A0A087WZL1_HUMAN Loading...

Mal, T cell differentiation protein 2

AlphaFold DB , UniProt , Accession A0A087WZL1, Species HUMAN (Homo sapiens, Human), Gene MAL2, Length 108 aa.

						>A0A087WZL1_HUMAN|A0A087WZL1|MAL2
MFVSVTAFFFSLLFLGMFLSGMVAQIDANWNFLDFAYHFTVFVFYFGAFLLEAAATSLHDLHCNTTITGQPLLSDNQYNINVAASIFAFMTTACYGCSLGLALRRWRP
					

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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	50.5	Low	49.1	Very low	208 Å²	208	96.5 Å²	96.5	100%	1.025	50%	0.501	S	S	*	.				0	-44.4	0	-78.3	-170.7	166.2	0	0	114.2	V3 S4 V5	M1-V3 VanDerWaalsContact C-N 3.27Å; M1-V3 PolarHBondContact O-N 3.02Å; M1-S4 PolarHBondContact O-N 3.36Å; M1-S4 VanDerWaalsContact O-N 3.14Å; M1-V5 PolarHBondContact O-N 3.09Å
2	F	44.5	Very low	49.3	Very low	163 Å²	163	96.2 Å²	96.2	72%	0.715	50%	0.5	S	S	*	.	H	α-helix	trans	-55.7	-36.4	-179.8	-176.4	-104.2	0	0	0	114.6	V5 T6	F2-V5 PolarHBondContact O-N 3.28Å; F2-T6 HydrophobicContact CE1-CG2 4.11Å; F2-T6 HydrophobicContact CZ-CG2 4.09Å; F2-T6 PolarHBondContact O-N 3.03Å; F2-T6 PolarHBondContact O-OG1 3.1Å
3	V	45.5	Very low	49.9	Very low	58 Å²	58	96.8 Å²	96.8	35%	0.352	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-40.1	176.6	165.3	0	0	0	0	113.1	M1 T6 A7 A48	M1-V3 VanDerWaalsContact C-N 3.27Å; M1-V3 PolarHBondContact O-N 3.02Å; V3-T6 VanDerWaalsContact CA-OG1 3.32Å; V3-T6 WeakPolarHBondContact CA-OG1 3.38Å; V3-T6 PolarHBondContact O-OG1 2.96Å; V3-A7 VanDerWaalsContact O-CB 3.27Å; V3-A7 WeakPolarHBondContact O-CB 3.36Å; V3-A7 PolarHBondContact O-N 3.27Å; V3-A48 HydrophobicContact CG1-CB 3.91Å
4	S	47.5	Very low	50	Low	86 Å²	86	92.6 Å²	92.6	60%	0.601	48%	0.479	S	S	*	.	H	α-helix	trans	-70.1	-38.3	177.5	166	0	0	0	0	111.2	M1 A7 F8	M1-S4 PolarHBondContact O-N 3.36Å; M1-S4 VanDerWaalsContact O-N 3.14Å; S4-A7 PolarHBondContact O-N 3.27Å; S4-F8 WeakPolarHBondContact O-CB 3.45Å; S4-F8 PolarHBondContact O-N 3.08Å
5	V	49.4	Very low	50.1	Low	73 Å²	73	93.1 Å²	93.1	44%	0.442	48%	0.482	S	S	.	.	H	α-helix	trans	-65.6	-44.9	176.3	176.9	0	0	0	0	110.7	M1 F2 F8 F9	M1-V5 PolarHBondContact O-N 3.09Å; F2-V5 PolarHBondContact O-N 3.28Å; V5-F8 WeakPolarHBondContact O-CB 3.36Å; V5-F8 PolarHBondContact O-N 2.97Å; V5-F9 HydrophobicContact CG1-CD2 3.85Å; V5-F9 HydrophobicContact CG1-CE2 3.77Å; V5-F9 VanDerWaalsContact O-CD2 3.25Å; V5-F9 WeakPolarHBondContact O-CD2 3.48Å; V5-F9 PolarHBondContact O-N 3.25Å
6	T	50.8	Low	50	Low	30 Å²	30	89.5 Å²	89.5	18%	0.184	48%	0.475	C	S	.	.	H	α-helix	trans	-64.9	-43	176	30.4	0	0	0	0	111.8	F2 V3 F8 F9 F10	F2-T6 HydrophobicContact CE1-CG2 4.11Å; F2-T6 HydrophobicContact CZ-CG2 4.09Å; F2-T6 PolarHBondContact O-N 3.03Å; F2-T6 PolarHBondContact O-OG1 3.1Å; V3-T6 VanDerWaalsContact CA-OG1 3.32Å; V3-T6 WeakPolarHBondContact CA-OG1 3.38Å; V3-T6 PolarHBondContact O-OG1 2.96Å; T6-F8 VanDerWaalsContact C-N 3.29Å; T6-F8 PolarHBondContact O-N 2.84Å; T6-F9 PolarHBondContact O-N 2.99Å; T6-F10 WeakPolarHBondContact O-CD2 3.44Å; T6-F10 PolarHBondContact O-N 3.39Å
7	A	50.8	Low	50	Low	28 Å²	28	88.2 Å²	88.2	23%	0.231	47%	0.467	C	S	.	.	H	α-helix	trans	-62.1	-34.4	174.6	0	0	0	0	0	113.1	V3 S4 S11	V3-A7 VanDerWaalsContact O-CB 3.27Å; V3-A7 WeakPolarHBondContact O-CB 3.36Å; V3-A7 PolarHBondContact O-N 3.27Å; S4-A7 PolarHBondContact O-N 3.27Å; A7-S11 WeakPolarHBondContact O-CB 3.4Å; A7-S11 PolarHBondContact O-N 3.4Å; A7-S11 PolarHBondContact O-OG 3.15Å
8	F	49.9	Very low	50	Low	128 Å²	128	91.4 Å²	91.4	56%	0.561	48%	0.476	S	S	*	.	H	α-helix	trans	-66.3	-47.7	173.6	-179.4	-98.7	0	0	0	111.5	S4 V5 T6 F10 S11 L12	S4-F8 WeakPolarHBondContact O-CB 3.45Å; S4-F8 PolarHBondContact O-N 3.08Å; V5-F8 WeakPolarHBondContact O-CB 3.36Å; V5-F8 PolarHBondContact O-N 2.97Å; T6-F8 VanDerWaalsContact C-N 3.29Å; T6-F8 PolarHBondContact O-N 2.84Å; F8-F10 VanDerWaalsContact C-N 3.34Å; F8-F10 PolarHBondContact O-N 3.17Å; F8-S11 PolarHBondContact O-N 3.46Å; F8-L12 HydrophobicContact CE1-CD1 3.81Å; F8-L12 HydrophobicContact CE2-CD1 4.46Å; F8-L12 HydrophobicContact CZ-CD1 3.7Å; F8-L12 VanDerWaalsContact O-CB 3.3Å; F8-L12 WeakPolarHBondContact O-CB 3.39Å; F8-L12 PolarHBondContact O-N 3.25Å
9	F	50.1	Low	49.8	Very low	133 Å²	133	93.6 Å²	93.6	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-61.2	-41.4	175.9	-87	-75.2	0	0	0	112.3	V5 T6 L12 L13	V5-F9 HydrophobicContact CG1-CD2 3.85Å; V5-F9 HydrophobicContact CG1-CE2 3.77Å; V5-F9 VanDerWaalsContact O-CD2 3.25Å; V5-F9 WeakPolarHBondContact O-CD2 3.48Å; V5-F9 PolarHBondContact O-N 3.25Å; T6-F9 PolarHBondContact O-N 2.99Å; F9-L12 PolarHBondContact O-N 3.37Å; F9-L13 VanDerWaalsContact O-CB 3.27Å; F9-L13 WeakPolarHBondContact O-CB 3.13Å; F9-L13 PolarHBondContact O-N 3.34Å
10	F	52.4	Low	49.6	Very low	101 Å²	101	93 Å²	93	44%	0.443	49%	0.492	S	S	.	.	H	α-helix	trans	-66.5	-40.6	176.2	-90.9	-78.1	0	0	0	112.6	T6 F8 L12 L13 F14 T40 F44	T6-F10 WeakPolarHBondContact O-CD2 3.44Å; T6-F10 PolarHBondContact O-N 3.39Å; F8-F10 VanDerWaalsContact C-N 3.34Å; F8-F10 PolarHBondContact O-N 3.17Å; F10-L12 VanDerWaalsContact C-N 3.35Å; F10-L13 PolarHBondContact O-N 3.09Å; F10-F14 WeakPolarHBondContact O-CB 3.48Å; F10-F14 PolarHBondContact O-N 2.83Å; F10-T40 HydrophobicContact CD1-CG2 4.18Å; F10-T40 HydrophobicContact CE1-CG2 4.32Å; F10-F44 HydrophobicContact CD2-CE2 4.04Å; F10-F44 AromaticContact CD2-CZ 3.98Å; F10-F44 HydrophobicContact CD2-CZ 3.98Å; F10-F44 AromaticContact CE2-CE2 3.89Å; F10-F44 HydrophobicContact CE2-CE2 3.89Å; F10-F44 AromaticContact CE2-CZ 3.68Å; F10-F44 HydrophobicContact CE2-CZ 3.68Å; F10-F44 HydrophobicContact CZ-CE2 4.36Å; F10-F44 HydrophobicContact CZ-CZ 4.45Å
11	S	48.1	Very low	49.5	Very low	53 Å²	53	90.3 Å²	90.3	37%	0.371	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-37.8	174.6	-63	0	0	0	0	112	A7 F8 F14 L15	A7-S11 WeakPolarHBondContact O-CB 3.4Å; A7-S11 PolarHBondContact O-N 3.4Å; A7-S11 PolarHBondContact O-OG 3.15Å; F8-S11 PolarHBondContact O-N 3.46Å; S11-F14 PolarHBondContact O-N 3.42Å; S11-L15 VanDerWaalsContact O-CB 3.28Å; S11-L15 WeakPolarHBondContact O-CB 3.28Å; S11-L15 PolarHBondContact O-N 3.47Å
12	L	52.5	Low	49.3	Very low	93 Å²	93	84.5 Å²	84.5	49%	0.487	46%	0.458	S	S	.	.	H	α-helix	trans	-71.5	-37.4	179.4	-158.1	124.9	0	0	0	112	F8 F9 F10 G16	F8-L12 HydrophobicContact CE1-CD1 3.81Å; F8-L12 HydrophobicContact CE2-CD1 4.46Å; F8-L12 HydrophobicContact CZ-CD1 3.7Å; F8-L12 VanDerWaalsContact O-CB 3.3Å; F8-L12 WeakPolarHBondContact O-CB 3.39Å; F8-L12 PolarHBondContact O-N 3.25Å; F9-L12 PolarHBondContact O-N 3.37Å; F10-L12 VanDerWaalsContact C-N 3.35Å; L12-G16 PolarHBondContact O-N 3.43Å
