakPolarHBondContact O-CB 3.29Å; T377-H380 PolarHBondContact O-N 3.05Å; T377-H380 PolarHBondContact OG1-CE1 2.81Å; T377-H380 PolarHBondContact OG1-ND1 2.8Å
378	V	82.3	Confident	85.6	Confident	37 Å²	37	36.1 Å²	36.1	22%	0.224	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-54	-32.7	174.2	176.7	0	0	0	0	112.2	L275 F311 H380 A381 M405	L275-V378 HydrophobicContact CD1-CG2 3.86Å; F311-V378 HydrophobicContact CB-CG1 4.48Å; F311-V378 HydrophobicContact CD1-CB 4.41Å; F311-V378 HydrophobicContact CD1-CG1 3.37Å; F311-V378 WeakPolarHBondContact CD1-O 3.47Å; F311-V378 HydrophobicContact CD2-CG1 3.72Å; F311-V378 HydrophobicContact CE1-CB 4.35Å; F311-V378 HydrophobicContact CE1-CG1 3.12Å; F311-V378 VanDerWaalsContact CE1-O 3.24Å; F311-V378 WeakPolarHBondContact CE1-O 3.32Å; F311-V378 HydrophobicContact CE2-CG1 3.55Å; F311-V378 HydrophobicContact CG-CG1 3.62Å; F311-V378 HydrophobicContact CZ-CG1 3.22Å; V378-H380 PolarHBondContact O-N 3.33Å; V378-A381 WeakPolarHBondContact O-CB 3.4Å; V378-A381 PolarHBondContact O-N 3.38Å; V378-M405 HydrophobicContact CG2-CG 4.06Å; V378-M405 HydrophobicContact CG2-SD 3.79Å
379	A	81.3	Confident	87.1	Confident	68 Å²	68	39.8 Å²	39.8	56%	0.562	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-66.9	-20.8	177.3	0	0	0	0	0	113.6	K297 T377	K297-A379 PolarHBondContact NZ-O 2.91Å; T377-A379 PolarHBondContact O-N 2.8Å; T377-A379 VanDerWaalsContact O-N 3.16Å; T377-A379 PolarHBondContact OG1-N 2.84Å
380	H	85.5	Confident	88	Confident	45 Å²	45	39.5 Å²	39.5	21%	0.208	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-78.6	-20.1	177.6	-66.8	96.3	0	0	0	113	L373 V376 T377 V378 Y384 L401	L373-H380 HydrophobicContact CD1-CB 4.21Å; V376-H380 HydrophobicContact CG1-CB 4.17Å; T377-H380 PolarHBondContact N-ND1 3.07Å; T377-H380 WeakPolarHBondContact O-CB 3.29Å; T377-H380 PolarHBondContact O-N 3.05Å; T377-H380 PolarHBondContact OG1-CE1 2.81Å; T377-H380 PolarHBondContact OG1-ND1 2.8Å; V378-H380 PolarHBondContact O-N 3.33Å; H380-Y384 WeakPolarHBondContact O-CE2 2.69Å; H380-Y384 PolarHBondContact O-OH 2.95Å; H380-L401 HydrophobicContact CB-CD2 4.17Å; H380-L401 WeakPolarHBondContact O-CD2 3.23Å
381	A	85.3	Confident	88.4	Confident	3 Å²	3	40.1 Å²	40.1	3%	0.025	21%	0.213	C	C	.	.			trans	-57.8	146.5	176.1	0	0	0	0	0	110.9	K297 F311 V378 L401 V403	K297-A381 PolarHBondContact NZ-O 2.83Å; F311-A381 HydrophobicContact CD1-CB 3.55Å; F311-A381 HydrophobicContact CE1-CB 4.17Å; V378-A381 WeakPolarHBondContact O-CB 3.4Å; V378-A381 PolarHBondContact O-N 3.38Å; A381-L401 WeakPolarHBondContact CA-O 3.41Å; A381-V403 HydrophobicContact CB-CB 4.46Å; A381-V403 HydrophobicContact CB-CG2 3.91Å
382	G	85.7	Confident	88.7	Confident	4 Å²	4	40.4 Å²	40.4	4%	0.041	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.2	-163.3	176.1	0	0	0	0	0	114.1	S299 E313 L401	S299-G382 WeakPolarHBondContact OG-CA 3.34Å; E313-G382 WeakPolarHBondContact OE2-CA 3.35Å; G382-L401 PolarHBondContact N-O 3.25Å; G382-L401 PolarHBondContact O-N 3.38Å
383	R	86.3	Confident	88.9	Confident	78 Å²	78	36.1 Å²	36.1	29%	0.294	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.3	-178.7	-173.2	-173.8	-60.4	-126.9	-3.9	109.7	K297 A298 S299 T398	K297-R383 CarbonylContact C-O 3.38Å; A298-R383 HydrophobicContact CB-CB 4.27Å; A298-R383 HydrophobicContact CB-CG 4.06Å; A298-R383 PolarHBondContact N-O 3.36Å; S299-R383 PolarHBondContact OG-N 3.06Å; R383-T398 HydrophobicContact CG-CG2 4.47Å
