A0A077Z2E8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z2E8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 122 aa.

						>A0A077Z2E8_TRITR|A0A077Z2E8
MPSRCCVCSSFACSSAVKSSRLDVVIHLWTANPRLPFLQTPFDQWNCSTVSCSSSSSSSFLRLAAIHGYYVTPFWLVKSARRIIVAWPSRPSLALANCNTAMAADILVGFHCWQSECQQFLY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.1	Very low	30	Very low	234 Å²	234	99.4 Å²	99.4	100%	1.153	56%	0.556	S	S	*	*				0	126.8	0	-78	178.3	172	0	0	107.7	S3	M1-S3 PolarHBondContact O-N 2.94Å
2	P	28.6	Very low	31.2	Very low	123 Å²	123	93.3 Å²	93.3	80%	0.799	53%	0.528	S	S	*	.			trans	-59.5	122.2	174.5	22.4	-28.9	0	0	0	109.4	R4	P2-R4 PolarHBondContact O-N 2.99Å
3	S	25.3	Very low	31.8	Very low	116 Å²	116	86.2 Å²	86.2	81%	0.811	49%	0.487	S	S	*	.			trans	-55.7	109.8	173.9	41.3	0	0	0	0	109.5	M1 C5	M1-S3 PolarHBondContact O-N 2.94Å; S3-C5 PolarHBondContact O-N 3.25Å
4	R	27.8	Very low	32.4	Very low	159 Å²	159	82.5 Å²	82.5	60%	0.6	47%	0.47	S	S	*	.			trans	-72.2	113.7	-174.6	-67.8	-177.3	168.8	-178.3	-4.9	109.8	P2 C6	P2-R4 PolarHBondContact O-N 2.99Å; R4-C6 PolarHBondContact O-N 2.9Å
5	C	22.1	Very low	33.1	Very low	111 Å²	111	79.6 Å²	79.6	75%	0.75	46%	0.457	S	S	*	.			trans	-58.8	127.1	178.2	-70.7	0	0	0	0	111.9	S3	S3-C5 PolarHBondContact O-N 3.25Å
6	C	28.5	Very low	33.6	Very low	15 Å²	15	74.8 Å²	74.8	10%	0.101	43%	0.43	C	S	.	.			trans	-155	132.2	162	-86.4	0	0	0	0	110.2	R4 Y69 Y70	R4-C6 PolarHBondContact O-N 2.9Å; C6-Y69 WeakPolarHBondContact CB-O 3.38Å; C6-Y69 PolarHBondContact SG-N 3.08Å; C6-Y69 PolarHBondContact SG-O 3.1Å; C6-Y70 WeakPolarHBondContact SG-CD2 3.12Å
7	V	27.6	Very low	34	Very low	110 Å²	110	72.6 Å²	72.6	67%	0.667	42%	0.418	S	S	*	.			trans	-102.7	98.2	174.4	-177.3	0	0	0	0	106.7	S9 L61	V7-S9 PolarHBondContact O-N 3.29Å; V7-S9 VanDerWaalsContact O-N 3.12Å; V7-L61 HydrophobicContact CG1-CD2 4.1Å
8	C	34.9	Very low	34.3	Very low	11 Å²	11	79.1 Å²	79.1	7%	0.074	44%	0.44	C	S	.	.			trans	-63.6	121.9	163.4	-68.1	0	0	0	0	105.7	S10 F60 A64	C8-S10 PolarHBondContact O-N 3.28Å; C8-F60 HydrophobicContact CB-CD1 4.23Å; C8-F60 HydrophobicContact CB-CE1 3.49Å; C8-F60 VanDerWaalsContact CB-CE1 3.49Å; C8-F60 HydrophobicContact CB-CZ 3.91Å; C8-A64 HydrophobicContact CB-CB 3.19Å; C8-A64 WeakPolarHBondContact SG-CB 3.11Å
9	S	36.4	Very low	34.7	Very low	34 Å²	34	79 Å²	79	24%	0.238	45%	0.446	C	S	.	.			trans	-53.9	116.4	-168.9	75.5	0	0	0	0	110	V7 F11 A12	V7-S9 PolarHBondContact O-N 3.29Å; V7-S9 VanDerWaalsContact O-N 3.12Å; S9-F11 PolarHBondContact O-N 2.82Å; S9-A12 PolarHBondContact O-N 3.19Å; S9-A12 VanDerWaalsContact O-N 3.14Å; S9-A12 PolarHBondContact OG-N 3.4Å
10	S	33.3	Very low	34.9	Very low	50 Å²	50	77.9 Å²	77.9	35%	0.35	44%	0.443	S	S	.	.	H	α-helix	trans	-47.5	-21	157.5	35.6	0	0	0	0	110.5	C8 S14	C8-S10 PolarHBondContact O-N 3.28Å; S10-S14 WeakPolarHBondContact O-CA 3.46Å; S10-S14 WeakPolarHBondContact O-CB 3.08Å; S10-S14 PolarHBondContact O-N 3.42Å; S10-S14 PolarHBondContact O-OG 3.43Å
11	F	39.9	Very low	35.3	Very low	130 Å²	130	86.4 Å²	86.4	57%	0.57	47%	0.469	S	S	*	.	H	α-helix	trans	-59	-43	174.1	-165.6	-99.1	0	0	0	115.1	S9 S15 L76	S9-F11 PolarHBondContact O-N 2.82Å; F11-S15 WeakPolarHBondContact CE1-OG 3.08Å; F11-S15 WeakPolarHBondContact CZ-OG 3.47Å; F11-S15 WeakPolarHBondContact O-CA 3.3Å; F11-S15 WeakPolarHBondContact O-CB 3.08Å; F11-S15 PolarHBondContact O-N 3.38Å; F11-S15 PolarHBondContact O-OG 3.41Å; F11-L76 HydrophobicContact CE1-CD1 4.3Å
12	A	44.2	Very low	36.1	Very low	27 Å²	27	77.7 Å²	77.7	22%	0.223	43%	0.426	C	S	.	.	H	α-helix	trans	-67.3	-47.5	-179.9	0	0	0	0	0	111.2	S9 A16	S9-A12 PolarHBondContact O-N 3.19Å; S9-A12 VanDerWaalsContact O-N 3.14Å; S9-A12 PolarHBondContact OG-N 3.4Å; A12-A16 WeakPolarHBondContact O-CB 3.43Å; A12-A16 PolarHBondContact O-N 3.28Å; A12-A16 VanDerWaalsContact O-N 3.09Å
13	C	39.3	Very low	36.8	Very low	0 Å²	0	78.6 Å²	78.6	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-67.1	-47.4	176.8	-158.2	0	0	0	0	110.5	A16 V17 C52 F60	C13-A16 PolarHBondContact O-N 3.03Å; C13-V17 WeakPolarHBondContact O-CB 3.33Å; C13-V17 WeakPolarHBondContact O-CG2 3.4Å; C13-V17 PolarHBondContact O-N 3.4Å; C13-C52 HydrophobicContact CB-CB 4.29Å; C13-C52 WeakPolarHBondContact CB-SG 3.35Å; C13-C52 WeakPolarHBondContact SG-CB 3.26Å; C13-C52 CovalentContact SG-SG 2.04Å; C13-C52 PolarHBondContact SG-SG 2.79Å; C13-F60 HydrophobicContact CB-CD1 4.29Å; C13-F60 HydrophobicContact CB-CG 4.43Å
14	S	40.4	Very low	37.8	Very low	35 Å²	35	73.6 Å²	73.6	25%	0.245	39%	0.389	C	S	.	.	H	α-helix	trans	-68.6	-35.7	-179.3	-60.7	0	0	0	0	113.1	S10 K18	S10-S14 WeakPolarHBondContact O-CA 3.46Å; S10-S14 WeakPolarHBondContact O-CB 3.08Å; S10-S14 PolarHBondContact O-N 3.42Å; S10-S14 PolarHBondContact O-OG 3.43Å; S14-K18 WeakPolarHBondContact O-CB 3.44Å; S14-K18 WeakPolarHBondContact O-CG 3.37Å; S14-K18 PolarHBondContact O-N 3.37Å
15	S	41.7	Very low	38.7	Very low	39 Å²	39	68.2 Å²	68.2	27%	0.273	37%	0.374	S	S	.	.	H	α-helix	trans	-72.6	-39.7	177.1	-61.4	0	0	0	0	111	F11 S19	F11-S15 WeakPolarHBondContact CE1-OG 3.08Å; F11-S15 WeakPolarHBondContact CZ-OG 3.47Å; F11-S15 WeakPolarHBondContact O-CA 3.3Å; F11-S15 WeakPolarHBondContact O-CB 3.08Å; F11-S15 PolarHBondContact O-N 3.38Å; F11-S15 PolarHBondContact O-OG 3.41Å; S15-S19 WeakPolarHBondContact O-CB 3.4Å; S15-S19 PolarHBondContact O-N 2.99Å; S15-S19 PolarHBondContact O-OG 3.43Å
16	A	41.9	Very low	40.2	Very low	3 Å²	3	63.1 Å²	63.1	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-67.5	-46.8	176	0	0	0	0	0	111	A12 C13 S19 V24 I83	A12-A16 WeakPolarHBondContact O-CB 3.43Å; A12-A16 PolarHBondContact O-N 3.28Å; A12-A16 VanDerWaalsContact O-N 3.09Å; C13-A16 PolarHBondContact O-N 3.03Å; A16-S19 PolarHBondContact O-N 3.03Å; A16-S19 PolarHBondContact O-OG 3.15Å; A16-V24 HydrophobicContact CB-CB 4.18Å; A16-V24 HydrophobicContact CB-CG1 3.9Å; A16-V24 HydrophobicContact CB-CG2 3.4Å; A16-V24 VanDerWaalsContact CB-CG2 3.4Å; A16-I83 HydrophobicContact CB-CD1 4.22Å
17	V	39.8	Very low	41	Very low	38 Å²	38	63.1 Å²	63.1	23%	0.23	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-45	174.6	163.1	0	0	0	0	112.9	C13 S19 S54	C13-V17 WeakPolarHBondContact O-CB 3.33Å; C13-V17 WeakPolarHBondContact O-CG2 3.4Å; C13-V17 PolarHBondContact O-N 3.4Å; V17-S19 PolarHBondContact O-N 3.07Å; V17-S54 VanDerWaalsContact CG1-CA 3.45Å