13	L	56.4	Low	49.4	Very low	105 Å²	105	80.5 Å²	80.5	55%	0.55	45%	0.447	S	S	.	.	H	α-helix	trans	-67.8	-38.4	174.1	-161.7	155.1	0	0	0	110.6	F9 F10 G16 M17	F9-L13 VanDerWaalsContact O-CB 3.27Å; F9-L13 WeakPolarHBondContact O-CB 3.13Å; F9-L13 PolarHBondContact O-N 3.34Å; F10-L13 PolarHBondContact O-N 3.09Å; L13-G16 PolarHBondContact O-N 2.84Å; L13-M17 HydrophobicContact CD2-CE 3.5Å; L13-M17 VanDerWaalsContact CD2-CE 3.5Å; L13-M17 HydrophobicContact CD2-CG 4.39Å; L13-M17 HydrophobicContact CD2-SD 3.97Å; L13-M17 WeakPolarHBondContact O-CG 3.27Å; L13-M17 PolarHBondContact O-N 3.09Å
14	F	51.4	Low	49.4	Very low	38 Å²	38	82.1 Å²	82.1	17%	0.167	47%	0.466	C	S	.	.	H	α-helix	trans	-69.2	-43.5	175.2	-150.3	-101	0	0	0	113.2	F10 S11 G16 M17 F18 L33 Y37	F10-F14 WeakPolarHBondContact O-CB 3.48Å; F10-F14 PolarHBondContact O-N 2.83Å; S11-F14 PolarHBondContact O-N 3.42Å; F14-G16 VanDerWaalsContact C-N 3.3Å; F14-G16 PolarHBondContact O-N 3.46Å; F14-M17 HydrophobicContact CD2-CE 3.63Å; F14-M17 HydrophobicContact CE2-CE 4.17Å; F14-M17 HydrophobicContact CG-CE 4.4Å; F14-M17 PolarHBondContact O-N 2.86Å; F14-F18 WeakPolarHBondContact O-CB 3.39Å; F14-F18 PolarHBondContact O-N 2.96Å; F14-L33 HydrophobicContact CE2-CD1 4.38Å; F14-L33 HydrophobicContact CE2-CG 4.13Å; F14-L33 HydrophobicContact CZ-CG 4.21Å; F14-Y37 HydrophobicContact CB-CD2 3.74Å; F14-Y37 HydrophobicContact CB-CE2 3.33Å; F14-Y37 AromaticContact CD1-CD1 3.91Å; F14-Y37 HydrophobicContact CD1-CD1 3.91Å; F14-Y37 AromaticContact CD1-CD2 3.3Å; F14-Y37 HydrophobicContact CD1-CD2 3.3Å; F14-Y37 AromaticContact CD1-CE1 3.93Å; F14-Y37 HydrophobicContact CD1-CE1 3.93Å; F14-Y37 AromaticContact CD1-CE2 3.31Å; F14-Y37 HydrophobicContact CD1-CE2 3.31Å; F14-Y37 AromaticContact CD1-CG 3.59Å; F14-Y37 HydrophobicContact CD1-CG 3.59Å; F14-Y37 AromaticContact CD1-CZ 3.61Å; F14-Y37 AromaticContact CD2-CD2 3.12Å; F14-Y37 HydrophobicContact CD2-CD2 3.12Å; F14-Y37 AromaticContact CD2-CE2 3.71Å; F14-Y37 HydrophobicContact CD2-CE2 3.71Å; F14-Y37 AromaticContact CD2-CG 3.78Å; F14-Y37 HydrophobicContact CD2-CG 3.78Å; F14-Y37 AromaticContact CE1-CD1 3.65Å; F14-Y37 HydrophobicContact CE1-CD1 3.65Å; F14-Y37 AromaticContact CE1-CD2 3.58Å; F14-Y37 HydrophobicContact CE1-CD2 3.58Å; F14-Y37 HydrophobicContact CE1-CE1 4.08Å; F14-Y37 HydrophobicContact CE1-CE2 4.01Å; F14-Y37 AromaticContact CE1-CG 3.35Å; F14-Y37 HydrophobicContact CE1-CG 3.35Å; F14-Y37 AromaticContact CE2-CD2 3.44Å; F14-Y37 HydrophobicContact CE2-CD2 3.44Å; F14-Y37 VanDerWaalsContact CE2-CD2 3.44Å; F14-Y37 HydrophobicContact CE2-CE2 4.37Å; F14-Y37 AromaticContact CE2-CG 3.59Å; F14-Y37 HydrophobicContact CE2-CG 3.59Å; F14-Y37 AromaticContact CG-CD2 3.06Å; F14-Y37 HydrophobicContact CG-CD2 3.06Å; F14-Y37 AromaticContact CG-CE2 3.13Å; F14-Y37 HydrophobicContact CG-CE2 3.13Å; F14-Y37 AromaticContact CG-CG 3.8Å; F14-Y37 HydrophobicContact CG-CG 3.8Å; F14-Y37 AromaticContact CG-CZ 3.93Å; F14-Y37 HydrophobicContact CZ-CD1 4.07Å; F14-Y37 AromaticContact CZ-CD2 3.67Å; F14-Y37 HydrophobicContact CZ-CD2 3.67Å; F14-Y37 AromaticContact CZ-CG 3.38Å; F14-Y37 HydrophobicContact CZ-CG 3.38Å
15	L	50.9	Low	49.3	Very low	99 Å²	99	86.6 Å²	86.6	52%	0.518	48%	0.477	S	S	.	.	H	α-helix	trans	-62.4	-38.8	172.5	-175.3	68.8	0	0	0	111.5	S11 F18 L19	S11-L15 VanDerWaalsContact O-CB 3.28Å; S11-L15 WeakPolarHBondContact O-CB 3.28Å; S11-L15 PolarHBondContact O-N 3.47Å; L15-F18 WeakPolarHBondContact O-CB 3.47Å; L15-F18 PolarHBondContact O-N 2.87Å; L15-L19 HydrophobicContact CD1-CD1 4.3Å; L15-L19 HydrophobicContact CD2-CD1 4.41Å; L15-L19 HydrophobicContact CG-CD1 3.9Å; L15-L19 WeakPolarHBondContact O-CB 3.49Å; L15-L19 PolarHBondContact O-N 2.78Å
16	G	49.9	Very low	49.2	Very low	36 Å²	36	86.8 Å²	86.8	37%	0.371	48%	0.475	S	S	.	.	H	α-helix	trans	-62.2	-44	174.3	0	0	0	0	0	112.3	L12 L13 F14 F18 L19 S20	L12-G16 PolarHBondContact O-N 3.43Å; L13-G16 PolarHBondContact O-N 2.84Å; F14-G16 VanDerWaalsContact C-N 3.3Å; F14-G16 PolarHBondContact O-N 3.46Å; G16-F18 VanDerWaalsContact C-N 3.31Å; G16-F18 PolarHBondContact O-N 3.25Å; G16-L19 PolarHBondContact O-N 3.33Å; G16-S20 WeakPolarHBondContact O-CB 3.33Å; G16-S20 PolarHBondContact O-N 2.81Å
17	M	49.8	Very low	49.1	Very low	67 Å²	67	94 Å²	94	33%	0.33	51%	0.513	S	S	.	.	H	α-helix	trans	-64.2	-35.8	173.7	-72.4	-174.5	-63.8	0	0	112.3	L13 F14	L13-M17 HydrophobicContact CD2-CE 3.5Å; L13-M17 VanDerWaalsContact CD2-CE 3.5Å; L13-M17 HydrophobicContact CD2-CG 4.39Å; L13-M17 HydrophobicContact CD2-SD 3.97Å; L13-M17 WeakPolarHBondContact O-CG 3.27Å; L13-M17 PolarHBondContact O-N 3.09Å; F14-M17 HydrophobicContact CD2-CE 3.63Å; F14-M17 HydrophobicContact CE2-CE 4.17Å; F14-M17 HydrophobicContact CG-CE 4.4Å; F14-M17 PolarHBondContact O-N 2.86Å
18	F	49.2	Very low	49.2	Very low	146 Å²	146	95 Å²	95	64%	0.64	52%	0.521	S	S	*	.	H	α-helix	trans	-69.6	-42.3	176.6	-159.6	-93	0	0	0	112.6	F14 L15 G16	F14-F18 WeakPolarHBondContact O-CB 3.39Å; F14-F18 PolarHBondContact O-N 2.96Å; L15-F18 WeakPolarHBondContact O-CB 3.47Å; L15-F18 PolarHBondContact O-N 2.87Å; G16-F18 VanDerWaalsContact C-N 3.31Å; G16-F18 PolarHBondContact O-N 3.25Å
19	L	45.6	Very low	49.4	Very low	134 Å²	134	94.4 Å²	94.4	70%	0.702	52%	0.524	S	S	*	.	H	α-helix	trans	-75.9	-29.5	178.4	-80.6	163.7	0	0	0	113.5	L15 G16 G21	L15-L19 HydrophobicContact CD1-CD1 4.3Å; L15-L19 HydrophobicContact CD2-CD1 4.41Å; L15-L19 HydrophobicContact CG-CD1 3.9Å; L15-L19 WeakPolarHBondContact O-CB 3.49Å; L15-L19 PolarHBondContact O-N 2.78Å; G16-L19 PolarHBondContact O-N 3.33Å; L19-G21 PolarHBondContact O-N 3.35Å
20	S	47.5	Very low	49.5	Very low	81 Å²	81	92.5 Å²	92.5	57%	0.566	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-6	-179.7	-170.2	0	0	0	0	113.3	G16 M22	G16-S20 WeakPolarHBondContact O-CB 3.33Å; G16-S20 PolarHBondContact O-N 2.81Å; S20-M22 PolarHBondContact O-N 3.43Å; S20-M22 VanDerWaalsContact O-N 3.09Å
21	G	47.5	Very low	49.6	Very low	37 Å²	37	91.3 Å²	91.3	38%	0.381	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	16.3	173.8	0	0	0	0	0	113.5	L19 V23 A24	L19-G21 PolarHBondContact O-N 3.35Å; G21-V23 PolarHBondContact O-N 2.78Å; G21-V23 VanDerWaalsContact O-N 3.1Å; G21-A24 PolarHBondContact O-N 3.29Å
22	M	45.6	Very low	49.6	Very low	86 Å²	86	95.6 Å²	95.6	42%	0.424	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-62.4	-14.9	172.3	-67.6	-177.1	79.1	0	0	111.9	S20 A24 Q25 I26 W30	S20-M22 PolarHBondContact O-N 3.43Å; S20-M22 VanDerWaalsContact O-N 3.09Å; M22-A24 PolarHBondContact O-N 3.01Å; M22-Q25 PolarHBondContact O-N 3.48Å; M22-I26 HydrophobicContact CB-CD1 4.28Å; M22-I26 HydrophobicContact CE-CD1 3.11Å; M22-I26 HydrophobicContact CG-CD1 4.43Å; M22-I26 PolarHBondContact O-N 3.41Å; M22-W30 WeakPolarHBondContact O-CZ2 3.38Å