384	Y	89.2	Confident	89.1	Confident	1 Å²	1	38 Å²	38	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.8	169.8	-64.1	-99.6	0	0	0	108.7	K296 K297 F362 L371 H380 T398 F399 L401	K296-Y384 CarbonylContact O-C 3.59Å; K296-Y384 WeakPolarHBondContact O-CA 3.42Å; K297-Y384 HydrophobicContact CB-CD1 4.13Å; K297-Y384 HydrophobicContact CB-CE1 3.95Å; K297-Y384 HydrophobicContact CD-CE1 4.36Å; K297-Y384 HydrophobicContact CG-CD1 4.28Å; K297-Y384 HydrophobicContact CG-CE1 3.93Å; F362-Y384 HydrophobicContact CE2-CE1 4.39Å; F362-Y384 HydrophobicContact CZ-CE1 4.22Å; L371-Y384 HydrophobicContact CD1-CD1 4.09Å; L371-Y384 HydrophobicContact CD1-CE1 4.17Å; L371-Y384 HydrophobicContact CD2-CD1 3.83Å; L371-Y384 HydrophobicContact CD2-CD2 4.4Å; L371-Y384 HydrophobicContact CD2-CE1 4.25Å; L371-Y384 HydrophobicContact CD2-CG 3.92Å; H380-Y384 WeakPolarHBondContact O-CE2 2.69Å; H380-Y384 PolarHBondContact O-OH 2.95Å; Y384-T398 CarbonylContact O-C 3.58Å; Y384-T398 WeakPolarHBondContact O-CA 3.35Å; Y384-F399 HydrophobicContact CD2-CD1 4Å; Y384-F399 HydrophobicContact CD2-CE1 4.48Å; Y384-F399 HydrophobicContact CG-CD1 4.28Å; Y384-F399 PolarHBondContact N-O 2.71Å; Y384-F399 PolarHBondContact O-N 3.05Å; Y384-L401 HydrophobicContact CD2-CB 4.3Å; Y384-L401 HydrophobicContact CE2-CB 3.91Å; Y384-L401 HydrophobicContact CE2-CD2 4.16Å
385	E	89.4	Confident	89.2	Confident	39 Å²	39	34.7 Å²	34.7	18%	0.182	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.9	174.3	-174.2	167.3	-141.1	0	0	107.9	K296 A298 R396 V397	K296-E385 WeakPolarHBondContact CE-OE2 3.33Å; K296-E385 HydrophobicContact CG-CB 4.01Å; K296-E385 PolarHBondContact N-O 3.12Å; K296-E385 IonicContact NZ-OE2 2.74Å; K296-E385 PolarHBondContact NZ-OE2 3.49Å; K296-E385 PolarHBondContact O-N 2.93Å; A298-E385 HydrophobicContact CB-CB 4.49Å; E385-R396 HydrophobicContact CG-CB 4.22Å; E385-R396 WeakPolarHBondContact OE1-CB 3.48Å; E385-R396 VanDerWaalsContact OE1-CD 3.23Å; E385-R396 WeakPolarHBondContact OE1-CD 3.48Å; E385-V397 WeakPolarHBondContact CA-O 3.41Å
386	C	90.5	Very high	89.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.2	165.1	173.9	0	0	0	0	108.4	C283 V293 T294 W295 R396 V397	C283-C386 HydrophobicContact CB-CB 3.78Å; C283-C386 WeakPolarHBondContact CB-SG 3.2Å; C283-C386 WeakPolarHBondContact SG-CB 3.35Å; C283-C386 CovalentContact SG-SG 2.01Å; C283-C386 PolarHBondContact SG-SG 2.86Å; V293-C386 WeakPolarHBondContact CG1-SG 3.17Å; T294-C386 CarbonylContact O-C 3.2Å; T294-C386 WeakPolarHBondContact O-CA 3.41Å; W295-C386 HydrophobicContact CD2-CB 3.9Å; W295-C386 HydrophobicContact CE3-CB 3.74Å; W295-C386 HydrophobicContact CH2-CB 3.83Å; W295-C386 HydrophobicContact CZ2-CB 3.96Å; W295-C386 HydrophobicContact CZ3-CB 3.69Å; C386-R396 CarbonylContact O-C 3.54Å; C386-R396 VanDerWaalsContact O-CA 3.32Å; C386-R396 WeakPolarHBondContact O-CA 3.45Å; C386-V397 HydrophobicContact CB-CG1 3.79Å; C386-V397 PolarHBondContact N-O 3.18Å; C386-V397 PolarHBondContact O-N 3.07Å