18	K	40.2	Very low	42.3	Very low	188 Å²	188	59 Å²	59	82%	0.817	31%	0.311	S	S	*	.	H	α-helix	trans	-63.7	-22.5	179.1	-82	176.3	179.6	-175.6	0	112	S14	S14-K18 WeakPolarHBondContact O-CB 3.44Å; S14-K18 WeakPolarHBondContact O-CG 3.37Å; S14-K18 PolarHBondContact O-N 3.37Å
19	S	40.9	Very low	43.1	Very low	78 Å²	78	59.8 Å²	59.8	55%	0.545	31%	0.313	S	S	.	.	H	α-helix	trans	-94.2	-23.1	-168.3	78.6	0	0	0	0	115.7	S15 A16 V17	S15-S19 WeakPolarHBondContact O-CB 3.4Å; S15-S19 PolarHBondContact O-N 2.99Å; S15-S19 PolarHBondContact O-OG 3.43Å; A16-S19 PolarHBondContact O-N 3.03Å; A16-S19 PolarHBondContact O-OG 3.15Å; V17-S19 PolarHBondContact O-N 3.07Å
20	S	39	Very low	43.9	Very low	57 Å²	57	60.1 Å²	60.1	40%	0.399	31%	0.313	S	S	.	.			trans	178.2	163.7	176.3	20.4	0	0	0	0	112.8	L22	S20-L22 PolarHBondContact O-N 3.42Å; S20-L22 VanDerWaalsContact OG-CD1 3.23Å; S20-L22 WeakPolarHBondContact OG-CD1 3.39Å
21	R	43.4	Very low	44.8	Very low	257 Å²	257	58.4 Å²	58.4	97%	0.97	30%	0.303	S	S	*	.	S	Bend	trans	-56.3	56	173.8	-60.5	178.2	173.7	-175.7	-2.8	114.1
22	L	43.2	Very low	45.1	Very low	51 Å²	51	54.1 Å²	54.1	27%	0.267	29%	0.286	S	S	.	.			trans	-118.4	123.8	-173.6	-63.7	168.9	0	0	0	108.5	S20 V24 R81	S20-L22 PolarHBondContact O-N 3.42Å; S20-L22 VanDerWaalsContact OG-CD1 3.23Å; S20-L22 WeakPolarHBondContact OG-CD1 3.39Å; L22-V24 HydrophobicContact CB-CG2 4.28Å; L22-V24 PolarHBondContact O-N 3.07Å; L22-V24 VanDerWaalsContact O-N 3.08Å; L22-R81 WeakPolarHBondContact CD1-O 3.08Å; L22-R81 WeakPolarHBondContact CD2-O 3.33Å
23	D	42.2	Very low	45.5	Very low	142 Å²	142	58.7 Å²	58.7	76%	0.759	31%	0.313	S	S	*	.			trans	-67.7	101.2	162.4	-68.9	-50.1	0	0	0	107.2	V25	D23-V25 PolarHBondContact O-N 3.47Å
24	V	47.5	Very low	46.2	Very low	11 Å²	11	69.4 Å²	69.4	7%	0.067	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	111.8	-178.8	172.4	0	0	0	0	106.7	A16 L22 I26 C52	A16-V24 HydrophobicContact CB-CB 4.18Å; A16-V24 HydrophobicContact CB-CG1 3.9Å; A16-V24 HydrophobicContact CB-CG2 3.4Å; A16-V24 VanDerWaalsContact CB-CG2 3.4Å; L22-V24 HydrophobicContact CB-CG2 4.28Å; L22-V24 PolarHBondContact O-N 3.07Å; L22-V24 VanDerWaalsContact O-N 3.08Å; V24-I26 HydrophobicContact CG1-CG1 4.2Å; V24-C52 HydrophobicContact CB-CB 3.78Å; V24-C52 HydrophobicContact CG1-CB 4.12Å; V24-C52 PolarHBondContact N-O 3.43Å; V24-C52 WeakPolarHBondContact O-CB 3.48Å; V24-C52 PolarHBondContact O-N 3.43Å
25	V	45.8	Very low	46.5	Very low	46 Å²	46	70.4 Å²	70.4	28%	0.279	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.3	176	-174.2	0	0	0	0	108.7	D23 H27 T49	D23-V25 PolarHBondContact O-N 3.47Å; V25-H27 WeakPolarHBondContact CG1-NE2 2.86Å; V25-T49 HydrophobicContact CG1-CG2 4.37Å
26	I	53.9	Low	46.8	Very low	4 Å²	4	72.5 Å²	72.5	2%	0.021	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.9	175.7	-61.6	177.1	0	0	0	107.8	V24 L28 T49 V50 C52 F60 V85	V24-I26 HydrophobicContact CG1-CG1 4.2Å; I26-L28 HydrophobicContact CG2-CD2 4.27Å; I26-L28 HydrophobicContact CG2-CG 4.29Å; I26-T49 CarbonylContact O-C 3.38Å; I26-T49 WeakPolarHBondContact O-CA 3.4Å; I26-V50 PolarHBondContact N-O 3.17Å; I26-V50 PolarHBondContact O-N 3.44Å; I26-C52 VanDerWaalsContact CD1-SG 3.58Å; I26-F60 HydrophobicContact CB-CE2 4.3Å; I26-F60 HydrophobicContact CD1-CD2 3.98Å; I26-F60 HydrophobicContact CD1-CE1 4.48Å; I26-F60 HydrophobicContact CD1-CE2 3.35Å; I26-F60 HydrophobicContact CD1-CZ 3.64Å; I26-F60 HydrophobicContact CG1-CE2 4.4Å; I26-F60 HydrophobicContact CG2-CE2 4.04Å; I26-F60 HydrophobicContact CG2-CZ 4.47Å; I26-V85 HydrophobicContact CG1-CG2 4.41Å; I26-V85 HydrophobicContact CG2-CB 3.96Å; I26-V85 HydrophobicContact CG2-CG1 4.41Å; I26-V85 HydrophobicContact CG2-CG2 4Å
27	H	44.9	Very low	47.1	Very low	14 Å²	14	79.3 Å²	79.3	7%	0.065	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	116.4	174.2	-61.3	-100.1	0	0	0	109.1	V25 S48 T49	V25-H27 WeakPolarHBondContact CG1-NE2 2.86Å; H27-S48 CarbonylContact C-O 3.56Å; H27-S48 WeakPolarHBondContact CA-O 3.37Å; H27-T49 WeakPolarHBondContact CE1-CG2 3.39Å; H27-T49 VanDerWaalsContact ND1-CG2 3.26Å; H27-T49 WeakPolarHBondContact ND1-CG2 3.5Å
28	L	55.9	Low	47.4	Very low	23 Å²	23	85.9 Å²	85.9	12%	0.12	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.6	175.9	-66.5	170.1	0	0	0	109.2	I26 C47 S48 V50 L63	I26-L28 HydrophobicContact CG2-CD2 4.27Å; I26-L28 HydrophobicContact CG2-CG 4.29Å; L28-C47 CarbonylContact O-C 3.55Å; L28-S48 WeakPolarHBondContact CB-OG 3.26Å; L28-S48 PolarHBondContact N-O 2.96Å; L28-S48 PolarHBondContact O-N 2.81Å; L28-S48 PolarHBondContact O-OG 2.92Å; L28-V50 HydrophobicContact CD1-CG2 3.92Å; L28-L63 HydrophobicContact CD1-CD2 3.87Å
29	W	51	Low	47.7	Very low	28 Å²	28	84.4 Å²	84.4	11%	0.106	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128	176.7	-67.9	83.5	0	0	0	110.1	W45 N46 C47 A94 N97 C98	W29-W45 HydrophobicContact CB-CE3 3.91Å; W29-W45 HydrophobicContact CE3-CB 3.74Å; W29-W45 HydrophobicContact CZ3-CB 4.32Å; W29-N46 WeakPolarHBondContact CA-O 3.16Å; W29-C47 HydrophobicContact CD2-CB 4Å; W29-C47 VanDerWaalsContact CE2-SG 3.56Å; W29-C47 HydrophobicContact CE3-CB 3.89Å; W29-C47 HydrophobicContact CH2-CB 3.72Å; W29-C47 HydrophobicContact CZ2-CB 3.82Å; W29-C47 VanDerWaalsContact CZ2-SG 3.56Å; W29-C47 HydrophobicContact CZ3-CB 3.76Å; W29-A94 HydrophobicContact CH2-CB 3.96Å; W29-A94 WeakPolarHBondContact CH2-O 3.5Å; W29-A94 HydrophobicContact CZ2-CB 3.61Å; W29-A94 WeakPolarHBondContact CZ2-O 3.02Å; W29-N97 HydrophobicContact CH2-CB 3.89Å; W29-N97 HydrophobicContact CZ3-CB 4.38Å; W29-C98 HydrophobicContact CH2-CB 3.86Å; W29-C98 HydrophobicContact CZ2-CB 3.58Å
30	T	53.5	Low	47.8	Very low	41 Å²	41	81.3 Å²	81.3	25%	0.252	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	134.9	174	45	0	0	0	0	110.5	N32 W45 N46 Y69	T30-N32 PolarHBondContact O-N 2.87Å; T30-W45 CarbonylContact O-C 3.46Å; T30-W45 VanDerWaalsContact O-CA 3.26Å; T30-W45 WeakPolarHBondContact O-CA 3Å; T30-N46 PolarHBondContact N-O 3.4Å; T30-N46 PolarHBondContact O-N 3.2Å; T30-N46 PolarHBondContact OG1-O 3.44Å; T30-Y69 HydrophobicContact CG2-CE1 4.45Å; T30-Y69 WeakPolarHBondContact CG2-OH 3.03Å