23	V	46	Very low	49.8	Very low	78 Å²	78	94 Å²	94	47%	0.473	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-47.7	-35.5	163.9	163.4	0	0	0	0	113.6	G21 W30	G21-V23 PolarHBondContact O-N 2.78Å; G21-V23 VanDerWaalsContact O-N 3.1Å; V23-W30 HydrophobicContact CB-CH2 3.98Å; V23-W30 HydrophobicContact CB-CZ2 4.16Å; V23-W30 HydrophobicContact CB-CZ3 4.32Å; V23-W30 HydrophobicContact CG2-CD2 4.31Å; V23-W30 HydrophobicContact CG2-CE3 3.79Å; V23-W30 HydrophobicContact CG2-CH2 3.36Å; V23-W30 HydrophobicContact CG2-CZ2 3.95Å; V23-W30 HydrophobicContact CG2-CZ3 3.25Å; V23-W30 VanDerWaalsContact N-CH2 3.26Å
24	A	46.3	Very low	49.7	Very low	92 Å²	92	92.3 Å²	92.3	76%	0.76	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-97	-11.2	-172.7	0	0	0	0	0	114.3	G21 M22	G21-A24 PolarHBondContact O-N 3.29Å; M22-A24 PolarHBondContact O-N 3.01Å
25	Q	44.4	Very low	49.7	Very low	180 Å²	180	96.7 Å²	96.7	84%	0.841	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-16.8	-171	-78.5	-162.5	-30.3	0	0	115.6	M22	M22-Q25 PolarHBondContact O-N 3.48Å
26	I	47.7	Very low	49.8	Very low	77 Å²	77	93.4 Å²	93.4	40%	0.395	51%	0.513	S	S	.	.			trans	-119.3	122.9	-172.5	-69.4	162.6	0	0	0	110	M22 A28	M22-I26 HydrophobicContact CB-CD1 4.28Å; M22-I26 HydrophobicContact CE-CD1 3.11Å; M22-I26 HydrophobicContact CG-CD1 4.43Å; M22-I26 PolarHBondContact O-N 3.41Å; I26-A28 HydrophobicContact CG2-CB 3.61Å; I26-A28 PolarHBondContact O-N 3.01Å
27	D	49.8	Very low	50	Low	183 Å²	183	93.9 Å²	93.9	98%	0.979	50%	0.503	S	S	*	.			trans	-66.5	45.4	170.2	-118.1	-30.5	0	0	0	111.4
28	A	51.7	Low	50.3	Low	47 Å²	47	92.8 Å²	92.8	39%	0.388	50%	0.497	S	S	.	.			trans	-89.1	143.1	175.8	0	0	0	0	0	109.1	I26 W30	I26-A28 HydrophobicContact CG2-CB 3.61Å; I26-A28 PolarHBondContact O-N 3.01Å; A28-W30 VanDerWaalsContact C-N 3.29Å; A28-W30 PolarHBondContact O-N 3.49Å; A28-W30 PolarHBondContact O-NE1 3.04Å
29	N	55	Low	50.4	Low	117 Å²	117	91.3 Å²	91.3	63%	0.626	49%	0.491	S	S	*	.			trans	-69.6	88.1	174.5	-168.2	8.6	0	0	0	109.3	N31 F32 L33	N29-N31 PolarHBondContact O-N 3.36Å; N29-N31 WeakPolarHBondContact OD1-CB 3.43Å; N29-F32 HydrophobicContact CB-CB 4.26Å; N29-F32 WeakPolarHBondContact O-CA 3.5Å; N29-F32 WeakPolarHBondContact O-CB 3.3Å; N29-F32 PolarHBondContact O-N 3.02Å; N29-L33 PolarHBondContact O-N 3.33Å
30	W	52.8	Low	50.7	Low	93 Å²	93	87 Å²	87	35%	0.352	47%	0.47	S	S	.	.	H	α-helix	trans	-50.9	-27.1	179.5	-70.8	93	0	0	0	113.2	M22 V23 A28 L33 D34	M22-W30 WeakPolarHBondContact O-CZ2 3.38Å; V23-W30 HydrophobicContact CB-CH2 3.98Å; V23-W30 HydrophobicContact CB-CZ2 4.16Å; V23-W30 HydrophobicContact CB-CZ3 4.32Å; V23-W30 HydrophobicContact CG2-CD2 4.31Å; V23-W30 HydrophobicContact CG2-CE3 3.79Å; V23-W30 HydrophobicContact CG2-CH2 3.36Å; V23-W30 HydrophobicContact CG2-CZ2 3.95Å; V23-W30 HydrophobicContact CG2-CZ3 3.25Å; V23-W30 VanDerWaalsContact N-CH2 3.26Å; A28-W30 VanDerWaalsContact C-N 3.29Å; A28-W30 PolarHBondContact O-N 3.49Å; A28-W30 PolarHBondContact O-NE1 3.04Å; W30-L33 HydrophobicContact CE3-CD2 4.02Å; W30-L33 HydrophobicContact CH2-CD2 4.42Å; W30-L33 HydrophobicContact CZ3-CD2 3.73Å; W30-L33 PolarHBondContact O-N 3.5Å; W30-D34 PolarHBondContact O-N 3Å
31	N	52.8	Low	50.9	Low	76 Å²	76	85.2 Å²	85.2	41%	0.406	46%	0.456	S	S	.	.	H	α-helix	trans	-69.2	-33.8	175.5	-153.8	53.8	0	0	0	113.3	N29 F35 W106	N29-N31 PolarHBondContact O-N 3.36Å; N29-N31 WeakPolarHBondContact OD1-CB 3.43Å; N31-F35 WeakPolarHBondContact O-CB 3.36Å; N31-F35 PolarHBondContact O-N 3.36Å; N31-F35 VanDerWaalsContact O-N 3.17Å; N31-W106 WeakPolarHBondContact ND2-CH2 3.44Å
32	F	48.6	Very low	51.1	Low	143 Å²	143	89.4 Å²	89.4	63%	0.627	46%	0.464	S	S	*	.	H	α-helix	trans	-72.2	-36	173.6	-179.8	-101.3	0	0	0	111.3	N29 F35 A36	N29-F32 HydrophobicContact CB-CB 4.26Å; N29-F32 WeakPolarHBondContact O-CA 3.5Å; N29-F32 WeakPolarHBondContact O-CB 3.3Å; N29-F32 PolarHBondContact O-N 3.02Å; F32-F35 PolarHBondContact O-N 2.84Å; F32-A36 VanDerWaalsContact O-CB 3.27Å; F32-A36 WeakPolarHBondContact O-CB 3.34Å; F32-A36 PolarHBondContact O-N 2.89Å
33	L	57.3	Low	51.5	Low	59 Å²	59	88.7 Å²	88.7	31%	0.309	46%	0.464	S	S	.	.	H	α-helix	trans	-67.9	-41	178.3	-168.4	68.4	0	0	0	111.6	F14 N29 W30 A36 Y37	F14-L33 HydrophobicContact CE2-CD1 4.38Å; F14-L33 HydrophobicContact CE2-CG 4.13Å; F14-L33 HydrophobicContact CZ-CG 4.21Å; N29-L33 PolarHBondContact O-N 3.33Å; W30-L33 HydrophobicContact CE3-CD2 4.02Å; W30-L33 HydrophobicContact CH2-CD2 4.42Å; W30-L33 HydrophobicContact CZ3-CD2 3.73Å; W30-L33 PolarHBondContact O-N 3.5Å; L33-A36 PolarHBondContact O-N 2.87Å; L33-Y37 WeakPolarHBondContact O-CB 3.35Å; L33-Y37 PolarHBondContact O-N 2.88Å
34	D	54.8	Low	51.8	Low	70 Å²	70	88.2 Å²	88.2	37%	0.374	46%	0.456	S	S	.	.	H	α-helix	trans	-64.7	-41.5	174.3	-173	78.5	0	0	0	112.3	W30 Y37 H38	W30-D34 PolarHBondContact O-N 3Å; D34-Y37 PolarHBondContact O-N 3.46Å; D34-H38 PolarHBondContact O-N 2.95Å; D34-H38 PolarHBondContact O-ND1 2.88Å; D34-H38 IonicContact OD1-CE1 3.63Å; D34-H38 IonicContact OD1-ND1 3.71Å; D34-H38 IonicContact OD2-CE1 3.81Å; D34-H38 IonicContact OD2-ND1 3.5Å; D34-H38 PolarHBondContact OD2-ND1 3.49Å
35	F	50.2	Low	52.1	Low	130 Å²	130	87.9 Å²	87.9	57%	0.57	44%	0.435	S	S	*	.	H	α-helix	trans	-63.4	-45.4	173.2	179.5	-98.3	0	0	0	112.1	N31 F32 Y37 H38 F39	N31-F35 WeakPolarHBondContact O-CB 3.36Å; N31-F35 PolarHBondContact O-N 3.36Å; N31-F35 VanDerWaalsContact O-N 3.17Å; F32-F35 PolarHBondContact O-N 2.84Å; F35-Y37 VanDerWaalsContact C-N 3.27Å; F35-Y37 PolarHBondContact O-N 3.42Å; F35-H38 PolarHBondContact O-N 3.29Å; F35-F39 WeakPolarHBondContact O-CB 3.36Å; F35-F39 PolarHBondContact O-N 3.28Å
36	A	53.4	Low	52.5	Low	30 Å²	30	84.1 Å²	84.1	25%	0.248	42%	0.417	C	S	.	.	H	α-helix	trans	-62.6	-36	178.3	0	0	0	0	0	111.8	F32 L33 T40	F32-A36 VanDerWaalsContact O-CB 3.27Å; F32-A36 WeakPolarHBondContact O-CB 3.34Å; F32-A36 PolarHBondContact O-N 2.89Å; L33-A36 PolarHBondContact O-N 2.87Å; A36-T40 VanDerWaalsContact O-CB 3.26Å; A36-T40 WeakPolarHBondContact O-CB 3.36Å; A36-T40 PolarHBondContact O-N 3.44Å; A36-T40 PolarHBondContact O-OG1 3.29Å
