A0A087XF43_POEFO Loading...

LRRCT domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XF43, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 329 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	V	51.1	Low	80.9	Confident	154 Å²	154	81.1 Å²	81.1	93%	0.933	55%	0.547	S	S	*	.				0	120.6	0	-166.7	0	0	0	0	107.3
2	P	55.5	Low	81.7	Confident	118 Å²	118	79 Å²	79	77%	0.766	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-54.8	147.7	170.3	24.3	-30.6	0	0	0	109	C4	P2-C4 PolarHBondContact O-N 2.76Å
3	A	69.5	Low	82	Confident	96 Å²	96	83.5 Å²	83.5	79%	0.793	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-56.6	129.8	179.5	0	0	0	0	0	109.7
4	C	81.8	Confident	82.8	Confident	57 Å²	57	83.6 Å²	83.6	39%	0.385	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-56.9	124.8	177.3	-168.5	0	0	0	0	108.9	P2 C8 C11	P2-C4 PolarHBondContact O-N 2.76Å; C4-C8 WeakPolarHBondContact SG-CB 3.2Å; C4-C11 WeakPolarHBondContact CA-SG 3.32Å; C4-C11 HydrophobicContact CB-CB 3.56Å; C4-C11 WeakPolarHBondContact CB-SG 3.37Å; C4-C11 WeakPolarHBondContact SG-CB 3.4Å; C4-C11 CovalentContact SG-SG 2.04Å; C4-C11 PolarHBondContact SG-SG 2.78Å
5	P	85.8	Confident	83.7	Confident	57 Å²	57	79.6 Å²	79.6	37%	0.37	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-55.4	151.7	179.8	-24.8	32.7	0	0	0	111.5	S7 C8	P5-S7 PolarHBondContact O-N 3.35Å; P5-S7 VanDerWaalsContact O-N 3.13Å; P5-C8 HydrophobicContact CB-CB 4.42Å; P5-C8 WeakPolarHBondContact O-CA 3.17Å; P5-C8 WeakPolarHBondContact O-CB 3.49Å; P5-C8 PolarHBondContact O-N 2.96Å
6	V	86.9	Confident	84.4	Confident	158 Å²	158	75.2 Å²	75.2	96%	0.958	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.4	178.6	-164.7	0	0	0	0	111.9	C8	V6-C8 PolarHBondContact O-N 3.04Å
7	S	90.8	Very high	85.1	Confident	51 Å²	51	74.1 Å²	74.1	36%	0.357	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-6.2	173.2	-65.3	0	0	0	0	113.9	P5 C18 Q19	P5-S7 PolarHBondContact O-N 3.35Å; P5-S7 VanDerWaalsContact O-N 3.13Å; S7-C18 CarbonylContact O-C 3.41Å; S7-C18 VanDerWaalsContact O-CA 3.28Å; S7-C18 WeakPolarHBondContact O-CA 3.47Å; S7-C18 WeakPolarHBondContact O-CB 3.24Å; S7-Q19 VanDerWaalsContact CB-O 3.31Å; S7-Q19 WeakPolarHBondContact CB-O 3.42Å; S7-Q19 PolarHBondContact O-N 3.27Å
8	C	93.3	Very high	85.7	Confident	15 Å²	15	70 Å²	70	10%	0.101	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.9	-175	-62	0	0	0	0	111.2	C4 P5 V6 C11 I17 C18	C4-C8 WeakPolarHBondContact SG-CB 3.2Å; P5-C8 HydrophobicContact CB-CB 4.42Å; P5-C8 WeakPolarHBondContact O-CA 3.17Å; P5-C8 WeakPolarHBondContact O-CB 3.49Å; P5-C8 PolarHBondContact O-N 2.96Å; V6-C8 PolarHBondContact O-N 3.04Å; C8-C11 VanDerWaalsContact CB-SG 3.53Å; C8-I17 CarbonylContact C-O 3.54Å; C8-I17 WeakPolarHBondContact CA-O 3.48Å; C8-C18 HydrophobicContact CB-CB 3.94Å; C8-C18 WeakPolarHBondContact CB-SG 3.38Å; C8-C18 WeakPolarHBondContact SG-CB 2.94Å; C8-C18 CovalentContact SG-SG 2.03Å; C8-C18 PolarHBondContact SG-SG 2.98Å
9	A	92.8	Very high	86.3	Confident	88 Å²	88	70.4 Å²	70.4	73%	0.727	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	-33	174.9	0	0	0	0	0	111.4	I17	A9-I17 PolarHBondContact N-O 3.25Å
10	V	92.3	Very high	86.7	Confident	56 Å²	56	76 Å²	76	34%	0.339	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128	-179.3	-176.1	0	0	0	0	109.3	A15 V16 I17	V10-A15 HydrophobicContact CG1-CB 4.42Å; V10-V16 CarbonylContact O-C 3.39Å; V10-V16 WeakPolarHBondContact O-CA 3.24Å; V10-I17 HydrophobicContact CB-CB 3.98Å; V10-I17 HydrophobicContact CB-CD1 4.24Å; V10-I17 HydrophobicContact CB-CG1 4.06Å; V10-I17 HydrophobicContact CG2-CB 4.26Å; V10-I17 HydrophobicContact CG2-CD1 4.03Å; V10-I17 HydrophobicContact CG2-CG1 4.35Å; V10-I17 PolarHBondContact N-O 2.81Å; V10-I17 PolarHBondContact O-N 2.91Å
11	C	90.9	Very high	87.1	Confident	42 Å²	42	73.4 Å²	73.4	28%	0.284	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	92.7	164.2	-53.2	0	0	0	0	108.3	C4 C8	C4-C11 WeakPolarHBondContact CA-SG 3.32Å; C4-C11 HydrophobicContact CB-CB 3.56Å; C4-C11 WeakPolarHBondContact CB-SG 3.37Å; C4-C11 WeakPolarHBondContact SG-CB 3.4Å; C4-C11 CovalentContact SG-SG 2.04Å; C4-C11 PolarHBondContact SG-SG 2.78Å; C8-C11 VanDerWaalsContact CB-SG 3.53Å
12	S	89.9	Confident	89.1	Confident	56 Å²	56	69 Å²	69	39%	0.392	42%	0.418	S	S	.	.			trans	-113.3	176.4	170.2	69.9	0	0	0	0	110.1	D14 A15	S12-D14 PolarHBondContact O-N 2.88Å; S12-D14 PolarHBondContact OG-N 2.8Å; S12-A15 PolarHBondContact N-O 3.4Å; S12-A15 PolarHBondContact OG-N 3.41Å; S12-A15 PolarHBondContact OG-O 3.48Å
13	E	86.1	Confident	91	Very high	137 Å²	137	69.1 Å²	69.1	64%	0.64	41%	0.412	S	S	*	.	S	Bend	trans	-64.2	-30.8	174.7	-65.3	-172.9	166.9	0	0	112	S30 T31	E13-S30 CarbonylContact O-C 3.54Å; E13-S30 PolarHBondContact O-OG 3.15Å; E13-T31 WeakPolarHBondContact O-CA 3.43Å; E13-T31 PolarHBondContact O-N 3.34Å; E13-T31 PolarHBondContact O-OG1 2.96Å
14	D	92.9	Very high	92.1	Very high	86 Å²	86	65.6 Å²	65.6	46%	0.46	38%	0.38	S	S	.	.	S	Bend	trans	-96.4	-25.1	-175.7	-57.9	-48.2	0	0	0	113.7	S12 Q32 A33	S12-D14 PolarHBondContact O-N 2.88Å; S12-D14 PolarHBondContact OG-N 2.8Å; D14-Q32 WeakPolarHBondContact O-CA 3.31Å; D14-Q32 PolarHBondContact O-N 3.23Å; D14-A33 PolarHBondContact O-N 3.26Å
15	A	95.6	Very high	92.6	Very high	23 Å²	23	64.9 Å²	64.9	19%	0.19	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	135.3	-172.1	0	0	0	0	0	113	V10 S12 A33	V10-A15 HydrophobicContact CG1-CB 4.42Å; S12-A15 PolarHBondContact N-O 3.4Å; S12-A15 PolarHBondContact OG-N 3.41Å; S12-A15 PolarHBondContact OG-O 3.48Å; A15-A33 CarbonylContact C-O 3.25Å; A15-A33 WeakPolarHBondContact CA-O 2.88Å; A15-A33 HydrophobicContact CB-CB 4.24Å
16	V	95.7	Very high	92.7	Very high	9 Å²	9	69.7 Å²	69.7	6%	0.055	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	117.4	173.8	178.8	0	0	0	0	108.2	V10 I25 A27 T31 A33 L34 L35	V10-V16 CarbonylContact O-C 3.39Å; V10-V16 WeakPolarHBondContact O-CA 3.24Å; V16-I25 HydrophobicContact CG1-CD1 3.76Å; V16-I25 HydrophobicContact CG1-CG1 4.5Å; V16-A27 HydrophobicContact CG2-CB 4.04Å; V16-T31 HydrophobicContact CG2-CG2 4.2Å; V16-A33 PolarHBondContact N-O 2.77Å; V16-L34 HydrophobicContact CB-CD1 3.78Å; V16-L34 HydrophobicContact CG1-CD1 3.88Å; V16-L34 WeakPolarHBondContact O-CA 3.47Å; V16-L35 PolarHBondContact O-N 3.14Å
17	I	96.5	Very high	92.8	Very high	57 Å²	57	63.2 Å²	63.2	29%	0.292	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	115	-178.7	-52.9	179.6	0	0	0	108.5	C8 A9 V10 L35	C8-I17 CarbonylContact C-O 3.54Å; C8-I17 WeakPolarHBondContact CA-O 3.48Å; A9-I17 PolarHBondContact N-O 3.25Å; V10-I17 HydrophobicContact CB-CB 3.98Å; V10-I17 HydrophobicContact CB-CD1 4.24Å; V10-I17 HydrophobicContact CB-CG1 4.06Å; V10-I17 HydrophobicContact CG2-CB 4.26Å; V10-I17 HydrophobicContact CG2-CD1 4.03Å; V10-I17 HydrophobicContact CG2-CG1 4.35Å; V10-I17 PolarHBondContact N-O 2.81Å; V10-I17 PolarHBondContact O-N 2.91Å; I17-L35 CarbonylContact C-O 3.26Å; I17-L35 WeakPolarHBondContact CA-O 3.37Å; I17-L35 HydrophobicContact CB-CB 4.5Å; I17-L35 HydrophobicContact CD1-CD1 4.11Å; I17-L35 HydrophobicContact CG1-CB 4.24Å; I17-L35 HydrophobicContact CG1-CD1 4.09Å; I17-L35 HydrophobicContact CG1-CG 4.38Å; I17-L35 HydrophobicContact CG2-CB 4.21Å
18	C	96.3	Very high	92.8	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	156.2	-177	-48.3	0	0	0	0	111.8	S7 C8 L21 I25 L35 L36 T37	S7-C18 CarbonylContact O-C 3.41Å; S7-C18 VanDerWaalsContact O-CA 3.28Å; S7-C18 WeakPolarHBondContact O-CA 3.47Å; S7-C18 WeakPolarHBondContact O-CB 3.24Å; C8-C18 HydrophobicContact CB-CB 3.94Å; C8-C18 WeakPolarHBondContact CB-SG 3.38Å; C8-C18 WeakPolarHBondContact SG-CB 2.94Å; C8-C18 CovalentContact SG-SG 2.03Å; C8-C18 PolarHBondContact SG-SG 2.98Å; C18-L21 HydrophobicContact CB-CD1 3.38Å; C18-L21 HydrophobicContact CB-CG 4.04Å; C18-I25 VanDerWaalsContact SG-CD1 3.58Å; C18-L35 PolarHBondContact N-O 2.67Å; C18-L36 HydrophobicContact CB-CD2 3.86Å; C18-L36 WeakPolarHBondContact O-CA 3.02Å; C18-T37 PolarHBondContact O-N 3.03Å
19	Q	95.7	Very high	92.7	Very high	77 Å²	77	67.4 Å²	67.4	36%	0.36	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	154.9	177.7	-61.7	-172.8	-28.3	0	0	110.8	S7 L21 T37 E38	S7-Q19 VanDerWaalsContact CB-O 3.31Å; S7-Q19 WeakPolarHBondContact CB-O 3.42Å; S7-Q19 PolarHBondContact O-N 3.27Å; Q19-L21 VanDerWaalsContact C-N 3.26Å; Q19-L21 PolarHBondContact O-N 3.21Å; Q19-T37 CarbonylContact C-O 3.1Å; Q19-T37 WeakPolarHBondContact CA-O 3.19Å; Q19-E38 PolarHBondContact NE2-OE1 2.73Å
20	R	94.5	Very high	92.7	Very high	183 Å²	183	64.7 Å²	64.7	69%	0.691	36%	0.356	S	S	*	.	S	Bend	trans	60.1	34.9	172	-54.2	-179.7	-174.3	129.2	8.5	113.8	T37 E38	R20-T37 PolarHBondContact N-O 3.24Å; R20-T37 VanDerWaalsContact N-O 3.11Å; R20-E38 WeakPolarHBondContact CA-O 3.25Å; R20-E38 WeakPolarHBondContact CG-O 3.01Å; R20-E38 PolarHBondContact N-O 3.07Å
21	L	94.4	Very high	92.8	Very high	22 Å²	22	62 Å²	62	12%	0.115	34%	0.34	C	S	.	.			trans	-89.3	146.5	173.7	-68	174.9	0	0	0	110.8	C18 Q19 I25 L36 G39 S40	C18-L21 HydrophobicContact CB-CD1 3.38Å; C18-L21 HydrophobicContact CB-CG 4.04Å; Q19-L21 VanDerWaalsContact C-N 3.26Å; Q19-L21 PolarHBondContact O-N 3.21Å; L21-I25 HydrophobicContact CD1-CD1 4.25Å; L21-I25 HydrophobicContact CD1-CG1 4.29Å; L21-I25 HydrophobicContact CD1-CG2 3.95Å; L21-I25 HydrophobicContact CD2-CG2 4.35Å; L21-L36 HydrophobicContact CD1-CD2 3.78Å; L21-G39 CarbonylContact O-C 3.2Å; L21-G39 VanDerWaalsContact O-CA 3.26Å; L21-G39 WeakPolarHBondContact O-CA 3.45Å; L21-S40 PolarHBondContact O-N 2.64Å
22	A	94.8	Very high	93.1	Very high	60 Å²	60	64.3 Å²	64.3	50%	0.496	35%	0.347	S	S	.	.	S	Bend	trans	-92.2	-17.8	173.9	0	0	0	0	0	113.1
23	N	94.1	Very high	93.5	Very high	121 Å²	121	62.8 Å²	62.8	65%	0.647	34%	0.338	S	S	*	.	S	Bend	trans	-140.2	156.2	-177.6	-61.9	-60.5	0	0	0	110.3	I25	N23-I25 PolarHBondContact O-N 3.05Å
24	I	93.7	Very high	94.1	Very high	23 Å²	23	56.3 Å²	56.3	12%	0.118	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-65.1	130.6	166.1	-60	174.6	0	0	0	107.9	L34 L36 I41 V44 L49	I24-L34 HydrophobicContact CG2-CD2 4.48Å; I24-L36 HydrophobicContact CB-CD1 4.29Å; I24-L36 HydrophobicContact CG1-CD1 4.28Å; I24-L36 HydrophobicContact CG2-CD1 4.09Å; I24-I41 HydrophobicContact CG1-CD1 4.13Å; I24-I41 HydrophobicContact CG1-CG2 4.16Å; I24-V44 HydrophobicContact CD1-CB 4.42Å; I24-V44 HydrophobicContact CD1-CG1 3.98Å; I24-V44 HydrophobicContact CD1-CG2 4.35Å; I24-L49 HydrophobicContact CD1-CD2 4.48Å; I24-L49 HydrophobicContact CG2-CD2 4.21Å
25	I	91.2	Very high	94.3	Very high	42 Å²	42	54.5 Å²	54.5	22%	0.215	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-96.1	155.1	-179.6	58.5	168	0	0	0	110.9	V16 C18 L21 N23 A27 L36	V16-I25 HydrophobicContact CG1-CD1 3.76Å; V16-I25 HydrophobicContact CG1-CG1 4.5Å; C18-I25 VanDerWaalsContact SG-CD1 3.58Å; L21-I25 HydrophobicContact CD1-CD1 4.25Å; L21-I25 HydrophobicContact CD1-CG1 4.29Å; L21-I25 HydrophobicContact CD1-CG2 3.95Å; L21-I25 HydrophobicContact CD2-CG2 4.35Å; N23-I25 PolarHBondContact O-N 3.05Å; I25-A27 PolarHBondContact O-N 3.19Å; I25-L36 HydrophobicContact CD1-CD2 4.45Å; I25-L36 HydrophobicContact CG1-CD2 4.21Å
26	D	88.1	Confident	94.4	Very high	158 Å²	158	53.5 Å²	53.5	85%	0.845	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-65.3	133.4	173.7	-62.6	-31.5	0	0	0	110.5
27	A	89.8	Confident	94.4	Very high	21 Å²	21	54.7 Å²	54.7	17%	0.174	30%	0.296	C	S	.	.			trans	-128.8	160.3	173.9	0	0	0	0	0	110	V16 I25 T31 L34 L52	V16-A27 HydrophobicContact CG2-CB 4.04Å; I25-A27 PolarHBondContact O-N 3.19Å; A27-T31 HydrophobicContact CB-CG2 4.35Å; A27-L34 HydrophobicContact CB-CD1 4.45Å; A27-L52 HydrophobicContact CB-CD2 3.82Å
28	A	89.9	Confident	94.3	Very high	44 Å²	44	56.6 Å²	56.6	36%	0.364	30%	0.304	S	S	.	.			trans	-68.6	153.6	179.6	0	0	0	0	0	110.8	S30 T31 L52	A28-S30 WeakPolarHBondContact CB-OG 3.39Å; A28-S30 PolarHBondContact O-N 3.26Å; A28-T31 PolarHBondContact N-OG1 3.43Å; A28-T31 WeakPolarHBondContact O-CB 2.98Å; A28-T31 PolarHBondContact O-N 2.8Å; A28-T31 PolarHBondContact O-OG1 3.4Å; A28-T31 VanDerWaalsContact O-OG1 3.05Å; A28-L52 WeakPolarHBondContact O-CD2 3.39Å
29	D	90.8	Very high	94.2	Very high	111 Å²	111	57 Å²	57	59%	0.594	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-23	175.9	65.3	-21.7	0	0	0	112.8	T31 V51	D29-T31 VanDerWaalsContact C-N 3.25Å; D29-T31 PolarHBondContact O-N 2.95Å; D29-V51 WeakPolarHBondContact CB-O 3.2Å
30	S	93.1	Very high	94.3	Very high	30 Å²	30	56.4 Å²	56.4	21%	0.21	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.2	171.3	60.7	0	0	0	0	114.1	E13 A28 Q32	E13-S30 CarbonylContact O-C 3.54Å; E13-S30 PolarHBondContact O-OG 3.15Å; A28-S30 WeakPolarHBondContact CB-OG 3.39Å; A28-S30 PolarHBondContact O-N 3.26Å; S30-Q32 PolarHBondContact O-N 2.76Å
31	T	95.4	Very high	94.4	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	28%	0.28	C	S	.	.			trans	-63.8	126.9	-173.8	-61.3	0	0	0	0	111.1	E13 V16 A27 A28 D29 A33 N54 I55	E13-T31 WeakPolarHBondContact O-CA 3.43Å; E13-T31 PolarHBondContact O-N 3.34Å; E13-T31 PolarHBondContact O-OG1 2.96Å; V16-T31 HydrophobicContact CG2-CG2 4.2Å; A27-T31 HydrophobicContact CB-CG2 4.35Å; A28-T31 PolarHBondContact N-OG1 3.43Å; A28-T31 WeakPolarHBondContact O-CB 2.98Å; A28-T31 PolarHBondContact O-N 2.8Å; A28-T31 PolarHBondContact O-OG1 3.4Å; A28-T31 VanDerWaalsContact O-OG1 3.05Å; D29-T31 VanDerWaalsContact C-N 3.25Å; D29-T31 PolarHBondContact O-N 2.95Å; T31-A33 WeakPolarHBondContact CG2-O 3.31Å; T31-N54 CarbonylContact O-C 3.47Å; T31-I55 HydrophobicContact CG2-CD1 4.05Å; T31-I55 WeakPolarHBondContact O-CA 3.3Å; T31-I55 WeakPolarHBondContact O-CD1 3.05Å; T31-I55 PolarHBondContact O-N 3.21Å
32	Q	97.2	Very high	94.6	Very high	90 Å²	90	49.6 Å²	49.6	42%	0.421	29%	0.294	S	S	.	.			trans	-100.1	-32.5	179.4	-59.9	-179	19.2	0	0	111.5	D14 S30 I55 T56 V57	D14-Q32 WeakPolarHBondContact O-CA 3.31Å; D14-Q32 PolarHBondContact O-N 3.23Å; S30-Q32 PolarHBondContact O-N 2.76Å; Q32-I55 WeakPolarHBondContact O-CD1 3.46Å; Q32-T56 PolarHBondContact O-N 2.74Å; Q32-T56 PolarHBondContact O-OG1 3.13Å; Q32-V57 PolarHBondContact O-N 3.34Å
33	A	98	Very high	94.7	Very high	24 Å²	24	48.8 Å²	48.8	20%	0.198	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	122.8	178.8	0	0	0	0	0	111.8	D14 A15 V16 T31 V57	D14-A33 PolarHBondContact O-N 3.26Å; A15-A33 CarbonylContact C-O 3.25Å; A15-A33 WeakPolarHBondContact CA-O 2.88Å; A15-A33 HydrophobicContact CB-CB 4.24Å; V16-A33 PolarHBondContact N-O 2.77Å; T31-A33 WeakPolarHBondContact CG2-O 3.31Å; A33-V57 WeakPolarHBondContact CA-O 3.19Å; A33-V57 HydrophobicContact CB-CB 4.38Å
34	L	97.4	Very high	94.8	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	105.8	174.3	-179	66.5	0	0	0	108.8	V16 I24 A27 L36 L49 L52 I55 V57 I58 G59	V16-L34 HydrophobicContact CB-CD1 3.78Å; V16-L34 HydrophobicContact CG1-CD1 3.88Å; V16-L34 WeakPolarHBondContact O-CA 3.47Å; I24-L34 HydrophobicContact CG2-CD2 4.48Å; A27-L34 HydrophobicContact CB-CD1 4.45Å; L34-L36 HydrophobicContact CD1-CD1 4.21Å; L34-L36 HydrophobicContact CD1-CD2 3.74Å; L34-L36 HydrophobicContact CD1-CG 4Å; L34-L36 HydrophobicContact CD2-CD1 4.31Å; L34-L36 HydrophobicContact CG-CD1 4.24Å; L34-L36 HydrophobicContact CG-CD2 4.34Å; L34-L36 HydrophobicContact CG-CG 4.06Å; L34-L49 HydrophobicContact CD2-CD2 3.95Å; L34-L52 HydrophobicContact CD2-CD1 3.75Å; L34-I55 HydrophobicContact CB-CD1 3.78Å; L34-V57 PolarHBondContact N-O 2.81Å; L34-I58 CarbonylContact O-C 3.53Å; L34-I58 WeakPolarHBondContact O-CA 3.31Å; L34-G59 PolarHBondContact O-N 3.29Å
35	L	98	Very high	94.8	Very high	49 Å²	49	46.9 Å²	46.9	26%	0.257	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	107	-179.5	-54.8	-178.7	0	0	0	109.3	V16 I17 C18 V57 G59	V16-L35 PolarHBondContact O-N 3.14Å; I17-L35 CarbonylContact C-O 3.26Å; I17-L35 WeakPolarHBondContact CA-O 3.37Å; I17-L35 HydrophobicContact CB-CB 4.5Å; I17-L35 HydrophobicContact CD1-CD1 4.11Å; I17-L35 HydrophobicContact CG1-CB 4.24Å; I17-L35 HydrophobicContact CG1-CD1 4.09Å; I17-L35 HydrophobicContact CG1-CG 4.38Å; I17-L35 HydrophobicContact CG2-CB 4.21Å; C18-L35 PolarHBondContact N-O 2.67Å; L35-V57 HydrophobicContact CD2-CG1 3.88Å; L35-G59 CarbonylContact C-O 3.07Å; L35-G59 WeakPolarHBondContact CA-O 3.47Å
36	L	97.3	Very high	94.9	Very high	2 Å²	2	48 Å²	48	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	91.4	178.8	-45.1	177.6	0	0	0	108.4	C18 L21 I24 I25 L34 I41 G59 L60 N63	C18-L36 HydrophobicContact CB-CD2 3.86Å; C18-L36 WeakPolarHBondContact O-CA 3.02Å; L21-L36 HydrophobicContact CD1-CD2 3.78Å; I24-L36 HydrophobicContact CB-CD1 4.29Å; I24-L36 HydrophobicContact CG1-CD1 4.28Å; I24-L36 HydrophobicContact CG2-CD1 4.09Å; I25-L36 HydrophobicContact CD1-CD2 4.45Å; I25-L36 HydrophobicContact CG1-CD2 4.21Å; L34-L36 HydrophobicContact CD1-CD1 4.21Å; L34-L36 HydrophobicContact CD1-CD2 3.74Å; L34-L36 HydrophobicContact CD1-CG 4Å; L34-L36 HydrophobicContact CD2-CD1 4.31Å; L34-L36 HydrophobicContact CG-CD1 4.24Å; L34-L36 HydrophobicContact CG-CD2 4.34Å; L34-L36 HydrophobicContact CG-CG 4.06Å; L36-I41 HydrophobicContact CB-CD1 4Å; L36-I41 HydrophobicContact CD1-CD1 4.1Å; L36-G59 PolarHBondContact N-O 2.89Å; L36-L60 HydrophobicContact CB-CD2 4.03Å; L36-L60 HydrophobicContact CD1-CD2 4.21Å; L36-L60 HydrophobicContact CG-CD2 4.38Å; L36-N63 PolarHBondContact O-ND2 2.78Å
37	T	96.2	Very high	95.1	Very high	33 Å²	33	44 Å²	44	20%	0.202	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	167.8	-171.6	66.4	0	0	0	0	112.9	C18 Q19 R20 G39 S61	C18-T37 PolarHBondContact O-N 3.03Å; Q19-T37 CarbonylContact C-O 3.1Å; Q19-T37 WeakPolarHBondContact CA-O 3.19Å; R20-T37 PolarHBondContact N-O 3.24Å; R20-T37 VanDerWaalsContact N-O 3.11Å; T37-G39 PolarHBondContact O-N 2.91Å; T37-G39 VanDerWaalsContact O-N 3.09Å; T37-S61 WeakPolarHBondContact CA-O 3.49Å
38	E	93.8	Very high	95.1	Very high	97 Å²	97	44.9 Å²	44.9	45%	0.453	27%	0.267	S	S	.	.	S	Bend	trans	52.8	36.7	173.9	-59.6	177.5	-125.4	0	0	113.3	Q19 R20 S61 S62	Q19-E38 PolarHBondContact NE2-OE1 2.73Å; R20-E38 WeakPolarHBondContact CA-O 3.25Å; R20-E38 WeakPolarHBondContact CG-O 3.01Å; R20-E38 PolarHBondContact N-O 3.07Å; E38-S61 PolarHBondContact N-O 2.9Å; E38-S62 CarbonylContact C-O 3.18Å; E38-S62 WeakPolarHBondContact CA-O 3.3Å; E38-S62 PolarHBondContact N-O 2.82Å
39	G	94.6	Very high	95.3	Very high	8 Å²	8	42.8 Å²	42.8	8%	0.082	25%	0.25	C	S	.	.	S	Bend	trans	-109.8	-164.1	-172.9	0	0	0	0	0	113.5	L21 T37 S62 N63	L21-G39 CarbonylContact O-C 3.2Å; L21-G39 VanDerWaalsContact O-CA 3.26Å; L21-G39 WeakPolarHBondContact O-CA 3.45Å; T37-G39 PolarHBondContact O-N 2.91Å; T37-G39 VanDerWaalsContact O-N 3.09Å; G39-S62 PolarHBondContact N-O 2.88Å; G39-S62 VanDerWaalsContact N-O 3.1Å; G39-N63 WeakPolarHBondContact CA-OD1 3.5Å; G39-N63 PolarHBondContact N-OD1 2.83Å
40	S	97.2	Very high	95.3	Very high	66 Å²	66	39.7 Å²	39.7	46%	0.462	24%	0.237	S	C	.	.			trans	-127.4	25.1	176.2	-56.6	0	0	0	0	111.9	L21 S42 N63	L21-S40 PolarHBondContact O-N 2.64Å; S40-S42 PolarHBondContact O-N 2.78Å; S40-N63 PolarHBondContact N-OD1 2.76Å
41	I	97.8	Very high	95.2	Very high	3 Å²	3	42 Å²	42	2%	0.015	25%	0.25	C	C	.	.			trans	-63	125.6	175.2	-57.5	172.2	0	0	0	107.9	I24 L36 L60 N63 H64 I65	I24-I41 HydrophobicContact CG1-CD1 4.13Å; I24-I41 HydrophobicContact CG1-CG2 4.16Å; L36-I41 HydrophobicContact CB-CD1 4Å; L36-I41 HydrophobicContact CD1-CD1 4.1Å; I41-L60 HydrophobicContact CD1-CD2 4.22Å; I41-N63 HydrophobicContact CB-CB 4.26Å; I41-N63 PolarHBondContact N-OD1 2.01Å; I41-H64 CarbonylContact O-C 3.53Å; I41-H64 WeakPolarHBondContact O-CA 3.07Å; I41-H64 PolarHBondContact O-N 3.18Å; I41-I65 HydrophobicContact CB-CG1 4.38Å; I41-I65 HydrophobicContact CG2-CD1 4.45Å; I41-I65 HydrophobicContact CG2-CG1 4.14Å; I41-I65 VanDerWaalsContact O-CG1 3.3Å; I41-I65 WeakPolarHBondContact O-CG1 3.43Å; I41-I65 PolarHBondContact O-N 3.01Å
42	S	97.6	Very high	95.1	Very high	58 Å²	58	42.1 Å²	42.1	41%	0.406	25%	0.25	S	S	.	.			trans	-110.2	-22.7	-176.8	56.7	0	0	0	0	114.5	S40 H64 I65 S66 E67	S40-S42 PolarHBondContact O-N 2.78Å; S42-H64 WeakPolarHBondContact CA-O 3.36Å; S42-I65 WeakPolarHBondContact O-CA 3.37Å; S42-S66 PolarHBondContact O-N 3.49Å; S42-E67 PolarHBondContact O-N 2.85Å
43	V	96.9	Very high	94.9	Very high	43 Å²	43	46.1 Å²	46.1	26%	0.261	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133.7	-176.8	-172.8	0	0	0	0	109.6	Q45 E67	V43-Q45 HydrophobicContact CG1-CG 3.9Å; V43-E67 WeakPolarHBondContact CA-O 3.36Å; V43-E67 HydrophobicContact CG1-CB 4.24Å; V43-E67 HydrophobicContact CG1-CG 4.3Å; V43-E67 HydrophobicContact CG2-CB 4.21Å
44	V	97	Very high	94.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.9	168.1	-175.4	0	0	0	0	108.6	I24 L49 L60 I65 E67 L68 S69 A72 F73	I24-V44 HydrophobicContact CD1-CB 4.42Å; I24-V44 HydrophobicContact CD1-CG1 3.98Å; I24-V44 HydrophobicContact CD1-CG2 4.35Å; V44-L49 HydrophobicContact CG1-CD1 3.59Å; V44-L49 HydrophobicContact CG1-CG 4.5Å; V44-L60 HydrophobicContact CG2-CD1 3.78Å; V44-I65 HydrophobicContact CG2-CD1 3.79Å; V44-I65 HydrophobicContact CG2-CG1 4.31Å; V44-I65 HydrophobicContact CG2-CG2 3.94Å; V44-E67 PolarHBondContact N-O 3.3Å; V44-L68 HydrophobicContact CB-CD2 3.68Å; V44-L68 HydrophobicContact CG2-CD2 3.69Å; V44-S69 PolarHBondContact O-N 3.48Å; V44-S69 PolarHBondContact O-OG 3.03Å; V44-A72 HydrophobicContact CG1-CB 4.23Å; V44-F73 HydrophobicContact CG1-CE1 4.05Å; V44-F73 HydrophobicContact CG1-CZ 3.98Å
45	Q	94.3	Very high	94.8	Very high	105 Å²	105	48.5 Å²	48.5	49%	0.491	27%	0.271	S	S	.	.			trans	-101.5	140	178.3	-62.4	-178.4	-4.2	0	0	110.5	V43 A47 S48	V43-Q45 HydrophobicContact CG1-CG 3.9Å; Q45-A47 PolarHBondContact O-N 2.96Å; Q45-S48 WeakPolarHBondContact O-CB 3.17Å; Q45-S48 PolarHBondContact O-N 3.11Å; Q45-S48 VanDerWaalsContact O-N 3.08Å
46	Q	92.6	Very high	94.8	Very high	66 Å²	66	48 Å²	48	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-52.5	-41.6	174.2	-179.1	-177.2	66.2	0	0	112.1	S48 L49 S50 S69 D71	Q46-S48 PolarHBondContact O-N 3.11Å; Q46-L49 PolarHBondContact O-N 2.92Å; Q46-L49 VanDerWaalsContact O-N 3.11Å; Q46-S50 VanDerWaalsContact O-CB 3.27Å; Q46-S50 WeakPolarHBondContact O-CB 3.35Å; Q46-S50 PolarHBondContact O-N 3.47Å; Q46-S69 PolarHBondContact N-OG 3.49Å; Q46-D71 VanDerWaalsContact NE2-CB 3.29Å; Q46-D71 PolarHBondContact NE2-O 3.3Å
47	A	91.7	Very high	94.9	Very high	73 Å²	73	49.8 Å²	49.8	60%	0.603	28%	0.281	S	S	*	.	H	α-helix	trans	-56.8	-36.6	-179	0	0	0	0	0	112.5	Q45 L49 S50	Q45-A47 PolarHBondContact O-N 2.96Å; A47-L49 VanDerWaalsContact C-N 3.31Å; A47-L49 PolarHBondContact O-N 2.05Å; A47-S50 PolarHBondContact O-OG 3.15Å
48	S	91.3	Very high	95	Very high	39 Å²	39	48.2 Å²	48.2	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-70.9	-21.7	-178.9	-52.8	0	0	0	0	114	Q45 Q46	Q45-S48 WeakPolarHBondContact O-CB 3.17Å; Q45-S48 PolarHBondContact O-N 3.11Å; Q45-S48 VanDerWaalsContact O-N 3.08Å; Q46-S48 PolarHBondContact O-N 3.11Å
49	L	93.6	Very high	95.2	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-115.5	-18.3	-175.5	-61	176.4	0	0	0	113.5	I24 L34 V44 Q46 A47 V51 L52 I58 F73	I24-L49 HydrophobicContact CD1-CD2 4.48Å; I24-L49 HydrophobicContact CG2-CD2 4.21Å; L34-L49 HydrophobicContact CD2-CD2 3.95Å; V44-L49 HydrophobicContact CG1-CD1 3.59Å; V44-L49 HydrophobicContact CG1-CG 4.5Å; Q46-L49 PolarHBondContact O-N 2.92Å; Q46-L49 VanDerWaalsContact O-N 3.11Å; A47-L49 VanDerWaalsContact C-N 3.31Å; A47-L49 PolarHBondContact O-N 2.05Å; L49-V51 PolarHBondContact O-N 2.89Å; L49-L52 HydrophobicContact CD2-CD1 3.9Å; L49-L52 WeakPolarHBondContact O-CB 3.33Å; L49-L52 PolarHBondContact O-N 2.73Å; L49-I58 HydrophobicContact CD1-CD1 4.22Å; L49-I58 HydrophobicContact CD2-CD1 4.4Å; L49-F73 HydrophobicContact CD1-CD1 3.7Å; L49-F73 HydrophobicContact CD1-CE1 3.58Å
50	S	90.2	Very high	95.4	Very high	46 Å²	46	43.2 Å²	43.2	32%	0.322	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.9	-172.5	63.7	0	0	0	0	115.7	Q46 A47	Q46-S50 VanDerWaalsContact O-CB 3.27Å; Q46-S50 WeakPolarHBondContact O-CB 3.35Å; Q46-S50 PolarHBondContact O-N 3.47Å; A47-S50 PolarHBondContact O-OG 3.15Å
51	V	90.9	Very high	95.5	Very high	78 Å²	78	40.8 Å²	40.8	47%	0.473	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-18.7	178.5	-63.7	0	0	0	0	113	D29 L49 R53	D29-V51 WeakPolarHBondContact CB-O 3.2Å; L49-V51 PolarHBondContact O-N 2.89Å; V51-R53 VanDerWaalsContact C-N 3.3Å; V51-R53 PolarHBondContact O-N 3.35Å