31	A	52.9	Low	48.4	Very low	15 Å²	15	81.3 Å²	81.3	12%	0.124	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	136	164.9	0	0	0	0	0	108.7	P33 F37 W45	A31-P33 WeakPolarHBondContact O-CD 3.09Å; A31-P33 VanDerWaalsContact O-N 3.16Å; A31-F37 HydrophobicContact CB-CD2 3.85Å; A31-F37 HydrophobicContact CB-CE2 3.69Å; A31-F37 HydrophobicContact CB-CZ 4.41Å; A31-W45 HydrophobicContact CB-CD2 4.33Å; A31-W45 HydrophobicContact CB-CH2 4.21Å; A31-W45 HydrophobicContact CB-CZ2 4.02Å; A31-W45 HydrophobicContact CB-CZ3 4.48Å
32	N	45.9	Very low	48.6	Very low	40 Å²	40	73.1 Å²	73.1	21%	0.214	38%	0.375	C	S	.	.			trans	-61.7	120.5	174.4	-179.9	-14.2	0	0	0	109	T30 R34 L35 Q44	T30-N32 PolarHBondContact O-N 2.87Å; N32-R34 PolarHBondContact O-N 3.35Å; N32-R34 WeakPolarHBondContact OD1-CB 3.36Å; N32-R34 WeakPolarHBondContact OD1-CG 3.49Å; N32-R34 PolarHBondContact OD1-N 3.44Å; N32-L35 HydrophobicContact CB-CD1 3.83Å; N32-L35 PolarHBondContact O-N 2.95Å; N32-Q44 WeakPolarHBondContact CB-O 3.34Å; N32-Q44 PolarHBondContact N-O 3.42Å
33	P	52.6	Low	48.9	Very low	122 Å²	122	75.8 Å²	75.8	79%	0.792	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-13	-174.5	26.5	-35.9	0	0	0	113.1	A31 L35	A31-P33 WeakPolarHBondContact O-CD 3.09Å; A31-P33 VanDerWaalsContact O-N 3.16Å; P33-L35 PolarHBondContact O-N 3.46Å
34	R	52.9	Low	49.3	Very low	225 Å²	225	72.1 Å²	72.1	85%	0.849	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-8.7	176.1	-62.2	-177.9	174.7	-174.6	-1.5	113.4	N32	N32-R34 PolarHBondContact O-N 3.35Å; N32-R34 WeakPolarHBondContact OD1-CB 3.36Å; N32-R34 WeakPolarHBondContact OD1-CG 3.49Å; N32-R34 PolarHBondContact OD1-N 3.44Å
35	L	46.5	Very low	49.5	Very low	57 Å²	57	73 Å²	73	30%	0.298	37%	0.369	S	S	.	.	S	Bend	trans	-121.5	140.8	-173.4	-70.2	134.7	0	0	0	111	N32 P33 F37 T40 Q44	N32-L35 HydrophobicContact CB-CD1 3.83Å; N32-L35 PolarHBondContact O-N 2.95Å; P33-L35 PolarHBondContact O-N 3.46Å; L35-F37 PolarHBondContact O-N 3.28Å; L35-T40 HydrophobicContact CB-CG2 3.81Å; L35-T40 WeakPolarHBondContact CB-OG1 3.49Å; L35-T40 HydrophobicContact CD1-CG2 3.97Å; L35-T40 HydrophobicContact CG-CG2 4.42Å; L35-Q44 HydrophobicContact CD1-CB 4Å; L35-Q44 HydrophobicContact CD1-CG 4.36Å; L35-Q44 VanDerWaalsContact CD2-OE1 3.24Å
36	P	49.1	Very low	49.8	Very low	83 Å²	83	74.9 Å²	74.9	54%	0.539	38%	0.378	S	S	.	.			trans	-61.6	124.6	177.6	24.5	-31.7	0	0	0	110.2	L38 Q39 T40	P36-L38 PolarHBondContact O-N 3.13Å; P36-Q39 HydrophobicContact CG-CB 4.47Å; P36-Q39 PolarHBondContact O-N 3.21Å; P36-T40 PolarHBondContact O-N 3.15Å; P36-T40 PolarHBondContact O-OG1 2.98Å; P36-T40 VanDerWaalsContact O-OG1 3.1Å
37	F	48.9	Very low	49.7	Very low	146 Å²	146	76.5 Å²	76.5	64%	0.64	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.7	-167.9	-154.1	-89.4	0	0	0	114.8	A31 L35 Q39 W45	A31-F37 HydrophobicContact CB-CD2 3.85Å; A31-F37 HydrophobicContact CB-CE2 3.69Å; A31-F37 HydrophobicContact CB-CZ 4.41Å; L35-F37 PolarHBondContact O-N 3.28Å; F37-Q39 VanDerWaalsContact C-N 3.32Å; F37-W45 HydrophobicContact CZ-CH2 4.44Å
38	L	46	Very low	50.1	Low	176 Å²	176	78.2 Å²	78.2	92%	0.921	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.8	-177.7	-83.4	154.3	0	0	0	114	P36	P36-L38 PolarHBondContact O-N 3.13Å
39	Q	44.7	Very low	49.9	Very low	157 Å²	157	81 Å²	81	73%	0.734	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	-4.8	-172.6	-68.6	-176.4	-28.7	0	0	114	P36 F37 P41	P36-Q39 HydrophobicContact CG-CB 4.47Å; P36-Q39 PolarHBondContact O-N 3.21Å; F37-Q39 VanDerWaalsContact C-N 3.32Å; Q39-P41 WeakPolarHBondContact O-CD 2.87Å
40	T	43	Very low	49.9	Very low	13 Å²	13	80.7 Å²	80.7	8%	0.08	42%	0.422	C	S	.	.			trans	-62.2	108.8	-178.6	-44.9	0	0	0	0	109.9	L35 P36 Q44	L35-T40 HydrophobicContact CB-CG2 3.81Å; L35-T40 WeakPolarHBondContact CB-OG1 3.49Å; L35-T40 HydrophobicContact CD1-CG2 3.97Å; L35-T40 HydrophobicContact CG-CG2 4.42Å; P36-T40 PolarHBondContact O-N 3.15Å; P36-T40 PolarHBondContact O-OG1 2.98Å; P36-T40 VanDerWaalsContact O-OG1 3.1Å; T40-Q44 HydrophobicContact CG2-CB 3.58Å
41	P	51.6	Low	49.7	Very low	57 Å²	57	82.5 Å²	82.5	37%	0.37	44%	0.436	S	S	.	.			trans	-64.2	149.3	177.9	33.3	-37.3	0	0	0	108.9	Q39 D43 Q44	Q39-P41 WeakPolarHBondContact O-CD 2.87Å; P41-D43 WeakPolarHBondContact CB-OD1 3.48Å; P41-D43 VanDerWaalsContact CG-OD1 3.3Å; P41-D43 WeakPolarHBondContact CG-OD1 3.17Å; P41-D43 PolarHBondContact O-N 2.84Å; P41-D43 VanDerWaalsContact O-N 3.08Å; P41-Q44 HydrophobicContact CG-CG 4.13Å; P41-Q44 WeakPolarHBondContact O-CB 3.2Å; P41-Q44 PolarHBondContact O-N 3.2Å
42	F	49.2	Very low	49.4	Very low	84 Å²	84	81.8 Å²	81.8	37%	0.368	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-61.6	-22.2	-165.8	-73.7	-73.3	0	0	0	114.5	Q44 W45 P88	F42-Q44 PolarHBondContact O-N 3.19Å; F42-W45 PolarHBondContact O-N 3.19Å; F42-P88 HydrophobicContact CD1-CB 3.65Å; F42-P88 HydrophobicContact CD1-CG 3.88Å; F42-P88 HydrophobicContact CE1-CB 3.42Å; F42-P88 VanDerWaalsContact CE1-CB 3.42Å; F42-P88 HydrophobicContact CE1-CG 4.18Å; F42-P88 HydrophobicContact CZ-CB 4.17Å
43	D	48.9	Very low	49.4	Very low	107 Å²	107	82.2 Å²	82.2	57%	0.572	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-64	-14.8	171.3	56.4	-52.6	0	0	0	113.7	P41	P41-D43 WeakPolarHBondContact CB-OD1 3.48Å; P41-D43 VanDerWaalsContact CG-OD1 3.3Å; P41-D43 WeakPolarHBondContact CG-OD1 3.17Å; P41-D43 PolarHBondContact O-N 2.84Å; P41-D43 VanDerWaalsContact O-N 3.08Å
44	Q	50.3	Low	49.2	Very low	65 Å²	65	81 Å²	81	30%	0.304	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-105.1	15.6	-179	-61.3	-179.7	-6.1	0	0	113.2	N32 L35 T40 P41 F42	N32-Q44 WeakPolarHBondContact CB-O 3.34Å; N32-Q44 PolarHBondContact N-O 3.42Å; L35-Q44 HydrophobicContact CD1-CB 4Å; L35-Q44 HydrophobicContact CD1-CG 4.36Å; L35-Q44 VanDerWaalsContact CD2-OE1 3.24Å; T40-Q44 HydrophobicContact CG2-CB 3.58Å; P41-Q44 HydrophobicContact CG-CG 4.13Å; P41-Q44 WeakPolarHBondContact O-CB 3.2Å; P41-Q44 PolarHBondContact O-N 3.2Å; F42-Q44 PolarHBondContact O-N 3.19Å