37	Y	55.2	Low	52.7	Low	45 Å²	45	82.1 Å²	82.1	18%	0.176	42%	0.415	C	S	.	.	H	α-helix	trans	-65.5	-54.4	174.5	-174.5	-117.1	0	0	0	112.6	F14 L33 D34 F35 F39 T40 V41	F14-Y37 HydrophobicContact CB-CD2 3.74Å; F14-Y37 HydrophobicContact CB-CE2 3.33Å; F14-Y37 AromaticContact CD1-CD1 3.91Å; F14-Y37 HydrophobicContact CD1-CD1 3.91Å; F14-Y37 AromaticContact CD1-CD2 3.3Å; F14-Y37 HydrophobicContact CD1-CD2 3.3Å; F14-Y37 AromaticContact CD1-CE1 3.93Å; F14-Y37 HydrophobicContact CD1-CE1 3.93Å; F14-Y37 AromaticContact CD1-CE2 3.31Å; F14-Y37 HydrophobicContact CD1-CE2 3.31Å; F14-Y37 AromaticContact CD1-CG 3.59Å; F14-Y37 HydrophobicContact CD1-CG 3.59Å; F14-Y37 AromaticContact CD1-CZ 3.61Å; F14-Y37 AromaticContact CD2-CD2 3.12Å; F14-Y37 HydrophobicContact CD2-CD2 3.12Å; F14-Y37 AromaticContact CD2-CE2 3.71Å; F14-Y37 HydrophobicContact CD2-CE2 3.71Å; F14-Y37 AromaticContact CD2-CG 3.78Å; F14-Y37 HydrophobicContact CD2-CG 3.78Å; F14-Y37 AromaticContact CE1-CD1 3.65Å; F14-Y37 HydrophobicContact CE1-CD1 3.65Å; F14-Y37 AromaticContact CE1-CD2 3.58Å; F14-Y37 HydrophobicContact CE1-CD2 3.58Å; F14-Y37 HydrophobicContact CE1-CE1 4.08Å; F14-Y37 HydrophobicContact CE1-CE2 4.01Å; F14-Y37 AromaticContact CE1-CG 3.35Å; F14-Y37 HydrophobicContact CE1-CG 3.35Å; F14-Y37 AromaticContact CE2-CD2 3.44Å; F14-Y37 HydrophobicContact CE2-CD2 3.44Å; F14-Y37 VanDerWaalsContact CE2-CD2 3.44Å; F14-Y37 HydrophobicContact CE2-CE2 4.37Å; F14-Y37 AromaticContact CE2-CG 3.59Å; F14-Y37 HydrophobicContact CE2-CG 3.59Å; F14-Y37 AromaticContact CG-CD2 3.06Å; F14-Y37 HydrophobicContact CG-CD2 3.06Å; F14-Y37 AromaticContact CG-CE2 3.13Å; F14-Y37 HydrophobicContact CG-CE2 3.13Å; F14-Y37 AromaticContact CG-CG 3.8Å; F14-Y37 HydrophobicContact CG-CG 3.8Å; F14-Y37 AromaticContact CG-CZ 3.93Å; F14-Y37 HydrophobicContact CZ-CD1 4.07Å; F14-Y37 AromaticContact CZ-CD2 3.67Å; F14-Y37 HydrophobicContact CZ-CD2 3.67Å; F14-Y37 AromaticContact CZ-CG 3.38Å; F14-Y37 HydrophobicContact CZ-CG 3.38Å; L33-Y37 WeakPolarHBondContact O-CB 3.35Å; L33-Y37 PolarHBondContact O-N 2.88Å; D34-Y37 PolarHBondContact O-N 3.46Å; F35-Y37 VanDerWaalsContact C-N 3.27Å; F35-Y37 PolarHBondContact O-N 3.42Å; Y37-F39 VanDerWaalsContact C-N 3.29Å; Y37-F39 PolarHBondContact O-N 2.91Å; Y37-T40 PolarHBondContact O-N 2.91Å; Y37-V41 HydrophobicContact CD2-CG2 4.39Å; Y37-V41 HydrophobicContact CE1-CG2 4.41Å; Y37-V41 HydrophobicContact CE2-CG2 4.15Å; Y37-V41 WeakPolarHBondContact O-CG2 3.31Å; Y37-V41 PolarHBondContact O-N 3.5Å
38	H	55.1	Low	52.9	Low	45 Å²	45	74.7 Å²	74.7	21%	0.208	38%	0.379	C	S	.	.	H	α-helix	trans	-63.7	-36.5	-179.5	-78.3	90.7	0	0	0	112	D34 F35 F42	D34-H38 PolarHBondContact O-N 2.95Å; D34-H38 PolarHBondContact O-ND1 2.88Å; D34-H38 IonicContact OD1-CE1 3.63Å; D34-H38 IonicContact OD1-ND1 3.71Å; D34-H38 IonicContact OD2-CE1 3.81Å; D34-H38 IonicContact OD2-ND1 3.5Å; D34-H38 PolarHBondContact OD2-ND1 3.49Å; F35-H38 PolarHBondContact O-N 3.29Å; H38-F42 VanDerWaalsContact O-CB 3.28Å; H38-F42 WeakPolarHBondContact O-CB 3.49Å; H38-F42 PolarHBondContact O-N 2.97Å
39	F	50.6	Low	53	Low	114 Å²	114	79.1 Å²	79.1	50%	0.5	39%	0.389	S	S	.	.	H	α-helix	trans	-65.2	-43.8	174.1	-179.3	-103.2	0	0	0	111.8	F35 Y37 F42 V43	F35-F39 WeakPolarHBondContact O-CB 3.36Å; F35-F39 PolarHBondContact O-N 3.28Å; Y37-F39 VanDerWaalsContact C-N 3.29Å; Y37-F39 PolarHBondContact O-N 2.91Å; F39-F42 PolarHBondContact O-N 3.38Å; F39-V43 HydrophobicContact CD1-CG2 4.27Å; F39-V43 HydrophobicContact CD2-CG2 4.45Å; F39-V43 HydrophobicContact CE1-CG2 3.89Å; F39-V43 HydrophobicContact CE2-CG2 4.09Å; F39-V43 HydrophobicContact CZ-CG2 3.79Å; F39-V43 VanDerWaalsContact O-CG2 3.3Å; F39-V43 WeakPolarHBondContact O-CG2 3.48Å; F39-V43 PolarHBondContact O-N 3.12Å
40	T	52	Low	53	Low	44 Å²	44	78.1 Å²	78.1	27%	0.27	38%	0.384	S	S	.	.	H	α-helix	trans	-62.9	-49.1	177.7	-60.1	0	0	0	0	110.4	F10 A36 Y37 F42 V43 F44	F10-T40 HydrophobicContact CD1-CG2 4.18Å; F10-T40 HydrophobicContact CE1-CG2 4.32Å; A36-T40 VanDerWaalsContact O-CB 3.26Å; A36-T40 WeakPolarHBondContact O-CB 3.36Å; A36-T40 PolarHBondContact O-N 3.44Å; A36-T40 PolarHBondContact O-OG1 3.29Å; Y37-T40 PolarHBondContact O-N 2.91Å; T40-F42 VanDerWaalsContact C-N 3.31Å; T40-F42 PolarHBondContact O-N 2.92Å; T40-V43 PolarHBondContact O-N 2.91Å; T40-F44 HydrophobicContact CG2-CD2 3.69Å; T40-F44 HydrophobicContact CG2-CE2 3.71Å; T40-F44 VanDerWaalsContact O-CD2 3.28Å; T40-F44 WeakPolarHBondContact O-CD2 3.4Å; T40-F44 PolarHBondContact O-N 2.86Å
41	V	52.8	Low	53.3	Low	44 Å²	44	79.5 Å²	79.5	27%	0.267	40%	0.397	S	S	.	.	H	α-helix	trans	-58.6	-43.3	177	174.9	0	0	0	0	111.1	Y37 F44 Y45	Y37-V41 HydrophobicContact CD2-CG2 4.39Å; Y37-V41 HydrophobicContact CE1-CG2 4.41Å; Y37-V41 HydrophobicContact CE2-CG2 4.15Å; Y37-V41 WeakPolarHBondContact O-CG2 3.31Å; Y37-V41 PolarHBondContact O-N 3.5Å; V41-F44 PolarHBondContact O-N 3.42Å; V41-Y45 HydrophobicContact CG1-CD2 3.65Å; V41-Y45 HydrophobicContact CG1-CE2 3.78Å; V41-Y45 WeakPolarHBondContact O-CD2 3.16Å; V41-Y45 PolarHBondContact O-N 3.47Å
42	F	50.8	Low	53.5	Low	125 Å²	125	79.2 Å²	79.2	55%	0.548	39%	0.394	S	S	.	.	H	α-helix	trans	-59.7	-48.5	175	172.8	-98.1	0	0	0	112.7	H38 F39 T40 F44 Y45 F46	H38-F42 VanDerWaalsContact O-CB 3.28Å; H38-F42 WeakPolarHBondContact O-CB 3.49Å; H38-F42 PolarHBondContact O-N 2.97Å; F39-F42 PolarHBondContact O-N 3.38Å; T40-F42 VanDerWaalsContact C-N 3.31Å; T40-F42 PolarHBondContact O-N 2.92Å; F42-F44 VanDerWaalsContact C-N 3.31Å; F42-F44 PolarHBondContact O-N 2.98Å; F42-Y45 PolarHBondContact O-N 3.49Å; F42-F46 WeakPolarHBondContact O-CB 3.44Å; F42-F46 PolarHBondContact O-N 3.4Å
43	V	53.7	Low	53.9	Low	71 Å²	71	74.6 Å²	74.6	43%	0.43	38%	0.382	S	S	.	.	H	α-helix	trans	-62	-39.6	179.4	170.4	0	0	0	0	111.3	F39 T40 G47	F39-V43 HydrophobicContact CD1-CG2 4.27Å; F39-V43 HydrophobicContact CD2-CG2 4.45Å; F39-V43 HydrophobicContact CE1-CG2 3.89Å; F39-V43 HydrophobicContact CE2-CG2 4.09Å; F39-V43 HydrophobicContact CZ-CG2 3.79Å; F39-V43 VanDerWaalsContact O-CG2 3.3Å; F39-V43 WeakPolarHBondContact O-CG2 3.48Å; F39-V43 PolarHBondContact O-N 3.12Å; T40-V43 PolarHBondContact O-N 2.91Å; V43-G47 PolarHBondContact O-N 3.43Å
44	F	52.3	Low	54	Low	68 Å²	68	74.2 Å²	74.2	30%	0.298	39%	0.387	S	S	.	.	H	α-helix	trans	-68.5	-45.2	177.8	-89	-82	0	0	0	112.8	F10 T40 V41 F42 A48	F10-F44 HydrophobicContact CD2-CE2 4.04Å; F10-F44 AromaticContact CD2-CZ 3.98Å; F10-F44 HydrophobicContact CD2-CZ 3.98Å; F10-F44 AromaticContact CE2-CE2 3.89Å; F10-F44 HydrophobicContact CE2-CE2 3.89Å; F10-F44 AromaticContact CE2-CZ 3.68Å; F10-F44 HydrophobicContact CE2-CZ 3.68Å; F10-F44 HydrophobicContact CZ-CE2 4.36Å; F10-F44 HydrophobicContact CZ-CZ 4.45Å; T40-F44 HydrophobicContact CG2-CD2 3.69Å; T40-F44 HydrophobicContact CG2-CE2 3.71Å; T40-F44 VanDerWaalsContact O-CD2 3.28Å; T40-F44 WeakPolarHBondContact O-CD2 3.4Å; T40-F44 PolarHBondContact O-N 2.86Å; V41-F44 PolarHBondContact O-N 3.42Å; F42-F44 VanDerWaalsContact C-N 3.31Å; F42-F44 PolarHBondContact O-N 2.98Å; F44-A48 PolarHBondContact O-N 3.32Å; F44-A48 VanDerWaalsContact O-N 3.14Å
