A0A077Z8S6_TRITR Loading...

DNA polymerase epsilon subunit 3

AlphaFold DB , UniProt , Accession A0A077Z8S6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 237 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.5	Very low	63.1	Low	237 Å²	237	142.9 Å²	142.9	100%	1.167	71%	0.706	S	S	*	*				0	115.9	0	-65.8	177.2	-148.6	0	0	107.4	Q3	M1-Q3 PolarHBondContact O-N 3.1Å
2	K	40.8	Very low	65.4	Low	207 Å²	207	136.7 Å²	136.7	90%	0.9	68%	0.675	S	S	*	*			trans	-84.4	102.7	167.8	-70.6	179.8	179.8	178.6	0	105.4	E4	K2-E4 VanDerWaalsContact C-N 3.33Å; K2-E4 PolarHBondContact O-N 3.09Å; K2-E4 VanDerWaalsContact O-N 3.08Å
3	Q	40.1	Very low	67.5	Low	182 Å²	182	132.3 Å²	132.3	85%	0.85	67%	0.666	S	S	*	*			trans	-70.6	100.9	166.8	-75.6	176.9	-69.6	0	0	105.8	M1 I5	M1-Q3 PolarHBondContact O-N 3.1Å; Q3-I5 PolarHBondContact O-N 3.15Å; Q3-I5 VanDerWaalsContact O-N 3.16Å
4	E	51.6	Low	69.3	Low	174 Å²	174	125.1 Å²	125.1	81%	0.813	64%	0.637	S	S	*	*			trans	-61	116.6	162.7	-72.3	-175.2	167.1	0	0	106.1	K2 E6	K2-E4 VanDerWaalsContact C-N 3.33Å; K2-E4 PolarHBondContact O-N 3.09Å; K2-E4 VanDerWaalsContact O-N 3.08Å; E4-E6 VanDerWaalsContact C-N 3.28Å; E4-E6 PolarHBondContact O-N 2.77Å
5	I	58.8	Low	71	Confident	143 Å²	143	116.9 Å²	116.9	73%	0.733	60%	0.595	S	S	*	*			trans	-66.9	100	170.9	-59.9	171.8	0	0	0	104.3	Q3 I7	Q3-I5 PolarHBondContact O-N 3.15Å; Q3-I5 VanDerWaalsContact O-N 3.16Å; I5-I7 VanDerWaalsContact C-N 3.26Å; I5-I7 HydrophobicContact CG2-CG1 4.33Å; I5-I7 PolarHBondContact O-N 3.34Å
6	E	66.8	Low	72.3	Confident	185 Å²	185	111.7 Å²	111.7	86%	0.864	57%	0.571	S	S	*	*			trans	-62.8	94.6	169.9	-71.4	-177	-167.7	0	0	107.5	E4 L8	E4-E6 VanDerWaalsContact C-N 3.28Å; E4-E6 PolarHBondContact O-N 2.77Å; E6-L8 PolarHBondContact O-N 3.26Å
7	I	66.9	Low	73.6	Confident	77 Å²	77	115.3 Å²	115.3	40%	0.395	58%	0.576	S	S	.	*			trans	-68.5	119.5	172.7	-60.4	169.7	0	0	0	105.8	I5 N9	I5-I7 VanDerWaalsContact C-N 3.26Å; I5-I7 HydrophobicContact CG2-CG1 4.33Å; I5-I7 PolarHBondContact O-N 3.34Å; I7-N9 VanDerWaalsContact O-CG 3.26Å; I7-N9 PolarHBondContact O-N 3.08Å; I7-N9 PolarHBondContact O-ND2 3.42Å; I7-N9 VanDerWaalsContact O-ND2 3.15Å
8	L	75.1	Confident	74.7	Confident	111 Å²	111	114.4 Å²	114.4	58%	0.581	57%	0.572	S	S	*	*			trans	-58	102.1	174	178.9	66.3	0	0	0	108.9	E6 G41 V44	E6-L8 PolarHBondContact O-N 3.26Å; L8-G41 WeakPolarHBondContact O-CA 3.35Å; L8-V44 HydrophobicContact CD2-CG1 4.27Å
9	N	82.4	Confident	75.6	Confident	96 Å²	96	108.9 Å²	108.9	51%	0.513	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-97.7	127.6	-179.9	-65.8	-47	0	0	0	109.7	I7 N37	I7-N9 VanDerWaalsContact O-CG 3.26Å; I7-N9 PolarHBondContact O-N 3.08Å; I7-N9 PolarHBondContact O-ND2 3.42Å; I7-N9 VanDerWaalsContact O-ND2 3.15Å; N9-N37 WeakPolarHBondContact CA-OD1 3.41Å; N9-N37 VanDerWaalsContact CB-OD1 3.25Å; N9-N37 WeakPolarHBondContact CB-OD1 3.37Å; N9-N37 PolarHBondContact OD1-OD1 3.07Å
10	L	87.1	Confident	76.4	Confident	76 Å²	76	110.6 Å²	110.6	40%	0.398	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-73.9	156.1	174.5	-67	154.4	0	0	0	109.9	M12 V15 N37 A40	L10-M12 PolarHBondContact O-N 3.19Å; L10-V15 HydrophobicContact CB-CG2 4.14Å; L10-N37 PolarHBondContact N-ND2 3.15Å; L10-N37 PolarHBondContact N-OD1 2.99Å; L10-N37 PolarHBondContact O-ND2 2.67Å; L10-A40 HydrophobicContact CD1-CB 3.47Å; L10-A40 VanDerWaalsContact CD1-CB 3.47Å
11	P	92.2	Very high	77.2	Confident	84 Å²	84	111.8 Å²	111.8	55%	0.545	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-56.1	129.4	167.9	-24.7	34.4	0	0	0	111	S13 A14 V15	P11-S13 PolarHBondContact O-N 2.96Å; P11-S13 VanDerWaalsContact O-N 3.12Å; P11-A14 HydrophobicContact CB-CB 4.38Å; P11-A14 WeakPolarHBondContact O-CA 3.41Å; P11-A14 WeakPolarHBondContact O-CB 3.44Å; P11-A14 PolarHBondContact O-N 3.38Å; P11-V15 PolarHBondContact O-N 2.89Å
12	M	90.5	Very high	80	Confident	68 Å²	68	106.1 Å²	106.1	34%	0.335	54%	0.536	S	S	.	.	H	α-helix	trans	-60.9	-25.5	-178.9	-72.3	-60.2	-68.4	0	0	113.1	L10 V15 T16 K33 N37	L10-M12 PolarHBondContact O-N 3.19Å; M12-V15 PolarHBondContact O-N 2.87Å; M12-T16 WeakPolarHBondContact O-CB 3.42Å; M12-T16 PolarHBondContact O-N 3.26Å; M12-T16 PolarHBondContact O-OG1 3.02Å; M12-K33 HydrophobicContact CE-CB 3.5Å; M12-K33 HydrophobicContact CE-CD 4.32Å; M12-N37 HydrophobicContact SD-CB 4.23Å
13	S	92.5	Very high	82.5	Confident	80 Å²	80	97.1 Å²	97.1	56%	0.559	50%	0.499	S	S	*	.	H	α-helix	trans	-63.6	-39.3	171.4	57.4	0	0	0	0	112.4	P11 R17	P11-S13 PolarHBondContact O-N 2.96Å; P11-S13 VanDerWaalsContact O-N 3.12Å; S13-R17 WeakPolarHBondContact O-CB 3.43Å; S13-R17 PolarHBondContact O-N 3.32Å
14	A	93.6	Very high	84.9	Confident	31 Å²	31	93.2 Å²	93.2	26%	0.256	49%	0.49	S	S	.	.	H	α-helix	trans	-67.8	-45.1	176.1	0	0	0	0	0	110.9	P11 T16 R17 I18	P11-A14 HydrophobicContact CB-CB 4.38Å; P11-A14 WeakPolarHBondContact O-CA 3.41Å; P11-A14 WeakPolarHBondContact O-CB 3.44Å; P11-A14 PolarHBondContact O-N 3.38Å; A14-T16 PolarHBondContact O-N 3.23Å; A14-R17 WeakPolarHBondContact O-CB 3.34Å; A14-R17 PolarHBondContact O-N 2.92Å; A14-I18 WeakPolarHBondContact O-CG1 3.31Å; A14-I18 PolarHBondContact O-N 2.94Å
15	V	93.5	Very high	86.9	Confident	3 Å²	3	92.5 Å²	92.5	2%	0.018	49%	0.492	C	S	.	.	H	α-helix	trans	-58.8	-48.4	175.8	-179.9	0	0	0	0	110.6	L10 P11 M12 R17 I18 S19 K33 V36 N37	L10-V15 HydrophobicContact CB-CG2 4.14Å; P11-V15 PolarHBondContact O-N 2.89Å; M12-V15 PolarHBondContact O-N 2.87Å; V15-R17 VanDerWaalsContact C-N 3.28Å; V15-R17 PolarHBondContact O-N 3.05Å; V15-I18 PolarHBondContact O-N 3.43Å; V15-S19 WeakPolarHBondContact O-CB 3.26Å; V15-S19 PolarHBondContact O-N 2.99Å; V15-S19 PolarHBondContact O-OG 2.87Å; V15-K33 HydrophobicContact CG1-CB 4.22Å; V15-V36 HydrophobicContact CG1-CB 4.24Å; V15-V36 HydrophobicContact CG1-CG1 4.01Å; V15-N37 HydrophobicContact CG2-CB 4.22Å; V15-N37 VanDerWaalsContact CG2-ND2 3.34Å; V15-N37 WeakPolarHBondContact CG2-ND2 3.27Å
16	T	92.5	Very high	88.5	Confident	33 Å²	33	90.9 Å²	90.9	20%	0.202	48%	0.484	C	S	.	.	H	α-helix	trans	-59.4	-39.6	178.3	-59.7	0	0	0	0	112.1	M12 A14 K20	M12-T16 WeakPolarHBondContact O-CB 3.42Å; M12-T16 PolarHBondContact O-N 3.26Å; M12-T16 PolarHBondContact O-OG1 3.02Å; A14-T16 PolarHBondContact O-N 3.23Å; T16-K20 WeakPolarHBondContact O-CG 3.27Å; T16-K20 PolarHBondContact O-N 2.9Å
17	R	94	Very high	89.6	Confident	173 Å²	173	92.1 Å²	92.1	65%	0.653	49%	0.486	S	S	*	.	H	α-helix	trans	-64.3	-48.6	176.9	-171.5	-177.1	-60.9	163.3	0.9	111.1	S13 A14 V15 K20 L21	S13-R17 WeakPolarHBondContact O-CB 3.43Å; S13-R17 PolarHBondContact O-N 3.32Å; A14-R17 WeakPolarHBondContact O-CB 3.34Å; A14-R17 PolarHBondContact O-N 2.92Å; V15-R17 VanDerWaalsContact C-N 3.28Å; V15-R17 PolarHBondContact O-N 3.05Å; R17-K20 PolarHBondContact O-N 3.39Å; R17-L21 HydrophobicContact CG-CD1 4.47Å; R17-L21 WeakPolarHBondContact O-CG 3.47Å; R17-L21 PolarHBondContact O-N 3.38Å; R17-L21 VanDerWaalsContact O-N 3.14Å
18	I	94.2	Very high	90.7	Very high	100 Å²	100	91.7 Å²	91.7	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-61.9	-45.4	178.6	-65.5	165.3	0	0	0	110.6	A14 V15 K20 L21 V22	A14-I18 WeakPolarHBondContact O-CG1 3.31Å; A14-I18 PolarHBondContact O-N 2.94Å; V15-I18 PolarHBondContact O-N 3.43Å; I18-K20 VanDerWaalsContact C-N 3.31Å; I18-K20 PolarHBondContact O-N 3.18Å; I18-L21 WeakPolarHBondContact O-CB 3.44Å; I18-L21 PolarHBondContact O-N 2.99Å; I18-V22 HydrophobicContact CG2-CG2 4.38Å; I18-V22 WeakPolarHBondContact O-CG2 3.38Å; I18-V22 PolarHBondContact O-N 2.95Å
19	S	92.3	Very high	91.7	Very high	10 Å²	10	89.9 Å²	89.9	7%	0.07	48%	0.475	C	S	.	.	H	α-helix	trans	-57	-42.9	178.4	-62.1	0	0	0	0	112.7	V15 L21 V22 A23 F28	V15-S19 WeakPolarHBondContact O-CB 3.26Å; V15-S19 PolarHBondContact O-N 2.99Å; V15-S19 PolarHBondContact O-OG 2.87Å; S19-L21 VanDerWaalsContact C-N 3.35Å; S19-V22 PolarHBondContact O-N 3.31Å; S19-A23 PolarHBondContact O-N 3.4Å; S19-F28 WeakPolarHBondContact O-CE2 3.39Å
20	K	91.5	Very high	92.1	Very high	141 Å²	141	91.1 Å²	91.1	61%	0.613	48%	0.478	S	S	*	.	H	α-helix	trans	-68.5	-31.3	176.8	-72.4	179.8	179.2	-175.4	0	113.2	T16 R17 I18 A23 P24	T16-K20 WeakPolarHBondContact O-CG 3.27Å; T16-K20 PolarHBondContact O-N 2.9Å; R17-K20 PolarHBondContact O-N 3.39Å; I18-K20 VanDerWaalsContact C-N 3.31Å; I18-K20 PolarHBondContact O-N 3.18Å; K20-A23 CarbonylContact O-C 3.5Å; K20-P24 VanDerWaalsContact O-CA 3.26Å; K20-P24 WeakPolarHBondContact O-CA 3.41Å
21	L	92.5	Very high	92.3	Very high	136 Å²	136	94.9 Å²	94.9	71%	0.712	49%	0.493	S	S	*	.	H	α-helix	trans	-70	-40.1	176.3	-71.1	170.6	0	0	0	111.7	R17 I18 S19	R17-L21 HydrophobicContact CG-CD1 4.47Å; R17-L21 WeakPolarHBondContact O-CG 3.47Å; R17-L21 PolarHBondContact O-N 3.38Å; R17-L21 VanDerWaalsContact O-N 3.14Å; I18-L21 WeakPolarHBondContact O-CB 3.44Å; I18-L21 PolarHBondContact O-N 2.99Å; S19-L21 VanDerWaalsContact C-N 3.35Å
22	V	92.2	Very high	92.4	Very high	119 Å²	119	92.5 Å²	92.5	72%	0.721	48%	0.481	S	S	*	.	H	α-helix	trans	-76.5	-36.7	-179.2	178.2	0	0	0	0	111.7	I18 S19	I18-V22 HydrophobicContact CG2-CG2 4.38Å; I18-V22 WeakPolarHBondContact O-CG2 3.38Å; I18-V22 PolarHBondContact O-N 2.95Å; S19-V22 PolarHBondContact O-N 3.31Å
23	A	92	Very high	92.6	Very high	17 Å²	17	90.6 Å²	90.6	14%	0.14	47%	0.471	C	S	.	.			trans	-139.7	83	-178.7	0	0	0	0	0	111.5	S19 K20 N25 I26 F28	S19-A23 PolarHBondContact O-N 3.4Å; K20-A23 CarbonylContact O-C 3.5Å; A23-N25 PolarHBondContact O-N 3.42Å; A23-I26 HydrophobicContact CB-CB 3.91Å; A23-I26 HydrophobicContact CB-CD1 3.84Å; A23-I26 HydrophobicContact CB-CG1 3.97Å; A23-I26 PolarHBondContact O-N 3.09Å; A23-F28 HydrophobicContact CB-CE2 4.04Å; A23-F28 HydrophobicContact CB-CZ 4.16Å
24	P	91.2	Very high	92.5	Very high	100 Å²	100	90.1 Å²	90.1	65%	0.649	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-28.4	-173.3	23.5	-33.8	0	0	0	113.7	K20	K20-P24 VanDerWaalsContact O-CA 3.26Å; K20-P24 WeakPolarHBondContact O-CA 3.41Å
25	N	92.9	Very high	92.5	Very high	160 Å²	160	91.2 Å²	91.2	86%	0.856	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	2.6	-176.4	-59.5	-34	0	0	0	113.4	A23	A23-N25 PolarHBondContact O-N 3.42Å
26	I	92.7	Very high	92.5	Very high	109 Å²	109	94.4 Å²	94.4	56%	0.559	49%	0.49	S	S	*	.			trans	-112	129.6	-175	-56.5	-176.4	0	0	0	110.1	A23 F28	A23-I26 HydrophobicContact CB-CB 3.91Å; A23-I26 HydrophobicContact CB-CD1 3.84Å; A23-I26 HydrophobicContact CB-CG1 3.97Å; A23-I26 PolarHBondContact O-N 3.09Å; I26-F28 HydrophobicContact CB-CE2 4.36Å; I26-F28 HydrophobicContact CG2-CE2 4.32Å
27	K	90.5	Very high	92.4	Very high	210 Å²	210	93 Å²	93	91%	0.913	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-87.4	120.8	171.6	-66.6	-178.2	-178.8	176.7	0	109.5
28	F	90.4	Very high	92.3	Very high	68 Å²	68	91.1 Å²	91.1	30%	0.298	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-88.1	130.9	174.5	-70.3	-102.2	0	0	0	110.4	S19 A23 I26 A32 K33	S19-F28 WeakPolarHBondContact O-CE2 3.39Å; A23-F28 HydrophobicContact CB-CE2 4.04Å; A23-F28 HydrophobicContact CB-CZ 4.16Å; I26-F28 HydrophobicContact CB-CE2 4.36Å; I26-F28 HydrophobicContact CG2-CE2 4.32Å; F28-A32 HydrophobicContact CD1-CB 4.35Å; F28-K33 HydrophobicContact CB-CG 3.98Å; F28-K33 WeakPolarHBondContact O-CE 3.35Å
29	T	94.2	Very high	92.2	Very high	74 Å²	74	89 Å²	89	45%	0.454	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-68.4	157.6	170.3	61.3	0	0	0	0	110.6	E31 A32 K33	T29-E31 PolarHBondContact O-N 3.43Å; T29-A32 PolarHBondContact O-N 2.89Å; T29-A32 VanDerWaalsContact O-N 3.15Å; T29-A32 WeakPolarHBondContact OG1-CB 3.42Å; T29-A32 PolarHBondContact OG1-N 3.45Å; T29-K33 WeakPolarHBondContact O-CG 3.49Å; T29-K33 PolarHBondContact O-N 2.8Å
30	E	91.6	Very high	92.2	Very high	121 Å²	121	89.9 Å²	89.9	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-60.3	-36.4	176.7	-67.6	-52.7	128.5	0	0	112.1	K33 L34	E30-K33 PolarHBondContact O-N 3.37Å; E30-K33 IonicContact OE1-NZ 3.56Å; E30-K33 PolarHBondContact OE1-NZ 2.73Å; E30-K33 IonicContact OE2-NZ 2.73Å; E30-L34 WeakPolarHBondContact O-CB 3.45Å; E30-L34 PolarHBondContact O-N 3.48Å
31	E	92.3	Very high	92.2	Very high	155 Å²	155	83.6 Å²	83.6	72%	0.724	45%	0.454	S	S	*	.	H	α-helix	trans	-63.6	-41.2	174.8	-170.7	178.1	-173.4	0	0	112.2	T29 L34 A35	T29-E31 PolarHBondContact O-N 3.43Å; E31-L34 PolarHBondContact O-N 2.65Å; E31-A35 WeakPolarHBondContact O-CB 3.07Å; E31-A35 PolarHBondContact O-N 2.94Å
32	A	94.2	Very high	92.2	Very high	35 Å²	35	83.4 Å²	83.4	29%	0.289	45%	0.452	S	S	.	.	H	α-helix	trans	-64.3	-42.8	176.1	0	0	0	0	0	111.5	F28 T29 L34 A35 V36	F28-A32 HydrophobicContact CD1-CB 4.35Å; T29-A32 PolarHBondContact O-N 2.89Å; T29-A32 VanDerWaalsContact O-N 3.15Å; T29-A32 WeakPolarHBondContact OG1-CB 3.42Å; T29-A32 PolarHBondContact OG1-N 3.45Å; A32-L34 VanDerWaalsContact C-N 3.34Å; A32-L34 PolarHBondContact O-N 3.41Å; A32-A35 PolarHBondContact O-N 3.39Å; A32-V36 WeakPolarHBondContact O-CG2 3.45Å; A32-V36 PolarHBondContact O-N 2.9Å
33	K	93.2	Very high	92.3	Very high	28 Å²	28	81.7 Å²	81.7	12%	0.122	44%	0.435	C	S	.	.	H	α-helix	trans	-63	-41.9	175.7	-63	173.4	-169	169.8	0	111.4	M12 V15 F28 T29 E30 V36 N37	M12-K33 HydrophobicContact CE-CB 3.5Å; M12-K33 HydrophobicContact CE-CD 4.32Å; V15-K33 HydrophobicContact CG1-CB 4.22Å; F28-K33 HydrophobicContact CB-CG 3.98Å; F28-K33 WeakPolarHBondContact O-CE 3.35Å; T29-K33 WeakPolarHBondContact O-CG 3.49Å; T29-K33 PolarHBondContact O-N 2.8Å; E30-K33 PolarHBondContact O-N 3.37Å; E30-K33 IonicContact OE1-NZ 3.56Å; E30-K33 PolarHBondContact OE1-NZ 2.73Å; E30-K33 IonicContact OE2-NZ 2.73Å; K33-V36 PolarHBondContact O-N 2.95Å; K33-N37 WeakPolarHBondContact O-CB 3.35Å; K33-N37 PolarHBondContact O-N 3.17Å
34	L	91.8	Very high	92.3	Very high	70 Å²	70	84.2 Å²	84.2	37%	0.366	45%	0.448	S	S	.	.	H	α-helix	trans	-64	-40.5	176.8	-174.5	66.7	0	0	0	111.5	E30 E31 A32 N37 R38	E30-L34 WeakPolarHBondContact O-CB 3.45Å; E30-L34 PolarHBondContact O-N 3.48Å; E31-L34 PolarHBondContact O-N 2.65Å; A32-L34 VanDerWaalsContact C-N 3.34Å; A32-L34 PolarHBondContact O-N 3.41Å; L34-N37 WeakPolarHBondContact O-CB 3.49Å; L34-N37 PolarHBondContact O-N 3.48Å; L34-R38 WeakPolarHBondContact O-CG 3.43Å; L34-R38 PolarHBondContact O-N 3.23Å