387	E	91	Very high	89.5	Confident	32 Å²	32	36 Å²	36	15%	0.15	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.1	-179.8	179.3	164.1	174.1	0	0	109.6	V293 T294 K296 V394 R396	V293-E387 WeakPolarHBondContact CA-O 3.43Å; T294-E387 PolarHBondContact N-O 2.81Å; T294-E387 PolarHBondContact O-N 2.96Å; T294-E387 PolarHBondContact OG1-O 2.74Å; K296-E387 IonicContact NZ-OE2 3.47Å; K296-E387 PolarHBondContact NZ-OE2 2.97Å; E387-V394 HydrophobicContact CG-CG1 3.76Å; E387-R396 HydrophobicContact CB-CG 4.16Å; E387-R396 VanDerWaalsContact CD-NH2 3.3Å; E387-R396 HydrophobicContact CG-CG 3.95Å; E387-R396 IonicContact OE1-CZ 2.84Å; E387-R396 IonicContact OE1-NE 2.83Å; E387-R396 PolarHBondContact OE1-NE 3.03Å; E387-R396 IonicContact OE1-NH2 3.33Å; E387-R396 PolarHBondContact OE1-NH2 3.21Å; E387-R396 IonicContact OE2-CZ 3.07Å; E387-R396 IonicContact OE2-NE 2.8Å; E387-R396 PolarHBondContact OE2-NE 3.39Å; E387-R396 IonicContact OE2-NH1 3.05Å; E387-R396 IonicContact OE2-NH2 3.97Å; E387-R396 PolarHBondContact OE2-NH2 2.55Å; E387-R396 VanDerWaalsContact OE2-NH2 3.07Å
388	A	92.8	Very high	89.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.3	174.6	0	0	0	0	0	110	P262 V264 A285 P291 Q292 V293 V394 A395	P262-A388 HydrophobicContact CB-CB 4.06Å; P262-A388 WeakPolarHBondContact CG-O 3.4Å; V264-A388 HydrophobicContact CG2-CB 3.38Å; A285-A388 HydrophobicContact CB-CB 3.55Å; P291-A388 HydrophobicContact CB-CB 4.31Å; Q292-A388 WeakPolarHBondContact O-CA 3.44Å; V293-A388 HydrophobicContact CG2-CB 4.22Å; A388-V394 WeakPolarHBondContact O-CA 3.24Å; A388-A395 PolarHBondContact N-O 3.42Å; A388-A395 PolarHBondContact O-N 3.24Å
389	W	93.8	Very high	89.9	Confident	138 Å²	138	34.1 Å²	34.1	52%	0.523	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.7	-174.7	179.5	99	0	0	0	111.9	P291 Q292 P391 V394	P291-W389 CarbonylContact C-O 3.59Å; P291-W389 WeakPolarHBondContact CA-O 3.42Å; P291-W389 WeakPolarHBondContact CB-O 3.48Å; Q292-W389 PolarHBondContact N-O 3.1Å; Q292-W389 PolarHBondContact O-N 2.67Å; W389-P391 HydrophobicContact CH2-CG 4.49Å; W389-V394 VanDerWaalsContact CD1-CG2 3.4Å; W389-V394 HydrophobicContact CG-CG2 4.34Å
390	N	94.2	Very high	90.3	Very high	2 Å²	2	33 Å²	33	1%	0.011	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	174.2	160.4	76	12.1	0	0	0	110	I260 P262 Y288 P289 P291 G392 G393	I260-N390 PolarHBondContact O-ND2 2.84Å; P262-N390 WeakPolarHBondContact CD-OD1 3.28Å; Y288-N390 PolarHBondContact N-ND2 3.35Å; Y288-N390 PolarHBondContact O-ND2 3.04Å; P289-N390 HydrophobicContact CG-CB 4.42Å; P289-N390 WeakPolarHBondContact O-CB 3.08Å; P289-N390 PolarHBondContact O-ND2 2.85Å; P291-N390 HydrophobicContact CB-CB 4.15Å; N390-G392 PolarHBondContact O-N 3.2Å; N390-G392 VanDerWaalsContact OD1-CA 3.25Å; N390-G392 WeakPolarHBondContact OD1-CA 3.42Å; N390-G392 PolarHBondContact OD1-N 3.13Å; N390-G393 PolarHBondContact N-O 3.35Å; N390-G393 PolarHBondContact O-N 3.24Å; N390-G393 PolarHBondContact OD1-N 3.48Å
391	P	93.9	Very high	90.4	Very high	52 Å²	52	31.1 Å²	31.1	34%	0.338	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.4	177.7	-26.6	35.3	0	0	0	115.8	A212 P289 W389	A212-P391 HydrophobicContact CB-CB 3.6Å; A212-P391 HydrophobicContact CB-CG 3.69Å; P289-P391 HydrophobicContact CG-CG 4.18Å; W389-P391 HydrophobicContact CH2-CG 4.49Å
