A0A3Q0KGA1_SCHMA Loading...

Golgi apparatus membrane protein TVP23 homolog

AlphaFold DB , UniProt , Accession A0A3Q0KGA1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 233 aa.

Structure Viewer

Loading PAE data...

(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	45.3	Very low	62.1	Low	193 Å²	193	94.3 Å²	94.3	95%	0.951	49%	0.494	S	S	*	.				0	143.6	0	-154	156.9	166.3	0	0	105.3	D3 D95	M1-D3 PolarHBondContact O-N 3.05Å; M1-D95 WeakPolarHBondContact CB-OD2 3.11Å; M1-D95 PolarHBondContact N-OD2 3.32Å
2	M	54.6	Low	61.8	Low	74 Å²	74	95.2 Å²	95.2	37%	0.365	50%	0.498	S	S	.	.			trans	-69.4	122.4	175.4	-80.9	169.3	80.4	0	0	107.6	E7 L10 R102	M2-E7 HydrophobicContact CB-CG 4.18Å; M2-E7 HydrophobicContact CE-CG 4.25Å; M2-L10 HydrophobicContact CE-CD1 3.28Å; M2-R102 VanDerWaalsContact CE-NH1 3.27Å; M2-R102 VanDerWaalsContact CE-NH2 3.29Å; M2-R102 PolarHBondContact SD-NH2 3.48Å
3	D	63.6	Low	61.8	Low	88 Å²	88	90.2 Å²	90.2	47%	0.471	48%	0.475	S	S	.	.			trans	-68.4	141	177.5	-163.3	6	0	0	0	108.5	M1 R5 D6 E7	M1-D3 PolarHBondContact O-N 3.05Å; D3-R5 PolarHBondContact O-N 3.43Å; D3-D6 PolarHBondContact O-N 3.27Å; D3-E7 PolarHBondContact O-N 3.43Å
4	S	71	Confident	61.6	Low	78 Å²	78	89.1 Å²	89.1	55%	0.545	47%	0.469	S	S	.	.	H	α-helix	trans	-57	-23.1	-173.4	-70.7	0	0	0	0	113	V8	S4-V8 WeakPolarHBondContact O-CB 3.23Å; S4-V8 WeakPolarHBondContact O-CG2 3.05Å; S4-V8 PolarHBondContact O-N 2.95Å
5	R	67.7	Low	61	Low	193 Å²	193	89.6 Å²	89.6	73%	0.728	47%	0.472	S	S	*	.	H	α-helix	trans	-70.9	-38.7	176.8	-53.9	-175	85.3	159.3	5.3	112.2	D3 V8 V9	D3-R5 PolarHBondContact O-N 3.43Å; R5-V8 PolarHBondContact O-N 3.15Å; R5-V9 WeakPolarHBondContact O-CG2 3.34Å; R5-V9 PolarHBondContact O-N 2.95Å
6	D	61.8	Low	60.6	Low	66 Å²	66	93.8 Å²	93.8	35%	0.353	49%	0.491	S	S	.	.	H	α-helix	trans	-72.7	-37.4	177.9	-71	-17.9	0	0	0	110.7	D3 V9 L10	D3-D6 PolarHBondContact O-N 3.27Å; D6-V9 PolarHBondContact O-N 3.17Å; D6-L10 VanDerWaalsContact O-CB 3.24Å; D6-L10 WeakPolarHBondContact O-CB 3.41Å; D6-L10 WeakPolarHBondContact O-CD1 3.5Å; D6-L10 WeakPolarHBondContact O-CG 3.47Å; D6-L10 PolarHBondContact O-N 3.4Å
7	E	63.2	Low	60	Low	107 Å²	107	92.1 Å²	92.1	50%	0.5	48%	0.482	S	S	.	.	H	α-helix	trans	-61.4	-43.7	168.7	-86.3	-167.6	156.4	0	0	111.7	M2 D3 L10 A11	M2-E7 HydrophobicContact CB-CG 4.18Å; M2-E7 HydrophobicContact CE-CG 4.25Å; D3-E7 PolarHBondContact O-N 3.43Å; E7-L10 PolarHBondContact O-N 3.45Å; E7-A11 WeakPolarHBondContact O-CA 3.39Å; E7-A11 WeakPolarHBondContact O-CB 3.32Å; E7-A11 PolarHBondContact O-N 3.21Å
8	V	67.3	Low	59.4	Low	83 Å²	83	92.1 Å²	92.1	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-66.5	-40.7	177.4	170	0	0	0	0	111.2	S4 R5 A11 L12	S4-V8 WeakPolarHBondContact O-CB 3.23Å; S4-V8 WeakPolarHBondContact O-CG2 3.05Å; S4-V8 PolarHBondContact O-N 2.95Å; R5-V8 PolarHBondContact O-N 3.15Å; V8-A11 PolarHBondContact O-N 3.41Å; V8-L12 HydrophobicContact CG1-CD1 3.7Å; V8-L12 HydrophobicContact CG1-CG 4.07Å; V8-L12 WeakPolarHBondContact O-CB 3.39Å; V8-L12 WeakPolarHBondContact O-CG 3.34Å; V8-L12 PolarHBondContact O-N 2.9Å
9	V	64.9	Low	58.2	Low	83 Å²	83	90.3 Å²	90.3	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-66.2	-42.8	176.1	172.7	0	0	0	0	110.5	R5 D6 L12 T13	R5-V9 WeakPolarHBondContact O-CG2 3.34Å; R5-V9 PolarHBondContact O-N 2.95Å; D6-V9 PolarHBondContact O-N 3.17Å; V9-L12 PolarHBondContact O-N 3.1Å; V9-T13 WeakPolarHBondContact O-CB 3.38Å; V9-T13 PolarHBondContact O-N 2.91Å; V9-T13 PolarHBondContact O-OG1 2.86Å
10	L	64	Low	57.1	Low	27 Å²	27	91.3 Å²	91.3	14%	0.141	51%	0.507	C	S	.	.	H	α-helix	trans	-63.3	-45.5	174.9	-76.1	163.4	0	0	0	111.5	M2 D6 E7 T13 D14	M2-L10 HydrophobicContact CE-CD1 3.28Å; D6-L10 VanDerWaalsContact O-CB 3.24Å; D6-L10 WeakPolarHBondContact O-CB 3.41Å; D6-L10 WeakPolarHBondContact O-CD1 3.5Å; D6-L10 WeakPolarHBondContact O-CG 3.47Å; D6-L10 PolarHBondContact O-N 3.4Å; E7-L10 PolarHBondContact O-N 3.45Å; L10-T13 CarbonylContact O-C 3.5Å; L10-T13 PolarHBondContact O-N 3.03Å; L10-T13 VanDerWaalsContact O-N 3.15Å; L10-D14 VanDerWaalsContact O-CB 3.28Å; L10-D14 WeakPolarHBondContact O-CB 3.22Å; L10-D14 PolarHBondContact O-N 2.73Å
11	A	59.5	Low	56	Low	45 Å²	45	91.7 Å²	91.7	37%	0.372	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-40.3	176.8	0	0	0	0	0	111.4	E7 V8 T13 D14 D15	E7-A11 WeakPolarHBondContact O-CA 3.39Å; E7-A11 WeakPolarHBondContact O-CB 3.32Å; E7-A11 PolarHBondContact O-N 3.21Å; V8-A11 PolarHBondContact O-N 3.41Å; A11-T13 VanDerWaalsContact C-N 3.32Å; A11-T13 PolarHBondContact O-N 3.22Å; A11-D14 CarbonylContact O-C 3.53Å; A11-D14 PolarHBondContact O-N 3.05Å; A11-D15 WeakPolarHBondContact O-CA 3.28Å; A11-D15 WeakPolarHBondContact O-CB 3.37Å; A11-D15 PolarHBondContact O-N 2.89Å
12	L	58.5	Low	55.6	Low	105 Å²	105	91.5 Å²	91.5	55%	0.55	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-36.8	173.3	-74	170.4	0	0	0	111.3	V8 V9 M16	V8-L12 HydrophobicContact CG1-CD1 3.7Å; V8-L12 HydrophobicContact CG1-CG 4.07Å; V8-L12 WeakPolarHBondContact O-CB 3.39Å; V8-L12 WeakPolarHBondContact O-CG 3.34Å; V8-L12 PolarHBondContact O-N 2.9Å; V9-L12 PolarHBondContact O-N 3.1Å; L12-M16 WeakPolarHBondContact O-CG 3.49Å; L12-M16 PolarHBondContact O-N 3.48Å
13	T	62.3	Low	55.2	Low	31 Å²	31	89.8 Å²	89.8	19%	0.19	52%	0.52	C	S	.	.	H	α-helix	trans	-75.8	-28.8	177.1	-30.3	0	0	0	0	111.9	V9 L10 A11	V9-T13 WeakPolarHBondContact O-CB 3.38Å; V9-T13 PolarHBondContact O-N 2.91Å; V9-T13 PolarHBondContact O-OG1 2.86Å; L10-T13 CarbonylContact O-C 3.5Å; L10-T13 PolarHBondContact O-N 3.03Å; L10-T13 VanDerWaalsContact O-N 3.15Å; A11-T13 VanDerWaalsContact C-N 3.32Å; A11-T13 PolarHBondContact O-N 3.22Å
14	D	59.3	Low	54.8	Low	75 Å²	75	89.9 Å²	89.9	40%	0.401	53%	0.526	S	S	.	.	H	α-helix	trans	-81.9	-31.4	175.1	-80.8	2.1	0	0	0	111.7	L10 A11 M16 D17 T18 R82	L10-D14 VanDerWaalsContact O-CB 3.28Å; L10-D14 WeakPolarHBondContact O-CB 3.22Å; L10-D14 PolarHBondContact O-N 2.73Å; A11-D14 CarbonylContact O-C 3.53Å; A11-D14 PolarHBondContact O-N 3.05Å; D14-M16 VanDerWaalsContact C-N 3.31Å; D14-D17 CarbonylContact O-C 3.29Å; D14-D17 VanDerWaalsContact O-C 3.29Å; D14-D17 WeakPolarHBondContact O-CA 3.31Å; D14-D17 VanDerWaalsContact O-CB 3.26Å; D14-D17 WeakPolarHBondContact O-CB 3.33Å; D14-D17 PolarHBondContact O-N 3.08Å; D14-T18 WeakPolarHBondContact O-CG2 3.19Å; D14-T18 PolarHBondContact O-N 3.03Å; D14-T18 PolarHBondContact O-OG1 3.16Å; D14-R82 IonicContact OD1-CZ 3.07Å; D14-R82 IonicContact OD1-NH1 3.79Å; D14-R82 IonicContact OD1-NH2 2.63Å; D14-R82 PolarHBondContact OD1-NH2 3.07Å
15	D	51.7	Low	54.3	Low	96 Å²	96	88.6 Å²	88.6	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-70.1	-30	174.4	-82.1	-21.7	0	0	0	111.3	A11 D17 T18 G19	A11-D15 WeakPolarHBondContact O-CA 3.28Å; A11-D15 WeakPolarHBondContact O-CB 3.37Å; A11-D15 PolarHBondContact O-N 2.89Å; D15-D17 PolarHBondContact O-N 2.89Å; D15-T18 WeakPolarHBondContact CA-OG1 3.35Å; D15-T18 PolarHBondContact OD1-OG1 3.37Å; D15-G19 VanDerWaalsContact O-CA 3.31Å; D15-G19 WeakPolarHBondContact O-CA 3.17Å; D15-G19 PolarHBondContact O-N 3.13Å
16	M	54.2	Low	54.3	Low	156 Å²	156	82.1 Å²	82.1	77%	0.768	50%	0.495	S	S	*	.	H	α-helix	trans	-66	-21.5	164.5	-69.8	-152	-54.6	0	0	112.8	L12 D14	L12-M16 WeakPolarHBondContact O-CG 3.49Å; L12-M16 PolarHBondContact O-N 3.48Å; D14-M16 VanDerWaalsContact C-N 3.31Å
17	D	51.3	Low	54.8	Low	65 Å²	65	82.2 Å²	82.2	35%	0.348	50%	0.5	S	S	.	.	H	α-helix	trans	-95.2	-24.2	176.5	-80.4	-13.7	0	0	0	113.3	D14 D15 R82	D14-D17 CarbonylContact O-C 3.29Å; D14-D17 VanDerWaalsContact O-C 3.29Å; D14-D17 WeakPolarHBondContact O-CA 3.31Å; D14-D17 VanDerWaalsContact O-CB 3.26Å; D14-D17 WeakPolarHBondContact O-CB 3.33Å; D14-D17 PolarHBondContact O-N 3.08Å; D15-D17 PolarHBondContact O-N 2.89Å; D17-R82 IonicContact OD2-CZ 3.18Å; D17-R82 IonicContact OD2-NE 3.91Å; D17-R82 PolarHBondContact OD2-NE 3.3Å; D17-R82 IonicContact OD2-NH2 3.49Å; D17-R82 PolarHBondContact OD2-NH2 2.84Å
18	T	49.2	Very low	55.6	Low	92 Å²	92	80.3 Å²	80.3	56%	0.564	50%	0.498	S	S	*	.	H	α-helix	trans	-105.9	-21.6	-178	60.2	0	0	0	0	113.6	D14 D15 S20	D14-T18 WeakPolarHBondContact O-CG2 3.19Å; D14-T18 PolarHBondContact O-N 3.03Å; D14-T18 PolarHBondContact O-OG1 3.16Å; D15-T18 WeakPolarHBondContact CA-OG1 3.35Å; D15-T18 PolarHBondContact OD1-OG1 3.37Å; T18-S20 PolarHBondContact O-N 3.47Å
19	G	35.9	Very low	56.3	Low	58 Å²	58	78.8 Å²	78.8	60%	0.598	49%	0.489	S	S	*	.	S	Bend	trans	-73.7	12.3	-174.5	0	0	0	0	0	116.5	D15	D15-G19 VanDerWaalsContact O-CA 3.31Å; D15-G19 WeakPolarHBondContact O-CA 3.17Å; D15-G19 PolarHBondContact O-N 3.13Å
20	S	35.9	Very low	57.1	Low	110 Å²	110	77 Å²	77	77%	0.769	47%	0.473	S	S	*	.	S	Bend	trans	-158	81.3	173.2	-73.2	0	0	0	0	111.3	T18	T18-S20 PolarHBondContact O-N 3.47Å
21	S	34.2	Very low	58.3	Low	100 Å²	100	83.5 Å²	83.5	70%	0.699	50%	0.496	S	S	*	.			trans	69.5	128.1	173.4	-66.5	0	0	0	0	115.9	G23	S21-G23 PolarHBondContact O-N 3.36Å
22	D	37.1	Very low	59.6	Low	189 Å²	189	84.6 Å²	84.6	100%	1.011	50%	0.501	S	S	*	.	S	Bend	trans	-61.6	47.3	160.9	-135.1	-9.6	0	0	0	111.8
23	G	46.4	Very low	61.1	Low	38 Å²	38	79.7 Å²	79.7	39%	0.392	48%	0.476	S	S	.	.	S	Bend	trans	-132.6	157.2	-169.4	0	0	0	0	0	111.6	S21 H25	S21-G23 PolarHBondContact O-N 3.36Å; G23-H25 PolarHBondContact O-N 3.18Å
24	P	55.8	Low	62.5	Low	91 Å²	91	79.5 Å²	79.5	59%	0.591	47%	0.474	S	S	*	.			trans	-58	127.5	177.1	24.4	-32.3	0	0	0	109.6	S26	P24-S26 PolarHBondContact O-N 3.39Å
25	H	59.2	Low	64.1	Low	50 Å²	50	81.1 Å²	81.1	23%	0.231	48%	0.482	C	S	.	.			trans	-38.5	132.2	175.4	-67.6	-74.9	0	0	0	110.5	G23 R30	G23-H25 PolarHBondContact O-N 3.18Å; H25-R30 HydrophobicContact CB-CG 4.16Å; H25-R30 PolarHBondContact O-NH1 3.37Å
26	S	68.1	Low	65.9	Low	57 Å²	57	77.2 Å²	77.2	40%	0.399	47%	0.465	S	S	.	.			trans	-47.6	140.1	180	173.4	0	0	0	0	110.2	P24 S28 T29 R30	P24-S26 PolarHBondContact O-N 3.39Å; S26-S28 PolarHBondContact O-N 3.15Å; S26-S28 PolarHBondContact OG-N 3.49Å; S26-S28 PolarHBondContact OG-OG 2.92Å; S26-T29 PolarHBondContact O-N 3.42Å; S26-R30 PolarHBondContact O-N 3.21Å
27	P	72.6	Confident	67.7	Low	69 Å²	69	69.9 Å²	69.9	45%	0.448	43%	0.428	S	S	.	.	H	α-helix	trans	-56.2	-19.5	175.3	24.6	-35.5	0	0	0	113.1	R31	P27-R31 VanDerWaalsContact O-CG 3.29Å; P27-R31 WeakPolarHBondContact O-CG 3.18Å; P27-R31 PolarHBondContact O-N 3.23Å; P27-R31 PolarHBondContact O-NE 3.1Å
28	S	79.8	Confident	69.7	Low	67 Å²	67	69.8 Å²	69.8	47%	0.469	43%	0.425	S	S	.	.	H	α-helix	trans	-69.3	-48	171.6	56.5	0	0	0	0	112.2	S26 R30 R31 S32	S26-S28 PolarHBondContact O-N 3.15Å; S26-S28 PolarHBondContact OG-N 3.49Å; S26-S28 PolarHBondContact OG-OG 2.92Å; S28-R30 VanDerWaalsContact C-N 3.33Å; S28-R30 PolarHBondContact O-N 3.15Å; S28-R31 WeakPolarHBondContact O-CB 3.31Å; S28-R31 PolarHBondContact O-N 3.44Å; S28-R31 VanDerWaalsContact O-N 3.1Å; S28-S32 PolarHBondContact O-N 3.33Å; S28-S32 PolarHBondContact O-OG 3.41Å
29	T	82.4	Confident	71.8	Confident	51 Å²	51	69.4 Å²	69.4	31%	0.313	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-38.8	-179.7	-50.1	0	0	0	0	112.1	S26 R31 S32 A33 I83	S26-T29 PolarHBondContact O-N 3.42Å; T29-R31 VanDerWaalsContact C-N 3.33Å; T29-R31 PolarHBondContact O-N 3.23Å; T29-S32 WeakPolarHBondContact CA-OG 3.47Å; T29-S32 PolarHBondContact O-N 3.02Å; T29-S32 PolarHBondContact O-OG 2.97Å; T29-A33 WeakPolarHBondContact O-CB 3.41Å; T29-A33 PolarHBondContact O-N 2.82Å; T29-I83 HydrophobicContact CG2-CD1 4.06Å
30	R	82.3	Confident	74.5	Confident	44 Å²	44	69.2 Å²	69.2	17%	0.166	40%	0.402	C	S	.	.	H	α-helix	trans	-66.3	-37.4	175.3	-64.9	-171.4	-60.7	-130.4	-0	112.1	H25 S26 S28 A33 V34 I83 L133	H25-R30 HydrophobicContact CB-CG 4.16Å; H25-R30 PolarHBondContact O-NH1 3.37Å; S26-R30 PolarHBondContact O-N 3.21Å; S28-R30 VanDerWaalsContact C-N 3.33Å; S28-R30 PolarHBondContact O-N 3.15Å; R30-A33 PolarHBondContact O-N 3.27Å; R30-V34 WeakPolarHBondContact O-CG2 3.4Å; R30-V34 PolarHBondContact O-N 2.82Å; R30-V34 VanDerWaalsContact O-N 3.14Å; R30-I83 HydrophobicContact CG-CG2 4.17Å; R30-L133 HydrophobicContact CB-CD1 3.94Å; R30-L133 HydrophobicContact CG-CD1 4.25Å
31	R	88	Confident	77.2	Confident	164 Å²	164	64.8 Å²	64.8	62%	0.619	37%	0.368	S	S	*	.	H	α-helix	trans	-66.4	-46.2	176.8	-79.2	-177.6	-86.8	-163.7	-0.3	111.3	P27 S28 T29 A33 V34 I35	P27-R31 VanDerWaalsContact O-CG 3.29Å; P27-R31 WeakPolarHBondContact O-CG 3.18Å; P27-R31 PolarHBondContact O-N 3.23Å; P27-R31 PolarHBondContact O-NE 3.1Å; S28-R31 WeakPolarHBondContact O-CB 3.31Å; S28-R31 PolarHBondContact O-N 3.44Å; S28-R31 VanDerWaalsContact O-N 3.1Å; T29-R31 VanDerWaalsContact C-N 3.33Å; T29-R31 PolarHBondContact O-N 3.23Å; R31-A33 VanDerWaalsContact C-N 3.31Å; R31-A33 PolarHBondContact O-N 3.17Å; R31-V34 PolarHBondContact O-N 3.37Å; R31-I35 VanDerWaalsContact O-CG1 3.29Å; R31-I35 WeakPolarHBondContact O-CG1 3.36Å; R31-I35 PolarHBondContact O-N 2.86Å
32	S	87.9	Confident	80	Confident	69 Å²	69	62.5 Å²	62.5	48%	0.483	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-38	176.6	60	0	0	0	0	112.1	S28 T29 I35 G36	S28-S32 PolarHBondContact O-N 3.33Å; S28-S32 PolarHBondContact O-OG 3.41Å; T29-S32 WeakPolarHBondContact CA-OG 3.47Å; T29-S32 PolarHBondContact O-N 3.02Å; T29-S32 PolarHBondContact O-OG 2.97Å; S32-I35 PolarHBondContact O-N 3.31Å; S32-G36 PolarHBondContact O-N 2.88Å
33	A	89.8	Confident	82.7	Confident	2 Å²	2	55.7 Å²	55.7	2%	0.017	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-44.6	175.5	0	0	0	0	0	112.5	T29 R30 R31 G36 H37 I83 L84	T29-A33 WeakPolarHBondContact O-CB 3.41Å; T29-A33 PolarHBondContact O-N 2.82Å; R30-A33 PolarHBondContact O-N 3.27Å; R31-A33 VanDerWaalsContact C-N 3.31Å; R31-A33 PolarHBondContact O-N 3.17Å; A33-G36 PolarHBondContact O-N 3.48Å; A33-H37 WeakPolarHBondContact O-CB 3.32Å; A33-H37 PolarHBondContact O-N 2.99Å; A33-I83 HydrophobicContact CB-CB 3.95Å; A33-I83 HydrophobicContact CB-CD1 3.95Å; A33-I83 HydrophobicContact CB-CG2 3.68Å; A33-L84 HydrophobicContact CB-CD2 3.98Å; A33-L84 HydrophobicContact CB-CG 4.29Å
34	V	91.2	Very high	85	Confident	27 Å²	27	53.9 Å²	53.9	16%	0.164	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-45.7	174.7	175.9	0	0	0	0	111.2	R30 R31 G36 H37 F38 L84 L133	R30-V34 WeakPolarHBondContact O-CG2 3.4Å; R30-V34 PolarHBondContact O-N 2.82Å; R30-V34 VanDerWaalsContact O-N 3.14Å; R31-V34 PolarHBondContact O-N 3.37Å; V34-G36 VanDerWaalsContact C-N 3.32Å; V34-G36 PolarHBondContact O-N 3.32Å; V34-H37 WeakPolarHBondContact O-CB 3.21Å; V34-H37 PolarHBondContact O-N 3.47Å; V34-H37 VanDerWaalsContact O-N 3.16Å; V34-F38 HydrophobicContact CG1-CD2 3.98Å; V34-F38 HydrophobicContact CG1-CE2 4.09Å; V34-F38 WeakPolarHBondContact O-CD2 3.27Å; V34-F38 PolarHBondContact O-N 2.87Å; V34-L84 HydrophobicContact CG2-CD1 4.15Å; V34-L84 HydrophobicContact CG2-CD2 3.64Å; V34-L133 HydrophobicContact CG2-CD2 3.25Å
35	I	92.4	Very high	86.8	Confident	108 Å²	108	50.8 Å²	50.8	55%	0.554	28%	0.279	S	S	*	.	H	α-helix	trans	-58	-48.8	178.6	-68	164.9	0	0	0	109.6	R31 S32 H37 F38 L39	R31-I35 VanDerWaalsContact O-CG1 3.29Å; R31-I35 WeakPolarHBondContact O-CG1 3.36Å; R31-I35 PolarHBondContact O-N 2.86Å; S32-I35 PolarHBondContact O-N 3.31Å; I35-H37 VanDerWaalsContact C-N 3.32Å; I35-H37 PolarHBondContact O-N 2.98Å; I35-F38 PolarHBondContact O-N 3.3Å; I35-L39 HydrophobicContact CG2-CD1 4.38Å; I35-L39 WeakPolarHBondContact O-CB 3.38Å; I35-L39 PolarHBondContact O-N 2.86Å
36	G	89.8	Confident	88.4	Confident	15 Å²	15	52 Å²	52	16%	0.155	29%	0.29	C	S	.	.	H	α-helix	trans	-58.1	-41.4	175.9	0	0	0	0	0	113.2	S32 A33 V34 F38 L39	S32-G36 PolarHBondContact O-N 2.88Å; A33-G36 PolarHBondContact O-N 3.48Å; V34-G36 VanDerWaalsContact C-N 3.32Å; V34-G36 PolarHBondContact O-N 3.32Å; G36-F38 VanDerWaalsContact C-N 3.27Å; G36-F38 PolarHBondContact O-N 2.99Å; G36-L39 PolarHBondContact O-N 3.2Å
37	H	91.9	Very high	89.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-30.7	179.1	-166.7	69.2	0	0	0	114	A33 V34 I35 S80 L84 F137	A33-H37 WeakPolarHBondContact O-CB 3.32Å; A33-H37 PolarHBondContact O-N 2.99Å; V34-H37 WeakPolarHBondContact O-CB 3.21Å; V34-H37 PolarHBondContact O-N 3.47Å; V34-H37 VanDerWaalsContact O-N 3.16Å; I35-H37 VanDerWaalsContact C-N 3.32Å; I35-H37 PolarHBondContact O-N 2.98Å; H37-S80 WeakPolarHBondContact CB-OG 3.29Å; H37-S80 WeakPolarHBondContact ND1-CB 3.44Å; H37-S80 PolarHBondContact ND1-OG 3.19Å; H37-S80 VanDerWaalsContact ND1-OG 3.07Å; H37-L84 HydrophobicContact CB-CD1 4.38Å; H37-F137 AromaticContact CE1-CD2 3.55Å; H37-F137 AromaticContact CE1-CE2 3.84Å; H37-F137 AromaticContact NE2-CD2 3.97Å; H37-F137 PolarHBondContact NE2-O 3.43Å
