A0A060X7C9_ONCMY Loading...

Target of rapamycin complex subunit lst8

Subunit of TORC1 and TORC2, which regulate cell growth and survival in response to nutrient and hormonal signals.

AlphaFold DB (A0A1S3Q5C1), UniProt , Accession A0A060X7C9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 328 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.9	Very low	47.6	Very low	233 Å²	233	111 Å²	111	100%	1.148	64%	0.638	S	S	*	*				0	105.5	0	-71.2	175	-164.4	0	0	106.6	V3	M1-V3 PolarHBondContact O-N 3.16Å
2	N	31.3	Very low	50.1	Low	163 Å²	163	108.3 Å²	108.3	87%	0.872	63%	0.63	S	S	*	*			trans	-74.7	106	175.4	-82.6	-7.6	0	0	0	107.7	N4	N2-N4 PolarHBondContact O-N 3.22Å; N2-N4 VanDerWaalsContact O-N 3.16Å
3	V	33.8	Very low	52.6	Low	124 Å²	124	102.6 Å²	102.6	75%	0.752	60%	0.596	S	S	*	*			trans	-74.4	102.5	166.2	-168.5	0	0	0	0	105.4	M1 Q5	M1-V3 PolarHBondContact O-N 3.16Å; V3-Q5 PolarHBondContact O-N 2.87Å
4	N	31.7	Very low	55.1	Low	155 Å²	155	101.4 Å²	101.4	83%	0.829	59%	0.593	S	S	*	*			trans	-58.3	95.6	161.4	-87.9	-19.9	0	0	0	106.9	N2 G6	N2-N4 PolarHBondContact O-N 3.22Å; N2-N4 VanDerWaalsContact O-N 3.16Å; N4-G6 VanDerWaalsContact C-N 3.28Å; N4-G6 PolarHBondContact O-N 3.16Å
5	Q	36.2	Very low	57.6	Low	175 Å²	175	96.9 Å²	96.9	82%	0.818	57%	0.567	S	S	*	*			trans	-65.6	99.6	157.4	-70.9	-176.7	-1.1	0	0	105.1	V3 Q7	V3-Q5 PolarHBondContact O-N 2.87Å; Q5-Q7 PolarHBondContact O-N 3.02Å; Q5-Q7 VanDerWaalsContact O-N 3.16Å
6	G	38.3	Very low	59.9	Low	69 Å²	69	90.9 Å²	90.9	71%	0.711	53%	0.532	S	S	*	.			trans	-52.4	124.2	166.1	0	0	0	0	0	107.2	N4 G8	N4-G6 VanDerWaalsContact C-N 3.28Å; N4-G6 PolarHBondContact O-N 3.16Å; G6-G8 VanDerWaalsContact C-N 3.33Å; G6-G8 PolarHBondContact O-N 2.68Å
7	Q	47.3	Very low	62.1	Low	177 Å²	177	85.6 Å²	85.6	83%	0.827	50%	0.501	S	S	*	.			trans	-60.4	101.3	172.5	-78.4	178.6	-23.6	0	0	107.1	Q5	Q5-Q7 PolarHBondContact O-N 3.02Å; Q5-Q7 VanDerWaalsContact O-N 3.16Å
8	G	58.4	Low	64.1	Low	58 Å²	58	80.9 Å²	80.9	60%	0.598	47%	0.473	S	S	*	.			trans	-54.9	146.1	171.2	0	0	0	0	0	109.6	G6	G6-G8 VanDerWaalsContact C-N 3.33Å; G6-G8 PolarHBondContact O-N 2.68Å
9	T	70.8	Confident	65.9	Low	38 Å²	38	76.6 Å²	76.6	23%	0.233	45%	0.448	C	S	.	.			trans	-76.8	156.1	177.7	55.2	0	0	0	0	109.2	G11 S12 N73	T9-G11 PolarHBondContact O-N 2.8Å; T9-S12 PolarHBondContact N-OG 3.22Å; T9-S12 WeakPolarHBondContact O-CB 3.48Å; T9-S12 PolarHBondContact O-N 3.21Å; T9-S12 PolarHBondContact O-OG 3.39Å; T9-N73 WeakPolarHBondContact CB-O 3.31Å; T9-N73 WeakPolarHBondContact CG2-O 3.43Å
10	V	75.3	Confident	67.6	Low	17 Å²	17	72.8 Å²	72.8	10%	0.103	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-56.5	-38.3	-178.1	177.2	0	0	0	0	111.5	S12 D13 I16 F28 R38 L72	V10-S12 PolarHBondContact O-N 2.75Å; V10-D13 PolarHBondContact O-N 3.34Å; V10-I16 HydrophobicContact CG1-CG2 4.43Å; V10-F28 HydrophobicContact CG1-CB 4.06Å; V10-F28 HydrophobicContact CG1-CD1 3.65Å; V10-F28 HydrophobicContact CG1-CE1 4.38Å; V10-F28 HydrophobicContact CG1-CG 4.03Å; V10-F28 HydrophobicContact CG2-CB 4.07Å; V10-F28 HydrophobicContact CG2-CG 4.23Å; V10-R38 HydrophobicContact CG2-CB 4Å; V10-L72 HydrophobicContact CG1-CD2 4.2Å; V10-L72 PolarHBondContact N-O 2.94Å
11	G	66.4	Low	68.9	Low	12 Å²	12	69.3 Å²	69.3	12%	0.124	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-67.9	-16.6	177.5	0	0	0	0	0	115.1	T9 L72	T9-G11 PolarHBondContact O-N 2.8Å; G11-L72 PolarHBondContact N-O 2.95Å
12	S	77.9	Confident	71.9	Confident	78 Å²	78	62.6 Å²	62.6	55%	0.545	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-86.2	-13.5	177.9	69.5	0	0	0	0	114.1	T9 V10	T9-S12 PolarHBondContact N-OG 3.22Å; T9-S12 WeakPolarHBondContact O-CB 3.48Å; T9-S12 PolarHBondContact O-N 3.21Å; T9-S12 PolarHBondContact O-OG 3.39Å; V10-S12 PolarHBondContact O-N 2.75Å
13	D	82.8	Confident	75	Confident	35 Å²	35	55.7 Å²	55.7	19%	0.187	33%	0.331	C	S	.	.	S	Bend	trans	-71.3	135.6	174.1	-164	-48.5	0	0	0	108.9	V10 V15 R56	V10-D13 PolarHBondContact O-N 3.34Å; D13-V15 PolarHBondContact O-N 3.34Å; D13-V15 VanDerWaalsContact O-N 3.13Å; D13-V15 PolarHBondContact OD1-N 3.4Å; D13-R56 PolarHBondContact O-NH2 3.03Å
14	P	86.8	Confident	77.9	Confident	85 Å²	85	53.2 Å²	53.2	55%	0.552	31%	0.311	S	S	*	.	S	Bend	trans	-54.9	-27.3	173.4	22.5	-35.5	0	0	0	113.3	R56	P14-R56 PolarHBondContact O-NH2 2.9Å
15	V	93.2	Very high	81	Confident	35 Å²	35	46.3 Å²	46.3	21%	0.212	28%	0.275	C	S	.	.			trans	-119.7	124.9	179.7	-175.5	0	0	0	0	110.8	D13 A31 F322 D324	D13-V15 PolarHBondContact O-N 3.34Å; D13-V15 VanDerWaalsContact O-N 3.13Å; D13-V15 PolarHBondContact OD1-N 3.4Å; V15-A31 HydrophobicContact CB-CB 4.36Å; V15-A31 HydrophobicContact CG1-CB 3.69Å; V15-F322 HydrophobicContact CG1-CD2 4.3Å; V15-F322 HydrophobicContact CG1-CE2 3.47Å; V15-F322 VanDerWaalsContact CG1-CE2 3.47Å; V15-F322 HydrophobicContact CG1-CZ 3.79Å; V15-D324 HydrophobicContact CG1-CB 4.32Å; V15-D324 HydrophobicContact CG2-CB 3.9Å
16	I	94.8	Very high	84	Confident	1 Å²	1	38 Å²	38	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	116.3	172.6	-60.6	162.2	0	0	0	107.6	V10 V52 R56 L72 F322 N323	V10-I16 HydrophobicContact CG1-CG2 4.43Å; I16-V52 HydrophobicContact CD1-CG1 4.27Å; I16-V52 HydrophobicContact CG2-CG2 3.92Å; I16-R56 HydrophobicContact CD1-CB 4.23Å; I16-L72 HydrophobicContact CD1-CD1 4.1Å; I16-L72 HydrophobicContact CG2-CD2 4.49Å; I16-F322 CarbonylContact O-C 3.51Å; I16-F322 WeakPolarHBondContact O-CA 3.26Å; I16-N323 PolarHBondContact N-O 3.04Å; I16-N323 PolarHBondContact O-N 2.87Å
17	L	97.4	Very high	86.8	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.8	168.6	173.1	58.9	0	0	0	109.1	T19 F28 W29 V288 Y310 A321 F322	L17-T19 HydrophobicContact CD1-CG2 4.42Å; L17-F28 WeakPolarHBondContact O-CA 3.39Å; L17-W29 HydrophobicContact CB-CB 4.37Å; L17-W29 HydrophobicContact CD2-CB 4.08Å; L17-W29 HydrophobicContact CG-CB 4.17Å; L17-W29 HydrophobicContact CG-CG 4.49Å; L17-W29 PolarHBondContact O-N 3.27Å; L17-V288 HydrophobicContact CD1-CG1 3.89Å; L17-V288 HydrophobicContact CD1-CG2 4.47Å; L17-V288 HydrophobicContact CD2-CG1 4.33Å; L17-Y310 HydrophobicContact CD2-CD1 4.12Å; L17-Y310 HydrophobicContact CD2-CD2 4.03Å; L17-Y310 HydrophobicContact CD2-CE1 3.68Å; L17-Y310 HydrophobicContact CD2-CE2 3.56Å; L17-Y310 HydrophobicContact CD2-CG 4.3Å; L17-A321 WeakPolarHBondContact CA-O 3.49Å; L17-F322 HydrophobicContact CB-CD2 4.32Å; L17-F322 HydrophobicContact CD1-CD2 4.21Å
18	A	98.1	Very high	89.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	145.2	174.6	0	0	0	0	0	110.9	V26 R27 F28 L50 I59 L320 A321	A18-V26 HydrophobicContact CB-CG1 4.46Å; A18-R27 CarbonylContact C-O 3.51Å; A18-R27 VanDerWaalsContact CA-O 3.23Å; A18-R27 WeakPolarHBondContact CA-O 3.36Å; A18-F28 HydrophobicContact CB-CD1 3.76Å; A18-F28 HydrophobicContact CB-CE1 3.8Å; A18-L50 HydrophobicContact CB-CD1 4.46Å; A18-I59 HydrophobicContact CB-CD1 3.47Å; A18-I59 VanDerWaalsContact CB-CD1 3.47Å; A18-L320 CarbonylContact O-C 3.52Å; A18-L320 VanDerWaalsContact O-CA 3.24Å; A18-L320 WeakPolarHBondContact O-CA 3.48Å; A18-A321 HydrophobicContact CB-CB 4.5Å; A18-A321 PolarHBondContact N-O 2.54Å; A18-A321 PolarHBondContact O-N 2.93Å
19	T	98.5	Very high	91	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	147.2	176.9	60.7	0	0	0	0	110.6	L17 R27 W29 A296 H313 V317 L320	L17-T19 HydrophobicContact CD1-CG2 4.42Å; T19-R27 PolarHBondContact N-O 2.79Å; T19-R27 PolarHBondContact O-N 3.26Å; T19-W29 PolarHBondContact OG1-NE1 3.01Å; T19-A296 HydrophobicContact CG2-CB 3.75Å; T19-H313 PolarHBondContact O-NE2 3.16Å; T19-H313 PolarHBondContact OG1-CD2 2.85Å; T19-H313 PolarHBondContact OG1-NE2 2.9Å; T19-V317 HydrophobicContact CG2-CG1 4.49Å; T19-L320 HydrophobicContact CG2-CB 4.24Å
20	A	98.4	Very high	92	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	166.1	175.3	0	0	0	0	0	112.7	V26 V47 L50 V317 V318 C319	A20-V26 HydrophobicContact CB-CB 4.45Å; A20-V26 HydrophobicContact CB-CG2 3.99Å; A20-V47 HydrophobicContact CB-CB 3.66Å; A20-V47 HydrophobicContact CB-CG1 4.04Å; A20-V47 HydrophobicContact CB-CG2 3.77Å; A20-L50 HydrophobicContact CB-CD1 3.58Å; A20-L50 HydrophobicContact CB-CD2 4.48Å; A20-L50 HydrophobicContact CB-CG 4.18Å; A20-V317 WeakPolarHBondContact O-CG1 3.46Å; A20-V318 PolarHBondContact O-N 2.86Å; A20-C319 PolarHBondContact N-O 3.16Å; A20-C319 VanDerWaalsContact N-O 3.1Å; A20-C319 PolarHBondContact O-N 3.36Å
21	G	96.4	Very high	92.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	-133.6	177.3	0	0	0	0	0	112.8	A316	G21-A316 WeakPolarHBondContact CA-O 3.28Å
22	Y	96.5	Very high	93.8	Very high	92 Å²	92	31.4 Å²	31.4	36%	0.361	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-4.5	-169.9	-63.5	-73.5	0	0	0	115.1	H24 Q46 K315 A316 V318	Y22-H24 PolarHBondContact O-N 3.17Å; Y22-Q46 HydrophobicContact CD1-CB 3.56Å; Y22-Q46 HydrophobicContact CD1-CG 4.13Å; Y22-Q46 HydrophobicContact CE1-CB 3.81Å; Y22-Q46 HydrophobicContact CE1-CG 3.85Å; Y22-Q46 HydrophobicContact CG-CB 4.48Å; Y22-K315 VanDerWaalsContact O-CD 3.29Å; Y22-K315 WeakPolarHBondContact O-CD 3.38Å; Y22-K315 PolarHBondContact O-NZ 3.19Å; Y22-A316 HydrophobicContact CD2-CB 3.86Å; Y22-A316 HydrophobicContact CE2-CB 4.28Å; Y22-A316 PolarHBondContact N-O 3.08Å; Y22-A316 VanDerWaalsContact N-O 3.15Å; Y22-V318 HydrophobicContact CD2-CG1 3.95Å; Y22-V318 HydrophobicContact CE2-CG1 3.36Å
23	D	96	Very high	94.4	Very high	18 Å²	18	29.5 Å²	29.5	10%	0.096	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	10.7	-178.2	74.5	-9	0	0	0	114	T25 H313 Q314 K315	D23-T25 VanDerWaalsContact CG-OG1 3.23Å; D23-T25 PolarHBondContact O-N 3.13Å; D23-T25 PolarHBondContact OD1-N 2.67Å; D23-T25 PolarHBondContact OD1-OG1 3.35Å; D23-T25 PolarHBondContact OD2-OG1 2.96Å; D23-H313 IonicContact OD1-CE1 3.5Å; D23-H313 IonicContact OD1-ND1 3.71Å; D23-H313 PolarHBondContact OD1-ND1 2.89Å; D23-H313 WeakPolarHBondContact OD2-CA 3.44Å; D23-H313 WeakPolarHBondContact OD2-CB 3.22Å; D23-H313 IonicContact OD2-CE1 3.63Å; D23-H313 IonicContact OD2-CG 2.79Å; D23-H313 IonicContact OD2-ND1 3.69Å; D23-H313 PolarHBondContact OD2-ND1 3.1Å; D23-Q314 HydrophobicContact CB-CB 4.2Å; D23-Q314 PolarHBondContact OD2-N 3.2Å; D23-K315 HydrophobicContact CB-CB 3.98Å; D23-K315 HydrophobicContact CB-CD 4.47Å; D23-K315 HydrophobicContact CB-CG 4.2Å
24	H	95.8	Very high	94.9	Very high	71 Å²	71	28.7 Å²	28.7	33%	0.329	15%	0.151	S	C	.	.	S	Bend	trans	59.9	26.7	179.3	-54.3	-62.1	0	0	0	113.6	Y22 H42 S45	Y22-H24 PolarHBondContact O-N 3.17Å; H24-H42 WeakPolarHBondContact CA-O 3.3Å; H24-H42 WeakPolarHBondContact CB-O 3.41Å; H24-H42 CarbonylContact O-C 3.51Å; H24-H42 PolarHBondContact O-N 2.89Å; H24-S45 PolarHBondContact ND1-O 2.68Å
25	T	96.8	Very high	95.2	Very high	10 Å²	10	29.5 Å²	29.5	6%	0.061	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.7	174.4	69.2	0	0	0	0	112.2	D23 T39 V40 H313	D23-T25 VanDerWaalsContact CG-OG1 3.23Å; D23-T25 PolarHBondContact O-N 3.13Å; D23-T25 PolarHBondContact OD1-N 2.67Å; D23-T25 PolarHBondContact OD1-OG1 3.35Å; D23-T25 PolarHBondContact OD2-OG1 2.96Å; T25-T39 HydrophobicContact CG2-CG2 3.88Å; T25-V40 WeakPolarHBondContact CA-O 3.33Å; T25-H313 PolarHBondContact OG1-ND1 3Å
26	V	97.9	Very high	95.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.1	161.7	-176	0	0	0	0	106.8	A18 A20 F28 V40 H42 V47 L50 Y70	A18-V26 HydrophobicContact CB-CG1 4.46Å; A20-V26 HydrophobicContact CB-CB 4.45Å; A20-V26 HydrophobicContact CB-CG2 3.99Å; V26-F28 HydrophobicContact CG1-CE2 4.14Å; V26-F28 HydrophobicContact CG1-CZ 4.08Å; V26-V40 HydrophobicContact CB-CB 4.33Å; V26-V40 PolarHBondContact N-O 3.27Å; V26-V40 PolarHBondContact O-N 2.55Å; V26-H42 HydrophobicContact CG2-CB 4.2Å; V26-V47 HydrophobicContact CG2-CG2 4.28Å; V26-L50 HydrophobicContact CG1-CD1 4.34Å; V26-L50 HydrophobicContact CG1-CD2 4.16Å; V26-L50 HydrophobicContact CG2-CD2 4.43Å; V26-Y70 HydrophobicContact CG2-CE2 4.5Å
27	R	97.7	Very high	95.2	Very high	40 Å²	40	32.9 Å²	32.9	15%	0.151	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.8	-178.3	-68.5	-177.9	176.9	-110	-1.1	110.1	A18 T19 W29 T39 G312	A18-R27 CarbonylContact C-O 3.51Å; A18-R27 VanDerWaalsContact CA-O 3.23Å; A18-R27 WeakPolarHBondContact CA-O 3.36Å; T19-R27 PolarHBondContact N-O 2.79Å; T19-R27 PolarHBondContact O-N 3.26Å; R27-W29 HydrophobicContact CB-CZ2 3.69Å; R27-W29 HydrophobicContact CG-CZ2 4.28Å; R27-W29 PolarHBondContact O-NE1 2.84Å; R27-T39 HydrophobicContact CG-CG2 4.12Å; R27-G312 PolarHBondContact NE-O 3.23Å; R27-G312 PolarHBondContact NH1-O 2.99Å; R27-G312 PolarHBondContact NH2-O 3.42Å
28	F	97.1	Very high	95	Very high	1 Å²	1	34 Å²	34	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	138.7	174.4	-59.9	-88.3	0	0	0	109.3	V10 L17 A18 V26 C36 T37 R38 V40 I59 L72	V10-F28 HydrophobicContact CG1-CB 4.06Å; V10-F28 HydrophobicContact CG1-CD1 3.65Å; V10-F28 HydrophobicContact CG1-CE1 4.38Å; V10-F28 HydrophobicContact CG1-CG 4.03Å; V10-F28 HydrophobicContact CG2-CB 4.07Å; V10-F28 HydrophobicContact CG2-CG 4.23Å; L17-F28 WeakPolarHBondContact O-CA 3.39Å; A18-F28 HydrophobicContact CB-CD1 3.76Å; A18-F28 HydrophobicContact CB-CE1 3.8Å; V26-F28 HydrophobicContact CG1-CE2 4.14Å; V26-F28 HydrophobicContact CG1-CZ 4.08Å; F28-C36 CarbonylContact O-C 3.54Å; F28-C36 VanDerWaalsContact O-CA 3.31Å; F28-C36 WeakPolarHBondContact O-CA 3.36Å; F28-C36 PolarHBondContact O-SG 3.21Å; F28-C36 VanDerWaalsContact O-SG 3.41Å; F28-T37 PolarHBondContact O-N 2.91Å; F28-T37 PolarHBondContact O-OG1 2.75Å; F28-R38 HydrophobicContact CB-CB 4.26Å; F28-R38 HydrophobicContact CD2-CB 4.01Å; F28-R38 HydrophobicContact CD2-CG 4.09Å; F28-R38 PolarHBondContact N-O 3.28Å; F28-V40 HydrophobicContact CD2-CG2 4.49Å; F28-V40 HydrophobicContact CE2-CB 4.22Å; F28-V40 HydrophobicContact CE2-CG2 3.72Å; F28-I59 HydrophobicContact CE1-CD1 4.13Å; F28-I59 HydrophobicContact CE1-CG2 4.04Å; F28-I59 HydrophobicContact CZ-CG2 3.83Å; F28-L72 HydrophobicContact CD1-CD2 4.23Å; F28-L72 HydrophobicContact CE1-CD2 3.49Å; F28-L72 VanDerWaalsContact CE1-CD2 3.49Å; F28-L72 HydrophobicContact CZ-CD2 4.11Å
29	W	96.6	Very high	94.9	Very high	8 Å²	8	36.5 Å²	36.5	3%	0.03	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.2	-171.6	-51.1	89.4	0	0	0	110.7	L17 T19 R27 A31 I35 C36 Y310 S311	L17-W29 HydrophobicContact CB-CB 4.37Å; L17-W29 HydrophobicContact CD2-CB 4.08Å; L17-W29 HydrophobicContact CG-CB 4.17Å; L17-W29 HydrophobicContact CG-CG 4.49Å; L17-W29 PolarHBondContact O-N 3.27Å; T19-W29 PolarHBondContact OG1-NE1 3.01Å; R27-W29 HydrophobicContact CB-CZ2 3.69Å; R27-W29 HydrophobicContact CG-CZ2 4.28Å; R27-W29 PolarHBondContact O-NE1 2.84Å; W29-A31 PolarHBondContact O-N 2.8Å; W29-I35 WeakPolarHBondContact CA-O 3.38Å; W29-C36 HydrophobicContact CD2-CB 4.37Å; W29-C36 HydrophobicContact CE3-CB 3.73Å; W29-C36 HydrophobicContact CH2-CB 4.13Å; W29-C36 HydrophobicContact CZ3-CB 3.61Å; W29-Y310 HydrophobicContact CB-CD1 3.86Å; W29-Y310 HydrophobicContact CB-CE1 4.17Å; W29-Y310 HydrophobicContact CD2-CD1 4.04Å; W29-Y310 HydrophobicContact CD2-CG 4.32Å; W29-Y310 AromaticContact CE3-CD1 3.99Å; W29-Y310 HydrophobicContact CE3-CD1 3.99Å; W29-Y310 HydrophobicContact CE3-CG 4.43Å; W29-Y310 AromaticContact CG-CD1 3.99Å; W29-Y310 HydrophobicContact CG-CD1 3.99Å; W29-Y310 HydrophobicContact CG-CG 4.42Å; W29-S311 WeakPolarHBondContact CH2-O 3.47Å; W29-S311 WeakPolarHBondContact CZ3-O 3.38Å
30	Q	92.6	Very high	94.8	Very high	54 Å²	54	36.5 Å²	36.5	25%	0.252	19%	0.191	S	C	.	.			trans	-78	111.4	160.1	-87.3	167	5.3	0	0	109.1	H32 S33 G34 I35 T37	Q30-H32 PolarHBondContact O-N 3.03Å; Q30-H32 VanDerWaalsContact O-N 3.17Å; Q30-S33 WeakPolarHBondContact CB-OG 3.11Å; Q30-S33 PolarHBondContact O-N 2.77Å; Q30-S33 VanDerWaalsContact O-N 3.1Å; Q30-S33 PolarHBondContact OE1-OG 2.89Å; Q30-G34 PolarHBondContact O-N 3.16Å; Q30-I35 PolarHBondContact N-O 2.89Å; Q30-T37 HydrophobicContact CB-CG2 4.33Å; Q30-T37 HydrophobicContact CG-CG2 3.54Å
31	A	90.1	Very high	94.7	Very high	15 Å²	15	41 Å²	41	12%	0.124	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-35.3	-178.3	0	0	0	0	0	112.6	V15 W29 R308 Y310	V15-A31 HydrophobicContact CB-CB 4.36Å; V15-A31 HydrophobicContact CG1-CB 3.69Å; W29-A31 PolarHBondContact O-N 2.8Å; A31-R308 WeakPolarHBondContact O-CD 3.48Å; A31-R308 PolarHBondContact O-NE 3.45Å; A31-Y310 WeakPolarHBondContact CA-OH 3.37Å; A31-Y310 PolarHBondContact O-OH 3.47Å
32	H	88.2	Confident	94.6	Very high	116 Å²	116	41 Å²	41	54%	0.537	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-1.4	-178.1	75.9	75.8	0	0	0	114.9	Q30 R308	Q30-H32 PolarHBondContact O-N 3.03Å; Q30-H32 VanDerWaalsContact O-N 3.17Å; H32-R308 VanDerWaalsContact C-NH2 3.29Å; H32-R308 PolarHBondContact O-NH1 3.39Å; H32-R308 PolarHBondContact O-NH2 3.25Å
33	S	91.2	Very high	94.3	Very high	37 Å²	37	42 Å²	42	26%	0.259	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.9	-26.7	179.9	70.7	0	0	0	0	112.5	Q30 I35	Q30-S33 WeakPolarHBondContact CB-OG 3.11Å; Q30-S33 PolarHBondContact O-N 2.77Å; Q30-S33 VanDerWaalsContact O-N 3.1Å; Q30-S33 PolarHBondContact OE1-OG 2.89Å; S33-I35 WeakPolarHBondContact OG-CB 3.11Å; S33-I35 WeakPolarHBondContact OG-CG1 3.42Å; S33-I35 PolarHBondContact OG-N 3.18Å; S33-I35 VanDerWaalsContact OG-N 3.16Å
34	G	92.4	Very high	94	Very high	18 Å²	18	47.6 Å²	47.6	19%	0.186	25%	0.25	C	S	.	.			trans	79.8	2.4	-170.8	0	0	0	0	0	113.2	Q30	Q30-G34 PolarHBondContact O-N 3.16Å
35	I	94.3	Very high	93.9	Very high	102 Å²	102	44.4 Å²	44.4	52%	0.523	24%	0.236	S	C	.	.			trans	-79.5	131.1	-178.5	-60.5	171.9	0	0	0	109.2	W29 Q30 S33 T37	W29-I35 WeakPolarHBondContact CA-O 3.38Å; Q30-I35 PolarHBondContact N-O 2.89Å; S33-I35 WeakPolarHBondContact OG-CB 3.11Å; S33-I35 WeakPolarHBondContact OG-CG1 3.42Å; S33-I35 PolarHBondContact OG-N 3.18Å; S33-I35 VanDerWaalsContact OG-N 3.16Å; I35-T37 PolarHBondContact O-N 2.95Å
36	C	95.7	Very high	93.9	Very high	41 Å²	41	46.3 Å²	46.3	28%	0.277	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	113.6	169.4	-174.7	0	0	0	0	109.2	F28 W29 R38 T39	F28-C36 CarbonylContact O-C 3.54Å; F28-C36 VanDerWaalsContact O-CA 3.31Å; F28-C36 WeakPolarHBondContact O-CA 3.36Å; F28-C36 PolarHBondContact O-SG 3.21Å; F28-C36 VanDerWaalsContact O-SG 3.41Å; W29-C36 HydrophobicContact CD2-CB 4.37Å; W29-C36 HydrophobicContact CE3-CB 3.73Å; W29-C36 HydrophobicContact CH2-CB 4.13Å; W29-C36 HydrophobicContact CZ3-CB 3.61Å; C36-R38 PolarHBondContact SG-O 2.69Å; C36-T39 PolarHBondContact SG-OG1 2.65Å
37	T	92.7	Very high	93.9	Very high	66 Å²	66	46.4 Å²	46.4	41%	0.405	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-38.3	-178.7	50.3	0	0	0	0	111.9	F28 Q30 I35	F28-T37 PolarHBondContact O-N 2.91Å; F28-T37 PolarHBondContact O-OG1 2.75Å; Q30-T37 HydrophobicContact CB-CG2 4.33Å; Q30-T37 HydrophobicContact CG-CG2 3.54Å; I35-T37 PolarHBondContact O-N 2.95Å
38	R	93.1	Very high	93.9	Very high	25 Å²	25	46.5 Å²	46.5	9%	0.094	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	142.6	-176.6	178.6	174.8	168.4	-163.4	-4.2	110.5	V10 F28 C36 V40 D71 S74 N76	V10-R38 HydrophobicContact CG2-CB 4Å; F28-R38 HydrophobicContact CB-CB 4.26Å; F28-R38 HydrophobicContact CD2-CB 4.01Å; F28-R38 HydrophobicContact CD2-CG 4.09Å; F28-R38 PolarHBondContact N-O 3.28Å; C36-R38 PolarHBondContact SG-O 2.69Å; R38-V40 HydrophobicContact CG-CG2 4.27Å; R38-D71 PolarHBondContact NH1-O 3.1Å; R38-D71 PolarHBondContact NH2-O 3.48Å; R38-D71 VanDerWaalsContact NH2-O 3.08Å; R38-S74 VanDerWaalsContact CZ-O 3.25Å; R38-S74 PolarHBondContact NH1-O 2.86Å; R38-S74 PolarHBondContact NH2-O 2.82Å; R38-N76 PolarHBondContact NH2-O 3.41Å
39	T	95.6	Very high	94	Very high	52 Å²	52	46.6 Å²	46.6	32%	0.319	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.5	170.2	-60.1	0	0	0	0	108.7	T25 R27 C36	T25-T39 HydrophobicContact CG2-CG2 3.88Å; R27-T39 HydrophobicContact CG-CG2 4.12Å; C36-T39 PolarHBondContact SG-OG1 2.65Å
40	V	96.4	Very high	94	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	138.6	178.8	162.5	0	0	0	0	108.6	T25 V26 F28 R38 Y70 P77	T25-V40 WeakPolarHBondContact CA-O 3.33Å; V26-V40 HydrophobicContact CB-CB 4.33Å; V26-V40 PolarHBondContact N-O 3.27Å; V26-V40 PolarHBondContact O-N 2.55Å; F28-V40 HydrophobicContact CD2-CG2 4.49Å; F28-V40 HydrophobicContact CE2-CB 4.22Å; F28-V40 HydrophobicContact CE2-CG2 3.72Å; R38-V40 HydrophobicContact CG-CG2 4.27Å; V40-Y70 HydrophobicContact CG1-CD1 3.33Å; V40-Y70 HydrophobicContact CG1-CD2 4.31Å; V40-Y70 HydrophobicContact CG1-CE1 3.17Å; V40-Y70 HydrophobicContact CG1-CE2 4.2Å; V40-Y70 HydrophobicContact CG1-CG 3.9Å; V40-P77 WeakPolarHBondContact CG1-O 3.5Å
41	Q	95.3	Very high	94.3	Very high	96 Å²	96	46.4 Å²	46.4	45%	0.449	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126	179.9	-63.1	-62.9	-44.4	0	0	109.8	Q43 Y70	Q41-Q43 HydrophobicContact CB-CG 4.47Å; Q41-Y70 PolarHBondContact O-OH 2.93Å
42	H	94.6	Very high	94.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.			trans	-120.8	72.8	174.3	-174.6	-79.1	0	0	0	108.6	H24 V26 S45 V47 H66 Y70	H24-H42 WeakPolarHBondContact CA-O 3.3Å; H24-H42 WeakPolarHBondContact CB-O 3.41Å; H24-H42 CarbonylContact O-C 3.51Å; H24-H42 PolarHBondContact O-N 2.89Å; V26-H42 HydrophobicContact CG2-CB 4.2Å; H42-S45 PolarHBondContact ND1-O 3.15Å; H42-V47 HydrophobicContact CB-CG2 4.3Å; H42-H66 AromaticContact CE1-NE2 3.2Å; H42-H66 PolarHBondContact CE1-NE2 3.24Å; H42-H66 AromaticContact NE2-CD2 3.8Å; H42-H66 AromaticContact NE2-NE2 3.1Å; H42-H66 PolarHBondContact NE2-NE2 3.41Å; H42-Y70 PolarHBondContact CD2-OH 3.16Å; H42-Y70 VanDerWaalsContact CD2-OH 3.27Å
43	Q	91	Very high	95	Very high	113 Å²	113	41 Å²	41	53%	0.528	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	165	-177.9	-64.7	-177.9	-9.5	0	0	111.6	Q41 S45 R68	Q41-Q43 HydrophobicContact CB-CG 4.47Å; Q43-S45 PolarHBondContact O-N 3.25Å; Q43-R68 PolarHBondContact O-NH1 3.29Å; Q43-R68 PolarHBondContact O-NH2 2.8Å
44	D	89.4	Confident	95.2	Very high	135 Å²	135	41.5 Å²	41.5	72%	0.722	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.2	-3.1	172.7	-42.4	-51.4	0	0	0	116.6	R68	D44-R68 IonicContact OD2-NH2 3.41Å
45	S	94	Very high	95.2	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.028	24%	0.238	C	C	.	.	S	Bend	trans	-162	155.5	175.1	-171.9	0	0	0	0	112.9	H24 H42 Q43 Y64 H66	H24-S45 PolarHBondContact ND1-O 2.68Å; H42-S45 PolarHBondContact ND1-O 3.15Å; Q43-S45 PolarHBondContact O-N 3.25Å; S45-Y64 WeakPolarHBondContact OG-CB 3.36Å; S45-Y64 PolarHBondContact OG-N 3.22Å; S45-H66 VanDerWaalsContact CB-CE1 3.44Å; S45-H66 WeakPolarHBondContact CB-CE1 3.25Å
46	Q	95.9	Very high	95.2	Very high	50 Å²	50	40.7 Å²	40.7	23%	0.234	22%	0.216	C	C	.	.			trans	-70.8	164.8	160.4	70.2	-80.6	4.4	0	0	111.6	Y22 G63 N89	Y22-Q46 HydrophobicContact CD1-CB 3.56Å; Y22-Q46 HydrophobicContact CD1-CG 4.13Å; Y22-Q46 HydrophobicContact CE1-CB 3.81Å; Y22-Q46 HydrophobicContact CE1-CG 3.85Å; Y22-Q46 HydrophobicContact CG-CB 4.48Å; Q46-G63 VanDerWaalsContact O-CA 3.32Å; Q46-G63 WeakPolarHBondContact O-CA 3.26Å; Q46-N89 PolarHBondContact NE2-OD1 3.21Å
47	V	98.1	Very high	95.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	120.8	173.6	-171.8	0	0	0	0	108.9	A20 V26 H42 L50 A61 V318 C319	A20-V47 HydrophobicContact CB-CB 3.66Å; A20-V47 HydrophobicContact CB-CG1 4.04Å; A20-V47 HydrophobicContact CB-CG2 3.77Å; V26-V47 HydrophobicContact CG2-CG2 4.28Å; H42-V47 HydrophobicContact CB-CG2 4.3Å; V47-L50 HydrophobicContact CG1-CD2 3.89Å; V47-L50 HydrophobicContact CG1-CG 3.88Å; V47-A61 HydrophobicContact CG1-CB 3.87Å; V47-A61 HydrophobicContact CG2-CB 4.36Å; V47-V318 WeakPolarHBondContact O-CG2 3.43Å; V47-C319 PolarHBondContact O-SG 2.89Å; V47-C319 VanDerWaalsContact O-SG 3.36Å
48	N	97.8	Very high	95.2	Very high	42 Å²	42	38.4 Å²	38.4	23%	0.225	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-33.7	-178.6	-58.3	-39.7	0	0	0	112.1	A62 N89 I90	N48-A62 PolarHBondContact N-O 2.95Å; N48-N89 PolarHBondContact ND2-OD1 3.46Å; N48-I90 WeakPolarHBondContact CB-O 3.46Å; N48-I90 PolarHBondContact ND2-O 2.78Å
49	S	98.1	Very high	95.4	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.028	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	137.9	179.6	-168.2	0	0	0	0	110.2	A62	S49-A62 PolarHBondContact N-O 2.9Å; S49-A62 PolarHBondContact O-N 3.42Å
50	L	98.3	Very high	95.6	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	137	172.7	-77.7	172.6	0	0	0	108.9	A18 A20 V26 V47 I59 A60 A61 A321	A18-L50 HydrophobicContact CB-CD1 4.46Å; A20-L50 HydrophobicContact CB-CD1 3.58Å; A20-L50 HydrophobicContact CB-CD2 4.48Å; A20-L50 HydrophobicContact CB-CG 4.18Å; V26-L50 HydrophobicContact CG1-CD1 4.34Å; V26-L50 HydrophobicContact CG1-CD2 4.16Å; V26-L50 HydrophobicContact CG2-CD2 4.43Å; V47-L50 HydrophobicContact CG1-CD2 3.89Å; V47-L50 HydrophobicContact CG1-CG 3.88Å; L50-I59 HydrophobicContact CD2-CD1 4.06Å; L50-I59 HydrophobicContact CD2-CG1 4.33Å; L50-A60 VanDerWaalsContact CA-O 3.31Å; L50-A60 WeakPolarHBondContact CA-O 3.49Å; L50-A60 WeakPolarHBondContact CD2-O 3.46Å; L50-A61 HydrophobicContact CD2-CB 3.74Å; L50-A321 HydrophobicContact CB-CB 3.88Å