35	A	92.4	Very high	92.3	Very high	54 Å²	54	85.2 Å²	85.2	45%	0.446	45%	0.447	S	S	.	.	H	α-helix	trans	-62.1	-45.1	175.3	0	0	0	0	0	111.6	E31 A32 N37 R38 A39	E31-A35 WeakPolarHBondContact O-CB 3.07Å; E31-A35 PolarHBondContact O-N 2.94Å; A32-A35 PolarHBondContact O-N 3.39Å; A35-N37 VanDerWaalsContact C-N 3.33Å; A35-N37 PolarHBondContact O-N 2.88Å; A35-R38 PolarHBondContact O-N 3.47Å; A35-A39 VanDerWaalsContact O-CB 3.29Å; A35-A39 WeakPolarHBondContact O-CB 3.37Å; A35-A39 PolarHBondContact O-N 3.04Å
36	V	93	Very high	92.4	Very high	70 Å²	70	83.1 Å²	83.1	42%	0.424	43%	0.428	S	S	.	.	H	α-helix	trans	-61.9	-41.2	174.6	172.6	0	0	0	0	111.2	V15 A32 K33 A39 A40	V15-V36 HydrophobicContact CG1-CB 4.24Å; V15-V36 HydrophobicContact CG1-CG1 4.01Å; A32-V36 WeakPolarHBondContact O-CG2 3.45Å; A32-V36 PolarHBondContact O-N 2.9Å; K33-V36 PolarHBondContact O-N 2.95Å; V36-A39 PolarHBondContact O-N 3.48Å; V36-A40 WeakPolarHBondContact O-CB 3.48Å; V36-A40 PolarHBondContact O-N 3.44Å
37	N	92	Very high	92.4	Very high	3 Å²	3	78.4 Å²	78.4	2%	0.016	41%	0.405	C	S	.	.	H	α-helix	trans	-59.9	-49	178.1	-163.1	-74.7	0	0	0	111.7	N9 L10 M12 V15 K33 L34 A35 A40 G41	N9-N37 WeakPolarHBondContact CA-OD1 3.41Å; N9-N37 VanDerWaalsContact CB-OD1 3.25Å; N9-N37 WeakPolarHBondContact CB-OD1 3.37Å; N9-N37 PolarHBondContact OD1-OD1 3.07Å; L10-N37 PolarHBondContact N-ND2 3.15Å; L10-N37 PolarHBondContact N-OD1 2.99Å; L10-N37 PolarHBondContact O-ND2 2.67Å; M12-N37 HydrophobicContact SD-CB 4.23Å; V15-N37 HydrophobicContact CG2-CB 4.22Å; V15-N37 VanDerWaalsContact CG2-ND2 3.34Å; V15-N37 WeakPolarHBondContact CG2-ND2 3.27Å; K33-N37 WeakPolarHBondContact O-CB 3.35Å; K33-N37 PolarHBondContact O-N 3.17Å; L34-N37 WeakPolarHBondContact O-CB 3.49Å; L34-N37 PolarHBondContact O-N 3.48Å; A35-N37 VanDerWaalsContact C-N 3.33Å; A35-N37 PolarHBondContact O-N 2.88Å; N37-A40 PolarHBondContact O-N 2.88Å; N37-G41 PolarHBondContact O-N 2.96Å
38	R	90.9	Very high	92.6	Very high	133 Å²	133	71.1 Å²	71.1	50%	0.502	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-44.1	175.9	-69.8	175.3	179.3	172.4	-0.3	111.9	L34 A35 A40 G41 M42	L34-R38 WeakPolarHBondContact O-CG 3.43Å; L34-R38 PolarHBondContact O-N 3.23Å; A35-R38 PolarHBondContact O-N 3.47Å; R38-A40 VanDerWaalsContact C-N 3.31Å; R38-A40 PolarHBondContact O-N 3.23Å; R38-G41 PolarHBondContact O-N 2.97Å; R38-M42 WeakPolarHBondContact O-CG 3.36Å; R38-M42 PolarHBondContact O-N 2.93Å
39	A	92.7	Very high	92.8	Very high	56 Å²	56	72.6 Å²	72.6	46%	0.463	39%	0.389	S	S	.	.	H	α-helix	trans	-62.5	-37.8	178.2	0	0	0	0	0	112	A35 V36 M42 F43	A35-A39 VanDerWaalsContact O-CB 3.29Å; A35-A39 WeakPolarHBondContact O-CB 3.37Å; A35-A39 PolarHBondContact O-N 3.04Å; V36-A39 PolarHBondContact O-N 3.48Å; A39-M42 PolarHBondContact O-N 3.42Å; A39-F43 WeakPolarHBondContact O-CB 3.34Å; A39-F43 PolarHBondContact O-N 2.81Å
40	A	92.9	Very high	92.9	Very high	29 Å²	29	70.1 Å²	70.1	24%	0.24	37%	0.373	C	S	.	.	H	α-helix	trans	-64.8	-42.3	176.1	0	0	0	0	0	112	L10 V36 N37 R38 F43 V44	L10-A40 HydrophobicContact CD1-CB 3.47Å; L10-A40 VanDerWaalsContact CD1-CB 3.47Å; V36-A40 WeakPolarHBondContact O-CB 3.48Å; V36-A40 PolarHBondContact O-N 3.44Å; N37-A40 PolarHBondContact O-N 2.88Å; R38-A40 VanDerWaalsContact C-N 3.31Å; R38-A40 PolarHBondContact O-N 3.23Å; A40-F43 WeakPolarHBondContact O-CB 3.22Å; A40-F43 PolarHBondContact O-N 3.21Å; A40-V44 WeakPolarHBondContact O-CG2 3.41Å; A40-V44 PolarHBondContact O-N 2.88Å
41	G	91.6	Very high	93	Very high	8 Å²	8	64.4 Å²	64.4	8%	0.082	35%	0.346	C	S	.	.	H	α-helix	trans	-60.4	-45.1	173.4	0	0	0	0	0	112.3	L8 N37 R38 F43 V44 L45	L8-G41 WeakPolarHBondContact O-CA 3.35Å; N37-G41 PolarHBondContact O-N 2.96Å; R38-G41 PolarHBondContact O-N 2.97Å; G41-F43 VanDerWaalsContact C-N 3.33Å; G41-F43 PolarHBondContact O-N 3.41Å; G41-V44 PolarHBondContact O-N 3.48Å; G41-L45 PolarHBondContact O-N 2.87Å; G41-L45 VanDerWaalsContact O-N 3.11Å
42	M	91.8	Very high	93.2	Very high	133 Å²	133	62.6 Å²	62.6	66%	0.655	33%	0.332	S	S	*	.	H	α-helix	trans	-62.3	-39.5	174.5	-70.6	-179.8	66.9	0	0	112.4	R38 A39 L45 Y46	R38-M42 WeakPolarHBondContact O-CG 3.36Å; R38-M42 PolarHBondContact O-N 2.93Å; A39-M42 PolarHBondContact O-N 3.42Å; M42-L45 PolarHBondContact O-N 3.42Å; M42-Y46 VanDerWaalsContact O-CB 3.23Å; M42-Y46 WeakPolarHBondContact O-CB 3.21Å; M42-Y46 PolarHBondContact O-N 3.14Å
43	F	93.5	Very high	93.2	Very high	83 Å²	83	65.8 Å²	65.8	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-45.2	177.9	175.6	-98.7	0	0	0	111.5	A39 A40 G41 T47 L72	A39-F43 WeakPolarHBondContact O-CB 3.34Å; A39-F43 PolarHBondContact O-N 2.81Å; A40-F43 WeakPolarHBondContact O-CB 3.22Å; A40-F43 PolarHBondContact O-N 3.21Å; G41-F43 VanDerWaalsContact C-N 3.33Å; G41-F43 PolarHBondContact O-N 3.41Å; F43-T47 WeakPolarHBondContact O-CB 3.27Å; F43-T47 PolarHBondContact O-N 2.7Å; F43-T47 PolarHBondContact O-OG1 3.02Å; F43-L72 HydrophobicContact CZ-CD2 4.28Å
44	V	92.8	Very high	93.3	Very high	69 Å²	69	65.3 Å²	65.3	42%	0.418	34%	0.341	S	S	.	.	H	α-helix	trans	-62.6	-45.7	177.3	173.7	0	0	0	0	110.8	L8 A40 G41 S48	L8-V44 HydrophobicContact CD2-CG1 4.27Å; A40-V44 WeakPolarHBondContact O-CG2 3.41Å; A40-V44 PolarHBondContact O-N 2.88Å; G41-V44 PolarHBondContact O-N 3.48Å; V44-S48 VanDerWaalsContact O-CB 3.29Å; V44-S48 WeakPolarHBondContact O-CB 3.36Å; V44-S48 PolarHBondContact O-N 3.09Å; V44-S48 PolarHBondContact O-OG 3.33Å
45	L	91.6	Very high	93.5	Very high	121 Å²	121	62 Å²	62	63%	0.634	32%	0.324	S	S	*	.	H	α-helix	trans	-63.5	-48.9	179.5	-179.6	60.5	0	0	0	111.8	G41 M42 S48 M49	G41-L45 PolarHBondContact O-N 2.87Å; G41-L45 VanDerWaalsContact O-N 3.11Å; M42-L45 PolarHBondContact O-N 3.42Å; L45-S48 PolarHBondContact O-N 3.37Å; L45-M49 PolarHBondContact O-N 3.22Å
46	Y	93.7	Very high	93.6	Very high	116 Å²	116	62.4 Å²	62.4	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-47.8	179.9	178.7	-115.2	0	0	0	111.5	M42 S48 M49 M50 F71	M42-Y46 VanDerWaalsContact O-CB 3.23Å; M42-Y46 WeakPolarHBondContact O-CB 3.21Å; M42-Y46 PolarHBondContact O-N 3.14Å; Y46-S48 VanDerWaalsContact C-N 3.29Å; Y46-S48 PolarHBondContact O-N 3.35Å; Y46-M49 HydrophobicContact CD2-CE 4.13Å; Y46-M49 HydrophobicContact CE2-CE 4.38Å; Y46-M49 PolarHBondContact O-N 2.7Å; Y46-M50 HydrophobicContact CD1-CG 4.46Å; Y46-M50 HydrophobicContact CD2-CG 4.08Å; Y46-M50 HydrophobicContact CE1-CG 4.1Å; Y46-M50 HydrophobicContact CE2-CE 4.24Å; Y46-M50 HydrophobicContact CE2-CG 3.63Å; Y46-M50 HydrophobicContact CE2-SD 3.8Å; Y46-M50 HydrophobicContact CG-CG 4.46Å; Y46-M50 VanDerWaalsContact O-CG 3.32Å; Y46-M50 WeakPolarHBondContact O-CG 3.3Å; Y46-M50 PolarHBondContact O-N 3.11Å; Y46-F71 HydrophobicContact CD1-CZ 4.15Å; Y46-F71 HydrophobicContact CE1-CE2 4.29Å; Y46-F71 AromaticContact CE1-CZ 3.67Å; Y46-F71 HydrophobicContact CE1-CZ 3.67Å
47	T	94.4	Very high	93.6	Very high	11 Å²	11	64.5 Å²	64.5	7%	0.067	33%	0.333	C	S	.	.	H	α-helix	trans	-60.9	-39.8	177.6	-57.3	0	0	0	0	111.3	F43 M50 A51 I68 F71	F43-T47 WeakPolarHBondContact O-CB 3.27Å; F43-T47 PolarHBondContact O-N 2.7Å; F43-T47 PolarHBondContact O-OG1 3.02Å; T47-M50 PolarHBondContact O-N 3.01Å; T47-A51 WeakPolarHBondContact O-CB 3.33Å; T47-A51 PolarHBondContact O-N 2.65Å; T47-I68 HydrophobicContact CG2-CG2 3.76Å; T47-F71 HydrophobicContact CG2-CD1 3.97Å; T47-F71 HydrophobicContact CG2-CE1 3.94Å
48	S	93.5	Very high	93.6	Very high	56 Å²	56	68.7 Å²	68.7	39%	0.392	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-42.1	176.7	-59.4	0	0	0	0	112	V44 L45 Y46 W52	V44-S48 VanDerWaalsContact O-CB 3.29Å; V44-S48 WeakPolarHBondContact O-CB 3.36Å; V44-S48 PolarHBondContact O-N 3.09Å; V44-S48 PolarHBondContact O-OG 3.33Å; L45-S48 PolarHBondContact O-N 3.37Å; Y46-S48 VanDerWaalsContact C-N 3.29Å; Y46-S48 PolarHBondContact O-N 3.35Å; S48-W52 WeakPolarHBondContact O-CB 3.42Å; S48-W52 PolarHBondContact O-N 2.8Å
49	M	94.6	Very high	93.7	Very high	99 Å²	99	72 Å²	72	49%	0.488	37%	0.371	S	S	.	.	H	α-helix	trans	-64.1	-44.9	177	-174.5	174.4	79.2	0	0	111.7	L45 Y46 W52 E53	L45-M49 PolarHBondContact O-N 3.22Å; Y46-M49 HydrophobicContact CD2-CE 4.13Å; Y46-M49 HydrophobicContact CE2-CE 4.38Å; Y46-M49 PolarHBondContact O-N 2.7Å; M49-W52 VanDerWaalsContact O-CB 3.31Å; M49-W52 WeakPolarHBondContact O-CB 3.3Å; M49-W52 PolarHBondContact O-N 2.96Å; M49-E53 PolarHBondContact O-N 3.12Å; M49-E53 VanDerWaalsContact O-N 3.11Å
50	M	95.6	Very high	93.7	Very high	23 Å²	23	71.3 Å²	71.3	11%	0.113	36%	0.356	C	S	.	.	H	α-helix	trans	-70.6	-38.8	179	-61.4	-70.1	93.3	0	0	112.2	Y46 T47 W52 E53 V54 F71	Y46-M50 HydrophobicContact CD1-CG 4.46Å; Y46-M50 HydrophobicContact CD2-CG 4.08Å; Y46-M50 HydrophobicContact CE1-CG 4.1Å; Y46-M50 HydrophobicContact CE2-CE 4.24Å; Y46-M50 HydrophobicContact CE2-CG 3.63Å; Y46-M50 HydrophobicContact CE2-SD 3.8Å; Y46-M50 HydrophobicContact CG-CG 4.46Å; Y46-M50 VanDerWaalsContact O-CG 3.32Å; Y46-M50 WeakPolarHBondContact O-CG 3.3Å; Y46-M50 PolarHBondContact O-N 3.11Å; T47-M50 PolarHBondContact O-N 3.01Å; M50-W52 PolarHBondContact O-N 2.74Å; M50-E53 VanDerWaalsContact CE-CD 3.41Å; M50-E53 HydrophobicContact CE-CG 4.36Å; M50-E53 WeakPolarHBondContact CE-OE1 3.31Å; M50-E53 WeakPolarHBondContact CE-OE2 3.29Å; M50-E53 WeakPolarHBondContact O-CB 3.09Å; M50-E53 PolarHBondContact O-N 3.42Å; M50-E53 VanDerWaalsContact O-N 3.12Å; M50-V54 WeakPolarHBondContact O-CG2 3.36Å; M50-V54 PolarHBondContact O-N 2.83Å; M50-F71 HydrophobicContact CB-CD1 4.11Å; M50-F71 HydrophobicContact CB-CD2 3.3Å; M50-F71 HydrophobicContact CB-CE1 4.11Å; M50-F71 HydrophobicContact CB-CE2 3.29Å; M50-F71 HydrophobicContact CB-CG 3.72Å; M50-F71 HydrophobicContact CB-CZ 3.72Å; M50-F71 HydrophobicContact CG-CD2 3.94Å; M50-F71 HydrophobicContact CG-CE1 4.49Å; M50-F71 HydrophobicContact CG-CE2 3.38Å; M50-F71 HydrophobicContact CG-CZ 3.71Å; M50-F71 HydrophobicContact SD-CE2 4.26Å
51	A	94.9	Very high	93.7	Very high	0 Å²	0	78.7 Å²	78.7	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63.4	-32	172.7	0	0	0	0	0	111.9	T47 V54 A55 I63 D67 I68	T47-A51 WeakPolarHBondContact O-CB 3.33Å; T47-A51 PolarHBondContact O-N 2.65Å; A51-V54 PolarHBondContact O-N 3.31Å; A51-A55 WeakPolarHBondContact O-CB 3.46Å; A51-A55 PolarHBondContact O-N 2.92Å; A51-I63 HydrophobicContact CB-CG2 3.74Å; A51-D67 HydrophobicContact CB-CB 4.28Å; A51-I68 HydrophobicContact CB-CB 4.49Å; A51-I68 HydrophobicContact CB-CG1 3.66Å
52	W	95.8	Very high	93.9	Very high	117 Å²	117	82.9 Å²	82.9	44%	0.443	41%	0.407	S	S	.	.	H	α-helix	trans	-64.2	-42.3	170.7	178.6	-101.3	0	0	0	112.5	S48 M49 M50 V54 A55 T56 K61 I63	S48-W52 WeakPolarHBondContact O-CB 3.42Å; S48-W52 PolarHBondContact O-N 2.8Å; M49-W52 VanDerWaalsContact O-CB 3.31Å; M49-W52 WeakPolarHBondContact O-CB 3.3Å; M49-W52 PolarHBondContact O-N 2.96Å; M50-W52 PolarHBondContact O-N 2.74Å; W52-V54 VanDerWaalsContact C-N 3.32Å; W52-V54 PolarHBondContact O-N 3.49Å; W52-A55 PolarHBondContact O-N 3.46Å; W52-T56 HydrophobicContact CD2-CG2 4.07Å; W52-T56 HydrophobicContact CG-CG2 4.37Å; W52-T56 HydrophobicContact CZ2-CG2 3.82Å; W52-T56 WeakPolarHBondContact O-CB 3.21Å; W52-T56 WeakPolarHBondContact O-CG2 3.32Å; W52-T56 PolarHBondContact O-N 3.22Å; W52-T56 PolarHBondContact O-OG1 3.14Å; W52-K61 HydrophobicContact CH2-CB 4.35Å; W52-K61 VanDerWaalsContact CZ3-O 3.27Å; W52-K61 WeakPolarHBondContact CZ3-O 3.05Å; W52-I63 HydrophobicContact CB-CD1 4.02Å; W52-I63 HydrophobicContact CB-CG1 4.44Å; W52-I63 HydrophobicContact CE3-CD1 4.07Å; W52-I63 HydrophobicContact CE3-CG1 3.82Å
53	E	95.1	Very high	94	Very high	102 Å²	102	79.6 Å²	79.6	48%	0.477	39%	0.392	S	S	.	.	H	α-helix	trans	-61.3	-40.4	174.3	-69.1	-178.1	179.2	0	0	111.9	M49 M50 T56 T57	M49-E53 PolarHBondContact O-N 3.12Å; M49-E53 VanDerWaalsContact O-N 3.11Å; M50-E53 VanDerWaalsContact CE-CD 3.41Å; M50-E53 HydrophobicContact CE-CG 4.36Å; M50-E53 WeakPolarHBondContact CE-OE1 3.31Å; M50-E53 WeakPolarHBondContact CE-OE2 3.29Å; M50-E53 WeakPolarHBondContact O-CB 3.09Å; M50-E53 PolarHBondContact O-N 3.42Å; M50-E53 VanDerWaalsContact O-N 3.12Å; E53-T56 WeakPolarHBondContact CA-OG1 3.23Å; E53-T56 PolarHBondContact O-OG1 3.37Å; E53-T57 WeakPolarHBondContact O-CB 3.39Å; E53-T57 PolarHBondContact O-N 2.99Å; E53-T57 PolarHBondContact O-OG1 3.4Å
54	V	94.6	Very high	94	Very high	19 Å²	19	82.7 Å²	82.7	12%	0.115	40%	0.401	C	S	.	.	H	α-helix	trans	-63.5	-43.5	174.2	175.6	0	0	0	0	111.6	M50 A51 W52 Q58 D67 K70 F71	M50-V54 WeakPolarHBondContact O-CG2 3.36Å; M50-V54 PolarHBondContact O-N 2.83Å; A51-V54 PolarHBondContact O-N 3.31Å; W52-V54 VanDerWaalsContact C-N 3.32Å; W52-V54 PolarHBondContact O-N 3.49Å; V54-Q58 PolarHBondContact O-N 3.02Å; V54-D67 HydrophobicContact CB-CB 4.24Å; V54-D67 HydrophobicContact CG1-CB 4.01Å; V54-K70 HydrophobicContact CG1-CB 4.44Å; V54-K70 HydrophobicContact CG1-CD 3.87Å; V54-F71 HydrophobicContact CG2-CB 4.2Å
55	A	95.5	Very high	94	Very high	0 Å²	0	81.7 Å²	81.7	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-65.8	-42.9	179.2	0	0	0	0	0	112.3	A51 W52 Q58 K59 R60	A51-A55 WeakPolarHBondContact O-CB 3.46Å; A51-A55 PolarHBondContact O-N 2.92Å; W52-A55 PolarHBondContact O-N 3.46Å; A55-Q58 CarbonylContact O-C 3.56Å; A55-Q58 WeakPolarHBondContact O-CA 3.27Å; A55-Q58 PolarHBondContact O-N 3.21Å; A55-Q58 VanDerWaalsContact O-N 3.08Å; A55-K59 PolarHBondContact O-N 3.28Å; A55-R60 CarbonylContact C-O 3.58Å; A55-R60 PolarHBondContact O-N 3.41Å
56	T	94.8	Very high	94.1	Very high	62 Å²	62	79.4 Å²	79.4	38%	0.38	39%	0.388	S	S	.	.	H	α-helix	trans	-68.5	-34.9	179.2	51.4	0	0	0	0	112.2	W52 E53 Q58 K59	W52-T56 HydrophobicContact CD2-CG2 4.07Å; W52-T56 HydrophobicContact CG-CG2 4.37Å; W52-T56 HydrophobicContact CZ2-CG2 3.82Å; W52-T56 WeakPolarHBondContact O-CB 3.21Å; W52-T56 WeakPolarHBondContact O-CG2 3.32Å; W52-T56 PolarHBondContact O-N 3.22Å; W52-T56 PolarHBondContact O-OG1 3.14Å; E53-T56 WeakPolarHBondContact CA-OG1 3.23Å; E53-T56 PolarHBondContact O-OG1 3.37Å; T56-Q58 PolarHBondContact O-N 3.27Å; T56-K59 WeakPolarHBondContact O-CA 3.28Å; T56-K59 PolarHBondContact O-N 2.83Å
57	T	93.8	Very high	94.2	Very high	114 Å²	114	73.9 Å²	73.9	70%	0.699	37%	0.366	S	S	*	.	H	α-helix	trans	-57.4	-33.9	169.6	-58.9	0	0	0	0	111.5	E53 K59	E53-T57 WeakPolarHBondContact O-CB 3.39Å; E53-T57 PolarHBondContact O-N 2.99Å; E53-T57 PolarHBondContact O-OG1 3.4Å; T57-K59 VanDerWaalsContact C-N 3.27Å; T57-K59 PolarHBondContact O-N 3.42Å