38	F	93.8	Very high	90.5	Very high	63 Å²	63	49.4 Å²	49.4	28%	0.276	27%	0.266	S	S	.	.	H	α-helix	trans	-102.6	-27.1	179.8	-73.3	-89.5	0	0	0	113	V34 I35 G36 S42 L136	V34-F38 HydrophobicContact CG1-CD2 3.98Å; V34-F38 HydrophobicContact CG1-CE2 4.09Å; V34-F38 WeakPolarHBondContact O-CD2 3.27Å; V34-F38 PolarHBondContact O-N 2.87Å; I35-F38 PolarHBondContact O-N 3.3Å; G36-F38 VanDerWaalsContact C-N 3.27Å; G36-F38 PolarHBondContact O-N 2.99Å; F38-S42 WeakPolarHBondContact O-CB 3.49Å; F38-S42 PolarHBondContact O-N 3.29Å; F38-S42 PolarHBondContact O-OG 3.45Å; F38-L136 HydrophobicContact CE2-CB 4.36Å; F38-L136 HydrophobicContact CZ-CB 4.5Å
39	L	94.1	Very high	91	Very high	84 Å²	84	50 Å²	50	44%	0.44	26%	0.263	S	S	.	.	H	α-helix	trans	-64.5	-55.4	-172.9	-178.4	131.6	0	0	0	112.4	I35 G36 R41 S42 S43	I35-L39 HydrophobicContact CG2-CD1 4.38Å; I35-L39 WeakPolarHBondContact O-CB 3.38Å; I35-L39 PolarHBondContact O-N 2.86Å; G36-L39 PolarHBondContact O-N 3.2Å; L39-R41 PolarHBondContact O-N 3.3Å; L39-S42 PolarHBondContact O-N 3Å; L39-S43 WeakPolarHBondContact O-CB 3.38Å; L39-S43 PolarHBondContact O-N 3.37Å; L39-S43 PolarHBondContact O-OG 3.4Å
40	F	90.8	Very high	91.4	Very high	54 Å²	54	51.4 Å²	51.4	24%	0.237	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-43.5	-174.6	-68.7	-67.5	0	0	0	112.6	S43 A44 L71 D72 V75	F40-S43 PolarHBondContact O-N 3.09Å; F40-A44 PolarHBondContact O-N 3.03Å; F40-L71 HydrophobicContact CD1-CB 3.79Å; F40-L71 HydrophobicContact CD1-CD1 3.96Å; F40-L71 HydrophobicContact CD2-CB 4.5Å; F40-L71 HydrophobicContact CE1-CB 4.07Å; F40-L71 HydrophobicContact CE1-CD1 3.65Å; F40-L71 HydrophobicContact CE1-CG 4.46Å; F40-L71 HydrophobicContact CG-CB 4.03Å; F40-L71 HydrophobicContact CZ-CD1 4.41Å; F40-D72 HydrophobicContact CB-CB 3.83Å; F40-V75 HydrophobicContact CD2-CB 4.46Å; F40-V75 HydrophobicContact CD2-CG2 3.84Å; F40-V75 HydrophobicContact CE2-CG2 3.78Å
41	R	93.2	Very high	91.6	Very high	17 Å²	17	49.7 Å²	49.7	6%	0.064	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-46	172.8	179.5	169.5	58.6	125.1	4	113.3	L39 S43 A44 L45 D72 G140 S144	L39-R41 PolarHBondContact O-N 3.3Å; R41-S43 VanDerWaalsContact C-N 3.33Å; R41-S43 PolarHBondContact O-N 3.4Å; R41-A44 PolarHBondContact O-N 2.81Å; R41-L45 HydrophobicContact CG-CD1 4.49Å; R41-L45 WeakPolarHBondContact O-CG 3.44Å; R41-L45 PolarHBondContact O-N 3.27Å; R41-L45 VanDerWaalsContact O-N 3.13Å; R41-D72 WeakPolarHBondContact CB-OD1 3.43Å; R41-D72 PolarHBondContact N-OD1 3.42Å; R41-G140 PolarHBondContact NH1-O 3.43Å; R41-S144 WeakPolarHBondContact CD-OG 3.47Å
42	S	93.4	Very high	91.1	Very high	53 Å²	53	45.4 Å²	45.4	37%	0.371	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-40	180	-56.6	0	0	0	0	110.8	F38 L39 A44 L45 V46	F38-S42 WeakPolarHBondContact O-CB 3.49Å; F38-S42 PolarHBondContact O-N 3.29Å; F38-S42 PolarHBondContact O-OG 3.45Å; L39-S42 PolarHBondContact O-N 3Å; S42-A44 VanDerWaalsContact C-N 3.35Å; S42-A44 PolarHBondContact O-N 3.41Å; S42-L45 PolarHBondContact O-N 2.87Å; S42-V46 WeakPolarHBondContact O-CB 3.43Å; S42-V46 VanDerWaalsContact O-CG2 3.28Å; S42-V46 WeakPolarHBondContact O-CG2 3.45Å; S42-V46 PolarHBondContact O-N 3.08Å
43	S	93.8	Very high	90.7	Very high	45 Å²	45	52.1 Å²	52.1	32%	0.315	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-44.1	173.6	-64.2	0	0	0	0	112	L39 F40 R41 L45 V46 I47	L39-S43 WeakPolarHBondContact O-CB 3.38Å; L39-S43 PolarHBondContact O-N 3.37Å; L39-S43 PolarHBondContact O-OG 3.4Å; F40-S43 PolarHBondContact O-N 3.09Å; R41-S43 VanDerWaalsContact C-N 3.33Å; R41-S43 PolarHBondContact O-N 3.4Å; S43-L45 VanDerWaalsContact C-N 3.33Å; S43-L45 PolarHBondContact O-N 3.34Å; S43-V46 PolarHBondContact O-N 3.31Å; S43-I47 WeakPolarHBondContact O-CB 3.18Å; S43-I47 WeakPolarHBondContact O-CD1 3.41Å; S43-I47 WeakPolarHBondContact O-CG1 3.46Å; S43-I47 PolarHBondContact O-N 3.16Å
44	A	94	Very high	90.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-42.8	176.2	0	0	0	0	0	112.3	F40 R41 S42 Y48 C68 L69 W148	F40-A44 PolarHBondContact O-N 3.03Å; R41-A44 PolarHBondContact O-N 2.81Å; S42-A44 VanDerWaalsContact C-N 3.35Å; S42-A44 PolarHBondContact O-N 3.41Å; A44-Y48 WeakPolarHBondContact O-CB 3.34Å; A44-Y48 PolarHBondContact O-N 3.32Å; A44-C68 HydrophobicContact CB-CB 3.77Å; A44-L69 HydrophobicContact CB-CD2 4.35Å; A44-L69 HydrophobicContact CB-CG 4.37Å; A44-W148 HydrophobicContact CB-CZ2 4.14Å
45	L	94.1	Very high	89.7	Confident	26 Å²	26	61.2 Å²	61.2	14%	0.136	32%	0.319	C	S	.	.	H	α-helix	trans	-66.6	-44	177	-66.2	174.7	0	0	0	112.1	R41 S42 S43 Y48 I49 I147 W148 F151	R41-L45 HydrophobicContact CG-CD1 4.49Å; R41-L45 WeakPolarHBondContact O-CG 3.44Å; R41-L45 PolarHBondContact O-N 3.27Å; R41-L45 VanDerWaalsContact O-N 3.13Å; S42-L45 PolarHBondContact O-N 2.87Å; S43-L45 VanDerWaalsContact C-N 3.33Å; S43-L45 PolarHBondContact O-N 3.34Å; L45-Y48 WeakPolarHBondContact O-CB 3.13Å; L45-Y48 PolarHBondContact O-N 3.21Å; L45-I49 WeakPolarHBondContact O-CG1 3.44Å; L45-I49 PolarHBondContact O-N 3.47Å; L45-I147 HydrophobicContact CD1-CD1 4.36Å; L45-I147 HydrophobicContact CD1-CG2 4.06Å; L45-I147 HydrophobicContact CD2-CG2 3.72Å; L45-W148 HydrophobicContact CD2-CD2 4.31Å; L45-W148 HydrophobicContact CD2-CH2 4.27Å; L45-W148 HydrophobicContact CD2-CZ2 3.77Å; L45-W148 HydrophobicContact CG-CZ2 4.49Å; L45-F151 HydrophobicContact CD2-CD2 4.27Å; L45-F151 HydrophobicContact CD2-CE2 3.9Å
46	V	93.6	Very high	89	Confident	77 Å²	77	62.9 Å²	62.9	47%	0.467	33%	0.334	S	S	.	.	H	α-helix	trans	-62.2	-45.2	177.7	169.3	0	0	0	0	110.3	S42 S43 Y48 I49 L50	S42-V46 WeakPolarHBondContact O-CB 3.43Å; S42-V46 VanDerWaalsContact O-CG2 3.28Å; S42-V46 WeakPolarHBondContact O-CG2 3.45Å; S42-V46 PolarHBondContact O-N 3.08Å; S43-V46 PolarHBondContact O-N 3.31Å; V46-Y48 VanDerWaalsContact C-N 3.34Å; V46-Y48 PolarHBondContact O-N 3.44Å; V46-I49 PolarHBondContact O-N 3.44Å; V46-L50 HydrophobicContact CG1-CD1 3.51Å; V46-L50 HydrophobicContact CG1-CG 4Å; V46-L50 VanDerWaalsContact O-CB 3.29Å; V46-L50 WeakPolarHBondContact O-CB 3.48Å; V46-L50 WeakPolarHBondContact O-CG 3.16Å; V46-L50 PolarHBondContact O-N 2.63Å
47	I	92.6	Very high	88.9	Confident	46 Å²	46	65.1 Å²	65.1	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-63.5	-41.4	177.3	-64.5	161.7	0	0	0	110.8	S43 I49 C51 F64 I65	S43-I47 WeakPolarHBondContact O-CB 3.18Å; S43-I47 WeakPolarHBondContact O-CD1 3.41Å; S43-I47 WeakPolarHBondContact O-CG1 3.46Å; S43-I47 PolarHBondContact O-N 3.16Å; I47-I49 PolarHBondContact O-N 2.95Å; I47-C51 WeakPolarHBondContact O-CB 3.31Å; I47-C51 PolarHBondContact O-N 3.23Å; I47-F64 HydrophobicContact CD1-CB 4.24Å; I47-F64 HydrophobicContact CG2-CB 4.28Å; I47-I65 HydrophobicContact CB-CG1 4.09Å; I47-I65 HydrophobicContact CG2-CD1 4.21Å; I47-I65 HydrophobicContact CG2-CG1 3.67Å
48	Y	92.2	Very high	88.7	Confident	24 Å²	24	67.3 Å²	67.3	9%	0.094	36%	0.358	C	S	.	.	H	α-helix	trans	-58.4	-47.3	175.7	-177.5	-84.8	0	0	0	111.9	A44 L45 V46 A52 I65 W148 F151 W163 V166	A44-Y48 WeakPolarHBondContact O-CB 3.34Å; A44-Y48 PolarHBondContact O-N 3.32Å; L45-Y48 WeakPolarHBondContact O-CB 3.13Å; L45-Y48 PolarHBondContact O-N 3.21Å; V46-Y48 VanDerWaalsContact C-N 3.34Å; V46-Y48 PolarHBondContact O-N 3.44Å; Y48-A52 PolarHBondContact O-N 3.13Å; Y48-I65 HydrophobicContact CD2-CD1 4.19Å; Y48-W148 HydrophobicContact CD2-CH2 4.13Å; Y48-W148 AromaticContact CD2-CZ3 3.81Å; Y48-W148 HydrophobicContact CD2-CZ3 3.81Å; Y48-W148 HydrophobicContact CE2-CZ3 4.12Å; Y48-W148 HydrophobicContact CG-CH2 4.37Å; Y48-W148 HydrophobicContact CG-CZ3 4.27Å; Y48-F151 HydrophobicContact CD1-CD1 4.25Å; Y48-F151 HydrophobicContact CD1-CE1 4.35Å; Y48-F151 HydrophobicContact CD1-CG 4.45Å; Y48-F151 HydrophobicContact CE1-CB 4.25Å; Y48-F151 AromaticContact CE1-CD1 3.6Å; Y48-F151 HydrophobicContact CE1-CD1 3.6Å; Y48-F151 HydrophobicContact CE1-CE1 4.05Å; Y48-F151 AromaticContact CE1-CG 3.91Å; Y48-F151 HydrophobicContact CE1-CG 3.91Å; Y48-W163 AromaticContact CD2-CE3 3.74Å; Y48-W163 HydrophobicContact CD2-CE3 3.74Å; Y48-W163 AromaticContact CD2-CZ3 3.57Å; Y48-W163 HydrophobicContact CD2-CZ3 3.57Å; Y48-W163 HydrophobicContact CE2-CD2 4.33Å; Y48-W163 AromaticContact CE2-CE3 3.33Å; Y48-W163 HydrophobicContact CE2-CE3 3.33Å; Y48-W163 AromaticContact CE2-CZ3 3.69Å; Y48-W163 HydrophobicContact CE2-CZ3 3.69Å; Y48-W163 HydrophobicContact CG-CZ3 4.28Å; Y48-W163 AromaticContact CZ-CE3 3.97Å; Y48-V166 HydrophobicContact CD2-CG1 4.28Å; Y48-V166 HydrophobicContact CE2-CG1 4.43Å
49	I	90.7	Very high	88.6	Confident	80 Å²	80	68.8 Å²	68.8	41%	0.41	37%	0.372	S	S	.	.	H	α-helix	trans	-69.6	-48.2	-180	-65	166.1	0	0	0	111.3	L45 V46 I47 C51 A52 F151	L45-I49 WeakPolarHBondContact O-CG1 3.44Å; L45-I49 PolarHBondContact O-N 3.47Å; V46-I49 PolarHBondContact O-N 3.44Å; I47-I49 PolarHBondContact O-N 2.95Å; I49-C51 VanDerWaalsContact C-N 3.26Å; I49-C51 PolarHBondContact O-N 3.29Å; I49-A52 WeakPolarHBondContact O-CB 3.18Å; I49-A52 PolarHBondContact O-N 3.41Å; I49-A52 VanDerWaalsContact O-N 3.13Å; I49-F151 HydrophobicContact CD1-CZ 4.27Å; I49-F151 HydrophobicContact CG1-CZ 4.27Å
50	L	89.2	Confident	88.4	Confident	81 Å²	81	70 Å²	70	42%	0.424	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-34.4	179.9	-69.6	178.5	0	0	0	111.7	V46 A52 W53 F54	V46-L50 HydrophobicContact CG1-CD1 3.51Å; V46-L50 HydrophobicContact CG1-CG 4Å; V46-L50 VanDerWaalsContact O-CB 3.29Å; V46-L50 WeakPolarHBondContact O-CB 3.48Å; V46-L50 WeakPolarHBondContact O-CG 3.16Å; V46-L50 PolarHBondContact O-N 2.63Å; L50-A52 VanDerWaalsContact C-N 3.25Å; L50-A52 PolarHBondContact O-N 2.99Å; L50-W53 PolarHBondContact O-N 3.46Å; L50-F54 HydrophobicContact CB-CD2 4.23Å; L50-F54 HydrophobicContact CD2-CD2 4.03Å; L50-F54 HydrophobicContact CD2-CE2 3.71Å; L50-F54 WeakPolarHBondContact O-CD2 3.44Å; L50-F54 PolarHBondContact O-N 3.01Å
51	C	86.3	Confident	88.5	Confident	8 Å²	8	68 Å²	68	5%	0.054	37%	0.37	C	S	.	.	H	α-helix	trans	-61.1	-37.9	175.8	-179.8	0	0	0	0	111.9	I47 I49 W53 T55 P61 W163	I47-C51 WeakPolarHBondContact O-CB 3.31Å; I47-C51 PolarHBondContact O-N 3.23Å; I49-C51 VanDerWaalsContact C-N 3.26Å; I49-C51 PolarHBondContact O-N 3.29Å; C51-W53 PolarHBondContact O-N 3.28Å; C51-W53 VanDerWaalsContact O-N 3.16Å; C51-T55 HydrophobicContact CB-CG2 4.13Å; C51-T55 PolarHBondContact O-N 3.5Å; C51-T55 VanDerWaalsContact O-O 3.11Å; C51-T55 WeakPolarHBondContact SG-CG2 3.11Å; C51-P61 HydrophobicContact CB-CB 3.8Å; C51-P61 HydrophobicContact CB-CG 4.11Å; C51-P61 WeakPolarHBondContact SG-CB 3.28Å; C51-P61 WeakPolarHBondContact SG-CG 3.46Å; C51-W163 HydrophobicContact CB-CH2 3.67Å; C51-W163 HydrophobicContact CB-CZ2 4.27Å; C51-W163 WeakPolarHBondContact SG-CH2 3.22Å; C51-W163 WeakPolarHBondContact SG-CZ2 3.39Å
52	A	78.6	Confident	88.5	Confident	73 Å²	73	69.3 Å²	69.3	60%	0.603	38%	0.376	S	S	*	.	H	α-helix	trans	-62.3	-21.6	177	0	0	0	0	0	112.5	Y48 I49 L50	Y48-A52 PolarHBondContact O-N 3.13Å; I49-A52 WeakPolarHBondContact O-CB 3.18Å; I49-A52 PolarHBondContact O-N 3.41Å; I49-A52 VanDerWaalsContact O-N 3.13Å; L50-A52 VanDerWaalsContact C-N 3.25Å; L50-A52 PolarHBondContact O-N 2.99Å
53	W	80.1	Confident	88.6	Confident	210 Å²	210	70.7 Å²	70.7	80%	0.795	38%	0.379	S	S	*	.	H	α-helix	trans	-102.7	-38.8	-175.3	-71.7	29.9	0	0	0	113.4	L50 C51	L50-W53 PolarHBondContact O-N 3.46Å; C51-W53 PolarHBondContact O-N 3.28Å; C51-W53 VanDerWaalsContact O-N 3.16Å
54	F	81.4	Confident	88.6	Confident	164 Å²	164	74.3 Å²	74.3	72%	0.719	39%	0.389	S	S	*	.	H	α-helix	trans	-107	-16.2	-166	-71.3	-77.8	0	0	0	115.1	L50	L50-F54 HydrophobicContact CB-CD2 4.23Å; L50-F54 HydrophobicContact CD2-CD2 4.03Å; L50-F54 HydrophobicContact CD2-CE2 3.71Å; L50-F54 WeakPolarHBondContact O-CD2 3.44Å; L50-F54 PolarHBondContact O-N 3.01Å
55	T	78.5	Confident	88.6	Confident	57 Å²	57	74.3 Å²	74.3	35%	0.35	39%	0.389	S	S	.	.			trans	-139.7	138.1	-174.6	-170.1	0	0	0	0	113.7	C51 S57 P61	C51-T55 HydrophobicContact CB-CG2 4.13Å; C51-T55 PolarHBondContact O-N 3.5Å; C51-T55 VanDerWaalsContact O-O 3.11Å; C51-T55 WeakPolarHBondContact SG-CG2 3.11Å; T55-S57 PolarHBondContact OG1-N 3.42Å; T55-P61 HydrophobicContact CG2-CG 3.54Å
56	T	77.5	Confident	88.7	Confident	142 Å²	142	76.2 Å²	76.2	87%	0.871	40%	0.399	S	S	*	.	S	Bend	trans	-85.7	-15.3	171	56.1	0	0	0	0	112
57	S	86.9	Confident	88.8	Confident	63 Å²	63	76 Å²	76	44%	0.441	40%	0.397	S	S	.	.			trans	-81.5	124.9	-176.9	-66.2	0	0	0	0	111.2	T55 P61	T55-S57 PolarHBondContact OG1-N 3.42Å; S57-P61 WeakPolarHBondContact O-CD 3.31Å; S57-P61 WeakPolarHBondContact O-CG 3.46Å
58	F	87.7	Confident	89	Confident	47 Å²	47	74.6 Å²	74.6	21%	0.206	39%	0.392	C	S	.	.	S	Bend	trans	-80.9	-35.3	179.5	176.5	-106.9	0	0	0	113.5	P61 F62 R162 V166	F58-P61 WeakPolarHBondContact O-CD 3.3Å; F58-F62 HydrophobicContact CE1-CB 4.24Å; F58-F62 HydrophobicContact CE1-CD2 4.37Å; F58-F62 HydrophobicContact CE1-CG 4.3Å; F58-F62 HydrophobicContact CZ-CB 4.23Å; F58-F62 HydrophobicContact CZ-CD2 4.02Å; F58-F62 HydrophobicContact CZ-CG 4.31Å; F58-F62 WeakPolarHBondContact O-CB 3.37Å; F58-F62 PolarHBondContact O-N 3.3Å; F58-F62 VanDerWaalsContact O-N 3.09Å; F58-R162 HydrophobicContact CD2-CB 4.02Å; F58-R162 HydrophobicContact CE2-CB 3.7Å; F58-R162 WeakPolarHBondContact CE2-O 3.41Å; F58-R162 HydrophobicContact CZ-CB 3.98Å; F58-R162 WeakPolarHBondContact CZ-O 3.4Å; F58-V166 HydrophobicContact CE2-CG2 4.01Å; F58-V166 HydrophobicContact CZ-CG2 4.16Å
59	V	91.3	Very high	89.2	Confident	94 Å²	94	73.7 Å²	73.7	57%	0.57	39%	0.389	S	S	*	.	H	α-helix	trans	-69.8	-48.8	-165	-179.3	0	0	0	0	113	F62 I63	V59-F62 WeakPolarHBondContact O-CB 3.17Å; V59-F62 PolarHBondContact O-N 2.95Å; V59-I63 HydrophobicContact CG1-CD1 3.88Å; V59-I63 VanDerWaalsContact O-CG1 3.31Å; V59-I63 WeakPolarHBondContact O-CG1 3.23Å; V59-I63 PolarHBondContact O-N 2.9Å
60	L	91.3	Very high	89.5	Confident	109 Å²	109	72.4 Å²	72.4	57%	0.571	39%	0.387	S	S	*	.	H	α-helix	trans	-63.1	-49.9	-178.4	-67.4	172.3	0	0	0	112.3	F62 I63 F64	L60-F62 VanDerWaalsContact C-N 3.31Å; L60-F62 PolarHBondContact O-N 2.9Å; L60-I63 PolarHBondContact O-N 2.86Å; L60-F64 HydrophobicContact CB-CE2 4.45Å; L60-F64 WeakPolarHBondContact O-CD2 3.18Å; L60-F64 PolarHBondContact O-N 2.63Å
61	P	92.2	Very high	89.8	Confident	11 Å²	11	72 Å²	72	7%	0.071	38%	0.384	C	S	.	.	H	α-helix	trans	-62	-38.7	177.2	-24	37.4	0	0	0	112.5	C51 T55 S57 F58 I63 F64 I65	C51-P61 HydrophobicContact CB-CB 3.8Å; C51-P61 HydrophobicContact CB-CG 4.11Å; C51-P61 WeakPolarHBondContact SG-CB 3.28Å; C51-P61 WeakPolarHBondContact SG-CG 3.46Å; T55-P61 HydrophobicContact CG2-CG 3.54Å; S57-P61 WeakPolarHBondContact O-CD 3.31Å; S57-P61 WeakPolarHBondContact O-CG 3.46Å; F58-P61 WeakPolarHBondContact O-CD 3.3Å; P61-I63 VanDerWaalsContact C-N 3.34Å; P61-I63 PolarHBondContact O-N 3.39Å; P61-F64 PolarHBondContact O-N 3.49Å; P61-I65 WeakPolarHBondContact O-CB 3.26Å; P61-I65 WeakPolarHBondContact O-CD1 3.28Å; P61-I65 WeakPolarHBondContact O-CG1 3.33Å; P61-I65 PolarHBondContact O-N 3.25Å
62	F	92.8	Very high	90.2	Very high	45 Å²	45	71.7 Å²	71.7	20%	0.197	38%	0.383	C	S	.	.	H	α-helix	trans	-55.5	-49.1	173.4	169.1	-98.9	0	0	0	111.5	F58 V59 L60 I65 L66 F165 V166 I169	F58-F62 HydrophobicContact CE1-CB 4.24Å; F58-F62 HydrophobicContact CE1-CD2 4.37Å; F58-F62 HydrophobicContact CE1-CG 4.3Å; F58-F62 HydrophobicContact CZ-CB 4.23Å; F58-F62 HydrophobicContact CZ-CD2 4.02Å; F58-F62 HydrophobicContact CZ-CG 4.31Å; F58-F62 WeakPolarHBondContact O-CB 3.37Å; F58-F62 PolarHBondContact O-N 3.3Å; F58-F62 VanDerWaalsContact O-N 3.09Å; V59-F62 WeakPolarHBondContact O-CB 3.17Å; V59-F62 PolarHBondContact O-N 2.95Å; L60-F62 VanDerWaalsContact C-N 3.31Å; L60-F62 PolarHBondContact O-N 2.9Å; F62-I65 PolarHBondContact O-N 3.44Å; F62-L66 HydrophobicContact CE1-CD2 4.22Å; F62-L66 HydrophobicContact CZ-CD2 4.16Å; F62-L66 VanDerWaalsContact O-CB 3.28Å; F62-L66 WeakPolarHBondContact O-CB 3.32Å; F62-L66 PolarHBondContact O-N 2.92Å; F62-F165 HydrophobicContact CE2-CD1 4.06Å; F62-F165 AromaticContact CE2-CE1 3.83Å; F62-F165 HydrophobicContact CE2-CE1 3.83Å; F62-F165 HydrophobicContact CZ-CE1 4.07Å; F62-V166 HydrophobicContact CD2-CG2 3.91Å; F62-I169 HydrophobicContact CE2-CD1 4.16Å; F62-I169 HydrophobicContact CZ-CD1 4.46Å
63	I	94.9	Very high	91	Very high	83 Å²	83	70.6 Å²	70.6	43%	0.426	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-47.4	179	-66.7	165.5	0	0	0	110.6	V59 L60 P61 I65 L66 V67	V59-I63 HydrophobicContact CG1-CD1 3.88Å; V59-I63 VanDerWaalsContact O-CG1 3.31Å; V59-I63 WeakPolarHBondContact O-CG1 3.23Å; V59-I63 PolarHBondContact O-N 2.9Å; L60-I63 PolarHBondContact O-N 2.86Å; P61-I63 VanDerWaalsContact C-N 3.34Å; P61-I63 PolarHBondContact O-N 3.39Å; I63-I65 PolarHBondContact O-N 2.82Å; I63-L66 PolarHBondContact O-N 3.38Å; I63-V67 HydrophobicContact CG2-CG2 4.47Å; I63-V67 WeakPolarHBondContact O-CG2 2.99Å; I63-V67 PolarHBondContact O-N 3.04Å