51	E	98.3	Very high	95.7	Very high	57 Å²	57	34.7 Å²	34.7	27%	0.266	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	133.7	174.1	-159.6	85.1	171.7	0	0	109.9	I59 A60 V93 F95	E51-I59 CarbonylContact O-C 3.52Å; E51-I59 WeakPolarHBondContact O-CA 3.39Å; E51-I59 WeakPolarHBondContact O-CG1 3.29Å; E51-A60 PolarHBondContact N-O 2.98Å; E51-A60 VanDerWaalsContact N-O 3.11Å; E51-A60 PolarHBondContact O-N 3.32Å; E51-V93 HydrophobicContact CB-CG1 4Å; E51-F95 HydrophobicContact CB-CD2 4.22Å; E51-F95 HydrophobicContact CB-CE2 3.94Å; E51-F95 HydrophobicContact CG-CD2 3.88Å; E51-F95 HydrophobicContact CG-CE2 4.12Å
52	V	97.4	Very high	95.8	Very high	12 Å²	12	30.1 Å²	30.1	7%	0.073	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	138.4	173.8	173.2	0	0	0	0	108.6	I16 I59 L72 A321 N323	I16-V52 HydrophobicContact CD1-CG1 4.27Å; I16-V52 HydrophobicContact CG2-CG2 3.92Å; V52-I59 HydrophobicContact CG2-CB 4.39Å; V52-I59 HydrophobicContact CG2-CD1 4.05Å; V52-I59 HydrophobicContact CG2-CG1 4.09Å; V52-L72 HydrophobicContact CG1-CD1 3.92Å; V52-A321 HydrophobicContact CG2-CB 3.98Å; V52-N323 HydrophobicContact CB-CB 4.34Å; V52-N323 HydrophobicContact CG1-CB 4.33Å
53	T	96.5	Very high	95.9	Very high	6 Å²	6	30.1 Å²	30.1	4%	0.037	16%	0.159	C	C	.	.			trans	-64.5	148.6	176.1	54.7	0	0	0	0	110.9	D55 R56 S57 M58 M69 F95	T53-D55 WeakPolarHBondContact CB-OD1 3.42Å; T53-D55 PolarHBondContact O-N 3.33Å; T53-D55 PolarHBondContact OG1-OD1 3.49Å; T53-R56 WeakPolarHBondContact O-CA 3.45Å; T53-R56 PolarHBondContact O-N 2.94Å; T53-S57 PolarHBondContact OG1-N 3Å; T53-M58 HydrophobicContact CG2-CB 4.01Å; T53-M58 PolarHBondContact N-O 3.39Å; T53-M58 PolarHBondContact OG1-N 3.12Å; T53-M58 PolarHBondContact OG1-O 2.89Å; T53-M58 VanDerWaalsContact OG1-O 3.07Å; T53-M69 HydrophobicContact CG2-CE 3.71Å; T53-F95 HydrophobicContact CG2-CD1 4.38Å; T53-F95 HydrophobicContact CG2-CD2 4.36Å; T53-F95 HydrophobicContact CG2-CE1 3.89Å; T53-F95 HydrophobicContact CG2-CE2 3.87Å; T53-F95 HydrophobicContact CG2-CZ 3.6Å
54	P	94	Very high	96.2	Very high	47 Å²	47	29.7 Å²	29.7	31%	0.305	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-32.6	-178.2	-27.2	35.7	0	0	0	114	R56 F95 E97	P54-R56 PolarHBondContact O-N 2.74Å; P54-F95 HydrophobicContact CG-CB 3.91Å; P54-E97 WeakPolarHBondContact CB-O 3.46Å
55	D	92.6	Very high	96.6	Very high	87 Å²	87	26.9 Å²	26.9	47%	0.465	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-0.3	175.5	71.8	-13.1	0	0	0	113.8	T53 S57	T53-D55 WeakPolarHBondContact CB-OD1 3.42Å; T53-D55 PolarHBondContact O-N 3.33Å; T53-D55 PolarHBondContact OG1-OD1 3.49Å; D55-S57 PolarHBondContact O-N 2.79Å; D55-S57 VanDerWaalsContact O-N 3.1Å; D55-S57 WeakPolarHBondContact OD1-CB 3.41Å; D55-S57 PolarHBondContact OD1-N 2.84Å; D55-S57 PolarHBondContact OD1-OG 3.38Å; D55-S57 WeakPolarHBondContact OD2-CB 3.46Å; D55-S57 PolarHBondContact OD2-OG 3.04Å
56	R	93.7	Very high	96.7	Very high	16 Å²	16	27.4 Å²	27.4	6%	0.06	14%	0.137	C	C	.	.	S	Bend	trans	57.9	19.7	-179.2	-51.9	180	65	-159.8	-13.3	114	D13 P14 I16 T53 P54 L72 S325	D13-R56 PolarHBondContact O-NH2 3.03Å; P14-R56 PolarHBondContact O-NH2 2.9Å; I16-R56 HydrophobicContact CD1-CB 4.23Å; T53-R56 WeakPolarHBondContact O-CA 3.45Å; T53-R56 PolarHBondContact O-N 2.94Å; P54-R56 PolarHBondContact O-N 2.74Å; R56-L72 WeakPolarHBondContact O-CD1 3.42Å; R56-S325 PolarHBondContact NH1-O 3.09Å
57	S	93.8	Very high	96.7	Very high	31 Å²	31	25 Å²	25	22%	0.217	13%	0.126	C	C	.	.	S	Bend	trans	-82.6	-32.6	-179	71.3	0	0	0	0	112.9	T53 D55 L72	T53-S57 PolarHBondContact OG1-N 3Å; D55-S57 PolarHBondContact O-N 2.79Å; D55-S57 VanDerWaalsContact O-N 3.1Å; D55-S57 WeakPolarHBondContact OD1-CB 3.41Å; D55-S57 PolarHBondContact OD1-N 2.84Å; D55-S57 PolarHBondContact OD1-OG 3.38Å; D55-S57 WeakPolarHBondContact OD2-CB 3.46Å; D55-S57 PolarHBondContact OD2-OG 3.04Å; S57-L72 PolarHBondContact O-N 3.08Å
58	M	95.8	Very high	96.7	Very high	27 Å²	27	26.5 Å²	26.5	13%	0.133	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	167.9	-174.6	-55.8	-173.1	83.4	0	0	112.4	T53 M69 Y70 L72 V80 I81	T53-M58 HydrophobicContact CG2-CB 4.01Å; T53-M58 PolarHBondContact N-O 3.39Å; T53-M58 PolarHBondContact OG1-N 3.12Å; T53-M58 PolarHBondContact OG1-O 2.89Å; T53-M58 VanDerWaalsContact OG1-O 3.07Å; M58-M69 HydrophobicContact CB-CE 3.76Å; M58-M69 HydrophobicContact CE-CB 3.46Å; M58-M69 VanDerWaalsContact CE-CB 3.46Å; M58-M69 HydrophobicContact CG-CE 4.5Å; M58-M69 HydrophobicContact SD-CB 4.31Å; M58-M69 HydrophobicContact SD-CE 4.01Å; M58-Y70 CarbonylContact C-O 3.55Å; M58-Y70 WeakPolarHBondContact CA-O 3.31Å; M58-Y70 WeakPolarHBondContact CB-O 3.45Å; M58-L72 VanDerWaalsContact C-CD1 3.46Å; M58-L72 VanDerWaalsContact O-CD1 3.31Å; M58-L72 WeakPolarHBondContact O-CD1 3.06Å; M58-V80 HydrophobicContact CE-CB 3.78Å; M58-V80 HydrophobicContact CE-CG1 4.27Å; M58-V80 HydrophobicContact CE-CG2 4.38Å; M58-I81 HydrophobicContact CE-CD1 4.29Å; M58-I81 HydrophobicContact CE-CG1 4.34Å; M58-I81 HydrophobicContact SD-CD1 4.23Å
59	I	97.6	Very high	96.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132.2	169.2	-172	173.3	0	0	0	109.8	A18 F28 L50 E51 V52 M69 Y70 L72 A321	A18-I59 HydrophobicContact CB-CD1 3.47Å; A18-I59 VanDerWaalsContact CB-CD1 3.47Å; F28-I59 HydrophobicContact CE1-CD1 4.13Å; F28-I59 HydrophobicContact CE1-CG2 4.04Å; F28-I59 HydrophobicContact CZ-CG2 3.83Å; L50-I59 HydrophobicContact CD2-CD1 4.06Å; L50-I59 HydrophobicContact CD2-CG1 4.33Å; E51-I59 CarbonylContact O-C 3.52Å; E51-I59 WeakPolarHBondContact O-CA 3.39Å; E51-I59 WeakPolarHBondContact O-CG1 3.29Å; V52-I59 HydrophobicContact CG2-CB 4.39Å; V52-I59 HydrophobicContact CG2-CD1 4.05Å; V52-I59 HydrophobicContact CG2-CG1 4.09Å; I59-M69 WeakPolarHBondContact O-CA 3.35Å; I59-Y70 HydrophobicContact CG2-CD2 4.42Å; I59-Y70 PolarHBondContact N-O 2.86Å; I59-Y70 PolarHBondContact O-N 2.82Å; I59-L72 HydrophobicContact CB-CD1 4.43Å; I59-L72 HydrophobicContact CB-CD2 4.18Å; I59-L72 HydrophobicContact CB-CG 4.42Å; I59-L72 HydrophobicContact CG2-CD2 3.97Å; I59-L72 HydrophobicContact CG2-CG 4.44Å; I59-A321 HydrophobicContact CD1-CB 3.97Å
60	A	98.3	Very high	96.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.5	171	0	0	0	0	0	110.6	L50 E51 I67 M69 V93 F95	L50-A60 VanDerWaalsContact CA-O 3.31Å; L50-A60 WeakPolarHBondContact CA-O 3.49Å; L50-A60 WeakPolarHBondContact CD2-O 3.46Å; E51-A60 PolarHBondContact N-O 2.98Å; E51-A60 VanDerWaalsContact N-O 3.11Å; E51-A60 PolarHBondContact O-N 3.32Å; A60-I67 HydrophobicContact CB-CG2 4.18Å; A60-M69 HydrophobicContact CB-SD 3.57Å; A60-M69 VanDerWaalsContact CB-SD 3.57Å; A60-V93 HydrophobicContact CB-CG1 4.19Å; A60-V93 HydrophobicContact CB-CG2 4.09Å; A60-F95 HydrophobicContact CB-CE2 4.04Å; A60-F95 HydrophobicContact CB-CZ 3.69Å
61	A	98.4	Very high	96.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	105.7	166.2	0	0	0	0	0	109	V47 L50 R68 Y70	V47-A61 HydrophobicContact CG1-CB 3.87Å; V47-A61 HydrophobicContact CG2-CB 4.36Å; L50-A61 HydrophobicContact CD2-CB 3.74Å; A61-R68 PolarHBondContact N-O 2.72Å; A61-R68 PolarHBondContact O-N 2.85Å; A61-Y70 HydrophobicContact CB-CD2 4.45Å; A61-Y70 HydrophobicContact CB-CE2 3.9Å
62	A	98.1	Very high	96.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	125.6	175.4	0	0	0	0	0	110	N48 S49 I67 I90 V93	N48-A62 PolarHBondContact N-O 2.95Å; S49-A62 PolarHBondContact N-O 2.9Å; S49-A62 PolarHBondContact O-N 3.42Å; A62-I67 HydrophobicContact CB-CG1 4.35Å; A62-I90 HydrophobicContact CB-CB 3.99Å; A62-I90 HydrophobicContact CB-CG2 3.69Å; A62-V93 HydrophobicContact CB-CB 4.18Å; A62-V93 HydrophobicContact CB-CG1 4.05Å
63	G	97.1	Very high	96.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	-147.8	-179	0	0	0	0	0	112.8	Q46 Q65 H66 I90	Q46-G63 VanDerWaalsContact O-CA 3.32Å; Q46-G63 WeakPolarHBondContact O-CA 3.26Å; G63-Q65 PolarHBondContact O-N 3.24Å; G63-H66 PolarHBondContact N-O 2.95Å; G63-I90 WeakPolarHBondContact O-CD1 3.38Å; G63-I90 PolarHBondContact O-N 3.15Å
64	Y	97.4	Very high	95.7	Very high	103 Å²	103	28.1 Å²	28.1	40%	0.404	14%	0.144	S	C	.	.	B	Isolated β-bridge	trans	-78.8	113.3	173.6	-174.9	-111.9	0	0	0	109.9	S45 H66	S45-Y64 WeakPolarHBondContact OG-CB 3.36Å; S45-Y64 PolarHBondContact OG-N 3.22Å; Y64-H66 PolarHBondContact O-N 3.34Å; Y64-H66 PolarHBondContact O-ND1 2.81Å
65	Q	96.5	Very high	95.4	Very high	76 Å²	76	30.3 Å²	30.3	36%	0.355	15%	0.153	S	C	.	.	S	Bend	trans	67.3	-7.9	174.1	-56.9	-177.8	-27.7	0	0	117.4	G63 V86 S87 K88	G63-Q65 PolarHBondContact O-N 3.24Å; Q65-V86 WeakPolarHBondContact CA-O 3.24Å; Q65-V86 WeakPolarHBondContact CB-O 3.45Å; Q65-V86 VanDerWaalsContact CG-O 3.29Å; Q65-V86 WeakPolarHBondContact CG-O 3.34Å; Q65-S87 PolarHBondContact NE2-O 2.86Å; Q65-K88 PolarHBondContact N-O 3.42Å
66	H	96.3	Very high	95.2	Very high	15 Å²	15	29 Å²	29	7%	0.069	15%	0.146	C	C	.	.			trans	-135.1	151.5	177.8	63.6	-108.6	0	0	0	113.8	H42 S45 G63 Y64 Y83	H42-H66 AromaticContact CE1-NE2 3.2Å; H42-H66 PolarHBondContact CE1-NE2 3.24Å; H42-H66 AromaticContact NE2-CD2 3.8Å; H42-H66 AromaticContact NE2-NE2 3.1Å; H42-H66 PolarHBondContact NE2-NE2 3.41Å; S45-H66 VanDerWaalsContact CB-CE1 3.44Å; S45-H66 WeakPolarHBondContact CB-CE1 3.25Å; G63-H66 PolarHBondContact N-O 2.95Å; Y64-H66 PolarHBondContact O-N 3.34Å; Y64-H66 PolarHBondContact O-ND1 2.81Å; H66-Y83 CarbonylContact C-O 3.55Å; H66-Y83 VanDerWaalsContact CA-O 3.26Å; H66-Y83 WeakPolarHBondContact CA-O 3.35Å
67	I	97.8	Very high	95	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114	163.1	-54.6	126.3	0	0	0	108	A60 A62 Y83 I90 M102 T104 W114	A60-I67 HydrophobicContact CB-CG2 4.18Å; A62-I67 HydrophobicContact CB-CG1 4.35Å; I67-Y83 HydrophobicContact CB-CD2 4.36Å; I67-Y83 PolarHBondContact N-O 2.74Å; I67-Y83 PolarHBondContact O-N 2.66Å; I67-I90 HydrophobicContact CD1-CD1 4.41Å; I67-I90 HydrophobicContact CD1-CG1 4.24Å; I67-I90 HydrophobicContact CG1-CB 4.5Å; I67-I90 HydrophobicContact CG1-CD1 4.14Å; I67-I90 HydrophobicContact CG1-CG1 4.17Å; I67-I90 HydrophobicContact CG1-CG2 4.28Å; I67-M102 HydrophobicContact CD1-CE 4.08Å; I67-M102 HydrophobicContact CG2-CE 4.29Å; I67-M102 HydrophobicContact CG2-SD 4.1Å; I67-T104 HydrophobicContact CD1-CG2 3.81Å; I67-T104 HydrophobicContact CG1-CG2 4.39Å; I67-W114 HydrophobicContact CD1-CH2 4.37Å; I67-W114 HydrophobicContact CD1-CZ2 3.79Å
68	R	97.8	Very high	95	Very high	32 Å²	32	34.5 Å²	34.5	12%	0.121	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.3	179.6	-78.4	174.7	-174.6	166.6	-0.5	110.3	Q43 D44 A61 Y70 P79 N82	Q43-R68 PolarHBondContact O-NH1 3.29Å; Q43-R68 PolarHBondContact O-NH2 2.8Å; D44-R68 IonicContact OD2-NH2 3.41Å; A61-R68 PolarHBondContact N-O 2.72Å; A61-R68 PolarHBondContact O-N 2.85Å; R68-Y70 HydrophobicContact CB-CE2 3.82Å; R68-Y70 WeakPolarHBondContact CD-OH 3.34Å; R68-P79 HydrophobicContact CB-CB 3.97Å; R68-P79 HydrophobicContact CG-CB 3.95Å; R68-P79 HydrophobicContact CG-CG 4.27Å; R68-N82 WeakPolarHBondContact CG-OD1 3.48Å
69	M	97.5	Very high	95	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.3	175.2	-59.4	-70.9	-69.6	0	0	109.9	T53 M58 I59 A60 P79 V80 I81 Y83 F95	T53-M69 HydrophobicContact CG2-CE 3.71Å; M58-M69 HydrophobicContact CB-CE 3.76Å; M58-M69 HydrophobicContact CE-CB 3.46Å; M58-M69 VanDerWaalsContact CE-CB 3.46Å; M58-M69 HydrophobicContact CG-CE 4.5Å; M58-M69 HydrophobicContact SD-CB 4.31Å; M58-M69 HydrophobicContact SD-CE 4.01Å; I59-M69 WeakPolarHBondContact O-CA 3.35Å; A60-M69 HydrophobicContact CB-SD 3.57Å; A60-M69 VanDerWaalsContact CB-SD 3.57Å; M69-P79 CarbonylContact O-C 3.6Å; M69-P79 WeakPolarHBondContact O-CA 3.46Å; M69-V80 PolarHBondContact O-N 2.84Å; M69-I81 HydrophobicContact CB-CB 3.94Å; M69-I81 HydrophobicContact CG-CB 4.01Å; M69-I81 PolarHBondContact N-O 3.25Å; M69-Y83 HydrophobicContact CG-CD2 4.4Å; M69-Y83 HydrophobicContact CG-CE2 3.94Å; M69-F95 HydrophobicContact CE-CE1 4.27Å; M69-F95 HydrophobicContact CE-CZ 3.96Å; M69-F95 HydrophobicContact SD-CZ 4.21Å
70	Y	97.1	Very high	94.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.4	175.6	-57.8	-83.8	0	0	0	110.4	V26 V40 Q41 H42 M58 I59 A61 R68 P79	V26-Y70 HydrophobicContact CG2-CE2 4.5Å; V40-Y70 HydrophobicContact CG1-CD1 3.33Å; V40-Y70 HydrophobicContact CG1-CD2 4.31Å; V40-Y70 HydrophobicContact CG1-CE1 3.17Å; V40-Y70 HydrophobicContact CG1-CE2 4.2Å; V40-Y70 HydrophobicContact CG1-CG 3.9Å; Q41-Y70 PolarHBondContact O-OH 2.93Å; H42-Y70 PolarHBondContact CD2-OH 3.16Å; H42-Y70 VanDerWaalsContact CD2-OH 3.27Å; M58-Y70 CarbonylContact C-O 3.55Å; M58-Y70 WeakPolarHBondContact CA-O 3.31Å; M58-Y70 WeakPolarHBondContact CB-O 3.45Å; I59-Y70 HydrophobicContact CG2-CD2 4.42Å; I59-Y70 PolarHBondContact N-O 2.86Å; I59-Y70 PolarHBondContact O-N 2.82Å; A61-Y70 HydrophobicContact CB-CD2 4.45Å; A61-Y70 HydrophobicContact CB-CE2 3.9Å; R68-Y70 HydrophobicContact CB-CE2 3.82Å; R68-Y70 WeakPolarHBondContact CD-OH 3.34Å; Y70-P79 HydrophobicContact CD1-CB 4.27Å; Y70-P79 HydrophobicContact CE1-CB 3.87Å; Y70-P79 HydrophobicContact CE1-CG 4.34Å
71	D	95.4	Very high	94.8	Very high	37 Å²	37	41.6 Å²	41.6	20%	0.198	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.7	176.9	176.9	16.6	0	0	0	110.8	R38 N73 S74 V80	R38-D71 PolarHBondContact NH1-O 3.1Å; R38-D71 PolarHBondContact NH2-O 3.48Å; R38-D71 VanDerWaalsContact NH2-O 3.08Å; D71-N73 WeakPolarHBondContact OD1-CB 3.38Å; D71-N73 PolarHBondContact OD1-N 2.81Å; D71-S74 PolarHBondContact OD1-N 2.85Å; D71-S74 WeakPolarHBondContact OD2-CB 3.46Å; D71-S74 PolarHBondContact OD2-N 2.82Å; D71-S74 PolarHBondContact OD2-OG 3.48Å; D71-V80 HydrophobicContact CB-CG2 3.79Å
72	L	93.8	Very high	94.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-85.8	-24.7	179.5	-66.2	170.3	0	0	0	112	V10 G11 I16 F28 V52 R56 S57 M58 I59	V10-L72 HydrophobicContact CG1-CD2 4.2Å; V10-L72 PolarHBondContact N-O 2.94Å; G11-L72 PolarHBondContact N-O 2.95Å; I16-L72 HydrophobicContact CD1-CD1 4.1Å; I16-L72 HydrophobicContact CG2-CD2 4.49Å; F28-L72 HydrophobicContact CD1-CD2 4.23Å; F28-L72 HydrophobicContact CE1-CD2 3.49Å; F28-L72 VanDerWaalsContact CE1-CD2 3.49Å; F28-L72 HydrophobicContact CZ-CD2 4.11Å; V52-L72 HydrophobicContact CG1-CD1 3.92Å; R56-L72 WeakPolarHBondContact O-CD1 3.42Å; S57-L72 PolarHBondContact O-N 3.08Å; M58-L72 VanDerWaalsContact C-CD1 3.46Å; M58-L72 VanDerWaalsContact O-CD1 3.31Å; M58-L72 WeakPolarHBondContact O-CD1 3.06Å; I59-L72 HydrophobicContact CB-CD1 4.43Å; I59-L72 HydrophobicContact CB-CD2 4.18Å; I59-L72 HydrophobicContact CB-CG 4.42Å; I59-L72 HydrophobicContact CG2-CD2 3.97Å; I59-L72 HydrophobicContact CG2-CG 4.44Å
73	N	91.8	Very high	94.5	Very high	79 Å²	79	43.9 Å²	43.9	42%	0.422	23%	0.233	S	C	.	.	S	Bend	trans	-90.6	-16.6	-175.3	-68	-40.2	0	0	0	113.5	T9 D71	T9-N73 WeakPolarHBondContact CB-O 3.31Å; T9-N73 WeakPolarHBondContact CG2-O 3.43Å; D71-N73 WeakPolarHBondContact OD1-CB 3.38Å; D71-N73 PolarHBondContact OD1-N 2.81Å
74	S	90	Very high	94.2	Very high	37 Å²	37	48 Å²	48	26%	0.259	26%	0.255	S	S	.	.	S	Bend	trans	-111.5	157.6	168.6	73.1	0	0	0	0	111.3	R38 D71 N76	R38-S74 VanDerWaalsContact CZ-O 3.25Å; R38-S74 PolarHBondContact NH1-O 2.86Å; R38-S74 PolarHBondContact NH2-O 2.82Å; D71-S74 PolarHBondContact OD1-N 2.85Å; D71-S74 WeakPolarHBondContact OD2-CB 3.46Å; D71-S74 PolarHBondContact OD2-N 2.82Å; D71-S74 PolarHBondContact OD2-OG 3.48Å; S74-N76 PolarHBondContact O-N 3.5Å; S74-N76 WeakPolarHBondContact OG-CB 3.33Å; S74-N76 PolarHBondContact OG-N 2.97Å
75	N	86.3	Confident	93.6	Very high	94 Å²	94	46.5 Å²	46.5	50%	0.503	27%	0.272	S	S	.	.			trans	-82.8	20.3	173.4	-72	-29.5	0	0	0	113	P77	N75-P77 VanDerWaalsContact O-CD 3.31Å; N75-P77 WeakPolarHBondContact O-CD 3.04Å
76	N	89.7	Confident	93.4	Very high	59 Å²	59	43.2 Å²	43.2	32%	0.316	26%	0.257	S	S	.	.			trans	-68.4	114.1	-177.8	-179.1	4.8	0	0	0	111.3	R38 S74 N78	R38-N76 PolarHBondContact NH2-O 3.41Å; S74-N76 PolarHBondContact O-N 3.5Å; S74-N76 WeakPolarHBondContact OG-CB 3.33Å; S74-N76 PolarHBondContact OG-N 2.97Å; N76-N78 PolarHBondContact O-N 2.8Å; N76-N78 WeakPolarHBondContact OD1-CB 3.43Å; N76-N78 PolarHBondContact OD1-N 2.91Å
77	P	89.4	Confident	93.2	Very high	64 Å²	64	45.7 Å²	45.7	42%	0.416	28%	0.276	S	S	.	.			trans	-73.9	-6.4	-176.7	32.7	-37.2	0	0	0	113.9	V40 N75	V40-P77 WeakPolarHBondContact CG1-O 3.5Å; N75-P77 VanDerWaalsContact O-CD 3.31Å; N75-P77 WeakPolarHBondContact O-CD 3.04Å
78	N	93.8	Very high	93.2	Very high	98 Å²	98	50.1 Å²	50.1	52%	0.524	30%	0.295	S	S	.	.	S	Bend	trans	-100.1	153.8	-175.3	-61.3	-46.3	0	0	0	111.6	N76 V80	N76-N78 PolarHBondContact O-N 2.8Å; N76-N78 WeakPolarHBondContact OD1-CB 3.43Å; N76-N78 PolarHBondContact OD1-N 2.91Å; N78-V80 PolarHBondContact O-N 2.79Å
79	P	94.9	Very high	93.2	Very high	50 Å²	50	49.6 Å²	49.6	33%	0.325	29%	0.294	S	S	.	.			trans	-62.7	136.1	171.7	28.2	-34.2	0	0	0	110.1	R68 M69 Y70	R68-P79 HydrophobicContact CB-CB 3.97Å; R68-P79 HydrophobicContact CG-CB 3.95Å; R68-P79 HydrophobicContact CG-CG 4.27Å; M69-P79 CarbonylContact O-C 3.6Å; M69-P79 WeakPolarHBondContact O-CA 3.46Å; Y70-P79 HydrophobicContact CD1-CB 4.27Å; Y70-P79 HydrophobicContact CE1-CB 3.87Å; Y70-P79 HydrophobicContact CE1-CG 4.34Å
80	V	95.4	Very high	93.2	Very high	78 Å²	78	49.5 Å²	49.5	47%	0.473	29%	0.294	S	S	.	.	S	Bend	trans	-89.3	-33.3	178.4	-177.7	0	0	0	0	110.9	M58 M69 D71 N78	M58-V80 HydrophobicContact CE-CB 3.78Å; M58-V80 HydrophobicContact CE-CG1 4.27Å; M58-V80 HydrophobicContact CE-CG2 4.38Å; M69-V80 PolarHBondContact O-N 2.84Å; D71-V80 HydrophobicContact CB-CG2 3.79Å; N78-V80 PolarHBondContact O-N 2.79Å
81	I	95.4	Very high	93.3	Very high	48 Å²	48	50.6 Å²	50.6	25%	0.246	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.6	174.6	-50.4	172.5	0	0	0	107.7	M58 M69 Y83 L121	M58-I81 HydrophobicContact CE-CD1 4.29Å; M58-I81 HydrophobicContact CE-CG1 4.34Å; M58-I81 HydrophobicContact SD-CD1 4.23Å; M69-I81 HydrophobicContact CB-CB 3.94Å; M69-I81 HydrophobicContact CG-CB 4.01Å; M69-I81 PolarHBondContact N-O 3.25Å; I81-Y83 HydrophobicContact CB-CE2 4.37Å; I81-Y83 HydrophobicContact CG2-CD2 4.06Å; I81-Y83 HydrophobicContact CG2-CE2 3.51Å; I81-L121 HydrophobicContact CG2-CD1 4.06Å; I81-L121 HydrophobicContact CG2-CD2 3.87Å
82	N	95.3	Very high	93.4	Very high	46 Å²	46	49 Å²	49	25%	0.246	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	114.3	175.2	-167.3	46.1	0	0	0	109.5	R68 D84 L121	R68-N82 WeakPolarHBondContact CG-OD1 3.48Å; N82-D84 PolarHBondContact ND2-OD1 3.4Å; N82-D84 PolarHBondContact ND2-OD2 3.21Å; N82-L121 WeakPolarHBondContact O-CD1 3.41Å
83	Y	95.6	Very high	93.6	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.008	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	114	173.5	-62.6	-91.7	0	0	0	108.7	H66 I67 M69 I81 M102 W114 L116 L121	H66-Y83 CarbonylContact C-O 3.55Å; H66-Y83 VanDerWaalsContact CA-O 3.26Å; H66-Y83 WeakPolarHBondContact CA-O 3.35Å; I67-Y83 HydrophobicContact CB-CD2 4.36Å; I67-Y83 PolarHBondContact N-O 2.74Å; I67-Y83 PolarHBondContact O-N 2.66Å; M69-Y83 HydrophobicContact CG-CD2 4.4Å; M69-Y83 HydrophobicContact CG-CE2 3.94Å; I81-Y83 HydrophobicContact CB-CE2 4.37Å; I81-Y83 HydrophobicContact CG2-CD2 4.06Å; I81-Y83 HydrophobicContact CG2-CE2 3.51Å; Y83-M102 HydrophobicContact CD2-CE 3.95Å; Y83-M102 HydrophobicContact CE2-CE 4.04Å; Y83-M102 HydrophobicContact CG-CE 4.22Å; Y83-W114 HydrophobicContact CD1-CD2 4.3Å; Y83-W114 AromaticContact CD1-CE3 3.59Å; Y83-W114 HydrophobicContact CD1-CE3 3.59Å; Y83-W114 AromaticContact CD1-CZ3 3.99Å; Y83-W114 HydrophobicContact CD1-CZ3 3.99Å; Y83-W114 HydrophobicContact CE1-CE3 4.27Å; Y83-W114 HydrophobicContact CG-CE3 4.29Å; Y83-W114 HydrophobicContact CG-CZ3 4.46Å; Y83-L116 HydrophobicContact CE2-CD2 4.38Å; Y83-L116 WeakPolarHBondContact OH-CD2 3.47Å; Y83-L121 HydrophobicContact CD1-CB 3.82Å; Y83-L121 HydrophobicContact CD1-CD2 4.12Å; Y83-L121 HydrophobicContact CD1-CG 4.43Å; Y83-L121 HydrophobicContact CE1-CB 4.06Å; Y83-L121 HydrophobicContact CE1-CD2 3.57Å; Y83-L121 HydrophobicContact CE1-CG 4.34Å
84	D	91.6	Very high	93.9	Very high	86 Å²	86	45.5 Å²	45.5	46%	0.46	27%	0.274	S	S	.	.			trans	-112.3	179.9	177.9	-61.7	-61.1	0	0	0	110.9	N82	N82-D84 PolarHBondContact ND2-OD1 3.4Å; N82-D84 PolarHBondContact ND2-OD2 3.21Å
85	G	85.1	Confident	94.3	Very high	73 Å²	73	44.5 Å²	44.5	75%	0.753	27%	0.265	S	S	*	.			trans	96	8.8	176.4	0	0	0	0	0	114.4
86	V	92.1	Very high	94.9	Very high	6 Å²	6	41.9 Å²	41.9	4%	0.036	25%	0.25	C	C	.	.			trans	-96.4	138.3	170.1	-175.5	0	0	0	0	109.1	Q65 I90 D108 W114	Q65-V86 WeakPolarHBondContact CA-O 3.24Å; Q65-V86 WeakPolarHBondContact CB-O 3.45Å; Q65-V86 VanDerWaalsContact CG-O 3.29Å; Q65-V86 WeakPolarHBondContact CG-O 3.34Å; V86-I90 HydrophobicContact CB-CD1 4.1Å; V86-I90 HydrophobicContact CB-CG1 4.4Å; V86-I90 HydrophobicContact CG1-CD1 4.12Å; V86-I90 HydrophobicContact CG1-CG1 4.04Å; V86-I90 HydrophobicContact CG2-CD1 4.39Å; V86-I90 HydrophobicContact CG2-CG1 4.44Å; V86-D108 WeakPolarHBondContact CG1-OD2 3.39Å; V86-W114 HydrophobicContact CG2-CH2 3.87Å; V86-W114 HydrophobicContact CG2-CZ2 4.03Å
87	S	91.7	Very high	95.1	Very high	67 Å²	67	45.8 Å²	45.8	47%	0.469	27%	0.266	S	S	.	.	S	Bend	trans	-89.2	-16.4	-168.3	66.6	0	0	0	0	115	Q65 D108	Q65-S87 PolarHBondContact NE2-O 2.86Å; S87-D108 WeakPolarHBondContact OG-CB 3.43Å; S87-D108 PolarHBondContact OG-OD2 2.79Å
88	K	97.1	Very high	95.3	Very high	94 Å²	94	46.1 Å²	46.1	41%	0.409	26%	0.264	S	S	.	.	S	Bend	trans	-138.4	-167.4	-177.3	-63.7	-173.9	-178.7	178.7	0	111.4	Q65 I90 E107 D108	Q65-K88 PolarHBondContact N-O 3.42Å; K88-I90 PolarHBondContact O-N 3.38Å; K88-E107 HydrophobicContact CB-CB 3.83Å; K88-E107 HydrophobicContact CD-CB 4.01Å; K88-E107 WeakPolarHBondContact CD-O 3.4Å; K88-D108 HydrophobicContact CB-CB 4.3Å; K88-D108 HydrophobicContact CD-CB 4.27Å; K88-D108 HydrophobicContact CG-CB 4.29Å
89	N	97.9	Very high	95.3	Very high	20 Å²	20	42.6 Å²	42.6	11%	0.107	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-60.4	135.5	175.1	-69.8	-66.7	0	0	0	111.4	Q46 N48 G106 E107	Q46-N89 PolarHBondContact NE2-OD1 3.21Å; N48-N89 PolarHBondContact ND2-OD1 3.46Å; N89-G106 CarbonylContact O-C 3.55Å; N89-G106 VanDerWaalsContact O-CA 3.26Å; N89-G106 WeakPolarHBondContact O-CA 3.33Å; N89-E107 HydrophobicContact CB-CB 4.45Å; N89-E107 HydrophobicContact CB-CG 3.99Å; N89-E107 WeakPolarHBondContact CB-OE2 3.39Å; N89-E107 VanDerWaalsContact ND2-CD 3.31Å; N89-E107 PolarHBondContact ND2-OE1 3.07Å; N89-E107 PolarHBondContact ND2-OE2 2.63Å; N89-E107 PolarHBondContact O-N 3.36Å
90	I	98.4	Very high	95.3	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	119.7	157.8	-58.4	100.1	0	0	0	106.5	N48 A62 G63 I67 V86 K88 T104 G105	N48-I90 WeakPolarHBondContact CB-O 3.46Å; N48-I90 PolarHBondContact ND2-O 2.78Å; A62-I90 HydrophobicContact CB-CB 3.99Å; A62-I90 HydrophobicContact CB-CG2 3.69Å; G63-I90 WeakPolarHBondContact O-CD1 3.38Å; G63-I90 PolarHBondContact O-N 3.15Å; I67-I90 HydrophobicContact CD1-CD1 4.41Å; I67-I90 HydrophobicContact CD1-CG1 4.24Å; I67-I90 HydrophobicContact CG1-CB 4.5Å; I67-I90 HydrophobicContact CG1-CD1 4.14Å; I67-I90 HydrophobicContact CG1-CG1 4.17Å; I67-I90 HydrophobicContact CG1-CG2 4.28Å; V86-I90 HydrophobicContact CB-CD1 4.1Å; V86-I90 HydrophobicContact CB-CG1 4.4Å; V86-I90 HydrophobicContact CG1-CD1 4.12Å; V86-I90 HydrophobicContact CG1-CG1 4.04Å; V86-I90 HydrophobicContact CG2-CD1 4.39Å; V86-I90 HydrophobicContact CG2-CG1 4.44Å; K88-I90 PolarHBondContact O-N 3.38Å; I90-T104 HydrophobicContact CG2-CG2 4.17Å; I90-G105 CarbonylContact C-O 3.59Å; I90-G105 WeakPolarHBondContact CA-O 3.27Å; I90-G105 WeakPolarHBondContact CG2-O 3.15Å
91	T	98.2	Very high	95.4	Very high	24 Å²	24	45.6 Å²	45.6	15%	0.147	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-26.9	-171.6	51.4	0	0	0	0	112.4	G105 E107 I133 N134	T91-G105 PolarHBondContact N-O 2.57Å; T91-G105 PolarHBondContact OG1-O 3.27Å; T91-E107 HydrophobicContact CG2-CG 3.83Å; T91-I133 WeakPolarHBondContact CB-O 3.24Å; T91-I133 WeakPolarHBondContact CG2-O 3.48Å; T91-I133 PolarHBondContact OG1-O 2.72Å; T91-N134 WeakPolarHBondContact CB-O 3.46Å; T91-N134 PolarHBondContact OG1-O 2.92Å
92	S	97.9	Very high	95.5	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.028	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	143.8	-178.3	174.9	0	0	0	0	110.4	T104 G105 V136	S92-T104 CarbonylContact O-C 3.53Å; S92-T104 VanDerWaalsContact O-CA 3.24Å; S92-T104 WeakPolarHBondContact O-CA 3.41Å; S92-G105 PolarHBondContact O-N 2.8Å; S92-V136 VanDerWaalsContact OG-CG2 3.31Å; S92-V136 WeakPolarHBondContact OG-CG2 3.37Å; S92-V136 PolarHBondContact OG-N 3.2Å; S92-V136 PolarHBondContact OG-O 3.47Å
93	V	98.5	Very high	95.6	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.7	174.6	60.8	0	0	0	0	108.7	E51 A60 A62 M102 Y103 T104	E51-V93 HydrophobicContact CB-CG1 4Å; A60-V93 HydrophobicContact CB-CG1 4.19Å; A60-V93 HydrophobicContact CB-CG2 4.09Å; A62-V93 HydrophobicContact CB-CB 4.18Å; A62-V93 HydrophobicContact CB-CG1 4.05Å; V93-M102 HydrophobicContact CG2-CG 3.67Å; V93-M102 HydrophobicContact CG2-SD 3.63Å; V93-Y103 CarbonylContact C-O 3.58Å; V93-Y103 WeakPolarHBondContact CA-O 3.25Å; V93-T104 HydrophobicContact CB-CG2 4.23Å; V93-T104 HydrophobicContact CG2-CG2 3.99Å
94	G	98.3	Very high	95.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	177.9	165.3	0	0	0	0	0	111.5	M102 Y103	G94-M102 WeakPolarHBondContact O-CA 3.5Å; G94-M102 WeakPolarHBondContact O-CG 3.41Å; G94-Y103 VanDerWaalsContact C-CZ 3.49Å; G94-Y103 PolarHBondContact N-O 2.77Å; G94-Y103 WeakPolarHBondContact O-CD1 3.17Å; G94-Y103 PolarHBondContact O-N 3.25Å