45	Y	53.9	Low	54.2	Low	84 Å²	84	73.7 Å²	73.7	33%	0.329	39%	0.392	S	S	.	.	H	α-helix	trans	-68.6	-39.2	176.5	-87	-73.4	0	0	0	112.6	V41 F42 A48 F49 A88	V41-Y45 HydrophobicContact CG1-CD2 3.65Å; V41-Y45 HydrophobicContact CG1-CE2 3.78Å; V41-Y45 WeakPolarHBondContact O-CD2 3.16Å; V41-Y45 PolarHBondContact O-N 3.47Å; F42-Y45 PolarHBondContact O-N 3.49Å; Y45-A48 PolarHBondContact O-N 3.12Å; Y45-F49 PolarHBondContact O-N 3.2Å; Y45-A88 HydrophobicContact CD1-CB 3.8Å; Y45-A88 HydrophobicContact CE1-CB 3.32Å
46	F	51.9	Low	54.5	Low	102 Å²	102	71.5 Å²	71.5	45%	0.447	39%	0.39	S	S	.	.	H	α-helix	trans	-66	-43.4	176.3	-177.6	-102.6	0	0	0	111.9	F42 A48 F49 L50	F42-F46 WeakPolarHBondContact O-CB 3.44Å; F42-F46 PolarHBondContact O-N 3.4Å; F46-A48 VanDerWaalsContact C-N 3.31Å; F46-A48 PolarHBondContact O-N 2.93Å; F46-F49 PolarHBondContact O-N 3.05Å; F46-L50 HydrophobicContact CE1-CD1 4.31Å; F46-L50 HydrophobicContact CE1-CD2 4.35Å; F46-L50 HydrophobicContact CZ-CD1 4.07Å; F46-L50 WeakPolarHBondContact O-CB 3.43Å; F46-L50 PolarHBondContact O-N 3.05Å
47	G	51.7	Low	54.6	Low	34 Å²	34	73.6 Å²	73.6	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-62.3	-36.3	176.1	0	0	0	0	0	113	V43 L50 L51	V43-G47 PolarHBondContact O-N 3.43Å; G47-L50 PolarHBondContact O-N 2.98Å; G47-L51 VanDerWaalsContact O-CB 3.24Å; G47-L51 WeakPolarHBondContact O-CB 3.5Å; G47-L51 PolarHBondContact O-N 2.93Å
48	A	54.8	Low	54.6	Low	28 Å²	28	76.5 Å²	76.5	23%	0.231	42%	0.421	C	S	.	.	H	α-helix	trans	-63.4	-47.8	175.6	0	0	0	0	0	112	V3 F44 Y45 F46 L51 E52	V3-A48 HydrophobicContact CG1-CB 3.91Å; F44-A48 PolarHBondContact O-N 3.32Å; F44-A48 VanDerWaalsContact O-N 3.14Å; Y45-A48 PolarHBondContact O-N 3.12Å; F46-A48 VanDerWaalsContact C-N 3.31Å; F46-A48 PolarHBondContact O-N 2.93Å; A48-L51 PolarHBondContact O-N 2.75Å; A48-E52 WeakPolarHBondContact O-CB 3.25Å; A48-E52 PolarHBondContact O-N 2.94Å
49	F	52.5	Low	54.5	Low	139 Å²	139	80.1 Å²	80.1	61%	0.61	44%	0.437	S	S	*	.	H	α-helix	trans	-60.4	-45.5	174.5	169.4	-100.3	0	0	0	111.9	Y45 F46 L51 E52 A53	Y45-F49 PolarHBondContact O-N 3.2Å; F46-F49 PolarHBondContact O-N 3.05Å; F49-L51 PolarHBondContact O-N 3.19Å; F49-E52 PolarHBondContact O-N 3.39Å; F49-A53 WeakPolarHBondContact O-CB 3.27Å; F49-A53 PolarHBondContact O-N 3.4Å
50	L	55.8	Low	54.5	Low	96 Å²	96	80.5 Å²	80.5	50%	0.503	45%	0.445	S	S	.	.	H	α-helix	trans	-66.1	-40	-177.9	-152.8	79.4	0	0	0	112	F46 G47 A54	F46-L50 HydrophobicContact CE1-CD1 4.31Å; F46-L50 HydrophobicContact CE1-CD2 4.35Å; F46-L50 HydrophobicContact CZ-CD1 4.07Å; F46-L50 WeakPolarHBondContact O-CB 3.43Å; F46-L50 PolarHBondContact O-N 3.05Å; G47-L50 PolarHBondContact O-N 2.98Å; L50-A54 VanDerWaalsContact O-CB 3.3Å; L50-A54 WeakPolarHBondContact O-CB 3.35Å; L50-A54 PolarHBondContact O-N 3.17Å
51	L	58.3	Low	54.4	Low	122 Å²	122	84.4 Å²	84.4	64%	0.639	46%	0.463	S	S	*	.	H	α-helix	trans	-68.9	-37.7	177.5	-171.4	64.7	0	0	0	111.5	G47 A48 F49 A54 A55	G47-L51 VanDerWaalsContact O-CB 3.24Å; G47-L51 WeakPolarHBondContact O-CB 3.5Å; G47-L51 PolarHBondContact O-N 2.93Å; A48-L51 PolarHBondContact O-N 2.75Å; F49-L51 PolarHBondContact O-N 3.19Å; L51-A54 PolarHBondContact O-N 3.38Å; L51-A55 WeakPolarHBondContact O-CB 3.35Å; L51-A55 PolarHBondContact O-N 3.38Å
52	E	57.7	Low	54.1	Low	71 Å²	71	88.1 Å²	88.1	33%	0.332	48%	0.478	S	S	.	.	H	α-helix	trans	-69.6	-39.8	175.5	-171.4	156.3	158.2	0	0	112.4	A48 F49 A55 T56 N81	A48-E52 WeakPolarHBondContact O-CB 3.25Å; A48-E52 PolarHBondContact O-N 2.94Å; F49-E52 PolarHBondContact O-N 3.39Å; E52-A55 PolarHBondContact O-N 2.84Å; E52-T56 WeakPolarHBondContact O-CB 3.34Å; E52-T56 PolarHBondContact O-N 3.36Å; E52-T56 PolarHBondContact O-OG1 3.35Å; E52-N81 PolarHBondContact OE1-ND2 2.99Å; E52-N81 PolarHBondContact OE2-ND2 2.97Å
53	A	57.4	Low	54	Low	45 Å²	45	87.4 Å²	87.4	37%	0.372	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-40.4	172.7	0	0	0	0	0	112	F49 T56 S57	F49-A53 WeakPolarHBondContact O-CB 3.27Å; F49-A53 PolarHBondContact O-N 3.4Å; A53-T56 PolarHBondContact O-N 2.83Å; A53-S57 WeakPolarHBondContact O-CB 3.27Å; A53-S57 PolarHBondContact O-N 2.85Å; A53-S57 PolarHBondContact O-OG 3.45Å
54	A	60.2	Low	53.6	Low	51 Å²	51	91 Å²	91	42%	0.421	50%	0.504	S	S	.	.	H	α-helix	trans	-68.3	-39.1	175.6	0	0	0	0	0	112.6	L50 L51 T56 S57 L58	L50-A54 VanDerWaalsContact O-CB 3.3Å; L50-A54 WeakPolarHBondContact O-CB 3.35Å; L50-A54 PolarHBondContact O-N 3.17Å; L51-A54 PolarHBondContact O-N 3.38Å; A54-T56 VanDerWaalsContact C-N 3.34Å; A54-S57 PolarHBondContact O-OG 2.9Å; A54-S57 VanDerWaalsContact O-OG 3.06Å; A54-L58 VanDerWaalsContact O-CB 3.26Å; A54-L58 WeakPolarHBondContact O-CB 3.46Å; A54-L58 PolarHBondContact O-N 3.45Å
55	A	58.3	Low	53.4	Low	59 Å²	59	91.2 Å²	91.2	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-65.9	-38.6	174.4	0	0	0	0	0	111.6	L51 E52 H59	L51-A55 WeakPolarHBondContact O-CB 3.35Å; L51-A55 PolarHBondContact O-N 3.38Å; E52-A55 PolarHBondContact O-N 2.84Å; A55-H59 WeakPolarHBondContact O-CB 3.34Å; A55-H59 PolarHBondContact O-N 3.14Å
56	T	57.2	Low	53.2	Low	85 Å²	85	93.9 Å²	93.9	52%	0.521	54%	0.536	S	S	.	.	H	α-helix	trans	-70.1	-41.6	177.7	-54.3	0	0	0	0	111.7	E52 A53 A54 H59 D60	E52-T56 WeakPolarHBondContact O-CB 3.34Å; E52-T56 PolarHBondContact O-N 3.36Å; E52-T56 PolarHBondContact O-OG1 3.35Å; A53-T56 PolarHBondContact O-N 2.83Å; A54-T56 VanDerWaalsContact C-N 3.34Å; T56-H59 WeakPolarHBondContact O-CB 3.21Å; T56-H59 PolarHBondContact O-N 3.25Å; T56-D60 PolarHBondContact O-N 2.93Å
57	S	54.4	Low	52.9	Low	74 Å²	74	95.4 Å²	95.4	52%	0.517	55%	0.547	S	S	.	.	H	α-helix	trans	-68.2	-34.5	175.6	65.8	0	0	0	0	112.7	A53 A54 H59 D60 L61	A53-S57 WeakPolarHBondContact O-CB 3.27Å; A53-S57 PolarHBondContact O-N 2.85Å; A53-S57 PolarHBondContact O-OG 3.45Å; A54-S57 PolarHBondContact O-OG 2.9Å; A54-S57 VanDerWaalsContact O-OG 3.06Å; S57-H59 VanDerWaalsContact C-N 3.33Å; S57-D60 PolarHBondContact O-N 2.92Å; S57-L61 PolarHBondContact O-N 3.26Å; S57-L61 VanDerWaalsContact O-N 3.09Å
58	L	54.3	Low	52.8	Low	106 Å²	106	100.3 Å²	100.3	56%	0.555	57%	0.57	S	S	*	*	H	α-helix	trans	-68.3	-33.1	172.2	-170.1	67.8	0	0	0	112	A54 L61 H62	A54-L58 VanDerWaalsContact O-CB 3.26Å; A54-L58 WeakPolarHBondContact O-CB 3.46Å; A54-L58 PolarHBondContact O-N 3.45Å; L58-L61 PolarHBondContact O-N 3.14Å; L58-H62 PolarHBondContact O-N 3.46Å; L58-H62 VanDerWaalsContact O-N 3.13Å