64	F	94.1	Very high	91.7	Very high	120 Å²	120	67.2 Å²	67.2	53%	0.526	35%	0.351	S	S	.	.	H	α-helix	trans	-63.1	-43.1	179.6	-74.9	-65.2	0	0	0	112.6	I47 L60 P61 V67 C68	I47-F64 HydrophobicContact CD1-CB 4.24Å; I47-F64 HydrophobicContact CG2-CB 4.28Å; L60-F64 HydrophobicContact CB-CE2 4.45Å; L60-F64 WeakPolarHBondContact O-CD2 3.18Å; L60-F64 PolarHBondContact O-N 2.63Å; P61-F64 PolarHBondContact O-N 3.49Å; F64-V67 PolarHBondContact O-N 2.9Å; F64-C68 PolarHBondContact O-N 3.3Å; F64-C68 PolarHBondContact O-SG 3.45Å; F64-C68 VanDerWaalsContact O-SG 3.35Å
65	I	95.2	Very high	92.2	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-44.8	176.2	-67.5	163.9	0	0	0	110.1	I47 Y48 P61 F62 I63 V67 C68 L69 W148 W163 V166	I47-I65 HydrophobicContact CB-CG1 4.09Å; I47-I65 HydrophobicContact CG2-CD1 4.21Å; I47-I65 HydrophobicContact CG2-CG1 3.67Å; Y48-I65 HydrophobicContact CD2-CD1 4.19Å; P61-I65 WeakPolarHBondContact O-CB 3.26Å; P61-I65 WeakPolarHBondContact O-CD1 3.28Å; P61-I65 WeakPolarHBondContact O-CG1 3.33Å; P61-I65 PolarHBondContact O-N 3.25Å; F62-I65 PolarHBondContact O-N 3.44Å; I63-I65 PolarHBondContact O-N 2.82Å; I65-V67 VanDerWaalsContact C-N 3.34Å; I65-V67 PolarHBondContact O-N 3.43Å; I65-C68 PolarHBondContact O-N 3.49Å; I65-L69 HydrophobicContact CG2-CD1 3.69Å; I65-L69 HydrophobicContact CG2-CG 4.15Å; I65-L69 WeakPolarHBondContact O-CB 3.38Å; I65-L69 VanDerWaalsContact O-CG 3.26Å; I65-L69 WeakPolarHBondContact O-CG 3.39Å; I65-L69 PolarHBondContact O-N 2.86Å; I65-W148 HydrophobicContact CG2-CH2 4.23Å; I65-W163 HydrophobicContact CD1-CZ3 4.14Å; I65-V166 HydrophobicContact CD1-CG1 4.36Å; I65-V166 HydrophobicContact CG2-CG1 3.76Å
66	L	95.7	Very high	92.9	Very high	65 Å²	65	57.4 Å²	57.4	34%	0.34	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-42.2	178.9	-176.6	64	0	0	0	111.9	F62 I63 L69 S70 I169	F62-L66 HydrophobicContact CE1-CD2 4.22Å; F62-L66 HydrophobicContact CZ-CD2 4.16Å; F62-L66 VanDerWaalsContact O-CB 3.28Å; F62-L66 WeakPolarHBondContact O-CB 3.32Å; F62-L66 PolarHBondContact O-N 2.92Å; I63-L66 PolarHBondContact O-N 3.38Å; L66-L69 PolarHBondContact O-N 3.18Å; L66-S70 WeakPolarHBondContact O-CB 3.28Å; L66-S70 PolarHBondContact O-N 3.02Å; L66-S70 PolarHBondContact O-OG 3.27Å; L66-I169 HydrophobicContact CD1-CG2 3.95Å
67	V	96.3	Very high	93.6	Very high	72 Å²	72	52.7 Å²	52.7	44%	0.436	27%	0.272	S	S	.	.	H	α-helix	trans	-65.3	-44.1	175.1	171.9	0	0	0	0	111.2	I63 F64 I65 L69 S70 L71	I63-V67 HydrophobicContact CG2-CG2 4.47Å; I63-V67 WeakPolarHBondContact O-CG2 2.99Å; I63-V67 PolarHBondContact O-N 3.04Å; F64-V67 PolarHBondContact O-N 2.9Å; I65-V67 VanDerWaalsContact C-N 3.34Å; I65-V67 PolarHBondContact O-N 3.43Å; V67-L69 VanDerWaalsContact C-N 3.34Å; V67-L69 PolarHBondContact O-N 2.77Å; V67-S70 PolarHBondContact O-N 3.32Å; V67-S70 PolarHBondContact O-OG 3.03Å; V67-L71 HydrophobicContact CG1-CD1 4.06Å; V67-L71 HydrophobicContact CG1-CG 4.49Å; V67-L71 WeakPolarHBondContact O-CB 3.02Å; V67-L71 VanDerWaalsContact O-CG 3.32Å; V67-L71 WeakPolarHBondContact O-CG 3.39Å; V67-L71 PolarHBondContact O-N 2.94Å
68	C	95.9	Very high	93.8	Very high	18 Å²	18	51.4 Å²	51.4	12%	0.122	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-39.8	176	-70.5	0	0	0	0	112.1	A44 F64 I65 D72	A44-C68 HydrophobicContact CB-CB 3.77Å; F64-C68 PolarHBondContact O-N 3.3Å; F64-C68 PolarHBondContact O-SG 3.45Å; F64-C68 VanDerWaalsContact O-SG 3.35Å; I65-C68 PolarHBondContact O-N 3.49Å; C68-D72 VanDerWaalsContact O-CB 3.25Å; C68-D72 WeakPolarHBondContact O-CB 3.17Å; C68-D72 PolarHBondContact O-N 3.45Å
69	L	96.5	Very high	93.9	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-67	-38.7	176.5	-74.2	170.9	0	0	0	112.5	A44 I65 L66 V67 D72 F73 W148 A170 M173	A44-L69 HydrophobicContact CB-CD2 4.35Å; A44-L69 HydrophobicContact CB-CG 4.37Å; I65-L69 HydrophobicContact CG2-CD1 3.69Å; I65-L69 HydrophobicContact CG2-CG 4.15Å; I65-L69 WeakPolarHBondContact O-CB 3.38Å; I65-L69 VanDerWaalsContact O-CG 3.26Å; I65-L69 WeakPolarHBondContact O-CG 3.39Å; I65-L69 PolarHBondContact O-N 2.86Å; L66-L69 PolarHBondContact O-N 3.18Å; V67-L69 VanDerWaalsContact C-N 3.34Å; V67-L69 PolarHBondContact O-N 2.77Å; L69-D72 PolarHBondContact O-N 2.81Å; L69-F73 VanDerWaalsContact O-CB 3.31Å; L69-F73 WeakPolarHBondContact O-CB 3.27Å; L69-F73 PolarHBondContact O-N 3.11Å; L69-W148 HydrophobicContact CD2-CZ2 3.9Å; L69-A170 HydrophobicContact CD1-CB 3.69Å; L69-A170 HydrophobicContact CD2-CB 3.83Å; L69-A170 HydrophobicContact CG-CB 4.45Å; L69-M173 HydrophobicContact CB-SD 4.2Å
70	S	96.5	Very high	93.9	Very high	52 Å²	52	47.4 Å²	47.4	36%	0.364	24%	0.237	S	C	.	.	H	α-helix	trans	-69.4	-41	177.6	69.3	0	0	0	0	112.3	L66 V67 F73 W74	L66-S70 WeakPolarHBondContact O-CB 3.28Å; L66-S70 PolarHBondContact O-N 3.02Å; L66-S70 PolarHBondContact O-OG 3.27Å; V67-S70 PolarHBondContact O-N 3.32Å; V67-S70 PolarHBondContact O-OG 3.03Å; S70-F73 PolarHBondContact O-N 3.04Å; S70-W74 WeakPolarHBondContact O-CB 3.4Å; S70-W74 PolarHBondContact O-N 3.31Å
71	L	95.7	Very high	93.9	Very high	72 Å²	72	42.2 Å²	42.2	38%	0.377	21%	0.21	S	C	.	.	H	α-helix	trans	-64.2	-44.4	172.2	-69.2	175	0	0	0	111.4	F40 V67 W74 V75	F40-L71 HydrophobicContact CD1-CB 3.79Å; F40-L71 HydrophobicContact CD1-CD1 3.96Å; F40-L71 HydrophobicContact CD2-CB 4.5Å; F40-L71 HydrophobicContact CE1-CB 4.07Å; F40-L71 HydrophobicContact CE1-CD1 3.65Å; F40-L71 HydrophobicContact CE1-CG 4.46Å; F40-L71 HydrophobicContact CG-CB 4.03Å; F40-L71 HydrophobicContact CZ-CD1 4.41Å; V67-L71 HydrophobicContact CG1-CD1 4.06Å; V67-L71 HydrophobicContact CG1-CG 4.49Å; V67-L71 WeakPolarHBondContact O-CB 3.02Å; V67-L71 VanDerWaalsContact O-CG 3.32Å; V67-L71 WeakPolarHBondContact O-CG 3.39Å; V67-L71 PolarHBondContact O-N 2.94Å; L71-W74 PolarHBondContact O-N 3.47Å; L71-V75 WeakPolarHBondContact O-CB 3.4Å; L71-V75 VanDerWaalsContact O-CG2 3.25Å; L71-V75 WeakPolarHBondContact O-CG2 3.29Å; L71-V75 PolarHBondContact O-N 2.92Å
72	D	95.2	Very high	93.8	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-58.1	-50.8	175.2	-177.1	64.6	0	0	0	111.3	F40 R41 C68 L69 W74 V75 V76	F40-D72 HydrophobicContact CB-CB 3.83Å; R41-D72 WeakPolarHBondContact CB-OD1 3.43Å; R41-D72 PolarHBondContact N-OD1 3.42Å; C68-D72 VanDerWaalsContact O-CB 3.25Å; C68-D72 WeakPolarHBondContact O-CB 3.17Å; C68-D72 PolarHBondContact O-N 3.45Å; L69-D72 PolarHBondContact O-N 2.81Å; D72-W74 VanDerWaalsContact C-N 3.28Å; D72-W74 PolarHBondContact O-N 3.35Å; D72-V75 PolarHBondContact O-N 3.45Å; D72-V76 WeakPolarHBondContact O-CB 3.39Å; D72-V76 VanDerWaalsContact O-CG2 3.24Å; D72-V76 WeakPolarHBondContact O-CG2 3.36Å; D72-V76 PolarHBondContact O-N 3.32Å
73	F	95	Very high	93.6	Very high	49 Å²	49	42.6 Å²	42.6	22%	0.215	21%	0.211	C	C	.	.	H	α-helix	trans	-54.9	-46	176.7	172.8	-97.3	0	0	0	111.8	L69 S70 K77 W89 M173 A176 N177	L69-F73 VanDerWaalsContact O-CB 3.31Å; L69-F73 WeakPolarHBondContact O-CB 3.27Å; L69-F73 PolarHBondContact O-N 3.11Å; S70-F73 PolarHBondContact O-N 3.04Å; F73-K77 HydrophobicContact CE1-CD 4.14Å; F73-K77 HydrophobicContact CZ-CD 4Å; F73-K77 VanDerWaalsContact O-CB 3.23Å; F73-K77 WeakPolarHBondContact O-CB 3.37Å; F73-K77 PolarHBondContact O-N 3.44Å; F73-W89 HydrophobicContact CE2-CZ2 4.46Å; F73-W89 HydrophobicContact CZ-CH2 4.24Å; F73-W89 HydrophobicContact CZ-CZ2 4.42Å; F73-M173 HydrophobicContact CB-CB 4.45Å; F73-M173 HydrophobicContact CB-CE 3.47Å; F73-M173 VanDerWaalsContact CB-CE 3.47Å; F73-M173 HydrophobicContact CD1-CE 4.18Å; F73-M173 HydrophobicContact CD2-CB 4.11Å; F73-M173 HydrophobicContact CD2-CE 4.46Å; F73-M173 WeakPolarHBondContact CD2-O 3.39Å; F73-M173 HydrophobicContact CG-CE 3.8Å; F73-A176 HydrophobicContact CE2-CB 4.23Å; F73-N177 VanDerWaalsContact CD2-ND2 3.29Å; F73-N177 WeakPolarHBondContact CD2-ND2 3.46Å; F73-N177 WeakPolarHBondContact CE2-OD1 3.27Å
74	W	94.2	Very high	93.4	Very high	140 Å²	140	38.9 Å²	38.9	53%	0.53	19%	0.192	S	C	.	.	H	α-helix	trans	-67.5	-43.4	-179.6	-174.6	94.4	0	0	0	112.6	S70 L71 D72 K77 N78 I79	S70-W74 WeakPolarHBondContact O-CB 3.4Å; S70-W74 PolarHBondContact O-N 3.31Å; L71-W74 PolarHBondContact O-N 3.47Å; D72-W74 VanDerWaalsContact C-N 3.28Å; D72-W74 PolarHBondContact O-N 3.35Å; W74-K77 PolarHBondContact O-N 2.91Å; W74-N78 VanDerWaalsContact CD1-ND2 3.25Å; W74-N78 HydrophobicContact CZ2-CB 4.45Å; W74-N78 PolarHBondContact NE1-ND2 3.3Å; W74-N78 WeakPolarHBondContact O-CB 3.41Å; W74-N78 PolarHBondContact O-N 3.43Å; W74-N78 PolarHBondContact O-ND2 2.87Å; W74-I79 HydrophobicContact CE3-CD1 4.33Å; W74-I79 HydrophobicContact CH2-CD1 4Å; W74-I79 HydrophobicContact CH2-CG1 4.36Å; W74-I79 HydrophobicContact CZ3-CD1 3.44Å; W74-I79 VanDerWaalsContact CZ3-CD1 3.44Å; W74-I79 HydrophobicContact CZ3-CG1 4.02Å
75	V	93.4	Very high	93.2	Very high	9 Å²	9	34.6 Å²	34.6	6%	0.055	18%	0.175	C	C	.	.	H	α-helix	trans	-64.8	-46.2	178.3	168.7	0	0	0	0	110.4	F40 L71 D72 K77 I79 S80	F40-V75 HydrophobicContact CD2-CB 4.46Å; F40-V75 HydrophobicContact CD2-CG2 3.84Å; F40-V75 HydrophobicContact CE2-CG2 3.78Å; L71-V75 WeakPolarHBondContact O-CB 3.4Å; L71-V75 VanDerWaalsContact O-CG2 3.25Å; L71-V75 WeakPolarHBondContact O-CG2 3.29Å; L71-V75 PolarHBondContact O-N 2.92Å; D72-V75 PolarHBondContact O-N 3.45Å; V75-K77 PolarHBondContact O-N 3.21Å; V75-I79 HydrophobicContact CG1-CB 4.35Å; V75-I79 HydrophobicContact CG2-CD1 4.48Å; V75-I79 CarbonylContact O-C 3.54Å; V75-I79 WeakPolarHBondContact O-CA 3.25Å; V75-I79 WeakPolarHBondContact O-CB 3.32Å; V75-I79 PolarHBondContact O-N 3.5Å; V75-S80 PolarHBondContact O-N 3.3Å
76	V	93.7	Very high	92.9	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.03	18%	0.181	C	C	.	.	I	π-helix	trans	-58.3	-52.5	177.5	171.1	0	0	0	0	109.8	D72 G81 L141 N177 Y181	D72-V76 WeakPolarHBondContact O-CB 3.39Å; D72-V76 VanDerWaalsContact O-CG2 3.24Å; D72-V76 WeakPolarHBondContact O-CG2 3.36Å; D72-V76 PolarHBondContact O-N 3.32Å; V76-G81 PolarHBondContact O-N 2.99Å; V76-L141 HydrophobicContact CG1-CD1 3.96Å; V76-N177 HydrophobicContact CG1-CB 4.05Å; V76-Y181 HydrophobicContact CG1-CE2 3.88Å; V76-Y181 PolarHBondContact O-OH 3.33Å
77	K	91.6	Very high	92.7	Very high	44 Å²	44	32.7 Å²	32.7	19%	0.191	17%	0.168	C	C	.	.	I	π-helix	trans	-62.8	-44.8	-176.9	-170	178	97.5	81	0	113.6	F73 W74 V75 W89 Y181	F73-K77 HydrophobicContact CE1-CD 4.14Å; F73-K77 HydrophobicContact CZ-CD 4Å; F73-K77 VanDerWaalsContact O-CB 3.23Å; F73-K77 WeakPolarHBondContact O-CB 3.37Å; F73-K77 PolarHBondContact O-N 3.44Å; W74-K77 PolarHBondContact O-N 2.91Å; V75-K77 PolarHBondContact O-N 3.21Å; K77-W89 HydrophobicContact CD-CH2 3.73Å; K77-W89 HydrophobicContact CD-CZ2 3.48Å; K77-W89 VanDerWaalsContact CD-CZ2 3.48Å; K77-W89 HydrophobicContact CD-CZ3 4.41Å; K77-W89 HydrophobicContact CG-CH2 4.41Å; K77-W89 HydrophobicContact CG-CZ2 3.7Å; K77-Y181 WeakPolarHBondContact CA-OH 3.46Å; K77-Y181 PolarHBondContact O-OH 3.02Å; K77-Y181 VanDerWaalsContact O-OH 3.08Å
78	N	91.1	Very high	92.5	Very high	36 Å²	36	30.8 Å²	30.8	19%	0.193	15%	0.154	C	C	.	.	I	π-helix	trans	-104	-29.5	-167.7	-59.8	-69.2	0	0	0	114.3	W74 R82	W74-N78 VanDerWaalsContact CD1-ND2 3.25Å; W74-N78 HydrophobicContact CZ2-CB 4.45Å; W74-N78 PolarHBondContact NE1-ND2 3.3Å; W74-N78 WeakPolarHBondContact O-CB 3.41Å; W74-N78 PolarHBondContact O-N 3.43Å; W74-N78 PolarHBondContact O-ND2 2.87Å; N78-R82 VanDerWaalsContact O-CD 3.31Å; N78-R82 WeakPolarHBondContact O-CD 3.27Å; N78-R82 WeakPolarHBondContact O-CG 3.47Å
79	I	89.9	Confident	92.3	Very high	57 Å²	57	31.1 Å²	31.1	29%	0.292	15%	0.152	S	C	.	.	I	π-helix	trans	-108.5	-64.1	-173.4	-61.4	-178.3	0	0	0	110.3	W74 V75 G81 R82 I83	W74-I79 HydrophobicContact CE3-CD1 4.33Å; W74-I79 HydrophobicContact CH2-CD1 4Å; W74-I79 HydrophobicContact CH2-CG1 4.36Å; W74-I79 HydrophobicContact CZ3-CD1 3.44Å; W74-I79 VanDerWaalsContact CZ3-CD1 3.44Å; W74-I79 HydrophobicContact CZ3-CG1 4.02Å; V75-I79 HydrophobicContact CG1-CB 4.35Å; V75-I79 HydrophobicContact CG2-CD1 4.48Å; V75-I79 CarbonylContact O-C 3.54Å; V75-I79 WeakPolarHBondContact O-CA 3.25Å; V75-I79 WeakPolarHBondContact O-CB 3.32Å; V75-I79 PolarHBondContact O-N 3.5Å; I79-G81 VanDerWaalsContact C-N 3.34Å; I79-G81 PolarHBondContact O-N 3.49Å; I79-R82 PolarHBondContact O-N 3.35Å; I79-I83 HydrophobicContact CG2-CD1 3.67Å; I79-I83 WeakPolarHBondContact O-CG1 3.47Å; I79-I83 PolarHBondContact O-N 3.24Å
80	S	91.6	Very high	92	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-62.1	-42.2	-172.3	-56.5	0	0	0	0	111.9	H37 V75 R82 L84	H37-S80 WeakPolarHBondContact CB-OG 3.29Å; H37-S80 WeakPolarHBondContact ND1-CB 3.44Å; H37-S80 PolarHBondContact ND1-OG 3.19Å; H37-S80 VanDerWaalsContact ND1-OG 3.07Å; V75-S80 PolarHBondContact O-N 3.3Å; S80-R82 PolarHBondContact O-N 3.49Å; S80-L84 WeakPolarHBondContact O-CB 3.45Å; S80-L84 WeakPolarHBondContact O-CG 3.31Å; S80-L84 PolarHBondContact O-N 2.88Å
81	G	90.9	Very high	91.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	I	π-helix	trans	-58.4	-46.9	175.9	0	0	0	0	0	113.5	V76 I79 V85 G86 L87 Y181	V76-G81 PolarHBondContact O-N 2.99Å; I79-G81 VanDerWaalsContact C-N 3.34Å; I79-G81 PolarHBondContact O-N 3.49Å; G81-V85 WeakPolarHBondContact O-CG2 3.44Å; G81-V85 PolarHBondContact O-N 3.48Å; G81-G86 PolarHBondContact O-N 3.42Å; G81-L87 CarbonylContact C-O 3.58Å; G81-L87 VanDerWaalsContact C-O 3.26Å; G81-L87 PolarHBondContact O-N 3.44Å; G81-Y181 WeakPolarHBondContact CA-OH 3.29Å
82	R	90.5	Very high	91.5	Very high	32 Å²	32	32.6 Å²	32.6	12%	0.121	16%	0.158	C	C	.	.	I	π-helix	trans	-66.2	-47.4	179.7	-66.3	-172	78.2	126.7	10.6	111.5	D14 D17 N78 I79 S80 G86	D14-R82 IonicContact OD1-CZ 3.07Å; D14-R82 IonicContact OD1-NH1 3.79Å; D14-R82 IonicContact OD1-NH2 2.63Å; D14-R82 PolarHBondContact OD1-NH2 3.07Å; D17-R82 IonicContact OD2-CZ 3.18Å; D17-R82 IonicContact OD2-NE 3.91Å; D17-R82 PolarHBondContact OD2-NE 3.3Å; D17-R82 IonicContact OD2-NH2 3.49Å; D17-R82 PolarHBondContact OD2-NH2 2.84Å; N78-R82 VanDerWaalsContact O-CD 3.31Å; N78-R82 WeakPolarHBondContact O-CD 3.27Å; N78-R82 WeakPolarHBondContact O-CG 3.47Å; I79-R82 PolarHBondContact O-N 3.35Å; S80-R82 PolarHBondContact O-N 3.49Å; R82-G86 VanDerWaalsContact O-CA 3.27Å; R82-G86 WeakPolarHBondContact O-CA 3.37Å; R82-G86 PolarHBondContact O-N 3.46Å
83	I	88.5	Confident	91.3	Very high	31 Å²	31	36.2 Å²	36.2	16%	0.159	18%	0.18	C	C	.	.	I	π-helix	trans	-82	-39.7	-170	-61.8	169.8	0	0	0	112.7	T29 R30 A33 I79	T29-I83 HydrophobicContact CG2-CD1 4.06Å; R30-I83 HydrophobicContact CG-CG2 4.17Å; A33-I83 HydrophobicContact CB-CB 3.95Å; A33-I83 HydrophobicContact CB-CD1 3.95Å; A33-I83 HydrophobicContact CB-CG2 3.68Å; I79-I83 HydrophobicContact CG2-CD1 3.67Å; I79-I83 WeakPolarHBondContact O-CG1 3.47Å; I79-I83 PolarHBondContact O-N 3.24Å
84	L	89.5	Confident	91.1	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.031	18%	0.181	C	C	.	.	I	π-helix	trans	-89.2	-41.2	-170.9	-57.2	-179.3	0	0	0	113	A33 V34 H37 S80 L133 F137	A33-L84 HydrophobicContact CB-CD2 3.98Å; A33-L84 HydrophobicContact CB-CG 4.29Å; V34-L84 HydrophobicContact CG2-CD1 4.15Å; V34-L84 HydrophobicContact CG2-CD2 3.64Å; H37-L84 HydrophobicContact CB-CD1 4.38Å; S80-L84 WeakPolarHBondContact O-CB 3.45Å; S80-L84 WeakPolarHBondContact O-CG 3.31Å; S80-L84 PolarHBondContact O-N 2.88Å; L84-L133 HydrophobicContact CD2-CB 4.22Å; L84-L133 HydrophobicContact CD2-CD2 4.12Å; L84-F137 HydrophobicContact CB-CB 3.98Å; L84-F137 HydrophobicContact CB-CD2 4.29Å; L84-F137 HydrophobicContact CB-CG 4.37Å; L84-F137 HydrophobicContact CD1-CB 4.06Å; L84-F137 HydrophobicContact CD1-CD2 4.16Å
85	V	91.1	Very high	91	Very high	29 Å²	29	35 Å²	35	18%	0.176	19%	0.186	C	C	.	.	I	π-helix	trans	-115	-18.8	-178.3	-69.1	0	0	0	0	113.8	G81 L87 F137	G81-V85 WeakPolarHBondContact O-CG2 3.44Å; G81-V85 PolarHBondContact O-N 3.48Å; V85-L87 VanDerWaalsContact C-N 3.34Å; V85-L87 HydrophobicContact CB-CD1 4.22Å; V85-L87 HydrophobicContact CB-CG 4.07Å; V85-L87 HydrophobicContact CG2-CB 3.85Å; V85-L87 HydrophobicContact CG2-CD1 3.95Å; V85-L87 HydrophobicContact CG2-CG 3.79Å; V85-F137 HydrophobicContact CB-CD1 4.16Å; V85-F137 HydrophobicContact CB-CE1 4.35Å; V85-F137 HydrophobicContact CG1-CB 3.88Å; V85-F137 HydrophobicContact CG1-CD1 3.26Å; V85-F137 HydrophobicContact CG1-CE1 3.89Å; V85-F137 HydrophobicContact CG1-CG 3.66Å; V85-F137 HydrophobicContact CG2-CD1 3.77Å; V85-F137 HydrophobicContact CG2-CD2 4.44Å; V85-F137 HydrophobicContact CG2-CE1 3.53Å; V85-F137 HydrophobicContact CG2-CE2 4.25Å; V85-F137 HydrophobicContact CG2-CG 4.2Å; V85-F137 HydrophobicContact CG2-CZ 3.79Å