95	F	98.3	Very high	96.1	Very high	17 Å²	17	38.1 Å²	38.1	8%	0.075	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	145.9	-172.3	-64.3	-75.6	0	0	0	111.3	E51 T53 P54 A60 M69 M102 Y103 L116	E51-F95 HydrophobicContact CB-CD2 4.22Å; E51-F95 HydrophobicContact CB-CE2 3.94Å; E51-F95 HydrophobicContact CG-CD2 3.88Å; E51-F95 HydrophobicContact CG-CE2 4.12Å; T53-F95 HydrophobicContact CG2-CD1 4.38Å; T53-F95 HydrophobicContact CG2-CD2 4.36Å; T53-F95 HydrophobicContact CG2-CE1 3.89Å; T53-F95 HydrophobicContact CG2-CE2 3.87Å; T53-F95 HydrophobicContact CG2-CZ 3.6Å; P54-F95 HydrophobicContact CG-CB 3.91Å; A60-F95 HydrophobicContact CB-CE2 4.04Å; A60-F95 HydrophobicContact CB-CZ 3.69Å; M69-F95 HydrophobicContact CE-CE1 4.27Å; M69-F95 HydrophobicContact CE-CZ 3.96Å; M69-F95 HydrophobicContact SD-CZ 4.21Å; F95-M102 HydrophobicContact CD1-CB 3.83Å; F95-M102 HydrophobicContact CD1-CG 4.05Å; F95-M102 HydrophobicContact CE1-CB 3.77Å; F95-M102 HydrophobicContact CE1-CG 3.73Å; F95-M102 HydrophobicContact CE1-SD 3.89Å; F95-M102 HydrophobicContact CZ-CG 4.4Å; F95-M102 HydrophobicContact CZ-SD 4.23Å; F95-Y103 VanDerWaalsContact N-CE1 3.28Å; F95-L116 HydrophobicContact CD1-CD1 3.8Å; F95-L116 HydrophobicContact CE1-CD1 3.81Å
96	H	97.6	Very high	96.7	Very high	39 Å²	39	34.6 Å²	34.6	18%	0.181	17%	0.171	C	C	.	.			trans	-71.3	143.2	163.3	-177.1	-77.8	0	0	0	109.3	D98 G99 W101 L138 Q142	H96-D98 VanDerWaalsContact C-N 3.25Å; H96-D98 IonicContact CE1-OD1 3.58Å; H96-D98 PolarHBondContact CE1-OD1 3.41Å; H96-D98 IonicContact CE1-OD2 3.48Å; H96-D98 IonicContact CG-OD1 3.16Å; H96-D98 PolarHBondContact ND1-N 3.47Å; H96-D98 IonicContact ND1-OD1 2.65Å; H96-D98 PolarHBondContact ND1-OD1 3.41Å; H96-D98 IonicContact ND1-OD2 3.64Å; H96-D98 PolarHBondContact O-N 2.84Å; H96-G99 PolarHBondContact O-N 3.45Å; H96-W101 HydrophobicContact CB-CB 3.81Å; H96-W101 PolarHBondContact N-O 3.48Å; H96-L138 HydrophobicContact CB-CD2 4.32Å; H96-Q142 PolarHBondContact CD2-OE1 2.79Å; H96-Q142 WeakPolarHBondContact NE2-CB 3.35Å
97	E	94.7	Very high	97	Very high	141 Å²	141	37.1 Å²	37.1	66%	0.659	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.5	-171	-169.5	-179.4	175.7	0	0	113.6	P54 G99	P54-E97 WeakPolarHBondContact CB-O 3.46Å; E97-G99 PolarHBondContact O-N 2.84Å; E97-G99 VanDerWaalsContact O-N 3.17Å
98	D	94.1	Very high	97.3	Very high	71 Å²	71	34.9 Å²	34.9	38%	0.38	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-3.3	176.3	81.3	-10.9	0	0	0	114.9	H96 R100	H96-D98 VanDerWaalsContact C-N 3.25Å; H96-D98 IonicContact CE1-OD1 3.58Å; H96-D98 PolarHBondContact CE1-OD1 3.41Å; H96-D98 IonicContact CE1-OD2 3.48Å; H96-D98 IonicContact CG-OD1 3.16Å; H96-D98 PolarHBondContact ND1-N 3.47Å; H96-D98 IonicContact ND1-OD1 2.65Å; H96-D98 PolarHBondContact ND1-OD1 3.41Å; H96-D98 IonicContact ND1-OD2 3.64Å; H96-D98 PolarHBondContact O-N 2.84Å; D98-R100 HydrophobicContact CB-CG 4.49Å; D98-R100 PolarHBondContact O-N 3.44Å; D98-R100 WeakPolarHBondContact OD1-CB 3.36Å; D98-R100 WeakPolarHBondContact OD1-CG 3.4Å; D98-R100 PolarHBondContact OD1-N 2.92Å; D98-R100 WeakPolarHBondContact OD2-CD 3.48Å; D98-R100 WeakPolarHBondContact OD2-CG 3.4Å; D98-R100 IonicContact OD2-CZ 3.29Å; D98-R100 IonicContact OD2-NE 3.21Å; D98-R100 IonicContact OD2-NH1 2.77Å
99	G	93.4	Very high	97.4	Very high	24 Å²	24	31.5 Å²	31.5	25%	0.247	15%	0.153	C	C	.	.	S	Bend	trans	70.4	11.8	178.4	0	0	0	0	0	115	H96 E97 L116	H96-G99 PolarHBondContact O-N 3.45Å; E97-G99 PolarHBondContact O-N 2.84Å; E97-G99 VanDerWaalsContact O-N 3.17Å; G99-L116 WeakPolarHBondContact O-CD1 3.44Å
100	R	94.5	Very high	97.4	Very high	126 Å²	126	32.6 Å²	32.6	48%	0.475	16%	0.158	S	C	.	.	S	Bend	trans	-91.5	-28.9	-178.9	-59.2	-174.6	-174.5	158	-2.2	113.3	D98 L116	D98-R100 HydrophobicContact CB-CG 4.49Å; D98-R100 PolarHBondContact O-N 3.44Å; D98-R100 WeakPolarHBondContact OD1-CB 3.36Å; D98-R100 WeakPolarHBondContact OD1-CG 3.4Å; D98-R100 PolarHBondContact OD1-N 2.92Å; D98-R100 WeakPolarHBondContact OD2-CD 3.48Å; D98-R100 WeakPolarHBondContact OD2-CG 3.4Å; D98-R100 IonicContact OD2-CZ 3.29Å; D98-R100 IonicContact OD2-NE 3.21Å; D98-R100 IonicContact OD2-NH1 2.77Å; R100-L116 PolarHBondContact O-N 3.05Å
101	W	96.8	Very high	97.4	Very high	64 Å²	64	32.6 Å²	32.6	24%	0.242	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.9	-174.1	-55.6	102.4	0	0	0	111.2	H96 I113 W114 D115 Q124	H96-W101 HydrophobicContact CB-CB 3.81Å; H96-W101 PolarHBondContact N-O 3.48Å; W101-I113 HydrophobicContact CB-CG2 4.43Å; W101-I113 HydrophobicContact CD2-CG2 4.29Å; W101-I113 HydrophobicContact CE3-CG2 3.64Å; W101-I113 HydrophobicContact CZ3-CG2 4.3Å; W101-W114 WeakPolarHBondContact CA-O 3.4Å; W101-D115 HydrophobicContact CE3-CB 4.08Å; W101-D115 HydrophobicContact CH2-CB 4.01Å; W101-D115 HydrophobicContact CZ3-CB 3.48Å; W101-D115 VanDerWaalsContact CZ3-CB 3.48Å; W101-Q124 HydrophobicContact CZ3-CB 4.41Å
102	M	98.2	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.8	166.4	178	-179.7	69.5	0	0	108.4	I67 Y83 V93 G94 F95 T104 I113 W114 L116	I67-M102 HydrophobicContact CD1-CE 4.08Å; I67-M102 HydrophobicContact CG2-CE 4.29Å; I67-M102 HydrophobicContact CG2-SD 4.1Å; Y83-M102 HydrophobicContact CD2-CE 3.95Å; Y83-M102 HydrophobicContact CE2-CE 4.04Å; Y83-M102 HydrophobicContact CG-CE 4.22Å; V93-M102 HydrophobicContact CG2-CG 3.67Å; V93-M102 HydrophobicContact CG2-SD 3.63Å; G94-M102 WeakPolarHBondContact O-CA 3.5Å; G94-M102 WeakPolarHBondContact O-CG 3.41Å; F95-M102 HydrophobicContact CD1-CB 3.83Å; F95-M102 HydrophobicContact CD1-CG 4.05Å; F95-M102 HydrophobicContact CE1-CB 3.77Å; F95-M102 HydrophobicContact CE1-CG 3.73Å; F95-M102 HydrophobicContact CE1-SD 3.89Å; F95-M102 HydrophobicContact CZ-CG 4.4Å; F95-M102 HydrophobicContact CZ-SD 4.23Å; M102-T104 HydrophobicContact CE-CG2 4.28Å; M102-T104 HydrophobicContact CG-CG2 4.32Å; M102-T104 HydrophobicContact SD-CG2 4.48Å; M102-I113 CarbonylContact O-C 3.35Å; M102-I113 WeakPolarHBondContact O-CA 3.43Å; M102-W114 HydrophobicContact CB-CB 4.25Å; M102-W114 HydrophobicContact CE-CB 3.88Å; M102-W114 HydrophobicContact CE-CD2 4Å; M102-W114 HydrophobicContact CE-CG 3.53Å; M102-W114 PolarHBondContact N-O 3.15Å; M102-W114 PolarHBondContact O-N 3.21Å; M102-L116 HydrophobicContact CB-CD1 4.31Å; M102-L116 HydrophobicContact CB-CD2 3.88Å; M102-L116 HydrophobicContact CB-CG 4.2Å
103	Y	98.5	Very high	97.4	Very high	25 Å²	25	32.5 Å²	32.5	10%	0.098	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	146	172.7	58.3	-95.6	0	0	0	110.4	V93 G94 F95 R112 V136 L138 L145	V93-Y103 CarbonylContact C-O 3.58Å; V93-Y103 WeakPolarHBondContact CA-O 3.25Å; G94-Y103 VanDerWaalsContact C-CZ 3.49Å; G94-Y103 PolarHBondContact N-O 2.77Å; G94-Y103 WeakPolarHBondContact O-CD1 3.17Å; G94-Y103 PolarHBondContact O-N 3.25Å; F95-Y103 VanDerWaalsContact N-CE1 3.28Å; Y103-R112 CarbonylContact C-O 3.58Å; Y103-R112 VanDerWaalsContact CA-O 3.27Å; Y103-R112 WeakPolarHBondContact CA-O 3.31Å; Y103-V136 HydrophobicContact CD2-CB 4.1Å; Y103-V136 HydrophobicContact CD2-CG2 3.59Å; Y103-V136 HydrophobicContact CE2-CB 4.38Å; Y103-V136 HydrophobicContact CE2-CG2 3.9Å; Y103-L138 HydrophobicContact CD1-CB 4.17Å; Y103-L138 HydrophobicContact CD1-CD2 4.36Å; Y103-L138 HydrophobicContact CE1-CB 3.42Å; Y103-L138 VanDerWaalsContact CE1-CB 3.42Å; Y103-L138 HydrophobicContact CE1-CD2 3.87Å; Y103-L138 HydrophobicContact CE1-CG 4.18Å; Y103-L138 HydrophobicContact CE2-CB 4.46Å; Y103-L145 HydrophobicContact CD1-CD1 4.28Å; Y103-L145 HydrophobicContact CD2-CD1 3.61Å; Y103-L145 HydrophobicContact CE2-CD1 4.03Å; Y103-L145 HydrophobicContact CG-CD1 3.74Å
104	T	98.6	Very high	97.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	146.3	-178.5	61.4	0	0	0	0	112	I67 I90 S92 V93 M102 A111 R112 W114	I67-T104 HydrophobicContact CD1-CG2 3.81Å; I67-T104 HydrophobicContact CG1-CG2 4.39Å; I90-T104 HydrophobicContact CG2-CG2 4.17Å; S92-T104 CarbonylContact O-C 3.53Å; S92-T104 VanDerWaalsContact O-CA 3.24Å; S92-T104 WeakPolarHBondContact O-CA 3.41Å; V93-T104 HydrophobicContact CB-CG2 4.23Å; V93-T104 HydrophobicContact CG2-CG2 3.99Å; M102-T104 HydrophobicContact CE-CG2 4.28Å; M102-T104 HydrophobicContact CG-CG2 4.32Å; M102-T104 HydrophobicContact SD-CG2 4.48Å; T104-A111 CarbonylContact O-C 3.58Å; T104-A111 VanDerWaalsContact O-CA 3.22Å; T104-A111 WeakPolarHBondContact O-CA 3.22Å; T104-R112 PolarHBondContact N-O 2.54Å; T104-R112 PolarHBondContact O-N 3.38Å; T104-W114 PolarHBondContact OG1-NE1 3.42Å
105	G	98.4	Very high	97.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	147.5	167	0	0	0	0	0	111.3	I90 T91 S92	I90-G105 CarbonylContact C-O 3.59Å; I90-G105 WeakPolarHBondContact CA-O 3.27Å; I90-G105 WeakPolarHBondContact CG2-O 3.15Å; T91-G105 PolarHBondContact N-O 2.57Å; T91-G105 PolarHBondContact OG1-O 3.27Å; S92-G105 PolarHBondContact O-N 2.8Å
106	G	98.1	Very high	97	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	159.5	-178.1	0	0	0	0	0	115	N89 D108 C109 M110 I133	N89-G106 CarbonylContact O-C 3.55Å; N89-G106 VanDerWaalsContact O-CA 3.26Å; N89-G106 WeakPolarHBondContact O-CA 3.33Å; G106-D108 PolarHBondContact O-N 3.33Å; G106-D108 VanDerWaalsContact O-N 3.16Å; G106-C109 PolarHBondContact O-N 3.22Å; G106-M110 PolarHBondContact N-O 2.68Å; G106-I133 WeakPolarHBondContact O-CB 3.06Å; G106-I133 PolarHBondContact O-N 3.46Å; G106-I133 VanDerWaalsContact O-N 3.08Å
107	E	98.5	Very high	96.8	Very high	59 Å²	59	40 Å²	40	28%	0.276	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-7.5	175.3	-77.3	-179.8	178.1	0	0	113.8	K88 N89 T91 C109 P132	K88-E107 HydrophobicContact CB-CB 3.83Å; K88-E107 HydrophobicContact CD-CB 4.01Å; K88-E107 WeakPolarHBondContact CD-O 3.4Å; N89-E107 HydrophobicContact CB-CB 4.45Å; N89-E107 HydrophobicContact CB-CG 3.99Å; N89-E107 WeakPolarHBondContact CB-OE2 3.39Å; N89-E107 VanDerWaalsContact ND2-CD 3.31Å; N89-E107 PolarHBondContact ND2-OE1 3.07Å; N89-E107 PolarHBondContact ND2-OE2 2.63Å; N89-E107 PolarHBondContact O-N 3.36Å; T91-E107 HydrophobicContact CG2-CG 3.83Å; E107-C109 PolarHBondContact O-N 3.08Å; E107-P132 HydrophobicContact CB-CB 4.43Å
108	D	97.8	Very high	96.6	Very high	19 Å²	19	35.4 Å²	35.4	10%	0.102	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	18.6	172.7	63.4	-4	0	0	0	113.3	V86 S87 K88 G106 M110 R112	V86-D108 WeakPolarHBondContact CG1-OD2 3.39Å; S87-D108 WeakPolarHBondContact OG-CB 3.43Å; S87-D108 PolarHBondContact OG-OD2 2.79Å; K88-D108 HydrophobicContact CB-CB 4.3Å; K88-D108 HydrophobicContact CD-CB 4.27Å; K88-D108 HydrophobicContact CG-CB 4.29Å; G106-D108 PolarHBondContact O-N 3.33Å; G106-D108 VanDerWaalsContact O-N 3.16Å; D108-M110 VanDerWaalsContact C-N 3.26Å; D108-M110 PolarHBondContact O-N 2.89Å; D108-R112 VanDerWaalsContact CG-NH2 3.35Å; D108-R112 IonicContact OD1-CZ 3.67Å; D108-R112 IonicContact OD1-NH1 3.52Å; D108-R112 PolarHBondContact OD1-NH1 3.05Å; D108-R112 IonicContact OD1-NH2 2.83Å; D108-R112 PolarHBondContact OD1-NH2 3.33Å; D108-R112 IonicContact OD2-CZ 3.06Å; D108-R112 IonicContact OD2-NH1 3.59Å; D108-R112 PolarHBondContact OD2-NH1 3.15Å; D108-R112 IonicContact OD2-NH2 3.81Å; D108-R112 PolarHBondContact OD2-NH2 2.74Å
109	C	98.3	Very high	96.2	Very high	24 Å²	24	43.8 Å²	43.8	16%	0.162	20%	0.195	C	C	.	.	S	Bend	trans	65.1	26.4	173.9	-43	0	0	0	0	113.4	G106 E107 V129 A131	G106-C109 PolarHBondContact O-N 3.22Å; E107-C109 PolarHBondContact O-N 3.08Å; C109-V129 HydrophobicContact CB-CG2 4.15Å; C109-V129 VanDerWaalsContact CB-O 3.24Å; C109-V129 WeakPolarHBondContact CB-O 3.21Å; C109-V129 WeakPolarHBondContact O-CG2 3.27Å; C109-V129 PolarHBondContact O-N 2.88Å; C109-A131 WeakPolarHBondContact CB-O 3.31Å
110	M	98.3	Very high	96	Very high	43 Å²	43	47.6 Å²	47.6	21%	0.212	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.5	-177.3	-69.8	-177.8	-173.9	0	0	111.7	G106 D108 R112 I126 F127 Q128	G106-M110 PolarHBondContact N-O 2.68Å; D108-M110 VanDerWaalsContact C-N 3.26Å; D108-M110 PolarHBondContact O-N 2.89Å; M110-R112 HydrophobicContact CB-CG 4.46Å; M110-R112 PolarHBondContact O-NH1 3.31Å; M110-R112 PolarHBondContact SD-NH2 3.32Å; M110-I126 HydrophobicContact CB-CG2 4.1Å; M110-I126 HydrophobicContact CG-CG2 3.87Å; M110-I126 HydrophobicContact SD-CD1 4.48Å; M110-I126 HydrophobicContact SD-CG2 3.83Å; M110-F127 WeakPolarHBondContact CA-O 3.31Å; M110-Q128 HydrophobicContact CG-CB 4.49Å; M110-Q128 HydrophobicContact CG-CG 4.38Å
111	A	98.4	Very high	95.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	139.3	160.3	0	0	0	0	0	108.5	T104 I126 F127 I133 V136 L145 V147	T104-A111 CarbonylContact O-C 3.58Å; T104-A111 VanDerWaalsContact O-CA 3.22Å; T104-A111 WeakPolarHBondContact O-CA 3.22Å; A111-I126 WeakPolarHBondContact O-CA 3.42Å; A111-F127 HydrophobicContact CB-CB 4.27Å; A111-F127 HydrophobicContact CB-CD1 4.31Å; A111-F127 PolarHBondContact N-O 2.74Å; A111-F127 PolarHBondContact O-N 3.44Å; A111-I133 HydrophobicContact CB-CD1 3.95Å; A111-V136 HydrophobicContact CB-CG1 4.45Å; A111-L145 HydrophobicContact CB-CD2 4.42Å; A111-V147 HydrophobicContact CB-CG1 4.4Å; A111-V147 HydrophobicContact CB-CG2 4.03Å
112	R	98.1	Very high	95.5	Very high	13 Å²	13	47 Å²	47	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.2	-173.5	-58.7	177.8	173.4	83.4	-4.3	111.3	Y103 T104 D108 M110 W114 C123 R125 I126	Y103-R112 CarbonylContact C-O 3.58Å; Y103-R112 VanDerWaalsContact CA-O 3.27Å; Y103-R112 WeakPolarHBondContact CA-O 3.31Å; T104-R112 PolarHBondContact N-O 2.54Å; T104-R112 PolarHBondContact O-N 3.38Å; D108-R112 VanDerWaalsContact CG-NH2 3.35Å; D108-R112 IonicContact OD1-CZ 3.67Å; D108-R112 IonicContact OD1-NH1 3.52Å; D108-R112 PolarHBondContact OD1-NH1 3.05Å; D108-R112 IonicContact OD1-NH2 2.83Å; D108-R112 PolarHBondContact OD1-NH2 3.33Å; D108-R112 IonicContact OD2-CZ 3.06Å; D108-R112 IonicContact OD2-NH1 3.59Å; D108-R112 PolarHBondContact OD2-NH1 3.15Å; D108-R112 IonicContact OD2-NH2 3.81Å; D108-R112 PolarHBondContact OD2-NH2 2.74Å; M110-R112 HydrophobicContact CB-CG 4.46Å; M110-R112 PolarHBondContact O-NH1 3.31Å; M110-R112 PolarHBondContact SD-NH2 3.32Å; R112-W114 HydrophobicContact CB-CZ2 4.19Å; R112-C123 HydrophobicContact CB-CB 4.08Å; R112-C123 HydrophobicContact CG-CB 4.41Å; R112-R125 WeakPolarHBondContact CA-O 3.06Å; R112-I126 HydrophobicContact CG-CG1 4.4Å
113	I	97.9	Very high	95.2	Very high	13 Å²	13	48.5 Å²	48.5	7%	0.067	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.8	170.9	-52.7	-62.6	0	0	0	109.1	W101 M102 C123 Q124 R125 L145 W157 L159	W101-I113 HydrophobicContact CB-CG2 4.43Å; W101-I113 HydrophobicContact CD2-CG2 4.29Å; W101-I113 HydrophobicContact CE3-CG2 3.64Å; W101-I113 HydrophobicContact CZ3-CG2 4.3Å; M102-I113 CarbonylContact O-C 3.35Å; M102-I113 WeakPolarHBondContact O-CA 3.43Å; I113-C123 CarbonylContact O-C 3.56Å; I113-Q124 PolarHBondContact O-N 3.05Å; I113-R125 HydrophobicContact CB-CB 4.16Å; I113-R125 HydrophobicContact CG1-CB 4.24Å; I113-R125 PolarHBondContact N-O 3.13Å; I113-R125 PolarHBondContact O-N 2.55Å; I113-L145 HydrophobicContact CD1-CD2 4.32Å; I113-W157 HydrophobicContact CD1-CH2 4.36Å; I113-W157 HydrophobicContact CD1-CZ3 3.97Å; I113-W157 HydrophobicContact CG1-CH2 3.67Å; I113-W157 HydrophobicContact CG1-CZ3 3.77Å; I113-L159 HydrophobicContact CD1-CD2 4.11Å; I113-L159 HydrophobicContact CG1-CD2 4.32Å
114	W	97.3	Very high	94.9	Very high	5 Å²	5	52.6 Å²	52.6	2%	0.019	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.8	-176.2	-46.6	80.4	0	0	0	109.8	I67 Y83 V86 W101 M102 T104 R112 L121 C123	I67-W114 HydrophobicContact CD1-CH2 4.37Å; I67-W114 HydrophobicContact CD1-CZ2 3.79Å; Y83-W114 HydrophobicContact CD1-CD2 4.3Å; Y83-W114 AromaticContact CD1-CE3 3.59Å; Y83-W114 HydrophobicContact CD1-CE3 3.59Å; Y83-W114 AromaticContact CD1-CZ3 3.99Å; Y83-W114 HydrophobicContact CD1-CZ3 3.99Å; Y83-W114 HydrophobicContact CE1-CE3 4.27Å; Y83-W114 HydrophobicContact CG-CE3 4.29Å; Y83-W114 HydrophobicContact CG-CZ3 4.46Å; V86-W114 HydrophobicContact CG2-CH2 3.87Å; V86-W114 HydrophobicContact CG2-CZ2 4.03Å; W101-W114 WeakPolarHBondContact CA-O 3.4Å; M102-W114 HydrophobicContact CB-CB 4.25Å; M102-W114 HydrophobicContact CE-CB 3.88Å; M102-W114 HydrophobicContact CE-CD2 4Å; M102-W114 HydrophobicContact CE-CG 3.53Å; M102-W114 PolarHBondContact N-O 3.15Å; M102-W114 PolarHBondContact O-N 3.21Å; T104-W114 PolarHBondContact OG1-NE1 3.42Å; R112-W114 HydrophobicContact CB-CZ2 4.19Å; W114-L121 VanDerWaalsContact CZ3-O 3.29Å; W114-L121 WeakPolarHBondContact CZ3-O 3.23Å; W114-C123 HydrophobicContact CD2-CB 4.02Å; W114-C123 HydrophobicContact CE3-CB 3.88Å; W114-C123 HydrophobicContact CH2-CB 4.25Å; W114-C123 HydrophobicContact CZ2-CB 4.36Å; W114-C123 HydrophobicContact CZ3-CB 4Å
115	D	95.6	Very high	94.8	Very high	23 Å²	23	55.6 Å²	55.6	12%	0.123	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	114.2	171.9	-167.6	-22.4	0	0	0	109.5	W101 R117 S118	W101-D115 HydrophobicContact CE3-CB 4.08Å; W101-D115 HydrophobicContact CH2-CB 4.01Å; W101-D115 HydrophobicContact CZ3-CB 3.48Å; W101-D115 VanDerWaalsContact CZ3-CB 3.48Å; D115-R117 PolarHBondContact O-N 3.08Å; D115-R117 WeakPolarHBondContact OD1-CB 3.31Å; D115-R117 IonicContact OD1-CZ 3.32Å; D115-R117 PolarHBondContact OD1-N 2.84Å; D115-R117 IonicContact OD1-NE 3.94Å; D115-R117 PolarHBondContact OD1-NE 3.02Å; D115-R117 IonicContact OD1-NH2 3.31Å; D115-R117 PolarHBondContact OD1-NH2 2.88Å; D115-R117 IonicContact OD2-CZ 2.74Å; D115-R117 IonicContact OD2-NE 2.9Å; D115-R117 IonicContact OD2-NH2 3.95Å; D115-R117 PolarHBondContact OD2-NH2 2.88Å; D115-S118 PolarHBondContact O-N 2.9Å
116	L	93.9	Very high	94.7	Very high	39 Å²	39	59.7 Å²	59.7	20%	0.204	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.6	-178.7	-62.7	178.3	0	0	0	113.1	Y83 F95 G99 R100 M102	Y83-L116 HydrophobicContact CE2-CD2 4.38Å; Y83-L116 WeakPolarHBondContact OH-CD2 3.47Å; F95-L116 HydrophobicContact CD1-CD1 3.8Å; F95-L116 HydrophobicContact CE1-CD1 3.81Å; G99-L116 WeakPolarHBondContact O-CD1 3.44Å; R100-L116 PolarHBondContact O-N 3.05Å; M102-L116 HydrophobicContact CB-CD1 4.31Å; M102-L116 HydrophobicContact CB-CD2 3.88Å; M102-L116 HydrophobicContact CB-CG 4.2Å
117	R	92.6	Very high	94.7	Very high	151 Å²	151	61 Å²	61	57%	0.57	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-19.3	179.1	-51.8	165.1	-62.8	152.7	8.8	111.9	D115	D115-R117 PolarHBondContact O-N 3.08Å; D115-R117 WeakPolarHBondContact OD1-CB 3.31Å; D115-R117 IonicContact OD1-CZ 3.32Å; D115-R117 PolarHBondContact OD1-N 2.84Å; D115-R117 IonicContact OD1-NE 3.94Å; D115-R117 PolarHBondContact OD1-NE 3.02Å; D115-R117 IonicContact OD1-NH2 3.31Å; D115-R117 PolarHBondContact OD1-NH2 2.88Å; D115-R117 IonicContact OD2-CZ 2.74Å; D115-R117 IonicContact OD2-NE 2.9Å; D115-R117 IonicContact OD2-NH2 3.95Å; D115-R117 PolarHBondContact OD2-NH2 2.88Å
118	S	91.2	Very high	94.7	Very high	45 Å²	45	64.6 Å²	64.6	32%	0.315	30%	0.301	S	S	.	.			trans	-73.8	136.5	179.7	175	0	0	0	0	110.5	D115 N120	D115-S118 PolarHBondContact O-N 2.9Å; S118-N120 VanDerWaalsContact C-N 3.27Å; S118-N120 PolarHBondContact OG-N 3.22Å; S118-N120 PolarHBondContact OG-O 3.02Å
119	R	86.6	Confident	94.7	Very high	247 Å²	247	64 Å²	64	93%	0.932	30%	0.298	S	S	*	.	S	Bend	trans	-74.2	-21.9	168.5	-66.4	-173.6	179.5	-171.6	-0.5	112.5	L121	R119-L121 PolarHBondContact O-N 2.94Å
120	N	88.3	Confident	94.6	Very high	103 Å²	103	70.8 Å²	70.8	55%	0.551	33%	0.333	S	S	*	.	S	Bend	trans	-82.7	110.5	173.1	-174.5	6.7	0	0	0	108.2	S118 Q122	S118-N120 VanDerWaalsContact C-N 3.27Å; S118-N120 PolarHBondContact OG-N 3.22Å; S118-N120 PolarHBondContact OG-O 3.02Å; N120-Q122 PolarHBondContact O-N 2.89Å; N120-Q122 WeakPolarHBondContact OD1-CG 3.41Å; N120-Q122 PolarHBondContact OD1-N 2.76Å
121	L	89.2	Confident	94.6	Very high	56 Å²	56	69.3 Å²	69.3	29%	0.293	33%	0.328	S	S	.	.			trans	-80.4	14.6	-176	-55.1	-178.4	0	0	0	113.2	I81 N82 Y83 W114 R119	I81-L121 HydrophobicContact CG2-CD1 4.06Å; I81-L121 HydrophobicContact CG2-CD2 3.87Å; N82-L121 WeakPolarHBondContact O-CD1 3.41Å; Y83-L121 HydrophobicContact CD1-CB 3.82Å; Y83-L121 HydrophobicContact CD1-CD2 4.12Å; Y83-L121 HydrophobicContact CD1-CG 4.43Å; Y83-L121 HydrophobicContact CE1-CB 4.06Å; Y83-L121 HydrophobicContact CE1-CD2 3.57Å; Y83-L121 HydrophobicContact CE1-CG 4.34Å; W114-L121 VanDerWaalsContact CZ3-O 3.29Å; W114-L121 WeakPolarHBondContact CZ3-O 3.23Å; R119-L121 PolarHBondContact O-N 2.94Å
122	Q	91.1	Very high	94.6	Very high	123 Å²	123	70.9 Å²	70.9	58%	0.575	34%	0.338	S	S	*	.	S	Bend	trans	-73.3	144.7	171.8	-65.3	-65.3	-45	0	0	110.3	N120	N120-Q122 PolarHBondContact O-N 2.89Å; N120-Q122 WeakPolarHBondContact OD1-CG 3.41Å; N120-Q122 PolarHBondContact OD1-N 2.76Å
123	C	92.8	Very high	94.6	Very high	31 Å²	31	70.2 Å²	70.2	21%	0.209	34%	0.335	C	S	.	.			trans	-65.4	140.4	174.1	61.8	0	0	0	0	110.6	R112 I113 W114	R112-C123 HydrophobicContact CB-CB 4.08Å; R112-C123 HydrophobicContact CG-CB 4.41Å; I113-C123 CarbonylContact O-C 3.56Å; W114-C123 HydrophobicContact CD2-CB 4.02Å; W114-C123 HydrophobicContact CE3-CB 3.88Å; W114-C123 HydrophobicContact CH2-CB 4.25Å; W114-C123 HydrophobicContact CZ2-CB 4.36Å; W114-C123 HydrophobicContact CZ3-CB 4Å
124	Q	92.6	Very high	94.7	Very high	111 Å²	111	71.1 Å²	71.1	52%	0.519	34%	0.34	S	S	.	.	S	Bend	trans	-83.7	-37.2	-178.5	-174.6	174.6	-46.6	0	0	112.3	W101 I113	W101-Q124 HydrophobicContact CZ3-CB 4.41Å; I113-Q124 PolarHBondContact O-N 3.05Å
125	R	95.5	Very high	94.7	Very high	63 Å²	63	71 Å²	71	24%	0.238	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147	-179.5	-63.1	174	71	-174.7	10.9	110.4	R112 I113 W157 L159 D162	R112-R125 WeakPolarHBondContact CA-O 3.06Å; I113-R125 HydrophobicContact CB-CB 4.16Å; I113-R125 HydrophobicContact CG1-CB 4.24Å; I113-R125 PolarHBondContact N-O 3.13Å; I113-R125 PolarHBondContact O-N 2.55Å; R125-W157 HydrophobicContact CB-CH2 4.01Å; R125-W157 HydrophobicContact CB-CZ2 4.35Å; R125-L159 VanDerWaalsContact CZ-O 3.25Å; R125-L159 PolarHBondContact NH1-O 2.84Å; R125-L159 PolarHBondContact NH2-O 3.22Å; R125-D162 IonicContact CZ-OD1 2.89Å; R125-D162 IonicContact NE-OD1 3.42Å; R125-D162 IonicContact NH2-OD1 3.65Å; R125-D162 PolarHBondContact NH2-OD1 2.9Å; R125-D162 IonicContact NH2-OD2 3.7Å; R125-D162 PolarHBondContact NH2-OD2 3.3Å; R125-D162 VanDerWaalsContact NH2-OD2 3.16Å
126	I	97	Very high	94.9	Very high	85 Å²	85	70.4 Å²	70.4	44%	0.436	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	129.8	178.5	-60.5	176.6	0	0	0	107.5	M110 A111 R112	M110-I126 HydrophobicContact CB-CG2 4.1Å; M110-I126 HydrophobicContact CG-CG2 3.87Å; M110-I126 HydrophobicContact SD-CD1 4.48Å; M110-I126 HydrophobicContact SD-CG2 3.83Å; A111-I126 WeakPolarHBondContact O-CA 3.42Å; R112-I126 HydrophobicContact CG-CG1 4.4Å
127	F	97.9	Very high	95.1	Very high	27 Å²	27	69 Å²	69	12%	0.118	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	113	166.5	175.3	-108.5	0	0	0	108	M110 A111 V129 H155 W157 N164	M110-F127 WeakPolarHBondContact CA-O 3.31Å; A111-F127 HydrophobicContact CB-CB 4.27Å; A111-F127 HydrophobicContact CB-CD1 4.31Å; A111-F127 PolarHBondContact N-O 2.74Å; A111-F127 PolarHBondContact O-N 3.44Å; F127-V129 HydrophobicContact CD1-CG1 3.98Å; F127-V129 HydrophobicContact CE1-CG1 3.32Å; F127-V129 HydrophobicContact CZ-CG1 3.83Å; F127-H155 HydrophobicContact CE1-CB 3.82Å; F127-H155 AromaticContact CE1-CG 3.91Å; F127-H155 AromaticContact CE1-ND1 3.86Å; F127-H155 HydrophobicContact CZ-CB 4.16Å; F127-H155 AromaticContact CZ-ND1 3.6Å; F127-W157 HydrophobicContact CB-CD2 3.69Å; F127-W157 HydrophobicContact CB-CE3 3.6Å; F127-W157 HydrophobicContact CB-CG 4.36Å; F127-W157 HydrophobicContact CB-CH2 3.92Å; F127-W157 HydrophobicContact CB-CZ2 4Å; F127-W157 HydrophobicContact CB-CZ3 3.72Å; F127-W157 HydrophobicContact CD1-CB 4.46Å; F127-W157 HydrophobicContact CD2-CD2 4.24Å; F127-W157 HydrophobicContact CD2-CG 4.08Å; F127-W157 HydrophobicContact CG-CB 4.46Å; F127-W157 AromaticContact CG-CD2 3.9Å; F127-W157 HydrophobicContact CG-CD2 3.9Å; F127-W157 HydrophobicContact CG-CE3 4.11Å; F127-W157 HydrophobicContact CG-CG 4.06Å; F127-N164 HydrophobicContact CE2-CB 3.66Å; F127-N164 HydrophobicContact CZ-CB 3.9Å; F127-N164 VanDerWaalsContact CZ-CG 3.43Å; F127-N164 WeakPolarHBondContact CZ-OD1 3.48Å
128	Q	98.1	Very high	95.3	Very high	136 Å²	136	62.7 Å²	62.7	64%	0.636	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.6	-174.9	-175.3	174.8	1.4	0	0	110.9	M110	M110-Q128 HydrophobicContact CG-CB 4.49Å; M110-Q128 HydrophobicContact CG-CG 4.38Å
129	V	97.8	Very high	95.6	Very high	6 Å²	6	60.7 Å²	60.7	4%	0.036	29%	0.294	C	S	.	.			trans	-120.3	177.6	176.4	-60.9	0	0	0	0	110.7	C109 F127 A131 I133 H155	C109-V129 HydrophobicContact CB-CG2 4.15Å; C109-V129 VanDerWaalsContact CB-O 3.24Å; C109-V129 WeakPolarHBondContact CB-O 3.21Å; C109-V129 WeakPolarHBondContact O-CG2 3.27Å; C109-V129 PolarHBondContact O-N 2.88Å; F127-V129 HydrophobicContact CD1-CG1 3.98Å; F127-V129 HydrophobicContact CE1-CG1 3.32Å; F127-V129 HydrophobicContact CZ-CG1 3.83Å; V129-A131 WeakPolarHBondContact CG2-O 3.49Å; V129-I133 HydrophobicContact CG2-CD1 3.91Å; V129-I133 HydrophobicContact CG2-CG1 3.64Å; V129-H155 WeakPolarHBondContact CG1-NE2 3.36Å