52	L	93.8	Very high	95.5	Very high	3 Å²	3	43 Å²	43	2%	0.016	25%	0.245	C	C	.	.			trans	-86.6	61.7	-170.5	-52.1	178.3	0	0	0	111.9	A27 A28 L34 L49 N54 I55 L76	A27-L52 HydrophobicContact CB-CD2 3.82Å; A28-L52 WeakPolarHBondContact O-CD2 3.39Å; L34-L52 HydrophobicContact CD2-CD1 3.75Å; L49-L52 HydrophobicContact CD2-CD1 3.9Å; L49-L52 WeakPolarHBondContact O-CB 3.33Å; L49-L52 PolarHBondContact O-N 2.73Å; L52-N54 PolarHBondContact O-N 2.99Å; L52-I55 HydrophobicContact CB-CB 3.99Å; L52-I55 HydrophobicContact CB-CG2 4.34Å; L52-I55 HydrophobicContact CD1-CD1 4.43Å; L52-I55 VanDerWaalsContact O-CB 3.32Å; L52-I55 WeakPolarHBondContact O-CB 3.17Å; L52-I55 WeakPolarHBondContact O-CG2 3.2Å; L52-I55 PolarHBondContact O-N 3.39Å; L52-I55 VanDerWaalsContact O-N 3.15Å; L52-L76 WeakPolarHBondContact O-CD2 3.31Å
53	R	93.4	Very high	95.5	Very high	175 Å²	175	40.5 Å²	40.5	66%	0.66	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24	-170.9	-64.6	-177.9	-179	177.6	1.7	114.4	V51 F78	V51-R53 VanDerWaalsContact C-N 3.3Å; V51-R53 PolarHBondContact O-N 3.35Å; R53-F78 WeakPolarHBondContact O-CD2 3.3Å
54	N	95.9	Very high	95.6	Very high	74 Å²	74	43 Å²	43	40%	0.396	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	6.4	179.4	-66.9	-6.3	0	0	0	113.3	T31 L52 T56	T31-N54 CarbonylContact O-C 3.47Å; L52-N54 PolarHBondContact O-N 2.99Å; N54-T56 PolarHBondContact O-N 3.11Å
55	I	97.5	Very high	95.7	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.235	C	C	.	.			trans	-64.3	131.9	-177.1	-156.9	75.3	0	0	0	110.7	T31 Q32 L34 L52 I58 L76 F78 L79	T31-I55 HydrophobicContact CG2-CD1 4.05Å; T31-I55 WeakPolarHBondContact O-CA 3.3Å; T31-I55 WeakPolarHBondContact O-CD1 3.05Å; T31-I55 PolarHBondContact O-N 3.21Å; Q32-I55 WeakPolarHBondContact O-CD1 3.46Å; L34-I55 HydrophobicContact CB-CD1 3.78Å; L52-I55 HydrophobicContact CB-CB 3.99Å; L52-I55 HydrophobicContact CB-CG2 4.34Å; L52-I55 HydrophobicContact CD1-CD1 4.43Å; L52-I55 VanDerWaalsContact O-CB 3.32Å; L52-I55 WeakPolarHBondContact O-CB 3.17Å; L52-I55 WeakPolarHBondContact O-CG2 3.2Å; L52-I55 PolarHBondContact O-N 3.39Å; L52-I55 VanDerWaalsContact O-N 3.15Å; I55-I58 HydrophobicContact CD1-CG1 4.48Å; I55-I58 HydrophobicContact CG1-CD1 4.15Å; I55-I58 HydrophobicContact CG1-CG1 3.62Å; I55-I58 HydrophobicContact CG2-CD1 4.13Å; I55-I58 HydrophobicContact CG2-CG1 4.42Å; I55-L76 HydrophobicContact CG2-CB 4Å; I55-L76 HydrophobicContact CG2-CD1 3.98Å; I55-L76 HydrophobicContact CG2-CD2 3.77Å; I55-L76 HydrophobicContact CG2-CG 4.12Å; I55-F78 CarbonylContact O-C 3.59Å; I55-L79 HydrophobicContact CG2-CD1 4.31Å; I55-L79 WeakPolarHBondContact O-CA 2.95Å; I55-L79 PolarHBondContact O-N 3.37Å
56	T	98.3	Very high	95.8	Very high	39 Å²	39	40.6 Å²	40.6	24%	0.239	23%	0.23	C	C	.	.			trans	-113.1	-30.7	177.1	62.4	0	0	0	0	112.2	Q32 N54 F78 H80 T81	Q32-T56 PolarHBondContact O-N 2.74Å; Q32-T56 PolarHBondContact O-OG1 3.13Å; N54-T56 PolarHBondContact O-N 3.11Å; T56-F78 VanDerWaalsContact CA-O 3.26Å; T56-F78 WeakPolarHBondContact CA-O 3.49Å; T56-F78 HydrophobicContact CG2-CB 4.26Å; T56-H80 PolarHBondContact O-N 3.41Å; T56-T81 PolarHBondContact O-N 2.93Å
57	V	98.6	Very high	96	Very high	38 Å²	38	42.6 Å²	42.6	23%	0.23	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	123.9	-179.7	-175.1	0	0	0	0	110.2	Q32 A33 L34 L35 T81	Q32-V57 PolarHBondContact O-N 3.34Å; A33-V57 WeakPolarHBondContact CA-O 3.19Å; A33-V57 HydrophobicContact CB-CB 4.38Å; L34-V57 PolarHBondContact N-O 2.81Å; L35-V57 HydrophobicContact CD2-CG1 3.88Å; V57-T81 WeakPolarHBondContact CA-O 3.44Å; V57-T81 HydrophobicContact CG1-CG2 4.18Å
58	I	98.4	Very high	96.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	116.5	167.4	-65.6	175.8	0	0	0	108.1	L34 L49 I55 L60 F73 L76 L79 T81 L82 L83	L34-I58 CarbonylContact O-C 3.53Å; L34-I58 WeakPolarHBondContact O-CA 3.31Å; L49-I58 HydrophobicContact CD1-CD1 4.22Å; L49-I58 HydrophobicContact CD2-CD1 4.4Å; I55-I58 HydrophobicContact CD1-CG1 4.48Å; I55-I58 HydrophobicContact CG1-CD1 4.15Å; I55-I58 HydrophobicContact CG1-CG1 3.62Å; I55-I58 HydrophobicContact CG2-CD1 4.13Å; I55-I58 HydrophobicContact CG2-CG1 4.42Å; I58-L60 HydrophobicContact CG2-CD1 3.86Å; I58-L60 HydrophobicContact CG2-CG 3.84Å; I58-F73 HydrophobicContact CD1-CD1 4.22Å; I58-F73 HydrophobicContact CD1-CE1 4.45Å; I58-F73 HydrophobicContact CG2-CE1 4.49Å; I58-L76 HydrophobicContact CD1-CD1 3.67Å; I58-L79 HydrophobicContact CB-CD1 4.16Å; I58-L79 HydrophobicContact CD1-CD1 3.95Å; I58-L79 HydrophobicContact CD1-CD2 4.45Å; I58-L79 HydrophobicContact CG1-CD1 3.8Å; I58-T81 PolarHBondContact N-O 3.29Å; I58-L82 HydrophobicContact CB-CD1 3.92Å; I58-L82 HydrophobicContact CG2-CD1 3.86Å; I58-L82 WeakPolarHBondContact O-CA 3.03Å; I58-L83 PolarHBondContact O-N 3.1Å
59	G	98.4	Very high	96.4	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	116	173.7	0	0	0	0	0	110.7	L34 L35 L36	L34-G59 PolarHBondContact O-N 3.29Å; L35-G59 CarbonylContact C-O 3.07Å; L35-G59 WeakPolarHBondContact CA-O 3.47Å; L36-G59 PolarHBondContact N-O 2.89Å
60	L	98.4	Very high	96.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.241	C	C	.	.			trans	-126.6	21.7	178.2	-66.6	172.8	0	0	0	111.1	L36 I41 V44 I58 N63 I65 L83 L84 N87	L36-L60 HydrophobicContact CB-CD2 4.03Å; L36-L60 HydrophobicContact CD1-CD2 4.21Å; L36-L60 HydrophobicContact CG-CD2 4.38Å; I41-L60 HydrophobicContact CD1-CD2 4.22Å; V44-L60 HydrophobicContact CG2-CD1 3.78Å; I58-L60 HydrophobicContact CG2-CD1 3.86Å; I58-L60 HydrophobicContact CG2-CG 3.84Å; L60-N63 PolarHBondContact O-ND2 3.24Å; L60-I65 HydrophobicContact CB-CD1 3.7Å; L60-I65 HydrophobicContact CD1-CD1 4.06Å; L60-I65 HydrophobicContact CG-CD1 4.37Å; L60-L83 WeakPolarHBondContact CA-O 3.36Å; L60-L83 PolarHBondContact N-O 3.47Å; L60-L84 HydrophobicContact CB-CD2 3.99Å; L60-L84 HydrophobicContact CD1-CD2 4.06Å; L60-N87 PolarHBondContact O-ND2 3.38Å
61	S	98.3	Very high	96.2	Very high	14 Å²	14	45.5 Å²	45.5	10%	0.098	24%	0.236	C	C	.	.			trans	-61.5	148.2	-178.3	-48	0	0	0	0	112.2	T37 E38 N63 L83 D85	T37-S61 WeakPolarHBondContact CA-O 3.49Å; E38-S61 PolarHBondContact N-O 2.9Å; S61-N63 PolarHBondContact O-ND2 3.3Å; S61-L83 VanDerWaalsContact OG-CB 3.3Å; S61-L83 WeakPolarHBondContact OG-CB 3.47Å; S61-D85 CarbonylContact C-O 3.57Å; S61-D85 WeakPolarHBondContact CA-O 3.03Å; S61-D85 WeakPolarHBondContact CB-OD1 3.11Å; S61-D85 WeakPolarHBondContact CB-OD2 3.36Å; S61-D85 PolarHBondContact OG-OD1 3.37Å
62	S	98.4	Very high	96.4	Very high	50 Å²	50	41.8 Å²	41.8	35%	0.35	21%	0.213	S	C	.	.	S	Bend	trans	58.1	54.5	178	-57.7	0	0	0	0	113.1	E38 G39 D85 H86	E38-S62 CarbonylContact C-O 3.18Å; E38-S62 WeakPolarHBondContact CA-O 3.3Å; E38-S62 PolarHBondContact N-O 2.82Å; G39-S62 PolarHBondContact N-O 2.88Å; G39-S62 VanDerWaalsContact N-O 3.1Å; S62-D85 PolarHBondContact N-O 2.98Å; S62-H86 WeakPolarHBondContact CA-O 3.48Å; S62-H86 PolarHBondContact N-O 3.33Å
63	N	98.4	Very high	96.5	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.032	21%	0.213	C	C	.	.	S	Bend	trans	-122.6	-161.8	171.8	-81	-80.9	0	0	0	109.8	L36 G39 S40 I41 L60 S61 I65 H86 N87	L36-N63 PolarHBondContact O-ND2 2.78Å; G39-N63 WeakPolarHBondContact CA-OD1 3.5Å; G39-N63 PolarHBondContact N-OD1 2.83Å; S40-N63 PolarHBondContact N-OD1 2.76Å; I41-N63 HydrophobicContact CB-CB 4.26Å; I41-N63 PolarHBondContact N-OD1 2.01Å; L60-N63 PolarHBondContact O-ND2 3.24Å; S61-N63 PolarHBondContact O-ND2 3.3Å; N63-I65 HydrophobicContact CB-CD1 4.2Å; N63-I65 HydrophobicContact CB-CG1 3.98Å; N63-H86 PolarHBondContact N-O 3.33Å; N63-N87 WeakPolarHBondContact CA-OD1 3.3Å; N63-N87 WeakPolarHBondContact CB-OD1 3.45Å; N63-N87 PolarHBondContact N-OD1 3.47Å; N63-N87 PolarHBondContact O-OD1 2.86Å
64	H	98.3	Very high	96.3	Very high	94 Å²	94	39.7 Å²	39.7	44%	0.435	21%	0.205	S	C	.	.			trans	-115.2	30.1	176	-63	-42.7	0	0	0	111.7	I41 S42 S66 N87 L88	I41-H64 CarbonylContact O-C 3.53Å; I41-H64 WeakPolarHBondContact O-CA 3.07Å; I41-H64 PolarHBondContact O-N 3.18Å; S42-H64 WeakPolarHBondContact CA-O 3.36Å; H64-S66 PolarHBondContact O-N 3.07Å; H64-N87 PolarHBondContact N-OD1 2.93Å; H64-L88 HydrophobicContact CB-CD1 4.09Å
65	I	98.5	Very high	95.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.			trans	-67.9	112.6	-171.7	-59.2	168.5	0	0	0	108.8	I41 S42 V44 L60 N63 L68 L84 N87 L88 L89	I41-I65 HydrophobicContact CB-CG1 4.38Å; I41-I65 HydrophobicContact CG2-CD1 4.45Å; I41-I65 HydrophobicContact CG2-CG1 4.14Å; I41-I65 VanDerWaalsContact O-CG1 3.3Å; I41-I65 WeakPolarHBondContact O-CG1 3.43Å; I41-I65 PolarHBondContact O-N 3.01Å; S42-I65 WeakPolarHBondContact O-CA 3.37Å; V44-I65 HydrophobicContact CG2-CD1 3.79Å; V44-I65 HydrophobicContact CG2-CG1 4.31Å; V44-I65 HydrophobicContact CG2-CG2 3.94Å; L60-I65 HydrophobicContact CB-CD1 3.7Å; L60-I65 HydrophobicContact CD1-CD1 4.06Å; L60-I65 HydrophobicContact CG-CD1 4.37Å; N63-I65 HydrophobicContact CB-CD1 4.2Å; N63-I65 HydrophobicContact CB-CG1 3.98Å; I65-L68 HydrophobicContact CG2-CD2 3.82Å; I65-L84 HydrophobicContact CD1-CD2 4.07Å; I65-N87 HydrophobicContact CB-CB 4.23Å; I65-N87 VanDerWaalsContact CB-OD1 3.32Å; I65-N87 WeakPolarHBondContact CB-OD1 3.15Å; I65-N87 WeakPolarHBondContact CG1-OD1 3.26Å; I65-N87 PolarHBondContact N-OD1 3.1Å; I65-L88 CarbonylContact O-C 3.16Å; I65-L88 VanDerWaalsContact O-CA 3.31Å; I65-L88 WeakPolarHBondContact O-CA 3.18Å; I65-L88 PolarHBondContact O-N 3.29Å; I65-L89 HydrophobicContact CG2-CD2 3.88Å; I65-L89 HydrophobicContact CG2-CG 4.47Å; I65-L89 PolarHBondContact O-N 3.37Å; I65-L89 VanDerWaalsContact O-N 3.14Å
66	S	97.7	Very high	95.7	Very high	56 Å²	56	41.8 Å²	41.8	39%	0.392	22%	0.216	S	C	.	.			trans	-111.1	-17	175.7	57.5	0	0	0	0	112.5	S42 H64 A93	S42-S66 PolarHBondContact O-N 3.49Å; H64-S66 PolarHBondContact O-N 3.07Å; S66-A93 WeakPolarHBondContact O-CB 3.3Å
67	E	96.9	Very high	95.5	Very high	108 Å²	108	43 Å²	43	51%	0.505	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.7	-175.3	-172.1	178.9	165	0	0	111.2	S42 V43 V44	S42-E67 PolarHBondContact O-N 2.85Å; V43-E67 WeakPolarHBondContact CA-O 3.36Å; V43-E67 HydrophobicContact CG1-CB 4.24Å; V43-E67 HydrophobicContact CG1-CG 4.3Å; V43-E67 HydrophobicContact CG2-CB 4.21Å; V44-E67 PolarHBondContact N-O 3.3Å
68	L	97.1	Very high	95.4	Very high	10 Å²	10	46.1 Å²	46.1	5%	0.052	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129	167.8	-55.2	176.4	0	0	0	106.6	V44 I65 A72 F73 L89 L94 A98	V44-L68 HydrophobicContact CB-CD2 3.68Å; V44-L68 HydrophobicContact CG2-CD2 3.69Å; I65-L68 HydrophobicContact CG2-CD2 3.82Å; L68-A72 HydrophobicContact CB-CB 4.39Å; L68-F73 HydrophobicContact CD1-CE2 4.26Å; L68-F73 HydrophobicContact CD2-CE2 4.29Å; L68-F73 HydrophobicContact CD2-CZ 4.4Å; L68-L89 HydrophobicContact CD1-CD1 4.49Å; L68-L89 HydrophobicContact CD1-CD2 4.04Å; L68-L89 HydrophobicContact CD2-CD2 4.1Å; L68-L89 HydrophobicContact CG-CD2 3.75Å; L68-L94 HydrophobicContact CD1-CD2 3.8Å; L68-A98 HydrophobicContact CB-CB 3.83Å; L68-A98 HydrophobicContact CD1-CB 3.93Å
69	S	94.4	Very high	95.4	Very high	27 Å²	27	46.3 Å²	46.3	19%	0.189	24%	0.237	C	C	.	.			trans	-62.2	158.6	173.2	73.3	0	0	0	0	110.6	V44 Q46 D71 A72	V44-S69 PolarHBondContact O-N 3.48Å; V44-S69 PolarHBondContact O-OG 3.03Å; Q46-S69 PolarHBondContact N-OG 3.49Å; S69-D71 PolarHBondContact O-N 3.09Å; S69-A72 WeakPolarHBondContact O-CB 3.33Å; S69-A72 PolarHBondContact O-N 3.27Å; S69-A72 VanDerWaalsContact O-N 3.11Å
70	E	90.1	Very high	95.4	Very high	144 Å²	144	48.8 Å²	48.8	67%	0.673	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.8	134.5	167.2	-170.3	174.9	-178	0	0	109.3	A72 G96	E70-A72 PolarHBondContact O-N 3.41Å; E70-A72 VanDerWaalsContact O-N 3.08Å; E70-G96 VanDerWaalsContact CA-O 3.32Å; E70-G96 WeakPolarHBondContact CA-O 3.42Å; E70-G96 WeakPolarHBondContact CG-O 3.37Å
71	D	89.2	Confident	95.4	Very high	38 Å²	38	50.3 Å²	50.3	20%	0.203	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	30.5	179.5	-71.5	-22.2	0	0	0	114.6	Q46 S69 F73 R74	Q46-D71 VanDerWaalsContact NE2-CB 3.29Å; Q46-D71 PolarHBondContact NE2-O 3.3Å; S69-D71 PolarHBondContact O-N 3.09Å; D71-F73 PolarHBondContact O-N 3.46Å; D71-R74 HydrophobicContact CB-CB 3.7Å; D71-R74 HydrophobicContact CB-CG 4.36Å; D71-R74 WeakPolarHBondContact O-CB 3.26Å; D71-R74 PolarHBondContact O-N 3.26Å; D71-R74 VanDerWaalsContact OD2-CD 3.24Å; D71-R74 WeakPolarHBondContact OD2-CD 3.45Å; D71-R74 IonicContact OD2-CZ 3.69Å; D71-R74 IonicContact OD2-NE 3.88Å; D71-R74 IonicContact OD2-NH1 2.75Å; D71-R74 PolarHBondContact OD2-NH1 2.88Å
72	A	94.2	Very high	95.4	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-35.3	-175	0	0	0	0	0	114.4	V44 L68 S69 E70 A98	V44-A72 HydrophobicContact CG1-CB 4.23Å; L68-A72 HydrophobicContact CB-CB 4.39Å; S69-A72 WeakPolarHBondContact O-CB 3.33Å; S69-A72 PolarHBondContact O-N 3.27Å; S69-A72 VanDerWaalsContact O-N 3.11Å; E70-A72 PolarHBondContact O-N 3.41Å; E70-A72 VanDerWaalsContact O-N 3.08Å; A72-A98 HydrophobicContact CB-CB 4.16Å
73	F	95.4	Very high	95.5	Very high	1 Å²	1	49.5 Å²	49.5	0%	0.004	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	16.3	-178.9	-56.3	-71.4	0	0	0	113.3	V44 L49 I58 L68 D71 L76 L79 L82 L84 A98 L99 L102	V44-F73 HydrophobicContact CG1-CE1 4.05Å; V44-F73 HydrophobicContact CG1-CZ 3.98Å; L49-F73 HydrophobicContact CD1-CD1 3.7Å; L49-F73 HydrophobicContact CD1-CE1 3.58Å; I58-F73 HydrophobicContact CD1-CD1 4.22Å; I58-F73 HydrophobicContact CD1-CE1 4.45Å; I58-F73 HydrophobicContact CG2-CE1 4.49Å; L68-F73 HydrophobicContact CD1-CE2 4.26Å; L68-F73 HydrophobicContact CD2-CE2 4.29Å; L68-F73 HydrophobicContact CD2-CZ 4.4Å; D71-F73 PolarHBondContact O-N 3.46Å; F73-L76 HydrophobicContact CB-CD1 4.14Å; F73-L76 HydrophobicContact CD1-CD1 4.25Å; F73-L76 WeakPolarHBondContact O-CG 3.29Å; F73-L79 HydrophobicContact CB-CD2 4.49Å; F73-L82 HydrophobicContact CD1-CD1 4.28Å; F73-L82 HydrophobicContact CD1-CD2 4.41Å; F73-L82 HydrophobicContact CD2-CD2 3.95Å; F73-L82 HydrophobicContact CE1-CD1 3.73Å; F73-L82 HydrophobicContact CE1-CD2 4.31Å; F73-L82 HydrophobicContact CE2-CD2 3.85Å; F73-L82 HydrophobicContact CG-CD2 4.24Å; F73-L82 HydrophobicContact CZ-CD1 3.87Å; F73-L82 HydrophobicContact CZ-CD2 4.04Å; F73-L84 HydrophobicContact CE2-CD1 4.16Å; F73-L84 HydrophobicContact CZ-CD1 4.15Å; F73-L84 HydrophobicContact CZ-CD2 4.43Å; F73-A98 HydrophobicContact CD2-CB 4.44Å; F73-A98 WeakPolarHBondContact CD2-O 3.28Å; F73-L99 HydrophobicContact CD2-CD2 4.1Å; F73-L99 HydrophobicContact CE2-CD2 4.28Å; F73-L102 HydrophobicContact CB-CD1 4.31Å; F73-L102 HydrophobicContact CB-CD2 3.91Å; F73-L102 WeakPolarHBondContact O-CD2 3.44Å
74	R	90.1	Very high	95.5	Very high	133 Å²	133	49.2 Å²	49.2	50%	0.502	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	150.1	179.9	-178.4	173.5	177	-179.2	1	111.4	D71 L76	D71-R74 HydrophobicContact CB-CB 3.7Å; D71-R74 HydrophobicContact CB-CG 4.36Å; D71-R74 WeakPolarHBondContact O-CB 3.26Å; D71-R74 PolarHBondContact O-N 3.26Å; D71-R74 VanDerWaalsContact OD2-CD 3.24Å; D71-R74 WeakPolarHBondContact OD2-CD 3.45Å; D71-R74 IonicContact OD2-CZ 3.69Å; D71-R74 IonicContact OD2-NE 3.88Å; D71-R74 IonicContact OD2-NH1 2.75Å; D71-R74 PolarHBondContact OD2-NH1 2.88Å; R74-L76 VanDerWaalsContact C-N 3.29Å; R74-L76 PolarHBondContact O-N 3.27Å
75	N	86.3	Confident	95.5	Very high	107 Å²	107	46.1 Å²	46.1	57%	0.572	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	29.6	-179.1	-54.6	-37.1	0	0	0	114.2	P77	N75-P77 VanDerWaalsContact C-CD 3.41Å; N75-P77 WeakPolarHBondContact O-CD 3.04Å
76	L	94.6	Very high	95.5	Very high	10 Å²	10	50.2 Å²	50.2	5%	0.052	25%	0.252	C	S	.	.			trans	-106.8	75.3	170.1	-53.8	-178.8	0	0	0	109	L52 I55 I58 F73 R74 F78 L79	L52-L76 WeakPolarHBondContact O-CD2 3.31Å; I55-L76 HydrophobicContact CG2-CB 4Å; I55-L76 HydrophobicContact CG2-CD1 3.98Å; I55-L76 HydrophobicContact CG2-CD2 3.77Å; I55-L76 HydrophobicContact CG2-CG 4.12Å; I58-L76 HydrophobicContact CD1-CD1 3.67Å; F73-L76 HydrophobicContact CB-CD1 4.14Å; F73-L76 HydrophobicContact CD1-CD1 4.25Å; F73-L76 WeakPolarHBondContact O-CG 3.29Å; R74-L76 VanDerWaalsContact C-N 3.29Å; R74-L76 PolarHBondContact O-N 3.27Å; L76-F78 PolarHBondContact O-N 2.63Å; L76-L79 HydrophobicContact CB-CB 3.95Å; L76-L79 HydrophobicContact CB-CD2 4.48Å; L76-L79 HydrophobicContact CD1-CD2 4.15Å; L76-L79 PolarHBondContact O-N 2.96Å
77	P	93.9	Very high	95.6	Very high	65 Å²	65	47.8 Å²	47.8	42%	0.422	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-20.1	-167.1	28.7	-37.2	0	0	0	113.7	N75 Q104	N75-P77 VanDerWaalsContact C-CD 3.41Å; N75-P77 WeakPolarHBondContact O-CD 3.04Å; P77-Q104 WeakPolarHBondContact O-CG 3.41Å
78	F	96.6	Very high	95.6	Very high	104 Å²	104	46 Å²	46	46%	0.456	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	13.2	-178.6	-56.2	-67.1	0	0	0	112.8	R53 I55 T56 L76 H80	R53-F78 WeakPolarHBondContact O-CD2 3.3Å; I55-F78 CarbonylContact O-C 3.59Å; T56-F78 VanDerWaalsContact CA-O 3.26Å; T56-F78 WeakPolarHBondContact CA-O 3.49Å; T56-F78 HydrophobicContact CG2-CB 4.26Å; L76-F78 PolarHBondContact O-N 2.63Å; F78-H80 PolarHBondContact O-CE1 3.05Å; F78-H80 VanDerWaalsContact O-CE1 3.24Å; F78-H80 PolarHBondContact O-N 3.41Å; F78-H80 VanDerWaalsContact O-N 3.15Å; F78-H80 PolarHBondContact O-ND1 3.11Å
79	L	98	Very high	95.7	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.016	23%	0.225	C	C	.	.			trans	-70.7	111.1	179.4	-176.8	67.2	0	0	0	110	I55 I58 F73 L76 T81 L82 Q104 L105	I55-L79 HydrophobicContact CG2-CD1 4.31Å; I55-L79 WeakPolarHBondContact O-CA 2.95Å; I55-L79 PolarHBondContact O-N 3.37Å; I58-L79 HydrophobicContact CB-CD1 4.16Å; I58-L79 HydrophobicContact CD1-CD1 3.95Å; I58-L79 HydrophobicContact CD1-CD2 4.45Å; I58-L79 HydrophobicContact CG1-CD1 3.8Å; F73-L79 HydrophobicContact CB-CD2 4.49Å; L76-L79 HydrophobicContact CB-CB 3.95Å; L76-L79 HydrophobicContact CB-CD2 4.48Å; L76-L79 HydrophobicContact CD1-CD2 4.15Å; L76-L79 PolarHBondContact O-N 2.96Å; L79-T81 WeakPolarHBondContact CD1-O 3.32Å; L79-L82 HydrophobicContact CD2-CB 4.49Å; L79-Q104 CarbonylContact O-C 3.34Å; L79-Q104 VanDerWaalsContact O-C 3.26Å; L79-L105 HydrophobicContact CD2-CD1 4.31Å; L79-L105 HydrophobicContact CG-CD1 4.07Å; L79-L105 VanDerWaalsContact O-CA 3.28Å; L79-L105 WeakPolarHBondContact O-CA 3.22Å; L79-L105 PolarHBondContact O-N 3.3Å
80	H	98.6	Very high	95.9	Very high	53 Å²	53	46.5 Å²	46.5	25%	0.245	23%	0.23	C	C	.	.			trans	-100.9	-33.5	179.3	-65.1	81.1	0	0	0	112.1	T56 F78 Q104 E106 V107	T56-H80 PolarHBondContact O-N 3.41Å; F78-H80 PolarHBondContact O-CE1 3.05Å; F78-H80 VanDerWaalsContact O-CE1 3.24Å; F78-H80 PolarHBondContact O-N 3.41Å; F78-H80 VanDerWaalsContact O-N 3.15Å; F78-H80 PolarHBondContact O-ND1 3.11Å; H80-Q104 WeakPolarHBondContact CA-O 3.48Å; H80-E106 IonicContact CD2-OE1 3.96Å; H80-E106 PolarHBondContact O-N 3.3Å; H80-V107 PolarHBondContact O-N 2.94Å
81	T	98.9	Very high	96.2	Very high	32 Å²	32	39.6 Å²	39.6	20%	0.196	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	125.8	-176.6	-61.9	0	0	0	0	111.2	T56 V57 I58 L79 L83 V107	T56-T81 PolarHBondContact O-N 2.93Å; V57-T81 WeakPolarHBondContact CA-O 3.44Å; V57-T81 HydrophobicContact CG1-CG2 4.18Å; I58-T81 PolarHBondContact N-O 3.29Å; L79-T81 WeakPolarHBondContact CD1-O 3.32Å; T81-L83 HydrophobicContact CG2-CD1 4.48Å; T81-L83 HydrophobicContact CG2-CD2 3.65Å; T81-L83 HydrophobicContact CG2-CG 3.91Å; T81-V107 WeakPolarHBondContact CA-O 3.3Å; T81-V107 HydrophobicContact CG2-CB 4.2Å; T81-V107 HydrophobicContact CG2-CG1 4.37Å
82	L	98.8	Very high	96.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	115.6	174.3	179.4	58.4	0	0	0	109.8	I58 F73 L79 L84 L99 L105 V107 L108 A109	I58-L82 HydrophobicContact CB-CD1 3.92Å; I58-L82 HydrophobicContact CG2-CD1 3.86Å; I58-L82 WeakPolarHBondContact O-CA 3.03Å; F73-L82 HydrophobicContact CD1-CD1 4.28Å; F73-L82 HydrophobicContact CD1-CD2 4.41Å; F73-L82 HydrophobicContact CD2-CD2 3.95Å; F73-L82 HydrophobicContact CE1-CD1 3.73Å; F73-L82 HydrophobicContact CE1-CD2 4.31Å; F73-L82 HydrophobicContact CE2-CD2 3.85Å; F73-L82 HydrophobicContact CG-CD2 4.24Å; F73-L82 HydrophobicContact CZ-CD1 3.87Å; F73-L82 HydrophobicContact CZ-CD2 4.04Å; L79-L82 HydrophobicContact CD2-CB 4.49Å; L82-L84 HydrophobicContact CD1-CD1 4.18Å; L82-L84 HydrophobicContact CD1-CG 4.1Å; L82-L84 HydrophobicContact CD2-CD1 3.85Å; L82-L84 HydrophobicContact CG-CD1 3.91Å; L82-L84 HydrophobicContact CG-CG 4.13Å; L82-L99 HydrophobicContact CD2-CD2 3.72Å; L82-L105 HydrophobicContact CB-CD1 3.75Å; L82-V107 PolarHBondContact N-O 3.44Å; L82-L108 HydrophobicContact CB-CD1 4.1Å; L82-L108 HydrophobicContact CD2-CD1 3.97Å; L82-L108 HydrophobicContact CG-CD1 4.05Å; L82-A109 PolarHBondContact O-N 3.41Å
83	L	98.9	Very high	96.6	Very high	48 Å²	48	43.6 Å²	43.6	25%	0.251	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.9	179	-43.8	173.8	0	0	0	109.6	I58 L60 S61 T81 A109	I58-L83 PolarHBondContact O-N 3.1Å; L60-L83 WeakPolarHBondContact CA-O 3.36Å; L60-L83 PolarHBondContact N-O 3.47Å; S61-L83 VanDerWaalsContact OG-CB 3.3Å; S61-L83 WeakPolarHBondContact OG-CB 3.47Å; T81-L83 HydrophobicContact CG2-CD1 4.48Å; T81-L83 HydrophobicContact CG2-CD2 3.65Å; T81-L83 HydrophobicContact CG2-CG 3.91Å; L83-A109 HydrophobicContact CD2-CB 3.87Å
84	L	98.6	Very high	96.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.218	C	C	.	.			trans	-127.8	16.3	179.9	-73.8	166.8	0	0	0	111	L60 I65 F73 L82 N87 L89 A109 L110 N113	L60-L84 HydrophobicContact CB-CD2 3.99Å; L60-L84 HydrophobicContact CD1-CD2 4.06Å; I65-L84 HydrophobicContact CD1-CD2 4.07Å; F73-L84 HydrophobicContact CE2-CD1 4.16Å; F73-L84 HydrophobicContact CZ-CD1 4.15Å; F73-L84 HydrophobicContact CZ-CD2 4.43Å; L82-L84 HydrophobicContact CD1-CD1 4.18Å; L82-L84 HydrophobicContact CD1-CG 4.1Å; L82-L84 HydrophobicContact CD2-CD1 3.85Å; L82-L84 HydrophobicContact CG-CD1 3.91Å; L82-L84 HydrophobicContact CG-CG 4.13Å; L84-N87 PolarHBondContact O-ND2 2.85Å; L84-L89 HydrophobicContact CB-CD1 4.04Å; L84-L89 HydrophobicContact CD1-CD1 4.22Å; L84-A109 CarbonylContact C-O 3.59Å; L84-A109 WeakPolarHBondContact CA-O 3.22Å; L84-A109 WeakPolarHBondContact CB-O 3.21Å; L84-A109 PolarHBondContact N-O 2.95Å; L84-L110 HydrophobicContact CB-CD2 3.92Å; L84-L110 HydrophobicContact CD1-CD2 4.1Å; L84-N113 PolarHBondContact O-ND2 3.41Å
85	D	98.8	Very high	96.7	Very high	28 Å²	28	42.7 Å²	42.7	15%	0.15	22%	0.22	C	C	.	.			trans	-66.8	156.6	179.7	61.2	-78	0	0	0	112.4	S61 S62 N87 A109 G111	S61-D85 CarbonylContact C-O 3.57Å; S61-D85 WeakPolarHBondContact CA-O 3.03Å; S61-D85 WeakPolarHBondContact CB-OD1 3.11Å; S61-D85 WeakPolarHBondContact CB-OD2 3.36Å; S61-D85 PolarHBondContact OG-OD1 3.37Å; S62-D85 PolarHBondContact N-O 2.98Å; D85-N87 PolarHBondContact O-ND2 3.35Å; D85-N87 VanDerWaalsContact O-ND2 3.15Å; D85-A109 HydrophobicContact CB-CB 4.34Å; D85-A109 PolarHBondContact N-O 3.38Å; D85-G111 CarbonylContact C-O 3.53Å; D85-G111 WeakPolarHBondContact CA-O 3.33Å; D85-G111 WeakPolarHBondContact CB-O 3.47Å
86	H	98.8	Very high	96.6	Very high	86 Å²	86	39.2 Å²	39.2	40%	0.398	21%	0.209	S	C	.	.	S	Bend	trans	55.9	57.5	-178.2	-57.9	86.7	0	0	0	112.3	S62 N63 G111 H112	S62-H86 WeakPolarHBondContact CA-O 3.48Å; S62-H86 PolarHBondContact N-O 3.33Å; N63-H86 PolarHBondContact N-O 3.33Å; H86-G111 PolarHBondContact N-O 2.85Å; H86-H112 VanDerWaalsContact CA-O 3.25Å; H86-H112 WeakPolarHBondContact CA-O 3.31Å; H86-H112 HydrophobicContact CB-CB 4.49Å; H86-H112 AromaticContact CD2-CD2 3.94Å; H86-H112 AromaticContact CD2-CG 3.83Å; H86-H112 AromaticContact CE1-CD2 3.39Å; H86-H112 PolarHBondContact CE1-CD2 2.82Å; H86-H112 PolarHBondContact N-O 3.29Å; H86-H112 AromaticContact NE2-CD2 3.24Å; H86-H112 PolarHBondContact NE2-CD2 3.26Å; H86-H112 AromaticContact NE2-CG 3.58Å; H86-H112 AromaticContact NE2-NE2 3.91Å
87	N	98.8	Very high	96.5	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.027	21%	0.211	C	C	.	.	S	Bend	trans	-134.4	-167.9	178.9	-86.2	-71.3	0	0	0	110.4	L60 N63 H64 I65 L84 D85 H112 N113	L60-N87 PolarHBondContact O-ND2 3.38Å; N63-N87 WeakPolarHBondContact CA-OD1 3.3Å; N63-N87 WeakPolarHBondContact CB-OD1 3.45Å; N63-N87 PolarHBondContact N-OD1 3.47Å; N63-N87 PolarHBondContact O-OD1 2.86Å; H64-N87 PolarHBondContact N-OD1 2.93Å; I65-N87 HydrophobicContact CB-CB 4.23Å; I65-N87 VanDerWaalsContact CB-OD1 3.32Å; I65-N87 WeakPolarHBondContact CB-OD1 3.15Å; I65-N87 WeakPolarHBondContact CG1-OD1 3.26Å; I65-N87 PolarHBondContact N-OD1 3.1Å; L84-N87 PolarHBondContact O-ND2 2.85Å; D85-N87 PolarHBondContact O-ND2 3.35Å; D85-N87 VanDerWaalsContact O-ND2 3.15Å; N87-H112 PolarHBondContact N-O 3.32Å; N87-N113 VanDerWaalsContact CA-OD1 3.31Å; N87-N113 WeakPolarHBondContact CA-OD1 3.28Å; N87-N113 WeakPolarHBondContact CB-OD1 3.43Å; N87-N113 PolarHBondContact O-OD1 2.63Å