86	G	88.4	Confident	91	Very high	13 Å²	13	38.6 Å²	38.6	13%	0.134	22%	0.217	C	C	.	.			trans	68.6	34.9	-174.9	0	0	0	0	0	112.3	G81 R82 S105 R106	G81-G86 PolarHBondContact O-N 3.42Å; R82-G86 VanDerWaalsContact O-CA 3.27Å; R82-G86 WeakPolarHBondContact O-CA 3.37Å; R82-G86 PolarHBondContact O-N 3.46Å; G86-S105 CarbonylContact O-C 3.26Å; G86-S105 WeakPolarHBondContact O-CA 3.27Å; G86-R106 WeakPolarHBondContact O-CB 3.42Å; G86-R106 PolarHBondContact O-N 2.96Å
87	L	91.2	Very high	90.8	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.068	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	141.7	176.7	-59.4	178.2	0	0	0	109.3	G81 V85 W138 Y181 C184	G81-L87 CarbonylContact C-O 3.58Å; G81-L87 VanDerWaalsContact C-O 3.26Å; G81-L87 PolarHBondContact O-N 3.44Å; V85-L87 VanDerWaalsContact C-N 3.34Å; V85-L87 HydrophobicContact CB-CD1 4.22Å; V85-L87 HydrophobicContact CB-CG 4.07Å; V85-L87 HydrophobicContact CG2-CB 3.85Å; V85-L87 HydrophobicContact CG2-CD1 3.95Å; V85-L87 HydrophobicContact CG2-CG 3.79Å; L87-W138 HydrophobicContact CD1-CZ2 3.88Å; L87-Y181 HydrophobicContact CB-CD1 3.71Å; L87-Y181 HydrophobicContact CB-CE1 3.89Å; L87-Y181 HydrophobicContact CD1-CD1 4.13Å; L87-C184 HydrophobicContact CB-CB 4.05Å; L87-C184 HydrophobicContact CD1-CB 4.25Å; L87-C184 HydrophobicContact CD2-CB 4.14Å; L87-C184 HydrophobicContact CG-CB 4.37Å
88	R	91.2	Very high	90.8	Very high	33 Å²	33	42.5 Å²	42.5	13%	0.125	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	133.3	177.7	178.2	178.8	172.6	82.1	-4.4	110.3	D104 C184	R88-D104 HydrophobicContact CB-CB 4.38Å; R88-D104 PolarHBondContact N-O 3Å; R88-D104 PolarHBondContact O-N 3.26Å; R88-C184 PolarHBondContact O-SG 3.04Å
89	W	92.8	Very high	90.8	Very high	24 Å²	24	44.3 Å²	44.3	9%	0.091	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	140.3	169.3	62.8	-84.6	0	0	0	109.8	F73 K77 W101 R102 Y103 Y181	F73-W89 HydrophobicContact CE2-CZ2 4.46Å; F73-W89 HydrophobicContact CZ-CH2 4.24Å; F73-W89 HydrophobicContact CZ-CZ2 4.42Å; K77-W89 HydrophobicContact CD-CH2 3.73Å; K77-W89 HydrophobicContact CD-CZ2 3.48Å; K77-W89 VanDerWaalsContact CD-CZ2 3.48Å; K77-W89 HydrophobicContact CD-CZ3 4.41Å; K77-W89 HydrophobicContact CG-CH2 4.41Å; K77-W89 HydrophobicContact CG-CZ2 3.7Å; W89-W101 HydrophobicContact CE3-CE3 4.44Å; W89-W101 AromaticContact CE3-CZ3 3.93Å; W89-W101 HydrophobicContact CE3-CZ3 3.93Å; W89-W101 AromaticContact CZ3-CZ3 3.85Å; W89-W101 HydrophobicContact CZ3-CZ3 3.85Å; W89-R102 WeakPolarHBondContact CA-O 3.43Å; W89-Y103 HydrophobicContact CB-CD1 3.91Å; W89-Y103 HydrophobicContact CB-CE1 4.1Å; W89-Y181 AromaticContact NE1-CE2 3.87Å
90	S	90.8	Very high	90.8	Very high	18 Å²	18	44.9 Å²	44.9	13%	0.126	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	144.6	175.3	53.5	0	0	0	0	110.3	R102	S90-R102 PolarHBondContact N-O 3.35Å; S90-R102 PolarHBondContact O-N 3.41Å
91	S	90.5	Very high	90.7	Very high	66 Å²	66	51.3 Å²	51.3	46%	0.462	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.5	166.7	54	0	0	0	0	109.4	H100	S91-H100 WeakPolarHBondContact CA-O 3.24Å
92	Y	90.8	Very high	90.6	Very high	76 Å²	76	53.7 Å²	53.7	30%	0.298	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	149.2	166.6	63.6	-86.2	0	0	0	108.8	H100 R102	Y92-H100 HydrophobicContact CD1-CB 4.21Å; Y92-H100 HydrophobicContact CD2-CB 4.12Å; Y92-H100 HydrophobicContact CE1-CB 3.67Å; Y92-H100 HydrophobicContact CE2-CB 3.57Å; Y92-H100 AromaticContact CE2-CD2 3.96Å; Y92-H100 AromaticContact CE2-CG 3.97Å; Y92-H100 HydrophobicContact CG-CB 4.41Å; Y92-H100 PolarHBondContact N-O 3.37Å; Y92-H100 PolarHBondContact O-N 2.91Å; Y92-R102 HydrophobicContact CD1-CB 4.22Å; Y92-R102 HydrophobicContact CE1-CB 4Å
93	T	90.4	Very high	90.7	Very high	80 Å²	80	53.7 Å²	53.7	49%	0.491	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.6	177.6	-51.6	0	0	0	0	107.5	V98	T93-V98 WeakPolarHBondContact CA-O 3.38Å
94	D	90.7	Very high	90.6	Very high	41 Å²	41	55.4 Å²	55.4	22%	0.219	31%	0.312	C	S	.	.			trans	-75.7	172.8	175.1	67.1	15.3	0	0	0	112.1	A96 G97 V98 H100	D94-A96 PolarHBondContact O-N 3.37Å; D94-A96 VanDerWaalsContact O-N 3.08Å; D94-A96 WeakPolarHBondContact OD1-CA 3.28Å; D94-A96 WeakPolarHBondContact OD1-CB 3.47Å; D94-A96 PolarHBondContact OD1-N 3.28Å; D94-G97 PolarHBondContact O-N 2.95Å; D94-G97 PolarHBondContact OD1-N 3.29Å; D94-V98 PolarHBondContact N-O 2.87Å; D94-V98 WeakPolarHBondContact OD1-CA 3.5Å; D94-V98 WeakPolarHBondContact OD1-CB 3.29Å; D94-V98 PolarHBondContact OD1-N 3.5Å; D94-H100 IonicContact OD2-CD2 2.75Å; D94-H100 PolarHBondContact OD2-CD2 2.9Å; D94-H100 IonicContact OD2-CE1 3.89Å; D94-H100 IonicContact OD2-NE2 2.89Å; D94-H100 PolarHBondContact OD2-NE2 2.95Å
95	D	92.9	Very high	90.6	Very high	121 Å²	121	56.7 Å²	56.7	65%	0.647	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.4	178.1	-50.1	-57.6	0	0	0	112.8	M1 G97	M1-D95 WeakPolarHBondContact CB-OD2 3.11Å; M1-D95 PolarHBondContact N-OD2 3.32Å; D95-G97 VanDerWaalsContact C-N 3.34Å
96	A	92.3	Very high	90.3	Very high	85 Å²	85	61 Å²	61	70%	0.702	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	0.6	176.1	0	0	0	0	0	113	D94 V98	D94-A96 PolarHBondContact O-N 3.37Å; D94-A96 VanDerWaalsContact O-N 3.08Å; D94-A96 WeakPolarHBondContact OD1-CA 3.28Å; D94-A96 WeakPolarHBondContact OD1-CB 3.47Å; D94-A96 PolarHBondContact OD1-N 3.28Å; A96-V98 VanDerWaalsContact C-N 3.33Å; A96-V98 HydrophobicContact CB-CG2 4.39Å
97	G	90.1	Very high	90	Very high	54 Å²	54	68.7 Å²	68.7	56%	0.557	36%	0.364	S	S	*	.	S	Bend	trans	79.8	10.5	-179	0	0	0	0	0	114.4	D94 D95	D94-G97 PolarHBondContact O-N 2.95Å; D94-G97 PolarHBondContact OD1-N 3.29Å; D95-G97 VanDerWaalsContact C-N 3.34Å
98	V	92.1	Very high	89.4	Confident	77 Å²	77	72.7 Å²	72.7	47%	0.467	39%	0.391	S	S	.	.			trans	-88.3	127.1	179.3	-175.9	0	0	0	0	109.7	T93 D94 A96 H100	T93-V98 WeakPolarHBondContact CA-O 3.38Å; D94-V98 PolarHBondContact N-O 2.87Å; D94-V98 WeakPolarHBondContact OD1-CA 3.5Å; D94-V98 WeakPolarHBondContact OD1-CB 3.29Å; D94-V98 PolarHBondContact OD1-N 3.5Å; A96-V98 VanDerWaalsContact C-N 3.33Å; A96-V98 HydrophobicContact CB-CG2 4.39Å; V98-H100 PolarHBondContact O-CD2 3.49Å; V98-H100 VanDerWaalsContact O-CD2 3.25Å; V98-H100 PolarHBondContact O-N 3.33Å
99	V	90.6	Very high	88.9	Confident	75 Å²	75	72 Å²	72	46%	0.455	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	115.1	178.4	179.8	0	0	0	0	110.2
100	H	90.5	Very high	88.3	Confident	68 Å²	68	76 Å²	76	32%	0.315	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.2	174.9	-66	-81.9	0	0	0	110.6	S91 Y92 D94 V98	S91-H100 WeakPolarHBondContact CA-O 3.24Å; Y92-H100 HydrophobicContact CD1-CB 4.21Å; Y92-H100 HydrophobicContact CD2-CB 4.12Å; Y92-H100 HydrophobicContact CE1-CB 3.67Å; Y92-H100 HydrophobicContact CE2-CB 3.57Å; Y92-H100 AromaticContact CE2-CD2 3.96Å; Y92-H100 AromaticContact CE2-CG 3.97Å; Y92-H100 HydrophobicContact CG-CB 4.41Å; Y92-H100 PolarHBondContact N-O 3.37Å; Y92-H100 PolarHBondContact O-N 2.91Å; D94-H100 IonicContact OD2-CD2 2.75Å; D94-H100 PolarHBondContact OD2-CD2 2.9Å; D94-H100 IonicContact OD2-CE1 3.89Å; D94-H100 IonicContact OD2-NE2 2.89Å; D94-H100 PolarHBondContact OD2-NE2 2.95Å; V98-H100 PolarHBondContact O-CD2 3.49Å; V98-H100 VanDerWaalsContact O-CD2 3.25Å; V98-H100 PolarHBondContact O-N 3.33Å
101	W	89.6	Confident	87.9	Confident	135 Å²	135	77.3 Å²	77.3	51%	0.511	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.7	176.8	-65.6	90.2	0	0	0	110.1	W89 Y103	W89-W101 HydrophobicContact CE3-CE3 4.44Å; W89-W101 AromaticContact CE3-CZ3 3.93Å; W89-W101 HydrophobicContact CE3-CZ3 3.93Å; W89-W101 AromaticContact CZ3-CZ3 3.85Å; W89-W101 HydrophobicContact CZ3-CZ3 3.85Å; W101-Y103 HydrophobicContact CB-CD2 4.37Å; W101-Y103 HydrophobicContact CB-CE2 3.49Å; W101-Y103 VanDerWaalsContact CB-CE2 3.49Å
102	R	88.4	Confident	87.5	Confident	50 Å²	50	76.3 Å²	76.3	19%	0.189	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.6	173.1	-171.6	176.5	-66.6	159.8	0.1	110.3	M2 W89 S90 Y92 D104	M2-R102 VanDerWaalsContact CE-NH1 3.27Å; M2-R102 VanDerWaalsContact CE-NH2 3.29Å; M2-R102 PolarHBondContact SD-NH2 3.48Å; W89-R102 WeakPolarHBondContact CA-O 3.43Å; S90-R102 PolarHBondContact N-O 3.35Å; S90-R102 PolarHBondContact O-N 3.41Å; Y92-R102 HydrophobicContact CD1-CB 4.22Å; Y92-R102 HydrophobicContact CE1-CB 4Å; R102-D104 WeakPolarHBondContact CD-OD1 3.34Å; R102-D104 VanDerWaalsContact CD-OD2 3.23Å; R102-D104 WeakPolarHBondContact CD-OD2 3.19Å; R102-D104 VanDerWaalsContact CG-OD1 3.31Å; R102-D104 WeakPolarHBondContact CG-OD1 3.41Å; R102-D104 WeakPolarHBondContact CG-OD2 3.41Å
103	Y	91.3	Very high	87.1	Confident	33 Å²	33	77 Å²	77	13%	0.129	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	97.9	179.8	-62.2	-75.8	0	0	0	109.3	W89 W101 R183	W89-Y103 HydrophobicContact CB-CD1 3.91Å; W89-Y103 HydrophobicContact CB-CE1 4.1Å; W101-Y103 HydrophobicContact CB-CD2 4.37Å; W101-Y103 HydrophobicContact CB-CE2 3.49Å; W101-Y103 VanDerWaalsContact CB-CE2 3.49Å; Y103-R183 HydrophobicContact CD1-CB 3.65Å; Y103-R183 HydrophobicContact CE1-CB 3.27Å; Y103-R183 HydrophobicContact CE1-CG 4.09Å; Y103-R183 HydrophobicContact CE2-CB 4.34Å; Y103-R183 HydrophobicContact CG-CB 4.33Å
104	D	88.4	Confident	86.8	Confident	66 Å²	66	74.5 Å²	74.5	35%	0.353	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	146	-176.6	-55.4	-46.2	0	0	0	110.7	R88 R102	R88-D104 HydrophobicContact CB-CB 4.38Å; R88-D104 PolarHBondContact N-O 3Å; R88-D104 PolarHBondContact O-N 3.26Å; R102-D104 WeakPolarHBondContact CD-OD1 3.34Å; R102-D104 VanDerWaalsContact CD-OD2 3.23Å; R102-D104 WeakPolarHBondContact CD-OD2 3.19Å; R102-D104 VanDerWaalsContact CG-OD1 3.31Å; R102-D104 WeakPolarHBondContact CG-OD1 3.41Å; R102-D104 WeakPolarHBondContact CG-OD2 3.41Å
105	S	88.3	Confident	86.7	Confident	33 Å²	33	78.3 Å²	78.3	23%	0.231	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	143.2	174.9	68.9	0	0	0	0	110.9	G86 K107 N188	G86-S105 CarbonylContact O-C 3.26Å; G86-S105 WeakPolarHBondContact O-CA 3.27Å; S105-K107 PolarHBondContact O-N 3.01Å; S105-N188 VanDerWaalsContact OG-CB 3.32Å; S105-N188 WeakPolarHBondContact OG-CB 3.46Å; S105-N188 PolarHBondContact OG-OD1 3.23Å
106	R	85.3	Confident	86.4	Confident	119 Å²	119	76.7 Å²	76.7	45%	0.449	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-70.2	129.3	177.9	-175.9	-179.3	177.4	155.6	10.1	109.5	G86	G86-R106 WeakPolarHBondContact O-CB 3.42Å; G86-R106 PolarHBondContact O-N 2.96Å
107	K	82.4	Confident	86.2	Confident	175 Å²	175	78.3 Å²	78.3	76%	0.761	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-57.5	139.1	171.4	-67.1	179.5	-178.7	174.4	0	110.2	S105 S109	S105-K107 PolarHBondContact O-N 3.01Å; K107-S109 PolarHBondContact O-N 3.38Å
108	P	79.1	Confident	86.1	Confident	97 Å²	97	79.8 Å²	79.8	63%	0.63	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-51.8	131.1	175.2	-25.5	33.9	0	0	0	110.5
109	S	79.9	Confident	85.9	Confident	18 Å²	18	77.1 Å²	77.1	13%	0.126	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-72	153.9	175	69	0	0	0	0	109.8	K107 I111 D112 S113 R130	K107-S109 PolarHBondContact O-N 3.38Å; S109-I111 PolarHBondContact O-N 2.81Å; S109-D112 WeakPolarHBondContact CB-OD2 3.38Å; S109-D112 PolarHBondContact N-OD2 3.38Å; S109-D112 WeakPolarHBondContact O-CA 3.24Å; S109-D112 WeakPolarHBondContact O-CB 3.38Å; S109-D112 PolarHBondContact O-N 3.27Å; S109-D112 PolarHBondContact OG-OD2 2.83Å; S109-S113 PolarHBondContact O-N 2.83Å; S109-R130 PolarHBondContact OG-NH1 3.04Å
110	P	80.2	Confident	85.8	Confident	108 Å²	108	76.2 Å²	76.2	70%	0.701	42%	0.421	S	S	*	.	H	α-helix	trans	-53.2	-32.8	177.7	-27.9	35.2	0	0	0	113.1	D112 S113 A114	P110-D112 VanDerWaalsContact C-N 3.31Å; P110-D112 PolarHBondContact O-N 2.93Å; P110-S113 PolarHBondContact O-N 3.41Å; P110-S113 PolarHBondContact O-OG 3.29Å; P110-A114 VanDerWaalsContact O-CB 3.23Å; P110-A114 WeakPolarHBondContact O-CB 3.25Å; P110-A114 PolarHBondContact O-N 3.25Å
111	I	81.9	Confident	85.7	Confident	46 Å²	46	83.8 Å²	83.8	24%	0.236	45%	0.447	C	S	.	.	H	α-helix	trans	-63	-34.4	174.6	-66.6	171.4	0	0	0	112.1	S109 L119 E123 R127	S109-I111 PolarHBondContact O-N 2.81Å; I111-L119 HydrophobicContact CB-CD2 4.26Å; I111-L119 HydrophobicContact CG1-CD2 4.48Å; I111-L119 HydrophobicContact CG2-CD2 3.71Å; I111-E123 HydrophobicContact CD1-CG 4.16Å; I111-E123 HydrophobicContact CG1-CG 4.39Å; I111-E123 HydrophobicContact CG2-CB 4.3Å; I111-R127 HydrophobicContact CG2-CB 4.1Å
112	D	82	Confident	85.6	Confident	45 Å²	45	87.9 Å²	87.9	24%	0.241	46%	0.462	C	S	.	.	H	α-helix	trans	-77.2	-30.7	-178.3	-55.9	-43.9	0	0	0	111.7	S109 P110 R127 R130	S109-D112 WeakPolarHBondContact CB-OD2 3.38Å; S109-D112 PolarHBondContact N-OD2 3.38Å; S109-D112 WeakPolarHBondContact O-CA 3.24Å; S109-D112 WeakPolarHBondContact O-CB 3.38Å; S109-D112 PolarHBondContact O-N 3.27Å; S109-D112 PolarHBondContact OG-OD2 2.83Å; P110-D112 VanDerWaalsContact C-N 3.31Å; P110-D112 PolarHBondContact O-N 2.93Å; D112-R127 VanDerWaalsContact O-CZ 3.31Å; D112-R127 PolarHBondContact O-NH2 3.02Å; D112-R130 IonicContact OD1-NH1 2.75Å; D112-R130 PolarHBondContact OD1-NH1 3.47Å; D112-R130 IonicContact OD2-NH1 3.22Å; D112-R130 PolarHBondContact OD2-NH1 3.25Å
113	S	82.3	Confident	85.5	Confident	91 Å²	91	88.9 Å²	88.9	64%	0.636	47%	0.469	S	S	*	.	H	α-helix	trans	-94.8	-12.2	178.7	61.3	0	0	0	0	114.6	S109 P110	S109-S113 PolarHBondContact O-N 2.83Å; P110-S113 PolarHBondContact O-N 3.41Å; P110-S113 PolarHBondContact O-OG 3.29Å
114	A	85.4	Confident	85.3	Confident	28 Å²	28	89.7 Å²	89.7	23%	0.231	48%	0.475	C	S	.	.	S	Bend	trans	-69.7	148.5	179.2	0	0	0	0	0	112.4	P110 L119 R127	P110-A114 VanDerWaalsContact O-CB 3.23Å; P110-A114 WeakPolarHBondContact O-CB 3.25Å; P110-A114 PolarHBondContact O-N 3.25Å; A114-L119 HydrophobicContact CB-CD1 3.97Å; A114-L119 HydrophobicContact CB-CD2 4.33Å; A114-L119 HydrophobicContact CB-CG 4.08Å; A114-R127 PolarHBondContact O-NH1 3.32Å
115	D	87.1	Confident	85.2	Confident	120 Å²	120	89.3 Å²	89.3	64%	0.642	48%	0.481	S	S	*	.			trans	-63.3	133.5	172.4	-78.1	-30.9	0	0	0	110.3	S117 S118 L119	D115-S117 PolarHBondContact O-N 3.26Å; D115-S118 PolarHBondContact O-N 3.03Å; D115-S118 PolarHBondContact O-OG 2.98Å; D115-L119 WeakPolarHBondContact O-CD1 3.43Å
116	V	88.1	Confident	85.1	Confident	88 Å²	88	89.3 Å²	89.3	53%	0.533	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-53.6	-31.7	-175.6	-179.2	0	0	0	0	112.1	L124	V116-L124 HydrophobicContact CG1-CD1 4.02Å
117	S	87.3	Confident	85.1	Confident	118 Å²	118	86.8 Å²	86.8	83%	0.825	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-72.5	-22.7	178.3	51.3	0	0	0	0	114.8	D115	D115-S117 PolarHBondContact O-N 3.26Å
118	S	88.2	Confident	85.3	Confident	85 Å²	85	83.8 Å²	83.8	59%	0.594	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-90.8	-8.1	179.9	70.4	0	0	0	0	113.3	D115	D115-S118 PolarHBondContact O-N 3.03Å; D115-S118 PolarHBondContact O-OG 2.98Å
119	L	87.1	Confident	85.7	Confident	21 Å²	21	80.8 Å²	80.8	11%	0.11	45%	0.447	C	S	.	.	S	Bend	trans	-86.5	136.6	-176.7	-74	133.9	0	0	0	111.6	I111 A114 D115 E123	I111-L119 HydrophobicContact CB-CD2 4.26Å; I111-L119 HydrophobicContact CG1-CD2 4.48Å; I111-L119 HydrophobicContact CG2-CD2 3.71Å; A114-L119 HydrophobicContact CB-CD1 3.97Å; A114-L119 HydrophobicContact CB-CD2 4.33Å; A114-L119 HydrophobicContact CB-CG 4.08Å; D115-L119 WeakPolarHBondContact O-CD1 3.43Å; L119-E123 HydrophobicContact CB-CB 4.29Å; L119-E123 HydrophobicContact CD2-CB 3.48Å; L119-E123 VanDerWaalsContact CD2-CB 3.48Å; L119-E123 HydrophobicContact CD2-CG 4.45Å; L119-E123 HydrophobicContact CG-CB 4.49Å
120	S	89.3	Confident	86	Confident	56 Å²	56	82.7 Å²	82.7	39%	0.392	45%	0.451	S	S	.	.			trans	-64.4	157	167.8	68.7	0	0	0	0	111	R122 E123 L124	S120-R122 PolarHBondContact O-N 3.46Å; S120-R122 VanDerWaalsContact O-N 3.08Å; S120-E123 VanDerWaalsContact CB-OE2 3.29Å; S120-E123 WeakPolarHBondContact CB-OE2 3.32Å; S120-E123 PolarHBondContact N-OE2 3.5Å; S120-E123 PolarHBondContact O-N 2.94Å; S120-E123 VanDerWaalsContact OG-CD 3.28Å; S120-E123 VanDerWaalsContact OG-CG 3.27Å; S120-E123 WeakPolarHBondContact OG-CG 3.1Å; S120-E123 PolarHBondContact OG-N 2.93Å; S120-E123 PolarHBondContact OG-OE2 3.26Å; S120-L124 PolarHBondContact O-N 3.31Å