130	N	96.8	Very high	96	Very high	166 Å²	166	51.1 Å²	51.1	89%	0.888	26%	0.264	S	S	*	.	S	Bend	trans	-93.7	-12.2	-173.5	-64.9	-30.4	0	0	0	114
131	A	98.1	Very high	96.2	Very high	13 Å²	13	48.7 Å²	48.7	11%	0.107	25%	0.251	C	S	.	.	S	Bend	trans	-130.3	157	-179.9	0	0	0	0	0	111.6	C109 V129 I133 D149	C109-A131 WeakPolarHBondContact CB-O 3.31Å; V129-A131 WeakPolarHBondContact CG2-O 3.49Å; A131-I133 PolarHBondContact O-N 3.07Å; A131-D149 HydrophobicContact CB-CB 4.26Å
132	P	98.6	Very high	96.5	Very high	32 Å²	32	48.2 Å²	48.2	21%	0.208	25%	0.247	C	C	.	.			trans	-56	138.1	176.7	-26.7	35.4	0	0	0	112	E107 D149 Q150	E107-P132 HydrophobicContact CB-CB 4.43Å; P132-D149 CarbonylContact O-C 3.58Å; P132-D149 WeakPolarHBondContact O-CA 3.29Å; P132-Q150 HydrophobicContact CB-CB 4.48Å; P132-Q150 HydrophobicContact CB-CG 4.07Å; P132-Q150 WeakPolarHBondContact O-CG 3.29Å; P132-Q150 PolarHBondContact O-N 2.55Å
133	I	98.7	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.9	-178.9	-61.3	169.7	0	0	0	108.9	T91 G106 A111 V129 A131 C135 V136 V147	T91-I133 WeakPolarHBondContact CB-O 3.24Å; T91-I133 WeakPolarHBondContact CG2-O 3.48Å; T91-I133 PolarHBondContact OG1-O 2.72Å; G106-I133 WeakPolarHBondContact O-CB 3.06Å; G106-I133 PolarHBondContact O-N 3.46Å; G106-I133 VanDerWaalsContact O-N 3.08Å; A111-I133 HydrophobicContact CB-CD1 3.95Å; V129-I133 HydrophobicContact CG2-CD1 3.91Å; V129-I133 HydrophobicContact CG2-CG1 3.64Å; A131-I133 PolarHBondContact O-N 3.07Å; I133-C135 WeakPolarHBondContact CG2-O 3.34Å; I133-V136 HydrophobicContact CG2-CG1 4.04Å; I133-V147 HydrophobicContact CB-CG1 4.3Å; I133-V147 HydrophobicContact CD1-CG1 3.67Å; I133-V147 HydrophobicContact CG1-CG1 3.82Å; I133-V147 HydrophobicContact CG2-CG1 3.53Å
134	N	98.6	Very high	96.8	Very high	32 Å²	32	42 Å²	42	17%	0.171	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-29.7	177	-67.1	-36.4	0	0	0	112.8	T91 G148 Q150 S174 I175	T91-N134 WeakPolarHBondContact CB-O 3.46Å; T91-N134 PolarHBondContact OG1-O 2.92Å; N134-G148 PolarHBondContact N-O 2.92Å; N134-Q150 VanDerWaalsContact ND2-CG 3.29Å; N134-Q150 WeakPolarHBondContact ND2-CG 3.26Å; N134-Q150 VanDerWaalsContact OD1-CG 3.3Å; N134-Q150 WeakPolarHBondContact OD1-CG 3.44Å; N134-Q150 PolarHBondContact OD1-NE2 2.86Å; N134-S174 PolarHBondContact ND2-OG 2.98Å; N134-I175 VanDerWaalsContact CB-O 3.31Å; N134-I175 WeakPolarHBondContact CB-O 3.18Å; N134-I175 PolarHBondContact ND2-O 3.47Å
135	C	98.4	Very high	97	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	150.7	-175.2	62.5	0	0	0	0	112.5	I133 G148 S177 V178	I133-C135 WeakPolarHBondContact CG2-O 3.34Å; C135-G148 PolarHBondContact N-O 3.32Å; C135-G148 PolarHBondContact O-N 3.03Å; C135-S177 VanDerWaalsContact SG-CA 3.53Å; C135-V178 PolarHBondContact SG-N 3.27Å; C135-V178 VanDerWaalsContact SG-N 3.4Å
136	V	98.6	Very high	97.2	Very high	10 Å²	10	34 Å²	34	6%	0.061	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.9	170.5	-67.1	0	0	0	0	109.4	S92 Y103 A111 I133 L145 I146 V147	S92-V136 VanDerWaalsContact OG-CG2 3.31Å; S92-V136 WeakPolarHBondContact OG-CG2 3.37Å; S92-V136 PolarHBondContact OG-N 3.2Å; S92-V136 PolarHBondContact OG-O 3.47Å; Y103-V136 HydrophobicContact CD2-CB 4.1Å; Y103-V136 HydrophobicContact CD2-CG2 3.59Å; Y103-V136 HydrophobicContact CE2-CB 4.38Å; Y103-V136 HydrophobicContact CE2-CG2 3.9Å; A111-V136 HydrophobicContact CB-CG1 4.45Å; I133-V136 HydrophobicContact CG2-CG1 4.04Å; V136-L145 HydrophobicContact CB-CD1 4.43Å; V136-I146 CarbonylContact C-O 3.59Å; V136-I146 VanDerWaalsContact CA-O 3.29Å; V136-I146 WeakPolarHBondContact CA-O 3.41Å; V136-V147 HydrophobicContact CG1-CB 4.45Å; V136-V147 HydrophobicContact CG1-CG1 4.17Å; V136-V147 HydrophobicContact CG1-CG2 4.05Å
137	C	98.3	Very high	97.3	Very high	10 Å²	10	29.9 Å²	29.9	7%	0.068	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	122.4	178.8	-174.5	0	0	0	0	109	I146	C137-I146 HydrophobicContact CB-CB 4.49Å; C137-I146 PolarHBondContact N-O 3.08Å; C137-I146 PolarHBondContact O-N 3.44Å
138	L	98.2	Very high	97.3	Very high	18 Å²	18	28.6 Å²	28.6	9%	0.094	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	135.9	173	-171.8	68.9	0	0	0	109.2	H96 Y103 E144 L145 L159	H96-L138 HydrophobicContact CB-CD2 4.32Å; Y103-L138 HydrophobicContact CD1-CB 4.17Å; Y103-L138 HydrophobicContact CD1-CD2 4.36Å; Y103-L138 HydrophobicContact CE1-CB 3.42Å; Y103-L138 VanDerWaalsContact CE1-CB 3.42Å; Y103-L138 HydrophobicContact CE1-CD2 3.87Å; Y103-L138 HydrophobicContact CE1-CG 4.18Å; Y103-L138 HydrophobicContact CE2-CB 4.46Å; L138-E144 WeakPolarHBondContact CD1-O 3.48Å; L138-L145 HydrophobicContact CB-CD1 4.23Å; L138-L145 HydrophobicContact CD1-CD1 4.24Å; L138-L159 HydrophobicContact CD1-CD1 3.93Å
139	H	97.1	Very high	97.3	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.019	13%	0.126	C	C	.	.			trans	-69.3	143.6	172.1	-174.2	-79.6	0	0	0	109.6	N141 Q142 E144 I180	H139-N141 WeakPolarHBondContact CB-OD1 3.16Å; H139-N141 PolarHBondContact CE1-ND2 3.2Å; H139-N141 WeakPolarHBondContact ND1-CB 3.5Å; H139-N141 PolarHBondContact ND1-N 3.32Å; H139-N141 PolarHBondContact ND1-ND2 2.85Å; H139-N141 VanDerWaalsContact ND1-ND2 3.14Å; H139-N141 PolarHBondContact ND1-OD1 3.21Å; H139-N141 PolarHBondContact O-N 2.57Å; H139-Q142 PolarHBondContact O-N 3.31Å; H139-E144 HydrophobicContact CB-CB 3.92Å; H139-E144 VanDerWaalsContact CB-O 3.31Å; H139-E144 WeakPolarHBondContact CB-O 3.36Å; H139-E144 IonicContact CD2-OE2 2.68Å; H139-E144 IonicContact CG-OE2 3.45Å; H139-E144 PolarHBondContact N-O 2.9Å; H139-I180 HydrophobicContact CB-CD1 3.93Å
140	P	94.8	Very high	97.3	Very high	46 Å²	46	25.8 Å²	25.8	30%	0.299	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-26.8	-178.8	-29.3	35.8	0	0	0	115.1	Q142 I180 D181 A184	P140-Q142 PolarHBondContact O-N 3.08Å; P140-Q142 VanDerWaalsContact O-N 3.11Å; P140-Q142 PolarHBondContact O-NE2 2.88Å; P140-I180 VanDerWaalsContact CD-CG2 3.49Å; P140-I180 HydrophobicContact CG-CG2 3.9Å; P140-D181 WeakPolarHBondContact CG-O 3.31Å; P140-A184 HydrophobicContact CB-CB 4.34Å; P140-A184 HydrophobicContact CG-CB 4.08Å
141	N	93.2	Very high	97.4	Very high	52 Å²	52	19.9 Å²	19.9	28%	0.278	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-5.6	172	73	5.5	0	0	0	114.9	H139 A143 E144 G204	H139-N141 WeakPolarHBondContact CB-OD1 3.16Å; H139-N141 PolarHBondContact CE1-ND2 3.2Å; H139-N141 WeakPolarHBondContact ND1-CB 3.5Å; H139-N141 PolarHBondContact ND1-N 3.32Å; H139-N141 PolarHBondContact ND1-ND2 2.85Å; H139-N141 VanDerWaalsContact ND1-ND2 3.14Å; H139-N141 PolarHBondContact ND1-OD1 3.21Å; H139-N141 PolarHBondContact O-N 2.57Å; N141-A143 PolarHBondContact O-N 3.18Å; N141-A143 VanDerWaalsContact O-N 3.09Å; N141-A143 PolarHBondContact OD1-N 3.27Å; N141-E144 PolarHBondContact ND2-OE2 3.28Å; N141-E144 PolarHBondContact OD1-N 3.5Å; N141-G204 WeakPolarHBondContact CB-O 3.36Å; N141-G204 PolarHBondContact ND2-O 2.85Å
142	Q	94.9	Very high	97.3	Very high	45 Å²	45	19.3 Å²	19.3	21%	0.21	11%	0.109	C	C	.	.	S	Bend	trans	61.1	10.5	-178.7	-49.9	-60.5	-63.7	0	0	115.6	H96 H139 P140	H96-Q142 PolarHBondContact CD2-OE1 2.79Å; H96-Q142 WeakPolarHBondContact NE2-CB 3.35Å; H139-Q142 PolarHBondContact O-N 3.31Å; P140-Q142 PolarHBondContact O-N 3.08Å; P140-Q142 VanDerWaalsContact O-N 3.11Å; P140-Q142 PolarHBondContact O-NE2 2.88Å
143	A	93.9	Very high	97.3	Very high	13 Å²	13	18.4 Å²	18.4	11%	0.107	10%	0.103	C	C	.	.	S	Bend	trans	-111.3	-22.7	-173.2	0	0	0	0	0	113.4	N141 L159	N141-A143 PolarHBondContact O-N 3.18Å; N141-A143 VanDerWaalsContact O-N 3.09Å; N141-A143 PolarHBondContact OD1-N 3.27Å; A143-L159 WeakPolarHBondContact O-CB 3.34Å; A143-L159 WeakPolarHBondContact O-CG 3.49Å; A143-L159 PolarHBondContact O-N 3.03Å
144	E	95.8	Very high	97.3	Very high	12 Å²	12	18.4 Å²	18.4	6%	0.056	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.8	-177.2	-65.5	162.5	140.3	0	0	110.8	L138 H139 N141 I156 W157 T210	L138-E144 WeakPolarHBondContact CD1-O 3.48Å; H139-E144 HydrophobicContact CB-CB 3.92Å; H139-E144 VanDerWaalsContact CB-O 3.31Å; H139-E144 WeakPolarHBondContact CB-O 3.36Å; H139-E144 IonicContact CD2-OE2 2.68Å; H139-E144 IonicContact CG-OE2 3.45Å; H139-E144 PolarHBondContact N-O 2.9Å; N141-E144 PolarHBondContact ND2-OE2 3.28Å; N141-E144 PolarHBondContact OD1-N 3.5Å; E144-I156 HydrophobicContact CB-CG2 4.5Å; E144-W157 CarbonylContact C-O 3.6Å; E144-W157 WeakPolarHBondContact CA-O 3.33Å; E144-T210 VanDerWaalsContact CD-OG1 3.23Å; E144-T210 VanDerWaalsContact OE1-CB 3.27Å; E144-T210 WeakPolarHBondContact OE1-CB 3.32Å; E144-T210 PolarHBondContact OE1-N 2.93Å; E144-T210 PolarHBondContact OE1-OG1 3.17Å; E144-T210 VanDerWaalsContact OE1-OG1 3.11Å; E144-T210 VanDerWaalsContact OE2-CB 3.31Å; E144-T210 WeakPolarHBondContact OE2-CB 2.91Å; E144-T210 PolarHBondContact OE2-OG1 3.18Å
145	L	97.8	Very high	97.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.2	174	-170.2	70.7	0	0	0	109.7	Y103 A111 I113 V136 L138 V147 W157 L159	Y103-L145 HydrophobicContact CD1-CD1 4.28Å; Y103-L145 HydrophobicContact CD2-CD1 3.61Å; Y103-L145 HydrophobicContact CE2-CD1 4.03Å; Y103-L145 HydrophobicContact CG-CD1 3.74Å; A111-L145 HydrophobicContact CB-CD2 4.42Å; I113-L145 HydrophobicContact CD1-CD2 4.32Å; V136-L145 HydrophobicContact CB-CD1 4.43Å; L138-L145 HydrophobicContact CB-CD1 4.23Å; L138-L145 HydrophobicContact CD1-CD1 4.24Å; L145-V147 HydrophobicContact CD2-CG2 4.12Å; L145-V147 HydrophobicContact CG-CG2 4.12Å; L145-W157 HydrophobicContact CB-CE3 4.19Å; L145-W157 HydrophobicContact CD2-CE3 3.85Å; L145-W157 HydrophobicContact CD2-CZ3 4.06Å; L145-W157 PolarHBondContact N-O 3.2Å; L145-W157 PolarHBondContact O-N 3.22Å; L145-L159 HydrophobicContact CB-CD2 4.29Å
146	I	98.4	Very high	97.2	Very high	4 Å²	4	17.8 Å²	17.8	2%	0.021	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.4	174.3	-44.9	-57.3	0	0	0	109.2	V136 C137 I154 H155 I156 V178 I180 M187	V136-I146 CarbonylContact C-O 3.59Å; V136-I146 VanDerWaalsContact CA-O 3.29Å; V136-I146 WeakPolarHBondContact CA-O 3.41Å; C137-I146 HydrophobicContact CB-CB 4.49Å; C137-I146 PolarHBondContact N-O 3.08Å; C137-I146 PolarHBondContact O-N 3.44Å; I146-I154 HydrophobicContact CG2-CG2 3.46Å; I146-I154 VanDerWaalsContact CG2-CG2 3.46Å; I146-H155 CarbonylContact C-O 3.49Å; I146-H155 WeakPolarHBondContact CA-O 3.36Å; I146-I156 HydrophobicContact CD1-CB 4.19Å; I146-I156 HydrophobicContact CD1-CG1 4.02Å; I146-I156 HydrophobicContact CD1-CG2 3.79Å; I146-V178 HydrophobicContact CB-CG1 4.38Å; I146-V178 HydrophobicContact CG2-CB 4.43Å; I146-V178 HydrophobicContact CG2-CG1 3.73Å; I146-I180 HydrophobicContact CD1-CD1 4.28Å; I146-I180 HydrophobicContact CG1-CD1 3.55Å; I146-M187 HydrophobicContact CG1-SD 4.37Å; I146-M187 HydrophobicContact CG2-SD 3.98Å
147	V	98.8	Very high	97.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	119.3	-175.3	-177.5	0	0	0	0	109	A111 I133 V136 L145 I154 H155	A111-V147 HydrophobicContact CB-CG1 4.4Å; A111-V147 HydrophobicContact CB-CG2 4.03Å; I133-V147 HydrophobicContact CB-CG1 4.3Å; I133-V147 HydrophobicContact CD1-CG1 3.67Å; I133-V147 HydrophobicContact CG1-CG1 3.82Å; I133-V147 HydrophobicContact CG2-CG1 3.53Å; V136-V147 HydrophobicContact CG1-CB 4.45Å; V136-V147 HydrophobicContact CG1-CG1 4.17Å; V136-V147 HydrophobicContact CG1-CG2 4.05Å; L145-V147 HydrophobicContact CD2-CG2 4.12Å; L145-V147 HydrophobicContact CG-CG2 4.12Å; V147-I154 CarbonylContact O-C 3.6Å; V147-I154 WeakPolarHBondContact O-CA 3.44Å; V147-H155 HydrophobicContact CB-CB 4.11Å; V147-H155 PolarHBondContact N-O 3.47Å; V147-H155 PolarHBondContact O-N 2.99Å
148	G	98.6	Very high	97	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.6	177.7	0	0	0	0	0	111.9	N134 C135	N134-G148 PolarHBondContact N-O 2.92Å; C135-G148 PolarHBondContact N-O 3.32Å; C135-G148 PolarHBondContact O-N 3.03Å
149	D	98.4	Very high	96.7	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	171.1	-175.7	83.2	15.2	0	0	0	114.8	A131 P132 S151 G152 V153 H155 I175	A131-D149 HydrophobicContact CB-CB 4.26Å; P132-D149 CarbonylContact O-C 3.58Å; P132-D149 WeakPolarHBondContact O-CA 3.29Å; D149-S151 VanDerWaalsContact C-N 3.28Å; D149-S151 VanDerWaalsContact CG-OG 3.26Å; D149-S151 PolarHBondContact O-N 3.06Å; D149-S151 WeakPolarHBondContact OD1-CA 3.36Å; D149-S151 WeakPolarHBondContact OD1-CB 3.39Å; D149-S151 PolarHBondContact OD1-N 2.85Å; D149-S151 PolarHBondContact OD1-OG 2.77Å; D149-S151 PolarHBondContact OD2-OG 3.12Å; D149-S151 VanDerWaalsContact OD2-OG 3.1Å; D149-G152 PolarHBondContact O-N 2.94Å; D149-G152 PolarHBondContact OD1-N 3.1Å; D149-G152 VanDerWaalsContact OD1-N 3.09Å; D149-V153 PolarHBondContact N-O 3.48Å; D149-V153 PolarHBondContact OD1-N 3.11Å; D149-H155 IonicContact OD2-NE2 3.44Å; D149-I175 PolarHBondContact O-N 3.24Å
150	Q	98.3	Very high	96.5	Very high	81 Å²	81	25.1 Å²	25.1	38%	0.379	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-15.7	-179.8	-74.9	-176.6	10.1	0	0	114.6	P132 N134 G152 S174	P132-Q150 HydrophobicContact CB-CB 4.48Å; P132-Q150 HydrophobicContact CB-CG 4.07Å; P132-Q150 WeakPolarHBondContact O-CG 3.29Å; P132-Q150 PolarHBondContact O-N 2.55Å; N134-Q150 VanDerWaalsContact ND2-CG 3.29Å; N134-Q150 WeakPolarHBondContact ND2-CG 3.26Å; N134-Q150 VanDerWaalsContact OD1-CG 3.3Å; N134-Q150 WeakPolarHBondContact OD1-CG 3.44Å; N134-Q150 PolarHBondContact OD1-NE2 2.86Å; Q150-G152 VanDerWaalsContact C-N 3.28Å; Q150-S174 VanDerWaalsContact O-CA 3.28Å; Q150-S174 WeakPolarHBondContact O-CA 3.38Å; Q150-S174 WeakPolarHBondContact O-CB 3.49Å
151	S	97.8	Very high	96.3	Very high	43 Å²	43	27.2 Å²	27.2	30%	0.301	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-10.6	175.8	73.1	0	0	0	0	113	D149 V153 E172	D149-S151 VanDerWaalsContact C-N 3.28Å; D149-S151 VanDerWaalsContact CG-OG 3.26Å; D149-S151 PolarHBondContact O-N 3.06Å; D149-S151 WeakPolarHBondContact OD1-CA 3.36Å; D149-S151 WeakPolarHBondContact OD1-CB 3.39Å; D149-S151 PolarHBondContact OD1-N 2.85Å; D149-S151 PolarHBondContact OD1-OG 2.77Å; D149-S151 PolarHBondContact OD2-OG 3.12Å; D149-S151 VanDerWaalsContact OD2-OG 3.1Å; S151-V153 VanDerWaalsContact OG-CG2 3.28Å; S151-V153 WeakPolarHBondContact OG-CG2 3.23Å; S151-E172 PolarHBondContact O-N 3.06Å
152	G	97.4	Very high	96.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	99.5	6.1	-178.3	0	0	0	0	0	113.5	D149 Q150 P169 V173	D149-G152 PolarHBondContact O-N 2.94Å; D149-G152 PolarHBondContact OD1-N 3.1Å; D149-G152 VanDerWaalsContact OD1-N 3.09Å; Q150-G152 VanDerWaalsContact C-N 3.28Å; G152-P169 WeakPolarHBondContact O-CD 3.39Å; G152-V173 WeakPolarHBondContact CA-O 3.21Å
153	V	98.3	Very high	96.2	Very high	14 Å²	14	32.5 Å²	32.5	9%	0.085	17%	0.169	C	C	.	.			trans	-88.3	134.7	-179.1	-173.3	0	0	0	0	109.5	D149 S151 H155 Q166 I168	D149-V153 PolarHBondContact N-O 3.48Å; D149-V153 PolarHBondContact OD1-N 3.11Å; S151-V153 VanDerWaalsContact OG-CG2 3.28Å; S151-V153 WeakPolarHBondContact OG-CG2 3.23Å; V153-H155 WeakPolarHBondContact CG1-NE2 3.44Å; V153-Q166 HydrophobicContact CG1-CB 3.98Å; V153-Q166 HydrophobicContact CG1-CG 4.09Å; V153-I168 HydrophobicContact CB-CG1 4.43Å; V153-I168 HydrophobicContact CG1-CG1 4.37Å; V153-I168 HydrophobicContact CG2-CD1 4.01Å; V153-I168 HydrophobicContact CG2-CG1 3.9Å
154	I	98.4	Very high	96.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.2	165.8	-57.4	176.5	0	0	0	106.9	I146 V147 Q166 L167 P169 I175 V178 M187 A189 W199	I146-I154 HydrophobicContact CG2-CG2 3.46Å; I146-I154 VanDerWaalsContact CG2-CG2 3.46Å; V147-I154 CarbonylContact O-C 3.6Å; V147-I154 WeakPolarHBondContact O-CA 3.44Å; I154-Q166 WeakPolarHBondContact O-CA 3.22Å; I154-L167 HydrophobicContact CB-CB 4.42Å; I154-L167 PolarHBondContact N-O 3.5Å; I154-L167 PolarHBondContact O-N 2.78Å; I154-P169 HydrophobicContact CD1-CG 3.76Å; I154-P169 HydrophobicContact CG1-CG 4.39Å; I154-I175 HydrophobicContact CD1-CG1 4.49Å; I154-I175 HydrophobicContact CG1-CG1 3.96Å; I154-I175 HydrophobicContact CG1-CG2 4.41Å; I154-V178 HydrophobicContact CD1-CG2 4.38Å; I154-M187 HydrophobicContact CD1-CE 4.25Å; I154-M187 HydrophobicContact CG2-CE 4.37Å; I154-A189 HydrophobicContact CD1-CB 3.56Å; I154-W199 HydrophobicContact CD1-CH2 3.71Å; I154-W199 HydrophobicContact CD1-CZ2 4.45Å; I154-W199 HydrophobicContact CD1-CZ3 4.19Å
155	H	98.3	Very high	96.1	Very high	7 Å²	7	37 Å²	37	3%	0.032	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	137.7	175.8	-66.4	-99.2	0	0	0	109.9	F127 V129 I146 V147 D149 V153 N164 E165 Q166	F127-H155 HydrophobicContact CE1-CB 3.82Å; F127-H155 AromaticContact CE1-CG 3.91Å; F127-H155 AromaticContact CE1-ND1 3.86Å; F127-H155 HydrophobicContact CZ-CB 4.16Å; F127-H155 AromaticContact CZ-ND1 3.6Å; V129-H155 WeakPolarHBondContact CG1-NE2 3.36Å; I146-H155 CarbonylContact C-O 3.49Å; I146-H155 WeakPolarHBondContact CA-O 3.36Å; V147-H155 HydrophobicContact CB-CB 4.11Å; V147-H155 PolarHBondContact N-O 3.47Å; V147-H155 PolarHBondContact O-N 2.99Å; D149-H155 IonicContact OD2-NE2 3.44Å; V153-H155 WeakPolarHBondContact CG1-NE2 3.44Å; H155-N164 WeakPolarHBondContact CB-OD1 3.41Å; H155-N164 PolarHBondContact ND1-OD1 2.77Å; H155-N164 VanDerWaalsContact ND1-OD1 3.12Å; H155-E165 CarbonylContact C-O 3.57Å; H155-E165 WeakPolarHBondContact CA-O 3.49Å; H155-Q166 PolarHBondContact CE1-NE2 3Å
156	I	96.9	Very high	96	Very high	13 Å²	13	42.7 Å²	42.7	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	101	174	-49.3	168.9	0	0	0	105.8	E144 I146 N164 E165 L212	E144-I156 HydrophobicContact CB-CG2 4.5Å; I146-I156 HydrophobicContact CD1-CB 4.19Å; I146-I156 HydrophobicContact CD1-CG1 4.02Å; I146-I156 HydrophobicContact CD1-CG2 3.79Å; I156-N164 WeakPolarHBondContact O-CA 3.4Å; I156-E165 HydrophobicContact CB-CB 4.29Å; I156-E165 HydrophobicContact CD1-CB 4.28Å; I156-E165 PolarHBondContact N-O 3.02Å; I156-E165 PolarHBondContact O-N 3.01Å; I156-L212 HydrophobicContact CD1-CD1 3.37Å; I156-L212 HydrophobicContact CD1-CG 4.06Å; I156-L212 HydrophobicContact CG1-CD1 4.19Å
157	W	97	Very high	95.9	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	113.2	-177.5	176.9	33.7	0	0	0	110.3	I113 R125 F127 E144 L145 L159 D162	I113-W157 HydrophobicContact CD1-CH2 4.36Å; I113-W157 HydrophobicContact CD1-CZ3 3.97Å; I113-W157 HydrophobicContact CG1-CH2 3.67Å; I113-W157 HydrophobicContact CG1-CZ3 3.77Å; R125-W157 HydrophobicContact CB-CH2 4.01Å; R125-W157 HydrophobicContact CB-CZ2 4.35Å; F127-W157 HydrophobicContact CB-CD2 3.69Å; F127-W157 HydrophobicContact CB-CE3 3.6Å; F127-W157 HydrophobicContact CB-CG 4.36Å; F127-W157 HydrophobicContact CB-CH2 3.92Å; F127-W157 HydrophobicContact CB-CZ2 4Å; F127-W157 HydrophobicContact CB-CZ3 3.72Å; F127-W157 HydrophobicContact CD1-CB 4.46Å; F127-W157 HydrophobicContact CD2-CD2 4.24Å; F127-W157 HydrophobicContact CD2-CG 4.08Å; F127-W157 HydrophobicContact CG-CB 4.46Å; F127-W157 AromaticContact CG-CD2 3.9Å; F127-W157 HydrophobicContact CG-CD2 3.9Å; F127-W157 HydrophobicContact CG-CE3 4.11Å; F127-W157 HydrophobicContact CG-CG 4.06Å; E144-W157 CarbonylContact C-O 3.6Å; E144-W157 WeakPolarHBondContact CA-O 3.33Å; L145-W157 HydrophobicContact CB-CE3 4.19Å; L145-W157 HydrophobicContact CD2-CE3 3.85Å; L145-W157 HydrophobicContact CD2-CZ3 4.06Å; L145-W157 PolarHBondContact N-O 3.2Å; L145-W157 PolarHBondContact O-N 3.22Å; W157-L159 HydrophobicContact CD2-CD2 3.84Å; W157-L159 HydrophobicContact CE3-CD2 3.65Å; W157-L159 HydrophobicContact CH2-CD2 3.91Å; W157-L159 HydrophobicContact CZ2-CD2 4.06Å; W157-L159 HydrophobicContact CZ3-CD2 3.69Å; W157-L159 PolarHBondContact O-N 2.94Å; W157-D162 PolarHBondContact NE1-OD1 2.84Å
158	D	94.2	Very high	95.9	Very high	35 Å²	35	48.7 Å²	48.7	19%	0.187	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	114.3	173.2	179.1	-6.7	0	0	0	110	K160 T161 D162 H163	D158-K160 VanDerWaalsContact C-N 3.25Å; D158-K160 PolarHBondContact O-N 3.42Å; D158-K160 WeakPolarHBondContact OD1-CA 3.45Å; D158-K160 WeakPolarHBondContact OD1-CB 3.32Å; D158-K160 PolarHBondContact OD1-N 3.05Å; D158-T161 WeakPolarHBondContact CB-OG1 3.27Å; D158-T161 PolarHBondContact OD1-N 3.48Å; D158-T161 WeakPolarHBondContact OD2-CB 3.31Å; D158-T161 VanDerWaalsContact OD2-CG2 3.23Å; D158-T161 WeakPolarHBondContact OD2-CG2 3.3Å; D158-T161 PolarHBondContact OD2-OG1 3.27Å; D158-D162 WeakPolarHBondContact O-CA 3.36Å; D158-D162 PolarHBondContact O-N 3.21Å; D158-H163 HydrophobicContact CB-CB 4.47Å; D158-H163 PolarHBondContact N-O 2.9Å
159	L	93.7	Very high	95.7	Very high	31 Å²	31	50.2 Å²	50.2	16%	0.162	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.4	-178.9	-57.8	174.9	0	0	0	112.2	I113 R125 L138 A143 L145 W157	I113-L159 HydrophobicContact CD1-CD2 4.11Å; I113-L159 HydrophobicContact CG1-CD2 4.32Å; R125-L159 VanDerWaalsContact CZ-O 3.25Å; R125-L159 PolarHBondContact NH1-O 2.84Å; R125-L159 PolarHBondContact NH2-O 3.22Å; L138-L159 HydrophobicContact CD1-CD1 3.93Å; A143-L159 WeakPolarHBondContact O-CB 3.34Å; A143-L159 WeakPolarHBondContact O-CG 3.49Å; A143-L159 PolarHBondContact O-N 3.03Å; L145-L159 HydrophobicContact CB-CD2 4.29Å; W157-L159 HydrophobicContact CD2-CD2 3.84Å; W157-L159 HydrophobicContact CE3-CD2 3.65Å; W157-L159 HydrophobicContact CH2-CD2 3.91Å; W157-L159 HydrophobicContact CZ2-CD2 4.06Å; W157-L159 HydrophobicContact CZ3-CD2 3.69Å; W157-L159 PolarHBondContact O-N 2.94Å
160	K	91.7	Very high	95.5	Very high	128 Å²	128	52.5 Å²	52.5	56%	0.557	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-45.3	176.4	-62	176	-178.4	172.8	0	111.8	D158 G206 D207	D158-K160 VanDerWaalsContact C-N 3.25Å; D158-K160 PolarHBondContact O-N 3.42Å; D158-K160 WeakPolarHBondContact OD1-CA 3.45Å; D158-K160 WeakPolarHBondContact OD1-CB 3.32Å; D158-K160 PolarHBondContact OD1-N 3.05Å; K160-G206 PolarHBondContact NZ-O 3.09Å; K160-D207 IonicContact NZ-OD1 3.95Å
161	T	91.6	Very high	95.3	Very high	91 Å²	91	53.1 Å²	53.1	56%	0.558	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-10.9	-169.6	66.2	0	0	0	0	114.4	D158 H163	D158-T161 WeakPolarHBondContact CB-OG1 3.27Å; D158-T161 PolarHBondContact OD1-N 3.48Å; D158-T161 WeakPolarHBondContact OD2-CB 3.31Å; D158-T161 VanDerWaalsContact OD2-CG2 3.23Å; D158-T161 WeakPolarHBondContact OD2-CG2 3.3Å; D158-T161 PolarHBondContact OD2-OG1 3.27Å; T161-H163 PolarHBondContact O-N 3.18Å; T161-H163 VanDerWaalsContact OG1-CB 3.28Å; T161-H163 WeakPolarHBondContact OG1-CB 3.17Å; T161-H163 PolarHBondContact OG1-N 3.49Å
162	D	91.9	Very high	95	Very high	99 Å²	99	59.4 Å²	59.4	53%	0.529	30%	0.303	S	S	.	.			trans	59.5	15.8	-167.8	-87.7	-37.4	0	0	0	113.9	R125 W157 D158	R125-D162 IonicContact CZ-OD1 2.89Å; R125-D162 IonicContact NE-OD1 3.42Å; R125-D162 IonicContact NH2-OD1 3.65Å; R125-D162 PolarHBondContact NH2-OD1 2.9Å; R125-D162 IonicContact NH2-OD2 3.7Å; R125-D162 PolarHBondContact NH2-OD2 3.3Å; R125-D162 VanDerWaalsContact NH2-OD2 3.16Å; W157-D162 PolarHBondContact NE1-OD1 2.84Å; D158-D162 WeakPolarHBondContact O-CA 3.36Å; D158-D162 PolarHBondContact O-N 3.21Å
163	H	92.7	Very high	95	Very high	109 Å²	109	60.5 Å²	60.5	51%	0.505	31%	0.31	S	S	.	.			trans	-71.9	142.8	171.3	-164.6	67.9	0	0	0	110.7	D158 T161	D158-H163 HydrophobicContact CB-CB 4.47Å; D158-H163 PolarHBondContact N-O 2.9Å; T161-H163 PolarHBondContact O-N 3.18Å; T161-H163 VanDerWaalsContact OG1-CB 3.28Å; T161-H163 WeakPolarHBondContact OG1-CB 3.17Å; T161-H163 PolarHBondContact OG1-N 3.49Å
164	N	94.4	Very high	95	Very high	41 Å²	41	60.8 Å²	60.8	22%	0.219	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122	175.8	161.9	78.9	0	0	0	110.1	F127 H155 I156 Q166	F127-N164 HydrophobicContact CE2-CB 3.66Å; F127-N164 HydrophobicContact CZ-CB 3.9Å; F127-N164 VanDerWaalsContact CZ-CG 3.43Å; F127-N164 WeakPolarHBondContact CZ-OD1 3.48Å; H155-N164 WeakPolarHBondContact CB-OD1 3.41Å; H155-N164 PolarHBondContact ND1-OD1 2.77Å; H155-N164 VanDerWaalsContact ND1-OD1 3.12Å; I156-N164 WeakPolarHBondContact O-CA 3.4Å; N164-Q166 WeakPolarHBondContact ND2-CG 3.32Å; N164-Q166 PolarHBondContact ND2-NE2 3.22Å
165	E	94.6	Very high	95	Very high	77 Å²	77	60.8 Å²	60.8	36%	0.36	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	149.1	167.4	-60.5	-167.5	171.2	0	0	110.6	H155 I156	H155-E165 CarbonylContact C-O 3.57Å; H155-E165 WeakPolarHBondContact CA-O 3.49Å; I156-E165 HydrophobicContact CB-CB 4.29Å; I156-E165 HydrophobicContact CD1-CB 4.28Å; I156-E165 PolarHBondContact N-O 3.02Å; I156-E165 PolarHBondContact O-N 3.01Å
166	Q	95.8	Very high	95	Very high	120 Å²	120	61.8 Å²	61.8	56%	0.561	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.6	-179.9	-64.7	-177	1.6	0	0	110.6	V153 I154 H155 N164	V153-Q166 HydrophobicContact CG1-CB 3.98Å; V153-Q166 HydrophobicContact CG1-CG 4.09Å; I154-Q166 WeakPolarHBondContact O-CA 3.22Å; H155-Q166 PolarHBondContact CE1-NE2 3Å; N164-Q166 WeakPolarHBondContact ND2-CG 3.32Å; N164-Q166 PolarHBondContact ND2-NE2 3.22Å
167	L	96.2	Very high	95.1	Very high	43 Å²	43	61.2 Å²	61.2	23%	0.225	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	130.9	176.8	174.8	67.3	0	0	0	109.3	I154 M187 W199 L212	I154-L167 HydrophobicContact CB-CB 4.42Å; I154-L167 PolarHBondContact N-O 3.5Å; I154-L167 PolarHBondContact O-N 2.78Å; L167-M187 HydrophobicContact CD2-CE 4.43Å; L167-W199 HydrophobicContact CD2-CD2 4.34Å; L167-W199 HydrophobicContact CD2-CH2 4.49Å; L167-W199 HydrophobicContact CD2-CZ2 3.72Å; L167-L212 HydrophobicContact CD2-CB 4.46Å; L167-L212 HydrophobicContact CD2-CD1 3.6Å