59	H	52.9	Low	52.5	Low	120 Å²	120	102.1 Å²	102.1	56%	0.556	59%	0.592	S	S	*	*	H	α-helix	trans	-64.6	-43.5	172.5	-169	86	0	0	0	111.5	A55 T56 S57 L61 H62 C63	A55-H59 WeakPolarHBondContact O-CB 3.34Å; A55-H59 PolarHBondContact O-N 3.14Å; T56-H59 WeakPolarHBondContact O-CB 3.21Å; T56-H59 PolarHBondContact O-N 3.25Å; S57-H59 VanDerWaalsContact C-N 3.33Å; H59-L61 VanDerWaalsContact C-N 3.3Å; H59-L61 PolarHBondContact O-N 2.99Å; H59-H62 PolarHBondContact O-N 3.37Å; H59-C63 PolarHBondContact O-N 3.29Å
60	D	51.8	Low	52.1	Low	123 Å²	123	104.2 Å²	104.2	66%	0.658	60%	0.603	S	S	*	*	H	α-helix	trans	-62.2	-36.6	175.6	-118	-5.2	0	0	0	112.1	T56 S57 C63	T56-D60 PolarHBondContact O-N 2.93Å; S57-D60 PolarHBondContact O-N 2.92Å; D60-C63 PolarHBondContact O-N 3.5Å
61	L	50.4	Low	51.7	Low	126 Å²	126	104.6 Å²	104.6	66%	0.66	61%	0.612	S	S	*	*	H	α-helix	trans	-69	-35.4	176.6	-145.9	84.4	0	0	0	112.6	S57 L58 H59 C63 T65	S57-L61 PolarHBondContact O-N 3.26Å; S57-L61 VanDerWaalsContact O-N 3.09Å; L58-L61 PolarHBondContact O-N 3.14Å; H59-L61 VanDerWaalsContact C-N 3.3Å; H59-L61 PolarHBondContact O-N 2.99Å; L61-C63 VanDerWaalsContact C-N 3.34Å; L61-T65 PolarHBondContact O-OG1 3.35Å
62	H	46.4	Very low	51.4	Low	122 Å²	122	106.3 Å²	106.3	57%	0.565	62%	0.621	S	S	*	*	H	α-helix	trans	-74	-23.3	176.9	-103.6	131.6	0	0	0	113.1	L58 H59 N64 T65	L58-H62 PolarHBondContact O-N 3.46Å; L58-H62 VanDerWaalsContact O-N 3.13Å; H59-H62 PolarHBondContact O-N 3.37Å; H62-N64 PolarHBondContact O-N 3.24Å; H62-T65 CarbonylContact O-C 3.57Å; H62-T65 PolarHBondContact O-N 3.1Å; H62-T65 VanDerWaalsContact O-O 3.04Å
63	C	47.7	Very low	51.1	Low	109 Å²	109	107.3 Å²	107.3	74%	0.736	63%	0.628	S	S	*	*	H	α-helix	trans	-68.6	-20.9	177.6	-153	0	0	0	0	113.1	H59 D60 L61	H59-C63 PolarHBondContact O-N 3.29Å; D60-C63 PolarHBondContact O-N 3.5Å; L61-C63 VanDerWaalsContact C-N 3.34Å
64	N	46.4	Very low	51.2	Low	148 Å²	148	108.5 Å²	108.5	79%	0.791	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-9.3	171.1	-163.2	35.7	0	0	0	113.2	H62	H62-N64 PolarHBondContact O-N 3.24Å
65	T	47.8	Very low	51	Low	72 Å²	72	112.8 Å²	112.8	44%	0.442	65%	0.65	S	S	.	*	S	Bend	trans	-102.9	94.3	178.8	-34.7	0	0	0	0	107.4	L61 H62 I67	L61-T65 PolarHBondContact O-OG1 3.35Å; H62-T65 CarbonylContact O-C 3.57Å; H62-T65 PolarHBondContact O-N 3.1Å; H62-T65 VanDerWaalsContact O-O 3.04Å; T65-I67 VanDerWaalsContact C-N 3.31Å; T65-I67 PolarHBondContact O-N 3.03Å
66	T	48.3	Very low	50.8	Low	140 Å²	140	115.2 Å²	115.2	86%	0.859	65%	0.654	S	S	*	*			trans	-50.7	85.6	175.4	46.1	0	0	0	0	112.4
67	I	45.9	Very low	50.6	Low	133 Å²	133	116 Å²	116	68%	0.682	65%	0.652	S	S	*	*			trans	-136.9	96.7	164.8	-58.2	-173.2	0	0	0	108.6	T65 G69	T65-I67 VanDerWaalsContact C-N 3.31Å; T65-I67 PolarHBondContact O-N 3.03Å; I67-G69 PolarHBondContact O-N 3.47Å
68	T	50.2	Low	50.5	Low	137 Å²	137	119.9 Å²	119.9	84%	0.84	66%	0.656	S	S	*	*			trans	-7.7	113.9	143.1	51.9	0	0	0	0	115.3
69	G	47.8	Very low	50.5	Low	66 Å²	66	119.7 Å²	119.7	68%	0.68	66%	0.656	S	S	*	*			trans	139.8	86.2	159.2	0	0	0	0	0	115.9	I67	I67-G69 PolarHBondContact O-N 3.47Å
70	Q	43.9	Very low	50.6	Low	183 Å²	183	118.7 Å²	118.7	86%	0.855	65%	0.654	S	S	*	*			trans	68.2	125	156.7	-53.4	-115.4	-77.7	0	0	117.5	L72	Q70-L72 PolarHBondContact O-N 2.67Å
71	P	47.6	Very low	50.6	Low	105 Å²	105	116 Å²	116	68%	0.682	64%	0.639	S	S	*	*			trans	-63	125.3	168.8	26.7	-30.8	0	0	0	109.2	L73	P71-L73 PolarHBondContact O-N 2.98Å
72	L	52.8	Low	50.8	Low	157 Å²	157	112.2 Å²	112.2	82%	0.822	62%	0.621	S	S	*	*	S	Bend	trans	-65.2	-18.3	-176.1	-168.8	66.4	0	0	0	113.1	Q70	Q70-L72 PolarHBondContact O-N 2.67Å
73	L	51.8	Low	51.1	Low	92 Å²	92	109.2 Å²	109.2	48%	0.482	62%	0.617	S	S	.	*	S	Bend	trans	-134.1	133.7	171.7	-90.6	93.6	0	0	0	110.6	P71 Q77	P71-L73 PolarHBondContact O-N 2.98Å; L73-Q77 HydrophobicContact CB-CB 4.36Å; L73-Q77 HydrophobicContact CD2-CB 3.75Å; L73-Q77 HydrophobicContact CD2-CG 3.66Å; L73-Q77 HydrophobicContact CG-CB 4.26Å; L73-Q77 HydrophobicContact CG-CG 4.21Å
74	S	58.7	Low	51.3	Low	70 Å²	70	106.5 Å²	106.5	49%	0.49	60%	0.603	S	S	.	*			trans	-70.7	149.8	170.5	63.2	0	0	0	0	111.2	N76 Q77 Y78	S74-N76 PolarHBondContact O-N 3.4Å; S74-Q77 WeakPolarHBondContact O-CA 3.43Å; S74-Q77 WeakPolarHBondContact O-CB 3.27Å; S74-Q77 PolarHBondContact O-N 2.94Å; S74-Y78 PolarHBondContact O-N 2.98Å
75	D	57	Low	51.5	Low	142 Å²	142	102 Å²	102	76%	0.759	58%	0.583	S	S	*	*	H	α-helix	trans	-50.4	-31.2	-176.8	-69.3	-54.3	0	0	0	114.4	Q77 Y78 N79	D75-Q77 VanDerWaalsContact C-N 3.28Å; D75-Q77 PolarHBondContact O-N 3.32Å; D75-Y78 PolarHBondContact O-N 2.97Å; D75-N79 PolarHBondContact O-N 3.48Å
76	N	54.2	Low	51.6	Low	110 Å²	110	103.1 Å²	103.1	59%	0.588	59%	0.585	S	S	*	*	H	α-helix	trans	-64.2	-35.9	177.2	-166.4	25.1	0	0	0	112.3	S74 N79 I80	S74-N76 PolarHBondContact O-N 3.4Å; N76-N79 PolarHBondContact O-N 3.3Å; N76-I80 WeakPolarHBondContact O-CD1 3.17Å; N76-I80 WeakPolarHBondContact O-CG1 3.32Å; N76-I80 PolarHBondContact O-N 2.83Å; N76-I80 VanDerWaalsContact O-N 3.14Å
77	Q	51.3	Low	51.7	Low	102 Å²	102	103.8 Å²	103.8	48%	0.477	58%	0.577	S	S	.	*	H	α-helix	trans	-77.9	-28.7	-175.3	-145	165.8	11.8	0	0	111	L73 S74 D75 N81	L73-Q77 HydrophobicContact CB-CB 4.36Å; L73-Q77 HydrophobicContact CD2-CB 3.75Å; L73-Q77 HydrophobicContact CD2-CG 3.66Å; L73-Q77 HydrophobicContact CG-CB 4.26Å; L73-Q77 HydrophobicContact CG-CG 4.21Å; S74-Q77 WeakPolarHBondContact O-CA 3.43Å; S74-Q77 WeakPolarHBondContact O-CB 3.27Å; S74-Q77 PolarHBondContact O-N 2.94Å; D75-Q77 VanDerWaalsContact C-N 3.28Å; D75-Q77 PolarHBondContact O-N 3.32Å; Q77-N81 WeakPolarHBondContact O-CB 3.26Å; Q77-N81 PolarHBondContact O-N 2.91Å
78	Y	52.9	Low	51.9	Low	155 Å²	155	98.4 Å²	98.4	61%	0.608	55%	0.552	S	S	*	*	H	α-helix	trans	-65.6	-49	167.9	176.2	-99.3	0	0	0	112.1	S74 D75 I80 N81 V82	S74-Y78 PolarHBondContact O-N 2.98Å; D75-Y78 PolarHBondContact O-N 2.97Å; Y78-I80 VanDerWaalsContact C-N 3.31Å; Y78-I80 PolarHBondContact O-N 3.4Å; Y78-N81 PolarHBondContact O-N 3.37Å; Y78-N81 VanDerWaalsContact O-N 3.1Å; Y78-V82 HydrophobicContact CD1-CG2 4.4Å; Y78-V82 HydrophobicContact CE1-CG2 4.01Å; Y78-V82 HydrophobicContact CE2-CG2 4.3Å; Y78-V82 WeakPolarHBondContact O-CG2 3.13Å; Y78-V82 PolarHBondContact O-N 3.23Å
79	N	54.4	Low	51.8	Low	101 Å²	101	98.9 Å²	98.9	54%	0.54	54%	0.543	S	S	.	.	H	α-helix	trans	-61.6	-38	178.9	-79.9	-30.3	0	0	0	112.9	D75 N76 N81 V82 A83	D75-N79 PolarHBondContact O-N 3.48Å; N76-N79 PolarHBondContact O-N 3.3Å; N79-N81 VanDerWaalsContact C-N 3.32Å; N79-N81 PolarHBondContact O-N 3.34Å; N79-V82 PolarHBondContact O-N 3.4Å; N79-A83 WeakPolarHBondContact O-CB 3.3Å; N79-A83 PolarHBondContact O-N 2.98Å