88	L	98.6	Very high	96.5	Very high	70 Å²	70	36.1 Å²	36.1	37%	0.366	19%	0.191	S	C	.	.			trans	-112.6	22.8	-177.4	-57.5	178.3	0	0	0	112	H64 I65 T90 N113 H114	H64-L88 HydrophobicContact CB-CD1 4.09Å; I65-L88 CarbonylContact O-C 3.16Å; I65-L88 VanDerWaalsContact O-CA 3.31Å; I65-L88 WeakPolarHBondContact O-CA 3.18Å; I65-L88 PolarHBondContact O-N 3.29Å; L88-T90 PolarHBondContact O-N 3.45Å; L88-N113 PolarHBondContact N-OD1 2.92Å; L88-H114 VanDerWaalsContact CD2-CE1 3.48Å; L88-H114 WeakPolarHBondContact CD2-CE1 3.22Å
89	L	98.6	Very high	96.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.			trans	-66.8	130.6	-176.1	-67	171.1	0	0	0	110.5	I65 L68 L84 A93 L110 N113 H114 I115	I65-L89 HydrophobicContact CG2-CD2 3.88Å; I65-L89 HydrophobicContact CG2-CG 4.47Å; I65-L89 PolarHBondContact O-N 3.37Å; I65-L89 VanDerWaalsContact O-N 3.14Å; L68-L89 HydrophobicContact CD1-CD1 4.49Å; L68-L89 HydrophobicContact CD1-CD2 4.04Å; L68-L89 HydrophobicContact CD2-CD2 4.1Å; L68-L89 HydrophobicContact CG-CD2 3.75Å; L84-L89 HydrophobicContact CB-CD1 4.04Å; L84-L89 HydrophobicContact CD1-CD1 4.22Å; L89-A93 HydrophobicContact CD2-CB 4.09Å; L89-L110 HydrophobicContact CD1-CD2 3.88Å; L89-N113 HydrophobicContact CB-CB 4.21Å; L89-N113 VanDerWaalsContact CB-OD1 3.27Å; L89-N113 WeakPolarHBondContact CB-OD1 3.32Å; L89-N113 PolarHBondContact N-OD1 2.95Å; L89-H114 CarbonylContact O-C 3.59Å; L89-H114 VanDerWaalsContact O-C 3.22Å; L89-H114 VanDerWaalsContact O-CA 3.29Å; L89-H114 WeakPolarHBondContact O-CA 3.45Å; L89-H114 PolarHBondContact O-N 3.03Å; L89-I115 PolarHBondContact O-N 3.38Å
90	T	98.2	Very high	96.2	Very high	48 Å²	48	33.7 Å²	33.7	29%	0.294	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-103.6	164.8	172.7	61.6	0	0	0	0	110	L88 Q92 A93 H114	L88-T90 PolarHBondContact O-N 3.45Å; T90-Q92 PolarHBondContact O-N 2.95Å; T90-A93 WeakPolarHBondContact O-CB 3.06Å; T90-A93 PolarHBondContact O-N 2.93Å; T90-A93 VanDerWaalsContact O-N 3.09Å; T90-A93 PolarHBondContact OG1-N 2.88Å; T90-H114 HydrophobicContact CG2-CB 4.15Å
91	S	97.2	Very high	96	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-30.6	173.5	-62.5	0	0	0	0	112.7	L94 I115 N116 M117 W122	S91-L94 PolarHBondContact O-N 2.94Å; S91-I115 WeakPolarHBondContact OG-CG2 3.06Å; S91-N116 WeakPolarHBondContact CB-OD1 3.4Å; S91-N116 PolarHBondContact OG-N 3.08Å; S91-N116 PolarHBondContact OG-OD1 3.27Å; S91-N116 VanDerWaalsContact OG-OD1 3.05Å; S91-M117 WeakPolarHBondContact OG-CG 3.12Å; S91-M117 PolarHBondContact OG-N 3.23Å; S91-M117 PolarHBondContact OG-O 3.26Å; S91-W122 VanDerWaalsContact O-CZ2 3.27Å; S91-W122 WeakPolarHBondContact O-CZ2 3.23Å
92	Q	95.8	Very high	95.8	Very high	107 Å²	107	35.5 Å²	35.5	50%	0.5	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-38.4	176.2	-68.9	75.2	8.4	0	0	111.9	T90 L94 Q95	T90-Q92 PolarHBondContact O-N 2.95Å; Q92-L94 PolarHBondContact O-N 3.01Å; Q92-Q95 WeakPolarHBondContact O-CB 3.48Å; Q92-Q95 PolarHBondContact O-N 3.09Å; Q92-Q95 VanDerWaalsContact O-N 3.09Å
93	A	95.4	Very high	95.6	Very high	15 Å²	15	38.5 Å²	38.5	12%	0.124	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.4	177.6	0	0	0	0	0	112.7	S66 L89 T90	S66-A93 WeakPolarHBondContact O-CB 3.3Å; L89-A93 HydrophobicContact CD2-CB 4.09Å; T90-A93 WeakPolarHBondContact O-CB 3.06Å; T90-A93 PolarHBondContact O-N 2.93Å; T90-A93 VanDerWaalsContact O-N 3.09Å; T90-A93 PolarHBondContact OG1-N 2.88Å
94	L	95.3	Very high	95.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.6	178.6	-59.3	-178.7	0	0	0	113.8	L68 S91 Q92 G96 L99 L110 I115 W122	L68-L94 HydrophobicContact CD1-CD2 3.8Å; S91-L94 PolarHBondContact O-N 2.94Å; Q92-L94 PolarHBondContact O-N 3.01Å; L94-G96 VanDerWaalsContact C-N 3.27Å; L94-G96 PolarHBondContact O-N 2.84Å; L94-L99 HydrophobicContact CD2-CD1 3.87Å; L94-L99 HydrophobicContact CD2-CG 4.47Å; L94-L110 HydrophobicContact CD1-CD1 4.48Å; L94-I115 HydrophobicContact CD1-CD1 3.94Å; L94-I115 HydrophobicContact CD1-CG1 4.4Å; L94-W122 HydrophobicContact CB-CD2 3.79Å; L94-W122 HydrophobicContact CB-CE3 4.14Å; L94-W122 HydrophobicContact CB-CG 4.07Å; L94-W122 HydrophobicContact CB-CH2 4.38Å; L94-W122 HydrophobicContact CB-CZ2 4.16Å; L94-W122 HydrophobicContact CB-CZ3 4.42Å; L94-W122 HydrophobicContact CD1-CD2 4.21Å; L94-W122 HydrophobicContact CD1-CE3 3.67Å; L94-W122 HydrophobicContact CD1-CH2 4.06Å; L94-W122 HydrophobicContact CD1-CZ3 3.57Å
95	Q	91.5	Very high	95.5	Very high	114 Å²	114	40.4 Å²	40.4	53%	0.533	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-23.4	-178	-68.8	-173.4	-12	0	0	113.5	Q92 G97	Q92-Q95 WeakPolarHBondContact O-CB 3.48Å; Q92-Q95 PolarHBondContact O-N 3.09Å; Q92-Q95 VanDerWaalsContact O-N 3.09Å; Q95-G97 PolarHBondContact O-N 2.79Å
96	G	85.6	Confident	95.5	Very high	33 Å²	33	42.6 Å²	42.6	34%	0.34	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	12.9	178.1	0	0	0	0	0	114.8	E70 L94 A98	E70-G96 VanDerWaalsContact CA-O 3.32Å; E70-G96 WeakPolarHBondContact CA-O 3.42Å; E70-G96 WeakPolarHBondContact CG-O 3.37Å; L94-G96 VanDerWaalsContact C-N 3.27Å; L94-G96 PolarHBondContact O-N 2.84Å; G96-A98 VanDerWaalsContact C-N 3.25Å; G96-A98 PolarHBondContact O-N 3.08Å
97	G	91.8	Very high	95.5	Very high	9 Å²	9	40.4 Å²	40.4	9%	0.093	22%	0.223	C	C	.	.			trans	70.5	15.6	173.9	0	0	0	0	0	115.4	Q95 L99 I100	Q95-G97 PolarHBondContact O-N 2.79Å; G97-L99 PolarHBondContact O-N 2.65Å; G97-I100 WeakPolarHBondContact O-CB 3.25Å; G97-I100 PolarHBondContact O-N 3Å; G97-I100 VanDerWaalsContact O-N 3.08Å
98	A	93.9	Very high	95.5	Very high	2 Å²	2	40.2 Å²	40.2	2%	0.017	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.3	-178.8	0	0	0	0	0	113.9	L68 A72 F73 G96	L68-A98 HydrophobicContact CB-CB 3.83Å; L68-A98 HydrophobicContact CD1-CB 3.93Å; A72-A98 HydrophobicContact CB-CB 4.16Å; F73-A98 HydrophobicContact CD2-CB 4.44Å; F73-A98 WeakPolarHBondContact CD2-O 3.28Å; G96-A98 VanDerWaalsContact C-N 3.25Å; G96-A98 PolarHBondContact O-N 3.08Å
99	L	94.9	Very high	95.5	Very high	2 Å²	2	37 Å²	37	1%	0.01	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	11.6	-176.5	-57.9	178.3	0	0	0	114	F73 L82 L94 G97 L102 L108 L110 W122 F123 T126	F73-L99 HydrophobicContact CD2-CD2 4.1Å; F73-L99 HydrophobicContact CE2-CD2 4.28Å; L82-L99 HydrophobicContact CD2-CD2 3.72Å; L94-L99 HydrophobicContact CD2-CD1 3.87Å; L94-L99 HydrophobicContact CD2-CG 4.47Å; G97-L99 PolarHBondContact O-N 2.65Å; L99-L102 HydrophobicContact CB-CD1 4.47Å; L99-L102 HydrophobicContact CD2-CD1 4.07Å; L99-L108 HydrophobicContact CD1-CD2 4.08Å; L99-L110 HydrophobicContact CD1-CD1 4.29Å; L99-W122 CarbonylContact C-O 3.13Å; L99-W122 VanDerWaalsContact CB-O 3.31Å; L99-W122 WeakPolarHBondContact CB-O 3.49Å; L99-F123 HydrophobicContact CD1-CE1 4.03Å; L99-T126 PolarHBondContact O-OG1 3.33Å; L99-T126 VanDerWaalsContact O-OG1 3.04Å
100	I	93.9	Very high	95.5	Very high	54 Å²	54	37.1 Å²	37.1	28%	0.277	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	144.4	179.9	-66.4	177.6	0	0	0	110.4	G97 L102	G97-I100 WeakPolarHBondContact O-CB 3.25Å; G97-I100 PolarHBondContact O-N 3Å; G97-I100 VanDerWaalsContact O-N 3.08Å; I100-L102 VanDerWaalsContact C-N 3.25Å; I100-L102 PolarHBondContact O-N 2.98Å
101	N	93.6	Very high	95.5	Very high	115 Å²	115	34.8 Å²	34.8	62%	0.615	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	26.1	175.4	-65.2	-36.8	0	0	0	115.3	S103 T124	N101-S103 PolarHBondContact O-N 3.43Å; N101-T124 PolarHBondContact N-O 3.32Å
102	L	95	Very high	95.6	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.042	21%	0.211	C	C	.	.			trans	-79.3	68.8	172	-57.1	-178.1	0	0	0	109.8	F73 L99 I100 Q104 L105 T126	F73-L102 HydrophobicContact CB-CD1 4.31Å; F73-L102 HydrophobicContact CB-CD2 3.91Å; F73-L102 WeakPolarHBondContact O-CD2 3.44Å; L99-L102 HydrophobicContact CB-CD1 4.47Å; L99-L102 HydrophobicContact CD2-CD1 4.07Å; I100-L102 VanDerWaalsContact C-N 3.25Å; I100-L102 PolarHBondContact O-N 2.98Å; L102-Q104 VanDerWaalsContact C-N 3.27Å; L102-Q104 PolarHBondContact O-N 3.02Å; L102-L105 HydrophobicContact CB-CB 3.81Å; L102-L105 HydrophobicContact CB-CD2 4.21Å; L102-L105 HydrophobicContact CD1-CD2 3.9Å; L102-L105 WeakPolarHBondContact O-CB 3.46Å; L102-L105 PolarHBondContact O-N 3.47Å; L102-T126 HydrophobicContact CB-CG2 4.33Å
103	S	94.3	Very high	95.8	Very high	62 Å²	62	33.9 Å²	33.9	43%	0.434	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-19.4	-163.6	63.9	0	0	0	0	115.8	N101 A128	N101-S103 PolarHBondContact O-N 3.43Å; S103-A128 VanDerWaalsContact O-CB 3.23Å; S103-A128 WeakPolarHBondContact O-CB 3.32Å
104	Q	97	Very high	95.9	Very high	87 Å²	87	37.4 Å²	37.4	41%	0.407	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	2.2	175.3	-60.2	-57.2	-63.9	0	0	113	P77 L79 H80 L102 E106	P77-Q104 WeakPolarHBondContact O-CG 3.41Å; L79-Q104 CarbonylContact O-C 3.34Å; L79-Q104 VanDerWaalsContact O-C 3.26Å; H80-Q104 WeakPolarHBondContact CA-O 3.48Å; L102-Q104 VanDerWaalsContact C-N 3.27Å; L102-Q104 PolarHBondContact O-N 3.02Å; Q104-E106 PolarHBondContact O-N 3.39Å
105	L	98.2	Very high	96.1	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.201	C	C	.	.			trans	-70.5	119.9	-177	-171.5	75.1	0	0	0	110	L79 L82 L102 L108 T126 A128 L129	L79-L105 HydrophobicContact CD2-CD1 4.31Å; L79-L105 HydrophobicContact CG-CD1 4.07Å; L79-L105 VanDerWaalsContact O-CA 3.28Å; L79-L105 WeakPolarHBondContact O-CA 3.22Å; L79-L105 PolarHBondContact O-N 3.3Å; L82-L105 HydrophobicContact CB-CD1 3.75Å; L102-L105 HydrophobicContact CB-CB 3.81Å; L102-L105 HydrophobicContact CB-CD2 4.21Å; L102-L105 HydrophobicContact CD1-CD2 3.9Å; L102-L105 WeakPolarHBondContact O-CB 3.46Å; L102-L105 PolarHBondContact O-N 3.47Å; L105-L108 HydrophobicContact CD2-CB 4.07Å; L105-L108 HydrophobicContact CD2-CD1 4.45Å; L105-L108 HydrophobicContact CD2-CD2 4.4Å; L105-T126 HydrophobicContact CB-CG2 4.09Å; L105-T126 HydrophobicContact CD2-CG2 4.1Å; L105-A128 CarbonylContact O-C 3.51Å; L105-L129 HydrophobicContact CD2-CD1 4.06Å; L105-L129 HydrophobicContact CG-CD1 4.04Å; L105-L129 WeakPolarHBondContact O-CA 3.35Å; L105-L129 PolarHBondContact O-N 3.14Å
106	E	98.7	Very high	96.4	Very high	74 Å²	74	35.1 Å²	35.1	35%	0.346	19%	0.193	S	C	.	.			trans	-102.4	-36.6	-179.1	-67.1	179.6	174.9	0	0	111.7	H80 Q104 L130 S131	H80-E106 IonicContact CD2-OE1 3.96Å; H80-E106 PolarHBondContact O-N 3.3Å; Q104-E106 PolarHBondContact O-N 3.39Å; E106-L130 HydrophobicContact CB-CD1 4.25Å; E106-L130 HydrophobicContact CB-CG 4.28Å; E106-L130 HydrophobicContact CG-CD1 4.26Å; E106-L130 HydrophobicContact CG-CG 4.44Å; E106-L130 WeakPolarHBondContact O-CA 3.48Å; E106-L130 PolarHBondContact O-N 2.92Å; E106-S131 PolarHBondContact O-N 3.02Å
107	V	98.9	Very high	96.9	Very high	41 Å²	41	36.8 Å²	36.8	25%	0.248	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.3	-176.8	-177.8	0	0	0	0	110.2	H80 T81 L82	H80-V107 PolarHBondContact O-N 2.94Å; T81-V107 WeakPolarHBondContact CA-O 3.3Å; T81-V107 HydrophobicContact CG2-CB 4.2Å; T81-V107 HydrophobicContact CG2-CG1 4.37Å; L82-V107 PolarHBondContact N-O 3.44Å
108	L	98.8	Very high	97.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	115.8	173.2	179.1	56.3	0	0	0	110.2	L82 L99 L105 L110 F123 L129 S131 L132 K133	L82-L108 HydrophobicContact CB-CD1 4.1Å; L82-L108 HydrophobicContact CD2-CD1 3.97Å; L82-L108 HydrophobicContact CG-CD1 4.05Å; L99-L108 HydrophobicContact CD1-CD2 4.08Å; L105-L108 HydrophobicContact CD2-CB 4.07Å; L105-L108 HydrophobicContact CD2-CD1 4.45Å; L105-L108 HydrophobicContact CD2-CD2 4.4Å; L108-L110 HydrophobicContact CD1-CD1 4.36Å; L108-L110 HydrophobicContact CD1-CG 4.08Å; L108-L110 HydrophobicContact CD2-CD1 3.9Å; L108-L110 HydrophobicContact CD2-CG 4.46Å; L108-L110 HydrophobicContact CG-CD1 4.03Å; L108-L110 HydrophobicContact CG-CG 4.07Å; L108-F123 HydrophobicContact CD2-CD1 4.18Å; L108-F123 HydrophobicContact CD2-CE1 3.66Å; L108-L129 HydrophobicContact CB-CD1 3.79Å; L108-S131 PolarHBondContact N-O 3.45Å; L108-L132 HydrophobicContact CB-CD1 4.11Å; L108-L132 HydrophobicContact CD2-CD1 3.95Å; L108-L132 HydrophobicContact CG-CD1 4.01Å; L108-K133 PolarHBondContact O-N 2.89Å
109	A	98.9	Very high	97.3	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.033	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116.9	173.8	0	0	0	0	0	111.5	L82 L83 L84 D85 K133	L82-A109 PolarHBondContact O-N 3.41Å; L83-A109 HydrophobicContact CD2-CB 3.87Å; L84-A109 CarbonylContact C-O 3.59Å; L84-A109 WeakPolarHBondContact CA-O 3.22Å; L84-A109 WeakPolarHBondContact CB-O 3.21Å; L84-A109 PolarHBondContact N-O 2.95Å; D85-A109 HydrophobicContact CB-CB 4.34Å; D85-A109 PolarHBondContact N-O 3.38Å; A109-K133 HydrophobicContact CB-CB 4.33Å; A109-K133 HydrophobicContact CB-CD 4.46Å
110	L	98.8	Very high	97.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.214	C	C	.	.			trans	-125.1	12.7	177.2	-70.8	169	0	0	0	111.5	L84 L89 L94 L99 L108 N113 I115 K133 L134 N137	L84-L110 HydrophobicContact CB-CD2 3.92Å; L84-L110 HydrophobicContact CD1-CD2 4.1Å; L89-L110 HydrophobicContact CD1-CD2 3.88Å; L94-L110 HydrophobicContact CD1-CD1 4.48Å; L99-L110 HydrophobicContact CD1-CD1 4.29Å; L108-L110 HydrophobicContact CD1-CD1 4.36Å; L108-L110 HydrophobicContact CD1-CG 4.08Å; L108-L110 HydrophobicContact CD2-CD1 3.9Å; L108-L110 HydrophobicContact CD2-CG 4.46Å; L108-L110 HydrophobicContact CG-CD1 4.03Å; L108-L110 HydrophobicContact CG-CG 4.07Å; L110-N113 PolarHBondContact O-ND2 3.34Å; L110-I115 HydrophobicContact CB-CD1 4.01Å; L110-I115 HydrophobicContact CD1-CD1 4.31Å; L110-I115 HydrophobicContact CD2-CD1 4.47Å; L110-K133 CarbonylContact C-O 3.15Å; L110-K133 WeakPolarHBondContact CA-O 3.49Å; L110-K133 PolarHBondContact N-O 2.97Å; L110-L134 HydrophobicContact CB-CD2 3.78Å; L110-L134 HydrophobicContact CD1-CD2 4.1Å; L110-N137 PolarHBondContact O-ND2 3.23Å
111	G	98.8	Very high	97.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.221	C	C	.	.			trans	-58	154	179.5	0	0	0	0	0	112.8	D85 H86 N113 K133 E135	D85-G111 CarbonylContact C-O 3.53Å; D85-G111 WeakPolarHBondContact CA-O 3.33Å; D85-G111 WeakPolarHBondContact CB-O 3.47Å; H86-G111 PolarHBondContact N-O 2.85Å; G111-N113 PolarHBondContact O-N 3.15Å; G111-N113 PolarHBondContact O-ND2 3.07Å; G111-K133 PolarHBondContact N-O 3.43Å; G111-E135 CarbonylContact C-O 3.16Å; G111-E135 WeakPolarHBondContact CA-O 3.41Å
112	H	98.8	Very high	97.2	Very high	83 Å²	83	35.2 Å²	35.2	38%	0.384	19%	0.193	S	C	.	.	S	Bend	trans	52.1	52.6	178.7	-59.9	-72.6	0	0	0	113.3	H86 N87 E135 G136	H86-H112 VanDerWaalsContact CA-O 3.25Å; H86-H112 WeakPolarHBondContact CA-O 3.31Å; H86-H112 HydrophobicContact CB-CB 4.49Å; H86-H112 AromaticContact CD2-CD2 3.94Å; H86-H112 AromaticContact CD2-CG 3.83Å; H86-H112 AromaticContact CE1-CD2 3.39Å; H86-H112 PolarHBondContact CE1-CD2 2.82Å; H86-H112 PolarHBondContact N-O 3.29Å; H86-H112 AromaticContact NE2-CD2 3.24Å; H86-H112 PolarHBondContact NE2-CD2 3.26Å; H86-H112 AromaticContact NE2-CG 3.58Å; H86-H112 AromaticContact NE2-NE2 3.91Å; N87-H112 PolarHBondContact N-O 3.32Å; H112-E135 PolarHBondContact N-O 3.5Å; H112-G136 WeakPolarHBondContact CA-O 3.38Å
113	N	98.8	Very high	97.1	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.027	19%	0.191	C	C	.	.	S	Bend	trans	-120.7	-167.7	171.4	-84.4	-79.4	0	0	0	109.9	L84 N87 L88 L89 L110 G111 I115 N137	L84-N113 PolarHBondContact O-ND2 3.41Å; N87-N113 VanDerWaalsContact CA-OD1 3.31Å; N87-N113 WeakPolarHBondContact CA-OD1 3.28Å; N87-N113 WeakPolarHBondContact CB-OD1 3.43Å; N87-N113 PolarHBondContact O-OD1 2.63Å; L88-N113 PolarHBondContact N-OD1 2.92Å; L89-N113 HydrophobicContact CB-CB 4.21Å; L89-N113 VanDerWaalsContact CB-OD1 3.27Å; L89-N113 WeakPolarHBondContact CB-OD1 3.32Å; L89-N113 PolarHBondContact N-OD1 2.95Å; L110-N113 PolarHBondContact O-ND2 3.34Å; G111-N113 PolarHBondContact O-N 3.15Å; G111-N113 PolarHBondContact O-ND2 3.07Å; N113-I115 HydrophobicContact CB-CD1 4.25Å; N113-I115 HydrophobicContact CB-CG1 4.13Å; N113-N137 VanDerWaalsContact CA-OD1 3.29Å; N113-N137 WeakPolarHBondContact CA-OD1 3.49Å; N113-N137 WeakPolarHBondContact CB-OD1 3.37Å; N113-N137 PolarHBondContact N-OD1 3.25Å; N113-N137 PolarHBondContact O-OD1 2.86Å
114	H	98.6	Very high	97.1	Very high	88 Å²	88	35 Å²	35	41%	0.407	19%	0.189	S	C	.	.	B	Isolated β-bridge	trans	-111	33.2	-179.8	-63.1	76.3	0	0	0	111.6	L88 L89 T90 N116 L138	L88-H114 VanDerWaalsContact CD2-CE1 3.48Å; L88-H114 WeakPolarHBondContact CD2-CE1 3.22Å; L89-H114 CarbonylContact O-C 3.59Å; L89-H114 VanDerWaalsContact O-C 3.22Å; L89-H114 VanDerWaalsContact O-CA 3.29Å; L89-H114 WeakPolarHBondContact O-CA 3.45Å; L89-H114 PolarHBondContact O-N 3.03Å; T90-H114 HydrophobicContact CG2-CB 4.15Å; H114-N116 PolarHBondContact O-N 2.94Å; H114-L138 HydrophobicContact CB-CD1 4.26Å
115	I	98.7	Very high	96.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.176	C	C	.	.			trans	-77	120.4	-178.7	-58.8	170.7	0	0	0	108.4	L89 S91 L94 L110 N113 M117 W122 L134 N137 L138 V139	L89-I115 PolarHBondContact O-N 3.38Å; S91-I115 WeakPolarHBondContact OG-CG2 3.06Å; L94-I115 HydrophobicContact CD1-CD1 3.94Å; L94-I115 HydrophobicContact CD1-CG1 4.4Å; L110-I115 HydrophobicContact CB-CD1 4.01Å; L110-I115 HydrophobicContact CD1-CD1 4.31Å; L110-I115 HydrophobicContact CD2-CD1 4.47Å; N113-I115 HydrophobicContact CB-CD1 4.25Å; N113-I115 HydrophobicContact CB-CG1 4.13Å; I115-M117 WeakPolarHBondContact CG2-O 3.25Å; I115-W122 HydrophobicContact CG2-CH2 4.2Å; I115-W122 HydrophobicContact CG2-CZ3 4.14Å; I115-L134 HydrophobicContact CD1-CD2 3.99Å; I115-N137 HydrophobicContact CB-CB 4.32Å; I115-N137 VanDerWaalsContact CB-OD1 3.3Å; I115-N137 WeakPolarHBondContact CB-OD1 3.31Å; I115-N137 WeakPolarHBondContact CG1-OD1 3.45Å; I115-N137 PolarHBondContact N-OD1 3.29Å; I115-N137 VanDerWaalsContact N-OD1 3.1Å; I115-L138 CarbonylContact O-C 3.16Å; I115-L138 VanDerWaalsContact O-C 3.28Å; I115-L138 WeakPolarHBondContact O-CA 3.32Å; I115-L138 PolarHBondContact O-N 2.9Å; I115-V139 HydrophobicContact CG2-CG2 4.36Å; I115-V139 PolarHBondContact O-N 3.06Å
116	N	98	Very high	96.7	Very high	68 Å²	68	31.4 Å²	31.4	36%	0.364	18%	0.176	S	C	.	.			trans	-108.5	-9.7	-176.1	68	3.4	0	0	0	114.7	S91 H114 L138 V139 T140	S91-N116 WeakPolarHBondContact CB-OD1 3.4Å; S91-N116 PolarHBondContact OG-N 3.08Å; S91-N116 PolarHBondContact OG-OD1 3.27Å; S91-N116 VanDerWaalsContact OG-OD1 3.05Å; H114-N116 PolarHBondContact O-N 2.94Å; N116-L138 WeakPolarHBondContact CA-O 3.37Å; N116-L138 HydrophobicContact CB-CB 4.11Å; N116-V139 WeakPolarHBondContact O-CA 3.26Å; N116-T140 PolarHBondContact O-N 2.87Å
117	M	97.1	Very high	96.5	Very high	68 Å²	68	33.9 Å²	33.9	34%	0.335	19%	0.186	S	C	.	.			trans	-147.2	161.8	173.7	59.5	-175.7	-76.3	0	0	109.6	S91 I115 Q119 W122	S91-M117 WeakPolarHBondContact OG-CG 3.12Å; S91-M117 PolarHBondContact OG-N 3.23Å; S91-M117 PolarHBondContact OG-O 3.26Å; I115-M117 WeakPolarHBondContact CG2-O 3.25Å; M117-Q119 VanDerWaalsContact CE-CD 3.41Å; M117-Q119 HydrophobicContact CE-CG 3.42Å; M117-Q119 VanDerWaalsContact CE-CG 3.42Å; M117-W122 WeakPolarHBondContact O-CH2 3.48Å; M117-W122 VanDerWaalsContact O-CZ3 3.32Å; M117-W122 WeakPolarHBondContact O-CZ3 3.34Å
118	I	97.2	Very high	96.4	Very high	9 Å²	9	33.1 Å²	33.1	5%	0.046	18%	0.184	C	C	.	.			trans	-121.5	136	174	-50.6	169.7	0	0	0	107.8	W122 F123 L134 V139 L142 S146 F147 L160	I118-W122 HydrophobicContact CB-CZ3 4.45Å; I118-W122 HydrophobicContact CG2-CE3 4.4Å; I118-W122 HydrophobicContact CG2-CZ3 4.32Å; I118-F123 HydrophobicContact CG2-CE2 3.92Å; I118-L134 HydrophobicContact CD1-CD1 3.71Å; I118-L134 HydrophobicContact CG1-CD1 4.38Å; I118-V139 HydrophobicContact CD1-CG1 4.24Å; I118-V139 HydrophobicContact CD1-CG2 4.26Å; I118-V139 HydrophobicContact CG1-CG1 4.25Å; I118-V139 HydrophobicContact CG1-CG2 4.02Å; I118-L142 HydrophobicContact CD1-CD2 4.01Å; I118-S146 WeakPolarHBondContact CG2-O 3.4Å; I118-F147 HydrophobicContact CD1-CE1 4.14Å; I118-F147 HydrophobicContact CD1-CZ 3.83Å; I118-F147 HydrophobicContact CG2-CE1 4.24Å; I118-L160 HydrophobicContact CD1-CD2 3.78Å
119	Q	95.3	Very high	96.4	Very high	67 Å²	67	33.1 Å²	33.1	31%	0.313	18%	0.184	S	C	.	.			trans	-125	132.4	174.9	-57.4	-175.7	-58.4	0	0	110.9	M117 G121 W122 S146	M117-Q119 VanDerWaalsContact CE-CD 3.41Å; M117-Q119 HydrophobicContact CE-CG 3.42Å; M117-Q119 VanDerWaalsContact CE-CG 3.42Å; Q119-G121 PolarHBondContact O-N 2.93Å; Q119-G121 VanDerWaalsContact O-N 3.1Å; Q119-W122 HydrophobicContact CB-CD2 4.06Å; Q119-W122 HydrophobicContact CB-CG 4.33Å; Q119-W122 HydrophobicContact CB-CZ2 4.17Å; Q119-W122 HydrophobicContact CG-CZ2 3.93Å; Q119-W122 PolarHBondContact O-N 3.08Å; Q119-W122 VanDerWaalsContact OE1-NE1 3.1Å; Q119-S146 CarbonylContact C-O 3.58Å
120	A	92.5	Very high	96.4	Very high	24 Å²	24	35.9 Å²	35.9	20%	0.198	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-54.5	-32.7	176.8	0	0	0	0	0	113.1	W122 F123 G145 S146 P148	A120-W122 PolarHBondContact O-N 3.23Å; A120-F123 PolarHBondContact O-N 3.02Å; A120-G145 VanDerWaalsContact CB-O 3.26Å; A120-G145 WeakPolarHBondContact CB-O 3.35Å; A120-G145 PolarHBondContact N-O 2.86Å; A120-S146 PolarHBondContact N-O 3.24Å; A120-P148 HydrophobicContact CB-CB 4.09Å
121	G	93.5	Very high	96.4	Very high	41 Å²	41	36.8 Å²	36.8	42%	0.423	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-58.9	-29.1	-178.4	0	0	0	0	0	114.4	Q119 F123 T124	Q119-G121 PolarHBondContact O-N 2.93Å; Q119-G121 VanDerWaalsContact O-N 3.1Å; G121-F123 PolarHBondContact O-N 3.03Å; G121-T124 PolarHBondContact O-N 2.94Å; G121-T124 PolarHBondContact O-OG1 3.21Å
122	W	94.6	Very high	96.4	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.03	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-63.7	-28.3	-179.7	-55.7	-21.9	0	0	0	113.1	S91 L94 L99 I115 M117 I118 Q119 A120	S91-W122 VanDerWaalsContact O-CZ2 3.27Å; S91-W122 WeakPolarHBondContact O-CZ2 3.23Å; L94-W122 HydrophobicContact CB-CD2 3.79Å; L94-W122 HydrophobicContact CB-CE3 4.14Å; L94-W122 HydrophobicContact CB-CG 4.07Å; L94-W122 HydrophobicContact CB-CH2 4.38Å; L94-W122 HydrophobicContact CB-CZ2 4.16Å; L94-W122 HydrophobicContact CB-CZ3 4.42Å; L94-W122 HydrophobicContact CD1-CD2 4.21Å; L94-W122 HydrophobicContact CD1-CE3 3.67Å; L94-W122 HydrophobicContact CD1-CH2 4.06Å; L94-W122 HydrophobicContact CD1-CZ3 3.57Å; L99-W122 CarbonylContact C-O 3.13Å; L99-W122 VanDerWaalsContact CB-O 3.31Å; L99-W122 WeakPolarHBondContact CB-O 3.49Å; I115-W122 HydrophobicContact CG2-CH2 4.2Å; I115-W122 HydrophobicContact CG2-CZ3 4.14Å; M117-W122 WeakPolarHBondContact O-CH2 3.48Å; M117-W122 VanDerWaalsContact O-CZ3 3.32Å; M117-W122 WeakPolarHBondContact O-CZ3 3.34Å; I118-W122 HydrophobicContact CB-CZ3 4.45Å; I118-W122 HydrophobicContact CG2-CE3 4.4Å; I118-W122 HydrophobicContact CG2-CZ3 4.32Å; Q119-W122 HydrophobicContact CB-CD2 4.06Å; Q119-W122 HydrophobicContact CB-CG 4.33Å; Q119-W122 HydrophobicContact CB-CZ2 4.17Å; Q119-W122 HydrophobicContact CG-CZ2 3.93Å; Q119-W122 PolarHBondContact O-N 3.08Å; Q119-W122 VanDerWaalsContact OE1-NE1 3.1Å; A120-W122 PolarHBondContact O-N 3.23Å
123	F	93.8	Very high	96.4	Very high	1 Å²	1	37 Å²	37	0%	0.004	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-110.4	17.2	-171.8	-48.6	-69.1	0	0	0	113	L99 L108 I118 A120 G121 G125 T126 L132 P148 F152	L99-F123 HydrophobicContact CD1-CE1 4.03Å; L108-F123 HydrophobicContact CD2-CD1 4.18Å; L108-F123 HydrophobicContact CD2-CE1 3.66Å; I118-F123 HydrophobicContact CG2-CE2 3.92Å; A120-F123 PolarHBondContact O-N 3.02Å; G121-F123 PolarHBondContact O-N 3.03Å; F123-G125 PolarHBondContact O-N 3.13Å; F123-T126 WeakPolarHBondContact O-CB 3.29Å; F123-T126 PolarHBondContact O-N 2.9Å; F123-T126 PolarHBondContact O-OG1 3.04Å; F123-L132 HydrophobicContact CZ-CD2 4.48Å; F123-P148 HydrophobicContact CB-CG 4.27Å; F123-F152 HydrophobicContact CB-CE1 3.5Å; F123-F152 VanDerWaalsContact CB-CE1 3.5Å; F123-F152 HydrophobicContact CB-CZ 3.54Å; F123-F152 HydrophobicContact CD1-CE1 4.44Å; F123-F152 AromaticContact CD1-CZ 3.87Å; F123-F152 HydrophobicContact CD1-CZ 3.87Å; F123-F152 HydrophobicContact CD2-CE1 4.36Å; F123-F152 HydrophobicContact CD2-CE2 4.05Å; F123-F152 AromaticContact CD2-CZ 3.52Å; F123-F152 HydrophobicContact CD2-CZ 3.52Å; F123-F152 HydrophobicContact CE1-CZ 4.43Å; F123-F152 HydrophobicContact CE2-CE2 4.42Å; F123-F152 HydrophobicContact CE2-CZ 4.13Å; F123-F152 AromaticContact CG-CE1 3.88Å; F123-F152 HydrophobicContact CG-CE1 3.88Å; F123-F152 HydrophobicContact CG-CE2 4.32Å; F123-F152 AromaticContact CG-CZ 3.36Å; F123-F152 HydrophobicContact CG-CZ 3.36Å