58	Q	92.3	Very high	94.3	Very high	92 Å²	92	75.9 Å²	75.9	43%	0.43	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	15.9	175.1	-61.9	-176.7	33.7	0	0	113.6	V54 A55 T56 R60	V54-Q58 PolarHBondContact O-N 3.02Å; A55-Q58 CarbonylContact O-C 3.56Å; A55-Q58 WeakPolarHBondContact O-CA 3.27Å; A55-Q58 PolarHBondContact O-N 3.21Å; A55-Q58 VanDerWaalsContact O-N 3.08Å; T56-Q58 PolarHBondContact O-N 3.27Å; Q58-R60 PolarHBondContact O-N 3.36Å
59	K	92.6	Very high	94.4	Very high	203 Å²	203	74.7 Å²	74.7	88%	0.883	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	27.1	-178.4	-57.7	178.4	179.9	178	0	113.8	A55 T56 T57	A55-K59 PolarHBondContact O-N 3.28Å; T56-K59 WeakPolarHBondContact O-CA 3.28Å; T56-K59 PolarHBondContact O-N 2.83Å; T57-K59 VanDerWaalsContact C-N 3.27Å; T57-K59 PolarHBondContact O-N 3.42Å
60	R	93.7	Very high	94.3	Very high	40 Å²	40	74.3 Å²	74.3	15%	0.151	36%	0.361	C	S	.	.			trans	-104.5	147.5	176.8	-69.9	-176.2	-73.6	100.3	-5.7	110.8	A55 Q58 T62 D67	A55-R60 CarbonylContact C-O 3.58Å; A55-R60 PolarHBondContact O-N 3.41Å; Q58-R60 PolarHBondContact O-N 3.36Å; R60-T62 PolarHBondContact NH1-O 2.85Å; R60-D67 IonicContact CZ-OD1 3.01Å; R60-D67 IonicContact CZ-OD2 2.65Å; R60-D67 IonicContact NH1-OD1 3.97Å; R60-D67 IonicContact NH1-OD2 2.7Å; R60-D67 PolarHBondContact NH1-OD2 3.45Å; R60-D67 IonicContact NH2-OD1 2.65Å; R60-D67 PolarHBondContact NH2-OD1 2.75Å; R60-D67 IonicContact NH2-OD2 3.56Å; R60-D67 PolarHBondContact NH2-OD2 2.93Å
61	K	92.7	Very high	94.3	Very high	185 Å²	185	73.9 Å²	73.9	80%	0.804	36%	0.358	S	S	*	.	S	Bend	trans	-101.9	9	172.4	-60.7	-175.7	179.5	-178.8	0	112.8	W52	W52-K61 HydrophobicContact CH2-CB 4.35Å; W52-K61 VanDerWaalsContact CZ3-O 3.27Å; W52-K61 WeakPolarHBondContact CZ3-O 3.05Å
62	T	94.1	Very high	94.3	Very high	95 Å²	95	74 Å²	74	58%	0.583	36%	0.359	S	S	*	.	S	Bend	trans	-128.1	122.8	-177	-51	0	0	0	0	108.4	R60	R60-T62 PolarHBondContact NH1-O 2.85Å
63	I	94	Very high	94.2	Very high	65 Å²	65	72.5 Å²	72.5	33%	0.333	36%	0.359	S	S	.	.			trans	-73.6	130.2	173.6	-54.8	175.8	0	0	0	108.3	A51 W52 D67 I68	A51-I63 HydrophobicContact CB-CG2 3.74Å; W52-I63 HydrophobicContact CB-CD1 4.02Å; W52-I63 HydrophobicContact CB-CG1 4.44Å; W52-I63 HydrophobicContact CE3-CD1 4.07Å; W52-I63 HydrophobicContact CE3-CG1 3.82Å; I63-D67 HydrophobicContact CG2-CB 4.3Å; I63-I68 HydrophobicContact CG2-CG1 4.27Å
64	R	93.7	Very high	94.1	Very high	148 Å²	148	72.8 Å²	72.8	56%	0.558	36%	0.364	S	S	*	.			trans	-111.1	162.3	175	-64.4	-179.5	178.1	179.4	-1.1	110.3	T66 D67	R64-T66 PolarHBondContact O-N 3.41Å; R64-D67 PolarHBondContact N-OD2 2.95Å; R64-D67 WeakPolarHBondContact O-CB 3.28Å; R64-D67 PolarHBondContact O-N 3.38Å
65	S	93.6	Very high	94	Very high	47 Å²	47	74.5 Å²	74.5	33%	0.329	38%	0.377	S	S	.	.	H	α-helix	trans	-56.5	-35.3	174.4	56.3	0	0	0	0	112	D67 I68 I69 D88	S65-D67 PolarHBondContact O-N 3.45Å; S65-I68 PolarHBondContact O-N 3.29Å; S65-I69 WeakPolarHBondContact O-CG1 3.3Å; S65-I69 PolarHBondContact O-N 3.28Å; S65-D88 WeakPolarHBondContact CB-OD1 3.28Å; S65-D88 PolarHBondContact OG-OD1 3.11Å; S65-D88 VanDerWaalsContact OG-OD1 3.05Å; S65-D88 PolarHBondContact OG-OD2 3.3Å
66	T	93.9	Very high	93.9	Very high	73 Å²	73	77.1 Å²	77.1	45%	0.448	40%	0.404	S	S	.	.	H	α-helix	trans	-60.3	-30	174.9	56.3	0	0	0	0	113.8	R64 K70	R64-T66 PolarHBondContact O-N 3.41Å; T66-K70 VanDerWaalsContact O-CB 3.27Å; T66-K70 WeakPolarHBondContact O-CB 3.42Å; T66-K70 PolarHBondContact O-N 3.25Å
67	D	95.3	Very high	93.7	Very high	0 Å²	0	77 Å²	77	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-73.2	-40.1	-179.8	-59.4	-35.4	0	0	0	111	A51 V54 R60 I63 R64 S65 F71	A51-D67 HydrophobicContact CB-CB 4.28Å; V54-D67 HydrophobicContact CB-CB 4.24Å; V54-D67 HydrophobicContact CG1-CB 4.01Å; R60-D67 IonicContact CZ-OD1 3.01Å; R60-D67 IonicContact CZ-OD2 2.65Å; R60-D67 IonicContact NH1-OD1 3.97Å; R60-D67 IonicContact NH1-OD2 2.7Å; R60-D67 PolarHBondContact NH1-OD2 3.45Å; R60-D67 IonicContact NH2-OD1 2.65Å; R60-D67 PolarHBondContact NH2-OD1 2.75Å; R60-D67 IonicContact NH2-OD2 3.56Å; R60-D67 PolarHBondContact NH2-OD2 2.93Å; I63-D67 HydrophobicContact CG2-CB 4.3Å; R64-D67 PolarHBondContact N-OD2 2.95Å; R64-D67 WeakPolarHBondContact O-CB 3.28Å; R64-D67 PolarHBondContact O-N 3.38Å; S65-D67 PolarHBondContact O-N 3.45Å; D67-F71 WeakPolarHBondContact O-CB 3.39Å; D67-F71 PolarHBondContact O-N 2.91Å
68	I	95.9	Very high	93.5	Very high	53 Å²	53	78 Å²	78	27%	0.272	40%	0.396	S	S	.	.	H	α-helix	trans	-66	-48.5	175.5	-59.5	170.4	0	0	0	109.8	T47 A51 I63 S65 K70 F71 L72 L84	T47-I68 HydrophobicContact CG2-CG2 3.76Å; A51-I68 HydrophobicContact CB-CB 4.49Å; A51-I68 HydrophobicContact CB-CG1 3.66Å; I63-I68 HydrophobicContact CG2-CG1 4.27Å; S65-I68 PolarHBondContact O-N 3.29Å; I68-K70 VanDerWaalsContact C-N 3.33Å; I68-K70 PolarHBondContact O-N 2.96Å; I68-F71 PolarHBondContact O-N 2.93Å; I68-L72 HydrophobicContact CG2-CD1 3.85Å; I68-L72 HydrophobicContact CG2-CG 4.37Å; I68-L72 VanDerWaalsContact O-CG 3.3Å; I68-L72 WeakPolarHBondContact O-CG 3.42Å; I68-L72 PolarHBondContact O-N 3.27Å; I68-L84 HydrophobicContact CG2-CD2 4Å
69	I	95.1	Very high	93.4	Very high	31 Å²	31	80.7 Å²	80.7	16%	0.159	41%	0.414	C	S	.	.	H	α-helix	trans	-60	-44.2	179.3	-69.1	168.2	0	0	0	110.8	S65 L72 N73 V81 L84 D88	S65-I69 WeakPolarHBondContact O-CG1 3.3Å; S65-I69 PolarHBondContact O-N 3.28Å; I69-L72 PolarHBondContact O-N 3.01Å; I69-N73 WeakPolarHBondContact O-CB 3.36Å; I69-N73 PolarHBondContact O-N 3.39Å; I69-V81 HydrophobicContact CG2-CG1 4.08Å; I69-L84 HydrophobicContact CG1-CD2 3.8Å; I69-L84 HydrophobicContact CG1-CG 4.15Å; I69-D88 HydrophobicContact CD1-CB 4.41Å
70	K	94.3	Very high	93.4	Very high	92 Å²	92	74.6 Å²	74.6	40%	0.4	39%	0.39	S	S	.	.	H	α-helix	trans	-60.9	-49.3	176.7	-177	-179.1	174.8	-167.1	0	111.4	V54 T66 I68 L72 N73 D74	V54-K70 HydrophobicContact CG1-CB 4.44Å; V54-K70 HydrophobicContact CG1-CD 3.87Å; T66-K70 VanDerWaalsContact O-CB 3.27Å; T66-K70 WeakPolarHBondContact O-CB 3.42Å; T66-K70 PolarHBondContact O-N 3.25Å; I68-K70 VanDerWaalsContact C-N 3.33Å; I68-K70 PolarHBondContact O-N 2.96Å; K70-L72 VanDerWaalsContact C-N 3.33Å; K70-L72 PolarHBondContact O-N 3.4Å; K70-N73 PolarHBondContact O-N 2.87Å; K70-D74 WeakPolarHBondContact CE-OD2 3.5Å; K70-D74 WeakPolarHBondContact O-CB 3.25Å; K70-D74 VanDerWaalsContact O-CG 3.26Å; K70-D74 PolarHBondContact O-N 2.83Å
71	F	94.7	Very high	93.4	Very high	13 Å²	13	73.3 Å²	73.3	6%	0.057	39%	0.387	C	S	.	.	H	α-helix	trans	-56.5	-46.2	177.5	157.9	-107.6	0	0	0	112.3	Y46 T47 M50 V54 D67 I68 N73 D74 S75	Y46-F71 HydrophobicContact CD1-CZ 4.15Å; Y46-F71 HydrophobicContact CE1-CE2 4.29Å; Y46-F71 AromaticContact CE1-CZ 3.67Å; Y46-F71 HydrophobicContact CE1-CZ 3.67Å; T47-F71 HydrophobicContact CG2-CD1 3.97Å; T47-F71 HydrophobicContact CG2-CE1 3.94Å; M50-F71 HydrophobicContact CB-CD1 4.11Å; M50-F71 HydrophobicContact CB-CD2 3.3Å; M50-F71 HydrophobicContact CB-CE1 4.11Å; M50-F71 HydrophobicContact CB-CE2 3.29Å; M50-F71 HydrophobicContact CB-CG 3.72Å; M50-F71 HydrophobicContact CB-CZ 3.72Å; M50-F71 HydrophobicContact CG-CD2 3.94Å; M50-F71 HydrophobicContact CG-CE1 4.49Å; M50-F71 HydrophobicContact CG-CE2 3.38Å; M50-F71 HydrophobicContact CG-CZ 3.71Å; M50-F71 HydrophobicContact SD-CE2 4.26Å; V54-F71 HydrophobicContact CG2-CB 4.2Å; D67-F71 WeakPolarHBondContact O-CB 3.39Å; D67-F71 PolarHBondContact O-N 2.91Å; I68-F71 PolarHBondContact O-N 2.93Å; F71-N73 VanDerWaalsContact C-N 3.32Å; F71-N73 PolarHBondContact O-N 2.91Å; F71-D74 PolarHBondContact O-N 3.31Å; F71-S75 WeakPolarHBondContact CD2-OG 3.31Å; F71-S75 WeakPolarHBondContact CE2-OG 3.32Å; F71-S75 VanDerWaalsContact O-CB 3.28Å; F71-S75 WeakPolarHBondContact O-CB 3.4Å; F71-S75 PolarHBondContact O-N 2.97Å; F71-S75 PolarHBondContact O-OG 3.12Å
72	L	95	Very high	93.4	Very high	3 Å²	3	67.4 Å²	67.4	2%	0.016	37%	0.372	C	S	.	.	H	α-helix	trans	-66.3	-35.6	-179.2	-68.4	171.4	0	0	0	112	F43 I68 I69 K70 S75 G76 Q77 I80 V81 L84	F43-L72 HydrophobicContact CZ-CD2 4.28Å; I68-L72 HydrophobicContact CG2-CD1 3.85Å; I68-L72 HydrophobicContact CG2-CG 4.37Å; I68-L72 VanDerWaalsContact O-CG 3.3Å; I68-L72 WeakPolarHBondContact O-CG 3.42Å; I68-L72 PolarHBondContact O-N 3.27Å; I69-L72 PolarHBondContact O-N 3.01Å; K70-L72 VanDerWaalsContact C-N 3.33Å; K70-L72 PolarHBondContact O-N 3.4Å; L72-S75 PolarHBondContact O-N 2.86Å; L72-G76 PolarHBondContact O-N 3.35Å; L72-Q77 HydrophobicContact CB-CB 4.45Å; L72-Q77 HydrophobicContact CD2-CB 4.38Å; L72-Q77 PolarHBondContact O-N 2.95Å; L72-I80 HydrophobicContact CD1-CG2 3.97Å; L72-V81 HydrophobicContact CB-CG2 3.56Å; L72-L84 HydrophobicContact CD1-CD2 3.71Å
73	N	94.1	Very high	93.3	Very high	85 Å²	85	66.1 Å²	66.1	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-66.9	-49.7	174.8	-166.9	-74	0	0	0	111	I69 K70 F71 S75 G76 V81	I69-N73 WeakPolarHBondContact O-CB 3.36Å; I69-N73 PolarHBondContact O-N 3.39Å; K70-N73 PolarHBondContact O-N 2.87Å; F71-N73 VanDerWaalsContact C-N 3.32Å; F71-N73 PolarHBondContact O-N 2.91Å; N73-S75 PolarHBondContact O-N 3.33Å; N73-G76 PolarHBondContact O-N 3.34Å; N73-V81 HydrophobicContact CB-CG2 4.05Å
74	D	92.8	Very high	93.3	Very high	108 Å²	108	65.6 Å²	65.6	58%	0.578	37%	0.368	S	S	*	.	H	α-helix	trans	-61.5	-26.6	177.3	-65.9	-13.1	0	0	0	111.9	K70 F71	K70-D74 WeakPolarHBondContact CE-OD2 3.5Å; K70-D74 WeakPolarHBondContact O-CB 3.25Å; K70-D74 VanDerWaalsContact O-CG 3.26Å; K70-D74 PolarHBondContact O-N 2.83Å; F71-D74 PolarHBondContact O-N 3.31Å
75	S	92	Very high	93.2	Very high	56 Å²	56	60.3 Å²	60.3	39%	0.392	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	1.9	177.1	-57.1	0	0	0	0	114.5	F71 L72 N73 Q77	F71-S75 WeakPolarHBondContact CD2-OG 3.31Å; F71-S75 WeakPolarHBondContact CE2-OG 3.32Å; F71-S75 VanDerWaalsContact O-CB 3.28Å; F71-S75 WeakPolarHBondContact O-CB 3.4Å; F71-S75 PolarHBondContact O-N 2.97Å; F71-S75 PolarHBondContact O-OG 3.12Å; L72-S75 PolarHBondContact O-N 2.86Å; N73-S75 PolarHBondContact O-N 3.33Å; S75-Q77 PolarHBondContact O-N 3.25Å
76	G	92.6	Very high	93.1	Very high	55 Å²	55	61.6 Å²	61.6	57%	0.567	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	21.8	179.8	0	0	0	0	0	114.9	L72 N73 E78	L72-G76 PolarHBondContact O-N 3.35Å; N73-G76 PolarHBondContact O-N 3.34Å; G76-E78 VanDerWaalsContact C-N 3.3Å; G76-E78 PolarHBondContact O-N 2.72Å
77	Q	90.8	Very high	93	Very high	58 Å²	58	64.4 Å²	64.4	27%	0.271	37%	0.366	S	S	.	.			trans	-93.7	53.3	177.1	-62.1	-174.7	9	0	0	111.3	L72 S75 D79 I80 V81	L72-Q77 HydrophobicContact CB-CB 4.45Å; L72-Q77 HydrophobicContact CD2-CB 4.38Å; L72-Q77 PolarHBondContact O-N 2.95Å; S75-Q77 PolarHBondContact O-N 3.25Å; Q77-D79 VanDerWaalsContact C-N 3.31Å; Q77-D79 PolarHBondContact O-N 2.91Å; Q77-I80 HydrophobicContact CB-CB 4.34Å; Q77-I80 HydrophobicContact CB-CD1 4.3Å; Q77-I80 HydrophobicContact CB-CG1 4.45Å; Q77-I80 PolarHBondContact O-N 2.84Å; Q77-I80 VanDerWaalsContact O-N 3.09Å; Q77-V81 WeakPolarHBondContact O-CG2 3.4Å; Q77-V81 PolarHBondContact O-N 3.22Å
78	E	90.8	Very high	92.8	Very high	137 Å²	137	65.3 Å²	65.3	64%	0.64	37%	0.371	S	S	*	.	H	α-helix	trans	-58.9	-38.6	-172.2	-63.5	-178.4	-173.5	0	0	113.2	G76 I80 V81 A82	G76-E78 VanDerWaalsContact C-N 3.3Å; G76-E78 PolarHBondContact O-N 2.72Å; E78-I80 VanDerWaalsContact C-N 3.28Å; E78-I80 PolarHBondContact O-N 3.44Å; E78-V81 WeakPolarHBondContact O-CB 3.46Å; E78-V81 PolarHBondContact O-N 3.28Å; E78-V81 VanDerWaalsContact O-N 3.14Å; E78-A82 PolarHBondContact O-N 3.45Å
79	D	90.3	Very high	92.6	Very high	148 Å²	148	67.1 Å²	67.1	79%	0.791	38%	0.382	S	S	*	.	H	α-helix	trans	-58.8	-40.7	176.9	-64.4	-28.3	0	0	0	112	Q77 A83	Q77-D79 VanDerWaalsContact C-N 3.31Å; Q77-D79 PolarHBondContact O-N 2.91Å; D79-A83 PolarHBondContact O-N 3.41Å
80	I	92.8	Very high	92.4	Very high	74 Å²	74	74.1 Å²	74.1	38%	0.379	41%	0.406	S	S	.	.	H	α-helix	trans	-72.8	-39.7	178.2	-57.5	-176.5	0	0	0	109.8	L72 Q77 E78 A82 A83 L84	L72-I80 HydrophobicContact CD1-CG2 3.97Å; Q77-I80 HydrophobicContact CB-CB 4.34Å; Q77-I80 HydrophobicContact CB-CD1 4.3Å; Q77-I80 HydrophobicContact CB-CG1 4.45Å; Q77-I80 PolarHBondContact O-N 2.84Å; Q77-I80 VanDerWaalsContact O-N 3.09Å; E78-I80 VanDerWaalsContact C-N 3.28Å; E78-I80 PolarHBondContact O-N 3.44Å; I80-A82 VanDerWaalsContact C-N 3.35Å; I80-A82 PolarHBondContact O-N 3.49Å; I80-A83 PolarHBondContact O-N 2.74Å; I80-L84 WeakPolarHBondContact O-CB 3.19Å; I80-L84 PolarHBondContact O-N 3.01Å
81	V	93.8	Very high	92.3	Very high	14 Å²	14	74.7 Å²	74.7	9%	0.085	41%	0.409	C	S	.	.	H	α-helix	trans	-60.1	-43.4	177.1	170.6	0	0	0	0	111.6	I69 L72 N73 Q77 E78 L84 S85	I69-V81 HydrophobicContact CG2-CG1 4.08Å; L72-V81 HydrophobicContact CB-CG2 3.56Å; N73-V81 HydrophobicContact CB-CG2 4.05Å; Q77-V81 WeakPolarHBondContact O-CG2 3.4Å; Q77-V81 PolarHBondContact O-N 3.22Å; E78-V81 WeakPolarHBondContact O-CB 3.46Å; E78-V81 PolarHBondContact O-N 3.28Å; E78-V81 VanDerWaalsContact O-N 3.14Å; V81-L84 PolarHBondContact O-N 3.24Å; V81-S85 VanDerWaalsContact O-CB 3.3Å; V81-S85 WeakPolarHBondContact O-CB 3.28Å; V81-S85 PolarHBondContact O-N 2.76Å; V81-S85 PolarHBondContact O-OG 2.97Å
82	A	91.5	Very high	92	Very high	61 Å²	61	78.5 Å²	78.5	50%	0.504	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-46.7	178.6	0	0	0	0	0	111.7	E78 I80 T86	E78-A82 PolarHBondContact O-N 3.45Å; I80-A82 VanDerWaalsContact C-N 3.35Å; I80-A82 PolarHBondContact O-N 3.49Å; A82-T86 PolarHBondContact O-N 2.74Å; A82-T86 PolarHBondContact O-OG1 3.4Å
83	A	92.4	Very high	91.8	Very high	67 Å²	67	85.8 Å²	85.8	55%	0.554	46%	0.457	S	S	*	.	H	α-helix	trans	-64.5	-43.4	177.1	0	0	0	0	0	112	D79 I80 T86 F87	D79-A83 PolarHBondContact O-N 3.41Å; I80-A83 PolarHBondContact O-N 2.74Å; A83-T86 PolarHBondContact O-N 3.29Å; A83-F87 PolarHBondContact O-N 3.5Å; A83-F87 VanDerWaalsContact O-N 3.15Å
84	L	93.9	Very high	91.5	Very high	54 Å²	54	84 Å²	84	28%	0.283	45%	0.454	S	S	.	.	H	α-helix	trans	-69	-39.4	-178.4	-173	61.7	0	0	0	112.2	I68 I69 L72 I80 V81 T86 F87 D88	I68-L84 HydrophobicContact CG2-CD2 4Å; I69-L84 HydrophobicContact CG1-CD2 3.8Å; I69-L84 HydrophobicContact CG1-CG 4.15Å; L72-L84 HydrophobicContact CD1-CD2 3.71Å; I80-L84 WeakPolarHBondContact O-CB 3.19Å; I80-L84 PolarHBondContact O-N 3.01Å; V81-L84 PolarHBondContact O-N 3.24Å; L84-T86 VanDerWaalsContact C-N 3.34Å; L84-T86 PolarHBondContact O-N 2.92Å; L84-F87 WeakPolarHBondContact O-CB 3.28Å; L84-F87 PolarHBondContact O-N 3.48Å; L84-D88 PolarHBondContact O-N 2.8Å
