A0A087XYI2_POEFO Loading...

Upstream binding transcription factor, like

AlphaFold DB , UniProt , Accession A0A087XYI2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 699 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	38.2	Very low	40.9	Very low	236 Å²	236	110.5 Å²	110.5	100%	1.163	71%	0.705	S	S	*	*				0	113.4	0	-73.3	134.7	91.1	0	0	108
2	N	34.3	Very low	40.9	Very low	179 Å²	179	117.2 Å²	117.2	96%	0.957	71%	0.706	S	S	*	*			trans	-178	91.5	157.7	-101.1	-0.5	0	0	0	107.9
3	G	38.5	Very low	41.2	Very low	79 Å²	79	117.3 Å²	117.3	81%	0.814	70%	0.699	S	S	*	*			trans	-144.2	84.5	175.2	0	0	0	0	0	108.4
4	S	43.3	Very low	41.1	Very low	108 Å²	108	121.1 Å²	121.1	76%	0.755	70%	0.702	S	S	*	*			trans	-168.4	85	163.9	-145.5	0	0	0	0	110.3
5	S	41.4	Very low	40.5	Very low	103 Å²	103	117.1 Å²	117.1	72%	0.72	69%	0.689	S	S	*	*	S	Bend	trans	-164.5	-19	161.9	-88.1	0	0	0	0	113.3
6	S	41	Very low	40.2	Very low	103 Å²	103	119.3 Å²	119.3	72%	0.72	69%	0.69	S	S	*	*	H	α-helix	trans	-75.9	-24.5	178	178.4	0	0	0	0	114	S8	S6-S8 VanDerWaalsContact C-N 3.32Å; S6-S8 PolarHBondContact O-N 3.4Å
7	V	40.3	Very low	40.2	Very low	91 Å²	91	116.9 Å²	116.9	55%	0.552	69%	0.688	S	S	*	*	H	α-helix	trans	-70.3	-29.1	-177.1	-161.1	0	0	0	0	111.9	Q11	V7-Q11 HydrophobicContact CG1-CG 4.5Å; V7-Q11 WeakPolarHBondContact O-CB 3.21Å; V7-Q11 WeakPolarHBondContact O-CG 3.46Å; V7-Q11 PolarHBondContact O-N 3.13Å
8	S	50.2	Low	39.9	Very low	70 Å²	70	114.6 Å²	114.6	49%	0.49	68%	0.684	S	S	.	*	H	α-helix	trans	-76.2	-28.4	-176.6	-53.6	0	0	0	0	113.9	S6 R12	S6-S8 VanDerWaalsContact C-N 3.32Å; S6-S8 PolarHBondContact O-N 3.4Å; S8-R12 WeakPolarHBondContact O-CB 3.39Å; S8-R12 WeakPolarHBondContact O-CG 3.48Å; S8-R12 PolarHBondContact O-N 3.5Å
9	A	41.7	Very low	39.9	Very low	57 Å²	57	112.5 Å²	112.5	47%	0.471	68%	0.681	S	S	.	*	H	α-helix	trans	-76.2	-40.8	176.6	0	0	0	0	0	111.5	R12 I13	A9-R12 PolarHBondContact O-N 3.19Å; A9-I13 VanDerWaalsContact O-CG1 3.31Å; A9-I13 WeakPolarHBondContact O-CG1 3.47Å; A9-I13 PolarHBondContact O-N 3.06Å
10	A	42.6	Very low	40.6	Very low	63 Å²	63	111.7 Å²	111.7	52%	0.521	67%	0.673	S	S	.	*	H	α-helix	trans	-67.8	-35.9	174.7	0	0	0	0	0	112.2	K14	A10-K14 WeakPolarHBondContact O-CB 3.48Å; A10-K14 PolarHBondContact O-N 2.84Å
11	Q	39.1	Very low	41.9	Very low	127 Å²	127	108.6 Å²	108.6	59%	0.593	66%	0.659	S	S	*	*	H	α-helix	trans	-70.9	-33.8	172.5	-76.2	175.6	-34.6	0	0	112.7	V7 A15	V7-Q11 HydrophobicContact CG1-CG 4.5Å; V7-Q11 WeakPolarHBondContact O-CB 3.21Å; V7-Q11 WeakPolarHBondContact O-CG 3.46Å; V7-Q11 PolarHBondContact O-N 3.13Å; Q11-A15 VanDerWaalsContact O-CB 3.24Å; Q11-A15 WeakPolarHBondContact O-CB 3.42Å; Q11-A15 PolarHBondContact O-N 3.49Å
12	R	40.3	Very low	44.1	Very low	190 Å²	190	98.8 Å²	98.8	72%	0.717	61%	0.609	S	S	*	*	H	α-helix	trans	-68	-42.4	172.7	-85.3	-177	-179.1	-137.4	1.5	113	S8 A9 K14 A15 E16	S8-R12 WeakPolarHBondContact O-CB 3.39Å; S8-R12 WeakPolarHBondContact O-CG 3.48Å; S8-R12 PolarHBondContact O-N 3.5Å; A9-R12 PolarHBondContact O-N 3.19Å; R12-K14 VanDerWaalsContact C-N 3.31Å; R12-K14 PolarHBondContact O-N 3.43Å; R12-A15 CarbonylContact O-C 3.58Å; R12-A15 PolarHBondContact O-N 3.43Å; R12-A15 VanDerWaalsContact O-N 3.16Å; R12-E16 PolarHBondContact O-N 3.02Å
13	I	45.3	Very low	46.7	Very low	119 Å²	119	92.8 Å²	92.8	61%	0.61	58%	0.581	S	S	*	*	H	α-helix	trans	-67	-35	176.2	-65.5	167.5	0	0	0	110.8	A9 A17	A9-I13 VanDerWaalsContact O-CG1 3.31Å; A9-I13 WeakPolarHBondContact O-CG1 3.47Å; A9-I13 PolarHBondContact O-N 3.06Å; I13-A17 VanDerWaalsContact O-CB 3.3Å; I13-A17 WeakPolarHBondContact O-CB 3.34Å; I13-A17 PolarHBondContact O-N 3.32Å
14	K	39	Very low	49	Very low	170 Å²	170	94 Å²	94	74%	0.739	57%	0.565	S	S	*	*	H	α-helix	trans	-72.4	-27.6	173.8	-143.6	172.3	-171.4	178	0	112.7	A10 R12 A18	A10-K14 WeakPolarHBondContact O-CB 3.48Å; A10-K14 PolarHBondContact O-N 2.84Å; R12-K14 VanDerWaalsContact C-N 3.31Å; R12-K14 PolarHBondContact O-N 3.43Å; K14-A18 WeakPolarHBondContact O-CB 3.49Å; K14-A18 PolarHBondContact O-N 3.06Å
15	A	32.6	Very low	51.2	Low	62 Å²	62	96.1 Å²	96.1	51%	0.512	56%	0.563	S	S	.	*	H	α-helix	trans	-80.2	-34	174.2	0	0	0	0	0	113	Q11 R12 A18 A19	Q11-A15 VanDerWaalsContact O-CB 3.24Å; Q11-A15 WeakPolarHBondContact O-CB 3.42Å; Q11-A15 PolarHBondContact O-N 3.49Å; R12-A15 CarbonylContact O-C 3.58Å; R12-A15 PolarHBondContact O-N 3.43Å; R12-A15 VanDerWaalsContact O-N 3.16Å; A15-A18 PolarHBondContact O-N 3.04Å; A15-A19 PolarHBondContact O-N 3.25Å
16	E	36	Very low	53.6	Low	152 Å²	152	92.3 Å²	92.3	71%	0.71	54%	0.535	S	S	*	.	H	α-helix	trans	-73.1	-35.1	171.5	-90.7	-177.1	135.1	0	0	112.2	R12 A18 A19	R12-E16 PolarHBondContact O-N 3.02Å; E16-A18 PolarHBondContact O-N 2.99Å; E16-A19 VanDerWaalsContact O-CB 3.3Å; E16-A19 WeakPolarHBondContact O-CB 3.43Å; E16-A19 PolarHBondContact O-N 3.04Å
17	A	39.2	Very low	55.9	Low	78 Å²	78	88 Å²	88	65%	0.645	50%	0.504	S	S	*	.	H	α-helix	trans	-68.5	-24.4	170.4	0	0	0	0	0	112.7	I13 A19	I13-A17 VanDerWaalsContact O-CB 3.3Å; I13-A17 WeakPolarHBondContact O-CB 3.34Å; I13-A17 PolarHBondContact O-N 3.32Å; A17-A19 PolarHBondContact O-N 3.5Å
18	A	35.7	Very low	58.3	Low	76 Å²	76	85.7 Å²	85.7	63%	0.628	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.2	170.5	0	0	0	0	0	113.3	K14 A15 E16	K14-A18 WeakPolarHBondContact O-CB 3.49Å; K14-A18 PolarHBondContact O-N 3.06Å; A15-A18 PolarHBondContact O-N 3.04Å; E16-A18 PolarHBondContact O-N 2.99Å
19	A	40	Very low	60.4	Low	75 Å²	75	84.9 Å²	84.9	62%	0.62	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-2.5	-178.9	0	0	0	0	0	114.6	A15 E16 A17 A21	A15-A19 PolarHBondContact O-N 3.25Å; E16-A19 VanDerWaalsContact O-CB 3.3Å; E16-A19 WeakPolarHBondContact O-CB 3.43Å; E16-A19 PolarHBondContact O-N 3.04Å; A17-A19 PolarHBondContact O-N 3.5Å; A19-A21 PolarHBondContact O-N 3.4Å
20	D	54.4	Low	62.8	Low	96 Å²	96	82.2 Å²	82.2	51%	0.513	46%	0.459	S	S	.	.			trans	-82.9	75.7	161.3	-156.1	-8	0	0	0	107.9	W22 K71	D20-W22 PolarHBondContact O-N 3.06Å; D20-K71 IonicContact OD1-NZ 3.4Å; D20-K71 PolarHBondContact OD1-NZ 3.37Å; D20-K71 IonicContact OD2-NZ 3.11Å
21	A	67.9	Low	65.2	Low	46 Å²	46	79.3 Å²	79.3	38%	0.38	44%	0.435	S	S	.	.			trans	-67	24.4	-167.4	0	0	0	0	0	115.5	A19 R62 F63	A19-A21 PolarHBondContact O-N 3.4Å; A21-R62 PolarHBondContact O-NH2 3.19Å; A21-F63 WeakPolarHBondContact O-CE1 3.5Å; A21-F63 WeakPolarHBondContact O-CZ 3.44Å
22	W	83.7	Confident	67.7	Low	31 Å²	31	77.3 Å²	77.3	12%	0.117	43%	0.425	C	S	.	.			trans	-113.3	107.3	-178.4	-73.8	83.3	0	0	0	110.1	D20 D26 L30 F60 F63 M67 K71	D20-W22 PolarHBondContact O-N 3.06Å; W22-D26 HydrophobicContact CE3-CB 3.8Å; W22-D26 HydrophobicContact CZ3-CB 4.37Å; W22-L30 HydrophobicContact CH2-CD2 4.01Å; W22-L30 HydrophobicContact CZ3-CB 3.95Å; W22-L30 HydrophobicContact CZ3-CD2 3.86Å; W22-L30 HydrophobicContact CZ3-CG 4.43Å; W22-F60 HydrophobicContact CH2-CE1 4.09Å; W22-F60 HydrophobicContact CH2-CZ 4.2Å; W22-F60 AromaticContact CZ3-CE1 3.95Å; W22-F60 HydrophobicContact CZ3-CE1 3.95Å; W22-F60 AromaticContact CZ3-CZ 3.71Å; W22-F60 HydrophobicContact CZ3-CZ 3.71Å; W22-F63 AromaticContact CD1-CE1 3.99Å; W22-F63 HydrophobicContact CD2-CD1 4.17Å; W22-F63 AromaticContact CD2-CE1 3.77Å; W22-F63 HydrophobicContact CD2-CE1 3.77Å; W22-F63 HydrophobicContact CD2-CZ 4Å; W22-F63 AromaticContact CE2-CD1 3.52Å; W22-F63 AromaticContact CE2-CE1 3.52Å; W22-F63 HydrophobicContact CE3-CE1 4.35Å; W22-F63 HydrophobicContact CE3-CE2 4.45Å; W22-F63 HydrophobicContact CE3-CZ 4.22Å; W22-F63 HydrophobicContact CG-CE1 4.07Å; W22-F63 HydrophobicContact CG-CZ 4.34Å; W22-F63 HydrophobicContact CH2-CB 3.97Å; W22-F63 AromaticContact CH2-CD1 3.98Å; W22-F63 HydrophobicContact CH2-CD1 3.98Å; W22-F63 HydrophobicContact CH2-CD2 4.19Å; W22-F63 HydrophobicContact CH2-CE1 4.47Å; W22-F63 AromaticContact CH2-CG 3.79Å; W22-F63 HydrophobicContact CH2-CG 3.79Å; W22-F63 HydrophobicContact CZ2-CB 3.98Å; W22-F63 AromaticContact CZ2-CD1 3.42Å; W22-F63 HydrophobicContact CZ2-CD1 3.42Å; W22-F63 VanDerWaalsContact CZ2-CD1 3.42Å; W22-F63 HydrophobicContact CZ2-CD2 4.46Å; W22-F63 AromaticContact CZ2-CE1 3.92Å; W22-F63 HydrophobicContact CZ2-CE1 3.92Å; W22-F63 AromaticContact CZ2-CG 3.71Å; W22-F63 HydrophobicContact CZ2-CG 3.71Å; W22-F63 HydrophobicContact CZ3-CD2 4.33Å; W22-F63 HydrophobicContact CZ3-CE2 4.46Å; W22-F63 HydrophobicContact CZ3-CG 4.35Å; W22-F63 AromaticContact NE1-CD1 3.85Å; W22-F63 AromaticContact NE1-CE1 3.66Å; W22-M67 HydrophobicContact CZ2-CB 4.16Å; W22-K71 HydrophobicContact CB-CD 4.24Å; W22-K71 VanDerWaalsContact CB-CE 3.49Å; W22-K71 HydrophobicContact CD2-CB 4.17Å; W22-K71 HydrophobicContact CD2-CD 3.91Å; W22-K71 HydrophobicContact CD2-CG 3.7Å; W22-K71 HydrophobicContact CE3-CB 4.4Å; W22-K71 HydrophobicContact CE3-CD 4.44Å; W22-K71 HydrophobicContact CE3-CG 3.82Å; W22-K71 HydrophobicContact CG-CD 3.79Å; W22-K71 HydrophobicContact CG-CG 4.14Å; W22-K71 HydrophobicContact CH2-CB 4.09Å; W22-K71 HydrophobicContact CH2-CG 4.39Å; W22-K71 HydrophobicContact CZ2-CB 3.82Å; W22-K71 HydrophobicContact CZ2-CG 4.27Å; W22-K71 HydrophobicContact CZ3-CB 4.36Å; W22-K71 HydrophobicContact CZ3-CG 4.17Å
23	S	89.4	Confident	70.1	Confident	52 Å²	52	73.9 Å²	73.9	36%	0.364	41%	0.412	S	S	.	.			trans	-70.1	166.5	169.1	67.1	0	0	0	0	111.5	E25 D26 C27	S23-E25 PolarHBondContact O-N 3.21Å; S23-D26 WeakPolarHBondContact CB-OD2 3.35Å; S23-D26 PolarHBondContact N-OD2 3.43Å; S23-D26 PolarHBondContact O-N 3.23Å; S23-D26 PolarHBondContact OG-N 2.93Å; S23-D26 PolarHBondContact OG-OD2 2.96Å; S23-C27 PolarHBondContact O-N 3.18Å; S23-C27 PolarHBondContact O-SG 2.85Å
24	Q	86.9	Confident	72.2	Confident	106 Å²	106	68.2 Å²	68.2	50%	0.495	38%	0.383	S	S	.	.	H	α-helix	trans	-56.6	-40.1	171	-177.6	178.5	-18.6	0	0	111.1	C27 L28 V96	Q24-C27 PolarHBondContact O-N 3.46Å; Q24-L28 HydrophobicContact CG-CD1 4.37Å; Q24-L28 WeakPolarHBondContact O-CG 3.49Å; Q24-L28 PolarHBondContact O-N 2.63Å; Q24-V96 HydrophobicContact CG-CG1 4.02Å
25	E	87.8	Confident	74.6	Confident	151 Å²	151	65.5 Å²	65.5	71%	0.706	37%	0.368	S	S	*	.	H	α-helix	trans	-65.6	-39.5	176.8	-64.5	-179.6	178.7	0	0	112.4	S23 C27 L28 T29	S23-E25 PolarHBondContact O-N 3.21Å; E25-C27 VanDerWaalsContact C-N 3.33Å; E25-C27 PolarHBondContact O-N 3.36Å; E25-L28 PolarHBondContact O-N 3.11Å; E25-T29 WeakPolarHBondContact O-CB 3.29Å; E25-T29 PolarHBondContact O-N 3.4Å; E25-T29 PolarHBondContact O-OG1 3.06Å
26	D	91.9	Very high	77.1	Confident	24 Å²	24	65.5 Å²	65.5	13%	0.128	37%	0.374	C	S	.	.	H	α-helix	trans	-62.8	-42.3	174.1	-64.1	-44.7	0	0	0	110.5	W22 S23 T29 L30 F60 R62 F63	W22-D26 HydrophobicContact CE3-CB 3.8Å; W22-D26 HydrophobicContact CZ3-CB 4.37Å; S23-D26 WeakPolarHBondContact CB-OD2 3.35Å; S23-D26 PolarHBondContact N-OD2 3.43Å; S23-D26 PolarHBondContact O-N 3.23Å; S23-D26 PolarHBondContact OG-N 2.93Å; S23-D26 PolarHBondContact OG-OD2 2.96Å; D26-T29 PolarHBondContact O-N 3.23Å; D26-L30 WeakPolarHBondContact O-CB 3.31Å; D26-L30 PolarHBondContact O-N 3.02Å; D26-F60 HydrophobicContact CB-CE2 4.43Å; D26-F60 HydrophobicContact CB-CZ 4.32Å; D26-F60 VanDerWaalsContact O-CZ 3.24Å; D26-F60 WeakPolarHBondContact O-CZ 3.47Å; D26-R62 IonicContact OD2-NH2 3.36Å; D26-R62 PolarHBondContact OD2-NH2 3.47Å; D26-F63 HydrophobicContact CB-CE2 3.84Å; D26-F63 HydrophobicContact CB-CZ 4.05Å
27	C	89.5	Confident	79.5	Confident	12 Å²	12	62 Å²	62	8%	0.081	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-40.5	177.2	-64.3	0	0	0	0	112.1	S23 Q24 E25 L30 L31 K71 V96	S23-C27 PolarHBondContact O-N 3.18Å; S23-C27 PolarHBondContact O-SG 2.85Å; Q24-C27 PolarHBondContact O-N 3.46Å; E25-C27 VanDerWaalsContact C-N 3.33Å; E25-C27 PolarHBondContact O-N 3.36Å; C27-L30 WeakPolarHBondContact O-CB 3.01Å; C27-L30 PolarHBondContact O-N 2.94Å; C27-L31 VanDerWaalsContact O-CG 3.28Å; C27-L31 WeakPolarHBondContact O-CG 3.49Å; C27-L31 PolarHBondContact O-N 3.43Å; C27-L31 VanDerWaalsContact O-N 3.09Å; C27-K71 WeakPolarHBondContact SG-CE 3.43Å; C27-V96 HydrophobicContact CB-CG1 3.59Å; C27-V96 HydrophobicContact CB-CG2 4.12Å
28	L	91.8	Very high	81.6	Confident	42 Å²	42	59.1 Å²	59.1	22%	0.22	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-39.4	175.4	-69.6	176	0	0	0	111.9	Q24 E25 L30 L31 E32 I93 V96 K97	Q24-L28 HydrophobicContact CG-CD1 4.37Å; Q24-L28 WeakPolarHBondContact O-CG 3.49Å; Q24-L28 PolarHBondContact O-N 2.63Å; E25-L28 PolarHBondContact O-N 3.11Å; L28-L30 VanDerWaalsContact C-N 3.34Å; L28-L31 PolarHBondContact O-N 2.76Å; L28-E32 WeakPolarHBondContact O-CB 3.36Å; L28-E32 PolarHBondContact O-N 3.17Å; L28-I93 HydrophobicContact CD2-CG2 4Å; L28-V96 HydrophobicContact CD2-CB 4.23Å; L28-V96 HydrophobicContact CD2-CG1 3.85Å; L28-V96 HydrophobicContact CG-CG1 3.9Å; L28-K97 HydrophobicContact CD1-CG 4.27Å; L28-K97 HydrophobicContact CD2-CG 4.05Å