392	G	92.6	Very high	90.5	Very high	13 Å²	13	31.2 Å²	31.2	13%	0.134	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-15.6	173.2	0	0	0	0	0	114.2	N390	N390-G392 PolarHBondContact O-N 3.2Å; N390-G392 VanDerWaalsContact OD1-CA 3.25Å; N390-G392 WeakPolarHBondContact OD1-CA 3.42Å; N390-G392 PolarHBondContact OD1-N 3.13Å
393	G	93.1	Very high	90.5	Very high	7 Å²	7	31 Å²	31	7%	0.072	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.2	-166.8	176	0	0	0	0	0	114.4	P262 N390	P262-G393 WeakPolarHBondContact CD-O 3.48Å; P262-G393 WeakPolarHBondContact CG-O 3.44Å; N390-G393 PolarHBondContact N-O 3.35Å; N390-G393 PolarHBondContact O-N 3.24Å; N390-G393 PolarHBondContact OD1-N 3.48Å
394	V	92.4	Very high	90.4	Very high	49 Å²	49	28.9 Å²	28.9	30%	0.297	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.4	-177.3	-168.1	0	0	0	0	109.6	A331 E387 A388 W389 R396	A331-V394 WeakPolarHBondContact CA-O 2.93Å; A331-V394 VanDerWaalsContact CB-O 3.3Å; A331-V394 WeakPolarHBondContact CB-O 3.3Å; E387-V394 HydrophobicContact CG-CG1 3.76Å; A388-V394 WeakPolarHBondContact O-CA 3.24Å; W389-V394 VanDerWaalsContact CD1-CG2 3.4Å; W389-V394 HydrophobicContact CG-CG2 4.34Å; V394-R396 HydrophobicContact CG1-CG 4.27Å
395	A	91.6	Very high	89.6	Confident	2 Å²	2	33 Å²	33	2%	0.017	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	138.7	172.3	0	0	0	0	0	109.2	P262 V264 A331 A388	P262-A395 HydrophobicContact CB-CB 4.17Å; P262-A395 HydrophobicContact CG-CB 3.95Å; P262-A395 WeakPolarHBondContact O-CB 3.5Å; V264-A395 HydrophobicContact CB-CB 4.46Å; V264-A395 HydrophobicContact CG2-CB 3.58Å; A331-A395 HydrophobicContact CB-CB 4.11Å; A388-A395 PolarHBondContact N-O 3.42Å; A388-A395 PolarHBondContact O-N 3.24Å
396	R	90.4	Very high	88.5	Confident	117 Å²	117	33.9 Å²	33.9	44%	0.442	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.2	-177.7	-64.1	-179.1	-178.6	-170	-4.6	110.4	V329 E385 C386 E387 V394	V329-R396 WeakPolarHBondContact CG1-O 3.25Å; E385-R396 HydrophobicContact CG-CB 4.22Å; E385-R396 WeakPolarHBondContact OE1-CB 3.48Å; E385-R396 VanDerWaalsContact OE1-CD 3.23Å; E385-R396 WeakPolarHBondContact OE1-CD 3.48Å; C386-R396 CarbonylContact O-C 3.54Å; C386-R396 VanDerWaalsContact O-CA 3.32Å; C386-R396 WeakPolarHBondContact O-CA 3.45Å; E387-R396 HydrophobicContact CB-CG 4.16Å; E387-R396 VanDerWaalsContact CD-NH2 3.3Å; E387-R396 HydrophobicContact CG-CG 3.95Å; E387-R396 IonicContact OE1-CZ 2.84Å; E387-R396 IonicContact OE1-NE 2.83Å; E387-R396 PolarHBondContact OE1-NE 3.03Å; E387-R396 IonicContact OE1-NH2 3.33Å; E387-R396 PolarHBondContact OE1-NH2 3.21Å; E387-R396 IonicContact OE2-CZ 3.07Å; E387-R396 IonicContact OE2-NE 2.8Å; E387-R396 PolarHBondContact OE2-NE 3.39Å; E387-R396 IonicContact OE2-NH1 3.05Å; E387-R396 IonicContact OE2-NH2 3.97Å; E387-R396 PolarHBondContact OE2-NH2 2.55Å; E387-R396 VanDerWaalsContact OE2-NH2 3.07Å; V394-R396 HydrophobicContact CG1-CG 4.27Å