85	S	91.4	Very high	91.2	Very high	38 Å²	38	82.8 Å²	82.8	27%	0.266	45%	0.445	S	S	.	.	H	α-helix	trans	-63.8	-41.7	177.2	-57.9	0	0	0	0	111.3	V81 F87 D88 D89	V81-S85 VanDerWaalsContact O-CB 3.3Å; V81-S85 WeakPolarHBondContact O-CB 3.28Å; V81-S85 PolarHBondContact O-N 2.76Å; V81-S85 PolarHBondContact O-OG 2.97Å; S85-F87 VanDerWaalsContact C-N 3.28Å; S85-F87 PolarHBondContact O-N 3.17Å; S85-D88 PolarHBondContact O-N 2.93Å; S85-D89 PolarHBondContact O-N 3.29Å
86	T	91.7	Very high	90.7	Very high	74 Å²	74	87.6 Å²	87.6	45%	0.454	46%	0.459	S	S	.	.	H	α-helix	trans	-60.4	-39.1	174.2	-57.2	0	0	0	0	111.7	A82 A83 L84 R90	A82-T86 PolarHBondContact O-N 2.74Å; A82-T86 PolarHBondContact O-OG1 3.4Å; A83-T86 PolarHBondContact O-N 3.29Å; L84-T86 VanDerWaalsContact C-N 3.34Å; L84-T86 PolarHBondContact O-N 2.92Å; T86-R90 WeakPolarHBondContact O-CG 3.34Å; T86-R90 PolarHBondContact O-N 2.95Å
87	F	92.4	Very high	89.8	Confident	131 Å²	131	88.1 Å²	88.1	58%	0.575	45%	0.454	S	S	*	.	H	α-helix	trans	-69.3	-43.6	175.9	178.9	-94.6	0	0	0	112.4	A83 L84 S85 D89 R90 F91	A83-F87 PolarHBondContact O-N 3.5Å; A83-F87 VanDerWaalsContact O-N 3.15Å; L84-F87 WeakPolarHBondContact O-CB 3.28Å; L84-F87 PolarHBondContact O-N 3.48Å; S85-F87 VanDerWaalsContact C-N 3.28Å; S85-F87 PolarHBondContact O-N 3.17Å; F87-D89 VanDerWaalsContact C-N 3.32Å; F87-D89 PolarHBondContact O-N 3.06Å; F87-R90 PolarHBondContact O-N 3.42Å; F87-F91 WeakPolarHBondContact O-CB 3.31Å; F87-F91 PolarHBondContact O-N 3.47Å
88	D	90.2	Very high	88.8	Confident	19 Å²	19	93 Å²	93	10%	0.102	47%	0.474	C	S	.	.	H	α-helix	trans	-60.2	-40.3	179.1	-168.4	48.1	0	0	0	111.4	S65 I69 L84 S85 F91 K92	S65-D88 WeakPolarHBondContact CB-OD1 3.28Å; S65-D88 PolarHBondContact OG-OD1 3.11Å; S65-D88 VanDerWaalsContact OG-OD1 3.05Å; S65-D88 PolarHBondContact OG-OD2 3.3Å; I69-D88 HydrophobicContact CD1-CB 4.41Å; L84-D88 PolarHBondContact O-N 2.8Å; S85-D88 PolarHBondContact O-N 2.93Å; D88-F91 PolarHBondContact O-N 3.22Å; D88-K92 WeakPolarHBondContact O-CB 3.22Å; D88-K92 VanDerWaalsContact O-CG 3.3Å; D88-K92 WeakPolarHBondContact O-CG 3.41Å; D88-K92 PolarHBondContact O-N 3.47Å; D88-K92 WeakPolarHBondContact OD2-CE 3.4Å; D88-K92 IonicContact OD2-NZ 2.71Å; D88-K92 PolarHBondContact OD2-NZ 2.98Å
89	D	91.4	Very high	87.2	Confident	91 Å²	91	92.7 Å²	92.7	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-66.3	-42.4	175.3	-76	-18.9	0	0	0	113	S85 F87 F91 K92 K93	S85-D89 PolarHBondContact O-N 3.29Å; F87-D89 VanDerWaalsContact C-N 3.32Å; F87-D89 PolarHBondContact O-N 3.06Å; D89-F91 VanDerWaalsContact C-N 3.33Å; D89-K92 PolarHBondContact O-N 3.39Å; D89-K93 WeakPolarHBondContact O-CG 3.35Å; D89-K93 PolarHBondContact O-N 3.14Å
90	R	91.8	Very high	85.4	Confident	179 Å²	179	89.3 Å²	89.3	68%	0.675	47%	0.465	S	S	*	.	H	α-helix	trans	-63.5	-41.5	174.5	-71.8	176.9	-175.3	-163.4	2	111.1	T86 F87 K93 A94	T86-R90 WeakPolarHBondContact O-CG 3.34Å; T86-R90 PolarHBondContact O-N 2.95Å; F87-R90 PolarHBondContact O-N 3.42Å; R90-K93 PolarHBondContact O-N 3.25Å; R90-A94 WeakPolarHBondContact O-CB 3.32Å; R90-A94 PolarHBondContact O-N 3.44Å
91	F	91.2	Very high	83.1	Confident	104 Å²	104	91.5 Å²	91.5	46%	0.456	48%	0.482	S	S	.	.	H	α-helix	trans	-63.4	-46.4	177.5	-175.8	-100	0	0	0	111.6	F87 D88 D89 K93 A94 Q95	F87-F91 WeakPolarHBondContact O-CB 3.31Å; F87-F91 PolarHBondContact O-N 3.47Å; D88-F91 PolarHBondContact O-N 3.22Å; D89-F91 VanDerWaalsContact C-N 3.33Å; F91-K93 PolarHBondContact O-N 3.02Å; F91-A94 PolarHBondContact O-N 3.25Å; F91-Q95 HydrophobicContact CD1-CG 4.17Å; F91-Q95 HydrophobicContact CE1-CG 3.83Å; F91-Q95 HydrophobicContact CZ-CG 4.04Å; F91-Q95 WeakPolarHBondContact O-CG 3.34Å; F91-Q95 PolarHBondContact O-N 3.4Å
92	K	90	Very high	80.8	Confident	93 Å²	93	98.7 Å²	98.7	40%	0.404	52%	0.52	S	S	.	.	H	α-helix	trans	-60.4	-40.6	175.8	-73.4	169.9	-170.3	159.6	0	112.7	D88 D89 Q95 K96	D88-K92 WeakPolarHBondContact O-CB 3.22Å; D88-K92 VanDerWaalsContact O-CG 3.3Å; D88-K92 WeakPolarHBondContact O-CG 3.41Å; D88-K92 PolarHBondContact O-N 3.47Å; D88-K92 WeakPolarHBondContact OD2-CE 3.4Å; D88-K92 IonicContact OD2-NZ 2.71Å; D88-K92 PolarHBondContact OD2-NZ 2.98Å; D89-K92 PolarHBondContact O-N 3.39Å; K92-Q95 PolarHBondContact O-N 3.26Å; K92-K96 WeakPolarHBondContact O-CG 3.2Å; K92-K96 PolarHBondContact O-N 3.29Å; K92-K96 VanDerWaalsContact O-N 3.14Å
93	K	90.1	Very high	78.4	Confident	155 Å²	155	104.3 Å²	104.3	67%	0.674	54%	0.536	S	S	*	.	H	α-helix	trans	-63.6	-44.3	175.6	-72.9	174.4	-177.3	179.5	0	111.7	D89 R90 F91 Q95 K96 S97	D89-K93 WeakPolarHBondContact O-CG 3.35Å; D89-K93 PolarHBondContact O-N 3.14Å; R90-K93 PolarHBondContact O-N 3.25Å; F91-K93 PolarHBondContact O-N 3.02Å; K93-Q95 VanDerWaalsContact C-N 3.33Å; K93-Q95 PolarHBondContact O-N 3.44Å; K93-K96 PolarHBondContact O-N 3.3Å; K93-S97 PolarHBondContact O-N 3.16Å; K93-S97 VanDerWaalsContact O-N 3.16Å
94	A	88.5	Confident	76	Confident	49 Å²	49	107.6 Å²	107.6	41%	0.405	55%	0.548	S	S	.	.	H	α-helix	trans	-66.8	-30.8	177.8	0	0	0	0	0	113.5	R90 F91 S97 K98	R90-A94 WeakPolarHBondContact O-CB 3.32Å; R90-A94 PolarHBondContact O-N 3.44Å; F91-A94 PolarHBondContact O-N 3.25Å; A94-S97 PolarHBondContact O-OG 3.46Å; A94-K98 PolarHBondContact O-N 3.23Å
95	Q	84.9	Confident	73.3	Confident	81 Å²	81	111.4 Å²	111.4	38%	0.379	57%	0.568	S	S	.	*	H	α-helix	trans	-69.7	-40	173.1	-71.1	-66.4	-44.2	0	0	111.7	F91 K92 K93 K98 N99	F91-Q95 HydrophobicContact CD1-CG 4.17Å; F91-Q95 HydrophobicContact CE1-CG 3.83Å; F91-Q95 HydrophobicContact CZ-CG 4.04Å; F91-Q95 WeakPolarHBondContact O-CG 3.34Å; F91-Q95 PolarHBondContact O-N 3.4Å; K92-Q95 PolarHBondContact O-N 3.26Å; K93-Q95 VanDerWaalsContact C-N 3.33Å; K93-Q95 PolarHBondContact O-N 3.44Å; Q95-K98 PolarHBondContact O-N 3.14Å; Q95-N99 PolarHBondContact O-N 3.34Å
96	K	81.6	Confident	70.9	Confident	157 Å²	157	116.3 Å²	116.3	68%	0.683	60%	0.596	S	S	*	*	H	α-helix	trans	-63.2	-42.2	176.8	-72.1	179.3	-179	-172.7	0	112.2	K92 K93 K98 N99 S100	K92-K96 WeakPolarHBondContact O-CG 3.2Å; K92-K96 PolarHBondContact O-N 3.29Å; K92-K96 VanDerWaalsContact O-N 3.14Å; K93-K96 PolarHBondContact O-N 3.3Å; K96-K98 VanDerWaalsContact C-N 3.29Å; K96-K98 PolarHBondContact O-N 3.33Å; K96-N99 PolarHBondContact O-N 3.25Å; K96-S100 PolarHBondContact O-N 3.37Å; K96-S100 PolarHBondContact O-OG 3.47Å
97	S	74.5	Confident	68.5	Low	67 Å²	67	119 Å²	119	47%	0.469	61%	0.607	S	S	.	*	H	α-helix	trans	-68.1	-26.8	179.2	59.7	0	0	0	0	113.7	K93 A94 S100 T101	K93-S97 PolarHBondContact O-N 3.16Å; K93-S97 VanDerWaalsContact O-N 3.16Å; A94-S97 PolarHBondContact O-OG 3.46Å; S97-S100 WeakPolarHBondContact CA-OG 3.45Å; S97-S100 PolarHBondContact O-OG 3.49Å; S97-S100 VanDerWaalsContact O-OG 3.11Å; S97-T101 PolarHBondContact O-OG1 2.92Å
98	K	69.1	Low	66.2	Low	159 Å²	159	122.1 Å²	122.1	69%	0.691	62%	0.623	S	S	*	*	H	α-helix	trans	-76.5	-28.4	174.5	-85.1	-178	148	-177.2	0	113.2	A94 Q95 K96 S100	A94-K98 PolarHBondContact O-N 3.23Å; Q95-K98 PolarHBondContact O-N 3.14Å; K96-K98 VanDerWaalsContact C-N 3.29Å; K96-K98 PolarHBondContact O-N 3.33Å; K98-S100 VanDerWaalsContact C-N 3.32Å
99	N	58.4	Low	63.6	Low	132 Å²	132	127.7 Å²	127.7	71%	0.706	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-5.4	177.9	-67.6	4.1	0	0	0	112.7	Q95 K96	Q95-N99 PolarHBondContact O-N 3.34Å; K96-N99 PolarHBondContact O-N 3.25Å
100	S	50.9	Low	61.3	Low	76 Å²	76	132.8 Å²	132.8	53%	0.531	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.4	12.3	-179.2	61.8	0	0	0	0	114.1	K96 S97 K98 D102	K96-S100 PolarHBondContact O-N 3.37Å; K96-S100 PolarHBondContact O-OG 3.47Å; S97-S100 WeakPolarHBondContact CA-OG 3.45Å; S97-S100 PolarHBondContact O-OG 3.49Å; S97-S100 VanDerWaalsContact O-OG 3.11Å; K98-S100 VanDerWaalsContact C-N 3.32Å; S100-D102 VanDerWaalsContact C-N 3.31Å
101	T	45.9	Very low	58.8	Low	121 Å²	121	132.5 Å²	132.5	74%	0.742	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	16.6	179.8	-41.8	0	0	0	0	113.4	S97	S97-T101 PolarHBondContact O-OG1 2.92Å
102	D	45.3	Very low	56.4	Low	164 Å²	164	133.2 Å²	133.2	88%	0.877	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	23.2	176.4	-127.5	-4.2	0	0	0	112.9	S100	S100-D102 VanDerWaalsContact C-N 3.31Å
103	E	41.5	Very low	53.9	Low	179 Å²	179	136.3 Å²	136.3	84%	0.836	71%	0.714	S	S	*	*	S	Bend	trans	-125	97.9	169.7	-70.8	-171	171.1	0	0	110.5
104	V	40.6	Very low	51.2	Low	136 Å²	136	137.9 Å²	137.9	82%	0.824	72%	0.724	S	S	*	*			trans	27.4	100.2	147	-174.7	0	0	0	0	118.3
105	I	38.5	Very low	48.7	Very low	135 Å²	135	139.2 Å²	139.2	69%	0.692	74%	0.743	S	S	*	*				20.5	115.2	129	-46.1	168.5	0	0	0	117.7	L107	I105-L107 HydrophobicContact CG2-CD1 4.44Å; I105-L107 HydrophobicContact CG2-CG 4.22Å
106	V	41.4	Very low	46.3	Very low	141 Å²	141	146.7 Å²	146.7	86%	0.855	77%	0.767	S	S	*	*				-139.7	122.4	122.7	-178.8	0	0	0	0	108.2
107	L	41.1	Very low	44.1	Very low	131 Å²	131	143.5 Å²	143.5	69%	0.686	77%	0.77	S	S	*	*			trans	-78.8	134.6	176.5	-62.8	157.3	0	0	0	109.5	I105	I105-L107 HydrophobicContact CG2-CD1 4.44Å; I105-L107 HydrophobicContact CG2-CG 4.22Å
108	E	43.8	Very low	42.1	Very low	195 Å²	195	149.5 Å²	149.5	91%	0.911	79%	0.791	S	S	*	*			trans	-133.3	119.9	146.2	-78	-167.7	150.7	0	0	108.5
109	D	34.7	Very low	40.7	Very low	137 Å²	137	147.4 Å²	147.4	73%	0.733	80%	0.796	S	S	*	*			trans	-73.1	138.1	-172.7	-63.9	-60.2	0	0	0	112.9
110	Q	43.4	Very low	39.7	Very low	197 Å²	197	146.4 Å²	146.4	92%	0.921	80%	0.8	S	S	*	*			trans	-154.3	95.3	139.1	-121.7	174.3	20.7	0	0	111.7
111	E	40.2	Very low	38.7	Very low	173 Å²	173	148.1 Å²	148.1	81%	0.808	81%	0.811	S	S	*	*			trans	-35.5	153.8	148.7	-73	-174	132.6	0	0	113.5
112	V	40.3	Very low	37.7	Very low	120 Å²	120	148.3 Å²	148.3	73%	0.727	81%	0.812	S	S	*	*			cis	-173.7	144.3	10.8	138	0	0	0	0	106.1
113	D	37.6	Very low	37.5	Very low	158 Å²	158	148.7 Å²	148.7	85%	0.845	81%	0.813	S	S	*	*				-174.1	113.6	118.9	-160.8	25.2	0	0	0	111.5
114	E	33.1	Very low	37.2	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	81%	0.806	S	S	*	*			trans	-94.5	141.5	-179.5	-78.2	-169.2	139.4	0	0	111.4
115	G	36.3	Very low	36.8	Very low	78 Å²	78	145.3 Å²	145.3	80%	0.804	81%	0.807	S	S	*	*			trans	-143.8	50.7	173.7	0	0	0	0	0	113.8
116	R	34.7	Very low	37	Very low	237 Å²	237	144.7 Å²	144.7	89%	0.894	82%	0.815	S	S	*	*			trans	16.8	126.3	144.4	-171	162.8	-179.4	152.1	-0.5	119.8
117	A	34.7	Very low	36.6	Very low	91 Å²	91	145.8 Å²	145.8	75%	0.752	82%	0.816	S	S	*	*				160.7	97.8	113.2	0	0	0	0	0	113.5
118	E	33.2	Very low	36.8	Very low	192 Å²	192	145.3 Å²	145.3	90%	0.897	82%	0.824	S	S	*	*			trans	-38.1	127.2	147.9	1.7	-178.4	141.5	0	0	114.1
119	S	39.9	Very low	36.9	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	82%	0.819	S	S	*	*			trans	-171.1	106	149.5	-130.3	0	0	0	0	108.5
120	S	37.2	Very low	37.4	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	82%	0.823	S	S	*	*				79.5	129.8	93.7	-170	0	0	0	0	113.7
121	C	29.9	Very low	37.1	Very low	113 Å²	113	138.7 Å²	138.7	76%	0.764	82%	0.819	S	S	*	*			trans	-45	160.6	179.6	-55.7	0	0	0	0	115.2
122	T	25.4	Very low	37.6	Very low	125 Å²	125	138.8 Å²	138.8	77%	0.767	82%	0.82	S	S	*	*			trans	118.4	102.5	145	-41.9	0	0	0	0	113.6
123	L	39.3	Very low	37.5	Very low	171 Å²	171	139 Å²	139	90%	0.895	82%	0.823	S	S	*	*			trans	-153	94.1	146.7	-73.7	-179	0	0	0	106.7
124	A	36.1	Very low	37.6	Very low	83 Å²	83	136.4 Å²	136.4	69%	0.686	82%	0.824	S	S	*	*				75.9	107	83	0	0	0	0	0	112.1
125	N	33	Very low	38.3	Very low	161 Å²	161	136.5 Å²	136.5	86%	0.861	82%	0.821	S	S	*	*			trans	-49	139.6	160.5	-73.2	-20.5	0	0	0	110.3
126	S	41.7	Very low	38.6	Very low	122 Å²	122	138.4 Å²	138.4	85%	0.853	82%	0.819	S	S	*	*			trans	-151.1	114.3	149.8	-74.5	0	0	0	0	108.5
127	D	33	Very low	39.3	Very low	164 Å²	164	134.7 Å²	134.7	88%	0.877	82%	0.817	S	S	*	*			trans	-48.4	138.8	168.2	-70.2	-54.4	0	0	0	112.1
128	S	46.2	Very low	39.6	Very low	122 Å²	122	141.6 Å²	141.6	85%	0.853	82%	0.823	S	S	*	*			trans	-151	106.3	142.7	-151.2	0	0	0	0	109.5
129	S	44.6	Very low	40.1	Very low	115 Å²	115	143.8 Å²	143.8	80%	0.804	82%	0.823	S	S	*	*			trans	-65.6	131.4	170.3	41.4	0	0	0	0	111.2
130	S	45.9	Very low	40.1	Very low	116 Å²	116	142.3 Å²	142.3	81%	0.811	82%	0.818	S	S	*	*			trans	-159.9	101.1	143.7	-166.1	0	0	0	0	109.3
131	D	36.5	Very low	40.1	Very low	158 Å²	158	142.8 Å²	142.8	85%	0.845	82%	0.818	S	S	*	*			trans	-45.5	128.6	161.3	-93.7	-47.6	0	0	0	111.4
132	Q	52	Low	40.9	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	81%	0.814	S	S	*	*			trans	-149.3	136.4	137.6	-79.2	-137.3	21.8	0	0	111.1	A134	Q132-A134 PolarHBondContact O-N 2.87Å; Q132-A134 VanDerWaalsContact O-N 3.14Å
133	P	36.6	Very low	42	Very low	124 Å²	124	145.3 Å²	145.3	81%	0.805	82%	0.818	S	S	*	*			trans	-78.9	101	-180	32.1	-30.7	0	0	0	109.3	K135	P133-K135 PolarHBondContact O-N 3.43Å
134	A	41.2	Very low	42.7	Very low	103 Å²	103	142 Å²	142	85%	0.851	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-78.8	118.4	175.3	0	0	0	0	0	110.9	Q132	Q132-A134 PolarHBondContact O-N 2.87Å; Q132-A134 VanDerWaalsContact O-N 3.14Å
135	K	46.9	Very low	43.8	Very low	190 Å²	190	144.1 Å²	144.1	83%	0.826	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-52.8	148.9	-177.6	-74	161.1	174.6	171.2	0	114	P133 L137	P133-K135 PolarHBondContact O-N 3.43Å; K135-L137 PolarHBondContact O-N 2.84Å
136	P	42.1	Very low	45.3	Very low	117 Å²	117	140.5 Å²	140.5	76%	0.76	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.4	123.5	177.6	26.7	-30.9	0	0	0	110.6	R138	P136-R138 PolarHBondContact O-N 3.4Å
137	L	50.9	Low	46.9	Very low	160 Å²	160	137.1 Å²	137.1	84%	0.838	76%	0.756	S	S	*	*			trans	-65.2	101.3	168.7	-86.9	109.2	0	0	0	108.6	K135 R139	K135-L137 PolarHBondContact O-N 2.84Å; L137-R139 PolarHBondContact O-N 3.06Å
138	R	40.3	Very low	48.9	Very low	236 Å²	236	136 Å²	136	89%	0.891	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-58.7	124.7	168.6	-68.6	-178	176.7	-179.9	-2.1	108.5	P136 A140	P136-R138 PolarHBondContact O-N 3.4Å; R138-A140 PolarHBondContact O-N 3.27Å