124	T	93.7	Very high	96.4	Very high	64 Å²	64	36.9 Å²	36.9	39%	0.393	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	124	-179	-57	0	0	0	0	109.9	N101 G121 T126	N101-T124 PolarHBondContact N-O 3.32Å; G121-T124 PolarHBondContact O-N 2.94Å; G121-T124 PolarHBondContact O-OG1 3.21Å; T124-T126 VanDerWaalsContact C-N 3.33Å; T124-T126 PolarHBondContact O-N 2.77Å
125	G	93	Very high	96.4	Very high	13 Å²	13	34.2 Å²	34.2	13%	0.134	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	2.1	179	0	0	0	0	0	116.1	F123 K127 D151	F123-G125 PolarHBondContact O-N 3.13Å; G125-K127 VanDerWaalsContact C-N 3.33Å; G125-K127 PolarHBondContact O-N 3.01Å; G125-K127 VanDerWaalsContact O-N 3.12Å; G125-D151 PolarHBondContact N-OD2 2.77Å; G125-D151 VanDerWaalsContact N-OD2 3.14Å
126	T	94	Very high	96.4	Very high	1 Å²	1	35 Å²	35	1%	0.006	20%	0.199	C	C	.	.			trans	-88.2	68.7	178.5	-55.6	0	0	0	0	110.5	L99 L102 L105 F123 T124 L129	L99-T126 PolarHBondContact O-OG1 3.33Å; L99-T126 VanDerWaalsContact O-OG1 3.04Å; L102-T126 HydrophobicContact CB-CG2 4.33Å; L105-T126 HydrophobicContact CB-CG2 4.09Å; L105-T126 HydrophobicContact CD2-CG2 4.1Å; F123-T126 WeakPolarHBondContact O-CB 3.29Å; F123-T126 PolarHBondContact O-N 2.9Å; F123-T126 PolarHBondContact O-OG1 3.04Å; T124-T126 VanDerWaalsContact C-N 3.33Å; T124-T126 PolarHBondContact O-N 2.77Å; T126-L129 HydrophobicContact CG2-CB 4.25Å; T126-L129 HydrophobicContact CG2-CD1 4.42Å
127	K	94.9	Very high	96.5	Very high	126 Å²	126	32 Å²	32	55%	0.548	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-18.8	-165.9	-64.3	-178.9	-179.9	178.4	0	115.8	G125 L129 D151 S154	G125-K127 VanDerWaalsContact C-N 3.33Å; G125-K127 PolarHBondContact O-N 3.01Å; G125-K127 VanDerWaalsContact O-N 3.12Å; K127-L129 VanDerWaalsContact C-N 3.33Å; K127-D151 WeakPolarHBondContact CA-O 3.45Å; K127-D151 WeakPolarHBondContact CE-OD1 3.36Å; K127-D151 HydrophobicContact CG-CB 4.32Å; K127-D151 WeakPolarHBondContact CG-OD1 3.4Å; K127-S154 PolarHBondContact O-OG 2.93Å
128	A	97.1	Very high	96.5	Very high	25 Å²	25	32.2 Å²	32.2	21%	0.207	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.3	-178.9	0	0	0	0	0	113.2	S103 L105 L130	S103-A128 VanDerWaalsContact O-CB 3.23Å; S103-A128 WeakPolarHBondContact O-CB 3.32Å; L105-A128 CarbonylContact O-C 3.51Å; A128-L130 WeakPolarHBondContact O-CG 3.29Å; A128-L130 PolarHBondContact O-N 3.04Å
129	L	98.2	Very high	96.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.183	C	C	.	.			trans	-63	122.9	-172	-159.6	70	0	0	0	110.9	L105 L108 T126 K127 L132 F152 S154 L155	L105-L129 HydrophobicContact CD2-CD1 4.06Å; L105-L129 HydrophobicContact CG-CD1 4.04Å; L105-L129 WeakPolarHBondContact O-CA 3.35Å; L105-L129 PolarHBondContact O-N 3.14Å; L108-L129 HydrophobicContact CB-CD1 3.79Å; T126-L129 HydrophobicContact CG2-CB 4.25Å; T126-L129 HydrophobicContact CG2-CD1 4.42Å; K127-L129 VanDerWaalsContact C-N 3.33Å; L129-L132 HydrophobicContact CD2-CB 4.09Å; L129-F152 HydrophobicContact CB-CE1 4.39Å; L129-F152 HydrophobicContact CD2-CD1 4.37Å; L129-F152 HydrophobicContact CD2-CE1 3.61Å; L129-F152 HydrophobicContact CD2-CE2 4.31Å; L129-F152 HydrophobicContact CD2-CZ 3.58Å; L129-S154 CarbonylContact O-C 3.47Å; L129-L155 HydrophobicContact CB-CD1 4.32Å; L129-L155 HydrophobicContact CD2-CD1 3.97Å; L129-L155 HydrophobicContact CG-CD1 3.9Å; L129-L155 WeakPolarHBondContact O-CA 3.33Å; L129-L155 PolarHBondContact O-N 3.05Å; L129-L155 VanDerWaalsContact O-N 3.08Å
130	L	98.8	Very high	96.8	Very high	62 Å²	62	31.3 Å²	31.3	33%	0.325	19%	0.185	S	C	.	.			trans	-105.1	-36.4	179.5	-59.6	-178.8	0	0	0	111.3	E106 A128 S154 E156 T157	E106-L130 HydrophobicContact CB-CD1 4.25Å; E106-L130 HydrophobicContact CB-CG 4.28Å; E106-L130 HydrophobicContact CG-CD1 4.26Å; E106-L130 HydrophobicContact CG-CG 4.44Å; E106-L130 WeakPolarHBondContact O-CA 3.48Å; E106-L130 PolarHBondContact O-N 2.92Å; A128-L130 WeakPolarHBondContact O-CG 3.29Å; A128-L130 PolarHBondContact O-N 3.04Å; L130-S154 WeakPolarHBondContact CD2-O 3.46Å; L130-E156 PolarHBondContact O-N 3.13Å; L130-T157 PolarHBondContact O-N 3.17Å
131	S	98.9	Very high	97	Very high	20 Å²	20	35.8 Å²	35.8	14%	0.14	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	124.4	-177.8	-174	0	0	0	0	111.7	E106 L108 T157	E106-S131 PolarHBondContact O-N 3.02Å; L108-S131 PolarHBondContact N-O 3.45Å; S131-T157 WeakPolarHBondContact CA-O 3.34Å
132	L	98.8	Very high	97.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119.9	173.4	178.5	56.9	0	0	0	109.6	L108 F123 L129 L134 F147 F152 L155 T157 L158 D159	L108-L132 HydrophobicContact CB-CD1 4.11Å; L108-L132 HydrophobicContact CD2-CD1 3.95Å; L108-L132 HydrophobicContact CG-CD1 4.01Å; F123-L132 HydrophobicContact CZ-CD2 4.48Å; L129-L132 HydrophobicContact CD2-CB 4.09Å; L132-L134 HydrophobicContact CD1-CD1 4.21Å; L132-L134 HydrophobicContact CD1-CG 4.16Å; L132-L134 HydrophobicContact CD2-CD1 3.8Å; L132-L134 HydrophobicContact CG-CD1 3.87Å; L132-L134 HydrophobicContact CG-CG 4.16Å; L132-F147 HydrophobicContact CD2-CE1 4.1Å; L132-F152 HydrophobicContact CD2-CE2 3.65Å; L132-F152 HydrophobicContact CD2-CZ 4.1Å; L132-L155 HydrophobicContact CB-CD1 3.85Å; L132-L155 HydrophobicContact CB-CD2 4.39Å; L132-T157 PolarHBondContact N-O 3.34Å; L132-L158 HydrophobicContact CB-CD1 4.09Å; L132-L158 HydrophobicContact CD2-CD1 4Å; L132-L158 HydrophobicContact CG-CD1 4.01Å; L132-L158 WeakPolarHBondContact O-CA 3.39Å; L132-D159 PolarHBondContact O-N 2.93Å
133	K	98.9	Very high	97.3	Very high	87 Å²	87	36.7 Å²	36.7	38%	0.378	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.2	179.9	-66.6	-170.3	-178.4	-172.1	0	110.2	L108 A109 L110 G111 E135	L108-K133 PolarHBondContact O-N 2.89Å; A109-K133 HydrophobicContact CB-CB 4.33Å; A109-K133 HydrophobicContact CB-CD 4.46Å; L110-K133 CarbonylContact C-O 3.15Å; L110-K133 WeakPolarHBondContact CA-O 3.49Å; L110-K133 PolarHBondContact N-O 2.97Å; G111-K133 PolarHBondContact N-O 3.43Å; K133-E135 VanDerWaalsContact CB-OE2 3.25Å; K133-E135 WeakPolarHBondContact CB-OE2 3.35Å
134	L	98.8	Very high	97.3	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.212	C	C	.	.			trans	-131.3	15.8	-177.1	-78.1	163.7	0	0	0	111.5	L110 I115 I118 L132 N137 D159 L160 N163	L110-L134 HydrophobicContact CB-CD2 3.78Å; L110-L134 HydrophobicContact CD1-CD2 4.1Å; I115-L134 HydrophobicContact CD1-CD2 3.99Å; I118-L134 HydrophobicContact CD1-CD1 3.71Å; I118-L134 HydrophobicContact CG1-CD1 4.38Å; L132-L134 HydrophobicContact CD1-CD1 4.21Å; L132-L134 HydrophobicContact CD1-CG 4.16Å; L132-L134 HydrophobicContact CD2-CD1 3.8Å; L132-L134 HydrophobicContact CG-CD1 3.87Å; L132-L134 HydrophobicContact CG-CG 4.16Å; L134-N137 WeakPolarHBondContact O-CB 3.41Å; L134-N137 PolarHBondContact O-ND2 3.44Å; L134-D159 CarbonylContact C-O 3.6Å; L134-D159 WeakPolarHBondContact CA-O 3.25Å; L134-D159 WeakPolarHBondContact CB-O 3.11Å; L134-D159 PolarHBondContact N-O 2.9Å; L134-L160 HydrophobicContact CB-CD2 3.89Å; L134-L160 HydrophobicContact CD1-CD2 3.98Å; L134-N163 PolarHBondContact O-ND2 3.01Å
135	E	98.8	Very high	97.3	Very high	32 Å²	32	38.8 Å²	38.8	15%	0.15	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	151.9	179.2	73.8	-75.8	-173.5	0	0	112.4	G111 H112 K133 N137 D159 S161	G111-E135 CarbonylContact C-O 3.16Å; G111-E135 WeakPolarHBondContact CA-O 3.41Å; H112-E135 PolarHBondContact N-O 3.5Å; K133-E135 VanDerWaalsContact CB-OE2 3.25Å; K133-E135 WeakPolarHBondContact CB-OE2 3.35Å; E135-N137 VanDerWaalsContact C-N 3.26Å; E135-N137 PolarHBondContact O-N 3.48Å; E135-N137 PolarHBondContact O-ND2 3.5Å; E135-D159 PolarHBondContact N-O 3.46Å; E135-S161 CarbonylContact C-O 3.2Å; E135-S161 WeakPolarHBondContact CA-O 3.26Å; E135-S161 WeakPolarHBondContact CB-OG 3.09Å
136	G	98.8	Very high	97.4	Very high	18 Å²	18	38.3 Å²	38.3	19%	0.186	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	26.7	172.8	0	0	0	0	0	114.6	H112 S161 D162	H112-G136 WeakPolarHBondContact CA-O 3.38Å; G136-S161 PolarHBondContact N-O 2.87Å; G136-D162 CarbonylContact C-O 3.51Å; G136-D162 WeakPolarHBondContact CA-O 3.48Å; G136-D162 PolarHBondContact N-O 2.98Å
137	N	98.9	Very high	97.5	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.021	21%	0.211	C	C	.	.	S	Bend	trans	-102	-167.2	175.9	-85.4	-79.8	0	0	0	110.9	L110 N113 I115 L134 E135 V139 N163	L110-N137 PolarHBondContact O-ND2 3.23Å; N113-N137 VanDerWaalsContact CA-OD1 3.29Å; N113-N137 WeakPolarHBondContact CA-OD1 3.49Å; N113-N137 WeakPolarHBondContact CB-OD1 3.37Å; N113-N137 PolarHBondContact N-OD1 3.25Å; N113-N137 PolarHBondContact O-OD1 2.86Å; I115-N137 HydrophobicContact CB-CB 4.32Å; I115-N137 VanDerWaalsContact CB-OD1 3.3Å; I115-N137 WeakPolarHBondContact CB-OD1 3.31Å; I115-N137 WeakPolarHBondContact CG1-OD1 3.45Å; I115-N137 PolarHBondContact N-OD1 3.29Å; I115-N137 VanDerWaalsContact N-OD1 3.1Å; L134-N137 WeakPolarHBondContact O-CB 3.41Å; L134-N137 PolarHBondContact O-ND2 3.44Å; E135-N137 VanDerWaalsContact C-N 3.26Å; E135-N137 PolarHBondContact O-N 3.48Å; E135-N137 PolarHBondContact O-ND2 3.5Å; N137-V139 HydrophobicContact CB-CG2 4.38Å; N137-N163 WeakPolarHBondContact CA-OD1 3.44Å; N137-N163 WeakPolarHBondContact CB-OD1 3.45Å; N137-N163 PolarHBondContact O-OD1 2.93Å
138	L	98.8	Very high	97.3	Very high	72 Å²	72	32.9 Å²	32.9	38%	0.377	19%	0.188	S	C	.	.			trans	-113.6	21	-175.9	-57.2	176.2	0	0	0	112.3	H114 I115 N116 T140 N163 L164	H114-L138 HydrophobicContact CB-CD1 4.26Å; I115-L138 CarbonylContact O-C 3.16Å; I115-L138 VanDerWaalsContact O-C 3.28Å; I115-L138 WeakPolarHBondContact O-CA 3.32Å; I115-L138 PolarHBondContact O-N 2.9Å; N116-L138 WeakPolarHBondContact CA-O 3.37Å; N116-L138 HydrophobicContact CB-CB 4.11Å; L138-T140 PolarHBondContact O-N 3.36Å; L138-N163 PolarHBondContact N-OD1 2.93Å; L138-L164 HydrophobicContact CB-CD1 4.36Å; L138-L164 HydrophobicContact CD2-CD1 4.06Å
139	V	98.8	Very high	96.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.			trans	-65.6	126.7	-174.3	-178.2	0	0	0	0	109.7	I115 N116 I118 N137 L142 N163 L164 I165	I115-V139 HydrophobicContact CG2-CG2 4.36Å; I115-V139 PolarHBondContact O-N 3.06Å; N116-V139 WeakPolarHBondContact O-CA 3.26Å; I118-V139 HydrophobicContact CD1-CG1 4.24Å; I118-V139 HydrophobicContact CD1-CG2 4.26Å; I118-V139 HydrophobicContact CG1-CG1 4.25Å; I118-V139 HydrophobicContact CG1-CG2 4.02Å; N137-V139 HydrophobicContact CB-CG2 4.38Å; V139-L142 HydrophobicContact CG1-CD2 4.22Å; V139-N163 HydrophobicContact CB-CB 4.42Å; V139-N163 WeakPolarHBondContact CB-OD1 3.47Å; V139-N163 WeakPolarHBondContact CG2-OD1 3.28Å; V139-N163 PolarHBondContact N-OD1 2.99Å; V139-L164 CarbonylContact O-C 3.53Å; V139-L164 VanDerWaalsContact O-CA 3.29Å; V139-L164 WeakPolarHBondContact O-CA 3.11Å; V139-L164 PolarHBondContact O-N 3.09Å; V139-I165 HydrophobicContact CB-CG1 4.29Å; V139-I165 HydrophobicContact CG1-CD1 4.48Å; V139-I165 HydrophobicContact CG1-CG1 4.1Å; V139-I165 WeakPolarHBondContact O-CG1 3.29Å; V139-I165 PolarHBondContact O-N 3.23Å
140	T	98.4	Very high	96.4	Very high	58 Å²	58	40.7 Å²	40.7	36%	0.356	23%	0.225	S	C	.	.			trans	-104	-27	-178.6	59.6	0	0	0	0	113.9	N116 L138 L164 I165 D166	N116-T140 PolarHBondContact O-N 2.87Å; L138-T140 PolarHBondContact O-N 3.36Å; T140-L164 WeakPolarHBondContact CA-O 3.34Å; T140-L164 HydrophobicContact CG2-CB 4.05Å; T140-I165 CarbonylContact O-C 3.56Å; T140-I165 VanDerWaalsContact O-CA 3.29Å; T140-I165 WeakPolarHBondContact O-CA 3.25Å; T140-D166 PolarHBondContact O-N 2.91Å
141	R	98.1	Very high	96.1	Very high	117 Å²	117	38.9 Å²	38.9	44%	0.442	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	139.8	-172.6	-55.7	-174.2	72.1	135.7	3.8	111.8	F167	R141-F167 HydrophobicContact CB-CB 4.49Å; R141-F167 HydrophobicContact CB-CD1 4.34Å; R141-F167 HydrophobicContact CG-CB 4.13Å; R141-F167 VanDerWaalsContact NH2-CG 3.28Å
142	L	98.2	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.6	167.1	-58.8	179	0	0	0	109.3	I118 V139 F147 L160 I165 F167 L168 D169 S172 F173 L184	I118-L142 HydrophobicContact CD1-CD2 4.01Å; V139-L142 HydrophobicContact CG1-CD2 4.22Å; L142-F147 HydrophobicContact CD2-CE2 4.21Å; L142-F147 HydrophobicContact CD2-CZ 4.46Å; L142-L160 HydrophobicContact CD1-CD1 3.91Å; L142-L160 HydrophobicContact CD2-CD1 4.41Å; L142-I165 HydrophobicContact CD1-CD1 4.12Å; L142-I165 HydrophobicContact CD1-CG2 4.47Å; L142-I165 HydrophobicContact CD2-CD1 4.41Å; L142-I165 HydrophobicContact CG-CD1 4.19Å; L142-I165 HydrophobicContact CG-CG2 4.2Å; L142-F167 PolarHBondContact N-O 2.93Å; L142-L168 HydrophobicContact CB-CG 4.48Å; L142-L168 HydrophobicContact CD1-CD1 4.22Å; L142-L168 HydrophobicContact CD1-CG 4.45Å; L142-D169 PolarHBondContact O-N 2.94Å; L142-D169 VanDerWaalsContact O-N 3.09Å; L142-S172 PolarHBondContact O-OG 3.14Å; L142-S172 VanDerWaalsContact O-OG 3.04Å; L142-F173 HydrophobicContact CD1-CE1 3.85Å; L142-F173 HydrophobicContact CD1-CZ 3.71Å; L142-L184 HydrophobicContact CD1-CD2 4.15Å
143	N	96.1	Very high	95.6	Very high	69 Å²	69	44.5 Å²	44.5	37%	0.369	23%	0.234	S	C	.	.			trans	-119.1	167.5	-178.3	-65	-50.8	0	0	0	109.3	G145 S146	N143-G145 PolarHBondContact O-N 3.29Å; N143-S146 PolarHBondContact N-OG 3.39Å; N143-S146 WeakPolarHBondContact O-CB 3.15Å; N143-S146 PolarHBondContact O-N 3.03Å; N143-S146 PolarHBondContact O-OG 2.91Å
144	P	94.5	Very high	95.5	Very high	62 Å²	62	42.6 Å²	42.6	40%	0.403	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.3	177.6	-24.9	34.8	0	0	0	114.6	D169 N171	P144-D169 HydrophobicContact CG-CB 4.21Å; P144-D169 WeakPolarHBondContact CG-OD1 3.32Å; P144-N171 HydrophobicContact CB-CB 4.06Å; P144-N171 HydrophobicContact CG-CB 4.05Å
145	G	92.6	Very high	95.5	Very high	47 Å²	47	42.5 Å²	42.5	49%	0.485	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	8.3	177.5	0	0	0	0	0	114.9	A120 N143	A120-G145 VanDerWaalsContact CB-O 3.26Å; A120-G145 WeakPolarHBondContact CB-O 3.35Å; A120-G145 PolarHBondContact N-O 2.86Å; N143-G145 PolarHBondContact O-N 3.29Å
146	S	95.9	Very high	95.5	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.014	24%	0.239	C	C	.	.	S	Bend	trans	-70.1	-41.8	177.9	-68	0	0	0	0	111.6	I118 Q119 A120 N143	I118-S146 WeakPolarHBondContact CG2-O 3.4Å; Q119-S146 CarbonylContact C-O 3.58Å; A120-S146 PolarHBondContact N-O 3.24Å; N143-S146 PolarHBondContact N-OG 3.39Å; N143-S146 WeakPolarHBondContact O-CB 3.15Å; N143-S146 PolarHBondContact O-N 3.03Å; N143-S146 PolarHBondContact O-OG 2.91Å
147	F	95.7	Very high	95.5	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.018	25%	0.245	C	C	.	.	S	Bend	trans	-118.2	140.5	179.3	-58	-69	0	0	0	111.4	I118 L132 L142 L149 F152 L158 L160 F173 L176	I118-F147 HydrophobicContact CD1-CE1 4.14Å; I118-F147 HydrophobicContact CD1-CZ 3.83Å; I118-F147 HydrophobicContact CG2-CE1 4.24Å; L132-F147 HydrophobicContact CD2-CE1 4.1Å; L142-F147 HydrophobicContact CD2-CE2 4.21Å; L142-F147 HydrophobicContact CD2-CZ 4.46Å; F147-L149 PolarHBondContact O-N 3.38Å; F147-F152 HydrophobicContact CB-CD2 4.21Å; F147-F152 AromaticContact CD1-CD2 3.94Å; F147-F152 HydrophobicContact CD1-CD2 3.94Å; F147-F152 AromaticContact CD1-CE2 3.8Å; F147-F152 HydrophobicContact CD1-CE2 3.8Å; F147-F152 HydrophobicContact CG-CD2 4.48Å; F147-L158 HydrophobicContact CE1-CD1 4.17Å; F147-L158 HydrophobicContact CE1-CD2 4.1Å; F147-L158 HydrophobicContact CE2-CD2 3.97Å; F147-L158 HydrophobicContact CZ-CD1 4.21Å; F147-L158 HydrophobicContact CZ-CD2 3.65Å; F147-L160 HydrophobicContact CE2-CD1 4.44Å; F147-L160 HydrophobicContact CZ-CD1 4.06Å; F147-L160 HydrophobicContact CZ-CD2 4.48Å; F147-F173 HydrophobicContact CD2-CD1 4.28Å; F147-F173 HydrophobicContact CE2-CD1 4.19Å; F147-F173 HydrophobicContact CE2-CE1 4.01Å; F147-L176 HydrophobicContact CB-CD2 3.93Å; F147-L176 HydrophobicContact CB-CG 4.47Å; F147-L176 HydrophobicContact CD2-CD1 4.14Å; F147-L176 HydrophobicContact CG-CD1 4.35Å; F147-L176 HydrophobicContact CG-CD2 4.2Å
148	P	90.2	Very high	95.5	Very high	10 Å²	10	45.6 Å²	45.6	7%	0.065	24%	0.244	C	C	.	.			trans	-71.4	125.6	-177.9	29.3	-35.3	0	0	0	111.9	A120 F123 N150 D151 F152	A120-P148 HydrophobicContact CB-CB 4.09Å; F123-P148 HydrophobicContact CB-CG 4.27Å; P148-N150 VanDerWaalsContact C-N 3.26Å; P148-N150 PolarHBondContact O-N 3.21Å; P148-D151 HydrophobicContact CB-CB 3.95Å; P148-D151 HydrophobicContact CG-CB 3.86Å; P148-F152 HydrophobicContact CG-CB 4.24Å; P148-F152 HydrophobicContact CG-CD1 3.57Å; P148-F152 HydrophobicContact CG-CD2 4.04Å; P148-F152 HydrophobicContact CG-CE1 3.89Å; P148-F152 HydrophobicContact CG-CE2 4.32Å; P148-F152 HydrophobicContact CG-CG 3.65Å; P148-F152 HydrophobicContact CG-CZ 4.26Å; P148-F152 PolarHBondContact O-N 2.84Å
149	L	88.7	Confident	95.5	Very high	80 Å²	80	44 Å²	44	42%	0.419	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.7	-177.9	-76.3	167.1	0	0	0	114.9	F147 R174	F147-L149 PolarHBondContact O-N 3.38Å; L149-R174 HydrophobicContact CD2-CB 3.79Å; L149-R174 HydrophobicContact CD2-CG 3.64Å
150	N	88.4	Confident	95.5	Very high	108 Å²	108	44 Å²	44	58%	0.578	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-14.6	-172.7	-69.3	-42	0	0	0	114.2	P148 R153	P148-N150 VanDerWaalsContact C-N 3.26Å; P148-N150 PolarHBondContact O-N 3.21Å; N150-R153 PolarHBondContact OD1-NH2 3.22Å
151	D	91.4	Very high	95.5	Very high	24 Å²	24	41.8 Å²	41.8	13%	0.128	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-33.6	-177	-64.2	-44.1	0	0	0	112	G125 K127 P148 R153	G125-D151 PolarHBondContact N-OD2 2.77Å; G125-D151 VanDerWaalsContact N-OD2 3.14Å; K127-D151 WeakPolarHBondContact CA-O 3.45Å; K127-D151 WeakPolarHBondContact CE-OD1 3.36Å; K127-D151 HydrophobicContact CG-CB 4.32Å; K127-D151 WeakPolarHBondContact CG-OD1 3.4Å; P148-D151 HydrophobicContact CB-CB 3.95Å; P148-D151 HydrophobicContact CG-CB 3.86Å; D151-R153 PolarHBondContact O-N 3.33Å; D151-R153 VanDerWaalsContact O-N 3.16Å
152	F	94.3	Very high	95.6	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-88.6	28.5	-179.3	-75.5	6.5	0	0	0	114.3	F123 L129 L132 F147 P148 S154 L155 L176	F123-F152 HydrophobicContact CB-CE1 3.5Å; F123-F152 VanDerWaalsContact CB-CE1 3.5Å; F123-F152 HydrophobicContact CB-CZ 3.54Å; F123-F152 HydrophobicContact CD1-CE1 4.44Å; F123-F152 AromaticContact CD1-CZ 3.87Å; F123-F152 HydrophobicContact CD1-CZ 3.87Å; F123-F152 HydrophobicContact CD2-CE1 4.36Å; F123-F152 HydrophobicContact CD2-CE2 4.05Å; F123-F152 AromaticContact CD2-CZ 3.52Å; F123-F152 HydrophobicContact CD2-CZ 3.52Å; F123-F152 HydrophobicContact CE1-CZ 4.43Å; F123-F152 HydrophobicContact CE2-CE2 4.42Å; F123-F152 HydrophobicContact CE2-CZ 4.13Å; F123-F152 AromaticContact CG-CE1 3.88Å; F123-F152 HydrophobicContact CG-CE1 3.88Å; F123-F152 HydrophobicContact CG-CE2 4.32Å; F123-F152 AromaticContact CG-CZ 3.36Å; F123-F152 HydrophobicContact CG-CZ 3.36Å; L129-F152 HydrophobicContact CB-CE1 4.39Å; L129-F152 HydrophobicContact CD2-CD1 4.37Å; L129-F152 HydrophobicContact CD2-CE1 3.61Å; L129-F152 HydrophobicContact CD2-CE2 4.31Å; L129-F152 HydrophobicContact CD2-CZ 3.58Å; L132-F152 HydrophobicContact CD2-CE2 3.65Å; L132-F152 HydrophobicContact CD2-CZ 4.1Å; F147-F152 HydrophobicContact CB-CD2 4.21Å; F147-F152 AromaticContact CD1-CD2 3.94Å; F147-F152 HydrophobicContact CD1-CD2 3.94Å; F147-F152 AromaticContact CD1-CE2 3.8Å; F147-F152 HydrophobicContact CD1-CE2 3.8Å; F147-F152 HydrophobicContact CG-CD2 4.48Å; P148-F152 HydrophobicContact CG-CB 4.24Å; P148-F152 HydrophobicContact CG-CD1 3.57Å; P148-F152 HydrophobicContact CG-CD2 4.04Å; P148-F152 HydrophobicContact CG-CE1 3.89Å; P148-F152 HydrophobicContact CG-CE2 4.32Å; P148-F152 HydrophobicContact CG-CG 3.65Å; P148-F152 HydrophobicContact CG-CZ 4.26Å; P148-F152 PolarHBondContact O-N 2.84Å; F152-S154 PolarHBondContact O-N 3.43Å; F152-L155 HydrophobicContact CB-CB 4.14Å; F152-L155 HydrophobicContact CD2-CD2 3.94Å; F152-L155 HydrophobicContact CE2-CD2 4.48Å; F152-L155 HydrophobicContact CG-CD2 4.48Å; F152-L155 WeakPolarHBondContact O-CB 3.31Å; F152-L155 PolarHBondContact O-N 3.39Å; F152-L176 HydrophobicContact CB-CD2 3.61Å; F152-L176 HydrophobicContact CD2-CD2 3.89Å; F152-L176 HydrophobicContact CG-CD2 4.29Å
153	R	94	Very high	95.6	Very high	137 Å²	137	40.1 Å²	40.1	52%	0.517	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-69.3	-18.1	179.5	-70	-170.9	173.8	-134	4.2	113.7	N150 D151 V177 S178	N150-R153 PolarHBondContact OD1-NH2 3.22Å; D151-R153 PolarHBondContact O-N 3.33Å; D151-R153 VanDerWaalsContact O-N 3.16Å; R153-V177 HydrophobicContact CB-CG2 4.36Å; R153-V177 HydrophobicContact CG-CG2 4.24Å; R153-S178 WeakPolarHBondContact O-CB 3.31Å; R153-S178 PolarHBondContact O-OG 3.38Å
154	S	97	Very high	95.7	Very high	47 Å²	47	39 Å²	39	33%	0.329	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-97	-7.5	176.9	-46.8	0	0	0	0	112.7	K127 L129 L130 F152 E156	K127-S154 PolarHBondContact O-OG 2.93Å; L129-S154 CarbonylContact O-C 3.47Å; L130-S154 WeakPolarHBondContact CD2-O 3.46Å; F152-S154 PolarHBondContact O-N 3.43Å; S154-E156 WeakPolarHBondContact O-CG 3.46Å; S154-E156 PolarHBondContact O-N 3.14Å
155	L	98.4	Very high	95.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.			trans	-66.6	120.7	-173.2	-168.3	76.5	0	0	0	110.1	L129 L132 F152 L158 L176 S178 L179	L129-L155 HydrophobicContact CB-CD1 4.32Å; L129-L155 HydrophobicContact CD2-CD1 3.97Å; L129-L155 HydrophobicContact CG-CD1 3.9Å; L129-L155 WeakPolarHBondContact O-CA 3.33Å; L129-L155 PolarHBondContact O-N 3.05Å; L129-L155 VanDerWaalsContact O-N 3.08Å; L132-L155 HydrophobicContact CB-CD1 3.85Å; L132-L155 HydrophobicContact CB-CD2 4.39Å; F152-L155 HydrophobicContact CB-CB 4.14Å; F152-L155 HydrophobicContact CD2-CD2 3.94Å; F152-L155 HydrophobicContact CE2-CD2 4.48Å; F152-L155 HydrophobicContact CG-CD2 4.48Å; F152-L155 WeakPolarHBondContact O-CB 3.31Å; F152-L155 PolarHBondContact O-N 3.39Å; L155-L158 HydrophobicContact CD2-CB 4.22Å; L155-L176 HydrophobicContact CD2-CD2 3.9Å; L155-S178 CarbonylContact O-C 3.57Å; L155-S178 VanDerWaalsContact O-C 3.25Å; L155-L179 HydrophobicContact CD2-CD1 4.03Å; L155-L179 HydrophobicContact CG-CD1 4.08Å; L155-L179 VanDerWaalsContact O-CA 3.26Å; L155-L179 WeakPolarHBondContact O-CA 3.42Å; L155-L179 PolarHBondContact O-N 3.05Å
156	E	98.6	Very high	96.2	Very high	66 Å²	66	37.7 Å²	37.7	31%	0.308	20%	0.196	S	C	.	.			trans	-105.3	-31.8	-178.4	-59	-159.2	138.2	0	0	112.1	L130 S154 R180 S181	L130-E156 PolarHBondContact O-N 3.13Å; S154-E156 WeakPolarHBondContact O-CG 3.46Å; S154-E156 PolarHBondContact O-N 3.14Å; E156-R180 HydrophobicContact CB-CG 4.28Å; E156-R180 WeakPolarHBondContact O-CA 3.27Å; E156-R180 PolarHBondContact O-N 3.45Å; E156-R180 IonicContact OE1-CZ 3.71Å; E156-R180 IonicContact OE1-NE 2.92Å; E156-R180 PolarHBondContact OE1-NE 3.4Å; E156-R180 IonicContact OE1-NH2 3.58Å; E156-R180 IonicContact OE2-NE 3.8Å; E156-S181 PolarHBondContact O-N 3.29Å
157	T	98.8	Very high	96.3	Very high	52 Å²	52	41 Å²	41	32%	0.319	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126	-178.1	-57	0	0	0	0	111.1	L130 S131 L132 S181	L130-T157 PolarHBondContact O-N 3.17Å; S131-T157 WeakPolarHBondContact CA-O 3.34Å; L132-T157 PolarHBondContact N-O 3.34Å; T157-S181 WeakPolarHBondContact CA-O 3.18Å
158	L	98.8	Very high	96.4	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	117.9	173.7	177.4	57.6	0	0	0	109.7	L132 F147 L155 L160 F173 L176 L179 S181 L182 D183	L132-L158 HydrophobicContact CB-CD1 4.09Å; L132-L158 HydrophobicContact CD2-CD1 4Å; L132-L158 HydrophobicContact CG-CD1 4.01Å; L132-L158 WeakPolarHBondContact O-CA 3.39Å; F147-L158 HydrophobicContact CE1-CD1 4.17Å; F147-L158 HydrophobicContact CE1-CD2 4.1Å; F147-L158 HydrophobicContact CE2-CD2 3.97Å; F147-L158 HydrophobicContact CZ-CD1 4.21Å; F147-L158 HydrophobicContact CZ-CD2 3.65Å; L155-L158 HydrophobicContact CD2-CB 4.22Å; L158-L160 HydrophobicContact CD1-CD1 4.29Å; L158-L160 HydrophobicContact CD1-CG 4.01Å; L158-L160 HydrophobicContact CD2-CD1 3.79Å; L158-L160 HydrophobicContact CD2-CG 4.39Å; L158-L160 HydrophobicContact CG-CD1 3.93Å; L158-L160 HydrophobicContact CG-CG 4.01Å; L158-F173 HydrophobicContact CD2-CE1 4.36Å; L158-L176 HydrophobicContact CD2-CD1 3.58Å; L158-L179 HydrophobicContact CB-CD1 3.78Å; L158-L179 HydrophobicContact CB-CD2 4.31Å; L158-S181 PolarHBondContact N-O 3.44Å; L158-L182 HydrophobicContact CB-CD1 4.14Å; L158-L182 HydrophobicContact CD2-CD1 3.94Å; L158-L182 HydrophobicContact CG-CD1 4.01Å; L158-L182 WeakPolarHBondContact O-CA 3.34Å; L158-D183 PolarHBondContact O-N 2.93Å