397	V	90.4	Very high	86.7	Confident	15 Å²	15	37.9 Å²	37.9	9%	0.091	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	142.2	176.1	66.3	0	0	0	0	109.9	V264 L266 V329 E385 C386	V264-V397 HydrophobicContact CB-CG1 4.44Å; V264-V397 HydrophobicContact CG1-CB 4.31Å; V264-V397 HydrophobicContact CG1-CG1 3.49Å; V264-V397 VanDerWaalsContact CG1-CG1 3.49Å; L266-V397 HydrophobicContact CB-CG1 3.77Å; L266-V397 HydrophobicContact CB-CG2 3.97Å; L266-V397 HydrophobicContact CD2-CG1 3.94Å; L266-V397 HydrophobicContact CD2-CG2 3.85Å; L266-V397 HydrophobicContact CG-CG1 4.37Å; V329-V397 HydrophobicContact CG2-CB 4.14Å; V329-V397 HydrophobicContact CG2-CG2 4.08Å; E385-V397 WeakPolarHBondContact CA-O 3.41Å; C386-V397 HydrophobicContact CB-CG1 3.79Å; C386-V397 PolarHBondContact N-O 3.18Å; C386-V397 PolarHBondContact O-N 3.07Å
398	T	89.6	Confident	84.5	Confident	52 Å²	52	42.1 Å²	42.1	32%	0.319	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	131.5	-177.6	52.4	0	0	0	0	111.6	R383 Y384	R383-T398 HydrophobicContact CG-CG2 4.47Å; Y384-T398 CarbonylContact O-C 3.58Å; Y384-T398 WeakPolarHBondContact O-CA 3.35Å
399	F	89.1	Confident	81.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.8	169.3	173.8	-110.5	0	0	0	110	L266 P268 N269 L271 V281 W295 L371 Y384 L401	L266-F399 HydrophobicContact CD2-CB 3.85Å; P268-F399 WeakPolarHBondContact O-CD2 3.43Å; N269-F399 WeakPolarHBondContact O-CA 3.45Å; L271-F399 HydrophobicContact CB-CE2 3.85Å; L271-F399 HydrophobicContact CB-CZ 3.63Å; V281-F399 HydrophobicContact CG1-CD2 4.14Å; V281-F399 HydrophobicContact CG1-CE2 4.22Å; V281-F399 HydrophobicContact CG2-CD2 4.49Å; V281-F399 HydrophobicContact CG2-CE1 4.08Å; V281-F399 HydrophobicContact CG2-CE2 3.82Å; V281-F399 HydrophobicContact CG2-CZ 3.59Å; W295-F399 HydrophobicContact CH2-CB 3.89Å; W295-F399 HydrophobicContact CH2-CG 4.38Å; W295-F399 HydrophobicContact CZ3-CB 3.68Å; W295-F399 HydrophobicContact CZ3-CG 4.4Å; L371-F399 HydrophobicContact CD2-CD1 3.85Å; L371-F399 HydrophobicContact CD2-CE1 4Å; Y384-F399 HydrophobicContact CD2-CD1 4Å; Y384-F399 HydrophobicContact CD2-CE1 4.48Å; Y384-F399 HydrophobicContact CG-CD1 4.28Å; Y384-F399 PolarHBondContact N-O 2.71Å; Y384-F399 PolarHBondContact O-N 3.05Å; F399-L401 HydrophobicContact CE1-CB 3.96Å
400	H	88.6	Confident	79.1	Confident	44 Å²	44	51 Å²	51	20%	0.204	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.5	178	-70.9	-80.8	0	0	0	111.5	N269 H270 L271	N269-H400 PolarHBondContact O-N 3.31Å; H270-H400 CarbonylContact C-O 3.04Å; H270-H400 VanDerWaalsContact CA-O 3.29Å; H270-H400 WeakPolarHBondContact CA-O 3.45Å; H270-H400 HydrophobicContact CB-CB 4.33Å; L271-H400 PolarHBondContact N-O 2.94Å
401	L	88	Confident	75.9	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.031	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.3	175.1	-177.1	59.1	0	0	0	110.7	V273 L279 L373 H380 A381 G382 Y384 F399	V273-L401 HydrophobicContact CB-CD1 4.19Å; V273-L401 HydrophobicContact CG2-CD1 3.76Å; L279-L401 HydrophobicContact CD2-CD1 3.45Å; L279-L401 VanDerWaalsContact CD2-CD1 3.45Å; L279-L401 HydrophobicContact CD2-CD2 3.61Å; L279-L401 HydrophobicContact CD2-CG 4.2Å; L373-L401 HydrophobicContact CD1-CD2 3.76Å; H380-L401 HydrophobicContact CB-CD2 4.17Å; H380-L401 WeakPolarHBondContact O-CD2 3.23Å; A381-L401 WeakPolarHBondContact CA-O 3.41Å; G382-L401 PolarHBondContact N-O 3.25Å; G382-L401 PolarHBondContact O-N 3.38Å; Y384-L401 HydrophobicContact CD2-CB 4.3Å; Y384-L401 HydrophobicContact CE2-CB 3.91Å; Y384-L401 HydrophobicContact CE2-CD2 4.16Å; F399-L401 HydrophobicContact CE1-CB 3.96Å