29	T	92.7	Very high	83.7	Confident	53 Å²	53	59.8 Å²	59.8	33%	0.325	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-43.3	175.6	-59.2	0	0	0	0	110.8	E25 D26 E32 R33 F60	E25-T29 WeakPolarHBondContact O-CB 3.29Å; E25-T29 PolarHBondContact O-N 3.4Å; E25-T29 PolarHBondContact O-OG1 3.06Å; D26-T29 PolarHBondContact O-N 3.23Å; T29-E32 PolarHBondContact O-N 3.31Å; T29-R33 HydrophobicContact CG2-CG 4.48Å; T29-R33 VanDerWaalsContact O-CG 3.26Å; T29-R33 WeakPolarHBondContact O-CG 3.26Å; T29-R33 PolarHBondContact O-N 2.99Å; T29-F60 HydrophobicContact CG2-CD1 4.45Å; T29-F60 HydrophobicContact CG2-CD2 3.69Å; T29-F60 HydrophobicContact CG2-CE1 4.47Å; T29-F60 HydrophobicContact CG2-CE2 3.7Å; T29-F60 HydrophobicContact CG2-CG 4.09Å; T29-F60 HydrophobicContact CG2-CZ 4.12Å
30	L	93.1	Very high	85.3	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-55.9	-52.2	172.5	172.4	61.2	0	0	0	111.5	W22 D26 C27 L28 E32 R33 I34 V58 F60 C68 K71	W22-L30 HydrophobicContact CH2-CD2 4.01Å; W22-L30 HydrophobicContact CZ3-CB 3.95Å; W22-L30 HydrophobicContact CZ3-CD2 3.86Å; W22-L30 HydrophobicContact CZ3-CG 4.43Å; D26-L30 WeakPolarHBondContact O-CB 3.31Å; D26-L30 PolarHBondContact O-N 3.02Å; C27-L30 WeakPolarHBondContact O-CB 3.01Å; C27-L30 PolarHBondContact O-N 2.94Å; L28-L30 VanDerWaalsContact C-N 3.34Å; L30-E32 VanDerWaalsContact C-N 3.3Å; L30-E32 PolarHBondContact O-N 3.42Å; L30-R33 PolarHBondContact O-N 3.2Å; L30-I34 HydrophobicContact CD1-CD1 3.81Å; L30-I34 HydrophobicContact CD1-CG1 4.07Å; L30-I34 HydrophobicContact CG-CD1 3.91Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.49Å; L30-I34 PolarHBondContact O-N 3.22Å; L30-V58 HydrophobicContact CD1-CG1 3.53Å; L30-F60 HydrophobicContact CB-CE1 3.88Å; L30-F60 HydrophobicContact CB-CZ 4.31Å; L30-F60 HydrophobicContact CD1-CE1 4.43Å; L30-C68 HydrophobicContact CD1-CB 3.54Å; L30-K71 HydrophobicContact CD2-CB 3.83Å; L30-K71 HydrophobicContact CD2-CG 4.03Å
31	L	92.2	Very high	86	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-62.2	-37.6	-177.9	-68.4	173.3	0	0	0	112.3	C27 L28 I34 R35 W72 I89 A92 I93 V96	C27-L31 VanDerWaalsContact O-CG 3.28Å; C27-L31 WeakPolarHBondContact O-CG 3.49Å; C27-L31 PolarHBondContact O-N 3.43Å; C27-L31 VanDerWaalsContact O-N 3.09Å; L28-L31 PolarHBondContact O-N 2.76Å; L31-I34 PolarHBondContact O-N 3.09Å; L31-R35 WeakPolarHBondContact O-CB 3.43Å; L31-R35 PolarHBondContact O-N 3.08Å; L31-W72 HydrophobicContact CD2-CE3 3.7Å; L31-W72 HydrophobicContact CD2-CZ3 3.51Å; L31-I89 HydrophobicContact CB-CG2 4.21Å; L31-A92 HydrophobicContact CD1-CB 3.93Å; L31-A92 HydrophobicContact CD2-CB 3.71Å; L31-I93 HydrophobicContact CB-CD1 4.41Å; L31-I93 HydrophobicContact CB-CG1 3.85Å; L31-I93 HydrophobicContact CD1-CB 4.42Å; L31-I93 HydrophobicContact CD1-CG1 3.74Å; L31-I93 HydrophobicContact CG-CG1 4.4Å; L31-V96 HydrophobicContact CD1-CB 4.36Å; L31-V96 HydrophobicContact CD1-CG2 3.91Å
32	E	92.1	Very high	86.6	Confident	84 Å²	84	61.4 Å²	61.4	39%	0.393	34%	0.337	S	S	.	.	H	α-helix	trans	-68.3	-40.3	175.1	-171.8	58.5	-140.9	0	0	112.1	L28 T29 L30 R35 G36	L28-E32 WeakPolarHBondContact O-CB 3.36Å; L28-E32 PolarHBondContact O-N 3.17Å; T29-E32 PolarHBondContact O-N 3.31Å; L30-E32 VanDerWaalsContact C-N 3.3Å; L30-E32 PolarHBondContact O-N 3.42Å; E32-R35 WeakPolarHBondContact O-CB 3.4Å; E32-R35 PolarHBondContact O-N 3.29Å; E32-R35 IonicContact OE1-CZ 2.63Å; E32-R35 IonicContact OE1-NE 3.28Å; E32-R35 PolarHBondContact OE1-NE 3.34Å; E32-R35 VanDerWaalsContact OE1-NE 3.13Å; E32-R35 IonicContact OE1-NH2 2.95Å; E32-R35 PolarHBondContact OE1-NH2 3.48Å; E32-R35 IonicContact OE2-CZ 3.92Å; E32-R35 IonicContact OE2-NE 2.68Å; E32-R35 PolarHBondContact OE2-NE 2.96Å; E32-R35 IonicContact OE2-NH1 3.97Å; E32-R35 IonicContact OE2-NH2 2.78Å; E32-R35 PolarHBondContact OE2-NH2 3.28Å; E32-G36 PolarHBondContact O-N 2.99Å
33	R	90.3	Very high	86.3	Confident	118 Å²	118	63.6 Å²	63.6	45%	0.445	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-41.4	174.8	-69.5	-64.1	-178.6	89.2	1.5	111.8	T29 L30 R35 G36 L37 V58	T29-R33 HydrophobicContact CG2-CG 4.48Å; T29-R33 VanDerWaalsContact O-CG 3.26Å; T29-R33 WeakPolarHBondContact O-CG 3.26Å; T29-R33 PolarHBondContact O-N 2.99Å; L30-R33 PolarHBondContact O-N 3.2Å; R33-R35 VanDerWaalsContact C-N 3.32Å; R33-G36 PolarHBondContact O-N 3.16Å; R33-L37 WeakPolarHBondContact O-CG 3.41Å; R33-L37 PolarHBondContact O-N 3.35Å; R33-V58 HydrophobicContact CB-CG1 4.32Å
34	I	89.9	Confident	85.9	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-46.6	174.1	-62.2	169.1	0	0	0	109	L30 L31 G36 L37 L38 F53 W55 V58 W72 I89	L30-I34 HydrophobicContact CD1-CD1 3.81Å; L30-I34 HydrophobicContact CD1-CG1 4.07Å; L30-I34 HydrophobicContact CG-CD1 3.91Å; L30-I34 VanDerWaalsContact O-CG1 3.28Å; L30-I34 WeakPolarHBondContact O-CG1 3.49Å; L30-I34 PolarHBondContact O-N 3.22Å; L31-I34 PolarHBondContact O-N 3.09Å; I34-G36 PolarHBondContact O-N 2.91Å; I34-L37 PolarHBondContact O-N 2.85Å; I34-L38 WeakPolarHBondContact O-CG 3.39Å; I34-F53 HydrophobicContact CB-CE1 4.27Å; I34-F53 HydrophobicContact CB-CZ 4.19Å; I34-F53 HydrophobicContact CG1-CE1 4.07Å; I34-F53 HydrophobicContact CG1-CZ 4.49Å; I34-F53 HydrophobicContact CG2-CE1 3.88Å; I34-F53 HydrophobicContact CG2-CE2 4.47Å; I34-F53 HydrophobicContact CG2-CZ 3.68Å; I34-W55 HydrophobicContact CD1-CH2 4.29Å; I34-W55 HydrophobicContact CD1-CZ3 4.07Å; I34-W55 HydrophobicContact CG1-CZ3 4.35Å; I34-V58 HydrophobicContact CG1-CG1 3.79Å; I34-W72 HydrophobicContact CD1-CB 4.04Å; I34-W72 HydrophobicContact CD1-CD2 3.8Å; I34-W72 HydrophobicContact CD1-CE3 3.5Å; I34-W72 VanDerWaalsContact CD1-CE3 3.5Å; I34-W72 HydrophobicContact CD1-CG 4.03Å; I34-W72 HydrophobicContact CD1-CZ3 4.26Å; I34-I89 HydrophobicContact CB-CD1 4.09Å; I34-I89 HydrophobicContact CG2-CD1 3.52Å; I34-I89 HydrophobicContact CG2-CG1 4.33Å
35	R	88.8	Confident	85.7	Confident	113 Å²	113	68.8 Å²	68.8	43%	0.426	38%	0.379	S	S	.	.	H	α-helix	trans	-58.7	-44.3	177.3	-167.9	179.2	77.5	172.9	5.7	112.7	L31 E32 R33 L37 L38 I89	L31-R35 WeakPolarHBondContact O-CB 3.43Å; L31-R35 PolarHBondContact O-N 3.08Å; E32-R35 WeakPolarHBondContact O-CB 3.4Å; E32-R35 PolarHBondContact O-N 3.29Å; E32-R35 IonicContact OE1-CZ 2.63Å; E32-R35 IonicContact OE1-NE 3.28Å; E32-R35 PolarHBondContact OE1-NE 3.34Å; E32-R35 VanDerWaalsContact OE1-NE 3.13Å; E32-R35 IonicContact OE1-NH2 2.95Å; E32-R35 PolarHBondContact OE1-NH2 3.48Å; E32-R35 IonicContact OE2-CZ 3.92Å; E32-R35 IonicContact OE2-NE 2.68Å; E32-R35 PolarHBondContact OE2-NE 2.96Å; E32-R35 IonicContact OE2-NH1 3.97Å; E32-R35 IonicContact OE2-NH2 2.78Å; E32-R35 PolarHBondContact OE2-NH2 3.28Å; R33-R35 VanDerWaalsContact C-N 3.32Å; R35-L37 PolarHBondContact O-N 3.24Å; R35-L38 WeakPolarHBondContact O-CB 3.36Å; R35-L38 PolarHBondContact O-N 3.16Å; R35-L38 VanDerWaalsContact O-N 3.15Å; R35-I89 HydrophobicContact CB-CD1 4.34Å; R35-I89 HydrophobicContact CB-CG2 4.32Å
36	G	85.9	Confident	85.6	Confident	62 Å²	62	63 Å²	63	64%	0.639	35%	0.351	S	S	*	.	H	α-helix	trans	-68.7	-17.6	-177.7	0	0	0	0	0	114.8	E32 R33 I34	E32-G36 PolarHBondContact O-N 2.99Å; R33-G36 PolarHBondContact O-N 3.16Å; I34-G36 PolarHBondContact O-N 2.91Å
37	L	86.1	Confident	85.3	Confident	77 Å²	77	68.1 Å²	68.1	40%	0.403	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-3.1	175.3	-66.2	171.5	0	0	0	112.9	R33 I34 R35 F53 K57 V58	R33-L37 WeakPolarHBondContact O-CG 3.41Å; R33-L37 PolarHBondContact O-N 3.35Å; I34-L37 PolarHBondContact O-N 2.85Å; R35-L37 PolarHBondContact O-N 3.24Å; L37-F53 HydrophobicContact CB-CE2 3.9Å; L37-F53 HydrophobicContact CB-CZ 3.65Å; L37-F53 HydrophobicContact CD1-CE1 4.27Å; L37-F53 HydrophobicContact CD1-CZ 3.99Å; L37-F53 HydrophobicContact CG-CZ 4.47Å; L37-K57 HydrophobicContact CD1-CB 4.05Å; L37-K57 HydrophobicContact CD2-CB 4.44Å; L37-V58 HydrophobicContact CD1-CB 4.5Å; L37-V58 HydrophobicContact CD1-CG2 3.7Å
38	L	84.3	Confident	85.1	Confident	18 Å²	18	70.4 Å²	70.4	9%	0.094	39%	0.385	C	S	.	.	S	Bend	trans	-84.8	144.9	175	-64.5	173.6	0	0	0	111.2	I34 R35 T49 F53 M85 I89	I34-L38 WeakPolarHBondContact O-CG 3.39Å; R35-L38 WeakPolarHBondContact O-CB 3.36Å; R35-L38 PolarHBondContact O-N 3.16Å; R35-L38 VanDerWaalsContact O-N 3.15Å; L38-T49 HydrophobicContact CD2-CG2 3.44Å; L38-T49 VanDerWaalsContact CD2-CG2 3.44Å; L38-F53 HydrophobicContact CD2-CE2 3.98Å; L38-M85 HydrophobicContact CD1-CB 3.83Å; L38-M85 HydrophobicContact CD1-CG 3.58Å; L38-M85 HydrophobicContact CD2-CB 4.12Å; L38-M85 HydrophobicContact CD2-CG 3.95Å; L38-M85 HydrophobicContact CG-CG 4.37Å; L38-I89 HydrophobicContact CD1-CD1 3.61Å
39	P	80.1	Confident	84.7	Confident	90 Å²	90	69 Å²	69	58%	0.584	38%	0.379	S	S	*	.			trans	-61.2	144.9	168.6	-19.1	30.9	0	0	0	111.6	G41	P39-G41 PolarHBondContact O-N 3.37Å
40	D	72.1	Confident	84.4	Confident	177 Å²	177	68 Å²	68	95%	0.947	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	109.1	174.7	-71.8	-37.3	0	0	0	111
41	G	69.8	Low	84	Confident	56 Å²	56	72.1 Å²	72.1	58%	0.577	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	63.5	178.5	0	0	0	0	0	114.3	P39 A43	P39-G41 PolarHBondContact O-N 3.37Å; G41-A43 PolarHBondContact O-N 3.22Å
42	D	80.9	Confident	83.5	Confident	19 Å²	19	79.2 Å²	79.2	10%	0.102	43%	0.432	C	S	.	.			trans	-57.3	136.3	176.8	72.9	-23.8	0	0	0	113.2	T84 M85 T86	D42-T84 VanDerWaalsContact CG-CB 3.4Å; D42-T84 VanDerWaalsContact OD1-CB 3.26Å; D42-T84 WeakPolarHBondContact OD1-CB 3.46Å; D42-T84 PolarHBondContact OD1-OG1 2.84Å; D42-T84 WeakPolarHBondContact OD2-CB 3.3Å; D42-T84 PolarHBondContact OD2-OG1 2.78Å; D42-M85 WeakPolarHBondContact OD2-CA 3.03Å; D42-M85 WeakPolarHBondContact OD2-CB 3.43Å; D42-M85 PolarHBondContact OD2-N 3.06Å; D42-T86 WeakPolarHBondContact OD1-CB 3.24Å; D42-T86 PolarHBondContact OD1-OG1 3.42Å; D42-T86 PolarHBondContact OD2-N 3.41Å; D42-T86 PolarHBondContact OD2-OG1 2.97Å
43	A	76.2	Confident	83.2	Confident	76 Å²	76	76.4 Å²	76.4	63%	0.628	42%	0.418	S	S	*	.			trans	-122.1	-8.5	-179.1	0	0	0	0	0	112.9	G41	G41-A43 PolarHBondContact O-N 3.22Å
44	M	81	Confident	83	Confident	109 Å²	109	74 Å²	74	54%	0.537	41%	0.414	S	S	.	.	S	Bend	trans	-82.5	160	179.6	-67.6	-168.8	-73.1	0	0	111.2
45	K	83.8	Confident	83	Confident	158 Å²	158	75.2 Å²	75.2	69%	0.687	42%	0.419	S	S	*	.			trans	-63.2	138.7	173.2	-70.7	-176.4	-179.6	179.3	0	109.8	K47 T48 T49 R83	K45-K47 VanDerWaalsContact C-N 3.27Å; K45-K47 PolarHBondContact O-N 3.4Å; K45-T48 WeakPolarHBondContact O-CB 3.49Å; K45-T48 PolarHBondContact O-N 2.86Å; K45-T49 PolarHBondContact O-N 3.38Å; K45-T49 VanDerWaalsContact O-N 3.1Å; K45-T49 PolarHBondContact O-OG1 3.32Å; K45-R83 CarbonylContact C-O 3.58Å; K45-R83 WeakPolarHBondContact CA-O 3.48Å
46	Y	86.2	Confident	83	Confident	30 Å²	30	76 Å²	76	12%	0.118	43%	0.431	C	S	.	.	H	α-helix	trans	-54.1	-43	-177.4	80.9	-86	0	0	0	112.2	T48 T49 E50 K81 Y82 R83 M85 L88	Y46-T48 VanDerWaalsContact C-N 3.29Å; Y46-T48 PolarHBondContact O-N 3.24Å; Y46-T49 CarbonylContact O-C 3.51Å; Y46-T49 WeakPolarHBondContact O-CA 3.26Å; Y46-T49 WeakPolarHBondContact O-CB 3.49Å; Y46-T49 PolarHBondContact O-N 3.35Å; Y46-E50 WeakPolarHBondContact O-CB 3.42Å; Y46-E50 PolarHBondContact O-N 2.8Å; Y46-K81 HydrophobicContact CE1-CB 4.47Å; Y46-Y82 WeakPolarHBondContact CD1-O 3.43Å; Y46-R83 PolarHBondContact N-O 2.93Å; Y46-M85 WeakPolarHBondContact O-CE 3.37Å; Y46-L88 HydrophobicContact CD2-CD2 3.55Å; Y46-L88 HydrophobicContact CE2-CD2 4.04Å; Y46-L88 HydrophobicContact CG-CD2 3.89Å
47	K	85	Confident	83.1	Confident	131 Å²	131	79.5 Å²	79.5	57%	0.57	43%	0.429	S	S	*	.	H	α-helix	trans	-59	-37.5	177.5	-68.3	-164.3	172.4	-166.9	0	113.7	K45 T49 S51	K45-K47 VanDerWaalsContact C-N 3.27Å; K45-K47 PolarHBondContact O-N 3.4Å; K47-T49 VanDerWaalsContact C-N 3.33Å; K47-S51 PolarHBondContact O-N 3.47Å; K47-S51 VanDerWaalsContact O-N 3.12Å; K47-S51 PolarHBondContact O-OG 2.88Å
48	T	85.1	Confident	83.2	Confident	60 Å²	60	75.8 Å²	75.8	37%	0.368	41%	0.41	S	S	.	.	H	α-helix	trans	-69.7	-37	176.9	-53.4	0	0	0	0	110.6	K45 Y46 S51 H52	K45-T48 WeakPolarHBondContact O-CB 3.49Å; K45-T48 PolarHBondContact O-N 2.86Å; Y46-T48 VanDerWaalsContact C-N 3.29Å; Y46-T48 PolarHBondContact O-N 3.24Å; T48-S51 PolarHBondContact O-OG 3.4Å; T48-H52 PolarHBondContact O-CD2 2.98Å
49	T	84	Confident	83.4	Confident	13 Å²	13	76 Å²	76	8%	0.08	42%	0.416	C	S	.	.	H	α-helix	trans	-71	-39.4	177.5	-48.8	0	0	0	0	110.9	L38 K45 Y46 K47 H52 F53 M85	L38-T49 HydrophobicContact CD2-CG2 3.44Å; L38-T49 VanDerWaalsContact CD2-CG2 3.44Å; K45-T49 PolarHBondContact O-N 3.38Å; K45-T49 VanDerWaalsContact O-N 3.1Å; K45-T49 PolarHBondContact O-OG1 3.32Å; Y46-T49 CarbonylContact O-C 3.51Å; Y46-T49 WeakPolarHBondContact O-CA 3.26Å; Y46-T49 WeakPolarHBondContact O-CB 3.49Å; Y46-T49 PolarHBondContact O-N 3.35Å; K47-T49 VanDerWaalsContact C-N 3.33Å; T49-H52 PolarHBondContact O-N 3.3Å; T49-F53 PolarHBondContact O-N 3.02Å; T49-M85 HydrophobicContact CG2-CB 4.22Å