159	D	98.9	Very high	96.7	Very high	39 Å²	39	42.3 Å²	42.3	21%	0.209	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	114.8	173.6	-164.7	-19	0	0	0	109.8	L132 L134 E135 S161	L132-D159 PolarHBondContact O-N 2.93Å; L134-D159 CarbonylContact C-O 3.6Å; L134-D159 WeakPolarHBondContact CA-O 3.25Å; L134-D159 WeakPolarHBondContact CB-O 3.11Å; L134-D159 PolarHBondContact N-O 2.9Å; E135-D159 PolarHBondContact N-O 3.46Å; D159-S161 VanDerWaalsContact OD1-CB 3.26Å; D159-S161 WeakPolarHBondContact OD1-CB 3.18Å; D159-S161 PolarHBondContact OD1-N 3.28Å; D159-S161 PolarHBondContact OD1-OG 2.98Å
160	L	98.8	Very high	97.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.218	C	C	.	.			trans	-122.3	18.8	175.3	-71.6	164	0	0	0	110.7	I118 L134 L142 F147 L158 N163 I165 F173 L182 D183 L184 N187	I118-L160 HydrophobicContact CD1-CD2 3.78Å; L134-L160 HydrophobicContact CB-CD2 3.89Å; L134-L160 HydrophobicContact CD1-CD2 3.98Å; L142-L160 HydrophobicContact CD1-CD1 3.91Å; L142-L160 HydrophobicContact CD2-CD1 4.41Å; F147-L160 HydrophobicContact CE2-CD1 4.44Å; F147-L160 HydrophobicContact CZ-CD1 4.06Å; F147-L160 HydrophobicContact CZ-CD2 4.48Å; L158-L160 HydrophobicContact CD1-CD1 4.29Å; L158-L160 HydrophobicContact CD1-CG 4.01Å; L158-L160 HydrophobicContact CD2-CD1 3.79Å; L158-L160 HydrophobicContact CD2-CG 4.39Å; L158-L160 HydrophobicContact CG-CD1 3.93Å; L158-L160 HydrophobicContact CG-CG 4.01Å; L160-N163 PolarHBondContact O-ND2 2.6Å; L160-I165 HydrophobicContact CB-CD1 4.09Å; L160-F173 HydrophobicContact CD1-CE1 4.47Å; L160-L182 HydrophobicContact CD1-CD1 4.48Å; L160-D183 CarbonylContact C-O 3.49Å; L160-D183 WeakPolarHBondContact CA-O 3.29Å; L160-D183 WeakPolarHBondContact CB-O 3.47Å; L160-D183 PolarHBondContact N-O 3.2Å; L160-L184 HydrophobicContact CB-CD2 3.95Å; L160-L184 HydrophobicContact CD1-CD2 3.89Å; L160-N187 PolarHBondContact O-ND2 3.09Å
161	S	98.7	Very high	97.5	Very high	11 Å²	11	41 Å²	41	8%	0.077	20%	0.201	C	C	.	.			trans	-63.6	162.1	179.5	63	0	0	0	0	111.8	E135 G136 D159 N163 D183 S185	E135-S161 CarbonylContact C-O 3.2Å; E135-S161 WeakPolarHBondContact CA-O 3.26Å; E135-S161 WeakPolarHBondContact CB-OG 3.09Å; G136-S161 PolarHBondContact N-O 2.87Å; D159-S161 VanDerWaalsContact OD1-CB 3.26Å; D159-S161 WeakPolarHBondContact OD1-CB 3.18Å; D159-S161 PolarHBondContact OD1-N 3.28Å; D159-S161 PolarHBondContact OD1-OG 2.98Å; S161-N163 PolarHBondContact O-N 2.86Å; S161-N163 VanDerWaalsContact O-N 3.15Å; S161-N163 PolarHBondContact O-ND2 3.47Å; S161-D183 PolarHBondContact N-O 3.3Å; S161-S185 CarbonylContact C-O 3.41Å; S161-S185 WeakPolarHBondContact CA-O 3.42Å
162	D	98.6	Very high	97.7	Very high	77 Å²	77	40 Å²	40	41%	0.412	20%	0.195	S	C	.	.	S	Bend	trans	53.8	41.7	175.7	-74.9	-64.2	0	0	0	113.2	G136 S185 R186	G136-D162 CarbonylContact C-O 3.51Å; G136-D162 WeakPolarHBondContact CA-O 3.48Å; G136-D162 PolarHBondContact N-O 2.98Å; D162-S185 PolarHBondContact N-O 3Å; D162-S185 VanDerWaalsContact N-O 3.07Å; D162-R186 WeakPolarHBondContact CA-O 3.07Å; D162-R186 HydrophobicContact CB-CB 4.46Å; D162-R186 PolarHBondContact N-O 3.13Å; D162-R186 WeakPolarHBondContact OD1-CB 3.37Å; D162-R186 WeakPolarHBondContact OD1-CD 3.31Å; D162-R186 WeakPolarHBondContact OD2-CD 3.38Å
163	N	98.9	Very high	97.8	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.027	20%	0.195	C	C	.	.	S	Bend	trans	-113.9	-168.5	174.4	-87.5	-89.8	0	0	0	110.1	L134 N137 L138 V139 L160 S161 I165 R186 N187	L134-N163 PolarHBondContact O-ND2 3.01Å; N137-N163 WeakPolarHBondContact CA-OD1 3.44Å; N137-N163 WeakPolarHBondContact CB-OD1 3.45Å; N137-N163 PolarHBondContact O-OD1 2.93Å; L138-N163 PolarHBondContact N-OD1 2.93Å; V139-N163 HydrophobicContact CB-CB 4.42Å; V139-N163 WeakPolarHBondContact CB-OD1 3.47Å; V139-N163 WeakPolarHBondContact CG2-OD1 3.28Å; V139-N163 PolarHBondContact N-OD1 2.99Å; L160-N163 PolarHBondContact O-ND2 2.6Å; S161-N163 PolarHBondContact O-N 2.86Å; S161-N163 VanDerWaalsContact O-N 3.15Å; S161-N163 PolarHBondContact O-ND2 3.47Å; N163-I165 HydrophobicContact CB-CD1 4.2Å; N163-I165 HydrophobicContact CB-CG1 4.06Å; N163-R186 PolarHBondContact N-O 3.11Å; N163-N187 WeakPolarHBondContact CA-OD1 3.18Å; N163-N187 WeakPolarHBondContact CB-OD1 3.35Å; N163-N187 PolarHBondContact O-OD1 3.02Å
164	L	98.8	Very high	97.9	Very high	47 Å²	47	39.7 Å²	39.7	25%	0.246	19%	0.194	C	C	.	.			trans	-113.4	24.1	-178	-54.5	-179.8	0	0	0	111.8	L138 V139 T140 D166 N187	L138-L164 HydrophobicContact CB-CD1 4.36Å; L138-L164 HydrophobicContact CD2-CD1 4.06Å; V139-L164 CarbonylContact O-C 3.53Å; V139-L164 VanDerWaalsContact O-CA 3.29Å; V139-L164 WeakPolarHBondContact O-CA 3.11Å; V139-L164 PolarHBondContact O-N 3.09Å; T140-L164 WeakPolarHBondContact CA-O 3.34Å; T140-L164 HydrophobicContact CG2-CB 4.05Å; L164-D166 PolarHBondContact O-N 2.99Å; L164-D166 VanDerWaalsContact O-N 3.14Å; L164-N187 PolarHBondContact N-OD1 2.96Å
165	I	98.8	Very high	97.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.18	C	C	.	.			trans	-67.5	114.8	-168.5	-57.6	165.8	0	0	0	109.4	V139 T140 L142 L160 N163 L184 N187 R188 L189	V139-I165 HydrophobicContact CB-CG1 4.29Å; V139-I165 HydrophobicContact CG1-CD1 4.48Å; V139-I165 HydrophobicContact CG1-CG1 4.1Å; V139-I165 WeakPolarHBondContact O-CG1 3.29Å; V139-I165 PolarHBondContact O-N 3.23Å; T140-I165 CarbonylContact O-C 3.56Å; T140-I165 VanDerWaalsContact O-CA 3.29Å; T140-I165 WeakPolarHBondContact O-CA 3.25Å; L142-I165 HydrophobicContact CD1-CD1 4.12Å; L142-I165 HydrophobicContact CD1-CG2 4.47Å; L142-I165 HydrophobicContact CD2-CD1 4.41Å; L142-I165 HydrophobicContact CG-CD1 4.19Å; L142-I165 HydrophobicContact CG-CG2 4.2Å; L160-I165 HydrophobicContact CB-CD1 4.09Å; N163-I165 HydrophobicContact CB-CD1 4.2Å; N163-I165 HydrophobicContact CB-CG1 4.06Å; I165-L184 HydrophobicContact CD1-CD2 4Å; I165-N187 HydrophobicContact CB-CB 4.2Å; I165-N187 VanDerWaalsContact CB-OD1 3.23Å; I165-N187 WeakPolarHBondContact CB-OD1 3.43Å; I165-N187 WeakPolarHBondContact CG1-OD1 3.49Å; I165-N187 PolarHBondContact N-OD1 3.22Å; I165-R188 CarbonylContact O-C 3.55Å; I165-R188 VanDerWaalsContact O-CA 3.28Å; I165-R188 WeakPolarHBondContact O-CA 3.3Å; I165-R188 PolarHBondContact O-N 3.04Å; I165-L189 HydrophobicContact CG2-CD2 3.9Å; I165-L189 PolarHBondContact O-N 2.91Å; I165-L189 VanDerWaalsContact O-N 3.08Å
166	D	98.1	Very high	97.7	Very high	81 Å²	81	37.6 Å²	37.6	43%	0.433	18%	0.18	S	C	.	.			trans	-110.8	-13.1	177.9	64.5	11	0	0	0	112.9	T140 L164 R188	T140-D166 PolarHBondContact O-N 2.91Å; L164-D166 PolarHBondContact O-N 2.99Å; L164-D166 VanDerWaalsContact O-N 3.14Å; D166-R188 HydrophobicContact CB-CB 4.08Å
167	F	98	Very high	97.6	Very high	70 Å²	70	36.9 Å²	36.9	31%	0.307	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	134.2	-176.5	176.4	-92.4	0	0	0	112.1	R141 L142 D169	R141-F167 HydrophobicContact CB-CB 4.49Å; R141-F167 HydrophobicContact CB-CD1 4.34Å; R141-F167 HydrophobicContact CG-CB 4.13Å; R141-F167 VanDerWaalsContact NH2-CG 3.28Å; L142-F167 PolarHBondContact N-O 2.93Å; F167-D169 HydrophobicContact CE1-CB 4.04Å; F167-D169 HydrophobicContact CZ-CB 4.32Å
168	L	97.5	Very high	97.5	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	114.9	178	-160.3	153	0	0	0	109.8	L142 F173 L184 L189 V192 P193 A196	L142-L168 HydrophobicContact CB-CG 4.48Å; L142-L168 HydrophobicContact CD1-CD1 4.22Å; L142-L168 HydrophobicContact CD1-CG 4.45Å; L168-F173 HydrophobicContact CD1-CE2 3.63Å; L168-F173 HydrophobicContact CD1-CZ 3.81Å; L168-F173 HydrophobicContact CD2-CE2 4.07Å; L168-F173 HydrophobicContact CG-CE2 4.27Å; L168-L184 HydrophobicContact CD1-CD1 4.04Å; L168-L189 HydrophobicContact CB-CD2 4.24Å; L168-V192 HydrophobicContact CD1-CG1 4.26Å; L168-V192 HydrophobicContact CD1-CG2 4.5Å; L168-V192 HydrophobicContact CD2-CG1 4.13Å; L168-P193 VanDerWaalsContact O-CD 3.25Å; L168-P193 WeakPolarHBondContact O-CD 3.48Å; L168-P193 VanDerWaalsContact O-CG 3.31Å; L168-P193 WeakPolarHBondContact O-CG 3.19Å; L168-A196 HydrophobicContact CD2-CB 3.24Å
169	D	97.6	Very high	97.5	Very high	37 Å²	37	36 Å²	36	20%	0.198	18%	0.176	C	C	.	.			trans	-73.5	146.9	173.5	-171.8	-88.1	0	0	0	111.9	L142 P144 F167 N171 S172	L142-D169 PolarHBondContact O-N 2.94Å; L142-D169 VanDerWaalsContact O-N 3.09Å; P144-D169 HydrophobicContact CG-CB 4.21Å; P144-D169 WeakPolarHBondContact CG-OD1 3.32Å; F167-D169 HydrophobicContact CE1-CB 4.04Å; F167-D169 HydrophobicContact CZ-CB 4.32Å; D169-N171 PolarHBondContact O-N 2.85Å; D169-N171 PolarHBondContact OD1-N 3.17Å; D169-S172 WeakPolarHBondContact CA-OG 3.37Å; D169-S172 PolarHBondContact N-OG 2.96Å; D169-S172 VanDerWaalsContact O-CB 3.26Å; D169-S172 WeakPolarHBondContact O-CB 3.32Å; D169-S172 PolarHBondContact O-N 3.22Å; D169-S172 PolarHBondContact O-OG 2.64Å
170	R	96.8	Very high	97.4	Very high	121 Å²	121	39.4 Å²	39.4	46%	0.457	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-23.2	178.3	80.2	-176.4	78.1	-110.1	-0.7	114.6	P193 E195 A196	R170-P193 HydrophobicContact CB-CB 4.06Å; R170-P193 HydrophobicContact CB-CG 4.44Å; R170-E195 HydrophobicContact CB-CB 4.32Å; R170-E195 IonicContact NH1-OE1 3.63Å; R170-E195 PolarHBondContact NH1-OE1 3.31Å; R170-E195 IonicContact NH1-OE2 2.93Å; R170-A196 VanDerWaalsContact O-CA 3.32Å; R170-A196 WeakPolarHBondContact O-CA 3.12Å
171	N	96.5	Very high	97.4	Very high	39 Å²	39	41 Å²	41	21%	0.209	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	8.7	178.2	-60.7	-75.9	0	0	0	113.8	P144 D169 F173 R174 Y199	P144-N171 HydrophobicContact CB-CB 4.06Å; P144-N171 HydrophobicContact CG-CB 4.05Å; D169-N171 PolarHBondContact O-N 2.85Å; D169-N171 PolarHBondContact OD1-N 3.17Å; N171-F173 PolarHBondContact O-N 2.95Å; N171-F173 VanDerWaalsContact O-N 3.11Å; N171-R174 HydrophobicContact CB-CB 4.34Å; N171-R174 WeakPolarHBondContact O-CB 3.2Å; N171-R174 PolarHBondContact O-N 3.11Å; N171-R174 VanDerWaalsContact O-N 3.13Å; N171-Y199 PolarHBondContact OD1-OH 2.99Å; N171-Y199 VanDerWaalsContact OD1-OH 3.13Å
172	S	96.1	Very high	97.4	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.014	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-35.9	-176.8	-63.1	0	0	0	0	113.2	L142 D169	L142-S172 PolarHBondContact O-OG 3.14Å; L142-S172 VanDerWaalsContact O-OG 3.04Å; D169-S172 WeakPolarHBondContact CA-OG 3.37Å; D169-S172 PolarHBondContact N-OG 2.96Å; D169-S172 VanDerWaalsContact O-CB 3.26Å; D169-S172 WeakPolarHBondContact O-CB 3.32Å; D169-S172 PolarHBondContact O-N 3.22Å; D169-S172 PolarHBondContact O-OG 2.64Å
173	F	96.8	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	12.7	-176.3	-54.7	-52.6	0	0	0	114.6	L142 F147 L158 L160 L168 N171 G175 L176 L182 L184 A196 F197 L200	L142-F173 HydrophobicContact CD1-CE1 3.85Å; L142-F173 HydrophobicContact CD1-CZ 3.71Å; F147-F173 HydrophobicContact CD2-CD1 4.28Å; F147-F173 HydrophobicContact CE2-CD1 4.19Å; F147-F173 HydrophobicContact CE2-CE1 4.01Å; L158-F173 HydrophobicContact CD2-CE1 4.36Å; L160-F173 HydrophobicContact CD1-CE1 4.47Å; L168-F173 HydrophobicContact CD1-CE2 3.63Å; L168-F173 HydrophobicContact CD1-CZ 3.81Å; L168-F173 HydrophobicContact CD2-CE2 4.07Å; L168-F173 HydrophobicContact CG-CE2 4.27Å; N171-F173 PolarHBondContact O-N 2.95Å; N171-F173 VanDerWaalsContact O-N 3.11Å; F173-G175 PolarHBondContact O-N 3.39Å; F173-L176 HydrophobicContact CB-CD1 4.28Å; F173-L176 HydrophobicContact CD1-CD1 3.67Å; F173-L176 HydrophobicContact CE1-CD1 4.5Å; F173-L176 HydrophobicContact CG-CD1 4.39Å; F173-L176 PolarHBondContact O-N 3.02Å; F173-L182 HydrophobicContact CD2-CD2 4.3Å; F173-L182 HydrophobicContact CE1-CD1 4.43Å; F173-L182 HydrophobicContact CE1-CD2 4.41Å; F173-L182 HydrophobicContact CE2-CD2 3.82Å; F173-L182 HydrophobicContact CZ-CD1 4.39Å; F173-L182 HydrophobicContact CZ-CD2 3.89Å; F173-L184 HydrophobicContact CE2-CD1 4.21Å; F173-L184 HydrophobicContact CZ-CD1 3.97Å; F173-L184 HydrophobicContact CZ-CD2 4.44Å; F173-A196 HydrophobicContact CD2-CB 4.43Å; F173-F197 HydrophobicContact CE2-CE1 4.3Å; F173-L200 HydrophobicContact CB-CD1 4.23Å; F173-L200 HydrophobicContact CB-CD2 3.87Å; F173-L200 HydrophobicContact CB-CG 4.21Å; F173-L200 HydrophobicContact CD2-CD1 4.21Å; F173-L200 HydrophobicContact CG-CD1 4.37Å
174	R	95.3	Very high	97.3	Very high	133 Å²	133	38.3 Å²	38.3	50%	0.502	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.9	-174.1	-177.4	176.4	175.2	-175.4	0.8	114.2	L149 N171 Y199	L149-R174 HydrophobicContact CD2-CB 3.79Å; L149-R174 HydrophobicContact CD2-CG 3.64Å; N171-R174 HydrophobicContact CB-CB 4.34Å; N171-R174 WeakPolarHBondContact O-CB 3.2Å; N171-R174 PolarHBondContact O-N 3.11Å; N171-R174 VanDerWaalsContact O-N 3.13Å; R174-Y199 HydrophobicContact CB-CD1 4.5Å; R174-Y199 HydrophobicContact CB-CD2 4.02Å; R174-Y199 HydrophobicContact CB-CE2 4.11Å; R174-Y199 HydrophobicContact CB-CG 4.22Å; R174-Y199 HydrophobicContact CG-CD1 4.06Å; R174-Y199 HydrophobicContact CG-CD2 4.4Å; R174-Y199 HydrophobicContact CG-CE1 3.99Å; R174-Y199 HydrophobicContact CG-CE2 4.31Å; R174-Y199 HydrophobicContact CG-CG 4.28Å
175	G	93.8	Very high	97.3	Very high	3 Å²	3	36.4 Å²	36.4	3%	0.031	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-15.6	179.2	0	0	0	0	0	115.3	F173 V177	F173-G175 PolarHBondContact O-N 3.39Å; G175-V177 VanDerWaalsContact C-N 3.26Å; G175-V177 PolarHBondContact O-N 3.46Å; G175-V177 VanDerWaalsContact O-N 3.09Å
176	L	96.9	Very high	97.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.197	C	C	.	.			trans	-92	49.9	-167.9	-50.6	-173.7	0	0	0	111.6	F147 F152 L155 L158 F173 S178 L179 L200	F147-L176 HydrophobicContact CB-CD2 3.93Å; F147-L176 HydrophobicContact CB-CG 4.47Å; F147-L176 HydrophobicContact CD2-CD1 4.14Å; F147-L176 HydrophobicContact CG-CD1 4.35Å; F147-L176 HydrophobicContact CG-CD2 4.2Å; F152-L176 HydrophobicContact CB-CD2 3.61Å; F152-L176 HydrophobicContact CD2-CD2 3.89Å; F152-L176 HydrophobicContact CG-CD2 4.29Å; L155-L176 HydrophobicContact CD2-CD2 3.9Å; L158-L176 HydrophobicContact CD2-CD1 3.58Å; F173-L176 HydrophobicContact CB-CD1 4.28Å; F173-L176 HydrophobicContact CD1-CD1 3.67Å; F173-L176 HydrophobicContact CE1-CD1 4.5Å; F173-L176 HydrophobicContact CG-CD1 4.39Å; F173-L176 PolarHBondContact O-N 3.02Å; L176-S178 PolarHBondContact O-N 2.96Å; L176-S178 VanDerWaalsContact O-N 3.14Å; L176-L179 HydrophobicContact CB-CB 4.1Å; L176-L179 HydrophobicContact CB-CD2 4.35Å; L176-L179 HydrophobicContact CD1-CD2 4.05Å; L176-L179 VanDerWaalsContact O-CB 3.29Å; L176-L179 WeakPolarHBondContact O-CB 3.21Å; L176-L179 PolarHBondContact O-N 2.99Å; L176-L179 VanDerWaalsContact O-N 3.11Å; L176-L200 HydrophobicContact CB-CD2 3.88Å; L176-L200 VanDerWaalsContact O-CD2 3.25Å; L176-L200 WeakPolarHBondContact O-CD2 3.09Å
177	V	96.2	Very high	97.2	Very high	51 Å²	51	39.3 Å²	39.3	31%	0.309	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-19.1	-167.9	-64	0	0	0	0	114.6	R153 G175 W202	R153-V177 HydrophobicContact CB-CG2 4.36Å; R153-V177 HydrophobicContact CG-CG2 4.24Å; G175-V177 VanDerWaalsContact C-N 3.26Å; G175-V177 PolarHBondContact O-N 3.46Å; G175-V177 VanDerWaalsContact O-N 3.09Å; V177-W202 VanDerWaalsContact O-CD1 3.25Å
178	S	97.6	Very high	97.2	Very high	35 Å²	35	42.8 Å²	42.8	25%	0.245	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	6.2	178.4	-58.4	0	0	0	0	113.6	R153 L155 L176 R180	R153-S178 WeakPolarHBondContact O-CB 3.31Å; R153-S178 PolarHBondContact O-OG 3.38Å; L155-S178 CarbonylContact O-C 3.57Å; L155-S178 VanDerWaalsContact O-C 3.25Å; L176-S178 PolarHBondContact O-N 2.96Å; L176-S178 VanDerWaalsContact O-N 3.14Å; S178-R180 PolarHBondContact O-N 2.95Å
179	L	98.3	Very high	97.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	19%	0.188	C	C	.	.			trans	-63.1	129.7	-174.8	-157.5	73	0	0	0	110.5	L155 L158 L176 L182 L200 W202 L203	L155-L179 HydrophobicContact CD2-CD1 4.03Å; L155-L179 HydrophobicContact CG-CD1 4.08Å; L155-L179 VanDerWaalsContact O-CA 3.26Å; L155-L179 WeakPolarHBondContact O-CA 3.42Å; L155-L179 PolarHBondContact O-N 3.05Å; L158-L179 HydrophobicContact CB-CD1 3.78Å; L158-L179 HydrophobicContact CB-CD2 4.31Å; L176-L179 HydrophobicContact CB-CB 4.1Å; L176-L179 HydrophobicContact CB-CD2 4.35Å; L176-L179 HydrophobicContact CD1-CD2 4.05Å; L176-L179 VanDerWaalsContact O-CB 3.29Å; L176-L179 WeakPolarHBondContact O-CB 3.21Å; L176-L179 PolarHBondContact O-N 2.99Å; L176-L179 VanDerWaalsContact O-N 3.11Å; L179-L182 HydrophobicContact CD2-CB 3.88Å; L179-L182 HydrophobicContact CD2-CD1 4.26Å; L179-L182 HydrophobicContact CD2-CD2 4.38Å; L179-L182 HydrophobicContact CD2-CG 4.4Å; L179-L200 HydrophobicContact CB-CD2 4.02Å; L179-L200 HydrophobicContact CD2-CD1 4.23Å; L179-L200 HydrophobicContact CD2-CD2 4.13Å; L179-W202 CarbonylContact O-C 3.47Å; L179-L203 HydrophobicContact CD2-CD1 4.33Å; L179-L203 HydrophobicContact CG-CD1 4.46Å; L179-L203 WeakPolarHBondContact O-CA 3.35Å; L179-L203 PolarHBondContact O-N 2.96Å
180	R	98.2	Very high	97.1	Very high	109 Å²	109	43.2 Å²	43.2	41%	0.411	20%	0.196	S	C	.	.			trans	-108.1	-36.2	178.3	-59.9	-177.5	-177.6	-78	-2.2	111.4	E156 S178 S204 N205	E156-R180 HydrophobicContact CB-CG 4.28Å; E156-R180 WeakPolarHBondContact O-CA 3.27Å; E156-R180 PolarHBondContact O-N 3.45Å; E156-R180 IonicContact OE1-CZ 3.71Å; E156-R180 IonicContact OE1-NE 2.92Å; E156-R180 PolarHBondContact OE1-NE 3.4Å; E156-R180 IonicContact OE1-NH2 3.58Å; E156-R180 IonicContact OE2-NE 3.8Å; S178-R180 PolarHBondContact O-N 2.95Å; R180-S204 PolarHBondContact O-N 3.19Å; R180-S204 PolarHBondContact O-OG 3.15Å; R180-S204 VanDerWaalsContact O-OG 3.09Å; R180-N205 PolarHBondContact O-N 3.38Å
181	S	98.4	Very high	97	Very high	34 Å²	34	40.3 Å²	40.3	24%	0.238	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.4	-179	-169.8	0	0	0	0	111.4	E156 T157 L158 N205	E156-S181 PolarHBondContact O-N 3.29Å; T157-S181 WeakPolarHBondContact CA-O 3.18Å; L158-S181 PolarHBondContact N-O 3.44Å; S181-N205 WeakPolarHBondContact CA-O 3.14Å
182	L	98.3	Very high	96.8	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	117.8	175.7	178.6	57	0	0	0	109.9	L158 L160 F173 L179 L184 F197 L200 L203 N205 L206 N207	L158-L182 HydrophobicContact CB-CD1 4.14Å; L158-L182 HydrophobicContact CD2-CD1 3.94Å; L158-L182 HydrophobicContact CG-CD1 4.01Å; L158-L182 WeakPolarHBondContact O-CA 3.34Å; L160-L182 HydrophobicContact CD1-CD1 4.48Å; F173-L182 HydrophobicContact CD2-CD2 4.3Å; F173-L182 HydrophobicContact CE1-CD1 4.43Å; F173-L182 HydrophobicContact CE1-CD2 4.41Å; F173-L182 HydrophobicContact CE2-CD2 3.82Å; F173-L182 HydrophobicContact CZ-CD1 4.39Å; F173-L182 HydrophobicContact CZ-CD2 3.89Å; L179-L182 HydrophobicContact CD2-CB 3.88Å; L179-L182 HydrophobicContact CD2-CD1 4.26Å; L179-L182 HydrophobicContact CD2-CD2 4.38Å; L179-L182 HydrophobicContact CD2-CG 4.4Å; L182-L184 HydrophobicContact CD1-CD1 4.43Å; L182-L184 HydrophobicContact CD1-CG 4.12Å; L182-L184 HydrophobicContact CD2-CD1 3.9Å; L182-L184 HydrophobicContact CD2-CG 4.43Å; L182-L184 HydrophobicContact CG-CD1 4.12Å; L182-L184 HydrophobicContact CG-CG 4.13Å; L182-F197 HydrophobicContact CD2-CE1 4.17Å; L182-L200 HydrophobicContact CD2-CD1 3.96Å; L182-L203 HydrophobicContact CB-CD1 3.73Å; L182-N205 PolarHBondContact N-O 3.32Å; L182-L206 HydrophobicContact CB-CD1 4.16Å; L182-L206 HydrophobicContact CD2-CD1 4.07Å; L182-L206 HydrophobicContact CG-CD1 4.15Å; L182-L206 WeakPolarHBondContact O-CA 3.15Å; L182-N207 PolarHBondContact O-N 3.21Å
183	D	98.3	Very high	96.8	Very high	35 Å²	35	40.2 Å²	40.2	19%	0.187	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	117.8	170.7	-156.3	-36.6	0	0	0	110.7	L158 L160 S161 S185 N207	L158-D183 PolarHBondContact O-N 2.93Å; L160-D183 CarbonylContact C-O 3.49Å; L160-D183 WeakPolarHBondContact CA-O 3.29Å; L160-D183 WeakPolarHBondContact CB-O 3.47Å; L160-D183 PolarHBondContact N-O 3.2Å; S161-D183 PolarHBondContact N-O 3.3Å; D183-S185 WeakPolarHBondContact OD1-CB 3.3Å; D183-S185 PolarHBondContact OD1-N 3.31Å; D183-S185 PolarHBondContact OD1-OG 3.33Å; D183-N207 HydrophobicContact CB-CB 4.34Å; D183-N207 PolarHBondContact OD1-ND2 3.03Å; D183-N207 PolarHBondContact OD2-ND2 3.34Å
184	L	97.8	Very high	96.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.			trans	-121.4	16.8	174.2	-75.7	166.5	0	0	0	110.7	L142 L160 I165 L168 F173 L182 N187 L189 F197 N207 L208 N211	L142-L184 HydrophobicContact CD1-CD2 4.15Å; L160-L184 HydrophobicContact CB-CD2 3.95Å; L160-L184 HydrophobicContact CD1-CD2 3.89Å; I165-L184 HydrophobicContact CD1-CD2 4Å; L168-L184 HydrophobicContact CD1-CD1 4.04Å; F173-L184 HydrophobicContact CE2-CD1 4.21Å; F173-L184 HydrophobicContact CZ-CD1 3.97Å; F173-L184 HydrophobicContact CZ-CD2 4.44Å; L182-L184 HydrophobicContact CD1-CD1 4.43Å; L182-L184 HydrophobicContact CD1-CG 4.12Å; L182-L184 HydrophobicContact CD2-CD1 3.9Å; L182-L184 HydrophobicContact CD2-CG 4.43Å; L182-L184 HydrophobicContact CG-CD1 4.12Å; L182-L184 HydrophobicContact CG-CG 4.13Å; L184-N187 PolarHBondContact O-ND2 3.33Å; L184-N187 VanDerWaalsContact O-ND2 3.08Å; L184-L189 HydrophobicContact CB-CD1 4.43Å; L184-F197 HydrophobicContact CD1-CE1 4.48Å; L184-N207 CarbonylContact C-O 3.55Å; L184-N207 WeakPolarHBondContact CA-O 3.44Å; L184-N207 PolarHBondContact N-O 3.39Å; L184-L208 HydrophobicContact CB-CD2 3.91Å; L184-L208 HydrophobicContact CD1-CD2 3.95Å; L184-N211 PolarHBondContact O-ND2 3.31Å
185	S	97.2	Very high	96.6	Very high	7 Å²	7	38.6 Å²	38.6	5%	0.049	20%	0.196	C	C	.	.			trans	-68.4	161.4	-178.7	66.6	0	0	0	0	112.2	S161 D162 D183 N187 N207 D209	S161-S185 CarbonylContact C-O 3.41Å; S161-S185 WeakPolarHBondContact CA-O 3.42Å; D162-S185 PolarHBondContact N-O 3Å; D162-S185 VanDerWaalsContact N-O 3.07Å; D183-S185 WeakPolarHBondContact OD1-CB 3.3Å; D183-S185 PolarHBondContact OD1-N 3.31Å; D183-S185 PolarHBondContact OD1-OG 3.33Å; S185-N187 VanDerWaalsContact C-N 3.26Å; S185-N187 PolarHBondContact O-N 3.27Å; S185-N187 PolarHBondContact O-ND2 3.1Å; S185-N207 WeakPolarHBondContact CB-ND2 3.29Å; S185-N207 WeakPolarHBondContact CB-OD1 3.48Å; S185-N207 PolarHBondContact N-O 3.45Å; S185-N207 PolarHBondContact OG-ND2 2.83Å; S185-D209 CarbonylContact C-O 3.59Å; S185-D209 WeakPolarHBondContact CA-O 3.36Å; S185-D209 WeakPolarHBondContact CB-O 3.5Å
186	R	96.8	Very high	96.6	Very high	134 Å²	134	38.5 Å²	38.5	51%	0.506	19%	0.194	S	C	.	.	S	Bend	trans	56.6	42.6	177.1	-57.2	172.1	-178.8	-89.5	1.3	112.3	D162 N163 D209 L210	D162-R186 WeakPolarHBondContact CA-O 3.07Å; D162-R186 HydrophobicContact CB-CB 4.46Å; D162-R186 PolarHBondContact N-O 3.13Å; D162-R186 WeakPolarHBondContact OD1-CB 3.37Å; D162-R186 WeakPolarHBondContact OD1-CD 3.31Å; D162-R186 WeakPolarHBondContact OD2-CD 3.38Å; N163-R186 PolarHBondContact N-O 3.11Å; R186-D209 PolarHBondContact N-O 2.99Å; R186-L210 WeakPolarHBondContact CA-O 3.47Å; R186-L210 HydrophobicContact CB-CB 4.46Å; R186-L210 HydrophobicContact CG-CB 3.79Å; R186-L210 HydrophobicContact CG-CD1 3.53Å; R186-L210 HydrophobicContact CG-CG 4.3Å; R186-L210 PolarHBondContact N-O 2.83Å
187	N	98.3	Very high	96.5	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.048	20%	0.199	C	C	.	.	S	Bend	trans	-115.2	-162.1	175.2	-86.6	-77.8	0	0	0	110	L160 N163 L164 I165 L184 S185 L210 N211	L160-N187 PolarHBondContact O-ND2 3.09Å; N163-N187 WeakPolarHBondContact CA-OD1 3.18Å; N163-N187 WeakPolarHBondContact CB-OD1 3.35Å; N163-N187 PolarHBondContact O-OD1 3.02Å; L164-N187 PolarHBondContact N-OD1 2.96Å; I165-N187 HydrophobicContact CB-CB 4.2Å; I165-N187 VanDerWaalsContact CB-OD1 3.23Å; I165-N187 WeakPolarHBondContact CB-OD1 3.43Å; I165-N187 WeakPolarHBondContact CG1-OD1 3.49Å; I165-N187 PolarHBondContact N-OD1 3.22Å; L184-N187 PolarHBondContact O-ND2 3.33Å; L184-N187 VanDerWaalsContact O-ND2 3.08Å; S185-N187 VanDerWaalsContact C-N 3.26Å; S185-N187 PolarHBondContact O-N 3.27Å; S185-N187 PolarHBondContact O-ND2 3.1Å; N187-L210 PolarHBondContact N-O 2.78Å; N187-N211 VanDerWaalsContact CA-OD1 3.31Å; N187-N211 WeakPolarHBondContact CA-OD1 3.4Å; N187-N211 WeakPolarHBondContact CB-OD1 3.09Å; N187-N211 PolarHBondContact O-OD1 2.8Å