168	I	97.4	Very high	95.2	Very high	88 Å²	88	61.3 Å²	61.3	45%	0.451	32%	0.316	S	S	.	.			trans	-119.3	101.9	178.4	-56.5	175.5	0	0	0	107.9	V153 P171	V153-I168 HydrophobicContact CB-CG1 4.43Å; V153-I168 HydrophobicContact CG1-CG1 4.37Å; V153-I168 HydrophobicContact CG2-CD1 4.01Å; V153-I168 HydrophobicContact CG2-CG1 3.9Å; I168-P171 HydrophobicContact CG2-CB 4.43Å; I168-P171 HydrophobicContact CG2-CG 4.23Å
169	P	95.5	Very high	95.4	Very high	31 Å²	31	61.2 Å²	61.2	20%	0.201	31%	0.314	C	S	.	.	S	Bend	trans	-69	-38.7	-179.9	-15.7	29.1	0	0	0	112.2	G152 I154 I175 Y197 W199	G152-P169 WeakPolarHBondContact O-CD 3.39Å; I154-P169 HydrophobicContact CD1-CG 3.76Å; I154-P169 HydrophobicContact CG1-CG 4.39Å; P169-I175 HydrophobicContact CG-CD1 4.24Å; P169-Y197 HydrophobicContact CB-CD1 3.9Å; P169-Y197 HydrophobicContact CB-CD2 3.87Å; P169-Y197 HydrophobicContact CB-CE1 4.07Å; P169-Y197 HydrophobicContact CB-CE2 4.05Å; P169-Y197 HydrophobicContact CB-CG 3.8Å; P169-W199 HydrophobicContact CB-CH2 4.13Å; P169-W199 HydrophobicContact CB-CZ2 3.89Å; P169-W199 HydrophobicContact CG-CH2 3.64Å; P169-W199 HydrophobicContact CG-CZ2 3.63Å
170	E	93.9	Very high	95.6	Very high	49 Å²	49	60 Å²	60	23%	0.229	31%	0.308	C	S	.	.	S	Bend	trans	-151.5	116.8	-178.6	-173.7	169	-160.6	0	0	107.7	V173 N191 N195 Y197 K217	E170-V173 HydrophobicContact CG-CB 4.35Å; E170-V173 HydrophobicContact CG-CG2 3.9Å; E170-N191 PolarHBondContact OE2-ND2 2.76Å; E170-N195 PolarHBondContact OE2-ND2 2.9Å; E170-N195 VanDerWaalsContact OE2-ND2 3.12Å; E170-Y197 HydrophobicContact CB-CE2 4.46Å; E170-Y197 WeakPolarHBondContact CB-OH 3.43Å; E170-Y197 PolarHBondContact OE2-OH 3.4Å; E170-K217 IonicContact OE2-NZ 2.78Å
171	P	92.8	Very high	95.9	Very high	95 Å²	95	53.9 Å²	53.9	62%	0.617	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	146.9	-178.2	-23	33	0	0	0	112.5	I168 V173	I168-P171 HydrophobicContact CG2-CB 4.43Å; I168-P171 HydrophobicContact CG2-CG 4.23Å; P171-V173 PolarHBondContact O-N 3.18Å; P171-V173 VanDerWaalsContact O-N 3.16Å
172	E	93.3	Very high	96.1	Very high	174 Å²	174	52.8 Å²	52.8	81%	0.813	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	19.1	171.8	-54.4	-67.5	165	0	0	114.6	S151	S151-E172 PolarHBondContact O-N 3.06Å
173	V	97.3	Very high	96.2	Very high	23 Å²	23	53.3 Å²	53.3	14%	0.139	28%	0.279	C	S	.	.			trans	-123.5	108.6	175.2	-173.3	0	0	0	0	110.2	G152 E170 P171 I175 N191 S193	G152-V173 WeakPolarHBondContact CA-O 3.21Å; E170-V173 HydrophobicContact CG-CB 4.35Å; E170-V173 HydrophobicContact CG-CG2 3.9Å; P171-V173 PolarHBondContact O-N 3.18Å; P171-V173 VanDerWaalsContact O-N 3.16Å; V173-I175 PolarHBondContact O-N 3.27Å; V173-N191 HydrophobicContact CG1-CB 3.9Å; V173-N191 WeakPolarHBondContact CG1-ND2 3.45Å; V173-S193 VanDerWaalsContact CG1-OG 3.27Å; V173-S193 WeakPolarHBondContact CG1-OG 3.37Å
174	S	98.1	Very high	96.4	Very high	21 Å²	21	49.5 Å²	49.5	15%	0.147	27%	0.266	C	S	.	.			trans	-44.1	125.6	177.6	174.1	0	0	0	0	113.8	N134 Q150 N176 N191 S192	N134-S174 PolarHBondContact ND2-OG 2.98Å; Q150-S174 VanDerWaalsContact O-CA 3.28Å; Q150-S174 WeakPolarHBondContact O-CA 3.38Å; Q150-S174 WeakPolarHBondContact O-CB 3.49Å; S174-N176 PolarHBondContact O-OD1 3.21Å; S174-N176 PolarHBondContact OG-OD1 3.42Å; S174-N191 CarbonylContact O-C 3.59Å; S174-N191 VanDerWaalsContact O-CA 3.23Å; S174-N191 WeakPolarHBondContact O-CA 3.32Å; S174-N191 WeakPolarHBondContact O-CB 3.36Å; S174-S192 PolarHBondContact O-N 2.74Å
175	I	98.4	Very high	96.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	120.9	168.4	-57.7	-53.3	0	0	0	108.2	N134 D149 I154 P169 V173 V178 A189 N191	N134-I175 VanDerWaalsContact CB-O 3.31Å; N134-I175 WeakPolarHBondContact CB-O 3.18Å; N134-I175 PolarHBondContact ND2-O 3.47Å; D149-I175 PolarHBondContact O-N 3.24Å; I154-I175 HydrophobicContact CD1-CG1 4.49Å; I154-I175 HydrophobicContact CG1-CG1 3.96Å; I154-I175 HydrophobicContact CG1-CG2 4.41Å; P169-I175 HydrophobicContact CG-CD1 4.24Å; V173-I175 PolarHBondContact O-N 3.27Å; I175-V178 HydrophobicContact CG2-CG2 3.69Å; I175-A189 HydrophobicContact CG2-CB 4.27Å; I175-N191 HydrophobicContact CD1-CB 3.97Å
176	N	98.4	Very high	96.6	Very high	27 Å²	27	48.1 Å²	48.1	14%	0.144	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-31.5	-174	-65.4	-15.7	0	0	0	112.4	S174 V190 S192 S225	S174-N176 PolarHBondContact O-OD1 3.21Å; S174-N176 PolarHBondContact OG-OD1 3.42Å; N176-V190 PolarHBondContact N-O 3.21Å; N176-S192 PolarHBondContact ND2-N 3.15Å; N176-S192 PolarHBondContact ND2-OG 3.47Å; N176-S192 PolarHBondContact OD1-OG 3.15Å; N176-S192 VanDerWaalsContact OD1-OG 3.07Å; N176-S225 WeakPolarHBondContact CB-O 3.39Å; N176-S225 PolarHBondContact ND2-O 3.01Å
177	S	98.6	Very high	96.7	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.007	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	146.2	178.1	-179.9	0	0	0	0	110.5	C135 A189 V190 C228	C135-S177 VanDerWaalsContact SG-CA 3.53Å; S177-A189 CarbonylContact O-C 3.56Å; S177-A189 WeakPolarHBondContact O-CA 3.28Å; S177-V190 PolarHBondContact N-O 3.2Å; S177-V190 PolarHBondContact O-N 2.93Å; S177-C228 PolarHBondContact OG-N 3.18Å; S177-C228 PolarHBondContact OG-O 3.36Å
178	V	98.7	Very high	96.8	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.03	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	143.5	170.7	-178.6	0	0	0	0	108.4	C135 I146 I154 I175 M187 A188 A189	C135-V178 PolarHBondContact SG-N 3.27Å; C135-V178 VanDerWaalsContact SG-N 3.4Å; I146-V178 HydrophobicContact CB-CG1 4.38Å; I146-V178 HydrophobicContact CG2-CB 4.43Å; I146-V178 HydrophobicContact CG2-CG1 3.73Å; I154-V178 HydrophobicContact CD1-CG2 4.38Å; I175-V178 HydrophobicContact CG2-CG2 3.69Å; V178-M187 HydrophobicContact CG1-CG 3.85Å; V178-M187 HydrophobicContact CG1-SD 3.94Å; V178-A188 CarbonylContact C-O 3.55Å; V178-A188 VanDerWaalsContact CA-O 3.3Å; V178-A188 WeakPolarHBondContact CA-O 3.23Å; V178-A189 HydrophobicContact CG2-CB 3.83Å
179	H	98.8	Very high	96.9	Very high	32 Å²	32	36.1 Å²	36.1	15%	0.148	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144.8	171.7	-155.2	-109.3	0	0	0	111	A188 K229 F230	H179-A188 PolarHBondContact N-O 3.14Å; H179-A188 PolarHBondContact O-N 2.91Å; H179-K229 HydrophobicContact CB-CD 4.5Å; H179-K229 WeakPolarHBondContact CD2-CD 3.35Å; H179-K229 PolarHBondContact CD2-NZ 3.3Å; H179-K229 VanDerWaalsContact CD2-NZ 3.32Å; H179-K229 VanDerWaalsContact NE2-CD 3.29Å; H179-K229 WeakPolarHBondContact NE2-CD 3.37Å; H179-K229 PolarHBondContact NE2-NZ 2.8Å; H179-F230 HydrophobicContact CB-CD2 4.32Å; H179-F230 AromaticContact ND1-CD2 3.92Å; H179-F230 PolarHBondContact ND1-N 3.26Å; H179-F230 WeakPolarHBondContact O-CE2 3.47Å
180	I	98.4	Very high	97	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143.1	169.2	-63.9	163.2	0	0	0	107.6	H139 P140 I146 Y186 M187 L201	H139-I180 HydrophobicContact CB-CD1 3.93Å; P140-I180 VanDerWaalsContact CD-CG2 3.49Å; P140-I180 HydrophobicContact CG-CG2 3.9Å; I146-I180 HydrophobicContact CD1-CD1 4.28Å; I146-I180 HydrophobicContact CG1-CD1 3.55Å; I180-Y186 WeakPolarHBondContact CA-O 3.44Å; I180-M187 HydrophobicContact CG1-CB 4.05Å; I180-M187 HydrophobicContact CG1-CG 3.82Å; I180-L201 HydrophobicContact CB-CD1 4.41Å; I180-L201 HydrophobicContact CG1-CD1 4.21Å; I180-L201 HydrophobicContact CG2-CD1 3.42Å; I180-L201 VanDerWaalsContact CG2-CD1 3.42Å
181	D	97.8	Very high	97.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.183	C	C	.	.			trans	-75.8	154.8	175.6	75.3	-51.6	0	0	0	111.5	P140 D183 A184 S185 Y186 F230 S234	P140-D181 WeakPolarHBondContact CG-O 3.31Å; D181-D183 VanDerWaalsContact C-N 3.26Å; D181-D183 PolarHBondContact O-N 2.98Å; D181-A184 PolarHBondContact O-N 3.36Å; D181-A184 PolarHBondContact OD1-N 3.09Å; D181-S185 PolarHBondContact OD1-N 3.11Å; D181-S185 WeakPolarHBondContact OD2-CB 3.44Å; D181-S185 PolarHBondContact OD2-N 2.83Å; D181-Y186 PolarHBondContact N-O 2.9Å; D181-Y186 VanDerWaalsContact N-O 3.12Å; D181-Y186 PolarHBondContact OD1-N 3.1Å; D181-F230 HydrophobicContact CB-CB 3.72Å; D181-F230 HydrophobicContact CB-CD1 3.99Å; D181-F230 HydrophobicContact CB-CD2 3.81Å; D181-F230 HydrophobicContact CB-CE2 4.39Å; D181-F230 HydrophobicContact CB-CG 3.58Å; D181-S234 VanDerWaalsContact CB-OG 3.31Å; D181-S234 WeakPolarHBondContact CB-OG 3.36Å; D181-S234 VanDerWaalsContact OD2-CB 3.25Å; D181-S234 WeakPolarHBondContact OD2-CB 3.1Å; D181-S234 PolarHBondContact OD2-OG 2.8Å
182	P	94.9	Very high	97.5	Very high	67 Å²	67	29.3 Å²	29.3	44%	0.435	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-33.7	-177.2	-28	37.9	0	0	0	114.6	A184	P182-A184 PolarHBondContact O-N 3.25Å
183	D	94.9	Very high	97.7	Very high	110 Å²	110	23.8 Å²	23.8	59%	0.588	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-1.1	176.2	-69.5	-15.8	0	0	0	113.4	D181 S185 S234	D181-D183 VanDerWaalsContact C-N 3.26Å; D181-D183 PolarHBondContact O-N 2.98Å; D183-S185 PolarHBondContact O-N 2.75Å; D183-S185 VanDerWaalsContact O-N 3.15Å; D183-S234 PolarHBondContact N-OG 2.99Å
184	A	95.2	Very high	97.6	Very high	30 Å²	30	22.7 Å²	22.7	25%	0.248	14%	0.138	C	C	.	.	S	Bend	trans	49.7	36.8	-174.6	0	0	0	0	0	112.9	P140 D181 P182 L201	P140-A184 HydrophobicContact CB-CB 4.34Å; P140-A184 HydrophobicContact CG-CB 4.08Å; D181-A184 PolarHBondContact O-N 3.36Å; D181-A184 PolarHBondContact OD1-N 3.09Å; P182-A184 PolarHBondContact O-N 3.25Å; A184-L201 VanDerWaalsContact O-CB 3.27Å; A184-L201 WeakPolarHBondContact O-CB 3.28Å
185	S	95.4	Very high	97.7	Very high	49 Å²	49	22.8 Å²	22.8	34%	0.343	14%	0.137	S	C	.	.			trans	-89.1	-34.1	178.1	-66	0	0	0	0	112.1	D181 D183 L201	D181-S185 PolarHBondContact OD1-N 3.11Å; D181-S185 WeakPolarHBondContact OD2-CB 3.44Å; D181-S185 PolarHBondContact OD2-N 2.83Å; D183-S185 PolarHBondContact O-N 2.75Å; D183-S185 VanDerWaalsContact O-N 3.15Å; S185-L201 PolarHBondContact O-N 3.21Å
186	Y	97.9	Very high	97.7	Very high	39 Å²	39	22.8 Å²	22.8	15%	0.153	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.6	-172.2	-60.4	-66.4	0	0	0	112.9	I180 D181 V198 W199 N200 K215 F254	I180-Y186 WeakPolarHBondContact CA-O 3.44Å; D181-Y186 PolarHBondContact N-O 2.9Å; D181-Y186 VanDerWaalsContact N-O 3.12Å; D181-Y186 PolarHBondContact OD1-N 3.1Å; Y186-V198 HydrophobicContact CD1-CG1 4.06Å; Y186-V198 HydrophobicContact CG-CG1 4.47Å; Y186-W199 VanDerWaalsContact CA-O 3.31Å; Y186-W199 WeakPolarHBondContact CA-O 3.35Å; Y186-N200 VanDerWaalsContact CE1-OD1 3.27Å; Y186-N200 WeakPolarHBondContact CE1-OD1 3.38Å; Y186-K215 HydrophobicContact CD1-CD 4.22Å; Y186-K215 HydrophobicContact CE1-CD 3.63Å; Y186-K215 PolarHBondContact OH-NZ 2.83Å; Y186-F254 HydrophobicContact CD1-CZ 4.13Å; Y186-F254 HydrophobicContact CE1-CE2 4.41Å; Y186-F254 HydrophobicContact CE1-CZ 4.19Å; Y186-F254 HydrophobicContact CG-CZ 4.37Å
187	M	98.4	Very high	97.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.4	161.2	-172.7	-176.9	80.1	0	0	108.9	I146 I154 L167 V178 I180 V198 W199 L201 L212	I146-M187 HydrophobicContact CG1-SD 4.37Å; I146-M187 HydrophobicContact CG2-SD 3.98Å; I154-M187 HydrophobicContact CD1-CE 4.25Å; I154-M187 HydrophobicContact CG2-CE 4.37Å; L167-M187 HydrophobicContact CD2-CE 4.43Å; V178-M187 HydrophobicContact CG1-CG 3.85Å; V178-M187 HydrophobicContact CG1-SD 3.94Å; I180-M187 HydrophobicContact CG1-CB 4.05Å; I180-M187 HydrophobicContact CG1-CG 3.82Å; M187-V198 CarbonylContact O-C 3.56Å; M187-V198 VanDerWaalsContact O-CA 3.3Å; M187-V198 WeakPolarHBondContact O-CA 3.24Å; M187-W199 HydrophobicContact CB-CE3 4.41Å; M187-W199 HydrophobicContact CE-CD2 3.77Å; M187-W199 HydrophobicContact CE-CE3 3.29Å; M187-W199 HydrophobicContact CE-CG 4.39Å; M187-W199 HydrophobicContact CE-CH2 4.23Å; M187-W199 HydrophobicContact CE-CZ3 3.55Å; M187-W199 HydrophobicContact CG-CE3 4.47Å; M187-W199 PolarHBondContact N-O 3.47Å; M187-W199 PolarHBondContact O-N 3.1Å; M187-L201 HydrophobicContact CB-CD1 4.27Å; M187-L201 HydrophobicContact CB-CD2 4.22Å; M187-L201 HydrophobicContact CB-CG 4.25Å; M187-L212 HydrophobicContact CB-CD2 4.04Å; M187-L212 HydrophobicContact CE-CD1 3.58Å; M187-L212 HydrophobicContact CE-CD2 3.72Å; M187-L212 HydrophobicContact CE-CG 4.34Å; M187-L212 HydrophobicContact SD-CD1 4.16Å; M187-L212 HydrophobicContact SD-CD2 3.85Å
188	A	98.8	Very high	97.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.9	172.4	0	0	0	0	0	110.5	V178 H179 Y197 V198 F230 L237	V178-A188 CarbonylContact C-O 3.55Å; V178-A188 VanDerWaalsContact CA-O 3.3Å; V178-A188 WeakPolarHBondContact CA-O 3.23Å; H179-A188 PolarHBondContact N-O 3.14Å; H179-A188 PolarHBondContact O-N 2.91Å; A188-Y197 CarbonylContact C-O 3.59Å; A188-Y197 VanDerWaalsContact CA-O 3.27Å; A188-Y197 WeakPolarHBondContact CA-O 3.29Å; A188-V198 HydrophobicContact CB-CG2 4.35Å; A188-F230 HydrophobicContact CB-CD2 4.49Å; A188-F230 HydrophobicContact CB-CE2 3.49Å; A188-F230 VanDerWaalsContact CB-CE2 3.49Å; A188-F230 HydrophobicContact CB-CZ 3.61Å; A188-L237 HydrophobicContact CB-CD1 3.84Å; A188-L237 HydrophobicContact CB-CD2 3.96Å
189	A	98.8	Very high	97.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.3	173.1	0	0	0	0	0	110.3	I154 I175 S177 V178 C196 Y197 W199	I154-A189 HydrophobicContact CD1-CB 3.56Å; I175-A189 HydrophobicContact CG2-CB 4.27Å; S177-A189 CarbonylContact O-C 3.56Å; S177-A189 WeakPolarHBondContact O-CA 3.28Å; V178-A189 HydrophobicContact CG2-CB 3.83Å; A189-C196 CarbonylContact O-C 3.56Å; A189-C196 WeakPolarHBondContact O-CA 3.38Å; A189-Y197 PolarHBondContact N-O 2.92Å; A189-Y197 PolarHBondContact O-N 2.7Å; A189-W199 HydrophobicContact CB-CH2 3.81Å; A189-W199 HydrophobicContact CB-CZ3 3.55Å
190	V	98.7	Very high	97.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.7	175.6	-68.8	0	0	0	0	111.4	N176 S177 N195 C196 C228 T239	N176-V190 PolarHBondContact N-O 3.21Å; S177-V190 PolarHBondContact N-O 3.2Å; S177-V190 PolarHBondContact O-N 2.93Å; V190-N195 WeakPolarHBondContact CA-O 3.4Å; V190-C196 HydrophobicContact CG1-CB 3.75Å; V190-C228 HydrophobicContact CG1-CB 3.7Å; V190-C228 HydrophobicContact CG2-CB 4.05Å; V190-T239 HydrophobicContact CG1-CG2 4.05Å
191	N	98.1	Very high	97.4	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	173.2	-176.2	79.9	1.2	0	0	0	113.5	E170 V173 S174 I175 S193 G194 N195 S225	E170-N191 PolarHBondContact OE2-ND2 2.76Å; V173-N191 HydrophobicContact CG1-CB 3.9Å; V173-N191 WeakPolarHBondContact CG1-ND2 3.45Å; S174-N191 CarbonylContact O-C 3.59Å; S174-N191 VanDerWaalsContact O-CA 3.23Å; S174-N191 WeakPolarHBondContact O-CA 3.32Å; S174-N191 WeakPolarHBondContact O-CB 3.36Å; I175-N191 HydrophobicContact CD1-CB 3.97Å; N191-S193 PolarHBondContact O-N 3.26Å; N191-S193 WeakPolarHBondContact OD1-CB 3.43Å; N191-S193 PolarHBondContact OD1-N 2.88Å; N191-S193 VanDerWaalsContact OD1-N 3.13Å; N191-G194 PolarHBondContact O-N 3.13Å; N191-G194 VanDerWaalsContact O-N 3.08Å; N191-G194 PolarHBondContact OD1-N 2.78Å; N191-N195 PolarHBondContact N-O 3.34Å; N191-N195 VanDerWaalsContact N-O 3.09Å; N191-N195 WeakPolarHBondContact OD1-CB 3.45Å; N191-N195 PolarHBondContact OD1-N 3.2Å; N191-N195 VanDerWaalsContact OD1-N 3.09Å; N191-S225 PolarHBondContact O-N 2.85Å
192	S	97.7	Very high	96.8	Very high	30 Å²	30	26 Å²	26	21%	0.21	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18	-178.4	-75.9	0	0	0	0	114.7	S174 N176 G194 Y224	S174-S192 PolarHBondContact O-N 2.74Å; N176-S192 PolarHBondContact ND2-N 3.15Å; N176-S192 PolarHBondContact ND2-OG 3.47Å; N176-S192 PolarHBondContact OD1-OG 3.15Å; N176-S192 VanDerWaalsContact OD1-OG 3.07Å; S192-G194 VanDerWaalsContact C-N 3.25Å; S192-G194 PolarHBondContact O-N 3.49Å; S192-Y224 WeakPolarHBondContact O-CA 3.31Å; S192-Y224 WeakPolarHBondContact O-CD1 3.45Å
193	S	97.4	Very high	95.9	Very high	59 Å²	59	25 Å²	25	41%	0.413	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-4.7	173.5	-64	0	0	0	0	113.5	V173 N191	V173-S193 VanDerWaalsContact CG1-OG 3.27Å; V173-S193 WeakPolarHBondContact CG1-OG 3.37Å; N191-S193 PolarHBondContact O-N 3.26Å; N191-S193 WeakPolarHBondContact OD1-CB 3.43Å; N191-S193 PolarHBondContact OD1-N 2.88Å; N191-S193 VanDerWaalsContact OD1-N 3.13Å
194	G	97.1	Very high	94.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	88.5	5.3	-178.3	0	0	0	0	0	114.1	N191 S192 A220 H221 R223 S225	N191-G194 PolarHBondContact O-N 3.13Å; N191-G194 VanDerWaalsContact O-N 3.08Å; N191-G194 PolarHBondContact OD1-N 2.78Å; S192-G194 VanDerWaalsContact C-N 3.25Å; S192-G194 PolarHBondContact O-N 3.49Å; G194-A220 PolarHBondContact O-N 2.88Å; G194-H221 PolarHBondContact O-N 2.59Å; G194-R223 VanDerWaalsContact CA-O 3.24Å; G194-R223 WeakPolarHBondContact CA-O 3.48Å; G194-S225 VanDerWaalsContact CA-OG 3.31Å; G194-S225 WeakPolarHBondContact CA-OG 3.27Å; G194-S225 PolarHBondContact O-OG 3.11Å
195	N	98.3	Very high	92.9	Very high	22 Å²	22	26.5 Å²	26.5	12%	0.118	16%	0.162	C	C	.	.			trans	-82	145.6	177.5	-63.7	-43.8	0	0	0	110.5	E170 V190 N191 Y197 K217	E170-N195 PolarHBondContact OE2-ND2 2.9Å; E170-N195 VanDerWaalsContact OE2-ND2 3.12Å; V190-N195 WeakPolarHBondContact CA-O 3.4Å; N191-N195 PolarHBondContact N-O 3.34Å; N191-N195 VanDerWaalsContact N-O 3.09Å; N191-N195 WeakPolarHBondContact OD1-CB 3.45Å; N191-N195 PolarHBondContact OD1-N 3.2Å; N191-N195 VanDerWaalsContact OD1-N 3.09Å; N195-Y197 HydrophobicContact CB-CD2 4.41Å; N195-Y197 HydrophobicContact CB-CE2 3.71Å; N195-K217 VanDerWaalsContact CG-CE 3.43Å; N195-K217 WeakPolarHBondContact ND2-CE 3.31Å; N195-K217 PolarHBondContact ND2-NZ 2.8Å
196	C	98.6	Very high	91.7	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.5	167.1	-173.7	0	0	0	0	108.7	A189 V190 I218 A220 T239	A189-C196 CarbonylContact O-C 3.56Å; A189-C196 WeakPolarHBondContact O-CA 3.38Å; V190-C196 HydrophobicContact CG1-CB 3.75Å; C196-I218 HydrophobicContact CB-CB 4.21Å; C196-I218 PolarHBondContact N-O 3.44Å; C196-I218 PolarHBondContact O-N 3.09Å; C196-A220 HydrophobicContact CB-CB 4.08Å; C196-T239 HydrophobicContact CB-CG2 4.37Å
197	Y	98.7	Very high	90.1	Very high	21 Å²	21	32.4 Å²	32.4	8%	0.082	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.9	175.9	-64.7	-89	0	0	0	108.9	P169 E170 A188 A189 N195 W199 K217	P169-Y197 HydrophobicContact CB-CD1 3.9Å; P169-Y197 HydrophobicContact CB-CD2 3.87Å; P169-Y197 HydrophobicContact CB-CE1 4.07Å; P169-Y197 HydrophobicContact CB-CE2 4.05Å; P169-Y197 HydrophobicContact CB-CG 3.8Å; E170-Y197 HydrophobicContact CB-CE2 4.46Å; E170-Y197 WeakPolarHBondContact CB-OH 3.43Å; E170-Y197 PolarHBondContact OE2-OH 3.4Å; A188-Y197 CarbonylContact C-O 3.59Å; A188-Y197 VanDerWaalsContact CA-O 3.27Å; A188-Y197 WeakPolarHBondContact CA-O 3.29Å; A189-Y197 PolarHBondContact N-O 2.92Å; A189-Y197 PolarHBondContact O-N 2.7Å; N195-Y197 HydrophobicContact CB-CD2 4.41Å; N195-Y197 HydrophobicContact CB-CE2 3.71Å; Y197-W199 HydrophobicContact CG-CH2 4.13Å; Y197-W199 HydrophobicContact CG-CZ2 4.42Å; Y197-W199 WeakPolarHBondContact O-CZ3 3.47Å; Y197-K217 HydrophobicContact CD1-CB 4.15Å; Y197-K217 HydrophobicContact CD1-CD 4.46Å; Y197-K217 HydrophobicContact CD1-CG 4.1Å; Y197-K217 HydrophobicContact CE1-CB 4.13Å; Y197-K217 HydrophobicContact CE1-CD 3.62Å; Y197-K217 HydrophobicContact CE1-CG 3.71Å; Y197-K217 VanDerWaalsContact OH-CE 3.26Å; Y197-K217 WeakPolarHBondContact OH-CE 3.34Å; Y197-K217 PolarHBondContact OH-NZ 2.85Å
198	V	98.6	Very high	88.8	Confident	2 Å²	2	39 Å²	39	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.7	178.2	-173.8	0	0	0	0	110.1	Y186 M187 A188 K215 T216 I218 L237 F254	Y186-V198 HydrophobicContact CD1-CG1 4.06Å; Y186-V198 HydrophobicContact CG-CG1 4.47Å; M187-V198 CarbonylContact O-C 3.56Å; M187-V198 VanDerWaalsContact O-CA 3.3Å; M187-V198 WeakPolarHBondContact O-CA 3.24Å; A188-V198 HydrophobicContact CB-CG2 4.35Å; V198-K215 WeakPolarHBondContact O-CA 3.15Å; V198-K215 WeakPolarHBondContact O-CB 3.4Å; V198-K215 PolarHBondContact O-N 3.23Å; V198-T216 HydrophobicContact CB-CG2 3.92Å; V198-T216 HydrophobicContact CG2-CG2 4.1Å; V198-T216 PolarHBondContact N-O 2.89Å; V198-T216 PolarHBondContact O-N 2.9Å; V198-I218 HydrophobicContact CG2-CD1 4.24Å; V198-L237 HydrophobicContact CG2-CD2 4.26Å; V198-F254 HydrophobicContact CB-CE1 4.27Å; V198-F254 HydrophobicContact CB-CZ 4.33Å; V198-F254 HydrophobicContact CG1-CE1 3.78Å; V198-F254 HydrophobicContact CG1-CE2 4.29Å; V198-F254 HydrophobicContact CG1-CZ 3.56Å; V198-F254 HydrophobicContact CG2-CD1 4.07Å; V198-F254 HydrophobicContact CG2-CE1 3.84Å; V198-F254 HydrophobicContact CG2-CZ 4.4Å
199	W	98.4	Very high	87.6	Confident	7 Å²	7	43 Å²	43	3%	0.027	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	143.6	175.1	-60.9	-99.5	0	0	0	109.6	I154 L167 P169 Y186 M187 A189 Y197 L212 I213 P214	I154-W199 HydrophobicContact CD1-CH2 3.71Å; I154-W199 HydrophobicContact CD1-CZ2 4.45Å; I154-W199 HydrophobicContact CD1-CZ3 4.19Å; L167-W199 HydrophobicContact CD2-CD2 4.34Å; L167-W199 HydrophobicContact CD2-CH2 4.49Å; L167-W199 HydrophobicContact CD2-CZ2 3.72Å; P169-W199 HydrophobicContact CB-CH2 4.13Å; P169-W199 HydrophobicContact CB-CZ2 3.89Å; P169-W199 HydrophobicContact CG-CH2 3.64Å; P169-W199 HydrophobicContact CG-CZ2 3.63Å; Y186-W199 VanDerWaalsContact CA-O 3.31Å; Y186-W199 WeakPolarHBondContact CA-O 3.35Å; M187-W199 HydrophobicContact CB-CE3 4.41Å; M187-W199 HydrophobicContact CE-CD2 3.77Å; M187-W199 HydrophobicContact CE-CE3 3.29Å; M187-W199 HydrophobicContact CE-CG 4.39Å; M187-W199 HydrophobicContact CE-CH2 4.23Å; M187-W199 HydrophobicContact CE-CZ3 3.55Å; M187-W199 HydrophobicContact CG-CE3 4.47Å; M187-W199 PolarHBondContact N-O 3.47Å; M187-W199 PolarHBondContact O-N 3.1Å; A189-W199 HydrophobicContact CB-CH2 3.81Å; A189-W199 HydrophobicContact CB-CZ3 3.55Å; Y197-W199 HydrophobicContact CG-CH2 4.13Å; Y197-W199 HydrophobicContact CG-CZ2 4.42Å; Y197-W199 WeakPolarHBondContact O-CZ3 3.47Å; W199-L212 HydrophobicContact CB-CB 4.28Å; W199-L212 HydrophobicContact CB-CD2 3.86Å; W199-L212 HydrophobicContact CG-CB 4.25Å; W199-L212 HydrophobicContact CG-CD2 4.3Å; W199-I213 CarbonylContact C-O 3.56Å; W199-I213 VanDerWaalsContact CA-O 3.25Å; W199-I213 WeakPolarHBondContact CA-O 3.46Å; W199-P214 VanDerWaalsContact CD1-CA 3.45Å
200	N	97.1	Very high	86.9	Confident	48 Å²	48	43.1 Å²	43.1	26%	0.257	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	138.5	158.7	-54.3	-75.3	0	0	0	107.7	Y186 I213 K215	Y186-N200 VanDerWaalsContact CE1-OD1 3.27Å; Y186-N200 WeakPolarHBondContact CE1-OD1 3.38Å; N200-I213 HydrophobicContact CB-CB 4.37Å; N200-I213 PolarHBondContact N-O 2.9Å; N200-I213 PolarHBondContact O-N 3.35Å; N200-K215 WeakPolarHBondContact OD1-CD 3.32Å; N200-K215 PolarHBondContact OD1-NZ 2.81Å
201	L	93.9	Very high	86.5	Confident	21 Å²	21	49.4 Å²	49.4	11%	0.11	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.6	168.5	-69	165	0	0	0	108.1	I180 A184 S185 M187 T210 L212	I180-L201 HydrophobicContact CB-CD1 4.41Å; I180-L201 HydrophobicContact CG1-CD1 4.21Å; I180-L201 HydrophobicContact CG2-CD1 3.42Å; I180-L201 VanDerWaalsContact CG2-CD1 3.42Å; A184-L201 VanDerWaalsContact O-CB 3.27Å; A184-L201 WeakPolarHBondContact O-CB 3.28Å; S185-L201 PolarHBondContact O-N 3.21Å; M187-L201 HydrophobicContact CB-CD1 4.27Å; M187-L201 HydrophobicContact CB-CD2 4.22Å; M187-L201 HydrophobicContact CB-CG 4.25Å; L201-T210 HydrophobicContact CD2-CG2 3.5Å; L201-T210 VanDerWaalsContact CD2-CG2 3.5Å; L201-L212 HydrophobicContact CD2-CD2 3.34Å; L201-L212 HydrophobicContact CD2-CG 4.46Å; L201-L212 HydrophobicContact CG-CD2 4.35Å
202	A	86.8	Confident	86.3	Confident	39 Å²	39	51 Å²	51	32%	0.322	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.3	173.4	0	0	0	0	0	109.4	Q211 I213	A202-Q211 PolarHBondContact N-O 3.09Å; A202-Q211 PolarHBondContact O-N 2.83Å; A202-I213 HydrophobicContact CB-CD1 3.99Å
203	G	74.7	Confident	86.2	Confident	46 Å²	46	53.3 Å²	53.3	47%	0.474	31%	0.309	S	S	.	.			trans	81.2	-153.4	-172.1	0	0	0	0	0	112	M205	G203-M205 PolarHBondContact O-N 3.23Å
204	G	64.9	Low	86.2	Confident	4 Å²	4	55.3 Å²	55.3	4%	0.041	32%	0.32	C	S	.	.			trans	83.9	3	175.7	0	0	0	0	0	115.8	N141 E208 T210	N141-G204 WeakPolarHBondContact CB-O 3.36Å; N141-G204 PolarHBondContact ND2-O 2.85Å; G204-E208 WeakPolarHBondContact CA-O 3.3Å; G204-E208 PolarHBondContact N-O 2.93Å; G204-T210 WeakPolarHBondContact CA-OG1 3.34Å
205	M	63.5	Low	86.2	Confident	169 Å²	169	59.3 Å²	59.3	83%	0.833	34%	0.338	S	S	*	.	S	Bend	trans	-96.1	126.9	167.2	-74	-165.1	-179.9	0	0	110.5	G203 D207	G203-M205 PolarHBondContact O-N 3.23Å; M205-D207 PolarHBondContact O-N 2.83Å
206	G	68.3	Low	86.1	Confident	59 Å²	59	60.8 Å²	60.8	61%	0.608	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-115.1	178.4	0	0	0	0	0	113.2	K160	K160-G206 PolarHBondContact NZ-O 3.09Å
207	D	64.9	Low	86.1	Confident	153 Å²	153	65.7 Å²	65.7	82%	0.818	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	2.8	-177.1	-65.3	-26	0	0	0	112.8	K160 M205	K160-D207 IonicContact NZ-OD1 3.95Å; M205-D207 PolarHBondContact O-N 2.83Å