50	E	85.9	Confident	84	Confident	33 Å²	33	72.8 Å²	72.8	15%	0.154	39%	0.393	C	S	.	.	H	α-helix	trans	-61.8	-41	176.2	-166.7	-176.8	-168.8	0	0	112.9	Y46 H52 F53 W55 W72 M85	Y46-E50 WeakPolarHBondContact O-CB 3.42Å; Y46-E50 PolarHBondContact O-N 2.8Å; E50-H52 VanDerWaalsContact C-N 3.29Å; E50-H52 PolarHBondContact O-N 3.48Å; E50-F53 VanDerWaalsContact O-CB 3.29Å; E50-F53 WeakPolarHBondContact O-CB 3.37Å; E50-F53 PolarHBondContact O-N 3.24Å; E50-W55 HydrophobicContact CG-CZ2 4.1Å; E50-W72 PolarHBondContact OE1-NE1 3.2Å; E50-M85 HydrophobicContact CB-CE 3.65Å; E50-M85 HydrophobicContact CG-CE 4.23Å
51	S	85.1	Confident	84.7	Confident	87 Å²	87	68.6 Å²	68.6	61%	0.608	39%	0.391	S	S	*	.	H	α-helix	trans	-70.2	-25.5	-178.5	60.2	0	0	0	0	113.8	K47 T48	K47-S51 PolarHBondContact O-N 3.47Å; K47-S51 VanDerWaalsContact O-N 3.12Å; K47-S51 PolarHBondContact O-OG 2.88Å; T48-S51 PolarHBondContact O-OG 3.4Å
52	H	80.3	Confident	85.7	Confident	152 Å²	152	73.5 Å²	73.5	70%	0.704	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	6.7	177.3	-65.4	-58.2	0	0	0	112.7	T48 T49 E50	T48-H52 PolarHBondContact O-CD2 2.98Å; T49-H52 PolarHBondContact O-N 3.3Å; E50-H52 VanDerWaalsContact C-N 3.29Å; E50-H52 PolarHBondContact O-N 3.48Å
53	F	85.5	Confident	86.2	Confident	25 Å²	25	73 Å²	73	11%	0.11	39%	0.389	C	S	.	.			trans	-79.1	129	-175.5	-147.6	-116.5	0	0	0	111	I34 L37 L38 T49 E50 W55 V58	I34-F53 HydrophobicContact CB-CE1 4.27Å; I34-F53 HydrophobicContact CB-CZ 4.19Å; I34-F53 HydrophobicContact CG1-CE1 4.07Å; I34-F53 HydrophobicContact CG1-CZ 4.49Å; I34-F53 HydrophobicContact CG2-CE1 3.88Å; I34-F53 HydrophobicContact CG2-CE2 4.47Å; I34-F53 HydrophobicContact CG2-CZ 3.68Å; L37-F53 HydrophobicContact CB-CE2 3.9Å; L37-F53 HydrophobicContact CB-CZ 3.65Å; L37-F53 HydrophobicContact CD1-CE1 4.27Å; L37-F53 HydrophobicContact CD1-CZ 3.99Å; L37-F53 HydrophobicContact CG-CZ 4.47Å; L38-F53 HydrophobicContact CD2-CE2 3.98Å; T49-F53 PolarHBondContact O-N 3.02Å; E50-F53 VanDerWaalsContact O-CB 3.29Å; E50-F53 WeakPolarHBondContact O-CB 3.37Å; E50-F53 PolarHBondContact O-N 3.24Å; F53-W55 HydrophobicContact CB-CZ2 4.43Å; F53-W55 HydrophobicContact CD1-CD2 4.06Å; F53-W55 AromaticContact CD1-CE2 4Å; F53-W55 HydrophobicContact CD1-CE3 4.15Å; F53-W55 HydrophobicContact CD1-CH2 4.12Å; F53-W55 HydrophobicContact CD1-CZ2 4.05Å; F53-W55 HydrophobicContact CD1-CZ3 4.19Å; F53-W55 HydrophobicContact CE1-CZ3 4.42Å; F53-W55 VanDerWaalsContact O-CD1 3.29Å; F53-W55 PolarHBondContact O-N 3.44Å; F53-V58 HydrophobicContact CD1-CG2 3.68Å; F53-V58 HydrophobicContact CE1-CG2 3.19Å; F53-V58 HydrophobicContact CZ-CG2 4.16Å
54	D	87.5	Confident	87	Confident	67 Å²	67	73.1 Å²	73.1	36%	0.358	38%	0.383	S	S	.	.			trans	-85	92.8	176.5	-174.2	-12.7	0	0	0	109.1	D56 K57	D54-D56 PolarHBondContact O-N 2.82Å; D54-D56 PolarHBondContact OD1-N 3.16Å; D54-K57 HydrophobicContact CB-CD 4.19Å; D54-K57 HydrophobicContact CB-CG 4.43Å; D54-K57 PolarHBondContact O-N 2.91Å; D54-K57 WeakPolarHBondContact OD2-CD 3.34Å; D54-K57 WeakPolarHBondContact OD2-CE 3.35Å; D54-K57 IonicContact OD2-NZ 3.86Å; D54-K57 PolarHBondContact OD2-NZ 2.68Å
55	W	90	Very high	87.4	Confident	27 Å²	27	68.1 Å²	68.1	10%	0.102	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-66.3	-24.8	-174.3	-70.1	97.8	0	0	0	113.3	I34 E50 F53 K57 V58 G59 G65 C68 R69 W72	I34-W55 HydrophobicContact CD1-CH2 4.29Å; I34-W55 HydrophobicContact CD1-CZ3 4.07Å; I34-W55 HydrophobicContact CG1-CZ3 4.35Å; E50-W55 HydrophobicContact CG-CZ2 4.1Å; F53-W55 HydrophobicContact CB-CZ2 4.43Å; F53-W55 HydrophobicContact CD1-CD2 4.06Å; F53-W55 AromaticContact CD1-CE2 4Å; F53-W55 HydrophobicContact CD1-CE3 4.15Å; F53-W55 HydrophobicContact CD1-CH2 4.12Å; F53-W55 HydrophobicContact CD1-CZ2 4.05Å; F53-W55 HydrophobicContact CD1-CZ3 4.19Å; F53-W55 HydrophobicContact CE1-CZ3 4.42Å; F53-W55 VanDerWaalsContact O-CD1 3.29Å; F53-W55 PolarHBondContact O-N 3.44Å; W55-K57 PolarHBondContact O-N 3.22Å; W55-V58 HydrophobicContact CE3-CB 4.24Å; W55-V58 HydrophobicContact CE3-CG1 4.36Å; W55-V58 HydrophobicContact CE3-CG2 3.95Å; W55-V58 HydrophobicContact CZ3-CG1 4.42Å; W55-V58 HydrophobicContact CZ3-CG2 4.43Å; W55-V58 WeakPolarHBondContact O-CB 3.49Å; W55-V58 PolarHBondContact O-N 3.08Å; W55-G59 PolarHBondContact O-N 3.15Å; W55-G65 WeakPolarHBondContact O-CA 3.26Å; W55-C68 HydrophobicContact CE3-CB 4.36Å; W55-R69 HydrophobicContact CD2-CB 3.56Å; W55-R69 HydrophobicContact CD2-CG 3.9Å; W55-R69 HydrophobicContact CE3-CB 3.74Å; W55-R69 HydrophobicContact CE3-CG 4.42Å; W55-R69 HydrophobicContact CG-CB 3.94Å; W55-R69 HydrophobicContact CG-CG 4.27Å; W55-R69 HydrophobicContact CZ2-CB 4.36Å; W55-R69 HydrophobicContact CZ2-CG 4.02Å; W55-R69 HydrophobicContact CZ3-CB 4.23Å; W55-W72 HydrophobicContact CH2-CB 3.76Å; W55-W72 AromaticContact CH2-CD1 3.41Å; W55-W72 VanDerWaalsContact CH2-CD1 3.41Å; W55-W72 HydrophobicContact CH2-CD2 4.46Å; W55-W72 AromaticContact CH2-CG 3.58Å; W55-W72 HydrophobicContact CH2-CG 3.58Å; W55-W72 AromaticContact CZ2-CD1 3.92Å; W55-W72 HydrophobicContact CZ2-CG 4.5Å; W55-W72 HydrophobicContact CZ3-CB 3.99Å; W55-W72 HydrophobicContact CZ3-CG 4.27Å
56	D	88.8	Confident	87.8	Confident	128 Å²	128	65.5 Å²	65.5	68%	0.684	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-64.8	-30.6	177.1	-67.8	-39.5	0	0	0	111.7	D54 V58	D54-D56 PolarHBondContact O-N 2.82Å; D54-D56 PolarHBondContact OD1-N 3.16Å; D56-V58 VanDerWaalsContact C-N 3.3Å; D56-V58 PolarHBondContact O-N 2.91Å
57	K	87.9	Confident	87.9	Confident	136 Å²	136	67.6 Å²	67.6	59%	0.591	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-76	-16.6	174.3	-67.1	-179.7	177.1	130.7	0	113.9	L37 D54 W55	L37-K57 HydrophobicContact CD1-CB 4.05Å; L37-K57 HydrophobicContact CD2-CB 4.44Å; D54-K57 HydrophobicContact CB-CD 4.19Å; D54-K57 HydrophobicContact CB-CG 4.43Å; D54-K57 PolarHBondContact O-N 2.91Å; D54-K57 WeakPolarHBondContact OD2-CD 3.34Å; D54-K57 WeakPolarHBondContact OD2-CE 3.35Å; D54-K57 IonicContact OD2-NZ 3.86Å; D54-K57 PolarHBondContact OD2-NZ 2.68Å; W55-K57 PolarHBondContact O-N 3.22Å
58	V	88.3	Confident	88.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-28.5	179	-171.2	0	0	0	0	111.1	L30 R33 I34 L37 F53 W55 D56 C68	L30-V58 HydrophobicContact CD1-CG1 3.53Å; R33-V58 HydrophobicContact CB-CG1 4.32Å; I34-V58 HydrophobicContact CG1-CG1 3.79Å; L37-V58 HydrophobicContact CD1-CB 4.5Å; L37-V58 HydrophobicContact CD1-CG2 3.7Å; F53-V58 HydrophobicContact CD1-CG2 3.68Å; F53-V58 HydrophobicContact CE1-CG2 3.19Å; F53-V58 HydrophobicContact CZ-CG2 4.16Å; W55-V58 HydrophobicContact CE3-CB 4.24Å; W55-V58 HydrophobicContact CE3-CG1 4.36Å; W55-V58 HydrophobicContact CE3-CG2 3.95Å; W55-V58 HydrophobicContact CZ3-CG1 4.42Å; W55-V58 HydrophobicContact CZ3-CG2 4.43Å; W55-V58 WeakPolarHBondContact O-CB 3.49Å; W55-V58 PolarHBondContact O-N 3.08Å; D56-V58 VanDerWaalsContact C-N 3.3Å; D56-V58 PolarHBondContact O-N 2.91Å; V58-C68 HydrophobicContact CB-CB 4.38Å; V58-C68 HydrophobicContact CG1-CB 4Å
59	G	88	Confident	88.5	Confident	23 Å²	23	63.2 Å²	63.2	24%	0.237	34%	0.337	C	S	.	.			trans	-48.9	140.4	-179.8	0	0	0	0	0	112.8	W55 F63	W55-G59 PolarHBondContact O-N 3.15Å; G59-F63 WeakPolarHBondContact CA-O 3.21Å
60	F	91.9	Very high	88.9	Confident	22 Å²	22	68 Å²	68	10%	0.096	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-151.5	145.8	179.7	68.6	-83.5	0	0	0	111.4	W22 D26 T29 L30 R62 F63	W22-F60 HydrophobicContact CH2-CE1 4.09Å; W22-F60 HydrophobicContact CH2-CZ 4.2Å; W22-F60 AromaticContact CZ3-CE1 3.95Å; W22-F60 HydrophobicContact CZ3-CE1 3.95Å; W22-F60 AromaticContact CZ3-CZ 3.71Å; W22-F60 HydrophobicContact CZ3-CZ 3.71Å; D26-F60 HydrophobicContact CB-CE2 4.43Å; D26-F60 HydrophobicContact CB-CZ 4.32Å; D26-F60 VanDerWaalsContact O-CZ 3.24Å; D26-F60 WeakPolarHBondContact O-CZ 3.47Å; T29-F60 HydrophobicContact CG2-CD1 4.45Å; T29-F60 HydrophobicContact CG2-CD2 3.69Å; T29-F60 HydrophobicContact CG2-CE1 4.47Å; T29-F60 HydrophobicContact CG2-CE2 3.7Å; T29-F60 HydrophobicContact CG2-CG 4.09Å; T29-F60 HydrophobicContact CG2-CZ 4.12Å; L30-F60 HydrophobicContact CB-CE1 3.88Å; L30-F60 HydrophobicContact CB-CZ 4.31Å; L30-F60 HydrophobicContact CD1-CE1 4.43Å; F60-R62 PolarHBondContact O-N 3.11Å; F60-R62 VanDerWaalsContact O-N 3.13Å; F60-F63 HydrophobicContact CD2-CD2 4.14Å; F60-F63 HydrophobicContact CE1-CD2 4.22Å; F60-F63 AromaticContact CE2-CD2 3.6Å; F60-F63 HydrophobicContact CE2-CD2 3.6Å; F60-F63 AromaticContact CE2-CE2 3.88Å; F60-F63 HydrophobicContact CE2-CE2 3.88Å; F60-F63 AromaticContact CZ-CD2 3.63Å; F60-F63 HydrophobicContact CZ-CD2 3.63Å; F60-F63 HydrophobicContact CZ-CE2 4.03Å; F60-F63 PolarHBondContact N-O 2.82Å; F60-F63 VanDerWaalsContact N-O 3.11Å; F60-F63 WeakPolarHBondContact O-CB 3.49Å; F60-F63 PolarHBondContact O-N 3.45Å
61	G	88.3	Confident	89.2	Confident	88 Å²	88	67.8 Å²	67.8	91%	0.907	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	-117.9	179.2	0	0	0	0	0	111.9
62	R	90.6	Very high	89.5	Confident	159 Å²	159	63.6 Å²	63.6	60%	0.6	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-2.1	178.5	66.7	-178.7	178	-84.5	-6.3	114.2	A21 D26 F60	A21-R62 PolarHBondContact O-NH2 3.19Å; D26-R62 IonicContact OD2-NH2 3.36Å; D26-R62 PolarHBondContact OD2-NH2 3.47Å; F60-R62 PolarHBondContact O-N 3.11Å; F60-R62 VanDerWaalsContact O-N 3.13Å
63	F	91.2	Very high	90	Very high	8 Å²	8	59.7 Å²	59.7	4%	0.035	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-101	122.1	-173.6	-53.5	-72.4	0	0	0	110.9	A21 W22 D26 G59 F60 M67	A21-F63 WeakPolarHBondContact O-CE1 3.5Å; A21-F63 WeakPolarHBondContact O-CZ 3.44Å; W22-F63 AromaticContact CD1-CE1 3.99Å; W22-F63 HydrophobicContact CD2-CD1 4.17Å; W22-F63 AromaticContact CD2-CE1 3.77Å; W22-F63 HydrophobicContact CD2-CE1 3.77Å; W22-F63 HydrophobicContact CD2-CZ 4Å; W22-F63 AromaticContact CE2-CD1 3.52Å; W22-F63 AromaticContact CE2-CE1 3.52Å; W22-F63 HydrophobicContact CE3-CE1 4.35Å; W22-F63 HydrophobicContact CE3-CE2 4.45Å; W22-F63 HydrophobicContact CE3-CZ 4.22Å; W22-F63 HydrophobicContact CG-CE1 4.07Å; W22-F63 HydrophobicContact CG-CZ 4.34Å; W22-F63 HydrophobicContact CH2-CB 3.97Å; W22-F63 AromaticContact CH2-CD1 3.98Å; W22-F63 HydrophobicContact CH2-CD1 3.98Å; W22-F63 HydrophobicContact CH2-CD2 4.19Å; W22-F63 HydrophobicContact CH2-CE1 4.47Å; W22-F63 AromaticContact CH2-CG 3.79Å; W22-F63 HydrophobicContact CH2-CG 3.79Å; W22-F63 HydrophobicContact CZ2-CB 3.98Å; W22-F63 AromaticContact CZ2-CD1 3.42Å; W22-F63 HydrophobicContact CZ2-CD1 3.42Å; W22-F63 VanDerWaalsContact CZ2-CD1 3.42Å; W22-F63 HydrophobicContact CZ2-CD2 4.46Å; W22-F63 AromaticContact CZ2-CE1 3.92Å; W22-F63 HydrophobicContact CZ2-CE1 3.92Å; W22-F63 AromaticContact CZ2-CG 3.71Å; W22-F63 HydrophobicContact CZ2-CG 3.71Å; W22-F63 HydrophobicContact CZ3-CD2 4.33Å; W22-F63 HydrophobicContact CZ3-CE2 4.46Å; W22-F63 HydrophobicContact CZ3-CG 4.35Å; W22-F63 AromaticContact NE1-CD1 3.85Å; W22-F63 AromaticContact NE1-CE1 3.66Å; D26-F63 HydrophobicContact CB-CE2 3.84Å; D26-F63 HydrophobicContact CB-CZ 4.05Å; G59-F63 WeakPolarHBondContact CA-O 3.21Å; F60-F63 HydrophobicContact CD2-CD2 4.14Å; F60-F63 HydrophobicContact CE1-CD2 4.22Å; F60-F63 AromaticContact CE2-CD2 3.6Å; F60-F63 HydrophobicContact CE2-CD2 3.6Å; F60-F63 AromaticContact CE2-CE2 3.88Å; F60-F63 HydrophobicContact CE2-CE2 3.88Å; F60-F63 AromaticContact CZ-CD2 3.63Å; F60-F63 HydrophobicContact CZ-CD2 3.63Å; F60-F63 HydrophobicContact CZ-CE2 4.03Å; F60-F63 PolarHBondContact N-O 2.82Å; F60-F63 VanDerWaalsContact N-O 3.11Å; F60-F63 WeakPolarHBondContact O-CB 3.49Å; F60-F63 PolarHBondContact O-N 3.45Å; F63-M67 HydrophobicContact CB-CB 4.44Å; F63-M67 HydrophobicContact CD1-CE 3.93Å; F63-M67 HydrophobicContact CD1-SD 4.46Å
64	T	92.4	Very high	90.2	Very high	80 Å²	80	64.9 Å²	64.9	49%	0.491	33%	0.333	S	S	.	.			trans	-76	167.4	174.3	64.6	0	0	0	0	111.3	D66 M67 C68	T64-D66 VanDerWaalsContact C-N 3.26Å; T64-D66 PolarHBondContact O-N 3.17Å; T64-M67 PolarHBondContact O-N 3.31Å; T64-M67 VanDerWaalsContact O-N 3.16Å; T64-M67 WeakPolarHBondContact OG1-CG 3.34Å; T64-C68 PolarHBondContact O-N 2.84Å; T64-C68 PolarHBondContact O-SG 3.17Å
65	G	90.6	Very high	90.3	Very high	3 Å²	3	62.4 Å²	62.4	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-55.9	-40.2	177	0	0	0	0	0	113.1	W55 C68 R69	W55-G65 WeakPolarHBondContact O-CA 3.26Å; G65-C68 WeakPolarHBondContact O-CB 3.24Å; G65-C68 PolarHBondContact O-N 2.78Å; G65-R69 PolarHBondContact O-N 2.92Å
66	D	90.3	Very high	90.2	Very high	104 Å²	104	61.9 Å²	61.9	56%	0.556	32%	0.32	S	S	*	.	H	α-helix	trans	-65.4	-40.4	176.8	-71	-38.4	0	0	0	113.2	T64 C68 R69 Q70	T64-D66 VanDerWaalsContact C-N 3.26Å; T64-D66 PolarHBondContact O-N 3.17Å; D66-C68 VanDerWaalsContact C-N 3.31Å; D66-C68 PolarHBondContact O-N 3.44Å; D66-R69 PolarHBondContact O-N 3.4Å; D66-Q70 WeakPolarHBondContact O-CG 3.08Å; D66-Q70 PolarHBondContact O-N 2.81Å