402	A	87.6	Confident	73.2	Confident	4 Å²	4	58.6 Å²	58.6	3%	0.033	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.9	166.9	0	0	0	0	0	110.2	L271 T272 V273 F311	L271-A402 PolarHBondContact O-N 3.34Å; T272-A402 CarbonylContact C-O 3.59Å; T272-A402 VanDerWaalsContact CA-O 3.28Å; T272-A402 WeakPolarHBondContact CA-O 3.26Å; T272-A402 HydrophobicContact CG2-CB 4.19Å; V273-A402 PolarHBondContact N-O 2.91Å; F311-A402 WeakPolarHBondContact O-CA 2.86Å
403	V	85.3	Confident	70.3	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.3	178.3	179.6	0	0	0	0	109.8	V273 F311 V376 A381	V273-V403 CarbonylContact O-C 3.6Å; V273-V403 WeakPolarHBondContact O-CA 3.47Å; F311-V403 HydrophobicContact CB-CB 4.45Å; F311-V403 WeakPolarHBondContact CB-O 3.29Å; F311-V403 PolarHBondContact N-O 2.85Å; F311-V403 PolarHBondContact O-N 2.86Å; V376-V403 HydrophobicContact CG1-CG1 4.45Å; V376-V403 HydrophobicContact CG1-CG2 3.67Å; A381-V403 HydrophobicContact CB-CB 4.46Å; A381-V403 HydrophobicContact CB-CG2 3.91Å
404	N	85.1	Confident	67.3	Low	34 Å²	34	73.8 Å²	73.8	18%	0.182	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	116.3	178.9	-172.8	-1.2	0	0	0	110.6	T272 V273 L275 L310 S406	T272-N404 HydrophobicContact CG2-CB 4.02Å; V273-N404 PolarHBondContact O-N 3.13Å; L275-N404 PolarHBondContact N-O 3.46Å; L310-N404 HydrophobicContact CD2-CB 4.35Å; N404-S406 PolarHBondContact ND2-OG 3.4Å; N404-S406 WeakPolarHBondContact OD1-CB 3.26Å; N404-S406 PolarHBondContact OD1-N 3.21Å; N404-S406 PolarHBondContact OD1-OG 3.48Å
405	M	72.3	Confident	64.3	Low	86 Å²	86	83 Å²	83	42%	0.424	44%	0.439	S	S	.	.			trans	-90.9	0.6	176	-73.8	-162	76.4	0	0	114.1	L275 L305 G309 V378 S407	L275-M405 HydrophobicContact CD1-CE 4.04Å; L275-M405 HydrophobicContact CD1-CG 3.91Å; L305-M405 HydrophobicContact CD1-SD 4.07Å; G309-M405 WeakPolarHBondContact O-CB 3.33Å; G309-M405 PolarHBondContact O-N 3.36Å; V378-M405 HydrophobicContact CG2-CG 4.06Å; V378-M405 HydrophobicContact CG2-SD 3.79Å; M405-S407 PolarHBondContact O-N 2.95Å
406	S	66.5	Low	61.4	Low	59 Å²	59	88.7 Å²	88.7	41%	0.413	48%	0.476	S	S	.	.			trans	-61.6	102.9	179.7	51.2	0	0	0	0	110.6	N404	N404-S406 PolarHBondContact ND2-OG 3.4Å; N404-S406 WeakPolarHBondContact OD1-CB 3.26Å; N404-S406 PolarHBondContact OD1-N 3.21Å; N404-S406 PolarHBondContact OD1-OG 3.48Å
407	S	51.4	Low	58.5	Low	83 Å²	83	94.7 Å²	94.7	58%	0.58	50%	0.499	S	S	*	.			trans	-60.4	133.5	166.6	50.7	0	0	0	0	108.2	M405 S409	M405-S407 PolarHBondContact O-N 2.95Å; S407-S409 PolarHBondContact O-N 2.89Å
408	S	46.8	Very low	55.4	Low	122 Å²	122	102.6 Å²	102.6	85%	0.853	54%	0.539	S	S	*	.	S	Bend	trans	-68	72.7	159.1	49.1	0	0	0	0	109
409	S	36.2	Very low	52.4	Low	89 Å²	89	106.7 Å²	106.7	62%	0.622	56%	0.559	S	S	*	*			trans	-167.2	75.3	166.4	58.6	0	0	0	0	110.6	S407 S411	S407-S409 PolarHBondContact O-N 2.89Å; S409-S411 PolarHBondContact O-N 3.44Å
410	Y	35.7	Very low	49.4	Very low	235 Å²	235	111.4 Å²	111.4	92%	0.922	59%	0.588	S	S	*	*			trans	-69	115.7	160.9	-113	-97.6	0	0	0	108.2
411	S	28.1	Very low	46.5	Very low	110 Å²	110	117.8 Å²	117.8	77%	0.769	62%	0.618	S	S	*	*			trans	-125.3	105.4	154.2	77.4	0	0	0	0	109.3	S409	S409-S411 PolarHBondContact O-N 3.44Å
412	S	37.2	Very low	43.5	Very low	104 Å²	104	121.1 Å²	121.1	73%	0.727	64%	0.642	S	S	*	*			trans	-64.9	120.9	172.3	47.9	0	0	0	0	112