45	W	51	Low	48.8	Very low	29 Å²	29	75.1 Å²	75.1	11%	0.11	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.7	171.9	-72.2	56.5	0	0	0	110.2	W29 T30 A31 F37 F42 W87	W29-W45 HydrophobicContact CB-CE3 3.91Å; W29-W45 HydrophobicContact CE3-CB 3.74Å; W29-W45 HydrophobicContact CZ3-CB 4.32Å; T30-W45 CarbonylContact O-C 3.46Å; T30-W45 VanDerWaalsContact O-CA 3.26Å; T30-W45 WeakPolarHBondContact O-CA 3Å; A31-W45 HydrophobicContact CB-CD2 4.33Å; A31-W45 HydrophobicContact CB-CH2 4.21Å; A31-W45 HydrophobicContact CB-CZ2 4.02Å; A31-W45 HydrophobicContact CB-CZ3 4.48Å; F37-W45 HydrophobicContact CZ-CH2 4.44Å; F42-W45 PolarHBondContact O-N 3.19Å; W45-W87 AromaticContact CH2-CE3 3.96Å; W45-W87 HydrophobicContact CH2-CE3 3.96Å; W45-W87 AromaticContact CH2-CH2 3.28Å; W45-W87 HydrophobicContact CH2-CH2 3.28Å; W45-W87 HydrophobicContact CH2-CZ2 4.14Å; W45-W87 AromaticContact CH2-CZ3 3.19Å; W45-W87 HydrophobicContact CH2-CZ3 3.19Å; W45-W87 HydrophobicContact CZ2-CH2 4.07Å; W45-W87 HydrophobicContact CZ2-CZ3 4.33Å; W45-W87 AromaticContact CZ3-CE3 3.73Å; W45-W87 HydrophobicContact CZ3-CE3 3.73Å; W45-W87 AromaticContact CZ3-CH2 3.95Å; W45-W87 HydrophobicContact CZ3-CH2 3.95Å; W45-W87 AromaticContact CZ3-CZ3 3.36Å; W45-W87 HydrophobicContact CZ3-CZ3 3.36Å
46	N	52.5	Low	48.7	Very low	86 Å²	86	73.3 Å²	73.3	46%	0.46	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	121.4	176.7	-66	-32.7	0	0	0	109.5	W29 T30	W29-N46 WeakPolarHBondContact CA-O 3.16Å; T30-N46 PolarHBondContact N-O 3.4Å; T30-N46 PolarHBondContact O-N 3.2Å; T30-N46 PolarHBondContact OG1-O 3.44Å
47	C	52.5	Low	48.4	Very low	39 Å²	39	71.8 Å²	71.8	26%	0.264	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	133.5	170.4	-165.4	0	0	0	0	110.1	L28 W29 C98	L28-C47 CarbonylContact O-C 3.55Å; W29-C47 HydrophobicContact CD2-CB 4Å; W29-C47 VanDerWaalsContact CE2-SG 3.56Å; W29-C47 HydrophobicContact CE3-CB 3.89Å; W29-C47 HydrophobicContact CH2-CB 3.72Å; W29-C47 HydrophobicContact CZ2-CB 3.82Å; W29-C47 VanDerWaalsContact CZ2-SG 3.56Å; W29-C47 HydrophobicContact CZ3-CB 3.76Å; C47-C98 HydrophobicContact CB-CB 3.84Å; C47-C98 WeakPolarHBondContact CB-SG 3.46Å; C47-C98 WeakPolarHBondContact SG-CB 3.24Å; C47-C98 CovalentContact SG-SG 2.05Å; C47-C98 PolarHBondContact SG-SG 2.82Å
48	S	52.9	Low	47.8	Very low	49 Å²	49	68.3 Å²	68.3	34%	0.343	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	138.5	171.2	58	0	0	0	0	110.1	H27 L28	H27-S48 CarbonylContact C-O 3.56Å; H27-S48 WeakPolarHBondContact CA-O 3.37Å; L28-S48 WeakPolarHBondContact CB-OG 3.26Å; L28-S48 PolarHBondContact N-O 2.96Å; L28-S48 PolarHBondContact O-N 2.81Å; L28-S48 PolarHBondContact O-OG 2.92Å
49	T	52.5	Low	47.1	Very low	81 Å²	81	63.3 Å²	63.3	50%	0.497	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.8	-176.9	57.8	0	0	0	0	110.9	V25 I26 H27	V25-T49 HydrophobicContact CG1-CG2 4.37Å; I26-T49 CarbonylContact O-C 3.38Å; I26-T49 WeakPolarHBondContact O-CA 3.4Å; H27-T49 WeakPolarHBondContact CE1-CG2 3.39Å; H27-T49 VanDerWaalsContact ND1-CG2 3.26Å; H27-T49 WeakPolarHBondContact ND1-CG2 3.5Å
50	V	49.9	Very low	46.6	Very low	23 Å²	23	56.5 Å²	56.5	14%	0.139	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118	173.9	-171.2	0	0	0	0	109.2	I26 L28 F60 L63	I26-V50 PolarHBondContact N-O 3.17Å; I26-V50 PolarHBondContact O-N 3.44Å; L28-V50 HydrophobicContact CD1-CG2 3.92Å; V50-F60 HydrophobicContact CB-CD2 4.49Å; V50-F60 HydrophobicContact CG1-CD2 4.05Å; V50-L63 HydrophobicContact CG2-CD2 3.49Å; V50-L63 VanDerWaalsContact CG2-CD2 3.49Å
51	S	49.7	Very low	46.1	Very low	78 Å²	78	59 Å²	59	55%	0.545	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	118.2	172	-55.8	0	0	0	0	110.3	S56	S51-S56 PolarHBondContact O-OG 3.19Å
52	C	46.3	Very low	45.1	Very low	1 Å²	1	65.6 Å²	65.6	1%	0.007	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.3	168.5	-86	0	0	0	0	109.2	C13 V24 I26	C13-C52 HydrophobicContact CB-CB 4.29Å; C13-C52 WeakPolarHBondContact CB-SG 3.35Å; C13-C52 WeakPolarHBondContact SG-CB 3.26Å; C13-C52 CovalentContact SG-SG 2.04Å; C13-C52 PolarHBondContact SG-SG 2.79Å; V24-C52 HydrophobicContact CB-CB 3.78Å; V24-C52 HydrophobicContact CG1-CB 4.12Å; V24-C52 PolarHBondContact N-O 3.43Å; V24-C52 WeakPolarHBondContact O-CB 3.48Å; V24-C52 PolarHBondContact O-N 3.43Å; I26-C52 VanDerWaalsContact CD1-SG 3.58Å
53	S	46	Very low	44.3	Very low	49 Å²	49	64.7 Å²	64.7	34%	0.343	38%	0.378	S	S	.	.			trans	-116.4	162.8	166.5	71.5	0	0	0	0	108.7	S55 S56	S53-S55 PolarHBondContact O-N 3.28Å; S53-S56 PolarHBondContact N-OG 2.77Å; S53-S56 PolarHBondContact O-N 2.05Å; S53-S56 PolarHBondContact O-OG 3.13Å; S53-S56 PolarHBondContact OG-N 3.28Å; S53-S56 PolarHBondContact OG-OG 3.06Å
54	S	48.5	Very low	43.6	Very low	96 Å²	96	59.7 Å²	59.7	67%	0.671	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-22.6	177.4	52.2	0	0	0	0	114.3	V17	V17-S54 VanDerWaalsContact CG1-CA 3.45Å
55	S	45.7	Very low	42.6	Very low	101 Å²	101	59.3 Å²	59.3	71%	0.706	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-12.8	-179.1	-41.9	0	0	0	0	113.6	S53	S53-S55 PolarHBondContact O-N 3.28Å
56	S	43.2	Very low	41.6	Very low	20 Å²	20	63.6 Å²	63.6	14%	0.14	38%	0.384	C	S	.	.			trans	-105.7	16.4	-170	70.1	0	0	0	0	115.2	S51 S53 S58 S59 F60	S51-S56 PolarHBondContact O-OG 3.19Å; S53-S56 PolarHBondContact N-OG 2.77Å; S53-S56 PolarHBondContact O-N 2.05Å; S53-S56 PolarHBondContact O-OG 3.13Å; S53-S56 PolarHBondContact OG-N 3.28Å; S53-S56 PolarHBondContact OG-OG 3.06Å; S56-S58 PolarHBondContact O-N 3.08Å; S56-S58 VanDerWaalsContact O-N 3.07Å; S56-S59 PolarHBondContact O-N 3.12Å; S56-F60 PolarHBondContact O-N 2.93Å
57	S	42.3	Very low	40.7	Very low	51 Å²	51	65.2 Å²	65.2	36%	0.357	39%	0.388	S	S	.	.	H	α-helix	trans	-54.1	-28.2	174.5	58.8	0	0	0	0	113.2
58	S	36	Very low	39.6	Very low	72 Å²	72	64.8 Å²	64.8	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-77.6	-32.8	176.7	57.3	0	0	0	0	114.2	S56 R62	S56-S58 PolarHBondContact O-N 3.08Å; S56-S58 VanDerWaalsContact O-N 3.07Å; S58-R62 PolarHBondContact O-N 3.43Å
59	S	33.4	Very low	38.7	Very low	71 Å²	71	64.6 Å²	64.6	50%	0.497	38%	0.382	S	S	.	.	H	α-helix	trans	-72.2	-35.2	-179.4	-55.4	0	0	0	0	112.2	S56 R62 L63	S56-S59 PolarHBondContact O-N 3.12Å; S59-R62 PolarHBondContact O-N 3.48Å; S59-L63 PolarHBondContact O-N 3.28Å; S59-L63 VanDerWaalsContact O-N 3.13Å