67	M	90.3	Very high	90.1	Very high	73 Å²	73	60.3 Å²	60.3	36%	0.36	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-40.2	175.3	-65.4	178	80.6	0	0	110.9	W22 F63 T64 Q70 K71	W22-M67 HydrophobicContact CZ2-CB 4.16Å; F63-M67 HydrophobicContact CB-CB 4.44Å; F63-M67 HydrophobicContact CD1-CE 3.93Å; F63-M67 HydrophobicContact CD1-SD 4.46Å; T64-M67 PolarHBondContact O-N 3.31Å; T64-M67 VanDerWaalsContact O-N 3.16Å; T64-M67 WeakPolarHBondContact OG1-CG 3.34Å; M67-Q70 PolarHBondContact O-N 3.27Å; M67-K71 PolarHBondContact O-N 2.97Å
68	C	91.4	Very high	89.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-44.1	175.5	-67	0	0	0	0	111.7	L30 W55 V58 T64 G65 D66 K71 W72	L30-C68 HydrophobicContact CD1-CB 3.54Å; W55-C68 HydrophobicContact CE3-CB 4.36Å; V58-C68 HydrophobicContact CB-CB 4.38Å; V58-C68 HydrophobicContact CG1-CB 4Å; T64-C68 PolarHBondContact O-N 2.84Å; T64-C68 PolarHBondContact O-SG 3.17Å; G65-C68 WeakPolarHBondContact O-CB 3.24Å; G65-C68 PolarHBondContact O-N 2.78Å; D66-C68 VanDerWaalsContact C-N 3.31Å; D66-C68 PolarHBondContact O-N 3.44Å; C68-K71 PolarHBondContact O-N 2.89Å; C68-W72 WeakPolarHBondContact O-CB 3.42Å; C68-W72 PolarHBondContact O-N 3.07Å
69	R	91	Very high	89.7	Confident	100 Å²	100	59.4 Å²	59.4	38%	0.377	32%	0.317	S	S	.	.	H	α-helix	trans	-60.5	-47.7	175.8	-176.5	178.7	175.9	-91.3	1.4	112	W55 G65 D66 K71 W72 Q73	W55-R69 HydrophobicContact CD2-CB 3.56Å; W55-R69 HydrophobicContact CD2-CG 3.9Å; W55-R69 HydrophobicContact CE3-CB 3.74Å; W55-R69 HydrophobicContact CE3-CG 4.42Å; W55-R69 HydrophobicContact CG-CB 3.94Å; W55-R69 HydrophobicContact CG-CG 4.27Å; W55-R69 HydrophobicContact CZ2-CB 4.36Å; W55-R69 HydrophobicContact CZ2-CG 4.02Å; W55-R69 HydrophobicContact CZ3-CB 4.23Å; G65-R69 PolarHBondContact O-N 2.92Å; D66-R69 PolarHBondContact O-N 3.4Å; R69-K71 PolarHBondContact O-N 2.82Å; R69-W72 PolarHBondContact O-N 2.91Å; R69-Q73 WeakPolarHBondContact O-CG 3.33Å; R69-Q73 PolarHBondContact O-N 3.44Å
70	Q	91.7	Very high	89.4	Confident	114 Å²	114	67 Å²	67	53%	0.533	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-42.8	179.3	-71.7	178.2	31.1	0	0	111.8	D66 M67 Q73 K74	D66-Q70 WeakPolarHBondContact O-CG 3.08Å; D66-Q70 PolarHBondContact O-N 2.81Å; M67-Q70 PolarHBondContact O-N 3.27Å; Q70-Q73 PolarHBondContact O-N 3.32Å; Q70-K74 PolarHBondContact O-N 3.42Å
71	K	92	Very high	88.8	Confident	27 Å²	27	73 Å²	73	12%	0.117	37%	0.365	C	S	.	.	H	α-helix	trans	-66.8	-41.7	177.9	-166.3	69.1	170.4	-171.4	0	111.4	D20 W22 C27 L30 M67 C68 R69 Q73 K74 V75	D20-K71 IonicContact OD1-NZ 3.4Å; D20-K71 PolarHBondContact OD1-NZ 3.37Å; D20-K71 IonicContact OD2-NZ 3.11Å; W22-K71 HydrophobicContact CB-CD 4.24Å; W22-K71 VanDerWaalsContact CB-CE 3.49Å; W22-K71 HydrophobicContact CD2-CB 4.17Å; W22-K71 HydrophobicContact CD2-CD 3.91Å; W22-K71 HydrophobicContact CD2-CG 3.7Å; W22-K71 HydrophobicContact CE3-CB 4.4Å; W22-K71 HydrophobicContact CE3-CD 4.44Å; W22-K71 HydrophobicContact CE3-CG 3.82Å; W22-K71 HydrophobicContact CG-CD 3.79Å; W22-K71 HydrophobicContact CG-CG 4.14Å; W22-K71 HydrophobicContact CH2-CB 4.09Å; W22-K71 HydrophobicContact CH2-CG 4.39Å; W22-K71 HydrophobicContact CZ2-CB 3.82Å; W22-K71 HydrophobicContact CZ2-CG 4.27Å; W22-K71 HydrophobicContact CZ3-CB 4.36Å; W22-K71 HydrophobicContact CZ3-CG 4.17Å; C27-K71 WeakPolarHBondContact SG-CE 3.43Å; L30-K71 HydrophobicContact CD2-CB 3.83Å; L30-K71 HydrophobicContact CD2-CG 4.03Å; M67-K71 PolarHBondContact O-N 2.97Å; C68-K71 PolarHBondContact O-N 2.89Å; R69-K71 PolarHBondContact O-N 2.82Å; K71-Q73 PolarHBondContact O-N 3.28Å; K71-K74 PolarHBondContact O-N 3.26Å; K71-V75 WeakPolarHBondContact O-CG2 3.36Å; K71-V75 PolarHBondContact O-N 2.96Å
72	W	91.8	Very high	88.2	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-56.6	-47.3	173.1	166.4	-103.1	0	0	0	112	L31 I34 E50 W55 C68 R69 K74 V75 S76 M85 L88 I89 A92	L31-W72 HydrophobicContact CD2-CE3 3.7Å; L31-W72 HydrophobicContact CD2-CZ3 3.51Å; I34-W72 HydrophobicContact CD1-CB 4.04Å; I34-W72 HydrophobicContact CD1-CD2 3.8Å; I34-W72 HydrophobicContact CD1-CE3 3.5Å; I34-W72 VanDerWaalsContact CD1-CE3 3.5Å; I34-W72 HydrophobicContact CD1-CG 4.03Å; I34-W72 HydrophobicContact CD1-CZ3 4.26Å; E50-W72 PolarHBondContact OE1-NE1 3.2Å; W55-W72 HydrophobicContact CH2-CB 3.76Å; W55-W72 AromaticContact CH2-CD1 3.41Å; W55-W72 VanDerWaalsContact CH2-CD1 3.41Å; W55-W72 HydrophobicContact CH2-CD2 4.46Å; W55-W72 AromaticContact CH2-CG 3.58Å; W55-W72 HydrophobicContact CH2-CG 3.58Å; W55-W72 AromaticContact CZ2-CD1 3.92Å; W55-W72 HydrophobicContact CZ2-CG 4.5Å; W55-W72 HydrophobicContact CZ3-CB 3.99Å; W55-W72 HydrophobicContact CZ3-CG 4.27Å; C68-W72 WeakPolarHBondContact O-CB 3.42Å; C68-W72 PolarHBondContact O-N 3.07Å; R69-W72 PolarHBondContact O-N 2.91Å; W72-K74 VanDerWaalsContact C-N 3.33Å; W72-K74 PolarHBondContact O-N 3.3Å; W72-V75 PolarHBondContact O-N 3.21Å; W72-S76 VanDerWaalsContact O-CB 3.25Å; W72-S76 WeakPolarHBondContact O-CB 3.35Å; W72-S76 PolarHBondContact O-N 2.84Å; W72-S76 PolarHBondContact O-OG 3.09Å; W72-M85 HydrophobicContact CH2-SD 3.61Å; W72-M85 HydrophobicContact CZ2-CE 4.04Å; W72-M85 HydrophobicContact CZ2-SD 3.2Å; W72-M85 WeakPolarHBondContact CZ2-SD 3.26Å; W72-L88 HydrophobicContact CH2-CB 4.39Å; W72-L88 HydrophobicContact CH2-CD2 3.79Å; W72-L88 HydrophobicContact CH2-CG 3.91Å; W72-L88 HydrophobicContact CZ2-CD2 3.56Å; W72-L88 HydrophobicContact CZ2-CG 4.2Å; W72-I89 HydrophobicContact CH2-CG1 3.73Å; W72-I89 HydrophobicContact CZ3-CG1 3.76Å; W72-A92 HydrophobicContact CZ3-CB 4.4Å
73	Q	90.5	Very high	87.3	Confident	70 Å²	70	71.3 Å²	71.3	33%	0.327	33%	0.331	S	S	.	.	H	α-helix	trans	-57.8	-45.3	178.6	-75.5	-176.6	-30.1	0	0	111.9	R69 Q70 K71 S76 C77	R69-Q73 WeakPolarHBondContact O-CG 3.33Å; R69-Q73 PolarHBondContact O-N 3.44Å; Q70-Q73 PolarHBondContact O-N 3.32Å; K71-Q73 PolarHBondContact O-N 3.28Å; Q73-S76 PolarHBondContact O-N 3.47Å; Q73-S76 PolarHBondContact O-OG 3.01Å; Q73-C77 PolarHBondContact O-N 3.48Å; Q73-C77 PolarHBondContact O-SG 3.48Å; Q73-C77 VanDerWaalsContact O-SG 3.38Å
74	K	90.1	Very high	87.2	Confident	134 Å²	134	71 Å²	71	58%	0.583	33%	0.331	S	S	*	.	H	α-helix	trans	-59.9	-49.1	176.1	-70	-179.9	179.4	-178.3	0	112	Q70 K71 W72 S76 C77	Q70-K74 PolarHBondContact O-N 3.42Å; K71-K74 PolarHBondContact O-N 3.26Å; W72-K74 VanDerWaalsContact C-N 3.33Å; W72-K74 PolarHBondContact O-N 3.3Å; K74-S76 PolarHBondContact O-N 2.86Å; K74-C77 PolarHBondContact O-N 3.49Å
75	V	89.2	Confident	86.9	Confident	14 Å²	14	67.2 Å²	67.2	9%	0.085	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-40.2	179.7	175.3	0	0	0	0	111.4	K71 W72 C77 E78 A92 F95 V96	K71-V75 WeakPolarHBondContact O-CG2 3.36Å; K71-V75 PolarHBondContact O-N 2.96Å; W72-V75 PolarHBondContact O-N 3.21Å; V75-C77 VanDerWaalsContact C-N 3.27Å; V75-C77 PolarHBondContact O-N 2.85Å; V75-E78 PolarHBondContact O-N 3.35Å; V75-A92 HydrophobicContact CG1-CB 3.7Å; V75-F95 HydrophobicContact CG1-CD1 4.36Å; V75-V96 HydrophobicContact CG1-CG2 3.99Å; V75-V96 HydrophobicContact CG2-CG2 4.32Å
76	S	88.1	Confident	86.8	Confident	16 Å²	16	69.2 Å²	69.2	11%	0.112	32%	0.319	C	S	.	.	H	α-helix	trans	-66.4	-24.4	-178.3	76.3	0	0	0	0	114	W72 Q73 K74 V79	W72-S76 VanDerWaalsContact O-CB 3.25Å; W72-S76 WeakPolarHBondContact O-CB 3.35Å; W72-S76 PolarHBondContact O-N 2.84Å; W72-S76 PolarHBondContact O-OG 3.09Å; Q73-S76 PolarHBondContact O-N 3.47Å; Q73-S76 PolarHBondContact O-OG 3.01Å; K74-S76 PolarHBondContact O-N 2.86Å; S76-V79 WeakPolarHBondContact O-CG2 3.48Å
77	C	86.9	Confident	86.7	Confident	96 Å²	96	67 Å²	67	65%	0.649	31%	0.305	S	S	*	.	H	α-helix	trans	-74.6	-27.9	176	-76.2	0	0	0	0	113	Q73 K74 V75 V79	Q73-C77 PolarHBondContact O-N 3.48Å; Q73-C77 PolarHBondContact O-SG 3.48Å; Q73-C77 VanDerWaalsContact O-SG 3.38Å; K74-C77 PolarHBondContact O-N 3.49Å; V75-C77 VanDerWaalsContact C-N 3.27Å; V75-C77 PolarHBondContact O-N 2.85Å; C77-V79 VanDerWaalsContact C-N 3.35Å
78	E	83.6	Confident	86.6	Confident	100 Å²	100	63.5 Å²	63.5	47%	0.467	29%	0.288	S	S	.	.	H	α-helix	trans	-83.5	-15.4	-177.8	-64.4	-61.2	157.2	0	0	113	V75 F95 K104	V75-E78 PolarHBondContact O-N 3.35Å; E78-F95 HydrophobicContact CB-CD1 4.03Å; E78-F95 HydrophobicContact CB-CD2 4.26Å; E78-F95 HydrophobicContact CB-CE1 3.54Å; E78-F95 HydrophobicContact CB-CE2 3.8Å; E78-F95 HydrophobicContact CB-CG 4.37Å; E78-F95 HydrophobicContact CB-CZ 3.42Å; E78-F95 VanDerWaalsContact CB-CZ 3.42Å; E78-F95 HydrophobicContact CG-CE1 3.88Å; E78-F95 HydrophobicContact CG-CE2 4.4Å; E78-F95 HydrophobicContact CG-CZ 3.65Å; E78-K104 IonicContact OE2-NZ 3.66Å; E78-K104 PolarHBondContact OE2-NZ 2.95Å
79	V	84.8	Confident	86.5	Confident	16 Å²	16	63.5 Å²	63.5	10%	0.097	29%	0.288	C	S	.	.	S	Bend	trans	-103	157.6	177.6	-64.7	0	0	0	0	112.3	S76 C77 K81 L88 D91 A92 F95	S76-V79 WeakPolarHBondContact O-CG2 3.48Å; C77-V79 VanDerWaalsContact C-N 3.35Å; V79-K81 PolarHBondContact O-N 2.78Å; V79-L88 HydrophobicContact CB-CD1 4.48Å; V79-L88 HydrophobicContact CG2-CD1 3.47Å; V79-L88 VanDerWaalsContact CG2-CD1 3.47Å; V79-L88 HydrophobicContact CG2-CG 4.19Å; V79-D91 HydrophobicContact CB-CB 4.29Å; V79-D91 HydrophobicContact CG1-CB 4.35Å; V79-A92 HydrophobicContact CG1-CB 4.37Å; V79-A92 HydrophobicContact CG2-CB 4.46Å; V79-F95 HydrophobicContact CG1-CB 3.61Å; V79-F95 HydrophobicContact CG1-CG 4.09Å
80	R	79.9	Confident	86.4	Confident	182 Å²	182	62.6 Å²	62.6	69%	0.687	29%	0.293	S	S	*	.			trans	-63.7	137	180	-169.4	-177.5	-66	162.6	-0.5	109.6	Y82 L88	R80-Y82 HydrophobicContact CB-CE2 3.86Å; R80-Y82 WeakPolarHBondContact O-CD2 3.43Å; R80-Y82 WeakPolarHBondContact O-CE2 2.91Å; R80-Y82 PolarHBondContact O-N 3.37Å; R80-L88 WeakPolarHBondContact O-CD1 3.36Å
81	K	79.8	Confident	86	Confident	150 Å²	150	58.8 Å²	58.8	65%	0.652	28%	0.276	S	S	*	.			trans	-71.8	101.8	178.9	-66.2	175.3	179.8	170.4	0	110.2	Y46 V79	Y46-K81 HydrophobicContact CE1-CB 4.47Å; V79-K81 PolarHBondContact O-N 2.78Å
82	Y	75.5	Confident	85.9	Confident	57 Å²	57	57.5 Å²	57.5	22%	0.224	27%	0.271	C	S	.	.			trans	-85.1	173.2	177.9	-75.6	-78.5	0	0	0	113.7	Y46 R80 E87 L88 D91	Y46-Y82 WeakPolarHBondContact CD1-O 3.43Å; R80-Y82 HydrophobicContact CB-CE2 3.86Å; R80-Y82 WeakPolarHBondContact O-CD2 3.43Å; R80-Y82 WeakPolarHBondContact O-CE2 2.91Å; R80-Y82 PolarHBondContact O-N 3.37Å; Y82-E87 HydrophobicContact CD1-CB 4.03Å; Y82-E87 HydrophobicContact CD2-CB 4.4Å; Y82-E87 HydrophobicContact CG-CB 3.76Å; Y82-L88 HydrophobicContact CD2-CD1 4.23Å; Y82-D91 HydrophobicContact CE2-CB 3.82Å; Y82-D91 WeakPolarHBondContact CE2-OD2 3.5Å; Y82-D91 PolarHBondContact OH-OD2 2.81Å
83	R	72.1	Confident	85.7	Confident	153 Å²	153	58.8 Å²	58.8	58%	0.577	28%	0.278	S	S	*	.	S	Bend	trans	-74.2	-41.7	175.4	52.3	164.3	-163.6	107.4	7.6	111.3	K45 Y46 E87	K45-R83 CarbonylContact C-O 3.58Å; K45-R83 WeakPolarHBondContact CA-O 3.48Å; Y46-R83 PolarHBondContact N-O 2.93Å; R83-E87 WeakPolarHBondContact CG-OE2 3.41Å; R83-E87 IonicContact CZ-OE1 3.77Å; R83-E87 IonicContact NE-OE1 2.7Å; R83-E87 PolarHBondContact NE-OE1 3.45Å; R83-E87 IonicContact NE-OE2 3.51Å; R83-E87 IonicContact NH2-OE1 3.77Å; R83-E87 PolarHBondContact NH2-OE1 3.19Å
84	T	88.9	Confident	85.5	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.018	28%	0.275	C	S	.	.	S	Bend	trans	-115.8	162.1	-176.2	82.5	0	0	0	0	112.4	D42 L88	D42-T84 VanDerWaalsContact CG-CB 3.4Å; D42-T84 VanDerWaalsContact OD1-CB 3.26Å; D42-T84 WeakPolarHBondContact OD1-CB 3.46Å; D42-T84 PolarHBondContact OD1-OG1 2.84Å; D42-T84 WeakPolarHBondContact OD2-CB 3.3Å; D42-T84 PolarHBondContact OD2-OG1 2.78Å; T84-L88 PolarHBondContact O-N 2.68Å
85	M	86.1	Confident	85.3	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.3	-38.2	179.5	-172.2	64.6	86.7	0	0	111.1	L38 D42 Y46 T49 E50 W72 E87 L88 I89	L38-M85 HydrophobicContact CD1-CB 3.83Å; L38-M85 HydrophobicContact CD1-CG 3.58Å; L38-M85 HydrophobicContact CD2-CB 4.12Å; L38-M85 HydrophobicContact CD2-CG 3.95Å; L38-M85 HydrophobicContact CG-CG 4.37Å; D42-M85 WeakPolarHBondContact OD2-CA 3.03Å; D42-M85 WeakPolarHBondContact OD2-CB 3.43Å; D42-M85 PolarHBondContact OD2-N 3.06Å; Y46-M85 WeakPolarHBondContact O-CE 3.37Å; T49-M85 HydrophobicContact CG2-CB 4.22Å; E50-M85 HydrophobicContact CB-CE 3.65Å; E50-M85 HydrophobicContact CG-CE 4.23Å; W72-M85 HydrophobicContact CH2-SD 3.61Å; W72-M85 HydrophobicContact CZ2-CE 4.04Å; W72-M85 HydrophobicContact CZ2-SD 3.2Å; W72-M85 WeakPolarHBondContact CZ2-SD 3.26Å; M85-E87 PolarHBondContact O-N 3.23Å; M85-L88 WeakPolarHBondContact O-CB 3.24Å; M85-L88 PolarHBondContact O-N 2.97Å; M85-L88 HydrophobicContact SD-CD2 4.37Å; M85-I89 HydrophobicContact CG-CD1 3.85Å; M85-I89 HydrophobicContact CG-CG1 4.37Å; M85-I89 VanDerWaalsContact O-CG1 3.27Å; M85-I89 WeakPolarHBondContact O-CG1 3.43Å; M85-I89 PolarHBondContact O-N 3.39Å
86	T	87.9	Confident	85.1	Confident	45 Å²	45	54 Å²	54	28%	0.276	26%	0.257	S	S	.	.	H	α-helix	trans	-60.6	-45.9	176.9	-50.7	0	0	0	0	112.1	D42 L88 I89 V90	D42-T86 WeakPolarHBondContact OD1-CB 3.24Å; D42-T86 PolarHBondContact OD1-OG1 3.42Å; D42-T86 PolarHBondContact OD2-N 3.41Å; D42-T86 PolarHBondContact OD2-OG1 2.97Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 3.47Å; T86-I89 PolarHBondContact O-N 3.06Å; T86-V90 WeakPolarHBondContact O-CG2 3.47Å; T86-V90 PolarHBondContact O-N 3.36Å; T86-V90 VanDerWaalsContact O-N 3.08Å