188	R	98	Very high	96.3	Very high	142 Å²	142	40.4 Å²	40.4	54%	0.536	21%	0.208	S	C	.	.			trans	-120.5	21.1	-176.6	-61.4	-176.3	175.5	-170.3	-1	112.7	I165 D166 S190 N211	I165-R188 CarbonylContact O-C 3.55Å; I165-R188 VanDerWaalsContact O-CA 3.28Å; I165-R188 WeakPolarHBondContact O-CA 3.3Å; I165-R188 PolarHBondContact O-N 3.04Å; D166-R188 HydrophobicContact CB-CB 4.08Å; R188-S190 PolarHBondContact O-N 3.38Å; R188-N211 PolarHBondContact N-OD1 3.46Å
189	L	97.1	Very high	96.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.			trans	-64.4	127.6	-177.9	-63.6	168	0	0	0	109.9	I165 L168 L184 V192 L208 N211 S212 W213	I165-L189 HydrophobicContact CG2-CD2 3.9Å; I165-L189 PolarHBondContact O-N 2.91Å; I165-L189 VanDerWaalsContact O-N 3.08Å; L168-L189 HydrophobicContact CB-CD2 4.24Å; L184-L189 HydrophobicContact CB-CD1 4.43Å; L189-V192 HydrophobicContact CB-CG2 4.41Å; L189-V192 HydrophobicContact CD1-CG2 3.9Å; L189-V192 HydrophobicContact CD2-CG2 4.19Å; L189-V192 HydrophobicContact CG-CG2 4.4Å; L189-L208 HydrophobicContact CD1-CD2 4.34Å; L189-N211 HydrophobicContact CB-CB 4.15Å; L189-N211 VanDerWaalsContact CB-OD1 3.3Å; L189-N211 WeakPolarHBondContact CB-OD1 3.29Å; L189-N211 WeakPolarHBondContact CG-OD1 3.3Å; L189-N211 PolarHBondContact N-OD1 2.9Å; L189-S212 CarbonylContact O-C 3.57Å; L189-S212 WeakPolarHBondContact O-CA 3.45Å; L189-S212 PolarHBondContact O-N 2.82Å; L189-W213 HydrophobicContact CB-CH2 3.93Å; L189-W213 HydrophobicContact CB-CZ2 4.34Å; L189-W213 HydrophobicContact CB-CZ3 4.24Å; L189-W213 HydrophobicContact CD1-CH2 4.25Å; L189-W213 PolarHBondContact O-N 2.8Å
190	S	95.9	Very high	96	Very high	53 Å²	53	42.8 Å²	42.8	37%	0.371	21%	0.212	S	C	.	.	S	Bend	trans	-100.9	-24.8	170.4	58.2	0	0	0	0	112.8	R188 S212 N214	R188-S190 PolarHBondContact O-N 3.38Å; S190-S212 VanDerWaalsContact CA-O 3.31Å; S190-S212 WeakPolarHBondContact CA-O 3.31Å; S190-N214 PolarHBondContact O-N 2.88Å; S190-N214 VanDerWaalsContact O-N 3.1Å
191	S	94.3	Very high	95.8	Very high	59 Å²	59	42.1 Å²	42.1	41%	0.413	22%	0.22	S	C	.	.			trans	-153.9	158.5	176	60.4	0	0	0	0	109.5
192	V	94.1	Very high	95.7	Very high	7 Å²	7	47.9 Å²	47.9	4%	0.042	24%	0.237	C	C	.	.			trans	-138.7	133.1	174	175.7	0	0	0	0	108.6	L168 L189 A196 F197 W213 L222	L168-V192 HydrophobicContact CD1-CG1 4.26Å; L168-V192 HydrophobicContact CD1-CG2 4.5Å; L168-V192 HydrophobicContact CD2-CG1 4.13Å; L189-V192 HydrophobicContact CB-CG2 4.41Å; L189-V192 HydrophobicContact CD1-CG2 3.9Å; L189-V192 HydrophobicContact CD2-CG2 4.19Å; L189-V192 HydrophobicContact CG-CG2 4.4Å; V192-A196 HydrophobicContact CG1-CB 4.26Å; V192-F197 HydrophobicContact CB-CE2 4.29Å; V192-F197 HydrophobicContact CG1-CD2 4.38Å; V192-F197 HydrophobicContact CG1-CE2 3.45Å; V192-F197 VanDerWaalsContact CG1-CE2 3.45Å; V192-F197 HydrophobicContact CG1-CZ 3.66Å; V192-W213 HydrophobicContact CB-CZ3 4.47Å; V192-W213 HydrophobicContact CG2-CH2 3.65Å; V192-W213 HydrophobicContact CG2-CZ3 3.87Å; V192-L222 HydrophobicContact CB-CD1 4.44Å; V192-L222 HydrophobicContact CB-CD2 4.01Å
193	P	95.3	Very high	95.6	Very high	33 Å²	33	48.1 Å²	48.1	21%	0.214	24%	0.238	C	C	.	.			trans	-62.9	126.7	173.1	-16	28.6	0	0	0	109.8	L168 R170 E195 A196	L168-P193 VanDerWaalsContact O-CD 3.25Å; L168-P193 WeakPolarHBondContact O-CD 3.48Å; L168-P193 VanDerWaalsContact O-CG 3.31Å; L168-P193 WeakPolarHBondContact O-CG 3.19Å; R170-P193 HydrophobicContact CB-CB 4.06Å; R170-P193 HydrophobicContact CB-CG 4.44Å; P193-E195 WeakPolarHBondContact CB-OE2 3.42Å; P193-E195 PolarHBondContact O-N 2.83Å; P193-E195 VanDerWaalsContact O-N 3.13Å; P193-A196 WeakPolarHBondContact O-CB 3.37Å; P193-A196 PolarHBondContact O-N 3.36Å
194	P	92.8	Very high	95.5	Very high	25 Å²	25	47.9 Å²	47.9	16%	0.162	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.8	179.2	-22.1	30.4	0	0	0	112.9	A196 F197 E221 L222 V225	P194-A196 PolarHBondContact O-N 3.29Å; P194-F197 PolarHBondContact O-N 3.01Å; P194-E221 HydrophobicContact CG-CB 3.62Å; P194-L222 HydrophobicContact CG-CB 4.33Å; P194-V225 HydrophobicContact CB-CG2 3.98Å
195	E	94.7	Very high	95.4	Very high	74 Å²	74	49.7 Å²	49.7	35%	0.346	25%	0.249	S	C	.	.	H	α-helix	trans	-67.1	-19.9	-178.8	-45.9	97.4	121	0	0	112.9	R170 P193 F197 S198	R170-E195 HydrophobicContact CB-CB 4.32Å; R170-E195 IonicContact NH1-OE1 3.63Å; R170-E195 PolarHBondContact NH1-OE1 3.31Å; R170-E195 IonicContact NH1-OE2 2.93Å; P193-E195 WeakPolarHBondContact CB-OE2 3.42Å; P193-E195 PolarHBondContact O-N 2.83Å; P193-E195 VanDerWaalsContact O-N 3.13Å; E195-F197 PolarHBondContact O-N 2.88Å; E195-S198 WeakPolarHBondContact O-CB 3.37Å; E195-S198 PolarHBondContact O-N 3.15Å; E195-S198 PolarHBondContact O-OG 3.05Å
196	A	94.7	Very high	95.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.6	-33	174.9	0	0	0	0	0	112.7	L168 R170 F173 V192 P193 P194	L168-A196 HydrophobicContact CD2-CB 3.24Å; R170-A196 VanDerWaalsContact O-CA 3.32Å; R170-A196 WeakPolarHBondContact O-CA 3.12Å; F173-A196 HydrophobicContact CD2-CB 4.43Å; V192-A196 HydrophobicContact CG1-CB 4.26Å; P193-A196 WeakPolarHBondContact O-CB 3.37Å; P193-A196 PolarHBondContact O-N 3.36Å; P194-A196 PolarHBondContact O-N 3.29Å
197	F	94.3	Very high	95.3	Very high	20 Å²	20	44.2 Å²	44.2	9%	0.088	23%	0.229	C	C	.	.	H	α-helix	trans	-90.1	-12.1	179	-55.4	-62.1	0	0	0	113.1	F173 L182 L184 V192 P194 E195 Y199 L200 L206 L208 L222	F173-F197 HydrophobicContact CE2-CE1 4.3Å; L182-F197 HydrophobicContact CD2-CE1 4.17Å; L184-F197 HydrophobicContact CD1-CE1 4.48Å; V192-F197 HydrophobicContact CB-CE2 4.29Å; V192-F197 HydrophobicContact CG1-CD2 4.38Å; V192-F197 HydrophobicContact CG1-CE2 3.45Å; V192-F197 VanDerWaalsContact CG1-CE2 3.45Å; V192-F197 HydrophobicContact CG1-CZ 3.66Å; P194-F197 PolarHBondContact O-N 3.01Å; E195-F197 PolarHBondContact O-N 2.88Å; F197-Y199 PolarHBondContact O-N 3.38Å; F197-Y199 VanDerWaalsContact O-N 3.14Å; F197-L200 HydrophobicContact CD1-CD1 4.15Å; F197-L200 WeakPolarHBondContact O-CB 3.26Å; F197-L200 PolarHBondContact O-N 2.94Å; F197-L206 HydrophobicContact CD1-CD2 4.45Å; F197-L206 HydrophobicContact CE1-CD1 4.04Å; F197-L206 HydrophobicContact CE1-CD2 4.24Å; F197-L206 HydrophobicContact CZ-CD2 4.41Å; F197-L208 HydrophobicContact CE2-CD1 4.46Å; F197-L208 HydrophobicContact CZ-CD1 4.08Å; F197-L208 HydrophobicContact CZ-CD2 4.27Å; F197-L222 HydrophobicContact CD2-CD1 4.24Å; F197-L222 HydrophobicContact CE2-CD1 3.81Å
198	S	92.7	Very high	95.1	Very high	72 Å²	72	43.8 Å²	43.8	50%	0.503	23%	0.227	S	C	.	.	H	α-helix	trans	-63.1	-23.6	-176	70.5	0	0	0	0	114.1	E195	E195-S198 WeakPolarHBondContact O-CB 3.37Å; E195-S198 PolarHBondContact O-N 3.15Å; E195-S198 PolarHBondContact O-OG 3.05Å
199	Y	93.1	Very high	94.9	Very high	76 Å²	76	37.9 Å²	37.9	30%	0.298	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-15.3	177.6	-58.3	-68.4	0	0	0	113.4	N171 R174 F197 V201	N171-Y199 PolarHBondContact OD1-OH 2.99Å; N171-Y199 VanDerWaalsContact OD1-OH 3.13Å; R174-Y199 HydrophobicContact CB-CD1 4.5Å; R174-Y199 HydrophobicContact CB-CD2 4.02Å; R174-Y199 HydrophobicContact CB-CE2 4.11Å; R174-Y199 HydrophobicContact CB-CG 4.22Å; R174-Y199 HydrophobicContact CG-CD1 4.06Å; R174-Y199 HydrophobicContact CG-CD2 4.4Å; R174-Y199 HydrophobicContact CG-CE1 3.99Å; R174-Y199 HydrophobicContact CG-CE2 4.31Å; R174-Y199 HydrophobicContact CG-CG 4.28Å; F197-Y199 PolarHBondContact O-N 3.38Å; F197-Y199 VanDerWaalsContact O-N 3.14Å; Y199-V201 VanDerWaalsContact C-N 3.33Å; Y199-V201 PolarHBondContact O-N 2.82Å
200	L	95.5	Very high	94.7	Very high	8 Å²	8	42.3 Å²	42.3	4%	0.042	23%	0.229	C	C	.	.			trans	-94.1	59.1	-170.1	-55.3	-177.7	0	0	0	111.4	F173 L176 L179 L182 F197 W202 L203	F173-L200 HydrophobicContact CB-CD1 4.23Å; F173-L200 HydrophobicContact CB-CD2 3.87Å; F173-L200 HydrophobicContact CB-CG 4.21Å; F173-L200 HydrophobicContact CD2-CD1 4.21Å; F173-L200 HydrophobicContact CG-CD1 4.37Å; L176-L200 HydrophobicContact CB-CD2 3.88Å; L176-L200 VanDerWaalsContact O-CD2 3.25Å; L176-L200 WeakPolarHBondContact O-CD2 3.09Å; L179-L200 HydrophobicContact CB-CD2 4.02Å; L179-L200 HydrophobicContact CD2-CD1 4.23Å; L179-L200 HydrophobicContact CD2-CD2 4.13Å; L182-L200 HydrophobicContact CD2-CD1 3.96Å; F197-L200 HydrophobicContact CD1-CD1 4.15Å; F197-L200 WeakPolarHBondContact O-CB 3.26Å; F197-L200 PolarHBondContact O-N 2.94Å; L200-W202 PolarHBondContact O-N 3.26Å; L200-W202 VanDerWaalsContact O-N 3.13Å; L200-L203 HydrophobicContact CB-CB 3.86Å; L200-L203 HydrophobicContact CB-CD2 4.31Å; L200-L203 HydrophobicContact CD1-CD1 4.43Å; L200-L203 HydrophobicContact CD1-CD2 4.03Å; L200-L203 VanDerWaalsContact O-CB 3.22Å; L200-L203 WeakPolarHBondContact O-CB 3.46Å; L200-L203 PolarHBondContact O-N 2.92Å
201	V	93.6	Very high	94.7	Very high	95 Å²	95	40.4 Å²	40.4	58%	0.576	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-28	-171.4	-61.8	0	0	0	0	113.9	Y199	Y199-V201 VanDerWaalsContact C-N 3.33Å; Y199-V201 PolarHBondContact O-N 2.82Å
202	W	96.1	Very high	94.8	Very high	156 Å²	156	40.3 Å²	40.3	59%	0.591	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	3.2	180	-61.1	115.6	0	0	0	114.2	V177 L179 L200 S204	V177-W202 VanDerWaalsContact O-CD1 3.25Å; L179-W202 CarbonylContact O-C 3.47Å; L200-W202 PolarHBondContact O-N 3.26Å; L200-W202 VanDerWaalsContact O-N 3.13Å; W202-S204 PolarHBondContact O-N 2.92Å; W202-S204 VanDerWaalsContact O-N 3.08Å
203	L	96.9	Very high	94.8	Very high	5 Å²	5	40 Å²	40	3%	0.026	21%	0.212	C	C	.	.			trans	-64	112.3	-175.3	-172.9	73	0	0	0	110.2	L179 L182 L200 L206 F229 K235	L179-L203 HydrophobicContact CD2-CD1 4.33Å; L179-L203 HydrophobicContact CG-CD1 4.46Å; L179-L203 WeakPolarHBondContact O-CA 3.35Å; L179-L203 PolarHBondContact O-N 2.96Å; L182-L203 HydrophobicContact CB-CD1 3.73Å; L200-L203 HydrophobicContact CB-CB 3.86Å; L200-L203 HydrophobicContact CB-CD2 4.31Å; L200-L203 HydrophobicContact CD1-CD1 4.43Å; L200-L203 HydrophobicContact CD1-CD2 4.03Å; L200-L203 VanDerWaalsContact O-CB 3.22Å; L200-L203 WeakPolarHBondContact O-CB 3.46Å; L200-L203 PolarHBondContact O-N 2.92Å; L203-L206 HydrophobicContact CD2-CB 4.08Å; L203-L206 HydrophobicContact CD2-CD1 4.32Å; L203-L206 HydrophobicContact CD2-CD2 4.34Å; L203-L206 HydrophobicContact CD2-CG 4.48Å; L203-F229 HydrophobicContact CB-CE2 4.44Å; L203-F229 HydrophobicContact CD2-CE2 4.22Å; L203-F229 HydrophobicContact CD2-CZ 4.26Å; L203-F229 HydrophobicContact CG-CE2 4.38Å; L203-F229 HydrophobicContact CG-CZ 4.28Å; L203-F229 VanDerWaalsContact O-CE2 3.29Å; L203-F229 WeakPolarHBondContact O-CE2 3.49Å; L203-K235 WeakPolarHBondContact O-CD 3.35Å; L203-K235 VanDerWaalsContact O-CE 3.28Å; L203-K235 WeakPolarHBondContact O-CE 3.34Å; L203-K235 PolarHBondContact O-NZ 2.98Å
204	S	95.9	Very high	94.8	Very high	30 Å²	30	41.2 Å²	41.2	21%	0.21	22%	0.217	C	C	.	.			trans	-95.9	-33.2	175.2	59.2	0	0	0	0	111.5	R180 W202 D234 K235 A236	R180-S204 PolarHBondContact O-N 3.19Å; R180-S204 PolarHBondContact O-OG 3.15Å; R180-S204 VanDerWaalsContact O-OG 3.09Å; W202-S204 PolarHBondContact O-N 2.92Å; W202-S204 VanDerWaalsContact O-N 3.08Å; S204-D234 VanDerWaalsContact CB-O 3.3Å; S204-D234 WeakPolarHBondContact CB-O 3.46Å; S204-K235 CarbonylContact O-C 3.51Å; S204-K235 WeakPolarHBondContact O-CA 3.5Å; S204-A236 PolarHBondContact O-N 3.33Å
205	N	96	Very high	94.8	Very high	39 Å²	39	40 Å²	40	21%	0.209	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	115.3	-169.5	-61.1	23	0	0	0	108.9	R180 S181 L182 A236 Y238	R180-N205 PolarHBondContact O-N 3.38Å; S181-N205 WeakPolarHBondContact CA-O 3.14Å; L182-N205 PolarHBondContact N-O 3.32Å; N205-A236 WeakPolarHBondContact CA-O 3.33Å; N205-Y238 HydrophobicContact CB-CD2 4.15Å; N205-Y238 HydrophobicContact CB-CE2 3.62Å; N205-Y238 VanDerWaalsContact ND2-CE2 3.31Å; N205-Y238 WeakPolarHBondContact ND2-CE2 3.42Å; N205-Y238 PolarHBondContact ND2-OH 2.82Å; N205-Y238 VanDerWaalsContact ND2-OH 3.11Å
206	L	95.9	Very high	94.7	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.4	175.4	-179.8	57.1	0	0	0	109.3	L182 F197 L203 L208 L226 F229 A236 L237 Y238	L182-L206 HydrophobicContact CB-CD1 4.16Å; L182-L206 HydrophobicContact CD2-CD1 4.07Å; L182-L206 HydrophobicContact CG-CD1 4.15Å; L182-L206 WeakPolarHBondContact O-CA 3.15Å; F197-L206 HydrophobicContact CD1-CD2 4.45Å; F197-L206 HydrophobicContact CE1-CD1 4.04Å; F197-L206 HydrophobicContact CE1-CD2 4.24Å; F197-L206 HydrophobicContact CZ-CD2 4.41Å; L203-L206 HydrophobicContact CD2-CB 4.08Å; L203-L206 HydrophobicContact CD2-CD1 4.32Å; L203-L206 HydrophobicContact CD2-CD2 4.34Å; L203-L206 HydrophobicContact CD2-CG 4.48Å; L206-L208 HydrophobicContact CD1-CD1 4.37Å; L206-L208 HydrophobicContact CD1-CD2 4.48Å; L206-L208 HydrophobicContact CD1-CG 4.03Å; L206-L208 HydrophobicContact CD2-CD1 3.81Å; L206-L208 HydrophobicContact CD2-CG 4.32Å; L206-L208 HydrophobicContact CG-CD1 4.08Å; L206-L208 HydrophobicContact CG-CG 4.03Å; L206-L226 HydrophobicContact CD2-CD2 3.76Å; L206-F229 HydrophobicContact CB-CE1 3.99Å; L206-F229 HydrophobicContact CB-CZ 4.14Å; L206-A236 PolarHBondContact N-O 3.1Å; L206-L237 HydrophobicContact CB-CD1 4.12Å; L206-L237 HydrophobicContact CD2-CD1 4.14Å; L206-L237 HydrophobicContact CG-CD1 3.95Å; L206-L237 CarbonylContact O-C 3.22Å; L206-L237 VanDerWaalsContact O-CA 3.31Å; L206-L237 WeakPolarHBondContact O-CA 3.49Å; L206-Y238 PolarHBondContact O-N 3.5Å
207	N	95.8	Very high	94.6	Very high	22 Å²	22	39.7 Å²	39.7	12%	0.118	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.8	173	-171.5	3.1	0	0	0	109.9	L182 D183 L184 S185 D209	L182-N207 PolarHBondContact O-N 3.21Å; D183-N207 HydrophobicContact CB-CB 4.34Å; D183-N207 PolarHBondContact OD1-ND2 3.03Å; D183-N207 PolarHBondContact OD2-ND2 3.34Å; L184-N207 CarbonylContact C-O 3.55Å; L184-N207 WeakPolarHBondContact CA-O 3.44Å; L184-N207 PolarHBondContact N-O 3.39Å; S185-N207 WeakPolarHBondContact CB-ND2 3.29Å; S185-N207 WeakPolarHBondContact CB-OD1 3.48Å; S185-N207 PolarHBondContact N-O 3.45Å; S185-N207 PolarHBondContact OG-ND2 2.83Å; N207-D209 PolarHBondContact OD1-N 3.48Å
208	L	94.9	Very high	94.5	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.247	C	C	.	.			trans	-125.6	9.2	-177.3	-76.9	173.9	0	0	0	111.9	L184 L189 F197 L206 N211 W213 L226 M243	L184-L208 HydrophobicContact CB-CD2 3.91Å; L184-L208 HydrophobicContact CD1-CD2 3.95Å; L189-L208 HydrophobicContact CD1-CD2 4.34Å; F197-L208 HydrophobicContact CE2-CD1 4.46Å; F197-L208 HydrophobicContact CZ-CD1 4.08Å; F197-L208 HydrophobicContact CZ-CD2 4.27Å; L206-L208 HydrophobicContact CD1-CD1 4.37Å; L206-L208 HydrophobicContact CD1-CD2 4.48Å; L206-L208 HydrophobicContact CD1-CG 4.03Å; L206-L208 HydrophobicContact CD2-CD1 3.81Å; L206-L208 HydrophobicContact CD2-CG 4.32Å; L206-L208 HydrophobicContact CG-CD1 4.08Å; L206-L208 HydrophobicContact CG-CG 4.03Å; L208-N211 PolarHBondContact O-ND2 2.83Å; L208-W213 HydrophobicContact CB-CZ2 3.88Å; L208-W213 HydrophobicContact CD2-CH2 4.15Å; L208-W213 HydrophobicContact CD2-CZ2 4.06Å; L208-W213 HydrophobicContact CG-CZ2 4.39Å; L208-W213 WeakPolarHBondContact O-CZ2 3.38Å; L208-W213 PolarHBondContact O-NE1 2.97Å; L208-W213 VanDerWaalsContact O-NE1 3.11Å; L208-L226 HydrophobicContact CD1-CD1 4.23Å; L208-L226 HydrophobicContact CD1-CD2 4Å; L208-M243 HydrophobicContact CB-CE 3.9Å; L208-M243 HydrophobicContact CB-CG 4.07Å; L208-M243 HydrophobicContact CB-SD 3.87Å; L208-M243 HydrophobicContact CD1-CE 3.81Å; L208-M243 HydrophobicContact CD1-SD 4.09Å; L208-M243 HydrophobicContact CG-CE 4.49Å
209	D	92.6	Very high	94.5	Very high	18 Å²	18	43.7 Å²	43.7	10%	0.096	23%	0.225	C	C	.	.			trans	-67.9	160.9	-176.1	-94	4.1	0	0	0	112.6	S185 R186 N207 N211 N239 M243	S185-D209 CarbonylContact C-O 3.59Å; S185-D209 WeakPolarHBondContact CA-O 3.36Å; S185-D209 WeakPolarHBondContact CB-O 3.5Å; R186-D209 PolarHBondContact N-O 2.99Å; N207-D209 PolarHBondContact OD1-N 3.48Å; D209-N211 VanDerWaalsContact C-N 3.28Å; D209-N211 PolarHBondContact O-N 3.18Å; D209-N211 PolarHBondContact O-ND2 2.83Å; D209-N239 WeakPolarHBondContact OD2-CB 3.45Å; D209-M243 PolarHBondContact OD1-N 3.01Å
210	L	94	Very high	94.5	Very high	93 Å²	93	42.2 Å²	42.2	49%	0.487	22%	0.222	S	C	.	.	S	Bend	trans	57	42.9	175.3	-55.7	171.1	0	0	0	112.7	R186 N187	R186-L210 WeakPolarHBondContact CA-O 3.47Å; R186-L210 HydrophobicContact CB-CB 4.46Å; R186-L210 HydrophobicContact CG-CB 3.79Å; R186-L210 HydrophobicContact CG-CD1 3.53Å; R186-L210 HydrophobicContact CG-CG 4.3Å; R186-L210 PolarHBondContact N-O 2.83Å; N187-L210 PolarHBondContact N-O 2.78Å
211	N	95.6	Very high	94.4	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.07	25%	0.25	C	S	.	.	S	Bend	trans	-109.2	179.6	168.3	-86	-76.2	0	0	0	110	L184 N187 R188 L189 L208 D209 W213	L184-N211 PolarHBondContact O-ND2 3.31Å; N187-N211 VanDerWaalsContact CA-OD1 3.31Å; N187-N211 WeakPolarHBondContact CA-OD1 3.4Å; N187-N211 WeakPolarHBondContact CB-OD1 3.09Å; N187-N211 PolarHBondContact O-OD1 2.8Å; R188-N211 PolarHBondContact N-OD1 3.46Å; L189-N211 HydrophobicContact CB-CB 4.15Å; L189-N211 VanDerWaalsContact CB-OD1 3.3Å; L189-N211 WeakPolarHBondContact CB-OD1 3.29Å; L189-N211 WeakPolarHBondContact CG-OD1 3.3Å; L189-N211 PolarHBondContact N-OD1 2.9Å; L208-N211 PolarHBondContact O-ND2 2.83Å; D209-N211 VanDerWaalsContact C-N 3.28Å; D209-N211 PolarHBondContact O-N 3.18Å; D209-N211 PolarHBondContact O-ND2 2.83Å; N211-W213 HydrophobicContact CB-CD2 4.3Å; N211-W213 HydrophobicContact CB-CZ2 3.76Å; N211-W213 PolarHBondContact O-N 2.81Å
212	S	96.1	Very high	94.4	Very high	56 Å²	56	43.9 Å²	43.9	39%	0.392	22%	0.223	S	C	.	.			trans	-100.8	48	-175.4	-61.9	0	0	0	0	112.6	L189 S190 N214	L189-S212 CarbonylContact O-C 3.57Å; L189-S212 WeakPolarHBondContact O-CA 3.45Å; L189-S212 PolarHBondContact O-N 2.82Å; S190-S212 VanDerWaalsContact CA-O 3.31Å; S190-S212 WeakPolarHBondContact CA-O 3.31Å; S212-N214 PolarHBondContact O-N 2.87Å
213	W	95	Very high	94.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	124.2	-170.7	-60.5	111.2	0	0	0	112.5	L189 V192 L208 N211 L219 L222 M243 C245 V246 V256	L189-W213 HydrophobicContact CB-CH2 3.93Å; L189-W213 HydrophobicContact CB-CZ2 4.34Å; L189-W213 HydrophobicContact CB-CZ3 4.24Å; L189-W213 HydrophobicContact CD1-CH2 4.25Å; L189-W213 PolarHBondContact O-N 2.8Å; V192-W213 HydrophobicContact CB-CZ3 4.47Å; V192-W213 HydrophobicContact CG2-CH2 3.65Å; V192-W213 HydrophobicContact CG2-CZ3 3.87Å; L208-W213 HydrophobicContact CB-CZ2 3.88Å; L208-W213 HydrophobicContact CD2-CH2 4.15Å; L208-W213 HydrophobicContact CD2-CZ2 4.06Å; L208-W213 HydrophobicContact CG-CZ2 4.39Å; L208-W213 WeakPolarHBondContact O-CZ2 3.38Å; L208-W213 PolarHBondContact O-NE1 2.97Å; L208-W213 VanDerWaalsContact O-NE1 3.11Å; N211-W213 HydrophobicContact CB-CD2 4.3Å; N211-W213 HydrophobicContact CB-CZ2 3.76Å; N211-W213 PolarHBondContact O-N 2.81Å; W213-L219 HydrophobicContact CE3-CD2 3.98Å; W213-L222 HydrophobicContact CZ3-CD2 3.98Å; W213-M243 HydrophobicContact CD2-CE 3.98Å; W213-M243 VanDerWaalsContact CE2-CE 3.48Å; W213-M243 HydrophobicContact CE3-CE 4.36Å; W213-M243 HydrophobicContact CH2-CE 3.93Å; W213-M243 HydrophobicContact CZ2-CE 3.52Å; W213-M243 HydrophobicContact CZ3-CE 4.32Å; W213-C245 CarbonylContact O-C 3.28Å; W213-C245 WeakPolarHBondContact O-CA 3.3Å; W213-V246 PolarHBondContact O-N 2.96Å; W213-V256 HydrophobicContact CB-CG2 3.64Å; W213-V256 HydrophobicContact CD2-CG2 3.97Å; W213-V256 HydrophobicContact CE3-CG2 4.33Å; W213-V256 HydrophobicContact CG-CG2 3.64Å
214	N	94.4	Very high	94.2	Very high	59 Å²	59	39 Å²	39	32%	0.316	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	97.2	172.4	-175.7	18	0	0	0	108.5	S190 S212 T216 L219 S247	S190-N214 PolarHBondContact O-N 2.88Å; S190-N214 VanDerWaalsContact O-N 3.1Å; S212-N214 PolarHBondContact O-N 2.87Å; N214-T216 PolarHBondContact O-N 2.99Å; N214-T216 WeakPolarHBondContact OD1-CG2 3.37Å; N214-L219 WeakPolarHBondContact O-CD1 3.46Å; N214-S247 CarbonylContact C-O 3.59Å; N214-S247 VanDerWaalsContact CG-OG 3.29Å; N214-S247 PolarHBondContact OD1-OG 3.05Å
215	C	93.8	Very high	94.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	64.4	-173.6	-61.9	0	0	0	0	112.1	C245 S247 A248 D249 V253 L259	C215-C245 HydrophobicContact CB-CB 3.69Å; C215-C245 WeakPolarHBondContact CB-SG 3.49Å; C215-C245 WeakPolarHBondContact SG-CB 3.49Å; C215-C245 CovalentContact SG-SG 2.01Å; C215-C245 PolarHBondContact SG-SG 3.45Å; C215-S247 PolarHBondContact N-O 3.47Å; C215-A248 HydrophobicContact CB-CB 3.9Å; C215-A248 VanDerWaalsContact O-CA 3.31Å; C215-A248 WeakPolarHBondContact O-CA 3.26Å; C215-D249 PolarHBondContact O-N 3.26Å; C215-V253 HydrophobicContact CB-CG1 4.04Å; C215-L259 HydrophobicContact CB-CD1 4.02Å; C215-L259 HydrophobicContact CB-CD2 4.37Å; C215-L259 HydrophobicContact CB-CG 4.35Å
216	T	92.8	Very high	93.9	Very high	17 Å²	17	38.9 Å²	38.9	10%	0.104	22%	0.216	C	C	.	.	S	Bend	trans	-86.9	173.2	165.5	68.4	0	0	0	0	109.9	N214 E218 L219 D249	N214-T216 PolarHBondContact O-N 2.99Å; N214-T216 WeakPolarHBondContact OD1-CG2 3.37Å; T216-E218 PolarHBondContact O-N 2.93Å; T216-E218 VanDerWaalsContact O-N 3.15Å; T216-E218 PolarHBondContact OG1-N 3.04Å; T216-L219 PolarHBondContact O-N 2.98Å; T216-L219 VanDerWaalsContact O-N 3.11Å; T216-D249 VanDerWaalsContact CA-OD2 3.25Å; T216-D249 WeakPolarHBondContact CA-OD2 3.42Å; T216-D249 WeakPolarHBondContact CB-OD2 3.47Å
217	C	91.7	Very high	93.7	Very high	50 Å²	50	41 Å²	41	34%	0.338	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-68.6	-9	176.9	-62.8	0	0	0	0	114.9	L219 L220 D249 C264	C217-L219 PolarHBondContact O-N 2.71Å; C217-L220 VanDerWaalsContact O-CB 3.3Å; C217-L220 WeakPolarHBondContact O-CB 3.31Å; C217-L220 PolarHBondContact O-N 3Å; C217-D249 PolarHBondContact N-OD2 3.32Å; C217-C264 WeakPolarHBondContact CA-SG 3.3Å; C217-C264 HydrophobicContact CB-CB 3.81Å; C217-C264 WeakPolarHBondContact CB-SG 3.47Å; C217-C264 WeakPolarHBondContact SG-CA 3.48Å; C217-C264 WeakPolarHBondContact SG-CB 3.49Å; C217-C264 CovalentContact SG-SG 2.05Å; C217-C264 PolarHBondContact SG-SG 3.43Å
218	E	91.4	Very high	93.6	Very high	170 Å²	170	43.1 Å²	43.1	79%	0.794	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-69.2	-23.2	170.8	-60.2	-177.3	165.3	0	0	112.3	T216 L220	T216-E218 PolarHBondContact O-N 2.93Å; T216-E218 VanDerWaalsContact O-N 3.15Å; T216-E218 PolarHBondContact OG1-N 3.04Å; E218-L220 VanDerWaalsContact C-N 3.32Å
219	L	93.6	Very high	93.4	Very high	6 Å²	6	44.4 Å²	44.4	3%	0.031	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-86.5	-0.2	176.9	-84	73.9	0	0	0	113.5	W213 N214 T216 C217 E221 L222 A223 V256 L259	W213-L219 HydrophobicContact CE3-CD2 3.98Å; N214-L219 WeakPolarHBondContact O-CD1 3.46Å; T216-L219 PolarHBondContact O-N 2.98Å; T216-L219 VanDerWaalsContact O-N 3.11Å; C217-L219 PolarHBondContact O-N 2.71Å; L219-E221 VanDerWaalsContact C-N 3.3Å; L219-E221 PolarHBondContact O-N 3.04Å; L219-L222 WeakPolarHBondContact O-CB 3.33Å; L219-L222 PolarHBondContact O-N 2.98Å; L219-L222 VanDerWaalsContact O-N 3.1Å; L219-A223 PolarHBondContact O-N 2.94Å; L219-V256 HydrophobicContact CD2-CG2 4.11Å; L219-L259 HydrophobicContact CB-CD1 3.72Å
220	L	93.1	Very high	93.3	Very high	44 Å²	44	47.1 Å²	47.1	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-58	-41.8	-174.5	-178.5	63.4	0	0	0	112.4	C217 E218 A223 A224 L259 E261	C217-L220 VanDerWaalsContact O-CB 3.3Å; C217-L220 WeakPolarHBondContact O-CB 3.31Å; C217-L220 PolarHBondContact O-N 3Å; E218-L220 VanDerWaalsContact C-N 3.32Å; L220-A223 PolarHBondContact O-N 2.83Å; L220-A224 PolarHBondContact O-N 2.79Å; L220-L259 HydrophobicContact CD1-CB 4.48Å; L220-E261 HydrophobicContact CD2-CG 4.02Å
221	E	93.9	Very high	93.2	Very high	136 Å²	136	49.9 Å²	49.9	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-65.2	-40.2	177.9	-64.8	-172.3	174	0	0	112	P194 L219 A224 V225	P194-E221 HydrophobicContact CG-CB 3.62Å; L219-E221 VanDerWaalsContact C-N 3.3Å; L219-E221 PolarHBondContact O-N 3.04Å; E221-A224 PolarHBondContact O-N 3.08Å; E221-V225 WeakPolarHBondContact O-CG2 3.41Å; E221-V225 PolarHBondContact O-N 2.82Å
222	L	93.8	Very high	93	Very high	2 Å²	2	54 Å²	54	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-45.5	176.4	176.1	64.7	0	0	0	110.5	V192 P194 F197 W213 L219 A224 V225 L226	V192-L222 HydrophobicContact CB-CD1 4.44Å; V192-L222 HydrophobicContact CB-CD2 4.01Å; P194-L222 HydrophobicContact CG-CB 4.33Å; F197-L222 HydrophobicContact CD2-CD1 4.24Å; F197-L222 HydrophobicContact CE2-CD1 3.81Å; W213-L222 HydrophobicContact CZ3-CD2 3.98Å; L219-L222 WeakPolarHBondContact O-CB 3.33Å; L219-L222 PolarHBondContact O-N 2.98Å; L219-L222 VanDerWaalsContact O-N 3.1Å; L222-A224 VanDerWaalsContact C-N 3.29Å; L222-A224 PolarHBondContact O-N 3.22Å; L222-V225 PolarHBondContact O-N 3.11Å; L222-L226 HydrophobicContact CD1-CD1 3.93Å; L222-L226 HydrophobicContact CD1-CG 4.06Å; L222-L226 HydrophobicContact CD2-CD1 4.5Å; L222-L226 HydrophobicContact CG-CD1 3.84Å; L222-L226 HydrophobicContact CG-CG 4.37Å; L222-L226 WeakPolarHBondContact O-CB 3.48Å; L222-L226 VanDerWaalsContact O-CG 3.26Å; L222-L226 WeakPolarHBondContact O-CG 3.05Å; L222-L226 PolarHBondContact O-N 3.13Å