139	R	44.3	Very low	50.5	Low	238 Å²	238	136.5 Å²	136.5	90%	0.898	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-50.8	133	160	-78.6	179.3	-179.2	165	0.2	107.7	L137	L137-R139 PolarHBondContact O-N 3.06Å
140	A	38.3	Very low	52.2	Low	84 Å²	84	133.7 Å²	133.7	69%	0.694	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-53.5	134.3	170.4	0	0	0	0	0	108.6	R138 V142	R138-A140 PolarHBondContact O-N 3.27Å; A140-V142 PolarHBondContact O-N 2.86Å
141	P	38	Very low	53.7	Low	120 Å²	120	132.4 Å²	132.4	78%	0.779	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61.4	124.4	171.7	-11.8	26.1	0	0	0	107.5	E143	P141-E143 PolarHBondContact O-N 2.84Å; P141-E143 VanDerWaalsContact O-N 3.13Å
142	V	47.2	Very low	55.9	Low	113 Å²	113	130.1 Å²	130.1	69%	0.685	68%	0.676	S	S	*	*			trans	-66.8	110.7	162.8	178.3	0	0	0	0	105	A140 H144	A140-V142 PolarHBondContact O-N 2.86Å; V142-H144 HydrophobicContact CG1-CB 4.5Å; V142-H144 PolarHBondContact O-N 3.37Å
143	E	48.2	Very low	57.4	Low	179 Å²	179	123.3 Å²	123.3	84%	0.836	65%	0.651	S	S	*	*	S	Bend	trans	-64.2	-1.1	-175	-121.8	172.8	179	0	0	113.9	P141	P141-E143 PolarHBondContact O-N 2.84Å; P141-E143 VanDerWaalsContact O-N 3.13Å
144	H	53.8	Low	59.7	Low	100 Å²	100	119.1 Å²	119.1	46%	0.463	62%	0.621	S	S	.	*			trans	-120.1	78.8	-177.9	-58.7	96.8	0	0	0	109.9	V142 I146 L232	V142-H144 HydrophobicContact CG1-CB 4.5Å; V142-H144 PolarHBondContact O-N 3.37Å; H144-I146 PolarHBondContact O-N 3.19Å; H144-L232 HydrophobicContact CB-CD2 3.35Å; H144-L232 HydrophobicContact CB-CG 4.5Å; H144-L232 VanDerWaalsContact CD2-CD1 3.46Å; H144-L232 WeakPolarHBondContact CD2-CD1 3.48Å; H144-L232 WeakPolarHBondContact CD2-CD2 3.4Å; H144-L232 WeakPolarHBondContact NE2-CD1 3.37Å
145	V	59.2	Low	61.7	Low	129 Å²	129	124 Å²	124	78%	0.782	62%	0.617	S	S	*	*			trans	-80.9	106.7	171.5	-179.1	0	0	0	0	107.1	P147	V145-P147 WeakPolarHBondContact O-CD 3.39Å
146	I	65.6	Low	63.5	Low	85 Å²	85	119 Å²	119	44%	0.436	61%	0.607	S	S	.	*			trans	-57.9	123.6	170.4	-60.1	172.6	0	0	0	107.4	H144 Q148 H150 L151	H144-I146 PolarHBondContact O-N 3.19Å; I146-Q148 PolarHBondContact O-N 3.15Å; I146-H150 HydrophobicContact CG2-CB 3.68Å; I146-L151 HydrophobicContact CB-CD2 4.22Å; I146-L151 HydrophobicContact CB-CG 4.28Å; I146-L151 HydrophobicContact CD1-CD2 4.35Å; I146-L151 HydrophobicContact CG2-CD2 3.92Å; I146-L151 HydrophobicContact CG2-CG 3.91Å
147	P	74.5	Confident	65.6	Low	50 Å²	50	114.1 Å²	114.1	33%	0.325	58%	0.575	S	S	.	*			trans	-49.4	138.5	177.2	-29.9	36.1	0	0	0	111.5	V145 E149 H150 L151	V145-P147 WeakPolarHBondContact O-CD 3.39Å; P147-E149 HydrophobicContact CB-CG 3.71Å; P147-E149 PolarHBondContact O-N 2.9Å; P147-H150 HydrophobicContact CB-CB 4.44Å; P147-H150 WeakPolarHBondContact O-CB 3.48Å; P147-H150 PolarHBondContact O-N 3.05Å; P147-L151 PolarHBondContact O-N 3.12Å
148	Q	75.8	Confident	67.2	Low	142 Å²	142	111.3 Å²	111.3	66%	0.664	57%	0.567	S	S	*	*	H	α-helix	trans	-58.8	-34.3	-176.4	-174.6	178.1	-27.6	0	0	111.8	I146 H150 L151 E152	I146-Q148 PolarHBondContact O-N 3.15Å; Q148-H150 VanDerWaalsContact C-N 3.3Å; Q148-H150 PolarHBondContact O-N 2.96Å; Q148-L151 WeakPolarHBondContact O-CB 3.41Å; Q148-L151 PolarHBondContact O-N 3.14Å; Q148-E152 HydrophobicContact CG-CG 4.48Å; Q148-E152 PolarHBondContact NE2-OE1 3.35Å; Q148-E152 WeakPolarHBondContact O-CG 3.34Å; Q148-E152 PolarHBondContact O-N 2.86Å
149	E	79	Confident	69.4	Low	131 Å²	131	102.4 Å²	102.4	61%	0.612	54%	0.543	S	S	*	.	H	α-helix	trans	-56.5	-40.1	173.1	62.7	-166	172.8	0	0	113	P147 E152 A153	P147-E149 HydrophobicContact CB-CG 3.71Å; P147-E149 PolarHBondContact O-N 2.9Å; E149-E152 PolarHBondContact O-N 3.38Å; E149-A153 WeakPolarHBondContact O-CB 3.32Å; E149-A153 PolarHBondContact O-N 3.24Å
150	H	80.5	Confident	71.3	Confident	56 Å²	56	91.3 Å²	91.3	26%	0.259	50%	0.502	S	S	.	.	H	α-helix	trans	-69.9	-39.3	177.2	-73	175.8	0	0	0	111.5	I146 P147 Q148 E152 A153 L154 L207	I146-H150 HydrophobicContact CG2-CB 3.68Å; P147-H150 HydrophobicContact CB-CB 4.44Å; P147-H150 WeakPolarHBondContact O-CB 3.48Å; P147-H150 PolarHBondContact O-N 3.05Å; Q148-H150 VanDerWaalsContact C-N 3.3Å; Q148-H150 PolarHBondContact O-N 2.96Å; H150-E152 VanDerWaalsContact C-N 3.33Å; H150-A153 PolarHBondContact O-N 3.08Å; H150-L154 WeakPolarHBondContact O-CB 3.5Å; H150-L154 VanDerWaalsContact O-CG 3.24Å; H150-L154 WeakPolarHBondContact O-CG 3.45Å; H150-L154 PolarHBondContact O-N 3.25Å; H150-L207 HydrophobicContact CB-CD2 3.4Å; H150-L207 VanDerWaalsContact CB-CD2 3.4Å
151	L	77.2	Confident	73.6	Confident	89 Å²	89	91 Å²	91	47%	0.466	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-39.1	173.7	-66.6	175.6	0	0	0	111.7	I146 P147 Q148 R155	I146-L151 HydrophobicContact CB-CD2 4.22Å; I146-L151 HydrophobicContact CB-CG 4.28Å; I146-L151 HydrophobicContact CD1-CD2 4.35Å; I146-L151 HydrophobicContact CG2-CD2 3.92Å; I146-L151 HydrophobicContact CG2-CG 3.91Å; P147-L151 PolarHBondContact O-N 3.12Å; Q148-L151 WeakPolarHBondContact O-CB 3.41Å; Q148-L151 PolarHBondContact O-N 3.14Å; L151-R155 VanDerWaalsContact O-CB 3.22Å; L151-R155 WeakPolarHBondContact O-CB 3.26Å; L151-R155 PolarHBondContact O-N 3.04Å
152	E	81.9	Confident	75.9	Confident	110 Å²	110	92.6 Å²	92.6	51%	0.514	48%	0.483	S	S	.	.	H	α-helix	trans	-68	-39.3	175.8	-72.1	176	-168.2	0	0	111.9	Q148 E149 H150 R155 S156	Q148-E152 HydrophobicContact CG-CG 4.48Å; Q148-E152 PolarHBondContact NE2-OE1 3.35Å; Q148-E152 WeakPolarHBondContact O-CG 3.34Å; Q148-E152 PolarHBondContact O-N 2.86Å; E149-E152 PolarHBondContact O-N 3.38Å; H150-E152 VanDerWaalsContact C-N 3.33Å; E152-R155 PolarHBondContact O-N 3.09Å; E152-S156 WeakPolarHBondContact O-CB 3.47Å; E152-S156 PolarHBondContact O-N 3.15Å; E152-S156 PolarHBondContact O-OG 3.18Å
153	A	84.1	Confident	77.8	Confident	34 Å²	34	87.6 Å²	87.6	28%	0.281	45%	0.452	S	S	.	.	H	α-helix	trans	-63.4	-45	173.7	0	0	0	0	0	112.2	E149 H150 R155 S156 S157	E149-A153 WeakPolarHBondContact O-CB 3.32Å; E149-A153 PolarHBondContact O-N 3.24Å; H150-A153 PolarHBondContact O-N 3.08Å; A153-R155 PolarHBondContact O-N 2.71Å; A153-S156 PolarHBondContact O-N 3.28Å; A153-S156 PolarHBondContact O-OG 3.27Å; A153-S157 PolarHBondContact O-N 2.9Å
154	L	84.1	Confident	79.6	Confident	36 Å²	36	81.2 Å²	81.2	19%	0.188	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-41.7	176	-70.7	171.9	0	0	0	111.7	H150 S157 L160 C203 T206 L207	H150-L154 WeakPolarHBondContact O-CB 3.5Å; H150-L154 VanDerWaalsContact O-CG 3.24Å; H150-L154 WeakPolarHBondContact O-CG 3.45Å; H150-L154 PolarHBondContact O-N 3.25Å; L154-S157 PolarHBondContact O-N 3.48Å; L154-L160 HydrophobicContact CB-CD1 4.38Å; L154-L160 HydrophobicContact CD2-CD1 3.57Å; L154-C203 HydrophobicContact CD2-CB 3.83Å; L154-T206 VanDerWaalsContact CD2-OG1 3.28Å; L154-T206 WeakPolarHBondContact CD2-OG1 3.36Å; L154-L207 HydrophobicContact CD1-CD1 4.41Å; L154-L207 HydrophobicContact CD1-CD2 4.17Å; L154-L207 HydrophobicContact CD2-CD2 4.32Å; L154-L207 HydrophobicContact CD2-CG 4.18Å; L154-L207 HydrophobicContact CG-CD2 4Å; L154-L207 HydrophobicContact CG-CG 4.37Å
155	R	83.1	Confident	81.1	Confident	204 Å²	204	83 Å²	83	77%	0.77	43%	0.432	S	S	*	.	H	α-helix	trans	-69.8	-33.4	-179.4	-173.8	178	-178.1	-176.2	0.9	113.1	L151 E152 A153	L151-R155 VanDerWaalsContact O-CB 3.22Å; L151-R155 WeakPolarHBondContact O-CB 3.26Å; L151-R155 PolarHBondContact O-N 3.04Å; E152-R155 PolarHBondContact O-N 3.09Å; A153-R155 PolarHBondContact O-N 2.71Å
156	S	85.3	Confident	82.4	Confident	86 Å²	86	81 Å²	81	60%	0.601	42%	0.424	S	S	*	.	H	α-helix	trans	-83.4	-11.8	180	57.4	0	0	0	0	113.6	E152 A153 P158	E152-S156 WeakPolarHBondContact O-CB 3.47Å; E152-S156 PolarHBondContact O-N 3.15Å; E152-S156 PolarHBondContact O-OG 3.18Å; A153-S156 PolarHBondContact O-N 3.28Å; A153-S156 PolarHBondContact O-OG 3.27Å; S156-P158 VanDerWaalsContact O-CD 3.27Å; S156-P158 WeakPolarHBondContact O-CD 3.45Å
157	S	86.2	Confident	83.2	Confident	14 Å²	14	77.3 Å²	77.3	10%	0.098	41%	0.406	C	S	.	.			trans	-69.4	114.5	-177.3	179.1	0	0	0	0	113.2	A153 L154 A159 L160 L161 T206	A153-S157 PolarHBondContact O-N 2.9Å; L154-S157 PolarHBondContact O-N 3.48Å; S157-A159 VanDerWaalsContact C-N 3.29Å; S157-A159 PolarHBondContact O-N 3.47Å; S157-L160 PolarHBondContact O-N 3.46Å; S157-L161 WeakPolarHBondContact O-CG 3.32Å; S157-L161 PolarHBondContact O-N 3.36Å; S157-L161 VanDerWaalsContact O-N 3.09Å; S157-T206 WeakPolarHBondContact OG-CG2 3.18Å
158	P	85.3	Confident	83.6	Confident	102 Å²	102	80 Å²	80	66%	0.662	42%	0.421	S	S	*	.	H	α-helix	trans	-68.8	-28.5	-178.7	27	-33.5	0	0	0	112.3	S156 K162	S156-P158 VanDerWaalsContact O-CD 3.27Å; S156-P158 WeakPolarHBondContact O-CD 3.45Å; P158-K162 VanDerWaalsContact O-CB 3.26Å; P158-K162 WeakPolarHBondContact O-CB 3.37Å; P158-K162 PolarHBondContact O-N 2.86Å
159	A	85.6	Confident	84.1	Confident	48 Å²	48	78.7 Å²	78.7	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-68.5	-42.7	177.9	0	0	0	0	0	111.6	S157 K162 L163 L202	S157-A159 VanDerWaalsContact C-N 3.29Å; S157-A159 PolarHBondContact O-N 3.47Å; A159-K162 PolarHBondContact O-N 3.17Å; A159-L163 PolarHBondContact O-N 3.31Å; A159-L202 HydrophobicContact CB-CD1 4.48Å; A159-L202 HydrophobicContact CB-CD2 4.14Å
160	L	85.6	Confident	84.5	Confident	5 Å²	5	72.5 Å²	72.5	3%	0.026	39%	0.39	C	S	.	.	H	α-helix	trans	-64.9	-46.6	174.9	-78.8	172.3	0	0	0	111.2	L154 S157 K162 L163 L164 F199 L202 T206	L154-L160 HydrophobicContact CB-CD1 4.38Å; L154-L160 HydrophobicContact CD2-CD1 3.57Å; S157-L160 PolarHBondContact O-N 3.46Å; L160-K162 VanDerWaalsContact C-N 3.32Å; L160-K162 PolarHBondContact O-N 3.49Å; L160-L163 PolarHBondContact O-N 2.72Å; L160-L164 WeakPolarHBondContact O-CB 3.27Å; L160-L164 WeakPolarHBondContact O-CG 3.44Å; L160-L164 PolarHBondContact O-N 3.07Å; L160-F199 HydrophobicContact CD2-CD2 3.85Å; L160-F199 HydrophobicContact CD2-CE2 4.03Å; L160-L202 HydrophobicContact CD2-CB 3.37Å; L160-L202 HydrophobicContact CD2-CD1 4.17Å; L160-L202 HydrophobicContact CD2-CG 4.44Å; L160-L202 HydrophobicContact CG-CB 3.95Å; L160-T206 HydrophobicContact CD1-CG2 4.3Å
161	L	84.6	Confident	84.8	Confident	77 Å²	77	75.8 Å²	75.8	40%	0.403	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-41.9	177.5	-69.2	176.5	0	0	0	111.9	S157 L164 Q165	S157-L161 WeakPolarHBondContact O-CG 3.32Å; S157-L161 PolarHBondContact O-N 3.36Å; S157-L161 VanDerWaalsContact O-N 3.09Å; L161-L164 PolarHBondContact O-N 3.46Å; L161-Q165 VanDerWaalsContact O-CB 3.31Å; L161-Q165 WeakPolarHBondContact O-CB 3.18Å; L161-Q165 WeakPolarHBondContact O-CG 3.3Å; L161-Q165 PolarHBondContact O-N 2.89Å
162	K	87.7	Confident	85.2	Confident	154 Å²	154	75 Å²	75	67%	0.67	40%	0.402	S	S	*	.	H	α-helix	trans	-64	-41.8	176.8	-170.1	175	-176.5	177.1	0	111.7	P158 A159 L160 Q165 S166	P158-K162 VanDerWaalsContact O-CB 3.26Å; P158-K162 WeakPolarHBondContact O-CB 3.37Å; P158-K162 PolarHBondContact O-N 2.86Å; A159-K162 PolarHBondContact O-N 3.17Å; L160-K162 VanDerWaalsContact C-N 3.32Å; L160-K162 PolarHBondContact O-N 3.49Å; K162-Q165 PolarHBondContact O-N 2.95Å; K162-S166 WeakPolarHBondContact O-CB 3.29Å; K162-S166 PolarHBondContact O-N 2.93Å; K162-S166 PolarHBondContact O-OG 2.97Å
163	L	86.9	Confident	85.5	Confident	9 Å²	9	71.2 Å²	71.2	5%	0.047	39%	0.385	C	S	.	.	H	α-helix	trans	-64.7	-46.7	176.6	-176.4	66.1	0	0	0	111.4	A159 L160 Q165 S166 S167 L170 R198 F199 L202	A159-L163 PolarHBondContact O-N 3.31Å; L160-L163 PolarHBondContact O-N 2.72Å; L163-Q165 PolarHBondContact O-N 3.19Å; L163-S166 PolarHBondContact O-N 2.69Å; L163-S166 PolarHBondContact O-OG 2.84Å; L163-S166 VanDerWaalsContact O-OG 3.09Å; L163-S167 PolarHBondContact O-N 3.21Å; L163-S167 VanDerWaalsContact O-N 3.1Å; L163-S167 PolarHBondContact O-OG 3.37Å; L163-L170 HydrophobicContact CD2-CD2 4.14Å; L163-L170 HydrophobicContact CG-CD2 3.99Å; L163-R198 HydrophobicContact CD2-CB 4.25Å; L163-R198 HydrophobicContact CD2-CG 4.1Å; L163-F199 HydrophobicContact CD2-CB 3.79Å; L163-L202 HydrophobicContact CB-CD1 4.15Å; L163-L202 HydrophobicContact CD2-CD1 3.72Å
164	L	85.7	Confident	85.7	Confident	44 Å²	44	72.1 Å²	72.1	23%	0.23	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-30.9	176.3	-73.5	171.2	0	0	0	112	L160 L161 L170 R171 L174 F199	L160-L164 WeakPolarHBondContact O-CB 3.27Å; L160-L164 WeakPolarHBondContact O-CG 3.44Å; L160-L164 PolarHBondContact O-N 3.07Å; L161-L164 PolarHBondContact O-N 3.46Å; L164-L170 HydrophobicContact CD2-CD2 3.82Å; L164-L170 HydrophobicContact CD2-CG 4.3Å; L164-R171 VanDerWaalsContact O-CZ 3.24Å; L164-R171 PolarHBondContact O-NE 3.31Å; L164-R171 PolarHBondContact O-NH2 3.26Å; L164-R171 VanDerWaalsContact O-NH2 3.14Å; L164-L174 HydrophobicContact CD2-CD1 3.6Å; L164-F199 HydrophobicContact CD1-CE2 4.4Å; L164-F199 HydrophobicContact CD2-CD2 4.21Å; L164-F199 HydrophobicContact CD2-CE2 4.05Å; L164-F199 HydrophobicContact CG-CD2 4.5Å; L164-F199 HydrophobicContact CG-CE2 4.36Å
165	Q	85.5	Confident	85.9	Confident	138 Å²	138	73.8 Å²	73.8	65%	0.645	40%	0.396	S	S	*	.	H	α-helix	trans	-79.7	-34.4	175.5	-74.4	174.4	-8.1	0	0	113.3	L161 K162 L163	L161-Q165 VanDerWaalsContact O-CB 3.31Å; L161-Q165 WeakPolarHBondContact O-CB 3.18Å; L161-Q165 WeakPolarHBondContact O-CG 3.3Å; L161-Q165 PolarHBondContact O-N 2.89Å; K162-Q165 PolarHBondContact O-N 2.95Å; L163-Q165 PolarHBondContact O-N 3.19Å
166	S	85.9	Confident	86.2	Confident	86 Å²	86	69.1 Å²	69.1	60%	0.601	38%	0.379	S	S	*	.	H	α-helix	trans	-79.2	-27.7	-176.9	64.1	0	0	0	0	113.7	K162 L163	K162-S166 WeakPolarHBondContact O-CB 3.29Å; K162-S166 PolarHBondContact O-N 2.93Å; K162-S166 PolarHBondContact O-OG 2.97Å; L163-S166 PolarHBondContact O-N 2.69Å; L163-S166 PolarHBondContact O-OG 2.84Å; L163-S166 VanDerWaalsContact O-OG 3.09Å
167	S	83.7	Confident	86.4	Confident	9 Å²	9	65.5 Å²	65.5	6%	0.063	35%	0.353	C	S	.	.			trans	-110.2	101.3	-171.3	55.5	0	0	0	0	112	L163 N169 L170 R171	L163-S167 PolarHBondContact O-N 3.21Å; L163-S167 VanDerWaalsContact O-N 3.1Å; L163-S167 PolarHBondContact O-OG 3.37Å; S167-N169 VanDerWaalsContact C-N 3.28Å; S167-N169 PolarHBondContact O-N 3.37Å; S167-L170 PolarHBondContact O-N 2.87Å; S167-L170 WeakPolarHBondContact OG-CB 3.27Å; S167-L170 WeakPolarHBondContact OG-CD2 3.24Å; S167-R171 PolarHBondContact O-N 3.18Å