87	E	88	Confident	85	Confident	56 Å²	56	58.5 Å²	58.5	26%	0.262	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-41.1	177.2	-70.7	176.6	179.4	0	0	111.2	Y82 R83 M85 V90 D91	Y82-E87 HydrophobicContact CD1-CB 4.03Å; Y82-E87 HydrophobicContact CD2-CB 4.4Å; Y82-E87 HydrophobicContact CG-CB 3.76Å; R83-E87 WeakPolarHBondContact CG-OE2 3.41Å; R83-E87 IonicContact CZ-OE1 3.77Å; R83-E87 IonicContact NE-OE1 2.7Å; R83-E87 PolarHBondContact NE-OE1 3.45Å; R83-E87 IonicContact NE-OE2 3.51Å; R83-E87 IonicContact NH2-OE1 3.77Å; R83-E87 PolarHBondContact NH2-OE1 3.19Å; M85-E87 PolarHBondContact O-N 3.23Å; E87-V90 PolarHBondContact O-N 3.02Å; E87-D91 PolarHBondContact O-N 3.09Å
88	L	88.6	Confident	84.8	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-38.7	178.3	-169	65.6	0	0	0	112.4	Y46 W72 V79 R80 Y82 T84 M85 T86 A92	Y46-L88 HydrophobicContact CD2-CD2 3.55Å; Y46-L88 HydrophobicContact CE2-CD2 4.04Å; Y46-L88 HydrophobicContact CG-CD2 3.89Å; W72-L88 HydrophobicContact CH2-CB 4.39Å; W72-L88 HydrophobicContact CH2-CD2 3.79Å; W72-L88 HydrophobicContact CH2-CG 3.91Å; W72-L88 HydrophobicContact CZ2-CD2 3.56Å; W72-L88 HydrophobicContact CZ2-CG 4.2Å; V79-L88 HydrophobicContact CB-CD1 4.48Å; V79-L88 HydrophobicContact CG2-CD1 3.47Å; V79-L88 VanDerWaalsContact CG2-CD1 3.47Å; V79-L88 HydrophobicContact CG2-CG 4.19Å; R80-L88 WeakPolarHBondContact O-CD1 3.36Å; Y82-L88 HydrophobicContact CD2-CD1 4.23Å; T84-L88 PolarHBondContact O-N 2.68Å; M85-L88 WeakPolarHBondContact O-CB 3.24Å; M85-L88 PolarHBondContact O-N 2.97Å; M85-L88 HydrophobicContact SD-CD2 4.37Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 3.47Å; L88-A92 VanDerWaalsContact O-CB 3.26Å; L88-A92 WeakPolarHBondContact O-CB 3.25Å; L88-A92 PolarHBondContact O-N 2.82Å
89	I	89.3	Confident	84.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-39.6	177.7	-69.2	165.7	0	0	0	111.3	L31 I34 R35 L38 W72 M85 T86 D91 A92 I93	L31-I89 HydrophobicContact CB-CG2 4.21Å; I34-I89 HydrophobicContact CB-CD1 4.09Å; I34-I89 HydrophobicContact CG2-CD1 3.52Å; I34-I89 HydrophobicContact CG2-CG1 4.33Å; R35-I89 HydrophobicContact CB-CD1 4.34Å; R35-I89 HydrophobicContact CB-CG2 4.32Å; L38-I89 HydrophobicContact CD1-CD1 3.61Å; W72-I89 HydrophobicContact CH2-CG1 3.73Å; W72-I89 HydrophobicContact CZ3-CG1 3.76Å; M85-I89 HydrophobicContact CG-CD1 3.85Å; M85-I89 HydrophobicContact CG-CG1 4.37Å; M85-I89 VanDerWaalsContact O-CG1 3.27Å; M85-I89 WeakPolarHBondContact O-CG1 3.43Å; M85-I89 PolarHBondContact O-N 3.39Å; T86-I89 PolarHBondContact O-N 3.06Å; I89-D91 VanDerWaalsContact C-N 3.33Å; I89-D91 PolarHBondContact O-N 2.74Å; I89-A92 PolarHBondContact O-N 3.04Å; I89-I93 HydrophobicContact CG2-CD1 3.77Å; I89-I93 HydrophobicContact CG2-CG1 4.2Å; I89-I93 WeakPolarHBondContact O-CB 3.42Å; I89-I93 VanDerWaalsContact O-CG1 3.24Å; I89-I93 WeakPolarHBondContact O-CG1 3.37Å; I89-I93 PolarHBondContact O-N 3.24Å
90	V	88.5	Confident	84.4	Confident	80 Å²	80	56.5 Å²	56.5	49%	0.485	26%	0.257	S	S	.	.	H	α-helix	trans	-59.5	-46.8	177.4	170.7	0	0	0	0	110.7	T86 E87 I93 E94	T86-V90 WeakPolarHBondContact O-CG2 3.47Å; T86-V90 PolarHBondContact O-N 3.36Å; T86-V90 VanDerWaalsContact O-N 3.08Å; E87-V90 PolarHBondContact O-N 3.02Å; V90-I93 PolarHBondContact O-N 3.48Å; V90-E94 PolarHBondContact O-N 2.95Å
91	D	84.6	Confident	84.1	Confident	34 Å²	34	51.1 Å²	51.1	18%	0.182	24%	0.238	C	C	.	.	H	α-helix	trans	-68.7	-35.5	176.6	-83.7	40.3	0	0	0	111.9	V79 Y82 E87 I89 I93 E94 F95	V79-D91 HydrophobicContact CB-CB 4.29Å; V79-D91 HydrophobicContact CG1-CB 4.35Å; Y82-D91 HydrophobicContact CE2-CB 3.82Å; Y82-D91 WeakPolarHBondContact CE2-OD2 3.5Å; Y82-D91 PolarHBondContact OH-OD2 2.81Å; E87-D91 PolarHBondContact O-N 3.09Å; I89-D91 VanDerWaalsContact C-N 3.33Å; I89-D91 PolarHBondContact O-N 2.74Å; D91-I93 VanDerWaalsContact C-N 3.33Å; D91-I93 PolarHBondContact O-N 2.89Å; D91-E94 PolarHBondContact O-N 3.15Å; D91-F95 WeakPolarHBondContact O-CB 3.41Å; D91-F95 PolarHBondContact O-N 3.02Å
92	A	88.9	Confident	83.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-38.3	173.4	0	0	0	0	0	112.2	L31 W72 V75 V79 L88 I89 F95 V96	L31-A92 HydrophobicContact CD1-CB 3.93Å; L31-A92 HydrophobicContact CD2-CB 3.71Å; W72-A92 HydrophobicContact CZ3-CB 4.4Å; V75-A92 HydrophobicContact CG1-CB 3.7Å; V79-A92 HydrophobicContact CG1-CB 4.37Å; V79-A92 HydrophobicContact CG2-CB 4.46Å; L88-A92 VanDerWaalsContact O-CB 3.26Å; L88-A92 WeakPolarHBondContact O-CB 3.25Å; L88-A92 PolarHBondContact O-N 2.82Å; I89-A92 PolarHBondContact O-N 3.04Å; A92-F95 PolarHBondContact O-N 3.37Å; A92-V96 WeakPolarHBondContact O-CB 3.45Å; A92-V96 VanDerWaalsContact O-CG2 3.3Å; A92-V96 WeakPolarHBondContact O-CG2 3.47Å; A92-V96 PolarHBondContact O-N 3.01Å
93	I	88.3	Confident	83.3	Confident	28 Å²	28	54 Å²	54	14%	0.144	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-43.8	174.1	-70.4	167.4	0	0	0	109.8	L28 L31 I89 V90 D91 F95 V96 K97	L28-I93 HydrophobicContact CD2-CG2 4Å; L31-I93 HydrophobicContact CB-CD1 4.41Å; L31-I93 HydrophobicContact CB-CG1 3.85Å; L31-I93 HydrophobicContact CD1-CB 4.42Å; L31-I93 HydrophobicContact CD1-CG1 3.74Å; L31-I93 HydrophobicContact CG-CG1 4.4Å; I89-I93 HydrophobicContact CG2-CD1 3.77Å; I89-I93 HydrophobicContact CG2-CG1 4.2Å; I89-I93 WeakPolarHBondContact O-CB 3.42Å; I89-I93 VanDerWaalsContact O-CG1 3.24Å; I89-I93 WeakPolarHBondContact O-CG1 3.37Å; I89-I93 PolarHBondContact O-N 3.24Å; V90-I93 PolarHBondContact O-N 3.48Å; D91-I93 VanDerWaalsContact C-N 3.33Å; D91-I93 PolarHBondContact O-N 2.89Å; I93-F95 VanDerWaalsContact C-N 3.34Å; I93-V96 PolarHBondContact O-N 3.39Å; I93-K97 HydrophobicContact CG2-CD 4.04Å; I93-K97 WeakPolarHBondContact O-CB 3.32Å; I93-K97 VanDerWaalsContact O-CG 3.27Å; I93-K97 WeakPolarHBondContact O-CG 3.42Å; I93-K97 PolarHBondContact O-N 3.49Å
94	E	85.4	Confident	83.4	Confident	57 Å²	57	50.5 Å²	50.5	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-62.2	-41.9	175.8	-169.2	177.7	-177.6	0	0	111.2	V90 D91 K97 N98 K101 R190	V90-E94 PolarHBondContact O-N 2.95Å; D91-E94 PolarHBondContact O-N 3.15Å; E94-K97 PolarHBondContact O-N 3.13Å; E94-N98 PolarHBondContact O-N 3.25Å; E94-K101 IonicContact OE1-NZ 2.85Å; E94-K101 PolarHBondContact OE1-NZ 3.07Å; E94-R190 IonicContact OE2-NH2 2.97Å; E94-R190 PolarHBondContact OE2-NH2 3.32Å
95	F	86.3	Confident	82.9	Confident	47 Å²	47	51.8 Å²	51.8	21%	0.206	26%	0.263	C	S	.	.	H	α-helix	trans	-65.6	-45.2	177.4	174.4	-102.2	0	0	0	112.8	V75 E78 V79 D91 A92 I93 K97 N98 P99	V75-F95 HydrophobicContact CG1-CD1 4.36Å; E78-F95 HydrophobicContact CB-CD1 4.03Å; E78-F95 HydrophobicContact CB-CD2 4.26Å; E78-F95 HydrophobicContact CB-CE1 3.54Å; E78-F95 HydrophobicContact CB-CE2 3.8Å; E78-F95 HydrophobicContact CB-CG 4.37Å; E78-F95 HydrophobicContact CB-CZ 3.42Å; E78-F95 VanDerWaalsContact CB-CZ 3.42Å; E78-F95 HydrophobicContact CG-CE1 3.88Å; E78-F95 HydrophobicContact CG-CE2 4.4Å; E78-F95 HydrophobicContact CG-CZ 3.65Å; V79-F95 HydrophobicContact CG1-CB 3.61Å; V79-F95 HydrophobicContact CG1-CG 4.09Å; D91-F95 WeakPolarHBondContact O-CB 3.41Å; D91-F95 PolarHBondContact O-N 3.02Å; A92-F95 PolarHBondContact O-N 3.37Å; I93-F95 VanDerWaalsContact C-N 3.34Å; F95-K97 VanDerWaalsContact C-N 3.3Å; F95-K97 PolarHBondContact O-N 3.2Å; F95-N98 CarbonylContact O-C 3.58Å; F95-N98 PolarHBondContact O-N 2.62Å; F95-P99 WeakPolarHBondContact O-CA 3.46Å; F95-P99 WeakPolarHBondContact O-CD 3.17Å; F95-P99 WeakPolarHBondContact O-CG 3.19Å
96	V	86.4	Confident	82.4	Confident	14 Å²	14	60.1 Å²	60.1	9%	0.085	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-34.7	178.1	168.4	0	0	0	0	111.3	Q24 C27 L28 L31 V75 A92 I93	Q24-V96 HydrophobicContact CG-CG1 4.02Å; C27-V96 HydrophobicContact CB-CG1 3.59Å; C27-V96 HydrophobicContact CB-CG2 4.12Å; L28-V96 HydrophobicContact CD2-CB 4.23Å; L28-V96 HydrophobicContact CD2-CG1 3.85Å; L28-V96 HydrophobicContact CG-CG1 3.9Å; L31-V96 HydrophobicContact CD1-CB 4.36Å; L31-V96 HydrophobicContact CD1-CG2 3.91Å; V75-V96 HydrophobicContact CG1-CG2 3.99Å; V75-V96 HydrophobicContact CG2-CG2 4.32Å; A92-V96 WeakPolarHBondContact O-CB 3.45Å; A92-V96 VanDerWaalsContact O-CG2 3.3Å; A92-V96 WeakPolarHBondContact O-CG2 3.47Å; A92-V96 PolarHBondContact O-N 3.01Å; I93-V96 PolarHBondContact O-N 3.39Å
97	K	85.1	Confident	82	Confident	110 Å²	110	62.3 Å²	62.3	48%	0.478	31%	0.312	S	S	.	.	H	α-helix	trans	-70.5	-44	174.8	-72.9	177.8	179.1	-176.9	0	112.1	L28 I93 E94 F95	L28-K97 HydrophobicContact CD1-CG 4.27Å; L28-K97 HydrophobicContact CD2-CG 4.05Å; I93-K97 HydrophobicContact CG2-CD 4.04Å; I93-K97 WeakPolarHBondContact O-CB 3.32Å; I93-K97 VanDerWaalsContact O-CG 3.27Å; I93-K97 WeakPolarHBondContact O-CG 3.42Å; I93-K97 PolarHBondContact O-N 3.49Å; E94-K97 PolarHBondContact O-N 3.13Å; F95-K97 VanDerWaalsContact C-N 3.3Å; F95-K97 PolarHBondContact O-N 3.2Å
98	N	83.1	Confident	81.5	Confident	34 Å²	34	60.6 Å²	60.6	18%	0.182	30%	0.304	C	S	.	.			trans	-128.5	73.8	-175.3	-59.4	10.2	0	0	0	111	E94 F95 Y100 K101 D185 L186	E94-N98 PolarHBondContact O-N 3.25Å; F95-N98 CarbonylContact O-C 3.58Å; F95-N98 PolarHBondContact O-N 2.62Å; N98-Y100 PolarHBondContact O-N 3.07Å; N98-Y100 VanDerWaalsContact O-N 3.07Å; N98-K101 HydrophobicContact CB-CB 3.94Å; N98-K101 HydrophobicContact CB-CD 4.29Å; N98-K101 WeakPolarHBondContact O-CB 3.29Å; N98-K101 PolarHBondContact O-N 2.96Å; N98-K101 VanDerWaalsContact O-N 3.07Å; N98-D185 PolarHBondContact ND2-O 2.97Å; N98-L186 HydrophobicContact CB-CD2 3.97Å
99	P	80.9	Confident	81.1	Confident	51 Å²	51	65.1 Å²	65.1	33%	0.331	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.2	-174.4	-24.7	34.3	0	0	0	114.4	F95	F95-P99 WeakPolarHBondContact O-CA 3.46Å; F95-P99 WeakPolarHBondContact O-CD 3.17Å; F95-P99 WeakPolarHBondContact O-CG 3.19Å
100	Y	78.2	Confident	80.7	Confident	84 Å²	84	69.8 Å²	69.8	33%	0.329	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	6.1	-177.6	-59.1	-77.8	0	0	0	113.5	N98 K104 L105 H108	N98-Y100 PolarHBondContact O-N 3.07Å; N98-Y100 VanDerWaalsContact O-N 3.07Å; Y100-K104 CarbonylContact O-C 3.5Å; Y100-L105 WeakPolarHBondContact O-CA 3.14Å; Y100-L105 WeakPolarHBondContact O-CB 3.06Å; Y100-L105 PolarHBondContact O-N 3.3Å; Y100-H108 HydrophobicContact CD1-CB 4Å; Y100-H108 AromaticContact CD2-CD2 3.35Å; Y100-H108 WeakPolarHBondContact CD2-CD2 3.28Å; Y100-H108 AromaticContact CE2-CD2 3.99Å; Y100-H108 HydrophobicContact CG-CB 3.99Å; Y100-H108 AromaticContact CG-CD2 3.5Å
101	K	75.1	Confident	80.4	Confident	70 Å²	70	68.1 Å²	68.1	30%	0.304	35%	0.345	S	S	.	.	S	Bend	trans	-68.7	143.4	-179.9	-159.8	174.9	-174.3	179.4	0	111.4	E94 N98 K103 L186	E94-K101 IonicContact OE1-NZ 2.85Å; E94-K101 PolarHBondContact OE1-NZ 3.07Å; N98-K101 HydrophobicContact CB-CB 3.94Å; N98-K101 HydrophobicContact CB-CD 4.29Å; N98-K101 WeakPolarHBondContact O-CB 3.29Å; N98-K101 PolarHBondContact O-N 2.96Å; N98-K101 VanDerWaalsContact O-N 3.07Å; K101-K103 PolarHBondContact O-N 3.22Å; K101-L186 HydrophobicContact CB-CD2 4.15Å
102	G	72.4	Confident	80.5	Confident	53 Å²	53	67.3 Å²	67.3	55%	0.546	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	73.7	-124.5	174.8	0	0	0	0	0	113.7	K104 L105	G102-K104 PolarHBondContact O-N 2.8Å; G102-K104 VanDerWaalsContact O-N 3.15Å; G102-L105 VanDerWaalsContact O-CB 3.24Å; G102-L105 WeakPolarHBondContact O-CB 3.36Å; G102-L105 PolarHBondContact O-N 3.04Å
103	K	65.9	Low	80.3	Confident	214 Å²	214	76.3 Å²	76.3	93%	0.93	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-61.5	-25.8	-172.3	-67.1	-172	178.3	-171.8	0	113.7	K101	K101-K103 PolarHBondContact O-N 3.22Å
104	K	73.8	Confident	80.2	Confident	79 Å²	79	83.4 Å²	83.4	34%	0.343	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-90.5	3.9	-179.9	-63	-173	-177.2	-177.1	0	113.4	E78 Y100 G102 K106 T107	E78-K104 IonicContact OE2-NZ 3.66Å; E78-K104 PolarHBondContact OE2-NZ 2.95Å; Y100-K104 CarbonylContact O-C 3.5Å; G102-K104 PolarHBondContact O-N 2.8Å; G102-K104 VanDerWaalsContact O-N 3.15Å; K104-K106 VanDerWaalsContact C-N 3.29Å; K104-K106 PolarHBondContact O-N 2.73Å; K104-T107 WeakPolarHBondContact O-CA 3.3Å; K104-T107 WeakPolarHBondContact O-CB 3.49Å; K104-T107 PolarHBondContact O-N 2.76Å; K104-T107 PolarHBondContact O-OG1 3.15Å
105	L	79.1	Confident	80.4	Confident	31 Å²	31	81.9 Å²	81.9	16%	0.162	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-60.2	-40.5	-177.7	-174.7	61.3	0	0	0	112.5	Y100 G102 T107 H108 F111 F179 L186 M187	Y100-L105 WeakPolarHBondContact O-CA 3.14Å; Y100-L105 WeakPolarHBondContact O-CB 3.06Å; Y100-L105 PolarHBondContact O-N 3.3Å; G102-L105 VanDerWaalsContact O-CB 3.24Å; G102-L105 WeakPolarHBondContact O-CB 3.36Å; G102-L105 PolarHBondContact O-N 3.04Å; L105-T107 PolarHBondContact O-N 3.06Å; L105-T107 VanDerWaalsContact O-N 3.15Å; L105-H108 WeakPolarHBondContact O-CB 3.3Å; L105-H108 PolarHBondContact O-N 3.15Å; L105-H108 VanDerWaalsContact O-N 3.15Å; L105-F111 HydrophobicContact CD2-CE2 4.46Å; L105-F111 HydrophobicContact CG-CD2 4.16Å; L105-F111 HydrophobicContact CG-CE2 4.15Å; L105-F179 HydrophobicContact CD1-CE1 4.14Å; L105-F179 HydrophobicContact CD1-CZ 4.04Å; L105-L186 HydrophobicContact CD1-CB 3.73Å; L105-L186 HydrophobicContact CD1-CD1 4.32Å; L105-M187 HydrophobicContact CD2-SD 4.08Å