60	F	33.9	Very low	37.6	Very low	14 Å²	14	65 Å²	65	6%	0.061	38%	0.375	C	S	.	.	H	α-helix	trans	-64.1	-40.3	176.7	-172.1	-104.7	0	0	0	112	C8 C13 I26 V50 S56 R62 L63 A64	C8-F60 HydrophobicContact CB-CD1 4.23Å; C8-F60 HydrophobicContact CB-CE1 3.49Å; C8-F60 VanDerWaalsContact CB-CE1 3.49Å; C8-F60 HydrophobicContact CB-CZ 3.91Å; C13-F60 HydrophobicContact CB-CD1 4.29Å; C13-F60 HydrophobicContact CB-CG 4.43Å; I26-F60 HydrophobicContact CB-CE2 4.3Å; I26-F60 HydrophobicContact CD1-CD2 3.98Å; I26-F60 HydrophobicContact CD1-CE1 4.48Å; I26-F60 HydrophobicContact CD1-CE2 3.35Å; I26-F60 HydrophobicContact CD1-CZ 3.64Å; I26-F60 HydrophobicContact CG1-CE2 4.4Å; I26-F60 HydrophobicContact CG2-CE2 4.04Å; I26-F60 HydrophobicContact CG2-CZ 4.47Å; V50-F60 HydrophobicContact CB-CD2 4.49Å; V50-F60 HydrophobicContact CG1-CD2 4.05Å; S56-F60 PolarHBondContact O-N 2.93Å; F60-R62 VanDerWaalsContact C-N 3.33Å; F60-R62 PolarHBondContact O-N 3.06Å; F60-L63 PolarHBondContact O-N 3.34Å; F60-A64 VanDerWaalsContact O-CB 3.3Å; F60-A64 WeakPolarHBondContact O-CB 3.48Å; F60-A64 PolarHBondContact O-N 3.36Å; F60-A64 VanDerWaalsContact O-N 3.13Å
61	L	31.8	Very low	36.6	Very low	67 Å²	67	66.7 Å²	66.7	35%	0.351	39%	0.385	S	S	.	.	H	α-helix	trans	-62.9	-37.9	174.8	-70	171.6	0	0	0	112.2	V7 A65	V7-L61 HydrophobicContact CG1-CD2 4.1Å; L61-A65 VanDerWaalsContact O-CB 3.24Å; L61-A65 WeakPolarHBondContact O-CB 3.36Å; L61-A65 PolarHBondContact O-N 3.44Å
62	R	30.5	Very low	35.6	Very low	194 Å²	194	66.3 Å²	66.3	73%	0.732	38%	0.38	S	S	*	.	H	α-helix	trans	-66.8	-44.4	176.7	-81.8	-176.5	167.2	-176.3	-3.3	111.9	S58 S59 F60 A64 A65 I66	S58-R62 PolarHBondContact O-N 3.43Å; S59-R62 PolarHBondContact O-N 3.48Å; F60-R62 VanDerWaalsContact C-N 3.33Å; F60-R62 PolarHBondContact O-N 3.06Å; R62-A64 VanDerWaalsContact C-N 3.32Å; R62-A64 PolarHBondContact O-N 2.85Å; R62-A65 PolarHBondContact O-N 3.49Å; R62-I66 WeakPolarHBondContact O-CD1 3.15Å; R62-I66 WeakPolarHBondContact O-CG1 3.28Å; R62-I66 PolarHBondContact O-N 3.09Å; R62-I66 VanDerWaalsContact O-N 3.09Å
63	L	33.1	Very low	34.7	Very low	66 Å²	66	72.5 Å²	72.5	35%	0.346	42%	0.42	S	S	.	.	H	α-helix	trans	-67	-36.9	-177.8	-145.4	88.5	0	0	0	112.5	L28 V50 S59 F60 I66	L28-L63 HydrophobicContact CD1-CD2 3.87Å; V50-L63 HydrophobicContact CG2-CD2 3.49Å; V50-L63 VanDerWaalsContact CG2-CD2 3.49Å; S59-L63 PolarHBondContact O-N 3.28Å; S59-L63 VanDerWaalsContact O-N 3.13Å; F60-L63 PolarHBondContact O-N 3.34Å; L63-I66 PolarHBondContact O-N 2.89Å
64	A	34.2	Very low	33.9	Very low	2 Å²	2	73.5 Å²	73.5	2%	0.017	42%	0.419	C	S	.	.	H	α-helix	trans	-62.1	-46.7	173	0	0	0	0	0	114.2	C8 F60 R62 I66 H67 G68	C8-A64 HydrophobicContact CB-CB 3.19Å; C8-A64 WeakPolarHBondContact SG-CB 3.11Å; F60-A64 VanDerWaalsContact O-CB 3.3Å; F60-A64 WeakPolarHBondContact O-CB 3.48Å; F60-A64 PolarHBondContact O-N 3.36Å; F60-A64 VanDerWaalsContact O-N 3.13Å; R62-A64 VanDerWaalsContact C-N 3.32Å; R62-A64 PolarHBondContact O-N 2.85Å; A64-I66 VanDerWaalsContact C-N 3.27Å; A64-I66 PolarHBondContact O-N 2.8Å; A64-H67 PolarHBondContact O-N 3.13Å; A64-G68 PolarHBondContact O-N 2.73Å
65	A	28	Very low	32.8	Very low	57 Å²	57	80.5 Å²	80.5	47%	0.471	43%	0.431	S	S	.	.	H	α-helix	trans	-69	-26	-179.6	0	0	0	0	0	112.3	L61 R62	L61-A65 VanDerWaalsContact O-CB 3.24Å; L61-A65 WeakPolarHBondContact O-CB 3.36Å; L61-A65 PolarHBondContact O-N 3.44Å; R62-A65 PolarHBondContact O-N 3.49Å
66	I	30.4	Very low	32.1	Very low	119 Å²	119	80.9 Å²	80.9	61%	0.61	42%	0.424	S	S	*	.	H	α-helix	trans	-71.9	-30.7	177.6	-68.8	162.6	0	0	0	111.8	R62 L63 A64	R62-I66 WeakPolarHBondContact O-CD1 3.15Å; R62-I66 WeakPolarHBondContact O-CG1 3.28Å; R62-I66 PolarHBondContact O-N 3.09Å; R62-I66 VanDerWaalsContact O-N 3.09Å; L63-I66 PolarHBondContact O-N 2.89Å; A64-I66 VanDerWaalsContact C-N 3.27Å; A64-I66 PolarHBondContact O-N 2.8Å
67	H	34.6	Very low	31.3	Very low	120 Å²	120	85.2 Å²	85.2	56%	0.556	45%	0.449	S	S	*	.	H	α-helix	trans	-118	-2.2	-169.2	-69	-63.8	0	0	0	117	A64 Y69	A64-H67 PolarHBondContact O-N 3.13Å; H67-Y69 HydrophobicContact CB-CD2 4.25Å; H67-Y69 HydrophobicContact CB-CE2 3.45Å; H67-Y69 VanDerWaalsContact CB-CE2 3.45Å
68	G	29.2	Very low	30.7	Very low	29 Å²	29	92.3 Å²	92.3	30%	0.299	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	57.8	165.3	0	0	0	0	0	115.8	A64	A64-G68 PolarHBondContact O-N 2.73Å
69	Y	33.1	Very low	30.4	Very low	45 Å²	45	92.5 Å²	92.5	18%	0.176	48%	0.475	C	S	.	.			trans	-104.9	129.8	177.8	-54.3	-74.6	0	0	0	116.3	C6 T30 H67 C112	C6-Y69 WeakPolarHBondContact CB-O 3.38Å; C6-Y69 PolarHBondContact SG-N 3.08Å; C6-Y69 PolarHBondContact SG-O 3.1Å; T30-Y69 HydrophobicContact CG2-CE1 4.45Å; T30-Y69 WeakPolarHBondContact CG2-OH 3.03Å; H67-Y69 HydrophobicContact CB-CD2 4.25Å; H67-Y69 HydrophobicContact CB-CE2 3.45Å; H67-Y69 VanDerWaalsContact CB-CE2 3.45Å; Y69-C112 VanDerWaalsContact CA-SG 3.58Å
70	Y	28.9	Very low	30.3	Very low	89 Å²	89	93.4 Å²	93.4	35%	0.349	49%	0.487	S	S	.	.			trans	-94.6	155.9	167.8	-102.3	-92.9	0	0	0	113.3	C6 C112	C6-Y70 WeakPolarHBondContact SG-CD2 3.12Å; Y70-C112 PolarHBondContact N-SG 3Å; Y70-C112 PolarHBondContact O-SG 3.02Å
71	V	30	Very low	30.1	Very low	59 Å²	59	102.2 Å²	102.2	36%	0.358	52%	0.52	S	S	.	.			trans	-125.4	122.1	-170.5	169.9	0	0	0	0	110.9	F110	V71-F110 HydrophobicContact CB-CD1 4.13Å; V71-F110 HydrophobicContact CB-CE1 4.35Å; V71-F110 HydrophobicContact CG1-CD1 3.71Å; V71-F110 HydrophobicContact CG1-CE1 3.53Å; V71-F110 HydrophobicContact CG2-CD1 4.09Å; V71-F110 HydrophobicContact CG2-CE1 4.25Å
72	T	27.5	Very low	30.1	Very low	71 Å²	71	105 Å²	105	44%	0.436	53%	0.526	S	S	.	.			trans	-94.6	138.5	165.3	47	0	0	0	0	110.8	F74	T72-F74 PolarHBondContact O-N 2.76Å
73	P	27.9	Very low	30.3	Very low	131 Å²	131	98.4 Å²	98.4	85%	0.851	50%	0.504	S	S	*	.			trans	-73.9	124	177.7	29.9	-32.5	0	0	0	110.2
