A0A087XN31_POEFO Loading...

GDNF family receptor alpha 1

AlphaFold DB , UniProt , Accession A0A087XN31, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 517 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	51.2	Low	55.8	Low	207 Å²	207	117.8 Å²	117.8	100%	1.02	61%	0.608	S	S	*	*				0	-54.6	0	-73	-177.8	71.3	0	0	113.5	V3 A4	M1-V3 PolarHBondContact O-N 3.03Å; M1-A4 PolarHBondContact O-N 2.83Å; M1-A4 VanDerWaalsContact O-N 3.13Å
2	I	57.9	Low	55.9	Low	136 Å²	136	116.4 Å²	116.4	70%	0.697	60%	0.602	S	S	*	*	H	α-helix	trans	-55.8	-43.5	-173	-60.7	170.4	0	0	0	113.5	A4 L5 L6	I2-A4 VanDerWaalsContact C-N 3.3Å; I2-A4 PolarHBondContact O-N 3.05Å; I2-L5 PolarHBondContact O-N 3.39Å; I2-L6 PolarHBondContact O-N 3.44Å
3	V	56.3	Low	55.6	Low	102 Å²	102	116 Å²	116	62%	0.618	60%	0.601	S	S	*	*	H	α-helix	trans	-61.7	-34.6	-179.5	-177.8	0	0	0	0	112.7	M1 L6 Y7	M1-V3 PolarHBondContact O-N 3.03Å; V3-L6 PolarHBondContact O-N 3.33Å; V3-Y7 HydrophobicContact CG1-CD2 4.27Å; V3-Y7 HydrophobicContact CG1-CE2 3.97Å; V3-Y7 WeakPolarHBondContact O-CD2 2.97Å
4	A	55.4	Low	55.5	Low	52 Å²	52	114.8 Å²	114.8	43%	0.43	60%	0.601	S	S	.	*	H	α-helix	trans	-65.1	-43.6	178.2	0	0	0	0	0	111.4	M1 I2 L6 Y7 F8	M1-A4 PolarHBondContact O-N 2.83Å; M1-A4 VanDerWaalsContact O-N 3.13Å; I2-A4 VanDerWaalsContact C-N 3.3Å; I2-A4 PolarHBondContact O-N 3.05Å; A4-L6 VanDerWaalsContact C-N 3.26Å; A4-L6 PolarHBondContact O-N 3.11Å; A4-Y7 PolarHBondContact O-N 3.13Å; A4-Y7 VanDerWaalsContact O-N 3.13Å; A4-F8 HydrophobicContact CB-CD2 4.48Å; A4-F8 WeakPolarHBondContact O-CD2 3.41Å; A4-F8 PolarHBondContact O-N 3.18Å
5	L	54.2	Low	55.1	Low	105 Å²	105	114.3 Å²	114.3	55%	0.55	60%	0.598	S	S	.	*	H	α-helix	trans	-58.8	-36.3	178.7	-77.5	158	0	0	0	112.6	I2 Y7 F8 L9	I2-L5 PolarHBondContact O-N 3.39Å; L5-Y7 VanDerWaalsContact C-N 3.3Å; L5-Y7 PolarHBondContact O-N 3.22Å; L5-F8 PolarHBondContact O-N 3.15Å; L5-L9 VanDerWaalsContact O-CG 3.3Å; L5-L9 WeakPolarHBondContact O-CG 3.48Å; L5-L9 PolarHBondContact O-N 3.35Å; L5-L9 VanDerWaalsContact O-N 3.08Å
6	L	57.1	Low	54.8	Low	118 Å²	118	111.4 Å²	111.4	62%	0.618	59%	0.591	S	S	*	*	H	α-helix	trans	-67.8	-25.1	179.2	-65.9	174	0	0	0	113.9	I2 V3 A4 P10	I2-L6 PolarHBondContact O-N 3.44Å; V3-L6 PolarHBondContact O-N 3.33Å; A4-L6 VanDerWaalsContact C-N 3.26Å; A4-L6 PolarHBondContact O-N 3.11Å; L6-P10 WeakPolarHBondContact O-CD 3.48Å; L6-P10 WeakPolarHBondContact O-CG 3.41Å
7	Y	57.1	Low	54.3	Low	178 Å²	178	109.2 Å²	109.2	70%	0.698	59%	0.585	S	S	*	*	H	α-helix	trans	-93.2	-30.6	173.2	-71.5	-76.6	0	0	0	112.9	V3 A4 L5 P10	V3-Y7 HydrophobicContact CG1-CD2 4.27Å; V3-Y7 HydrophobicContact CG1-CE2 3.97Å; V3-Y7 WeakPolarHBondContact O-CD2 2.97Å; A4-Y7 PolarHBondContact O-N 3.13Å; A4-Y7 VanDerWaalsContact O-N 3.13Å; L5-Y7 VanDerWaalsContact C-N 3.3Å; L5-Y7 PolarHBondContact O-N 3.22Å; Y7-P10 WeakPolarHBondContact O-CD 3.37Å
8	F	56.3	Low	53.7	Low	128 Å²	128	105.5 Å²	105.5	56%	0.561	57%	0.573	S	S	*	*	H	α-helix	trans	-71.8	-36.2	178.6	-93.2	-82.9	0	0	0	113.3	A4 L5 L11 L12	A4-F8 HydrophobicContact CB-CD2 4.48Å; A4-F8 WeakPolarHBondContact O-CD2 3.41Å; A4-F8 PolarHBondContact O-N 3.18Å; L5-F8 PolarHBondContact O-N 3.15Å; F8-L11 PolarHBondContact O-N 3.06Å; F8-L12 WeakPolarHBondContact O-CB 3.36Å; F8-L12 WeakPolarHBondContact O-CD1 3.39Å; F8-L12 WeakPolarHBondContact O-CG 2.97Å; F8-L12 PolarHBondContact O-N 3.4Å
9	L	57.5	Low	52.9	Low	101 Å²	101	104.6 Å²	104.6	53%	0.529	56%	0.564	S	S	.	*	H	α-helix	trans	-59.6	-53.9	179	-73.8	166.7	0	0	0	114	L5 L11 L12 D13	L5-L9 VanDerWaalsContact O-CG 3.3Å; L5-L9 WeakPolarHBondContact O-CG 3.48Å; L5-L9 PolarHBondContact O-N 3.35Å; L5-L9 VanDerWaalsContact O-N 3.08Å; L9-L11 VanDerWaalsContact C-N 3.26Å; L9-L11 PolarHBondContact O-N 3.03Å; L9-L12 WeakPolarHBondContact O-CB 3.29Å; L9-L12 PolarHBondContact O-N 3.11Å; L9-L12 VanDerWaalsContact O-N 3.17Å; L9-D13 PolarHBondContact O-N 3.18Å
10	P	56.5	Low	52.2	Low	69 Å²	69	107 Å²	107	45%	0.448	57%	0.571	S	S	.	*	H	α-helix	trans	-66.4	-28.1	177.1	26	-34.7	0	0	0	112.7	L6 Y7 V14	L6-P10 WeakPolarHBondContact O-CD 3.48Å; L6-P10 WeakPolarHBondContact O-CG 3.41Å; Y7-P10 WeakPolarHBondContact O-CD 3.37Å; P10-V14 WeakPolarHBondContact O-CG2 3.36Å; P10-V14 PolarHBondContact O-N 3.5Å; P10-V14 VanDerWaalsContact O-N 3.08Å
11	L	54.3	Low	51.7	Low	100 Å²	100	107.6 Å²	107.6	52%	0.524	58%	0.575	S	S	.	*	H	α-helix	trans	-68.1	-38.9	174.1	-155.3	79.2	0	0	0	111.4	F8 L9 V14 L15	F8-L11 PolarHBondContact O-N 3.06Å; L9-L11 VanDerWaalsContact C-N 3.26Å; L9-L11 PolarHBondContact O-N 3.03Å; L11-V14 PolarHBondContact O-N 3.45Å; L11-L15 HydrophobicContact CG-CD1 4.36Å; L11-L15 WeakPolarHBondContact O-CB 3.48Å; L11-L15 PolarHBondContact O-N 3.44Å
12	L	57	Low	51	Low	101 Å²	101	104.3 Å²	104.3	53%	0.529	56%	0.561	S	S	.	*	H	α-helix	trans	-67.2	-38.7	174.4	-79.3	161.2	0	0	0	112.3	F8 L9 L15 S16	F8-L12 WeakPolarHBondContact O-CB 3.36Å; F8-L12 WeakPolarHBondContact O-CD1 3.39Å; F8-L12 WeakPolarHBondContact O-CG 2.97Å; F8-L12 PolarHBondContact O-N 3.4Å; L9-L12 WeakPolarHBondContact O-CB 3.29Å; L9-L12 PolarHBondContact O-N 3.11Å; L9-L12 VanDerWaalsContact O-N 3.17Å; L12-L15 PolarHBondContact O-N 3.42Å; L12-S16 VanDerWaalsContact O-CB 3.23Å; L12-S16 WeakPolarHBondContact O-CB 3.3Å; L12-S16 PolarHBondContact O-N 3.09Å
13	D	51.4	Low	49.9	Very low	111 Å²	111	106.7 Å²	106.7	59%	0.594	56%	0.561	S	S	*	*	H	α-helix	trans	-63.8	-42.3	172.9	-87	-36.2	0	0	0	111.8	L9 S16 C17	L9-D13 PolarHBondContact O-N 3.18Å; D13-S16 PolarHBondContact O-N 3.46Å; D13-C17 WeakPolarHBondContact O-CB 3.5Å; D13-C17 PolarHBondContact O-N 2.99Å; D13-C17 PolarHBondContact O-SG 3.01Å
14	V	54.1	Low	48.9	Very low	99 Å²	99	104.2 Å²	104.2	60%	0.6	55%	0.551	S	S	*	*	H	α-helix	trans	-66.2	-41.1	175.9	170.8	0	0	0	0	111.4	P10 L11 A18	P10-V14 WeakPolarHBondContact O-CG2 3.36Å; P10-V14 PolarHBondContact O-N 3.5Å; P10-V14 VanDerWaalsContact O-N 3.08Å; L11-V14 PolarHBondContact O-N 3.45Å; V14-A18 WeakPolarHBondContact O-CB 3.36Å; V14-A18 PolarHBondContact O-N 3.35Å
15	L	50.2	Low	48	Very low	107 Å²	107	104.3 Å²	104.3	56%	0.56	56%	0.557	S	S	*	*	H	α-helix	trans	-66	-39.2	174.4	-90.1	153.8	0	0	0	112.4	L11 L12 A18 E19	L11-L15 HydrophobicContact CG-CD1 4.36Å; L11-L15 WeakPolarHBondContact O-CB 3.48Å; L11-L15 PolarHBondContact O-N 3.44Å; L12-L15 PolarHBondContact O-N 3.42Å; L15-A18 PolarHBondContact O-N 2.02Å; L15-E19 VanDerWaalsContact O-CB 3.3Å; L15-E19 WeakPolarHBondContact O-CB 3.33Å; L15-E19 PolarHBondContact O-N 3.07Å
16	S	50.4	Low	47.4	Very low	68 Å²	68	104.6 Å²	104.6	48%	0.476	58%	0.575	S	S	.	*	H	α-helix	trans	-66.8	-42.5	176.4	-166.3	0	0	0	0	111.3	L12 D13 A18 E19 E20	L12-S16 VanDerWaalsContact O-CB 3.23Å; L12-S16 WeakPolarHBondContact O-CB 3.3Å; L12-S16 PolarHBondContact O-N 3.09Å; D13-S16 PolarHBondContact O-N 3.46Å; S16-A18 VanDerWaalsContact C-N 3.33Å; S16-A18 PolarHBondContact O-N 3.28Å; S16-E19 PolarHBondContact O-N 2.88Å; S16-E20 PolarHBondContact O-N 3.19Å
17	C	45.8	Very low	47.2	Very low	74 Å²	74	102.2 Å²	102.2	50%	0.5	57%	0.568	S	S	.	*	H	α-helix	trans	-60.6	-40.1	170.9	-68.5	0	0	0	0	112.4	D13 N21	D13-C17 WeakPolarHBondContact O-CB 3.5Å; D13-C17 PolarHBondContact O-N 2.99Å; D13-C17 PolarHBondContact O-SG 3.01Å; C17-N21 PolarHBondContact O-N 3.21Å; C17-N21 PolarHBondContact O-ND2 3.11Å
18	A	42.8	Very low	47.8	Very low	43 Å²	43	98.8 Å²	98.8	36%	0.355	55%	0.554	S	S	.	*	H	α-helix	trans	-68.4	-39.2	175.4	0	0	0	0	0	111.7	V14 L15 S16 N21 L22	V14-A18 WeakPolarHBondContact O-CB 3.36Å; V14-A18 PolarHBondContact O-N 3.35Å; L15-A18 PolarHBondContact O-N 2.02Å; S16-A18 VanDerWaalsContact C-N 3.33Å; S16-A18 PolarHBondContact O-N 3.28Å; A18-N21 PolarHBondContact O-N 3.07Å; A18-L22 WeakPolarHBondContact O-CD1 3.07Å; A18-L22 PolarHBondContact O-N 3.5Å
19	E	38.5	Very low	49.1	Very low	88 Å²	88	94.5 Å²	94.5	41%	0.411	54%	0.537	S	S	.	.	H	α-helix	trans	-74.1	-31.5	-178.3	-160.1	176.4	-156.4	0	0	112.7	L15 S16 L22 R23	L15-E19 VanDerWaalsContact O-CB 3.3Å; L15-E19 WeakPolarHBondContact O-CB 3.33Å; L15-E19 PolarHBondContact O-N 3.07Å; S16-E19 PolarHBondContact O-N 2.88Å; E19-L22 PolarHBondContact O-N 2.7Å; E19-R23 VanDerWaalsContact CD-NH2 3.28Å; E19-R23 HydrophobicContact CG-CG 4.35Å; E19-R23 VanDerWaalsContact O-CB 3.22Å; E19-R23 WeakPolarHBondContact O-CB 3.45Å; E19-R23 WeakPolarHBondContact O-CG 3.48Å; E19-R23 PolarHBondContact O-N 3.05Å; E19-R23 IonicContact OE1-CZ 2.87Å; E19-R23 IonicContact OE1-NE 2.92Å; E19-R23 IonicContact OE1-NH1 3.9Å; E19-R23 PolarHBondContact OE1-NH1 3.33Å; E19-R23 IonicContact OE1-NH2 3.52Å; E19-R23 PolarHBondContact OE1-NH2 3.5Å; E19-R23 IonicContact OE2-CZ 3.76Å; E19-R23 IonicContact OE2-NH1 2.64Å; E19-R23 PolarHBondContact OE2-NH1 3.02Å; E19-R23 IonicContact OE2-NH2 3.03Å
20	E	39.8	Very low	50.7	Low	152 Å²	152	90.8 Å²	90.8	71%	0.71	52%	0.517	S	S	*	.	H	α-helix	trans	-62.3	-42.8	165.2	-91	-156.3	133.5	0	0	111.5	S16 A24	S16-E20 PolarHBondContact O-N 3.19Å; E20-A24 WeakPolarHBondContact O-CB 3.24Å; E20-A24 PolarHBondContact O-N 3.28Å
21	N	40.9	Very low	52.4	Low	121 Å²	121	87.5 Å²	87.5	65%	0.647	50%	0.496	S	S	*	.	H	α-helix	trans	-68.5	-33.6	178.2	-79	-65.6	0	0	0	112.9	C17 A18	C17-N21 PolarHBondContact O-N 3.21Å; C17-N21 PolarHBondContact O-ND2 3.11Å; A18-N21 PolarHBondContact O-N 3.07Å
22	L	37.8	Very low	54.3	Low	138 Å²	138	83 Å²	83	72%	0.723	47%	0.473	S	S	*	.	H	α-helix	trans	-79.1	-35.6	174.6	-90.8	80.5	0	0	0	113.1	A18 E19 A24 G25	A18-L22 WeakPolarHBondContact O-CD1 3.07Å; A18-L22 PolarHBondContact O-N 3.5Å; E19-L22 PolarHBondContact O-N 2.7Å; L22-A24 VanDerWaalsContact C-N 3.32Å; L22-G25 PolarHBondContact O-N 3.17Å
23	R	34.8	Very low	56.1	Low	186 Å²	186	84.6 Å²	84.6	70%	0.702	47%	0.472	S	S	*	.	H	α-helix	trans	-73.1	-23.9	173.6	-73.8	-179.6	174.5	135.9	3.9	112.4	E19 G25	E19-R23 VanDerWaalsContact CD-NH2 3.28Å; E19-R23 HydrophobicContact CG-CG 4.35Å; E19-R23 VanDerWaalsContact O-CB 3.22Å; E19-R23 WeakPolarHBondContact O-CB 3.45Å; E19-R23 WeakPolarHBondContact O-CG 3.48Å; E19-R23 PolarHBondContact O-N 3.05Å; E19-R23 IonicContact OE1-CZ 2.87Å; E19-R23 IonicContact OE1-NE 2.92Å; E19-R23 IonicContact OE1-NH1 3.9Å; E19-R23 PolarHBondContact OE1-NH1 3.33Å; E19-R23 IonicContact OE1-NH2 3.52Å; E19-R23 PolarHBondContact OE1-NH2 3.5Å; E19-R23 IonicContact OE2-CZ 3.76Å; E19-R23 IonicContact OE2-NH1 2.64Å; E19-R23 PolarHBondContact OE2-NH1 3.02Å; E19-R23 IonicContact OE2-NH2 3.03Å; R23-G25 PolarHBondContact O-N 3.24Å
24	A	35.1	Very low	58.1	Low	49 Å²	49	79.4 Å²	79.4	41%	0.405	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	35.9	166.4	0	0	0	0	0	113.2	E20 L22 A26 S27	E20-A24 WeakPolarHBondContact O-CB 3.24Å; E20-A24 PolarHBondContact O-N 3.28Å; L22-A24 VanDerWaalsContact C-N 3.32Å; A24-A26 PolarHBondContact O-N 3.1Å; A24-S27 PolarHBondContact O-N 3.45Å
25	G	35.6	Very low	60	Low	55 Å²	55	75 Å²	75	57%	0.567	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.2	107.8	-171.3	0	0	0	0	0	113.8	L22 R23 S27	L22-G25 PolarHBondContact O-N 3.17Å; R23-G25 PolarHBondContact O-N 3.24Å; G25-S27 PolarHBondContact O-N 2.93Å
26	A	41.9	Very low	62	Low	111 Å²	111	73.9 Å²	73.9	92%	0.917	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	21.2	173.8	0	0	0	0	0	116.6	A24 R28	A24-A26 PolarHBondContact O-N 3.1Å; A26-R28 PolarHBondContact O-N 3.11Å; A26-R28 VanDerWaalsContact O-N 3.13Å
27	S	53.2	Low	64.1	Low	68 Å²	68	74 Å²	74	48%	0.476	40%	0.403	S	S	.	.			trans	-77	106.8	-178.3	71	0	0	0	0	110	A24 G25 L29	A24-S27 PolarHBondContact O-N 3.45Å; G25-S27 PolarHBondContact O-N 2.93Å; S27-L29 PolarHBondContact O-N 3.45Å; S27-L29 VanDerWaalsContact O-N 3.08Å
28	R	68.9	Low	66.3	Low	105 Å²	105	70.7 Å²	70.7	40%	0.396	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-49.8	117.4	178.2	-165.9	176.2	-167	164.4	5.6	109.7	A26 D30 N89	A26-R28 PolarHBondContact O-N 3.11Å; A26-R28 VanDerWaalsContact O-N 3.13Å; R28-D30 PolarHBondContact O-N 3.04Å; R28-N89 VanDerWaalsContact CZ-O 3.24Å; R28-N89 PolarHBondContact NE-O 2.91Å; R28-N89 PolarHBondContact NH2-O 2.92Å
29	L	83.6	Confident	68.7	Low	38 Å²	38	72.5 Å²	72.5	20%	0.199	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-67.1	133.2	179.6	-77.2	157.9	0	0	0	109.7	S27 R33 A34 P86	S27-L29 PolarHBondContact O-N 3.45Å; S27-L29 VanDerWaalsContact O-N 3.08Å; L29-R33 HydrophobicContact CD2-CB 3.91Å; L29-A34 HydrophobicContact CB-CB 4.03Å; L29-P86 HydrophobicContact CD1-CB 4.08Å
30	D	91.1	Very high	71.4	Confident	24 Å²	24	78.4 Å²	78.4	13%	0.128	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-67.8	153.2	171.5	72	73.5	0	0	0	110.6	R28 V32 R33 A34 R91 M96	R28-D30 PolarHBondContact O-N 3.04Å; D30-V32 PolarHBondContact O-N 3.04Å; D30-V32 WeakPolarHBondContact OD1-CA 3.36Å; D30-V32 VanDerWaalsContact OD1-CB 3.27Å; D30-V32 WeakPolarHBondContact OD1-CB 3.44Å; D30-V32 PolarHBondContact OD1-N 3.43Å; D30-R33 PolarHBondContact O-N 3.33Å; D30-R33 VanDerWaalsContact O-N 3.08Å; D30-R33 PolarHBondContact OD1-N 2.92Å; D30-R33 WeakPolarHBondContact OD2-CD 3.17Å; D30-R33 WeakPolarHBondContact OD2-CG 3.1Å; D30-A34 WeakPolarHBondContact O-CB 3.41Å; D30-A34 PolarHBondContact O-N 2.82Å; D30-R91 VanDerWaalsContact CA-O 3.27Å; D30-R91 WeakPolarHBondContact CA-O 3.45Å; D30-M96 HydrophobicContact CB-CE 4.25Å
31	C	93.4	Very high	73.9	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-60.1	-22.3	-174.5	-60.6	0	0	0	0	114.4	S35 C90 R91 I105	C31-S35 WeakPolarHBondContact O-CB 3.19Å; C31-S35 PolarHBondContact O-N 3.26Å; C31-S35 VanDerWaalsContact O-N 3.16Å; C31-C90 WeakPolarHBondContact CA-SG 3.36Å; C31-C90 HydrophobicContact CB-CB 3.82Å; C31-C90 WeakPolarHBondContact CB-SG 3.37Å; C31-C90 WeakPolarHBondContact SG-CB 3.25Å; C31-C90 CovalentContact SG-SG 2.03Å; C31-C90 PolarHBondContact SG-SG 3.25Å; C31-R91 PolarHBondContact N-O 3.29Å; C31-I105 HydrophobicContact CB-CB 4.15Å; C31-I105 HydrophobicContact CB-CG2 3.82Å
32	V	94.8	Very high	76.4	Confident	5 Å²	5	76.3 Å²	76.3	3%	0.03	39%	0.389	C	S	.	.	H	α-helix	trans	-74	-51.6	174.4	-174.2	0	0	0	0	109.8	D30 A34 S35 E36 M96 K98 C102 I105	D30-V32 PolarHBondContact O-N 3.04Å; D30-V32 WeakPolarHBondContact OD1-CA 3.36Å; D30-V32 VanDerWaalsContact OD1-CB 3.27Å; D30-V32 WeakPolarHBondContact OD1-CB 3.44Å; D30-V32 PolarHBondContact OD1-N 3.43Å; V32-A34 PolarHBondContact O-N 3.49Å; V32-S35 PolarHBondContact O-N 3.37Å; V32-E36 HydrophobicContact CG1-CG 4.44Å; V32-E36 VanDerWaalsContact CG1-OE1 3.3Å; V32-E36 WeakPolarHBondContact CG1-OE1 3.45Å; V32-E36 WeakPolarHBondContact O-CB 3.23Å; V32-E36 WeakPolarHBondContact O-CG 3.47Å; V32-E36 PolarHBondContact O-N 2.87Å; V32-M96 HydrophobicContact CG2-CE 4.48Å; V32-K98 HydrophobicContact CG1-CD 3.69Å; V32-K98 HydrophobicContact CG2-CB 4.08Å; V32-K98 HydrophobicContact CG2-CD 4.38Å; V32-C102 HydrophobicContact CG2-CB 3.81Å; V32-I105 HydrophobicContact CG2-CD1 4.36Å
33	R	93.8	Very high	78.9	Confident	134 Å²	134	73.6 Å²	73.6	51%	0.506	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-43.4	178.3	-69.4	-179	67.5	-157.3	-1.2	112.2	L29 D30 S35 E36 Q37	L29-R33 HydrophobicContact CD2-CB 3.91Å; D30-R33 PolarHBondContact O-N 3.33Å; D30-R33 VanDerWaalsContact O-N 3.08Å; D30-R33 PolarHBondContact OD1-N 2.92Å; D30-R33 WeakPolarHBondContact OD2-CD 3.17Å; D30-R33 WeakPolarHBondContact OD2-CG 3.1Å; R33-S35 VanDerWaalsContact C-N 3.3Å; R33-S35 PolarHBondContact O-N 3.35Å; R33-E36 PolarHBondContact O-N 3.21Å; R33-Q37 PolarHBondContact O-N 3.47Å
34	A	93.3	Very high	81.7	Confident	3 Å²	3	65.5 Å²	65.5	3%	0.025	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-36.9	177.2	0	0	0	0	0	112	L29 D30 V32 C38 L87 C90	L29-A34 HydrophobicContact CB-CB 4.03Å; D30-A34 WeakPolarHBondContact O-CB 3.41Å; D30-A34 PolarHBondContact O-N 2.82Å; V32-A34 PolarHBondContact O-N 3.49Å; A34-C38 WeakPolarHBondContact O-CB 3.48Å; A34-C38 PolarHBondContact O-N 3.44Å; A34-L87 HydrophobicContact CB-CB 4.29Å; A34-L87 HydrophobicContact CB-CD1 3.98Å; A34-C90 HydrophobicContact CB-CB 4.15Å
35	S	93.9	Very high	84.5	Confident	7 Å²	7	63.2 Å²	63.2	5%	0.049	34%	0.339	C	S	.	.	H	α-helix	trans	-72.4	-37.8	174.7	-173.4	0	0	0	0	111.9	C31 V32 R33 Q37 L39 Y48	C31-S35 WeakPolarHBondContact O-CB 3.19Å; C31-S35 PolarHBondContact O-N 3.26Å; C31-S35 VanDerWaalsContact O-N 3.16Å; V32-S35 PolarHBondContact O-N 3.37Å; R33-S35 VanDerWaalsContact C-N 3.3Å; R33-S35 PolarHBondContact O-N 3.35Å; S35-Q37 VanDerWaalsContact C-N 3.31Å; S35-L39 WeakPolarHBondContact O-CB 3.26Å; S35-L39 WeakPolarHBondContact O-CD1 3.42Å; S35-L39 WeakPolarHBondContact O-CG 3.45Å; S35-L39 PolarHBondContact O-N 3.47Å; S35-Y48 WeakPolarHBondContact OG-CE1 3.49Å; S35-Y48 PolarHBondContact OG-OH 2.97Å
36	E	93.6	Very high	87.2	Confident	82 Å²	82	63.5 Å²	63.5	38%	0.383	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-34.7	175.1	-74.3	170.7	-173.3	0	0	111.2	V32 R33 R40 K98	V32-E36 HydrophobicContact CG1-CG 4.44Å; V32-E36 VanDerWaalsContact CG1-OE1 3.3Å; V32-E36 WeakPolarHBondContact CG1-OE1 3.45Å; V32-E36 WeakPolarHBondContact O-CB 3.23Å; V32-E36 WeakPolarHBondContact O-CG 3.47Å; V32-E36 PolarHBondContact O-N 2.87Å; R33-E36 PolarHBondContact O-N 3.21Å; E36-R40 WeakPolarHBondContact O-CG 3.48Å; E36-K98 IonicContact OE1-NZ 3.71Å; E36-K98 PolarHBondContact OE1-NZ 3.22Å
37	Q	92.8	Very high	89.5	Confident	71 Å²	71	61.4 Å²	61.4	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-70.1	-53	172.5	-178.8	174.2	-9.3	0	0	112.2	R33 S35 L39 R40 E41	R33-Q37 PolarHBondContact O-N 3.47Å; S35-Q37 VanDerWaalsContact C-N 3.31Å; Q37-L39 PolarHBondContact O-N 3.14Å; Q37-L39 VanDerWaalsContact O-N 3.14Å; Q37-R40 WeakPolarHBondContact O-CB 3.41Å; Q37-R40 PolarHBondContact O-N 3.05Å; Q37-E41 PolarHBondContact O-N 3.06Å
38	C	92.7	Very high	91.3	Very high	4 Å²	4	58.4 Å²	58.4	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-56.6	-31.6	178.3	179.1	0	0	0	0	112.9	A34 R40 E41 C44 S45 L87	A34-C38 WeakPolarHBondContact O-CB 3.48Å; A34-C38 PolarHBondContact O-N 3.44Å; C38-R40 VanDerWaalsContact C-N 3.32Å; C38-R40 PolarHBondContact O-N 3.34Å; C38-E41 PolarHBondContact O-N 3.03Å; C38-E41 VanDerWaalsContact O-O 3.09Å; C38-C44 HydrophobicContact CB-CB 4.02Å; C38-C44 WeakPolarHBondContact CB-SG 3.01Å; C38-C44 WeakPolarHBondContact SG-CB 3.34Å; C38-C44 CovalentContact SG-SG 2.04Å; C38-C44 PolarHBondContact SG-SG 2.92Å; C38-S45 WeakPolarHBondContact O-CA 3.31Å; C38-S45 WeakPolarHBondContact O-CB 3.3Å; C38-S45 PolarHBondContact O-N 3.04Å; C38-L87 HydrophobicContact CB-CD2 3.84Å
39	L	93.6	Very high	92.4	Very high	81 Å²	81	59.9 Å²	59.9	42%	0.424	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.1	176.6	-74.1	169.4	0	0	0	114.4	S35 Q37 Y48	S35-L39 WeakPolarHBondContact O-CB 3.26Å; S35-L39 WeakPolarHBondContact O-CD1 3.42Å; S35-L39 WeakPolarHBondContact O-CG 3.45Å; S35-L39 PolarHBondContact O-N 3.47Å; Q37-L39 PolarHBondContact O-N 3.14Å; Q37-L39 VanDerWaalsContact O-N 3.14Å; L39-Y48 HydrophobicContact CD2-CD1 4.17Å
40	R	93.9	Very high	92.6	Very high	212 Å²	212	59.3 Å²	59.3	80%	0.8	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-30.7	172.7	-64.5	171.2	-170.2	-175.1	0.5	112.2	E36 Q37 C38	E36-R40 WeakPolarHBondContact O-CG 3.48Å; Q37-R40 WeakPolarHBondContact O-CB 3.41Å; Q37-R40 PolarHBondContact O-N 3.05Å; C38-R40 VanDerWaalsContact C-N 3.32Å; C38-R40 PolarHBondContact O-N 3.34Å
41	E	93.4	Very high	92.4	Very high	93 Å²	93	58.2 Å²	58.2	44%	0.435	28%	0.276	S	S	.	.	S	Bend	trans	-86.3	113.8	179.3	-68.7	168	-150.4	0	0	110.1	Q37 C38 A43 C44 S45	Q37-E41 PolarHBondContact O-N 3.06Å; C38-E41 PolarHBondContact O-N 3.03Å; C38-E41 VanDerWaalsContact O-O 3.09Å; E41-A43 VanDerWaalsContact C-N 3.25Å; E41-A43 PolarHBondContact O-N 2.83Å; E41-A43 VanDerWaalsContact O-N 3.16Å; E41-C44 HydrophobicContact CB-CB 4.05Å; E41-C44 PolarHBondContact O-N 3.47Å; E41-C44 VanDerWaalsContact O-N 3.15Å; E41-S45 WeakPolarHBondContact O-CB 3.35Å; E41-S45 PolarHBondContact O-N 3.31Å
42	Q	93.4	Very high	92	Very high	137 Å²	137	63.1 Å²	63.1	64%	0.64	29%	0.294	S	S	*	.	H	α-helix	trans	-57.3	-36.6	-174.1	-175.8	61.4	13.4	0	0	113.3	T46	Q42-T46 WeakPolarHBondContact O-CB 3.46Å; Q42-T46 PolarHBondContact O-N 3.15Å; Q42-T46 PolarHBondContact O-OG1 3.43Å
43	A	90.8	Very high	91.5	Very high	81 Å²	81	69.4 Å²	69.4	67%	0.669	32%	0.323	S	S	*	.	H	α-helix	trans	-64.6	-51.4	176.2	0	0	0	0	0	112.3	E41 T46 K47	E41-A43 VanDerWaalsContact C-N 3.25Å; E41-A43 PolarHBondContact O-N 2.83Å; E41-A43 VanDerWaalsContact O-N 3.16Å; A43-T46 PolarHBondContact O-N 3.16Å; A43-K47 PolarHBondContact O-N 3.22Å
44	C	92.3	Very high	90.8	Very high	16 Å²	16	63.7 Å²	63.7	11%	0.108	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-46.6	178.8	-166.7	0	0	0	0	111.2	C38 E41 T46 K47 Y48	C38-C44 HydrophobicContact CB-CB 4.02Å; C38-C44 WeakPolarHBondContact CB-SG 3.01Å; C38-C44 WeakPolarHBondContact SG-CB 3.34Å; C38-C44 CovalentContact SG-SG 2.04Å; C38-C44 PolarHBondContact SG-SG 2.92Å; E41-C44 HydrophobicContact CB-CB 4.05Å; E41-C44 PolarHBondContact O-N 3.47Å; E41-C44 VanDerWaalsContact O-N 3.15Å; C44-T46 VanDerWaalsContact C-N 3.32Å; C44-T46 PolarHBondContact O-N 2.71Å; C44-K47 PolarHBondContact O-N 2.04Å; C44-Y48 VanDerWaalsContact O-CB 3.23Å; C44-Y48 WeakPolarHBondContact O-CB 3.36Å; C44-Y48 PolarHBondContact O-N 2.83Å
45	S	94	Very high	89.9	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-54.7	-44.1	177.7	-173.3	0	0	0	0	112.6	C38 E41 Y48 R49	C38-S45 WeakPolarHBondContact O-CA 3.31Å; C38-S45 WeakPolarHBondContact O-CB 3.3Å; C38-S45 PolarHBondContact O-N 3.04Å; E41-S45 WeakPolarHBondContact O-CB 3.35Å; E41-S45 PolarHBondContact O-N 3.31Å; S45-Y48 PolarHBondContact O-N 2.82Å; S45-R49 VanDerWaalsContact O-CG 3.29Å; S45-R49 WeakPolarHBondContact O-CG 3.37Å; S45-R49 PolarHBondContact O-N 2.88Å; S45-R49 VanDerWaalsContact O-N 3.07Å; S45-R49 PolarHBondContact OG-NH2 3.41Å
46	T	93	Very high	88.7	Confident	61 Å²	61	67.9 Å²	67.9	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-64.4	-54.7	178.5	-56.8	0	0	0	0	110.8	Q42 A43 C44 Y48 R49 T50	Q42-T46 WeakPolarHBondContact O-CB 3.46Å; Q42-T46 PolarHBondContact O-N 3.15Å; Q42-T46 PolarHBondContact O-OG1 3.43Å; A43-T46 PolarHBondContact O-N 3.16Å; C44-T46 VanDerWaalsContact C-N 3.32Å; C44-T46 PolarHBondContact O-N 2.71Å; T46-Y48 VanDerWaalsContact C-N 3.27Å; T46-Y48 PolarHBondContact O-N 3.49Å; T46-R49 PolarHBondContact O-N 3.16Å; T46-R49 VanDerWaalsContact O-N 3.11Å; T46-T50 PolarHBondContact O-N 3.24Å; T46-T50 PolarHBondContact O-OG1 2.95Å
47	K	91.1	Very high	86.9	Confident	68 Å²	68	66.2 Å²	66.2	30%	0.296	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-34.4	179	-63.4	-55.2	-157.8	171.2	0	112.4	A43 C44 T50 M51 S77 A78 A81	A43-K47 PolarHBondContact O-N 3.22Å; C44-K47 PolarHBondContact O-N 2.04Å; K47-T50 PolarHBondContact O-N 3.3Å; K47-M51 WeakPolarHBondContact O-CB 3.39Å; K47-M51 PolarHBondContact O-N 3.24Å; K47-S77 PolarHBondContact NZ-OG 2.9Å; K47-A78 HydrophobicContact CB-CB 4.26Å; K47-A78 HydrophobicContact CD-CB 4.22Å; K47-A81 HydrophobicContact CB-CB 4.25Å; K47-A81 HydrophobicContact CG-CB 3.87Å
48	Y	90.5	Very high	85.1	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.016	35%	0.347	C	S	.	.	H	α-helix	trans	-66.4	-35.4	175.6	-173.2	-133	0	0	0	113.5	S35 L39 C44 S45 T46 M51 R52 L82 L87 I105 I109	S35-Y48 WeakPolarHBondContact OG-CE1 3.49Å; S35-Y48 PolarHBondContact OG-OH 2.97Å; L39-Y48 HydrophobicContact CD2-CD1 4.17Å; C44-Y48 VanDerWaalsContact O-CB 3.23Å; C44-Y48 WeakPolarHBondContact O-CB 3.36Å; C44-Y48 PolarHBondContact O-N 2.83Å; S45-Y48 PolarHBondContact O-N 2.82Å; T46-Y48 VanDerWaalsContact C-N 3.27Å; T46-Y48 PolarHBondContact O-N 3.49Å; Y48-M51 HydrophobicContact CD2-CE 3.5Å; Y48-M51 HydrophobicContact CE2-CE 3.56Å; Y48-R52 WeakPolarHBondContact O-CG 3.47Å; Y48-R52 PolarHBondContact O-N 3.48Å; Y48-R52 PolarHBondContact OH-NE 3.36Å; Y48-R52 PolarHBondContact OH-NH2 2.87Å; Y48-L82 HydrophobicContact CD2-CD1 4.33Å; Y48-L82 HydrophobicContact CD2-CD2 4.14Å; Y48-L82 HydrophobicContact CG-CD2 4.48Å; Y48-L87 HydrophobicContact CD1-CD2 4.32Å; Y48-L87 HydrophobicContact CD2-CD2 3.71Å; Y48-L87 HydrophobicContact CE1-CD2 4.17Å; Y48-L87 HydrophobicContact CE2-CD2 3.6Å; Y48-L87 HydrophobicContact CG-CD2 4.08Å; Y48-I105 WeakPolarHBondContact OH-CG2 3.43Å; Y48-I109 HydrophobicContact CE2-CD1 4.37Å; Y48-I109 HydrophobicContact CE2-CG1 4.09Å
49	R	90.9	Very high	82.9	Confident	137 Å²	137	73.1 Å²	73.1	52%	0.517	38%	0.38	S	S	.	.	H	α-helix	trans	-70.6	-46.8	173.5	-69.8	168.7	-167.8	174.2	4	111.3	S45 T46 M51 R52 Q53	S45-R49 VanDerWaalsContact O-CG 3.29Å; S45-R49 WeakPolarHBondContact O-CG 3.37Å; S45-R49 PolarHBondContact O-N 2.88Å; S45-R49 VanDerWaalsContact O-N 3.07Å; S45-R49 PolarHBondContact OG-NH2 3.41Å; T46-R49 PolarHBondContact O-N 3.16Å; T46-R49 VanDerWaalsContact O-N 3.11Å; R49-M51 PolarHBondContact O-N 2.93Å; R49-R52 PolarHBondContact O-N 3.3Å; R49-Q53 PolarHBondContact O-N 3.21Å; R49-Q53 VanDerWaalsContact O-N 3.11Å
50	T	88.5	Confident	80.5	Confident	26 Å²	26	77.7 Å²	77.7	16%	0.16	40%	0.399	C	S	.	.	H	α-helix	trans	-54.2	-52.1	174.9	-54	0	0	0	0	110.8	T46 K47 R52 Q53 C54 E74 A78	T46-T50 PolarHBondContact O-N 3.24Å; T46-T50 PolarHBondContact O-OG1 2.95Å; K47-T50 PolarHBondContact O-N 3.3Å; T50-R52 VanDerWaalsContact C-N 3.31Å; T50-R52 PolarHBondContact O-N 3.14Å; T50-Q53 WeakPolarHBondContact O-CB 3.41Å; T50-Q53 PolarHBondContact O-N 3.36Å; T50-C54 PolarHBondContact O-N 3.03Å; T50-C54 PolarHBondContact O-SG 3.26Å; T50-E74 HydrophobicContact CG2-CB 4.46Å; T50-A78 HydrophobicContact CG2-CB 3.98Å
51	M	86.6	Confident	78.1	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-54.4	-44.9	177.5	178.3	-79	-69.6	0	0	112.5	K47 Y48 R49 Q53 C54 V55 A78 M79 L82 I109	K47-M51 WeakPolarHBondContact O-CB 3.39Å; K47-M51 PolarHBondContact O-N 3.24Å; Y48-M51 HydrophobicContact CD2-CE 3.5Å; Y48-M51 HydrophobicContact CE2-CE 3.56Å; R49-M51 PolarHBondContact O-N 2.93Å; M51-Q53 VanDerWaalsContact C-N 3.29Å; M51-Q53 PolarHBondContact O-N 3.09Å; M51-C54 VanDerWaalsContact O-CB 3.3Å; M51-C54 WeakPolarHBondContact O-CB 3.45Å; M51-C54 PolarHBondContact O-N 3.22Å; M51-V55 WeakPolarHBondContact O-CG2 3.34Å; M51-V55 PolarHBondContact O-N 3.31Å; M51-V55 VanDerWaalsContact O-N 3.1Å; M51-V55 HydrophobicContact SD-CG2 3.95Å; M51-A78 HydrophobicContact CB-CB 4.26Å; M51-M79 HydrophobicContact CB-SD 4.48Å; M51-M79 HydrophobicContact CG-CG 4.32Å; M51-M79 HydrophobicContact CG-SD 3.34Å; M51-M79 WeakPolarHBondContact CG-SD 3.19Å; M51-M79 HydrophobicContact SD-SD 4.37Å; M51-L82 HydrophobicContact CB-CD1 3.54Å; M51-L82 HydrophobicContact CE-CD1 3.85Å; M51-L82 HydrophobicContact CG-CD1 3.64Å; M51-I109 HydrophobicContact CE-CB 4.43Å; M51-I109 HydrophobicContact CE-CG1 3.82Å
52	R	85.8	Confident	75.8	Confident	104 Å²	104	73.1 Å²	73.1	39%	0.392	40%	0.401	S	S	.	.	H	α-helix	trans	-63.3	-33.4	178.3	-78	170.2	165.5	-104.9	0.6	113.1	Y48 R49 T50 A56	Y48-R52 WeakPolarHBondContact O-CG 3.47Å; Y48-R52 PolarHBondContact O-N 3.48Å; Y48-R52 PolarHBondContact OH-NE 3.36Å; Y48-R52 PolarHBondContact OH-NH2 2.87Å; R49-R52 PolarHBondContact O-N 3.3Å; T50-R52 VanDerWaalsContact C-N 3.31Å; T50-R52 PolarHBondContact O-N 3.14Å; R52-A56 WeakPolarHBondContact O-CB 3.21Å; R52-A56 PolarHBondContact O-N 3.13Å; R52-A56 VanDerWaalsContact O-N 3.13Å
53	Q	83.6	Confident	73.3	Confident	136 Å²	136	69.6 Å²	69.6	64%	0.636	38%	0.383	S	S	*	.	H	α-helix	trans	-68	-43	174.6	-68.5	165.7	-43.7	0	0	110.7	R49 T50 M51 V55 A56 G57	R49-Q53 PolarHBondContact O-N 3.21Å; R49-Q53 VanDerWaalsContact O-N 3.11Å; T50-Q53 WeakPolarHBondContact O-CB 3.41Å; T50-Q53 PolarHBondContact O-N 3.36Å; M51-Q53 VanDerWaalsContact C-N 3.29Å; M51-Q53 PolarHBondContact O-N 3.09Å; Q53-V55 PolarHBondContact O-N 2.98Å; Q53-A56 PolarHBondContact O-N 3.08Å; Q53-G57 PolarHBondContact O-N 3.45Å; Q53-G57 VanDerWaalsContact O-N 3.11Å
54	C	79.8	Confident	71.3	Confident	15 Å²	15	68.4 Å²	68.4	10%	0.101	37%	0.37	C	S	.	.	H	α-helix	trans	-56.1	-45.5	175.2	-55	0	0	0	0	112.9	T50 M51 A58 C75	T50-C54 PolarHBondContact O-N 3.03Å; T50-C54 PolarHBondContact O-SG 3.26Å; M51-C54 VanDerWaalsContact O-CB 3.3Å; M51-C54 WeakPolarHBondContact O-CB 3.45Å; M51-C54 PolarHBondContact O-N 3.22Å; C54-A58 PolarHBondContact O-N 3.1Å; C54-C75 HydrophobicContact CB-CB 3.77Å; C54-C75 WeakPolarHBondContact CB-SG 3.05Å; C54-C75 WeakPolarHBondContact SG-CA 3.49Å; C54-C75 WeakPolarHBondContact SG-CB 3.07Å; C54-C75 CovalentContact SG-SG 2.02Å; C54-C75 PolarHBondContact SG-SG 3.25Å
55	V	74.3	Confident	69	Low	25 Å²	25	74.5 Å²	74.5	15%	0.152	40%	0.401	C	S	.	.	H	α-helix	trans	-71.4	-34.3	179.6	-179.2	0	0	0	0	112	M51 Q53 A58 Q111 T112	M51-V55 WeakPolarHBondContact O-CG2 3.34Å; M51-V55 PolarHBondContact O-N 3.31Å; M51-V55 VanDerWaalsContact O-N 3.1Å; M51-V55 HydrophobicContact SD-CG2 3.95Å; Q53-V55 PolarHBondContact O-N 2.98Å; V55-A58 PolarHBondContact O-N 3.1Å; V55-Q111 HydrophobicContact CG1-CB 4.34Å; V55-Q111 HydrophobicContact CG1-CG 4.22Å; V55-T112 HydrophobicContact CG2-CG2 3.95Å; V55-T112 WeakPolarHBondContact CG2-OG1 3.45Å
56	A	67.8	Low	66.7	Low	72 Å²	72	81 Å²	81	60%	0.595	44%	0.44	S	S	*	.	H	α-helix	trans	-66.9	-37.1	178.3	0	0	0	0	0	112.5	R52 Q53	R52-A56 WeakPolarHBondContact O-CB 3.21Å; R52-A56 PolarHBondContact O-N 3.13Å; R52-A56 VanDerWaalsContact O-N 3.13Å; Q53-A56 PolarHBondContact O-N 3.08Å
57	G	56.8	Low	64.8	Low	48 Å²	48	79.1 Å²	79.1	50%	0.495	43%	0.431	S	S	.	.	H	α-helix	trans	-77	-13.3	177.5	0	0	0	0	0	115.2	Q53 K59	Q53-G57 PolarHBondContact O-N 3.45Å; Q53-G57 VanDerWaalsContact O-N 3.11Å; G57-K59 VanDerWaalsContact C-N 3.33Å; G57-K59 PolarHBondContact O-N 3.15Å
58	A	55.3	Low	63.4	Low	54 Å²	54	78.3 Å²	78.3	45%	0.446	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	6.2	-175.6	0	0	0	0	0	114.6	C54 V55 E60	C54-A58 PolarHBondContact O-N 3.1Å; V55-A58 PolarHBondContact O-N 3.1Å; A58-E60 PolarHBondContact O-N 2.81Å
59	K	45.9	Very low	62.2	Low	166 Å²	166	83.2 Å²	83.2	72%	0.722	47%	0.472	S	S	*	.	S	Bend	trans	-79	-19.2	-164.3	-115	-171.8	175.5	-165.8	0	116.2	G57	G57-K59 VanDerWaalsContact C-N 3.33Å; G57-K59 PolarHBondContact O-N 3.15Å