106	K	74.3	Confident	80.6	Confident	175 Å²	175	83.6 Å²	83.6	76%	0.761	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-67.7	-10.5	176.5	-61.6	-178.6	-178.8	177.5	0	113.8	K104 F111	K104-K106 VanDerWaalsContact C-N 3.29Å; K104-K106 PolarHBondContact O-N 2.73Å; K106-F111 HydrophobicContact CB-CE1 4.43Å; K106-F111 HydrophobicContact CG-CE1 4.14Å; K106-F111 HydrophobicContact CG-CZ 4.28Å
107	T	79.1	Confident	80.8	Confident	90 Å²	90	85.7 Å²	85.7	55%	0.552	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-98.3	-2.1	177.6	68.6	0	0	0	0	112.8	K104 L105	K104-T107 WeakPolarHBondContact O-CA 3.3Å; K104-T107 WeakPolarHBondContact O-CB 3.49Å; K104-T107 PolarHBondContact O-N 2.76Å; K104-T107 PolarHBondContact O-OG1 3.15Å; L105-T107 PolarHBondContact O-N 3.06Å; L105-T107 VanDerWaalsContact O-N 3.15Å
108	H	78.6	Confident	81.2	Confident	20 Å²	20	81.4 Å²	81.4	9%	0.093	41%	0.413	C	S	.	.			trans	-63.1	134.1	175.9	-170.9	-79	0	0	0	109.7	Y100 L105 D110 F111 F179 H183	Y100-H108 HydrophobicContact CD1-CB 4Å; Y100-H108 AromaticContact CD2-CD2 3.35Å; Y100-H108 WeakPolarHBondContact CD2-CD2 3.28Å; Y100-H108 AromaticContact CE2-CD2 3.99Å; Y100-H108 HydrophobicContact CG-CB 3.99Å; Y100-H108 AromaticContact CG-CD2 3.5Å; L105-H108 WeakPolarHBondContact O-CB 3.3Å; L105-H108 PolarHBondContact O-N 3.15Å; L105-H108 VanDerWaalsContact O-N 3.15Å; H108-D110 IonicContact CE1-OD2 3.73Å; H108-D110 PolarHBondContact CE1-OD2 3.33Å; H108-D110 PolarHBondContact ND1-N 3.48Å; H108-D110 IonicContact ND1-OD2 3.97Å; H108-D110 PolarHBondContact O-N 2.92Å; H108-F111 HydrophobicContact CB-CB 4Å; H108-F111 WeakPolarHBondContact O-CB 3.48Å; H108-F111 PolarHBondContact O-N 2.9Å; H108-F179 HydrophobicContact CB-CE2 4.45Å; H108-F179 HydrophobicContact CB-CZ 4.41Å; H108-F179 AromaticContact CE1-CE2 3.98Å; H108-F179 AromaticContact CG-CE2 3.99Å; H108-F179 AromaticContact ND1-CE2 3.55Å; H108-H183 AromaticContact CE1-CE1 3.42Å; H108-H183 PolarHBondContact CE1-CE1 2.88Å; H108-H183 VanDerWaalsContact CE1-CE1 3.42Å; H108-H183 AromaticContact CE1-NE2 3.48Å; H108-H183 PolarHBondContact CE1-NE2 2.96Å; H108-H183 AromaticContact NE2-CE1 3.56Å; H108-H183 AromaticContact NE2-ND1 3.86Å
109	P	80.9	Confident	81.5	Confident	97 Å²	97	82.1 Å²	82.1	63%	0.63	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-39.2	-177.2	-5.6	4.3	0	0	0	112.6
110	D	79.1	Confident	81.9	Confident	97 Å²	97	84.9 Å²	84.9	52%	0.519	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.1	179.4	-50.4	-48.2	0	0	0	113.9	H108 P112 F179 H183	H108-D110 IonicContact CE1-OD2 3.73Å; H108-D110 PolarHBondContact CE1-OD2 3.33Å; H108-D110 PolarHBondContact ND1-N 3.48Å; H108-D110 IonicContact ND1-OD2 3.97Å; H108-D110 PolarHBondContact O-N 2.92Å; D110-P112 WeakPolarHBondContact O-CD 3.32Å; D110-F179 HydrophobicContact CB-CD2 4.13Å; D110-F179 HydrophobicContact CB-CE2 4.26Å; D110-F179 WeakPolarHBondContact O-CD2 3.44Å; D110-H183 IonicContact OD2-NE2 3.75Å
111	F	82.2	Confident	82.5	Confident	46 Å²	46	83.1 Å²	83.1	20%	0.202	41%	0.413	C	S	.	.	S	Bend	trans	-69.8	116.7	176.7	-172.7	-92.8	0	0	0	109.6	L105 K106 H108 K113 M176 F179	L105-F111 HydrophobicContact CD2-CE2 4.46Å; L105-F111 HydrophobicContact CG-CD2 4.16Å; L105-F111 HydrophobicContact CG-CE2 4.15Å; K106-F111 HydrophobicContact CB-CE1 4.43Å; K106-F111 HydrophobicContact CG-CE1 4.14Å; K106-F111 HydrophobicContact CG-CZ 4.28Å; H108-F111 HydrophobicContact CB-CB 4Å; H108-F111 WeakPolarHBondContact O-CB 3.48Å; H108-F111 PolarHBondContact O-N 2.9Å; F111-K113 PolarHBondContact O-N 3.15Å; F111-M176 HydrophobicContact CE1-CE 4.27Å; F111-M176 HydrophobicContact CE2-CE 4.21Å; F111-M176 HydrophobicContact CE2-SD 4.37Å; F111-M176 HydrophobicContact CZ-CE 3.93Å; F111-F179 HydrophobicContact CB-CE2 4.33Å; F111-F179 HydrophobicContact CB-CZ 4.29Å; F111-F179 HydrophobicContact CD2-CD1 4.17Å; F111-F179 AromaticContact CD2-CE1 3.65Å; F111-F179 HydrophobicContact CD2-CE1 3.65Å; F111-F179 AromaticContact CD2-CZ 3.89Å; F111-F179 HydrophobicContact CD2-CZ 3.89Å; F111-F179 HydrophobicContact CE2-CE1 4.26Å
112	P	86.6	Confident	83.3	Confident	16 Å²	16	80.3 Å²	80.3	10%	0.104	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-63.7	136.1	-177.2	-21.4	34.3	0	0	0	110.6	D110 F172 N175 M176 F179	D110-P112 WeakPolarHBondContact O-CD 3.32Å; P112-F172 HydrophobicContact CB-CD2 3.71Å; P112-F172 HydrophobicContact CB-CE2 3.84Å; P112-F172 WeakPolarHBondContact O-CE2 3.44Å; P112-N175 HydrophobicContact CB-CB 4.04Å; P112-N175 VanDerWaalsContact CG-C 3.49Å; P112-N175 HydrophobicContact CG-CB 3.8Å; P112-N175 WeakPolarHBondContact CG-O 3.38Å; P112-M176 HydrophobicContact CB-CE 4.06Å; P112-M176 HydrophobicContact CG-CB 4.34Å; P112-M176 HydrophobicContact CG-CE 4.11Å; P112-M176 HydrophobicContact CG-SD 4.44Å; P112-F179 HydrophobicContact CG-CB 4.18Å
113	K	84.7	Confident	84.2	Confident	190 Å²	190	78.5 Å²	78.5	83%	0.826	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-85.6	139.7	175.2	-66.6	-178.7	-178.1	177.5	0	109.8	F111 F172	F111-K113 PolarHBondContact O-N 3.15Å; K113-F172 WeakPolarHBondContact O-CD2 3.24Å; K113-F172 WeakPolarHBondContact O-CE2 3.46Å
114	K	86.9	Confident	85.2	Confident	176 Å²	176	73.7 Å²	73.7	77%	0.765	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-58.3	136.4	176.4	-68.4	-176.2	176.9	-174.5	0	109.9	F172	K114-F172 HydrophobicContact CG-CE2 4.15Å; K114-F172 HydrophobicContact CG-CZ 3.87Å
115	P	89.7	Confident	86	Confident	26 Å²	26	73.4 Å²	73.4	17%	0.169	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-64.7	147.8	175.3	31	-38.4	0	0	0	110.3	F165 E168 K169 F172	P115-F165 HydrophobicContact CB-CD2 4.2Å; P115-F165 HydrophobicContact CB-CE2 4.26Å; P115-F165 HydrophobicContact CG-CD2 4.25Å; P115-F165 HydrophobicContact CG-CE2 3.88Å; P115-E168 HydrophobicContact CB-CB 3.72Å; P115-K169 HydrophobicContact CG-CB 4.16Å; P115-F172 HydrophobicContact CG-CB 4.41Å
116	L	89.5	Confident	86.4	Confident	82 Å²	82	74.3 Å²	74.3	43%	0.429	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-72.4	135.8	177.6	-67.5	173.6	0	0	0	110.1	F120 F165	L116-F120 HydrophobicContact CB-CB 4.46Å; L116-F120 HydrophobicContact CD2-CB 4.43Å; L116-F165 WeakPolarHBondContact O-CD2 3.45Å
117	T	91.9	Very high	87	Confident	59 Å²	59	69.9 Å²	69.9	36%	0.362	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-61.6	158.4	175.4	71.8	0	0	0	0	111.1	Y119 F120 R121	T117-Y119 PolarHBondContact O-N 3.25Å; T117-Y119 VanDerWaalsContact O-N 3.15Å; T117-F120 PolarHBondContact O-N 3.49Å; T117-F120 VanDerWaalsContact O-N 3.08Å; T117-F120 WeakPolarHBondContact OG1-CD2 3.5Å; T117-F120 PolarHBondContact OG1-N 2.76Å; T117-R121 WeakPolarHBondContact O-CB 3.45Å; T117-R121 PolarHBondContact O-N 3.2Å
118	P	92.4	Very high	87.4	Confident	19 Å²	19	68.4 Å²	68.4	12%	0.123	34%	0.338	C	S	.	.	H	α-helix	trans	-53.5	-38.4	-178	-30.1	38.2	0	0	0	113.9	F122 Y150 I162 F165	P118-F122 PolarHBondContact O-N 2.91Å; P118-Y150 WeakPolarHBondContact CB-OH 3.42Å; P118-I162 HydrophobicContact CB-CG1 4.04Å; P118-I162 HydrophobicContact CG-CB 4.43Å; P118-I162 HydrophobicContact CG-CG1 3.96Å; P118-F165 HydrophobicContact CG-CB 3.74Å; P118-F165 HydrophobicContact CG-CD1 4.02Å; P118-F165 HydrophobicContact CG-CG 3.98Å
119	Y	90.9	Very high	87.8	Confident	49 Å²	49	72.8 Å²	72.8	19%	0.192	36%	0.357	C	S	.	.	H	α-helix	trans	-67.2	-51	174.9	169.2	-107.4	0	0	0	112.4	T117 R121 F122 F123 S147 Y150	T117-Y119 PolarHBondContact O-N 3.25Å; T117-Y119 VanDerWaalsContact O-N 3.15Å; Y119-R121 VanDerWaalsContact C-N 3.25Å; Y119-R121 PolarHBondContact O-N 3.37Å; Y119-F122 WeakPolarHBondContact O-CB 3.44Å; Y119-F122 PolarHBondContact O-N 2.92Å; Y119-F122 VanDerWaalsContact O-N 3.11Å; Y119-F123 WeakPolarHBondContact O-CB 3.35Å; Y119-F123 PolarHBondContact O-N 2.84Å; Y119-S147 PolarHBondContact OH-OG 3.09Å; Y119-Y150 AromaticContact CD2-CD1 3.6Å; Y119-Y150 HydrophobicContact CD2-CD1 3.6Å; Y119-Y150 HydrophobicContact CD2-CD2 4.16Å; Y119-Y150 HydrophobicContact CD2-CE1 4.2Å; Y119-Y150 AromaticContact CD2-CG 3.57Å; Y119-Y150 HydrophobicContact CD2-CG 3.57Å; Y119-Y150 HydrophobicContact CE2-CG 4.31Å; Y119-Y150 HydrophobicContact CG-CD1 4.3Å
120	F	89.2	Confident	88	Confident	109 Å²	109	71.3 Å²	71.3	48%	0.478	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-33.3	-179.1	-86.1	-65.8	0	0	0	112.4	L116 T117 F123 M124	L116-F120 HydrophobicContact CB-CB 4.46Å; L116-F120 HydrophobicContact CD2-CB 4.43Å; T117-F120 PolarHBondContact O-N 3.49Å; T117-F120 VanDerWaalsContact O-N 3.08Å; T117-F120 WeakPolarHBondContact OG1-CD2 3.5Å; T117-F120 PolarHBondContact OG1-N 2.76Å; F120-F123 PolarHBondContact O-N 3.35Å; F120-M124 WeakPolarHBondContact O-CB 3.22Å; F120-M124 WeakPolarHBondContact O-CG 3.43Å; F120-M124 PolarHBondContact O-N 3.5Å
121	R	90.1	Very high	88.4	Confident	48 Å²	48	68.5 Å²	68.5	18%	0.181	33%	0.329	C	S	.	.	H	α-helix	trans	-59.9	-50.7	171.4	-176.4	72	131	-116	-16.4	111.7	T117 Y119 F123 M124 E125 Y161 E164 E168	T117-R121 WeakPolarHBondContact O-CB 3.45Å; T117-R121 PolarHBondContact O-N 3.2Å; Y119-R121 VanDerWaalsContact C-N 3.25Å; Y119-R121 PolarHBondContact O-N 3.37Å; R121-F123 VanDerWaalsContact C-N 3.34Å; R121-M124 PolarHBondContact O-N 3.49Å; R121-E125 PolarHBondContact O-N 2.83Å; R121-E125 VanDerWaalsContact O-N 3.17Å; R121-Y161 HydrophobicContact CB-CD1 4.41Å; R121-Y161 HydrophobicContact CG-CD1 3.88Å; R121-E164 IonicContact CZ-OE2 3.19Å; R121-E164 IonicContact NE-OE2 2.92Å; R121-E164 PolarHBondContact NE-OE2 3.29Å; R121-E164 IonicContact NH2-OE2 2.63Å; R121-E164 PolarHBondContact NH2-OE2 3.1Å; R121-E164 VanDerWaalsContact NH2-OE2 3.11Å; R121-E168 IonicContact CZ-OE1 2.64Å; R121-E168 VanDerWaalsContact CZ-OE1 3.26Å; R121-E168 IonicContact CZ-OE2 3.5Å; R121-E168 VanDerWaalsContact NH1-CD 3.28Å; R121-E168 IonicContact NH1-OE1 3.63Å; R121-E168 PolarHBondContact NH1-OE1 3.19Å; R121-E168 IonicContact NH1-OE2 2.68Å; R121-E168 PolarHBondContact NH1-OE2 3.26Å; R121-E168 IonicContact NH2-OE1 3.58Å; R121-E168 PolarHBondContact NH2-OE1 2.84Å; R121-E168 IonicContact NH2-OE2 3.26Å; R121-E168 PolarHBondContact NH2-OE2 3.13Å
122	F	91.7	Very high	88.7	Confident	10 Å²	10	74.6 Å²	74.6	4%	0.044	36%	0.356	C	S	.	.	H	α-helix	trans	-60.3	-44.7	175.1	167.9	-96.8	0	0	0	111.6	P118 Y119 M124 E125 K126 L146 K149 Y150 L153 Y161	P118-F122 PolarHBondContact O-N 2.91Å; Y119-F122 WeakPolarHBondContact O-CB 3.44Å; Y119-F122 PolarHBondContact O-N 2.92Å; Y119-F122 VanDerWaalsContact O-N 3.11Å; F122-M124 PolarHBondContact O-N 3.2Å; F122-E125 PolarHBondContact O-N 2.99Å; F122-K126 HydrophobicContact CD2-CG 3.82Å; F122-K126 HydrophobicContact CE1-CG 4.33Å; F122-K126 HydrophobicContact CE2-CD 4.3Å; F122-K126 HydrophobicContact CE2-CG 3.43Å; F122-K126 VanDerWaalsContact CE2-CG 3.43Å; F122-K126 HydrophobicContact CG-CG 4.42Å; F122-K126 HydrophobicContact CZ-CB 4.42Å; F122-K126 HydrophobicContact CZ-CG 3.73Å; F122-K126 WeakPolarHBondContact O-CB 3.33Å; F122-K126 WeakPolarHBondContact O-CG 3.33Å; F122-K126 PolarHBondContact O-N 3.45Å; F122-L146 HydrophobicContact CE1-CD2 4.23Å; F122-K149 HydrophobicContact CZ-CB 4.45Å; F122-Y150 HydrophobicContact CB-CD2 3.75Å; F122-Y150 HydrophobicContact CB-CE2 3.94Å; F122-Y150 AromaticContact CD1-CD2 3.53Å; F122-Y150 HydrophobicContact CD1-CD2 3.53Å; F122-Y150 HydrophobicContact CD1-CG 4.08Å; F122-Y150 HydrophobicContact CD2-CD2 4.31Å; F122-Y150 HydrophobicContact CE1-CD2 4.18Å; F122-Y150 HydrophobicContact CE1-CG 4.48Å; F122-Y150 AromaticContact CG-CD2 3.59Å; F122-Y150 HydrophobicContact CG-CD2 3.59Å; F122-Y150 HydrophobicContact CG-CE2 4.25Å; F122-L153 HydrophobicContact CD2-CD1 3.79Å; F122-L153 HydrophobicContact CE2-CD1 3.55Å; F122-L153 HydrophobicContact CE2-CG 4.47Å; F122-L153 HydrophobicContact CG-CD1 4.41Å; F122-L153 HydrophobicContact CZ-CD1 3.97Å; F122-Y161 HydrophobicContact CB-CD1 4.47Å; F122-Y161 HydrophobicContact CB-CE1 4.29Å; F122-Y161 HydrophobicContact CB-CE2 4.35Å; F122-Y161 AromaticContact CD2-CE2 3.99Å; F122-Y161 HydrophobicContact CD2-CE2 3.99Å; F122-Y161 AromaticContact CD2-CZ 3.88Å