74	F	30.6	Very low	30.3	Very low	70 Å²	70	96.1 Å²	96.1	31%	0.307	49%	0.492	S	S	.	.			trans	-125.6	160.7	161.5	56	-83.3	0	0	0	109.5	T72 L76 V108 G109 F110	T72-F74 PolarHBondContact O-N 2.76Å; F74-L76 PolarHBondContact O-N 3.14Å; F74-V108 HydrophobicContact CE1-CG1 4.09Å; F74-V108 HydrophobicContact CE2-CB 3.53Å; F74-V108 HydrophobicContact CE2-CG1 3.46Å; F74-V108 VanDerWaalsContact CE2-CG1 3.46Å; F74-V108 HydrophobicContact CE2-CG2 3.7Å; F74-V108 VanDerWaalsContact CZ-C 3.41Å; F74-V108 HydrophobicContact CZ-CB 3.45Å; F74-V108 VanDerWaalsContact CZ-CB 3.45Å; F74-V108 HydrophobicContact CZ-CG1 3.02Å; F74-V108 HydrophobicContact CZ-CG2 4.13Å; F74-G109 WeakPolarHBondContact CD1-O 3.09Å; F74-G109 WeakPolarHBondContact CE1-O 2.93Å; F74-G109 WeakPolarHBondContact CZ-O 3.35Å; F74-F110 AromaticContact CE1-CD1 3.93Å; F74-F110 HydrophobicContact CE1-CD1 3.93Å; F74-F110 AromaticContact CE1-CE1 3.68Å; F74-F110 HydrophobicContact CE1-CE1 3.68Å; F74-F110 HydrophobicContact CE1-CZ 4.2Å; F74-F110 HydrophobicContact CZ-CE1 4.29Å; F74-F110 HydrophobicContact CZ-CZ 4.38Å
75	W	25.1	Very low	30.5	Very low	243 Å²	243	96.6 Å²	96.6	92%	0.92	50%	0.495	S	S	*	.			trans	-69.1	117.7	-168	-61.8	68.7	0	0	0	109.7	V77	W75-V77 PolarHBondContact O-N 3.31Å
76	L	30.3	Very low	30.6	Very low	109 Å²	109	94.1 Å²	94.1	57%	0.571	47%	0.474	S	S	*	.			trans	-63.4	103.5	169.4	-72.5	164.3	0	0	0	108.5	F11 F74 K78	F11-L76 HydrophobicContact CE1-CD1 4.3Å; F74-L76 PolarHBondContact O-N 3.14Å; L76-K78 PolarHBondContact O-N 2.96Å; L76-K78 VanDerWaalsContact O-N 3.13Å
77	V	26.3	Very low	31	Very low	111 Å²	111	91.9 Å²	91.9	67%	0.673	46%	0.459	S	S	*	.			trans	-77.5	99.5	164.2	-173.3	0	0	0	0	106.8	W75 S79 I106	W75-V77 PolarHBondContact O-N 3.31Å; V77-S79 PolarHBondContact O-N 2.88Å; V77-S79 VanDerWaalsContact O-N 3.08Å; V77-I106 WeakPolarHBondContact O-CD1 3.3Å
78	K	30.3	Very low	31	Very low	199 Å²	199	86.8 Å²	86.8	87%	0.865	44%	0.436	S	S	*	.			trans	-66.8	103.8	176.3	-173.9	-178.3	-179.2	-178.3	0	109.2	L76	L76-K78 PolarHBondContact O-N 2.96Å; L76-K78 VanDerWaalsContact O-N 3.13Å
79	S	29	Very low	31.3	Very low	77 Å²	77	90.2 Å²	90.2	54%	0.538	46%	0.455	S	S	.	.			trans	-97.9	147.6	155.8	-178.7	0	0	0	0	109	V77 R81	V77-S79 PolarHBondContact O-N 2.88Å; V77-S79 VanDerWaalsContact O-N 3.08Å; S79-R81 PolarHBondContact O-N 3.09Å
80	A	31.8	Very low	31.7	Very low	90 Å²	90	96 Å²	96	74%	0.744	48%	0.477	S	S	*	.	S	Bend	trans	-63.8	-2.9	-164.8	0	0	0	0	0	115.8
81	R	30.4	Very low	32.3	Very low	198 Å²	198	93.9 Å²	93.9	75%	0.747	47%	0.474	S	S	*	.	S	Bend	trans	-134.8	-22.1	-170.3	-68.3	-168.5	179.9	-175.5	1	119.4	L22 S79	L22-R81 WeakPolarHBondContact CD1-O 3.08Å; L22-R81 WeakPolarHBondContact CD2-O 3.33Å; S79-R81 PolarHBondContact O-N 3.09Å
82	R	30.6	Very low	32.9	Very low	126 Å²	126	95.4 Å²	95.4	48%	0.475	49%	0.487	S	S	.	.			trans	-160.1	156.3	-174.7	-62.5	-172.9	178.5	161	-3.3	113.6	A103 I106	R82-A103 PolarHBondContact NH1-O 2.68Å; R82-I106 WeakPolarHBondContact O-CD1 3.35Å
83	I	35.2	Very low	33.7	Very low	55 Å²	55	95.7 Å²	95.7	28%	0.282	49%	0.486	S	S	.	.			trans	-132.5	118.3	171.7	-57.7	175.1	0	0	0	107.4	A16 V108	A16-I83 HydrophobicContact CB-CD1 4.22Å; I83-V108 HydrophobicContact CG2-CG2 3.99Å
84	I	33.7	Very low	34.5	Very low	19 Å²	19	89.7 Å²	89.7	10%	0.097	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.8	168.1	-68.5	-152.3	0	0	0	110.1	A86 D105 I106 L107 V108	I84-A86 HydrophobicContact CG2-CB 4.32Å; I84-D105 HydrophobicContact CB-CB 3.85Å; I84-D105 HydrophobicContact CD1-CB 3.46Å; I84-D105 VanDerWaalsContact CD1-CB 3.46Å; I84-D105 WeakPolarHBondContact CD1-OD1 3.37Å; I84-D105 WeakPolarHBondContact CD1-OD2 2.99Å; I84-D105 HydrophobicContact CG1-CB 3.54Å; I84-D105 WeakPolarHBondContact CG1-OD1 3.02Å; I84-I106 CarbonylContact C-O 3.53Å; I84-I106 VanDerWaalsContact C-O 3.3Å; I84-I106 VanDerWaalsContact CA-O 3.28Å; I84-I106 WeakPolarHBondContact CA-O 3.46Å; I84-I106 WeakPolarHBondContact CB-O 3.23Å; I84-I106 PolarHBondContact N-O 2.7Å; I84-L107 CarbonylContact O-C 3.3Å; I84-V108 WeakPolarHBondContact O-CB 3.43Å; I84-V108 PolarHBondContact O-N 2.98Å
85	V	36.8	Very low	35.3	Very low	11 Å²	11	87.8 Å²	87.8	7%	0.067	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	118.5	171.1	-179	0	0	0	0	107.4	I26 V108 F110	I26-V85 HydrophobicContact CG1-CG2 4.41Å; I26-V85 HydrophobicContact CG2-CB 3.96Å; I26-V85 HydrophobicContact CG2-CG1 4.41Å; I26-V85 HydrophobicContact CG2-CG2 4Å; V85-V108 CarbonylContact C-O 3.47Å; V85-V108 WeakPolarHBondContact CA-O 3.08Å; V85-V108 WeakPolarHBondContact CG1-O 3.05Å; V85-V108 HydrophobicContact CG2-CB 4.24Å; V85-V108 HydrophobicContact CG2-CG1 3.93Å; V85-F110 HydrophobicContact CG1-CD2 3.93Å; V85-F110 HydrophobicContact CG1-CE2 3.63Å; V85-F110 HydrophobicContact CG2-CE2 4.35Å
86	A	31	Very low	36.4	Very low	5 Å²	5	79.3 Å²	79.3	4%	0.041	42%	0.422	C	S	.	.			trans	-148	124.2	173.8	0	0	0	0	0	110	I84 L107 V108	I84-A86 HydrophobicContact CG2-CB 4.32Å; A86-L107 HydrophobicContact CB-CD1 3.65Å; A86-L107 HydrophobicContact CB-CG 3.97Å; A86-L107 WeakPolarHBondContact O-CD2 3.09Å; A86-L107 WeakPolarHBondContact O-CG 3.17Å; A86-V108 PolarHBondContact N-O 3.31Å
87	W	37.9	Very low	37.2	Very low	73 Å²	73	77.7 Å²	77.7	28%	0.277	41%	0.414	S	S	.	.			trans	-111.7	130.6	158.9	179.3	46.5	0	0	0	105.3	W45	W45-W87 AromaticContact CH2-CE3 3.96Å; W45-W87 HydrophobicContact CH2-CE3 3.96Å; W45-W87 AromaticContact CH2-CH2 3.28Å; W45-W87 HydrophobicContact CH2-CH2 3.28Å; W45-W87 HydrophobicContact CH2-CZ2 4.14Å; W45-W87 AromaticContact CH2-CZ3 3.19Å; W45-W87 HydrophobicContact CH2-CZ3 3.19Å; W45-W87 HydrophobicContact CZ2-CH2 4.07Å; W45-W87 HydrophobicContact CZ2-CZ3 4.33Å; W45-W87 AromaticContact CZ3-CE3 3.73Å; W45-W87 HydrophobicContact CZ3-CE3 3.73Å; W45-W87 AromaticContact CZ3-CH2 3.95Å; W45-W87 HydrophobicContact CZ3-CH2 3.95Å; W45-W87 AromaticContact CZ3-CZ3 3.36Å; W45-W87 HydrophobicContact CZ3-CZ3 3.36Å
88	P	35.2	Very low	38	Very low	13 Å²	13	73.4 Å²	73.4	8%	0.084	39%	0.388	C	S	.	.	S	Bend		-122.7	177.2	62.4	18.7	4.5	0	0	0	112.9	F42 R90 A94	F42-P88 HydrophobicContact CD1-CB 3.65Å; F42-P88 HydrophobicContact CD1-CG 3.88Å; F42-P88 HydrophobicContact CE1-CB 3.42Å; F42-P88 VanDerWaalsContact CE1-CB 3.42Å; F42-P88 HydrophobicContact CE1-CG 4.18Å; F42-P88 HydrophobicContact CZ-CB 4.17Å; P88-R90 CarbonylContact O-C 3.57Å; P88-R90 PolarHBondContact O-N 2.93Å; P88-A94 HydrophobicContact CG-CB 3.58Å
89	S	36.3	Very low	38.9	Very low	101 Å²	101	71.3 Å²	71.3	71%	0.706	39%	0.387	S	S	*	.	S	Bend	trans	-47.1	-14.5	168.1	37.1	0	0	0	0	115