80	I	55.8	Low	52	Low	99 Å²	99	101.2 Å²	101.2	51%	0.508	54%	0.537	S	S	.	.	H	α-helix	trans	-65.7	-37.7	176.4	-67.3	163.3	0	0	0	110.9	N76 Y78 A83 A84	N76-I80 WeakPolarHBondContact O-CD1 3.17Å; N76-I80 WeakPolarHBondContact O-CG1 3.32Å; N76-I80 PolarHBondContact O-N 2.83Å; N76-I80 VanDerWaalsContact O-N 3.14Å; Y78-I80 VanDerWaalsContact C-N 3.31Å; Y78-I80 PolarHBondContact O-N 3.4Å; I80-A83 PolarHBondContact O-N 3.39Å; I80-A84 WeakPolarHBondContact O-CB 3.49Å; I80-A84 PolarHBondContact O-N 3.23Å
81	N	52	Low	52.3	Low	66 Å²	66	94.2 Å²	94.2	35%	0.353	51%	0.507	S	S	.	.	H	α-helix	trans	-71.5	-38.4	179.7	-146.9	46.3	0	0	0	112.1	E52 Q77 Y78 N79 A84 S85	E52-N81 PolarHBondContact OE1-ND2 2.99Å; E52-N81 PolarHBondContact OE2-ND2 2.97Å; Q77-N81 WeakPolarHBondContact O-CB 3.26Å; Q77-N81 PolarHBondContact O-N 2.91Å; Y78-N81 PolarHBondContact O-N 3.37Å; Y78-N81 VanDerWaalsContact O-N 3.1Å; N79-N81 VanDerWaalsContact C-N 3.32Å; N79-N81 PolarHBondContact O-N 3.34Å; N81-A84 PolarHBondContact O-N 2.97Å; N81-S85 PolarHBondContact O-N 2.93Å
82	V	54.2	Low	52.4	Low	47 Å²	47	91.9 Å²	91.9	29%	0.285	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-44	172.1	169.1	0	0	0	0	111.5	Y78 N79 A84 S85 I86	Y78-V82 HydrophobicContact CD1-CG2 4.4Å; Y78-V82 HydrophobicContact CE1-CG2 4.01Å; Y78-V82 HydrophobicContact CE2-CG2 4.3Å; Y78-V82 WeakPolarHBondContact O-CG2 3.13Å; Y78-V82 PolarHBondContact O-N 3.23Å; N79-V82 PolarHBondContact O-N 3.4Å; V82-A84 VanDerWaalsContact C-N 3.29Å; V82-A84 PolarHBondContact O-N 3.44Å; V82-S85 PolarHBondContact O-N 2.7Å; V82-S85 PolarHBondContact O-OG 2.93Å; V82-I86 HydrophobicContact CG1-CD1 3.9Å; V82-I86 VanDerWaalsContact O-CG1 3.32Å; V82-I86 WeakPolarHBondContact O-CG1 3.36Å; V82-I86 PolarHBondContact O-N 3.41Å; V82-I86 VanDerWaalsContact O-N 3.12Å
83	A	52.4	Low	52.2	Low	59 Å²	59	86.5 Å²	86.5	49%	0.488	47%	0.469	S	S	.	.	H	α-helix	trans	-62.4	-39.3	176.3	0	0	0	0	0	111.7	N79 I80 F87	N79-A83 WeakPolarHBondContact O-CB 3.3Å; N79-A83 PolarHBondContact O-N 2.98Å; I80-A83 PolarHBondContact O-N 3.39Å; A83-F87 PolarHBondContact O-N 3.15Å; A83-F87 VanDerWaalsContact O-N 3.12Å
84	A	52.8	Low	52.1	Low	52 Å²	52	86.2 Å²	86.2	43%	0.43	47%	0.474	S	S	.	.	H	α-helix	trans	-65.7	-40.2	177.3	0	0	0	0	0	112.4	I80 N81 V82 F87 A88	I80-A84 WeakPolarHBondContact O-CB 3.49Å; I80-A84 PolarHBondContact O-N 3.23Å; N81-A84 PolarHBondContact O-N 2.97Å; V82-A84 VanDerWaalsContact C-N 3.29Å; V82-A84 PolarHBondContact O-N 3.44Å; A84-F87 PolarHBondContact O-N 2.79Å; A84-A88 WeakPolarHBondContact O-CB 3.28Å; A84-A88 PolarHBondContact O-N 3.34Å
85	S	49.2	Very low	51.7	Low	54 Å²	54	89 Å²	89	38%	0.378	48%	0.475	S	S	.	.	H	α-helix	trans	-69	-36.3	179.3	71.7	0	0	0	0	112.5	N81 V82 A88 F89	N81-S85 PolarHBondContact O-N 2.93Å; V82-S85 PolarHBondContact O-N 2.7Å; V82-S85 PolarHBondContact O-OG 2.93Å; S85-A88 WeakPolarHBondContact O-CB 3.32Å; S85-F89 VanDerWaalsContact O-CB 3.31Å; S85-F89 WeakPolarHBondContact O-CB 3.22Å; S85-F89 PolarHBondContact O-N 3.46Å
86	I	50.3	Low	51.3	Low	95 Å²	95	84.2 Å²	84.2	49%	0.487	46%	0.458	S	S	.	.	H	α-helix	trans	-66	-44.5	174.6	-65.8	165.3	0	0	0	110.7	V82 F89 M90	V82-I86 HydrophobicContact CG1-CD1 3.9Å; V82-I86 VanDerWaalsContact O-CG1 3.32Å; V82-I86 WeakPolarHBondContact O-CG1 3.36Å; V82-I86 PolarHBondContact O-N 3.41Å; V82-I86 VanDerWaalsContact O-N 3.12Å; I86-F89 PolarHBondContact O-N 2.81Å; I86-M90 WeakPolarHBondContact O-CG 3.47Å; I86-M90 PolarHBondContact O-N 3.24Å
87	F	50.3	Low	51.1	Low	154 Å²	154	83 Å²	83	68%	0.675	46%	0.458	S	S	*	.	H	α-helix	trans	-66.2	-41.3	178.4	-170.8	-97.9	0	0	0	112	A83 A84 F89 M90 T91	A83-F87 PolarHBondContact O-N 3.15Å; A83-F87 VanDerWaalsContact O-N 3.12Å; A84-F87 PolarHBondContact O-N 2.79Å; F87-F89 VanDerWaalsContact C-N 3.34Å; F87-F89 PolarHBondContact O-N 2.69Å; F87-M90 PolarHBondContact O-N 3.22Å; F87-T91 WeakPolarHBondContact O-CB 3.28Å; F87-T91 PolarHBondContact O-N 3.48Å; F87-T91 PolarHBondContact O-OG1 2.92Å
88	A	49.8	Very low	50.9	Low	20 Å²	20	81.8 Å²	81.8	17%	0.165	46%	0.46	C	S	.	.	H	α-helix	trans	-56.7	-45.8	171.9	0	0	0	0	0	112.3	Y45 A84 S85 T91 T92	Y45-A88 HydrophobicContact CD1-CB 3.8Å; Y45-A88 HydrophobicContact CE1-CB 3.32Å; A84-A88 WeakPolarHBondContact O-CB 3.28Å; A84-A88 PolarHBondContact O-N 3.34Å; S85-A88 WeakPolarHBondContact O-CB 3.32Å; A88-T91 PolarHBondContact O-N 3.02Å; A88-T92 WeakPolarHBondContact O-CB 3.5Å; A88-T92 PolarHBondContact O-N 2.87Å; A88-T92 PolarHBondContact O-OG1 3.36Å
89	F	49.7	Very low	50.8	Low	148 Å²	148	77 Å²	77	65%	0.649	45%	0.445	S	S	*	.	H	α-helix	trans	-66.3	-46.2	179.7	-178.1	-97.3	0	0	0	112.3	S85 I86 F87 T91 T92 A93	S85-F89 VanDerWaalsContact O-CB 3.31Å; S85-F89 WeakPolarHBondContact O-CB 3.22Å; S85-F89 PolarHBondContact O-N 3.46Å; I86-F89 PolarHBondContact O-N 2.81Å; F87-F89 VanDerWaalsContact C-N 3.34Å; F87-F89 PolarHBondContact O-N 2.69Å; F89-T91 VanDerWaalsContact C-N 3.31Å; F89-T91 PolarHBondContact O-N 3.42Å; F89-T92 PolarHBondContact O-N 3.19Å; F89-A93 PolarHBondContact O-N 2.89Å
90	M	51	Low	50.6	Low	115 Å²	115	74 Å²	74	57%	0.567	44%	0.438	S	S	*	.	H	α-helix	trans	-60.5	-42.7	177	-71.3	-62.9	-176.9	0	0	111.7	I86 F87 A93 C94	I86-M90 WeakPolarHBondContact O-CG 3.47Å; I86-M90 PolarHBondContact O-N 3.24Å; F87-M90 PolarHBondContact O-N 3.22Å; M90-A93 PolarHBondContact O-N 3.48Å; M90-C94 PolarHBondContact O-N 3.5Å
91	T	50.4	Low	50.6	Low	35 Å²	35	75 Å²	75	22%	0.215	44%	0.443	C	S	.	.	H	α-helix	trans	-62.3	-45.7	176.4	-55.7	0	0	0	0	110.7	F87 A88 F89 A93 C94 Y95	F87-T91 WeakPolarHBondContact O-CB 3.28Å; F87-T91 PolarHBondContact O-N 3.48Å; F87-T91 PolarHBondContact O-OG1 2.92Å; A88-T91 PolarHBondContact O-N 3.02Å; F89-T91 VanDerWaalsContact C-N 3.31Å; F89-T91 PolarHBondContact O-N 3.42Å; T91-A93 VanDerWaalsContact C-N 3.35Å; T91-A93 PolarHBondContact O-N 3.41Å; T91-C94 PolarHBondContact O-N 3.14Å; T91-Y95 HydrophobicContact CG2-CD2 3.72Å; T91-Y95 HydrophobicContact CG2-CE2 3.69Å; T91-Y95 VanDerWaalsContact O-CD2 3.27Å; T91-Y95 WeakPolarHBondContact O-CD2 3.33Å; T91-Y95 PolarHBondContact O-N 2.89Å
92	T	49.5	Very low	50.4	Low	57 Å²	57	74.3 Å²	74.3	35%	0.35	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-40.9	177.1	-56.7	0	0	0	0	112.1	A88 F89 Y95 G96	A88-T92 WeakPolarHBondContact O-CB 3.5Å; A88-T92 PolarHBondContact O-N 2.87Å; A88-T92 PolarHBondContact O-OG1 3.36Å; F89-T92 PolarHBondContact O-N 3.19Å; T92-Y95 PolarHBondContact O-N 3.43Å; T92-G96 PolarHBondContact O-N 2.72Å