123	F	91.1	Very high	88.8	Confident	15 Å²	15	79.3 Å²	79.3	7%	0.066	38%	0.379	C	S	.	.	H	α-helix	trans	-57.8	-49.7	178.8	178.4	-103	0	0	0	111.3	Y119 F120 R121 E125 K126 R127 T143 L146	Y119-F123 WeakPolarHBondContact O-CB 3.35Å; Y119-F123 PolarHBondContact O-N 2.84Å; F120-F123 PolarHBondContact O-N 3.35Å; R121-F123 VanDerWaalsContact C-N 3.34Å; F123-E125 PolarHBondContact O-N 2.93Å; F123-K126 PolarHBondContact O-N 3.44Å; F123-R127 HydrophobicContact CE2-CB 4.48Å; F123-R127 HydrophobicContact CZ-CB 4.43Å; F123-R127 HydrophobicContact CZ-CG 4.25Å; F123-R127 WeakPolarHBondContact O-CA 3.37Å; F123-R127 WeakPolarHBondContact O-CB 3.48Å; F123-R127 PolarHBondContact O-N 3.29Å; F123-T143 HydrophobicContact CE2-CG2 3.91Å; F123-T143 HydrophobicContact CZ-CG2 4.2Å; F123-T143 WeakPolarHBondContact CZ-OG1 3.45Å; F123-L146 HydrophobicContact CD2-CB 3.84Å; F123-L146 HydrophobicContact CD2-CD1 3.57Å; F123-L146 HydrophobicContact CD2-CG 4.35Å; F123-L146 HydrophobicContact CE2-CB 4.23Å; F123-L146 HydrophobicContact CE2-CD1 3.61Å
124	M	87.9	Confident	88.6	Confident	114 Å²	114	74.1 Å²	74.1	56%	0.562	36%	0.357	S	S	*	.	H	α-helix	trans	-61.9	-40.3	178.4	-74.5	-62.3	-64.4	0	0	112.8	F120 R121 F122	F120-M124 WeakPolarHBondContact O-CB 3.22Å; F120-M124 WeakPolarHBondContact O-CG 3.43Å; F120-M124 PolarHBondContact O-N 3.5Å; R121-M124 PolarHBondContact O-N 3.49Å; F122-M124 PolarHBondContact O-N 3.2Å
125	E	89.4	Confident	88.5	Confident	72 Å²	72	70.8 Å²	70.8	34%	0.336	35%	0.354	S	S	.	.	H	α-helix	trans	-68.7	-36.6	179.7	-162.2	-150.7	121.9	0	0	112.6	R121 F122 F123 K129 Y161	R121-E125 PolarHBondContact O-N 2.83Å; R121-E125 VanDerWaalsContact O-N 3.17Å; F122-E125 PolarHBondContact O-N 2.99Å; F123-E125 PolarHBondContact O-N 2.93Å; E125-K129 IonicContact OE1-NZ 3.96Å; E125-K129 PolarHBondContact OE1-NZ 3.3Å; E125-Y161 PolarHBondContact OE2-OH 3.28Å
126	K	89.1	Confident	88.3	Confident	51 Å²	51	79 Å²	79	22%	0.222	39%	0.39	C	S	.	.	H	α-helix	trans	-93.7	-32.4	-175.2	-61.7	-48.1	-176	-159.6	0	113.6	F122 F123 A128 K129 Y130 L146	F122-K126 HydrophobicContact CD2-CG 3.82Å; F122-K126 HydrophobicContact CE1-CG 4.33Å; F122-K126 HydrophobicContact CE2-CD 4.3Å; F122-K126 HydrophobicContact CE2-CG 3.43Å; F122-K126 VanDerWaalsContact CE2-CG 3.43Å; F122-K126 HydrophobicContact CG-CG 4.42Å; F122-K126 HydrophobicContact CZ-CB 4.42Å; F122-K126 HydrophobicContact CZ-CG 3.73Å; F122-K126 WeakPolarHBondContact O-CB 3.33Å; F122-K126 WeakPolarHBondContact O-CG 3.33Å; F122-K126 PolarHBondContact O-N 3.45Å; F123-K126 PolarHBondContact O-N 3.44Å; K126-A128 VanDerWaalsContact C-N 3.31Å; K126-A128 PolarHBondContact O-N 2.96Å; K126-K129 WeakPolarHBondContact O-CA 3.24Å; K126-K129 WeakPolarHBondContact O-CB 3.5Å; K126-K129 PolarHBondContact O-N 3.21Å; K126-Y130 HydrophobicContact CB-CD2 4.19Å; K126-Y130 HydrophobicContact CB-CE2 4.4Å; K126-Y130 WeakPolarHBondContact O-CD2 3.45Å; K126-Y130 PolarHBondContact O-N 3.07Å; K126-L146 HydrophobicContact CB-CD2 3.58Å
127	R	86.8	Confident	88	Confident	82 Å²	82	79 Å²	79	31%	0.309	39%	0.388	S	S	.	.	H	α-helix	trans	-52	-47.7	179	177.8	-161.1	170.5	114.4	-9.3	112	F123 K129 Y130 A131 N139 L146	F123-R127 HydrophobicContact CE2-CB 4.48Å; F123-R127 HydrophobicContact CZ-CB 4.43Å; F123-R127 HydrophobicContact CZ-CG 4.25Å; F123-R127 WeakPolarHBondContact O-CA 3.37Å; F123-R127 WeakPolarHBondContact O-CB 3.48Å; F123-R127 PolarHBondContact O-N 3.29Å; R127-K129 PolarHBondContact O-N 2.61Å; R127-Y130 PolarHBondContact O-N 3.07Å; R127-A131 VanDerWaalsContact O-CB 3.24Å; R127-A131 WeakPolarHBondContact O-CB 3.41Å; R127-A131 PolarHBondContact O-N 3.37Å; R127-N139 VanDerWaalsContact CZ-ND2 3.28Å; R127-N139 PolarHBondContact NH1-OD1 3.14Å; R127-N139 VanDerWaalsContact NH2-CG 3.33Å; R127-N139 PolarHBondContact NH2-ND2 2.87Å; R127-N139 PolarHBondContact NH2-OD1 2.99Å; R127-N139 VanDerWaalsContact NH2-OD1 3.09Å; R127-L146 HydrophobicContact CB-CD1 3.9Å
128	A	86.7	Confident	87.8	Confident	59 Å²	59	78.8 Å²	78.8	49%	0.488	39%	0.39	S	S	.	.	H	α-helix	trans	-63	-27	-179.7	0	0	0	0	0	113.3	K126 K132	K126-A128 VanDerWaalsContact C-N 3.31Å; K126-A128 PolarHBondContact O-N 2.96Å; A128-K132 WeakPolarHBondContact O-CG 3.5Å
129	K	87	Confident	87.3	Confident	111 Å²	111	81.7 Å²	81.7	48%	0.483	40%	0.404	S	S	.	.	H	α-helix	trans	-82.2	-44.6	176.9	-63.6	172.8	-177.5	167.6	0	110.6	E125 K126 R127 K132 I133	E125-K129 IonicContact OE1-NZ 3.96Å; E125-K129 PolarHBondContact OE1-NZ 3.3Å; K126-K129 WeakPolarHBondContact O-CA 3.24Å; K126-K129 WeakPolarHBondContact O-CB 3.5Å; K126-K129 PolarHBondContact O-N 3.21Å; R127-K129 PolarHBondContact O-N 2.61Å; K129-K132 PolarHBondContact O-N 3.07Å; K129-I133 WeakPolarHBondContact O-CD1 3.42Å; K129-I133 VanDerWaalsContact O-CG1 3.3Å; K129-I133 WeakPolarHBondContact O-CG1 3.19Å; K129-I133 PolarHBondContact O-N 3.47Å; K129-I133 VanDerWaalsContact O-N 3.16Å
130	Y	85.1	Confident	87	Confident	67 Å²	67	84.6 Å²	84.6	26%	0.263	42%	0.423	S	S	.	.	H	α-helix	trans	-68.7	-34.8	179.2	-86.2	-103.2	0	0	0	112.8	K126 R127 K132 I133 H134 I145 L146	K126-Y130 HydrophobicContact CB-CD2 4.19Å; K126-Y130 HydrophobicContact CB-CE2 4.4Å; K126-Y130 WeakPolarHBondContact O-CD2 3.45Å; K126-Y130 PolarHBondContact O-N 3.07Å; R127-Y130 PolarHBondContact O-N 3.07Å; Y130-K132 VanDerWaalsContact C-N 3.25Å; Y130-K132 PolarHBondContact O-N 3.23Å; Y130-I133 PolarHBondContact O-N 3.44Å; Y130-H134 PolarHBondContact O-N 3.15Å; Y130-I145 HydrophobicContact CD1-CG2 4.45Å; Y130-I145 HydrophobicContact CE1-CG2 4.23Å; Y130-L146 HydrophobicContact CD2-CD2 3.92Å; Y130-L146 HydrophobicContact CE2-CD2 4.12Å; Y130-L146 HydrophobicContact CG-CD2 4.17Å
131	A	87.9	Confident	87	Confident	38 Å²	38	82.1 Å²	82.1	31%	0.314	41%	0.414	S	S	.	.	H	α-helix	trans	-64.3	-28.8	173.2	0	0	0	0	0	112.8	R127 H134 P135 L142	R127-A131 VanDerWaalsContact O-CB 3.24Å; R127-A131 WeakPolarHBondContact O-CB 3.41Å; R127-A131 PolarHBondContact O-N 3.37Å; A131-H134 CarbonylContact O-C 3.59Å; A131-P135 WeakPolarHBondContact O-CA 3.49Å; A131-L142 HydrophobicContact CB-CD1 3.94Å
132	K	88.4	Confident	86.8	Confident	174 Å²	174	80.1 Å²	80.1	76%	0.757	41%	0.407	S	S	*	.	H	α-helix	trans	-79.4	-31.7	174.5	-70.4	178.1	-178.4	-172.5	0	112.9	A128 K129 Y130 P135	A128-K132 WeakPolarHBondContact O-CG 3.5Å; K129-K132 PolarHBondContact O-N 3.07Å; Y130-K132 VanDerWaalsContact C-N 3.25Å; Y130-K132 PolarHBondContact O-N 3.23Å; K132-P135 WeakPolarHBondContact O-CG 3Å
133	I	87.6	Confident	86.7	Confident	115 Å²	115	81.7 Å²	81.7	59%	0.59	42%	0.418	S	S	*	.	H	α-helix	trans	-81	-29.8	179.8	-63.2	163	0	0	0	110.7	K129 Y130	K129-I133 WeakPolarHBondContact O-CD1 3.42Å; K129-I133 VanDerWaalsContact O-CG1 3.3Å; K129-I133 WeakPolarHBondContact O-CG1 3.19Å; K129-I133 PolarHBondContact O-N 3.47Å; K129-I133 VanDerWaalsContact O-N 3.16Å; Y130-I133 PolarHBondContact O-N 3.44Å
134	H	81.1	Confident	86.8	Confident	80 Å²	80	86.7 Å²	86.7	37%	0.37	44%	0.439	S	S	.	.			trans	-126.2	71.3	176	-59.7	-76	0	0	0	111.3	Y130 A131 E136 M137 L142	Y130-H134 PolarHBondContact O-N 3.15Å; A131-H134 CarbonylContact O-C 3.59Å; H134-E136 PolarHBondContact O-N 3.18Å; H134-M137 HydrophobicContact CB-CB 3.8Å; H134-M137 HydrophobicContact CB-CG 3.59Å; H134-M137 PolarHBondContact O-N 3.32Å; H134-L142 HydrophobicContact CB-CD2 4.31Å
135	P	84.3	Confident	86.8	Confident	107 Å²	107	83.9 Å²	83.9	70%	0.695	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.3	-180	-19.2	32.6	0	0	0	113.6	A131 K132	A131-P135 WeakPolarHBondContact O-CA 3.49Å; K132-P135 WeakPolarHBondContact O-CG 3Å
136	E	86	Confident	86.8	Confident	199 Å²	199	80.4 Å²	80.4	93%	0.93	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-11.4	178.5	-67.9	-170.8	144.8	0	0	113.7	H134	H134-E136 PolarHBondContact O-N 3.18Å
137	M	82.6	Confident	86.9	Confident	80 Å²	80	79.8 Å²	79.8	39%	0.394	41%	0.412	S	S	.	.	S	Bend	trans	-83.1	136.9	-179.3	-71	-70.3	-76.8	0	0	111	H134 D141 L142 I145	H134-M137 HydrophobicContact CB-CB 3.8Å; H134-M137 HydrophobicContact CB-CG 3.59Å; H134-M137 PolarHBondContact O-N 3.32Å; M137-D141 HydrophobicContact CE-CB 3.62Å; M137-L142 HydrophobicContact CB-CD2 4.28Å; M137-L142 HydrophobicContact CB-CG 4.34Å; M137-I145 HydrophobicContact CE-CD1 3.95Å
138	S	88.3	Confident	87.1	Confident	55 Å²	55	82.7 Å²	82.7	39%	0.385	43%	0.427	S	S	.	.			trans	-65.4	156.5	179.5	84.1	0	0	0	0	111.7	L140 D141 L142	S138-L140 PolarHBondContact O-N 3.15Å; S138-L140 PolarHBondContact OG-N 2.85Å; S138-D141 WeakPolarHBondContact CB-OD2 3.24Å; S138-D141 PolarHBondContact O-N 3.05Å; S138-D141 VanDerWaalsContact O-N 3.13Å; S138-D141 PolarHBondContact OG-N 3.14Å; S138-D141 PolarHBondContact OG-OD2 2.76Å; S138-L142 WeakPolarHBondContact O-CG 3.42Å; S138-L142 PolarHBondContact O-N 2.54Å
139	N	82	Confident	87.3	Confident	80 Å²	80	84 Å²	84	43%	0.428	42%	0.422	S	S	.	.	H	α-helix	trans	-58.9	-35.1	177	-146.8	-95.1	0	0	0	113.1	R127 T143	R127-N139 VanDerWaalsContact CZ-ND2 3.28Å; R127-N139 PolarHBondContact NH1-OD1 3.14Å; R127-N139 VanDerWaalsContact NH2-CG 3.33Å; R127-N139 PolarHBondContact NH2-ND2 2.87Å; R127-N139 PolarHBondContact NH2-OD1 2.99Å; R127-N139 VanDerWaalsContact NH2-OD1 3.09Å; N139-T143 PolarHBondContact O-N 2.93Å; N139-T143 PolarHBondContact O-OG1 2.93Å
140	L	85.8	Confident	87.5	Confident	111 Å²	111	80.4 Å²	80.4	58%	0.581	41%	0.405	S	S	*	.	H	α-helix	trans	-63.7	-44.5	177.7	-162	97.7	0	0	0	110.4	S138 T143 K144	S138-L140 PolarHBondContact O-N 3.15Å; S138-L140 PolarHBondContact OG-N 2.85Å; L140-T143 PolarHBondContact O-N 3.37Å; L140-K144 WeakPolarHBondContact O-CG 3.47Å; L140-K144 PolarHBondContact O-N 3.27Å
141	D	88.1	Confident	87.7	Confident	57 Å²	57	85.2 Å²	85.2	31%	0.305	43%	0.427	S	S	.	.	H	α-helix	trans	-70.8	-38.7	-179.3	-58.8	-43.4	0	0	0	111.8	M137 S138 T143 K144 I145	M137-D141 HydrophobicContact CE-CB 3.62Å; S138-D141 WeakPolarHBondContact CB-OD2 3.24Å; S138-D141 PolarHBondContact O-N 3.05Å; S138-D141 VanDerWaalsContact O-N 3.13Å; S138-D141 PolarHBondContact OG-N 3.14Å; S138-D141 PolarHBondContact OG-OD2 2.76Å; D141-T143 VanDerWaalsContact C-N 3.26Å; D141-T143 PolarHBondContact O-N 3.36Å; D141-K144 PolarHBondContact O-N 3.05Å; D141-I145 WeakPolarHBondContact O-CD1 3.25Å; D141-I145 VanDerWaalsContact O-CG1 3.25Å; D141-I145 WeakPolarHBondContact O-CG1 3.4Å; D141-I145 PolarHBondContact O-N 3.48Å
142	L	86.4	Confident	87.9	Confident	5 Å²	5	89.3 Å²	89.3	3%	0.026	44%	0.44	C	S	.	.	H	α-helix	trans	-59.2	-38.8	171.7	-70.5	177.6	0	0	0	111.8	A131 H134 M137 S138 I145 L146	A131-L142 HydrophobicContact CB-CD1 3.94Å; H134-L142 HydrophobicContact CB-CD2 4.31Å; M137-L142 HydrophobicContact CB-CD2 4.28Å; M137-L142 HydrophobicContact CB-CG 4.34Å; S138-L142 WeakPolarHBondContact O-CG 3.42Å; S138-L142 PolarHBondContact O-N 2.54Å; L142-I145 PolarHBondContact O-N 3Å; L142-L146 WeakPolarHBondContact O-CB 3.45Å; L142-L146 VanDerWaalsContact O-CG 3.26Å; L142-L146 WeakPolarHBondContact O-CG 3.12Å; L142-L146 PolarHBondContact O-N 3.19Å
143	T	89.4	Confident	88	Confident	44 Å²	44	82.5 Å²	82.5	27%	0.27	41%	0.412	S	S	.	.	H	α-helix	trans	-67.4	-45.6	177.5	-54	0	0	0	0	111.8	F123 N139 L140 D141 I145 L146 S147	F123-T143 HydrophobicContact CE2-CG2 3.91Å; F123-T143 HydrophobicContact CZ-CG2 4.2Å; F123-T143 WeakPolarHBondContact CZ-OG1 3.45Å; N139-T143 PolarHBondContact O-N 2.93Å; N139-T143 PolarHBondContact O-OG1 2.93Å; L140-T143 PolarHBondContact O-N 3.37Å; D141-T143 VanDerWaalsContact C-N 3.26Å; D141-T143 PolarHBondContact O-N 3.36Å; T143-I145 VanDerWaalsContact C-N 3.34Å; T143-I145 PolarHBondContact O-N 2.72Å; T143-L146 PolarHBondContact O-N 2.99Å; T143-S147 WeakPolarHBondContact O-CB 3.26Å; T143-S147 PolarHBondContact O-N 3.21Å; T143-S147 PolarHBondContact O-OG 3.45Å
144	K	92.1	Very high	88.2	Confident	119 Å²	119	80.5 Å²	80.5	52%	0.517	41%	0.406	S	S	.	.	H	α-helix	trans	-58.6	-43.7	174.4	-70.2	174	-178	175.4	0	112.3	L140 D141 K148	L140-K144 WeakPolarHBondContact O-CG 3.47Å; L140-K144 PolarHBondContact O-N 3.27Å; D141-K144 PolarHBondContact O-N 3.05Å; K144-K148 PolarHBondContact O-N 3.26Å; K144-K148 VanDerWaalsContact O-N 3.15Å
145	I	88.3	Confident	88.6	Confident	55 Å²	55	82.4 Å²	82.4	28%	0.282	42%	0.419	S	S	.	.	H	α-helix	trans	-64.2	-46	178	-68.1	165.1	0	0	0	110.7	Y130 M137 D141 L142 T143 K148 K149	Y130-I145 HydrophobicContact CD1-CG2 4.45Å; Y130-I145 HydrophobicContact CE1-CG2 4.23Å; M137-I145 HydrophobicContact CE-CD1 3.95Å; D141-I145 WeakPolarHBondContact O-CD1 3.25Å; D141-I145 VanDerWaalsContact O-CG1 3.25Å; D141-I145 WeakPolarHBondContact O-CG1 3.4Å; D141-I145 PolarHBondContact O-N 3.48Å; L142-I145 PolarHBondContact O-N 3Å; T143-I145 VanDerWaalsContact C-N 3.34Å; T143-I145 PolarHBondContact O-N 2.72Å; I145-K148 PolarHBondContact O-N 3.17Å; I145-K149 HydrophobicContact CG2-CG 4.28Å; I145-K149 WeakPolarHBondContact O-CB 3.4Å; I145-K149 VanDerWaalsContact O-CG 3.24Å; I145-K149 WeakPolarHBondContact O-CG 3.43Å; I145-K149 PolarHBondContact O-N 3.07Å