121	R	88.8	Confident	86.4	Confident	228 Å²	228	82.3 Å²	82.3	86%	0.86	44%	0.44	S	S	*	.	H	α-helix	trans	-53.1	-34.5	176.5	-173.6	-179.2	-70.5	-124.8	0.8	112.6	A125	R121-A125 WeakPolarHBondContact O-CB 3.38Å; R121-A125 PolarHBondContact O-N 3.44Å; R121-A125 VanDerWaalsContact O-N 3.09Å
122	R	86.5	Confident	86.9	Confident	220 Å²	220	85.9 Å²	85.9	83%	0.83	46%	0.456	S	S	*	.	H	α-helix	trans	-70.2	-42.7	178.2	179.8	175.6	170.5	145.2	-3.8	111.9	S120 A125 A126	S120-R122 PolarHBondContact O-N 3.46Å; S120-R122 VanDerWaalsContact O-N 3.08Å; R122-A125 PolarHBondContact O-N 3.07Å; R122-A126 WeakPolarHBondContact O-CB 3.46Å; R122-A126 PolarHBondContact O-N 3.16Å
123	E	86.3	Confident	87.3	Confident	71 Å²	71	85 Å²	85	33%	0.332	45%	0.451	S	S	.	.	H	α-helix	trans	-70.4	-38.6	178.3	-66.7	162.8	130.8	0	0	111.5	I111 L119 S120 A125 A126 R127	I111-E123 HydrophobicContact CD1-CG 4.16Å; I111-E123 HydrophobicContact CG1-CG 4.39Å; I111-E123 HydrophobicContact CG2-CB 4.3Å; L119-E123 HydrophobicContact CB-CB 4.29Å; L119-E123 HydrophobicContact CD2-CB 3.48Å; L119-E123 VanDerWaalsContact CD2-CB 3.48Å; L119-E123 HydrophobicContact CD2-CG 4.45Å; L119-E123 HydrophobicContact CG-CB 4.49Å; S120-E123 VanDerWaalsContact CB-OE2 3.29Å; S120-E123 WeakPolarHBondContact CB-OE2 3.32Å; S120-E123 PolarHBondContact N-OE2 3.5Å; S120-E123 PolarHBondContact O-N 2.94Å; S120-E123 VanDerWaalsContact OG-CD 3.28Å; S120-E123 VanDerWaalsContact OG-CG 3.27Å; S120-E123 WeakPolarHBondContact OG-CG 3.1Å; S120-E123 PolarHBondContact OG-N 2.93Å; S120-E123 PolarHBondContact OG-OE2 3.26Å; E123-A125 PolarHBondContact O-N 2.85Å; E123-A126 WeakPolarHBondContact O-CB 3.23Å; E123-A126 PolarHBondContact O-N 2.83Å; E123-R127 PolarHBondContact O-N 3.3Å
124	L	87.5	Confident	87.8	Confident	50 Å²	50	82.4 Å²	82.4	26%	0.262	43%	0.433	S	S	.	.	H	α-helix	trans	-59.8	-46.7	173.5	-174.7	63.1	0	0	0	111.3	V116 S120 A126 R127 M128	V116-L124 HydrophobicContact CG1-CD1 4.02Å; S120-L124 PolarHBondContact O-N 3.31Å; L124-A126 VanDerWaalsContact C-N 3.3Å; L124-A126 PolarHBondContact O-N 3.42Å; L124-R127 PolarHBondContact O-N 2.91Å; L124-M128 HydrophobicContact CD1-CE 3.97Å; L124-M128 HydrophobicContact CD2-CE 4.12Å; L124-M128 HydrophobicContact CG-CE 3.87Å; L124-M128 HydrophobicContact CG-SD 4.47Å; L124-M128 WeakPolarHBondContact O-CG 3.46Å; L124-M128 PolarHBondContact O-N 3.49Å
125	A	86.8	Confident	88.2	Confident	58 Å²	58	88 Å²	88	48%	0.479	45%	0.448	S	S	.	.	H	α-helix	trans	-61	-38.7	175	0	0	0	0	0	112.2	R121 R122 E123 A129	R121-A125 WeakPolarHBondContact O-CB 3.38Å; R121-A125 PolarHBondContact O-N 3.44Å; R121-A125 VanDerWaalsContact O-N 3.09Å; R122-A125 PolarHBondContact O-N 3.07Å; E123-A125 PolarHBondContact O-N 2.85Å; A125-A129 WeakPolarHBondContact O-CB 3.41Å; A125-A129 PolarHBondContact O-N 3.25Å
126	A	84.8	Confident	88.5	Confident	33 Å²	33	85.2 Å²	85.2	27%	0.273	43%	0.433	S	S	.	.	H	α-helix	trans	-66.3	-42.1	176.2	0	0	0	0	0	112.6	R122 E123 L124 A129 R130	R122-A126 WeakPolarHBondContact O-CB 3.46Å; R122-A126 PolarHBondContact O-N 3.16Å; E123-A126 WeakPolarHBondContact O-CB 3.23Å; E123-A126 PolarHBondContact O-N 2.83Å; L124-A126 VanDerWaalsContact C-N 3.3Å; L124-A126 PolarHBondContact O-N 3.42Å; A126-A129 PolarHBondContact O-N 3.44Å; A126-R130 PolarHBondContact O-N 3.23Å
127	R	85.3	Confident	88.8	Confident	66 Å²	66	81 Å²	81	25%	0.249	41%	0.408	C	S	.	.	H	α-helix	trans	-61.2	-47.9	175	-175.6	178.9	178.8	169.3	1.6	111.2	I111 D112 A114 E123 L124 A129 R130 Q131	I111-R127 HydrophobicContact CG2-CB 4.1Å; D112-R127 VanDerWaalsContact O-CZ 3.31Å; D112-R127 PolarHBondContact O-NH2 3.02Å; A114-R127 PolarHBondContact O-NH1 3.32Å; E123-R127 PolarHBondContact O-N 3.3Å; L124-R127 PolarHBondContact O-N 2.91Å; R127-A129 PolarHBondContact O-N 3.27Å; R127-R130 PolarHBondContact O-N 2.78Å; R127-Q131 PolarHBondContact O-N 3.08Å
128	M	87.8	Confident	89.2	Confident	112 Å²	112	78 Å²	78	55%	0.552	38%	0.378	S	S	*	.	H	α-helix	trans	-60.4	-45.4	177	-71.6	-179.6	177.2	0	0	111.8	L124 R130 Q131 Q132	L124-M128 HydrophobicContact CD1-CE 3.97Å; L124-M128 HydrophobicContact CD2-CE 4.12Å; L124-M128 HydrophobicContact CG-CE 3.87Å; L124-M128 HydrophobicContact CG-SD 4.47Å; L124-M128 WeakPolarHBondContact O-CG 3.46Å; L124-M128 PolarHBondContact O-N 3.49Å; M128-R130 PolarHBondContact O-N 3.49Å; M128-Q131 PolarHBondContact O-N 2.98Å; M128-Q132 PolarHBondContact O-N 2.92Å
129	A	87.6	Confident	89.5	Confident	34 Å²	34	80.5 Å²	80.5	28%	0.281	38%	0.382	S	S	.	.	H	α-helix	trans	-60.1	-46.6	176.6	0	0	0	0	0	111.6	A125 A126 R127 Q131 Q132 L133	A125-A129 WeakPolarHBondContact O-CB 3.41Å; A125-A129 PolarHBondContact O-N 3.25Å; A126-A129 PolarHBondContact O-N 3.44Å; R127-A129 PolarHBondContact O-N 3.27Å; A129-Q131 VanDerWaalsContact C-N 3.34Å; A129-Q131 PolarHBondContact O-N 2.92Å; A129-Q132 PolarHBondContact O-N 2.95Å; A129-L133 WeakPolarHBondContact O-CB 3.34Å; A129-L133 WeakPolarHBondContact O-CG 3.29Å; A129-L133 PolarHBondContact O-N 3.42Å
130	R	85.8	Confident	89.9	Confident	58 Å²	58	79.5 Å²	79.5	22%	0.219	38%	0.377	C	S	.	.	H	α-helix	trans	-59.7	-43.9	176.4	179.5	180	-83.3	144.6	-7.6	111.7	S109 D112 A126 R127 M128 Q132 L133 S134	S109-R130 PolarHBondContact OG-NH1 3.04Å; D112-R130 IonicContact OD1-NH1 2.75Å; D112-R130 PolarHBondContact OD1-NH1 3.47Å; D112-R130 IonicContact OD2-NH1 3.22Å; D112-R130 PolarHBondContact OD2-NH1 3.25Å; A126-R130 PolarHBondContact O-N 3.23Å; R127-R130 PolarHBondContact O-N 2.78Å; M128-R130 PolarHBondContact O-N 3.49Å; R130-Q132 VanDerWaalsContact C-N 3.34Å; R130-Q132 PolarHBondContact O-N 3.33Å; R130-L133 PolarHBondContact O-N 2.98Å; R130-S134 WeakPolarHBondContact O-CB 3.35Å; R130-S134 PolarHBondContact O-N 3.4Å
131	Q	88.7	Confident	90.1	Very high	100 Å²	100	77.1 Å²	77.1	47%	0.467	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-41.7	178.4	-165.2	-179	5.9	0	0	111.6	R127 M128 A129 S134 R135	R127-Q131 PolarHBondContact O-N 3.08Å; M128-Q131 PolarHBondContact O-N 2.98Å; A129-Q131 VanDerWaalsContact C-N 3.34Å; A129-Q131 PolarHBondContact O-N 2.92Å; Q131-S134 PolarHBondContact O-N 3.3Å; Q131-R135 VanDerWaalsContact O-CG 3.29Å; Q131-R135 WeakPolarHBondContact O-CG 3.48Å; Q131-R135 PolarHBondContact O-N 2.96Å
132	Q	91.3	Very high	90.5	Very high	121 Å²	121	70.7 Å²	70.7	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-64.4	-42.8	175.6	-174.8	177	-0.5	0	0	112	M128 A129 R130 S134 R135 L136	M128-Q132 PolarHBondContact O-N 2.92Å; A129-Q132 PolarHBondContact O-N 2.95Å; R130-Q132 VanDerWaalsContact C-N 3.34Å; R130-Q132 PolarHBondContact O-N 3.33Å; Q132-S134 PolarHBondContact O-N 3.13Å; Q132-R135 PolarHBondContact O-N 2.98Å; Q132-L136 HydrophobicContact CG-CD1 4.39Å; Q132-L136 WeakPolarHBondContact O-CG 3.17Å; Q132-L136 PolarHBondContact O-N 3.49Å
133	L	92	Very high	90.9	Very high	26 Å²	26	61.3 Å²	61.3	14%	0.136	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-42.9	177	-68.9	169.7	0	0	0	111.9	R30 V34 L84 A129 R130 L136 F137	R30-L133 HydrophobicContact CB-CD1 3.94Å; R30-L133 HydrophobicContact CG-CD1 4.25Å; V34-L133 HydrophobicContact CG2-CD2 3.25Å; L84-L133 HydrophobicContact CD2-CB 4.22Å; L84-L133 HydrophobicContact CD2-CD2 4.12Å; A129-L133 WeakPolarHBondContact O-CB 3.34Å; A129-L133 WeakPolarHBondContact O-CG 3.29Å; A129-L133 PolarHBondContact O-N 3.42Å; R130-L133 PolarHBondContact O-N 2.98Å; L133-L136 PolarHBondContact O-N 3.29Å; L133-F137 PolarHBondContact O-N 3.49Å
134	S	91.5	Very high	91.3	Very high	37 Å²	37	58 Å²	58	26%	0.259	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-45.4	174	175	0	0	0	0	111.5	R130 Q131 Q132 L136 F137 W138	R130-S134 WeakPolarHBondContact O-CB 3.35Å; R130-S134 PolarHBondContact O-N 3.4Å; Q131-S134 PolarHBondContact O-N 3.3Å; Q132-S134 PolarHBondContact O-N 3.13Å; S134-L136 PolarHBondContact O-N 3.41Å; S134-F137 WeakPolarHBondContact O-CB 3.44Å; S134-F137 PolarHBondContact O-N 2.96Å; S134-W138 PolarHBondContact O-N 3.42Å; S134-W138 VanDerWaalsContact O-N 3.07Å
135	R	94	Very high	91.6	Very high	145 Å²	145	56.6 Å²	56.6	55%	0.547	29%	0.292	S	S	.	.	H	α-helix	trans	-59.3	-46.3	175	-68.1	173.3	-157.5	179.7	6	111.8	Q131 Q132 F137 W138 M139	Q131-R135 VanDerWaalsContact O-CG 3.29Å; Q131-R135 WeakPolarHBondContact O-CG 3.48Å; Q131-R135 PolarHBondContact O-N 2.96Å; Q132-R135 PolarHBondContact O-N 2.98Å; R135-F137 VanDerWaalsContact C-N 3.3Å; R135-F137 PolarHBondContact O-N 2.96Å; R135-W138 PolarHBondContact O-N 2.95Å; R135-M139 WeakPolarHBondContact O-CB 3.4Å; R135-M139 VanDerWaalsContact O-CG 3.22Å; R135-M139 WeakPolarHBondContact O-CG 3.13Å; R135-M139 PolarHBondContact O-N 3.31Å
136	L	94.1	Very high	92.1	Very high	63 Å²	63	56.5 Å²	56.5	33%	0.33	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-39.3	178.4	-73.6	173.2	0	0	0	112.1	F38 Q132 L133 S134 G140	F38-L136 HydrophobicContact CE2-CB 4.36Å; F38-L136 HydrophobicContact CZ-CB 4.5Å; Q132-L136 HydrophobicContact CG-CD1 4.39Å; Q132-L136 WeakPolarHBondContact O-CG 3.17Å; Q132-L136 PolarHBondContact O-N 3.49Å; L133-L136 PolarHBondContact O-N 3.29Å; S134-L136 PolarHBondContact O-N 3.41Å; L136-G140 PolarHBondContact O-N 3.1Å
137	F	94.7	Very high	92.6	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.3	-53.8	174.3	171.3	-92.5	0	0	0	111.1	H37 L84 V85 L133 S134 R135 M139 G140 L141 Y181	H37-F137 AromaticContact CE1-CD2 3.55Å; H37-F137 AromaticContact CE1-CE2 3.84Å; H37-F137 AromaticContact NE2-CD2 3.97Å; H37-F137 PolarHBondContact NE2-O 3.43Å; L84-F137 HydrophobicContact CB-CB 3.98Å; L84-F137 HydrophobicContact CB-CD2 4.29Å; L84-F137 HydrophobicContact CB-CG 4.37Å; L84-F137 HydrophobicContact CD1-CB 4.06Å; L84-F137 HydrophobicContact CD1-CD2 4.16Å; V85-F137 HydrophobicContact CB-CD1 4.16Å; V85-F137 HydrophobicContact CB-CE1 4.35Å; V85-F137 HydrophobicContact CG1-CB 3.88Å; V85-F137 HydrophobicContact CG1-CD1 3.26Å; V85-F137 HydrophobicContact CG1-CE1 3.89Å; V85-F137 HydrophobicContact CG1-CG 3.66Å; V85-F137 HydrophobicContact CG2-CD1 3.77Å; V85-F137 HydrophobicContact CG2-CD2 4.44Å; V85-F137 HydrophobicContact CG2-CE1 3.53Å; V85-F137 HydrophobicContact CG2-CE2 4.25Å; V85-F137 HydrophobicContact CG2-CG 4.2Å; V85-F137 HydrophobicContact CG2-CZ 3.79Å; L133-F137 PolarHBondContact O-N 3.49Å; S134-F137 WeakPolarHBondContact O-CB 3.44Å; S134-F137 PolarHBondContact O-N 2.96Å; R135-F137 VanDerWaalsContact C-N 3.3Å; R135-F137 PolarHBondContact O-N 2.96Å; F137-M139 PolarHBondContact O-N 3.31Å; F137-G140 PolarHBondContact O-N 3.37Å; F137-L141 HydrophobicContact CE1-CD2 3.76Å; F137-L141 HydrophobicContact CZ-CD2 4.04Å; F137-L141 VanDerWaalsContact O-CB 3.27Å; F137-L141 WeakPolarHBondContact O-CB 3.21Å; F137-L141 PolarHBondContact O-N 2.92Å; F137-Y181 HydrophobicContact CE1-CD1 4.13Å; F137-Y181 HydrophobicContact CE1-CD2 4.39Å; F137-Y181 HydrophobicContact CE1-CE1 4.5Å; F137-Y181 HydrophobicContact CE1-CG 4.1Å; F137-Y181 HydrophobicContact CE2-CE2 4.43Å; F137-Y181 AromaticContact CZ-CD1 3.77Å; F137-Y181 HydrophobicContact CZ-CD1 3.77Å; F137-Y181 AromaticContact CZ-CD2 3.74Å; F137-Y181 HydrophobicContact CZ-CD2 3.74Å; F137-Y181 AromaticContact CZ-CE1 3.75Å; F137-Y181 HydrophobicContact CZ-CE1 3.75Å; F137-Y181 AromaticContact CZ-CE2 3.75Å; F137-Y181 HydrophobicContact CZ-CE2 3.75Å; F137-Y181 AromaticContact CZ-CG 3.8Å; F137-Y181 HydrophobicContact CZ-CG 3.8Å; F137-Y181 AromaticContact CZ-CZ 3.77Å
138	W	95.1	Very high	93.2	Very high	53 Å²	53	55 Å²	55	20%	0.201	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-40.6	-179.8	-75.1	108.4	0	0	0	112.7	L87 S134 R135 G140 L141 I142 I182 W185	L87-W138 HydrophobicContact CD1-CZ2 3.88Å; S134-W138 PolarHBondContact O-N 3.42Å; S134-W138 VanDerWaalsContact O-N 3.07Å; R135-W138 PolarHBondContact O-N 2.95Å; W138-G140 VanDerWaalsContact C-N 3.32Å; W138-G140 PolarHBondContact O-N 3.49Å; W138-L141 HydrophobicContact CE3-CD2 3.87Å; W138-L141 HydrophobicContact CZ3-CD2 3.85Å; W138-L141 PolarHBondContact O-N 3.28Å; W138-I142 HydrophobicContact CE3-CD1 4.32Å; W138-I142 WeakPolarHBondContact O-CB 3.34Å; W138-I142 WeakPolarHBondContact O-CG1 3.41Å; W138-I142 PolarHBondContact O-N 3.14Å; W138-I182 HydrophobicContact CZ3-CG1 4.15Å; W138-W185 HydrophobicContact CH2-CB 4.12Å; W138-W185 HydrophobicContact CZ2-CB 4.17Å; W138-W185 HydrophobicContact CZ2-CG 4.41Å
139	M	95	Very high	93.6	Very high	138 Å²	138	52.2 Å²	52.2	68%	0.68	27%	0.274	S	S	*	.	H	α-helix	trans	-60.5	-42.2	174.1	-73.2	-61.5	-63.7	0	0	111.7	R135 F137 G143	R135-M139 WeakPolarHBondContact O-CB 3.4Å; R135-M139 VanDerWaalsContact O-CG 3.22Å; R135-M139 WeakPolarHBondContact O-CG 3.13Å; R135-M139 PolarHBondContact O-N 3.31Å; F137-M139 PolarHBondContact O-N 3.31Å; M139-G143 VanDerWaalsContact O-CA 3.31Å; M139-G143 WeakPolarHBondContact O-CA 3.27Å; M139-G143 PolarHBondContact O-N 3.43Å
140	G	94	Very high	94	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-44.8	175.3	0	0	0	0	0	112.5	R41 L136 F137 W138 S144	R41-G140 PolarHBondContact NH1-O 3.43Å; L136-G140 PolarHBondContact O-N 3.1Å; F137-G140 PolarHBondContact O-N 3.37Å; W138-G140 VanDerWaalsContact C-N 3.32Å; W138-G140 PolarHBondContact O-N 3.49Å; G140-S144 WeakPolarHBondContact O-CB 3.39Å; G140-S144 PolarHBondContact O-N 3.48Å
141	L	95.1	Very high	94.4	Very high	5 Å²	5	54.9 Å²	54.9	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-44.3	-177.6	-176.5	66.6	0	0	0	112.3	V76 F137 W138 P145 N177 V178 Y181	V76-L141 HydrophobicContact CG1-CD1 3.96Å; F137-L141 HydrophobicContact CE1-CD2 3.76Å; F137-L141 HydrophobicContact CZ-CD2 4.04Å; F137-L141 VanDerWaalsContact O-CB 3.27Å; F137-L141 WeakPolarHBondContact O-CB 3.21Å; F137-L141 PolarHBondContact O-N 2.92Å; W138-L141 HydrophobicContact CE3-CD2 3.87Å; W138-L141 HydrophobicContact CZ3-CD2 3.85Å; W138-L141 PolarHBondContact O-N 3.28Å; L141-P145 WeakPolarHBondContact O-CD 3.45Å; L141-N177 HydrophobicContact CD1-CB 3.87Å; L141-V178 HydrophobicContact CD1-CG2 4.05Å; L141-V178 HydrophobicContact CG-CG2 3.86Å; L141-V178 VanDerWaalsContact O-CG2 3.28Å; L141-V178 WeakPolarHBondContact O-CG2 3.29Å; L141-Y181 HydrophobicContact CD1-CD2 3.96Å; L141-Y181 HydrophobicContact CD2-CD2 3.71Å; L141-Y181 HydrophobicContact CD2-CG 3.92Å
142	I	95.6	Very high	94.7	Very high	93 Å²	93	52.6 Å²	52.6	48%	0.477	28%	0.277	S	S	.	.	H	α-helix	trans	-83.9	-36.8	179.4	-62.5	169.4	0	0	0	111.3	W138 S144 P145 A146	W138-I142 HydrophobicContact CE3-CD1 4.32Å; W138-I142 WeakPolarHBondContact O-CB 3.34Å; W138-I142 WeakPolarHBondContact O-CG1 3.41Å; W138-I142 PolarHBondContact O-N 3.14Å; I142-S144 VanDerWaalsContact C-N 3.3Å; I142-S144 PolarHBondContact O-N 2.83Å; I142-P145 VanDerWaalsContact O-CD 3.23Å; I142-P145 WeakPolarHBondContact O-CD 3.37Å; I142-P145 VanDerWaalsContact O-CG 3.3Å; I142-P145 WeakPolarHBondContact O-CG 3.47Å; I142-A146 PolarHBondContact O-N 3Å
143	G	95.3	Very high	94.9	Very high	23 Å²	23	50.5 Å²	50.5	24%	0.237	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-32.3	-179.6	0	0	0	0	0	113	M139 A146 I147	M139-G143 VanDerWaalsContact O-CA 3.31Å; M139-G143 WeakPolarHBondContact O-CA 3.27Å; M139-G143 PolarHBondContact O-N 3.43Å; G143-A146 PolarHBondContact O-N 2.87Å; G143-I147 VanDerWaalsContact O-CG1 3.27Å; G143-I147 WeakPolarHBondContact O-CG1 3.3Å; G143-I147 PolarHBondContact O-N 2.89Å
144	S	94.5	Very high	95	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-60.1	178.6	-170.8	0	0	0	0	114.1	R41 G140 I142 A146 I147 W148 N174	R41-S144 WeakPolarHBondContact CD-OG 3.47Å; G140-S144 WeakPolarHBondContact O-CB 3.39Å; G140-S144 PolarHBondContact O-N 3.48Å; I142-S144 VanDerWaalsContact C-N 3.3Å; I142-S144 PolarHBondContact O-N 2.83Å; S144-A146 PolarHBondContact O-N 3.28Å; S144-I147 PolarHBondContact O-N 3.06Å; S144-W148 VanDerWaalsContact O-CD1 3.25Å; S144-W148 PolarHBondContact O-N 3.49Å; S144-N174 WeakPolarHBondContact CB-OD1 3.43Å; S144-N174 PolarHBondContact OG-ND2 2.95Å; S144-N174 PolarHBondContact OG-OD1 3.49Å
145	P	95.6	Very high	94.9	Very high	19 Å²	19	50.4 Å²	50.4	12%	0.123	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-30.2	178.2	27.4	-36.4	0	0	0	112	L141 I142 W148 C149 L171 N174 V178	L141-P145 WeakPolarHBondContact O-CD 3.45Å; I142-P145 VanDerWaalsContact O-CD 3.23Å; I142-P145 WeakPolarHBondContact O-CD 3.37Å; I142-P145 VanDerWaalsContact O-CG 3.3Å; I142-P145 WeakPolarHBondContact O-CG 3.47Å; P145-W148 PolarHBondContact O-N 3.22Å; P145-C149 WeakPolarHBondContact O-CB 3.45Å; P145-C149 PolarHBondContact O-N 3.05Å; P145-L171 HydrophobicContact CB-CD2 4.27Å; P145-L171 WeakPolarHBondContact O-CD2 3.31Å; P145-N174 HydrophobicContact CB-CB 3.98Å; P145-N174 HydrophobicContact CG-CB 4.42Å; P145-V178 HydrophobicContact CG-CG2 4.04Å