413	Q	30	Very low	40.6	Very low	175 Å²	175	131.3 Å²	131.3	82%	0.818	68%	0.681	S	S	*	*			trans	-143.4	99.2	155.2	-67.4	-168.9	-10.5	0	0	107.7
414	L	31.2	Very low	37.8	Very low	163 Å²	163	136.8 Å²	136.8	85%	0.853	71%	0.714	S	S	*	*				73.3	95.7	99.7	-89.2	147.7	0	0	0	113.2
415	W	29.7	Very low	35	Very low	243 Å²	243	140 Å²	140	92%	0.92	74%	0.739	S	S	*	*			trans	-79.9	148.2	162.7	-67.4	63.8	0	0	0	109.9
416	P	30.9	Very low	32.8	Very low	122 Å²	122	140.7 Å²	140.7	79%	0.792	75%	0.753	S	S	*	*			trans	-107.8	123.2	144.9	15.9	2.5	0	0	0	111.1
417	R	29	Very low	30.9	Very low	243 Å²	243	142.5 Å²	142.5	92%	0.917	77%	0.765	S	S	*	*			trans	-17.7	137.4	163.5	-61.1	179.3	173.3	-168.5	-3	117.7
418	L	25.5	Very low	29.7	Very low	180 Å²	180	144 Å²	144	94%	0.942	78%	0.775	S	S	*	*			trans	-109	127.9	151.4	-92.1	150.5	0	0	0	109.2
419	N	26.1	Very low	28.7	Very low	138 Å²	138	143.2 Å²	143.2	74%	0.738	77%	0.77	S	S	*	*			trans	-103.9	145.2	171	-138.6	13.1	0	0	0	108.6
420	T	26.3	Very low	28.1	Very low	100 Å²	100	144.3 Å²	144.3	61%	0.613	78%	0.778	S	S	*	*			trans	73.7	118.9	148	52.6	0	0	0	0	122.4
421	H	27.2	Very low	27.7	Very low	177 Å²	177	142.3 Å²	142.3	82%	0.819	77%	0.774	S	S	*	*			trans	59.4	143.5	132.5	-67.6	-64.3	0	0	0	119.1
422	S	26	Very low	27.5	Very low	77 Å²	77	148.3 Å²	148.3	54%	0.538	78%	0.782	S	S	.	*			cis	172.4	160.2	0.4	44	0	0	0	0	107
423	Y	26	Very low	27.3	Very low	217 Å²	217	151.7 Å²	151.7	85%	0.851	79%	0.786	S	S	*	*			trans	70	155.6	167.9	-59.9	-82.9	0	0	0	117.3
424	V	26.1	Very low	27.3	Very low	116 Å²	116	149 Å²	149	70%	0.703	78%	0.783	S	S	*	*			cis	-166.2	159.6	-25	137.5	0	0	0	0	104.5
425	S	27.1	Very low	27	Very low	101 Å²	101	150.1 Å²	150.1	71%	0.706	78%	0.784	S	S	*	*			trans	-38	155.7	169.3	55	0	0	0	0	115.4
426	S	26.6	Very low	27.2	Very low	101 Å²	101	144.8 Å²	144.8	71%	0.706	78%	0.778	S	S	*	*			cis	-179.2	158.8	43.1	41.9	0	0	0	0	110.8
427	S	25.7	Very low	27	Very low	97 Å²	97	147.2 Å²	147.2	68%	0.678	78%	0.784	S	S	*	*			trans	63.1	122.5	144.5	59.9	0	0	0	0	123.5
428	S	25.6	Very low	26.9	Very low	113 Å²	113	142.2 Å²	142.2	79%	0.79	78%	0.776	S	S	*	*			trans	51.1	137.4	141.9	54.9	0	0	0	0	119.9
429	S	26.3	Very low	26.9	Very low	106 Å²	106	139.8 Å²	139.8	74%	0.741	77%	0.768	S	S	*	*			cis	-176.9	137.6	3.8	45.3	0	0	0	0	106.1
430	S	24.5	Very low	26.9	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	77%	0.768	S	S	*	*			trans	155.3	130.9	142.3	48.6	0	0	0	0	113.8
431	F	27	Very low	27	Very low	193 Å²	193	142.6 Å²	142.6	85%	0.846	78%	0.781	S	S	*	*			trans	41.8	113.4	146.8	-77.5	-93	0	0	0	120.3
432	Y	23.8	Very low	27.1	Very low	236 Å²	236	143.1 Å²	143.1	93%	0.925	78%	0.784	S	S	*	*				-165	115.9	128.8	-106.7	-78.4	0	0	0	109.7
433	Q	32.1	Very low	27.8	Very low	174 Å²	174	144.2 Å²	144.2	81%	0.813	79%	0.789	S	S	*	*			trans	-75.9	155.6	154.8	-92.2	171.9	-52.5	0	0	108.4
434	P	31.3	Very low	27.8	Very low	118 Å²	118	141.1 Å²	141.1	77%	0.766	79%	0.787	S	S	*	*				-142	132.9	106.7	29.4	-11.2	0	0	0	115
435	E	25.2	Very low	27.8	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.874	79%	0.791	S	S	*	*				40.9	130.7	126.4	-67	-176.1	156.5	0	0	123.5
436	V	32.6	Very low	28	Very low	131 Å²	131	148.7 Å²	148.7	79%	0.794	80%	0.796	S	S	*	*			trans	-56.5	137.7	160	176.6	0	0	0	0	111.5