60	E	43.1	Very low	61.2	Low	177 Å²	177	84.6 Å²	84.6	83%	0.827	48%	0.484	S	S	*	.	S	Bend	trans	-137.9	102.6	176	-70	-177.5	178.1	0	0	109	A58	A58-E60 PolarHBondContact O-N 2.81Å
61	S	44	Very low	60.6	Low	96 Å²	96	85 Å²	85	67%	0.671	49%	0.49	S	S	*	.	S	Bend	trans	60.9	124	-179	74	0	0	0	0	116.8	F63	S61-F63 PolarHBondContact O-N 2.66Å
62	N	44.1	Very low	60.1	Low	113 Å²	113	90 Å²	90	60%	0.604	51%	0.509	S	S	*	.			trans	22.6	88.2	149.7	-68.6	-27.6	0	0	0	117.6	S64 L65	N62-S64 PolarHBondContact O-N 3.24Å; N62-L65 HydrophobicContact CB-CD1 4.37Å; N62-L65 PolarHBondContact O-N 3.02Å
63	F	42.3	Very low	59.8	Low	62 Å²	62	89 Å²	89	27%	0.272	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-7.9	162.3	-169.1	-103.2	0	0	0	113.2	S61 L65 A67 A71 R72	S61-F63 PolarHBondContact O-N 2.66Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 3.35Å; F63-A67 HydrophobicContact CD1-CB 3.89Å; F63-A67 HydrophobicContact CD2-CB 3.8Å; F63-A67 HydrophobicContact CE1-CB 3.5Å; F63-A67 VanDerWaalsContact CE1-CB 3.5Å; F63-A67 HydrophobicContact CE2-CB 3.39Å; F63-A67 HydrophobicContact CG-CB 4.04Å; F63-A67 HydrophobicContact CZ-CB 3.23Å; F63-A71 HydrophobicContact CZ-CB 4.31Å; F63-R72 HydrophobicContact CD1-CG 3.86Å; F63-R72 HydrophobicContact CE1-CB 4.47Å; F63-R72 HydrophobicContact CE1-CG 3.72Å
64	S	47	Very low	59.9	Low	56 Å²	56	88.3 Å²	88.3	39%	0.392	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.8	171.6	70.4	0	0	0	0	115.6	N62	N62-S64 PolarHBondContact O-N 3.24Å
65	L	44.4	Very low	60.1	Low	145 Å²	145	88.6 Å²	88.6	76%	0.759	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-19.2	-174.7	-79.5	162.3	0	0	0	114.9	N62 F63	N62-L65 HydrophobicContact CB-CD1 4.37Å; N62-L65 PolarHBondContact O-N 3.02Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 3.35Å
66	V	46.1	Very low	60.6	Low	135 Å²	135	94.8 Å²	94.8	82%	0.818	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-20.3	-170.9	-176.6	0	0	0	0	113.3
67	A	52.7	Low	61.5	Low	23 Å²	23	94 Å²	94	19%	0.19	52%	0.521	C	S	.	.	S	Bend	trans	-105.3	131	178	0	0	0	0	0	111.4	F63 A71	F63-A67 HydrophobicContact CD1-CB 3.89Å; F63-A67 HydrophobicContact CD2-CB 3.8Å; F63-A67 HydrophobicContact CE1-CB 3.5Å; F63-A67 VanDerWaalsContact CE1-CB 3.5Å; F63-A67 HydrophobicContact CE2-CB 3.39Å; F63-A67 HydrophobicContact CG-CB 4.04Å; F63-A67 HydrophobicContact CZ-CB 3.23Å; A67-A71 HydrophobicContact CB-CB 4.24Å
68	G	61.8	Low	63	Low	50 Å²	50	91.7 Å²	91.7	52%	0.515	50%	0.497	S	S	.	.			trans	-56.2	154.7	174.4	0	0	0	0	0	112.3	E70 A71 R72	G68-E70 PolarHBondContact O-N 3.22Å; G68-E70 VanDerWaalsContact O-N 3.15Å; G68-A71 PolarHBondContact O-N 3.23Å; G68-R72 PolarHBondContact O-N 3.38Å
69	V	66.4	Low	64.4	Low	107 Å²	107	89.8 Å²	89.8	65%	0.648	48%	0.479	S	S	*	.	H	α-helix	trans	-52.3	-40.6	-176.5	-178.6	0	0	0	0	111.5	A71 R72 D73	V69-A71 PolarHBondContact O-N 3Å; V69-R72 WeakPolarHBondContact O-CA 3.46Å; V69-R72 WeakPolarHBondContact O-CB 3.47Å; V69-R72 PolarHBondContact O-N 3.33Å; V69-D73 PolarHBondContact O-N 2.95Å
70	E	69.8	Low	66.3	Low	166 Å²	166	86 Å²	86	78%	0.776	46%	0.464	S	S	*	.	H	α-helix	trans	-53.1	-49.3	176.3	-59.9	173.8	157.9	0	0	112.7	G68 R72 D73 E74	G68-E70 PolarHBondContact O-N 3.22Å; G68-E70 VanDerWaalsContact O-N 3.15Å; E70-R72 VanDerWaalsContact C-N 3.28Å; E70-R72 PolarHBondContact O-N 3.24Å; E70-D73 PolarHBondContact O-N 2.82Å; E70-E74 WeakPolarHBondContact O-CG 3.45Å; E70-E74 PolarHBondContact O-N 3.1Å
71	A	75.3	Confident	68.4	Low	34 Å²	34	79.5 Å²	79.5	28%	0.281	44%	0.441	S	S	.	.	H	α-helix	trans	-65.3	-31.8	178.1	0	0	0	0	0	112.2	F63 A67 G68 V69 C75	F63-A71 HydrophobicContact CZ-CB 4.31Å; A67-A71 HydrophobicContact CB-CB 4.24Å; G68-A71 PolarHBondContact O-N 3.23Å; V69-A71 PolarHBondContact O-N 3Å; A71-C75 WeakPolarHBondContact O-CB 3.45Å; A71-C75 PolarHBondContact O-N 3.02Å; A71-C75 VanDerWaalsContact O-N 3.09Å; A71-C75 PolarHBondContact O-SG 3.5Å
72	R	75.1	Confident	70.5	Confident	107 Å²	107	75 Å²	75	40%	0.404	41%	0.409	S	S	.	.	H	α-helix	trans	-69.3	-38	175.4	-58.9	-178.1	67.8	-179.1	-0.5	111.5	F63 G68 V69 E70 C75 R76	F63-R72 HydrophobicContact CD1-CG 3.86Å; F63-R72 HydrophobicContact CE1-CB 4.47Å; F63-R72 HydrophobicContact CE1-CG 3.72Å; G68-R72 PolarHBondContact O-N 3.38Å; V69-R72 WeakPolarHBondContact O-CA 3.46Å; V69-R72 WeakPolarHBondContact O-CB 3.47Å; V69-R72 PolarHBondContact O-N 3.33Å; E70-R72 VanDerWaalsContact C-N 3.28Å; E70-R72 PolarHBondContact O-N 3.24Å; R72-C75 WeakPolarHBondContact O-CB 3.48Å; R72-C75 PolarHBondContact O-N 3.01Å; R72-R76 PolarHBondContact O-N 3.11Å
73	D	81.4	Confident	72.5	Confident	81 Å²	81	73.1 Å²	73.1	43%	0.433	40%	0.396	S	S	.	.	H	α-helix	trans	-77.2	-31.7	178	-71.5	-29.4	0	0	0	112.7	V69 E70 R76 S77	V69-D73 PolarHBondContact O-N 2.95Å; E70-D73 PolarHBondContact O-N 2.82Å; D73-R76 PolarHBondContact O-N 3.25Å; D73-R76 IonicContact OD1-NE 2.74Å; D73-S77 VanDerWaalsContact O-CB 3.24Å; D73-S77 WeakPolarHBondContact O-CB 3.48Å; D73-S77 PolarHBondContact O-N 2.87Å
74	E	85.1	Confident	74.6	Confident	123 Å²	123	78.5 Å²	78.5	58%	0.575	42%	0.422	S	S	*	.	H	α-helix	trans	-60	-45.6	166.4	-75.3	-170.3	172.2	0	0	111.9	T50 E70 R76 S77 A78	T50-E74 HydrophobicContact CG2-CB 4.46Å; E70-E74 WeakPolarHBondContact O-CG 3.45Å; E70-E74 PolarHBondContact O-N 3.1Å; E74-R76 PolarHBondContact O-N 2.91Å; E74-S77 PolarHBondContact O-N 3.24Å; E74-A78 WeakPolarHBondContact O-CB 3.37Å; E74-A78 PolarHBondContact O-N 2.97Å
75	C	83.8	Confident	76.5	Confident	20 Å²	20	76.6 Å²	76.6	14%	0.135	41%	0.409	C	S	.	.	H	α-helix	trans	-60.4	-43.4	175.1	-69	0	0	0	0	112.3	C54 A71 R72 A78 M79	C54-C75 HydrophobicContact CB-CB 3.77Å; C54-C75 WeakPolarHBondContact CB-SG 3.05Å; C54-C75 WeakPolarHBondContact SG-CA 3.49Å; C54-C75 WeakPolarHBondContact SG-CB 3.07Å; C54-C75 CovalentContact SG-SG 2.02Å; C54-C75 PolarHBondContact SG-SG 3.25Å; A71-C75 WeakPolarHBondContact O-CB 3.45Å; A71-C75 PolarHBondContact O-N 3.02Å; A71-C75 VanDerWaalsContact O-N 3.09Å; A71-C75 PolarHBondContact O-SG 3.5Å; R72-C75 WeakPolarHBondContact O-CB 3.48Å; R72-C75 PolarHBondContact O-N 3.01Å; C75-A78 PolarHBondContact O-N 3.32Å; C75-M79 WeakPolarHBondContact O-CG 3.38Å; C75-M79 PolarHBondContact O-N 3.5Å
76	R	83.9	Confident	78.5	Confident	155 Å²	155	73.1 Å²	73.1	59%	0.585	39%	0.394	S	S	*	.	H	α-helix	trans	-62.6	-49.9	175.2	-173.1	-172.8	-57.7	-77.7	2.4	111.4	R72 D73 E74 A78 M79 E80	R72-R76 PolarHBondContact O-N 3.11Å; D73-R76 PolarHBondContact O-N 3.25Å; D73-R76 IonicContact OD1-NE 2.74Å; E74-R76 PolarHBondContact O-N 2.91Å; R76-A78 VanDerWaalsContact C-N 3.27Å; R76-A78 PolarHBondContact O-N 3.24Å; R76-M79 PolarHBondContact O-N 3.42Å; R76-M79 VanDerWaalsContact O-N 3.13Å; R76-E80 PolarHBondContact O-N 3.09Å
77	S	87.5	Confident	80.5	Confident	56 Å²	56	66.8 Å²	66.8	39%	0.392	36%	0.356	S	S	.	.	H	α-helix	trans	-56.7	-40.6	176.7	178	0	0	0	0	112	K47 D73 E74 A81	K47-S77 PolarHBondContact NZ-OG 2.9Å; D73-S77 VanDerWaalsContact O-CB 3.24Å; D73-S77 WeakPolarHBondContact O-CB 3.48Å; D73-S77 PolarHBondContact O-N 2.87Å; E74-S77 PolarHBondContact O-N 3.24Å; S77-A81 WeakPolarHBondContact O-CB 3.42Å; S77-A81 PolarHBondContact O-N 3.2Å; S77-A81 VanDerWaalsContact O-N 3.1Å
78	A	88.4	Confident	82.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-65.6	-42	175.7	0	0	0	0	0	112.8	K47 T50 M51 E74 C75 R76 L82	K47-A78 HydrophobicContact CB-CB 4.26Å; K47-A78 HydrophobicContact CD-CB 4.22Å; T50-A78 HydrophobicContact CG2-CB 3.98Å; M51-A78 HydrophobicContact CB-CB 4.26Å; E74-A78 WeakPolarHBondContact O-CB 3.37Å; E74-A78 PolarHBondContact O-N 2.97Å; C75-A78 PolarHBondContact O-N 3.32Å; R76-A78 VanDerWaalsContact C-N 3.27Å; R76-A78 PolarHBondContact O-N 3.24Å; A78-L82 VanDerWaalsContact O-CG 3.26Å; A78-L82 WeakPolarHBondContact O-CG 3.3Å; A78-L82 PolarHBondContact O-N 2.97Å; A78-L82 VanDerWaalsContact O-N 3.08Å
79	M	84.7	Confident	83.1	Confident	14 Å²	14	69.6 Å²	69.6	7%	0.069	35%	0.353	C	S	.	.	H	α-helix	trans	-64.7	-44.9	175.8	-74.8	-63.2	-64.2	0	0	112.7	M51 C75 R76 L82 K83 T112 L113	M51-M79 HydrophobicContact CB-SD 4.48Å; M51-M79 HydrophobicContact CG-CG 4.32Å; M51-M79 HydrophobicContact CG-SD 3.34Å; M51-M79 WeakPolarHBondContact CG-SD 3.19Å; M51-M79 HydrophobicContact SD-SD 4.37Å; C75-M79 WeakPolarHBondContact O-CG 3.38Å; C75-M79 PolarHBondContact O-N 3.5Å; R76-M79 PolarHBondContact O-N 3.42Å; R76-M79 VanDerWaalsContact O-N 3.13Å; M79-L82 PolarHBondContact O-N 3.26Å; M79-K83 PolarHBondContact O-N 2.71Å; M79-T112 HydrophobicContact CE-CG2 4.11Å; M79-T112 HydrophobicContact CG-CG2 3.98Å; M79-T112 HydrophobicContact SD-CG2 3.74Å; M79-L113 HydrophobicContact CE-CD2 3.89Å; M79-L113 HydrophobicContact CE-CG 4.06Å
80	E	85.6	Confident	84.3	Confident	85 Å²	85	64.5 Å²	64.5	40%	0.397	32%	0.322	S	S	.	.	H	α-helix	trans	-65.4	-39.5	178.9	-63	-48.4	130.2	0	0	112.4	R76 L82 K83	R76-E80 PolarHBondContact O-N 3.09Å; E80-L82 VanDerWaalsContact C-N 3.32Å; E80-L82 PolarHBondContact O-N 2.84Å; E80-K83 PolarHBondContact O-N 3.38Å; E80-K83 WeakPolarHBondContact OE1-CE 3.07Å; E80-K83 IonicContact OE1-NZ 3.48Å; E80-K83 PolarHBondContact OE1-NZ 2.97Å; E80-K83 VanDerWaalsContact OE2-CD 3.31Å; E80-K83 WeakPolarHBondContact OE2-CD 3.34Å; E80-K83 IonicContact OE2-NZ 2.66Å; E80-K83 PolarHBondContact OE2-NZ 2.95Å
81	A	87.7	Confident	85.3	Confident	41 Å²	41	57.1 Å²	57.1	34%	0.339	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-38.7	173.4	0	0	0	0	0	112.1	K47 S77 Q84	K47-A81 HydrophobicContact CB-CB 4.25Å; K47-A81 HydrophobicContact CG-CB 3.87Å; S77-A81 WeakPolarHBondContact O-CB 3.42Å; S77-A81 PolarHBondContact O-N 3.2Å; S77-A81 VanDerWaalsContact O-N 3.1Å; A81-Q84 PolarHBondContact O-N 3.3Å
82	L	87.6	Confident	86.2	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-68.2	-35.4	177.1	-73.6	168.4	0	0	0	112.7	Y48 M51 A78 M79 E80 Q84 S85 L87 Y88	Y48-L82 HydrophobicContact CD2-CD1 4.33Å; Y48-L82 HydrophobicContact CD2-CD2 4.14Å; Y48-L82 HydrophobicContact CG-CD2 4.48Å; M51-L82 HydrophobicContact CB-CD1 3.54Å; M51-L82 HydrophobicContact CE-CD1 3.85Å; M51-L82 HydrophobicContact CG-CD1 3.64Å; A78-L82 VanDerWaalsContact O-CG 3.26Å; A78-L82 WeakPolarHBondContact O-CG 3.3Å; A78-L82 PolarHBondContact O-N 2.97Å; A78-L82 VanDerWaalsContact O-N 3.08Å; M79-L82 PolarHBondContact O-N 3.26Å; E80-L82 VanDerWaalsContact C-N 3.32Å; E80-L82 PolarHBondContact O-N 2.84Å; L82-Q84 PolarHBondContact O-N 2.86Å; L82-S85 WeakPolarHBondContact O-CB 3.26Å; L82-S85 PolarHBondContact O-N 2.89Å; L82-S85 PolarHBondContact O-OG 3.21Å; L82-L87 HydrophobicContact CD2-CD2 4.45Å; L82-Y88 VanDerWaalsContact O-CB 3.3Å; L82-Y88 WeakPolarHBondContact O-CB 3.46Å
83	K	86.4	Confident	86.9	Confident	73 Å²	73	55 Å²	55	32%	0.317	27%	0.274	S	S	.	.	H	α-helix	trans	-55.9	-32.6	176.2	-75.6	175.9	-174.5	169.9	0	113.5	M79 E80 S85 Y88	M79-K83 PolarHBondContact O-N 2.71Å; E80-K83 PolarHBondContact O-N 3.38Å; E80-K83 WeakPolarHBondContact OE1-CE 3.07Å; E80-K83 IonicContact OE1-NZ 3.48Å; E80-K83 PolarHBondContact OE1-NZ 2.97Å; E80-K83 VanDerWaalsContact OE2-CD 3.31Å; E80-K83 WeakPolarHBondContact OE2-CD 3.34Å; E80-K83 IonicContact OE2-NZ 2.66Å; E80-K83 PolarHBondContact OE2-NZ 2.95Å; K83-S85 VanDerWaalsContact C-N 3.29Å; K83-Y88 HydrophobicContact CB-CD2 4.46Å; K83-Y88 HydrophobicContact CB-CG 4.4Å; K83-Y88 HydrophobicContact CG-CD1 4.35Å; K83-Y88 HydrophobicContact CG-CD2 3.84Å; K83-Y88 HydrophobicContact CG-CE1 4.17Å; K83-Y88 HydrophobicContact CG-CE2 3.62Å; K83-Y88 HydrophobicContact CG-CG 4.19Å
84	Q	86.6	Confident	87.2	Confident	175 Å²	175	53.6 Å²	53.6	82%	0.818	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-14.3	177.8	-59.3	179	13.6	0	0	112.7	A81 L82	A81-Q84 PolarHBondContact O-N 3.3Å; L82-Q84 PolarHBondContact O-N 2.86Å
85	S	86.9	Confident	87.2	Confident	17 Å²	17	48.5 Å²	48.5	12%	0.119	24%	0.244	C	C	.	.	S	Bend	trans	-86.9	154.8	-178.7	79.2	0	0	0	0	112.9	L82 K83 L87 Y88	L82-S85 WeakPolarHBondContact O-CB 3.26Å; L82-S85 PolarHBondContact O-N 2.89Å; L82-S85 PolarHBondContact O-OG 3.21Å; K83-S85 VanDerWaalsContact C-N 3.29Å; S85-L87 PolarHBondContact O-N 3.14Å; S85-L87 WeakPolarHBondContact OG-CB 3.35Å; S85-L87 PolarHBondContact OG-N 3.44Å; S85-Y88 PolarHBondContact O-N 2.9Å
86	P	86.2	Confident	87.5	Confident	71 Å²	71	49.6 Å²	49.6	46%	0.461	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-18.2	171.5	-24.1	34.2	0	0	0	114.3	L29	L29-P86 HydrophobicContact CD1-CB 4.08Å
87	L	87.6	Confident	87.7	Confident	2 Å²	2	53 Å²	53	1%	0.01	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-30.6	-178.2	-179.5	56	0	0	0	113	A34 C38 Y48 L82 S85 C90 I105 I109	A34-L87 HydrophobicContact CB-CB 4.29Å; A34-L87 HydrophobicContact CB-CD1 3.98Å; C38-L87 HydrophobicContact CB-CD2 3.84Å; Y48-L87 HydrophobicContact CD1-CD2 4.32Å; Y48-L87 HydrophobicContact CD2-CD2 3.71Å; Y48-L87 HydrophobicContact CE1-CD2 4.17Å; Y48-L87 HydrophobicContact CE2-CD2 3.6Å; Y48-L87 HydrophobicContact CG-CD2 4.08Å; L82-L87 HydrophobicContact CD2-CD2 4.45Å; S85-L87 PolarHBondContact O-N 3.14Å; S85-L87 WeakPolarHBondContact OG-CB 3.35Å; S85-L87 PolarHBondContact OG-N 3.44Å; L87-C90 WeakPolarHBondContact O-CB 3.04Å; L87-C90 PolarHBondContact O-N 3.44Å; L87-C90 PolarHBondContact O-SG 2.81Å; L87-I105 HydrophobicContact CD1-CG2 3.9Å; L87-I109 HydrophobicContact CD1-CD1 3.71Å; L87-I109 HydrophobicContact CD2-CD1 4.38Å; L87-I109 HydrophobicContact CG-CD1 3.68Å
88	Y	85.6	Confident	88	Confident	46 Å²	46	55.4 Å²	55.4	18%	0.18	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-49.2	178.3	-177.6	-100.8	0	0	0	111.7	L82 K83 S85 C90 I109 Y110 L113	L82-Y88 VanDerWaalsContact O-CB 3.3Å; L82-Y88 WeakPolarHBondContact O-CB 3.46Å; K83-Y88 HydrophobicContact CB-CD2 4.46Å; K83-Y88 HydrophobicContact CB-CG 4.4Å; K83-Y88 HydrophobicContact CG-CD1 4.35Å; K83-Y88 HydrophobicContact CG-CD2 3.84Å; K83-Y88 HydrophobicContact CG-CE1 4.17Å; K83-Y88 HydrophobicContact CG-CE2 3.62Å; K83-Y88 HydrophobicContact CG-CG 4.19Å; S85-Y88 PolarHBondContact O-N 2.9Å; Y88-C90 PolarHBondContact O-N 3.23Å; Y88-I109 HydrophobicContact CD2-CG2 4.1Å; Y88-Y110 WeakPolarHBondContact O-CE2 3.29Å; Y88-Y110 PolarHBondContact O-OH 3.16Å; Y88-L113 HydrophobicContact CE2-CD1 4Å
89	N	84.6	Confident	88.2	Confident	86 Å²	86	56.3 Å²	56.3	46%	0.46	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	14.5	-178.7	-75.1	-45.5	0	0	0	114	R28	R28-N89 VanDerWaalsContact CZ-O 3.24Å; R28-N89 PolarHBondContact NE-O 2.91Å; R28-N89 PolarHBondContact NH2-O 2.92Å
90	C	90.8	Very high	88.6	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.007	30%	0.295	C	S	.	.			trans	-64.5	154.7	178.7	78.8	0	0	0	0	112	C31 A34 L87 Y88	C31-C90 WeakPolarHBondContact CA-SG 3.36Å; C31-C90 HydrophobicContact CB-CB 3.82Å; C31-C90 WeakPolarHBondContact CB-SG 3.37Å; C31-C90 WeakPolarHBondContact SG-CB 3.25Å; C31-C90 CovalentContact SG-SG 2.03Å; C31-C90 PolarHBondContact SG-SG 3.25Å; A34-C90 HydrophobicContact CB-CB 4.15Å; L87-C90 WeakPolarHBondContact O-CB 3.04Å; L87-C90 PolarHBondContact O-N 3.44Å; L87-C90 PolarHBondContact O-SG 2.81Å; Y88-C90 PolarHBondContact O-N 3.23Å
91	R	91.4	Very high	89.1	Confident	10 Å²	10	60 Å²	60	4%	0.038	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-136.4	173	171	-69.5	-66.9	178.6	-83.5	4.8	110.3	D30 C31 Y110 E121 S122 P123 E125	D30-R91 VanDerWaalsContact CA-O 3.27Å; D30-R91 WeakPolarHBondContact CA-O 3.45Å; C31-R91 PolarHBondContact N-O 3.29Å; R91-Y110 PolarHBondContact NH1-OH 3Å; R91-Y110 PolarHBondContact NH2-OH 3.5Å; R91-E121 IonicContact CZ-OE1 3.6Å; R91-E121 IonicContact CZ-OE2 3.37Å; R91-E121 IonicContact NE-OE1 3.74Å; R91-E121 IonicContact NH2-OE1 2.9Å; R91-E121 PolarHBondContact NH2-OE1 3.02Å; R91-E121 IonicContact NH2-OE2 3.27Å; R91-E121 PolarHBondContact NH2-OE2 3.12Å; R91-S122 PolarHBondContact NE-O 3.13Å; R91-P123 CarbonylContact C-O 3.53Å; R91-P123 WeakPolarHBondContact CA-O 3.24Å; R91-P123 VanDerWaalsContact CD-O 3.31Å; R91-P123 WeakPolarHBondContact CD-O 3.32Å; R91-E125 HydrophobicContact CB-CG 3.59Å; R91-E125 HydrophobicContact CG-CG 4.48Å
92	C	92.9	Very high	89.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-115.7	157.9	-179.9	-64.3	0	0	0	0	111.9	M96 C102 L103 P123 Y124 E125	C92-M96 HydrophobicContact CB-SD 4.43Å; C92-C102 WeakPolarHBondContact CA-SG 3.35Å; C92-C102 HydrophobicContact CB-CB 3.99Å; C92-C102 WeakPolarHBondContact CB-SG 3.5Å; C92-C102 WeakPolarHBondContact SG-CB 3.5Å; C92-C102 CovalentContact SG-SG 2.04Å; C92-C102 PolarHBondContact SG-SG 3.32Å; C92-L103 HydrophobicContact CB-CD2 3.8Å; C92-P123 PolarHBondContact N-O 3.47Å; C92-Y124 HydrophobicContact CB-CD1 4.14Å; C92-Y124 HydrophobicContact CB-CE1 4.28Å; C92-Y124 CarbonylContact O-C 3.57Å; C92-Y124 VanDerWaalsContact O-CA 3.29Å; C92-Y124 WeakPolarHBondContact O-CA 3.3Å; C92-E125 PolarHBondContact O-N 3.26Å
93	K	89.8	Confident	89.8	Confident	96 Å²	96	58 Å²	58	42%	0.417	28%	0.275	S	S	.	.			trans	-109.8	130.4	177.4	-74.4	171.8	176.1	152.6	0	110.2	G95 M96 E125	K93-G95 PolarHBondContact O-N 3.2Å; K93-M96 HydrophobicContact CB-CB 4.2Å; K93-M96 HydrophobicContact CB-SD 4.19Å; K93-M96 PolarHBondContact N-SD 3.26Å; K93-M96 WeakPolarHBondContact O-CB 3.33Å; K93-M96 WeakPolarHBondContact O-CG 3.45Å; K93-M96 PolarHBondContact O-N 2.62Å; K93-E125 WeakPolarHBondContact CE-OE1 3.24Å; K93-E125 WeakPolarHBondContact CE-OE2 3.31Å; K93-E125 IonicContact NZ-OE1 2.91Å; K93-E125 PolarHBondContact NZ-OE1 2.65Å; K93-E125 IonicContact NZ-OE2 3.73Å; K93-E125 PolarHBondContact NZ-OE2 3.34Å
94	R	87.9	Confident	90.1	Very high	52 Å²	52	59.8 Å²	59.8	20%	0.196	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	130.2	176	173.5	161.2	-176.1	-175.2	-2.2	110.7	M96 E99 D256 L345 S348 G349	R94-M96 VanDerWaalsContact C-N 3.27Å; R94-M96 PolarHBondContact O-N 2.83Å; R94-E99 WeakPolarHBondContact CA-OE1 3.37Å; R94-D256 IonicContact CZ-OD1 3.83Å; R94-D256 IonicContact NE-OD1 2.7Å; R94-D256 PolarHBondContact NE-OD1 3.39Å; R94-D256 IonicContact NH2-OD1 3.93Å; R94-D256 PolarHBondContact NH2-OD1 3.43Å; R94-L345 PolarHBondContact NH1-O 3.04Å; R94-S348 PolarHBondContact NH1-OG 2.91Å; R94-S348 PolarHBondContact NH2-O 3.09Å; R94-G349 VanDerWaalsContact CZ-CA 3.47Å; R94-G349 VanDerWaalsContact NH1-CA 3.26Å; R94-G349 VanDerWaalsContact NH1-N 3.15Å
95	G	85.3	Confident	90.3	Very high	16 Å²	16	51.8 Å²	51.8	17%	0.165	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	18.9	175.1	0	0	0	0	0	115.4	K93 E99 K257	K93-G95 PolarHBondContact O-N 3.2Å; G95-E99 PolarHBondContact N-OE1 3.47Å; G95-K257 PolarHBondContact O-NZ 2.91Å
96	M	89.5	Confident	90.5	Very high	43 Å²	43	51.1 Å²	51.1	21%	0.212	24%	0.237	C	C	.	.			trans	-72.4	150.1	174.1	73.2	-174.7	-70.4	0	0	112.1	D30 V32 C92 K93 R94 K98 E99 C102	D30-M96 HydrophobicContact CB-CE 4.25Å; V32-M96 HydrophobicContact CG2-CE 4.48Å; C92-M96 HydrophobicContact CB-SD 4.43Å; K93-M96 HydrophobicContact CB-CB 4.2Å; K93-M96 HydrophobicContact CB-SD 4.19Å; K93-M96 PolarHBondContact N-SD 3.26Å; K93-M96 WeakPolarHBondContact O-CB 3.33Å; K93-M96 WeakPolarHBondContact O-CG 3.45Å; K93-M96 PolarHBondContact O-N 2.62Å; R94-M96 VanDerWaalsContact C-N 3.27Å; R94-M96 PolarHBondContact O-N 2.83Å; M96-K98 VanDerWaalsContact C-N 3.27Å; M96-K98 PolarHBondContact O-N 2.84Å; M96-K98 VanDerWaalsContact O-N 3.12Å; M96-E99 HydrophobicContact CG-CB 3.72Å; M96-E99 HydrophobicContact CG-CG 4.44Å; M96-E99 WeakPolarHBondContact O-CB 3.45Å; M96-E99 PolarHBondContact O-N 3.01Å; M96-C102 HydrophobicContact CE-CB 4.27Å; M96-C102 HydrophobicContact SD-CB 3.85Å
97	K	89.5	Confident	90.7	Very high	226 Å²	226	47.8 Å²	47.8	98%	0.983	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-39	-175	-68.8	-176.7	-179.8	177.9	0	114.2
98	K	93.2	Very high	90.6	Very high	108 Å²	108	48.5 Å²	48.5	47%	0.47	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	23.2	-179.6	-69.3	-178.1	176.4	175.1	0	113.1	V32 E36 M96 K100 N101 C102	V32-K98 HydrophobicContact CG1-CD 3.69Å; V32-K98 HydrophobicContact CG2-CB 4.08Å; V32-K98 HydrophobicContact CG2-CD 4.38Å; E36-K98 IonicContact OE1-NZ 3.71Å; E36-K98 PolarHBondContact OE1-NZ 3.22Å; M96-K98 VanDerWaalsContact C-N 3.27Å; M96-K98 PolarHBondContact O-N 2.84Å; M96-K98 VanDerWaalsContact O-N 3.12Å; K98-K100 PolarHBondContact O-N 3.08Å; K98-N101 HydrophobicContact CB-CB 4.46Å; K98-N101 WeakPolarHBondContact O-CA 3.33Å; K98-N101 WeakPolarHBondContact O-CB 3.32Å; K98-N101 PolarHBondContact O-N 3.33Å; K98-C102 PolarHBondContact O-N 2.04Å
99	E	92.9	Very high	90.5	Very high	18 Å²	18	46.4 Å²	46.4	8%	0.084	22%	0.215	C	C	.	.	H	α-helix	trans	-49.1	-54.3	-171.4	-175.1	174.4	-132.8	0	0	113.5	R94 G95 M96 N101 C102 L103 Y124 R317	R94-E99 WeakPolarHBondContact CA-OE1 3.37Å; G95-E99 PolarHBondContact N-OE1 3.47Å; M96-E99 HydrophobicContact CG-CB 3.72Å; M96-E99 HydrophobicContact CG-CG 4.44Å; M96-E99 WeakPolarHBondContact O-CB 3.45Å; M96-E99 PolarHBondContact O-N 3.01Å; E99-N101 PolarHBondContact O-N 3.43Å; E99-N101 VanDerWaalsContact O-N 3.1Å; E99-C102 WeakPolarHBondContact O-CA 3.01Å; E99-C102 WeakPolarHBondContact O-CB 3.42Å; E99-C102 PolarHBondContact O-N 2.86Å; E99-L103 HydrophobicContact CG-CD1 4.05Å; E99-L103 HydrophobicContact CG-CG 4.35Å; E99-L103 WeakPolarHBondContact O-CG 3.04Å; E99-L103 PolarHBondContact O-N 2.87Å; E99-Y124 HydrophobicContact CG-CE1 4.47Å; E99-Y124 WeakPolarHBondContact OE1-CE1 3.31Å; E99-Y124 PolarHBondContact OE1-OH 2.88Å; E99-R317 IonicContact OE1-CZ 3.49Å; E99-R317 IonicContact OE1-NH1 3.13Å; E99-R317 PolarHBondContact OE1-NH1 2.91Å; E99-R317 IonicContact OE1-NH2 3.35Å; E99-R317 PolarHBondContact OE1-NH2 2.67Å; E99-R317 IonicContact OE2-NH2 2.92Å
100	K	93.2	Very high	90.1	Very high	117 Å²	117	43.3 Å²	43.3	51%	0.509	20%	0.197	S	C	.	.	H	α-helix	trans	-56.2	-31.5	178.6	-175	176.1	179	178.8	0	113.3	K98 R104 I313	K98-K100 PolarHBondContact O-N 3.08Å; K100-R104 WeakPolarHBondContact O-CB 3.31Å; K100-R104 PolarHBondContact O-N 3.09Å; K100-I313 HydrophobicContact CB-CD1 4.43Å
101	N	95.2	Very high	89.2	Confident	61 Å²	61	46.9 Å²	46.9	33%	0.326	21%	0.214	S	C	.	.	H	α-helix	trans	-78.1	-40.6	176.6	-165.9	58.9	0	0	0	111.7	K98 E99 L103 R104 I105	K98-N101 HydrophobicContact CB-CB 4.46Å; K98-N101 WeakPolarHBondContact O-CA 3.33Å; K98-N101 WeakPolarHBondContact O-CB 3.32Å; K98-N101 PolarHBondContact O-N 3.33Å; E99-N101 PolarHBondContact O-N 3.43Å; E99-N101 VanDerWaalsContact O-N 3.1Å; N101-L103 PolarHBondContact O-N 2.78Å; N101-R104 PolarHBondContact O-N 3.23Å; N101-I105 WeakPolarHBondContact O-CG1 3.42Å; N101-I105 PolarHBondContact O-N 3.44Å
102	C	95.4	Very high	87.4	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56	-50.5	173.8	-170.5	0	0	0	0	111.1	V32 C92 M96 K98 E99 R104 I105 Y106	V32-C102 HydrophobicContact CG2-CB 3.81Å; C92-C102 WeakPolarHBondContact CA-SG 3.35Å; C92-C102 HydrophobicContact CB-CB 3.99Å; C92-C102 WeakPolarHBondContact CB-SG 3.5Å; C92-C102 WeakPolarHBondContact SG-CB 3.5Å; C92-C102 CovalentContact SG-SG 2.04Å; C92-C102 PolarHBondContact SG-SG 3.32Å; M96-C102 HydrophobicContact CE-CB 4.27Å; M96-C102 HydrophobicContact SD-CB 3.85Å; K98-C102 PolarHBondContact O-N 2.04Å; E99-C102 WeakPolarHBondContact O-CA 3.01Å; E99-C102 WeakPolarHBondContact O-CB 3.42Å; E99-C102 PolarHBondContact O-N 2.86Å; C102-R104 PolarHBondContact O-N 2.86Å; C102-I105 WeakPolarHBondContact O-CB 3.19Å; C102-I105 PolarHBondContact O-N 3.32Å; C102-I105 VanDerWaalsContact O-N 3.14Å; C102-Y106 PolarHBondContact O-N 2.87Å
103	L	94.3	Very high	85.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.6	-38.5	179.4	-58.4	175.4	0	0	0	112.4	C92 E99 N101 I105 Y106 W107 P123 Y124 I313 S316	C92-L103 HydrophobicContact CB-CD2 3.8Å; E99-L103 HydrophobicContact CG-CD1 4.05Å; E99-L103 HydrophobicContact CG-CG 4.35Å; E99-L103 WeakPolarHBondContact O-CG 3.04Å; E99-L103 PolarHBondContact O-N 2.87Å; N101-L103 PolarHBondContact O-N 2.78Å; L103-I105 VanDerWaalsContact C-N 3.29Å; L103-I105 PolarHBondContact O-N 3.41Å; L103-Y106 PolarHBondContact O-N 2.98Å; L103-W107 WeakPolarHBondContact O-CB 3.22Å; L103-W107 PolarHBondContact O-N 2.93Å; L103-P123 HydrophobicContact CD2-CB 4.12Å; L103-P123 HydrophobicContact CD2-CG 4.03Å; L103-Y124 VanDerWaalsContact CD1-OH 3.32Å; L103-Y124 WeakPolarHBondContact CD1-OH 3.38Å; L103-Y124 HydrophobicContact CD2-CE1 3.92Å; L103-Y124 HydrophobicContact CD2-CE2 4.48Å; L103-I313 HydrophobicContact CD1-CG1 4.11Å; L103-S316 WeakPolarHBondContact CD2-OG 2.98Å
104	R	92.8	Very high	83.8	Confident	111 Å²	111	52 Å²	52	42%	0.419	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-38.8	173.9	-179.5	-168.2	-73.9	152.7	-16.3	111.6	K100 N101 C102 G108 Y312	K100-R104 WeakPolarHBondContact O-CB 3.31Å; K100-R104 PolarHBondContact O-N 3.09Å; N101-R104 PolarHBondContact O-N 3.23Å; C102-R104 PolarHBondContact O-N 2.86Å; R104-G108 PolarHBondContact O-N 3.13Å; R104-Y312 HydrophobicContact CB-CD2 4.1Å; R104-Y312 HydrophobicContact CB-CE2 3.96Å; R104-Y312 HydrophobicContact CG-CD2 4.47Å; R104-Y312 HydrophobicContact CG-CE2 3.84Å
105	I	92.1	Very high	81.6	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-66.4	-50.7	176.1	-70.3	162.1	0	0	0	110.1	C31 V32 Y48 L87 N101 C102 L103 G108 I109	C31-I105 HydrophobicContact CB-CB 4.15Å; C31-I105 HydrophobicContact CB-CG2 3.82Å; V32-I105 HydrophobicContact CG2-CD1 4.36Å; Y48-I105 WeakPolarHBondContact OH-CG2 3.43Å; L87-I105 HydrophobicContact CD1-CG2 3.9Å; N101-I105 WeakPolarHBondContact O-CG1 3.42Å; N101-I105 PolarHBondContact O-N 3.44Å; C102-I105 WeakPolarHBondContact O-CB 3.19Å; C102-I105 PolarHBondContact O-N 3.32Å; C102-I105 VanDerWaalsContact O-N 3.14Å; L103-I105 VanDerWaalsContact C-N 3.29Å; L103-I105 PolarHBondContact O-N 3.41Å; I105-G108 PolarHBondContact O-N 3.1Å; I105-I109 HydrophobicContact CG2-CD1 4.01Å; I105-I109 WeakPolarHBondContact O-CD1 3.04Å; I105-I109 WeakPolarHBondContact O-CG1 2.99Å; I105-I109 PolarHBondContact O-N 3.43Å
106	Y	91.5	Very high	79.5	Confident	2 Å²	2	60 Å²	60	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-53.9	-57.5	177.4	178.1	-82.4	0	0	0	111.5	C102 L103 G108 I109 Y110 P123	C102-Y106 PolarHBondContact O-N 2.87Å; L103-Y106 PolarHBondContact O-N 2.98Å; Y106-G108 PolarHBondContact O-N 3.27Å; Y106-I109 PolarHBondContact O-N 3.39Å; Y106-Y110 AromaticContact CD1-CD2 3.94Å; Y106-Y110 HydrophobicContact CD1-CD2 3.94Å; Y106-Y110 HydrophobicContact CD1-CG 4.46Å; Y106-Y110 AromaticContact CD2-CD2 3.69Å; Y106-Y110 HydrophobicContact CD2-CD2 3.69Å; Y106-Y110 AromaticContact CD2-CE2 3.62Å; Y106-Y110 HydrophobicContact CD2-CE2 3.62Å; Y106-Y110 AromaticContact CE1-CD2 3.67Å; Y106-Y110 HydrophobicContact CE1-CD2 3.67Å; Y106-Y110 HydrophobicContact CE1-CE2 4.31Å; Y106-Y110 AromaticContact CE1-CG 3.89Å; Y106-Y110 HydrophobicContact CE1-CG 3.89Å; Y106-Y110 AromaticContact CE2-CD2 3.41Å; Y106-Y110 HydrophobicContact CE2-CD2 3.41Å; Y106-Y110 VanDerWaalsContact CE2-CD2 3.41Å; Y106-Y110 AromaticContact CE2-CE2 3.19Å; Y106-Y110 HydrophobicContact CE2-CE2 3.19Å; Y106-Y110 HydrophobicContact CE2-CG 4.23Å; Y106-Y110 AromaticContact CE2-CZ 3.87Å; Y106-Y110 AromaticContact CG-CD2 3.94Å; Y106-Y110 HydrophobicContact CG-CD2 3.94Å; Y106-Y110 HydrophobicContact CG-CE2 4.35Å; Y106-Y110 AromaticContact CZ-CD2 3.4Å; Y106-Y110 AromaticContact CZ-CE2 3.58Å; Y106-Y110 AromaticContact CZ-CG 3.76Å; Y106-Y110 WeakPolarHBondContact O-CD2 3.47Å; Y106-Y110 PolarHBondContact O-N 3.24Å; Y106-P123 HydrophobicContact CD1-CB 3.5Å; Y106-P123 HydrophobicContact CD2-CB 3.87Å; Y106-P123 HydrophobicContact CE1-CB 3.58Å; Y106-P123 HydrophobicContact CE1-CG 4.5Å; Y106-P123 HydrophobicContact CE2-CB 3.93Å; Y106-P123 HydrophobicContact CG-CB 3.66Å
107	W	88.6	Confident	77.6	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-30.6	-178.2	-71.5	118.3	0	0	0	112.2	L103 I109 Q111 E120 P123 Y312 R315 S316	L103-W107 WeakPolarHBondContact O-CB 3.22Å; L103-W107 PolarHBondContact O-N 2.93Å; W107-I109 PolarHBondContact O-N 2.01Å; W107-Q111 WeakPolarHBondContact O-CB 3.46Å; W107-Q111 PolarHBondContact O-N 3.13Å; W107-E120 HydrophobicContact CH2-CB 3.92Å; W107-E120 VanDerWaalsContact CH2-OE2 3.24Å; W107-E120 WeakPolarHBondContact CH2-OE2 3.33Å; W107-E120 HydrophobicContact CZ3-CB 4.42Å; W107-P123 HydrophobicContact CZ2-CG 4.29Å; W107-Y312 HydrophobicContact CB-CD1 3.95Å; W107-Y312 HydrophobicContact CB-CE1 3.78Å; W107-Y312 AromaticContact CD1-CD1 3.43Å; W107-Y312 VanDerWaalsContact CD1-CD1 3.43Å; W107-Y312 AromaticContact CG-CD1 3.92Å; W107-Y312 HydrophobicContact CG-CD1 3.92Å; W107-Y312 HydrophobicContact CG-CE1 4.23Å; W107-R315 VanDerWaalsContact CE3-CZ 3.42Å; W107-R315 HydrophobicContact CH2-CG 4.23Å; W107-R315 HydrophobicContact CZ2-CB 4.48Å; W107-R315 HydrophobicContact CZ2-CG 3.72Å; W107-R315 VanDerWaalsContact CZ3-CZ 3.46Å; W107-S316 PolarHBondContact NE1-OG 3.38Å
108	G	87.1	Confident	75.7	Confident	17 Å²	17	58.6 Å²	58.6	18%	0.175	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-17.1	173.3	0	0	0	0	0	114.8	R104 I105 Y106	R104-G108 PolarHBondContact O-N 3.13Å; I105-G108 PolarHBondContact O-N 3.1Å; Y106-G108 PolarHBondContact O-N 3.27Å
109	I	82	Confident	74.2	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-98.5	-44.2	175.8	-61.6	155.4	0	0	0	110.5	Y48 M51 L87 Y88 I105 Y106 W107 T112	Y48-I109 HydrophobicContact CE2-CD1 4.37Å; Y48-I109 HydrophobicContact CE2-CG1 4.09Å; M51-I109 HydrophobicContact CE-CB 4.43Å; M51-I109 HydrophobicContact CE-CG1 3.82Å; L87-I109 HydrophobicContact CD1-CD1 3.71Å; L87-I109 HydrophobicContact CD2-CD1 4.38Å; L87-I109 HydrophobicContact CG-CD1 3.68Å; Y88-I109 HydrophobicContact CD2-CG2 4.1Å; I105-I109 HydrophobicContact CG2-CD1 4.01Å; I105-I109 WeakPolarHBondContact O-CD1 3.04Å; I105-I109 WeakPolarHBondContact O-CG1 2.99Å; I105-I109 PolarHBondContact O-N 3.43Å; Y106-I109 PolarHBondContact O-N 3.39Å; W107-I109 PolarHBondContact O-N 2.01Å; I109-T112 PolarHBondContact O-OG1 2.83Å; I109-T112 VanDerWaalsContact O-OG1 3.09Å