168	T	83	Confident	86.3	Confident	105 Å²	105	71.6 Å²	71.6	64%	0.644	38%	0.384	S	S	*	.	H	α-helix	trans	-61.9	-39.4	172	-49.7	0	0	0	0	110.9	L170 R171 S172	T168-L170 PolarHBondContact O-N 2.99Å; T168-R171 PolarHBondContact O-N 2.88Å; T168-S172 PolarHBondContact O-N 2.94Å; T168-S172 VanDerWaalsContact O-N 3.07Å; T168-S172 PolarHBondContact O-OG 2.88Å
169	N	85.5	Confident	86.3	Confident	115 Å²	115	76.3 Å²	76.3	62%	0.615	39%	0.389	S	S	*	.	H	α-helix	trans	-60.5	-42.9	179.2	-67.9	-17	0	0	0	112.2	S167 R171 S172 L173	S167-N169 VanDerWaalsContact C-N 3.28Å; S167-N169 PolarHBondContact O-N 3.37Å; N169-R171 VanDerWaalsContact C-N 3.32Å; N169-R171 PolarHBondContact O-N 3.37Å; N169-S172 PolarHBondContact O-N 2.91Å; N169-L173 VanDerWaalsContact O-CB 3.27Å; N169-L173 WeakPolarHBondContact O-CB 3.4Å; N169-L173 PolarHBondContact O-N 3.48Å
170	L	88.1	Confident	86.2	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-61.7	-40.6	178.2	-178.8	61.9	0	0	0	111.7	L163 L164 S167 T168 L173 L174 F196 F199	L163-L170 HydrophobicContact CD2-CD2 4.14Å; L163-L170 HydrophobicContact CG-CD2 3.99Å; L164-L170 HydrophobicContact CD2-CD2 3.82Å; L164-L170 HydrophobicContact CD2-CG 4.3Å; S167-L170 PolarHBondContact O-N 2.87Å; S167-L170 WeakPolarHBondContact OG-CB 3.27Å; S167-L170 WeakPolarHBondContact OG-CD2 3.24Å; T168-L170 PolarHBondContact O-N 2.99Å; L170-L173 PolarHBondContact O-N 3.42Å; L170-L174 HydrophobicContact CD1-CD1 4.33Å; L170-L174 HydrophobicContact CD1-CG 4.29Å; L170-L174 HydrophobicContact CG-CD1 4.04Å; L170-L174 HydrophobicContact CG-CG 4.43Å; L170-L174 WeakPolarHBondContact O-CB 3.23Å; L170-L174 VanDerWaalsContact O-CG 3.25Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3.36Å; L170-F196 HydrophobicContact CD1-CB 4.18Å; L170-F196 HydrophobicContact CD1-CD2 3.8Å; L170-F196 HydrophobicContact CD1-CG 4.48Å; L170-F199 HydrophobicContact CD1-CB 3.93Å; L170-F199 HydrophobicContact CD1-CG 4.21Å; L170-F199 HydrophobicContact CD2-CB 3.81Å; L170-F199 HydrophobicContact CD2-CD2 4.08Å; L170-F199 HydrophobicContact CD2-CG 4.08Å
171	R	86.1	Confident	86.1	Confident	126 Å²	126	81.8 Å²	81.8	48%	0.475	42%	0.416	S	S	.	.	H	α-helix	trans	-64.4	-47.1	176.7	-68.1	-176.7	178.1	179.3	-1.8	111.4	L164 S167 T168 N169 L173 L174 V175	L164-R171 VanDerWaalsContact O-CZ 3.24Å; L164-R171 PolarHBondContact O-NE 3.31Å; L164-R171 PolarHBondContact O-NH2 3.26Å; L164-R171 VanDerWaalsContact O-NH2 3.14Å; S167-R171 PolarHBondContact O-N 3.18Å; T168-R171 PolarHBondContact O-N 2.88Å; N169-R171 VanDerWaalsContact C-N 3.32Å; N169-R171 PolarHBondContact O-N 3.37Å; R171-L173 VanDerWaalsContact C-N 3.26Å; R171-L173 PolarHBondContact O-N 3.2Å; R171-L174 PolarHBondContact O-N 3.18Å; R171-V175 VanDerWaalsContact O-CG2 3.31Å; R171-V175 WeakPolarHBondContact O-CG2 3.46Å; R171-V175 PolarHBondContact O-N 3.34Å
172	S	85.9	Confident	86.1	Confident	73 Å²	73	81.8 Å²	81.8	51%	0.51	42%	0.419	S	S	.	.	H	α-helix	trans	-59.5	-41.1	176.2	-58.7	0	0	0	0	111.2	T168 N169 V175 W176	T168-S172 PolarHBondContact O-N 2.94Å; T168-S172 VanDerWaalsContact O-N 3.07Å; T168-S172 PolarHBondContact O-OG 2.88Å; N169-S172 PolarHBondContact O-N 2.91Å; S172-V175 PolarHBondContact O-N 3.44Å; S172-W176 VanDerWaalsContact O-CB 3.28Å; S172-W176 WeakPolarHBondContact O-CB 3.33Å; S172-W176 PolarHBondContact O-N 3.24Å
173	L	87.8	Confident	85.6	Confident	30 Å²	30	77.8 Å²	77.8	16%	0.157	41%	0.409	C	S	.	.	H	α-helix	trans	-66.3	-44.5	177.6	-165.5	77.5	0	0	0	111.9	N169 L170 R171 V175 W176 I177 A190 E193 F196	N169-L173 VanDerWaalsContact O-CB 3.27Å; N169-L173 WeakPolarHBondContact O-CB 3.4Å; N169-L173 PolarHBondContact O-N 3.48Å; L170-L173 PolarHBondContact O-N 3.42Å; R171-L173 VanDerWaalsContact C-N 3.26Å; R171-L173 PolarHBondContact O-N 3.2Å; L173-V175 VanDerWaalsContact C-N 3.34Å; L173-V175 PolarHBondContact O-N 3.4Å; L173-W176 HydrophobicContact CD1-CE3 4.21Å; L173-W176 WeakPolarHBondContact O-CB 3.37Å; L173-W176 PolarHBondContact O-N 3.21Å; L173-I177 HydrophobicContact CG-CD1 4.42Å; L173-I177 VanDerWaalsContact O-CG1 3.27Å; L173-I177 WeakPolarHBondContact O-CG1 3.16Å; L173-I177 PolarHBondContact O-N 3.21Å; L173-A190 HydrophobicContact CD1-CB 4.34Å; L173-A190 HydrophobicContact CD2-CB 3.73Å; L173-A190 HydrophobicContact CG-CB 4.04Å; L173-E193 HydrophobicContact CD1-CG 4.39Å; L173-E193 HydrophobicContact CD2-CB 4.07Å; L173-E193 HydrophobicContact CD2-CG 4.09Å; L173-F196 HydrophobicContact CD2-CB 3.57Å; L173-F196 HydrophobicContact CD2-CD2 3.75Å; L173-F196 HydrophobicContact CD2-CG 3.77Å
174	L	89.3	Confident	85.3	Confident	53 Å²	53	80.3 Å²	80.3	28%	0.277	43%	0.427	S	S	.	.	H	α-helix	trans	-62.1	-41	176.3	-74.1	169.9	0	0	0	111.8	L164 L170 R171 W176 I177 D178 F196 F199	L164-L174 HydrophobicContact CD2-CD1 3.6Å; L170-L174 HydrophobicContact CD1-CD1 4.33Å; L170-L174 HydrophobicContact CD1-CG 4.29Å; L170-L174 HydrophobicContact CG-CD1 4.04Å; L170-L174 HydrophobicContact CG-CG 4.43Å; L170-L174 WeakPolarHBondContact O-CB 3.23Å; L170-L174 VanDerWaalsContact O-CG 3.25Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3.36Å; R171-L174 PolarHBondContact O-N 3.18Å; L174-W176 VanDerWaalsContact C-N 3.35Å; L174-I177 PolarHBondContact O-N 3.22Å; L174-D178 PolarHBondContact O-N 3.08Å; L174-D178 VanDerWaalsContact O-N 3.07Å; L174-F196 HydrophobicContact CD2-CD2 4.42Å; L174-F196 HydrophobicContact CD2-CE2 3.84Å; L174-F199 HydrophobicContact CD1-CZ 4.42Å; L174-F199 HydrophobicContact CD2-CD1 4.46Å; L174-F199 HydrophobicContact CD2-CE1 3.95Å; L174-F199 HydrophobicContact CD2-CZ 4.38Å
175	V	87.7	Confident	85.2	Confident	70 Å²	70	79.8 Å²	79.8	42%	0.424	43%	0.43	S	S	.	.	H	α-helix	trans	-67	-37.8	174.3	173.2	0	0	0	0	111.3	R171 S172 L173 D178 R179	R171-V175 VanDerWaalsContact O-CG2 3.31Å; R171-V175 WeakPolarHBondContact O-CG2 3.46Å; R171-V175 PolarHBondContact O-N 3.34Å; S172-V175 PolarHBondContact O-N 3.44Å; L173-V175 VanDerWaalsContact C-N 3.34Å; L173-V175 PolarHBondContact O-N 3.4Å; V175-D178 PolarHBondContact O-N 2.83Å; V175-R179 WeakPolarHBondContact O-CG 3.21Å; V175-R179 PolarHBondContact O-N 3.31Å
176	W	88.8	Confident	85.2	Confident	106 Å²	106	73.2 Å²	73.2	40%	0.402	40%	0.399	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175.9	177.4	79.5	0	0	0	111.6	S172 L173 L174 R179 H180 A186 Y189	S172-W176 VanDerWaalsContact O-CB 3.28Å; S172-W176 WeakPolarHBondContact O-CB 3.33Å; S172-W176 PolarHBondContact O-N 3.24Å; L173-W176 HydrophobicContact CD1-CE3 4.21Å; L173-W176 WeakPolarHBondContact O-CB 3.37Å; L173-W176 PolarHBondContact O-N 3.21Å; L174-W176 VanDerWaalsContact C-N 3.35Å; W176-R179 PolarHBondContact O-N 2.85Å; W176-H180 AromaticContact CE2-CD2 3.84Å; W176-H180 AromaticContact CZ2-CD2 3.52Å; W176-H180 AromaticContact CZ2-NE2 3.84Å; W176-H180 WeakPolarHBondContact O-CB 3.27Å; W176-H180 PolarHBondContact O-N 3.44Å; W176-A186 HydrophobicContact CE3-CB 4.2Å; W176-A186 HydrophobicContact CH2-CB 3.88Å; W176-A186 HydrophobicContact CZ3-CB 3.6Å; W176-A186 WeakPolarHBondContact CZ3-O 3.15Å; W176-Y189 HydrophobicContact CH2-CD2 4.32Å; W176-Y189 HydrophobicContact CH2-CG 4.33Å
177	I	89.1	Confident	85.2	Confident	10 Å²	10	72.4 Å²	72.4	5%	0.051	39%	0.385	C	S	.	.	H	α-helix	trans	-60.6	-47	175.6	-65.2	164.6	0	0	0	110.9	L173 L174 R179 H180 A186 F187 A190 F196	L173-I177 HydrophobicContact CG-CD1 4.42Å; L173-I177 VanDerWaalsContact O-CG1 3.27Å; L173-I177 WeakPolarHBondContact O-CG1 3.16Å; L173-I177 PolarHBondContact O-N 3.21Å; L174-I177 PolarHBondContact O-N 3.22Å; I177-R179 PolarHBondContact O-N 3.14Å; I177-H180 WeakPolarHBondContact O-CB 3.49Å; I177-H180 PolarHBondContact O-N 3.47Å; I177-H180 VanDerWaalsContact O-N 3.14Å; I177-A186 HydrophobicContact CB-CB 4.4Å; I177-A186 HydrophobicContact CG1-CB 4.14Å; I177-A186 HydrophobicContact CG2-CB 4.33Å; I177-F187 HydrophobicContact CD1-CD1 4.36Å; I177-F187 HydrophobicContact CD1-CE1 4.36Å; I177-F187 HydrophobicContact CG2-CD1 4.46Å; I177-F187 HydrophobicContact CG2-CD2 4.15Å; I177-F187 HydrophobicContact CG2-CE1 4.12Å; I177-F187 HydrophobicContact CG2-CE2 3.75Å; I177-F187 HydrophobicContact CG2-CG 4.47Å; I177-F187 HydrophobicContact CG2-CZ 3.73Å; I177-A190 HydrophobicContact CD1-CB 3.49Å; I177-A190 VanDerWaalsContact CD1-CB 3.49Å; I177-A190 HydrophobicContact CG1-CB 4.11Å; I177-F196 HydrophobicContact CD1-CD2 4.25Å; I177-F196 HydrophobicContact CD1-CE2 3.51Å; I177-F196 HydrophobicContact CD1-CZ 3.7Å
178	D	85.7	Confident	85.3	Confident	142 Å²	142	75.4 Å²	75.4	76%	0.759	40%	0.4	S	S	*	.	H	α-helix	trans	-60.9	-31.6	-179.3	-174.9	62.7	0	0	0	112.8	L174 V175	L174-D178 PolarHBondContact O-N 3.08Å; L174-D178 VanDerWaalsContact O-N 3.07Å; V175-D178 PolarHBondContact O-N 2.83Å
179	R	84.9	Confident	85.5	Confident	201 Å²	201	77.2 Å²	77.2	76%	0.758	40%	0.396	S	S	*	.	H	α-helix	trans	-92.9	-6.4	179.5	-66.7	179.4	177.2	-169.7	0.4	113.9	V175 W176 I177	V175-R179 WeakPolarHBondContact O-CG 3.21Å; V175-R179 PolarHBondContact O-N 3.31Å; W176-R179 PolarHBondContact O-N 2.85Å; I177-R179 PolarHBondContact O-N 3.14Å
180	H	82.8	Confident	85.6	Confident	50 Å²	50	71.7 Å²	71.7	23%	0.231	37%	0.367	C	S	.	.			trans	-72.5	134.6	-174.1	-161.1	-97.5	0	0	0	110.6	W176 I177 T182 A186	W176-H180 AromaticContact CE2-CD2 3.84Å; W176-H180 AromaticContact CZ2-CD2 3.52Å; W176-H180 AromaticContact CZ2-NE2 3.84Å; W176-H180 WeakPolarHBondContact O-CB 3.27Å; W176-H180 PolarHBondContact O-N 3.44Å; I177-H180 WeakPolarHBondContact O-CB 3.49Å; I177-H180 PolarHBondContact O-N 3.47Å; I177-H180 VanDerWaalsContact O-N 3.14Å; H180-T182 PolarHBondContact CE1-OG1 2.85Å; H180-T182 PolarHBondContact ND1-N 2.76Å; H180-T182 PolarHBondContact ND1-O 3.27Å; H180-T182 PolarHBondContact ND1-OG1 3.47Å; H180-T182 PolarHBondContact O-N 3.14Å; H180-T182 VanDerWaalsContact O-N 3.13Å; H180-A186 HydrophobicContact CB-CB 3.63Å
181	P	82.6	Confident	85.5	Confident	119 Å²	119	72.3 Å²	72.3	77%	0.773	37%	0.37	S	S	*	.	S	Bend	trans	-61.7	-23.8	-179.8	23.8	-34.4	0	0	0	113.2
182	T	85.1	Confident	85.6	Confident	76 Å²	76	72.8 Å²	72.8	47%	0.466	38%	0.375	S	S	.	.	S	Bend	trans	-129.2	88.3	175.9	48.9	0	0	0	0	109.8	H180 S184 A185 A186	H180-T182 PolarHBondContact CE1-OG1 2.85Å; H180-T182 PolarHBondContact ND1-N 2.76Å; H180-T182 PolarHBondContact ND1-O 3.27Å; H180-T182 PolarHBondContact ND1-OG1 3.47Å; H180-T182 PolarHBondContact O-N 3.14Å; H180-T182 VanDerWaalsContact O-N 3.13Å; T182-S184 PolarHBondContact O-N 3.05Å; T182-A185 PolarHBondContact O-N 3.18Å; T182-A186 PolarHBondContact O-N 2.93Å
183	P	78.7	Confident	85.6	Confident	71 Å²	71	73.6 Å²	73.6	46%	0.461	37%	0.371	S	S	.	.	H	α-helix	trans	-59.2	-35	-174.3	21.5	-32.7	0	0	0	112.2	A185 A186 F187	P183-A185 PolarHBondContact O-N 3.01Å; P183-A186 WeakPolarHBondContact O-CA 3.14Å; P183-A186 WeakPolarHBondContact O-CB 3.42Å; P183-A186 PolarHBondContact O-N 3.28Å; P183-A186 VanDerWaalsContact O-N 3.08Å; P183-F187 HydrophobicContact CB-CE2 4.32Å; P183-F187 WeakPolarHBondContact O-CD2 3.49Å; P183-F187 PolarHBondContact O-N 3.34Å
184	S	80.1	Confident	85.6	Confident	61 Å²	61	75.9 Å²	75.9	43%	0.427	39%	0.388	S	S	.	.	H	α-helix	trans	-55.2	-50.1	176.6	-173.4	0	0	0	0	112.5	T182 A186 F187 D188	T182-S184 PolarHBondContact O-N 3.05Å; S184-A186 VanDerWaalsContact C-N 3.31Å; S184-A186 PolarHBondContact O-N 3.32Å; S184-F187 PolarHBondContact O-N 2.77Å; S184-D188 PolarHBondContact O-N 3.15Å
185	A	83	Confident	85.5	Confident	34 Å²	34	75.9 Å²	75.9	28%	0.281	39%	0.388	S	S	.	.	H	α-helix	trans	-64.9	-36.6	176.2	0	0	0	0	0	111.9	T182 P183 F187 D188 Y189	T182-A185 PolarHBondContact O-N 3.18Å; P183-A185 PolarHBondContact O-N 3.01Å; A185-F187 VanDerWaalsContact C-N 3.33Å; A185-F187 PolarHBondContact O-N 3.3Å; A185-D188 PolarHBondContact O-N 2.85Å; A185-Y189 WeakPolarHBondContact O-CD2 3.12Å; A185-Y189 PolarHBondContact O-N 3.24Å
186	A	86.2	Confident	85.6	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-63.4	-39.1	176.6	0	0	0	0	0	112.2	W176 I177 H180 T182 P183 S184 D188 Y189 A190	W176-A186 HydrophobicContact CE3-CB 4.2Å; W176-A186 HydrophobicContact CH2-CB 3.88Å; W176-A186 HydrophobicContact CZ3-CB 3.6Å; W176-A186 WeakPolarHBondContact CZ3-O 3.15Å; I177-A186 HydrophobicContact CB-CB 4.4Å; I177-A186 HydrophobicContact CG1-CB 4.14Å; I177-A186 HydrophobicContact CG2-CB 4.33Å; H180-A186 HydrophobicContact CB-CB 3.63Å; T182-A186 PolarHBondContact O-N 2.93Å; P183-A186 WeakPolarHBondContact O-CA 3.14Å; P183-A186 WeakPolarHBondContact O-CB 3.42Å; P183-A186 PolarHBondContact O-N 3.28Å; P183-A186 VanDerWaalsContact O-N 3.08Å; S184-A186 VanDerWaalsContact C-N 3.31Å; S184-A186 PolarHBondContact O-N 3.32Å; A186-D188 VanDerWaalsContact C-N 3.34Å; A186-D188 PolarHBondContact O-N 2.82Å; A186-Y189 PolarHBondContact O-N 3.46Å; A186-A190 VanDerWaalsContact O-CB 3.32Å; A186-A190 WeakPolarHBondContact O-CB 3.28Å; A186-A190 PolarHBondContact O-N 3.38Å
187	F	86.2	Confident	85.5	Confident	69 Å²	69	72.5 Å²	72.5	30%	0.303	37%	0.368	S	S	.	.	H	α-helix	trans	-60.8	-41.9	174	-80.4	-73.3	0	0	0	111.7	I177 P183 S184 A185 Y189 A190 L191 F196 A224	I177-F187 HydrophobicContact CD1-CD1 4.36Å; I177-F187 HydrophobicContact CD1-CE1 4.36Å; I177-F187 HydrophobicContact CG2-CD1 4.46Å; I177-F187 HydrophobicContact CG2-CD2 4.15Å; I177-F187 HydrophobicContact CG2-CE1 4.12Å; I177-F187 HydrophobicContact CG2-CE2 3.75Å; I177-F187 HydrophobicContact CG2-CG 4.47Å; I177-F187 HydrophobicContact CG2-CZ 3.73Å; P183-F187 HydrophobicContact CB-CE2 4.32Å; P183-F187 WeakPolarHBondContact O-CD2 3.49Å; P183-F187 PolarHBondContact O-N 3.34Å; S184-F187 PolarHBondContact O-N 2.77Å; A185-F187 VanDerWaalsContact C-N 3.33Å; A185-F187 PolarHBondContact O-N 3.3Å; F187-Y189 VanDerWaalsContact C-N 3.3Å; F187-Y189 PolarHBondContact O-N 3.04Å; F187-A190 PolarHBondContact O-N 2.97Å; F187-A190 VanDerWaalsContact O-N 3.14Å; F187-L191 WeakPolarHBondContact O-CB 3.42Å; F187-L191 VanDerWaalsContact O-CG 3.26Å; F187-L191 WeakPolarHBondContact O-CG 3.07Å; F187-L191 PolarHBondContact O-N 3.43Å; F187-F196 HydrophobicContact CD1-CE1 4.06Å; F187-F196 AromaticContact CD1-CZ 3.66Å; F187-F196 HydrophobicContact CD1-CZ 3.66Å; F187-F196 AromaticContact CE1-CZ 3.77Å; F187-F196 HydrophobicContact CE1-CZ 3.77Å; F187-A224 HydrophobicContact CB-CB 3.79Å