90	R	39.9	Very low	39.8	Very low	166 Å²	166	70 Å²	70	63%	0.626	38%	0.376	S	S	*	.			trans	-118.6	81.6	168.5	-66.7	-174.7	172.7	-170.7	-1.8	110.9	P88 S92 L93 A94	P88-R90 CarbonylContact O-C 3.57Å; P88-R90 PolarHBondContact O-N 2.93Å; R90-S92 VanDerWaalsContact C-N 3.27Å; R90-S92 PolarHBondContact O-N 2.75Å; R90-L93 HydrophobicContact CB-CB 4.12Å; R90-L93 PolarHBondContact O-N 3.08Å; R90-A94 PolarHBondContact O-N 3.46Å
91	P	43.1	Very low	40.1	Very low	45 Å²	45	70.7 Å²	70.7	29%	0.292	38%	0.381	S	S	.	.	H	α-helix	trans	-61.4	-34.4	-175.7	23.6	-34.5	0	0	0	113.6	L93 A94 L95 L107	P91-L93 VanDerWaalsContact C-N 3.32Å; P91-L93 PolarHBondContact O-N 2.04Å; P91-A94 PolarHBondContact O-N 3.41Å; P91-L95 WeakPolarHBondContact O-CB 3.34Å; P91-L95 WeakPolarHBondContact O-CD1 3.2Å; P91-L95 WeakPolarHBondContact O-CG 3.44Å; P91-L95 PolarHBondContact O-N 3.43Å; P91-L107 HydrophobicContact CB-CD1 3.26Å; P91-L107 HydrophobicContact CB-CD2 3.76Å; P91-L107 HydrophobicContact CB-CG 4.14Å; P91-L107 HydrophobicContact CG-CD1 4.15Å; P91-L107 HydrophobicContact CG-CD2 4.09Å
92	S	42.6	Very low	40.5	Very low	90 Å²	90	68.3 Å²	68.3	63%	0.629	38%	0.38	S	S	*	.	H	α-helix	trans	-59.9	-39.8	177.2	51.2	0	0	0	0	112.9	R90 A96	R90-S92 VanDerWaalsContact C-N 3.27Å; R90-S92 PolarHBondContact O-N 2.75Å; S92-A96 WeakPolarHBondContact O-CB 3.08Å; S92-A96 PolarHBondContact O-N 3.38Å; S92-A96 VanDerWaalsContact O-N 3.15Å
93	L	43.4	Very low	40.6	Very low	78 Å²	78	64.7 Å²	64.7	41%	0.408	38%	0.377	S	S	.	.	H	α-helix	trans	-72.6	-40.7	-178.4	-156.5	94.7	0	0	0	111.4	R90 P91 A96 N97	R90-L93 HydrophobicContact CB-CB 4.12Å; R90-L93 PolarHBondContact O-N 3.08Å; P91-L93 VanDerWaalsContact C-N 3.32Å; P91-L93 PolarHBondContact O-N 2.04Å; L93-A96 PolarHBondContact O-N 3.37Å; L93-N97 PolarHBondContact O-N 3.33Å
94	A	45.2	Very low	40.4	Very low	5 Å²	5	66.3 Å²	66.3	4%	0.041	40%	0.399	C	S	.	.	H	α-helix	trans	-70.9	-40.3	178.3	0	0	0	0	0	112.7	W29 P88 R90 P91 A96 N97 C98	W29-A94 HydrophobicContact CH2-CB 3.96Å; W29-A94 WeakPolarHBondContact CH2-O 3.5Å; W29-A94 HydrophobicContact CZ2-CB 3.61Å; W29-A94 WeakPolarHBondContact CZ2-O 3.02Å; P88-A94 HydrophobicContact CG-CB 3.58Å; R90-A94 PolarHBondContact O-N 3.46Å; P91-A94 PolarHBondContact O-N 3.41Å; A94-A96 VanDerWaalsContact C-N 3.28Å; A94-A96 PolarHBondContact O-N 3.26Å; A94-N97 CarbonylContact O-C 3.58Å; A94-N97 PolarHBondContact O-N 3Å; A94-N97 VanDerWaalsContact O-N 3.07Å; A94-C98 PolarHBondContact O-N 3.21Å
95	L	46.5	Very low	40.3	Very low	29 Å²	29	67.9 Å²	67.9	15%	0.152	41%	0.407	C	S	.	.	H	α-helix	trans	-57.9	-44	172.7	-79.4	158.3	0	0	0	111.4	P91 N97 C98 M102	P91-L95 WeakPolarHBondContact O-CB 3.34Å; P91-L95 WeakPolarHBondContact O-CD1 3.2Å; P91-L95 WeakPolarHBondContact O-CG 3.44Å; P91-L95 PolarHBondContact O-N 3.43Å; L95-N97 VanDerWaalsContact C-N 3.3Å; L95-N97 PolarHBondContact O-N 3.4Å; L95-C98 PolarHBondContact O-N 3.13Å; L95-M102 HydrophobicContact CD1-CE 4.29Å
96	A	49	Very low	40.2	Very low	66 Å²	66	69.5 Å²	69.5	55%	0.545	42%	0.415	S	S	.	.	H	α-helix	trans	-58.4	-41.8	173.8	0	0	0	0	0	112	S92 L93 A94 N99	S92-A96 WeakPolarHBondContact O-CB 3.08Å; S92-A96 PolarHBondContact O-N 3.38Å; S92-A96 VanDerWaalsContact O-N 3.15Å; L93-A96 PolarHBondContact O-N 3.37Å; A94-A96 VanDerWaalsContact C-N 3.28Å; A94-A96 PolarHBondContact O-N 3.26Å; A96-N99 PolarHBondContact O-N 3.36Å
97	N	46	Very low	40.3	Very low	75 Å²	75	73 Å²	73	40%	0.401	43%	0.433	S	S	.	.	H	α-helix	trans	-72.8	-23.9	178.2	-76.2	-4.2	0	0	0	114.1	W29 L93 A94 L95 N99	W29-N97 HydrophobicContact CH2-CB 3.89Å; W29-N97 HydrophobicContact CZ3-CB 4.38Å; L93-N97 PolarHBondContact O-N 3.33Å; A94-N97 CarbonylContact O-C 3.58Å; A94-N97 PolarHBondContact O-N 3Å; A94-N97 VanDerWaalsContact O-N 3.07Å; L95-N97 VanDerWaalsContact C-N 3.3Å; L95-N97 PolarHBondContact O-N 3.4Å; N97-N99 PolarHBondContact O-N 3.44Å
98	C	44.8	Very low	40.1	Very low	20 Å²	20	70.1 Å²	70.1	14%	0.135	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	6.7	177.4	-158.3	0	0	0	0	113.1	W29 C47 A94 L95 T100	W29-C98 HydrophobicContact CH2-CB 3.86Å; W29-C98 HydrophobicContact CZ2-CB 3.58Å; C47-C98 HydrophobicContact CB-CB 3.84Å; C47-C98 WeakPolarHBondContact CB-SG 3.46Å; C47-C98 WeakPolarHBondContact SG-CB 3.24Å; C47-C98 CovalentContact SG-SG 2.05Å; C47-C98 PolarHBondContact SG-SG 2.82Å; A94-C98 PolarHBondContact O-N 3.21Å; L95-C98 PolarHBondContact O-N 3.13Å; C98-T100 WeakPolarHBondContact O-CG2 3.38Å; C98-T100 PolarHBondContact O-N 3.33Å
99	N	49.2	Very low	40.1	Very low	155 Å²	155	70.8 Å²	70.8	83%	0.829	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	27.3	179.3	-75.2	-19.3	0	0	0	114.2	A96 N97	A96-N99 PolarHBondContact O-N 3.36Å; N97-N99 PolarHBondContact O-N 3.44Å
100	T	46.2	Very low	40.1	Very low	51 Å²	51	68.7 Å²	68.7	31%	0.313	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-102.6	122.8	179.1	53	0	0	0	0	110.5	C98 M102	C98-T100 WeakPolarHBondContact O-CG2 3.38Å; C98-T100 PolarHBondContact O-N 3.33Å; T100-M102 PolarHBondContact O-N 2.81Å
101	A	39.2	Very low	39.6	Very low	103 Å²	103	65.9 Å²	65.9	85%	0.851	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-64	121.5	174.4	0	0	0	0	0	109.8
102	M	38	Very low	39.2	Very low	149 Å²	149	66 Å²	66	73%	0.734	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-62	128.7	-174.7	-155.5	-179.5	-164	0	0	111.7	L95 T100	L95-M102 HydrophobicContact CD1-CE 4.29Å; T100-M102 PolarHBondContact O-N 2.81Å
103	A	33.6	Very low	38.6	Very low	50 Å²	50	70 Å²	70	41%	0.413	41%	0.408	S	S	.	.			trans	-135.4	66.7	170.5	0	0	0	0	0	111.3	R82 D105	R82-A103 PolarHBondContact NH1-O 2.68Å; A103-D105 PolarHBondContact N-OD2 2.71Å
104	A	31.5	Very low	38.1	Very low	88 Å²	88	73.6 Å²	73.6	73%	0.727	42%	0.422	S	S	*	.			trans	55.4	88.2	165.4	0	0	0	0	0	115.5
105	D	31.4	Very low	37.6	Very low	53 Å²	53	77.6 Å²	77.6	28%	0.283	45%	0.45	S	S	.	.			trans	-132.7	131.4	-160	-63.4	-52.2	0	0	0	113.2	I84 A103	I84-D105 HydrophobicContact CB-CB 3.85Å; I84-D105 HydrophobicContact CD1-CB 3.46Å; I84-D105 VanDerWaalsContact CD1-CB 3.46Å; I84-D105 WeakPolarHBondContact CD1-OD1 3.37Å; I84-D105 WeakPolarHBondContact CD1-OD2 2.99Å; I84-D105 HydrophobicContact CG1-CB 3.54Å; I84-D105 WeakPolarHBondContact CG1-OD1 3.02Å; A103-D105 PolarHBondContact N-OD2 2.71Å