110	Y	76.9	Confident	73.2	Confident	21 Å²	21	57.7 Å²	57.7	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-82.5	-19.8	-174.1	-79.1	-87.5	0	0	0	114.1	Y88 R91 Y106 T112 L113	Y88-Y110 WeakPolarHBondContact O-CE2 3.29Å; Y88-Y110 PolarHBondContact O-OH 3.16Å; R91-Y110 PolarHBondContact NH1-OH 3Å; R91-Y110 PolarHBondContact NH2-OH 3.5Å; Y106-Y110 AromaticContact CD1-CD2 3.94Å; Y106-Y110 HydrophobicContact CD1-CD2 3.94Å; Y106-Y110 HydrophobicContact CD1-CG 4.46Å; Y106-Y110 AromaticContact CD2-CD2 3.69Å; Y106-Y110 HydrophobicContact CD2-CD2 3.69Å; Y106-Y110 AromaticContact CD2-CE2 3.62Å; Y106-Y110 HydrophobicContact CD2-CE2 3.62Å; Y106-Y110 AromaticContact CE1-CD2 3.67Å; Y106-Y110 HydrophobicContact CE1-CD2 3.67Å; Y106-Y110 HydrophobicContact CE1-CE2 4.31Å; Y106-Y110 AromaticContact CE1-CG 3.89Å; Y106-Y110 HydrophobicContact CE1-CG 3.89Å; Y106-Y110 AromaticContact CE2-CD2 3.41Å; Y106-Y110 HydrophobicContact CE2-CD2 3.41Å; Y106-Y110 VanDerWaalsContact CE2-CD2 3.41Å; Y106-Y110 AromaticContact CE2-CE2 3.19Å; Y106-Y110 HydrophobicContact CE2-CE2 3.19Å; Y106-Y110 HydrophobicContact CE2-CG 4.23Å; Y106-Y110 AromaticContact CE2-CZ 3.87Å; Y106-Y110 AromaticContact CG-CD2 3.94Å; Y106-Y110 HydrophobicContact CG-CD2 3.94Å; Y106-Y110 HydrophobicContact CG-CE2 4.35Å; Y106-Y110 AromaticContact CZ-CD2 3.4Å; Y106-Y110 AromaticContact CZ-CE2 3.58Å; Y106-Y110 AromaticContact CZ-CG 3.76Å; Y106-Y110 WeakPolarHBondContact O-CD2 3.47Å; Y106-Y110 PolarHBondContact O-N 3.24Å; Y110-T112 PolarHBondContact O-N 3Å; Y110-L113 HydrophobicContact CD1-CD1 4.06Å; Y110-L113 PolarHBondContact O-N 3.47Å; Y110-L113 VanDerWaalsContact O-N 3.09Å
111	Q	71.1	Confident	72.6	Confident	76 Å²	76	57 Å²	57	36%	0.355	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-64.5	-19.5	175.4	-177.3	160.9	4.5	0	0	113	V55 W107 L113	V55-Q111 HydrophobicContact CG1-CB 4.34Å; V55-Q111 HydrophobicContact CG1-CG 4.22Å; W107-Q111 WeakPolarHBondContact O-CB 3.46Å; W107-Q111 PolarHBondContact O-N 3.13Å; Q111-L113 PolarHBondContact O-N 2.94Å
112	T	54.3	Low	72.1	Confident	55 Å²	55	54.6 Å²	54.6	34%	0.337	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-71.5	-12.4	173.8	-27.7	0	0	0	0	113.8	V55 M79 I109 Y110	V55-T112 HydrophobicContact CG2-CG2 3.95Å; V55-T112 WeakPolarHBondContact CG2-OG1 3.45Å; M79-T112 HydrophobicContact CE-CG2 4.11Å; M79-T112 HydrophobicContact CG-CG2 3.98Å; M79-T112 HydrophobicContact SD-CG2 3.74Å; I109-T112 PolarHBondContact O-OG1 2.83Å; I109-T112 VanDerWaalsContact O-OG1 3.09Å; Y110-T112 PolarHBondContact O-N 3Å
113	L	52.7	Low	71.8	Confident	81 Å²	81	54.6 Å²	54.6	42%	0.424	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-109.2	-6.5	-170.1	-63.1	173.6	0	0	0	114.2	M79 Y88 Y110 Q111	M79-L113 HydrophobicContact CE-CD2 3.89Å; M79-L113 HydrophobicContact CE-CG 4.06Å; Y88-L113 HydrophobicContact CE2-CD1 4Å; Y110-L113 HydrophobicContact CD1-CD1 4.06Å; Y110-L113 PolarHBondContact O-N 3.47Å; Y110-L113 VanDerWaalsContact O-N 3.09Å; Q111-L113 PolarHBondContact O-N 2.94Å
114	Q	54.8	Low	71.6	Confident	77 Å²	77	55.1 Å²	55.1	36%	0.36	29%	0.29	S	S	.	.			trans	-94.5	108.9	-169.2	-68.1	-174.8	-59.3	0	0	112.4
115	G	42.6	Very low	71.1	Confident	58 Å²	58	51.9 Å²	51.9	60%	0.598	28%	0.28	S	S	*	.			trans	-71.4	-178.3	143.5	0	0	0	0	0	110.9	D117	G115-D117 PolarHBondContact O-N 3.38Å
116	N	41	Very low	70.2	Confident	180 Å²	180	56 Å²	56	96%	0.963	31%	0.307	S	S	*	.	S	Bend	trans	-72.1	37.4	-171.9	-70.8	-14.9	0	0	0	115.4
117	D	48.1	Very low	69	Low	139 Å²	139	57.7 Å²	57.7	74%	0.743	32%	0.317	S	S	*	.			trans	-71.8	135.5	178.7	-100.2	-39.6	0	0	0	112.5	G115 L119	G115-D117 PolarHBondContact O-N 3.38Å; D117-L119 VanDerWaalsContact C-N 3.26Å; D117-L119 PolarHBondContact O-N 3Å
118	F	49.2	Very low	67.6	Low	99 Å²	99	63.2 Å²	63.2	43%	0.434	35%	0.347	S	S	.	.	S	Bend	trans	-66.5	-25.3	-176.2	-178.6	-103.7	0	0	0	113.3
119	L	62	Low	66	Low	84 Å²	84	70.7 Å²	70.7	44%	0.44	38%	0.375	S	S	.	.			trans	-110.3	99	-174.4	-64	174.3	0	0	0	111.5	D117 F322 M326	D117-L119 VanDerWaalsContact C-N 3.26Å; D117-L119 PolarHBondContact O-N 3Å; L119-F322 HydrophobicContact CD2-CB 4.15Å; L119-M326 HydrophobicContact CD1-CE 3.66Å; L119-M326 HydrophobicContact CD2-CE 3.94Å; L119-M326 HydrophobicContact CG-CE 4.47Å
120	E	72.9	Confident	64.6	Low	23 Å²	23	80.8 Å²	80.8	11%	0.107	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-75	135.7	170.8	-45.3	-170.6	141.3	0	0	110.6	W107 R315 A319	W107-E120 HydrophobicContact CH2-CB 3.92Å; W107-E120 VanDerWaalsContact CH2-OE2 3.24Å; W107-E120 WeakPolarHBondContact CH2-OE2 3.33Å; W107-E120 HydrophobicContact CZ3-CB 4.42Å; E120-R315 IonicContact OE1-CZ 3.66Å; E120-R315 VanDerWaalsContact OE1-CZ 3.3Å; E120-R315 IonicContact OE1-NE 3.51Å; E120-R315 PolarHBondContact OE1-NE 3.23Å; E120-R315 VanDerWaalsContact OE1-NE 3.08Å; E120-R315 IonicContact OE1-NH2 2.67Å; E120-R315 PolarHBondContact OE1-NH2 3.22Å; E120-R315 VanDerWaalsContact OE2-CG 3.26Å; E120-R315 WeakPolarHBondContact OE2-CG 3.1Å; E120-R315 IonicContact OE2-CZ 3.37Å; E120-R315 IonicContact OE2-NE 3.9Å; E120-R315 PolarHBondContact OE2-NE 3.34Å; E120-R315 IonicContact OE2-NH2 3.69Å; E120-A319 HydrophobicContact CB-CB 4.06Å
121	E	80.3	Confident	63.5	Low	102 Å²	102	82.7 Å²	82.7	48%	0.477	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-63.7	141.1	176.4	-153.7	-154.2	157.2	0	0	111	R91 P123	R91-E121 IonicContact CZ-OE1 3.6Å; R91-E121 IonicContact CZ-OE2 3.37Å; R91-E121 IonicContact NE-OE1 3.74Å; R91-E121 IonicContact NH2-OE1 2.9Å; R91-E121 PolarHBondContact NH2-OE1 3.02Å; R91-E121 IonicContact NH2-OE2 3.27Å; R91-E121 PolarHBondContact NH2-OE2 3.12Å; E121-P123 WeakPolarHBondContact O-CD 3.41Å
122	S	85.1	Confident	62.7	Low	11 Å²	11	80.2 Å²	80.2	8%	0.077	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-68.9	128.2	178.8	-176.5	0	0	0	0	111.2	R91 Y124 D320	R91-S122 PolarHBondContact NE-O 3.13Å; S122-Y124 VanDerWaalsContact C-N 3.26Å; S122-Y124 PolarHBondContact O-N 2.99Å; S122-Y124 PolarHBondContact OG-N 3.08Å; S122-D320 WeakPolarHBondContact CB-OD1 3.34Å; S122-D320 PolarHBondContact OG-OD1 3.3Å
123	P	88.8	Confident	62.6	Low	0 Å²	0	80.5 Å²	80.5	0%	0	42%	0.415	C	S	.	.			trans	-77.8	-10.3	176.5	29.7	-32.9	0	0	0	113.4	R91 C92 L103 Y106 W107 E121 S316	R91-P123 CarbonylContact C-O 3.53Å; R91-P123 WeakPolarHBondContact CA-O 3.24Å; R91-P123 VanDerWaalsContact CD-O 3.31Å; R91-P123 WeakPolarHBondContact CD-O 3.32Å; C92-P123 PolarHBondContact N-O 3.47Å; L103-P123 HydrophobicContact CD2-CB 4.12Å; L103-P123 HydrophobicContact CD2-CG 4.03Å; Y106-P123 HydrophobicContact CD1-CB 3.5Å; Y106-P123 HydrophobicContact CD2-CB 3.87Å; Y106-P123 HydrophobicContact CE1-CB 3.58Å; Y106-P123 HydrophobicContact CE1-CG 4.5Å; Y106-P123 HydrophobicContact CE2-CB 3.93Å; Y106-P123 HydrophobicContact CG-CB 3.66Å; W107-P123 HydrophobicContact CZ2-CG 4.29Å; E121-P123 WeakPolarHBondContact O-CD 3.41Å; P123-S316 VanDerWaalsContact CG-CB 3.43Å; P123-S316 VanDerWaalsContact CG-OG 3.24Å; P123-S316 WeakPolarHBondContact CG-OG 3.32Å
124	Y	89.4	Confident	62.7	Low	11 Å²	11	80.3 Å²	80.3	4%	0.043	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-84.3	153.1	-179.5	-66.2	-71	0	0	0	111.5	C92 E99 L103 S122 R317 D320	C92-Y124 HydrophobicContact CB-CD1 4.14Å; C92-Y124 HydrophobicContact CB-CE1 4.28Å; C92-Y124 CarbonylContact O-C 3.57Å; C92-Y124 VanDerWaalsContact O-CA 3.29Å; C92-Y124 WeakPolarHBondContact O-CA 3.3Å; E99-Y124 HydrophobicContact CG-CE1 4.47Å; E99-Y124 WeakPolarHBondContact OE1-CE1 3.31Å; E99-Y124 PolarHBondContact OE1-OH 2.88Å; L103-Y124 VanDerWaalsContact CD1-OH 3.32Å; L103-Y124 WeakPolarHBondContact CD1-OH 3.38Å; L103-Y124 HydrophobicContact CD2-CE1 3.92Å; L103-Y124 HydrophobicContact CD2-CE2 4.48Å; S122-Y124 VanDerWaalsContact C-N 3.26Å; S122-Y124 PolarHBondContact O-N 2.99Å; S122-Y124 PolarHBondContact OG-N 3.08Å; Y124-R317 VanDerWaalsContact CE1-NH1 3.26Å; Y124-R317 VanDerWaalsContact CE2-NH1 3.31Å; Y124-R317 PolarHBondContact OH-NH1 3.05Å; Y124-D320 HydrophobicContact CD2-CB 4.18Å
125	E	83.5	Confident	62.6	Low	43 Å²	43	76.8 Å²	76.8	20%	0.201	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-66	137	167.4	-71.8	-179.9	-165.6	0	0	110.2	R91 C92 K93	R91-E125 HydrophobicContact CB-CG 3.59Å; R91-E125 HydrophobicContact CG-CG 4.48Å; C92-E125 PolarHBondContact O-N 3.26Å; K93-E125 WeakPolarHBondContact CE-OE1 3.24Å; K93-E125 WeakPolarHBondContact CE-OE2 3.31Å; K93-E125 IonicContact NZ-OE1 2.91Å; K93-E125 PolarHBondContact NZ-OE1 2.65Å; K93-E125 IonicContact NZ-OE2 3.73Å; K93-E125 PolarHBondContact NZ-OE2 3.34Å
126	P	73.4	Confident	63.2	Low	95 Å²	95	79.6 Å²	79.6	62%	0.617	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-53.3	147.4	166.2	-24.2	34.1	0	0	0	111.1	N128	P126-N128 PolarHBondContact O-N 2.97Å
127	V	66.3	Low	63.5	Low	36 Å²	36	76.7 Å²	76.7	22%	0.218	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-68.9	130.1	-173.8	-173.2	0	0	0	0	110.2	L131 D342 L345	V127-L131 HydrophobicContact CG1-CB 3.27Å; V127-L131 HydrophobicContact CG1-CD1 3.74Å; V127-L131 HydrophobicContact CG1-CG 4.1Å; V127-D342 WeakPolarHBondContact CB-OD1 3.31Å; V127-D342 WeakPolarHBondContact CG2-OD1 3.3Å; V127-L345 HydrophobicContact CG2-CD2 3.33Å
128	N	58.8	Low	63.4	Low	119 Å²	119	70.7 Å²	70.7	64%	0.636	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-60.8	142.5	175.6	-82.5	-42.9	0	0	0	111.1	P126 R130 L131	P126-N128 PolarHBondContact O-N 2.97Å; N128-R130 PolarHBondContact O-N 3.16Å; N128-L131 PolarHBondContact O-N 3.12Å
129	K	53.7	Low	63.3	Low	173 Å²	173	69 Å²	69	75%	0.752	34%	0.342	S	S	*	.	H	α-helix	trans	-48.4	-33.9	179.8	-67.5	-172.4	175.6	-174.1	0	114.5	L131 S132 D133	K129-L131 PolarHBondContact O-N 3.29Å; K129-S132 WeakPolarHBondContact CA-OG 3.43Å; K129-S132 PolarHBondContact O-N 3.08Å; K129-S132 VanDerWaalsContact O-N 3.11Å; K129-S132 PolarHBondContact O-OG 3.37Å; K129-D133 PolarHBondContact O-N 2.81Å; K129-D133 VanDerWaalsContact O-OD2 3.07Å
130	R	51.9	Low	62.4	Low	213 Å²	213	69.9 Å²	69.9	80%	0.804	35%	0.346	S	S	*	.	H	α-helix	trans	-59.8	-25.5	175.3	-74.3	-170.7	176	-170.5	-0.9	114.9	N128 D133 I134	N128-R130 PolarHBondContact O-N 3.16Å; R130-D133 WeakPolarHBondContact CA-OD2 3.28Å; R130-I134 WeakPolarHBondContact O-CG1 3.34Å; R130-I134 PolarHBondContact O-N 2.68Å
131	L	53.9	Low	61.1	Low	62 Å²	62	74.1 Å²	74.1	33%	0.325	37%	0.369	S	S	.	.	H	α-helix	trans	-79.3	-43.1	173.8	-106	160.5	0	0	0	110.3	V127 N128 K129 D133 I134 F135 P260	V127-L131 HydrophobicContact CG1-CB 3.27Å; V127-L131 HydrophobicContact CG1-CD1 3.74Å; V127-L131 HydrophobicContact CG1-CG 4.1Å; N128-L131 PolarHBondContact O-N 3.12Å; K129-L131 PolarHBondContact O-N 3.29Å; L131-D133 PolarHBondContact O-N 2.94Å; L131-I134 HydrophobicContact CD2-CD1 4.13Å; L131-I134 HydrophobicContact CG-CD1 4.44Å; L131-I134 WeakPolarHBondContact O-CA 3.49Å; L131-I134 VanDerWaalsContact O-CB 3.32Å; L131-I134 WeakPolarHBondContact O-CB 3.39Å; L131-I134 PolarHBondContact O-N 2.98Å; L131-F135 HydrophobicContact CD2-CE2 4.3Å; L131-F135 WeakPolarHBondContact O-CD2 3.27Å; L131-F135 PolarHBondContact O-N 2.94Å; L131-F135 VanDerWaalsContact O-N 3.12Å; L131-P260 HydrophobicContact CD2-CG 4.11Å
132	S	54.5	Low	59.5	Low	23 Å²	23	78.1 Å²	78.1	16%	0.161	39%	0.387	C	S	.	.	H	α-helix	trans	-57.9	-29.2	169.2	46.7	0	0	0	0	112.8	K129 F135 R136	K129-S132 WeakPolarHBondContact CA-OG 3.43Å; K129-S132 PolarHBondContact O-N 3.08Å; K129-S132 VanDerWaalsContact O-N 3.11Å; K129-S132 PolarHBondContact O-OG 3.37Å; S132-F135 WeakPolarHBondContact O-CB 3.5Å; S132-F135 PolarHBondContact O-N 3.04Å; S132-R136 WeakPolarHBondContact O-CG 3.41Å; S132-R136 PolarHBondContact O-N 2.87Å
133	D	52.5	Low	57.1	Low	62 Å²	62	80.8 Å²	80.8	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-69.9	-28.7	171.5	-56.6	-37.7	0	0	0	112.9	K129 R130 L131 R136 L137	K129-D133 PolarHBondContact O-N 2.81Å; K129-D133 VanDerWaalsContact O-OD2 3.07Å; R130-D133 WeakPolarHBondContact CA-OD2 3.28Å; L131-D133 PolarHBondContact O-N 2.94Å; D133-R136 IonicContact OD1-NH1 3.33Å; D133-R136 PolarHBondContact OD1-NH1 3.42Å; D133-L137 WeakPolarHBondContact O-CD1 3.41Å; D133-L137 VanDerWaalsContact O-CG 3.22Å; D133-L137 WeakPolarHBondContact O-CG 3.46Å; D133-L137 PolarHBondContact O-N 3.26Å
134	I	53	Low	54.5	Low	76 Å²	76	84.4 Å²	84.4	39%	0.39	45%	0.454	S	S	.	.	H	α-helix	trans	-70.2	-33.6	170.4	-66.5	166.3	0	0	0	111.1	R130 L131 L137	R130-I134 WeakPolarHBondContact O-CG1 3.34Å; R130-I134 PolarHBondContact O-N 2.68Å; L131-I134 HydrophobicContact CD2-CD1 4.13Å; L131-I134 HydrophobicContact CG-CD1 4.44Å; L131-I134 WeakPolarHBondContact O-CA 3.49Å; L131-I134 VanDerWaalsContact O-CB 3.32Å; L131-I134 WeakPolarHBondContact O-CB 3.39Å; L131-I134 PolarHBondContact O-N 2.98Å; I134-L137 PolarHBondContact O-N 3.4Å
135	F	54.2	Low	51.4	Low	3 Å²	3	92.3 Å²	92.3	1%	0.013	49%	0.491	C	S	.	.	H	α-helix	trans	-68.1	-46.2	174.8	-77.3	-83.4	0	0	0	111.6	L131 S132 L137 A138 P260 Y264 A341 L344 F403 D408	L131-F135 HydrophobicContact CD2-CE2 4.3Å; L131-F135 WeakPolarHBondContact O-CD2 3.27Å; L131-F135 PolarHBondContact O-N 2.94Å; L131-F135 VanDerWaalsContact O-N 3.12Å; S132-F135 WeakPolarHBondContact O-CB 3.5Å; S132-F135 PolarHBondContact O-N 3.04Å; F135-L137 PolarHBondContact O-N 2.69Å; F135-L137 VanDerWaalsContact O-N 3.12Å; F135-A138 PolarHBondContact O-N 2.9Å; F135-P260 HydrophobicContact CZ-CB 4.32Å; F135-Y264 AromaticContact CE1-CD2 3.5Å; F135-Y264 HydrophobicContact CE1-CD2 3.5Å; F135-Y264 AromaticContact CE1-CE2 3.33Å; F135-Y264 HydrophobicContact CE1-CE2 3.33Å; F135-Y264 AromaticContact CZ-CD2 3.99Å; F135-Y264 HydrophobicContact CZ-CD2 3.99Å; F135-Y264 AromaticContact CZ-CE2 3.39Å; F135-Y264 HydrophobicContact CZ-CE2 3.39Å; F135-A341 HydrophobicContact CB-CB 4.02Å; F135-A341 HydrophobicContact CD1-CB 4.02Å; F135-A341 HydrophobicContact CD2-CB 3.24Å; F135-A341 HydrophobicContact CE1-CB 4.29Å; F135-A341 HydrophobicContact CE2-CB 3.61Å; F135-A341 HydrophobicContact CG-CB 3.5Å; F135-A341 VanDerWaalsContact CG-CB 3.5Å; F135-A341 HydrophobicContact CZ-CB 4.13Å; F135-L344 HydrophobicContact CE1-CB 4.46Å; F135-L344 HydrophobicContact CE1-CD1 4.36Å; F135-F403 HydrophobicContact CD1-CD2 4.25Å; F135-F403 HydrophobicContact CD1-CE2 4.37Å; F135-D408 WeakPolarHBondContact CB-OD2 3.04Å
136	R	54	Low	48.8	Very low	118 Å²	118	94.6 Å²	94.6	45%	0.445	51%	0.51	S	S	.	.	H	α-helix	trans	-58	-21.9	170.5	-70.6	164	167.8	-177.8	-12.6	114.6	S132 D133 I409	S132-R136 WeakPolarHBondContact O-CG 3.41Å; S132-R136 PolarHBondContact O-N 2.87Å; D133-R136 IonicContact OD1-NH1 3.33Å; D133-R136 PolarHBondContact OD1-NH1 3.42Å; R136-I409 WeakPolarHBondContact O-CD1 3.34Å; R136-I409 WeakPolarHBondContact O-CG1 3.4Å
137	L	47	Very low	46.5	Very low	119 Å²	119	102.9 Å²	102.9	62%	0.623	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	7	177.2	-69.6	170.5	0	0	0	113.7	D133 I134 F135	D133-L137 WeakPolarHBondContact O-CD1 3.41Å; D133-L137 VanDerWaalsContact O-CG 3.22Å; D133-L137 WeakPolarHBondContact O-CG 3.46Å; D133-L137 PolarHBondContact O-N 3.26Å; I134-L137 PolarHBondContact O-N 3.4Å; F135-L137 PolarHBondContact O-N 2.69Å; F135-L137 VanDerWaalsContact O-N 3.12Å
138	A	47	Very low	44.5	Very low	13 Å²	13	105.7 Å²	105.7	11%	0.107	55%	0.55	C	S	.	*			trans	-103.1	78.1	170.5	0	0	0	0	0	109.6	F135 F403	F135-A138 PolarHBondContact O-N 2.9Å; A138-F403 HydrophobicContact CB-CE2 3.89Å; A138-F403 HydrophobicContact CB-CZ 4.37Å
139	P	46.5	Very low	43.3	Very low	63 Å²	63	106 Å²	106	41%	0.409	56%	0.561	S	S	.	*				-142.8	109.6	93.6	40.4	-28	0	0	0	113.7	G406 I409	P139-G406 WeakPolarHBondContact CG-O 3.35Å; P139-I409 HydrophobicContact CG-CD1 4.4Å
140	I	43.9	Very low	42.1	Very low	103 Å²	103	102.9 Å²	102.9	53%	0.528	56%	0.562	S	S	.	*			trans	-132.9	81.3	158.4	-53	-179.4	0	0	0	107.1	E142	I140-E142 VanDerWaalsContact CG2-O 3.28Å; I140-E142 WeakPolarHBondContact CG2-O 3.2Å
141	L	46.2	Very low	41.1	Very low	112 Å²	112	97.7 Å²	97.7	59%	0.586	57%	0.565	S	S	*	*	S	Bend	trans	-113.5	1.6	155.7	-71.2	178.6	0	0	0	111.6	T210 A214	L141-T210 HydrophobicContact CD1-CG2 4.09Å; L141-T210 HydrophobicContact CD2-CG2 4.49Å; L141-A214 HydrophobicContact CD2-CB 4.35Å
142	E	46.4	Very low	40.1	Very low	185 Å²	185	101.4 Å²	101.4	86%	0.864	59%	0.59	S	S	*	*			trans	-101.9	123.2	158.2	-65.4	-169	157.7	0	0	107.5	I140	I140-E142 VanDerWaalsContact CG2-O 3.28Å; I140-E142 WeakPolarHBondContact CG2-O 3.2Å
143	G	33.8	Very low	38.8	Very low	68 Å²	68	105.9 Å²	105.9	70%	0.701	62%	0.621	S	S	*	*			trans	154.1	49	-168.7	0	0	0	0	0	113	E145	G143-E145 PolarHBondContact O-N 3.45Å
144	G	34.3	Very low	37.7	Very low	75 Å²	75	107.4 Å²	107.4	77%	0.773	64%	0.642	S	S	*	*			trans	-73.8	102.5	154.3	0	0	0	0	0	107.4	P146	G144-P146 VanDerWaalsContact O-CD 3.29Å; G144-P146 WeakPolarHBondContact O-CD 3.32Å
145	E	24.3	Very low	36.9	Very low	178 Å²	178	110.4 Å²	110.4	83%	0.832	67%	0.667	S	S	*	*			trans	-69.5	117.2	169.7	-90.9	-81.3	112.1	0	0	109	G143	G143-E145 PolarHBondContact O-N 3.45Å
146	P	28.5	Very low	35.7	Very low	91 Å²	91	114 Å²	114	59%	0.591	71%	0.705	S	S	*	*			trans	-73.8	126.3	165.6	-2.9	21.4	0	0	0	107.6	G144 S148	G144-P146 VanDerWaalsContact O-CD 3.29Å; G144-P146 WeakPolarHBondContact O-CD 3.32Å; P146-S148 VanDerWaalsContact C-N 3.3Å; P146-S148 PolarHBondContact O-N 3.48Å; P146-S148 PolarHBondContact O-OG 3.24Å; P146-S148 VanDerWaalsContact O-OG 3.13Å
147	W	25.2	Very low	34.5	Very low	268 Å²	268	120.8 Å²	120.8	100%	1.015	73%	0.73	S	S	*	*			trans	-58.9	95.3	171.3	-90.7	-35.9	0	0	0	110.4	S149	W147-S149 PolarHBondContact O-N 3.19Å
148	S	24.8	Very low	33.7	Very low	95 Å²	95	119 Å²	119	66%	0.664	74%	0.741	S	S	*	*			trans	-92.8	101.8	178.3	-60.7	0	0	0	0	108	P146 S150	P146-S148 VanDerWaalsContact C-N 3.3Å; P146-S148 PolarHBondContact O-N 3.48Å; P146-S148 PolarHBondContact O-OG 3.24Å; P146-S148 VanDerWaalsContact O-OG 3.13Å; S148-S150 PolarHBondContact O-N 3.45Å; S148-S150 PolarHBondContact O-OG 2.72Å
149	S	34	Very low	32.8	Very low	125 Å²	125	123.5 Å²	123.5	87%	0.874	78%	0.778	S	S	*	*			trans	-43.9	109.4	-178.8	-50.1	0	0	0	0	112.4	W147	W147-S149 PolarHBondContact O-N 3.19Å
150	S	27.8	Very low	32	Very low	109 Å²	109	125.5 Å²	125.5	76%	0.762	80%	0.8	S	S	*	*			trans	-113.1	105.7	169.1	-65.5	0	0	0	0	108.7	S148	S148-S150 PolarHBondContact O-N 3.45Å; S148-S150 PolarHBondContact O-OG 2.72Å
151	A	32.3	Very low	31.3	Very low	104 Å²	104	130.2 Å²	130.2	86%	0.86	82%	0.819	S	S	*	*			trans	-67	132.9	177.2	0	0	0	0	0	110.2
152	T	31.6	Very low	30.4	Very low	139 Å²	139	128.3 Å²	128.3	85%	0.853	83%	0.827	S	S	*	*			trans	-122.8	104.6	163.7	-51.4	0	0	0	0	108.5
153	S	28.6	Very low	29.6	Very low	118 Å²	118	131 Å²	131	83%	0.825	83%	0.83	S	S	*	*			trans	-71.8	126.7	175.8	53.3	0	0	0	0	111.8
154	A	29.3	Very low	29.3	Very low	93 Å²	93	134.9 Å²	134.9	77%	0.769	84%	0.839	S	S	*	*			trans	-145.2	138	154.4	0	0	0	0	0	109.1
155	P	35.1	Very low	29.1	Very low	139 Å²	139	135.7 Å²	135.7	90%	0.903	83%	0.833	S	S	*	*			trans	-89.5	135.6	-167.1	33.7	-34.3	0	0	0	113.2
156	G	28.5	Very low	29.3	Very low	79 Å²	79	136 Å²	136	81%	0.814	84%	0.835	S	S	*	*			trans	-138.2	119.7	170	0	0	0	0	0	110.7
157	R	30.3	Very low	29.3	Very low	260 Å²	260	135.8 Å²	135.8	98%	0.981	84%	0.841	S	S	*	*			trans	-86.2	147	-180	-61.3	178.6	178.5	-154.4	-0.3	110.8
158	G	28.7	Very low	29.5	Very low	82 Å²	82	133.2 Å²	133.2	85%	0.845	84%	0.837	S	S	*	*			trans	159.1	103.7	165	0	0	0	0	0	113.1
159	A	29	Very low	29.7	Very low	108 Å²	108	137.7 Å²	137.7	89%	0.893	85%	0.847	S	S	*	*			trans	-97.7	144.7	177.8	0	0	0	0	0	111.8
160	A	30.3	Very low	29.4	Very low	104 Å²	104	135.5 Å²	135.5	86%	0.86	84%	0.837	S	S	*	*			trans	-161.9	148.6	148.6	0	0	0	0	0	110.5
161	Q	28.8	Very low	29.5	Very low	202 Å²	202	138.3 Å²	138.3	94%	0.944	84%	0.841	S	S	*	*			trans	-90.2	165.8	-178.1	-58.4	140.2	-46.6	0	0	111.6
162	G	27	Very low	29.4	Very low	73 Å²	73	141.4 Å²	141.4	75%	0.753	84%	0.843	S	S	*	*			trans	151.9	107.3	143.1	0	0	0	0	0	119.2
163	R	28.6	Very low	29.2	Very low	241 Å²	241	138.3 Å²	138.3	91%	0.909	84%	0.838	S	S	*	*			trans	58.1	109.4	145.9	-68	179.9	175.2	149.9	0.4	119.8
164	V	28	Very low	29.2	Very low	149 Å²	149	145.2 Å²	145.2	90%	0.903	85%	0.846	S	S	*	*			trans	-90.7	133	141.3	172.5	0	0	0	0	108.1
165	S	30.6	Very low	29	Very low	93 Å²	93	144.4 Å²	144.4	65%	0.65	85%	0.847	S	S	*	*			trans	-113.1	123.8	168.1	-67.2	0	0	0	0	109.8
166	Q	28.7	Very low	28.7	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	84%	0.844	S	S	*	*				14.4	149.8	124.3	-68.1	173	-23.9	0	0	117.9
167	A	27.3	Very low	29.6	Very low	87 Å²	87	145.5 Å²	145.5	72%	0.719	84%	0.843	S	S	*	*			cis	164.4	146.4	-8.7	0	0	0	0	0	104.5
168	K	30.3	Very low	29.4	Very low	213 Å²	213	138.5 Å²	138.5	93%	0.926	83%	0.834	S	S	*	*			trans	-167.6	106.4	151.2	-114.9	172.8	-177.2	-176.3	0	113.3
169	E	28.4	Very low	29.3	Very low	189 Å²	189	141 Å²	141	88%	0.883	83%	0.833	S	S	*	*			trans	-64.5	173.5	150.8	-71.9	173.6	127.2	0	0	110.5
170	A	28.2	Very low	29.1	Very low	80 Å²	80	143.3 Å²	143.3	66%	0.661	83%	0.825	S	S	*	*			cis	-173.8	-177.5	-22.5	0	0	0	0	0	106.8
171	I	30.7	Very low	28.9	Very low	167 Å²	167	146.7 Å²	146.7	86%	0.856	83%	0.828	S	S	*	*			trans	157.3	151.7	135.1	-80.1	162.1	0	0	0	112.6
172	L	29.4	Very low	28.8	Very low	170 Å²	170	144.2 Å²	144.2	89%	0.89	82%	0.816	S	S	*	*			trans	-90.3	164.9	-165.1	-69.6	74.4	0	0	0	116.1
173	G	27.1	Very low	28.8	Very low	74 Å²	74	147.5 Å²	147.5	76%	0.763	82%	0.816	S	S	*	*			trans	164.4	87.3	153.8	0	0	0	0	0	113.1
174	R	27.9	Very low	29.7	Very low	262 Å²	262	140.4 Å²	140.4	99%	0.989	80%	0.802	S	S	*	*				81.1	108.8	77.7	-162.8	-176	-141.2	-113.7	6	114.2
175	G	26.3	Very low	29.7	Very low	76 Å²	76	138.8 Å²	138.8	78%	0.784	80%	0.797	S	S	*	*			trans	161.9	113.3	167.7	0	0	0	0	0	116
176	S	28.3	Very low	29.9	Very low	121 Å²	121	144.9 Å²	144.9	85%	0.846	81%	0.805	S	S	*	*			trans	-138.6	-174.5	168.6	-40	0	0	0	0	107.6
177	P	48.3	Very low	30.1	Very low	120 Å²	120	142.6 Å²	142.6	78%	0.779	80%	0.799	S	S	*	*			cis	-132.7	-174.9	-14.1	41.2	-24.4	0	0	0	113.3
178	S	24.6	Very low	30.3	Very low	114 Å²	114	147.5 Å²	147.5	80%	0.797	80%	0.799	S	S	*	*			trans	158.2	141.5	153.5	-81.8	0	0	0	0	110.7
179	T	26.7	Very low	30.4	Very low	134 Å²	134	147.3 Å²	147.3	82%	0.822	79%	0.793	S	S	*	*			cis	-151.3	160.9	-10.9	-61.9	0	0	0	0	108.4
180	Q	25.6	Very low	30.4	Very low	156 Å²	156	142 Å²	142	73%	0.729	78%	0.782	S	S	*	*			trans	-75.4	161.5	-175	-59.4	178.7	-17.5	0	0	115.4
181	L	26.9	Very low	30.5	Very low	175 Å²	175	146.8 Å²	146.8	92%	0.916	79%	0.79	S	S	*	*			trans	-146	111.2	132.5	-149.3	76.7	0	0	0	111.2
182	Q	26.2	Very low	31.2	Very low	151 Å²	151	144.1 Å²	144.1	71%	0.706	78%	0.783	S	S	*	*			trans	-98.9	167.2	155.3	-69.4	171.1	-31.9	0	0	106.1
183	D	27.4	Very low	31.5	Very low	141 Å²	141	143.7 Å²	143.7	75%	0.754	78%	0.782	S	S	*	*			cis	-168.9	-151.4	45.2	-159.7	27.2	0	0	0	110.1
184	P	46.2	Very low	31.6	Very low	93 Å²	93	149.8 Å²	149.8	60%	0.604	78%	0.782	S	S	*	*				-130.6	176.3	-109.3	43.2	-27.1	0	0	0	117.5
185	S	27.8	Very low	32.2	Very low	114 Å²	114	142.3 Å²	142.3	80%	0.797	78%	0.776	S	S	*	*			trans	171.9	150.2	132.9	-85.8	0	0	0	0	113.4
186	R	35.3	Very low	32.6	Very low	221 Å²	221	144 Å²	144	83%	0.834	77%	0.766	S	S	*	*			cis	-172.1	120.6	-22.7	-163.9	-175.8	-169	-175.3	6	110.5
187	N	32.3	Very low	33	Very low	137 Å²	137	145.9 Å²	145.9	73%	0.733	77%	0.766	S	S	*	*			trans	58.5	152.8	156.2	-97	-34.8	0	0	0	120.1
188	R	33.5	Very low	32.4	Very low	189 Å²	189	143.9 Å²	143.9	71%	0.713	77%	0.767	S	S	*	*			cis	-162.2	144.2	35.2	-146.7	178.6	-66.4	-147.9	6	115.2
189	R	30.6	Very low	32.6	Very low	209 Å²	209	147.2 Å²	147.2	79%	0.789	77%	0.77	S	S	*	*			trans	75.1	116.4	150.9	-96	-178	-75.7	-138.8	6.3	121.8
190	A	28.9	Very low	33.1	Very low	79 Å²	79	145.9 Å²	145.9	65%	0.653	76%	0.764	S	S	*	*			trans	-72.2	163.6	150.3	0	0	0	0	0	110.6
191	H	30.9	Very low	33.8	Very low	179 Å²	179	143.3 Å²	143.3	83%	0.829	77%	0.769	S	S	*	*				-170.9	-179.1	57.3	-102.4	-84.4	0	0	0	108.9
192	P	44.3	Very low	34.6	Very low	111 Å²	111	140.6 Å²	140.6	72%	0.721	76%	0.76	S	S	*	*			cis	-126.7	-175.5	-7.6	32.2	-11.6	0	0	0	114.1
193	N	36.2	Very low	35.7	Very low	161 Å²	161	137.4 Å²	137.4	86%	0.861	76%	0.759	S	S	*	*			trans	-57.1	134.2	175.1	-70.1	-19.8	0	0	0	113.7
194	W	29.3	Very low	37.1	Very low	202 Å²	202	139.7 Å²	139.7	77%	0.765	76%	0.757	S	S	*	*			trans	-126.7	103.3	143.6	70.7	-64.6	0	0	0	107.7	I196	W194-I196 HydrophobicContact CE3-CB 3.6Å; W194-I196 HydrophobicContact CE3-CD1 3.68Å; W194-I196 HydrophobicContact CE3-CG1 3.61Å; W194-I196 HydrophobicContact CZ3-CB 3.59Å; W194-I196 HydrophobicContact CZ3-CD1 3.95Å; W194-I196 HydrophobicContact CZ3-CG1 4.02Å; W194-I196 HydrophobicContact CZ3-CG2 4.14Å; W194-I196 PolarHBondContact O-N 3.49Å
195	A	40.9	Very low	38	Very low	105 Å²	105	139 Å²	139	87%	0.868	75%	0.746	S	S	*	*			trans	-82.9	94.2	169.3	0	0	0	0	0	107.4
196	I	35.4	Very low	40.7	Very low	113 Å²	113	134.6 Å²	134.6	58%	0.579	71%	0.713	S	S	*	*			trans	-118.9	122.5	164.7	-66.8	-168.7	0	0	0	107.9	W194	W194-I196 HydrophobicContact CE3-CB 3.6Å; W194-I196 HydrophobicContact CE3-CD1 3.68Å; W194-I196 HydrophobicContact CE3-CG1 3.61Å; W194-I196 HydrophobicContact CZ3-CB 3.59Å; W194-I196 HydrophobicContact CZ3-CD1 3.95Å; W194-I196 HydrophobicContact CZ3-CG1 4.02Å; W194-I196 HydrophobicContact CZ3-CG2 4.14Å; W194-I196 PolarHBondContact O-N 3.49Å
197	L	35.4	Very low	43.2	Very low	159 Å²	159	127.3 Å²	127.3	83%	0.832	69%	0.691	S	S	*	*			trans	14.5	107.4	155.1	-67.7	154.3	0	0	0	114.9	E199	L197-E199 PolarHBondContact O-N 3.23Å
198	G	35.3	Very low	46.1	Very low	78 Å²	78	121 Å²	121	80%	0.804	66%	0.657	S	S	*	*			trans	-60.1	106.6	165.2	0	0	0	0	0	109.6
199	E	29.1	Very low	48.9	Very low	184 Å²	184	114.7 Å²	114.7	86%	0.86	64%	0.637	S	S	*	*			trans	-56.6	126.8	159.9	-70.7	-166.6	124.1	0	0	107.3	L197 A201	L197-E199 PolarHBondContact O-N 3.23Å; E199-A201 PolarHBondContact O-N 2.96Å
200	P	38.4	Very low	51.8	Low	106 Å²	106	106.2 Å²	106.2	69%	0.688	61%	0.609	S	S	*	*			trans	-61.5	128.7	170.1	26.8	-31.8	0	0	0	107	V202	P200-V202 PolarHBondContact O-N 3.02Å
201	A	38.9	Very low	54.8	Low	102 Å²	102	102.7 Å²	102.7	84%	0.843	58%	0.58	S	S	*	*			trans	-65.1	83.1	168.5	0	0	0	0	0	108.8	E199 A203	E199-A201 PolarHBondContact O-N 2.96Å; A201-A203 PolarHBondContact O-N 3.07Å
202	V	45.3	Very low	57.9	Low	119 Å²	119	94.5 Å²	94.5	72%	0.721	54%	0.543	S	S	*	.			trans	-65.6	81.3	158.8	-177.1	0	0	0	0	105.3	P200 R204	P200-V202 PolarHBondContact O-N 3.02Å; V202-R204 PolarHBondContact O-N 2.04Å
203	A	47.9	Very low	60.3	Low	83 Å²	83	94 Å²	94	69%	0.686	53%	0.529	S	S	*	.			trans	-55.8	105.5	170.3	0	0	0	0	0	106.3	A201 E205	A201-A203 PolarHBondContact O-N 3.07Å; A203-E205 WeakPolarHBondContact O-CA 3.46Å; A203-E205 PolarHBondContact O-N 2.03Å
204	R	58.1	Low	63	Low	190 Å²	190	87.4 Å²	87.4	72%	0.717	50%	0.498	S	S	*	.			trans	-48.3	102.6	-170	-73.1	-176.8	175.6	-179.4	-0.4	109.4	V202 N206	V202-R204 PolarHBondContact O-N 2.04Å; R204-N206 PolarHBondContact O-N 3.35Å
205	E	64.9	Low	66.2	Low	79 Å²	79	77.8 Å²	77.8	37%	0.369	46%	0.461	S	S	.	.			trans	-82.8	111.9	-164.6	-159.7	174.7	163.2	0	0	110	A203 N207 L209 T210 K213	A203-E205 WeakPolarHBondContact O-CA 3.46Å; A203-E205 PolarHBondContact O-N 2.03Å; E205-N207 PolarHBondContact O-N 3.18Å; E205-L209 HydrophobicContact CG-CD2 4.41Å; E205-T210 WeakPolarHBondContact CG-OG1 3.46Å; E205-T210 PolarHBondContact OE1-OG1 3.18Å; E205-K213 VanDerWaalsContact OE1-CD 3.24Å; E205-K213 WeakPolarHBondContact OE1-CD 3.24Å; E205-K213 WeakPolarHBondContact OE1-CE 3.48Å; E205-K213 IonicContact OE1-NZ 3.03Å; E205-K213 PolarHBondContact OE1-NZ 3.05Å; E205-K213 IonicContact OE2-NZ 3.04Å; E205-K213 PolarHBondContact OE2-NZ 2.82Å
206	N	83.2	Confident	68.8	Low	20 Å²	20	76.6 Å²	76.6	11%	0.107	44%	0.44	C	S	.	.			trans	-51.3	118.3	173.3	169.4	-22.9	0	0	0	110.8	R204 C208 L209 T210 C279	R204-N206 PolarHBondContact O-N 3.35Å; N206-C208 PolarHBondContact O-N 2.89Å; N206-C208 VanDerWaalsContact O-N 3.09Å; N206-C208 WeakPolarHBondContact OD1-CA 3.4Å; N206-C208 VanDerWaalsContact OD1-CB 3.26Å; N206-C208 WeakPolarHBondContact OD1-CB 2.99Å; N206-C208 PolarHBondContact OD1-N 2.04Å; N206-L209 HydrophobicContact CB-CB 4.05Å; N206-L209 VanDerWaalsContact O-CA 3.3Å; N206-L209 WeakPolarHBondContact O-CA 3.06Å; N206-L209 VanDerWaalsContact O-CB 3.23Å; N206-L209 WeakPolarHBondContact O-CB 3.43Å; N206-L209 PolarHBondContact O-N 3.42Å; N206-L209 PolarHBondContact OD1-N 3.07Å; N206-T210 PolarHBondContact O-N 3.29Å; N206-T210 PolarHBondContact O-OG1 2.92Å; N206-C279 WeakPolarHBondContact ND2-CA 3.03Å; N206-C279 PolarHBondContact OD1-SG 3.48Å; N206-C279 VanDerWaalsContact OD1-SG 3.35Å
207	N	89.4	Confident	71.7	Confident	69 Å²	69	78.4 Å²	78.4	37%	0.369	45%	0.45	S	S	.	.	H	α-helix	trans	-53.6	-34.8	-176.8	-64.8	-18.2	0	0	0	113.7	E205 L209 T210 A211 C269 S270	E205-N207 PolarHBondContact O-N 3.18Å; N207-L209 VanDerWaalsContact C-N 3.34Å; N207-T210 PolarHBondContact O-N 2.95Å; N207-A211 WeakPolarHBondContact O-CB 3.27Å; N207-A211 PolarHBondContact O-N 3.24Å; N207-C269 HydrophobicContact CB-CB 4.37Å; N207-S270 PolarHBondContact ND2-OG 3.28Å
208	C	92.1	Very high	74.6	Confident	3 Å²	3	73 Å²	73	2%	0.02	42%	0.422	C	S	.	.	H	α-helix	trans	-70.2	-28.4	174.5	-54.7	0	0	0	0	112.9	N206 A212 C269 C279 R282	N206-C208 PolarHBondContact O-N 2.89Å; N206-C208 VanDerWaalsContact O-N 3.09Å; N206-C208 WeakPolarHBondContact OD1-CA 3.4Å; N206-C208 VanDerWaalsContact OD1-CB 3.26Å; N206-C208 WeakPolarHBondContact OD1-CB 2.99Å; N206-C208 PolarHBondContact OD1-N 2.04Å; C208-A212 VanDerWaalsContact O-CB 3.27Å; C208-A212 WeakPolarHBondContact O-CB 3.48Å; C208-A212 PolarHBondContact O-N 3.03Å; C208-A212 VanDerWaalsContact O-N 3.14Å; C208-C269 VanDerWaalsContact CA-SG 3.52Å; C208-C269 HydrophobicContact CB-CB 3.88Å; C208-C269 WeakPolarHBondContact CB-SG 3.44Å; C208-C269 WeakPolarHBondContact SG-CB 3.39Å; C208-C269 CovalentContact SG-SG 2.02Å; C208-C269 PolarHBondContact SG-SG 3.16Å; C208-C279 PolarHBondContact SG-SG 3.46Å; C208-R282 HydrophobicContact CB-CB 4.33Å; C208-R282 HydrophobicContact CB-CG 3.9Å