188	D	85.8	Confident	85.4	Confident	72 Å²	72	79.5 Å²	79.5	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-61.6	-36.8	177	-69.6	-31.4	0	0	0	112.9	S184 A185 A186 A224	S184-D188 PolarHBondContact O-N 3.15Å; A185-D188 PolarHBondContact O-N 2.85Å; A186-D188 VanDerWaalsContact C-N 3.34Å; A186-D188 PolarHBondContact O-N 2.82Å; D188-A224 WeakPolarHBondContact OD1-CB 3.49Å; D188-A224 PolarHBondContact OD1-N 2.88Å
189	Y	86.9	Confident	85.6	Confident	142 Å²	142	74.5 Å²	74.5	56%	0.557	37%	0.365	S	S	*	.	H	α-helix	trans	-69.9	-44.4	172	-77.7	-78.4	0	0	0	111.6	W176 A185 A186 F187 L191 K192	W176-Y189 HydrophobicContact CH2-CD2 4.32Å; W176-Y189 HydrophobicContact CH2-CG 4.33Å; A185-Y189 WeakPolarHBondContact O-CD2 3.12Å; A185-Y189 PolarHBondContact O-N 3.24Å; A186-Y189 PolarHBondContact O-N 3.46Å; F187-Y189 VanDerWaalsContact C-N 3.3Å; F187-Y189 PolarHBondContact O-N 3.04Å; Y189-L191 VanDerWaalsContact C-N 3.3Å; Y189-L191 PolarHBondContact O-N 3.38Å; Y189-K192 WeakPolarHBondContact O-CB 3.35Å; Y189-K192 PolarHBondContact O-N 3.11Å; Y189-K192 VanDerWaalsContact O-N 3.12Å
190	A	87.3	Confident	85.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-34.7	-179.3	0	0	0	0	0	112.5	L173 I177 A186 F187 K192 E193 F196	L173-A190 HydrophobicContact CD1-CB 4.34Å; L173-A190 HydrophobicContact CD2-CB 3.73Å; L173-A190 HydrophobicContact CG-CB 4.04Å; I177-A190 HydrophobicContact CD1-CB 3.49Å; I177-A190 VanDerWaalsContact CD1-CB 3.49Å; I177-A190 HydrophobicContact CG1-CB 4.11Å; A186-A190 VanDerWaalsContact O-CB 3.32Å; A186-A190 WeakPolarHBondContact O-CB 3.28Å; A186-A190 PolarHBondContact O-N 3.38Å; F187-A190 PolarHBondContact O-N 2.97Å; F187-A190 VanDerWaalsContact O-N 3.14Å; A190-K192 PolarHBondContact O-N 3.03Å; A190-K192 VanDerWaalsContact O-N 3.14Å; A190-E193 WeakPolarHBondContact O-CB 3.44Å; A190-E193 PolarHBondContact O-N 3.16Å; A190-F196 VanDerWaalsContact C-CD1 3.4Å; A190-F196 HydrophobicContact CB-CD1 3.61Å; A190-F196 HydrophobicContact CB-CD2 4.19Å; A190-F196 HydrophobicContact CB-CE1 3.66Å; A190-F196 HydrophobicContact CB-CE2 4.24Å; A190-F196 HydrophobicContact CB-CG 3.89Å; A190-F196 HydrophobicContact CB-CZ 3.98Å; A190-F196 VanDerWaalsContact O-CB 3.29Å; A190-F196 WeakPolarHBondContact O-CB 3.47Å; A190-F196 VanDerWaalsContact O-CD1 3.31Å; A190-F196 WeakPolarHBondContact O-CD1 3.16Å
191	L	86.2	Confident	86	Confident	14 Å²	14	66.2 Å²	66.2	7%	0.073	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.6	176.5	-74.1	170.9	0	0	0	113.9	F187 Y189 E193 F196 R197 A224 M227	F187-L191 WeakPolarHBondContact O-CB 3.42Å; F187-L191 VanDerWaalsContact O-CG 3.26Å; F187-L191 WeakPolarHBondContact O-CG 3.07Å; F187-L191 PolarHBondContact O-N 3.43Å; Y189-L191 VanDerWaalsContact C-N 3.3Å; Y189-L191 PolarHBondContact O-N 3.38Å; L191-E193 VanDerWaalsContact C-N 3.33Å; L191-F196 HydrophobicContact CD2-CD1 4.11Å; L191-F196 HydrophobicContact CD2-CE1 4.01Å; L191-F196 HydrophobicContact CG-CD1 4.43Å; L191-F196 HydrophobicContact CG-CE1 4.23Å; L191-R197 WeakPolarHBondContact O-CD 3.28Å; L191-R197 VanDerWaalsContact O-CG 3.23Å; L191-R197 WeakPolarHBondContact O-CG 3.48Å; L191-R197 PolarHBondContact O-NH1 3.43Å; L191-A224 HydrophobicContact CD1-CB 4.07Å; L191-M227 HydrophobicContact CD1-SD 4.31Å; L191-M227 HydrophobicContact CD2-SD 3.45Å; L191-M227 WeakPolarHBondContact CD2-SD 3.41Å
192	K	87.5	Confident	86.2	Confident	135 Å²	135	62.3 Å²	62.3	59%	0.587	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-27.1	170.9	-61.7	175	-177.5	171.7	0	111.8	Y189 A190 R197	Y189-K192 WeakPolarHBondContact O-CB 3.35Å; Y189-K192 PolarHBondContact O-N 3.11Å; Y189-K192 VanDerWaalsContact O-N 3.12Å; A190-K192 PolarHBondContact O-N 3.03Å; A190-K192 VanDerWaalsContact O-N 3.14Å; K192-R197 PolarHBondContact O-NH1 3.33Å; K192-R197 PolarHBondContact O-NH2 3.36Å
193	E	87.1	Confident	86.3	Confident	90 Å²	90	59.6 Å²	59.6	42%	0.421	30%	0.3	S	S	.	.	S	Bend	trans	-76.4	128.1	-179.8	-70.4	-61.5	143.7	0	0	111.7	L173 A190 L191 D195 F196 R197	L173-E193 HydrophobicContact CD1-CG 4.39Å; L173-E193 HydrophobicContact CD2-CB 4.07Å; L173-E193 HydrophobicContact CD2-CG 4.09Å; A190-E193 WeakPolarHBondContact O-CB 3.44Å; A190-E193 PolarHBondContact O-N 3.16Å; L191-E193 VanDerWaalsContact C-N 3.33Å; E193-D195 VanDerWaalsContact C-N 3.33Å; E193-D195 PolarHBondContact O-N 3.13Å; E193-F196 HydrophobicContact CB-CB 4.07Å; E193-F196 PolarHBondContact O-N 2.86Å; E193-R197 PolarHBondContact O-N 3.45Å; E193-R197 VanDerWaalsContact O-N 3.09Å
194	P	86.7	Confident	86.5	Confident	79 Å²	79	58.3 Å²	58.3	51%	0.513	29%	0.289	S	S	.	.	H	α-helix	trans	-65.1	-36	-177.3	26.8	-33.7	0	0	0	112.6	F196 R197 R198	P194-F196 VanDerWaalsContact C-N 3.34Å; P194-R197 PolarHBondContact O-N 3.17Å; P194-R198 WeakPolarHBondContact O-CB 3.47Å; P194-R198 PolarHBondContact O-N 3.34Å
195	D	86.6	Confident	86.8	Confident	52 Å²	52	60 Å²	60	28%	0.278	29%	0.293	S	S	.	.	H	α-helix	trans	-66.6	-38.3	178.8	-75.3	-17.2	0	0	0	111.6	E193 R198 F199	E193-D195 VanDerWaalsContact C-N 3.33Å; E193-D195 PolarHBondContact O-N 3.13Å; D195-R198 PolarHBondContact O-N 3.18Å; D195-F199 WeakPolarHBondContact O-CB 3.46Å; D195-F199 PolarHBondContact O-N 3.37Å
196	F	89.4	Confident	86.9	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.009	29%	0.292	C	S	.	.	H	α-helix	trans	-69.1	-42.3	176.7	-171.3	-102.3	0	0	0	111.7	L170 L173 L174 I177 F187 A190 L191 E193 P194 R198 F199 C200	L170-F196 HydrophobicContact CD1-CB 4.18Å; L170-F196 HydrophobicContact CD1-CD2 3.8Å; L170-F196 HydrophobicContact CD1-CG 4.48Å; L173-F196 HydrophobicContact CD2-CB 3.57Å; L173-F196 HydrophobicContact CD2-CD2 3.75Å; L173-F196 HydrophobicContact CD2-CG 3.77Å; L174-F196 HydrophobicContact CD2-CD2 4.42Å; L174-F196 HydrophobicContact CD2-CE2 3.84Å; I177-F196 HydrophobicContact CD1-CD2 4.25Å; I177-F196 HydrophobicContact CD1-CE2 3.51Å; I177-F196 HydrophobicContact CD1-CZ 3.7Å; F187-F196 HydrophobicContact CD1-CE1 4.06Å; F187-F196 AromaticContact CD1-CZ 3.66Å; F187-F196 HydrophobicContact CD1-CZ 3.66Å; F187-F196 AromaticContact CE1-CZ 3.77Å; F187-F196 HydrophobicContact CE1-CZ 3.77Å; A190-F196 VanDerWaalsContact C-CD1 3.4Å; A190-F196 HydrophobicContact CB-CD1 3.61Å; A190-F196 HydrophobicContact CB-CD2 4.19Å; A190-F196 HydrophobicContact CB-CE1 3.66Å; A190-F196 HydrophobicContact CB-CE2 4.24Å; A190-F196 HydrophobicContact CB-CG 3.89Å; A190-F196 HydrophobicContact CB-CZ 3.98Å; A190-F196 VanDerWaalsContact O-CB 3.29Å; A190-F196 WeakPolarHBondContact O-CB 3.47Å; A190-F196 VanDerWaalsContact O-CD1 3.31Å; A190-F196 WeakPolarHBondContact O-CD1 3.16Å; L191-F196 HydrophobicContact CD2-CD1 4.11Å; L191-F196 HydrophobicContact CD2-CE1 4.01Å; L191-F196 HydrophobicContact CG-CD1 4.43Å; L191-F196 HydrophobicContact CG-CE1 4.23Å; E193-F196 HydrophobicContact CB-CB 4.07Å; E193-F196 PolarHBondContact O-N 2.86Å; P194-F196 VanDerWaalsContact C-N 3.34Å; F196-R198 VanDerWaalsContact C-N 3.3Å; F196-R198 PolarHBondContact O-N 3.28Å; F196-F199 HydrophobicContact CD2-CD1 4.31Å; F196-F199 HydrophobicContact CE2-CD1 4.21Å; F196-F199 WeakPolarHBondContact O-CB 3.5Å; F196-F199 PolarHBondContact O-N 2.89Å; F196-F199 VanDerWaalsContact O-N 3.15Å; F196-C200 VanDerWaalsContact CE1-SG 3.5Å; F196-C200 PolarHBondContact O-N 2.91Å; F196-C200 PolarHBondContact O-SG 3Å; F196-C200 VanDerWaalsContact O-SG 3.34Å
197	R	87.9	Confident	86.6	Confident	104 Å²	104	61.8 Å²	61.8	39%	0.392	30%	0.299	S	S	.	.	H	α-helix	trans	-58.6	-42.6	171.9	-73.3	-170.7	-72.9	-120.9	-2	112.1	L191 K192 E193 P194 F199 C200 S201	L191-R197 WeakPolarHBondContact O-CD 3.28Å; L191-R197 VanDerWaalsContact O-CG 3.23Å; L191-R197 WeakPolarHBondContact O-CG 3.48Å; L191-R197 PolarHBondContact O-NH1 3.43Å; K192-R197 PolarHBondContact O-NH1 3.33Å; K192-R197 PolarHBondContact O-NH2 3.36Å; E193-R197 PolarHBondContact O-N 3.45Å; E193-R197 VanDerWaalsContact O-N 3.09Å; P194-R197 PolarHBondContact O-N 3.17Å; R197-F199 VanDerWaalsContact C-N 3.33Å; R197-C200 PolarHBondContact O-N 3.16Å; R197-S201 WeakPolarHBondContact O-CB 3.29Å; R197-S201 PolarHBondContact O-N 3.46Å
198	R	87.8	Confident	85.9	Confident	156 Å²	156	61.4 Å²	61.4	59%	0.589	31%	0.305	S	S	*	.	H	α-helix	trans	-63.4	-40.7	175.9	-170	178.5	-177.3	178.1	3.3	111.5	L163 P194 D195 F196 S201 L202	L163-R198 HydrophobicContact CD2-CB 4.25Å; L163-R198 HydrophobicContact CD2-CG 4.1Å; P194-R198 WeakPolarHBondContact O-CB 3.47Å; P194-R198 PolarHBondContact O-N 3.34Å; D195-R198 PolarHBondContact O-N 3.18Å; F196-R198 VanDerWaalsContact C-N 3.3Å; F196-R198 PolarHBondContact O-N 3.28Å; R198-S201 PolarHBondContact O-N 3.46Å; R198-L202 WeakPolarHBondContact O-CB 3.48Å; R198-L202 WeakPolarHBondContact O-CG 3.38Å; R198-L202 PolarHBondContact O-N 2.86Å
199	F	89.9	Confident	84.8	Confident	37 Å²	37	61.1 Å²	61.1	16%	0.162	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-51.4	174	168.8	-102	0	0	0	111.6	L160 L163 L164 L170 L174 D195 F196 R197 S201 L202 C203	L160-F199 HydrophobicContact CD2-CD2 3.85Å; L160-F199 HydrophobicContact CD2-CE2 4.03Å; L163-F199 HydrophobicContact CD2-CB 3.79Å; L164-F199 HydrophobicContact CD1-CE2 4.4Å; L164-F199 HydrophobicContact CD2-CD2 4.21Å; L164-F199 HydrophobicContact CD2-CE2 4.05Å; L164-F199 HydrophobicContact CG-CD2 4.5Å; L164-F199 HydrophobicContact CG-CE2 4.36Å; L170-F199 HydrophobicContact CD1-CB 3.93Å; L170-F199 HydrophobicContact CD1-CG 4.21Å; L170-F199 HydrophobicContact CD2-CB 3.81Å; L170-F199 HydrophobicContact CD2-CD2 4.08Å; L170-F199 HydrophobicContact CD2-CG 4.08Å; L174-F199 HydrophobicContact CD1-CZ 4.42Å; L174-F199 HydrophobicContact CD2-CD1 4.46Å; L174-F199 HydrophobicContact CD2-CE1 3.95Å; L174-F199 HydrophobicContact CD2-CZ 4.38Å; D195-F199 WeakPolarHBondContact O-CB 3.46Å; D195-F199 PolarHBondContact O-N 3.37Å; F196-F199 HydrophobicContact CD2-CD1 4.31Å; F196-F199 HydrophobicContact CE2-CD1 4.21Å; F196-F199 WeakPolarHBondContact O-CB 3.5Å; F196-F199 PolarHBondContact O-N 2.89Å; F196-F199 VanDerWaalsContact O-N 3.15Å; R197-F199 VanDerWaalsContact C-N 3.33Å; F199-S201 VanDerWaalsContact C-N 3.34Å; F199-S201 PolarHBondContact O-N 3.04Å; F199-L202 PolarHBondContact O-N 3.07Å; F199-C203 VanDerWaalsContact CZ-SG 3.59Å; F199-C203 PolarHBondContact O-N 3.25Å; F199-C203 PolarHBondContact O-SG 2.83Å; F199-C203 VanDerWaalsContact O-SG 3.33Å
200	C	88.3	Confident	82.9	Confident	21 Å²	21	59.8 Å²	59.8	14%	0.142	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-42.6	177.6	-64.8	0	0	0	0	112.3	F196 R197 L202 C203 L204 M227	F196-C200 VanDerWaalsContact CE1-SG 3.5Å; F196-C200 PolarHBondContact O-N 2.91Å; F196-C200 PolarHBondContact O-SG 3Å; F196-C200 VanDerWaalsContact O-SG 3.34Å; R197-C200 PolarHBondContact O-N 3.16Å; C200-L202 PolarHBondContact O-N 3.33Å; C200-C203 WeakPolarHBondContact O-CB 3.49Å; C200-C203 PolarHBondContact O-N 3.08Å; C200-L204 WeakPolarHBondContact O-CG 3.46Å; C200-L204 PolarHBondContact O-N 3.43Å; C200-M227 HydrophobicContact CB-CE 3.6Å
201	S	86.9	Confident	80.8	Confident	56 Å²	56	65.8 Å²	65.8	39%	0.392	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-42.6	175.7	176.1	0	0	0	0	112	R197 R198 F199 L204 N205	R197-S201 WeakPolarHBondContact O-CB 3.29Å; R197-S201 PolarHBondContact O-N 3.46Å; R198-S201 PolarHBondContact O-N 3.46Å; F199-S201 VanDerWaalsContact C-N 3.34Å; F199-S201 PolarHBondContact O-N 3.04Å; S201-L204 PolarHBondContact O-N 3.47Å; S201-N205 WeakPolarHBondContact O-CB 3.39Å; S201-N205 PolarHBondContact O-N 3.21Å; S201-N205 PolarHBondContact O-ND2 3.25Å
202	L	87.2	Confident	78.7	Confident	38 Å²	38	71.6 Å²	71.6	20%	0.199	38%	0.382	C	S	.	.	H	α-helix	trans	-63.4	-43.7	175.1	-75.6	176.2	0	0	0	111.7	A159 L160 L163 R198 F199 C200 L204 N205 T206	A159-L202 HydrophobicContact CB-CD1 4.48Å; A159-L202 HydrophobicContact CB-CD2 4.14Å; L160-L202 HydrophobicContact CD2-CB 3.37Å; L160-L202 HydrophobicContact CD2-CD1 4.17Å; L160-L202 HydrophobicContact CD2-CG 4.44Å; L160-L202 HydrophobicContact CG-CB 3.95Å; L163-L202 HydrophobicContact CB-CD1 4.15Å; L163-L202 HydrophobicContact CD2-CD1 3.72Å; R198-L202 WeakPolarHBondContact O-CB 3.48Å; R198-L202 WeakPolarHBondContact O-CG 3.38Å; R198-L202 PolarHBondContact O-N 2.86Å; F199-L202 PolarHBondContact O-N 3.07Å; C200-L202 PolarHBondContact O-N 3.33Å; L202-L204 PolarHBondContact O-N 3.29Å; L202-N205 PolarHBondContact O-N 2.95Å; L202-T206 PolarHBondContact O-N 2.98Å; L202-T206 PolarHBondContact O-OG1 3.36Å
203	C	86.7	Confident	76.4	Confident	18 Å²	18	69.6 Å²	69.6	12%	0.122	40%	0.399	C	S	.	.	H	α-helix	trans	-57.2	-49.8	175.7	-69	0	0	0	0	111	L154 F199 C200 N205 T206 L207	L154-C203 HydrophobicContact CD2-CB 3.83Å; F199-C203 VanDerWaalsContact CZ-SG 3.59Å; F199-C203 PolarHBondContact O-N 3.25Å; F199-C203 PolarHBondContact O-SG 2.83Å; F199-C203 VanDerWaalsContact O-SG 3.33Å; C200-C203 WeakPolarHBondContact O-CB 3.49Å; C200-C203 PolarHBondContact O-N 3.08Å; C203-N205 PolarHBondContact O-N 3.13Å; C203-T206 WeakPolarHBondContact CA-OG1 3.36Å; C203-T206 PolarHBondContact O-N 3.32Å; C203-T206 PolarHBondContact O-OG1 3.49Å; C203-L207 VanDerWaalsContact O-CG 3.28Å; C203-L207 WeakPolarHBondContact O-CG 3.24Å; C203-L207 PolarHBondContact O-N 2.91Å
204	L	83.7	Confident	74.2	Confident	44 Å²	44	69.7 Å²	69.7	23%	0.23	41%	0.41	C	S	.	.	H	α-helix	trans	-61	-42.4	178.1	-72.3	169.6	0	0	0	112.1	C200 S201 L202 T206 L207 S208 M227 L231	C200-L204 WeakPolarHBondContact O-CG 3.46Å; C200-L204 PolarHBondContact O-N 3.43Å; S201-L204 PolarHBondContact O-N 3.47Å; L202-L204 PolarHBondContact O-N 3.29Å; L204-T206 VanDerWaalsContact C-N 3.34Å; L204-T206 PolarHBondContact O-N 2.75Å; L204-L207 PolarHBondContact O-N 3.41Å; L204-S208 VanDerWaalsContact O-CB 3.28Å; L204-S208 WeakPolarHBondContact O-CB 3.46Å; L204-S208 PolarHBondContact O-N 3.27Å; L204-S208 PolarHBondContact O-OG 2.87Å; L204-M227 HydrophobicContact CD1-CE 3.82Å; L204-L231 HydrophobicContact CD2-CD2 3.43Å; L204-L231 VanDerWaalsContact CD2-CD2 3.43Å; L204-L231 HydrophobicContact CD2-CG 3.94Å; L204-L231 HydrophobicContact CG-CD2 4.33Å
205	N	85.1	Confident	71.9	Confident	98 Å²	98	70.1 Å²	70.1	52%	0.524	42%	0.42	S	S	.	.	H	α-helix	trans	-64	-37.8	177.5	-69.8	-21.9	0	0	0	112.4	S201 L202 C203	S201-N205 WeakPolarHBondContact O-CB 3.39Å; S201-N205 PolarHBondContact O-N 3.21Å; S201-N205 PolarHBondContact O-ND2 3.25Å; L202-N205 PolarHBondContact O-N 2.95Å; C203-N205 PolarHBondContact O-N 3.13Å