93	A	48.7	Very low	50.2	Low	44 Å²	44	77.5 Å²	77.5	36%	0.364	46%	0.462	S	S	.	.	H	α-helix	trans	-64.9	-43.7	176.8	0	0	0	0	0	111.9	F89 M90 T91 G96 C97	F89-A93 PolarHBondContact O-N 2.89Å; M90-A93 PolarHBondContact O-N 3.48Å; T91-A93 VanDerWaalsContact C-N 3.35Å; T91-A93 PolarHBondContact O-N 3.41Å; A93-G96 PolarHBondContact O-N 3.43Å; A93-C97 WeakPolarHBondContact O-CB 3.33Å; A93-C97 PolarHBondContact O-N 2.91Å; A93-C97 PolarHBondContact O-SG 2.92Å
94	C	49.9	Very low	50.2	Low	85 Å²	85	84.3 Å²	84.3	57%	0.574	48%	0.475	S	S	*	.	H	α-helix	trans	-64.1	-41.2	177.2	-75.6	0	0	0	0	113	M90 T91 S98	M90-C94 PolarHBondContact O-N 3.5Å; T91-C94 PolarHBondContact O-N 3.14Å; C94-S98 PolarHBondContact O-N 3.43Å; C94-S98 VanDerWaalsContact O-N 3.09Å; C94-S98 PolarHBondContact O-OG 3.41Å; C94-S98 VanDerWaalsContact O-OG 3.08Å
95	Y	49	Very low	50	Low	130 Å²	130	92.6 Å²	92.6	51%	0.51	50%	0.495	S	S	.	.	H	α-helix	trans	-70.2	-38.9	175.3	-82.8	-73.7	0	0	0	111.9	T91 T92 C97 S98 L99	T91-Y95 HydrophobicContact CG2-CD2 3.72Å; T91-Y95 HydrophobicContact CG2-CE2 3.69Å; T91-Y95 VanDerWaalsContact O-CD2 3.27Å; T91-Y95 WeakPolarHBondContact O-CD2 3.33Å; T91-Y95 PolarHBondContact O-N 2.89Å; T92-Y95 PolarHBondContact O-N 3.43Å; Y95-C97 PolarHBondContact O-N 2.92Å; Y95-S98 PolarHBondContact O-N 3.27Å; Y95-L99 WeakPolarHBondContact O-CB 3.24Å; Y95-L99 PolarHBondContact O-N 3.4Å
96	G	48.6	Very low	49.6	Very low	40 Å²	40	98.7 Å²	98.7	41%	0.412	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-39.5	173.7	0	0	0	0	0	113.2	T92 A93 L99 G100	T92-G96 PolarHBondContact O-N 2.72Å; A93-G96 PolarHBondContact O-N 3.43Å; G96-L99 PolarHBondContact O-N 3.03Å; G96-G100 PolarHBondContact O-N 2.96Å
97	C	50.8	Low	49.2	Very low	86 Å²	86	104.2 Å²	104.2	58%	0.581	53%	0.525	S	S	*	.	H	α-helix	trans	-66	-41.5	173.9	-72.1	0	0	0	0	112.1	A93 Y95 L99 G100 L101	A93-C97 WeakPolarHBondContact O-CB 3.33Å; A93-C97 PolarHBondContact O-N 2.91Å; A93-C97 PolarHBondContact O-SG 2.92Å; Y95-C97 PolarHBondContact O-N 2.92Å; C97-L99 VanDerWaalsContact C-N 3.34Å; C97-G100 PolarHBondContact O-N 3.25Å; C97-L101 WeakPolarHBondContact O-CG 3.41Å; C97-L101 PolarHBondContact O-N 2.9Å
98	S	47.9	Very low	49.3	Very low	75 Å²	75	106.2 Å²	106.2	52%	0.524	55%	0.553	S	S	.	*	H	α-helix	trans	-63.2	-40.1	175.2	-63.7	0	0	0	0	111.9	C94 Y95 L101 A102	C94-S98 PolarHBondContact O-N 3.43Å; C94-S98 VanDerWaalsContact O-N 3.09Å; C94-S98 PolarHBondContact O-OG 3.41Å; C94-S98 VanDerWaalsContact O-OG 3.08Å; Y95-S98 PolarHBondContact O-N 3.27Å; S98-L101 PolarHBondContact O-N 3.17Å; S98-A102 WeakPolarHBondContact O-CB 3.32Å; S98-A102 PolarHBondContact O-N 3.24Å
99	L	50.4	Low	49.3	Very low	55 Å²	55	110.5 Å²	110.5	29%	0.288	57%	0.573	S	S	.	*	H	α-helix	trans	-63.9	-42.7	173.3	-172.3	75.9	0	0	0	111.8	Y95 G96 C97 L101 A102 L103	Y95-L99 WeakPolarHBondContact O-CB 3.24Å; Y95-L99 PolarHBondContact O-N 3.4Å; G96-L99 PolarHBondContact O-N 3.03Å; C97-L99 VanDerWaalsContact C-N 3.34Å; L99-L101 VanDerWaalsContact C-N 3.35Å; L99-L101 PolarHBondContact O-N 3.22Å; L99-A102 PolarHBondContact O-N 3.09Å; L99-L103 HydrophobicContact CG-CD1 4.23Å; L99-L103 WeakPolarHBondContact O-CB 3.34Å; L99-L103 WeakPolarHBondContact O-CG 3.47Å; L99-L103 PolarHBondContact O-N 3Å
100	G	50.7	Low	49.3	Very low	38 Å²	38	108.5 Å²	108.5	39%	0.392	57%	0.569	S	S	.	*	H	α-helix	trans	-62.2	-39.3	176.1	0	0	0	0	0	112.9	G96 C97 R104	G96-G100 PolarHBondContact O-N 2.96Å; C97-G100 PolarHBondContact O-N 3.25Å; G100-R104 WeakPolarHBondContact O-CB 3.3Å; G100-R104 PolarHBondContact O-N 3Å
101	L	54.6	Low	49.2	Very low	119 Å²	119	108.2 Å²	108.2	62%	0.623	57%	0.569	S	S	*	*	H	α-helix	trans	-68.8	-38.3	174.3	-68.9	171.9	0	0	0	111.9	C97 S98 L99 R104 R105	C97-L101 WeakPolarHBondContact O-CG 3.41Å; C97-L101 PolarHBondContact O-N 2.9Å; S98-L101 PolarHBondContact O-N 3.17Å; L99-L101 VanDerWaalsContact C-N 3.35Å; L99-L101 PolarHBondContact O-N 3.22Å; L101-R104 PolarHBondContact O-N 3.27Å; L101-R105 PolarHBondContact O-N 3.42Å; L101-R105 VanDerWaalsContact O-N 3.15Å
102	A	48.6	Very low	49.1	Very low	53 Å²	53	112.5 Å²	112.5	44%	0.438	59%	0.589	S	S	.	*	H	α-helix	trans	-65.3	-42.6	174.6	0	0	0	0	0	112.3	S98 L99 R104 R105 W106	S98-A102 WeakPolarHBondContact O-CB 3.32Å; S98-A102 PolarHBondContact O-N 3.24Å; L99-A102 PolarHBondContact O-N 3.09Å; A102-R104 VanDerWaalsContact C-N 3.33Å; A102-R104 PolarHBondContact O-N 3.06Å; A102-R105 WeakPolarHBondContact O-CB 3.42Å; A102-R105 PolarHBondContact O-N 3.41Å; A102-W106 PolarHBondContact O-N 3.41Å
103	L	50.1	Low	49.1	Very low	113 Å²	113	115.9 Å²	115.9	59%	0.592	60%	0.604	S	S	*	*	H	α-helix	trans	-63.9	-36.6	173.8	-77.4	167.8	0	0	0	112.3	L99 R105 W106 R107	L99-L103 HydrophobicContact CG-CD1 4.23Å; L99-L103 WeakPolarHBondContact O-CB 3.34Å; L99-L103 WeakPolarHBondContact O-CG 3.47Å; L99-L103 PolarHBondContact O-N 3Å; L103-R105 PolarHBondContact O-N 2.73Å; L103-W106 WeakPolarHBondContact O-CB 3.34Å; L103-W106 PolarHBondContact O-N 3.3Å; L103-W106 VanDerWaalsContact O-N 3.09Å; L103-R107 PolarHBondContact O-N 3.13Å
104	R	51.2	Low	49.1	Very low	202 Å²	202	120.7 Å²	120.7	76%	0.762	62%	0.621	S	S	*	*	H	α-helix	trans	-67.5	-27.4	176.2	-153.7	175.2	179.2	-178.7	-0.3	112.3	G100 L101 A102 W106	G100-R104 WeakPolarHBondContact O-CB 3.3Å; G100-R104 PolarHBondContact O-N 3Å; L101-R104 PolarHBondContact O-N 3.27Å; A102-R104 VanDerWaalsContact C-N 3.33Å; A102-R104 PolarHBondContact O-N 3.06Å; R104-W106 VanDerWaalsContact C-N 3.31Å
105	R	49.2	Very low	49	Very low	227 Å²	227	123.3 Å²	123.3	86%	0.857	62%	0.624	S	S	*	*	H	α-helix	trans	-76.4	-19.5	172.6	-155.3	178.4	-172.4	-171.8	2.1	113	L101 A102 L103	L101-R105 PolarHBondContact O-N 3.42Å; L101-R105 VanDerWaalsContact O-N 3.15Å; A102-R105 WeakPolarHBondContact O-CB 3.42Å; A102-R105 PolarHBondContact O-N 3.41Å; L103-R105 PolarHBondContact O-N 2.73Å
106	W	40.4	Very low	49	Very low	181 Å²	181	122.8 Å²	122.8	69%	0.686	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-2.1	178.3	-108.2	70.1	0	0	0	114.1	N31 A102 L103 R104 P108	N31-W106 WeakPolarHBondContact ND2-CH2 3.44Å; A102-W106 PolarHBondContact O-N 3.41Å; L103-W106 WeakPolarHBondContact O-CB 3.34Å; L103-W106 PolarHBondContact O-N 3.3Å; L103-W106 VanDerWaalsContact O-N 3.09Å; R104-W106 VanDerWaalsContact C-N 3.31Å; W106-P108 WeakPolarHBondContact O-CD 3.26Å
107	R	43.3	Very low	49.1	Very low	211 Å²	211	129.7 Å²	129.7	80%	0.796	65%	0.651	S	S	*	*			trans	-82.7	116.9	172.7	-153.4	176.8	-178.6	-179.7	-0.4	108	L103	L103-R107 PolarHBondContact O-N 3.13Å
108	P	51.6	Low	48.9	Very low	196 Å²	196	133.6 Å²	133.6	100%	1.273	66%	0.657	S	S	*	*			trans	-64.4	0	174.8	27.9	-33.7	0	0	0	111.9	W106	W106-P108 WeakPolarHBondContact O-CD 3.26Å

Retrieved 108 of 108 residues in 30.3 ms (Link to these results)

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