106	I	34.1	Very low	36.8	Very low	44 Å²	44	81.4 Å²	81.4	23%	0.226	47%	0.467	C	S	.	.			trans	-76.6	140.1	169.1	-70.4	162.5	0	0	0	108.9	V77 R82 I84 V108	V77-I106 WeakPolarHBondContact O-CD1 3.3Å; R82-I106 WeakPolarHBondContact O-CD1 3.35Å; I84-I106 CarbonylContact C-O 3.53Å; I84-I106 VanDerWaalsContact C-O 3.3Å; I84-I106 VanDerWaalsContact CA-O 3.28Å; I84-I106 WeakPolarHBondContact CA-O 3.46Å; I84-I106 WeakPolarHBondContact CB-O 3.23Å; I84-I106 PolarHBondContact N-O 2.7Å; I106-V108 HydrophobicContact CG2-CG2 4.35Å
107	L	33.8	Very low	35.9	Very low	80 Å²	80	80.4 Å²	80.4	42%	0.419	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.3	-177.2	-147	97.5	0	0	0	112.7	I84 A86 P91	I84-L107 CarbonylContact O-C 3.3Å; A86-L107 HydrophobicContact CB-CD1 3.65Å; A86-L107 HydrophobicContact CB-CG 3.97Å; A86-L107 WeakPolarHBondContact O-CD2 3.09Å; A86-L107 WeakPolarHBondContact O-CG 3.17Å; P91-L107 HydrophobicContact CB-CD1 3.26Å; P91-L107 HydrophobicContact CB-CD2 3.76Å; P91-L107 HydrophobicContact CB-CG 4.14Å; P91-L107 HydrophobicContact CG-CD1 4.15Å; P91-L107 HydrophobicContact CG-CD2 4.09Å
108	V	34	Very low	35	Very low	11 Å²	11	84.7 Å²	84.7	7%	0.067	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	116	-179.3	166.4	0	0	0	0	107.4	F74 I83 I84 V85 A86 I106 F110	F74-V108 HydrophobicContact CE1-CG1 4.09Å; F74-V108 HydrophobicContact CE2-CB 3.53Å; F74-V108 HydrophobicContact CE2-CG1 3.46Å; F74-V108 VanDerWaalsContact CE2-CG1 3.46Å; F74-V108 HydrophobicContact CE2-CG2 3.7Å; F74-V108 VanDerWaalsContact CZ-C 3.41Å; F74-V108 HydrophobicContact CZ-CB 3.45Å; F74-V108 VanDerWaalsContact CZ-CB 3.45Å; F74-V108 HydrophobicContact CZ-CG1 3.02Å; F74-V108 HydrophobicContact CZ-CG2 4.13Å; I83-V108 HydrophobicContact CG2-CG2 3.99Å; I84-V108 WeakPolarHBondContact O-CB 3.43Å; I84-V108 PolarHBondContact O-N 2.98Å; V85-V108 CarbonylContact C-O 3.47Å; V85-V108 WeakPolarHBondContact CA-O 3.08Å; V85-V108 WeakPolarHBondContact CG1-O 3.05Å; V85-V108 HydrophobicContact CG2-CB 4.24Å; V85-V108 HydrophobicContact CG2-CG1 3.93Å; A86-V108 PolarHBondContact N-O 3.31Å; I106-V108 HydrophobicContact CG2-CG2 4.35Å; V108-F110 HydrophobicContact CG1-CE2 4.13Å; V108-F110 HydrophobicContact CG1-CZ 3.88Å
109	G	34.7	Very low	34.1	Very low	28 Å²	28	91.4 Å²	91.4	29%	0.289	50%	0.503	S	S	.	.			trans	-120.7	145.2	-176.3	0	0	0	0	0	114.7	F74	F74-G109 WeakPolarHBondContact CD1-O 3.09Å; F74-G109 WeakPolarHBondContact CE1-O 2.93Å; F74-G109 WeakPolarHBondContact CZ-O 3.35Å
110	F	36.8	Very low	33	Very low	56 Å²	56	91.6 Å²	91.6	25%	0.246	50%	0.496	C	S	.	.			trans	-123.4	145.5	-179	-56.8	-75.9	0	0	0	112.1	V71 F74 V85 V108	V71-F110 HydrophobicContact CB-CD1 4.13Å; V71-F110 HydrophobicContact CB-CE1 4.35Å; V71-F110 HydrophobicContact CG1-CD1 3.71Å; V71-F110 HydrophobicContact CG1-CE1 3.53Å; V71-F110 HydrophobicContact CG2-CD1 4.09Å; V71-F110 HydrophobicContact CG2-CE1 4.25Å; F74-F110 AromaticContact CE1-CD1 3.93Å; F74-F110 HydrophobicContact CE1-CD1 3.93Å; F74-F110 AromaticContact CE1-CE1 3.68Å; F74-F110 HydrophobicContact CE1-CE1 3.68Å; F74-F110 HydrophobicContact CE1-CZ 4.2Å; F74-F110 HydrophobicContact CZ-CE1 4.29Å; F74-F110 HydrophobicContact CZ-CZ 4.38Å; V85-F110 HydrophobicContact CG1-CD2 3.93Å; V85-F110 HydrophobicContact CG1-CE2 3.63Å; V85-F110 HydrophobicContact CG2-CE2 4.35Å; V108-F110 HydrophobicContact CG1-CE2 4.13Å; V108-F110 HydrophobicContact CG1-CZ 3.88Å
111	H	29.5	Very low	31.9	Very low	107 Å²	107	96 Å²	96	50%	0.495	52%	0.518	S	S	.	.			trans	-108.7	142.1	170	-83.9	-83.4	0	0	0	110.8
112	C	33.1	Very low	31.2	Very low	49 Å²	49	104.8 Å²	104.8	33%	0.331	53%	0.531	S	S	.	.			trans	-122	129	168.2	-50.2	0	0	0	0	109.4	Y69 Y70	Y69-C112 VanDerWaalsContact CA-SG 3.58Å; Y70-C112 PolarHBondContact N-SG 3Å; Y70-C112 PolarHBondContact O-SG 3.02Å
113	W	30.6	Very low	30.9	Very low	172 Å²	172	102.6 Å²	102.6	65%	0.652	52%	0.52	S	S	*	.			trans	-104.9	130.6	169.2	-83.6	10.2	0	0	0	109.6	S115 E116	W113-S115 VanDerWaalsContact C-N 3.26Å; W113-S115 PolarHBondContact O-N 3.07Å; W113-E116 HydrophobicContact CE3-CG 4.44Å
114	Q	33.3	Very low	30.7	Very low	154 Å²	154	105.3 Å²	105.3	72%	0.72	53%	0.526	S	S	*	.	S	Bend	trans	-67.2	-27.7	172.5	-93.6	-166.2	0.3	0	0	112.7	E116 C117	Q114-E116 VanDerWaalsContact C-N 3.34Å; Q114-E116 PolarHBondContact O-N 2.87Å; Q114-C117 PolarHBondContact O-N 3.25Å
115	S	33.6	Very low	30.7	Very low	90 Å²	90	106.3 Å²	106.3	63%	0.629	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-69.4	-25.3	-173.5	46.4	0	0	0	0	114.1	W113	W113-S115 VanDerWaalsContact C-N 3.26Å; W113-S115 PolarHBondContact O-N 3.07Å
116	E	30.4	Very low	30.6	Very low	108 Å²	108	109.4 Å²	109.4	51%	0.505	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-87	-3.9	-179	-65	-167	155.3	0	0	113.8	W113 Q114 Q118 Q119	W113-E116 HydrophobicContact CE3-CG 4.44Å; Q114-E116 VanDerWaalsContact C-N 3.34Å; Q114-E116 PolarHBondContact O-N 2.87Å; E116-Q118 PolarHBondContact O-N 3.47Å; E116-Q118 VanDerWaalsContact O-N 3.17Å; E116-Q119 PolarHBondContact O-N 3.21Å
117	C	30.2	Very low	30.4	Very low	46 Å²	46	113.5 Å²	113.5	31%	0.311	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-68	-10.4	177.2	-69.9	0	0	0	0	114.5	Q114	Q114-C117 PolarHBondContact O-N 3.25Å
118	Q	26.6	Very low	30.2	Very low	165 Å²	165	115.7 Å²	115.7	77%	0.771	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-85.5	-23.7	178.6	-82.5	-166.4	-13.7	0	0	114.4	E116	E116-Q118 PolarHBondContact O-N 3.47Å; E116-Q118 VanDerWaalsContact O-N 3.17Å
119	Q	26.3	Very low	29.9	Very low	161 Å²	161	123.2 Å²	123.2	75%	0.752	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-17.3	-172.9	-81.5	-175.9	-18.1	0	0	114.7	E116	E116-Q119 PolarHBondContact O-N 3.21Å
120	F	25.6	Very low	29.6	Very low	158 Å²	158	130.5 Å²	130.5	69%	0.693	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	16.1	179.9	-77.2	-82.8	0	0	0	113.9
121	L	22.9	Very low	29	Very low	145 Å²	145	136.8 Å²	136.8	76%	0.759	65%	0.645	S	S	*	*			trans	-96.8	8.2	175.4	-82.4	165.4	0	0	0	113.8
122	Y	25.2	Very low	28.9	Very low	286 Å²	286	139.5 Å²	139.5	100%	1.122	66%	0.659	S	S	*	*			trans	-110.4	0	169.2	-89.3	-80.8	0	0	0	110.3

Retrieved 122 of 122 residues in 444.7 ms (Link to these results)

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