208	E	71.1	Confident	86.1	Confident	139 Å²	139	65.2 Å²	65.2	65%	0.65	37%	0.368	S	S	*	.	S	Bend	trans	-78.6	131.3	176.1	-68.4	-171.8	170.6	0	0	111.2	G204	G204-E208 WeakPolarHBondContact CA-O 3.3Å; G204-E208 PolarHBondContact N-O 2.93Å
209	V	73.3	Confident	86	Confident	83 Å²	83	70 Å²	70	50%	0.503	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-63.8	132.7	177.7	-176.9	0	0	0	0	110.2	Q211	V209-Q211 PolarHBondContact O-N 2.84Å
210	T	85.8	Confident	85.9	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.018	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-68.7	118.8	174.9	-65.4	0	0	0	0	110.8	E144 L201 G204	E144-T210 VanDerWaalsContact CD-OG1 3.23Å; E144-T210 VanDerWaalsContact OE1-CB 3.27Å; E144-T210 WeakPolarHBondContact OE1-CB 3.32Å; E144-T210 PolarHBondContact OE1-N 2.93Å; E144-T210 PolarHBondContact OE1-OG1 3.17Å; E144-T210 VanDerWaalsContact OE1-OG1 3.11Å; E144-T210 VanDerWaalsContact OE2-CB 3.31Å; E144-T210 WeakPolarHBondContact OE2-CB 2.91Å; E144-T210 PolarHBondContact OE2-OG1 3.18Å; L201-T210 HydrophobicContact CD2-CG2 3.5Å; L201-T210 VanDerWaalsContact CD2-CG2 3.5Å; G204-T210 WeakPolarHBondContact CA-OG1 3.34Å
211	Q	89.1	Confident	86	Confident	131 Å²	131	67.9 Å²	67.9	61%	0.612	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.4	175.1	-64.5	-164.9	2.1	0	0	111.3	A202 V209	A202-Q211 PolarHBondContact N-O 3.09Å; A202-Q211 PolarHBondContact O-N 2.83Å; V209-Q211 PolarHBondContact O-N 2.84Å
212	L	94.1	Very high	86	Confident	34 Å²	34	76.6 Å²	76.6	18%	0.178	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	112.1	174.2	-69.6	174.6	0	0	0	111.1	I156 L167 M187 W199 L201	I156-L212 HydrophobicContact CD1-CD1 3.37Å; I156-L212 HydrophobicContact CD1-CG 4.06Å; I156-L212 HydrophobicContact CG1-CD1 4.19Å; L167-L212 HydrophobicContact CD2-CB 4.46Å; L167-L212 HydrophobicContact CD2-CD1 3.6Å; M187-L212 HydrophobicContact CB-CD2 4.04Å; M187-L212 HydrophobicContact CE-CD1 3.58Å; M187-L212 HydrophobicContact CE-CD2 3.72Å; M187-L212 HydrophobicContact CE-CG 4.34Å; M187-L212 HydrophobicContact SD-CD1 4.16Å; M187-L212 HydrophobicContact SD-CD2 3.85Å; W199-L212 HydrophobicContact CB-CB 4.28Å; W199-L212 HydrophobicContact CB-CD2 3.86Å; W199-L212 HydrophobicContact CG-CB 4.25Å; W199-L212 HydrophobicContact CG-CD2 4.3Å; L201-L212 HydrophobicContact CD2-CD2 3.34Å; L201-L212 HydrophobicContact CD2-CG 4.46Å; L201-L212 HydrophobicContact CG-CD2 4.35Å
213	I	95.6	Very high	86.5	Confident	80 Å²	80	79.4 Å²	79.4	41%	0.41	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	111.5	178.7	-54.6	169.6	0	0	0	108.7	W199 N200 A202 K215	W199-I213 CarbonylContact C-O 3.56Å; W199-I213 VanDerWaalsContact CA-O 3.25Å; W199-I213 WeakPolarHBondContact CA-O 3.46Å; N200-I213 HydrophobicContact CB-CB 4.37Å; N200-I213 PolarHBondContact N-O 2.9Å; N200-I213 PolarHBondContact O-N 3.35Å; A202-I213 HydrophobicContact CB-CD1 3.99Å; I213-K215 PolarHBondContact O-N 3.03Å
214	P	97	Very high	87.5	Confident	101 Å²	101	82.8 Å²	82.8	66%	0.656	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.7	125.3	-179.6	-23.9	32.9	0	0	0	111.6	W199	W199-P214 VanDerWaalsContact CD1-CA 3.45Å
215	K	96.8	Very high	89	Confident	84 Å²	84	82.6 Å²	82.6	37%	0.365	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-56.4	-177.7	-175.1	173.3	-165.9	151.3	0	112.3	Y186 V198 N200 I213 F254	Y186-K215 HydrophobicContact CD1-CD 4.22Å; Y186-K215 HydrophobicContact CE1-CD 3.63Å; Y186-K215 PolarHBondContact OH-NZ 2.83Å; V198-K215 WeakPolarHBondContact O-CA 3.15Å; V198-K215 WeakPolarHBondContact O-CB 3.4Å; V198-K215 PolarHBondContact O-N 3.23Å; N200-K215 WeakPolarHBondContact OD1-CD 3.32Å; N200-K215 PolarHBondContact OD1-NZ 2.81Å; I213-K215 PolarHBondContact O-N 3.03Å; K215-F254 HydrophobicContact CD-CD2 4.48Å; K215-F254 HydrophobicContact CD-CE2 3.66Å; K215-F254 HydrophobicContact CD-CZ 4.39Å
216	T	97.7	Very high	90.7	Very high	53 Å²	53	75.8 Å²	75.8	33%	0.325	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	153.7	-176.4	-169.9	0	0	0	0	112.4	V198 I218 F254	V198-T216 HydrophobicContact CB-CG2 3.92Å; V198-T216 HydrophobicContact CG2-CG2 4.1Å; V198-T216 PolarHBondContact N-O 2.89Å; V198-T216 PolarHBondContact O-N 2.9Å; T216-I218 HydrophobicContact CG2-CD1 4.44Å; T216-I218 HydrophobicContact CG2-CG1 4.08Å; T216-F254 HydrophobicContact CG2-CB 4.03Å; T216-F254 HydrophobicContact CG2-CD1 4.38Å; T216-F254 HydrophobicContact CG2-CD2 3.66Å; T216-F254 HydrophobicContact CG2-CE2 4.29Å; T216-F254 HydrophobicContact CG2-CG 3.73Å
217	K	97.9	Very high	92.1	Very high	103 Å²	103	74.7 Å²	74.7	45%	0.448	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	116.6	168.5	175.7	-177.6	178.5	158.5	0	108	E170 N195 Y197	E170-K217 IonicContact OE2-NZ 2.78Å; N195-K217 VanDerWaalsContact CG-CE 3.43Å; N195-K217 WeakPolarHBondContact ND2-CE 3.31Å; N195-K217 PolarHBondContact ND2-NZ 2.8Å; Y197-K217 HydrophobicContact CD1-CB 4.15Å; Y197-K217 HydrophobicContact CD1-CD 4.46Å; Y197-K217 HydrophobicContact CD1-CG 4.1Å; Y197-K217 HydrophobicContact CE1-CB 4.13Å; Y197-K217 HydrophobicContact CE1-CD 3.62Å; Y197-K217 HydrophobicContact CE1-CG 3.71Å; Y197-K217 VanDerWaalsContact OH-CE 3.26Å; Y197-K217 WeakPolarHBondContact OH-CE 3.34Å; Y197-K217 PolarHBondContact OH-NZ 2.85Å
218	I	98.1	Very high	93.7	Very high	10 Å²	10	67.4 Å²	67.4	5%	0.051	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.5	178.8	-49	168.6	0	0	0	107.8	C196 V198 T216 A220 W249 F254	C196-I218 HydrophobicContact CB-CB 4.21Å; C196-I218 PolarHBondContact N-O 3.44Å; C196-I218 PolarHBondContact O-N 3.09Å; V198-I218 HydrophobicContact CG2-CD1 4.24Å; T216-I218 HydrophobicContact CG2-CD1 4.44Å; T216-I218 HydrophobicContact CG2-CG1 4.08Å; I218-A220 HydrophobicContact CG2-CB 4.28Å; I218-A220 PolarHBondContact O-N 2.97Å; I218-W249 HydrophobicContact CG2-CD2 4.19Å; I218-W249 HydrophobicContact CG2-CE3 3.79Å; I218-W249 HydrophobicContact CG2-CH2 3.55Å; I218-W249 HydrophobicContact CG2-CZ2 3.96Å; I218-W249 HydrophobicContact CG2-CZ3 3.45Å; I218-W249 VanDerWaalsContact CG2-CZ3 3.45Å; I218-F254 HydrophobicContact CD1-CB 3.75Å; I218-F254 HydrophobicContact CD1-CD1 3.84Å; I218-F254 HydrophobicContact CD1-CG 4.11Å; I218-F254 HydrophobicContact CG1-CB 4.24Å
219	P	97.5	Very high	95	Very high	103 Å²	103	62.5 Å²	62.5	67%	0.669	31%	0.306	S	S	*	.			trans	-73.4	72.9	168.2	31.4	-33.7	0	0	0	109.2
220	A	96.8	Very high	96.2	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.284	C	S	.	.			trans	-66.5	-44.6	-166.4	0	0	0	0	0	112.1	G194 C196 I218 K247 W249	G194-A220 PolarHBondContact O-N 2.88Å; C196-A220 HydrophobicContact CB-CB 4.08Å; I218-A220 HydrophobicContact CG2-CB 4.28Å; I218-A220 PolarHBondContact O-N 2.97Å; A220-K247 WeakPolarHBondContact O-CD 3.41Å; A220-K247 PolarHBondContact O-NZ 2.93Å; A220-W249 HydrophobicContact CB-CH2 4.36Å; A220-W249 HydrophobicContact CB-CZ2 3.63Å
221	H	97.8	Very high	96.8	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.046	28%	0.283	C	S	.	.			trans	-137.1	157.4	-174.1	-63.3	-84.2	0	0	0	112.2	G194 S225 T239 S241 D243 T245	G194-H221 PolarHBondContact O-N 2.59Å; H221-S225 PolarHBondContact CD2-OG 3.34Å; H221-T239 PolarHBondContact NE2-O 2.91Å; H221-T239 PolarHBondContact NE2-OG1 3.14Å; H221-S241 WeakPolarHBondContact CB-OG 3.24Å; H221-S241 WeakPolarHBondContact ND1-CB 3.37Å; H221-D243 IonicContact CE1-OD1 3.77Å; H221-D243 IonicContact CG-OD2 3.85Å; H221-D243 IonicContact ND1-OD1 3.7Å; H221-D243 PolarHBondContact ND1-OD1 3.49Å; H221-D243 IonicContact ND1-OD2 2.92Å; H221-D243 PolarHBondContact ND1-OD2 3.02Å; H221-T245 PolarHBondContact CE1-OG1 2.93Å; H221-T245 PolarHBondContact ND1-OG1 2.83Å
222	K	95	Very high	97.2	Very high	205 Å²	205	55.1 Å²	55.1	89%	0.891	27%	0.271	S	S	*	.	S	Bend	trans	-89.3	-11.9	176	-67.7	-177.6	-179.5	-179.9	0	113.2
223	R	96.2	Very high	97.3	Very high	98 Å²	98	56.6 Å²	56.6	37%	0.37	28%	0.279	S	S	.	.	S	Bend	trans	-124	178.5	176.9	-61.2	-174.1	69.7	-173.6	8.6	108.7	G194 S225 S241 A242 D243	G194-R223 VanDerWaalsContact CA-O 3.24Å; G194-R223 WeakPolarHBondContact CA-O 3.48Å; R223-S225 PolarHBondContact O-N 2.94Å; R223-S241 PolarHBondContact O-OG 3.42Å; R223-A242 HydrophobicContact CB-CB 4.17Å; R223-A242 PolarHBondContact NH1-O 3.38Å; R223-D243 HydrophobicContact CB-CB 4.14Å; R223-D243 HydrophobicContact CG-CB 4.11Å
224	Y	95.5	Very high	97.4	Very high	117 Å²	117	53.2 Å²	53.2	46%	0.459	26%	0.262	S	S	.	.			trans	-43.1	120.9	175.8	-51.2	-80.6	0	0	0	112.2	S192 S241 A242	S192-Y224 WeakPolarHBondContact O-CA 3.31Å; S192-Y224 WeakPolarHBondContact O-CD1 3.45Å; Y224-S241 VanDerWaalsContact O-CA 3.29Å; Y224-S241 WeakPolarHBondContact O-CA 3.38Å; Y224-S241 WeakPolarHBondContact O-CB 3.31Å; Y224-S241 PolarHBondContact O-OG 2.91Å; Y224-A242 HydrophobicContact CD2-CB 4.16Å; Y224-A242 PolarHBondContact O-N 2.78Å
225	S	97.6	Very high	97.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.2	164.9	-69.4	0	0	0	0	107.9	N176 N191 G194 H221 R223 C240	N176-S225 WeakPolarHBondContact CB-O 3.39Å; N176-S225 PolarHBondContact ND2-O 3.01Å; N191-S225 PolarHBondContact O-N 2.85Å; G194-S225 VanDerWaalsContact CA-OG 3.31Å; G194-S225 WeakPolarHBondContact CA-OG 3.27Å; G194-S225 PolarHBondContact O-OG 3.11Å; H221-S225 PolarHBondContact CD2-OG 3.34Å; R223-S225 PolarHBondContact O-N 2.94Å; S225-C240 CarbonylContact C-O 3.54Å; S225-C240 WeakPolarHBondContact CA-O 3.33Å
226	L	98.3	Very high	97.6	Very high	26 Å²	26	47.9 Å²	47.9	14%	0.136	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-39.2	-169.5	-62.7	174.3	0	0	0	111.9	C240 A242 W274 M275 W276	L226-C240 PolarHBondContact N-O 3.38Å; L226-A242 HydrophobicContact CD1-CB 4.39Å; L226-W274 HydrophobicContact CD1-CB 3.9Å; L226-W274 HydrophobicContact CD1-CD2 4.46Å; L226-W274 HydrophobicContact CD1-CE3 3.96Å; L226-W274 HydrophobicContact CD1-CG 4.49Å; L226-W274 HydrophobicContact CD2-CE3 4.48Å; L226-M275 WeakPolarHBondContact CD1-O 3.21Å; L226-W276 HydrophobicContact CD1-CD2 4.13Å; L226-W276 HydrophobicContact CD1-CE3 3.92Å; L226-W276 HydrophobicContact CD1-CZ3 4.26Å; L226-W276 HydrophobicContact CD2-CE3 4.49Å; L226-W276 HydrophobicContact CD2-CZ3 4.24Å
227	R	98.5	Very high	97.6	Very high	35 Å²	35	45.3 Å²	45.3	13%	0.132	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	145.7	-177.1	-166	75.7	156.5	168.1	-1.9	111	K229 T239 C240 W276 D277	R227-K229 HydrophobicContact CG-CG 4.32Å; R227-K229 VanDerWaalsContact NH2-CE 3.29Å; R227-T239 CarbonylContact O-C 3.58Å; R227-T239 WeakPolarHBondContact O-CA 3.35Å; R227-C240 HydrophobicContact CB-CB 4.15Å; R227-C240 PolarHBondContact O-N 2.95Å; R227-W276 WeakPolarHBondContact CB-O 3.26Å; R227-D277 WeakPolarHBondContact CD-OD1 3.12Å; R227-D277 WeakPolarHBondContact CG-OD1 3.32Å; R227-D277 IonicContact CZ-OD1 3Å; R227-D277 IonicContact NE-OD1 3.77Å; R227-D277 PolarHBondContact NE-OD1 2.9Å; R227-D277 IonicContact NH2-OD1 3.92Å
228	C	98.6	Very high	97.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.4	162	60.3	0	0	0	0	110.3	S177 V190 L237 A238 T239	S177-C228 PolarHBondContact OG-N 3.18Å; S177-C228 PolarHBondContact OG-O 3.36Å; V190-C228 HydrophobicContact CG1-CB 3.7Å; V190-C228 HydrophobicContact CG2-CB 4.05Å; C228-L237 HydrophobicContact CB-CD1 4.23Å; C228-A238 CarbonylContact C-O 3.51Å; C228-A238 WeakPolarHBondContact CA-O 3.21Å; C228-T239 HydrophobicContact CB-CG2 4.25Å
229	K	98.6	Very high	97.7	Very high	36 Å²	36	40 Å²	40	16%	0.157	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	132.6	177.3	-75.1	-64.1	-170.8	160.3	0	109.9	H179 R227 A238	H179-K229 HydrophobicContact CB-CD 4.5Å; H179-K229 WeakPolarHBondContact CD2-CD 3.35Å; H179-K229 PolarHBondContact CD2-NZ 3.3Å; H179-K229 VanDerWaalsContact CD2-NZ 3.32Å; H179-K229 VanDerWaalsContact NE2-CD 3.29Å; H179-K229 WeakPolarHBondContact NE2-CD 3.37Å; H179-K229 PolarHBondContact NE2-NZ 2.8Å; R227-K229 HydrophobicContact CG-CG 4.32Å; R227-K229 VanDerWaalsContact NH2-CE 3.29Å; K229-A238 PolarHBondContact N-O 3.36Å; K229-A238 PolarHBondContact O-N 2.91Å
230	F	98.8	Very high	97.7	Very high	9 Å²	9	35 Å²	35	4%	0.039	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	152.8	167	-75.1	-78.1	0	0	0	110.2	H179 D181 A188 L236 L237 T251	H179-F230 HydrophobicContact CB-CD2 4.32Å; H179-F230 AromaticContact ND1-CD2 3.92Å; H179-F230 PolarHBondContact ND1-N 3.26Å; H179-F230 WeakPolarHBondContact O-CE2 3.47Å; D181-F230 HydrophobicContact CB-CB 3.72Å; D181-F230 HydrophobicContact CB-CD1 3.99Å; D181-F230 HydrophobicContact CB-CD2 3.81Å; D181-F230 HydrophobicContact CB-CE2 4.39Å; D181-F230 HydrophobicContact CB-CG 3.58Å; A188-F230 HydrophobicContact CB-CD2 4.49Å; A188-F230 HydrophobicContact CB-CE2 3.49Å; A188-F230 VanDerWaalsContact CB-CE2 3.49Å; A188-F230 HydrophobicContact CB-CZ 3.61Å; F230-L236 WeakPolarHBondContact CA-O 3.31Å; F230-L236 WeakPolarHBondContact CD1-O 3.4Å; F230-L237 HydrophobicContact CD1-CB 3.99Å; F230-L237 HydrophobicContact CD1-CD1 4.02Å; F230-L237 HydrophobicContact CD2-CD1 4.27Å; F230-L237 HydrophobicContact CE1-CB 3.91Å; F230-L237 HydrophobicContact CE1-CD1 3.97Å; F230-L237 HydrophobicContact CE1-CD2 4.35Å; F230-L237 HydrophobicContact CE1-CG 4.29Å; F230-L237 HydrophobicContact CE2-CD1 4.23Å; F230-L237 HydrophobicContact CG-CD1 4.17Å; F230-L237 HydrophobicContact CZ-CD1 4.07Å; F230-L237 HydrophobicContact CZ-CD2 4.44Å; F230-T251 HydrophobicContact CD1-CG2 3.89Å; F230-T251 HydrophobicContact CE1-CG2 3.73Å
231	S	98.3	Very high	97.8	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.			trans	-75.2	154.9	170.7	60.6	0	0	0	0	111.4	D233 S234 T235 L236 S284	S231-D233 VanDerWaalsContact CB-OD1 3.26Å; S231-D233 WeakPolarHBondContact CB-OD1 3.39Å; S231-D233 PolarHBondContact O-N 2.96Å; S231-D233 PolarHBondContact OG-OD1 2.81Å; S231-S234 PolarHBondContact O-N 3.4Å; S231-T235 PolarHBondContact OG-N 3.47Å; S231-L236 PolarHBondContact N-O 2.8Å; S231-L236 WeakPolarHBondContact OG-CB 3.25Å; S231-L236 PolarHBondContact OG-N 3.27Å; S231-L236 PolarHBondContact OG-O 3.45Å; S231-S284 WeakPolarHBondContact CB-OG 3.33Å
232	P	96.8	Very high	97.8	Very high	54 Å²	54	34.6 Å²	34.6	35%	0.351	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.9	-179.8	-31.4	38.4	0	0	0	115	S234 F280 S281 S284	P232-S234 VanDerWaalsContact C-N 3.28Å; P232-S234 PolarHBondContact O-N 3.2Å; P232-F280 HydrophobicContact CG-CB 4.43Å; P232-S281 WeakPolarHBondContact CG-O 3.48Å; P232-S284 WeakPolarHBondContact CD-OG 3.48Å
233	D	96.6	Very high	97.8	Very high	65 Å²	65	25.6 Å²	25.6	35%	0.348	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	6.1	176.2	70.9	-21.9	0	0	0	114	S231 T235 S284	S231-D233 VanDerWaalsContact CB-OD1 3.26Å; S231-D233 WeakPolarHBondContact CB-OD1 3.39Å; S231-D233 PolarHBondContact O-N 2.96Å; S231-D233 PolarHBondContact OG-OD1 2.81Å; D233-T235 HydrophobicContact CB-CG2 4.29Å; D233-T235 WeakPolarHBondContact O-CG2 3.29Å; D233-T235 PolarHBondContact O-N 2.93Å; D233-T235 PolarHBondContact OD1-N 2.85Å; D233-T235 PolarHBondContact OD1-OG1 2.81Å; D233-T235 WeakPolarHBondContact OD2-CB 3.47Å; D233-T235 VanDerWaalsContact OD2-CG2 3.29Å; D233-T235 WeakPolarHBondContact OD2-CG2 3.42Å; D233-T235 PolarHBondContact OD2-OG1 2.95Å; D233-S284 PolarHBondContact N-OG 3.02Å; D233-S284 WeakPolarHBondContact OD1-CB 3.31Å; D233-S284 PolarHBondContact OD1-OG 2.89Å
234	S	97.8	Very high	97.8	Very high	8 Å²	8	22.2 Å²	22.2	6%	0.056	11%	0.111	C	C	.	.	S	Bend	trans	57.4	11	-178.1	-71.7	0	0	0	0	115.5	D181 D183 S231 P232 T251	D181-S234 VanDerWaalsContact CB-OG 3.31Å; D181-S234 WeakPolarHBondContact CB-OG 3.36Å; D181-S234 VanDerWaalsContact OD2-CB 3.25Å; D181-S234 WeakPolarHBondContact OD2-CB 3.1Å; D181-S234 PolarHBondContact OD2-OG 2.8Å; D183-S234 PolarHBondContact N-OG 2.99Å; S231-S234 PolarHBondContact O-N 3.4Å; P232-S234 VanDerWaalsContact C-N 3.28Å; P232-S234 PolarHBondContact O-N 3.2Å; S234-T251 WeakPolarHBondContact O-CB 3.27Å; S234-T251 VanDerWaalsContact O-CG2 3.31Å; S234-T251 WeakPolarHBondContact O-CG2 3.34Å; S234-T251 PolarHBondContact O-OG1 3.1Å
235	T	98.3	Very high	97.9	Very high	61 Å²	61	16.6 Å²	16.6	37%	0.374	9%	0.089	S	C	.	.	S	Bend	trans	-89.6	-18.6	-176.9	72.5	0	0	0	0	113.8	S231 D233 T251	S231-T235 PolarHBondContact OG-N 3.47Å; D233-T235 HydrophobicContact CB-CG2 4.29Å; D233-T235 WeakPolarHBondContact O-CG2 3.29Å; D233-T235 PolarHBondContact O-N 2.93Å; D233-T235 PolarHBondContact OD1-N 2.85Å; D233-T235 PolarHBondContact OD1-OG1 2.81Å; D233-T235 WeakPolarHBondContact OD2-CB 3.47Å; D233-T235 VanDerWaalsContact OD2-CG2 3.29Å; D233-T235 WeakPolarHBondContact OD2-CG2 3.42Å; D233-T235 PolarHBondContact OD2-OG1 2.95Å; T235-T251 VanDerWaalsContact C-OG1 3.28Å; T235-T251 WeakPolarHBondContact CA-OG1 3.49Å; T235-T251 PolarHBondContact O-N 2.85Å; T235-T251 PolarHBondContact O-OG1 2.89Å; T235-T251 VanDerWaalsContact O-OG1 3.09Å
236	L	98.6	Very high	97.9	Very high	12 Å²	12	16.6 Å²	16.6	6%	0.063	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.9	-175.6	-53.9	172.6	0	0	0	112.4	F230 S231 I248 W249 M257 F280 V301	F230-L236 WeakPolarHBondContact CA-O 3.31Å; F230-L236 WeakPolarHBondContact CD1-O 3.4Å; S231-L236 PolarHBondContact N-O 2.8Å; S231-L236 WeakPolarHBondContact OG-CB 3.25Å; S231-L236 PolarHBondContact OG-N 3.27Å; S231-L236 PolarHBondContact OG-O 3.45Å; L236-I248 HydrophobicContact CB-CG2 4.05Å; L236-I248 HydrophobicContact CD1-CG2 4.13Å; L236-I248 HydrophobicContact CD2-CG2 4.08Å; L236-I248 HydrophobicContact CG-CG2 4.33Å; L236-W249 CarbonylContact C-O 3.59Å; L236-W249 WeakPolarHBondContact CA-O 3.36Å; L236-M257 HydrophobicContact CD2-SD 3.62Å; L236-F280 HydrophobicContact CB-CE1 4.34Å; L236-F280 HydrophobicContact CB-CZ 4.02Å; L236-F280 HydrophobicContact CD1-CE1 4.05Å; L236-V301 HydrophobicContact CD1-CG1 3.46Å; L236-V301 VanDerWaalsContact CD1-CG1 3.46Å
237	L	98.8	Very high	98	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124	170.7	172.8	63.3	0	0	0	108.2	A188 V198 C228 F230 T239 I248 W249 F254	A188-L237 HydrophobicContact CB-CD1 3.84Å; A188-L237 HydrophobicContact CB-CD2 3.96Å; V198-L237 HydrophobicContact CG2-CD2 4.26Å; C228-L237 HydrophobicContact CB-CD1 4.23Å; F230-L237 HydrophobicContact CD1-CB 3.99Å; F230-L237 HydrophobicContact CD1-CD1 4.02Å; F230-L237 HydrophobicContact CD2-CD1 4.27Å; F230-L237 HydrophobicContact CE1-CB 3.91Å; F230-L237 HydrophobicContact CE1-CD1 3.97Å; F230-L237 HydrophobicContact CE1-CD2 4.35Å; F230-L237 HydrophobicContact CE1-CG 4.29Å; F230-L237 HydrophobicContact CE2-CD1 4.23Å; F230-L237 HydrophobicContact CG-CD1 4.17Å; F230-L237 HydrophobicContact CZ-CD1 4.07Å; F230-L237 HydrophobicContact CZ-CD2 4.44Å; L237-T239 HydrophobicContact CG-CG2 4.4Å; L237-I248 CarbonylContact O-C 3.57Å; L237-I248 WeakPolarHBondContact O-CA 2.94Å; L237-W249 HydrophobicContact CB-CB 4.39Å; L237-W249 PolarHBondContact N-O 3.39Å; L237-W249 VanDerWaalsContact O-CD1 3.26Å; L237-W249 PolarHBondContact O-N 3.4Å; L237-F254 HydrophobicContact CD2-CE1 4.5Å
238	A	98.8	Very high	98	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	140.1	171.2	0	0	0	0	0	110.6	C228 K229 K247 F280 I287	C228-A238 CarbonylContact C-O 3.51Å; C228-A238 WeakPolarHBondContact CA-O 3.21Å; K229-A238 PolarHBondContact N-O 3.36Å; K229-A238 PolarHBondContact O-N 2.91Å; A238-K247 CarbonylContact C-O 3.52Å; A238-K247 WeakPolarHBondContact CA-O 3.4Å; A238-F280 HydrophobicContact CB-CE2 3.56Å; A238-F280 HydrophobicContact CB-CZ 3.74Å; A238-I287 HydrophobicContact CB-CD1 3.57Å
239	T	98.8	Very high	98	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	123.2	172.6	60.8	0	0	0	0	110.4	V190 C196 H221 R227 C228 L237 C246 K247 W249	V190-T239 HydrophobicContact CG1-CG2 4.05Å; C196-T239 HydrophobicContact CB-CG2 4.37Å; H221-T239 PolarHBondContact NE2-O 2.91Å; H221-T239 PolarHBondContact NE2-OG1 3.14Å; R227-T239 CarbonylContact O-C 3.58Å; R227-T239 WeakPolarHBondContact O-CA 3.35Å; C228-T239 HydrophobicContact CB-CG2 4.25Å; L237-T239 HydrophobicContact CG-CG2 4.4Å; T239-C246 CarbonylContact O-C 3.59Å; T239-C246 VanDerWaalsContact O-CA 3.26Å; T239-C246 WeakPolarHBondContact O-CA 3.15Å; T239-K247 PolarHBondContact N-O 3.34Å; T239-K247 PolarHBondContact O-N 3.01Å; T239-K247 PolarHBondContact OG1-O 3.47Å; T239-W249 PolarHBondContact OG1-NE1 3.38Å
240	C	98.6	Very high	98	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	147.2	177.5	-65.5	0	0	0	0	111.3	S225 L226 R227 M275 C278	S225-C240 CarbonylContact C-O 3.54Å; S225-C240 WeakPolarHBondContact CA-O 3.33Å; L226-C240 PolarHBondContact N-O 3.38Å; R227-C240 HydrophobicContact CB-CB 4.15Å; R227-C240 PolarHBondContact O-N 2.95Å; C240-M275 HydrophobicContact CB-CB 4.17Å; C240-M275 HydrophobicContact CB-CG 3.95Å; C240-M275 WeakPolarHBondContact CB-O 3.11Å; C240-C278 VanDerWaalsContact SG-CB 3.52Å
241	S	98.3	Very high	97.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	158.3	-175.4	178.3	0	0	0	0	115	H221 R223 Y224 D243 Q244 T245 M275	H221-S241 WeakPolarHBondContact CB-OG 3.24Å; H221-S241 WeakPolarHBondContact ND1-CB 3.37Å; R223-S241 PolarHBondContact O-OG 3.42Å; Y224-S241 VanDerWaalsContact O-CA 3.29Å; Y224-S241 WeakPolarHBondContact O-CA 3.38Å; Y224-S241 WeakPolarHBondContact O-CB 3.31Å; Y224-S241 PolarHBondContact O-OG 2.91Å; S241-D243 WeakPolarHBondContact CB-OD1 3.32Å; S241-D243 PolarHBondContact O-N 3.39Å; S241-D243 PolarHBondContact OG-N 3.03Å; S241-D243 VanDerWaalsContact OG-N 3.13Å; S241-D243 PolarHBondContact OG-OD1 3.46Å; S241-Q244 PolarHBondContact O-N 2.99Å; S241-T245 PolarHBondContact N-O 3Å; S241-M275 PolarHBondContact N-O 2.96Å; S241-M275 WeakPolarHBondContact O-CB 3.44Å; S241-M275 PolarHBondContact O-N 2.91Å; S241-M275 VanDerWaalsContact O-N 3.1Å
242	A	97.1	Very high	97.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-10.4	166.6	0	0	0	0	0	114	R223 Y224 L226 Q244 W274	R223-A242 HydrophobicContact CB-CB 4.17Å; R223-A242 PolarHBondContact NH1-O 3.38Å; Y224-A242 HydrophobicContact CD2-CB 4.16Å; Y224-A242 PolarHBondContact O-N 2.78Å; L226-A242 HydrophobicContact CD1-CB 4.39Å; A242-Q244 PolarHBondContact O-N 3.5Å; A242-W274 HydrophobicContact CB-CB 4.41Å; A242-W274 HydrophobicContact CB-CD2 3.6Å; A242-W274 HydrophobicContact CB-CE3 4.12Å; A242-W274 HydrophobicContact CB-CG 3.71Å; A242-W274 HydrophobicContact CB-CZ2 4.35Å
243	D	95.3	Very high	97.8	Very high	17 Å²	17	24.9 Å²	24.9	9%	0.091	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	9	170.2	74.2	7.2	0	0	0	114.2	H221 R223 S241 T245 K263	H221-D243 IonicContact CE1-OD1 3.77Å; H221-D243 IonicContact CG-OD2 3.85Å; H221-D243 IonicContact ND1-OD1 3.7Å; H221-D243 PolarHBondContact ND1-OD1 3.49Å; H221-D243 IonicContact ND1-OD2 2.92Å; H221-D243 PolarHBondContact ND1-OD2 3.02Å; R223-D243 HydrophobicContact CB-CB 4.14Å; R223-D243 HydrophobicContact CG-CB 4.11Å; S241-D243 WeakPolarHBondContact CB-OD1 3.32Å; S241-D243 PolarHBondContact O-N 3.39Å; S241-D243 PolarHBondContact OG-N 3.03Å; S241-D243 VanDerWaalsContact OG-N 3.13Å; S241-D243 PolarHBondContact OG-OD1 3.46Å; D243-T245 VanDerWaalsContact C-N 3.28Å; D243-T245 WeakPolarHBondContact OD1-CB 3.42Å; D243-T245 PolarHBondContact OD1-N 3Å; D243-T245 VanDerWaalsContact OD1-N 3.08Å; D243-T245 PolarHBondContact OD1-OG1 2.79Å; D243-T245 PolarHBondContact OD2-OG1 2.86Å; D243-K263 WeakPolarHBondContact O-CE 3.48Å
244	Q	95.9	Very high	97.9	Very high	26 Å²	26	22.6 Å²	22.6	12%	0.121	12%	0.12	C	C	.	.	S	Bend	trans	70.5	23.3	177.3	-35.3	174.5	37.1	0	0	112.8	S241 A242 I262 K263 S271 G273	S241-Q244 PolarHBondContact O-N 2.99Å; A242-Q244 PolarHBondContact O-N 3.5Å; Q244-I262 HydrophobicContact CB-CG1 3.91Å; Q244-I262 WeakPolarHBondContact O-CG1 3.21Å; Q244-I262 PolarHBondContact O-N 2.62Å; Q244-I262 VanDerWaalsContact O-N 3.16Å; Q244-K263 HydrophobicContact CB-CG 4.02Å; Q244-S271 VanDerWaalsContact NE2-CA 3.3Å; Q244-S271 PolarHBondContact NE2-OG 2.83Å; Q244-S271 VanDerWaalsContact NE2-OG 3.09Å; Q244-G273 VanDerWaalsContact CG-O 3.23Å; Q244-G273 WeakPolarHBondContact CG-O 3.44Å
245	T	97.6	Very high	97.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	151.2	178.2	73	0	0	0	0	112.3	H221 S241 D243 E259 L260 K263	H221-T245 PolarHBondContact CE1-OG1 2.93Å; H221-T245 PolarHBondContact ND1-OG1 2.83Å; S241-T245 PolarHBondContact N-O 3Å; D243-T245 VanDerWaalsContact C-N 3.28Å; D243-T245 WeakPolarHBondContact OD1-CB 3.42Å; D243-T245 PolarHBondContact OD1-N 3Å; D243-T245 VanDerWaalsContact OD1-N 3.08Å; D243-T245 PolarHBondContact OD1-OG1 2.79Å; D243-T245 PolarHBondContact OD2-OG1 2.86Å; T245-E259 HydrophobicContact CG2-CG 4.4Å; T245-L260 CarbonylContact C-O 3.59Å; T245-L260 WeakPolarHBondContact CA-O 3.41Å; T245-L260 WeakPolarHBondContact CB-O 3.45Å; T245-K263 VanDerWaalsContact CG2-NZ 3.32Å
246	C	98.5	Very high	97.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	120.9	158.9	-180	0	0	0	0	107.3	T239 L260 M275 T289	T239-C246 CarbonylContact O-C 3.59Å; T239-C246 VanDerWaalsContact O-CA 3.26Å; T239-C246 WeakPolarHBondContact O-CA 3.15Å; C246-L260 HydrophobicContact CB-CB 4.17Å; C246-L260 HydrophobicContact CB-CD1 4.26Å; C246-L260 PolarHBondContact N-O 3.37Å; C246-L260 WeakPolarHBondContact O-CA 3.33Å; C246-L260 WeakPolarHBondContact O-CB 3.26Å; C246-L260 PolarHBondContact O-N 2.9Å; C246-M275 HydrophobicContact CB-CG 4.1Å; C246-T289 HydrophobicContact CB-CG2 4.25Å