437	L	26.4	Very low	28.1	Very low	174 Å²	174	151.5 Å²	151.5	91%	0.911	80%	0.798	S	S	*	*			trans	-133.5	105.9	151.4	-98.1	158.9	0	0	0	108.6
438	D	27.1	Very low	28.1	Very low	138 Å²	138	153.6 Å²	153.6	74%	0.738	80%	0.802	S	S	*	*			trans	-72.5	176.6	160.6	-156.2	-9.6	0	0	0	109.6
439	V	25.8	Very low	28.2	Very low	128 Å²	128	153 Å²	153	78%	0.776	80%	0.797	S	S	*	*			trans	124.3	94.3	166.4	-178.9	0	0	0	0	112.7
440	S	25.5	Very low	28.2	Very low	108 Å²	108	156 Å²	156	76%	0.755	80%	0.802	S	S	*	*				-178	111.1	86.7	37.5	0	0	0	0	111.3
441	Q	29.7	Very low	28.5	Very low	189 Å²	189	157.9 Å²	157.9	88%	0.883	80%	0.803	S	S	*	*			trans	-87.8	141.6	145.7	-71.8	-171.6	-20.9	0	0	107.7
442	E	28.5	Very low	28.7	Very low	188 Å²	188	158.4 Å²	158.4	88%	0.879	81%	0.805	S	S	*	*				175.6	163	119.2	-95.8	-153.1	154.8	0	0	113.2
443	P	41.3	Very low	29	Very low	100 Å²	100	151.7 Å²	151.7	65%	0.649	79%	0.793	S	S	*	*			trans	-123.7	-163.2	-140.6	40.9	-23.5	0	0	0	115
444	L	25.1	Very low	29	Very low	152 Å²	152	148 Å²	148	80%	0.796	79%	0.792	S	S	*	*			trans	101.8	114.6	161.3	-68.7	145.7	0	0	0	118.1
445	Y	27	Very low	29.2	Very low	202 Å²	202	150.8 Å²	150.8	79%	0.792	80%	0.8	S	S	*	*				-168.6	142.7	90.5	-148.6	-106.5	0	0	0	111.9
446	E	30.7	Very low	29.6	Very low	175 Å²	175	144.9 Å²	144.9	82%	0.818	79%	0.789	S	S	*	*			trans	-77.2	140.1	166.3	-76.6	178.7	136.5	0	0	110.8
447	Q	29.3	Very low	29.8	Very low	160 Å²	160	145.1 Å²	145.1	75%	0.748	79%	0.794	S	S	*	*			trans	-158.9	112.8	142.5	-129.2	159.8	-9.6	0	0	112.8
448	D	26.1	Very low	30.3	Very low	140 Å²	140	141.2 Å²	141.2	75%	0.749	79%	0.786	S	S	*	*			trans	48.5	117.5	140.1	-70.5	-34.4	0	0	0	121.2
449	S	27.8	Very low	30.8	Very low	100 Å²	100	144.9 Å²	144.9	70%	0.699	81%	0.814	S	S	*	*				49.4	115.6	122.5	157.2	0	0	0	0	118
450	M	26.6	Very low	31.1	Very low	169 Å²	169	145.8 Å²	145.8	83%	0.833	82%	0.816	S	S	*	*				-171.2	138.1	103.3	-96.5	-163.6	-77.6	0	0	111.8
451	D	30.8	Very low	31.4	Very low	153 Å²	153	147.7 Å²	147.7	82%	0.818	82%	0.819	S	S	*	*			trans	-40.9	144	158.7	-79.3	-49.9	0	0	0	112.1
452	F	29.9	Very low	31.5	Very low	204 Å²	204	145.4 Å²	145.4	90%	0.895	82%	0.816	S	S	*	*			trans	-140.1	126.1	146.5	-116.7	-83.3	0	0	0	113
453	S	30.7	Very low	31.6	Very low	95 Å²	95	142.9 Å²	142.9	66%	0.664	81%	0.812	S	S	*	*			trans	-71.8	157.1	-175.9	-30.3	0	0	0	0	112.4
454	A	31	Very low	31	Very low	97 Å²	97	145.6 Å²	145.6	80%	0.802	82%	0.822	S	S	*	*			trans	-0.1	125.8	145.6	0	0	0	0	0	117.4
455	L	35.5	Very low	31.4	Very low	176 Å²	176	145.2 Å²	145.2	92%	0.921	82%	0.824	S	S	*	*			trans	-118.6	113.7	150.2	-75.9	171.3	0	0	0	109
456	G	33.8	Very low	31.8	Very low	64 Å²	64	141.1 Å²	141.1	66%	0.66	83%	0.826	S	S	*	*			trans	-72.8	-175.3	162.4	0	0	0	0	0	112.3
457	P	38.3	Very low	31.8	Very low	136 Å²	136	138.5 Å²	138.5	88%	0.883	83%	0.827	S	S	*	*			trans	-81.3	150.7	-156.8	33.5	-34.5	0	0	0	112.8
458	A	34.9	Very low	32.1	Very low	91 Å²	91	136.8 Å²	136.8	75%	0.752	83%	0.833	S	S	*	*			trans	-99.9	126.8	171.3	0	0	0	0	0	110.9
459	T	39.3	Very low	32.6	Very low	216 Å²	216	136.5 Å²	136.5	100%	1.325	84%	0.841	S	S	*	*			trans	64.5	0	158.5	62.4	0	0	0	0	119.8

Retrieved 459 of 459 residues in 79.4 ms (Link to these results)

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