146	A	96.6	Very high	94.9	Very high	57 Å²	57	47.7 Å²	47.7	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-47.5	174.5	0	0	0	0	0	111.7	I142 G143 S144 C149 V150	I142-A146 PolarHBondContact O-N 3Å; G143-A146 PolarHBondContact O-N 2.87Å; S144-A146 PolarHBondContact O-N 3.28Å; A146-C149 WeakPolarHBondContact O-CB 3.37Å; A146-C149 PolarHBondContact O-N 3.44Å; A146-V150 PolarHBondContact O-N 3.36Å; A146-V150 VanDerWaalsContact O-N 3.15Å
147	I	96	Very high	94.8	Very high	68 Å²	68	52.9 Å²	52.9	35%	0.349	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-46.6	176.3	-68	164.9	0	0	0	110.8	L45 G143 S144 C149 V150 F151	L45-I147 HydrophobicContact CD1-CD1 4.36Å; L45-I147 HydrophobicContact CD1-CG2 4.06Å; L45-I147 HydrophobicContact CD2-CG2 3.72Å; G143-I147 VanDerWaalsContact O-CG1 3.27Å; G143-I147 WeakPolarHBondContact O-CG1 3.3Å; G143-I147 PolarHBondContact O-N 2.89Å; S144-I147 PolarHBondContact O-N 3.06Å; I147-C149 VanDerWaalsContact C-N 3.27Å; I147-C149 PolarHBondContact O-N 2.99Å; I147-V150 PolarHBondContact O-N 3.06Å; I147-F151 HydrophobicContact CG2-CD2 3.86Å; I147-F151 HydrophobicContact CG2-CE2 3.53Å; I147-F151 WeakPolarHBondContact O-CD2 3.32Å; I147-F151 PolarHBondContact O-N 3.5Å; I147-F151 VanDerWaalsContact O-N 3.15Å
148	W	96.5	Very high	94.6	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.7	-30.9	177.8	-77.3	112.7	0	0	0	113.1	A44 L45 Y48 I65 L69 S144 P145 F151 F152 C167 A170 L171	A44-W148 HydrophobicContact CB-CZ2 4.14Å; L45-W148 HydrophobicContact CD2-CD2 4.31Å; L45-W148 HydrophobicContact CD2-CH2 4.27Å; L45-W148 HydrophobicContact CD2-CZ2 3.77Å; L45-W148 HydrophobicContact CG-CZ2 4.49Å; Y48-W148 HydrophobicContact CD2-CH2 4.13Å; Y48-W148 AromaticContact CD2-CZ3 3.81Å; Y48-W148 HydrophobicContact CD2-CZ3 3.81Å; Y48-W148 HydrophobicContact CE2-CZ3 4.12Å; Y48-W148 HydrophobicContact CG-CH2 4.37Å; Y48-W148 HydrophobicContact CG-CZ3 4.27Å; I65-W148 HydrophobicContact CG2-CH2 4.23Å; L69-W148 HydrophobicContact CD2-CZ2 3.9Å; S144-W148 VanDerWaalsContact O-CD1 3.25Å; S144-W148 PolarHBondContact O-N 3.49Å; P145-W148 PolarHBondContact O-N 3.22Å; W148-F151 PolarHBondContact O-N 2.97Å; W148-F152 VanDerWaalsContact O-CB 3.31Å; W148-F152 WeakPolarHBondContact O-CB 3.38Å; W148-F152 PolarHBondContact O-N 2.93Å; W148-C167 HydrophobicContact CE3-CB 4.42Å; W148-A170 HydrophobicContact CB-CB 4.37Å; W148-A170 HydrophobicContact CD2-CB 3.37Å; W148-A170 HydrophobicContact CE3-CB 3.67Å; W148-A170 HydrophobicContact CG-CB 3.7Å; W148-A170 HydrophobicContact CH2-CB 4.33Å; W148-A170 HydrophobicContact CZ2-CB 4.09Å; W148-A170 HydrophobicContact CZ3-CB 4.14Å; W148-L171 HydrophobicContact CB-CD2 3.94Å; W148-L171 HydrophobicContact CB-CG 4.17Å
149	C	96.5	Very high	94.2	Very high	53 Å²	53	60.4 Å²	60.4	36%	0.358	34%	0.339	S	S	.	.	H	α-helix	trans	-65.8	-42	174.3	-172.6	0	0	0	0	111.2	P145 A146 I147 F151 F152 L153 L171	P145-C149 WeakPolarHBondContact O-CB 3.45Å; P145-C149 PolarHBondContact O-N 3.05Å; A146-C149 WeakPolarHBondContact O-CB 3.37Å; A146-C149 PolarHBondContact O-N 3.44Å; I147-C149 VanDerWaalsContact C-N 3.27Å; I147-C149 PolarHBondContact O-N 2.99Å; C149-F151 PolarHBondContact O-N 2.79Å; C149-F152 WeakPolarHBondContact O-CB 3.36Å; C149-F152 PolarHBondContact O-N 3.29Å; C149-L153 WeakPolarHBondContact O-CG 3.47Å; C149-L153 PolarHBondContact O-N 3.05Å; C149-L171 HydrophobicContact CB-CD2 4.16Å
150	V	96	Very high	93.8	Very high	97 Å²	97	58.6 Å²	58.6	59%	0.588	33%	0.329	S	S	*	.	H	α-helix	trans	-60.3	-46.5	174.2	174.6	0	0	0	0	110.9	A146 I147 L153 A154	A146-V150 PolarHBondContact O-N 3.36Å; A146-V150 VanDerWaalsContact O-N 3.15Å; I147-V150 PolarHBondContact O-N 3.06Å; V150-L153 PolarHBondContact O-N 2.89Å; V150-A154 WeakPolarHBondContact O-CB 3.48Å; V150-A154 PolarHBondContact O-N 2.87Å
151	F	94.3	Very high	93.6	Very high	51 Å²	51	65 Å²	65	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-65.1	-38.2	176.1	-72.8	-57.4	0	0	0	113	L45 Y48 I49 I147 W148 C149 A154 S155	L45-F151 HydrophobicContact CD2-CD2 4.27Å; L45-F151 HydrophobicContact CD2-CE2 3.9Å; Y48-F151 HydrophobicContact CD1-CD1 4.25Å; Y48-F151 HydrophobicContact CD1-CE1 4.35Å; Y48-F151 HydrophobicContact CD1-CG 4.45Å; Y48-F151 HydrophobicContact CE1-CB 4.25Å; Y48-F151 AromaticContact CE1-CD1 3.6Å; Y48-F151 HydrophobicContact CE1-CD1 3.6Å; Y48-F151 HydrophobicContact CE1-CE1 4.05Å; Y48-F151 AromaticContact CE1-CG 3.91Å; Y48-F151 HydrophobicContact CE1-CG 3.91Å; I49-F151 HydrophobicContact CD1-CZ 4.27Å; I49-F151 HydrophobicContact CG1-CZ 4.27Å; I147-F151 HydrophobicContact CG2-CD2 3.86Å; I147-F151 HydrophobicContact CG2-CE2 3.53Å; I147-F151 WeakPolarHBondContact O-CD2 3.32Å; I147-F151 PolarHBondContact O-N 3.5Å; I147-F151 VanDerWaalsContact O-N 3.15Å; W148-F151 PolarHBondContact O-N 2.97Å; C149-F151 PolarHBondContact O-N 2.79Å; F151-A154 PolarHBondContact O-N 2.66Å; F151-S155 WeakPolarHBondContact O-CB 3.42Å; F151-S155 PolarHBondContact O-N 3.01Å; F151-S155 PolarHBondContact O-OG 3.37Å
152	F	95.4	Very high	93.4	Very high	51 Å²	51	71.5 Å²	71.5	22%	0.224	39%	0.386	C	S	.	.	H	α-helix	trans	-59.4	-51.7	174.8	179.1	-107.7	0	0	0	110.8	W148 C149 A154 S155 L156 A164 C167 T168 L171	W148-F152 VanDerWaalsContact O-CB 3.31Å; W148-F152 WeakPolarHBondContact O-CB 3.38Å; W148-F152 PolarHBondContact O-N 2.93Å; C149-F152 WeakPolarHBondContact O-CB 3.36Å; C149-F152 PolarHBondContact O-N 3.29Å; F152-A154 PolarHBondContact O-N 3.35Å; F152-S155 PolarHBondContact O-N 3.16Å; F152-S155 PolarHBondContact O-OG 2.93Å; F152-L156 WeakPolarHBondContact O-CB 3.32Å; F152-L156 PolarHBondContact O-N 3.27Å; F152-A164 HydrophobicContact CE2-CB 4.33Å; F152-C167 HydrophobicContact CB-CB 3.74Å; F152-C167 HydrophobicContact CD2-CB 3.89Å; F152-C167 HydrophobicContact CG-CB 4.32Å; F152-T168 WeakPolarHBondContact CE2-OG1 3.37Å; F152-L171 HydrophobicContact CB-CD1 3.87Å; F152-L171 HydrophobicContact CD1-CD1 4.24Å; F152-L171 HydrophobicContact CD2-CD1 4.41Å; F152-L171 HydrophobicContact CG-CD1 3.92Å
153	L	95.4	Very high	93.2	Very high	78 Å²	78	69 Å²	69	41%	0.408	37%	0.37	S	S	.	.	H	α-helix	trans	-59.9	-45.6	177.3	-68.8	174.5	0	0	0	111.5	C149 V150 S155 L156 F157	C149-L153 WeakPolarHBondContact O-CG 3.47Å; C149-L153 PolarHBondContact O-N 3.05Å; V150-L153 PolarHBondContact O-N 2.89Å; L153-S155 VanDerWaalsContact C-N 3.34Å; L153-S155 PolarHBondContact O-N 3.44Å; L153-L156 PolarHBondContact O-N 3.49Å; L153-F157 HydrophobicContact CB-CD2 4.44Å; L153-F157 HydrophobicContact CB-CE2 4.27Å; L153-F157 WeakPolarHBondContact O-CD2 3.33Å; L153-F157 PolarHBondContact O-N 3.48Å
154	A	93.1	Very high	93.1	Very high	54 Å²	54	68.4 Å²	68.4	45%	0.446	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-44.2	176.3	0	0	0	0	0	112.1	V150 F151 F152 L156 S158	V150-A154 WeakPolarHBondContact O-CB 3.48Å; V150-A154 PolarHBondContact O-N 2.87Å; F151-A154 PolarHBondContact O-N 2.66Å; F152-A154 PolarHBondContact O-N 3.35Å; A154-L156 VanDerWaalsContact C-N 3.33Å; A154-L156 PolarHBondContact O-N 2.99Å; A154-S158 VanDerWaalsContact O-CB 3.23Å; A154-S158 WeakPolarHBondContact O-CB 3.48Å; A154-S158 PolarHBondContact O-N 3.09Å
155	S	91	Very high	93	Very high	6 Å²	6	73.7 Å²	73.7	4%	0.042	39%	0.386	C	S	.	.	H	α-helix	trans	-68.5	-31.3	178.4	71.9	0	0	0	0	113.3	F151 F152 L153 L159 H160 A164	F151-S155 WeakPolarHBondContact O-CB 3.42Å; F151-S155 PolarHBondContact O-N 3.01Å; F151-S155 PolarHBondContact O-OG 3.37Å; F152-S155 PolarHBondContact O-N 3.16Å; F152-S155 PolarHBondContact O-OG 2.93Å; L153-S155 VanDerWaalsContact C-N 3.34Å; L153-S155 PolarHBondContact O-N 3.44Å; S155-L159 PolarHBondContact O-N 2.81Å; S155-H160 PolarHBondContact O-N 3.01Å; S155-A164 WeakPolarHBondContact OG-CA 3.46Å; S155-A164 WeakPolarHBondContact OG-CB 3.48Å; S155-A164 PolarHBondContact OG-N 3.46Å
156	L	92.6	Very high	92.9	Very high	89 Å²	89	73 Å²	73	47%	0.466	38%	0.381	S	S	.	.	H	α-helix	trans	-70.9	-48.1	176.8	-171.1	67.3	0	0	0	110.8	F152 L153 A154 S158 L159	F152-L156 WeakPolarHBondContact O-CB 3.32Å; F152-L156 PolarHBondContact O-N 3.27Å; L153-L156 PolarHBondContact O-N 3.49Å; A154-L156 VanDerWaalsContact C-N 3.33Å; A154-L156 PolarHBondContact O-N 2.99Å; L156-S158 VanDerWaalsContact C-N 3.29Å; L156-S158 PolarHBondContact O-N 3.44Å; L156-L159 PolarHBondContact O-N 2.92Å; L156-L159 VanDerWaalsContact O-N 3.15Å
157	F	92.8	Very high	92.9	Very high	171 Å²	171	70.2 Å²	70.2	75%	0.75	36%	0.359	S	S	*	.	H	α-helix	trans	-66.4	-31	176	-70.5	-59.6	0	0	0	112.8	L153 L159	L153-F157 HydrophobicContact CB-CD2 4.44Å; L153-F157 HydrophobicContact CB-CE2 4.27Å; L153-F157 WeakPolarHBondContact O-CD2 3.33Å; L153-F157 PolarHBondContact O-N 3.48Å; F157-L159 VanDerWaalsContact C-N 3.26Å; F157-L159 PolarHBondContact O-N 3.35Å
158	S	90.2	Very high	92.9	Very high	66 Å²	66	69.8 Å²	69.8	46%	0.462	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	1	175.2	-163.6	0	0	0	0	114	A154 L156 H160	A154-S158 VanDerWaalsContact O-CB 3.23Å; A154-S158 WeakPolarHBondContact O-CB 3.48Å; A154-S158 PolarHBondContact O-N 3.09Å; L156-S158 VanDerWaalsContact C-N 3.29Å; L156-S158 PolarHBondContact O-N 3.44Å; S158-H160 PolarHBondContact O-N 3.38Å; S158-H160 VanDerWaalsContact O-N 3.1Å; S158-H160 PolarHBondContact OG-CD2 3.18Å; S158-H160 PolarHBondContact OG-NE2 3.03Å
159	L	87.8	Confident	92.9	Very high	145 Å²	145	71.7 Å²	71.7	76%	0.759	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	26.2	-177	-61.7	175.4	0	0	0	114.6	S155 L156 F157 I161	S155-L159 PolarHBondContact O-N 2.81Å; L156-L159 PolarHBondContact O-N 2.92Å; L156-L159 VanDerWaalsContact O-N 3.15Å; F157-L159 VanDerWaalsContact C-N 3.26Å; F157-L159 PolarHBondContact O-N 3.35Å; L159-I161 PolarHBondContact O-N 3.08Å; L159-I161 VanDerWaalsContact O-N 3.17Å
160	H	86.4	Confident	92.9	Very high	100 Å²	100	69.1 Å²	69.1	46%	0.463	35%	0.352	S	S	.	.			trans	-90.3	71.8	176.8	-73.1	-42.9	0	0	0	110.8	S155 S158 R162 W163 A164	S155-H160 PolarHBondContact O-N 3.01Å; S158-H160 PolarHBondContact O-N 3.38Å; S158-H160 VanDerWaalsContact O-N 3.1Å; S158-H160 PolarHBondContact OG-CD2 3.18Å; S158-H160 PolarHBondContact OG-NE2 3.03Å; H160-R162 PolarHBondContact O-N 3.25Å; H160-R162 VanDerWaalsContact O-N 3.08Å; H160-W163 HydrophobicContact CB-CB 4.28Å; H160-W163 WeakPolarHBondContact O-CA 3.47Å; H160-W163 WeakPolarHBondContact O-CB 3.46Å; H160-W163 PolarHBondContact O-N 3.01Å; H160-A164 PolarHBondContact O-N 3.38Å
161	I	89.3	Confident	92.9	Very high	136 Å²	136	65.8 Å²	65.8	70%	0.697	33%	0.33	S	S	*	.	H	α-helix	trans	-52.9	-37.2	-173.5	-57.3	176.7	0	0	0	112.9	L159 W163 A164 F165	L159-I161 PolarHBondContact O-N 3.08Å; L159-I161 VanDerWaalsContact O-N 3.17Å; I161-W163 VanDerWaalsContact C-N 3.27Å; I161-W163 PolarHBondContact O-N 2.8Å; I161-A164 PolarHBondContact O-N 2.99Å; I161-F165 PolarHBondContact O-N 3.03Å
162	R	90.8	Very high	93.1	Very high	141 Å²	141	67.2 Å²	67.2	53%	0.532	35%	0.346	S	S	.	.	H	α-helix	trans	-57.1	-40.7	176.4	-68.1	-177.3	-73.7	147.9	-2.5	112.3	F58 H160	F58-R162 HydrophobicContact CD2-CB 4.02Å; F58-R162 HydrophobicContact CE2-CB 3.7Å; F58-R162 WeakPolarHBondContact CE2-O 3.41Å; F58-R162 HydrophobicContact CZ-CB 3.98Å; F58-R162 WeakPolarHBondContact CZ-O 3.4Å; H160-R162 PolarHBondContact O-N 3.25Å; H160-R162 VanDerWaalsContact O-N 3.08Å
163	W	90.5	Very high	93.1	Very high	41 Å²	41	66.7 Å²	66.7	16%	0.155	35%	0.345	C	S	.	.	H	α-helix	trans	-79.6	-34.8	178.4	-72.3	112.6	0	0	0	112.2	Y48 C51 I65 H160 I161 F165 V166 C167	Y48-W163 AromaticContact CD2-CE3 3.74Å; Y48-W163 HydrophobicContact CD2-CE3 3.74Å; Y48-W163 AromaticContact CD2-CZ3 3.57Å; Y48-W163 HydrophobicContact CD2-CZ3 3.57Å; Y48-W163 HydrophobicContact CE2-CD2 4.33Å; Y48-W163 AromaticContact CE2-CE3 3.33Å; Y48-W163 HydrophobicContact CE2-CE3 3.33Å; Y48-W163 AromaticContact CE2-CZ3 3.69Å; Y48-W163 HydrophobicContact CE2-CZ3 3.69Å; Y48-W163 HydrophobicContact CG-CZ3 4.28Å; Y48-W163 AromaticContact CZ-CE3 3.97Å; C51-W163 HydrophobicContact CB-CH2 3.67Å; C51-W163 HydrophobicContact CB-CZ2 4.27Å; C51-W163 WeakPolarHBondContact SG-CH2 3.22Å; C51-W163 WeakPolarHBondContact SG-CZ2 3.39Å; I65-W163 HydrophobicContact CD1-CZ3 4.14Å; H160-W163 HydrophobicContact CB-CB 4.28Å; H160-W163 WeakPolarHBondContact O-CA 3.47Å; H160-W163 WeakPolarHBondContact O-CB 3.46Å; H160-W163 PolarHBondContact O-N 3.01Å; I161-W163 VanDerWaalsContact C-N 3.27Å; I161-W163 PolarHBondContact O-N 2.8Å; W163-F165 VanDerWaalsContact C-N 3.25Å; W163-F165 PolarHBondContact O-N 2.94Å; W163-V166 HydrophobicContact CE3-CG2 4.21Å; W163-V166 WeakPolarHBondContact O-CB 3.23Å; W163-V166 PolarHBondContact O-N 3.45Å; W163-C167 PolarHBondContact O-N 2.8Å; W163-C167 VanDerWaalsContact O-N 3.1Å; W163-C167 PolarHBondContact O-SG 3Å; W163-C167 VanDerWaalsContact O-SG 3.37Å
164	A	93.1	Very high	93.1	Very high	10 Å²	10	63.3 Å²	63.3	8%	0.083	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-40.4	172.3	0	0	0	0	0	111.4	F152 S155 H160 I161 V166 C167 T168	F152-A164 HydrophobicContact CE2-CB 4.33Å; S155-A164 WeakPolarHBondContact OG-CA 3.46Å; S155-A164 WeakPolarHBondContact OG-CB 3.48Å; S155-A164 PolarHBondContact OG-N 3.46Å; H160-A164 PolarHBondContact O-N 3.38Å; I161-A164 PolarHBondContact O-N 2.99Å; A164-V166 PolarHBondContact O-N 3.08Å; A164-C167 PolarHBondContact O-N 3.49Å; A164-T168 PolarHBondContact O-N 3.25Å; A164-T168 PolarHBondContact O-OG1 3.29Å
165	F	93.2	Very high	93.3	Very high	114 Å²	114	65.3 Å²	65.3	50%	0.5	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-44	175.2	-179.6	-107.8	0	0	0	113	F62 I161 W163 C167 T168 I169	F62-F165 HydrophobicContact CE2-CD1 4.06Å; F62-F165 AromaticContact CE2-CE1 3.83Å; F62-F165 HydrophobicContact CE2-CE1 3.83Å; F62-F165 HydrophobicContact CZ-CE1 4.07Å; I161-F165 PolarHBondContact O-N 3.03Å; W163-F165 VanDerWaalsContact C-N 3.25Å; W163-F165 PolarHBondContact O-N 2.94Å; F165-C167 VanDerWaalsContact C-N 3.34Å; F165-C167 PolarHBondContact O-N 3Å; F165-T168 PolarHBondContact O-N 2.94Å; F165-I169 HydrophobicContact CD1-CD1 4.08Å; F165-I169 HydrophobicContact CE1-CD1 3.53Å; F165-I169 HydrophobicContact CE2-CD1 4.34Å; F165-I169 HydrophobicContact CZ-CD1 3.69Å; F165-I169 HydrophobicContact CZ-CG1 4.42Å; F165-I169 PolarHBondContact O-N 3.39Å; F165-I169 VanDerWaalsContact O-N 3.16Å
166	V	94.5	Very high	93.5	Very high	4 Å²	4	66.9 Å²	66.9	2%	0.024	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-48.2	175.1	178.7	0	0	0	0	110.4	Y48 F58 F62 I65 W163 A164 T168 I169 A170	Y48-V166 HydrophobicContact CD2-CG1 4.28Å; Y48-V166 HydrophobicContact CE2-CG1 4.43Å; F58-V166 HydrophobicContact CE2-CG2 4.01Å; F58-V166 HydrophobicContact CZ-CG2 4.16Å; F62-V166 HydrophobicContact CD2-CG2 3.91Å; I65-V166 HydrophobicContact CD1-CG1 4.36Å; I65-V166 HydrophobicContact CG2-CG1 3.76Å; W163-V166 HydrophobicContact CE3-CG2 4.21Å; W163-V166 WeakPolarHBondContact O-CB 3.23Å; W163-V166 PolarHBondContact O-N 3.45Å; A164-V166 PolarHBondContact O-N 3.08Å; V166-T168 VanDerWaalsContact C-N 3.33Å; V166-T168 PolarHBondContact O-N 2.93Å; V166-I169 PolarHBondContact O-N 3.48Å; V166-A170 PolarHBondContact O-N 3.09Å; V166-A170 VanDerWaalsContact O-N 3.08Å
167	C	95.2	Very high	93.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65	-35.7	-179.6	-62.4	0	0	0	0	112.1	W148 F152 W163 A164 F165 A170 L171	W148-C167 HydrophobicContact CE3-CB 4.42Å; F152-C167 HydrophobicContact CB-CB 3.74Å; F152-C167 HydrophobicContact CD2-CB 3.89Å; F152-C167 HydrophobicContact CG-CB 4.32Å; W163-C167 PolarHBondContact O-N 2.8Å; W163-C167 VanDerWaalsContact O-N 3.1Å; W163-C167 PolarHBondContact O-SG 3Å; W163-C167 VanDerWaalsContact O-SG 3.37Å; A164-C167 PolarHBondContact O-N 3.49Å; F165-C167 VanDerWaalsContact C-N 3.34Å; F165-C167 PolarHBondContact O-N 3Å; C167-A170 PolarHBondContact O-N 2.89Å; C167-L171 WeakPolarHBondContact O-CB 3.38Å; C167-L171 WeakPolarHBondContact O-CG 3.4Å; C167-L171 PolarHBondContact O-N 2.86Å
168	T	96.2	Very high	93.8	Very high	59 Å²	59	55.7 Å²	55.7	36%	0.362	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-47.5	174.2	-59	0	0	0	0	111.6	F152 A164 F165 V166 A170 L171 C172	F152-T168 WeakPolarHBondContact CE2-OG1 3.37Å; A164-T168 PolarHBondContact O-N 3.25Å; A164-T168 PolarHBondContact O-OG1 3.29Å; F165-T168 PolarHBondContact O-N 2.94Å; V166-T168 VanDerWaalsContact C-N 3.33Å; V166-T168 PolarHBondContact O-N 2.93Å; T168-A170 VanDerWaalsContact C-N 3.33Å; T168-A170 PolarHBondContact O-N 3.27Å; T168-L171 PolarHBondContact O-N 3.48Å; T168-C172 PolarHBondContact O-N 2.85Å; T168-C172 PolarHBondContact O-SG 3.17Å