209	L	91.9	Very high	77.6	Confident	58 Å²	58	75.1 Å²	75.1	30%	0.304	42%	0.415	S	S	.	.	H	α-helix	trans	-72.4	-45.7	170.4	179.8	63.2	0	0	0	110.5	E205 N206 N207 A211 A212 K213	E205-L209 HydrophobicContact CG-CD2 4.41Å; N206-L209 HydrophobicContact CB-CB 4.05Å; N206-L209 VanDerWaalsContact O-CA 3.3Å; N206-L209 WeakPolarHBondContact O-CA 3.06Å; N206-L209 VanDerWaalsContact O-CB 3.23Å; N206-L209 WeakPolarHBondContact O-CB 3.43Å; N206-L209 PolarHBondContact O-N 3.42Å; N206-L209 PolarHBondContact OD1-N 3.07Å; N207-L209 VanDerWaalsContact C-N 3.34Å; L209-A211 VanDerWaalsContact C-N 3.35Å; L209-A211 PolarHBondContact O-N 3.14Å; L209-A212 CarbonylContact O-C 3.59Å; L209-A212 WeakPolarHBondContact O-CA 3.21Å; L209-A212 WeakPolarHBondContact O-CB 3.43Å; L209-A212 PolarHBondContact O-N 2.04Å; L209-A212 VanDerWaalsContact O-N 3.08Å; L209-K213 PolarHBondContact O-N 2.92Å
210	T	91.6	Very high	80.8	Confident	31 Å²	31	69.3 Å²	69.3	19%	0.19	39%	0.392	C	S	.	.	H	α-helix	trans	-57.8	-46.6	176.5	-43	0	0	0	0	111.1	L141 E205 N206 N207 A212 K213 A214	L141-T210 HydrophobicContact CD1-CG2 4.09Å; L141-T210 HydrophobicContact CD2-CG2 4.49Å; E205-T210 WeakPolarHBondContact CG-OG1 3.46Å; E205-T210 PolarHBondContact OE1-OG1 3.18Å; N206-T210 PolarHBondContact O-N 3.29Å; N206-T210 PolarHBondContact O-OG1 2.92Å; N207-T210 PolarHBondContact O-N 2.95Å; T210-A212 VanDerWaalsContact C-N 3.35Å; T210-A212 PolarHBondContact O-N 3.46Å; T210-K213 WeakPolarHBondContact O-CB 3.31Å; T210-K213 PolarHBondContact O-N 3.46Å; T210-A214 PolarHBondContact O-N 3.26Å
211	A	93.1	Very high	83.6	Confident	5 Å²	5	64.3 Å²	64.3	4%	0.041	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-38.6	174.4	0	0	0	0	0	112.9	N207 L209 K213 A214 C215 G265 M266	N207-A211 WeakPolarHBondContact O-CB 3.27Å; N207-A211 PolarHBondContact O-N 3.24Å; L209-A211 VanDerWaalsContact C-N 3.35Å; L209-A211 PolarHBondContact O-N 3.14Å; A211-K213 VanDerWaalsContact C-N 3.35Å; A211-A214 PolarHBondContact O-N 3Å; A211-C215 PolarHBondContact O-N 2.96Å; A211-G265 WeakPolarHBondContact CB-O 3.44Å; A211-M266 HydrophobicContact CB-CG 4.21Å
212	A	94.5	Very high	86.4	Confident	7 Å²	7	64.3 Å²	64.3	6%	0.058	34%	0.341	C	S	.	.	H	α-helix	trans	-66.2	-33.6	174.3	0	0	0	0	0	112.9	C208 L209 T210 N216 R225	C208-A212 VanDerWaalsContact O-CB 3.27Å; C208-A212 WeakPolarHBondContact O-CB 3.48Å; C208-A212 PolarHBondContact O-N 3.03Å; C208-A212 VanDerWaalsContact O-N 3.14Å; L209-A212 CarbonylContact O-C 3.59Å; L209-A212 WeakPolarHBondContact O-CA 3.21Å; L209-A212 WeakPolarHBondContact O-CB 3.43Å; L209-A212 PolarHBondContact O-N 2.04Å; L209-A212 VanDerWaalsContact O-N 3.08Å; T210-A212 VanDerWaalsContact C-N 3.35Å; T210-A212 PolarHBondContact O-N 3.46Å; A212-N216 VanDerWaalsContact O-CG 3.24Å; A212-N216 PolarHBondContact O-N 3.27Å; A212-N216 PolarHBondContact O-ND2 2.62Å; A212-N216 PolarHBondContact O-OD1 2.66Å; A212-R225 PolarHBondContact O-NH1 3.33Å
213	K	94.4	Very high	88.9	Confident	99 Å²	99	65.7 Å²	65.7	43%	0.43	34%	0.337	S	S	.	.	H	α-helix	trans	-67.4	-48.4	170.5	-70	-179.5	-176.3	171.8	0	110.6	E205 L209 T210 A211 C215 N216 L217	E205-K213 VanDerWaalsContact OE1-CD 3.24Å; E205-K213 WeakPolarHBondContact OE1-CD 3.24Å; E205-K213 WeakPolarHBondContact OE1-CE 3.48Å; E205-K213 IonicContact OE1-NZ 3.03Å; E205-K213 PolarHBondContact OE1-NZ 3.05Å; E205-K213 IonicContact OE2-NZ 3.04Å; E205-K213 PolarHBondContact OE2-NZ 2.82Å; L209-K213 PolarHBondContact O-N 2.92Å; T210-K213 WeakPolarHBondContact O-CB 3.31Å; T210-K213 PolarHBondContact O-N 3.46Å; A211-K213 VanDerWaalsContact C-N 3.35Å; K213-C215 VanDerWaalsContact C-N 3.31Å; K213-C215 PolarHBondContact O-N 3.41Å; K213-N216 WeakPolarHBondContact O-CA 3.25Å; K213-N216 WeakPolarHBondContact O-CB 3.47Å; K213-N216 PolarHBondContact O-N 3.05Å; K213-L217 PolarHBondContact O-N 2.95Å; K213-L217 VanDerWaalsContact O-N 3.11Å
214	A	94	Very high	91.3	Very high	24 Å²	24	65 Å²	65	20%	0.198	32%	0.317	C	S	.	.	H	α-helix	trans	-58.2	-39.5	178.7	0	0	0	0	0	112.9	L141 T210 A211 N216 L217 N218	L141-A214 HydrophobicContact CD2-CB 4.35Å; T210-A214 PolarHBondContact O-N 3.26Å; A211-A214 PolarHBondContact O-N 3Å; A214-N216 VanDerWaalsContact C-N 3.35Å; A214-L217 PolarHBondContact O-N 3.23Å; A214-N218 PolarHBondContact O-N 3.3Å
215	C	96.3	Very high	93.2	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-37.1	172	178.5	0	0	0	0	112.9	A211 K213 L217 N218 C221 K222 M266	A211-C215 PolarHBondContact O-N 2.96Å; K213-C215 VanDerWaalsContact C-N 3.31Å; K213-C215 PolarHBondContact O-N 3.41Å; C215-L217 VanDerWaalsContact C-N 3.29Å; C215-L217 PolarHBondContact O-N 3.42Å; C215-N218 PolarHBondContact O-N 2.99Å; C215-N218 VanDerWaalsContact O-O 3.06Å; C215-C221 HydrophobicContact CB-CB 3.98Å; C215-C221 WeakPolarHBondContact CB-SG 3.28Å; C215-C221 WeakPolarHBondContact O-CB 3.35Å; C215-C221 VanDerWaalsContact SG-C 3.56Å; C215-C221 WeakPolarHBondContact SG-CB 3.04Å; C215-C221 CovalentContact SG-SG 2.03Å; C215-C221 PolarHBondContact SG-SG 3.38Å; C215-K222 PolarHBondContact O-N 3.4Å; C215-M266 HydrophobicContact CB-CG 4.49Å; C215-M266 HydrophobicContact CB-SD 3.51Å; C215-M266 VanDerWaalsContact CB-SD 3.51Å; C215-M266 VanDerWaalsContact SG-SD 3.66Å
216	N	96	Very high	94.7	Very high	80 Å²	80	58 Å²	58	43%	0.428	30%	0.299	S	S	.	.	H	α-helix	trans	-72.7	-21.1	179.8	-71.4	-8.3	0	0	0	113.4	A212 K213 A214 R225	A212-N216 VanDerWaalsContact O-CG 3.24Å; A212-N216 PolarHBondContact O-N 3.27Å; A212-N216 PolarHBondContact O-ND2 2.62Å; A212-N216 PolarHBondContact O-OD1 2.66Å; K213-N216 WeakPolarHBondContact O-CA 3.25Å; K213-N216 WeakPolarHBondContact O-CB 3.47Å; K213-N216 PolarHBondContact O-N 3.05Å; A214-N216 VanDerWaalsContact C-N 3.35Å; N216-R225 PolarHBondContact OD1-NH1 3.43Å
217	L	96.1	Very high	95.4	Very high	151 Å²	151	59.5 Å²	59.5	79%	0.791	31%	0.314	S	S	*	.	H	α-helix	trans	-82.9	-18	172.6	-64.8	173.6	0	0	0	113	K213 A214 C215	K213-L217 PolarHBondContact O-N 2.95Å; K213-L217 VanDerWaalsContact O-N 3.11Å; A214-L217 PolarHBondContact O-N 3.23Å; C215-L217 VanDerWaalsContact C-N 3.29Å; C215-L217 PolarHBondContact O-N 3.42Å
218	N	96.3	Very high	95.8	Very high	45 Å²	45	56.4 Å²	56.4	24%	0.241	30%	0.297	C	S	.	.	S	Bend	trans	-97.5	114.6	177	-179.4	-88	0	0	0	110.7	A214 C215 T220 C221 K222 H262	A214-N218 PolarHBondContact O-N 3.3Å; C215-N218 PolarHBondContact O-N 2.99Å; C215-N218 VanDerWaalsContact O-O 3.06Å; N218-T220 VanDerWaalsContact C-N 3.26Å; N218-T220 PolarHBondContact O-N 2.94Å; N218-T220 VanDerWaalsContact O-N 3.17Å; N218-T220 WeakPolarHBondContact OD1-CB 3.49Å; N218-T220 PolarHBondContact OD1-N 3.08Å; N218-C221 HydrophobicContact CB-CB 4.05Å; N218-C221 PolarHBondContact O-N 3.28Å; N218-C221 VanDerWaalsContact O-N 3.08Å; N218-C221 PolarHBondContact OD1-N 2.91Å; N218-K222 VanDerWaalsContact O-CB 3.31Å; N218-K222 WeakPolarHBondContact O-CB 3.47Å; N218-K222 PolarHBondContact O-N 3.12Å; N218-H262 PolarHBondContact ND2-NE2 3.27Å
219	D	97.3	Very high	96.1	Very high	122 Å²	122	59 Å²	59	65%	0.652	31%	0.31	S	S	*	.	H	α-helix	trans	-57.2	-35.8	-175.5	-71.8	-46.1	0	0	0	114.1	K223	D219-K223 WeakPolarHBondContact O-CB 3.19Å; D219-K223 PolarHBondContact O-N 3.13Å
220	T	97.1	Very high	96.2	Very high	63 Å²	63	59.5 Å²	59.5	39%	0.387	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-49.9	176.3	-64.8	0	0	0	0	110.7	N218 K223 Y224	N218-T220 VanDerWaalsContact C-N 3.26Å; N218-T220 PolarHBondContact O-N 2.94Å; N218-T220 VanDerWaalsContact O-N 3.17Å; N218-T220 WeakPolarHBondContact OD1-CB 3.49Å; N218-T220 PolarHBondContact OD1-N 3.08Å; T220-K223 PolarHBondContact O-N 3.04Å; T220-Y224 HydrophobicContact CG2-CD2 3.85Å; T220-Y224 HydrophobicContact CG2-CE2 3.93Å; T220-Y224 VanDerWaalsContact O-CD2 3.29Å; T220-Y224 WeakPolarHBondContact O-CD2 3.45Å; T220-Y224 PolarHBondContact O-N 3.45Å
221	C	97.6	Very high	96.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.5	-49.8	178.7	-165.8	0	0	0	0	111.4	C215 N218 K223 Y224 R225 V258 H262	C215-C221 HydrophobicContact CB-CB 3.98Å; C215-C221 WeakPolarHBondContact CB-SG 3.28Å; C215-C221 WeakPolarHBondContact O-CB 3.35Å; C215-C221 VanDerWaalsContact SG-C 3.56Å; C215-C221 WeakPolarHBondContact SG-CB 3.04Å; C215-C221 CovalentContact SG-SG 2.03Å; C215-C221 PolarHBondContact SG-SG 3.38Å; N218-C221 HydrophobicContact CB-CB 4.05Å; N218-C221 PolarHBondContact O-N 3.28Å; N218-C221 VanDerWaalsContact O-N 3.08Å; N218-C221 PolarHBondContact OD1-N 2.91Å; C221-K223 VanDerWaalsContact C-N 3.34Å; C221-K223 PolarHBondContact O-N 3.25Å; C221-Y224 PolarHBondContact O-N 3.21Å; C221-R225 WeakPolarHBondContact O-CB 3.36Å; C221-R225 PolarHBondContact O-N 3.07Å; C221-V258 HydrophobicContact CB-CG1 3.81Å; C221-V258 VanDerWaalsContact SG-CG1 3.55Å; C221-H262 HydrophobicContact CB-CB 4.04Å; C221-H262 VanDerWaalsContact SG-CB 3.59Å
222	K	97.8	Very high	96.6	Very high	102 Å²	102	59 Å²	59	44%	0.443	32%	0.315	S	S	.	.	H	α-helix	trans	-51.9	-48	174.6	-175.7	-173.4	-175.4	176.1	0	112.2	C215 N218 R225 S226	C215-K222 PolarHBondContact O-N 3.4Å; N218-K222 VanDerWaalsContact O-CB 3.31Å; N218-K222 WeakPolarHBondContact O-CB 3.47Å; N218-K222 PolarHBondContact O-N 3.12Å; K222-R225 PolarHBondContact O-N 3.01Å; K222-S226 PolarHBondContact O-N 3.08Å; K222-S226 PolarHBondContact O-OG 2.89Å
223	K	98.1	Very high	96.6	Very high	148 Å²	148	62.7 Å²	62.7	64%	0.643	34%	0.337	S	S	*	.	H	α-helix	trans	-61.4	-54.1	178.7	177.3	177.2	179.2	173.7	0	112.2	D219 T220 C221 R225 S226 A227	D219-K223 WeakPolarHBondContact O-CB 3.19Å; D219-K223 PolarHBondContact O-N 3.13Å; T220-K223 PolarHBondContact O-N 3.04Å; C221-K223 VanDerWaalsContact C-N 3.34Å; C221-K223 PolarHBondContact O-N 3.25Å; K223-R225 VanDerWaalsContact C-N 3.31Å; K223-R225 PolarHBondContact O-N 3.17Å; K223-S226 PolarHBondContact O-N 3.34Å; K223-A227 WeakPolarHBondContact O-CB 3.27Å; K223-A227 PolarHBondContact O-N 3.39Å
224	Y	98.1	Very high	96.3	Very high	68 Å²	68	61 Å²	61	27%	0.267	34%	0.338	S	S	.	.	H	α-helix	trans	-68.7	-31.3	-179.4	-77	-72.3	0	0	0	112.3	T220 C221 A227 Y228 K257 V258	T220-Y224 HydrophobicContact CG2-CD2 3.85Å; T220-Y224 HydrophobicContact CG2-CE2 3.93Å; T220-Y224 VanDerWaalsContact O-CD2 3.29Å; T220-Y224 WeakPolarHBondContact O-CD2 3.45Å; T220-Y224 PolarHBondContact O-N 3.45Å; C221-Y224 PolarHBondContact O-N 3.21Å; Y224-A227 PolarHBondContact O-N 2.97Å; Y224-Y228 WeakPolarHBondContact O-CD1 3.48Å; Y224-Y228 PolarHBondContact O-N 3.02Å; Y224-K257 HydrophobicContact CD2-CB 4.21Å; Y224-K257 HydrophobicContact CE1-CB 4.11Å; Y224-K257 HydrophobicContact CE1-CG 4.24Å; Y224-K257 HydrophobicContact CE2-CB 3.69Å; Y224-V258 HydrophobicContact CD2-CG2 3.91Å; Y224-V258 HydrophobicContact CG-CG2 4.07Å
225	R	97.7	Very high	95.8	Very high	50 Å²	50	68.9 Å²	68.9	19%	0.189	36%	0.362	C	S	.	.	H	α-helix	trans	-60.6	-55.1	173.5	-174.5	-177	-173.5	168.2	11.9	111.1	A212 N216 C221 K222 K223 A227 Y228 I229 F254	A212-R225 PolarHBondContact O-NH1 3.33Å; N216-R225 PolarHBondContact OD1-NH1 3.43Å; C221-R225 WeakPolarHBondContact O-CB 3.36Å; C221-R225 PolarHBondContact O-N 3.07Å; K222-R225 PolarHBondContact O-N 3.01Å; K223-R225 VanDerWaalsContact C-N 3.31Å; K223-R225 PolarHBondContact O-N 3.17Å; R225-A227 PolarHBondContact O-N 2.03Å; R225-Y228 HydrophobicContact CB-CE1 4.19Å; R225-Y228 HydrophobicContact CG-CE1 4Å; R225-Y228 WeakPolarHBondContact O-CD1 3.3Å; R225-Y228 PolarHBondContact O-N 3.3Å; R225-I229 HydrophobicContact CG-CG1 4.33Å; R225-I229 VanDerWaalsContact O-CG1 3.28Å; R225-I229 WeakPolarHBondContact O-CG1 3.13Å; R225-I229 PolarHBondContact O-N 3.19Å; R225-F254 HydrophobicContact CB-CE2 4.07Å
226	S	97.2	Very high	95.2	Very high	74 Å²	74	72.4 Å²	72.4	52%	0.517	38%	0.384	S	S	.	.	H	α-helix	trans	-59.2	-37	176.1	-60.5	0	0	0	0	112.2	K222 K223 Y228 I229 S230	K222-S226 PolarHBondContact O-N 3.08Å; K222-S226 PolarHBondContact O-OG 2.89Å; K223-S226 PolarHBondContact O-N 3.34Å; S226-Y228 PolarHBondContact O-N 2.87Å; S226-I229 PolarHBondContact O-N 3.19Å; S226-S230 PolarHBondContact O-N 2.89Å; S226-S230 VanDerWaalsContact O-N 3.12Å
227	A	97.8	Very high	94.6	Very high	51 Å²	51	71.1 Å²	71.1	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-67	-28.7	179.2	0	0	0	0	0	114.4	K223 Y224 R225 P231	K223-A227 WeakPolarHBondContact O-CB 3.27Å; K223-A227 PolarHBondContact O-N 3.39Å; Y224-A227 PolarHBondContact O-N 2.97Å; R225-A227 PolarHBondContact O-N 2.03Å; A227-P231 WeakPolarHBondContact O-CD 3.4Å; A227-P231 WeakPolarHBondContact O-CG 3.41Å
228	Y	97.9	Very high	93.6	Very high	3 Å²	3	71 Å²	71	1%	0.012	39%	0.387	C	S	.	.	H	α-helix	trans	-88.5	-38.2	171.3	85	-106.4	0	0	0	112.9	Y224 R225 S226 S230 P231 C232 L251 F254 T286 V288	Y224-Y228 WeakPolarHBondContact O-CD1 3.48Å; Y224-Y228 PolarHBondContact O-N 3.02Å; R225-Y228 HydrophobicContact CB-CE1 4.19Å; R225-Y228 HydrophobicContact CG-CE1 4Å; R225-Y228 WeakPolarHBondContact O-CD1 3.3Å; R225-Y228 PolarHBondContact O-N 3.3Å; S226-Y228 PolarHBondContact O-N 2.87Å; Y228-S230 PolarHBondContact O-N 2.91Å; Y228-P231 VanDerWaalsContact O-CD 3.27Å; Y228-P231 WeakPolarHBondContact O-CD 3.49Å; Y228-P231 WeakPolarHBondContact O-CG 3.48Å; Y228-C232 WeakPolarHBondContact O-CB 3.34Å; Y228-C232 PolarHBondContact O-N 3.23Å; Y228-C232 PolarHBondContact O-SG 3.44Å; Y228-L251 HydrophobicContact CD1-CD2 4.47Å; Y228-L251 HydrophobicContact CD2-CD2 3.48Å; Y228-L251 VanDerWaalsContact CD2-CD2 3.48Å; Y228-L251 HydrophobicContact CD2-CG 4.17Å; Y228-L251 HydrophobicContact CE2-CD2 3.78Å; Y228-L251 HydrophobicContact CG-CD2 3.89Å; Y228-L251 HydrophobicContact CG-CG 4.43Å; Y228-F254 HydrophobicContact CD1-CB 3.8Å; Y228-F254 HydrophobicContact CD1-CD1 4.37Å; Y228-F254 AromaticContact CD1-CD2 3.68Å; Y228-F254 HydrophobicContact CD1-CD2 3.68Å; Y228-F254 HydrophobicContact CD1-CE2 4.36Å; Y228-F254 AromaticContact CD1-CG 3.7Å; Y228-F254 HydrophobicContact CD1-CG 3.7Å; Y228-F254 HydrophobicContact CE1-CB 4.32Å; Y228-F254 HydrophobicContact CE1-CD1 4.04Å; Y228-F254 AromaticContact CE1-CD2 3.59Å; Y228-F254 HydrophobicContact CE1-CD2 3.59Å; Y228-F254 HydrophobicContact CE1-CE1 4.23Å; Y228-F254 AromaticContact CE1-CE2 3.82Å; Y228-F254 HydrophobicContact CE1-CE2 3.82Å; Y228-F254 AromaticContact CE1-CG 3.72Å; Y228-F254 HydrophobicContact CE1-CG 3.72Å; Y228-F254 HydrophobicContact CE1-CZ 4.13Å; Y228-T286 WeakPolarHBondContact CE2-O 3.42Å; Y228-T286 PolarHBondContact OH-O 3.13Å; Y228-V288 HydrophobicContact CE2-CG2 4.43Å
229	I	96.8	Very high	92.6	Very high	58 Å²	58	71.6 Å²	71.6	30%	0.297	40%	0.398	S	S	.	.	H	α-helix	trans	-57.9	-48.5	179.6	-69.1	-67.6	0	0	0	110.9	R225 S226 C232 T233 V288	R225-I229 HydrophobicContact CG-CG1 4.33Å; R225-I229 VanDerWaalsContact O-CG1 3.28Å; R225-I229 WeakPolarHBondContact O-CG1 3.13Å; R225-I229 PolarHBondContact O-N 3.19Å; S226-I229 PolarHBondContact O-N 3.19Å; I229-C232 CarbonylContact O-C 3.52Å; I229-C232 PolarHBondContact O-N 3.4Å; I229-T233 HydrophobicContact CG2-CG2 4.06Å; I229-T233 PolarHBondContact O-N 2.9Å; I229-T233 PolarHBondContact O-OG1 2.8Å; I229-T233 VanDerWaalsContact O-OG1 3.08Å; I229-V288 HydrophobicContact CD1-CG2 3.63Å
230	S	95.2	Very high	91.9	Very high	68 Å²	68	70.9 Å²	70.9	48%	0.476	39%	0.391	S	S	.	.	H	α-helix	trans	-49.3	-61.3	-178.9	166.9	0	0	0	0	114	S226 Y228 C232 T233 S234	S226-S230 PolarHBondContact O-N 2.89Å; S226-S230 VanDerWaalsContact O-N 3.12Å; Y228-S230 PolarHBondContact O-N 2.91Å; S230-C232 PolarHBondContact O-N 2.91Å; S230-T233 PolarHBondContact O-N 3.39Å; S230-S234 WeakPolarHBondContact O-CB 3.37Å; S230-S234 PolarHBondContact O-N 3.42Å; S230-S234 PolarHBondContact O-OG 2.89Å
231	P	95.8	Very high	91.4	Very high	23 Å²	23	72.3 Å²	72.3	15%	0.149	40%	0.395	C	S	.	.	H	α-helix	trans	-69.4	-15.8	179.2	28.2	-36.7	0	0	0	114.6	A227 Y228 K246 A250	A227-P231 WeakPolarHBondContact O-CD 3.4Å; A227-P231 WeakPolarHBondContact O-CG 3.41Å; Y228-P231 VanDerWaalsContact O-CD 3.27Å; Y228-P231 WeakPolarHBondContact O-CD 3.49Å; Y228-P231 WeakPolarHBondContact O-CG 3.48Å; P231-K246 HydrophobicContact CB-CB 3.76Å; P231-A250 HydrophobicContact CG-CB 4.15Å
232	C	96.1	Very high	91.2	Very high	3 Å²	3	73 Å²	73	2%	0.02	40%	0.4	C	S	.	.	H	α-helix	trans	-85.9	-23.3	175.4	-59.6	0	0	0	0	113.3	Y228 I229 S230 C247 V288 C291	Y228-C232 WeakPolarHBondContact O-CB 3.34Å; Y228-C232 PolarHBondContact O-N 3.23Å; Y228-C232 PolarHBondContact O-SG 3.44Å; I229-C232 CarbonylContact O-C 3.52Å; I229-C232 PolarHBondContact O-N 3.4Å; S230-C232 PolarHBondContact O-N 2.91Å; C232-C247 HydrophobicContact CB-CB 3.94Å; C232-C247 WeakPolarHBondContact CB-SG 3.17Å; C232-C247 VanDerWaalsContact SG-CA 3.5Å; C232-C247 WeakPolarHBondContact SG-CB 3.42Å; C232-C247 CovalentContact SG-SG 2.03Å; C232-C247 PolarHBondContact SG-SG 3.37Å; C232-V288 HydrophobicContact CB-CB 3.94Å; C232-V288 HydrophobicContact CB-CG1 4.06Å; C232-V288 HydrophobicContact CB-CG2 4.07Å; C232-C291 HydrophobicContact CB-CB 4.33Å; C232-C291 WeakPolarHBondContact O-CB 3.18Å; C232-C291 PolarHBondContact O-SG 3.11Å
233	T	94.6	Very high	90.9	Very high	84 Å²	84	70.6 Å²	70.6	52%	0.515	39%	0.392	S	S	.	.	H	α-helix	trans	-109.4	-18.5	-179.6	61.3	0	0	0	0	114.3	I229 S230 R235 V288	I229-T233 HydrophobicContact CG2-CG2 4.06Å; I229-T233 PolarHBondContact O-N 2.9Å; I229-T233 PolarHBondContact O-OG1 2.8Å; I229-T233 VanDerWaalsContact O-OG1 3.08Å; S230-T233 PolarHBondContact O-N 3.39Å; T233-R235 PolarHBondContact O-N 3.45Å; T233-V288 HydrophobicContact CG2-CG1 4.22Å
234	S	89	Confident	90.7	Very high	63 Å²	63	65.8 Å²	65.8	44%	0.441	37%	0.371	S	S	.	.	S	Bend	trans	-69.6	112.1	174.8	-68.6	0	0	0	0	111.2	S230	S230-S234 WeakPolarHBondContact O-CB 3.37Å; S230-S234 PolarHBondContact O-N 3.42Å; S230-S234 PolarHBondContact O-OG 2.89Å
235	R	83.9	Confident	90.5	Very high	191 Å²	191	73.3 Å²	73.3	72%	0.721	40%	0.399	S	S	*	.			trans	-59.4	138.6	169.4	-73.2	-174.3	178.2	-123.1	4.2	110.8	T233 I241	T233-R235 PolarHBondContact O-N 3.45Å; R235-I241 WeakPolarHBondContact CA-O 3.11Å
236	V	83.2	Confident	90.4	Very high	74 Å²	74	77.4 Å²	77.4	45%	0.448	42%	0.418	S	S	.	.			trans	-102.4	-39.7	-179	179.5	0	0	0	0	110.7	E240 N243	V236-E240 HydrophobicContact CB-CB 4.18Å; V236-E240 PolarHBondContact N-O 3.21Å; V236-N243 HydrophobicContact CG2-CB 3.91Å
237	S	82.6	Confident	90.4	Very high	53 Å²	53	73.9 Å²	73.9	37%	0.371	39%	0.393	S	S	.	.	S	Bend	trans	-152.9	-176	174.9	71.2	0	0	0	0	110.8	A239 E240	S237-A239 VanDerWaalsContact C-N 3.26Å; S237-A239 PolarHBondContact OG-N 2.94Å; S237-E240 PolarHBondContact N-O 2.88Å; S237-E240 WeakPolarHBondContact OG-CB 3.44Å; S237-E240 PolarHBondContact OG-N 3.1Å
238	T	76.3	Confident	90.4	Very high	148 Å²	148	72.4 Å²	72.4	91%	0.908	38%	0.378	S	S	*	.	S	Bend	trans	-66.1	-28.4	169.9	47.5	0	0	0	0	112.7
239	A	75.6	Confident	90.3	Very high	58 Å²	58	78 Å²	78	48%	0.479	40%	0.402	S	S	.	.	S	Bend	trans	-100.8	-14	-177.5	0	0	0	0	0	114.5	S237 K296	S237-A239 VanDerWaalsContact C-N 3.26Å; S237-A239 PolarHBondContact OG-N 2.94Å; A239-K296 PolarHBondContact O-NZ 2.65Å
240	E	81.3	Confident	90.4	Very high	106 Å²	106	75.7 Å²	75.7	50%	0.495	39%	0.392	S	S	.	.			trans	-121.1	108.4	178.5	-65	-166.9	154.1	0	0	111.6	V236 S237 C242	V236-E240 HydrophobicContact CB-CB 4.18Å; V236-E240 PolarHBondContact N-O 3.21Å; S237-E240 PolarHBondContact N-O 2.88Å; S237-E240 WeakPolarHBondContact OG-CB 3.44Å; S237-E240 PolarHBondContact OG-N 3.1Å; E240-C242 VanDerWaalsContact C-N 3.27Å; E240-C242 PolarHBondContact O-N 3.4Å
241	I	86.6	Confident	90.5	Very high	93 Å²	93	72.5 Å²	72.5	48%	0.477	37%	0.369	S	S	.	.	S	Bend	trans	-64.5	-31	-176.9	-56.5	170.5	0	0	0	112	R235 V290	R235-I241 WeakPolarHBondContact CA-O 3.11Å; I241-V290 HydrophobicContact CD1-CG1 4.43Å; I241-V290 HydrophobicContact CG2-CG1 4.2Å
242	C	93.3	Very high	90.5	Very high	16 Å²	16	74.4 Å²	74.4	11%	0.108	37%	0.373	C	S	.	.	S	Bend	trans	-161.9	170.2	-179.9	73.4	0	0	0	0	111.9	E240 K244 C291	E240-C242 VanDerWaalsContact C-N 3.27Å; E240-C242 PolarHBondContact O-N 3.4Å; C242-K244 PolarHBondContact O-N 2.74Å; C242-C291 HydrophobicContact CB-CB 3.75Å; C242-C291 WeakPolarHBondContact CB-SG 3.46Å; C242-C291 WeakPolarHBondContact SG-CA 3.41Å; C242-C291 WeakPolarHBondContact SG-CB 3.22Å; C242-C291 CovalentContact SG-SG 2.01Å; C242-C291 PolarHBondContact SG-SG 3.03Å
243	N	92.9	Very high	90.5	Very high	50 Å²	50	78.6 Å²	78.6	27%	0.267	39%	0.392	S	S	.	.			trans	-87.9	84.1	168.7	-166.2	-66.7	0	0	0	110.7	V236 R245 K246 C247	V236-N243 HydrophobicContact CG2-CB 3.91Å; N243-R245 PolarHBondContact O-N 3.01Å; N243-R245 VanDerWaalsContact O-N 3.11Å; N243-K246 HydrophobicContact CB-CB 4.14Å; N243-K246 HydrophobicContact CB-CD 4.2Å; N243-K246 HydrophobicContact CB-CG 4.38Å; N243-K246 PolarHBondContact O-N 2.89Å; N243-K246 WeakPolarHBondContact OD1-CB 3.48Å; N243-K246 VanDerWaalsContact OD1-CG 3.31Å; N243-K246 WeakPolarHBondContact OD1-CG 3.33Å; N243-K246 PolarHBondContact OD1-N 3.04Å; N243-C247 PolarHBondContact O-N 3.11Å
244	K	93.5	Very high	90.6	Very high	48 Å²	48	74.6 Å²	74.6	21%	0.209	37%	0.368	C	S	.	.	H	α-helix	trans	-50.5	-39.2	-176.5	-168.6	164.6	-167.9	172.8	0	112.9	C242 C247 H248 C291 S292 Y293 E294 E295	C242-K244 PolarHBondContact O-N 2.74Å; K244-C247 PolarHBondContact O-N 3.28Å; K244-H248 VanDerWaalsContact O-CB 3.29Å; K244-H248 WeakPolarHBondContact O-CB 3.41Å; K244-H248 PolarHBondContact O-N 3.48Å; K244-C291 WeakPolarHBondContact CD-O 3.23Å; K244-C291 WeakPolarHBondContact CE-O 3.35Å; K244-C291 WeakPolarHBondContact CG-O 3.2Å; K244-S292 VanDerWaalsContact CE-O 3.28Å; K244-S292 WeakPolarHBondContact CE-O 3.35Å; K244-Y293 PolarHBondContact NZ-O 3.02Å; K244-E294 PolarHBondContact NZ-O 3.05Å; K244-E295 IonicContact NZ-OE1 2.76Å; K244-E295 PolarHBondContact NZ-OE1 2.77Å
245	R	93.9	Very high	91	Very high	225 Å²	225	72.1 Å²	72.1	85%	0.849	35%	0.349	S	S	*	.	H	α-helix	trans	-64.1	-41.4	177.5	-174.8	175.3	177.2	176.1	-1.7	113.7	N243 K249	N243-R245 PolarHBondContact O-N 3.01Å; N243-R245 VanDerWaalsContact O-N 3.11Å; R245-K249 WeakPolarHBondContact O-CB 3.42Å; R245-K249 PolarHBondContact O-N 3.37Å
246	K	95.8	Very high	91.3	Very high	136 Å²	136	64.6 Å²	64.6	59%	0.591	32%	0.323	S	S	*	.	H	α-helix	trans	-70.7	-44.6	174	-74.5	177.5	-177.7	178.1	0	110.8	P231 N243 K249 A250	P231-K246 HydrophobicContact CB-CB 3.76Å; N243-K246 HydrophobicContact CB-CB 4.14Å; N243-K246 HydrophobicContact CB-CD 4.2Å; N243-K246 HydrophobicContact CB-CG 4.38Å; N243-K246 PolarHBondContact O-N 2.89Å; N243-K246 WeakPolarHBondContact OD1-CB 3.48Å; N243-K246 VanDerWaalsContact OD1-CG 3.31Å; N243-K246 WeakPolarHBondContact OD1-CG 3.33Å; N243-K246 PolarHBondContact OD1-N 3.04Å; K246-K249 PolarHBondContact O-N 2.76Å; K246-A250 PolarHBondContact O-N 3.37Å
247	C	97.4	Very high	91.8	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-54.5	-55	175.8	174.6	0	0	0	0	111.7	C232 N243 K244 K249 A250 L251 C291	C232-C247 HydrophobicContact CB-CB 3.94Å; C232-C247 WeakPolarHBondContact CB-SG 3.17Å; C232-C247 VanDerWaalsContact SG-CA 3.5Å; C232-C247 WeakPolarHBondContact SG-CB 3.42Å; C232-C247 CovalentContact SG-SG 2.03Å; C232-C247 PolarHBondContact SG-SG 3.37Å; N243-C247 PolarHBondContact O-N 3.11Å; K244-C247 PolarHBondContact O-N 3.28Å; C247-K249 VanDerWaalsContact C-N 3.34Å; C247-K249 PolarHBondContact O-N 2.93Å; C247-A250 PolarHBondContact O-N 3.29Å; C247-A250 VanDerWaalsContact O-N 3.13Å; C247-L251 PolarHBondContact O-N 3.14Å; C247-C291 PolarHBondContact SG-SG 3.01Å
248	H	97.2	Very high	92.3	Very high	21 Å²	21	63.5 Å²	63.5	10%	0.097	31%	0.306	C	S	.	.	H	α-helix	trans	-56.5	-41.4	175.4	-82.7	-163	0	0	0	113.6	K244 R252 S292 G352 T353	K244-H248 VanDerWaalsContact O-CB 3.29Å; K244-H248 WeakPolarHBondContact O-CB 3.41Å; K244-H248 PolarHBondContact O-N 3.48Å; H248-R252 WeakPolarHBondContact O-CG 3.36Å; H248-R252 PolarHBondContact O-N 2.78Å; H248-R252 VanDerWaalsContact O-N 3.12Å; H248-S292 PolarHBondContact NE2-O 3.29Å; H248-G352 WeakPolarHBondContact CB-O 3.36Å; H248-T353 PolarHBondContact CE1-O 3.22Å
249	K	95.9	Very high	93	Very high	121 Å²	121	59.2 Å²	59.2	53%	0.526	28%	0.281	S	S	.	.	H	α-helix	trans	-62.7	-42.9	176.5	-177	-175.9	174.4	-172.3	0	111.4	R245 K246 C247 Q253	R245-K249 WeakPolarHBondContact O-CB 3.42Å; R245-K249 PolarHBondContact O-N 3.37Å; K246-K249 PolarHBondContact O-N 2.76Å; C247-K249 VanDerWaalsContact C-N 3.34Å; C247-K249 PolarHBondContact O-N 2.93Å; K249-Q253 WeakPolarHBondContact O-CG 3.47Å; K249-Q253 PolarHBondContact O-N 2.84Å
250	A	97.6	Very high	93.6	Very high	9 Å²	9	57.6 Å²	57.6	7%	0.074	27%	0.265	C	S	.	.	H	α-helix	trans	-72.8	-37	-179.5	0	0	0	0	0	112.4	P231 K246 C247 Q253 F254	P231-A250 HydrophobicContact CG-CB 4.15Å; K246-A250 PolarHBondContact O-N 3.37Å; C247-A250 PolarHBondContact O-N 3.29Å; C247-A250 VanDerWaalsContact O-N 3.13Å; A250-Q253 WeakPolarHBondContact O-CB 3.22Å; A250-Q253 PolarHBondContact O-N 3.49Å; A250-F254 PolarHBondContact O-N 3.35Å
251	L	98.2	Very high	93.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59	-46.9	172.2	-78.9	168.2	0	0	0	112	Y228 C247 Q253 F254 F255 I287	Y228-L251 HydrophobicContact CD1-CD2 4.47Å; Y228-L251 HydrophobicContact CD2-CD2 3.48Å; Y228-L251 VanDerWaalsContact CD2-CD2 3.48Å; Y228-L251 HydrophobicContact CD2-CG 4.17Å; Y228-L251 HydrophobicContact CE2-CD2 3.78Å; Y228-L251 HydrophobicContact CG-CD2 3.89Å; Y228-L251 HydrophobicContact CG-CG 4.43Å; C247-L251 PolarHBondContact O-N 3.14Å; L251-Q253 VanDerWaalsContact C-N 3.31Å; L251-Q253 PolarHBondContact O-N 3.08Å; L251-F254 WeakPolarHBondContact O-CB 3.41Å; L251-F254 PolarHBondContact O-N 2.94Å; L251-F254 VanDerWaalsContact O-N 3.15Å; L251-F255 HydrophobicContact CD2-CE2 4.44Å; L251-F255 WeakPolarHBondContact O-CD2 3.18Å; L251-F255 PolarHBondContact O-N 3.41Å; L251-F255 VanDerWaalsContact O-N 3.11Å; L251-I287 HydrophobicContact CD2-CB 4.34Å; L251-I287 HydrophobicContact CD2-CG2 4.48Å
252	R	96.1	Very high	94	Very high	63 Å²	63	54.6 Å²	54.6	24%	0.238	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-43.2	173.9	-67.6	-170.6	-48.6	-91.5	-0.9	111.5	H248 F254 F255 D256 I351 G352	H248-R252 WeakPolarHBondContact O-CG 3.36Å; H248-R252 PolarHBondContact O-N 2.78Å; H248-R252 VanDerWaalsContact O-N 3.12Å; R252-F254 VanDerWaalsContact C-N 3.32Å; R252-F254 PolarHBondContact O-N 3.14Å; R252-F255 PolarHBondContact O-N 3.22Å; R252-D256 WeakPolarHBondContact O-CB 3.39Å; R252-D256 PolarHBondContact O-N 2.95Å; R252-I351 WeakPolarHBondContact CG-O 3.43Å; R252-G352 WeakPolarHBondContact CD-O 3.36Å; R252-G352 PolarHBondContact NH1-O 3.37Å
253	Q	95.3	Very high	94	Very high	91 Å²	91	53.9 Å²	53.9	43%	0.425	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-35.7	175.9	-73	178.6	-36.5	0	0	113.2	K249 A250 L251 K257	K249-Q253 WeakPolarHBondContact O-CG 3.47Å; K249-Q253 PolarHBondContact O-N 2.84Å; A250-Q253 WeakPolarHBondContact O-CB 3.22Å; A250-Q253 PolarHBondContact O-N 3.49Å; L251-Q253 VanDerWaalsContact C-N 3.31Å; L251-Q253 PolarHBondContact O-N 3.08Å; Q253-K257 WeakPolarHBondContact O-CB 3.23Å; Q253-K257 VanDerWaalsContact O-CG 3.27Å; Q253-K257 WeakPolarHBondContact O-CG 3.4Å; Q253-K257 PolarHBondContact O-N 3.48Å
254	F	97.7	Very high	94.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-56.3	174	177.1	-96.4	0	0	0	110.9	R225 Y228 A250 L251 R252 D256 K257 V258	R225-F254 HydrophobicContact CB-CE2 4.07Å; Y228-F254 HydrophobicContact CD1-CB 3.8Å; Y228-F254 HydrophobicContact CD1-CD1 4.37Å; Y228-F254 AromaticContact CD1-CD2 3.68Å; Y228-F254 HydrophobicContact CD1-CD2 3.68Å; Y228-F254 HydrophobicContact CD1-CE2 4.36Å; Y228-F254 AromaticContact CD1-CG 3.7Å; Y228-F254 HydrophobicContact CD1-CG 3.7Å; Y228-F254 HydrophobicContact CE1-CB 4.32Å; Y228-F254 HydrophobicContact CE1-CD1 4.04Å; Y228-F254 AromaticContact CE1-CD2 3.59Å; Y228-F254 HydrophobicContact CE1-CD2 3.59Å; Y228-F254 HydrophobicContact CE1-CE1 4.23Å; Y228-F254 AromaticContact CE1-CE2 3.82Å; Y228-F254 HydrophobicContact CE1-CE2 3.82Å; Y228-F254 AromaticContact CE1-CG 3.72Å; Y228-F254 HydrophobicContact CE1-CG 3.72Å; Y228-F254 HydrophobicContact CE1-CZ 4.13Å; A250-F254 PolarHBondContact O-N 3.35Å; L251-F254 WeakPolarHBondContact O-CB 3.41Å; L251-F254 PolarHBondContact O-N 2.94Å; L251-F254 VanDerWaalsContact O-N 3.15Å; R252-F254 VanDerWaalsContact C-N 3.32Å; R252-F254 PolarHBondContact O-N 3.14Å; F254-D256 VanDerWaalsContact C-N 3.3Å; F254-D256 PolarHBondContact O-N 3.02Å; F254-K257 PolarHBondContact O-N 2.63Å; F254-V258 HydrophobicContact CD2-CB 4.38Å; F254-V258 HydrophobicContact CD2-CG2 3.59Å; F254-V258 HydrophobicContact CE2-CB 4.32Å; F254-V258 HydrophobicContact CE2-CG1 4.32Å; F254-V258 HydrophobicContact CE2-CG2 3.76Å; F254-V258 HydrophobicContact CG-CG2 4.21Å; F254-V258 HydrophobicContact CZ-CG1 4.43Å; F254-V258 VanDerWaalsContact O-CB 3.27Å; F254-V258 WeakPolarHBondContact O-CB 3.34Å; F254-V258 WeakPolarHBondContact O-CG2 3.2Å; F254-V258 PolarHBondContact O-N 2.94Å
255	F	95.8	Very high	94	Very high	11 Å²	11	50 Å²	50	5%	0.048	23%	0.228	C	C	.	.	H	α-helix	trans	-70.3	-21.6	-178.6	-68.3	-71.7	0	0	0	114.3	L251 R252 L267 I287 I351	L251-F255 HydrophobicContact CD2-CE2 4.44Å; L251-F255 WeakPolarHBondContact O-CD2 3.18Å; L251-F255 PolarHBondContact O-N 3.41Å; L251-F255 VanDerWaalsContact O-N 3.11Å; R252-F255 PolarHBondContact O-N 3.22Å; F255-L267 HydrophobicContact CE1-CB 4.29Å; F255-L267 HydrophobicContact CE1-CD2 3.72Å; F255-L267 HydrophobicContact CZ-CD1 4.46Å; F255-L267 HydrophobicContact CZ-CD2 4.03Å; F255-I287 HydrophobicContact CE2-CG2 4.37Å; F255-I287 HydrophobicContact CZ-CG2 4.47Å; F255-I351 HydrophobicContact CD2-CB 4.26Å; F255-I351 HydrophobicContact CD2-CG2 4.06Å; F255-I351 HydrophobicContact CE2-CB 4.26Å; F255-I351 HydrophobicContact CE2-CD1 4.06Å; F255-I351 HydrophobicContact CE2-CG2 3.72Å; F255-I351 HydrophobicContact CZ-CD1 4.13Å
256	D	92	Very high	94	Very high	33 Å²	33	39.5 Å²	39.5	18%	0.176	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.7	176.9	-67.1	-9.3	0	0	0	114.5	R94 R252 F254	R94-D256 IonicContact CZ-OD1 3.83Å; R94-D256 IonicContact NE-OD1 2.7Å; R94-D256 PolarHBondContact NE-OD1 3.39Å; R94-D256 IonicContact NH2-OD1 3.93Å; R94-D256 PolarHBondContact NH2-OD1 3.43Å; R252-D256 WeakPolarHBondContact O-CB 3.39Å; R252-D256 PolarHBondContact O-N 2.95Å; F254-D256 VanDerWaalsContact C-N 3.3Å; F254-D256 PolarHBondContact O-N 3.02Å