223	A	93.9	Very high	92.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58.3	-41.8	176.6	0	0	0	0	0	111.9	L219 L220 L226 T227 V256 L259	L219-A223 PolarHBondContact O-N 2.94Å; L220-A223 PolarHBondContact O-N 2.83Å; A223-L226 PolarHBondContact O-N 3.24Å; A223-T227 VanDerWaalsContact O-CB 3.3Å; A223-T227 WeakPolarHBondContact O-CB 3.42Å; A223-T227 PolarHBondContact O-N 3.2Å; A223-T227 PolarHBondContact O-OG1 3.09Å; A223-V256 HydrophobicContact CB-CG1 4.09Å; A223-V256 WeakPolarHBondContact CB-O 3.28Å; A223-L259 HydrophobicContact CB-CB 3.86Å; A223-L259 HydrophobicContact CB-CD1 4.47Å
224	A	93.8	Very high	92.4	Very high	60 Å²	60	63.8 Å²	63.8	50%	0.496	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-46.9	176.3	0	0	0	0	0	112.2	L220 E221 L222 L226 T227 S228	L220-A224 PolarHBondContact O-N 2.79Å; E221-A224 PolarHBondContact O-N 3.08Å; L222-A224 VanDerWaalsContact C-N 3.29Å; L222-A224 PolarHBondContact O-N 3.22Å; A224-L226 PolarHBondContact O-N 3.16Å; A224-T227 PolarHBondContact O-N 3.28Å; A224-S228 PolarHBondContact O-N 2.97Å
225	V	93.3	Very high	92.3	Very high	63 Å²	63	63 Å²	63	38%	0.382	34%	0.343	S	S	.	.	H	α-helix	trans	-59.4	-46.4	176.6	167.8	0	0	0	0	111.2	P194 E221 L222 S228 F229	P194-V225 HydrophobicContact CB-CG2 3.98Å; E221-V225 WeakPolarHBondContact O-CG2 3.41Å; E221-V225 PolarHBondContact O-N 2.82Å; L222-V225 PolarHBondContact O-N 3.11Å; V225-S228 PolarHBondContact O-N 3.02Å; V225-F229 WeakPolarHBondContact O-CB 3.38Å; V225-F229 PolarHBondContact O-N 3.13Å
226	L	92.8	Very high	92.2	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-67.7	-36.3	179.9	-66.2	172.3	0	0	0	112.6	L206 L208 L222 A223 A224 F229 I230 L237 M243 V256 L257	L206-L226 HydrophobicContact CD2-CD2 3.76Å; L208-L226 HydrophobicContact CD1-CD1 4.23Å; L208-L226 HydrophobicContact CD1-CD2 4Å; L222-L226 HydrophobicContact CD1-CD1 3.93Å; L222-L226 HydrophobicContact CD1-CG 4.06Å; L222-L226 HydrophobicContact CD2-CD1 4.5Å; L222-L226 HydrophobicContact CG-CD1 3.84Å; L222-L226 HydrophobicContact CG-CG 4.37Å; L222-L226 WeakPolarHBondContact O-CB 3.48Å; L222-L226 VanDerWaalsContact O-CG 3.26Å; L222-L226 WeakPolarHBondContact O-CG 3.05Å; L222-L226 PolarHBondContact O-N 3.13Å; A223-L226 PolarHBondContact O-N 3.24Å; A224-L226 PolarHBondContact O-N 3.16Å; L226-F229 WeakPolarHBondContact O-CB 3.43Å; L226-F229 PolarHBondContact O-N 2.6Å; L226-I230 PolarHBondContact O-N 3.3Å; L226-I230 VanDerWaalsContact O-N 3.11Å; L226-L237 HydrophobicContact CD2-CD1 4.34Å; L226-M243 HydrophobicContact CD1-CE 3.53Å; L226-M243 HydrophobicContact CD1-SD 3.55Å; L226-M243 VanDerWaalsContact CD1-SD 3.55Å; L226-V256 HydrophobicContact CD1-CG1 4.44Å; L226-L257 HydrophobicContact CB-CD2 3.74Å
227	T	91.9	Very high	92	Very high	48 Å²	48	65.1 Å²	65.1	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-65.1	-40.6	175.3	-59.9	0	0	0	0	111.1	A223 A224 I230 Q231	A223-T227 VanDerWaalsContact O-CB 3.3Å; A223-T227 WeakPolarHBondContact O-CB 3.42Å; A223-T227 PolarHBondContact O-N 3.2Å; A223-T227 PolarHBondContact O-OG1 3.09Å; A224-T227 PolarHBondContact O-N 3.28Å; T227-I230 VanDerWaalsContact O-CG1 3.24Å; T227-I230 WeakPolarHBondContact O-CG1 3.32Å; T227-Q231 WeakPolarHBondContact O-CG 3.43Å
228	S	92.4	Very high	91.4	Very high	66 Å²	66	68.4 Å²	68.4	46%	0.462	37%	0.365	S	S	.	.	H	α-helix	trans	-66.3	-40.9	173.3	-171	0	0	0	0	111.5	A224 V225 I230 Q231	A224-S228 PolarHBondContact O-N 2.97Å; V225-S228 PolarHBondContact O-N 3.02Å; S228-I230 PolarHBondContact O-N 2.93Å; S228-Q231 PolarHBondContact O-N 3.35Å
229	F	92.1	Very high	89.6	Confident	29 Å²	29	65.9 Å²	65.9	13%	0.127	36%	0.357	C	S	.	.	H	α-helix	trans	-56.9	-46.8	179.4	-178.5	-97.6	0	0	0	111.7	L203 L206 V225 L226 Q231 E232 K235	L203-F229 HydrophobicContact CB-CE2 4.44Å; L203-F229 HydrophobicContact CD2-CE2 4.22Å; L203-F229 HydrophobicContact CD2-CZ 4.26Å; L203-F229 HydrophobicContact CG-CE2 4.38Å; L203-F229 HydrophobicContact CG-CZ 4.28Å; L203-F229 VanDerWaalsContact O-CE2 3.29Å; L203-F229 WeakPolarHBondContact O-CE2 3.49Å; L206-F229 HydrophobicContact CB-CE1 3.99Å; L206-F229 HydrophobicContact CB-CZ 4.14Å; V225-F229 WeakPolarHBondContact O-CB 3.38Å; V225-F229 PolarHBondContact O-N 3.13Å; L226-F229 WeakPolarHBondContact O-CB 3.43Å; L226-F229 PolarHBondContact O-N 2.6Å; F229-Q231 VanDerWaalsContact C-N 3.25Å; F229-Q231 PolarHBondContact O-N 2.89Å; F229-E232 PolarHBondContact O-N 2.93Å; F229-K235 HydrophobicContact CD1-CB 4.12Å; F229-K235 HydrophobicContact CD2-CB 4.42Å; F229-K235 HydrophobicContact CD2-CD 4.27Å; F229-K235 HydrophobicContact CD2-CG 4.29Å; F229-K235 HydrophobicContact CE1-CB 3.91Å; F229-K235 HydrophobicContact CE2-CB 4.24Å; F229-K235 HydrophobicContact CE2-CD 3.68Å; F229-K235 HydrophobicContact CE2-CG 4.11Å; F229-K235 HydrophobicContact CG-CB 4.37Å; F229-K235 HydrophobicContact CZ-CB 3.97Å; F229-K235 HydrophobicContact CZ-CD 3.93Å; F229-K235 HydrophobicContact CZ-CG 4.29Å; F229-K235 WeakPolarHBondContact O-CB 3.02Å; F229-K235 WeakPolarHBondContact O-CG 3.01Å
230	I	90	Very high	87.6	Confident	74 Å²	74	68.5 Å²	68.5	38%	0.379	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.1	-178.7	64.2	174.1	0	0	0	114.8	L226 T227 S228 E232 L237 L257	L226-I230 PolarHBondContact O-N 3.3Å; L226-I230 VanDerWaalsContact O-N 3.11Å; T227-I230 VanDerWaalsContact O-CG1 3.24Å; T227-I230 WeakPolarHBondContact O-CG1 3.32Å; S228-I230 PolarHBondContact O-N 2.93Å; I230-E232 VanDerWaalsContact C-N 3.34Å; I230-L237 HydrophobicContact CG2-CB 3.34Å; I230-L237 HydrophobicContact CG2-CD2 4.01Å; I230-L237 HydrophobicContact CG2-CG 4.34Å; I230-L257 HydrophobicContact CD1-CD1 4.34Å
231	Q	91.3	Very high	85.7	Confident	151 Å²	151	76.6 Å²	76.6	71%	0.706	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-17.6	174.9	-73.5	176.6	4.2	0	0	112.4	T227 S228 F229	T227-Q231 WeakPolarHBondContact O-CG 3.43Å; S228-Q231 PolarHBondContact O-N 3.35Å; F229-Q231 VanDerWaalsContact C-N 3.25Å; F229-Q231 PolarHBondContact O-N 2.89Å
232	E	92.4	Very high	84.3	Confident	99 Å²	99	75.9 Å²	75.9	46%	0.463	40%	0.404	S	S	.	.	S	Bend	trans	-77.7	139	176	-71.3	-178	-150.1	0	0	111.2	F229 I230 D234 K235	F229-E232 PolarHBondContact O-N 2.93Å; I230-E232 VanDerWaalsContact C-N 3.34Å; E232-D234 VanDerWaalsContact C-N 3.34Å; E232-D234 PolarHBondContact O-N 3.35Å; E232-K235 HydrophobicContact CB-CB 4.01Å; E232-K235 HydrophobicContact CB-CG 3.37Å; E232-K235 HydrophobicContact CG-CG 4.27Å; E232-K235 PolarHBondContact O-N 2.87Å; E232-K235 WeakPolarHBondContact OE2-CE 3.36Å; E232-K235 WeakPolarHBondContact OE2-CG 2.92Å
233	P	88.8	Confident	84.1	Confident	127 Å²	127	75.9 Å²	75.9	83%	0.825	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-28.9	-167.8	25.8	-35.1	0	0	0	114.8
234	D	89.9	Confident	84	Confident	136 Å²	136	81.8 Å²	81.8	73%	0.727	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	12.8	-178.1	-59.9	-47.7	0	0	0	112.4	S204 E232	S204-D234 VanDerWaalsContact CB-O 3.3Å; S204-D234 WeakPolarHBondContact CB-O 3.46Å; E232-D234 VanDerWaalsContact C-N 3.34Å; E232-D234 PolarHBondContact O-N 3.35Å
235	K	91.7	Very high	83.9	Confident	41 Å²	41	80.1 Å²	80.1	18%	0.178	42%	0.417	C	S	.	.			trans	-109.4	130.7	-178.5	-57.4	-58.6	-166.6	-179.4	0	110.3	L203 S204 F229 E232	L203-K235 WeakPolarHBondContact O-CD 3.35Å; L203-K235 VanDerWaalsContact O-CE 3.28Å; L203-K235 WeakPolarHBondContact O-CE 3.34Å; L203-K235 PolarHBondContact O-NZ 2.98Å; S204-K235 CarbonylContact O-C 3.51Å; S204-K235 WeakPolarHBondContact O-CA 3.5Å; F229-K235 HydrophobicContact CD1-CB 4.12Å; F229-K235 HydrophobicContact CD2-CB 4.42Å; F229-K235 HydrophobicContact CD2-CD 4.27Å; F229-K235 HydrophobicContact CD2-CG 4.29Å; F229-K235 HydrophobicContact CE1-CB 3.91Å; F229-K235 HydrophobicContact CE2-CB 4.24Å; F229-K235 HydrophobicContact CE2-CD 3.68Å; F229-K235 HydrophobicContact CE2-CG 4.11Å; F229-K235 HydrophobicContact CG-CB 4.37Å; F229-K235 HydrophobicContact CZ-CB 3.97Å; F229-K235 HydrophobicContact CZ-CD 3.93Å; F229-K235 HydrophobicContact CZ-CG 4.29Å; F229-K235 WeakPolarHBondContact O-CB 3.02Å; F229-K235 WeakPolarHBondContact O-CG 3.01Å; E232-K235 HydrophobicContact CB-CB 4.01Å; E232-K235 HydrophobicContact CB-CG 3.37Å; E232-K235 HydrophobicContact CG-CG 4.27Å; E232-K235 PolarHBondContact O-N 2.87Å; E232-K235 WeakPolarHBondContact OE2-CE 3.36Å; E232-K235 WeakPolarHBondContact OE2-CG 2.92Å
236	A	90.9	Very high	84	Confident	35 Å²	35	82.2 Å²	82.2	29%	0.289	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	114.2	179	0	0	0	0	0	109.5	S204 N205 L206 Y238	S204-A236 PolarHBondContact O-N 3.33Å; N205-A236 WeakPolarHBondContact CA-O 3.33Å; L206-A236 PolarHBondContact N-O 3.1Å; A236-Y238 HydrophobicContact CB-CD2 3.97Å; A236-Y238 HydrophobicContact CB-CE2 3.67Å
237	L	89.3	Confident	84	Confident	29 Å²	29	84.9 Å²	84.9	15%	0.152	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	102	158.5	-173.6	66.7	0	0	0	106.5	L206 L226 I230 M243 L257	L206-L237 HydrophobicContact CB-CD1 4.12Å; L206-L237 HydrophobicContact CD2-CD1 4.14Å; L206-L237 HydrophobicContact CG-CD1 3.95Å; L206-L237 CarbonylContact O-C 3.22Å; L206-L237 VanDerWaalsContact O-CA 3.31Å; L206-L237 WeakPolarHBondContact O-CA 3.49Å; L226-L237 HydrophobicContact CD2-CD1 4.34Å; I230-L237 HydrophobicContact CG2-CB 3.34Å; I230-L237 HydrophobicContact CG2-CD2 4.01Å; I230-L237 HydrophobicContact CG2-CG 4.34Å; L237-M243 HydrophobicContact CD1-SD 4.46Å; L237-M243 HydrophobicContact CD2-SD 4.1Å; L237-L257 HydrophobicContact CD2-CD1 4.03Å; L237-L257 HydrophobicContact CD2-CD2 4.22Å
238	Y	78.8	Confident	83.9	Confident	118 Å²	118	84.2 Å²	84.2	46%	0.463	45%	0.448	S	S	.	.	S	Bend	trans	-63.3	147.3	-169.6	-88.1	-97.2	0	0	0	112.7	N205 L206 A236	N205-Y238 HydrophobicContact CB-CD2 4.15Å; N205-Y238 HydrophobicContact CB-CE2 3.62Å; N205-Y238 VanDerWaalsContact ND2-CE2 3.31Å; N205-Y238 WeakPolarHBondContact ND2-CE2 3.42Å; N205-Y238 PolarHBondContact ND2-OH 2.82Å; N205-Y238 VanDerWaalsContact ND2-OH 3.11Å; L206-Y238 PolarHBondContact O-N 3.5Å; A236-Y238 HydrophobicContact CB-CD2 3.97Å; A236-Y238 HydrophobicContact CB-CE2 3.67Å
239	N	54.2	Low	83.8	Confident	118 Å²	118	86.3 Å²	86.3	63%	0.631	45%	0.454	S	S	*	.	S	Bend	trans	64.2	95.4	-176	-97.8	-10.3	0	0	0	116.6	D209 R241 R242	D209-N239 WeakPolarHBondContact OD2-CB 3.45Å; N239-R241 PolarHBondContact O-N 3.37Å; N239-R242 PolarHBondContact O-N 3.39Å; N239-R242 VanDerWaalsContact O-N 3.14Å
240	G	52.5	Low	83.6	Confident	60 Å²	60	87 Å²	87	62%	0.619	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	23.5	179.8	0	0	0	0	0	118.4	R242	G240-R242 PolarHBondContact O-NE 2.87Å
241	R	52.4	Low	83.5	Confident	214 Å²	214	89.4 Å²	89.4	81%	0.808	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	24.8	165.9	-63.7	-164.1	-176.8	-145.5	2	115.7	N239	N239-R241 PolarHBondContact O-N 3.37Å
242	R	65	Low	83.4	Confident	122 Å²	122	86 Å²	86	46%	0.46	48%	0.477	S	S	.	.				75.3	81.5	118.7	-55.3	155.7	-154.5	-176.6	-2.3	116.1	N239 G240 M244 T255	N239-R242 PolarHBondContact O-N 3.39Å; N239-R242 VanDerWaalsContact O-N 3.14Å; G240-R242 PolarHBondContact O-NE 2.87Å; R242-M244 WeakPolarHBondContact O-CA 3.26Å; R242-M244 PolarHBondContact O-N 2.81Å; R242-T255 HydrophobicContact CB-CG2 3.68Å; R242-T255 VanDerWaalsContact O-CB 3.24Å; R242-T255 WeakPolarHBondContact O-CB 3.2Å; R242-T255 WeakPolarHBondContact O-CG2 3.5Å
243	M	88.4	Confident	83.4	Confident	1 Å²	1	81.6 Å²	81.6	1%	0.005	46%	0.457	C	S	.	.			trans	30.5	58.8	151.2	-65.9	-179.7	68.1	0	0	113.8	L208 D209 W213 L226 L237 V256	L208-M243 HydrophobicContact CB-CE 3.9Å; L208-M243 HydrophobicContact CB-CG 4.07Å; L208-M243 HydrophobicContact CB-SD 3.87Å; L208-M243 HydrophobicContact CD1-CE 3.81Å; L208-M243 HydrophobicContact CD1-SD 4.09Å; L208-M243 HydrophobicContact CG-CE 4.49Å; D209-M243 PolarHBondContact OD1-N 3.01Å; W213-M243 HydrophobicContact CD2-CE 3.98Å; W213-M243 VanDerWaalsContact CE2-CE 3.48Å; W213-M243 HydrophobicContact CE3-CE 4.36Å; W213-M243 HydrophobicContact CH2-CE 3.93Å; W213-M243 HydrophobicContact CZ2-CE 3.52Å; W213-M243 HydrophobicContact CZ3-CE 4.32Å; L226-M243 HydrophobicContact CD1-CE 3.53Å; L226-M243 HydrophobicContact CD1-SD 3.55Å; L226-M243 VanDerWaalsContact CD1-SD 3.55Å; L237-M243 HydrophobicContact CD1-SD 4.46Å; L237-M243 HydrophobicContact CD2-SD 4.1Å; M243-V256 HydrophobicContact CB-CB 4.03Å; M243-V256 HydrophobicContact CB-CG2 4.1Å; M243-V256 HydrophobicContact CE-CB 4.09Å; M243-V256 HydrophobicContact CE-CG1 4.07Å; M243-V256 HydrophobicContact CE-CG2 4.11Å; M243-V256 PolarHBondContact O-N 3.43Å
244	M	91.6	Very high	83.5	Confident	124 Å²	124	79.4 Å²	79.4	61%	0.611	44%	0.441	S	S	*	.	B	Isolated β-bridge	trans	-68.6	140.6	-167.2	-70.8	-166.8	-61.7	0	0	110.1	R242	R242-M244 WeakPolarHBondContact O-CA 3.26Å; R242-M244 PolarHBondContact O-N 2.81Å
245	C	93.4	Very high	83.7	Confident	26 Å²	26	73.3 Å²	73.3	18%	0.176	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	131	177.2	-51.8	0	0	0	0	109.8	W213 C215 A248 T254 T255	W213-C245 CarbonylContact O-C 3.28Å; W213-C245 WeakPolarHBondContact O-CA 3.3Å; C215-C245 HydrophobicContact CB-CB 3.69Å; C215-C245 WeakPolarHBondContact CB-SG 3.49Å; C215-C245 WeakPolarHBondContact SG-CB 3.49Å; C215-C245 CovalentContact SG-SG 2.01Å; C215-C245 PolarHBondContact SG-SG 3.45Å; C245-A248 HydrophobicContact CB-CB 4.47Å; C245-T254 PolarHBondContact N-O 3.38Å; C245-T255 WeakPolarHBondContact SG-CA 3.35Å; C245-T255 PolarHBondContact SG-N 3.05Å; C245-T255 VanDerWaalsContact SG-N 3.41Å
246	V	94.1	Very high	83.7	Confident	107 Å²	107	71.3 Å²	71.3	65%	0.648	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	-33	166	177.9	0	0	0	0	110.2	W213	W213-V246 PolarHBondContact O-N 2.96Å
247	S	92.3	Very high	83.8	Confident	57 Å²	57	71.6 Å²	71.6	40%	0.399	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	153.3	173.7	49.3	0	0	0	0	109.8	N214 C215	N214-S247 CarbonylContact C-O 3.59Å; N214-S247 VanDerWaalsContact CG-OG 3.29Å; N214-S247 PolarHBondContact OD1-OG 3.05Å; C215-S247 PolarHBondContact N-O 3.47Å
248	A	91.6	Very high	83.9	Confident	34 Å²	34	73.4 Å²	73.4	28%	0.281	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	145.7	176.2	0	0	0	0	0	110.5	C215 C245 N250 V253	C215-A248 HydrophobicContact CB-CB 3.9Å; C215-A248 VanDerWaalsContact O-CA 3.31Å; C215-A248 WeakPolarHBondContact O-CA 3.26Å; C245-A248 HydrophobicContact CB-CB 4.47Å; A248-N250 VanDerWaalsContact C-N 3.33Å; A248-V253 HydrophobicContact CB-CB 4.28Å
249	D	89	Confident	84.6	Confident	110 Å²	110	68.2 Å²	68.2	59%	0.588	39%	0.385	S	S	*	.	S	Bend	trans	-68.3	-37.2	174.2	-71.7	-28.1	0	0	0	111.1	C215 T216 C217	C215-D249 PolarHBondContact O-N 3.26Å; T216-D249 VanDerWaalsContact CA-OD2 3.25Å; T216-D249 WeakPolarHBondContact CA-OD2 3.42Å; T216-D249 WeakPolarHBondContact CB-OD2 3.47Å; C217-D249 PolarHBondContact N-OD2 3.32Å
250	N	88.6	Confident	86.4	Confident	45 Å²	45	65.8 Å²	65.8	24%	0.241	37%	0.374	C	S	.	.	S	Bend	trans	-102.2	116.9	176.5	-169.4	-39.6	0	0	0	110	A248 A252 V253 N263	A248-N250 VanDerWaalsContact C-N 3.33Å; N250-A252 PolarHBondContact O-N 3.06Å; N250-A252 VanDerWaalsContact OD1-CB 3.32Å; N250-A252 WeakPolarHBondContact OD1-CB 3.44Å; N250-A252 PolarHBondContact OD1-N 2.98Å; N250-V253 HydrophobicContact CB-CG2 3.99Å; N250-V253 WeakPolarHBondContact O-CB 3.49Å; N250-V253 PolarHBondContact O-N 3.4Å; N250-N263 HydrophobicContact CB-CB 4.33Å; N250-N263 WeakPolarHBondContact ND2-CB 3.47Å; N250-N263 PolarHBondContact ND2-O 3.32Å
251	P	87.5	Confident	88.2	Confident	124 Å²	124	70.2 Å²	70.2	81%	0.805	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.3	-179	-24.3	33.7	0	0	0	115.2	V253	P251-V253 VanDerWaalsContact C-N 3.3Å
252	A	89.2	Confident	89.8	Confident	78 Å²	78	64.1 Å²	64.1	65%	0.645	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-15.7	175.7	0	0	0	0	0	113.1	N250	N250-A252 PolarHBondContact O-N 3.06Å; N250-A252 VanDerWaalsContact OD1-CB 3.32Å; N250-A252 WeakPolarHBondContact OD1-CB 3.44Å; N250-A252 PolarHBondContact OD1-N 2.98Å
253	V	91.8	Very high	90.9	Very high	8 Å²	8	59.9 Å²	59.9	5%	0.048	36%	0.36	C	S	.	.			trans	-88.8	116	179.2	176.9	0	0	0	0	109	C215 A248 N250 P251 T255 E258 L259 N263	C215-V253 HydrophobicContact CB-CG1 4.04Å; A248-V253 HydrophobicContact CB-CB 4.28Å; N250-V253 HydrophobicContact CB-CG2 3.99Å; N250-V253 WeakPolarHBondContact O-CB 3.49Å; N250-V253 PolarHBondContact O-N 3.4Å; P251-V253 VanDerWaalsContact C-N 3.3Å; V253-T255 WeakPolarHBondContact CG1-O 3.33Å; V253-E258 HydrophobicContact CG1-CB 4.25Å; V253-L259 HydrophobicContact CG1-CD2 3.9Å; V253-L259 HydrophobicContact CG1-CG 3.92Å; V253-L259 HydrophobicContact CG2-CD2 4.29Å; V253-N263 HydrophobicContact CG2-CB 4.08Å
254	T	92.2	Very high	90.7	Very high	80 Å²	80	61.1 Å²	61.1	49%	0.491	37%	0.369	S	S	.	.			trans	-110	-17.9	-179.9	64.5	0	0	0	0	113.1	C245 E258	C245-T254 PolarHBondContact N-O 3.38Å; T254-E258 PolarHBondContact N-OE2 3.14Å; T254-E258 PolarHBondContact OG1-OE1 3.09Å; T254-E258 PolarHBondContact OG1-OE2 3.2Å
255	T	92.9	Very high	89.7	Confident	8 Å²	8	59.7 Å²	59.7	5%	0.049	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-136.5	154	179.5	73	0	0	0	0	110.9	R242 C245 V253 L257 E258	R242-T255 HydrophobicContact CB-CG2 3.68Å; R242-T255 VanDerWaalsContact O-CB 3.24Å; R242-T255 WeakPolarHBondContact O-CB 3.2Å; R242-T255 WeakPolarHBondContact O-CG2 3.5Å; C245-T255 WeakPolarHBondContact SG-CA 3.35Å; C245-T255 PolarHBondContact SG-N 3.05Å; C245-T255 VanDerWaalsContact SG-N 3.41Å; V253-T255 WeakPolarHBondContact CG1-O 3.33Å; T255-L257 PolarHBondContact O-N 2.99Å; T255-E258 PolarHBondContact N-OE2 3.05Å; T255-E258 WeakPolarHBondContact O-CB 3.37Å; T255-E258 PolarHBondContact O-N 3.26Å; T255-E258 WeakPolarHBondContact OG1-CG 3.34Å
256	V	92.9	Very high	88	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-56.4	-36.3	177.4	173.1	0	0	0	0	111.6	W213 L219 A223 L226 M243 E258 L259	W213-V256 HydrophobicContact CB-CG2 3.64Å; W213-V256 HydrophobicContact CD2-CG2 3.97Å; W213-V256 HydrophobicContact CE3-CG2 4.33Å; W213-V256 HydrophobicContact CG-CG2 3.64Å; L219-V256 HydrophobicContact CD2-CG2 4.11Å; A223-V256 HydrophobicContact CB-CG1 4.09Å; A223-V256 WeakPolarHBondContact CB-O 3.28Å; L226-V256 HydrophobicContact CD1-CG1 4.44Å; M243-V256 HydrophobicContact CB-CB 4.03Å; M243-V256 HydrophobicContact CB-CG2 4.1Å; M243-V256 HydrophobicContact CE-CB 4.09Å; M243-V256 HydrophobicContact CE-CG1 4.07Å; M243-V256 HydrophobicContact CE-CG2 4.11Å; M243-V256 PolarHBondContact O-N 3.43Å; V256-E258 PolarHBondContact O-N 2.04Å; V256-L259 WeakPolarHBondContact O-CB 3.23Å; V256-L259 PolarHBondContact O-N 2.86Å
257	L	91.9	Very high	86	Confident	40 Å²	40	63 Å²	63	21%	0.209	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-71.6	-11.8	-179.3	-60.6	178.3	0	0	0	114	L226 I230 L237 T255	L226-L257 HydrophobicContact CB-CD2 3.74Å; I230-L257 HydrophobicContact CD1-CD1 4.34Å; L237-L257 HydrophobicContact CD2-CD1 4.03Å; L237-L257 HydrophobicContact CD2-CD2 4.22Å; T255-L257 PolarHBondContact O-N 2.99Å
258	E	92.1	Very high	83.9	Confident	67 Å²	67	67.5 Å²	67.5	31%	0.313	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-86.5	-9.7	174.4	-74.2	166.2	-173.6	0	0	112.4	V253 T254 T255 V256 T260 N263	V253-E258 HydrophobicContact CG1-CB 4.25Å; T254-E258 PolarHBondContact N-OE2 3.14Å; T254-E258 PolarHBondContact OG1-OE1 3.09Å; T254-E258 PolarHBondContact OG1-OE2 3.2Å; T255-E258 PolarHBondContact N-OE2 3.05Å; T255-E258 WeakPolarHBondContact O-CB 3.37Å; T255-E258 PolarHBondContact O-N 3.26Å; T255-E258 WeakPolarHBondContact OG1-CG 3.34Å; V256-E258 PolarHBondContact O-N 2.04Å; E258-T260 PolarHBondContact O-N 2.03Å; E258-N263 PolarHBondContact O-ND2 2.85Å
259	L	92.3	Very high	82.1	Confident	10 Å²	10	72.3 Å²	72.3	5%	0.052	43%	0.429	C	S	.	.			trans	-65.4	129.1	175.3	-74.2	166.4	0	0	0	110.8	C215 L219 L220 A223 V253 V256	C215-L259 HydrophobicContact CB-CD1 4.02Å; C215-L259 HydrophobicContact CB-CD2 4.37Å; C215-L259 HydrophobicContact CB-CG 4.35Å; L219-L259 HydrophobicContact CB-CD1 3.72Å; L220-L259 HydrophobicContact CD1-CB 4.48Å; A223-L259 HydrophobicContact CB-CB 3.86Å; A223-L259 HydrophobicContact CB-CD1 4.47Å; V253-L259 HydrophobicContact CG1-CD2 3.9Å; V253-L259 HydrophobicContact CG1-CG 3.92Å; V253-L259 HydrophobicContact CG2-CD2 4.29Å; V256-L259 WeakPolarHBondContact O-CB 3.23Å; V256-L259 PolarHBondContact O-N 2.86Å
260	T	92.3	Very high	79.9	Confident	66 Å²	66	74.3 Å²	74.3	41%	0.405	44%	0.44	S	S	.	.			trans	-144.3	162.2	179.1	62.2	0	0	0	0	109.2	E258 A262 N263 C264	E258-T260 PolarHBondContact O-N 2.03Å; T260-A262 PolarHBondContact O-N 3.26Å; T260-A262 VanDerWaalsContact O-N 3.13Å; T260-N263 PolarHBondContact N-ND2 2.92Å; T260-N263 PolarHBondContact N-OD1 3.33Å; T260-N263 PolarHBondContact O-N 3.41Å; T260-N263 PolarHBondContact O-OD1 2.86Å; T260-N263 PolarHBondContact OG1-ND2 2.96Å; T260-C264 PolarHBondContact O-N 3.1Å
261	E	90	Very high	78.2	Confident	154 Å²	154	78 Å²	78	72%	0.72	46%	0.459	S	S	*	.	H	α-helix	trans	-53.9	-36.2	174	-68.9	-178.6	-176.9	0	0	112.1	L220 N263 C264 V265	L220-E261 HydrophobicContact CD2-CG 4.02Å; E261-N263 PolarHBondContact O-N 2.85Å; E261-C264 PolarHBondContact O-N 3.17Å; E261-C264 VanDerWaalsContact O-N 3.15Å; E261-V265 WeakPolarHBondContact O-CG2 3.4Å; E261-V265 PolarHBondContact O-N 3.01Å
262	A	87.1	Confident	76.1	Confident	86 Å²	86	77.4 Å²	77.4	71%	0.711	45%	0.453	S	S	*	.	H	α-helix	trans	-64.5	-36.5	-177.6	0	0	0	0	0	113.9	T260 C264	T260-A262 PolarHBondContact O-N 3.26Å; T260-A262 VanDerWaalsContact O-N 3.13Å; A262-C264 VanDerWaalsContact C-N 3.33Å
263	N	88.1	Confident	74.2	Confident	32 Å²	32	78.8 Å²	78.8	17%	0.171	45%	0.453	C	S	.	.	H	α-helix	trans	-87.5	-6.4	177.2	57.8	45.6	0	0	0	113.4	N250 V253 E258 T260 E261	N250-N263 HydrophobicContact CB-CB 4.33Å; N250-N263 WeakPolarHBondContact ND2-CB 3.47Å; N250-N263 PolarHBondContact ND2-O 3.32Å; V253-N263 HydrophobicContact CG2-CB 4.08Å; E258-N263 PolarHBondContact O-ND2 2.85Å; T260-N263 PolarHBondContact N-ND2 2.92Å; T260-N263 PolarHBondContact N-OD1 3.33Å; T260-N263 PolarHBondContact O-N 3.41Å; T260-N263 PolarHBondContact O-OD1 2.86Å; T260-N263 PolarHBondContact OG1-ND2 2.96Å; E261-N263 PolarHBondContact O-N 2.85Å
264	C	84.8	Confident	72	Confident	27 Å²	27	86 Å²	86	18%	0.182	49%	0.486	C	S	.	.	H	α-helix	trans	-100.3	-1.4	176.8	-90.2	0	0	0	0	115.4	C217 T260 E261 A262	C217-C264 WeakPolarHBondContact CA-SG 3.3Å; C217-C264 HydrophobicContact CB-CB 3.81Å; C217-C264 WeakPolarHBondContact CB-SG 3.47Å; C217-C264 WeakPolarHBondContact SG-CA 3.48Å; C217-C264 WeakPolarHBondContact SG-CB 3.49Å; C217-C264 CovalentContact SG-SG 2.05Å; C217-C264 PolarHBondContact SG-SG 3.43Å; T260-C264 PolarHBondContact O-N 3.1Å; E261-C264 PolarHBondContact O-N 3.17Å; E261-C264 VanDerWaalsContact O-N 3.15Å; A262-C264 VanDerWaalsContact C-N 3.33Å
265	V	70.4	Confident	70	Confident	95 Å²	95	88.8 Å²	88.8	58%	0.576	50%	0.497	S	S	*	.	S	Bend	trans	-80.7	124.6	168.7	176.3	0	0	0	0	108.4	E261 S267	E261-V265 WeakPolarHBondContact O-CG2 3.4Å; E261-V265 PolarHBondContact O-N 3.01Å; V265-S267 PolarHBondContact O-N 2.78Å
266	P	56.9	Low	67.6	Low	84 Å²	84	96.8 Å²	96.8	55%	0.545	53%	0.533	S	S	.	.			trans	-58	128.8	174.5	-18.9	29	0	0	0	109.9	N268 Q269	P266-N268 PolarHBondContact O-N 3.34Å; P266-Q269 PolarHBondContact O-N 2.99Å
267	S	52.3	Low	65.3	Low	117 Å²	117	100.5 Å²	100.5	82%	0.818	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-1.8	-177.7	-47.4	0	0	0	0	115.1	V265	V265-S267 PolarHBondContact O-N 2.78Å
268	N	48.9	Very low	63.1	Low	153 Å²	153	110.5 Å²	110.5	82%	0.818	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	22.3	-173.3	-75.6	-23	0	0	0	115.3	P266 N270	P266-N268 PolarHBondContact O-N 3.34Å; N268-N270 PolarHBondContact O-N 3Å
269	Q	52.2	Low	61	Low	135 Å²	135	110.1 Å²	110.1	63%	0.631	61%	0.612	S	S	*	*			trans	-95.4	86.5	157.5	-71.6	-165	-4	0	0	109.1	P266 I271	P266-Q269 PolarHBondContact O-N 2.99Å; Q269-I271 HydrophobicContact CB-CG1 3.91Å; Q269-I271 PolarHBondContact O-N 2.76Å