247	K	98.7	Very high	97.9	Very high	32 Å²	32	27.5 Å²	27.5	14%	0.139	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	136.5	179.1	-73.1	-179.7	-176.2	179.2	0	110.1	A220 A238 T239 W249 L256 E259	A220-K247 WeakPolarHBondContact O-CD 3.41Å; A220-K247 PolarHBondContact O-NZ 2.93Å; A238-K247 CarbonylContact C-O 3.52Å; A238-K247 WeakPolarHBondContact CA-O 3.4Å; T239-K247 PolarHBondContact N-O 3.34Å; T239-K247 PolarHBondContact O-N 3.01Å; T239-K247 PolarHBondContact OG1-O 3.47Å; K247-W249 HydrophobicContact CB-CZ2 3.82Å; K247-W249 HydrophobicContact CD-CH2 4.19Å; K247-W249 HydrophobicContact CD-CZ2 3.66Å; K247-W249 HydrophobicContact CG-CZ2 4.41Å; K247-W249 PolarHBondContact O-NE1 2.83Å; K247-L256 HydrophobicContact CB-CD1 3.71Å; K247-L256 HydrophobicContact CD-CD1 4.02Å; K247-L256 HydrophobicContact CG-CD1 3.9Å; K247-E259 HydrophobicContact CG-CB 4.47Å; K247-E259 HydrophobicContact CG-CG 4.15Å
248	I	98.8	Very high	97.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.5	179	-55.3	-179.6	0	0	0	108.4	L236 L237 M257 T258 L260 F280 I287 V301	L236-I248 HydrophobicContact CB-CG2 4.05Å; L236-I248 HydrophobicContact CD1-CG2 4.13Å; L236-I248 HydrophobicContact CD2-CG2 4.08Å; L236-I248 HydrophobicContact CG-CG2 4.33Å; L237-I248 CarbonylContact O-C 3.57Å; L237-I248 WeakPolarHBondContact O-CA 2.94Å; I248-M257 PolarHBondContact O-N 2.74Å; I248-T258 PolarHBondContact N-O 2.83Å; I248-T258 PolarHBondContact O-N 3.4Å; I248-L260 HydrophobicContact CD1-CD1 4.14Å; I248-L260 HydrophobicContact CD1-CG 4.48Å; I248-F280 HydrophobicContact CG2-CZ 4.48Å; I248-I287 HydrophobicContact CD1-CG2 4.24Å; I248-V301 HydrophobicContact CD1-CB 4.3Å; I248-V301 HydrophobicContact CD1-CG1 3.92Å; I248-V301 HydrophobicContact CD1-CG2 4.08Å; I248-V301 HydrophobicContact CG2-CG1 4.37Å
249	W	98.7	Very high	97.8	Very high	17 Å²	17	32.6 Å²	32.6	6%	0.064	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.3	-176.2	-46.2	85.4	0	0	0	109.1	I218 A220 L236 L237 T239 K247 S255 L256	I218-W249 HydrophobicContact CG2-CD2 4.19Å; I218-W249 HydrophobicContact CG2-CE3 3.79Å; I218-W249 HydrophobicContact CG2-CH2 3.55Å; I218-W249 HydrophobicContact CG2-CZ2 3.96Å; I218-W249 HydrophobicContact CG2-CZ3 3.45Å; I218-W249 VanDerWaalsContact CG2-CZ3 3.45Å; A220-W249 HydrophobicContact CB-CH2 4.36Å; A220-W249 HydrophobicContact CB-CZ2 3.63Å; L236-W249 CarbonylContact C-O 3.59Å; L236-W249 WeakPolarHBondContact CA-O 3.36Å; L237-W249 HydrophobicContact CB-CB 4.39Å; L237-W249 PolarHBondContact N-O 3.39Å; L237-W249 VanDerWaalsContact O-CD1 3.26Å; L237-W249 PolarHBondContact O-N 3.4Å; T239-W249 PolarHBondContact OG1-NE1 3.38Å; K247-W249 HydrophobicContact CB-CZ2 3.82Å; K247-W249 HydrophobicContact CD-CH2 4.19Å; K247-W249 HydrophobicContact CD-CZ2 3.66Å; K247-W249 HydrophobicContact CG-CZ2 4.41Å; K247-W249 PolarHBondContact O-NE1 2.83Å; W249-S255 WeakPolarHBondContact CA-O 3.27Å; W249-L256 HydrophobicContact CD2-CD1 4.33Å; W249-L256 HydrophobicContact CE3-CB 3.95Å; W249-L256 HydrophobicContact CE3-CD1 4.31Å; W249-L256 HydrophobicContact CH2-CB 4.41Å; W249-L256 HydrophobicContact CH2-CD1 4.24Å; W249-L256 HydrophobicContact CZ2-CD1 4.25Å; W249-L256 HydrophobicContact CZ3-CB 3.78Å; W249-L256 HydrophobicContact CZ3-CD1 4.27Å
250	R	98.4	Very high	97.7	Very high	90 Å²	90	32.6 Å²	32.6	34%	0.34	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	132.9	174.2	-172.3	-179	-65.4	97	3.7	110.4	S252 F254 S255	R250-S252 VanDerWaalsContact C-N 3.29Å; R250-S252 WeakPolarHBondContact CD-OG 3.46Å; R250-S252 WeakPolarHBondContact CG-OG 3.29Å; R250-S252 PolarHBondContact O-N 3.08Å; R250-F254 WeakPolarHBondContact O-CA 3.23Å; R250-F254 PolarHBondContact O-N 3.25Å; R250-S255 PolarHBondContact N-O 3.13Å; R250-S255 PolarHBondContact NH1-OG 2.84Å
251	T	97.9	Very high	97.6	Very high	13 Å²	13	34.8 Å²	34.8	8%	0.08	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.8	-177.9	58.1	0	0	0	0	114	F230 S234 T235 N253 F254	F230-T251 HydrophobicContact CD1-CG2 3.89Å; F230-T251 HydrophobicContact CE1-CG2 3.73Å; S234-T251 WeakPolarHBondContact O-CB 3.27Å; S234-T251 VanDerWaalsContact O-CG2 3.31Å; S234-T251 WeakPolarHBondContact O-CG2 3.34Å; S234-T251 PolarHBondContact O-OG1 3.1Å; T235-T251 VanDerWaalsContact C-OG1 3.28Å; T235-T251 WeakPolarHBondContact CA-OG1 3.49Å; T235-T251 PolarHBondContact O-N 2.85Å; T235-T251 PolarHBondContact O-OG1 2.89Å; T235-T251 VanDerWaalsContact O-OG1 3.09Å; T251-N253 VanDerWaalsContact C-N 3.32Å; T251-N253 PolarHBondContact O-N 2.86Å; T251-F254 HydrophobicContact CG2-CE1 4.43Å; T251-F254 WeakPolarHBondContact O-CE2 3.47Å; T251-F254 WeakPolarHBondContact O-CZ 3.34Å
252	S	97.1	Very high	97.3	Very high	85 Å²	85	35.2 Å²	35.2	59%	0.594	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-33.6	179.1	68	0	0	0	0	113.7	R250	R250-S252 VanDerWaalsContact C-N 3.29Å; R250-S252 WeakPolarHBondContact CD-OG 3.46Å; R250-S252 WeakPolarHBondContact CG-OG 3.29Å; R250-S252 PolarHBondContact O-N 3.08Å
253	N	96.3	Very high	97	Very high	96 Å²	96	39.4 Å²	39.4	51%	0.513	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141.5	-1.6	-176.6	68.5	-6.3	0	0	0	114.3	T251 S255	T251-N253 VanDerWaalsContact C-N 3.32Å; T251-N253 PolarHBondContact O-N 2.86Å; N253-S255 PolarHBondContact ND2-OG 3.12Å; N253-S255 VanDerWaalsContact ND2-OG 3.12Å; N253-S255 PolarHBondContact O-N 2.63Å; N253-S255 WeakPolarHBondContact OD1-CB 3.33Å; N253-S255 PolarHBondContact OD1-N 2.9Å; N253-S255 PolarHBondContact OD1-OG 3.4Å
254	F	97.8	Very high	96.2	Very high	17 Å²	17	40 Å²	40	8%	0.075	21%	0.21	C	C	.	.			trans	55.6	28.6	-175.6	-61	-78	0	0	0	114.5	Y186 V198 K215 T216 I218 L237 R250 T251	Y186-F254 HydrophobicContact CD1-CZ 4.13Å; Y186-F254 HydrophobicContact CE1-CE2 4.41Å; Y186-F254 HydrophobicContact CE1-CZ 4.19Å; Y186-F254 HydrophobicContact CG-CZ 4.37Å; V198-F254 HydrophobicContact CB-CE1 4.27Å; V198-F254 HydrophobicContact CB-CZ 4.33Å; V198-F254 HydrophobicContact CG1-CE1 3.78Å; V198-F254 HydrophobicContact CG1-CE2 4.29Å; V198-F254 HydrophobicContact CG1-CZ 3.56Å; V198-F254 HydrophobicContact CG2-CD1 4.07Å; V198-F254 HydrophobicContact CG2-CE1 3.84Å; V198-F254 HydrophobicContact CG2-CZ 4.4Å; K215-F254 HydrophobicContact CD-CD2 4.48Å; K215-F254 HydrophobicContact CD-CE2 3.66Å; K215-F254 HydrophobicContact CD-CZ 4.39Å; T216-F254 HydrophobicContact CG2-CB 4.03Å; T216-F254 HydrophobicContact CG2-CD1 4.38Å; T216-F254 HydrophobicContact CG2-CD2 3.66Å; T216-F254 HydrophobicContact CG2-CE2 4.29Å; T216-F254 HydrophobicContact CG2-CG 3.73Å; I218-F254 HydrophobicContact CD1-CB 3.75Å; I218-F254 HydrophobicContact CD1-CD1 3.84Å; I218-F254 HydrophobicContact CD1-CG 4.11Å; I218-F254 HydrophobicContact CG1-CB 4.24Å; L237-F254 HydrophobicContact CD2-CE1 4.5Å; R250-F254 WeakPolarHBondContact O-CA 3.23Å; R250-F254 PolarHBondContact O-N 3.25Å; T251-F254 HydrophobicContact CG2-CE1 4.43Å; T251-F254 WeakPolarHBondContact O-CE2 3.47Å; T251-F254 WeakPolarHBondContact O-CZ 3.34Å
255	S	98	Very high	95.2	Very high	43 Å²	43	46.2 Å²	46.2	30%	0.301	25%	0.245	S	C	.	.			trans	-80.4	145.3	169.7	68.8	0	0	0	0	111.1	W249 R250 N253 M257	W249-S255 WeakPolarHBondContact CA-O 3.27Å; R250-S255 PolarHBondContact N-O 3.13Å; R250-S255 PolarHBondContact NH1-OG 2.84Å; N253-S255 PolarHBondContact ND2-OG 3.12Å; N253-S255 VanDerWaalsContact ND2-OG 3.12Å; N253-S255 PolarHBondContact O-N 2.63Å; N253-S255 WeakPolarHBondContact OD1-CB 3.33Å; N253-S255 PolarHBondContact OD1-N 2.9Å; N253-S255 PolarHBondContact OD1-OG 3.4Å; S255-M257 PolarHBondContact O-N 3.35Å
256	L	98.4	Very high	94.3	Very high	76 Å²	76	51.1 Å²	51.1	40%	0.398	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	125.3	172.1	-176.7	66.3	0	0	0	109.8	K247 W249	K247-L256 HydrophobicContact CB-CD1 3.71Å; K247-L256 HydrophobicContact CD-CD1 4.02Å; K247-L256 HydrophobicContact CG-CD1 3.9Å; W249-L256 HydrophobicContact CD2-CD1 4.33Å; W249-L256 HydrophobicContact CE3-CB 3.95Å; W249-L256 HydrophobicContact CE3-CD1 4.31Å; W249-L256 HydrophobicContact CH2-CB 4.41Å; W249-L256 HydrophobicContact CH2-CD1 4.24Å; W249-L256 HydrophobicContact CZ2-CD1 4.25Å; W249-L256 HydrophobicContact CZ3-CB 3.78Å; W249-L256 HydrophobicContact CZ3-CD1 4.27Å
257	M	97.8	Very high	92.8	Very high	66 Å²	66	57.9 Å²	57.9	33%	0.325	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-54.1	175.7	176.5	171.3	163.6	0	0	110.7	L236 I248 S255 V301 E302	L236-M257 HydrophobicContact CD2-SD 3.62Å; I248-M257 PolarHBondContact O-N 2.74Å; S255-M257 PolarHBondContact O-N 3.35Å; M257-V301 HydrophobicContact CE-CG1 4.39Å; M257-E302 HydrophobicContact CE-CG 4.33Å
258	T	97.9	Very high	91.1	Very high	15 Å²	15	60.2 Å²	60.2	9%	0.092	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	139.6	-175.3	-49.3	0	0	0	0	110.1	I248 L260 V301	I248-T258 PolarHBondContact N-O 2.83Å; I248-T258 PolarHBondContact O-N 3.4Å; T258-L260 HydrophobicContact CG2-CD2 3.81Å; T258-V301 WeakPolarHBondContact CB-O 3.26Å; T258-V301 WeakPolarHBondContact CG2-O 3.47Å; T258-V301 PolarHBondContact OG1-O 3.22Å
259	E	97.7	Very high	89.8	Confident	91 Å²	91	64 Å²	64	43%	0.425	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	113.8	170.8	-179	171.6	158.4	0	0	109.5	T245 K247 K263	T245-E259 HydrophobicContact CG2-CG 4.4Å; K247-E259 HydrophobicContact CG-CB 4.47Å; K247-E259 HydrophobicContact CG-CG 4.15Å; E259-K263 IonicContact OE1-NZ 3.7Å
260	L	97.4	Very high	88.1	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.7	173.4	-46.8	178.8	0	0	0	108	T245 C246 I248 T258 I287 W299 G304	T245-L260 CarbonylContact C-O 3.59Å; T245-L260 WeakPolarHBondContact CA-O 3.41Å; T245-L260 WeakPolarHBondContact CB-O 3.45Å; C246-L260 HydrophobicContact CB-CB 4.17Å; C246-L260 HydrophobicContact CB-CD1 4.26Å; C246-L260 PolarHBondContact N-O 3.37Å; C246-L260 WeakPolarHBondContact O-CA 3.33Å; C246-L260 WeakPolarHBondContact O-CB 3.26Å; C246-L260 PolarHBondContact O-N 2.9Å; I248-L260 HydrophobicContact CD1-CD1 4.14Å; I248-L260 HydrophobicContact CD1-CG 4.48Å; T258-L260 HydrophobicContact CG2-CD2 3.81Å; L260-I287 HydrophobicContact CD1-CG2 3.51Å; L260-W299 HydrophobicContact CB-CD2 4.16Å; L260-W299 HydrophobicContact CB-CE3 4.03Å; L260-W299 HydrophobicContact CB-CH2 4.39Å; L260-W299 HydrophobicContact CB-CZ3 4.13Å; L260-W299 HydrophobicContact CD1-CB 3.86Å; L260-W299 HydrophobicContact CD1-CD2 4.02Å; L260-W299 HydrophobicContact CD1-CE3 4.47Å; L260-W299 HydrophobicContact CD1-CG 3.75Å; L260-W299 HydrophobicContact CD2-CB 4.17Å; L260-W299 HydrophobicContact CD2-CD2 4.18Å; L260-W299 HydrophobicContact CD2-CE3 3.82Å; L260-W299 HydrophobicContact CD2-CG 4.36Å; L260-W299 HydrophobicContact CG-CD2 4.35Å; L260-W299 HydrophobicContact CG-CE3 4.33Å; L260-G304 VanDerWaalsContact CD2-CA 3.44Å
261	S	95.4	Very high	87	Confident	46 Å²	46	67.9 Å²	67.9	32%	0.322	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.8	-174.2	174.1	0	0	0	0	111	K263	S261-K263 WeakPolarHBondContact OG-CB 3.41Å; S261-K263 WeakPolarHBondContact OG-CG 3.36Å; S261-K263 PolarHBondContact OG-N 3.2Å
262	I	93.4	Very high	85.9	Confident	10 Å²	10	72.5 Å²	72.5	5%	0.051	42%	0.42	C	S	.	.			trans	-105.6	12.8	171.9	62.1	172.3	0	0	0	112	Q244 R272 M275 W299	Q244-I262 HydrophobicContact CB-CG1 3.91Å; Q244-I262 WeakPolarHBondContact O-CG1 3.21Å; Q244-I262 PolarHBondContact O-N 2.62Å; Q244-I262 VanDerWaalsContact O-N 3.16Å; I262-R272 WeakPolarHBondContact O-CD 3.42Å; I262-M275 HydrophobicContact CB-CE 4.41Å; I262-M275 HydrophobicContact CD1-CE 3.87Å; I262-M275 HydrophobicContact CG1-CE 3.88Å; I262-M275 HydrophobicContact CG2-CE 3.75Å; I262-W299 HydrophobicContact CG2-CH2 3.86Å; I262-W299 HydrophobicContact CG2-CZ2 3.73Å
263	K	89.3	Confident	85.5	Confident	88 Å²	88	68.8 Å²	68.8	38%	0.383	40%	0.395	S	S	.	.			trans	-59.4	139.4	177.3	-66.6	170.9	-174.4	156.6	0	110.3	D243 Q244 T245 E259 S261	D243-K263 WeakPolarHBondContact O-CE 3.48Å; Q244-K263 HydrophobicContact CB-CG 4.02Å; T245-K263 VanDerWaalsContact CG2-NZ 3.32Å; E259-K263 IonicContact OE1-NZ 3.7Å; S261-K263 WeakPolarHBondContact OG-CB 3.41Å; S261-K263 WeakPolarHBondContact OG-CG 3.36Å; S261-K263 PolarHBondContact OG-N 3.2Å
264	S	80.4	Confident	85.5	Confident	28 Å²	28	68.2 Å²	68.2	20%	0.196	39%	0.385	C	S	.	.			trans	-72	143.1	167.3	-172.3	0	0	0	0	110.4	N266 E269 R272	S264-N266 PolarHBondContact O-N 3.45Å; S264-N266 PolarHBondContact OG-N 2.74Å; S264-N266 VanDerWaalsContact OG-N 3.15Å; S264-E269 WeakPolarHBondContact CB-OE2 3.23Å; S264-E269 PolarHBondContact OG-OE2 3.23Å; S264-R272 PolarHBondContact OG-NH2 3.26Å
265	N	74.8	Confident	85.5	Confident	157 Å²	157	67.4 Å²	67.4	84%	0.84	38%	0.382	S	S	*	.	S	Bend	trans	-76.5	-6.2	170.4	-68.5	-21.9	0	0	0	112.5	P267	N265-P267 WeakPolarHBondContact O-CD 3.47Å
266	N	77.4	Confident	85.5	Confident	103 Å²	103	68.3 Å²	68.3	55%	0.551	38%	0.379	S	S	*	.			trans	-87.9	117.2	-179.9	-69.5	-27.5	0	0	0	110.9	S264 G268 E269	S264-N266 PolarHBondContact O-N 3.45Å; S264-N266 PolarHBondContact OG-N 2.74Å; S264-N266 VanDerWaalsContact OG-N 3.15Å; N266-G268 PolarHBondContact O-N 2.77Å; N266-E269 HydrophobicContact CB-CB 4.13Å; N266-E269 PolarHBondContact O-N 3.01Å; N266-E269 VanDerWaalsContact O-N 3.08Å
267	P	67.4	Low	85.5	Confident	143 Å²	143	65.1 Å²	65.1	93%	0.929	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.6	-176.4	-22.7	33.2	0	0	0	115.3	N265	N265-P267 WeakPolarHBondContact O-CD 3.47Å
268	G	63.9	Low	85.5	Confident	80 Å²	80	62 Å²	62	83%	0.825	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.8	178.8	0	0	0	0	0	114.6	N266	N266-G268 PolarHBondContact O-N 2.77Å
269	E	70.3	Confident	85.5	Confident	81 Å²	81	62.2 Å²	62.2	38%	0.379	35%	0.35	S	S	.	.	S	Bend	trans	-84.7	122.4	-180	-156.6	170.5	154.2	0	0	109.3	S264 N266 R272	S264-E269 WeakPolarHBondContact CB-OE2 3.23Å; S264-E269 PolarHBondContact OG-OE2 3.23Å; N266-E269 HydrophobicContact CB-CB 4.13Å; N266-E269 PolarHBondContact O-N 3.01Å; N266-E269 VanDerWaalsContact O-N 3.08Å; E269-R272 IonicContact OE1-CZ 3.7Å; E269-R272 VanDerWaalsContact OE1-CZ 3.29Å; E269-R272 IonicContact OE1-NE 3.77Å; E269-R272 PolarHBondContact OE1-NE 2.84Å; E269-R272 IonicContact OE1-NH2 2.85Å; E269-R272 PolarHBondContact OE1-NH2 3.26Å; E269-R272 IonicContact OE2-NE 3.85Å; E269-R272 IonicContact OE2-NH2 3.18Å; E269-R272 PolarHBondContact OE2-NH2 3.44Å
270	T	63.7	Low	85.5	Confident	127 Å²	127	58.6 Å²	58.6	78%	0.779	33%	0.333	S	S	*	.			trans	-62.4	154.1	173.7	40.9	0	0	0	0	110.3	R272	T270-R272 PolarHBondContact O-N 3.06Å; T270-R272 VanDerWaalsContact O-N 3.14Å
271	S	74.6	Confident	85.5	Confident	60 Å²	60	59 Å²	59	42%	0.42	34%	0.336	S	S	.	.			trans	-41.2	118.1	-178.1	172.4	0	0	0	0	112.7	Q244 G273	Q244-S271 VanDerWaalsContact NE2-CA 3.3Å; Q244-S271 PolarHBondContact NE2-OG 2.83Å; Q244-S271 VanDerWaalsContact NE2-OG 3.09Å; S271-G273 PolarHBondContact O-N 2.95Å
272	R	74.4	Confident	85.4	Confident	111 Å²	111	58.7 Å²	58.7	42%	0.419	34%	0.34	S	S	.	.			trans	-64.8	-27.9	-175.9	-76.7	-169.9	167.3	178.7	2.4	113.5	I262 S264 E269 T270 D293	I262-R272 WeakPolarHBondContact O-CD 3.42Å; S264-R272 PolarHBondContact OG-NH2 3.26Å; E269-R272 IonicContact OE1-CZ 3.7Å; E269-R272 VanDerWaalsContact OE1-CZ 3.29Å; E269-R272 IonicContact OE1-NE 3.77Å; E269-R272 PolarHBondContact OE1-NE 2.84Å; E269-R272 IonicContact OE1-NH2 2.85Å; E269-R272 PolarHBondContact OE1-NH2 3.26Å; E269-R272 IonicContact OE2-NE 3.85Å; E269-R272 IonicContact OE2-NH2 3.18Å; E269-R272 PolarHBondContact OE2-NH2 3.44Å; T270-R272 PolarHBondContact O-N 3.06Å; T270-R272 VanDerWaalsContact O-N 3.14Å; R272-D293 WeakPolarHBondContact O-CB 3.16Å
273	G	89.4	Confident	85.5	Confident	7 Å²	7	62.4 Å²	62.4	7%	0.072	36%	0.36	C	S	.	.			trans	154.7	159.3	177.4	0	0	0	0	0	111.7	Q244 S271	Q244-G273 VanDerWaalsContact CG-O 3.23Å; Q244-G273 WeakPolarHBondContact CG-O 3.44Å; S271-G273 PolarHBondContact O-N 2.95Å
274	W	95.7	Very high	85.8	Confident	83 Å²	83	58.3 Å²	58.3	31%	0.314	34%	0.343	S	S	.	.			trans	-77.3	154.6	174.2	-61.1	-3.8	0	0	0	110.8	L226 A242 W276 S291 S292	L226-W274 HydrophobicContact CD1-CB 3.9Å; L226-W274 HydrophobicContact CD1-CD2 4.46Å; L226-W274 HydrophobicContact CD1-CE3 3.96Å; L226-W274 HydrophobicContact CD1-CG 4.49Å; L226-W274 HydrophobicContact CD2-CE3 4.48Å; A242-W274 HydrophobicContact CB-CB 4.41Å; A242-W274 HydrophobicContact CB-CD2 3.6Å; A242-W274 HydrophobicContact CB-CE3 4.12Å; A242-W274 HydrophobicContact CB-CG 3.71Å; A242-W274 HydrophobicContact CB-CZ2 4.35Å; W274-W276 HydrophobicContact CB-CZ2 4.49Å; W274-W276 HydrophobicContact CD2-CZ2 4.26Å; W274-W276 AromaticContact CE3-CH2 3.5Å; W274-W276 HydrophobicContact CE3-CH2 3.5Å; W274-W276 VanDerWaalsContact CE3-CH2 3.5Å; W274-W276 AromaticContact CE3-CZ2 3.41Å; W274-W276 HydrophobicContact CE3-CZ2 3.41Å; W274-W276 VanDerWaalsContact CE3-CZ2 3.41Å; W274-W276 HydrophobicContact CE3-CZ3 4.25Å; W274-W276 AromaticContact CZ3-CH2 3.71Å; W274-W276 HydrophobicContact CZ3-CH2 3.71Å; W274-W276 AromaticContact CZ3-CZ2 3.99Å; W274-W276 HydrophobicContact CZ3-CZ2 3.99Å; W274-S291 VanDerWaalsContact O-CA 3.28Å; W274-S291 WeakPolarHBondContact O-CA 3.16Å; W274-S291 WeakPolarHBondContact O-CB 3.32Å; W274-S292 PolarHBondContact O-N 2.94Å
275	M	97.7	Very high	86.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	106.5	170.2	-161.9	68.6	71.4	0	0	108.1	L226 C240 S241 C246 I262 T289	L226-M275 WeakPolarHBondContact CD1-O 3.21Å; C240-M275 HydrophobicContact CB-CB 4.17Å; C240-M275 HydrophobicContact CB-CG 3.95Å; C240-M275 WeakPolarHBondContact CB-O 3.11Å; S241-M275 PolarHBondContact N-O 2.96Å; S241-M275 WeakPolarHBondContact O-CB 3.44Å; S241-M275 PolarHBondContact O-N 2.91Å; S241-M275 VanDerWaalsContact O-N 3.1Å; C246-M275 HydrophobicContact CB-CG 4.1Å; I262-M275 HydrophobicContact CB-CE 4.41Å; I262-M275 HydrophobicContact CD1-CE 3.87Å; I262-M275 HydrophobicContact CG1-CE 3.88Å; I262-M275 HydrophobicContact CG2-CE 3.75Å; M275-T289 VanDerWaalsContact SD-CB 3.55Å; M275-T289 HydrophobicContact SD-CG2 4.2Å
276	W	98.3	Very high	87.7	Confident	63 Å²	63	57.7 Å²	57.7	24%	0.239	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-48.8	-168.1	-74.3	98.8	0	0	0	113.4	L226 R227 W274 A290 S292 V317 V318	L226-W276 HydrophobicContact CD1-CD2 4.13Å; L226-W276 HydrophobicContact CD1-CE3 3.92Å; L226-W276 HydrophobicContact CD1-CZ3 4.26Å; L226-W276 HydrophobicContact CD2-CE3 4.49Å; L226-W276 HydrophobicContact CD2-CZ3 4.24Å; R227-W276 WeakPolarHBondContact CB-O 3.26Å; W274-W276 HydrophobicContact CB-CZ2 4.49Å; W274-W276 HydrophobicContact CD2-CZ2 4.26Å; W274-W276 AromaticContact CE3-CH2 3.5Å; W274-W276 HydrophobicContact CE3-CH2 3.5Å; W274-W276 VanDerWaalsContact CE3-CH2 3.5Å; W274-W276 AromaticContact CE3-CZ2 3.41Å; W274-W276 HydrophobicContact CE3-CZ2 3.41Å; W274-W276 VanDerWaalsContact CE3-CZ2 3.41Å; W274-W276 HydrophobicContact CE3-CZ3 4.25Å; W274-W276 AromaticContact CZ3-CH2 3.71Å; W274-W276 HydrophobicContact CZ3-CH2 3.71Å; W274-W276 AromaticContact CZ3-CZ2 3.99Å; W274-W276 HydrophobicContact CZ3-CZ2 3.99Å; W276-A290 PolarHBondContact N-O 2.84Å; W276-S292 PolarHBondContact NE1-OG 2.8Å; W276-V317 VanDerWaalsContact CD1-O 3.28Å; W276-V318 HydrophobicContact CB-CB 4.39Å; W276-V318 VanDerWaalsContact CB-O 3.28Å; W276-V318 WeakPolarHBondContact CB-O 3.38Å; W276-V318 HydrophobicContact CD2-CB 4.25Å; W276-V318 HydrophobicContact CD2-CG1 4.18Å; W276-V318 HydrophobicContact CG-CB 4.11Å; W276-V318 HydrophobicContact CG-CG1 4.22Å
277	D	98.3	Very high	88.7	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.043	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	159.1	-169.3	-160	8.7	0	0	0	111	R227 T289 A290 L320	R227-D277 WeakPolarHBondContact CD-OD1 3.12Å; R227-D277 WeakPolarHBondContact CG-OD1 3.32Å; R227-D277 IonicContact CZ-OD1 3Å; R227-D277 IonicContact NE-OD1 3.77Å; R227-D277 PolarHBondContact NE-OD1 2.9Å; R227-D277 IonicContact NH2-OD1 3.92Å; D277-T289 WeakPolarHBondContact O-CA 3.36Å; D277-A290 HydrophobicContact CB-CB 4.37Å; D277-A290 PolarHBondContact O-N 2.98Å; D277-L320 HydrophobicContact CB-CD2 4.26Å; D277-L320 HydrophobicContact CB-CG 4.31Å; D277-L320 PolarHBondContact OD2-N 3.46Å
278	C	98.3	Very high	90.2	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	150.7	178.7	60.7	0	0	0	0	112	C240 I287 V288 T289	C240-C278 VanDerWaalsContact SG-CB 3.52Å; C278-I287 HydrophobicContact CB-CD1 3.88Å; C278-I287 HydrophobicContact CB-CG1 4.13Å; C278-V288 CarbonylContact C-O 3.52Å; C278-V288 WeakPolarHBondContact CA-O 3.43Å; C278-T289 HydrophobicContact CB-CG2 4.37Å
279	A	98.2	Very high	91.8	Very high	20 Å²	20	42.3 Å²	42.3	17%	0.165	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	138.2	167.5	0	0	0	0	0	110.7	I287 V288 L320 F322	A279-I287 CarbonylContact O-C 3.53Å; A279-I287 WeakPolarHBondContact O-CA 3.27Å; A279-I287 WeakPolarHBondContact O-CG1 3.44Å; A279-V288 PolarHBondContact N-O 3.44Å; A279-V288 PolarHBondContact O-N 2.8Å; A279-L320 HydrophobicContact CB-CD1 3.37Å; A279-F322 HydrophobicContact CB-CB 3.69Å; A279-F322 HydrophobicContact CB-CG 4.47Å
280	F	98.1	Very high	93.1	Very high	14 Å²	14	38.4 Å²	38.4	6%	0.061	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	154.7	173.9	-77.4	-82.7	0	0	0	111.3	P232 L236 A238 I248 Y286 I287 V301 F322	P232-F280 HydrophobicContact CG-CB 4.43Å; L236-F280 HydrophobicContact CB-CE1 4.34Å; L236-F280 HydrophobicContact CB-CZ 4.02Å; L236-F280 HydrophobicContact CD1-CE1 4.05Å; A238-F280 HydrophobicContact CB-CE2 3.56Å; A238-F280 HydrophobicContact CB-CZ 3.74Å; I248-F280 HydrophobicContact CG2-CZ 4.48Å; F280-Y286 WeakPolarHBondContact CA-O 3.28Å; F280-I287 HydrophobicContact CD1-CB 4.21Å; F280-I287 HydrophobicContact CD1-CD1 4.41Å; F280-I287 HydrophobicContact CD1-CG1 4.4Å; F280-I287 HydrophobicContact CD2-CD1 4.44Å; F280-I287 HydrophobicContact CE1-CB 4.37Å; F280-I287 HydrophobicContact CE1-CD1 4.1Å; F280-I287 HydrophobicContact CE2-CD1 4.14Å; F280-I287 HydrophobicContact CZ-CD1 3.96Å; F280-V301 HydrophobicContact CD1-CG2 4.2Å; F280-V301 HydrophobicContact CE1-CG2 3.93Å; F280-F322 VanDerWaalsContact O-CD1 3.27Å; F280-F322 WeakPolarHBondContact O-CD1 3.4Å
281	S	96.6	Very high	94.8	Very high	9 Å²	9	32.4 Å²	32.4	6%	0.063	16%	0.164	C	C	.	.			trans	-69.6	157.8	160.7	53.4	0	0	0	0	111.4	P232 D283 S284 Q285 Y286	P232-S281 WeakPolarHBondContact CG-O 3.48Å; S281-D283 VanDerWaalsContact CB-OD1 3.3Å; S281-D283 WeakPolarHBondContact CB-OD1 3.39Å; S281-D283 PolarHBondContact O-N 2.93Å; S281-D283 PolarHBondContact OG-OD1 3.19Å; S281-S284 WeakPolarHBondContact O-CA 3.29Å; S281-S284 PolarHBondContact O-N 3.47Å; S281-Q285 PolarHBondContact OG-N 3.26Å; S281-Y286 PolarHBondContact N-O 3.07Å; S281-Y286 PolarHBondContact OG-N 3.47Å; S281-Y286 PolarHBondContact OG-O 3.07Å
282	G	94	Very high	95.8	Very high	40 Å²	40	31 Å²	31	41%	0.412	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25	179.1	0	0	0	0	0	114	D324	G282-D324 WeakPolarHBondContact CA-OD1 3.24Å; G282-D324 VanDerWaalsContact N-CG 3.35Å; G282-D324 PolarHBondContact N-OD1 2.69Å; G282-D324 VanDerWaalsContact N-OD1 3.16Å; G282-D324 PolarHBondContact N-OD2 3.39Å
283	D	94.5	Very high	96.8	Very high	88 Å²	88	27.3 Å²	27.3	47%	0.471	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	2.3	174.1	68.9	-4.1	0	0	0	114.1	S281 Q285	S281-D283 VanDerWaalsContact CB-OD1 3.3Å; S281-D283 WeakPolarHBondContact CB-OD1 3.39Å; S281-D283 PolarHBondContact O-N 2.93Å; S281-D283 PolarHBondContact OG-OD1 3.19Å; D283-Q285 HydrophobicContact CB-CG 4.23Å; D283-Q285 WeakPolarHBondContact O-CG 3.4Å; D283-Q285 PolarHBondContact O-N 3.18Å; D283-Q285 PolarHBondContact O-NE2 3.03Å; D283-Q285 WeakPolarHBondContact OD1-CB 3.3Å; D283-Q285 PolarHBondContact OD1-N 2.89Å
284	S	96.9	Very high	97.1	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.014	15%	0.153	C	C	.	.	S	Bend	trans	58.2	11.1	-176.2	-57.3	0	0	0	0	115.7	S231 P232 D233 S281	S231-S284 WeakPolarHBondContact CB-OG 3.33Å; P232-S284 WeakPolarHBondContact CD-OG 3.48Å; D233-S284 PolarHBondContact N-OG 3.02Å; D233-S284 WeakPolarHBondContact OD1-CB 3.31Å; D233-S284 PolarHBondContact OD1-OG 2.89Å; S281-S284 WeakPolarHBondContact O-CA 3.29Å; S281-S284 PolarHBondContact O-N 3.47Å
285	Q	96.7	Very high	97.1	Very high	79 Å²	79	26.9 Å²	26.9	37%	0.369	15%	0.145	S	C	.	.	S	Bend	trans	-85.8	-23.8	-177	-62.6	-54.5	-51.6	0	0	113.6	S281 D283 V301	S281-Q285 PolarHBondContact OG-N 3.26Å; D283-Q285 HydrophobicContact CB-CG 4.23Å; D283-Q285 WeakPolarHBondContact O-CG 3.4Å; D283-Q285 PolarHBondContact O-N 3.18Å; D283-Q285 PolarHBondContact O-NE2 3.03Å; D283-Q285 WeakPolarHBondContact OD1-CB 3.3Å; D283-Q285 PolarHBondContact OD1-N 2.89Å; Q285-V301 WeakPolarHBondContact O-CB 3.34Å; Q285-V301 WeakPolarHBondContact O-CG2 3.22Å; Q285-V301 PolarHBondContact O-N 2.7Å
286	Y	97.4	Very high	97.2	Very high	93 Å²	93	26.9 Å²	26.9	37%	0.365	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	156.7	-179.8	-58.9	-82.4	0	0	0	111.2	F280 S281 L298 W299 C300 K307	F280-Y286 WeakPolarHBondContact CA-O 3.28Å; S281-Y286 PolarHBondContact N-O 3.07Å; S281-Y286 PolarHBondContact OG-N 3.47Å; S281-Y286 PolarHBondContact OG-O 3.07Å; Y286-L298 HydrophobicContact CD1-CD1 4.49Å; Y286-L298 HydrophobicContact CD1-CG 4.42Å; Y286-L298 HydrophobicContact CG-CD1 4.37Å; Y286-W299 VanDerWaalsContact CA-O 3.25Å; Y286-W299 WeakPolarHBondContact CA-O 3.39Å; Y286-W299 WeakPolarHBondContact CD1-O 3.37Å; Y286-C300 HydrophobicContact CD1-CB 4.33Å; Y286-C300 HydrophobicContact CE1-CB 4.21Å; Y286-K307 HydrophobicContact CE1-CG 4.17Å