257	K	92.4	Very high	94.1	Very high	99 Å²	99	33.1 Å²	33.1	43%	0.43	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-24.3	-174.5	-58	-68.6	158.8	-117.9	0	115.2	G95 Y224 Q253 F254	G95-K257 PolarHBondContact O-NZ 2.91Å; Y224-K257 HydrophobicContact CD2-CB 4.21Å; Y224-K257 HydrophobicContact CE1-CB 4.11Å; Y224-K257 HydrophobicContact CE1-CG 4.24Å; Y224-K257 HydrophobicContact CE2-CB 3.69Å; Q253-K257 WeakPolarHBondContact O-CB 3.23Å; Q253-K257 VanDerWaalsContact O-CG 3.27Å; Q253-K257 WeakPolarHBondContact O-CG 3.4Å; Q253-K257 PolarHBondContact O-N 3.48Å; F254-K257 PolarHBondContact O-N 2.63Å
258	V	93.5	Very high	94	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	16%	0.161	C	C	.	.	S	Bend	trans	-84.1	129.8	175.9	176.1	0	0	0	0	109.5	C221 Y224 F254 H262 S263	C221-V258 HydrophobicContact CB-CG1 3.81Å; C221-V258 VanDerWaalsContact SG-CG1 3.55Å; Y224-V258 HydrophobicContact CD2-CG2 3.91Å; Y224-V258 HydrophobicContact CG-CG2 4.07Å; F254-V258 HydrophobicContact CD2-CB 4.38Å; F254-V258 HydrophobicContact CD2-CG2 3.59Å; F254-V258 HydrophobicContact CE2-CB 4.32Å; F254-V258 HydrophobicContact CE2-CG1 4.32Å; F254-V258 HydrophobicContact CE2-CG2 3.76Å; F254-V258 HydrophobicContact CG-CG2 4.21Å; F254-V258 HydrophobicContact CZ-CG1 4.43Å; F254-V258 VanDerWaalsContact O-CB 3.27Å; F254-V258 WeakPolarHBondContact O-CB 3.34Å; F254-V258 WeakPolarHBondContact O-CG2 3.2Å; F254-V258 PolarHBondContact O-N 2.94Å; V258-H262 HydrophobicContact CG1-CB 4Å; V258-S263 PolarHBondContact O-OG 3.35Å
259	P	90.6	Very high	93.8	Very high	59 Å²	59	32.4 Å²	32.4	38%	0.383	16%	0.158	S	C	.	.			trans	-52.9	138	178	-27.6	35	0	0	0	112.5	K261 H262 S263	P259-K261 PolarHBondContact O-N 2.86Å; P259-K261 VanDerWaalsContact O-N 3.11Å; P259-H262 PolarHBondContact O-N 2.77Å; P259-S263 PolarHBondContact O-N 3.38Å; P259-S263 PolarHBondContact O-OG 3.24Å
260	P	87.9	Confident	93.5	Very high	23 Å²	23	27.6 Å²	27.6	15%	0.149	14%	0.14	C	C	.	.	H	α-helix	trans	-49.4	-41.2	-178.2	-31	36.2	0	0	0	113.6	L131 F135 H262 S263 Y264	L131-P260 HydrophobicContact CD2-CG 4.11Å; F135-P260 HydrophobicContact CZ-CB 4.32Å; P260-H262 PolarHBondContact O-N 3Å; P260-S263 WeakPolarHBondContact CA-OG 3.44Å; P260-S263 PolarHBondContact O-N 3.3Å; P260-Y264 HydrophobicContact CB-CD1 4.26Å; P260-Y264 HydrophobicContact CB-CD2 4.44Å; P260-Y264 HydrophobicContact CB-CE1 4.44Å; P260-Y264 HydrophobicContact CB-CG 4.24Å; P260-Y264 WeakPolarHBondContact O-CB 3.29Å; P260-Y264 PolarHBondContact O-N 3.14Å
261	K	85.3	Confident	93.2	Very high	103 Å²	103	28.5 Å²	28.5	45%	0.448	15%	0.145	S	C	.	.	H	α-helix	trans	-46.9	-33	176.3	-176.9	168.9	-178.5	168.1	0	114.2	P259	P259-K261 PolarHBondContact O-N 2.86Å; P259-K261 VanDerWaalsContact O-N 3.11Å
262	H	92	Very high	92.5	Very high	34 Å²	34	31.1 Å²	31.1	16%	0.157	16%	0.162	C	C	.	.	H	α-helix	trans	-99.8	-45.4	178	-57.3	-60.4	0	0	0	113.4	N218 C221 V258 P259 P260 M266	N218-H262 PolarHBondContact ND2-NE2 3.27Å; C221-H262 HydrophobicContact CB-CB 4.04Å; C221-H262 VanDerWaalsContact SG-CB 3.59Å; V258-H262 HydrophobicContact CG1-CB 4Å; P259-H262 PolarHBondContact O-N 2.77Å; P260-H262 PolarHBondContact O-N 3Å; H262-M266 PolarHBondContact O-N 3.49Å
263	S	94.1	Very high	91.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.007	19%	0.188	C	C	.	.	H	α-helix	trans	-69.1	-36.5	-176.7	50.1	0	0	0	0	112.2	V258 P259 P260 L267	V258-S263 PolarHBondContact O-OG 3.35Å; P259-S263 PolarHBondContact O-N 3.38Å; P259-S263 PolarHBondContact O-OG 3.24Å; P260-S263 WeakPolarHBondContact CA-OG 3.44Å; P260-S263 PolarHBondContact O-N 3.3Å; S263-L267 PolarHBondContact O-N 3.02Å
264	Y	93.9	Very high	90.5	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-83.6	-33.1	-178.3	-74.6	31.6	0	0	0	111.3	F135 P260 M266 L267 F268 L344 L345 S348 F403	F135-Y264 AromaticContact CE1-CD2 3.5Å; F135-Y264 HydrophobicContact CE1-CD2 3.5Å; F135-Y264 AromaticContact CE1-CE2 3.33Å; F135-Y264 HydrophobicContact CE1-CE2 3.33Å; F135-Y264 AromaticContact CZ-CD2 3.99Å; F135-Y264 HydrophobicContact CZ-CD2 3.99Å; F135-Y264 AromaticContact CZ-CE2 3.39Å; F135-Y264 HydrophobicContact CZ-CE2 3.39Å; P260-Y264 HydrophobicContact CB-CD1 4.26Å; P260-Y264 HydrophobicContact CB-CD2 4.44Å; P260-Y264 HydrophobicContact CB-CE1 4.44Å; P260-Y264 HydrophobicContact CB-CG 4.24Å; P260-Y264 WeakPolarHBondContact O-CB 3.29Å; P260-Y264 PolarHBondContact O-N 3.14Å; Y264-M266 PolarHBondContact O-N 2.67Å; Y264-L267 PolarHBondContact O-N 3.17Å; Y264-F268 HydrophobicContact CD1-CE2 4.24Å; Y264-F268 AromaticContact CD2-CD2 3.63Å; Y264-F268 HydrophobicContact CD2-CD2 3.63Å; Y264-F268 AromaticContact CD2-CE2 3.42Å; Y264-F268 HydrophobicContact CD2-CE2 3.42Å; Y264-F268 VanDerWaalsContact CD2-CE2 3.42Å; Y264-F268 HydrophobicContact CE2-CD2 4.39Å; Y264-F268 AromaticContact CE2-CE2 3.74Å; Y264-F268 HydrophobicContact CE2-CE2 3.74Å; Y264-F268 AromaticContact CG-CD2 3.76Å; Y264-F268 HydrophobicContact CG-CD2 3.76Å; Y264-F268 AromaticContact CG-CE2 3.71Å; Y264-F268 HydrophobicContact CG-CE2 3.71Å; Y264-F268 PolarHBondContact O-N 3.13Å; Y264-L344 HydrophobicContact CD2-CB 4.26Å; Y264-L344 HydrophobicContact CE2-CB 3.73Å; Y264-L344 PolarHBondContact OH-O 2.91Å; Y264-L345 WeakPolarHBondContact OH-CA 3.28Å; Y264-L345 VanDerWaalsContact OH-CD1 3.25Å; Y264-L345 WeakPolarHBondContact OH-CD1 3.48Å; Y264-S348 PolarHBondContact OH-OG 2.77Å; Y264-F403 VanDerWaalsContact C-CE1 3.48Å; Y264-F403 HydrophobicContact CD2-CE2 4.38Å; Y264-F403 WeakPolarHBondContact O-CE1 3.28Å
265	G	92	Very high	89.4	Confident	14 Å²	14	36 Å²	36	14%	0.144	21%	0.206	C	C	.	.	H	α-helix	trans	-53.4	-37.9	169.2	0	0	0	0	0	112.3	A211 C269	A211-G265 WeakPolarHBondContact CB-O 3.44Å; G265-C269 VanDerWaalsContact O-CB 3.26Å; G265-C269 WeakPolarHBondContact O-CB 3.49Å
266	M	94.3	Very high	88.8	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.02	22%	0.219	C	C	.	.	H	α-helix	trans	-79	-25.7	176	-71.5	-179.4	49.7	0	0	114.5	A211 C215 H262 Y264 T286	A211-M266 HydrophobicContact CB-CG 4.21Å; C215-M266 HydrophobicContact CB-CG 4.49Å; C215-M266 HydrophobicContact CB-SD 3.51Å; C215-M266 VanDerWaalsContact CB-SD 3.51Å; C215-M266 VanDerWaalsContact SG-SD 3.66Å; H262-M266 PolarHBondContact O-N 3.49Å; Y264-M266 PolarHBondContact O-N 2.67Å; M266-T286 HydrophobicContact CB-CG2 4.13Å; M266-T286 HydrophobicContact CE-CG2 4.32Å; M266-T286 PolarHBondContact O-OG1 2.86Å
267	L	96.4	Very high	88.5	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-94.1	-36.8	-174	-178.2	63	0	0	0	113	F255 S263 Y264 R283 I287 Y347 I351 Y359	F255-L267 HydrophobicContact CE1-CB 4.29Å; F255-L267 HydrophobicContact CE1-CD2 3.72Å; F255-L267 HydrophobicContact CZ-CD1 4.46Å; F255-L267 HydrophobicContact CZ-CD2 4.03Å; S263-L267 PolarHBondContact O-N 3.02Å; Y264-L267 PolarHBondContact O-N 3.17Å; L267-R283 WeakPolarHBondContact O-CG 3.41Å; L267-I287 HydrophobicContact CD1-CG2 4.46Å; L267-Y347 HydrophobicContact CD2-CD1 4.46Å; L267-Y347 HydrophobicContact CD2-CE1 4.25Å; L267-I351 HydrophobicContact CD1-CD1 3.88Å; L267-I351 HydrophobicContact CD2-CD1 3.58Å; L267-I351 HydrophobicContact CG-CD1 4.4Å; L267-Y359 WeakPolarHBondContact O-CE2 3.48Å; L267-Y359 PolarHBondContact O-OH 2.94Å
268	F	95.3	Very high	88.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-119.8	15.4	-170.6	-55.1	-57.8	0	0	0	113.1	Y264 S270 L344 Y347 Y359 I400 F403 G404	Y264-F268 HydrophobicContact CD1-CE2 4.24Å; Y264-F268 AromaticContact CD2-CD2 3.63Å; Y264-F268 HydrophobicContact CD2-CD2 3.63Å; Y264-F268 AromaticContact CD2-CE2 3.42Å; Y264-F268 HydrophobicContact CD2-CE2 3.42Å; Y264-F268 VanDerWaalsContact CD2-CE2 3.42Å; Y264-F268 HydrophobicContact CE2-CD2 4.39Å; Y264-F268 AromaticContact CE2-CE2 3.74Å; Y264-F268 HydrophobicContact CE2-CE2 3.74Å; Y264-F268 AromaticContact CG-CD2 3.76Å; Y264-F268 HydrophobicContact CG-CD2 3.76Å; Y264-F268 AromaticContact CG-CE2 3.71Å; Y264-F268 HydrophobicContact CG-CE2 3.71Å; Y264-F268 PolarHBondContact O-N 3.13Å; F268-S270 PolarHBondContact O-N 2.79Å; F268-L344 HydrophobicContact CD1-CD2 4.1Å; F268-L344 HydrophobicContact CD2-CD2 4.07Å; F268-L344 HydrophobicContact CE1-CD2 3.84Å; F268-L344 HydrophobicContact CE2-CB 3.94Å; F268-L344 HydrophobicContact CE2-CD2 3.84Å; F268-L344 HydrophobicContact CE2-CG 4.34Å; F268-L344 HydrophobicContact CG-CD2 4.2Å; F268-L344 HydrophobicContact CZ-CB 4.18Å; F268-L344 HydrophobicContact CZ-CD2 3.69Å; F268-Y347 AromaticContact CE1-CD1 3.51Å; F268-Y347 HydrophobicContact CE1-CD1 3.51Å; F268-Y347 AromaticContact CE1-CE1 3.66Å; F268-Y347 HydrophobicContact CE1-CE1 3.66Å; F268-Y347 HydrophobicContact CE1-CG 4.44Å; F268-Y347 AromaticContact CZ-CD1 3.58Å; F268-Y347 HydrophobicContact CZ-CD1 3.58Å; F268-Y347 HydrophobicContact CZ-CE1 4.11Å; F268-Y347 HydrophobicContact CZ-CG 4.5Å; F268-Y359 WeakPolarHBondContact CD1-OH 3.2Å; F268-I400 HydrophobicContact CB-CG2 4.28Å; F268-I400 HydrophobicContact CD1-CB 4.47Å; F268-I400 HydrophobicContact CD1-CD1 4.17Å; F268-I400 HydrophobicContact CD1-CG1 3.72Å; F268-I400 HydrophobicContact CD1-CG2 4.17Å; F268-I400 HydrophobicContact CE1-CD1 4.23Å; F268-I400 HydrophobicContact CE1-CG1 4Å; F268-F403 HydrophobicContact CB-CD1 3.62Å; F268-F403 HydrophobicContact CB-CE1 4.16Å; F268-F403 HydrophobicContact CB-CG 4.4Å; F268-F403 HydrophobicContact CD2-CD1 4.47Å; F268-G404 WeakPolarHBondContact O-CA 3.31Å
269	C	92.9	Very high	88.3	Confident	7 Å²	7	41 Å²	41	5%	0.047	25%	0.249	C	C	.	.			trans	-49	134.5	172.6	42.3	0	0	0	0	112	N207 C208 G265 R283	N207-C269 HydrophobicContact CB-CB 4.37Å; C208-C269 VanDerWaalsContact CA-SG 3.52Å; C208-C269 HydrophobicContact CB-CB 3.88Å; C208-C269 WeakPolarHBondContact CB-SG 3.44Å; C208-C269 WeakPolarHBondContact SG-CB 3.39Å; C208-C269 CovalentContact SG-SG 2.02Å; C208-C269 PolarHBondContact SG-SG 3.16Å; G265-C269 VanDerWaalsContact O-CB 3.26Å; G265-C269 WeakPolarHBondContact O-CB 3.49Å; C269-R283 VanDerWaalsContact O-CD 3.25Å; C269-R283 WeakPolarHBondContact O-CD 3.27Å; C269-R283 PolarHBondContact O-NH1 3.29Å
270	S	90.9	Very high	88.4	Confident	19 Å²	19	39.8 Å²	39.8	13%	0.133	24%	0.242	C	C	.	.			trans	-66	155.3	166.7	53.2	0	0	0	0	110.4	N207 F268 G404 N405	N207-S270 PolarHBondContact ND2-OG 3.28Å; F268-S270 PolarHBondContact O-N 2.79Å; S270-G404 WeakPolarHBondContact CB-O 3.4Å; S270-G404 PolarHBondContact OG-O 2.97Å; S270-N405 WeakPolarHBondContact CB-OD1 3.39Å
271	C	90.1	Very high	88.7	Confident	28 Å²	28	41.1 Å²	41.1	19%	0.189	25%	0.246	C	C	.	.			trans	-130	115.5	175.7	-71.2	0	0	0	0	108.9	C279 S280	C271-C279 WeakPolarHBondContact CA-SG 3.5Å; C271-C279 HydrophobicContact CB-CB 3.58Å; C271-C279 WeakPolarHBondContact CB-SG 3.34Å; C271-C279 WeakPolarHBondContact SG-CB 3.47Å; C271-C279 CovalentContact SG-SG 2.04Å; C271-C279 PolarHBondContact SG-SG 3.47Å; C271-S280 PolarHBondContact SG-N 2.78Å; C271-S280 VanDerWaalsContact SG-N 3.43Å
272	P	83.6	Confident	89.1	Confident	56 Å²	56	41.5 Å²	41.5	36%	0.364	25%	0.245	S	C	.	.			trans	-67.9	155	178	29.9	-35	0	0	0	110.5	S274 D275 Q276	P272-S274 PolarHBondContact O-N 3.26Å; P272-D275 PolarHBondContact O-N 3.02Å; P272-Q276 WeakPolarHBondContact O-CA 3.34Å; P272-Q276 PolarHBondContact O-N 3.3Å; P272-Q276 VanDerWaalsContact O-N 3.13Å
273	V	79.1	Confident	89.3	Confident	127 Å²	127	40.8 Å²	40.8	77%	0.77	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-59.9	-30.6	-178.1	-176	0	0	0	0	112	D275	V273-D275 VanDerWaalsContact C-N 3.29Å; V273-D275 PolarHBondContact O-N 3.49Å
274	S	71.6	Confident	89.3	Confident	70 Å²	70	41.4 Å²	41.4	49%	0.49	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-61.2	-32.8	178.6	55.3	0	0	0	0	114.4	P272	P272-S274 PolarHBondContact O-N 3.26Å
275	D	74.6	Confident	89.4	Confident	60 Å²	60	45.3 Å²	45.3	32%	0.321	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-127.8	20.4	-170.3	-61.8	-85	0	0	0	111.5	P272 V273 T277 A278 C279	P272-D275 PolarHBondContact O-N 3.02Å; V273-D275 VanDerWaalsContact C-N 3.29Å; V273-D275 PolarHBondContact O-N 3.49Å; D275-T277 VanDerWaalsContact C-N 3.31Å; D275-T277 PolarHBondContact O-N 2.96Å; D275-A278 PolarHBondContact O-N 3.49Å; D275-C279 VanDerWaalsContact O-CB 3.24Å; D275-C279 WeakPolarHBondContact O-CB 3.4Å; D275-C279 PolarHBondContact O-N 3.01Å
276	Q	81.4	Confident	89.7	Confident	69 Å²	69	45.3 Å²	45.3	32%	0.322	26%	0.259	S	S	.	.	H	α-helix	trans	-54.7	-43.3	-165.4	-167.6	177.3	11.5	0	0	112.4	P272 S280 P363	P272-Q276 WeakPolarHBondContact O-CA 3.34Å; P272-Q276 PolarHBondContact O-N 3.3Å; P272-Q276 VanDerWaalsContact O-N 3.13Å; Q276-S280 WeakPolarHBondContact O-CB 3.39Å; Q276-S280 PolarHBondContact O-N 3.06Å; Q276-S280 PolarHBondContact O-OG 3.34Å; Q276-P363 PolarHBondContact NE2-O 3.28Å
277	T	86.9	Confident	89.9	Confident	114 Å²	114	45.2 Å²	45.2	70%	0.699	26%	0.258	S	S	*	.	H	α-helix	trans	-65.8	-53.6	-178.5	-48.3	0	0	0	0	112.2	D275 C279 S280 E281	D275-T277 VanDerWaalsContact C-N 3.31Å; D275-T277 PolarHBondContact O-N 2.96Å; T277-C279 VanDerWaalsContact C-N 3.33Å; T277-C279 PolarHBondContact O-N 3.34Å; T277-S280 PolarHBondContact O-OG 3.03Å; T277-E281 WeakPolarHBondContact O-CB 3.38Å; T277-E281 PolarHBondContact O-N 2.74Å
278	A	89.8	Confident	89.9	Confident	68 Å²	68	46.1 Å²	46.1	56%	0.562	26%	0.264	S	S	*	.	H	α-helix	trans	-68.9	-32.8	-178.1	0	0	0	0	0	112.3	D275 R282	D275-A278 PolarHBondContact O-N 3.49Å; A278-R282 WeakPolarHBondContact O-CB 3.29Å; A278-R282 PolarHBondContact O-N 3.15Å; A278-R282 VanDerWaalsContact O-N 3.16Å
279	C	92.4	Very high	90	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-72.4	-48.5	175.4	-179.2	0	0	0	0	112.8	N206 C208 C271 D275 T277 E281 R282 R283	N206-C279 WeakPolarHBondContact ND2-CA 3.03Å; N206-C279 PolarHBondContact OD1-SG 3.48Å; N206-C279 VanDerWaalsContact OD1-SG 3.35Å; C208-C279 PolarHBondContact SG-SG 3.46Å; C271-C279 WeakPolarHBondContact CA-SG 3.5Å; C271-C279 HydrophobicContact CB-CB 3.58Å; C271-C279 WeakPolarHBondContact CB-SG 3.34Å; C271-C279 WeakPolarHBondContact SG-CB 3.47Å; C271-C279 CovalentContact SG-SG 2.04Å; C271-C279 PolarHBondContact SG-SG 3.47Å; D275-C279 VanDerWaalsContact O-CB 3.24Å; D275-C279 WeakPolarHBondContact O-CB 3.4Å; D275-C279 PolarHBondContact O-N 3.01Å; T277-C279 VanDerWaalsContact C-N 3.33Å; T277-C279 PolarHBondContact O-N 3.34Å; C279-E281 VanDerWaalsContact C-N 3.34Å; C279-E281 PolarHBondContact O-N 2.89Å; C279-R282 WeakPolarHBondContact O-CB 3.5Å; C279-R282 PolarHBondContact O-N 3.18Å; C279-R282 VanDerWaalsContact O-N 3.14Å; C279-R283 PolarHBondContact O-N 3.27Å
280	S	92.3	Very high	90	Very high	34 Å²	34	49 Å²	49	24%	0.238	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-38.1	-179.9	60	0	0	0	0	112.1	C271 Q276 T277 R283 R284	C271-S280 PolarHBondContact SG-N 2.78Å; C271-S280 VanDerWaalsContact SG-N 3.43Å; Q276-S280 WeakPolarHBondContact O-CB 3.39Å; Q276-S280 PolarHBondContact O-N 3.06Å; Q276-S280 PolarHBondContact O-OG 3.34Å; T277-S280 PolarHBondContact O-OG 3.03Å; S280-R283 WeakPolarHBondContact O-CB 3.28Å; S280-R283 PolarHBondContact O-N 2.97Å; S280-R284 WeakPolarHBondContact O-CB 3.43Å; S280-R284 PolarHBondContact O-N 3.23Å
281	E	92.9	Very high	90.3	Very high	51 Å²	51	48.3 Å²	48.3	24%	0.238	28%	0.276	C	S	.	.	H	α-helix	trans	-65.4	-41.7	171.6	-82.2	-66.8	146.3	0	0	111.9	T277 C279 R283 R284 Q285 R361	T277-E281 WeakPolarHBondContact O-CB 3.38Å; T277-E281 PolarHBondContact O-N 2.74Å; C279-E281 VanDerWaalsContact C-N 3.34Å; C279-E281 PolarHBondContact O-N 2.89Å; E281-R283 VanDerWaalsContact C-N 3.28Å; E281-R283 PolarHBondContact O-N 3.06Å; E281-R284 PolarHBondContact O-N 3.41Å; E281-R284 IonicContact OE1-CZ 2.71Å; E281-R284 IonicContact OE1-NE 2.65Å; E281-R284 PolarHBondContact OE1-NE 3.34Å; E281-R284 IonicContact OE1-NH2 2.93Å; E281-R284 PolarHBondContact OE1-NH2 3.27Å; E281-R284 IonicContact OE2-CZ 3.33Å; E281-R284 IonicContact OE2-NE 3.75Å; E281-R284 PolarHBondContact OE2-NE 3.4Å; E281-R284 VanDerWaalsContact OE2-NE 3.13Å; E281-R284 IonicContact OE2-NH2 3.08Å; E281-R284 PolarHBondContact OE2-NH2 3Å; E281-Q285 WeakPolarHBondContact O-CB 3.3Å; E281-Q285 WeakPolarHBondContact O-CG 3.1Å; E281-Q285 PolarHBondContact O-N 3.4Å; E281-R361 IonicContact OE1-CZ 3.3Å; E281-R361 IonicContact OE1-NE 3.88Å; E281-R361 PolarHBondContact OE1-NE 3.32Å; E281-R361 IonicContact OE1-NH2 2.67Å
282	R	94.6	Very high	90.6	Very high	111 Å²	111	47 Å²	47	42%	0.419	27%	0.267	S	S	.	.	H	α-helix	trans	-56.9	-42.2	172.6	-178.4	175.3	-66.8	-80	0.5	111.8	C208 A278 C279 Q285 T286	C208-R282 HydrophobicContact CB-CB 4.33Å; C208-R282 HydrophobicContact CB-CG 3.9Å; A278-R282 WeakPolarHBondContact O-CB 3.29Å; A278-R282 PolarHBondContact O-N 3.15Å; A278-R282 VanDerWaalsContact O-N 3.16Å; C279-R282 WeakPolarHBondContact O-CB 3.5Å; C279-R282 PolarHBondContact O-N 3.18Å; C279-R282 VanDerWaalsContact O-N 3.14Å; R282-Q285 PolarHBondContact O-N 2.92Å; R282-T286 PolarHBondContact O-N 2.83Å; R282-T286 PolarHBondContact O-OG1 2.79Å
283	R	95.1	Very high	91.2	Very high	19 Å²	19	45.6 Å²	45.6	7%	0.072	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-46	176.4	-168.9	172.3	67.3	-159	-1	112.3	L267 C269 C279 S280 E281 Q285 T286 Y359	L267-R283 WeakPolarHBondContact O-CG 3.41Å; C269-R283 VanDerWaalsContact O-CD 3.25Å; C269-R283 WeakPolarHBondContact O-CD 3.27Å; C269-R283 PolarHBondContact O-NH1 3.29Å; C279-R283 PolarHBondContact O-N 3.27Å; S280-R283 WeakPolarHBondContact O-CB 3.28Å; S280-R283 PolarHBondContact O-N 2.97Å; E281-R283 VanDerWaalsContact C-N 3.28Å; E281-R283 PolarHBondContact O-N 3.06Å; R283-Q285 VanDerWaalsContact C-N 3.26Å; R283-Q285 PolarHBondContact O-N 2.9Å; R283-T286 VanDerWaalsContact O-CB 3.32Å; R283-T286 WeakPolarHBondContact O-CB 3.34Å; R283-T286 PolarHBondContact O-N 3.5Å; R283-T286 PolarHBondContact O-OG1 2.7Å; R283-Y359 HydrophobicContact CG-CD2 4.08Å; R283-Y359 HydrophobicContact CG-CE2 3.6Å
284	R	95.9	Very high	91.9	Very high	15 Å²	15	42.7 Å²	42.7	6%	0.057	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-31	177	-166.5	-176.2	71.3	74.2	11.6	112.6	S280 E281 E294 N358 Y359	S280-R284 WeakPolarHBondContact O-CB 3.43Å; S280-R284 PolarHBondContact O-N 3.23Å; E281-R284 PolarHBondContact O-N 3.41Å; E281-R284 IonicContact OE1-CZ 2.71Å; E281-R284 IonicContact OE1-NE 2.65Å; E281-R284 PolarHBondContact OE1-NE 3.34Å; E281-R284 IonicContact OE1-NH2 2.93Å; E281-R284 PolarHBondContact OE1-NH2 3.27Å; E281-R284 IonicContact OE2-CZ 3.33Å; E281-R284 IonicContact OE2-NE 3.75Å; E281-R284 PolarHBondContact OE2-NE 3.4Å; E281-R284 VanDerWaalsContact OE2-NE 3.13Å; E281-R284 IonicContact OE2-NH2 3.08Å; E281-R284 PolarHBondContact OE2-NH2 3Å; R284-E294 IonicContact NH1-OE1 2.87Å; R284-N358 PolarHBondContact O-ND2 3.37Å; R284-Y359 WeakPolarHBondContact CD-O 3.21Å; R284-Y359 WeakPolarHBondContact CG-O 3.27Å
285	Q	96.3	Very high	92.8	Very high	84 Å²	84	44.6 Å²	44.6	39%	0.393	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-80.6	-10.6	179.1	-67.1	-73.8	-1.2	0	0	113.9	E281 R282 R283 I287 V288	E281-Q285 WeakPolarHBondContact O-CB 3.3Å; E281-Q285 WeakPolarHBondContact O-CG 3.1Å; E281-Q285 PolarHBondContact O-N 3.4Å; R282-Q285 PolarHBondContact O-N 2.92Å; R283-Q285 VanDerWaalsContact C-N 3.26Å; R283-Q285 PolarHBondContact O-N 2.9Å; Q285-I287 PolarHBondContact O-N 3.49Å; Q285-V288 PolarHBondContact O-N 3.13Å
286	T	97.2	Very high	93.4	Very high	14 Å²	14	50.4 Å²	50.4	9%	0.086	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-51.9	-34.9	-177.4	-72.9	0	0	0	0	113.6	Y228 M266 R282 R283	Y228-T286 WeakPolarHBondContact CE2-O 3.42Å; Y228-T286 PolarHBondContact OH-O 3.13Å; M266-T286 HydrophobicContact CB-CG2 4.13Å; M266-T286 HydrophobicContact CE-CG2 4.32Å; M266-T286 PolarHBondContact O-OG1 2.86Å; R282-T286 PolarHBondContact O-N 2.83Å; R282-T286 PolarHBondContact O-OG1 2.79Å; R283-T286 VanDerWaalsContact O-CB 3.32Å; R283-T286 WeakPolarHBondContact O-CB 3.34Å; R283-T286 PolarHBondContact O-N 3.5Å; R283-T286 PolarHBondContact O-OG1 2.7Å
287	I	97.6	Very high	93.9	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.01	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-97.9	3.5	-179.3	66.1	169.4	0	0	0	114.7	L251 F255 L267 Q285 S292 I351 T356 N358	L251-I287 HydrophobicContact CD2-CB 4.34Å; L251-I287 HydrophobicContact CD2-CG2 4.48Å; F255-I287 HydrophobicContact CE2-CG2 4.37Å; F255-I287 HydrophobicContact CZ-CG2 4.47Å; L267-I287 HydrophobicContact CD1-CG2 4.46Å; Q285-I287 PolarHBondContact O-N 3.49Å; I287-S292 WeakPolarHBondContact O-CB 3.48Å; I287-S292 PolarHBondContact O-OG 3.14Å; I287-I351 HydrophobicContact CG2-CD1 4.33Å; I287-I351 HydrophobicContact CG2-CG2 3.84Å; I287-T356 HydrophobicContact CD1-CG2 3.91Å; I287-N358 HydrophobicContact CD1-CB 4.01Å
288	V	97.3	Very high	94.2	Very high	21 Å²	21	53.3 Å²	53.3	13%	0.127	26%	0.263	C	S	.	.			trans	57.6	67.7	-173.7	-165.2	0	0	0	0	112.4	Y228 I229 C232 T233 Q285 V290 C291 S292	Y228-V288 HydrophobicContact CE2-CG2 4.43Å; I229-V288 HydrophobicContact CD1-CG2 3.63Å; C232-V288 HydrophobicContact CB-CB 3.94Å; C232-V288 HydrophobicContact CB-CG1 4.06Å; C232-V288 HydrophobicContact CB-CG2 4.07Å; T233-V288 HydrophobicContact CG2-CG1 4.22Å; Q285-V288 PolarHBondContact O-N 3.13Å; V288-V290 VanDerWaalsContact C-N 3.32Å; V288-V290 PolarHBondContact O-N 2.91Å; V288-C291 HydrophobicContact CG1-CB 4.29Å; V288-C291 PolarHBondContact O-N 3.36Å; V288-S292 PolarHBondContact O-N 3.22Å; V288-S292 PolarHBondContact O-OG 2.99Å; V288-S292 VanDerWaalsContact O-OG 3.1Å
289	P	96.7	Very high	94.5	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.2	-36.8	-169.6	18.3	-31.3	0	0	0	115	C291 S292 Y293 E294	P289-C291 PolarHBondContact O-N 2.99Å; P289-S292 PolarHBondContact O-N 2.93Å; P289-Y293 HydrophobicContact CB-CD1 4.24Å; P289-Y293 HydrophobicContact CB-CG 4.49Å; P289-Y293 WeakPolarHBondContact O-CA 2.76Å; P289-Y293 WeakPolarHBondContact O-CB 3.07Å; P289-Y293 PolarHBondContact O-N 2.87Å; P289-E294 PolarHBondContact O-N 2.9Å
290	V	94.4	Very high	94.7	Very high	68 Å²	68	52.7 Å²	52.7	41%	0.412	25%	0.252	S	S	.	.	H	α-helix	trans	-55.6	-22	178	-176.5	0	0	0	0	113	I241 V288	I241-V290 HydrophobicContact CD1-CG1 4.43Å; I241-V290 HydrophobicContact CG2-CG1 4.2Å; V288-V290 VanDerWaalsContact C-N 3.32Å; V288-V290 PolarHBondContact O-N 2.91Å
291	C	95.6	Very high	94.9	Very high	4 Å²	4	51.1 Å²	51.1	3%	0.027	24%	0.241	C	C	.	.	H	α-helix	trans	-110.2	-45.2	175.2	174.9	0	0	0	0	113.3	C232 C242 K244 C247 V288 P289	C232-C291 HydrophobicContact CB-CB 4.33Å; C232-C291 WeakPolarHBondContact O-CB 3.18Å; C232-C291 PolarHBondContact O-SG 3.11Å; C242-C291 HydrophobicContact CB-CB 3.75Å; C242-C291 WeakPolarHBondContact CB-SG 3.46Å; C242-C291 WeakPolarHBondContact SG-CA 3.41Å; C242-C291 WeakPolarHBondContact SG-CB 3.22Å; C242-C291 CovalentContact SG-SG 2.01Å; C242-C291 PolarHBondContact SG-SG 3.03Å; K244-C291 WeakPolarHBondContact CD-O 3.23Å; K244-C291 WeakPolarHBondContact CE-O 3.35Å; K244-C291 WeakPolarHBondContact CG-O 3.2Å; C247-C291 PolarHBondContact SG-SG 3.01Å; V288-C291 HydrophobicContact CG1-CB 4.29Å; V288-C291 PolarHBondContact O-N 3.36Å; P289-C291 PolarHBondContact O-N 2.99Å
292	S	96.5	Very high	95	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-89.1	-24.9	-168.6	64.8	0	0	0	0	114.2	K244 H248 I287 V288 P289	K244-S292 VanDerWaalsContact CE-O 3.28Å; K244-S292 WeakPolarHBondContact CE-O 3.35Å; H248-S292 PolarHBondContact NE2-O 3.29Å; I287-S292 WeakPolarHBondContact O-CB 3.48Å; I287-S292 PolarHBondContact O-OG 3.14Å; V288-S292 PolarHBondContact O-N 3.22Å; V288-S292 PolarHBondContact O-OG 2.99Å; V288-S292 VanDerWaalsContact O-OG 3.1Å; P289-S292 PolarHBondContact O-N 2.93Å
293	Y	96.8	Very high	95	Very high	26 Å²	26	51.1 Å²	51.1	10%	0.102	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-61.5	-169.9	178.1	-113.3	0	0	0	110.6	K244 P289 T356 N358 S368 P369 Y370	K244-Y293 PolarHBondContact NZ-O 3.02Å; P289-Y293 HydrophobicContact CB-CD1 4.24Å; P289-Y293 HydrophobicContact CB-CG 4.49Å; P289-Y293 WeakPolarHBondContact O-CA 2.76Å; P289-Y293 WeakPolarHBondContact O-CB 3.07Å; P289-Y293 PolarHBondContact O-N 2.87Å; Y293-T356 WeakPolarHBondContact CD2-O 3.33Å; Y293-N358 HydrophobicContact CD1-CB 4.16Å; Y293-N358 HydrophobicContact CD2-CB 3.72Å; Y293-N358 HydrophobicContact CE1-CB 4.22Å; Y293-N358 HydrophobicContact CE2-CB 3.78Å; Y293-N358 HydrophobicContact CG-CB 3.94Å; Y293-S368 VanDerWaalsContact CE2-O 3.28Å; Y293-S368 WeakPolarHBondContact CE2-O 2.98Å; Y293-S368 PolarHBondContact OH-O 2.93Å; Y293-S368 VanDerWaalsContact OH-O 3.14Å; Y293-P369 PolarHBondContact OH-O 2.82Å; Y293-Y370 AromaticContact CD1-CD2 3.98Å; Y293-Y370 HydrophobicContact CD1-CD2 3.98Å; Y293-Y370 AromaticContact CE1-CD2 3.65Å; Y293-Y370 HydrophobicContact CE1-CD2 3.65Å; Y293-Y370 HydrophobicContact CE1-CG 4.49Å; Y293-Y370 AromaticContact CZ-CD2 3.96Å; Y293-Y370 WeakPolarHBondContact O-CB 3.41Å
294	E	94.1	Very high	95.1	Very high	65 Å²	65	51.2 Å²	51.2	30%	0.304	25%	0.249	S	C	.	.			trans	-64.3	147	-175.3	-61.4	166.5	-160.4	0	0	111.5	K244 R284 P289 Y370	K244-E294 PolarHBondContact NZ-O 3.05Å; R284-E294 IonicContact NH1-OE1 2.87Å; P289-E294 PolarHBondContact O-N 2.9Å; E294-Y370 HydrophobicContact CB-CE2 4.28Å; E294-Y370 HydrophobicContact CG-CE2 4.17Å
295	E	89.4	Confident	95	Very high	110 Å²	110	51.2 Å²	51.2	51%	0.514	25%	0.249	S	C	.	.			trans	-134.9	169.4	174.1	-65.8	-151.9	-178.9	0	0	110.9	K244 Q297 Y370	K244-E295 IonicContact NZ-OE1 2.76Å; K244-E295 PolarHBondContact NZ-OE1 2.77Å; E295-Q297 VanDerWaalsContact C-N 3.27Å; E295-Q297 PolarHBondContact O-N 3.13Å; E295-Y370 HydrophobicContact CB-CD1 4.06Å; E295-Y370 HydrophobicContact CB-CE1 3.88Å; E295-Y370 HydrophobicContact CG-CD1 4.41Å; E295-Y370 VanDerWaalsContact N-CE1 3.29Å; E295-Y370 PolarHBondContact O-OH 3.5Å
296	K	88.7	Confident	94.8	Very high	182 Å²	182	49.8 Å²	49.8	79%	0.791	25%	0.252	S	S	*	.	S	Bend	trans	-69.5	-25.2	-177.7	-68.1	-177.4	178.4	178.2	0	113.2	A239	A239-K296 PolarHBondContact O-NZ 2.65Å
297	Q	91.1	Very high	94.7	Very high	164 Å²	164	51.9 Å²	51.9	77%	0.766	27%	0.267	S	S	*	.	S	Bend	trans	-136.8	147.1	177.4	-68.8	177.4	-11.7	0	0	107.4	E295 P299	E295-Q297 VanDerWaalsContact C-N 3.27Å; E295-Q297 PolarHBondContact O-N 3.13Å; Q297-P299 WeakPolarHBondContact O-CD 3.25Å
298	M	94.1	Very high	94.6	Very high	81 Å²	81	51.8 Å²	51.8	40%	0.399	27%	0.267	S	S	.	.			trans	-92.4	114.9	174.5	-168.5	164.4	-68.1	0	0	108	Y370 D372	M298-Y370 HydrophobicContact CB-CE1 4.26Å; M298-Y370 HydrophobicContact CE-CD1 4.48Å; M298-Y370 HydrophobicContact CE-CD2 3.99Å; M298-Y370 HydrophobicContact CE-CE1 4.06Å; M298-Y370 HydrophobicContact CE-CE2 3.53Å; M298-Y370 HydrophobicContact CE-CG 4.45Å; M298-Y370 HydrophobicContact CG-CE1 4.44Å; M298-D372 HydrophobicContact CG-CB 4.38Å; M298-D372 HydrophobicContact SD-CB 3.86Å
299	P	95.4	Very high	94.3	Very high	39 Å²	39	55.4 Å²	55.4	25%	0.253	28%	0.278	S	S	.	.			trans	-78.1	165.4	177.7	33.4	-36	0	0	0	111	Q297 L304 C371 D372	Q297-P299 WeakPolarHBondContact O-CD 3.25Å; P299-L304 HydrophobicContact CG-CB 4.4Å; P299-C371 HydrophobicContact CG-CB 4.38Å; P299-C371 VanDerWaalsContact O-CA 3.3Å; P299-C371 WeakPolarHBondContact O-CA 3.24Å; P299-C371 VanDerWaalsContact O-CB 3.24Å; P299-C371 WeakPolarHBondContact O-CB 3.5Å; P299-D372 PolarHBondContact O-N 2.85Å
300	N	96.1	Very high	94.1	Very high	16 Å²	16	60.8 Å²	60.8	9%	0.086	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-66.9	141.3	168.8	-177.4	-81.5	0	0	0	110.4	L302 E303 L304 D372 T374 S376	N300-L302 VanDerWaalsContact C-N 3.27Å; N300-L302 PolarHBondContact O-N 3.38Å; N300-L302 VanDerWaalsContact OD1-CB 3.31Å; N300-L302 WeakPolarHBondContact OD1-CB 3.37Å; N300-L302 PolarHBondContact OD1-N 3.5Å; N300-E303 HydrophobicContact CB-CB 4.39Å; N300-E303 HydrophobicContact CB-CG 3.97Å; N300-E303 PolarHBondContact N-OE2 2.87Å; N300-E303 WeakPolarHBondContact O-CB 3.42Å; N300-E303 PolarHBondContact O-N 3.28Å; N300-E303 VanDerWaalsContact O-N 3.14Å; N300-L304 PolarHBondContact O-N 2.99Å; N300-D372 CarbonylContact C-O 3.26Å; N300-D372 WeakPolarHBondContact CA-O 3.42Å; N300-T374 PolarHBondContact ND2-O 3.19Å; N300-S376 PolarHBondContact ND2-OG 2.94Å
301	C	97	Very high	94	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-30.4	-177.6	-70.5	0	0	0	0	114	L304 Q305 C371 D372 F386	C301-L304 PolarHBondContact O-N 3.37Å; C301-Q305 WeakPolarHBondContact O-CB 3.29Å; C301-Q305 PolarHBondContact O-N 2.82Å; C301-C371 WeakPolarHBondContact CA-SG 3.39Å; C301-C371 HydrophobicContact CB-CB 3.88Å; C301-C371 WeakPolarHBondContact CB-SG 3.45Å; C301-C371 WeakPolarHBondContact SG-CB 3.24Å; C301-C371 CovalentContact SG-SG 2.04Å; C301-C371 PolarHBondContact SG-SG 3.12Å; C301-D372 PolarHBondContact N-O 2.92Å; C301-D372 PolarHBondContact SG-O 2.98Å; C301-F386 HydrophobicContact CB-CD1 3.77Å; C301-F386 HydrophobicContact CB-CE1 3.84Å
302	L	95.6	Very high	93.8	Very high	37 Å²	37	63.8 Å²	63.8	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-72.2	-35.1	175.8	-58	179.2	0	0	0	111.9	N300 Q305 A306 N379 C383	N300-L302 VanDerWaalsContact C-N 3.27Å; N300-L302 PolarHBondContact O-N 3.38Å; N300-L302 VanDerWaalsContact OD1-CB 3.31Å; N300-L302 WeakPolarHBondContact OD1-CB 3.37Å; N300-L302 PolarHBondContact OD1-N 3.5Å; L302-Q305 PolarHBondContact O-N 3.03Å; L302-A306 WeakPolarHBondContact O-CB 3.31Å; L302-A306 PolarHBondContact O-N 2.89Å; L302-N379 HydrophobicContact CD1-CB 3.59Å; L302-C383 HydrophobicContact CD1-CB 4.02Å; L302-C383 HydrophobicContact CD2-CB 4.26Å; L302-C383 HydrophobicContact CG-CB 3.91Å
303	E	94.7	Very high	93.7	Very high	126 Å²	126	64.8 Å²	64.8	59%	0.589	33%	0.325	S	S	*	.	H	α-helix	trans	-65.6	-43	171.9	-63.9	175.9	151.1	0	0	111.1	N300 Q305 A306 S307	N300-E303 HydrophobicContact CB-CB 4.39Å; N300-E303 HydrophobicContact CB-CG 3.97Å; N300-E303 PolarHBondContact N-OE2 2.87Å; N300-E303 WeakPolarHBondContact O-CB 3.42Å; N300-E303 PolarHBondContact O-N 3.28Å; N300-E303 VanDerWaalsContact O-N 3.14Å; E303-Q305 VanDerWaalsContact C-N 3.32Å; E303-Q305 PolarHBondContact O-N 3.35Å; E303-A306 PolarHBondContact O-N 3.17Å; E303-S307 WeakPolarHBondContact O-CB 3.06Å; E303-S307 PolarHBondContact O-N 2.79Å