270	N	43.2	Very low	58.7	Low	151 Å²	151	115 Å²	115	81%	0.807	65%	0.648	S	S	*	*			trans	-56.2	87.1	142.9	-79	-13.5	0	0	0	106	N268 T272	N268-N270 PolarHBondContact O-N 3Å; N270-T272 PolarHBondContact O-N 2.99Å
271	I	53	Low	56.8	Low	123 Å²	123	116.4 Å²	116.4	63%	0.631	66%	0.656	S	S	*	*			trans	-69	80.8	165.1	-54.2	177.4	0	0	0	104.5	Q269 V273	Q269-I271 HydrophobicContact CB-CG1 3.91Å; Q269-I271 PolarHBondContact O-N 2.76Å; I271-V273 HydrophobicContact CG2-CG2 3.7Å; I271-V273 PolarHBondContact O-N 3.39Å
272	T	44.7	Very low	55.1	Low	112 Å²	112	111.4 Å²	111.4	69%	0.687	64%	0.641	S	S	*	*			trans	-61.4	94.9	151.4	32.9	0	0	0	0	104.7	N270 Q274	N270-T272 PolarHBondContact O-N 2.99Å; T272-Q274 PolarHBondContact O-N 2.86Å
273	V	49.3	Very low	53.6	Low	106 Å²	106	112.9 Å²	112.9	64%	0.642	64%	0.643	S	S	*	*			trans	-61.4	89.5	162.9	-174.1	0	0	0	0	105	I271 I275	I271-V273 HydrophobicContact CG2-CG2 3.7Å; I271-V273 PolarHBondContact O-N 3.39Å; V273-I275 HydrophobicContact CG1-CG1 3.67Å; V273-I275 PolarHBondContact O-N 3.42Å
274	Q	44.8	Very low	52	Low	160 Å²	160	119.5 Å²	119.5	75%	0.748	67%	0.673	S	S	*	*			trans	-67.4	89.7	160.4	-75.9	-87.6	-19.2	0	0	104.2	T272 E276	T272-Q274 PolarHBondContact O-N 2.86Å; Q274-E276 PolarHBondContact O-N 3.24Å
275	I	49.2	Very low	50.7	Low	139 Å²	139	122.8 Å²	122.8	71%	0.713	69%	0.686	S	S	*	*			trans	-64.5	88.3	162.4	-53.9	175.3	0	0	0	104.1	V273 A277	V273-I275 HydrophobicContact CG1-CG1 3.67Å; V273-I275 PolarHBondContact O-N 3.42Å; I275-A277 PolarHBondContact O-N 2.67Å
276	E	43	Very low	50.2	Low	176 Å²	176	126.3 Å²	126.3	82%	0.822	69%	0.69	S	S	*	*			trans	-65.4	88.7	156.3	-86.4	-170.1	158.4	0	0	105.5	Q274 R278	Q274-E276 PolarHBondContact O-N 3.24Å; E276-R278 VanDerWaalsContact C-N 3.31Å; E276-R278 PolarHBondContact O-N 3.23Å
277	A	46	Very low	50.7	Low	77 Å²	77	125.2 Å²	125.2	64%	0.636	69%	0.688	S	S	*	*			trans	-53.7	105.4	162.5	0	0	0	0	0	105.7	I275 G279	I275-A277 PolarHBondContact O-N 2.67Å; A277-G279 VanDerWaalsContact C-N 3.29Å; A277-G279 PolarHBondContact O-N 3.15Å
278	R	44.4	Very low	51.7	Low	251 Å²	251	126.7 Å²	126.7	95%	0.947	68%	0.676	S	S	*	*	S	Bend	trans	-58.9	97.9	175	-133.3	-179.1	-171.7	-174.7	2.8	107.1	E276	E276-R278 VanDerWaalsContact C-N 3.31Å; E276-R278 PolarHBondContact O-N 3.23Å
279	G	47.9	Very low	52.8	Low	58 Å²	58	123.3 Å²	123.3	60%	0.598	66%	0.658	S	S	*	*			trans	61.5	86.4	170.4	0	0	0	0	0	115.1	A277 V281	A277-G279 VanDerWaalsContact C-N 3.29Å; A277-G279 PolarHBondContact O-N 3.15Å; G279-V281 PolarHBondContact O-N 3.05Å
280	S	44.6	Very low	53.9	Low	113 Å²	113	122.2 Å²	122.2	79%	0.79	66%	0.655	S	S	*	*			trans	-63.3	93.6	142	53.9	0	0	0	0	107.1	A282	S280-A282 PolarHBondContact O-N 3.02Å; S280-A282 VanDerWaalsContact O-N 3.07Å
281	V	53	Low	55.4	Low	96 Å²	96	117.6 Å²	117.6	58%	0.582	64%	0.638	S	S	*	*			trans	-55.3	116.3	171.6	177.6	0	0	0	0	106.8	G279 Q285	G279-V281 PolarHBondContact O-N 3.05Å; V281-Q285 HydrophobicContact CG1-CB 3.73Å
282	A	53.3	Low	56.6	Low	49 Å²	49	115.7 Å²	115.7	41%	0.405	63%	0.629	S	S	.	*			trans	-55.8	136.4	178.7	0	0	0	0	0	109.2	S280 Q284 Q285	S280-A282 PolarHBondContact O-N 3.02Å; S280-A282 VanDerWaalsContact O-N 3.07Å; A282-Q284 PolarHBondContact O-N 3.46Å; A282-Q285 PolarHBondContact O-N 3.12Å
283	P	55.8	Low	58.1	Low	117 Å²	117	112.7 Å²	112.7	76%	0.76	62%	0.615	S	S	*	*	H	α-helix	trans	-56.9	-18.9	-175	15.7	-28	0	0	0	114.3
284	Q	55.1	Low	59.5	Low	171 Å²	171	110.4 Å²	110.4	80%	0.799	61%	0.607	S	S	*	*	H	α-helix	trans	-71.2	-31.9	173.2	-76.7	-176.6	-23.4	0	0	114.1	A282 R288	A282-Q284 PolarHBondContact O-N 3.46Å; Q284-R288 PolarHBondContact O-N 3.19Å
285	Q	56.9	Low	61.4	Low	96 Å²	96	106.9 Å²	106.9	45%	0.449	60%	0.596	S	S	.	*	H	α-helix	trans	-70.3	-39.7	179.9	-132.9	110.3	-0.1	0	0	110.8	V281 A282 A287 R288 D289	V281-Q285 HydrophobicContact CG1-CB 3.73Å; A282-Q285 PolarHBondContact O-N 3.12Å; Q285-A287 PolarHBondContact O-N 2.93Å; Q285-R288 PolarHBondContact O-N 3.23Å; Q285-D289 PolarHBondContact O-N 2.88Å; Q285-D289 VanDerWaalsContact O-N 3.09Å
286	Y	60.1	Low	62.9	Low	168 Å²	168	105.5 Å²	105.5	66%	0.659	59%	0.589	S	S	*	*	H	α-helix	trans	-65	-40.9	-179.3	-161.2	-94.3	0	0	0	112.4	R288 L290	Y286-R288 VanDerWaalsContact C-N 3.34Å; Y286-R288 PolarHBondContact O-N 3.19Å; Y286-L290 WeakPolarHBondContact O-CB 3.38Å; Y286-L290 PolarHBondContact O-N 3.36Å
287	A	67.4	Low	64.6	Low	61 Å²	61	101.7 Å²	101.7	50%	0.504	58%	0.581	S	S	.	*	H	α-helix	trans	-65.4	-37.2	176.5	0	0	0	0	0	112.4	Q285 A291	Q285-A287 PolarHBondContact O-N 2.93Å; A287-A291 WeakPolarHBondContact O-CB 3.33Å; A287-A291 PolarHBondContact O-N 3.25Å
288	R	72.3	Confident	66.6	Low	148 Å²	148	105.5 Å²	105.5	56%	0.558	58%	0.584	S	S	*	*	H	α-helix	trans	-66.9	-45.5	178.2	-167.1	-174.4	72.7	179.2	3.7	111.6	Q284 Q285 Y286 A291 I292	Q284-R288 PolarHBondContact O-N 3.19Å; Q285-R288 PolarHBondContact O-N 3.23Å; Y286-R288 VanDerWaalsContact C-N 3.34Å; Y286-R288 PolarHBondContact O-N 3.19Å; R288-A291 PolarHBondContact O-N 3.31Å; R288-I292 HydrophobicContact CG-CD1 4.16Å; R288-I292 VanDerWaalsContact O-CG1 3.3Å; R288-I292 WeakPolarHBondContact O-CG1 3.37Å; R288-I292 PolarHBondContact O-N 2.93Å
289	D	73.4	Confident	68.5	Low	83 Å²	83	99.1 Å²	99.1	44%	0.444	57%	0.567	S	S	.	*	H	α-helix	trans	-71.3	-34.7	-177.2	-63.6	-15.7	0	0	0	111.4	Q285 I292 A293	Q285-D289 PolarHBondContact O-N 2.88Å; Q285-D289 VanDerWaalsContact O-N 3.09Å; D289-I292 PolarHBondContact O-N 3.45Å; D289-A293 WeakPolarHBondContact O-CB 3.43Å; D289-A293 PolarHBondContact O-N 3.3Å
290	L	74.3	Confident	70.3	Confident	111 Å²	111	98 Å²	98	58%	0.581	56%	0.556	S	S	*	*	H	α-helix	trans	-66.3	-39.7	172.3	-165	74	0	0	0	112.1	Y286 A293 A294	Y286-L290 WeakPolarHBondContact O-CB 3.38Å; Y286-L290 PolarHBondContact O-N 3.36Å; L290-A293 PolarHBondContact O-N 2.9Å; L290-A294 WeakPolarHBondContact O-CB 3.43Å; L290-A294 PolarHBondContact O-N 2.97Å
291	A	75.4	Confident	72.1	Confident	54 Å²	54	94.2 Å²	94.2	45%	0.446	54%	0.535	S	S	.	.	H	α-helix	trans	-64.8	-41.6	175.5	0	0	0	0	0	111.9	A287 R288 A294 V295	A287-A291 WeakPolarHBondContact O-CB 3.33Å; A287-A291 PolarHBondContact O-N 3.25Å; R288-A291 PolarHBondContact O-N 3.31Å; A291-A294 PolarHBondContact O-N 3.4Å; A291-V295 VanDerWaalsContact O-CG2 3.32Å; A291-V295 WeakPolarHBondContact O-CG2 3.27Å; A291-V295 PolarHBondContact O-N 3.29Å
292	I	78	Confident	73.8	Confident	84 Å²	84	92.7 Å²	92.7	43%	0.431	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-46.1	176.3	-67.8	165.6	0	0	0	110.5	R288 D289 A294 V295 I296	R288-I292 HydrophobicContact CG-CD1 4.16Å; R288-I292 VanDerWaalsContact O-CG1 3.3Å; R288-I292 WeakPolarHBondContact O-CG1 3.37Å; R288-I292 PolarHBondContact O-N 2.93Å; D289-I292 PolarHBondContact O-N 3.45Å; I292-A294 VanDerWaalsContact C-N 3.34Å; I292-A294 PolarHBondContact O-N 3.23Å; I292-V295 PolarHBondContact O-N 3.38Å; I292-I296 HydrophobicContact CG2-CD1 3.83Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 3.06Å
293	A	76.5	Confident	75.3	Confident	49 Å²	49	93 Å²	93	41%	0.405	53%	0.529	S	S	.	.	H	α-helix	trans	-60.5	-43.3	177.1	0	0	0	0	0	111.9	D289 L290 V295 I296 C297	D289-A293 WeakPolarHBondContact O-CB 3.43Å; D289-A293 PolarHBondContact O-N 3.3Å; L290-A293 PolarHBondContact O-N 2.9Å; A293-V295 PolarHBondContact O-N 3.48Å; A293-I296 PolarHBondContact O-N 3.09Å; A293-C297 PolarHBondContact O-N 3.34Å; A293-C297 PolarHBondContact O-SG 3Å; A293-C297 VanDerWaalsContact O-SG 3.38Å
294	A	78.1	Confident	76.7	Confident	57 Å²	57	93.5 Å²	93.5	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-62	-42.5	177.3	0	0	0	0	0	112.4	L290 A291 I292 C297 F298	L290-A294 WeakPolarHBondContact O-CB 3.43Å; L290-A294 PolarHBondContact O-N 2.97Å; A291-A294 PolarHBondContact O-N 3.4Å; I292-A294 VanDerWaalsContact C-N 3.34Å; I292-A294 PolarHBondContact O-N 3.23Å; A294-C297 PolarHBondContact O-N 2.87Å; A294-F298 WeakPolarHBondContact O-CB 3.31Å; A294-F298 PolarHBondContact O-N 3.32Å
295	V	83.9	Confident	78.2	Confident	86 Å²	86	89.4 Å²	89.4	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-42.7	177.1	171.5	0	0	0	0	111.4	A291 I292 A293 F298 L299	A291-V295 VanDerWaalsContact O-CG2 3.32Å; A291-V295 WeakPolarHBondContact O-CG2 3.27Å; A291-V295 PolarHBondContact O-N 3.29Å; I292-V295 PolarHBondContact O-N 3.38Å; A293-V295 PolarHBondContact O-N 3.48Å; V295-F298 PolarHBondContact O-N 3.43Å; V295-L299 HydrophobicContact CG1-CD1 3.93Å; V295-L299 HydrophobicContact CG1-CG 4.41Å; V295-L299 WeakPolarHBondContact O-CB 3.41Å; V295-L299 WeakPolarHBondContact O-CG 3.19Å; V295-L299 PolarHBondContact O-N 3.08Å
296	I	82.1	Confident	79.6	Confident	110 Å²	110	90 Å²	90	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-62.9	-44.4	177.3	-67.2	168.8	0	0	0	110.7	I292 A293 F298 L299 G300	I292-I296 HydrophobicContact CG2-CD1 3.83Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 3.06Å; A293-I296 PolarHBondContact O-N 3.09Å; I296-F298 VanDerWaalsContact C-N 3.34Å; I296-F298 PolarHBondContact O-N 3.19Å; I296-L299 PolarHBondContact O-N 3.38Å; I296-G300 PolarHBondContact O-N 3.48Å
297	C	79	Confident	81	Confident	96 Å²	96	87 Å²	87	65%	0.649	51%	0.512	S	S	*	.	H	α-helix	trans	-62.5	-40	176.1	-72.6	0	0	0	0	112.2	A293 A294 G300 G301	A293-C297 PolarHBondContact O-N 3.34Å; A293-C297 PolarHBondContact O-SG 3Å; A293-C297 VanDerWaalsContact O-SG 3.38Å; A294-C297 PolarHBondContact O-N 2.87Å; C297-G300 PolarHBondContact O-N 2.86Å; C297-G301 PolarHBondContact O-N 3.36Å
298	F	86.1	Confident	81.8	Confident	158 Å²	158	86.5 Å²	86.5	69%	0.693	51%	0.507	S	S	*	.	H	α-helix	trans	-66.8	-45.3	178.5	-138	-85.6	0	0	0	111.6	A294 V295 I296 G300 G301 V302	A294-F298 WeakPolarHBondContact O-CB 3.31Å; A294-F298 PolarHBondContact O-N 3.32Å; V295-F298 PolarHBondContact O-N 3.43Å; I296-F298 VanDerWaalsContact C-N 3.34Å; I296-F298 PolarHBondContact O-N 3.19Å; F298-G300 PolarHBondContact O-N 3.46Å; F298-G301 PolarHBondContact O-N 3.27Å; F298-V302 HydrophobicContact CD1-CG2 4.22Å; F298-V302 VanDerWaalsContact O-CG2 3.32Å; F298-V302 WeakPolarHBondContact O-CG2 3.22Å; F298-V302 PolarHBondContact O-N 3.05Å
299	L	85.2	Confident	82.6	Confident	116 Å²	116	84.2 Å²	84.2	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-63.3	-41.5	176.2	-71.8	172.1	0	0	0	111.8	V295 I296 V302 A303	V295-L299 HydrophobicContact CG1-CD1 3.93Å; V295-L299 HydrophobicContact CG1-CG 4.41Å; V295-L299 WeakPolarHBondContact O-CB 3.41Å; V295-L299 WeakPolarHBondContact O-CG 3.19Å; V295-L299 PolarHBondContact O-N 3.08Å; I296-L299 PolarHBondContact O-N 3.38Å; L299-V302 PolarHBondContact O-N 3.02Å; L299-A303 WeakPolarHBondContact O-CB 3.2Å; L299-A303 PolarHBondContact O-N 3.2Å
300	G	84.9	Confident	83.3	Confident	35 Å²	35	85 Å²	85	36%	0.361	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-42.8	174.3	0	0	0	0	0	112.5	I296 C297 F298 A303 L304	I296-G300 PolarHBondContact O-N 3.48Å; C297-G300 PolarHBondContact O-N 2.86Å; F298-G300 PolarHBondContact O-N 3.46Å; G300-A303 PolarHBondContact O-N 3.26Å; G300-L304 WeakPolarHBondContact O-CG 3.43Å; G300-L304 PolarHBondContact O-N 3.25Å
301	G	84.1	Confident	83.9	Confident	33 Å²	33	84.2 Å²	84.2	34%	0.34	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-44.2	175.1	0	0	0	0	0	112.9	C297 F298 L304 T305	C297-G301 PolarHBondContact O-N 3.36Å; F298-G301 PolarHBondContact O-N 3.27Å; G301-L304 PolarHBondContact O-N 2.82Å; G301-T305 WeakPolarHBondContact O-CG2 3.32Å; G301-T305 PolarHBondContact O-N 3.18Å; G301-T305 PolarHBondContact O-OG1 3.18Å
302	V	87.9	Confident	84.3	Confident	64 Å²	64	85.9 Å²	85.9	39%	0.388	52%	0.516	S	S	.	.	H	α-helix	trans	-64.7	-39.8	176.6	173.4	0	0	0	0	111.6	F298 L299 T305 L306	F298-V302 HydrophobicContact CD1-CG2 4.22Å; F298-V302 VanDerWaalsContact O-CG2 3.32Å; F298-V302 WeakPolarHBondContact O-CG2 3.22Å; F298-V302 PolarHBondContact O-N 3.05Å; L299-V302 PolarHBondContact O-N 3.02Å; V302-T305 WeakPolarHBondContact CA-OG1 3.4Å; V302-T305 PolarHBondContact O-N 3.36Å; V302-T305 PolarHBondContact O-OG1 3.46Å; V302-L306 HydrophobicContact CG1-CD1 3.96Å; V302-L306 HydrophobicContact CG1-CG 4.43Å; V302-L306 WeakPolarHBondContact O-CB 3.4Å; V302-L306 VanDerWaalsContact O-CG 3.31Å; V302-L306 WeakPolarHBondContact O-CG 3.09Å; V302-L306 PolarHBondContact O-N 3.02Å
303	A	85.2	Confident	84.8	Confident	57 Å²	57	88.6 Å²	88.6	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-43.7	176.2	0	0	0	0	0	111.7	L299 G300 L306 L307	L299-A303 WeakPolarHBondContact O-CB 3.2Å; L299-A303 PolarHBondContact O-N 3.2Å; G300-A303 PolarHBondContact O-N 3.26Å; A303-L306 PolarHBondContact O-N 3.15Å; A303-L307 WeakPolarHBondContact O-CB 3.39Å; A303-L307 PolarHBondContact O-N 3.23Å
304	L	85.8	Confident	85.1	Confident	126 Å²	126	91.6 Å²	91.6	66%	0.66	53%	0.527	S	S	*	.	H	α-helix	trans	-64.9	-40.3	177.8	-74.9	169.5	0	0	0	112.4	G300 G301 L307 A308	G300-L304 WeakPolarHBondContact O-CG 3.43Å; G300-L304 PolarHBondContact O-N 3.25Å; G301-L304 PolarHBondContact O-N 2.82Å; L304-L307 PolarHBondContact O-N 3.04Å; L304-A308 WeakPolarHBondContact O-CB 3.4Å; L304-A308 PolarHBondContact O-N 3.46Å
305	T	84.9	Confident	85.4	Confident	85 Å²	85	92 Å²	92	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-68.5	-41.3	177.3	55.3	0	0	0	0	111.9	G301 V302 L307 A308 V309	G301-T305 WeakPolarHBondContact O-CG2 3.32Å; G301-T305 PolarHBondContact O-N 3.18Å; G301-T305 PolarHBondContact O-OG1 3.18Å; V302-T305 WeakPolarHBondContact CA-OG1 3.4Å; V302-T305 PolarHBondContact O-N 3.36Å; V302-T305 PolarHBondContact O-OG1 3.46Å; T305-L307 VanDerWaalsContact C-N 3.31Å; T305-L307 PolarHBondContact O-N 3.25Å; T305-A308 PolarHBondContact O-N 2.81Å; T305-V309 WeakPolarHBondContact O-CG2 3.03Å; T305-V309 PolarHBondContact O-N 3.46Å
306	L	87.2	Confident	85.1	Confident	108 Å²	108	90.8 Å²	90.8	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-61.4	-40.5	173.6	-74.7	170.9	0	0	0	111.8	V302 A303 V309 L310	V302-L306 HydrophobicContact CG1-CD1 3.96Å; V302-L306 HydrophobicContact CG1-CG 4.43Å; V302-L306 WeakPolarHBondContact O-CB 3.4Å; V302-L306 VanDerWaalsContact O-CG 3.31Å; V302-L306 WeakPolarHBondContact O-CG 3.09Å; V302-L306 PolarHBondContact O-N 3.02Å; A303-L306 PolarHBondContact O-N 3.15Å; L306-V309 PolarHBondContact O-N 3.04Å; L306-L310 WeakPolarHBondContact O-CB 3.32Å; L306-L310 PolarHBondContact O-N 3.19Å
307	L	88.3	Confident	85	Confident	107 Å²	107	88.6 Å²	88.6	56%	0.56	51%	0.506	S	S	*	.	H	α-helix	trans	-65.2	-42	177.1	-154.7	119.9	0	0	0	111.4	A303 L304 T305 L310 I311	A303-L307 WeakPolarHBondContact O-CB 3.39Å; A303-L307 PolarHBondContact O-N 3.23Å; L304-L307 PolarHBondContact O-N 3.04Å; T305-L307 VanDerWaalsContact C-N 3.31Å; T305-L307 PolarHBondContact O-N 3.25Å; L307-L310 WeakPolarHBondContact O-CB 3.37Å; L307-L310 PolarHBondContact O-N 3.19Å; L307-I311 HydrophobicContact CD2-CD1 3.82Å; L307-I311 VanDerWaalsContact O-CG1 3.29Å; L307-I311 WeakPolarHBondContact O-CG1 3.46Å; L307-I311 PolarHBondContact O-N 3.26Å
308	A	85.8	Confident	85	Confident	50 Å²	50	89.9 Å²	89.9	41%	0.413	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-42.2	174.4	0	0	0	0	0	112.2	L304 T305 L310 I311 C312	L304-A308 WeakPolarHBondContact O-CB 3.4Å; L304-A308 PolarHBondContact O-N 3.46Å; T305-A308 PolarHBondContact O-N 2.81Å; A308-L310 PolarHBondContact O-N 3.18Å; A308-I311 PolarHBondContact O-N 3.18Å; A308-C312 WeakPolarHBondContact O-CB 3.46Å; A308-C312 PolarHBondContact O-N 2.94Å
309	V	88.4	Confident	84.3	Confident	99 Å²	99	90.2 Å²	90.2	60%	0.6	50%	0.499	S	S	*	.	H	α-helix	trans	-62.6	-42.3	175.1	171.1	0	0	0	0	111.1	T305 L306 C312 Y313	T305-V309 WeakPolarHBondContact O-CG2 3.03Å; T305-V309 PolarHBondContact O-N 3.46Å; L306-V309 PolarHBondContact O-N 3.04Å; V309-C312 PolarHBondContact O-N 3.16Å; V309-Y313 VanDerWaalsContact O-CB 3.3Å; V309-Y313 WeakPolarHBondContact O-CB 3.34Å; V309-Y313 PolarHBondContact O-N 3.19Å
310	L	88.1	Confident	83.6	Confident	99 Å²	99	88.4 Å²	88.4	52%	0.518	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-43.5	176.3	-116	153.1	0	0	0	111.9	L306 L307 A308 Y313 H314	L306-L310 WeakPolarHBondContact O-CB 3.32Å; L306-L310 PolarHBondContact O-N 3.19Å; L307-L310 WeakPolarHBondContact O-CB 3.37Å; L307-L310 PolarHBondContact O-N 3.19Å; A308-L310 PolarHBondContact O-N 3.18Å; L310-Y313 PolarHBondContact O-N 3.11Å; L310-H314 PolarHBondContact O-CD2 3.14Å; L310-H314 PolarHBondContact O-N 2.9Å
311	I	87.5	Confident	83	Confident	96 Å²	96	93 Å²	93	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-49.2	175.3	-68.6	166.7	0	0	0	110.1	L307 A308 Y313 H314 V315	L307-I311 HydrophobicContact CD2-CD1 3.82Å; L307-I311 VanDerWaalsContact O-CG1 3.29Å; L307-I311 WeakPolarHBondContact O-CG1 3.46Å; L307-I311 PolarHBondContact O-N 3.26Å; A308-I311 PolarHBondContact O-N 3.18Å; I311-Y313 VanDerWaalsContact C-N 3.3Å; I311-Y313 PolarHBondContact O-N 3.39Å; I311-H314 PolarHBondContact O-N 2.95Å; I311-V315 HydrophobicContact CG2-CG2 4.35Å; I311-V315 WeakPolarHBondContact O-CG2 3.45Å; I311-V315 PolarHBondContact O-N 3.05Å
312	C	84.4	Confident	82.3	Confident	88 Å²	88	97.6 Å²	97.6	60%	0.595	51%	0.512	S	S	*	.	H	α-helix	trans	-59.2	-40.9	177.1	-79.8	0	0	0	0	112.2	A308 V309 V315 S316	A308-C312 WeakPolarHBondContact O-CB 3.46Å; A308-C312 PolarHBondContact O-N 2.94Å; V309-C312 PolarHBondContact O-N 3.16Å; C312-V315 PolarHBondContact O-N 3.42Å; C312-S316 VanDerWaalsContact O-CB 3.31Å; C312-S316 WeakPolarHBondContact O-CB 3.41Å; C312-S316 PolarHBondContact O-N 3.23Å
313	Y	86.7	Confident	81.3	Confident	142 Å²	142	100.4 Å²	100.4	56%	0.557	52%	0.521	S	S	*	.	H	α-helix	trans	-62.5	-45.7	175.7	-178.5	-101.4	0	0	0	111.4	V309 L310 I311 S316 Q317	V309-Y313 VanDerWaalsContact O-CB 3.3Å; V309-Y313 WeakPolarHBondContact O-CB 3.34Å; V309-Y313 PolarHBondContact O-N 3.19Å; L310-Y313 PolarHBondContact O-N 3.11Å; I311-Y313 VanDerWaalsContact C-N 3.3Å; I311-Y313 PolarHBondContact O-N 3.39Å; Y313-S316 PolarHBondContact O-N 3.21Å; Y313-Q317 HydrophobicContact CD1-CG 4.28Å; Y313-Q317 HydrophobicContact CE1-CG 3.91Å; Y313-Q317 HydrophobicContact CE2-CG 4.35Å; Y313-Q317 WeakPolarHBondContact O-CB 3.11Å; Y313-Q317 VanDerWaalsContact O-CG 3.3Å; Y313-Q317 WeakPolarHBondContact O-CG 3.27Å; Y313-Q317 PolarHBondContact O-N 3.08Å; Y313-Q317 PolarHBondContact OH-NE2 3.5Å
314	H	84.5	Confident	80.2	Confident	112 Å²	112	105.1 Å²	105.1	52%	0.519	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-43.4	176	-91.8	-72.5	0	0	0	112.9	L310 I311 S316 Q317 Q318	L310-H314 PolarHBondContact O-CD2 3.14Å; L310-H314 PolarHBondContact O-N 2.9Å; I311-H314 PolarHBondContact O-N 2.95Å; H314-S316 VanDerWaalsContact C-N 3.35Å; H314-Q317 PolarHBondContact O-N 3.26Å; H314-Q318 WeakPolarHBondContact O-CG 3.17Å; H314-Q318 PolarHBondContact O-N 3.22Å
315	V	83.4	Confident	79	Confident	64 Å²	64	104.2 Å²	104.2	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-41	176.5	171.7	0	0	0	0	110.9	I311 C312 Q318 R319	I311-V315 HydrophobicContact CG2-CG2 4.35Å; I311-V315 WeakPolarHBondContact O-CG2 3.45Å; I311-V315 PolarHBondContact O-N 3.05Å; C312-V315 PolarHBondContact O-N 3.42Å; V315-Q318 PolarHBondContact O-N 2.91Å; V315-R319 PolarHBondContact O-N 3.29Å
316	S	77.6	Confident	77.9	Confident	61 Å²	61	108 Å²	108	43%	0.427	53%	0.532	S	S	.	.	H	α-helix	trans	-63.6	-42.3	175	176.6	0	0	0	0	111.9	C312 Y313 H314 Q318 R319 L320	C312-S316 VanDerWaalsContact O-CB 3.31Å; C312-S316 WeakPolarHBondContact O-CB 3.41Å; C312-S316 PolarHBondContact O-N 3.23Å; Y313-S316 PolarHBondContact O-N 3.21Å; H314-S316 VanDerWaalsContact C-N 3.35Å; S316-Q318 VanDerWaalsContact C-N 3.32Å; S316-Q318 PolarHBondContact O-N 3.08Å; S316-R319 PolarHBondContact O-N 3.11Å; S316-L320 WeakPolarHBondContact O-CG 3.49Å; S316-L320 PolarHBondContact O-N 3.02Å
317	Q	80.8	Confident	76.5	Confident	64 Å²	64	110.1 Å²	110.1	30%	0.299	54%	0.544	S	S	.	.	H	α-helix	trans	-65.2	-33.6	175.4	-72.9	-66.9	-18.3	0	0	112.8	Y313 H314 K321	Y313-Q317 HydrophobicContact CD1-CG 4.28Å; Y313-Q317 HydrophobicContact CE1-CG 3.91Å; Y313-Q317 HydrophobicContact CE2-CG 4.35Å; Y313-Q317 WeakPolarHBondContact O-CB 3.11Å; Y313-Q317 VanDerWaalsContact O-CG 3.3Å; Y313-Q317 WeakPolarHBondContact O-CG 3.27Å; Y313-Q317 PolarHBondContact O-N 3.08Å; Y313-Q317 PolarHBondContact OH-NE2 3.5Å; H314-Q317 PolarHBondContact O-N 3.26Å; Q317-K321 PolarHBondContact O-N 3.4Å
318	Q	77.6	Confident	75	Confident	123 Å²	123	115.6 Å²	115.6	58%	0.575	56%	0.557	S	S	*	*	H	α-helix	trans	-67.1	-45.4	172.4	-77.4	-178	-25.4	0	0	111.6	H314 V315 S316 L320 K321 E322	H314-Q318 WeakPolarHBondContact O-CG 3.17Å; H314-Q318 PolarHBondContact O-N 3.22Å; V315-Q318 PolarHBondContact O-N 2.91Å; S316-Q318 VanDerWaalsContact C-N 3.32Å; S316-Q318 PolarHBondContact O-N 3.08Å; Q318-L320 VanDerWaalsContact C-N 3.34Å; Q318-L320 PolarHBondContact O-N 2.98Å; Q318-K321 WeakPolarHBondContact O-CB 3.24Å; Q318-K321 PolarHBondContact O-N 3.49Å; Q318-E322 PolarHBondContact O-N 3.05Å
319	R	72.8	Confident	73.4	Confident	166 Å²	166	121.7 Å²	121.7	63%	0.626	59%	0.589	S	S	*	*	H	α-helix	trans	-60	-41.1	174.7	-73.9	-171.3	-173	-170.3	2.6	112.7	V315 S316 K321 E322 E323	V315-R319 PolarHBondContact O-N 3.29Å; S316-R319 PolarHBondContact O-N 3.11Å; R319-K321 PolarHBondContact O-N 3.3Å; R319-E322 PolarHBondContact O-N 2.89Å; R319-E323 PolarHBondContact O-N 3.2Å
320	L	70.6	Confident	72.6	Confident	77 Å²	77	122.9 Å²	122.9	40%	0.403	59%	0.589	S	S	.	*	H	α-helix	trans	-67.6	-19.9	175.5	-75.3	168.3	0	0	0	113.9	S316 Q318 R324	S316-L320 WeakPolarHBondContact O-CG 3.49Å; S316-L320 PolarHBondContact O-N 3.02Å; Q318-L320 VanDerWaalsContact C-N 3.34Å; Q318-L320 PolarHBondContact O-N 2.98Å; L320-R324 PolarHBondContact O-NE 2.88Å
321	K	71.4	Confident	71.8	Confident	132 Å²	132	124.1 Å²	124.1	57%	0.574	59%	0.593	S	S	*	*	H	α-helix	trans	-81.6	-44.5	169.7	-78.3	-178.3	177.5	-176.7	0	110.8	Q317 Q318 R319 E323 R324 D325	Q317-K321 PolarHBondContact O-N 3.4Å; Q318-K321 WeakPolarHBondContact O-CB 3.24Å; Q318-K321 PolarHBondContact O-N 3.49Å; R319-K321 PolarHBondContact O-N 3.3Å; K321-E323 VanDerWaalsContact C-N 3.32Å; K321-E323 PolarHBondContact O-N 2.95Å; K321-R324 PolarHBondContact O-N 3.11Å; K321-R324 VanDerWaalsContact O-N 3.16Å; K321-D325 PolarHBondContact O-N 2.94Å
322	E	69.9	Low	71	Confident	129 Å²	129	125.7 Å²	125.7	60%	0.603	60%	0.598	S	S	*	*	H	α-helix	trans	-61.7	-37.1	176.1	-70.9	178.1	171.8	0	0	112.8	Q318 R319 K326	Q318-E322 PolarHBondContact O-N 3.05Å; R319-E322 PolarHBondContact O-N 2.89Å; E322-K326 PolarHBondContact O-N 3.04Å; E322-K326 VanDerWaalsContact O-N 3.11Å
323	E	66.8	Low	70.2	Confident	123 Å²	123	127.9 Å²	127.9	58%	0.575	60%	0.598	S	S	*	*	H	α-helix	trans	-68.2	-38.7	173.1	-76.2	178.7	168.7	0	0	112.3	R319 K321 D325 K326 D327	R319-E323 PolarHBondContact O-N 3.2Å; K321-E323 VanDerWaalsContact C-N 3.32Å; K321-E323 PolarHBondContact O-N 2.95Å; E323-D325 PolarHBondContact O-N 2.99Å; E323-K326 PolarHBondContact O-N 3.47Å; E323-D327 PolarHBondContact O-N 3.29Å
324	R	61.6	Low	69.1	Low	156 Å²	156	127 Å²	127	59%	0.589	60%	0.601	S	S	*	*	H	α-helix	trans	-68.9	-30.3	175.3	-94.4	-172.8	-71.9	-177.4	-6	113.9	L320 K321	L320-R324 PolarHBondContact O-NE 2.88Å; K321-R324 PolarHBondContact O-N 3.11Å; K321-R324 VanDerWaalsContact O-N 3.16Å
325	D	61.7	Low	68.1	Low	108 Å²	108	128 Å²	128	58%	0.578	61%	0.606	S	S	*	*	H	α-helix	trans	-79.1	-28.1	176.4	-75.2	-21.9	0	0	0	111.8	K321 E323 R328	K321-D325 PolarHBondContact O-N 2.94Å; E323-D325 PolarHBondContact O-N 2.99Å; D325-R328 PolarHBondContact O-N 3.36Å
326	K	60	Low	67	Low	164 Å²	164	132.6 Å²	132.6	71%	0.713	62%	0.622	S	S	*	*	H	α-helix	trans	-68.9	-31	170.9	-92.1	-179.9	175.8	174.5	0	114.1	E322 E323 R328	E322-K326 PolarHBondContact O-N 3.04Å; E322-K326 VanDerWaalsContact O-N 3.11Å; E323-K326 PolarHBondContact O-N 3.47Å; K326-R328 PolarHBondContact O-N 2.75Å
327	D	59	Low	66.2	Low	153 Å²	153	138.1 Å²	138.1	82%	0.818	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	0.1	174	-88.3	-12.7	0	0	0	113.4	E323	E323-D327 PolarHBondContact O-N 3.29Å
328	R	57.6	Low	65	Low	222 Å²	222	144.3 Å²	144.3	84%	0.838	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	9.6	-178.5	-88.4	-176.2	171.9	-172.3	-2.5	115.1	D325 K326	D325-R328 PolarHBondContact O-N 3.36Å; K326-R328 PolarHBondContact O-N 2.75Å
329	T	51	Low	63.8	Low	178 Å²	178	146.2 Å²	146.2	100%	1.092	67%	0.673	S	S	*	*			trans	-127.6	0	172	47.3	0	0	0	0	110.6

Retrieved 329 of 329 residues in 656.5 ms (Link to these results)

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