287	I	98.3	Very high	97.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.6	172.4	-169.1	172.6	0	0	0	109.2	A238 I248 L260 C278 A279 F280 W299 V301	A238-I287 HydrophobicContact CB-CD1 3.57Å; I248-I287 HydrophobicContact CD1-CG2 4.24Å; L260-I287 HydrophobicContact CD1-CG2 3.51Å; C278-I287 HydrophobicContact CB-CD1 3.88Å; C278-I287 HydrophobicContact CB-CG1 4.13Å; A279-I287 CarbonylContact O-C 3.53Å; A279-I287 WeakPolarHBondContact O-CA 3.27Å; A279-I287 WeakPolarHBondContact O-CG1 3.44Å; F280-I287 HydrophobicContact CD1-CB 4.21Å; F280-I287 HydrophobicContact CD1-CD1 4.41Å; F280-I287 HydrophobicContact CD1-CG1 4.4Å; F280-I287 HydrophobicContact CD2-CD1 4.44Å; F280-I287 HydrophobicContact CE1-CB 4.37Å; F280-I287 HydrophobicContact CE1-CD1 4.1Å; F280-I287 HydrophobicContact CE2-CD1 4.14Å; F280-I287 HydrophobicContact CZ-CD1 3.96Å; I287-W299 HydrophobicContact CG2-CB 3.84Å; I287-W299 HydrophobicContact CG2-CG 4.39Å; I287-W299 PolarHBondContact N-O 3.01Å; I287-W299 PolarHBondContact O-N 3.12Å; I287-V301 HydrophobicContact CB-CG2 4.18Å; I287-V301 HydrophobicContact CG2-CG2 4.14Å
288	V	98.4	Very high	97.2	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.012	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	135.4	171.3	-172.6	0	0	0	0	108.2	L17 C278 A279 R297 L298 Y310 L320 F322	L17-V288 HydrophobicContact CD1-CG1 3.89Å; L17-V288 HydrophobicContact CD1-CG2 4.47Å; L17-V288 HydrophobicContact CD2-CG1 4.33Å; C278-V288 CarbonylContact C-O 3.52Å; C278-V288 WeakPolarHBondContact CA-O 3.43Å; A279-V288 PolarHBondContact N-O 3.44Å; A279-V288 PolarHBondContact O-N 2.8Å; V288-R297 CarbonylContact C-O 3.51Å; V288-R297 VanDerWaalsContact CA-O 3.24Å; V288-R297 WeakPolarHBondContact CA-O 3.21Å; V288-L298 HydrophobicContact CG2-CD1 3.7Å; V288-Y310 HydrophobicContact CG1-CE2 4.46Å; V288-L320 HydrophobicContact CG1-CD2 4.27Å; V288-F322 HydrophobicContact CG2-CD2 4.02Å; V288-F322 HydrophobicContact CG2-CE2 4.34Å
289	T	98.5	Very high	97.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.9	176.8	66	0	0	0	0	111.3	C246 M275 D277 C278 A296 R297 W299	C246-T289 HydrophobicContact CB-CG2 4.25Å; M275-T289 VanDerWaalsContact SD-CB 3.55Å; M275-T289 HydrophobicContact SD-CG2 4.2Å; D277-T289 WeakPolarHBondContact O-CA 3.36Å; C278-T289 HydrophobicContact CB-CG2 4.37Å; T289-A296 CarbonylContact O-C 3.51Å; T289-A296 WeakPolarHBondContact O-CA 3.28Å; T289-A296 WeakPolarHBondContact O-CB 3.29Å; T289-R297 PolarHBondContact N-O 2.9Å; T289-R297 PolarHBondContact O-N 2.65Å; T289-W299 PolarHBondContact OG1-NE1 2.85Å
290	A	98.2	Very high	97.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.4	172	0	0	0	0	0	111.1	W276 D277 V317 L320	W276-A290 PolarHBondContact N-O 2.84Å; D277-A290 HydrophobicContact CB-CB 4.37Å; D277-A290 PolarHBondContact O-N 2.98Å; A290-V317 HydrophobicContact CB-CB 4.28Å; A290-V317 HydrophobicContact CB-CG1 3.72Å; A290-L320 HydrophobicContact CB-CB 4.46Å; A290-L320 HydrophobicContact CB-CD2 3.81Å
291	S	97.4	Very high	97.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	157.4	-176.8	44.8	0	0	0	0	114.5	W274 D293 N294 L295 R297 V317	W274-S291 VanDerWaalsContact O-CA 3.28Å; W274-S291 WeakPolarHBondContact O-CA 3.16Å; W274-S291 WeakPolarHBondContact O-CB 3.32Å; S291-D293 VanDerWaalsContact CB-OD1 3.31Å; S291-D293 WeakPolarHBondContact CB-OD1 3.33Å; S291-D293 PolarHBondContact O-N 3.01Å; S291-D293 PolarHBondContact OG-OD1 3.05Å; S291-N294 PolarHBondContact O-N 3.36Å; S291-L295 PolarHBondContact N-O 3.09Å; S291-L295 VanDerWaalsContact N-O 3.15Å; S291-L295 PolarHBondContact OG-O 3.16Å; S291-L295 VanDerWaalsContact OG-O 3.05Å; S291-R297 PolarHBondContact OG-NH1 2.94Å; S291-R297 VanDerWaalsContact OG-NH1 3.13Å; S291-V317 CarbonylContact C-O 3.52Å; S291-V317 PolarHBondContact O-N 3.47Å
292	S	96.3	Very high	97.1	Very high	31 Å²	31	30.6 Å²	30.6	22%	0.217	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-10.1	177.6	-82.2	0	0	0	0	115	W274 W276 N294 A316	W274-S292 PolarHBondContact O-N 2.94Å; W276-S292 PolarHBondContact NE1-OG 2.8Å; S292-N294 PolarHBondContact O-N 2.83Å; S292-N294 VanDerWaalsContact O-N 3.15Å; S292-N294 PolarHBondContact O-OD1 3.41Å; S292-A316 WeakPolarHBondContact O-CB 3.32Å
293	D	95.1	Very high	97.2	Very high	33 Å²	33	32.4 Å²	32.4	18%	0.176	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	18.6	176.2	67.7	-9.9	0	0	0	112.9	R272 S291 L295 R297	R272-D293 WeakPolarHBondContact O-CB 3.16Å; S291-D293 VanDerWaalsContact CB-OD1 3.31Å; S291-D293 WeakPolarHBondContact CB-OD1 3.33Å; S291-D293 PolarHBondContact O-N 3.01Å; S291-D293 PolarHBondContact OG-OD1 3.05Å; D293-L295 PolarHBondContact O-N 2.8Å; D293-L295 PolarHBondContact OD1-N 2.98Å; D293-R297 IonicContact OD1-NH1 3.89Å; D293-R297 PolarHBondContact OD1-NH1 2.67Å; D293-R297 IonicContact OD2-CZ 3.6Å; D293-R297 IonicContact OD2-NH1 2.72Å; D293-R297 PolarHBondContact OD2-NH1 3.16Å; D293-R297 IonicContact OD2-NH2 3.51Å; D293-R297 PolarHBondContact OD2-NH2 2.93Å
294	N	96.1	Very high	97.3	Very high	54 Å²	54	29 Å²	29	29%	0.289	15%	0.151	S	C	.	.	S	Bend	trans	69.8	11.7	178.3	-45	-19.2	0	0	0	114.4	S291 S292 K315 A316	S291-N294 PolarHBondContact O-N 3.36Å; S292-N294 PolarHBondContact O-N 2.83Å; S292-N294 VanDerWaalsContact O-N 3.15Å; S292-N294 PolarHBondContact O-OD1 3.41Å; N294-K315 VanDerWaalsContact CG-C 3.47Å; N294-K315 WeakPolarHBondContact OD1-CA 3.46Å; N294-K315 PolarHBondContact OD1-O 3.35Å; N294-A316 WeakPolarHBondContact OD1-CA 3.37Å; N294-A316 PolarHBondContact OD1-N 2.79Å
295	L	96.8	Very high	97.2	Very high	27 Å²	27	34.1 Å²	34.1	14%	0.141	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.1	-177.3	-62.6	167.3	0	0	0	110.7	S291 D293	S291-L295 PolarHBondContact N-O 3.09Å; S291-L295 VanDerWaalsContact N-O 3.15Å; S291-L295 PolarHBondContact OG-O 3.16Å; S291-L295 VanDerWaalsContact OG-O 3.05Å; D293-L295 PolarHBondContact O-N 2.8Å; D293-L295 PolarHBondContact OD1-N 2.98Å
296	A	98.1	Very high	97.3	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.008	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	151.7	154.7	0	0	0	0	0	109.1	T19 T289 Y310	T19-A296 HydrophobicContact CG2-CB 3.75Å; T289-A296 CarbonylContact O-C 3.51Å; T289-A296 WeakPolarHBondContact O-CA 3.28Å; T289-A296 WeakPolarHBondContact O-CB 3.29Å; A296-Y310 HydrophobicContact CB-CD2 4.05Å; A296-Y310 PolarHBondContact N-O 2.89Å; A296-Y310 WeakPolarHBondContact O-CD2 3.4Å; A296-Y310 PolarHBondContact O-N 3.41Å
297	R	98.2	Very high	97.3	Very high	14 Å²	14	33.9 Å²	33.9	5%	0.053	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.6	-176.1	-66.4	-173.4	177.2	85.9	-6.3	111.4	V288 T289 S291 D293 W299 R308 E309	V288-R297 CarbonylContact C-O 3.51Å; V288-R297 VanDerWaalsContact CA-O 3.24Å; V288-R297 WeakPolarHBondContact CA-O 3.21Å; T289-R297 PolarHBondContact N-O 2.9Å; T289-R297 PolarHBondContact O-N 2.65Å; S291-R297 PolarHBondContact OG-NH1 2.94Å; S291-R297 VanDerWaalsContact OG-NH1 3.13Å; D293-R297 IonicContact OD1-NH1 3.89Å; D293-R297 PolarHBondContact OD1-NH1 2.67Å; D293-R297 IonicContact OD2-CZ 3.6Å; D293-R297 IonicContact OD2-NH1 2.72Å; D293-R297 PolarHBondContact OD2-NH1 3.16Å; D293-R297 IonicContact OD2-NH2 3.51Å; D293-R297 PolarHBondContact OD2-NH2 2.93Å; R297-W299 HydrophobicContact CB-CZ2 4.09Å; R297-W299 VanDerWaalsContact CB-NE1 3.32Å; R297-W299 HydrophobicContact CG-CZ2 4.47Å; R297-R308 WeakPolarHBondContact CA-O 3.46Å; R297-E309 HydrophobicContact CG-CG 4.18Å; R297-E309 IonicContact CZ-OE1 2.7Å; R297-E309 IonicContact NE-OE1 3.8Å; R297-E309 PolarHBondContact NE-OE1 3.41Å; R297-E309 IonicContact NH2-OE1 3.6Å
298	L	98.3	Very high	97.2	Very high	22 Å²	22	38.3 Å²	38.3	12%	0.115	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	124.3	169.7	-178.7	70.2	0	0	0	108.6	Y286 V288 K307 R308 Y310	Y286-L298 HydrophobicContact CD1-CD1 4.49Å; Y286-L298 HydrophobicContact CD1-CG 4.42Å; Y286-L298 HydrophobicContact CG-CD1 4.37Å; V288-L298 HydrophobicContact CG2-CD1 3.7Å; L298-K307 HydrophobicContact CD2-CB 4.41Å; L298-K307 PolarHBondContact O-N 2.82Å; L298-R308 HydrophobicContact CB-CB 4.06Å; L298-R308 HydrophobicContact CD2-CG 4.34Å; L298-R308 PolarHBondContact N-O 3.25Å; L298-R308 PolarHBondContact O-N 2.68Å; L298-Y310 HydrophobicContact CB-CE2 3.94Å
299	W	98.4	Very high	97.1	Very high	7 Å²	7	43 Å²	43	3%	0.027	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.8	-179	-50.6	79.3	0	0	0	110.3	L260 I262 Y286 I287 T289 R297 E305 I306	L260-W299 HydrophobicContact CB-CD2 4.16Å; L260-W299 HydrophobicContact CB-CE3 4.03Å; L260-W299 HydrophobicContact CB-CH2 4.39Å; L260-W299 HydrophobicContact CB-CZ3 4.13Å; L260-W299 HydrophobicContact CD1-CB 3.86Å; L260-W299 HydrophobicContact CD1-CD2 4.02Å; L260-W299 HydrophobicContact CD1-CE3 4.47Å; L260-W299 HydrophobicContact CD1-CG 3.75Å; L260-W299 HydrophobicContact CD2-CB 4.17Å; L260-W299 HydrophobicContact CD2-CD2 4.18Å; L260-W299 HydrophobicContact CD2-CE3 3.82Å; L260-W299 HydrophobicContact CD2-CG 4.36Å; L260-W299 HydrophobicContact CG-CD2 4.35Å; L260-W299 HydrophobicContact CG-CE3 4.33Å; I262-W299 HydrophobicContact CG2-CH2 3.86Å; I262-W299 HydrophobicContact CG2-CZ2 3.73Å; Y286-W299 VanDerWaalsContact CA-O 3.25Å; Y286-W299 WeakPolarHBondContact CA-O 3.39Å; Y286-W299 WeakPolarHBondContact CD1-O 3.37Å; I287-W299 HydrophobicContact CG2-CB 3.84Å; I287-W299 HydrophobicContact CG2-CG 4.39Å; I287-W299 PolarHBondContact N-O 3.01Å; I287-W299 PolarHBondContact O-N 3.12Å; T289-W299 PolarHBondContact OG1-NE1 2.85Å; R297-W299 HydrophobicContact CB-CZ2 4.09Å; R297-W299 VanDerWaalsContact CB-NE1 3.32Å; R297-W299 HydrophobicContact CG-CZ2 4.47Å; W299-E305 WeakPolarHBondContact CA-O 3.36Å; W299-I306 HydrophobicContact CD2-CG1 3.96Å; W299-I306 HydrophobicContact CE3-CB 4.41Å; W299-I306 HydrophobicContact CE3-CG1 3.45Å; W299-I306 VanDerWaalsContact CE3-CG1 3.45Å; W299-I306 HydrophobicContact CH2-CD1 3.67Å; W299-I306 HydrophobicContact CH2-CG1 3.45Å; W299-I306 VanDerWaalsContact CH2-CG1 3.45Å; W299-I306 HydrophobicContact CZ2-CD1 4.25Å; W299-I306 HydrophobicContact CZ2-CG1 3.94Å; W299-I306 HydrophobicContact CZ3-CD1 3.85Å; W299-I306 HydrophobicContact CZ3-CG1 3.19Å
300	C	98	Very high	97.1	Very high	15 Å²	15	43 Å²	43	10%	0.101	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	125.7	164.5	171.7	0	0	0	0	109	Y286 E302 T303 G304 E305 K307	Y286-C300 HydrophobicContact CD1-CB 4.33Å; Y286-C300 HydrophobicContact CE1-CB 4.21Å; C300-E302 PolarHBondContact O-N 2.83Å; C300-T303 VanDerWaalsContact CB-OG1 3.26Å; C300-T303 WeakPolarHBondContact CB-OG1 3.4Å; C300-T303 PolarHBondContact SG-OG1 3.23Å; C300-G304 WeakPolarHBondContact O-CA 3.18Å; C300-G304 PolarHBondContact O-N 3.46Å; C300-E305 PolarHBondContact N-O 2.88Å; C300-K307 HydrophobicContact CB-CD 4.38Å; C300-K307 HydrophobicContact CB-CG 4.02Å
301	V	97.4	Very high	97	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-41.6	-173.3	167.2	0	0	0	0	112.2	L236 I248 M257 T258 F280 Q285 I287	L236-V301 HydrophobicContact CD1-CG1 3.46Å; L236-V301 VanDerWaalsContact CD1-CG1 3.46Å; I248-V301 HydrophobicContact CD1-CB 4.3Å; I248-V301 HydrophobicContact CD1-CG1 3.92Å; I248-V301 HydrophobicContact CD1-CG2 4.08Å; I248-V301 HydrophobicContact CG2-CG1 4.37Å; M257-V301 HydrophobicContact CE-CG1 4.39Å; T258-V301 WeakPolarHBondContact CB-O 3.26Å; T258-V301 WeakPolarHBondContact CG2-O 3.47Å; T258-V301 PolarHBondContact OG1-O 3.22Å; F280-V301 HydrophobicContact CD1-CG2 4.2Å; F280-V301 HydrophobicContact CE1-CG2 3.93Å; Q285-V301 WeakPolarHBondContact O-CB 3.34Å; Q285-V301 WeakPolarHBondContact O-CG2 3.22Å; Q285-V301 PolarHBondContact O-N 2.7Å; I287-V301 HydrophobicContact CB-CG2 4.18Å; I287-V301 HydrophobicContact CG2-CG2 4.14Å
302	E	95.9	Very high	96.9	Very high	133 Å²	133	48.3 Å²	48.3	62%	0.621	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-43.6	-178	-63.9	-169.3	151.5	0	0	113.1	M257 C300	M257-E302 HydrophobicContact CE-CG 4.33Å; C300-E302 PolarHBondContact O-N 2.83Å
303	T	96.2	Very high	96.9	Very high	77 Å²	77	47.4 Å²	47.4	47%	0.472	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-22.6	-173	58.5	0	0	0	0	113.1	C300 E305	C300-T303 VanDerWaalsContact CB-OG1 3.26Å; C300-T303 WeakPolarHBondContact CB-OG1 3.4Å; C300-T303 PolarHBondContact SG-OG1 3.23Å; T303-E305 PolarHBondContact O-N 3.02Å; T303-E305 PolarHBondContact OG1-N 3.03Å
304	G	95.9	Very high	97	Very high	17 Å²	17	53.4 Å²	53.4	18%	0.175	28%	0.276	C	S	.	.			trans	69.8	11.2	-171.4	0	0	0	0	0	114.3	L260 C300	L260-G304 VanDerWaalsContact CD2-CA 3.44Å; C300-G304 WeakPolarHBondContact O-CA 3.18Å; C300-G304 PolarHBondContact O-N 3.46Å
305	E	96.4	Very high	97	Very high	109 Å²	109	55.7 Å²	55.7	51%	0.509	28%	0.283	S	S	.	.			trans	-81.8	139.8	179.8	-68.7	-176.7	163.7	0	0	112.1	W299 C300 T303 K307	W299-E305 WeakPolarHBondContact CA-O 3.36Å; C300-E305 PolarHBondContact N-O 2.88Å; T303-E305 PolarHBondContact O-N 3.02Å; T303-E305 PolarHBondContact OG1-N 3.03Å; E305-K307 PolarHBondContact O-N 3.28Å; E305-K307 IonicContact OE2-NZ 2.75Å; E305-K307 PolarHBondContact OE2-NZ 3.36Å
306	I	97.1	Very high	97	Very high	74 Å²	74	55.2 Å²	55.2	38%	0.379	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	113.5	167.1	-57.8	168.9	0	0	0	107.7	W299 R308 E309	W299-I306 HydrophobicContact CD2-CG1 3.96Å; W299-I306 HydrophobicContact CE3-CB 4.41Å; W299-I306 HydrophobicContact CE3-CG1 3.45Å; W299-I306 VanDerWaalsContact CE3-CG1 3.45Å; W299-I306 HydrophobicContact CH2-CD1 3.67Å; W299-I306 HydrophobicContact CH2-CG1 3.45Å; W299-I306 VanDerWaalsContact CH2-CG1 3.45Å; W299-I306 HydrophobicContact CZ2-CD1 4.25Å; W299-I306 HydrophobicContact CZ2-CG1 3.94Å; W299-I306 HydrophobicContact CZ3-CD1 3.85Å; W299-I306 HydrophobicContact CZ3-CG1 3.19Å; I306-R308 WeakPolarHBondContact CG2-O 3.29Å; I306-E309 HydrophobicContact CG2-CG 3.78Å
307	K	97.3	Very high	97	Very high	93 Å²	93	55.1 Å²	55.1	40%	0.404	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-33	173.1	-62.8	-55.3	-174.9	-169	0	111.6	Y286 L298 C300 E305	Y286-K307 HydrophobicContact CE1-CG 4.17Å; L298-K307 HydrophobicContact CD2-CB 4.41Å; L298-K307 PolarHBondContact O-N 2.82Å; C300-K307 HydrophobicContact CB-CD 4.38Å; C300-K307 HydrophobicContact CB-CG 4.02Å; E305-K307 PolarHBondContact O-N 3.28Å; E305-K307 IonicContact OE2-NZ 2.75Å; E305-K307 PolarHBondContact OE2-NZ 3.36Å
308	R	96.8	Very high	97	Very high	93 Å²	93	55.1 Å²	55.1	35%	0.351	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	155.1	177.4	-62.1	-178.9	-167.8	-96.7	-3.9	112.9	A31 H32 R297 L298 I306	A31-R308 WeakPolarHBondContact O-CD 3.48Å; A31-R308 PolarHBondContact O-NE 3.45Å; H32-R308 VanDerWaalsContact C-NH2 3.29Å; H32-R308 PolarHBondContact O-NH1 3.39Å; H32-R308 PolarHBondContact O-NH2 3.25Å; R297-R308 WeakPolarHBondContact CA-O 3.46Å; L298-R308 HydrophobicContact CB-CB 4.06Å; L298-R308 HydrophobicContact CD2-CG 4.34Å; L298-R308 PolarHBondContact N-O 3.25Å; L298-R308 PolarHBondContact O-N 2.68Å; I306-R308 WeakPolarHBondContact CG2-O 3.29Å
309	E	97.1	Very high	96.9	Very high	100 Å²	100	54.1 Å²	54.1	47%	0.467	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.7	168.3	-55.6	-166	130.9	0	0	109.5	R297 I306	R297-E309 HydrophobicContact CG-CG 4.18Å; R297-E309 IonicContact CZ-OE1 2.7Å; R297-E309 IonicContact NE-OE1 3.8Å; R297-E309 PolarHBondContact NE-OE1 3.41Å; R297-E309 IonicContact NH2-OE1 3.6Å; I306-E309 HydrophobicContact CG2-CG 3.78Å
310	Y	97.8	Very high	96.9	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	98.8	176.4	-55	-82.2	0	0	0	107.9	L17 W29 A31 V288 A296 L298	L17-Y310 HydrophobicContact CD2-CD1 4.12Å; L17-Y310 HydrophobicContact CD2-CD2 4.03Å; L17-Y310 HydrophobicContact CD2-CE1 3.68Å; L17-Y310 HydrophobicContact CD2-CE2 3.56Å; L17-Y310 HydrophobicContact CD2-CG 4.3Å; W29-Y310 HydrophobicContact CB-CD1 3.86Å; W29-Y310 HydrophobicContact CB-CE1 4.17Å; W29-Y310 HydrophobicContact CD2-CD1 4.04Å; W29-Y310 HydrophobicContact CD2-CG 4.32Å; W29-Y310 AromaticContact CE3-CD1 3.99Å; W29-Y310 HydrophobicContact CE3-CD1 3.99Å; W29-Y310 HydrophobicContact CE3-CG 4.43Å; W29-Y310 AromaticContact CG-CD1 3.99Å; W29-Y310 HydrophobicContact CG-CD1 3.99Å; W29-Y310 HydrophobicContact CG-CG 4.42Å; A31-Y310 WeakPolarHBondContact CA-OH 3.37Å; A31-Y310 PolarHBondContact O-OH 3.47Å; V288-Y310 HydrophobicContact CG1-CE2 4.46Å; A296-Y310 HydrophobicContact CB-CD2 4.05Å; A296-Y310 PolarHBondContact N-O 2.89Å; A296-Y310 WeakPolarHBondContact O-CD2 3.4Å; A296-Y310 PolarHBondContact O-N 3.41Å; L298-Y310 HydrophobicContact CB-CE2 3.94Å
311	S	96.3	Very high	96.9	Very high	88 Å²	88	53.5 Å²	53.5	62%	0.615	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.8	-176.7	-173.6	0	0	0	0	111.6	W29	W29-S311 WeakPolarHBondContact CH2-O 3.47Å; W29-S311 WeakPolarHBondContact CZ3-O 3.38Å
312	G	95.1	Very high	96.8	Very high	24 Å²	24	55.3 Å²	55.3	25%	0.247	28%	0.283	C	S	.	.			trans	168.5	-24	176.1	0	0	0	0	0	114.2	R27	R27-G312 PolarHBondContact NE-O 3.23Å; R27-G312 PolarHBondContact NH1-O 2.99Å; R27-G312 PolarHBondContact NH2-O 3.42Å
313	H	97.3	Very high	96.7	Very high	13 Å²	13	50.2 Å²	50.2	6%	0.06	26%	0.26	C	S	.	.			trans	-66.8	144.6	175.2	-76.6	-74.5	0	0	0	111.7	T19 D23 T25 V317	T19-H313 PolarHBondContact O-NE2 3.16Å; T19-H313 PolarHBondContact OG1-CD2 2.85Å; T19-H313 PolarHBondContact OG1-NE2 2.9Å; D23-H313 IonicContact OD1-CE1 3.5Å; D23-H313 IonicContact OD1-ND1 3.71Å; D23-H313 PolarHBondContact OD1-ND1 2.89Å; D23-H313 WeakPolarHBondContact OD2-CA 3.44Å; D23-H313 WeakPolarHBondContact OD2-CB 3.22Å; D23-H313 IonicContact OD2-CE1 3.63Å; D23-H313 IonicContact OD2-CG 2.79Å; D23-H313 IonicContact OD2-ND1 3.69Å; D23-H313 PolarHBondContact OD2-ND1 3.1Å; T25-H313 PolarHBondContact OG1-ND1 3Å; H313-V317 HydrophobicContact CB-CG2 3.86Å; H313-V317 VanDerWaalsContact CD2-CG2 3.44Å; H313-V317 WeakPolarHBondContact CD2-CG2 3.49Å
314	Q	96.4	Very high	96.4	Very high	158 Å²	158	48.8 Å²	48.8	74%	0.738	25%	0.25	S	C	*	.	S	Bend	trans	-94.2	-13.8	-179.7	-64.3	-178.3	3.8	0	0	113.1	D23	D23-Q314 HydrophobicContact CB-CB 4.2Å; D23-Q314 PolarHBondContact OD2-N 3.2Å
315	K	96.6	Very high	95.6	Very high	103 Å²	103	51.3 Å²	51.3	45%	0.448	27%	0.265	S	S	.	.	S	Bend	trans	-140.2	175.5	178.4	-61.4	179.2	-177.5	171.2	0	109.5	Y22 D23 N294 V317	Y22-K315 VanDerWaalsContact O-CD 3.29Å; Y22-K315 WeakPolarHBondContact O-CD 3.38Å; Y22-K315 PolarHBondContact O-NZ 3.19Å; D23-K315 HydrophobicContact CB-CB 3.98Å; D23-K315 HydrophobicContact CB-CD 4.47Å; D23-K315 HydrophobicContact CB-CG 4.2Å; N294-K315 VanDerWaalsContact CG-C 3.47Å; N294-K315 WeakPolarHBondContact OD1-CA 3.46Å; N294-K315 PolarHBondContact OD1-O 3.35Å; K315-V317 PolarHBondContact O-N 2.84Å
316	A	96.6	Very high	93.9	Very high	16 Å²	16	52.1 Å²	52.1	13%	0.132	28%	0.277	C	S	.	.			trans	-52.4	135.7	-176.3	0	0	0	0	0	112.6	G21 Y22 S292 N294	G21-A316 WeakPolarHBondContact CA-O 3.28Å; Y22-A316 HydrophobicContact CD2-CB 3.86Å; Y22-A316 HydrophobicContact CE2-CB 4.28Å; Y22-A316 PolarHBondContact N-O 3.08Å; Y22-A316 VanDerWaalsContact N-O 3.15Å; S292-A316 WeakPolarHBondContact O-CB 3.32Å; N294-A316 WeakPolarHBondContact OD1-CA 3.37Å; N294-A316 PolarHBondContact OD1-N 2.79Å
317	V	97.9	Very high	91.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.7	172.8	-170.3	0	0	0	0	107.6	T19 A20 W276 A290 S291 H313 K315	T19-V317 HydrophobicContact CG2-CG1 4.49Å; A20-V317 WeakPolarHBondContact O-CG1 3.46Å; W276-V317 VanDerWaalsContact CD1-O 3.28Å; A290-V317 HydrophobicContact CB-CB 4.28Å; A290-V317 HydrophobicContact CB-CG1 3.72Å; S291-V317 CarbonylContact C-O 3.52Å; S291-V317 PolarHBondContact O-N 3.47Å; H313-V317 HydrophobicContact CB-CG2 3.86Å; H313-V317 VanDerWaalsContact CD2-CG2 3.44Å; H313-V317 WeakPolarHBondContact CD2-CG2 3.49Å; K315-V317 PolarHBondContact O-N 2.84Å
318	V	97.8	Very high	88.8	Confident	14 Å²	14	56.7 Å²	56.7	9%	0.085	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	-19.2	-174	-54.5	0	0	0	0	113.6	A20 Y22 V47 W276	A20-V318 PolarHBondContact O-N 2.86Å; Y22-V318 HydrophobicContact CD2-CG1 3.95Å; Y22-V318 HydrophobicContact CE2-CG1 3.36Å; V47-V318 WeakPolarHBondContact O-CG2 3.43Å; W276-V318 HydrophobicContact CB-CB 4.39Å; W276-V318 VanDerWaalsContact CB-O 3.28Å; W276-V318 WeakPolarHBondContact CB-O 3.38Å; W276-V318 HydrophobicContact CD2-CB 4.25Å; W276-V318 HydrophobicContact CD2-CG1 4.18Å; W276-V318 HydrophobicContact CG-CB 4.11Å; W276-V318 HydrophobicContact CG-CG1 4.22Å
319	C	97.4	Very high	88.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.7	179	55.7	0	0	0	0	111.1	A20 V47	A20-C319 PolarHBondContact N-O 3.16Å; A20-C319 VanDerWaalsContact N-O 3.1Å; A20-C319 PolarHBondContact O-N 3.36Å; V47-C319 PolarHBondContact O-SG 2.89Å; V47-C319 VanDerWaalsContact O-SG 3.36Å
320	L	97.5	Very high	87.9	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152.4	174.1	65.1	92.7	0	0	0	110	A18 T19 D277 A279 V288 A290 F322	A18-L320 CarbonylContact O-C 3.52Å; A18-L320 VanDerWaalsContact O-CA 3.24Å; A18-L320 WeakPolarHBondContact O-CA 3.48Å; T19-L320 HydrophobicContact CG2-CB 4.24Å; D277-L320 HydrophobicContact CB-CD2 4.26Å; D277-L320 HydrophobicContact CB-CG 4.31Å; D277-L320 PolarHBondContact OD2-N 3.46Å; A279-L320 HydrophobicContact CB-CD1 3.37Å; V288-L320 HydrophobicContact CG1-CD2 4.27Å; A290-L320 HydrophobicContact CB-CB 4.46Å; A290-L320 HydrophobicContact CB-CD2 3.81Å; L320-F322 HydrophobicContact CD1-CB 4.31Å
321	A	97.4	Very high	87.4	Confident	5 Å²	5	55.4 Å²	55.4	4%	0.041	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.3	164.7	0	0	0	0	0	108.4	L17 A18 L50 V52 I59	L17-A321 WeakPolarHBondContact CA-O 3.49Å; A18-A321 HydrophobicContact CB-CB 4.5Å; A18-A321 PolarHBondContact N-O 2.54Å; A18-A321 PolarHBondContact O-N 2.93Å; L50-A321 HydrophobicContact CB-CB 3.88Å; V52-A321 HydrophobicContact CG2-CB 3.98Å; I59-A321 HydrophobicContact CD1-CB 3.97Å
322	F	96.1	Very high	86.9	Confident	39 Å²	39	53.5 Å²	53.5	17%	0.171	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.4	179.1	-178.9	-90.2	0	0	0	108.8	V15 I16 L17 A279 F280 V288 L320 D324	V15-F322 HydrophobicContact CG1-CD2 4.3Å; V15-F322 HydrophobicContact CG1-CE2 3.47Å; V15-F322 VanDerWaalsContact CG1-CE2 3.47Å; V15-F322 HydrophobicContact CG1-CZ 3.79Å; I16-F322 CarbonylContact O-C 3.51Å; I16-F322 WeakPolarHBondContact O-CA 3.26Å; L17-F322 HydrophobicContact CB-CD2 4.32Å; L17-F322 HydrophobicContact CD1-CD2 4.21Å; A279-F322 HydrophobicContact CB-CB 3.69Å; A279-F322 HydrophobicContact CB-CG 4.47Å; F280-F322 VanDerWaalsContact O-CD1 3.27Å; F280-F322 WeakPolarHBondContact O-CD1 3.4Å; V288-F322 HydrophobicContact CG2-CD2 4.02Å; V288-F322 HydrophobicContact CG2-CE2 4.34Å; L320-F322 HydrophobicContact CD1-CB 4.31Å; F322-D324 HydrophobicContact CE1-CB 3.89Å; F322-D324 VanDerWaalsContact CE1-CG 3.47Å; F322-D324 HydrophobicContact CZ-CB 3.91Å
323	N	93.8	Very high	86.3	Confident	26 Å²	26	55.4 Å²	55.4	14%	0.139	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	117.5	177.2	-171.8	-51.3	0	0	0	109.2	I16 V52 S325	I16-N323 PolarHBondContact N-O 3.04Å; I16-N323 PolarHBondContact O-N 2.87Å; V52-N323 HydrophobicContact CB-CB 4.34Å; V52-N323 HydrophobicContact CG1-CB 4.33Å; N323-S325 WeakPolarHBondContact OD1-CB 3.43Å; N323-S325 PolarHBondContact OD1-N 2.84Å; N323-S325 VanDerWaalsContact OD1-N 3.08Å; N323-S325 PolarHBondContact OD1-OG 3.1Å
324	D	89.4	Confident	85.6	Confident	47 Å²	47	58.2 Å²	58.2	25%	0.251	36%	0.361	S	S	.	.			trans	-118.5	18.1	175.2	60.9	-10.1	0	0	0	112.4	V15 G282 F322 V326	V15-D324 HydrophobicContact CG1-CB 4.32Å; V15-D324 HydrophobicContact CG2-CB 3.9Å; G282-D324 WeakPolarHBondContact CA-OD1 3.24Å; G282-D324 VanDerWaalsContact N-CG 3.35Å; G282-D324 PolarHBondContact N-OD1 2.69Å; G282-D324 VanDerWaalsContact N-OD1 3.16Å; G282-D324 PolarHBondContact N-OD2 3.39Å; F322-D324 HydrophobicContact CE1-CB 3.89Å; F322-D324 VanDerWaalsContact CE1-CG 3.47Å; F322-D324 HydrophobicContact CZ-CB 3.91Å; D324-V326 PolarHBondContact O-N 3.49Å
325	S	78.8	Confident	84.8	Confident	70 Å²	70	51.1 Å²	51.1	49%	0.49	33%	0.334	S	S	.	.			trans	-63.9	121.3	177.5	-57.8	0	0	0	0	110.1	R56 N323 L327	R56-S325 PolarHBondContact NH1-O 3.09Å; N323-S325 WeakPolarHBondContact OD1-CB 3.43Å; N323-S325 PolarHBondContact OD1-N 2.84Å; N323-S325 VanDerWaalsContact OD1-N 3.08Å; N323-S325 PolarHBondContact OD1-OG 3.1Å; S325-L327 PolarHBondContact O-N 3.24Å
326	V	62.4	Low	83.9	Confident	126 Å²	126	47.1 Å²	47.1	76%	0.764	33%	0.326	S	S	*	.			trans	-72.2	122	168.5	-174.2	0	0	0	0	107.1	D324 G328	D324-V326 PolarHBondContact O-N 3.49Å; V326-G328 PolarHBondContact O-N 2.82Å
327	L	52.8	Low	82.9	Confident	116 Å²	116	49.7 Å²	49.7	61%	0.607	34%	0.342	S	S	*	.			trans	-62.6	109.6	167.5	-70.8	166.9	0	0	0	106.8	S325	S325-L327 PolarHBondContact O-N 3.24Å
328	G	33.3	Very low	81.5	Confident	148 Å²	148	54.2 Å²	54.2	100%	1.526	37%	0.373	S	S	*	.			trans	-71.6	0	174.4	0	0	0	0	0	112.7	V326	V326-G328 PolarHBondContact O-N 2.82Å

Retrieved 328 of 328 residues in 398.8 ms (Link to these results)

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