304	L	95.8	Very high	93.7	Very high	20 Å²	20	63.6 Å²	63.6	11%	0.105	32%	0.32	C	S	.	.	H	α-helix	trans	-64.3	-38.1	175	-172.4	62.4	0	0	0	111.5	P299 N300 C301 S307 C308 V354 M355 P369 C371	P299-L304 HydrophobicContact CG-CB 4.4Å; N300-L304 PolarHBondContact O-N 2.99Å; C301-L304 PolarHBondContact O-N 3.37Å; L304-S307 PolarHBondContact O-N 3.44Å; L304-C308 WeakPolarHBondContact O-CB 3.06Å; L304-C308 PolarHBondContact O-N 3.45Å; L304-V354 HydrophobicContact CD1-CB 4.41Å; L304-M355 HydrophobicContact CB-CE 4.22Å; L304-M355 HydrophobicContact CD2-CE 4.19Å; L304-M355 HydrophobicContact CD2-SD 3.9Å; L304-M355 HydrophobicContact CG-CE 3.77Å; L304-M355 HydrophobicContact CG-SD 4.12Å; L304-P369 HydrophobicContact CD2-CB 4.1Å; L304-C371 HydrophobicContact CB-CB 4.42Å; L304-C371 HydrophobicContact CD2-CB 3.86Å
305	Q	94.6	Very high	93.7	Very high	16 Å²	16	61.6 Å²	61.6	8%	0.075	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-45.6	173.5	-166.6	-162.6	60.1	0	0	111.3	C301 L302 E303 C308 R309 L318 M355 F386	C301-Q305 WeakPolarHBondContact O-CB 3.29Å; C301-Q305 PolarHBondContact O-N 2.82Å; L302-Q305 PolarHBondContact O-N 3.03Å; E303-Q305 VanDerWaalsContact C-N 3.32Å; E303-Q305 PolarHBondContact O-N 3.35Å; Q305-C308 WeakPolarHBondContact O-CB 3.38Å; Q305-C308 PolarHBondContact O-N 3.03Å; Q305-R309 WeakPolarHBondContact O-CG 3.27Å; Q305-R309 PolarHBondContact O-N 2.84Å; Q305-L318 HydrophobicContact CG-CD2 4.08Å; Q305-M355 HydrophobicContact CB-CE 4.16Å; Q305-F386 HydrophobicContact CB-CE2 4.25Å; Q305-F386 HydrophobicContact CB-CZ 4.35Å; Q305-F386 HydrophobicContact CG-CD2 4.4Å; Q305-F386 HydrophobicContact CG-CE2 3.87Å; Q305-F386 HydrophobicContact CG-CZ 4.42Å
306	A	92.8	Very high	93.9	Very high	53 Å²	53	56.3 Å²	56.3	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-46.8	175.8	0	0	0	0	0	111.5	L302 E303 C308 R309 T310	L302-A306 WeakPolarHBondContact O-CB 3.31Å; L302-A306 PolarHBondContact O-N 2.89Å; E303-A306 PolarHBondContact O-N 3.17Å; A306-C308 VanDerWaalsContact C-N 3.34Å; A306-C308 PolarHBondContact O-N 2.04Å; A306-R309 PolarHBondContact O-N 2.94Å; A306-R309 VanDerWaalsContact O-N 3.16Å; A306-T310 WeakPolarHBondContact O-CG2 3.34Å; A306-T310 PolarHBondContact O-N 3.43Å
307	S	94.8	Very high	94.2	Very high	59 Å²	59	47.8 Å²	47.8	41%	0.413	25%	0.248	S	C	.	.	H	α-helix	trans	-57.4	-45	173.9	-178	0	0	0	0	111.9	E303 L304 R309 T310	E303-S307 WeakPolarHBondContact O-CB 3.06Å; E303-S307 PolarHBondContact O-N 2.79Å; L304-S307 PolarHBondContact O-N 3.44Å; S307-R309 PolarHBondContact O-N 2.89Å; S307-T310 PolarHBondContact O-N 3.27Å; S307-T310 PolarHBondContact O-OG1 3.15Å
308	C	94.9	Very high	94.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.3	-43.2	175	-175.7	0	0	0	0	112.6	L304 Q305 A306 T310 N311 C314 R315 L318 V354 M355	L304-C308 WeakPolarHBondContact O-CB 3.06Å; L304-C308 PolarHBondContact O-N 3.45Å; Q305-C308 WeakPolarHBondContact O-CB 3.38Å; Q305-C308 PolarHBondContact O-N 3.03Å; A306-C308 VanDerWaalsContact C-N 3.34Å; A306-C308 PolarHBondContact O-N 2.04Å; C308-T310 VanDerWaalsContact C-N 3.27Å; C308-T310 PolarHBondContact O-N 3.25Å; C308-N311 PolarHBondContact O-N 3.12Å; C308-N311 VanDerWaalsContact O-O 3.13Å; C308-C314 VanDerWaalsContact CA-SG 3.56Å; C308-C314 HydrophobicContact CB-CB 4.04Å; C308-C314 WeakPolarHBondContact CB-SG 3.28Å; C308-C314 WeakPolarHBondContact O-CB 3.31Å; C308-C314 WeakPolarHBondContact SG-CB 3.4Å; C308-C314 PolarHBondContact SG-O 3.1Å; C308-C314 CovalentContact SG-SG 2.04Å; C308-C314 PolarHBondContact SG-SG 3.23Å; C308-R315 PolarHBondContact O-N 3.35Å; C308-L318 HydrophobicContact CB-CD2 4.47Å; C308-V354 HydrophobicContact CB-CG2 3.87Å; C308-M355 HydrophobicContact CB-CB 4.29Å; C308-M355 HydrophobicContact CB-CE 4.14Å
309	R	91.4	Very high	94.3	Very high	96 Å²	96	36.5 Å²	36.5	36%	0.362	20%	0.195	S	C	.	.	H	α-helix	trans	-61	-30.1	177.7	-75.9	175.3	170.9	169.4	-1.9	113.2	Q305 A306 S307 N311 R315	Q305-R309 WeakPolarHBondContact O-CG 3.27Å; Q305-R309 PolarHBondContact O-N 2.84Å; A306-R309 PolarHBondContact O-N 2.94Å; A306-R309 VanDerWaalsContact O-N 3.16Å; S307-R309 PolarHBondContact O-N 2.89Å; R309-N311 VanDerWaalsContact C-N 3.25Å; R309-N311 PolarHBondContact O-N 3.16Å; R309-R315 HydrophobicContact CG-CG 4.5Å
310	T	91.4	Very high	94.2	Very high	114 Å²	114	35.3 Å²	35.3	70%	0.699	19%	0.187	S	C	*	.	H	α-helix	trans	-66.4	-25.2	174.6	74.2	0	0	0	0	113.7	A306 S307 C308	A306-T310 WeakPolarHBondContact O-CG2 3.34Å; A306-T310 PolarHBondContact O-N 3.43Å; S307-T310 PolarHBondContact O-N 3.27Å; S307-T310 PolarHBondContact O-OG1 3.15Å; C308-T310 VanDerWaalsContact C-N 3.27Å; C308-T310 PolarHBondContact O-N 3.25Å
311	N	92.9	Very high	94.1	Very high	64 Å²	64	34.6 Å²	34.6	34%	0.342	18%	0.183	S	C	.	.	S	Bend	trans	-102.4	108.8	-175.7	-178.5	-21.2	0	0	0	110.1	C308 R309 I313 C314 R315	C308-N311 PolarHBondContact O-N 3.12Å; C308-N311 VanDerWaalsContact O-O 3.13Å; R309-N311 VanDerWaalsContact C-N 3.25Å; R309-N311 PolarHBondContact O-N 3.16Å; N311-I313 CarbonylContact O-C 3.59Å; N311-I313 PolarHBondContact O-N 3.22Å; N311-I313 PolarHBondContact OD1-N 2.88Å; N311-I313 VanDerWaalsContact OD1-N 3.09Å; N311-C314 HydrophobicContact CB-CB 4.09Å; N311-C314 PolarHBondContact O-N 2.92Å; N311-R315 PolarHBondContact O-N 3.36Å
312	Y	92.4	Very high	93.9	Very high	71 Å²	71	35 Å²	35	28%	0.278	19%	0.185	S	C	.	.	H	α-helix	trans	-47	-36	-179.3	-63.4	-57.4	0	0	0	114.7	R104 W107 S316	R104-Y312 HydrophobicContact CB-CD2 4.1Å; R104-Y312 HydrophobicContact CB-CE2 3.96Å; R104-Y312 HydrophobicContact CG-CD2 4.47Å; R104-Y312 HydrophobicContact CG-CE2 3.84Å; W107-Y312 HydrophobicContact CB-CD1 3.95Å; W107-Y312 HydrophobicContact CB-CE1 3.78Å; W107-Y312 AromaticContact CD1-CD1 3.43Å; W107-Y312 VanDerWaalsContact CD1-CD1 3.43Å; W107-Y312 AromaticContact CG-CD1 3.92Å; W107-Y312 HydrophobicContact CG-CD1 3.92Å; W107-Y312 HydrophobicContact CG-CE1 4.23Å; Y312-S316 WeakPolarHBondContact O-CB 3.08Å; Y312-S316 PolarHBondContact O-N 3.44Å; Y312-S316 PolarHBondContact O-OG 2.83Å
313	I	94.1	Very high	93.6	Very high	22 Å²	22	35 Å²	35	11%	0.113	19%	0.186	C	C	.	.	H	α-helix	trans	-70.1	-47.5	176.8	-60.8	175.3	0	0	0	110.5	K100 L103 N311 R317 T353	K100-I313 HydrophobicContact CB-CD1 4.43Å; L103-I313 HydrophobicContact CD1-CG1 4.11Å; N311-I313 CarbonylContact O-C 3.59Å; N311-I313 PolarHBondContact O-N 3.22Å; N311-I313 PolarHBondContact OD1-N 2.88Å; N311-I313 VanDerWaalsContact OD1-N 3.09Å; I313-R317 HydrophobicContact CG2-CG 4.42Å; I313-R317 WeakPolarHBondContact O-CG 3.12Å; I313-R317 PolarHBondContact O-N 3.08Å; I313-T353 HydrophobicContact CG2-CG2 4.38Å
314	C	95.6	Very high	93.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66	-50.7	-178.4	-166.9	0	0	0	0	111.2	C308 N311 S316 R317 L318 T353 V354	C308-C314 VanDerWaalsContact CA-SG 3.56Å; C308-C314 HydrophobicContact CB-CB 4.04Å; C308-C314 WeakPolarHBondContact CB-SG 3.28Å; C308-C314 WeakPolarHBondContact O-CB 3.31Å; C308-C314 WeakPolarHBondContact SG-CB 3.4Å; C308-C314 PolarHBondContact SG-O 3.1Å; C308-C314 CovalentContact SG-SG 2.04Å; C308-C314 PolarHBondContact SG-SG 3.23Å; N311-C314 HydrophobicContact CB-CB 4.09Å; N311-C314 PolarHBondContact O-N 2.92Å; C314-S316 VanDerWaalsContact C-N 3.31Å; C314-S316 PolarHBondContact O-N 2.03Å; C314-R317 PolarHBondContact O-N 3.33Å; C314-L318 WeakPolarHBondContact O-CB 3.5Å; C314-L318 PolarHBondContact O-N 2.8Å; C314-T353 HydrophobicContact CB-CG2 4.44Å; C314-T353 PolarHBondContact SG-OG1 3.18Å; C314-V354 HydrophobicContact CB-CG2 4.25Å; C314-V354 WeakPolarHBondContact SG-CG2 3.47Å
315	R	94.1	Very high	93.3	Very high	23 Å²	23	29 Å²	29	9%	0.087	16%	0.158	C	C	.	.	H	α-helix	trans	-47.6	-52.9	174.2	-170.5	-177	-177.9	-173.7	4.3	111.8	W107 E120 C308 R309 N311 R317 L318 A319	W107-R315 VanDerWaalsContact CE3-CZ 3.42Å; W107-R315 HydrophobicContact CH2-CG 4.23Å; W107-R315 HydrophobicContact CZ2-CB 4.48Å; W107-R315 HydrophobicContact CZ2-CG 3.72Å; W107-R315 VanDerWaalsContact CZ3-CZ 3.46Å; E120-R315 IonicContact OE1-CZ 3.66Å; E120-R315 VanDerWaalsContact OE1-CZ 3.3Å; E120-R315 IonicContact OE1-NE 3.51Å; E120-R315 PolarHBondContact OE1-NE 3.23Å; E120-R315 VanDerWaalsContact OE1-NE 3.08Å; E120-R315 IonicContact OE1-NH2 2.67Å; E120-R315 PolarHBondContact OE1-NH2 3.22Å; E120-R315 VanDerWaalsContact OE2-CG 3.26Å; E120-R315 WeakPolarHBondContact OE2-CG 3.1Å; E120-R315 IonicContact OE2-CZ 3.37Å; E120-R315 IonicContact OE2-NE 3.9Å; E120-R315 PolarHBondContact OE2-NE 3.34Å; E120-R315 IonicContact OE2-NH2 3.69Å; C308-R315 PolarHBondContact O-N 3.35Å; R309-R315 HydrophobicContact CG-CG 4.5Å; N311-R315 PolarHBondContact O-N 3.36Å; R315-R317 PolarHBondContact O-N 3.45Å; R315-L318 PolarHBondContact O-N 3.28Å; R315-A319 PolarHBondContact O-N 3.17Å
316	S	94	Very high	93.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.5	-37.1	180	-66.2	0	0	0	0	114.1	L103 W107 P123 Y312 C314 D320	L103-S316 WeakPolarHBondContact CD2-OG 2.98Å; W107-S316 PolarHBondContact NE1-OG 3.38Å; P123-S316 VanDerWaalsContact CG-CB 3.43Å; P123-S316 VanDerWaalsContact CG-OG 3.24Å; P123-S316 WeakPolarHBondContact CG-OG 3.32Å; Y312-S316 WeakPolarHBondContact O-CB 3.08Å; Y312-S316 PolarHBondContact O-N 3.44Å; Y312-S316 PolarHBondContact O-OG 2.83Å; C314-S316 VanDerWaalsContact C-N 3.31Å; C314-S316 PolarHBondContact O-N 2.03Å; S316-D320 VanDerWaalsContact O-CB 3.31Å; S316-D320 WeakPolarHBondContact O-CB 3.04Å; S316-D320 PolarHBondContact O-N 2.64Å; S316-D320 VanDerWaalsContact O-N 3.14Å
317	R	94.9	Very high	93	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-73.3	-33.2	177.3	-67.1	-69.9	-160.5	-115.6	-22.2	112.1	E99 Y124 I313 C314 R315 F321 G349 L350 T353	E99-R317 IonicContact OE1-CZ 3.49Å; E99-R317 IonicContact OE1-NH1 3.13Å; E99-R317 PolarHBondContact OE1-NH1 2.91Å; E99-R317 IonicContact OE1-NH2 3.35Å; E99-R317 PolarHBondContact OE1-NH2 2.67Å; E99-R317 IonicContact OE2-NH2 2.92Å; Y124-R317 VanDerWaalsContact CE1-NH1 3.26Å; Y124-R317 VanDerWaalsContact CE2-NH1 3.31Å; Y124-R317 PolarHBondContact OH-NH1 3.05Å; I313-R317 HydrophobicContact CG2-CG 4.42Å; I313-R317 WeakPolarHBondContact O-CG 3.12Å; I313-R317 PolarHBondContact O-N 3.08Å; C314-R317 PolarHBondContact O-N 3.33Å; R315-R317 PolarHBondContact O-N 3.45Å; R317-F321 WeakPolarHBondContact O-CB 3.32Å; R317-F321 PolarHBondContact O-N 3.47Å; R317-G349 WeakPolarHBondContact CD-O 3.47Å; R317-G349 VanDerWaalsContact CG-O 3.23Å; R317-G349 WeakPolarHBondContact CG-O 3.27Å; R317-G349 PolarHBondContact NE-O 2.94Å; R317-L350 HydrophobicContact CB-CD2 3.97Å; R317-T353 HydrophobicContact CG-CG2 4.47Å
318	L	95.2	Very high	92.7	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-71.9	-42.8	177	-176.2	58.3	0	0	0	111.9	Q305 C308 C314 R315 D320 F321 F322 L350 M355 F390	Q305-L318 HydrophobicContact CG-CD2 4.08Å; C308-L318 HydrophobicContact CB-CD2 4.47Å; C314-L318 WeakPolarHBondContact O-CB 3.5Å; C314-L318 PolarHBondContact O-N 2.8Å; R315-L318 PolarHBondContact O-N 3.28Å; L318-D320 VanDerWaalsContact C-N 3.34Å; L318-D320 PolarHBondContact O-N 3.34Å; L318-F321 PolarHBondContact O-N 3.23Å; L318-F322 HydrophobicContact CD1-CD2 4.19Å; L318-F322 HydrophobicContact CD1-CE2 3.59Å; L318-F322 HydrophobicContact CD1-CZ 3.81Å; L318-F322 HydrophobicContact CD2-CE2 4.13Å; L318-F322 HydrophobicContact CG-CD2 4.06Å; L318-F322 HydrophobicContact CG-CE2 3.54Å; L318-F322 HydrophobicContact CG-CZ 4.25Å; L318-F322 VanDerWaalsContact O-CD2 3.25Å; L318-F322 WeakPolarHBondContact O-CD2 3.32Å; L318-F322 PolarHBondContact O-N 2.87Å; L318-L350 HydrophobicContact CB-CD2 4.21Å; L318-L350 HydrophobicContact CD1-CD2 4.39Å; L318-M355 HydrophobicContact CD1-CG 4.24Å; L318-M355 HydrophobicContact CD2-CE 4.36Å; L318-F390 HydrophobicContact CD1-CZ 4.05Å
319	A	92.8	Very high	92.2	Very high	4 Å²	4	35.9 Å²	35.9	3%	0.033	19%	0.19	C	C	.	.	H	α-helix	trans	-58.3	-45.3	170.2	0	0	0	0	0	111.8	E120 R315 F321 F322 V323	E120-A319 HydrophobicContact CB-CB 4.06Å; R315-A319 PolarHBondContact O-N 3.17Å; A319-F321 VanDerWaalsContact C-N 3.28Å; A319-F321 PolarHBondContact O-N 3.24Å; A319-F322 PolarHBondContact O-N 3.32Å; A319-V323 WeakPolarHBondContact O-CB 3.47Å; A319-V323 WeakPolarHBondContact O-CG2 3.48Å; A319-V323 PolarHBondContact O-N 3.3Å
320	D	92.6	Very high	92	Very high	14 Å²	14	42.6 Å²	42.6	8%	0.075	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-35	177.1	-158.6	43.8	0	0	0	112.7	S122 Y124 S316 L318 N324 A346	S122-D320 WeakPolarHBondContact CB-OD1 3.34Å; S122-D320 PolarHBondContact OG-OD1 3.3Å; Y124-D320 HydrophobicContact CD2-CB 4.18Å; S316-D320 VanDerWaalsContact O-CB 3.31Å; S316-D320 WeakPolarHBondContact O-CB 3.04Å; S316-D320 PolarHBondContact O-N 2.64Å; S316-D320 VanDerWaalsContact O-N 3.14Å; L318-D320 VanDerWaalsContact C-N 3.34Å; L318-D320 PolarHBondContact O-N 3.34Å; D320-N324 WeakPolarHBondContact O-CB 3.25Å; D320-N324 PolarHBondContact O-N 2.84Å; D320-N324 VanDerWaalsContact O-N 3.14Å; D320-N324 PolarHBondContact O-ND2 3.25Å; D320-N324 PolarHBondContact OD1-ND2 3.28Å; D320-A346 WeakPolarHBondContact O-CB 3.29Å
321	F	94.6	Very high	91.8	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-68.8	-47.9	174.6	-180	-110.3	0	0	0	112.4	R317 L318 A319 V323 N324 C325 A346 Y347 L350 F389 F390 L396	R317-F321 WeakPolarHBondContact O-CB 3.32Å; R317-F321 PolarHBondContact O-N 3.47Å; L318-F321 PolarHBondContact O-N 3.23Å; A319-F321 VanDerWaalsContact C-N 3.28Å; A319-F321 PolarHBondContact O-N 3.24Å; F321-V323 VanDerWaalsContact C-N 3.3Å; F321-V323 PolarHBondContact O-N 2.94Å; F321-N324 PolarHBondContact O-N 3.14Å; F321-C325 HydrophobicContact CD2-CB 4.03Å; F321-C325 VanDerWaalsContact CD2-SG 3.54Å; F321-C325 HydrophobicContact CE2-CB 3.81Å; F321-C325 WeakPolarHBondContact CE2-SG 3.13Å; F321-C325 HydrophobicContact CZ-CB 4.33Å; F321-C325 WeakPolarHBondContact O-CB 3.34Å; F321-C325 PolarHBondContact O-N 3.16Å; F321-A346 HydrophobicContact CB-CB 4.29Å; F321-A346 HydrophobicContact CD2-CB 4.47Å; F321-Y347 HydrophobicContact CE2-CD2 4.09Å; F321-L350 HydrophobicContact CB-CD1 4.01Å; F321-L350 HydrophobicContact CB-CG 4.42Å; F321-L350 HydrophobicContact CD1-CD1 4.01Å; F321-L350 HydrophobicContact CD2-CD1 4.14Å; F321-L350 HydrophobicContact CG-CD1 3.79Å; F321-F389 HydrophobicContact CD1-CD1 4.17Å; F321-F389 HydrophobicContact CD1-CE1 4Å; F321-F389 AromaticContact CE1-CD1 3.63Å; F321-F389 HydrophobicContact CE1-CD1 3.63Å; F321-F389 AromaticContact CE1-CE1 3.74Å; F321-F389 HydrophobicContact CE1-CE1 3.74Å; F321-F389 HydrophobicContact CZ-CD1 4.35Å; F321-F389 HydrophobicContact CZ-CE1 4.31Å; F321-F390 HydrophobicContact CD1-CD1 4.44Å; F321-F390 AromaticContact CD1-CE1 3.72Å; F321-F390 HydrophobicContact CD1-CE1 3.72Å; F321-F390 AromaticContact CD1-CZ 3.82Å; F321-F390 HydrophobicContact CD1-CZ 3.82Å; F321-F390 AromaticContact CE1-CD1 3.48Å; F321-F390 HydrophobicContact CE1-CD1 3.48Å; F321-F390 VanDerWaalsContact CE1-CD1 3.48Å; F321-F390 HydrophobicContact CE1-CD2 4.41Å; F321-F390 AromaticContact CE1-CE1 3.17Å; F321-F390 HydrophobicContact CE1-CE1 3.17Å; F321-F390 HydrophobicContact CE1-CE2 4.16Å; F321-F390 HydrophobicContact CE1-CG 4.1Å; F321-F390 AromaticContact CE1-CZ 3.55Å; F321-F390 HydrophobicContact CE1-CZ 3.55Å; F321-F390 AromaticContact CZ-CD1 3.7Å; F321-F390 HydrophobicContact CZ-CD1 3.7Å; F321-F390 AromaticContact CZ-CE1 3.73Å; F321-F390 HydrophobicContact CZ-CE1 3.73Å; F321-F390 HydrophobicContact CZ-CG 4.48Å; F321-L396 HydrophobicContact CE2-CD2 4.01Å; F321-L396 HydrophobicContact CZ-CD2 3.96Å
322	F	92.3	Very high	91.3	Very high	9 Å²	9	42.3 Å²	42.3	4%	0.039	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-38.3	176.3	-70.3	-51	0	0	0	112.8	L119 L318 A319 F386 F389	L119-F322 HydrophobicContact CD2-CB 4.15Å; L318-F322 HydrophobicContact CD1-CD2 4.19Å; L318-F322 HydrophobicContact CD1-CE2 3.59Å; L318-F322 HydrophobicContact CD1-CZ 3.81Å; L318-F322 HydrophobicContact CD2-CE2 4.13Å; L318-F322 HydrophobicContact CG-CD2 4.06Å; L318-F322 HydrophobicContact CG-CE2 3.54Å; L318-F322 HydrophobicContact CG-CZ 4.25Å; L318-F322 VanDerWaalsContact O-CD2 3.25Å; L318-F322 WeakPolarHBondContact O-CD2 3.32Å; L318-F322 PolarHBondContact O-N 2.87Å; A319-F322 PolarHBondContact O-N 3.32Å; F322-F386 AromaticContact CZ-CD2 3.83Å; F322-F386 HydrophobicContact CZ-CD2 3.83Å; F322-F386 AromaticContact CZ-CE2 3.75Å; F322-F386 HydrophobicContact CZ-CE2 3.75Å; F322-F389 AromaticContact CD1-CD1 3.51Å; F322-F389 HydrophobicContact CD1-CD1 3.51Å; F322-F389 HydrophobicContact CD1-CD2 4.2Å; F322-F389 AromaticContact CD1-CE1 3.48Å; F322-F389 HydrophobicContact CD1-CE1 3.48Å; F322-F389 VanDerWaalsContact CD1-CE1 3.48Å; F322-F389 HydrophobicContact CD1-CE2 4.14Å; F322-F389 AromaticContact CD1-CG 3.91Å; F322-F389 HydrophobicContact CD1-CG 3.91Å; F322-F389 AromaticContact CD1-CZ 3.8Å; F322-F389 HydrophobicContact CD1-CZ 3.8Å; F322-F389 HydrophobicContact CE1-CB 4.29Å; F322-F389 AromaticContact CE1-CD1 3.61Å; F322-F389 HydrophobicContact CE1-CD1 3.61Å; F322-F389 HydrophobicContact CE1-CD2 4.44Å; F322-F389 HydrophobicContact CE1-CE1 4.09Å; F322-F389 AromaticContact CE1-CG 3.85Å; F322-F389 HydrophobicContact CE1-CG 3.85Å; F322-F389 HydrophobicContact CG-CE1 4.48Å
323	V	90	Very high	90.8	Very high	36 Å²	36	39.1 Å²	39.1	22%	0.218	20%	0.199	C	C	.	.	H	α-helix	trans	-74.2	-34.3	-178.6	168.6	0	0	0	0	113.4	A319 F321	A319-V323 WeakPolarHBondContact O-CB 3.47Å; A319-V323 WeakPolarHBondContact O-CG2 3.48Å; A319-V323 PolarHBondContact O-N 3.3Å; F321-V323 VanDerWaalsContact C-N 3.3Å; F321-V323 PolarHBondContact O-N 2.94Å
324	N	89.8	Confident	90.4	Very high	21 Å²	21	38.3 Å²	38.3	11%	0.112	20%	0.196	C	C	.	.	H	α-helix	trans	-104.1	-23.2	-172.3	-62.5	-49.7	0	0	0	114.6	D320 F321 K337 D342 A346	D320-N324 WeakPolarHBondContact O-CB 3.25Å; D320-N324 PolarHBondContact O-N 2.84Å; D320-N324 VanDerWaalsContact O-N 3.14Å; D320-N324 PolarHBondContact O-ND2 3.25Å; D320-N324 PolarHBondContact OD1-ND2 3.28Å; F321-N324 PolarHBondContact O-N 3.14Å; N324-K337 PolarHBondContact OD1-NZ 2.94Å; N324-D342 HydrophobicContact CB-CB 4.01Å; N324-A346 HydrophobicContact CB-CB 4.18Å
325	C	93	Very high	90	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-99.9	20.7	172.8	-65	0	0	0	0	113	F321 S327 C343 F389 N393	F321-C325 HydrophobicContact CD2-CB 4.03Å; F321-C325 VanDerWaalsContact CD2-SG 3.54Å; F321-C325 HydrophobicContact CE2-CB 3.81Å; F321-C325 WeakPolarHBondContact CE2-SG 3.13Å; F321-C325 HydrophobicContact CZ-CB 4.33Å; F321-C325 WeakPolarHBondContact O-CB 3.34Å; F321-C325 PolarHBondContact O-N 3.16Å; C325-S327 PolarHBondContact O-N 2.8Å; C325-C343 VanDerWaalsContact CA-SG 3.55Å; C325-C343 HydrophobicContact CB-CB 4.07Å; C325-C343 WeakPolarHBondContact CB-SG 3.21Å; C325-C343 VanDerWaalsContact SG-C 3.56Å; C325-C343 WeakPolarHBondContact SG-CA 3.28Å; C325-C343 WeakPolarHBondContact SG-CB 3.49Å; C325-C343 PolarHBondContact SG-O 3.4Å; C325-C343 CovalentContact SG-SG 2.04Å; C325-C343 PolarHBondContact SG-SG 3.43Å; C325-F389 HydrophobicContact CB-CE1 4.41Å; C325-N393 PolarHBondContact O-ND2 2.87Å; C325-N393 PolarHBondContact O-OD1 2.99Å
326	M	91.6	Very high	89.5	Confident	51 Å²	51	41.8 Å²	41.8	25%	0.251	22%	0.216	S	C	.	.			trans	-64.2	121.6	177.5	-166.2	173.7	-68.5	0	0	110.6	L119 L336	L119-M326 HydrophobicContact CD1-CE 3.66Å; L119-M326 HydrophobicContact CD2-CE 3.94Å; L119-M326 HydrophobicContact CG-CE 4.47Å; M326-L336 HydrophobicContact CB-CB 4.38Å; M326-L336 PolarHBondContact O-N 3.07Å; M326-L336 VanDerWaalsContact O-N 3.15Å; M326-L336 HydrophobicContact SD-CD2 3.79Å
327	S	90.6	Very high	88.7	Confident	45 Å²	45	46.9 Å²	46.9	32%	0.315	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-74.1	128.5	177.6	-169.4	0	0	0	0	110.3	C325 G334	C325-S327 PolarHBondContact O-N 2.8Å; S327-G334 CarbonylContact C-O 3.57Å; S327-G334 VanDerWaalsContact CA-O 3.3Å; S327-G334 WeakPolarHBondContact CA-O 3.29Å
328	E	89.3	Confident	87.8	Confident	57 Å²	57	50.9 Å²	50.9	27%	0.266	26%	0.257	S	S	.	.			trans	-123.1	101.7	175.5	174.1	47	-102.2	0	0	108.6	R330 S331 G334 L336	E328-R330 PolarHBondContact O-N 2.75Å; E328-R330 VanDerWaalsContact O-N 3.09Å; E328-R330 VanDerWaalsContact OE1-CB 3.29Å; E328-R330 WeakPolarHBondContact OE1-CB 3.32Å; E328-R330 WeakPolarHBondContact OE1-CG 3.1Å; E328-R330 PolarHBondContact OE1-N 3.46Å; E328-S331 PolarHBondContact O-N 3.03Å; E328-S331 VanDerWaalsContact O-N 3.09Å; E328-G334 PolarHBondContact N-O 3.43Å; E328-L336 HydrophobicContact CB-CB 4.08Å; E328-L336 HydrophobicContact CB-CD1 4.2Å; E328-L336 HydrophobicContact CG-CD1 4.12Å
329	P	84.4	Confident	87.1	Confident	119 Å²	119	52.6 Å²	52.6	77%	0.773	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.9	-176.8	-25.2	35	0	0	0	114.9
330	R	86.2	Confident	86.9	Confident	237 Å²	237	54.3 Å²	54.3	89%	0.894	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-13	178.9	-60.6	175.7	175.3	169.4	-0	113.9	E328	E328-R330 PolarHBondContact O-N 2.75Å; E328-R330 VanDerWaalsContact O-N 3.09Å; E328-R330 VanDerWaalsContact OE1-CB 3.29Å; E328-R330 WeakPolarHBondContact OE1-CB 3.32Å; E328-R330 WeakPolarHBondContact OE1-CG 3.1Å; E328-R330 PolarHBondContact OE1-N 3.46Å
331	S	86.8	Confident	86.6	Confident	18 Å²	18	53.8 Å²	53.8	13%	0.126	27%	0.269	C	S	.	.	S	Bend	trans	-83.2	139.6	174	170.5	0	0	0	0	110.6	E328 S333 G334 C335 E338	E328-S331 PolarHBondContact O-N 3.03Å; E328-S331 VanDerWaalsContact O-N 3.09Å; S331-S333 PolarHBondContact O-N 2.67Å; S331-S333 PolarHBondContact OG-N 2.95Å; S331-S333 VanDerWaalsContact OG-N 3.09Å; S331-S333 PolarHBondContact OG-OG 2.92Å; S331-G334 PolarHBondContact O-N 3.28Å; S331-C335 PolarHBondContact OG-O 2.94Å; S331-E338 PolarHBondContact OG-OE1 3.4Å
332	L	82.5	Confident	86.3	Confident	154 Å²	154	54.5 Å²	54.5	81%	0.806	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-28.7	172.7	-62.1	175.9	0	0	0	112.5	G334	L332-G334 VanDerWaalsContact C-N 3.33Å
333	S	82.4	Confident	86.3	Confident	5 Å²	5	54 Å²	54	4%	0.035	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-18.5	174.5	73.1	0	0	0	0	113.2	S331 C335 E338 Y340 N398	S331-S333 PolarHBondContact O-N 2.67Å; S331-S333 PolarHBondContact OG-N 2.95Å; S331-S333 VanDerWaalsContact OG-N 3.09Å; S331-S333 PolarHBondContact OG-OG 2.92Å; S333-C335 PolarHBondContact O-N 3.4Å; S333-C335 WeakPolarHBondContact OG-CB 3.23Å; S333-C335 PolarHBondContact OG-N 3.11Å; S333-C335 PolarHBondContact OG-O 3.23Å; S333-E338 WeakPolarHBondContact OG-CA 3.21Å; S333-Y340 WeakPolarHBondContact CA-OH 3.02Å; S333-Y340 WeakPolarHBondContact O-CE1 3.4Å; S333-Y340 PolarHBondContact O-OH 3.02Å; S333-N398 PolarHBondContact O-ND2 3.18Å
334	G	86.1	Confident	86.4	Confident	5 Å²	5	52.3 Å²	52.3	5%	0.052	26%	0.261	C	S	.	.	S	Bend	trans	72.7	0.1	-165.8	0	0	0	0	0	114.6	S327 E328 S331 L332 C395	S327-G334 CarbonylContact C-O 3.57Å; S327-G334 VanDerWaalsContact CA-O 3.3Å; S327-G334 WeakPolarHBondContact CA-O 3.29Å; E328-G334 PolarHBondContact N-O 3.43Å; S331-G334 PolarHBondContact O-N 3.28Å; L332-G334 VanDerWaalsContact C-N 3.33Å; G334-C395 WeakPolarHBondContact O-CB 3.22Å
335	C	87	Confident	86.5	Confident	2 Å²	2	53 Å²	53	1%	0.014	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-109.9	134.9	179.7	-62.3	0	0	0	0	111.7	S331 S333 K337 E338 C395	S331-C335 PolarHBondContact OG-O 2.94Å; S333-C335 PolarHBondContact O-N 3.4Å; S333-C335 WeakPolarHBondContact OG-CB 3.23Å; S333-C335 PolarHBondContact OG-N 3.11Å; S333-C335 PolarHBondContact OG-O 3.23Å; C335-K337 VanDerWaalsContact C-N 3.26Å; C335-K337 PolarHBondContact O-N 3.38Å; C335-K337 VanDerWaalsContact O-N 3.12Å; C335-E338 PolarHBondContact O-N 2.67Å; C335-C395 HydrophobicContact CB-CB 3.89Å; C335-C395 WeakPolarHBondContact CB-SG 3.18Å; C335-C395 WeakPolarHBondContact SG-CA 3.46Å; C335-C395 WeakPolarHBondContact SG-CB 3.49Å; C335-C395 CovalentContact SG-SG 2.03Å; C335-C395 PolarHBondContact SG-SG 3.13Å
336	L	83.4	Confident	86.6	Confident	94 Å²	94	53 Å²	53	49%	0.492	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.9	-177.8	-177.8	63.5	0	0	0	115	M326 E328	M326-L336 HydrophobicContact CB-CB 4.38Å; M326-L336 PolarHBondContact O-N 3.07Å; M326-L336 VanDerWaalsContact O-N 3.15Å; M326-L336 HydrophobicContact SD-CD2 3.79Å; E328-L336 HydrophobicContact CB-CB 4.08Å; E328-L336 HydrophobicContact CB-CD1 4.2Å; E328-L336 HydrophobicContact CG-CD1 4.12Å
337	K	76.4	Confident	86.8	Confident	106 Å²	106	50.6 Å²	50.6	46%	0.461	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	4.6	-179.6	-59	179.1	-170.6	169.4	0	113.9	N324 C335 N339	N324-K337 PolarHBondContact OD1-NZ 2.94Å; C335-K337 VanDerWaalsContact C-N 3.26Å; C335-K337 PolarHBondContact O-N 3.38Å; C335-K337 VanDerWaalsContact O-N 3.12Å; K337-N339 PolarHBondContact O-N 3.38Å
338	E	75.9	Confident	87.1	Confident	86 Å²	86	48.4 Å²	48.4	40%	0.402	24%	0.237	S	C	.	.	S	Bend	trans	51.2	27.1	-173.6	-44.5	-151.8	133.6	0	0	115	S331 S333 C335	S331-E338 PolarHBondContact OG-OE1 3.4Å; S333-E338 WeakPolarHBondContact OG-CA 3.21Å; C335-E338 PolarHBondContact O-N 2.67Å
339	N	82.1	Confident	87.4	Confident	41 Å²	41	45.8 Å²	45.8	22%	0.219	23%	0.225	C	C	.	.			trans	-120.2	92.3	-174.3	-169.6	-0.8	0	0	0	112.4	K337 A341 D342	K337-N339 PolarHBondContact O-N 3.38Å; N339-A341 VanDerWaalsContact C-N 3.26Å; N339-A341 PolarHBondContact O-N 3.41Å; N339-A341 VanDerWaalsContact OD1-CB 3.3Å; N339-A341 WeakPolarHBondContact OD1-CB 3.38Å; N339-A341 PolarHBondContact OD1-N 3.49Å; N339-A341 VanDerWaalsContact OD1-N 3.17Å; N339-D342 HydrophobicContact CB-CB 4.4Å; N339-D342 PolarHBondContact ND2-OD1 3.44Å; N339-D342 VanDerWaalsContact ND2-OD1 3.11Å; N339-D342 PolarHBondContact ND2-OD2 2.81Å; N339-D342 PolarHBondContact O-N 2.94Å
340	Y	87.5	Confident	88	Confident	41 Å²	41	40.1 Å²	40.1	16%	0.161	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-34.2	175.7	-63	-36.9	0	0	0	113	S333 D342 C343 L344 N398 A399 A402	S333-Y340 WeakPolarHBondContact CA-OH 3.02Å; S333-Y340 WeakPolarHBondContact O-CE1 3.4Å; S333-Y340 PolarHBondContact O-OH 3.02Å; Y340-D342 PolarHBondContact O-N 3.44Å; Y340-C343 PolarHBondContact O-N 2.71Å; Y340-L344 WeakPolarHBondContact O-CG 3.04Å; Y340-L344 PolarHBondContact O-N 3.22Å; Y340-N398 HydrophobicContact CE1-CB 3.87Å; Y340-A399 HydrophobicContact CD1-CB 3.57Å; Y340-A399 HydrophobicContact CE1-CB 4.4Å; Y340-A399 HydrophobicContact CG-CB 3.86Å; Y340-A402 HydrophobicContact CD2-CB 3.86Å; Y340-A402 HydrophobicContact CE2-CB 3.78Å
341	A	86.4	Confident	88.6	Confident	2 Å²	2	29 Å²	29	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-43	-179.7	0	0	0	0	0	112.7	F135 N339 L345	F135-A341 HydrophobicContact CB-CB 4.02Å; F135-A341 HydrophobicContact CD1-CB 4.02Å; F135-A341 HydrophobicContact CD2-CB 3.24Å; F135-A341 HydrophobicContact CE1-CB 4.29Å; F135-A341 HydrophobicContact CE2-CB 3.61Å; F135-A341 HydrophobicContact CG-CB 3.5Å; F135-A341 VanDerWaalsContact CG-CB 3.5Å; F135-A341 HydrophobicContact CZ-CB 4.13Å; N339-A341 VanDerWaalsContact C-N 3.26Å; N339-A341 PolarHBondContact O-N 3.41Å; N339-A341 VanDerWaalsContact OD1-CB 3.3Å; N339-A341 WeakPolarHBondContact OD1-CB 3.38Å; N339-A341 PolarHBondContact OD1-N 3.49Å; N339-A341 VanDerWaalsContact OD1-N 3.17Å; A341-L345 WeakPolarHBondContact O-CB 3.48Å; A341-L345 PolarHBondContact O-N 3.38Å
342	D	87.6	Confident	89.1	Confident	15 Å²	15	28.1 Å²	28.1	8%	0.08	14%	0.141	C	C	.	.	H	α-helix	trans	-65.3	-42.6	178.1	-73	-7.6	0	0	0	110.8	V127 N324 N339 Y340 L345 A346	V127-D342 WeakPolarHBondContact CB-OD1 3.31Å; V127-D342 WeakPolarHBondContact CG2-OD1 3.3Å; N324-D342 HydrophobicContact CB-CB 4.01Å; N339-D342 HydrophobicContact CB-CB 4.4Å; N339-D342 PolarHBondContact ND2-OD1 3.44Å; N339-D342 VanDerWaalsContact ND2-OD1 3.11Å; N339-D342 PolarHBondContact ND2-OD2 2.81Å; N339-D342 PolarHBondContact O-N 2.94Å; Y340-D342 PolarHBondContact O-N 3.44Å; D342-L345 PolarHBondContact O-N 2.9Å; D342-A346 WeakPolarHBondContact O-CB 3.44Å; D342-A346 PolarHBondContact O-N 3.12Å
343	C	92.6	Very high	89.8	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.8	-46.5	177.2	176	0	0	0	0	112.2	C325 Y340 L345 A346 Y347	C325-C343 VanDerWaalsContact CA-SG 3.55Å; C325-C343 HydrophobicContact CB-CB 4.07Å; C325-C343 WeakPolarHBondContact CB-SG 3.21Å; C325-C343 VanDerWaalsContact SG-C 3.56Å; C325-C343 WeakPolarHBondContact SG-CA 3.28Å; C325-C343 WeakPolarHBondContact SG-CB 3.49Å; C325-C343 PolarHBondContact SG-O 3.4Å; C325-C343 CovalentContact SG-SG 2.04Å; C325-C343 PolarHBondContact SG-SG 3.43Å; Y340-C343 PolarHBondContact O-N 2.71Å; C343-L345 VanDerWaalsContact C-N 3.28Å; C343-L345 PolarHBondContact O-N 2.88Å; C343-A346 PolarHBondContact O-N 2.03Å; C343-A346 VanDerWaalsContact O-N 3.17Å; C343-Y347 WeakPolarHBondContact O-CB 3.47Å; C343-Y347 PolarHBondContact O-N 2.98Å
344	L	93.2	Very high	90.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-32.7	176.8	-65.2	174.6	0	0	0	112.3	F135 Y264 F268 Y340 S348 A399 I400 F403	F135-L344 HydrophobicContact CE1-CB 4.46Å; F135-L344 HydrophobicContact CE1-CD1 4.36Å; Y264-L344 HydrophobicContact CD2-CB 4.26Å; Y264-L344 HydrophobicContact CE2-CB 3.73Å; Y264-L344 PolarHBondContact OH-O 2.91Å; F268-L344 HydrophobicContact CD1-CD2 4.1Å; F268-L344 HydrophobicContact CD2-CD2 4.07Å; F268-L344 HydrophobicContact CE1-CD2 3.84Å; F268-L344 HydrophobicContact CE2-CB 3.94Å; F268-L344 HydrophobicContact CE2-CD2 3.84Å; F268-L344 HydrophobicContact CE2-CG 4.34Å; F268-L344 HydrophobicContact CG-CD2 4.2Å; F268-L344 HydrophobicContact CZ-CB 4.18Å; F268-L344 HydrophobicContact CZ-CD2 3.69Å; Y340-L344 WeakPolarHBondContact O-CG 3.04Å; Y340-L344 PolarHBondContact O-N 3.22Å; L344-S348 WeakPolarHBondContact O-CB 3.45Å; L344-S348 PolarHBondContact O-N 3.4Å; L344-S348 PolarHBondContact O-OG 3.46Å; L344-A399 HydrophobicContact CD1-CB 4.46Å; L344-A399 HydrophobicContact CD2-CB 3.94Å; L344-A399 HydrophobicContact CG-CB 3.97Å; L344-I400 HydrophobicContact CD2-CG1 3.73Å; L344-F403 HydrophobicContact CD1-CB 3.79Å; L344-F403 HydrophobicContact CD1-CD2 4.2Å; L344-F403 HydrophobicContact CD1-CG 4.15Å