169	I	96.4	Very high	94.1	Very high	39 Å²	39	58.6 Å²	58.6	20%	0.2	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-46.7	177.2	-65.8	169	0	0	0	110.1	F62 L66 F165 V166 L171 C172 M173	F62-I169 HydrophobicContact CE2-CD1 4.16Å; F62-I169 HydrophobicContact CZ-CD1 4.46Å; L66-I169 HydrophobicContact CD1-CG2 3.95Å; F165-I169 HydrophobicContact CD1-CD1 4.08Å; F165-I169 HydrophobicContact CE1-CD1 3.53Å; F165-I169 HydrophobicContact CE2-CD1 4.34Å; F165-I169 HydrophobicContact CZ-CD1 3.69Å; F165-I169 HydrophobicContact CZ-CG1 4.42Å; F165-I169 PolarHBondContact O-N 3.39Å; F165-I169 VanDerWaalsContact O-N 3.16Å; V166-I169 PolarHBondContact O-N 3.48Å; I169-L171 VanDerWaalsContact C-N 3.34Å; I169-L171 PolarHBondContact O-N 3Å; I169-C172 PolarHBondContact O-N 3.32Å; I169-M173 HydrophobicContact CG2-SD 3.99Å; I169-M173 WeakPolarHBondContact O-CG 3.3Å; I169-M173 PolarHBondContact O-N 2.94Å; I169-M173 VanDerWaalsContact O-N 3.11Å
170	A	96.6	Very high	94.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.5	-45	177.8	0	0	0	0	0	112	L69 W148 V166 C167 T168 M173 N174	L69-A170 HydrophobicContact CD1-CB 3.69Å; L69-A170 HydrophobicContact CD2-CB 3.83Å; L69-A170 HydrophobicContact CG-CB 4.45Å; W148-A170 HydrophobicContact CB-CB 4.37Å; W148-A170 HydrophobicContact CD2-CB 3.37Å; W148-A170 HydrophobicContact CE3-CB 3.67Å; W148-A170 HydrophobicContact CG-CB 3.7Å; W148-A170 HydrophobicContact CH2-CB 4.33Å; W148-A170 HydrophobicContact CZ2-CB 4.09Å; W148-A170 HydrophobicContact CZ3-CB 4.14Å; V166-A170 PolarHBondContact O-N 3.09Å; V166-A170 VanDerWaalsContact O-N 3.08Å; C167-A170 PolarHBondContact O-N 2.89Å; T168-A170 VanDerWaalsContact C-N 3.33Å; T168-A170 PolarHBondContact O-N 3.27Å; A170-M173 PolarHBondContact O-N 3Å; A170-N174 WeakPolarHBondContact O-CB 3.47Å; A170-N174 PolarHBondContact O-N 3.22Å; A170-N174 PolarHBondContact O-ND2 2.9Å
171	L	97.2	Very high	94.8	Very high	26 Å²	26	47 Å²	47	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-48.3	176.9	-77.4	172.2	0	0	0	111.8	P145 W148 C149 F152 C167 T168 I169 M173 N174 I175	P145-L171 HydrophobicContact CB-CD2 4.27Å; P145-L171 WeakPolarHBondContact O-CD2 3.31Å; W148-L171 HydrophobicContact CB-CD2 3.94Å; W148-L171 HydrophobicContact CB-CG 4.17Å; C149-L171 HydrophobicContact CB-CD2 4.16Å; F152-L171 HydrophobicContact CB-CD1 3.87Å; F152-L171 HydrophobicContact CD1-CD1 4.24Å; F152-L171 HydrophobicContact CD2-CD1 4.41Å; F152-L171 HydrophobicContact CG-CD1 3.92Å; C167-L171 WeakPolarHBondContact O-CB 3.38Å; C167-L171 WeakPolarHBondContact O-CG 3.4Å; C167-L171 PolarHBondContact O-N 2.86Å; T168-L171 PolarHBondContact O-N 3.48Å; I169-L171 VanDerWaalsContact C-N 3.34Å; I169-L171 PolarHBondContact O-N 3Å; L171-M173 VanDerWaalsContact C-N 3.33Å; L171-M173 PolarHBondContact O-N 2.92Å; L171-N174 PolarHBondContact O-N 2.8Å; L171-I175 HydrophobicContact CB-CD1 4.26Å; L171-I175 VanDerWaalsContact O-CB 3.27Å; L171-I175 WeakPolarHBondContact O-CB 3.31Å; L171-I175 WeakPolarHBondContact O-CD1 3.37Å; L171-I175 WeakPolarHBondContact O-CG1 3.4Å; L171-I175 PolarHBondContact O-N 3.18Å
172	C	97.1	Very high	95.1	Very high	81 Å²	81	43.5 Å²	43.5	55%	0.547	22%	0.218	S	C	.	.	H	α-helix	trans	-55.9	-46.8	179	-71.4	0	0	0	0	112	T168 I169 A176	T168-C172 PolarHBondContact O-N 2.85Å; T168-C172 PolarHBondContact O-SG 3.17Å; I169-C172 PolarHBondContact O-N 3.32Å; C172-A176 WeakPolarHBondContact O-CB 3.27Å; C172-A176 PolarHBondContact O-N 2.9Å
173	M	95	Very high	95.2	Very high	41 Å²	41	41.2 Å²	41.2	20%	0.202	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-41.9	-179.6	-63.5	-179.8	79.8	0	0	112.1	L69 F73 I169 A170 L171 N177	L69-M173 HydrophobicContact CB-SD 4.2Å; F73-M173 HydrophobicContact CB-CB 4.45Å; F73-M173 HydrophobicContact CB-CE 3.47Å; F73-M173 VanDerWaalsContact CB-CE 3.47Å; F73-M173 HydrophobicContact CD1-CE 4.18Å; F73-M173 HydrophobicContact CD2-CB 4.11Å; F73-M173 HydrophobicContact CD2-CE 4.46Å; F73-M173 WeakPolarHBondContact CD2-O 3.39Å; F73-M173 HydrophobicContact CG-CE 3.8Å; I169-M173 HydrophobicContact CG2-SD 3.99Å; I169-M173 WeakPolarHBondContact O-CG 3.3Å; I169-M173 PolarHBondContact O-N 2.94Å; I169-M173 VanDerWaalsContact O-N 3.11Å; A170-M173 PolarHBondContact O-N 3Å; L171-M173 VanDerWaalsContact C-N 3.33Å; L171-M173 PolarHBondContact O-N 2.92Å; M173-N177 PolarHBondContact O-N 3.33Å
174	N	96.3	Very high	95.3	Very high	7 Å²	7	39.2 Å²	39.2	4%	0.037	20%	0.202	C	C	.	.	H	α-helix	trans	-69.7	-41.7	178.9	-79.8	-78.7	0	0	0	112.4	S144 P145 A170 L171 A176 N177 V178	S144-N174 WeakPolarHBondContact CB-OD1 3.43Å; S144-N174 PolarHBondContact OG-ND2 2.95Å; S144-N174 PolarHBondContact OG-OD1 3.49Å; P145-N174 HydrophobicContact CB-CB 3.98Å; P145-N174 HydrophobicContact CG-CB 4.42Å; A170-N174 WeakPolarHBondContact O-CB 3.47Å; A170-N174 PolarHBondContact O-N 3.22Å; A170-N174 PolarHBondContact O-ND2 2.9Å; L171-N174 PolarHBondContact O-N 2.8Å; N174-A176 VanDerWaalsContact C-N 3.34Å; N174-A176 PolarHBondContact O-N 3.44Å; N174-N177 PolarHBondContact O-N 2.6Å; N174-V178 WeakPolarHBondContact O-CG2 3.23Å; N174-V178 PolarHBondContact O-N 3.48Å
175	I	96.5	Very high	95.2	Very high	96 Å²	96	44.7 Å²	44.7	49%	0.492	22%	0.221	S	C	.	.	H	α-helix	trans	-63.5	-41.1	177.1	-69.6	166.8	0	0	0	110.5	L171 N177 V178 Y179	L171-I175 HydrophobicContact CB-CD1 4.26Å; L171-I175 VanDerWaalsContact O-CB 3.27Å; L171-I175 WeakPolarHBondContact O-CB 3.31Å; L171-I175 WeakPolarHBondContact O-CD1 3.37Å; L171-I175 WeakPolarHBondContact O-CG1 3.4Å; L171-I175 PolarHBondContact O-N 3.18Å; I175-N177 VanDerWaalsContact C-N 3.32Å; I175-N177 PolarHBondContact O-N 3.03Å; I175-V178 PolarHBondContact O-N 2.89Å; I175-Y179 VanDerWaalsContact O-CB 3.28Å; I175-Y179 WeakPolarHBondContact O-CB 3.26Å; I175-Y179 PolarHBondContact O-N 3.42Å
176	A	95.1	Very high	95.2	Very high	39 Å²	39	42.7 Å²	42.7	32%	0.322	21%	0.214	S	C	.	.	H	α-helix	trans	-57.7	-45	175.8	0	0	0	0	0	111.9	F73 C172 N174 G180	F73-A176 HydrophobicContact CE2-CB 4.23Å; C172-A176 WeakPolarHBondContact O-CB 3.27Å; C172-A176 PolarHBondContact O-N 2.9Å; N174-A176 VanDerWaalsContact C-N 3.34Å; N174-A176 PolarHBondContact O-N 3.44Å; A176-G180 PolarHBondContact O-N 3.49Å
177	N	95.8	Very high	94.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-49.8	175	-83	-26.3	0	0	0	112	F73 V76 L141 M173 N174 I175 Y179 G180 Y181	F73-N177 VanDerWaalsContact CD2-ND2 3.29Å; F73-N177 WeakPolarHBondContact CD2-ND2 3.46Å; F73-N177 WeakPolarHBondContact CE2-OD1 3.27Å; V76-N177 HydrophobicContact CG1-CB 4.05Å; L141-N177 HydrophobicContact CD1-CB 3.87Å; M173-N177 PolarHBondContact O-N 3.33Å; N174-N177 PolarHBondContact O-N 2.6Å; I175-N177 VanDerWaalsContact C-N 3.32Å; I175-N177 PolarHBondContact O-N 3.03Å; N177-Y179 VanDerWaalsContact C-N 3.32Å; N177-Y179 PolarHBondContact O-N 2.95Å; N177-G180 PolarHBondContact O-N 2.91Å; N177-Y181 WeakPolarHBondContact O-CD2 3.28Å; N177-Y181 PolarHBondContact O-N 3.29Å
178	V	96.3	Very high	94.6	Very high	24 Å²	24	47.2 Å²	47.2	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-55.1	-49.5	178.2	169.9	0	0	0	0	111	L141 P145 N174 I175 G180 Y181 I182	L141-V178 HydrophobicContact CD1-CG2 4.05Å; L141-V178 HydrophobicContact CG-CG2 3.86Å; L141-V178 VanDerWaalsContact O-CG2 3.28Å; L141-V178 WeakPolarHBondContact O-CG2 3.29Å; P145-V178 HydrophobicContact CG-CG2 4.04Å; N174-V178 WeakPolarHBondContact O-CG2 3.23Å; N174-V178 PolarHBondContact O-N 3.48Å; I175-V178 PolarHBondContact O-N 2.89Å; V178-G180 PolarHBondContact O-N 3.27Å; V178-Y181 PolarHBondContact O-N 3.34Å; V178-I182 HydrophobicContact CG1-CD1 3.46Å; V178-I182 VanDerWaalsContact CG1-CD1 3.46Å; V178-I182 HydrophobicContact CG1-CG1 4.23Å; V178-I182 WeakPolarHBondContact O-CB 3.38Å; V178-I182 VanDerWaalsContact O-CG1 3.27Å; V178-I182 WeakPolarHBondContact O-CG1 3.24Å; V178-I182 PolarHBondContact O-N 3.18Å
179	Y	96.2	Very high	94.2	Very high	126 Å²	126	47.5 Å²	47.5	49%	0.494	24%	0.239	S	C	.	.	H	α-helix	trans	-59.5	-48	179.8	177.8	-100.9	0	0	0	111.6	I175 N177 Y181 I182 R183	I175-Y179 VanDerWaalsContact O-CB 3.28Å; I175-Y179 WeakPolarHBondContact O-CB 3.26Å; I175-Y179 PolarHBondContact O-N 3.42Å; N177-Y179 VanDerWaalsContact C-N 3.32Å; N177-Y179 PolarHBondContact O-N 2.95Å; Y179-Y181 PolarHBondContact O-N 3.3Å; Y179-I182 PolarHBondContact O-N 3.05Å; Y179-R183 HydrophobicContact CD1-CG 4.3Å; Y179-R183 HydrophobicContact CD2-CG 4.33Å; Y179-R183 HydrophobicContact CE1-CG 3.96Å; Y179-R183 HydrophobicContact CE2-CG 3.98Å; Y179-R183 HydrophobicContact CG-CG 4.49Å; Y179-R183 WeakPolarHBondContact O-CB 3.21Å; Y179-R183 VanDerWaalsContact O-CG 3.24Å; Y179-R183 WeakPolarHBondContact O-CG 3.41Å; Y179-R183 PolarHBondContact O-N 3.49Å; Y179-R183 PolarHBondContact OH-NH1 2.85Å
180	G	94.7	Very high	93.8	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-56.2	-47.8	177.5	0	0	0	0	0	112.7	A176 N177 V178 R183 C184	A176-G180 PolarHBondContact O-N 3.49Å; N177-G180 PolarHBondContact O-N 2.91Å; V178-G180 PolarHBondContact O-N 3.27Å; G180-R183 PolarHBondContact O-N 2.98Å; G180-C184 PolarHBondContact O-N 3.15Å; G180-C184 PolarHBondContact O-SG 3.38Å
181	Y	95.4	Very high	93.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-71.7	-36.3	-179.8	-75	-66.1	0	0	0	114	V76 K77 G81 L87 W89 F137 L141 N177 V178 Y179 R183 C184 W185	V76-Y181 HydrophobicContact CG1-CE2 3.88Å; V76-Y181 PolarHBondContact O-OH 3.33Å; K77-Y181 WeakPolarHBondContact CA-OH 3.46Å; K77-Y181 PolarHBondContact O-OH 3.02Å; K77-Y181 VanDerWaalsContact O-OH 3.08Å; G81-Y181 WeakPolarHBondContact CA-OH 3.29Å; L87-Y181 HydrophobicContact CB-CD1 3.71Å; L87-Y181 HydrophobicContact CB-CE1 3.89Å; L87-Y181 HydrophobicContact CD1-CD1 4.13Å; W89-Y181 AromaticContact NE1-CE2 3.87Å; F137-Y181 HydrophobicContact CE1-CD1 4.13Å; F137-Y181 HydrophobicContact CE1-CD2 4.39Å; F137-Y181 HydrophobicContact CE1-CE1 4.5Å; F137-Y181 HydrophobicContact CE1-CG 4.1Å; F137-Y181 HydrophobicContact CE2-CE2 4.43Å; F137-Y181 AromaticContact CZ-CD1 3.77Å; F137-Y181 HydrophobicContact CZ-CD1 3.77Å; F137-Y181 AromaticContact CZ-CD2 3.74Å; F137-Y181 HydrophobicContact CZ-CD2 3.74Å; F137-Y181 AromaticContact CZ-CE1 3.75Å; F137-Y181 HydrophobicContact CZ-CE1 3.75Å; F137-Y181 AromaticContact CZ-CE2 3.75Å; F137-Y181 HydrophobicContact CZ-CE2 3.75Å; F137-Y181 AromaticContact CZ-CG 3.8Å; F137-Y181 HydrophobicContact CZ-CG 3.8Å; F137-Y181 AromaticContact CZ-CZ 3.77Å; L141-Y181 HydrophobicContact CD1-CD2 3.96Å; L141-Y181 HydrophobicContact CD2-CD2 3.71Å; L141-Y181 HydrophobicContact CD2-CG 3.92Å; N177-Y181 WeakPolarHBondContact O-CD2 3.28Å; N177-Y181 PolarHBondContact O-N 3.29Å; V178-Y181 PolarHBondContact O-N 3.34Å; Y179-Y181 PolarHBondContact O-N 3.3Å; Y181-R183 VanDerWaalsContact C-N 3.32Å; Y181-C184 WeakPolarHBondContact O-CB 3.44Å; Y181-C184 PolarHBondContact O-N 2.75Å; Y181-W185 WeakPolarHBondContact O-CB 3.31Å; Y181-W185 PolarHBondContact O-N 3.03Å
182	I	95.2	Very high	92.7	Very high	62 Å²	62	56.5 Å²	56.5	32%	0.318	29%	0.289	S	S	.	.	H	α-helix	trans	-63	-42.5	173.8	-71.3	174.1	0	0	0	109.8	W138 V178 Y179 W185 M186	W138-I182 HydrophobicContact CZ3-CG1 4.15Å; V178-I182 HydrophobicContact CG1-CD1 3.46Å; V178-I182 VanDerWaalsContact CG1-CD1 3.46Å; V178-I182 HydrophobicContact CG1-CG1 4.23Å; V178-I182 WeakPolarHBondContact O-CB 3.38Å; V178-I182 VanDerWaalsContact O-CG1 3.27Å; V178-I182 WeakPolarHBondContact O-CG1 3.24Å; V178-I182 PolarHBondContact O-N 3.18Å; Y179-I182 PolarHBondContact O-N 3.05Å; I182-W185 PolarHBondContact O-N 2.76Å; I182-M186 HydrophobicContact CG2-CE 3.74Å; I182-M186 HydrophobicContact CG2-CG 4.47Å; I182-M186 HydrophobicContact CG2-SD 4.16Å; I182-M186 WeakPolarHBondContact O-CG 3.35Å; I182-M186 PolarHBondContact O-N 3.31Å
183	R	93.5	Very high	92.2	Very high	92 Å²	92	58.4 Å²	58.4	35%	0.347	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-41.9	174.7	-69.9	-67.5	-58.6	-102.6	0.5	112.3	Y103 Y179 G180 Y181 W185 M186 S187	Y103-R183 HydrophobicContact CD1-CB 3.65Å; Y103-R183 HydrophobicContact CE1-CB 3.27Å; Y103-R183 HydrophobicContact CE1-CG 4.09Å; Y103-R183 HydrophobicContact CE2-CB 4.34Å; Y103-R183 HydrophobicContact CG-CB 4.33Å; Y179-R183 HydrophobicContact CD1-CG 4.3Å; Y179-R183 HydrophobicContact CD2-CG 4.33Å; Y179-R183 HydrophobicContact CE1-CG 3.96Å; Y179-R183 HydrophobicContact CE2-CG 3.98Å; Y179-R183 HydrophobicContact CG-CG 4.49Å; Y179-R183 WeakPolarHBondContact O-CB 3.21Å; Y179-R183 VanDerWaalsContact O-CG 3.24Å; Y179-R183 WeakPolarHBondContact O-CG 3.41Å; Y179-R183 PolarHBondContact O-N 3.49Å; Y179-R183 PolarHBondContact OH-NH1 2.85Å; G180-R183 PolarHBondContact O-N 2.98Å; Y181-R183 VanDerWaalsContact C-N 3.32Å; R183-W185 VanDerWaalsContact C-N 3.34Å; R183-W185 PolarHBondContact O-N 2.92Å; R183-M186 HydrophobicContact CG-CE 4.36Å; R183-M186 PolarHBondContact O-N 2.81Å; R183-S187 WeakPolarHBondContact O-CB 3.34Å; R183-S187 PolarHBondContact O-N 2.78Å
184	C	92.6	Very high	91.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.2	-47.3	171.3	-68.9	0	0	0	0	112.3	L87 R88 G180 Y181 S187 N188	L87-C184 HydrophobicContact CB-CB 4.05Å; L87-C184 HydrophobicContact CD1-CB 4.25Å; L87-C184 HydrophobicContact CD2-CB 4.14Å; L87-C184 HydrophobicContact CG-CB 4.37Å; R88-C184 PolarHBondContact O-SG 3.04Å; G180-C184 PolarHBondContact O-N 3.15Å; G180-C184 PolarHBondContact O-SG 3.38Å; Y181-C184 WeakPolarHBondContact O-CB 3.44Å; Y181-C184 PolarHBondContact O-N 2.75Å; C184-S187 PolarHBondContact O-N 3.49Å; C184-N188 PolarHBondContact O-N 3.26Å; C184-N188 VanDerWaalsContact O-N 3.09Å
185	W	91	Very high	91.3	Very high	125 Å²	125	61.4 Å²	61.4	47%	0.473	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-43.5	-179	176.6	67.9	0	0	0	112.1	W138 Y181 I182 R183 N188 M189	W138-W185 HydrophobicContact CH2-CB 4.12Å; W138-W185 HydrophobicContact CZ2-CB 4.17Å; W138-W185 HydrophobicContact CZ2-CG 4.41Å; Y181-W185 WeakPolarHBondContact O-CB 3.31Å; Y181-W185 PolarHBondContact O-N 3.03Å; I182-W185 PolarHBondContact O-N 2.76Å; R183-W185 VanDerWaalsContact C-N 3.34Å; R183-W185 PolarHBondContact O-N 2.92Å; W185-N188 PolarHBondContact O-N 3.08Å; W185-M189 HydrophobicContact CD2-CE 3.83Å; W185-M189 HydrophobicContact CD2-SD 4.33Å; W185-M189 HydrophobicContact CE3-CE 3.62Å; W185-M189 HydrophobicContact CH2-CE 3.44Å; W185-M189 VanDerWaalsContact CH2-CE 3.44Å; W185-M189 HydrophobicContact CH2-SD 3.8Å; W185-M189 HydrophobicContact CZ2-CE 3.64Å; W185-M189 HydrophobicContact CZ2-SD 3.44Å; W185-M189 WeakPolarHBondContact CZ2-SD 3.48Å; W185-M189 HydrophobicContact CZ3-CE 3.42Å; W185-M189 VanDerWaalsContact CZ3-CE 3.42Å; W185-M189 HydrophobicContact CZ3-SD 4.36Å; W185-M189 PolarHBondContact O-N 2.68Å
186	M	91.8	Very high	90.9	Very high	71 Å²	71	61.6 Å²	61.6	35%	0.35	31%	0.311	S	S	.	.	H	α-helix	trans	-65.6	-40.1	176	-68.9	-175.8	-57.7	0	0	112.8	I182 R183 N188 M189 N190	I182-M186 HydrophobicContact CG2-CE 3.74Å; I182-M186 HydrophobicContact CG2-CG 4.47Å; I182-M186 HydrophobicContact CG2-SD 4.16Å; I182-M186 WeakPolarHBondContact O-CG 3.35Å; I182-M186 PolarHBondContact O-N 3.31Å; R183-M186 HydrophobicContact CG-CE 4.36Å; R183-M186 PolarHBondContact O-N 2.81Å; M186-N188 VanDerWaalsContact C-N 3.32Å; M186-N188 PolarHBondContact O-N 3.4Å; M186-M189 HydrophobicContact CB-CE 4.42Å; M186-M189 HydrophobicContact CG-CE 4.07Å; M186-M189 PolarHBondContact O-N 2.84Å; M186-N190 PolarHBondContact O-N 3.27Å; M186-N190 VanDerWaalsContact O-N 3.13Å
187	S	89.9	Confident	90.5	Very high	46 Å²	46	64.5 Å²	64.5	32%	0.322	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-43.3	176.8	-165.4	0	0	0	0	111.7	R183 C184 M189 N190 E191	R183-S187 WeakPolarHBondContact O-CB 3.34Å; R183-S187 PolarHBondContact O-N 2.78Å; C184-S187 PolarHBondContact O-N 3.49Å; S187-M189 PolarHBondContact O-N 3.37Å; S187-N190 PolarHBondContact O-N 2.75Å; S187-E191 PolarHBondContact O-N 3.3Å
188	N	88.2	Confident	90.2	Very high	53 Å²	53	70.8 Å²	70.8	28%	0.283	35%	0.348	S	S	.	.	H	α-helix	trans	-61.7	-40.6	177.1	-177.9	44.5	0	0	0	112.7	S105 C184 W185 M186 E191 S192	S105-N188 VanDerWaalsContact OG-CB 3.32Å; S105-N188 WeakPolarHBondContact OG-CB 3.46Å; S105-N188 PolarHBondContact OG-OD1 3.23Å; C184-N188 PolarHBondContact O-N 3.26Å; C184-N188 VanDerWaalsContact O-N 3.09Å; W185-N188 PolarHBondContact O-N 3.08Å; M186-N188 VanDerWaalsContact C-N 3.32Å; M186-N188 PolarHBondContact O-N 3.4Å; N188-E191 PolarHBondContact O-N 3.06Å; N188-S192 WeakPolarHBondContact O-CB 3.4Å; N188-S192 PolarHBondContact O-N 2.72Å