206	T	84.4	Confident	69.8	Low	41 Å²	41	73.2 Å²	73.2	25%	0.252	44%	0.441	S	S	.	.	H	α-helix	trans	-68.7	-34	174.2	25.7	0	0	0	0	113.3	L154 S157 L160 L202 C203 L204	L154-T206 VanDerWaalsContact CD2-OG1 3.28Å; L154-T206 WeakPolarHBondContact CD2-OG1 3.36Å; S157-T206 WeakPolarHBondContact OG-CG2 3.18Å; L160-T206 HydrophobicContact CD1-CG2 4.3Å; L202-T206 PolarHBondContact O-N 2.98Å; L202-T206 PolarHBondContact O-OG1 3.36Å; C203-T206 WeakPolarHBondContact CA-OG1 3.36Å; C203-T206 PolarHBondContact O-N 3.32Å; C203-T206 PolarHBondContact O-OG1 3.49Å; L204-T206 VanDerWaalsContact C-N 3.34Å; L204-T206 PolarHBondContact O-N 2.75Å
207	L	80.5	Confident	67.5	Low	29 Å²	29	79.2 Å²	79.2	15%	0.152	48%	0.478	C	S	.	.	H	α-helix	trans	-80.7	-28.7	179.4	-65.2	177.3	0	0	0	112.4	H150 L154 C203 L204 G209 L231	H150-L207 HydrophobicContact CB-CD2 3.4Å; H150-L207 VanDerWaalsContact CB-CD2 3.4Å; L154-L207 HydrophobicContact CD1-CD1 4.41Å; L154-L207 HydrophobicContact CD1-CD2 4.17Å; L154-L207 HydrophobicContact CD2-CD2 4.32Å; L154-L207 HydrophobicContact CD2-CG 4.18Å; L154-L207 HydrophobicContact CG-CD2 4Å; L154-L207 HydrophobicContact CG-CG 4.37Å; C203-L207 VanDerWaalsContact O-CG 3.28Å; C203-L207 WeakPolarHBondContact O-CG 3.24Å; C203-L207 PolarHBondContact O-N 2.91Å; L204-L207 PolarHBondContact O-N 3.41Å; L207-G209 PolarHBondContact O-N 3.4Å; L207-L231 HydrophobicContact CD1-CD2 3.75Å
208	S	71.9	Confident	65.5	Low	61 Å²	61	79.6 Å²	79.6	43%	0.427	49%	0.487	S	S	.	.	S	Bend	trans	-80.4	1.3	-175.1	-55.8	0	0	0	0	114	L204 E210	L204-S208 VanDerWaalsContact O-CB 3.28Å; L204-S208 WeakPolarHBondContact O-CB 3.46Å; L204-S208 PolarHBondContact O-N 3.27Å; L204-S208 PolarHBondContact O-OG 2.87Å; S208-E210 PolarHBondContact O-N 2.99Å
209	G	62.3	Low	63.5	Low	66 Å²	66	75.5 Å²	75.5	68%	0.68	49%	0.493	S	S	*	.			trans	61.5	-8.1	170.3	0	0	0	0	0	117.4	L207	L207-G209 PolarHBondContact O-N 3.4Å
210	E	48.6	Very low	61.8	Low	114 Å²	114	81.8 Å²	81.8	53%	0.533	52%	0.523	S	S	.	.			trans	-110.3	113.2	-172.5	-83.5	-100.9	122.6	0	0	111.1	S208 K212	S208-E210 PolarHBondContact O-N 2.99Å; E210-K212 VanDerWaalsContact C-N 3.25Å; E210-K212 VanDerWaalsContact CD-NZ 3.28Å; E210-K212 PolarHBondContact O-N 3.19Å; E210-K212 IonicContact OE1-NZ 3.37Å; E210-K212 PolarHBondContact OE1-NZ 3.15Å; E210-K212 VanDerWaalsContact OE2-CD 3.22Å; E210-K212 WeakPolarHBondContact OE2-CD 3.48Å; E210-K212 WeakPolarHBondContact OE2-CE 3.35Å; E210-K212 IonicContact OE2-NZ 3.52Å; E210-K212 PolarHBondContact OE2-NZ 2.88Å
211	P	42	Very low	60	Low	126 Å²	126	88.1 Å²	88.1	82%	0.818	55%	0.55	S	S	*	*			trans	-80.3	77.9	166.7	34	-30.1	0	0	0	107.8
212	K	42.8	Very low	58.6	Low	137 Å²	137	86.7 Å²	86.7	60%	0.596	54%	0.54	S	S	*	.			trans	-130.2	123.3	171.5	-68.4	-167.5	-172.5	126.6	0	110.8	E210 S214	E210-K212 VanDerWaalsContact C-N 3.25Å; E210-K212 VanDerWaalsContact CD-NZ 3.28Å; E210-K212 PolarHBondContact O-N 3.19Å; E210-K212 IonicContact OE1-NZ 3.37Å; E210-K212 PolarHBondContact OE1-NZ 3.15Å; E210-K212 VanDerWaalsContact OE2-CD 3.22Å; E210-K212 WeakPolarHBondContact OE2-CD 3.48Å; E210-K212 WeakPolarHBondContact OE2-CE 3.35Å; E210-K212 IonicContact OE2-NZ 3.52Å; E210-K212 PolarHBondContact OE2-NZ 2.88Å; K212-S214 PolarHBondContact O-N 3.23Å
213	G	38.2	Very low	57.7	Low	93 Å²	93	88.5 Å²	88.5	96%	0.959	55%	0.553	S	S	*	*			trans	-70.2	55	-178.8	0	0	0	0	0	114.1
214	S	41.3	Very low	56.7	Low	91 Å²	91	87.8 Å²	87.8	64%	0.636	55%	0.548	S	S	*	.			trans	-91.5	106.5	162.7	50.2	0	0	0	0	107.9	K212 V216	K212-S214 PolarHBondContact O-N 3.23Å; S214-V216 PolarHBondContact O-N 3.24Å
215	A	37.9	Very low	56	Low	89 Å²	89	92.4 Å²	92.4	74%	0.736	57%	0.568	S	S	*	*			trans	-49.7	106.1	160.6	0	0	0	0	0	107.9	T217	A215-T217 PolarHBondContact O-N 3.14Å
216	V	43.2	Very low	55.2	Low	117 Å²	117	90.1 Å²	90.1	71%	0.709	56%	0.56	S	S	*	*			trans	-66.4	98.9	162.9	176.6	0	0	0	0	104.6	S214 L218	S214-V216 PolarHBondContact O-N 3.24Å; V216-L218 HydrophobicContact CG1-CG 4.43Å; V216-L218 PolarHBondContact O-N 3.36Å
217	T	41.7	Very low	54.2	Low	127 Å²	127	89.6 Å²	89.6	78%	0.779	56%	0.555	S	S	*	*			trans	-62.1	92.2	166	48	0	0	0	0	106.6	A215 G219	A215-T217 PolarHBondContact O-N 3.14Å; T217-G219 PolarHBondContact O-N 3.17Å
218	L	44.5	Very low	53.6	Low	113 Å²	113	91.3 Å²	91.3	59%	0.592	56%	0.564	S	S	*	*			trans	-65.8	72.4	161.1	-79.2	164.9	0	0	0	107.5	V216 P222	V216-L218 HydrophobicContact CG1-CG 4.43Å; V216-L218 PolarHBondContact O-N 3.36Å; L218-P222 HydrophobicContact CD1-CG 4.2Å; L218-P222 HydrophobicContact CD2-CB 3.75Å; L218-P222 HydrophobicContact CD2-CG 3.53Å; L218-P222 HydrophobicContact CG-CG 4.43Å
219	G	46.3	Very low	53.6	Low	69 Å²	69	93.5 Å²	93.5	71%	0.711	57%	0.569	S	S	*	*			trans	-76.4	-10.5	177	0	0	0	0	0	113	T217	T217-G219 PolarHBondContact O-N 3.17Å
220	E	54.2	Low	53.7	Low	170 Å²	170	92.9 Å²	92.9	79%	0.794	56%	0.557	S	S	*	*	S	Bend	trans	-131.2	134.8	172.3	-136.4	120	143	0	0	107.6	P222	E220-P222 WeakPolarHBondContact O-CD 3.35Å
221	Q	51.5	Low	54.4	Low	153 Å²	153	91.6 Å²	91.6	72%	0.715	55%	0.553	S	S	*	*			trans	-50	114.1	178	-82.5	-89.2	-16.2	0	0	109.3	T223	Q221-T223 PolarHBondContact O-N 3.21Å; Q221-T223 VanDerWaalsContact O-N 3.08Å
222	P	57	Low	55.5	Low	27 Å²	27	87.9 Å²	87.9	18%	0.175	53%	0.527	C	S	.	.			trans	-70.6	112.3	177.1	30.6	-31.7	0	0	0	106.9	L218 E220 S226 M227	L218-P222 HydrophobicContact CD1-CG 4.2Å; L218-P222 HydrophobicContact CD2-CB 3.75Å; L218-P222 HydrophobicContact CD2-CG 3.53Å; L218-P222 HydrophobicContact CG-CG 4.43Å; E220-P222 WeakPolarHBondContact O-CD 3.35Å; P222-S226 VanDerWaalsContact CA-OG 3.32Å; P222-S226 WeakPolarHBondContact CA-OG 3.33Å; P222-M227 HydrophobicContact CB-CG 3.79Å; P222-M227 HydrophobicContact CB-SD 4.13Å; P222-M227 HydrophobicContact CG-CG 4.42Å; P222-M227 HydrophobicContact CG-SD 4.1Å
223	T	68.5	Low	56.7	Low	76 Å²	76	86.7 Å²	86.7	47%	0.466	53%	0.526	S	S	.	.			trans	-63.5	153.2	170.6	56.6	0	0	0	0	109.1	Q221 E225 S226 M227	Q221-T223 PolarHBondContact O-N 3.21Å; Q221-T223 VanDerWaalsContact O-N 3.08Å; T223-E225 PolarHBondContact O-N 3.3Å; T223-E225 VanDerWaalsContact O-N 3.15Å; T223-S226 PolarHBondContact N-OG 2.95Å; T223-S226 VanDerWaalsContact N-OG 3.12Å; T223-S226 PolarHBondContact O-N 3.2Å; T223-S226 PolarHBondContact O-OG 2.89Å; T223-S226 PolarHBondContact OG1-N 3Å; T223-M227 PolarHBondContact O-N 3.02Å
224	A	66.2	Low	57.6	Low	3 Å²	3	85.2 Å²	85.2	3%	0.025	50%	0.497	C	S	.	.	H	α-helix	trans	-52.5	-38.5	175	0	0	0	0	0	111.3	F187 D188 L191 S226 M227 I228	F187-A224 HydrophobicContact CB-CB 3.79Å; D188-A224 WeakPolarHBondContact OD1-CB 3.49Å; D188-A224 PolarHBondContact OD1-N 2.88Å; L191-A224 HydrophobicContact CD1-CB 4.07Å; A224-S226 PolarHBondContact O-N 3.48Å; A224-M227 PolarHBondContact O-N 3.12Å; A224-I228 HydrophobicContact CB-CD1 4.4Å; A224-I228 VanDerWaalsContact O-CB 3.28Å; A224-I228 WeakPolarHBondContact O-CB 3.41Å; A224-I228 WeakPolarHBondContact O-CD1 3.49Å; A224-I228 WeakPolarHBondContact O-CG1 3.39Å; A224-I228 PolarHBondContact O-N 3.33Å
225	E	67.8	Low	57.9	Low	140 Å²	140	88 Å²	88	65%	0.654	50%	0.504	S	S	*	.	H	α-helix	trans	-57.6	-44.5	173.6	-67.5	-172	163.3	0	0	112.8	T223 M227 I228 M229	T223-E225 PolarHBondContact O-N 3.3Å; T223-E225 VanDerWaalsContact O-N 3.15Å; E225-M227 PolarHBondContact O-N 3.21Å; E225-I228 PolarHBondContact O-N 3.45Å; E225-M229 WeakPolarHBondContact O-CB 3.43Å; E225-M229 WeakPolarHBondContact O-CG 3.41Å; E225-M229 PolarHBondContact O-N 2.94Å
226	S	68.5	Low	58.1	Low	51 Å²	51	93.2 Å²	93.2	36%	0.357	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-38	179.6	72.5	0	0	0	0	112.8	P222 T223 A224 A230	P222-S226 VanDerWaalsContact CA-OG 3.32Å; P222-S226 WeakPolarHBondContact CA-OG 3.33Å; T223-S226 PolarHBondContact N-OG 2.95Å; T223-S226 VanDerWaalsContact N-OG 3.12Å; T223-S226 PolarHBondContact O-N 3.2Å; T223-S226 PolarHBondContact O-OG 2.89Å; T223-S226 PolarHBondContact OG1-N 3Å; A224-S226 PolarHBondContact O-N 3.48Å; S226-A230 VanDerWaalsContact O-CB 3.27Å; S226-A230 WeakPolarHBondContact O-CB 3.44Å; S226-A230 PolarHBondContact O-N 3.23Å
227	M	63.7	Low	57.9	Low	30 Å²	30	96.6 Å²	96.6	15%	0.148	54%	0.535	C	S	.	.	H	α-helix	trans	-75.6	-39	178.7	-62.4	-166	74.5	0	0	111.7	L191 C200 L204 P222 T223 A224 E225 A230 L231	L191-M227 HydrophobicContact CD1-SD 4.31Å; L191-M227 HydrophobicContact CD2-SD 3.45Å; L191-M227 WeakPolarHBondContact CD2-SD 3.41Å; C200-M227 HydrophobicContact CB-CE 3.6Å; L204-M227 HydrophobicContact CD1-CE 3.82Å; P222-M227 HydrophobicContact CB-CG 3.79Å; P222-M227 HydrophobicContact CB-SD 4.13Å; P222-M227 HydrophobicContact CG-CG 4.42Å; P222-M227 HydrophobicContact CG-SD 4.1Å; T223-M227 PolarHBondContact O-N 3.02Å; A224-M227 PolarHBondContact O-N 3.12Å; E225-M227 PolarHBondContact O-N 3.21Å; M227-A230 PolarHBondContact O-N 3.32Å; M227-L231 WeakPolarHBondContact O-CB 3.34Å; M227-L231 VanDerWaalsContact O-CG 3.3Å; M227-L231 WeakPolarHBondContact O-CG 3.42Å; M227-L231 PolarHBondContact O-N 3.34Å
228	I	67.8	Low	58.7	Low	65 Å²	65	95.1 Å²	95.1	33%	0.333	52%	0.523	S	S	.	.	H	α-helix	trans	-62.2	-51.3	172.8	-69.3	166	0	0	0	108.3	A224 E225 A230 L231 L232	A224-I228 HydrophobicContact CB-CD1 4.4Å; A224-I228 VanDerWaalsContact O-CB 3.28Å; A224-I228 WeakPolarHBondContact O-CB 3.41Å; A224-I228 WeakPolarHBondContact O-CD1 3.49Å; A224-I228 WeakPolarHBondContact O-CG1 3.39Å; A224-I228 PolarHBondContact O-N 3.33Å; E225-I228 PolarHBondContact O-N 3.45Å; I228-A230 VanDerWaalsContact C-N 3.29Å; I228-A230 PolarHBondContact O-N 3.38Å; I228-L231 CarbonylContact O-C 3.41Å; I228-L231 WeakPolarHBondContact O-CA 3.25Å; I228-L231 WeakPolarHBondContact O-CB 3.17Å; I228-L231 PolarHBondContact O-N 2.71Å; I228-L232 HydrophobicContact CG2-CD1 3.46Å; I228-L232 VanDerWaalsContact CG2-CD1 3.46Å; I228-L232 HydrophobicContact CG2-CG 4.05Å; I228-L232 WeakPolarHBondContact O-CB 3.26Å; I228-L232 WeakPolarHBondContact O-CG 3.48Å; I228-L232 PolarHBondContact O-N 3.04Å
229	M	71	Confident	59.4	Low	107 Å²	107	94.1 Å²	94.1	53%	0.527	52%	0.519	S	S	.	.	H	α-helix	trans	-57.6	-38.7	174.8	-74.9	-68.3	-147.4	0	0	112.7	E225 L231 L232 N233	E225-M229 WeakPolarHBondContact O-CB 3.43Å; E225-M229 WeakPolarHBondContact O-CG 3.41Å; E225-M229 PolarHBondContact O-N 2.94Å; M229-L231 VanDerWaalsContact C-N 3.34Å; M229-L232 PolarHBondContact O-N 3.15Å; M229-N233 WeakPolarHBondContact O-CB 3.46Å; M229-N233 PolarHBondContact O-N 2.9Å; M229-N233 PolarHBondContact O-ND2 3.34Å; M229-N233 VanDerWaalsContact O-ND2 3.15Å
230	A	66.1	Low	60.2	Low	53 Å²	53	95.5 Å²	95.5	44%	0.438	51%	0.509	S	S	.	.	H	α-helix	trans	-66.4	-35.4	175.1	0	0	0	0	0	112.6	S226 M227 I228	S226-A230 VanDerWaalsContact O-CB 3.27Å; S226-A230 WeakPolarHBondContact O-CB 3.44Å; S226-A230 PolarHBondContact O-N 3.23Å; M227-A230 PolarHBondContact O-N 3.32Å; I228-A230 VanDerWaalsContact C-N 3.29Å; I228-A230 PolarHBondContact O-N 3.38Å
231	L	63	Low	60.5	Low	86 Å²	86	91.1 Å²	91.1	45%	0.45	49%	0.492	S	S	.	.	H	α-helix	trans	-71.8	-31.6	173.9	-73.3	168.2	0	0	0	112.5	L204 L207 M227 I228 M229	L204-L231 HydrophobicContact CD2-CD2 3.43Å; L204-L231 VanDerWaalsContact CD2-CD2 3.43Å; L204-L231 HydrophobicContact CD2-CG 3.94Å; L204-L231 HydrophobicContact CG-CD2 4.33Å; L207-L231 HydrophobicContact CD1-CD2 3.75Å; M227-L231 WeakPolarHBondContact O-CB 3.34Å; M227-L231 VanDerWaalsContact O-CG 3.3Å; M227-L231 WeakPolarHBondContact O-CG 3.42Å; M227-L231 PolarHBondContact O-N 3.34Å; I228-L231 CarbonylContact O-C 3.41Å; I228-L231 WeakPolarHBondContact O-CA 3.25Å; I228-L231 WeakPolarHBondContact O-CB 3.17Å; I228-L231 PolarHBondContact O-N 2.71Å; M229-L231 VanDerWaalsContact C-N 3.34Å
232	L	64.2	Low	61.1	Low	49 Å²	49	87.3 Å²	87.3	26%	0.257	48%	0.478	S	S	.	.	H	α-helix	trans	-88.8	-34.5	-176.4	-62.9	179.2	0	0	0	113.3	H144 I228 M229 N234	H144-L232 HydrophobicContact CB-CD2 3.35Å; H144-L232 HydrophobicContact CB-CG 4.5Å; H144-L232 VanDerWaalsContact CD2-CD1 3.46Å; H144-L232 WeakPolarHBondContact CD2-CD1 3.48Å; H144-L232 WeakPolarHBondContact CD2-CD2 3.4Å; H144-L232 WeakPolarHBondContact NE2-CD1 3.37Å; I228-L232 HydrophobicContact CG2-CD1 3.46Å; I228-L232 VanDerWaalsContact CG2-CD1 3.46Å; I228-L232 HydrophobicContact CG2-CG 4.05Å; I228-L232 WeakPolarHBondContact O-CB 3.26Å; I228-L232 WeakPolarHBondContact O-CG 3.48Å; I228-L232 PolarHBondContact O-N 3.04Å; M229-L232 PolarHBondContact O-N 3.15Å; L232-N234 VanDerWaalsContact C-N 3.29Å; L232-N234 PolarHBondContact O-N 3Å
233	N	67.8	Low	61.4	Low	111 Å²	111	91.3 Å²	91.3	59%	0.594	50%	0.498	S	S	*	.	S	Bend	trans	-86.9	6.6	-176.9	-65.7	-30.6	0	0	0	113.3	M229 D235	M229-N233 WeakPolarHBondContact O-CB 3.46Å; M229-N233 PolarHBondContact O-N 2.9Å; M229-N233 PolarHBondContact O-ND2 3.34Å; M229-N233 VanDerWaalsContact O-ND2 3.15Å; N233-D235 PolarHBondContact O-N 3.32Å
234	N	57.8	Low	60.9	Low	62 Å²	62	92.4 Å²	92.4	33%	0.332	50%	0.5	S	S	.	.			trans	-77.7	28.6	178.1	-145.2	17.3	0	0	0	113.2	L232 Y236	L232-N234 VanDerWaalsContact C-N 3.29Å; L232-N234 PolarHBondContact O-N 3Å; N234-Y236 VanDerWaalsContact C-N 3.28Å; N234-Y236 PolarHBondContact O-N 3.14Å; N234-Y236 VanDerWaalsContact O-N 3.16Å; N234-Y236 VanDerWaalsContact OD1-CD2 3.28Å; N234-Y236 WeakPolarHBondContact OD1-CD2 3.45Å; N234-Y236 VanDerWaalsContact OD1-CE2 3.27Å; N234-Y236 WeakPolarHBondContact OD1-CE2 3.46Å
235	D	47.8	Very low	60.4	Low	149 Å²	149	99.2 Å²	99.2	80%	0.797	54%	0.537	S	S	*	.			trans	-77.3	84.5	158.8	-78.9	-29	0	0	0	107.7	N233 S237	N233-D235 PolarHBondContact O-N 3.32Å; D235-S237 PolarHBondContact O-N 3.43Å
236	Y	41.5	Very low	59.8	Low	200 Å²	200	95.8 Å²	95.8	78%	0.784	53%	0.527	S	S	*	.			trans	-67.3	125.7	162.7	-93.3	-95.7	0	0	0	108.8	N234	N234-Y236 VanDerWaalsContact C-N 3.28Å; N234-Y236 PolarHBondContact O-N 3.14Å; N234-Y236 VanDerWaalsContact O-N 3.16Å; N234-Y236 VanDerWaalsContact OD1-CD2 3.28Å; N234-Y236 WeakPolarHBondContact OD1-CD2 3.45Å; N234-Y236 VanDerWaalsContact OD1-CE2 3.27Å; N234-Y236 WeakPolarHBondContact OD1-CE2 3.46Å
237	S	38.9	Very low	59	Low	187 Å²	187	99.9 Å²	99.9	100%	1.308	54%	0.542	S	S	*	.			trans	16.5	0	152.6	-164.9	0	0	0	0	120	D235	D235-S237 PolarHBondContact O-N 3.43Å

Retrieved 237 of 237 residues in 47.8 ms (Link to these results)

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