345	L	92.1	Very high	90.9	Very high	34 Å²	34	23.5 Å²	23.5	18%	0.178	12%	0.117	C	C	.	.	H	α-helix	trans	-68.6	-43	171.1	-171.3	71.1	0	0	0	112.7	R94 V127 Y264 A341 D342 C343 S348 G349	R94-L345 PolarHBondContact NH1-O 3.04Å; V127-L345 HydrophobicContact CG2-CD2 3.33Å; Y264-L345 WeakPolarHBondContact OH-CA 3.28Å; Y264-L345 VanDerWaalsContact OH-CD1 3.25Å; Y264-L345 WeakPolarHBondContact OH-CD1 3.48Å; A341-L345 WeakPolarHBondContact O-CB 3.48Å; A341-L345 PolarHBondContact O-N 3.38Å; D342-L345 PolarHBondContact O-N 2.9Å; C343-L345 VanDerWaalsContact C-N 3.28Å; C343-L345 PolarHBondContact O-N 2.88Å; L345-S348 PolarHBondContact O-N 3.09Å; L345-S348 PolarHBondContact O-OG 3.45Å; L345-S348 VanDerWaalsContact O-OG 3.14Å; L345-G349 PolarHBondContact O-N 3.44Å
346	A	93.9	Very high	91.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.8	-45.2	178.6	0	0	0	0	0	111.4	D320 F321 N324 D342 C343 G349 L350	D320-A346 WeakPolarHBondContact O-CB 3.29Å; F321-A346 HydrophobicContact CB-CB 4.29Å; F321-A346 HydrophobicContact CD2-CB 4.47Å; N324-A346 HydrophobicContact CB-CB 4.18Å; D342-A346 WeakPolarHBondContact O-CB 3.44Å; D342-A346 PolarHBondContact O-N 3.12Å; C343-A346 PolarHBondContact O-N 2.03Å; C343-A346 VanDerWaalsContact O-N 3.17Å; A346-G349 WeakPolarHBondContact O-CA 3.42Å; A346-G349 PolarHBondContact O-N 3.11Å; A346-L350 PolarHBondContact O-N 3.33Å
347	Y	96.9	Very high	92.1	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	10%	0.095	C	C	.	.	H	α-helix	trans	-57.5	-50.8	173.7	176.3	-88.3	0	0	0	112.2	L267 F268 F321 C343 G349 L350 I351 P357 V367 L396	L267-Y347 HydrophobicContact CD2-CD1 4.46Å; L267-Y347 HydrophobicContact CD2-CE1 4.25Å; F268-Y347 AromaticContact CE1-CD1 3.51Å; F268-Y347 HydrophobicContact CE1-CD1 3.51Å; F268-Y347 AromaticContact CE1-CE1 3.66Å; F268-Y347 HydrophobicContact CE1-CE1 3.66Å; F268-Y347 HydrophobicContact CE1-CG 4.44Å; F268-Y347 AromaticContact CZ-CD1 3.58Å; F268-Y347 HydrophobicContact CZ-CD1 3.58Å; F268-Y347 HydrophobicContact CZ-CE1 4.11Å; F268-Y347 HydrophobicContact CZ-CG 4.5Å; F321-Y347 HydrophobicContact CE2-CD2 4.09Å; C343-Y347 WeakPolarHBondContact O-CB 3.47Å; C343-Y347 PolarHBondContact O-N 2.98Å; Y347-G349 PolarHBondContact O-N 3.39Å; Y347-G349 VanDerWaalsContact O-N 3.11Å; Y347-L350 WeakPolarHBondContact O-CB 3.46Å; Y347-L350 PolarHBondContact O-N 3.26Å; Y347-L350 VanDerWaalsContact O-N 3.14Å; Y347-I351 HydrophobicContact CE1-CD1 4.2Å; Y347-P357 HydrophobicContact CD2-CG 3.93Å; Y347-P357 HydrophobicContact CE1-CG 4.49Å; Y347-P357 HydrophobicContact CE2-CB 3.73Å; Y347-P357 HydrophobicContact CE2-CG 3.37Å; Y347-V367 HydrophobicContact CE2-CB 4.08Å; Y347-V367 HydrophobicContact CE2-CG1 4.13Å; Y347-V367 HydrophobicContact CE2-CG2 3.81Å; Y347-L396 HydrophobicContact CD2-CD1 4.13Å; Y347-L396 HydrophobicContact CD2-CD2 3.9Å; Y347-L396 HydrophobicContact CE2-CD2 4.33Å; Y347-L396 HydrophobicContact CG-CD1 4.19Å
348	S	96.4	Very high	93.1	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.9	-13.2	178	77.4	0	0	0	0	113	R94 Y264 L344 L345	R94-S348 PolarHBondContact NH1-OG 2.91Å; R94-S348 PolarHBondContact NH2-O 3.09Å; Y264-S348 PolarHBondContact OH-OG 2.77Å; L344-S348 WeakPolarHBondContact O-CB 3.45Å; L344-S348 PolarHBondContact O-N 3.4Å; L344-S348 PolarHBondContact O-OG 3.46Å; L345-S348 PolarHBondContact O-N 3.09Å; L345-S348 PolarHBondContact O-OG 3.45Å; L345-S348 VanDerWaalsContact O-OG 3.14Å
349	G	95.6	Very high	94.1	Very high	2 Å²	2	10.6 Å²	10.6	2%	0.021	6%	0.056	C	C	.	.	H	α-helix	trans	-76.6	-27.4	175	0	0	0	0	0	113.9	R94 R317 L345 A346 Y347	R94-G349 VanDerWaalsContact CZ-CA 3.47Å; R94-G349 VanDerWaalsContact NH1-CA 3.26Å; R94-G349 VanDerWaalsContact NH1-N 3.15Å; R317-G349 WeakPolarHBondContact CD-O 3.47Å; R317-G349 VanDerWaalsContact CG-O 3.23Å; R317-G349 WeakPolarHBondContact CG-O 3.27Å; R317-G349 PolarHBondContact NE-O 2.94Å; L345-G349 PolarHBondContact O-N 3.44Å; A346-G349 WeakPolarHBondContact O-CA 3.42Å; A346-G349 PolarHBondContact O-N 3.11Å; Y347-G349 PolarHBondContact O-N 3.39Å; Y347-G349 VanDerWaalsContact O-N 3.11Å
350	L	97.8	Very high	94.7	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-72.6	-27.3	175.6	-71.6	175.1	0	0	0	113	R317 L318 F321 A346 Y347 G352 T353 M355 T356 P357 F390	R317-L350 HydrophobicContact CB-CD2 3.97Å; L318-L350 HydrophobicContact CB-CD2 4.21Å; L318-L350 HydrophobicContact CD1-CD2 4.39Å; F321-L350 HydrophobicContact CB-CD1 4.01Å; F321-L350 HydrophobicContact CB-CG 4.42Å; F321-L350 HydrophobicContact CD1-CD1 4.01Å; F321-L350 HydrophobicContact CD2-CD1 4.14Å; F321-L350 HydrophobicContact CG-CD1 3.79Å; A346-L350 PolarHBondContact O-N 3.33Å; Y347-L350 WeakPolarHBondContact O-CB 3.46Å; Y347-L350 PolarHBondContact O-N 3.26Å; Y347-L350 VanDerWaalsContact O-N 3.14Å; L350-G352 PolarHBondContact O-N 3.42Å; L350-T353 WeakPolarHBondContact O-CB 3.03Å; L350-T353 WeakPolarHBondContact O-CG2 3.26Å; L350-T353 PolarHBondContact O-N 2.91Å; L350-T353 PolarHBondContact O-OG1 3.08Å; L350-M355 WeakPolarHBondContact CB-O 3.17Å; L350-M355 HydrophobicContact CD2-CB 4.38Å; L350-M355 HydrophobicContact CD2-CG 4.39Å; L350-T356 PolarHBondContact O-OG1 3.36Å; L350-P357 HydrophobicContact CB-CG 4.19Å; L350-P357 HydrophobicContact CD1-CG 4.24Å; L350-F390 HydrophobicContact CD1-CE1 3.73Å; L350-F390 HydrophobicContact CD1-CZ 4.21Å
351	I	98.3	Very high	94.9	Very high	2 Å²	2	19 Å²	19	1%	0.01	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	126.3	-174.8	-59.3	174.6	0	0	0	111.2	R252 F255 L267 I287 Y347 T356	R252-I351 WeakPolarHBondContact CG-O 3.43Å; F255-I351 HydrophobicContact CD2-CB 4.26Å; F255-I351 HydrophobicContact CD2-CG2 4.06Å; F255-I351 HydrophobicContact CE2-CB 4.26Å; F255-I351 HydrophobicContact CE2-CD1 4.06Å; F255-I351 HydrophobicContact CE2-CG2 3.72Å; F255-I351 HydrophobicContact CZ-CD1 4.13Å; L267-I351 HydrophobicContact CD1-CD1 3.88Å; L267-I351 HydrophobicContact CD2-CD1 3.58Å; L267-I351 HydrophobicContact CG-CD1 4.4Å; I287-I351 HydrophobicContact CG2-CD1 4.33Å; I287-I351 HydrophobicContact CG2-CG2 3.84Å; Y347-I351 HydrophobicContact CE1-CD1 4.2Å; I351-T356 HydrophobicContact CG2-CG2 4.37Å
352	G	96.4	Very high	94.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	80	18.3	-173.1	0	0	0	0	0	113.3	H248 R252 L350 T356	H248-G352 WeakPolarHBondContact CB-O 3.36Å; R252-G352 WeakPolarHBondContact CD-O 3.36Å; R252-G352 PolarHBondContact NH1-O 3.37Å; L350-G352 PolarHBondContact O-N 3.42Å; G352-T356 PolarHBondContact N-OG1 2.76Å
353	T	96.9	Very high	94.6	Very high	6 Å²	6	25.8 Å²	25.8	4%	0.037	14%	0.135	C	C	.	.	S	Bend	trans	-102	180	160	74.4	0	0	0	0	110	H248 I313 C314 R317 L350 M355 T356	H248-T353 PolarHBondContact CE1-O 3.22Å; I313-T353 HydrophobicContact CG2-CG2 4.38Å; C314-T353 HydrophobicContact CB-CG2 4.44Å; C314-T353 PolarHBondContact SG-OG1 3.18Å; R317-T353 HydrophobicContact CG-CG2 4.47Å; L350-T353 WeakPolarHBondContact O-CB 3.03Å; L350-T353 WeakPolarHBondContact O-CG2 3.26Å; L350-T353 PolarHBondContact O-N 2.91Å; L350-T353 PolarHBondContact O-OG1 3.08Å; T353-M355 PolarHBondContact O-N 2.84Å; T353-M355 PolarHBondContact OG1-N 3.14Å; T353-T356 PolarHBondContact N-OG1 3.31Å; T353-T356 PolarHBondContact O-N 3.43Å; T353-T356 PolarHBondContact O-OG1 3.42Å
354	V	95.6	Very high	94.3	Very high	61 Å²	61	31.9 Å²	31.9	37%	0.37	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-30.8	171.8	-63	0	0	0	0	111.6	L304 C308 C314 T356	L304-V354 HydrophobicContact CD1-CB 4.41Å; C308-V354 HydrophobicContact CB-CG2 3.87Å; C314-V354 HydrophobicContact CB-CG2 4.25Å; C314-V354 WeakPolarHBondContact SG-CG2 3.47Å; V354-T356 VanDerWaalsContact C-N 3.27Å; V354-T356 PolarHBondContact O-N 2.95Å
355	M	96.9	Very high	94.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	52	174.4	-165.4	62.4	72.6	0	0	110.9	L304 Q305 C308 L318 L350 T353 P357 P369 F386 F390	L304-M355 HydrophobicContact CB-CE 4.22Å; L304-M355 HydrophobicContact CD2-CE 4.19Å; L304-M355 HydrophobicContact CD2-SD 3.9Å; L304-M355 HydrophobicContact CG-CE 3.77Å; L304-M355 HydrophobicContact CG-SD 4.12Å; Q305-M355 HydrophobicContact CB-CE 4.16Å; C308-M355 HydrophobicContact CB-CB 4.29Å; C308-M355 HydrophobicContact CB-CE 4.14Å; L318-M355 HydrophobicContact CD1-CG 4.24Å; L318-M355 HydrophobicContact CD2-CE 4.36Å; L350-M355 WeakPolarHBondContact CB-O 3.17Å; L350-M355 HydrophobicContact CD2-CB 4.38Å; L350-M355 HydrophobicContact CD2-CG 4.39Å; T353-M355 PolarHBondContact O-N 2.84Å; T353-M355 PolarHBondContact OG1-N 3.14Å; M355-P357 WeakPolarHBondContact O-CD 3.26Å; M355-P369 HydrophobicContact SD-CB 3.52Å; M355-P369 VanDerWaalsContact SD-CB 3.52Å; M355-P369 HydrophobicContact SD-CG 3.78Å; M355-F386 HydrophobicContact CE-CE1 4.41Å; M355-F386 HydrophobicContact CE-CE2 4.46Å; M355-F386 HydrophobicContact CE-CZ 3.63Å; M355-F386 HydrophobicContact SD-CE1 4.42Å; M355-F386 HydrophobicContact SD-CZ 3.83Å; M355-F390 HydrophobicContact CG-CZ 4.44Å
356	T	97.9	Very high	94.3	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.031	16%	0.164	C	C	.	.			trans	-80	115	177.9	-69.9	0	0	0	0	110	I287 Y293 L350 I351 G352 T353 V354	I287-T356 HydrophobicContact CD1-CG2 3.91Å; Y293-T356 WeakPolarHBondContact CD2-O 3.33Å; L350-T356 PolarHBondContact O-OG1 3.36Å; I351-T356 HydrophobicContact CG2-CG2 4.37Å; G352-T356 PolarHBondContact N-OG1 2.76Å; T353-T356 PolarHBondContact N-OG1 3.31Å; T353-T356 PolarHBondContact O-N 3.43Å; T353-T356 PolarHBondContact O-OG1 3.42Å; V354-T356 VanDerWaalsContact C-N 3.27Å; V354-T356 PolarHBondContact O-N 2.95Å
357	P	98	Very high	94.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	156.9	172.7	34.5	-36.5	0	0	0	111.8	Y347 L350 M355 S368 F390	Y347-P357 HydrophobicContact CD2-CG 3.93Å; Y347-P357 HydrophobicContact CE1-CG 4.49Å; Y347-P357 HydrophobicContact CE2-CB 3.73Å; Y347-P357 HydrophobicContact CE2-CG 3.37Å; L350-P357 HydrophobicContact CB-CG 4.19Å; L350-P357 HydrophobicContact CD1-CG 4.24Å; M355-P357 WeakPolarHBondContact O-CD 3.26Å; P357-S368 CarbonylContact C-O 3.57Å; P357-S368 VanDerWaalsContact CA-O 3.28Å; P357-S368 WeakPolarHBondContact CA-O 3.02Å; P357-F390 HydrophobicContact CB-CD1 4.39Å; P357-F390 HydrophobicContact CB-CE1 4.49Å
358	N	97.9	Very high	94.5	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.011	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	167	164.7	-160.1	6.9	0	0	0	111.5	R284 I287 Y293 L360 V367 S368	R284-N358 PolarHBondContact O-ND2 3.37Å; I287-N358 HydrophobicContact CD1-CB 4.01Å; Y293-N358 HydrophobicContact CD1-CB 4.16Å; Y293-N358 HydrophobicContact CD2-CB 3.72Å; Y293-N358 HydrophobicContact CE1-CB 4.22Å; Y293-N358 HydrophobicContact CE2-CB 3.78Å; Y293-N358 HydrophobicContact CG-CB 3.94Å; N358-L360 PolarHBondContact O-N 2.94Å; N358-V367 VanDerWaalsContact O-CA 3.24Å; N358-V367 WeakPolarHBondContact O-CA 3.4Å; N358-S368 PolarHBondContact N-O 2.02Å; N358-S368 PolarHBondContact O-N 3.22Å
359	Y	96.9	Very high	94.6	Very high	10 Å²	10	32.7 Å²	32.7	4%	0.039	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	130.7	174.5	-65.3	-84.9	0	0	0	112	L267 F268 R283 R284 I365 V367	L267-Y359 WeakPolarHBondContact O-CE2 3.48Å; L267-Y359 PolarHBondContact O-OH 2.94Å; F268-Y359 WeakPolarHBondContact CD1-OH 3.2Å; R283-Y359 HydrophobicContact CG-CD2 4.08Å; R283-Y359 HydrophobicContact CG-CE2 3.6Å; R284-Y359 WeakPolarHBondContact CD-O 3.21Å; R284-Y359 WeakPolarHBondContact CG-O 3.27Å; Y359-I365 HydrophobicContact CE1-CG2 4.17Å; Y359-V367 HydrophobicContact CD1-CG1 3.85Å; Y359-V367 HydrophobicContact CE1-CG1 4.08Å; Y359-V367 HydrophobicContact CG-CG1 4.27Å
360	L	94.6	Very high	94.6	Very high	71 Å²	71	35.1 Å²	35.1	37%	0.372	18%	0.177	S	C	.	.			trans	-74.9	157	167.2	-61.1	-179.7	0	0	0	110.3	N358 S362 S366 T391	N358-L360 PolarHBondContact O-N 2.94Å; L360-S362 PolarHBondContact O-N 3.11Å; L360-S366 PolarHBondContact N-O 2.96Å; L360-T391 HydrophobicContact CD1-CG2 4.13Å
361	R	91.4	Very high	94.6	Very high	189 Å²	189	35.6 Å²	35.6	71%	0.713	18%	0.18	S	C	*	.	S	Bend	trans	-79.2	68.4	172.7	-65.4	-169.8	-175.9	108	-3.9	110.5	E281	E281-R361 IonicContact OE1-CZ 3.3Å; E281-R361 IonicContact OE1-NE 3.88Å; E281-R361 PolarHBondContact OE1-NE 3.32Å; E281-R361 IonicContact OE1-NH2 2.67Å
362	S	86	Confident	94.5	Very high	52 Å²	52	37.8 Å²	37.8	36%	0.364	19%	0.191	S	C	.	.	S	Bend	trans	-121.4	148.2	179.7	178.4	0	0	0	0	110	L360 K364	L360-S362 PolarHBondContact O-N 3.11Å; S362-K364 PolarHBondContact O-N 3.2Å; S362-K364 PolarHBondContact OG-N 3.44Å
363	P	81	Confident	94.5	Very high	106 Å²	106	38.6 Å²	38.6	69%	0.688	20%	0.197	S	C	*	.	S	Bend	trans	-63.9	-26	169.3	27.1	-35.3	0	0	0	112.1	Q276	Q276-P363 PolarHBondContact NE2-O 3.28Å
364	K	87.1	Confident	94.3	Very high	129 Å²	129	41.8 Å²	41.8	56%	0.561	22%	0.216	S	C	*	.	S	Bend	trans	-83.8	149.6	173.1	-62.3	-177.8	-178.3	178.5	0	110.4	S362 S366	S362-K364 PolarHBondContact O-N 3.2Å; S362-K364 PolarHBondContact OG-N 3.44Å; K364-S366 PolarHBondContact O-N 3.43Å
365	I	90.8	Very high	94.2	Very high	30 Å²	30	46.4 Å²	46.4	15%	0.154	24%	0.239	C	C	.	.			trans	-69.2	95.8	168.8	-70.1	167.7	0	0	0	108.4	Y359 R397 I400 Q401	Y359-I365 HydrophobicContact CE1-CG2 4.17Å; I365-R397 PolarHBondContact O-NH1 2.85Å; I365-I400 HydrophobicContact CD1-CG2 4.18Å; I365-I400 HydrophobicContact CG2-CB 4.24Å; I365-I400 HydrophobicContact CG2-CD1 3.98Å; I365-I400 HydrophobicContact CG2-CG2 4.02Å; I365-Q401 HydrophobicContact CD1-CG 3.61Å
366	S	94.8	Very high	94	Very high	9 Å²	9	47.1 Å²	47.1	6%	0.063	24%	0.244	C	C	.	.			trans	-132.3	141.8	176.9	-171.4	0	0	0	0	108.9	L360 K364 T391	L360-S366 PolarHBondContact N-O 2.96Å; K364-S366 PolarHBondContact O-N 3.43Å; S366-T391 VanDerWaalsContact OG-CA 3.29Å; S366-T391 WeakPolarHBondContact OG-CA 3.49Å; S366-T391 WeakPolarHBondContact OG-CB 3.32Å; S366-T391 PolarHBondContact OG-O 2.04Å
367	V	97.3	Very high	93.8	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.5	-174.6	-63.9	0	0	0	0	109.1	Y347 N358 Y359 F390 T391 L396	Y347-V367 HydrophobicContact CE2-CB 4.08Å; Y347-V367 HydrophobicContact CE2-CG1 4.13Å; Y347-V367 HydrophobicContact CE2-CG2 3.81Å; N358-V367 VanDerWaalsContact O-CA 3.24Å; N358-V367 WeakPolarHBondContact O-CA 3.4Å; Y359-V367 HydrophobicContact CD1-CG1 3.85Å; Y359-V367 HydrophobicContact CE1-CG1 4.08Å; Y359-V367 HydrophobicContact CG-CG1 4.27Å; V367-F390 VanDerWaalsContact CG2-O 3.31Å; V367-F390 WeakPolarHBondContact CG2-O 3.02Å; V367-F390 CarbonylContact O-C 3.59Å; V367-F390 VanDerWaalsContact O-C 3.26Å; V367-F390 WeakPolarHBondContact O-CB 3.46Å; V367-T391 WeakPolarHBondContact O-CG2 3.34Å; V367-T391 PolarHBondContact O-N 3.48Å; V367-L396 HydrophobicContact CG2-CD2 3.68Å
368	S	97.3	Very high	93.6	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.063	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	150.4	173.2	-173.2	0	0	0	0	110	Y293 P357 N358	Y293-S368 VanDerWaalsContact CE2-O 3.28Å; Y293-S368 WeakPolarHBondContact CE2-O 2.98Å; Y293-S368 PolarHBondContact OH-O 2.93Å; Y293-S368 VanDerWaalsContact OH-O 3.14Å; P357-S368 CarbonylContact C-O 3.57Å; P357-S368 VanDerWaalsContact CA-O 3.28Å; P357-S368 WeakPolarHBondContact CA-O 3.02Å; N358-S368 PolarHBondContact N-O 2.02Å; N358-S368 PolarHBondContact O-N 3.22Å
369	P	97.4	Very high	93.4	Very high	1 Å²	1	62 Å²	62	1%	0.006	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	164.7	154.4	27.8	-35	0	0	0	112	Y293 L304 M355 C371 F386 F390	Y293-P369 PolarHBondContact OH-O 2.82Å; L304-P369 HydrophobicContact CD2-CB 4.1Å; M355-P369 HydrophobicContact SD-CB 3.52Å; M355-P369 VanDerWaalsContact SD-CB 3.52Å; M355-P369 HydrophobicContact SD-CG 3.78Å; P369-C371 VanDerWaalsContact C-N 3.32Å; P369-C371 PolarHBondContact O-N 3.25Å; P369-F386 HydrophobicContact CG-CE1 4.31Å; P369-F390 HydrophobicContact CG-CD2 4.36Å; P369-F390 HydrophobicContact CG-CE2 4.37Å
370	Y	97.2	Very high	93.3	Very high	53 Å²	53	65.4 Å²	65.4	21%	0.208	35%	0.352	C	S	.	.	S	Bend	trans	-82.4	76.4	176.8	-166.4	-97.2	0	0	0	110.7	Y293 E294 E295 M298	Y293-Y370 AromaticContact CD1-CD2 3.98Å; Y293-Y370 HydrophobicContact CD1-CD2 3.98Å; Y293-Y370 AromaticContact CE1-CD2 3.65Å; Y293-Y370 HydrophobicContact CE1-CD2 3.65Å; Y293-Y370 HydrophobicContact CE1-CG 4.49Å; Y293-Y370 AromaticContact CZ-CD2 3.96Å; Y293-Y370 WeakPolarHBondContact O-CB 3.41Å; E294-Y370 HydrophobicContact CB-CE2 4.28Å; E294-Y370 HydrophobicContact CG-CE2 4.17Å; E295-Y370 HydrophobicContact CB-CD1 4.06Å; E295-Y370 HydrophobicContact CB-CE1 3.88Å; E295-Y370 HydrophobicContact CG-CD1 4.41Å; E295-Y370 VanDerWaalsContact N-CE1 3.29Å; E295-Y370 PolarHBondContact O-OH 3.5Å; M298-Y370 HydrophobicContact CB-CE1 4.26Å; M298-Y370 HydrophobicContact CE-CD1 4.48Å; M298-Y370 HydrophobicContact CE-CD2 3.99Å; M298-Y370 HydrophobicContact CE-CE1 4.06Å; M298-Y370 HydrophobicContact CE-CE2 3.53Å; M298-Y370 HydrophobicContact CE-CG 4.45Å; M298-Y370 HydrophobicContact CG-CE1 4.44Å
371	C	96.7	Very high	93.3	Very high	10 Å²	10	67.3 Å²	67.3	7%	0.068	36%	0.363	C	S	.	.			trans	-156.3	168.4	175.8	61.8	0	0	0	0	109.8	P299 C301 L304 P369	P299-C371 HydrophobicContact CG-CB 4.38Å; P299-C371 VanDerWaalsContact O-CA 3.3Å; P299-C371 WeakPolarHBondContact O-CA 3.24Å; P299-C371 VanDerWaalsContact O-CB 3.24Å; P299-C371 WeakPolarHBondContact O-CB 3.5Å; C301-C371 WeakPolarHBondContact CA-SG 3.39Å; C301-C371 HydrophobicContact CB-CB 3.88Å; C301-C371 WeakPolarHBondContact CB-SG 3.45Å; C301-C371 WeakPolarHBondContact SG-CB 3.24Å; C301-C371 CovalentContact SG-SG 2.04Å; C301-C371 PolarHBondContact SG-SG 3.12Å; L304-C371 HydrophobicContact CB-CB 4.42Å; L304-C371 HydrophobicContact CD2-CB 3.86Å; P369-C371 VanDerWaalsContact C-N 3.32Å; P369-C371 PolarHBondContact O-N 3.25Å
372	D	96.3	Very high	93.4	Very high	48 Å²	48	62.1 Å²	62.1	26%	0.257	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-135	-177.4	168.3	67.2	37.1	0	0	0	111.6	M298 P299 N300 C301 T374	M298-D372 HydrophobicContact CG-CB 4.38Å; M298-D372 HydrophobicContact SD-CB 3.86Å; P299-D372 PolarHBondContact O-N 2.85Å; N300-D372 CarbonylContact C-O 3.26Å; N300-D372 WeakPolarHBondContact CA-O 3.42Å; C301-D372 PolarHBondContact N-O 2.92Å; C301-D372 PolarHBondContact SG-O 2.98Å; D372-T374 VanDerWaalsContact OD1-CB 3.25Å; D372-T374 WeakPolarHBondContact OD1-CB 3.02Å; D372-T374 WeakPolarHBondContact OD1-CG2 3.45Å; D372-T374 PolarHBondContact OD1-N 3.11Å; D372-T374 PolarHBondContact OD1-OG1 2.87Å
373	C	96.3	Very high	93.9	Very high	17 Å²	17	59.6 Å²	59.6	12%	0.115	33%	0.332	C	S	.	.			trans	-107.8	30.5	175.7	-66.1	0	0	0	0	112.7	S376 K380 C383 T387	C373-S376 PolarHBondContact O-OG 3.21Å; C373-K380 HydrophobicContact CB-CD 4.03Å; C373-K380 WeakPolarHBondContact O-CD 3.13Å; C373-K380 VanDerWaalsContact O-CE 3.31Å; C373-K380 WeakPolarHBondContact O-CE 3.38Å; C373-C383 WeakPolarHBondContact CA-SG 3.48Å; C373-C383 HydrophobicContact CB-CB 3.85Å; C373-C383 WeakPolarHBondContact CB-SG 3.44Å; C373-C383 WeakPolarHBondContact SG-CB 3.47Å; C373-C383 PolarHBondContact SG-O 3.38Å; C373-C383 CovalentContact SG-SG 2.04Å; C373-C383 PolarHBondContact SG-SG 2.91Å; C373-T387 PolarHBondContact SG-OG1 2.65Å; C373-T387 VanDerWaalsContact SG-OG1 3.41Å
374	T	94	Very high	94.6	Very high	72 Å²	72	56.9 Å²	56.9	44%	0.442	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	146.9	165.8	65.1	0	0	0	0	109.6	N300 D372 S376	N300-T374 PolarHBondContact ND2-O 3.19Å; D372-T374 VanDerWaalsContact OD1-CB 3.25Å; D372-T374 WeakPolarHBondContact OD1-CB 3.02Å; D372-T374 WeakPolarHBondContact OD1-CG2 3.45Å; D372-T374 PolarHBondContact OD1-N 3.11Å; D372-T374 PolarHBondContact OD1-OG1 2.87Å; T374-S376 PolarHBondContact O-N 2.97Å; T374-S376 VanDerWaalsContact O-N 3.1Å
375	N	92.4	Very high	95	Very high	159 Å²	159	56 Å²	56	85%	0.85	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	14.6	178.3	-49.3	-48.8	0	0	0	116.6	G377	N375-G377 PolarHBondContact O-N 2.82Å; N375-G377 VanDerWaalsContact O-N 3.15Å
376	S	93	Very high	95.2	Very high	14 Å²	14	54.6 Å²	54.6	10%	0.098	30%	0.3	C	S	.	.			trans	-64.5	-16	178.2	-55.7	0	0	0	0	115.1	N300 C373 T374 N378 N379 C383	N300-S376 PolarHBondContact ND2-OG 2.94Å; C373-S376 PolarHBondContact O-OG 3.21Å; T374-S376 PolarHBondContact O-N 2.97Å; T374-S376 VanDerWaalsContact O-N 3.1Å; S376-N378 PolarHBondContact O-N 2.92Å; S376-N379 PolarHBondContact O-N 3.06Å; S376-C383 PolarHBondContact OG-SG 3.28Å
377	G	93.1	Very high	95.2	Very high	59 Å²	59	55.5 Å²	55.5	61%	0.608	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	54.4	-128.9	-176.8	0	0	0	0	0	112	N375 N379 K380	N375-G377 PolarHBondContact O-N 2.82Å; N375-G377 VanDerWaalsContact O-N 3.15Å; G377-N379 PolarHBondContact O-N 3.35Å; G377-K380 PolarHBondContact O-N 2.66Å
378	N	93.8	Very high	95.1	Very high	167 Å²	167	60.7 Å²	60.7	89%	0.893	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-66	-18.2	178.9	-62.2	-8.7	0	0	0	113.7	S376 K380	S376-N378 PolarHBondContact O-N 2.92Å; N378-K380 VanDerWaalsContact C-N 3.27Å; N378-K380 PolarHBondContact O-N 3.17Å
379	N	93.6	Very high	95	Very high	93 Å²	93	62 Å²	62	50%	0.497	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-93	21.8	-178.4	-56.4	-23.8	0	0	0	112.1	L302 S376 G377 D382 C383	L302-N379 HydrophobicContact CD1-CB 3.59Å; S376-N379 PolarHBondContact O-N 3.06Å; G377-N379 PolarHBondContact O-N 3.35Å; N379-D382 PolarHBondContact O-N 3.46Å; N379-C383 PolarHBondContact O-N 3.06Å; N379-C383 VanDerWaalsContact O-N 3.1Å
380	K	95	Very high	95	Very high	82 Å²	82	62.1 Å²	62.1	36%	0.357	34%	0.335	S	S	.	.	H	α-helix	trans	-61	-47.8	-177.5	-173.4	58.9	168.7	70.3	0	111.7	C373 G377 N378 D382 C383 D384	C373-K380 HydrophobicContact CB-CD 4.03Å; C373-K380 WeakPolarHBondContact O-CD 3.13Å; C373-K380 VanDerWaalsContact O-CE 3.31Å; C373-K380 WeakPolarHBondContact O-CE 3.38Å; G377-K380 PolarHBondContact O-N 2.66Å; N378-K380 VanDerWaalsContact C-N 3.27Å; N378-K380 PolarHBondContact O-N 3.17Å; K380-D382 VanDerWaalsContact C-N 3.3Å; K380-D382 PolarHBondContact O-N 3.21Å; K380-C383 WeakPolarHBondContact O-CB 3.4Å; K380-C383 PolarHBondContact O-N 3.07Å; K380-C383 VanDerWaalsContact O-N 3.13Å; K380-D384 IonicContact NZ-OD1 2.71Å; K380-D384 PolarHBondContact NZ-OD1 2.89Å; K380-D384 IonicContact NZ-OD2 2.82Å; K380-D384 PolarHBondContact NZ-OD2 3.48Å; K380-D384 PolarHBondContact O-N 3.25Å
381	D	94.9	Very high	94.9	Very high	111 Å²	111	60.8 Å²	60.8	59%	0.594	33%	0.332	S	S	*	.	H	α-helix	trans	-59.4	-39	180	-61	-2.6	0	0	0	112.6	D384 K385	D381-D384 PolarHBondContact O-N 2.76Å; D381-K385 WeakPolarHBondContact O-CB 3.3Å; D381-K385 WeakPolarHBondContact O-CD 3.32Å; D381-K385 WeakPolarHBondContact O-CG 3.38Å; D381-K385 PolarHBondContact O-N 3.09Å
382	D	93.6	Very high	94.8	Very high	80 Å²	80	65.3 Å²	65.3	43%	0.428	35%	0.352	S	S	.	.	H	α-helix	trans	-74.4	-32.6	179.1	-68.5	-18.8	0	0	0	112.1	N379 K380 K385 F386	N379-D382 PolarHBondContact O-N 3.46Å; K380-D382 VanDerWaalsContact C-N 3.3Å; K380-D382 PolarHBondContact O-N 3.21Å; D382-K385 IonicContact OD1-NZ 3.57Å; D382-K385 PolarHBondContact OD1-NZ 2.79Å; D382-F386 VanDerWaalsContact O-CB 3.28Å; D382-F386 WeakPolarHBondContact O-CB 3.49Å; D382-F386 PolarHBondContact O-N 3.27Å
383	C	96.5	Very high	94.7	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-66.7	-40.8	170.8	-168.7	0	0	0	0	111.7	L302 C373 S376 N379 K380 F386 T387	L302-C383 HydrophobicContact CD1-CB 4.02Å; L302-C383 HydrophobicContact CD2-CB 4.26Å; L302-C383 HydrophobicContact CG-CB 3.91Å; C373-C383 WeakPolarHBondContact CA-SG 3.48Å; C373-C383 HydrophobicContact CB-CB 3.85Å; C373-C383 WeakPolarHBondContact CB-SG 3.44Å; C373-C383 WeakPolarHBondContact SG-CB 3.47Å; C373-C383 PolarHBondContact SG-O 3.38Å; C373-C383 CovalentContact SG-SG 2.04Å; C373-C383 PolarHBondContact SG-SG 2.91Å; S376-C383 PolarHBondContact OG-SG 3.28Å; N379-C383 PolarHBondContact O-N 3.06Å; N379-C383 VanDerWaalsContact O-N 3.1Å; K380-C383 WeakPolarHBondContact O-CB 3.4Å; K380-C383 PolarHBondContact O-N 3.07Å; K380-C383 VanDerWaalsContact O-N 3.13Å; C383-F386 WeakPolarHBondContact O-CB 3.31Å; C383-F386 PolarHBondContact O-N 2.96Å; C383-T387 WeakPolarHBondContact O-CB 3.41Å; C383-T387 PolarHBondContact O-N 3.32Å; C383-T387 PolarHBondContact O-OG1 2.89Å
384	D	96.3	Very high	94.6	Very high	48 Å²	48	65.5 Å²	65.5	26%	0.257	35%	0.354	S	S	.	.	H	α-helix	trans	-68.3	-48.6	179.3	-69.4	-19.8	0	0	0	110.7	K380 D381 F386 T387 E388	K380-D384 IonicContact NZ-OD1 2.71Å; K380-D384 PolarHBondContact NZ-OD1 2.89Å; K380-D384 IonicContact NZ-OD2 2.82Å; K380-D384 PolarHBondContact NZ-OD2 3.48Å; K380-D384 PolarHBondContact O-N 3.25Å; D381-D384 PolarHBondContact O-N 2.76Å; D384-F386 VanDerWaalsContact C-N 3.27Å; D384-F386 PolarHBondContact O-N 2.61Å; D384-T387 CarbonylContact O-C 3.56Å; D384-T387 WeakPolarHBondContact O-CA 3.5Å; D384-T387 PolarHBondContact O-N 3.43Å; D384-E388 WeakPolarHBondContact O-CB 3.39Å; D384-E388 WeakPolarHBondContact O-CG 3.42Å; D384-E388 PolarHBondContact O-N 3.35Å
385	K	94.4	Very high	94.6	Very high	111 Å²	111	62 Å²	62	48%	0.483	33%	0.333	S	S	.	.	H	α-helix	trans	-54.2	-42.1	171.5	-68.9	164.9	-152.9	157.5	0	112.4	D381 D382 T387 F389	D381-K385 WeakPolarHBondContact O-CB 3.3Å; D381-K385 WeakPolarHBondContact O-CD 3.32Å; D381-K385 WeakPolarHBondContact O-CG 3.38Å; D381-K385 PolarHBondContact O-N 3.09Å; D382-K385 IonicContact OD1-NZ 3.57Å; D382-K385 PolarHBondContact OD1-NZ 2.79Å; K385-T387 VanDerWaalsContact C-N 3.33Å; K385-F389 PolarHBondContact O-N 2.94Å; K385-F389 VanDerWaalsContact O-N 3.16Å
386	F	95.1	Very high	94.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-41.3	176.1	172.4	-91.4	0	0	0	111.8	C301 Q305 F322 M355 P369 D382 C383 D384 F390	C301-F386 HydrophobicContact CB-CD1 3.77Å; C301-F386 HydrophobicContact CB-CE1 3.84Å; Q305-F386 HydrophobicContact CB-CE2 4.25Å; Q305-F386 HydrophobicContact CB-CZ 4.35Å; Q305-F386 HydrophobicContact CG-CD2 4.4Å; Q305-F386 HydrophobicContact CG-CE2 3.87Å; Q305-F386 HydrophobicContact CG-CZ 4.42Å; F322-F386 AromaticContact CZ-CD2 3.83Å; F322-F386 HydrophobicContact CZ-CD2 3.83Å; F322-F386 AromaticContact CZ-CE2 3.75Å; F322-F386 HydrophobicContact CZ-CE2 3.75Å; M355-F386 HydrophobicContact CE-CE1 4.41Å; M355-F386 HydrophobicContact CE-CE2 4.46Å; M355-F386 HydrophobicContact CE-CZ 3.63Å; M355-F386 HydrophobicContact SD-CE1 4.42Å; M355-F386 HydrophobicContact SD-CZ 3.83Å; P369-F386 HydrophobicContact CG-CE1 4.31Å; D382-F386 VanDerWaalsContact O-CB 3.28Å; D382-F386 WeakPolarHBondContact O-CB 3.49Å; D382-F386 PolarHBondContact O-N 3.27Å; C383-F386 WeakPolarHBondContact O-CB 3.31Å; C383-F386 PolarHBondContact O-N 2.96Å; D384-F386 VanDerWaalsContact C-N 3.27Å; D384-F386 PolarHBondContact O-N 2.61Å; F386-F390 HydrophobicContact CE1-CE2 4.07Å; F386-F390 HydrophobicContact CE2-CE2 4.05Å; F386-F390 AromaticContact CZ-CE2 3.71Å; F386-F390 HydrophobicContact CZ-CE2 3.71Å; F386-F390 HydrophobicContact CZ-CZ 4.47Å; F386-F390 WeakPolarHBondContact O-CD2 3.24Å
387	T	95.9	Very high	94.7	Very high	28 Å²	28	55.9 Å²	55.9	17%	0.172	30%	0.296	C	S	.	.	H	α-helix	trans	-72.7	-44.1	-179.4	-55.6	0	0	0	0	111.5	C373 C383 D384 K385 F389 F390 T391	C373-T387 PolarHBondContact SG-OG1 2.65Å; C373-T387 VanDerWaalsContact SG-OG1 3.41Å; C383-T387 WeakPolarHBondContact O-CB 3.41Å; C383-T387 PolarHBondContact O-N 3.32Å; C383-T387 PolarHBondContact O-OG1 2.89Å; D384-T387 CarbonylContact O-C 3.56Å; D384-T387 WeakPolarHBondContact O-CA 3.5Å; D384-T387 PolarHBondContact O-N 3.43Å; K385-T387 VanDerWaalsContact C-N 3.33Å; T387-F389 PolarHBondContact O-N 3.18Å; T387-F390 PolarHBondContact O-N 3.26Å; T387-T391 HydrophobicContact CG2-CG2 4.09Å; T387-T391 PolarHBondContact O-N 3.45Å; T387-T391 PolarHBondContact O-OG1 3.18Å
388	E	95.2	Very high	94.7	Very high	113 Å²	113	55 Å²	55	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-57.3	-35.1	175.5	-74.3	177.1	172.9	0	0	112.5	D384 F390 T391 E392	D384-E388 WeakPolarHBondContact O-CB 3.39Å; D384-E388 WeakPolarHBondContact O-CG 3.42Å; D384-E388 PolarHBondContact O-N 3.35Å; E388-F390 PolarHBondContact O-N 3.4Å; E388-F390 VanDerWaalsContact O-N 3.13Å; E388-T391 WeakPolarHBondContact CA-OG1 3.46Å; E388-T391 PolarHBondContact O-N 2.99Å; E388-E392 CarbonylContact O-C 3.54Å; E388-E392 PolarHBondContact O-N 3.37Å
389	F	95.3	Very high	94.6	Very high	37 Å²	37	47 Å²	47	16%	0.162	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-20.8	174.6	-161.7	-81.5	0	0	0	113.4	F321 F322 C325 K385 T387 N393	F321-F389 HydrophobicContact CD1-CD1 4.17Å; F321-F389 HydrophobicContact CD1-CE1 4Å; F321-F389 AromaticContact CE1-CD1 3.63Å; F321-F389 HydrophobicContact CE1-CD1 3.63Å; F321-F389 AromaticContact CE1-CE1 3.74Å; F321-F389 HydrophobicContact CE1-CE1 3.74Å; F321-F389 HydrophobicContact CZ-CD1 4.35Å; F321-F389 HydrophobicContact CZ-CE1 4.31Å; F322-F389 AromaticContact CD1-CD1 3.51Å; F322-F389 HydrophobicContact CD1-CD1 3.51Å; F322-F389 HydrophobicContact CD1-CD2 4.2Å; F322-F389 AromaticContact CD1-CE1 3.48Å; F322-F389 HydrophobicContact CD1-CE1 3.48Å; F322-F389 VanDerWaalsContact CD1-CE1 3.48Å; F322-F389 HydrophobicContact CD1-CE2 4.14Å; F322-F389 AromaticContact CD1-CG 3.91Å; F322-F389 HydrophobicContact CD1-CG 3.91Å; F322-F389 AromaticContact CD1-CZ 3.8Å; F322-F389 HydrophobicContact CD1-CZ 3.8Å; F322-F389 HydrophobicContact CE1-CB 4.29Å; F322-F389 AromaticContact CE1-CD1 3.61Å; F322-F389 HydrophobicContact CE1-CD1 3.61Å; F322-F389 HydrophobicContact CE1-CD2 4.44Å; F322-F389 HydrophobicContact CE1-CE1 4.09Å; F322-F389 AromaticContact CE1-CG 3.85Å; F322-F389 HydrophobicContact CE1-CG 3.85Å; F322-F389 HydrophobicContact CG-CE1 4.48Å; C325-F389 HydrophobicContact CB-CE1 4.41Å; K385-F389 PolarHBondContact O-N 2.94Å; K385-F389 VanDerWaalsContact O-N 3.16Å; T387-F389 PolarHBondContact O-N 3.18Å; F389-N393 VanDerWaalsContact O-CB 3.28Å; F389-N393 WeakPolarHBondContact O-CB 3.23Å; F389-N393 PolarHBondContact O-ND2 2.92Å