189	M	87.4	Confident	89.9	Confident	65 Å²	65	73.9 Å²	73.9	32%	0.32	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-48.8	177	-68.6	-170.3	-65.1	0	0	111.3	W185 M186 S187 E191 S192 E193	W185-M189 HydrophobicContact CD2-CE 3.83Å; W185-M189 HydrophobicContact CD2-SD 4.33Å; W185-M189 HydrophobicContact CE3-CE 3.62Å; W185-M189 HydrophobicContact CH2-CE 3.44Å; W185-M189 VanDerWaalsContact CH2-CE 3.44Å; W185-M189 HydrophobicContact CH2-SD 3.8Å; W185-M189 HydrophobicContact CZ2-CE 3.64Å; W185-M189 HydrophobicContact CZ2-SD 3.44Å; W185-M189 WeakPolarHBondContact CZ2-SD 3.48Å; W185-M189 HydrophobicContact CZ3-CE 3.42Å; W185-M189 VanDerWaalsContact CZ3-CE 3.42Å; W185-M189 HydrophobicContact CZ3-SD 4.36Å; W185-M189 PolarHBondContact O-N 2.68Å; M186-M189 HydrophobicContact CB-CE 4.42Å; M186-M189 HydrophobicContact CG-CE 4.07Å; M186-M189 PolarHBondContact O-N 2.84Å; S187-M189 PolarHBondContact O-N 3.37Å; M189-E191 VanDerWaalsContact C-N 3.32Å; M189-E191 PolarHBondContact O-N 2.63Å; M189-S192 PolarHBondContact O-N 3.46Å; M189-S192 VanDerWaalsContact O-N 3.16Å; M189-S192 PolarHBondContact O-OG 3.23Å; M189-E193 PolarHBondContact O-N 2.73Å
190	N	89.1	Confident	89.5	Confident	104 Å²	104	72.6 Å²	72.6	56%	0.556	37%	0.368	S	S	*	.	H	α-helix	trans	-61.2	-40.4	179.2	-64.8	-16.1	0	0	0	112.1	M186 S187 E193 S194	M186-N190 PolarHBondContact O-N 3.27Å; M186-N190 VanDerWaalsContact O-N 3.13Å; S187-N190 PolarHBondContact O-N 2.75Å; N190-E193 PolarHBondContact O-N 2.57Å; N190-S194 PolarHBondContact O-N 3.46Å; N190-S194 VanDerWaalsContact O-N 3.08Å
191	E	86.2	Confident	89.3	Confident	99 Å²	99	79.5 Å²	79.5	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-63	-44.5	175.9	-173.2	177.1	171.7	0	0	111.1	S187 N188 M189 E193 S194 N195	S187-E191 PolarHBondContact O-N 3.3Å; N188-E191 PolarHBondContact O-N 3.06Å; M189-E191 VanDerWaalsContact C-N 3.32Å; M189-E191 PolarHBondContact O-N 2.63Å; E191-E193 PolarHBondContact O-N 3.39Å; E191-S194 PolarHBondContact O-N 2.87Å; E191-S194 PolarHBondContact O-OG 3.33Å; E191-N195 PolarHBondContact O-N 3.11Å; E191-N195 PolarHBondContact O-ND2 2.93Å
192	S	84.2	Confident	88.9	Confident	52 Å²	52	82.5 Å²	82.5	36%	0.364	42%	0.418	S	S	.	.	H	α-helix	trans	-60.4	-42.6	178.5	75.4	0	0	0	0	112.8	N188 M189 N195 I196	N188-S192 WeakPolarHBondContact O-CB 3.4Å; N188-S192 PolarHBondContact O-N 2.72Å; M189-S192 PolarHBondContact O-N 3.46Å; M189-S192 VanDerWaalsContact O-N 3.16Å; M189-S192 PolarHBondContact O-OG 3.23Å; S192-N195 PolarHBondContact O-N 3.15Å; S192-I196 VanDerWaalsContact O-CG1 3.3Å; S192-I196 WeakPolarHBondContact O-CG1 3.38Å; S192-I196 PolarHBondContact O-N 2.89Å
193	E	85.1	Confident	88.5	Confident	120 Å²	120	82.7 Å²	82.7	56%	0.561	42%	0.422	S	S	*	.	H	α-helix	trans	-63.7	-44.8	175.6	-70	-175.9	167.5	0	0	111.6	M189 N190 E191 N195 I196 L197	M189-E193 PolarHBondContact O-N 2.73Å; N190-E193 PolarHBondContact O-N 2.57Å; E191-E193 PolarHBondContact O-N 3.39Å; E193-N195 VanDerWaalsContact C-N 3.28Å; E193-N195 PolarHBondContact O-N 2.85Å; E193-I196 PolarHBondContact O-N 3.49Å; E193-L197 WeakPolarHBondContact O-CG 3.47Å; E193-L197 PolarHBondContact O-N 3.45Å
194	S	86.7	Confident	88.1	Confident	44 Å²	44	81 Å²	81	31%	0.308	43%	0.427	S	S	.	.	H	α-helix	trans	-61.9	-37.3	178.6	81.8	0	0	0	0	112.3	N190 E191 K198	N190-S194 PolarHBondContact O-N 3.46Å; N190-S194 VanDerWaalsContact O-N 3.08Å; E191-S194 PolarHBondContact O-N 2.87Å; E191-S194 PolarHBondContact O-OG 3.33Å; S194-K198 VanDerWaalsContact O-CG 3.27Å; S194-K198 WeakPolarHBondContact O-CG 3.22Å; S194-K198 PolarHBondContact O-N 3.22Å
195	N	87.5	Confident	87.6	Confident	68 Å²	68	84.8 Å²	84.8	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-70.8	-40.6	177.9	-72.5	-24.9	0	0	0	111.4	E191 S192 E193 K198 V199	E191-N195 PolarHBondContact O-N 3.11Å; E191-N195 PolarHBondContact O-ND2 2.93Å; S192-N195 PolarHBondContact O-N 3.15Å; E193-N195 VanDerWaalsContact C-N 3.28Å; E193-N195 PolarHBondContact O-N 2.85Å; N195-K198 PolarHBondContact O-N 3.13Å; N195-V199 WeakPolarHBondContact O-CG2 3.31Å; N195-V199 PolarHBondContact O-N 3.02Å
196	I	86.7	Confident	87	Confident	100 Å²	100	81.4 Å²	81.4	51%	0.513	45%	0.446	S	S	.	.	H	α-helix	trans	-61.5	-46.7	173.4	-68.4	165.1	0	0	0	110.6	S192 E193 K198 V199 I200	S192-I196 VanDerWaalsContact O-CG1 3.3Å; S192-I196 WeakPolarHBondContact O-CG1 3.38Å; S192-I196 PolarHBondContact O-N 2.89Å; E193-I196 PolarHBondContact O-N 3.49Å; I196-K198 VanDerWaalsContact C-N 3.32Å; I196-K198 PolarHBondContact O-N 2.95Å; I196-V199 PolarHBondContact O-N 3Å; I196-I200 HydrophobicContact CG2-CD1 3.78Å; I196-I200 HydrophobicContact CG2-CG1 4.4Å; I196-I200 WeakPolarHBondContact O-CG1 3.41Å; I196-I200 PolarHBondContact O-N 3.01Å
197	L	88.1	Confident	86.1	Confident	100 Å²	100	84.8 Å²	84.8	52%	0.524	46%	0.459	S	S	.	.	H	α-helix	trans	-61.7	-37.9	177.7	-70.9	176.1	0	0	0	112.5	E193 I200 K201	E193-L197 WeakPolarHBondContact O-CG 3.47Å; E193-L197 PolarHBondContact O-N 3.45Å; L197-I200 PolarHBondContact O-N 3.48Å; L197-K201 WeakPolarHBondContact O-CB 3.27Å; L197-K201 VanDerWaalsContact O-CG 3.3Å; L197-K201 WeakPolarHBondContact O-CG 3.37Å; L197-K201 PolarHBondContact O-N 3.35Å
198	K	89.3	Confident	85.2	Confident	132 Å²	132	88.4 Å²	88.4	57%	0.574	47%	0.472	S	S	*	.	H	α-helix	trans	-62.7	-44	173.8	-75.4	169.4	-173.7	168.2	0	111.8	S194 N195 I196 K201 S202	S194-K198 VanDerWaalsContact O-CG 3.27Å; S194-K198 WeakPolarHBondContact O-CG 3.22Å; S194-K198 PolarHBondContact O-N 3.22Å; N195-K198 PolarHBondContact O-N 3.13Å; I196-K198 VanDerWaalsContact C-N 3.32Å; I196-K198 PolarHBondContact O-N 2.95Å; K198-K201 PolarHBondContact O-N 3.32Å; K198-S202 WeakPolarHBondContact O-CB 3.45Å; K198-S202 PolarHBondContact O-N 2.88Å; K198-S202 PolarHBondContact O-OG 2.88Å
199	V	88.8	Confident	84.3	Confident	89 Å²	89	89.2 Å²	89.2	54%	0.539	48%	0.482	S	S	.	.	H	α-helix	trans	-65.1	-41.8	177.5	172.3	0	0	0	0	111.6	N195 I196 S202 T203	N195-V199 WeakPolarHBondContact O-CG2 3.31Å; N195-V199 PolarHBondContact O-N 3.02Å; I196-V199 PolarHBondContact O-N 3Å; V199-S202 PolarHBondContact O-N 2.89Å; V199-S202 PolarHBondContact O-OG 2.69Å; V199-T203 VanDerWaalsContact O-CB 3.31Å; V199-T203 WeakPolarHBondContact O-CB 3.09Å; V199-T203 PolarHBondContact O-N 3.02Å; V199-T203 PolarHBondContact O-OG1 3.14Å
200	I	89.2	Confident	83.2	Confident	100 Å²	100	91.9 Å²	91.9	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-46.8	176.2	-67.7	169.2	0	0	0	110.3	I196 L197 S202 T203 A204	I196-I200 HydrophobicContact CG2-CD1 3.78Å; I196-I200 HydrophobicContact CG2-CG1 4.4Å; I196-I200 WeakPolarHBondContact O-CG1 3.41Å; I196-I200 PolarHBondContact O-N 3.01Å; L197-I200 PolarHBondContact O-N 3.48Å; I200-S202 PolarHBondContact O-N 2.92Å; I200-T203 PolarHBondContact O-N 3.21Å; I200-A204 WeakPolarHBondContact O-CB 3.35Å; I200-A204 PolarHBondContact O-N 2.91Å
201	K	89	Confident	82.1	Confident	148 Å²	148	92.7 Å²	92.7	64%	0.643	50%	0.501	S	S	*	.	H	α-helix	trans	-60.8	-45	177.9	-75.7	178.9	-179.4	-176.5	0	111.9	L197 K198 T203 A204 T205	L197-K201 WeakPolarHBondContact O-CB 3.27Å; L197-K201 VanDerWaalsContact O-CG 3.3Å; L197-K201 WeakPolarHBondContact O-CG 3.37Å; L197-K201 PolarHBondContact O-N 3.35Å; K198-K201 PolarHBondContact O-N 3.32Å; K201-T203 VanDerWaalsContact C-N 3.33Å; K201-T203 PolarHBondContact O-N 2.82Å; K201-A204 PolarHBondContact O-N 2.66Å; K201-T205 WeakPolarHBondContact O-CG2 3.2Å; K201-T205 PolarHBondContact O-N 2.73Å; K201-T205 PolarHBondContact O-OG1 3.44Å; K201-T205 VanDerWaalsContact O-OG1 3.1Å
202	S	88.1	Confident	81	Confident	63 Å²	63	96.5 Å²	96.5	44%	0.441	51%	0.511	S	S	.	.	H	α-helix	trans	-68	-32.5	178.5	66.8	0	0	0	0	113	K198 V199 I200 T205 S206	K198-S202 WeakPolarHBondContact O-CB 3.45Å; K198-S202 PolarHBondContact O-N 2.88Å; K198-S202 PolarHBondContact O-OG 2.88Å; V199-S202 PolarHBondContact O-N 2.89Å; V199-S202 PolarHBondContact O-OG 2.69Å; I200-S202 PolarHBondContact O-N 2.92Å; S202-T205 WeakPolarHBondContact CA-OG1 3.15Å; S202-T205 PolarHBondContact O-OG1 3.1Å; S202-T205 VanDerWaalsContact O-OG1 3.13Å; S202-S206 WeakPolarHBondContact O-CB 3.05Å; S202-S206 PolarHBondContact O-N 2.93Å; S202-S206 PolarHBondContact O-OG 3.28Å
203	T	86.4	Confident	79.8	Confident	65 Å²	65	98.4 Å²	98.4	40%	0.399	52%	0.523	S	S	.	.	H	α-helix	trans	-71.3	-39.6	174	-55.2	0	0	0	0	111.2	V199 I200 K201 S206 K207	V199-T203 VanDerWaalsContact O-CB 3.31Å; V199-T203 WeakPolarHBondContact O-CB 3.09Å; V199-T203 PolarHBondContact O-N 3.02Å; V199-T203 PolarHBondContact O-OG1 3.14Å; I200-T203 PolarHBondContact O-N 3.21Å; K201-T203 VanDerWaalsContact C-N 3.33Å; K201-T203 PolarHBondContact O-N 2.82Å; T203-S206 WeakPolarHBondContact CA-OG 3.44Å; T203-S206 PolarHBondContact O-OG 2.74Å; T203-K207 WeakPolarHBondContact O-CG 3.44Å; T203-K207 PolarHBondContact O-N 3.4Å; T203-K207 VanDerWaalsContact O-N 3.11Å
204	A	84.7	Confident	78.3	Confident	56 Å²	56	99.1 Å²	99.1	46%	0.463	53%	0.53	S	S	.	.	H	α-helix	trans	-67.1	-43.4	175.9	0	0	0	0	0	111.7	I200 K201 K207 M208	I200-A204 WeakPolarHBondContact O-CB 3.35Å; I200-A204 PolarHBondContact O-N 2.91Å; K201-A204 PolarHBondContact O-N 2.66Å; A204-K207 PolarHBondContact O-N 3.47Å; A204-M208 VanDerWaalsContact O-CB 3.27Å; A204-M208 WeakPolarHBondContact O-CB 3.5Å; A204-M208 PolarHBondContact O-N 3.21Å
205	T	82.1	Confident	76.7	Confident	80 Å²	80	100.8 Å²	100.8	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-68.3	-37.7	178	54.5	0	0	0	0	112.4	K201 S202 M208 S209	K201-T205 WeakPolarHBondContact O-CG2 3.2Å; K201-T205 PolarHBondContact O-N 2.73Å; K201-T205 PolarHBondContact O-OG1 3.44Å; K201-T205 VanDerWaalsContact O-OG1 3.1Å; S202-T205 WeakPolarHBondContact CA-OG1 3.15Å; S202-T205 PolarHBondContact O-OG1 3.1Å; S202-T205 VanDerWaalsContact O-OG1 3.13Å; T205-M208 PolarHBondContact O-N 2.91Å; T205-S209 WeakPolarHBondContact O-CB 3.42Å; T205-S209 PolarHBondContact O-N 3.3Å; T205-S209 PolarHBondContact O-OG 2.84Å; T205-S209 VanDerWaalsContact O-OG 3.13Å
206	S	78.3	Confident	75.1	Confident	54 Å²	54	105 Å²	105	38%	0.378	56%	0.559	S	S	.	*	H	α-helix	trans	-67.5	-38.1	176.2	59.2	0	0	0	0	112.5	S202 T203 S209 N210	S202-S206 WeakPolarHBondContact O-CB 3.05Å; S202-S206 PolarHBondContact O-N 2.93Å; S202-S206 PolarHBondContact O-OG 3.28Å; T203-S206 WeakPolarHBondContact CA-OG 3.44Å; T203-S206 PolarHBondContact O-OG 2.74Å; S206-S209 WeakPolarHBondContact CA-OG 3.26Å; S206-S209 PolarHBondContact O-OG 2.7Å; S206-N210 WeakPolarHBondContact O-CB 3.34Å; S206-N210 PolarHBondContact O-N 3.11Å; S206-N210 PolarHBondContact O-ND2 3.39Å; S206-N210 VanDerWaalsContact O-ND2 3.15Å
207	K	73.1	Confident	73.2	Confident	142 Å²	142	105.9 Å²	105.9	62%	0.617	57%	0.569	S	S	*	*	H	α-helix	trans	-66.8	-41.5	171.2	-72.7	-170.4	178.8	-168.9	0	111.9	T203 A204 N210 L211	T203-K207 WeakPolarHBondContact O-CG 3.44Å; T203-K207 PolarHBondContact O-N 3.4Å; T203-K207 VanDerWaalsContact O-N 3.11Å; A204-K207 PolarHBondContact O-N 3.47Å; K207-N210 PolarHBondContact O-N 3.03Å; K207-L211 VanDerWaalsContact O-CG 3.26Å; K207-L211 WeakPolarHBondContact O-CG 3.35Å; K207-L211 PolarHBondContact O-N 3.15Å; K207-L211 VanDerWaalsContact O-N 3.11Å
208	M	70.7	Confident	70.9	Confident	122 Å²	122	111.4 Å²	111.4	60%	0.601	59%	0.589	S	S	*	*	H	α-helix	trans	-69.1	-39.7	179.9	-169.3	160.3	69.1	0	0	112.3	A204 T205 N210 L211 W212	A204-M208 VanDerWaalsContact O-CB 3.27Å; A204-M208 WeakPolarHBondContact O-CB 3.5Å; A204-M208 PolarHBondContact O-N 3.21Å; T205-M208 PolarHBondContact O-N 2.91Å; M208-N210 VanDerWaalsContact C-N 3.28Å; M208-N210 PolarHBondContact O-N 3.15Å; M208-L211 PolarHBondContact O-N 3.4Å; M208-L211 VanDerWaalsContact O-N 3.15Å; M208-W212 WeakPolarHBondContact O-CB 3.16Å; M208-W212 PolarHBondContact O-N 3.13Å
209	S	68.9	Low	68.6	Low	71 Å²	71	111.2 Å²	111.2	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-65.2	-32.6	175.6	63.4	0	0	0	0	112.2	T205 S206 L211 P213	T205-S209 WeakPolarHBondContact O-CB 3.42Å; T205-S209 PolarHBondContact O-N 3.3Å; T205-S209 PolarHBondContact O-OG 2.84Å; T205-S209 VanDerWaalsContact O-OG 3.13Å; S206-S209 WeakPolarHBondContact CA-OG 3.26Å; S206-S209 PolarHBondContact O-OG 2.7Å; S209-L211 VanDerWaalsContact C-N 3.35Å; S209-P213 WeakPolarHBondContact O-CD 3.2Å
210	N	65.7	Low	66.5	Low	121 Å²	121	110.7 Å²	110.7	65%	0.647	62%	0.616	S	S	*	*	H	α-helix	trans	-76.3	-22.1	175.3	-68.7	-16.3	0	0	0	113.1	S206 K207 M208	S206-N210 WeakPolarHBondContact O-CB 3.34Å; S206-N210 PolarHBondContact O-N 3.11Å; S206-N210 PolarHBondContact O-ND2 3.39Å; S206-N210 VanDerWaalsContact O-ND2 3.15Å; K207-N210 PolarHBondContact O-N 3.03Å; M208-N210 VanDerWaalsContact C-N 3.28Å; M208-N210 PolarHBondContact O-N 3.15Å
211	L	65.9	Low	64.3	Low	120 Å²	120	111.4 Å²	111.4	63%	0.628	63%	0.63	S	S	*	*	H	α-helix	trans	-93.2	-23.7	176.5	-68.7	170.4	0	0	0	113.1	K207 M208 S209 P213 L214	K207-L211 VanDerWaalsContact O-CG 3.26Å; K207-L211 WeakPolarHBondContact O-CG 3.35Å; K207-L211 PolarHBondContact O-N 3.15Å; K207-L211 VanDerWaalsContact O-N 3.11Å; M208-L211 PolarHBondContact O-N 3.4Å; M208-L211 VanDerWaalsContact O-N 3.15Å; S209-L211 VanDerWaalsContact C-N 3.35Å; L211-P213 VanDerWaalsContact C-CD 3.41Å; L211-L214 PolarHBondContact O-N 2.78Å
212	W	62.6	Low	62.1	Low	179 Å²	179	111.9 Å²	111.9	68%	0.678	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-63.1	-27.8	-179.4	-168.9	-102.1	0	0	0	116	M208 L214	M208-W212 WeakPolarHBondContact O-CB 3.16Å; M208-W212 PolarHBondContact O-N 3.13Å; W212-L214 PolarHBondContact O-N 3.15Å; W212-L214 VanDerWaalsContact O-N 3.15Å
213	P	59.5	Low	60.2	Low	92 Å²	92	115.8 Å²	115.8	60%	0.597	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-72.4	-1.8	176.3	26.6	-32.8	0	0	0	114.6	S209 L211	S209-P213 WeakPolarHBondContact O-CD 3.2Å; L211-P213 VanDerWaalsContact C-CD 3.41Å
214	L	52.6	Low	58.2	Low	136 Å²	136	119.2 Å²	119.2	71%	0.712	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-94	-1.8	-178	-79.9	152.3	0	0	0	115.3	L211 W212	L211-L214 PolarHBondContact O-N 2.78Å; W212-L214 PolarHBondContact O-N 3.15Å; W212-L214 VanDerWaalsContact O-N 3.15Å
215	S	54.4	Low	56.4	Low	78 Å²	78	121.6 Å²	121.6	55%	0.545	70%	0.695	S	S	.	*	S	Bend	trans	-100.8	1.3	-178.1	72	0	0	0	0	115.7
216	Q	53.8	Low	54.8	Low	157 Å²	157	126.7 Å²	126.7	73%	0.734	71%	0.714	S	S	*	*	S	Bend	trans	-110.9	16.1	-173	-71.7	-75.2	-27.4	0	0	115.3
217	T	46.8	Very low	53.1	Low	119 Å²	119	128.1 Å²	128.1	73%	0.73	74%	0.737	S	S	*	*	S	Bend	trans	-130	82.4	178.8	46.1	0	0	0	0	113.7
218	K	39.6	Very low	51.7	Low	216 Å²	216	125.1 Å²	125.1	94%	0.939	75%	0.747	S	S	*	*			trans	145.5	99.8	147.1	-89.5	179.7	169.5	177.1	0	111.9
219	S	40.6	Very low	50.7	Low	128 Å²	128	127.5 Å²	127.5	90%	0.895	76%	0.761	S	S	*	*			trans	-158.8	115.2	152.7	-174.3	0	0	0	0	111.8
220	G	44.4	Very low	49.4	Very low	77 Å²	77	129.7 Å²	129.7	79%	0.794	77%	0.773	S	S	*	*			trans	84.5	130.8	157.5	0	0	0	0	0	116
221	S	44.5	Very low	48.3	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	79%	0.787	S	S	*	*			cis	-160.4	139.6	19	55.6	0	0	0	0	111.7
222	N	42.1	Very low	47.6	Very low	158 Å²	158	133.1 Å²	133.1	85%	0.845	80%	0.796	S	S	*	*			trans	-62.8	143.2	164.1	-74.3	-25.4	0	0	0	111.7
223	T	46.8	Very low	46.8	Very low	145 Å²	145	132.6 Å²	132.6	89%	0.89	83%	0.83	S	S	*	*				-161.6	135.8	127.3	22	0	0	0	0	111.3
224	T	45.9	Very low	46.1	Very low	137 Å²	137	134.6 Å²	134.6	84%	0.84	84%	0.841	S	S	*	*			trans	-87.2	154.5	-170.6	28	0	0	0	0	114.2
225	S	46.2	Very low	45.8	Very low	105 Å²	105	134.5 Å²	134.5	73%	0.734	85%	0.848	S	S	*	*			trans	96.7	137.6	138.1	-134.9	0	0	0	0	120.8
226	E	48	Very low	45.3	Very low	187 Å²	187	137.7 Å²	137.7	87%	0.874	87%	0.865	S	S	*	*			trans	75.1	122.9	163.1	-54.8	-173.4	150.2	0	0	115.2
227	G	43.7	Very low	44.8	Very low	84 Å²	84	136.5 Å²	136.5	87%	0.866	87%	0.873	S	S	*	*			cis	129.1	102.9	28.3	0	0	0	0	0	106.3
228	G	43.7	Very low	44.7	Very low	80 Å²	80	137.6 Å²	137.6	83%	0.825	88%	0.882	S	S	*	*			trans	179.5	111.1	-178.3	0	0	0	0	0	113.1
229	L	48.5	Very low	45	Very low	171 Å²	171	132.4 Å²	132.4	90%	0.895	88%	0.878	S	S	*	*			trans	-57.5	158.4	-172.8	-75.3	134	0	0	0	116
230	P	41.6	Very low	45.4	Very low	117 Å²	117	132.7 Å²	132.7	76%	0.76	88%	0.877	S	S	*	*			trans	-90	143.7	166.7	35.9	-28	0	0	0	111.1
231	L	42.9	Very low	45.4	Very low	177 Å²	177	137 Å²	137	93%	0.927	88%	0.883	S	S	*	*			trans	-147.8	137.6	157.4	-111.1	165.4	0	0	0	110.8
232	V	50.9	Low	45.5	Very low	136 Å²	136	138.8 Å²	138.8	82%	0.824	89%	0.889	S	S	*	*			trans	-67.7	139.7	-172.9	168.4	0	0	0	0	112.7
233	A	46	Very low	45.8	Very low	168 Å²	168	137 Å²	137	100%	1.388	89%	0.893	S	S	*	*			trans	-147.9	0	135.1	0	0	0	0	0	108

Retrieved 233 of 233 residues in 43.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).