390	F	96.4	Very high	94.6	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.013	21%	0.211	C	C	.	.	H	α-helix	trans	-96.1	-44.9	169.7	-69.6	-88.6	0	0	0	112.6	L318 F321 L350 M355 P357 V367 P369 F386 T387 E388	L318-F390 HydrophobicContact CD1-CZ 4.05Å; F321-F390 HydrophobicContact CD1-CD1 4.44Å; F321-F390 AromaticContact CD1-CE1 3.72Å; F321-F390 HydrophobicContact CD1-CE1 3.72Å; F321-F390 AromaticContact CD1-CZ 3.82Å; F321-F390 HydrophobicContact CD1-CZ 3.82Å; F321-F390 AromaticContact CE1-CD1 3.48Å; F321-F390 HydrophobicContact CE1-CD1 3.48Å; F321-F390 VanDerWaalsContact CE1-CD1 3.48Å; F321-F390 HydrophobicContact CE1-CD2 4.41Å; F321-F390 AromaticContact CE1-CE1 3.17Å; F321-F390 HydrophobicContact CE1-CE1 3.17Å; F321-F390 HydrophobicContact CE1-CE2 4.16Å; F321-F390 HydrophobicContact CE1-CG 4.1Å; F321-F390 AromaticContact CE1-CZ 3.55Å; F321-F390 HydrophobicContact CE1-CZ 3.55Å; F321-F390 AromaticContact CZ-CD1 3.7Å; F321-F390 HydrophobicContact CZ-CD1 3.7Å; F321-F390 AromaticContact CZ-CE1 3.73Å; F321-F390 HydrophobicContact CZ-CE1 3.73Å; F321-F390 HydrophobicContact CZ-CG 4.48Å; L350-F390 HydrophobicContact CD1-CE1 3.73Å; L350-F390 HydrophobicContact CD1-CZ 4.21Å; M355-F390 HydrophobicContact CG-CZ 4.44Å; P357-F390 HydrophobicContact CB-CD1 4.39Å; P357-F390 HydrophobicContact CB-CE1 4.49Å; V367-F390 VanDerWaalsContact CG2-O 3.31Å; V367-F390 WeakPolarHBondContact CG2-O 3.02Å; V367-F390 CarbonylContact O-C 3.59Å; V367-F390 VanDerWaalsContact O-C 3.26Å; V367-F390 WeakPolarHBondContact O-CB 3.46Å; P369-F390 HydrophobicContact CG-CD2 4.36Å; P369-F390 HydrophobicContact CG-CE2 4.37Å; F386-F390 HydrophobicContact CE1-CE2 4.07Å; F386-F390 HydrophobicContact CE2-CE2 4.05Å; F386-F390 AromaticContact CZ-CE2 3.71Å; F386-F390 HydrophobicContact CZ-CE2 3.71Å; F386-F390 HydrophobicContact CZ-CZ 4.47Å; F386-F390 WeakPolarHBondContact O-CD2 3.24Å; T387-F390 PolarHBondContact O-N 3.26Å; E388-F390 PolarHBondContact O-N 3.4Å; E388-F390 VanDerWaalsContact O-N 3.13Å
391	T	95.9	Very high	94.4	Very high	24 Å²	24	42.6 Å²	42.6	15%	0.147	21%	0.212	C	C	.	.	H	α-helix	trans	-82.7	-35.5	-167.9	54.9	0	0	0	0	114	L360 S366 V367 T387 E388 R397	L360-T391 HydrophobicContact CD1-CG2 4.13Å; S366-T391 VanDerWaalsContact OG-CA 3.29Å; S366-T391 WeakPolarHBondContact OG-CA 3.49Å; S366-T391 WeakPolarHBondContact OG-CB 3.32Å; S366-T391 PolarHBondContact OG-O 2.04Å; V367-T391 WeakPolarHBondContact O-CG2 3.34Å; V367-T391 PolarHBondContact O-N 3.48Å; T387-T391 HydrophobicContact CG2-CG2 4.09Å; T387-T391 PolarHBondContact O-N 3.45Å; T387-T391 PolarHBondContact O-OG1 3.18Å; E388-T391 WeakPolarHBondContact CA-OG1 3.46Å; E388-T391 PolarHBondContact O-N 2.99Å; T391-R397 PolarHBondContact O-NH2 3.09Å
392	E	93.9	Very high	94.1	Very high	105 Å²	105	37.6 Å²	37.6	49%	0.491	19%	0.187	S	C	.	.	S	Bend	trans	-123.2	37	-173.8	-67.5	-56.2	154.2	0	0	112.9	E388 R397	E388-E392 CarbonylContact O-C 3.54Å; E388-E392 PolarHBondContact O-N 3.37Å; E392-R397 IonicContact OE1-NH2 3.18Å; E392-R397 IonicContact OE2-CZ 2.62Å; E392-R397 IonicContact OE2-NH2 2.66Å; E392-R397 PolarHBondContact OE2-NH2 3.29Å
393	N	94.4	Very high	93.8	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.032	17%	0.171	C	C	.	.			trans	-89.1	107.7	178.2	-172.2	-41.4	0	0	0	112.1	C325 F389 C395 L396 R397	C325-N393 PolarHBondContact O-ND2 2.87Å; C325-N393 PolarHBondContact O-OD1 2.99Å; F389-N393 VanDerWaalsContact O-CB 3.28Å; F389-N393 WeakPolarHBondContact O-CB 3.23Å; F389-N393 PolarHBondContact O-ND2 2.92Å; N393-C395 WeakPolarHBondContact OD1-CB 3.41Å; N393-C395 PolarHBondContact OD1-N 3.12Å; N393-C395 VanDerWaalsContact OD1-N 3.1Å; N393-L396 HydrophobicContact CB-CB 4.06Å; N393-L396 PolarHBondContact O-N 3.31Å; N393-L396 PolarHBondContact OD1-N 3.19Å; N393-R397 VanDerWaalsContact O-CB 3.23Å; N393-R397 WeakPolarHBondContact O-CB 3.27Å; N393-R397 PolarHBondContact O-N 3.38Å
394	T	93.8	Very high	93.3	Very high	63 Å²	63	35.4 Å²	35.4	39%	0.387	18%	0.177	S	C	.	.	H	α-helix	trans	-62	-42.3	179.1	-57.7	0	0	0	0	112.5	L396 R397 N398	T394-L396 PolarHBondContact O-N 3.21Å; T394-R397 PolarHBondContact O-N 3.28Å; T394-N398 VanDerWaalsContact O-CB 3.31Å; T394-N398 WeakPolarHBondContact O-CB 3.3Å; T394-N398 PolarHBondContact O-N 3Å; T394-N398 PolarHBondContact O-OD1 3.36Å
395	C	94.1	Very high	92.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57	-51.9	176.6	174.1	0	0	0	0	111.8	G334 C335 N393 N398 A399	G334-C395 WeakPolarHBondContact O-CB 3.22Å; C335-C395 HydrophobicContact CB-CB 3.89Å; C335-C395 WeakPolarHBondContact CB-SG 3.18Å; C335-C395 WeakPolarHBondContact SG-CA 3.46Å; C335-C395 WeakPolarHBondContact SG-CB 3.49Å; C335-C395 CovalentContact SG-SG 2.03Å; C335-C395 PolarHBondContact SG-SG 3.13Å; N393-C395 WeakPolarHBondContact OD1-CB 3.41Å; N393-C395 PolarHBondContact OD1-N 3.12Å; N393-C395 VanDerWaalsContact OD1-N 3.1Å; C395-N398 PolarHBondContact O-N 3.21Å; C395-A399 VanDerWaalsContact O-CB 3.29Å; C395-A399 WeakPolarHBondContact O-CB 3.41Å; C395-A399 PolarHBondContact O-N 2.98Å
396	L	94.6	Very high	91.8	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-66.8	-40.2	-179.9	-179	62.5	0	0	0	112.1	F321 Y347 V367 N393 T394 A399 I400	F321-L396 HydrophobicContact CE2-CD2 4.01Å; F321-L396 HydrophobicContact CZ-CD2 3.96Å; Y347-L396 HydrophobicContact CD2-CD1 4.13Å; Y347-L396 HydrophobicContact CD2-CD2 3.9Å; Y347-L396 HydrophobicContact CE2-CD2 4.33Å; Y347-L396 HydrophobicContact CG-CD1 4.19Å; V367-L396 HydrophobicContact CG2-CD2 3.68Å; N393-L396 HydrophobicContact CB-CB 4.06Å; N393-L396 PolarHBondContact O-N 3.31Å; N393-L396 PolarHBondContact OD1-N 3.19Å; T394-L396 PolarHBondContact O-N 3.21Å; L396-A399 PolarHBondContact O-N 2.64Å; L396-I400 HydrophobicContact CD1-CD1 3.89Å; L396-I400 HydrophobicContact CD1-CG1 4.15Å; L396-I400 HydrophobicContact CG-CD1 3.95Å; L396-I400 VanDerWaalsContact O-CG1 3.28Å; L396-I400 WeakPolarHBondContact O-CG1 3.45Å; L396-I400 PolarHBondContact O-N 2.86Å
397	R	93.8	Very high	90.3	Very high	40 Å²	40	37.9 Å²	37.9	15%	0.151	20%	0.202	C	C	.	.	H	α-helix	trans	-57	-51.7	175	-178.3	-173.6	-55.5	-62.6	1.7	110.7	I365 T391 E392 N393 T394 I400 Q401	I365-R397 PolarHBondContact O-NH1 2.85Å; T391-R397 PolarHBondContact O-NH2 3.09Å; E392-R397 IonicContact OE1-NH2 3.18Å; E392-R397 IonicContact OE2-CZ 2.62Å; E392-R397 IonicContact OE2-NH2 2.66Å; E392-R397 PolarHBondContact OE2-NH2 3.29Å; N393-R397 VanDerWaalsContact O-CB 3.23Å; N393-R397 WeakPolarHBondContact O-CB 3.27Å; N393-R397 PolarHBondContact O-N 3.38Å; T394-R397 PolarHBondContact O-N 3.28Å; R397-I400 PolarHBondContact O-N 3.48Å; R397-Q401 WeakPolarHBondContact O-CB 3.28Å; R397-Q401 VanDerWaalsContact O-CG 3.32Å; R397-Q401 WeakPolarHBondContact O-CG 3.38Å; R397-Q401 PolarHBondContact O-N 3.03Å; R397-Q401 VanDerWaalsContact O-N 3.07Å
398	N	91.8	Very high	88.2	Confident	39 Å²	39	38.1 Å²	38.1	21%	0.209	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-43.2	179.4	-68.7	-3.3	0	0	0	111.5	S333 Y340 T394 C395 I400 Q401 A402	S333-N398 PolarHBondContact O-ND2 3.18Å; Y340-N398 HydrophobicContact CE1-CB 3.87Å; T394-N398 VanDerWaalsContact O-CB 3.31Å; T394-N398 WeakPolarHBondContact O-CB 3.3Å; T394-N398 PolarHBondContact O-N 3Å; T394-N398 PolarHBondContact O-OD1 3.36Å; C395-N398 PolarHBondContact O-N 3.21Å; N398-I400 PolarHBondContact O-N 3.23Å; N398-Q401 PolarHBondContact O-N 2.88Å; N398-A402 VanDerWaalsContact O-CB 3.31Å; N398-A402 WeakPolarHBondContact O-CB 3.36Å; N398-A402 PolarHBondContact O-N 2.89Å
399	A	91.8	Very high	85.9	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-45.4	178.4	0	0	0	0	0	112.8	Y340 L344 C395 L396 F403	Y340-A399 HydrophobicContact CD1-CB 3.57Å; Y340-A399 HydrophobicContact CE1-CB 4.4Å; Y340-A399 HydrophobicContact CG-CB 3.86Å; L344-A399 HydrophobicContact CD1-CB 4.46Å; L344-A399 HydrophobicContact CD2-CB 3.94Å; L344-A399 HydrophobicContact CG-CB 3.97Å; C395-A399 VanDerWaalsContact O-CB 3.29Å; C395-A399 WeakPolarHBondContact O-CB 3.41Å; C395-A399 PolarHBondContact O-N 2.98Å; L396-A399 PolarHBondContact O-N 2.64Å; A399-F403 WeakPolarHBondContact O-CB 3.33Å; A399-F403 PolarHBondContact O-N 2.94Å
400	I	92.9	Very high	83.5	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-39.5	177.6	-64.5	171.5	0	0	0	110.6	F268 L344 I365 L396 R397 N398 G404	F268-I400 HydrophobicContact CB-CG2 4.28Å; F268-I400 HydrophobicContact CD1-CB 4.47Å; F268-I400 HydrophobicContact CD1-CD1 4.17Å; F268-I400 HydrophobicContact CD1-CG1 3.72Å; F268-I400 HydrophobicContact CD1-CG2 4.17Å; F268-I400 HydrophobicContact CE1-CD1 4.23Å; F268-I400 HydrophobicContact CE1-CG1 4Å; L344-I400 HydrophobicContact CD2-CG1 3.73Å; I365-I400 HydrophobicContact CD1-CG2 4.18Å; I365-I400 HydrophobicContact CG2-CB 4.24Å; I365-I400 HydrophobicContact CG2-CD1 3.98Å; I365-I400 HydrophobicContact CG2-CG2 4.02Å; L396-I400 HydrophobicContact CD1-CD1 3.89Å; L396-I400 HydrophobicContact CD1-CG1 4.15Å; L396-I400 HydrophobicContact CG-CD1 3.95Å; L396-I400 VanDerWaalsContact O-CG1 3.28Å; L396-I400 WeakPolarHBondContact O-CG1 3.45Å; L396-I400 PolarHBondContact O-N 2.86Å; R397-I400 PolarHBondContact O-N 3.48Å; N398-I400 PolarHBondContact O-N 3.23Å; I400-G404 PolarHBondContact O-N 3.02Å
401	Q	91.2	Very high	80.5	Confident	80 Å²	80	46.1 Å²	46.1	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-67.2	-45.8	177.1	-74.2	176.3	-33.3	0	0	112.3	I365 R397 N398 G404 N405	I365-Q401 HydrophobicContact CD1-CG 3.61Å; R397-Q401 WeakPolarHBondContact O-CB 3.28Å; R397-Q401 VanDerWaalsContact O-CG 3.32Å; R397-Q401 WeakPolarHBondContact O-CG 3.38Å; R397-Q401 PolarHBondContact O-N 3.03Å; R397-Q401 VanDerWaalsContact O-N 3.07Å; N398-Q401 PolarHBondContact O-N 2.88Å; Q401-G404 PolarHBondContact O-N 2.82Å; Q401-N405 VanDerWaalsContact O-CB 3.27Å; Q401-N405 WeakPolarHBondContact O-CB 3.21Å; Q401-N405 PolarHBondContact O-N 3.08Å
402	A	88.7	Confident	77.5	Confident	7 Å²	7	54.1 Å²	54.1	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-45.6	179.4	0	0	0	0	0	111.6	Y340 N398 G406 T407	Y340-A402 HydrophobicContact CD2-CB 3.86Å; Y340-A402 HydrophobicContact CE2-CB 3.78Å; N398-A402 VanDerWaalsContact O-CB 3.31Å; N398-A402 WeakPolarHBondContact O-CB 3.36Å; N398-A402 PolarHBondContact O-N 2.89Å; A402-G406 CarbonylContact O-C 3.59Å; A402-G406 PolarHBondContact O-N 2.92Å; A402-T407 WeakPolarHBondContact CA-OG1 3.35Å; A402-T407 PolarHBondContact O-N 3.17Å
403	F	88.3	Confident	74.5	Confident	20 Å²	20	53.9 Å²	53.9	9%	0.088	30%	0.3	C	S	.	.	H	α-helix	trans	-63.7	-46.4	173.9	-176.6	-84.7	0	0	0	112	F135 A138 Y264 F268 L344 A399 N405 G406	F135-F403 HydrophobicContact CD1-CD2 4.25Å; F135-F403 HydrophobicContact CD1-CE2 4.37Å; A138-F403 HydrophobicContact CB-CE2 3.89Å; A138-F403 HydrophobicContact CB-CZ 4.37Å; Y264-F403 VanDerWaalsContact C-CE1 3.48Å; Y264-F403 HydrophobicContact CD2-CE2 4.38Å; Y264-F403 WeakPolarHBondContact O-CE1 3.28Å; F268-F403 HydrophobicContact CB-CD1 3.62Å; F268-F403 HydrophobicContact CB-CE1 4.16Å; F268-F403 HydrophobicContact CB-CG 4.4Å; F268-F403 HydrophobicContact CD2-CD1 4.47Å; L344-F403 HydrophobicContact CD1-CB 3.79Å; L344-F403 HydrophobicContact CD1-CD2 4.2Å; L344-F403 HydrophobicContact CD1-CG 4.15Å; A399-F403 WeakPolarHBondContact O-CB 3.33Å; A399-F403 PolarHBondContact O-N 2.94Å; F403-N405 VanDerWaalsContact C-N 3.3Å; F403-N405 PolarHBondContact O-N 3.12Å; F403-G406 PolarHBondContact O-N 2.95Å
404	G	86.1	Confident	71.6	Confident	14 Å²	14	59.1 Å²	59.1	14%	0.144	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-31.8	-178.4	0	0	0	0	0	113.8	F268 S270 I400 Q401	F268-G404 WeakPolarHBondContact O-CA 3.31Å; S270-G404 WeakPolarHBondContact CB-O 3.4Å; S270-G404 PolarHBondContact OG-O 2.97Å; I400-G404 PolarHBondContact O-N 3.02Å; Q401-G404 PolarHBondContact O-N 2.82Å
405	N	84	Confident	68.8	Low	106 Å²	106	63.6 Å²	63.6	57%	0.567	35%	0.354	S	S	*	.	H	α-helix	trans	-92	-10	179	-64.5	-8.3	0	0	0	113	S270 Q401 F403 T407	S270-N405 WeakPolarHBondContact CB-OD1 3.39Å; Q401-N405 VanDerWaalsContact O-CB 3.27Å; Q401-N405 WeakPolarHBondContact O-CB 3.21Å; Q401-N405 PolarHBondContact O-N 3.08Å; F403-N405 VanDerWaalsContact C-N 3.3Å; F403-N405 PolarHBondContact O-N 3.12Å; N405-T407 HydrophobicContact CB-CG2 4.01Å
406	G	75.4	Confident	65.5	Low	13 Å²	13	67.9 Å²	67.9	13%	0.134	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	19.2	-175.5	0	0	0	0	0	114.7	P139 A402 F403 D408	P139-G406 WeakPolarHBondContact CG-O 3.35Å; A402-G406 CarbonylContact O-C 3.59Å; A402-G406 PolarHBondContact O-N 2.92Å; F403-G406 PolarHBondContact O-N 2.95Å; G406-D408 VanDerWaalsContact C-N 3.34Å; G406-D408 PolarHBondContact O-N 2.79Å
407	T	62.4	Low	62.5	Low	92 Å²	92	73.3 Å²	73.3	56%	0.564	42%	0.42	S	S	*	.			trans	-94.5	19.1	-175.7	63.8	0	0	0	0	113.3	A402 N405 I409	A402-T407 WeakPolarHBondContact CA-OG1 3.35Å; A402-T407 PolarHBondContact O-N 3.17Å; N405-T407 HydrophobicContact CB-CG2 4.01Å; T407-I409 PolarHBondContact O-N 2.9Å; T407-I409 VanDerWaalsContact O-N 3.08Å
408	D	52.4	Low	59.5	Low	32 Å²	32	77.5 Å²	77.5	17%	0.171	45%	0.45	C	S	.	.			trans	-77.6	25.3	173.1	-162.9	18.4	0	0	0	112.9	F135 G406	F135-D408 WeakPolarHBondContact CB-OD2 3.04Å; G406-D408 VanDerWaalsContact C-N 3.34Å; G406-D408 PolarHBondContact O-N 2.79Å
409	I	47.3	Very low	56.6	Low	111 Å²	111	83.2 Å²	83.2	57%	0.569	48%	0.475	S	S	*	.	S	Bend	trans	-126.3	103.4	179.3	-59.5	174.7	0	0	0	106.8	R136 P139 T407	R136-I409 WeakPolarHBondContact O-CD1 3.34Å; R136-I409 WeakPolarHBondContact O-CG1 3.4Å; P139-I409 HydrophobicContact CG-CD1 4.4Å; T407-I409 PolarHBondContact O-N 2.9Å; T407-I409 VanDerWaalsContact O-N 3.08Å
410	G	43.9	Very low	53.4	Low	76 Å²	76	89.6 Å²	89.6	78%	0.784	51%	0.514	S	S	*	.			trans	144.1	3.6	162	0	0	0	0	0	120
411	M	33.8	Very low	50.5	Low	134 Å²	134	94.7 Å²	94.7	66%	0.66	55%	0.545	S	S	*	.	S	Bend	trans	-102.5	118.7	167.6	-66.7	-167.4	-170.8	0	0	111.5
412	W	32.2	Very low	47.7	Very low	192 Å²	192	97 Å²	97	73%	0.727	57%	0.565	S	S	*	*			trans	77.4	119.5	-179.6	-57.9	98.7	0	0	0	117.9
413	P	31.3	Very low	44.8	Very low	100 Å²	100	101.7 Å²	101.7	65%	0.649	60%	0.598	S	S	*	*			trans	-67.3	164.2	167.2	31.2	-34.9	0	0	0	110.8	I415	P413-I415 PolarHBondContact O-N 3.39Å; P413-I415 VanDerWaalsContact O-N 3.12Å
414	P	33	Very low	42.2	Very low	117 Å²	117	108.4 Å²	108.4	76%	0.76	63%	0.633	S	S	*	*			trans	-59.8	120.3	172.7	25.8	-33.9	0	0	0	110	S416	P414-S416 VanDerWaalsContact C-N 3.33Å; P414-S416 PolarHBondContact O-N 3.47Å
415	I	34.9	Very low	39.4	Very low	156 Å²	156	113.9 Å²	113.9	80%	0.8	66%	0.664	S	S	*	*			trans	-62.4	101.7	160.7	-61.6	170.2	0	0	0	105.9	P413	P413-I415 PolarHBondContact O-N 3.39Å; P413-I415 VanDerWaalsContact O-N 3.12Å
416	S	26.7	Very low	36.7	Very low	91 Å²	91	115.2 Å²	115.2	64%	0.636	68%	0.676	S	S	*	*			trans	-50.5	140.7	168.3	-70.2	0	0	0	0	109	P414 V418	P414-S416 VanDerWaalsContact C-N 3.33Å; P414-S416 PolarHBondContact O-N 3.47Å; S416-V418 PolarHBondContact O-N 2.79Å
417	P	30.9	Very low	34.8	Very low	118 Å²	118	120 Å²	120	77%	0.766	70%	0.704	S	S	*	*			trans	-58.3	113.8	174.9	25.3	-32.8	0	0	0	108.2	Q419	P417-Q419 PolarHBondContact O-N 2.7Å
418	V	30	Very low	32.9	Very low	127 Å²	127	125.2 Å²	125.2	77%	0.77	72%	0.715	S	S	*	*			trans	-58.9	109.4	172.2	175.6	0	0	0	0	106.3	S416 T420	S416-V418 PolarHBondContact O-N 2.79Å; V418-T420 PolarHBondContact O-N 3.3Å
419	Q	30.7	Very low	31.7	Very low	160 Å²	160	130.4 Å²	130.4	75%	0.748	74%	0.739	S	S	*	*			trans	-63.8	121.6	169.8	-72.4	-177	-20.1	0	0	107.1	P417 T421	P417-Q419 PolarHBondContact O-N 2.7Å; Q419-T421 HydrophobicContact CB-CG2 4.48Å; Q419-T421 PolarHBondContact O-N 3.21Å
420	T	26.3	Very low	30.7	Very low	133 Å²	133	136.3 Å²	136.3	82%	0.816	75%	0.754	S	S	*	*			trans	-69.4	79.2	171.9	-47.7	0	0	0	0	108.7	V418 T422	V418-T420 PolarHBondContact O-N 3.3Å; T420-T422 PolarHBondContact O-N 2.74Å
421	T	32	Very low	29.8	Very low	109 Å²	109	140.6 Å²	140.6	67%	0.669	76%	0.758	S	S	*	*			trans	-71	98	172.9	49.1	0	0	0	0	108.9	Q419 S423	Q419-T421 HydrophobicContact CB-CG2 4.48Å; Q419-T421 PolarHBondContact O-N 3.21Å; T421-S423 PolarHBondContact O-N 3.49Å
422	T	31.4	Very low	29.5	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	76%	0.762	S	S	*	*			trans	-65.7	85.6	162.5	47.4	0	0	0	0	109	T420 I424	T420-T422 PolarHBondContact O-N 2.74Å; T422-I424 PolarHBondContact O-N 3.13Å
423	S	28.8	Very low	29.2	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	77%	0.77	S	S	*	*			trans	-78.9	111.6	173.9	56	0	0	0	0	110	T421	T421-S423 PolarHBondContact O-N 3.49Å
424	I	32	Very low	29.1	Very low	161 Å²	161	149.2 Å²	149.2	83%	0.826	78%	0.779	S	S	*	*			trans	-62.7	142	173.7	-66.7	165.2	0	0	0	109.9	T422 T426	T422-I424 PolarHBondContact O-N 3.13Å; I424-T426 PolarHBondContact O-N 3.48Å
425	T	27.7	Very low	29	Very low	128 Å²	128	150 Å²	150	79%	0.785	78%	0.775	S	S	*	*			trans	-64.1	123.3	179.5	-46	0	0	0	0	113.1
426	T	27.9	Very low	29	Very low	135 Å²	135	148.6 Å²	148.6	83%	0.828	78%	0.776	S	S	*	*			trans	-149.6	150.1	143.8	34	0	0	0	0	110.7	I424	I424-T426 PolarHBondContact O-N 3.48Å
427	P	34.3	Very low	29.2	Very low	112 Å²	112	150.4 Å²	150.4	73%	0.727	78%	0.779	S	S	*	*			trans	-110.6	142.9	-167.9	37.6	-28.5	0	0	0	114
428	Y	23.2	Very low	29.1	Very low	202 Å²	202	152 Å²	152	79%	0.792	78%	0.781	S	S	*	*			trans	-162.5	136.9	141.1	-132.7	-125.7	0	0	0	116.1
429	Q	27.5	Very low	29.3	Very low	142 Å²	142	151.8 Å²	151.8	66%	0.664	77%	0.774	S	S	*	*			trans	37.3	95.3	153.9	-65.5	-170.9	-3.6	0	0	122.5
430	R	26.2	Very low	29.3	Very low	235 Å²	235	151 Å²	151	89%	0.887	78%	0.775	S	S	*	*				29.1	107.8	102.1	-171.1	-169.9	-115.2	-178	0.7	116.5
431	N	25.4	Very low	29.6	Very low	165 Å²	165	151.3 Å²	151.3	88%	0.882	77%	0.772	S	S	*	*			trans	-125.5	152.4	142	-156.2	-1.3	0	0	0	110.4
432	R	26.6	Very low	29.7	Very low	194 Å²	194	154.8 Å²	154.8	73%	0.732	78%	0.78	S	S	*	*			trans	-140.5	108.1	-159.8	174.2	-159.5	179.3	-177.9	1.9	111.4
433	E	25.9	Very low	29.7	Very low	193 Å²	193	156 Å²	156	90%	0.902	78%	0.78	S	S	*	*			trans	-132.6	97.2	159.6	-64.5	-169.2	138.9	0	0	107.4
434	R	29.1	Very low	29.6	Very low	221 Å²	221	158.7 Å²	158.7	83%	0.834	79%	0.786	S	S	*	*				70.5	88.4	92.9	-95.3	-172.3	172.1	167.1	-1.1	114.4
435	I	31	Very low	29.4	Very low	133 Å²	133	154.9 Å²	154.9	68%	0.682	78%	0.779	S	S	*	*			trans	-39.7	160.1	151.1	-7.5	175.6	0	0	0	113.1	N437	I435-N437 WeakPolarHBondContact CG2-OD1 3.29Å
436	P	36.3	Very low	29.4	Very low	127 Å²	127	156.7 Å²	156.7	83%	0.825	78%	0.783	S	S	*	*				-132.2	151.8	80.3	18.7	2.5	0	0	0	116
437	N	30	Very low	29.3	Very low	128 Å²	128	155.5 Å²	155.5	68%	0.684	78%	0.781	S	S	*	*			trans	-72.3	162.4	170.4	-53.1	-37.1	0	0	0	110.7	I435	I435-N437 WeakPolarHBondContact CG2-OD1 3.29Å
438	N	28.5	Very low	29.2	Very low	153 Å²	153	155.2 Å²	155.2	82%	0.818	78%	0.782	S	S	*	*			trans	-131	147.5	134.5	-158.6	10.1	0	0	0	110.2
439	I	34.3	Very low	29.6	Very low	122 Å²	122	152.2 Å²	152.2	63%	0.626	78%	0.778	S	S	*	*			trans	-111.9	134.9	-178.3	-66.6	162.2	0	0	0	106.3
440	D	30.1	Very low	29.8	Very low	142 Å²	142	155.8 Å²	155.8	76%	0.759	79%	0.787	S	S	*	*			trans	-137.6	117	153.4	-95.8	-45.1	0	0	0	110
441	N	32.7	Very low	29.8	Very low	140 Å²	140	152.8 Å²	152.8	75%	0.749	78%	0.783	S	S	*	*			trans	-98.7	112.9	171.2	-95.1	-20.4	0	0	0	107.8
442	H	34	Very low	30	Very low	182 Å²	182	155.2 Å²	155.2	84%	0.843	79%	0.786	S	S	*	*			trans	-114.5	102.1	159.1	-91.6	-70.2	0	0	0	109.9
443	I	31.2	Very low	30.1	Very low	154 Å²	154	151.6 Å²	151.6	79%	0.79	79%	0.789	S	S	*	*			trans	-78.1	124.8	161.8	-62.6	171.2	0	0	0	106.7
444	N	27.4	Very low	30.2	Very low	163 Å²	163	145.4 Å²	145.4	87%	0.872	78%	0.778	S	S	*	*			trans	-138.3	139.1	146.7	-157.1	4.8	0	0	0	108.8
445	A	27.9	Very low	30.1	Very low	81 Å²	81	142.8 Å²	142.8	67%	0.669	78%	0.78	S	S	*	*			trans	-109.6	132	-170.8	0	0	0	0	0	110.2
446	D	27.2	Very low	30.2	Very low	166 Å²	166	145 Å²	145	89%	0.888	79%	0.792	S	S	*	*			trans	-161.6	171.5	132.4	-145.2	-17.3	0	0	0	111.6
447	S	26.6	Very low	29.8	Very low	111 Å²	111	147.6 Å²	147.6	78%	0.776	79%	0.794	S	S	*	*			trans	83.4	88.8	171.3	-132.3	0	0	0	0	116.7
448	S	32.3	Very low	29.7	Very low	106 Å²	106	146.1 Å²	146.1	74%	0.741	80%	0.799	S	S	*	*			trans	-52.8	139.1	157.5	-65.8	0	0	0	0	111.8
449	L	30.9	Very low	29.6	Very low	138 Å²	138	148.6 Å²	148.6	72%	0.723	81%	0.806	S	S	*	*				169.8	130.6	118.5	-87	156.3	0	0	0	112
450	Y	32.3	Very low	29.3	Very low	217 Å²	217	151.2 Å²	151.2	85%	0.851	81%	0.813	S	S	*	*			trans	61.5	94.3	167.7	-54.9	-63.5	0	0	0	119.6
451	H	26.8	Very low	29.3	Very low	173 Å²	173	151 Å²	151	80%	0.801	81%	0.81	S	S	*	*			trans	-106.2	112.5	158	-179.3	86.3	0	0	0	109.6
452	F	28.2	Very low	29	Very low	215 Å²	215	153 Å²	153	94%	0.943	82%	0.815	S	S	*	*			trans	-152.6	92.7	169.1	-126.7	-80.8	0	0	0	112.9
453	C	29.8	Very low	28.7	Very low	118 Å²	118	149.2 Å²	149.2	80%	0.797	81%	0.809	S	S	*	*			trans	-169.7	134	158	-149.1	0	0	0	0	106.2
454	G	28	Very low	28.4	Very low	64 Å²	64	148.9 Å²	148.9	66%	0.66	81%	0.809	S	S	*	*			cis	159.6	76.6	4.8	0	0	0	0	0	108.4	L456	G454-L456 PolarHBondContact O-N 3.04Å; G454-L456 VanDerWaalsContact O-N 3.12Å
455	N	27.8	Very low	28.4	Very low	166 Å²	166	145.8 Å²	145.8	89%	0.888	81%	0.806	S	S	*	*			trans	-78	96.2	-176.6	-86.1	-22	0	0	0	111.7
456	L	31.5	Very low	28.4	Very low	179 Å²	179	148.4 Å²	148.4	94%	0.937	81%	0.814	S	S	*	*			trans	-113.3	66	162.1	-85.6	168	0	0	0	110.3	G454	G454-L456 PolarHBondContact O-N 3.04Å; G454-L456 VanDerWaalsContact O-N 3.12Å
457	Q	28.8	Very low	28.3	Very low	182 Å²	182	146.3 Å²	146.3	85%	0.85	81%	0.807	S	S	*	*			trans	-87.5	130.4	157.1	-98.7	-176.7	-14.5	0	0	109.4	Q459	Q457-Q459 PolarHBondContact O-N 2.95Å
458	A	26.9	Very low	28.2	Very low	97 Å²	97	147.8 Å²	147.8	80%	0.802	81%	0.806	S	S	*	*			trans	-65.3	118.7	-175.4	0	0	0	0	0	111.7	K460	A458-K460 PolarHBondContact O-N 3.27Å
459	Q	26.8	Very low	27.8	Very low	204 Å²	204	148.9 Å²	148.9	95%	0.953	81%	0.808	S	S	*	*			trans	-70.9	97.8	164.4	-79.1	-174.6	-25.4	0	0	109.5	Q457	Q457-Q459 PolarHBondContact O-N 2.95Å
460	K	29	Very low	27.4	Very low	178 Å²	178	148.7 Å²	148.7	77%	0.774	82%	0.816	S	S	*	*			trans	-98.4	130.2	168.8	-167.3	179.9	-176.4	-174.6	0	108.4	A458	A458-K460 PolarHBondContact O-N 3.27Å
461	L	29.4	Very low	27	Very low	136 Å²	136	143.7 Å²	143.7	71%	0.712	81%	0.814	S	S	*	*			trans	11	120	168.4	-70.6	108	0	0	0	118.5
462	H	26.8	Very low	27	Very low	183 Å²	183	141.1 Å²	141.1	85%	0.847	82%	0.815	S	S	*	*			trans	-123.6	102.2	141.9	-99.4	-105.5	0	0	0	109.3
463	S	27.1	Very low	26.8	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	81%	0.807	S	S	*	*			trans	-80.8	124.6	159.3	-58.8	0	0	0	0	107.6
464	N	25.8	Very low	27.4	Very low	148 Å²	148	137 Å²	137	79%	0.791	80%	0.8	S	S	*	*			trans	-120.1	111	161.8	-108	9.8	0	0	0	108.2
465	A	27.6	Very low	27.3	Very low	98 Å²	98	142 Å²	142	81%	0.81	81%	0.806	S	S	*	*			trans	-86.6	129.7	164.3	0	0	0	0	0	108.3
466	T	25.9	Very low	27.3	Very low	135 Å²	135	138.1 Å²	138.1	83%	0.828	80%	0.797	S	S	*	*			trans	-133.3	135.2	161.4	42.9	0	0	0	0	108.1
467	V	27	Very low	27.4	Very low	123 Å²	123	135.4 Å²	135.4	75%	0.745	79%	0.791	S	S	*	*			trans	-90.4	146.1	-166.6	169.8	0	0	0	0	110.9
468	D	23	Very low	27.3	Very low	142 Å²	142	135.6 Å²	135.6	76%	0.759	79%	0.788	S	S	*	*			trans	30.6	136	160.6	-58.6	-33.1	0	0	0	121.5
469	V	25.2	Very low	27.4	Very low	128 Å²	128	137 Å²	137	78%	0.776	79%	0.787	S	S	*	*				-165.5	129	105.3	150.7	0	0	0	0	108.5
470	C	21.6	Very low	27.5	Very low	134 Å²	134	134 Å²	134	91%	0.905	78%	0.777	S	S	*	*			trans	-100.1	128.9	164.4	-73.6	0	0	0	0	109.3
471	S	23.3	Very low	27.3	Very low	113 Å²	113	129 Å²	129	79%	0.79	78%	0.776	S	S	*	*			trans	-138.9	146.4	167.5	-75.9	0	0	0	0	111.2
472	S	27.3	Very low	27.8	Very low	118 Å²	118	128.3 Å²	128.3	83%	0.825	78%	0.78	S	S	*	*			trans	-57.5	157.9	-167.5	47.2	0	0	0	0	119.7
473	D	24.9	Very low	27.9	Very low	146 Å²	146	124.6 Å²	124.6	78%	0.781	78%	0.775	S	S	*	*			trans	-39.8	165.6	152.2	-130.9	10.8	0	0	0	113.6
474	P	42.3	Very low	28	Very low	100 Å²	100	127 Å²	127	65%	0.649	79%	0.785	S	S	*	*			cis	-140	163.7	33.8	36.8	-15.3	0	0	0	118.5
475	Q	25.8	Very low	28.2	Very low	170 Å²	170	124.8 Å²	124.8	79%	0.794	78%	0.781	S	S	*	*				175.5	137.3	115.1	-133.5	85.3	14.8	0	0	112.4
476	A	26.8	Very low	28.4	Very low	85 Å²	85	128.4 Å²	128.4	70%	0.702	79%	0.787	S	S	*	*			trans	-102.1	167.8	166.3	0	0	0	0	0	111.2
477	P	33.6	Very low	28.5	Very low	122 Å²	122	126.2 Å²	126.2	79%	0.792	78%	0.783	S	S	*	*				-149.6	151.5	91.5	36.2	-17.8	0	0	0	118.5
478	K	26.5	Very low	28.5	Very low	185 Å²	185	128.9 Å²	128.9	80%	0.804	79%	0.791	S	S	*	*			trans	4.8	142.7	148.3	-51.6	177	-179.7	179.7	0	119.1
479	V	30.4	Very low	28.6	Very low	126 Å²	126	129.2 Å²	129.2	76%	0.764	79%	0.792	S	S	*	*				179	149.7	80.6	153.5	0	0	0	0	107.5
480	D	27.1	Very low	28.7	Very low	141 Å²	141	134.9 Å²	134.9	75%	0.754	80%	0.799	S	S	*	*			cis	-161.8	-156.4	-20.9	-91.9	-16.5	0	0	0	108
481	G	25.6	Very low	28.9	Very low	73 Å²	73	132.2 Å²	132.2	75%	0.753	79%	0.794	S	S	*	*			trans	-109	-158.5	-176.1	0	0	0	0	0	116
482	P	39.2	Very low	29.1	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	80%	0.798	S	S	*	*			cis	-139.8	157.5	28.3	41.1	-22.5	0	0	0	119.6
483	S	29.2	Very low	29	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	80%	0.797	S	S	*	*			trans	37.9	127.3	140.9	-58.7	0	0	0	0	123.8
484	T	30.5	Very low	29	Very low	151 Å²	151	130.5 Å²	130.5	93%	0.926	79%	0.794	S	S	*	*				-154	148.1	99.9	14.5	0	0	0	0	111.3
485	S	29.6	Very low	28.1	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	81%	0.805	S	S	*	*			trans	-104.7	150.8	-163.4	-52.4	0	0	0	0	113.6
486	N	31.4	Very low	28.1	Very low	175 Å²	175	135 Å²	135	94%	0.936	81%	0.809	S	S	*	*				-156.5	130.2	129.7	-97.6	-33	0	0	0	109.7
487	A	27.5	Very low	28.1	Very low	89 Å²	89	140 Å²	140	74%	0.736	82%	0.818	S	S	*	*			trans	-123.4	139.5	-173.6	0	0	0	0	0	111
488	I	27.7	Very low	27.8	Very low	178 Å²	178	139 Å²	139	91%	0.913	82%	0.82	S	S	*	*			trans	-128	132.9	156.4	-65.1	-175.6	0	0	0	108.2
489	L	26	Very low	28	Very low	150 Å²	150	136.4 Å²	136.4	79%	0.785	82%	0.82	S	S	*	*			trans	-97.1	135	-168	-138.3	85.7	0	0	0	111.4
490	R	26.3	Very low	27.8	Very low	246 Å²	246	134 Å²	134	93%	0.928	82%	0.82	S	S	*	*				152.9	142.2	122.9	-90	-174.1	170.3	-155.1	-2.5	113.2
491	G	26	Very low	28	Very low	78 Å²	78	133.7 Å²	133.7	80%	0.804	82%	0.823	S	S	*	*			trans	133.9	69.8	157.5	0	0	0	0	0	114.8
492	S	26.3	Very low	28.3	Very low	123 Å²	123	136.8 Å²	136.8	86%	0.86	83%	0.827	S	S	*	*			trans	-67.5	153	179.9	-52.3	0	0	0	0	113.6
493	A	25.8	Very low	28	Very low	97 Å²	97	136.3 Å²	136.3	80%	0.802	83%	0.827	S	S	*	*			trans	-65.1	154.5	-178.7	0	0	0	0	0	114.4
494	V	25	Very low	28.1	Very low	121 Å²	121	139.9 Å²	139.9	73%	0.733	84%	0.837	S	S	*	*			trans	-133.9	99.8	157.9	179.9	0	0	0	0	108.9	R496	V494-R496 HydrophobicContact CG1-CG 4.05Å
495	C	23	Very low	28.4	Very low	129 Å²	129	139.8 Å²	139.8	87%	0.872	83%	0.83	S	S	*	*			trans	-71.5	128.6	156.6	-76	0	0	0	0	108.4
496	R	26	Very low	29	Very low	235 Å²	235	140.2 Å²	140.2	89%	0.887	83%	0.831	S	S	*	*			trans	-111.6	116.7	166	-90.5	-176.7	174.1	-167.7	-2.2	109.6	V494	V494-R496 HydrophobicContact CG1-CG 4.05Å
497	Q	27.2	Very low	29.2	Very low	191 Å²	191	139.5 Å²	139.5	89%	0.893	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-71.1	159.2	164	-86.1	174.8	-35.4	0	0	110.9
498	A	27.3	Very low	29.8	Very low	101 Å²	101	142.8 Å²	142.8	84%	0.835	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-68.8	142.4	179	0	0	0	0	0	112.1
499	V	29.8	Very low	30.3	Very low	131 Å²	131	142.4 Å²	142.4	79%	0.794	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-102.4	120.7	162.9	179.7	0	0	0	0	107
500	G	27.6	Very low	30.9	Very low	74 Å²	74	145 Å²	145	76%	0.763	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-72.2	141.6	174.1	0	0	0	0	0	111.2
501	V	30.5	Very low	31.5	Very low	136 Å²	136	143.7 Å²	143.7	82%	0.824	83%	0.831	S	S	*	*			trans	-131.1	104.5	170.3	-175.4	0	0	0	0	108.6
502	T	33.3	Very low	32.2	Very low	137 Å²	137	143.4 Å²	143.4	84%	0.84	83%	0.828	S	S	*	*			trans	-123.8	136.8	165.7	45.7	0	0	0	0	109.9
503	S	32.8	Very low	32.9	Very low	113 Å²	113	145.8 Å²	145.8	79%	0.79	83%	0.828	S	S	*	*			trans	78.3	90.5	162.8	-150.1	0	0	0	0	118.5
504	L	31	Very low	33.3	Very low	181 Å²	181	151 Å²	151	95%	0.948	84%	0.835	S	S	*	*			trans	-144.9	88.2	136.5	-81.4	-174.1	0	0	0	110.1
505	L	35.6	Very low	33.6	Very low	148 Å²	148	148.9 Å²	148.9	78%	0.775	84%	0.839	S	S	*	*			trans	-80.2	142.6	140.9	-81.6	145.8	0	0	0	105.8
506	P	42.7	Very low	34.5	Very low	112 Å²	112	154.1 Å²	154.1	73%	0.727	84%	0.842	S	S	*	*			cis	-144	149.1	40.5	38.5	-19.4	0	0	0	116.7
507	L	36.6	Very low	34.9	Very low	160 Å²	160	154.8 Å²	154.8	84%	0.838	86%	0.861	S	S	*	*			trans	-145.8	22.7	168.9	-114.8	168.4	0	0	0	114.5
508	L	38.8	Very low	35.3	Very low	158 Å²	158	153 Å²	153	83%	0.827	86%	0.86	S	S	*	*			trans	-114.7	38.5	-175.4	-70.2	176	0	0	0	113.9
509	L	38.9	Very low	35.8	Very low	169 Å²	169	155.7 Å²	155.7	89%	0.885	86%	0.861	S	S	*	*	S	Bend	trans	-138	34.5	175.3	-74.3	178.4	0	0	0	113.6
510	Y	37.6	Very low	36.1	Very low	206 Å²	206	157.1 Å²	157.1	81%	0.808	87%	0.865	S	S	*	*	S	Bend	trans	-133.6	4.4	179.8	-124.2	-88.4	0	0	0	117
511	F	39.7	Very low	36.6	Very low	218 Å²	218	161.9 Å²	161.9	96%	0.956	87%	0.871	S	S	*	*	S	Bend	trans	-134.3	63.3	174.8	-75.8	-74	0	0	0	111.4
512	G	41.6	Very low	37	Very low	71 Å²	71	163.6 Å²	163.6	73%	0.732	87%	0.874	S	S	*	*	S	Bend	trans	-146.6	16.5	-176.1	0	0	0	0	0	115.9
513	M	39.8	Very low	37.2	Very low	174 Å²	174	165.3 Å²	165.3	86%	0.857	88%	0.876	S	S	*	*			trans	-149.8	76.2	178.4	-80	-63.7	-75.9	0	0	112.1
514	Q	34.6	Very low	37.5	Very low	205 Å²	205	169.1 Å²	169.1	96%	0.958	88%	0.882	S	S	*	*			trans	-166.9	126.8	152.2	-148.7	87.3	30.7	0	0	109.4
515	G	31.9	Very low	38	Very low	78 Å²	78	168.2 Å²	168.2	80%	0.804	88%	0.877	S	S	*	*			trans	126.3	60.5	170.8	0	0	0	0	0	116.3
516	Y	40.7	Very low	38.2	Very low	238 Å²	238	169.8 Å²	169.8	93%	0.933	89%	0.886	S	S	*	*			trans	-83.8	119.1	155.6	-106.5	-94.9	0	0	0	108.5
517	L	35.8	Very low	37.8	Very low	249 Å²	249	175.1 Å²	175.1	100%	1.304	90%	0.9	S	S	*	*			trans	-179.1	0	143.3	-103.4	161.5	0	0	0	110.4

Retrieved 517 of 517 residues in 118.5 ms (Link to these results)

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