146	L	90.1	Very high	88.9	Confident	0 Å²	0	86.4 Å²	86.4	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-68.5	-34.5	-179.2	-72.8	170.2	0	0	0	112.7	F122 F123 K126 R127 Y130 L142 T143 K149 Y150	F122-L146 HydrophobicContact CE1-CD2 4.23Å; F123-L146 HydrophobicContact CD2-CB 3.84Å; F123-L146 HydrophobicContact CD2-CD1 3.57Å; F123-L146 HydrophobicContact CD2-CG 4.35Å; F123-L146 HydrophobicContact CE2-CB 4.23Å; F123-L146 HydrophobicContact CE2-CD1 3.61Å; K126-L146 HydrophobicContact CB-CD2 3.58Å; R127-L146 HydrophobicContact CB-CD1 3.9Å; Y130-L146 HydrophobicContact CD2-CD2 3.92Å; Y130-L146 HydrophobicContact CE2-CD2 4.12Å; Y130-L146 HydrophobicContact CG-CD2 4.17Å; L142-L146 WeakPolarHBondContact O-CB 3.45Å; L142-L146 VanDerWaalsContact O-CG 3.26Å; L142-L146 WeakPolarHBondContact O-CG 3.12Å; L142-L146 PolarHBondContact O-N 3.19Å; T143-L146 PolarHBondContact O-N 2.99Å; L146-K149 PolarHBondContact O-N 2.91Å; L146-Y150 WeakPolarHBondContact O-CB 3.49Å; L146-Y150 PolarHBondContact O-N 3.16Å
147	S	90.9	Very high	89.1	Confident	38 Å²	38	83 Å²	83	27%	0.266	41%	0.408	S	S	.	.	H	α-helix	trans	-60	-50.2	171.1	-63.1	0	0	0	0	112.1	Y119 T143 K149 Y150 K151	Y119-S147 PolarHBondContact OH-OG 3.09Å; T143-S147 WeakPolarHBondContact O-CB 3.26Å; T143-S147 PolarHBondContact O-N 3.21Å; T143-S147 PolarHBondContact O-OG 3.45Å; S147-K149 PolarHBondContact O-N 3.11Å; S147-Y150 PolarHBondContact O-N 3.39Å; S147-K151 PolarHBondContact O-N 3.07Å
148	K	91.9	Very high	89.5	Confident	143 Å²	143	81 Å²	81	62%	0.622	40%	0.397	S	S	*	.	H	α-helix	trans	-60.6	-45.8	176.1	-71.1	-176.4	179.3	-174	0	111.3	K144 I145 Y150 K151 E152	K144-K148 PolarHBondContact O-N 3.26Å; K144-K148 VanDerWaalsContact O-N 3.15Å; I145-K148 PolarHBondContact O-N 3.17Å; K148-Y150 VanDerWaalsContact C-N 3.29Å; K148-Y150 PolarHBondContact O-N 2.85Å; K148-K151 PolarHBondContact O-N 3.24Å; K148-E152 WeakPolarHBondContact O-CG 3.33Å; K148-E152 PolarHBondContact O-N 3.01Å
149	K	89.4	Confident	89.7	Confident	87 Å²	87	83.1 Å²	83.1	38%	0.378	40%	0.401	S	S	.	.	H	α-helix	trans	-61.2	-35.9	178	-72.6	-73.4	159.1	-140.8	0	112.9	F122 I145 L146 S147 E152 L153	F122-K149 HydrophobicContact CZ-CB 4.45Å; I145-K149 HydrophobicContact CG2-CG 4.28Å; I145-K149 WeakPolarHBondContact O-CB 3.4Å; I145-K149 VanDerWaalsContact O-CG 3.24Å; I145-K149 WeakPolarHBondContact O-CG 3.43Å; I145-K149 PolarHBondContact O-N 3.07Å; L146-K149 PolarHBondContact O-N 2.91Å; S147-K149 PolarHBondContact O-N 3.11Å; K149-E152 IonicContact NZ-OE2 3.21Å; K149-E152 PolarHBondContact NZ-OE2 2.88Å; K149-L153 WeakPolarHBondContact O-CG 3.44Å; K149-L153 PolarHBondContact O-N 3.26Å
150	Y	91.2	Very high	90.2	Very high	35 Å²	35	85.1 Å²	85.1	14%	0.137	41%	0.405	C	S	.	.	H	α-helix	trans	-69.8	-41.9	175.3	-175.4	-100.1	0	0	0	112.2	P118 Y119 F122 L146 S147 K148 E152 L153 K158	P118-Y150 WeakPolarHBondContact CB-OH 3.42Å; Y119-Y150 AromaticContact CD2-CD1 3.6Å; Y119-Y150 HydrophobicContact CD2-CD1 3.6Å; Y119-Y150 HydrophobicContact CD2-CD2 4.16Å; Y119-Y150 HydrophobicContact CD2-CE1 4.2Å; Y119-Y150 AromaticContact CD2-CG 3.57Å; Y119-Y150 HydrophobicContact CD2-CG 3.57Å; Y119-Y150 HydrophobicContact CE2-CG 4.31Å; Y119-Y150 HydrophobicContact CG-CD1 4.3Å; F122-Y150 HydrophobicContact CB-CD2 3.75Å; F122-Y150 HydrophobicContact CB-CE2 3.94Å; F122-Y150 AromaticContact CD1-CD2 3.53Å; F122-Y150 HydrophobicContact CD1-CD2 3.53Å; F122-Y150 HydrophobicContact CD1-CG 4.08Å; F122-Y150 HydrophobicContact CD2-CD2 4.31Å; F122-Y150 HydrophobicContact CE1-CD2 4.18Å; F122-Y150 HydrophobicContact CE1-CG 4.48Å; F122-Y150 AromaticContact CG-CD2 3.59Å; F122-Y150 HydrophobicContact CG-CD2 3.59Å; F122-Y150 HydrophobicContact CG-CE2 4.25Å; L146-Y150 WeakPolarHBondContact O-CB 3.49Å; L146-Y150 PolarHBondContact O-N 3.16Å; S147-Y150 PolarHBondContact O-N 3.39Å; K148-Y150 VanDerWaalsContact C-N 3.29Å; K148-Y150 PolarHBondContact O-N 2.85Å; Y150-E152 VanDerWaalsContact C-N 3.3Å; Y150-E152 PolarHBondContact O-N 3.5Å; Y150-L153 HydrophobicContact CD2-CD1 3.87Å; Y150-L153 HydrophobicContact CE2-CD1 4.47Å; Y150-L153 WeakPolarHBondContact O-CB 3.27Å; Y150-L153 PolarHBondContact O-N 3.49Å; Y150-L153 VanDerWaalsContact O-N 3.16Å; Y150-K158 WeakPolarHBondContact O-CE 3.28Å
151	K	90.6	Very high	90.4	Very high	167 Å²	167	80.7 Å²	80.7	73%	0.726	38%	0.381	S	S	*	.	H	α-helix	trans	-59.9	-41.8	174.7	-70	-173.8	179.4	-169.8	0	111.4	S147 K148 L153 K158	S147-K151 PolarHBondContact O-N 3.07Å; K148-K151 PolarHBondContact O-N 3.24Å; K151-L153 VanDerWaalsContact C-N 3.29Å; K151-L153 PolarHBondContact O-N 3.16Å; K151-K158 PolarHBondContact O-NZ 3.02Å
152	E	91.9	Very high	90.6	Very high	125 Å²	125	80.4 Å²	80.4	58%	0.584	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-9.9	176.7	-69.4	169.5	-169.7	0	0	114.7	K148 K149 Y150	K148-E152 WeakPolarHBondContact O-CG 3.33Å; K148-E152 PolarHBondContact O-N 3.01Å; K149-E152 IonicContact NZ-OE2 3.21Å; K149-E152 PolarHBondContact NZ-OE2 2.88Å; Y150-E152 VanDerWaalsContact C-N 3.3Å; Y150-E152 PolarHBondContact O-N 3.5Å
153	L	89.8	Confident	90.9	Very high	30 Å²	30	83.8 Å²	83.8	16%	0.157	40%	0.4	C	S	.	.	S	Bend	trans	-66.3	138.8	-179.3	-84.2	171.8	0	0	0	111.1	F122 K149 Y150 K151 K157 K158	F122-L153 HydrophobicContact CD2-CD1 3.79Å; F122-L153 HydrophobicContact CE2-CD1 3.55Å; F122-L153 HydrophobicContact CE2-CG 4.47Å; F122-L153 HydrophobicContact CG-CD1 4.41Å; F122-L153 HydrophobicContact CZ-CD1 3.97Å; K149-L153 WeakPolarHBondContact O-CG 3.44Å; K149-L153 PolarHBondContact O-N 3.26Å; Y150-L153 HydrophobicContact CD2-CD1 3.87Å; Y150-L153 HydrophobicContact CE2-CD1 4.47Å; Y150-L153 WeakPolarHBondContact O-CB 3.27Å; Y150-L153 PolarHBondContact O-N 3.49Å; Y150-L153 VanDerWaalsContact O-N 3.16Å; K151-L153 VanDerWaalsContact C-N 3.29Å; K151-L153 PolarHBondContact O-N 3.16Å; L153-K157 HydrophobicContact CD2-CB 4.31Å; L153-K157 HydrophobicContact CD2-CD 4.03Å; L153-K158 HydrophobicContact CB-CD 4.47Å; L153-K158 HydrophobicContact CB-CG 3.86Å; L153-K158 WeakPolarHBondContact O-CE 3.47Å; L153-K158 PolarHBondContact O-NZ 3.31Å; L153-K158 VanDerWaalsContact O-NZ 3.08Å
154	P	92.7	Very high	90.9	Very high	73 Å²	73	84.4 Å²	84.4	47%	0.474	40%	0.4	S	S	.	.			trans	-57	142.1	169.8	-23.6	32.1	0	0	0	111.5	K156 K157 K158	P154-K156 PolarHBondContact O-N 3.38Å; P154-K156 VanDerWaalsContact O-N 3.13Å; P154-K157 WeakPolarHBondContact O-CA 3.47Å; P154-K157 WeakPolarHBondContact O-CB 3.37Å; P154-K157 PolarHBondContact O-N 3.46Å; P154-K158 PolarHBondContact O-N 3.29Å; P154-K158 VanDerWaalsContact O-N 3.09Å
155	D	89	Confident	91	Very high	120 Å²	120	81.2 Å²	81.2	64%	0.642	39%	0.386	S	S	*	.	H	α-helix	trans	-58.4	-33.7	-176.9	-63.2	-24.1	0	0	0	112.3	K157 K158 Q159	D155-K157 VanDerWaalsContact C-N 3.25Å; D155-K157 PolarHBondContact O-N 3.42Å; D155-K158 PolarHBondContact O-N 2.9Å; D155-K158 VanDerWaalsContact O-N 3.17Å; D155-K158 IonicContact OD1-NZ 3.13Å; D155-Q159 VanDerWaalsContact O-CB 3.29Å; D155-Q159 WeakPolarHBondContact O-CB 3.3Å; D155-Q159 PolarHBondContact O-N 3.34Å
156	K	90.9	Very high	91.1	Very high	192 Å²	192	83.3 Å²	83.3	84%	0.835	40%	0.395	S	S	*	.	H	α-helix	trans	-58.8	-33.3	173.5	-168.3	172.3	-176.3	174.4	0	113.5	P154	P154-K156 PolarHBondContact O-N 3.38Å; P154-K156 VanDerWaalsContact O-N 3.13Å
157	K	89.6	Confident	91.2	Very high	127 Å²	127	89.5 Å²	89.5	55%	0.552	42%	0.418	S	S	*	.	H	α-helix	trans	-82.5	-36.8	176	-68	-174.9	-178.2	172.9	0	111.5	L153 P154 D155 Q159 K160 Y161	L153-K157 HydrophobicContact CD2-CB 4.31Å; L153-K157 HydrophobicContact CD2-CD 4.03Å; P154-K157 WeakPolarHBondContact O-CA 3.47Å; P154-K157 WeakPolarHBondContact O-CB 3.37Å; P154-K157 PolarHBondContact O-N 3.46Å; D155-K157 VanDerWaalsContact C-N 3.25Å; D155-K157 PolarHBondContact O-N 3.42Å; K157-Q159 VanDerWaalsContact C-N 3.31Å; K157-K160 PolarHBondContact O-N 2.97Å; K157-Y161 VanDerWaalsContact O-CD2 3.26Å; K157-Y161 WeakPolarHBondContact O-CD2 3.43Å; K157-Y161 WeakPolarHBondContact O-CE2 3.42Å
158	K	91.1	Very high	91.3	Very high	39 Å²	39	89.9 Å²	89.9	17%	0.17	42%	0.415	C	S	.	.	H	α-helix	trans	-61.5	-41	172.1	-68.3	175.1	177.9	155.8	0	111.2	Y150 K151 L153 P154 D155 K160 Y161 I162	Y150-K158 WeakPolarHBondContact O-CE 3.28Å; K151-K158 PolarHBondContact O-NZ 3.02Å; L153-K158 HydrophobicContact CB-CD 4.47Å; L153-K158 HydrophobicContact CB-CG 3.86Å; L153-K158 WeakPolarHBondContact O-CE 3.47Å; L153-K158 PolarHBondContact O-NZ 3.31Å; L153-K158 VanDerWaalsContact O-NZ 3.08Å; P154-K158 PolarHBondContact O-N 3.29Å; P154-K158 VanDerWaalsContact O-N 3.09Å; D155-K158 PolarHBondContact O-N 2.9Å; D155-K158 VanDerWaalsContact O-N 3.17Å; D155-K158 IonicContact OD1-NZ 3.13Å; K158-K160 PolarHBondContact O-N 3.02Å; K158-Y161 PolarHBondContact O-N 3.5Å; K158-I162 HydrophobicContact CB-CD1 4.42Å; K158-I162 WeakPolarHBondContact O-CG1 3.46Å; K158-I162 PolarHBondContact O-N 3.19Å
159	Q	91.8	Very high	91.2	Very high	99 Å²	99	87.8 Å²	87.8	46%	0.463	41%	0.406	S	S	.	.	H	α-helix	trans	-55.8	-37	-179.1	-164.8	65	12	0	0	112.3	D155 K157 Y161 I162 T163	D155-Q159 VanDerWaalsContact O-CB 3.29Å; D155-Q159 WeakPolarHBondContact O-CB 3.3Å; D155-Q159 PolarHBondContact O-N 3.34Å; K157-Q159 VanDerWaalsContact C-N 3.31Å; Q159-Y161 PolarHBondContact O-N 3.46Å; Q159-I162 PolarHBondContact O-N 3.39Å; Q159-T163 WeakPolarHBondContact O-CB 3.4Å; Q159-T163 PolarHBondContact O-N 2.59Å; Q159-T163 PolarHBondContact O-OG1 3.13Å; Q159-T163 VanDerWaalsContact O-OG1 3.06Å
160	K	93	Very high	91.3	Very high	121 Å²	121	88.9 Å²	88.9	53%	0.526	41%	0.413	S	S	.	.	H	α-helix	trans	-56	-49.4	174	-174.2	-170.3	173.6	-165	0	111.7	K157 K158 I162 E164	K157-K160 PolarHBondContact O-N 2.97Å; K158-K160 PolarHBondContact O-N 3.02Å; K160-I162 VanDerWaalsContact C-N 3.33Å; K160-E164 WeakPolarHBondContact CE-OE1 3.35Å; K160-E164 IonicContact NZ-OE1 3.3Å; K160-E164 WeakPolarHBondContact O-CB 3.33Å; K160-E164 WeakPolarHBondContact O-CG 3.41Å; K160-E164 PolarHBondContact O-N 3.14Å
161	Y	91.4	Very high	91.2	Very high	19 Å²	19	91.6 Å²	91.6	8%	0.075	43%	0.427	C	S	.	.	H	α-helix	trans	-70.1	-32.3	179.9	-57	-75.3	0	0	0	111.9	R121 F122 E125 K157 K158 Q159 F165	R121-Y161 HydrophobicContact CB-CD1 4.41Å; R121-Y161 HydrophobicContact CG-CD1 3.88Å; F122-Y161 HydrophobicContact CB-CD1 4.47Å; F122-Y161 HydrophobicContact CB-CE1 4.29Å; F122-Y161 HydrophobicContact CB-CE2 4.35Å; F122-Y161 AromaticContact CD2-CE2 3.99Å; F122-Y161 HydrophobicContact CD2-CE2 3.99Å; F122-Y161 AromaticContact CD2-CZ 3.88Å; E125-Y161 PolarHBondContact OE2-OH 3.28Å; K157-Y161 VanDerWaalsContact O-CD2 3.26Å; K157-Y161 WeakPolarHBondContact O-CD2 3.43Å; K157-Y161 WeakPolarHBondContact O-CE2 3.42Å; K158-Y161 PolarHBondContact O-N 3.5Å; Q159-Y161 PolarHBondContact O-N 3.46Å; Y161-F165 WeakPolarHBondContact O-CB 3.33Å; Y161-F165 PolarHBondContact O-N 3.15Å
162	I	91.2	Very high	91.2	Very high	51 Å²	51	85.5 Å²	85.5	26%	0.262	40%	0.401	S	S	.	.	H	α-helix	trans	-66	-48.9	175.2	-64	168	0	0	0	110.9	P118 K158 Q159 K160 E164 F165 Q166	P118-I162 HydrophobicContact CB-CG1 4.04Å; P118-I162 HydrophobicContact CG-CB 4.43Å; P118-I162 HydrophobicContact CG-CG1 3.96Å; K158-I162 HydrophobicContact CB-CD1 4.42Å; K158-I162 WeakPolarHBondContact O-CG1 3.46Å; K158-I162 PolarHBondContact O-N 3.19Å; Q159-I162 PolarHBondContact O-N 3.39Å; K160-I162 VanDerWaalsContact C-N 3.33Å; I162-E164 PolarHBondContact O-N 2.95Å; I162-F165 PolarHBondContact O-N 2.8Å; I162-Q166 WeakPolarHBondContact O-CG 3.43Å; I162-Q166 PolarHBondContact O-N 3.41Å
163	T	92.4	Very high	91.1	Very high	75 Å²	75	84.4 Å²	84.4	46%	0.46	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-40.5	178.2	-57.3	0	0	0	0	111.7	Q159 Q166 R167	Q159-T163 WeakPolarHBondContact O-CB 3.4Å; Q159-T163 PolarHBondContact O-N 2.59Å; Q159-T163 PolarHBondContact O-OG1 3.13Å; Q159-T163 VanDerWaalsContact O-OG1 3.06Å; T163-Q166 PolarHBondContact O-N 3.19Å; T163-R167 PolarHBondContact O-N 3.02Å
164	E	90.3	Very high	91.1	Very high	57 Å²	57	89.9 Å²	89.9	27%	0.266	42%	0.418	S	S	.	.	H	α-helix	trans	-61.7	-42.3	173.5	-78.9	-176.6	-156.1	0	0	112.4	R121 K160 I162 R167 E168	R121-E164 IonicContact CZ-OE2 3.19Å; R121-E164 IonicContact NE-OE2 2.92Å; R121-E164 PolarHBondContact NE-OE2 3.29Å; R121-E164 IonicContact NH2-OE2 2.63Å; R121-E164 PolarHBondContact NH2-OE2 3.1Å; R121-E164 VanDerWaalsContact NH2-OE2 3.11Å; K160-E164 WeakPolarHBondContact CE-OE1 3.35Å; K160-E164 IonicContact NZ-OE1 3.3Å; K160-E164 WeakPolarHBondContact O-CB 3.33Å; K160-E164 WeakPolarHBondContact O-CG 3.41Å; K160-E164 PolarHBondContact O-N 3.14Å; I162-E164 PolarHBondContact O-N 2.95Å; E164-R167 PolarHBondContact O-N 3.34Å; E164-E168 WeakPolarHBondContact O-CG 3.32Å; E164-E168 PolarHBondContact O-N 3.27Å
165	F	93	Very high	90.8	Very high	52 Å²	52	89.7 Å²	89.7	23%	0.228	41%	0.413	C	S	.	.	H	α-helix	trans	-63.4	-43.7	176.1	170.9	-112.1	0	0	0	112.3	P115 L116 P118 Y161 I162 R167 E168 K169	P115-F165 HydrophobicContact CB-CD2 4.2Å; P115-F165 HydrophobicContact CB-CE2 4.26Å; P115-F165 HydrophobicContact CG-CD2 4.25Å; P115-F165 HydrophobicContact CG-CE2 3.88Å; L116-F165 WeakPolarHBondContact O-CD2 3.45Å; P118-F165 HydrophobicContact CG-CB 3.74Å; P118-F165 HydrophobicContact CG-CD1 4.02Å; P118-F165 HydrophobicContact CG-CG 3.98Å; Y161-F165 WeakPolarHBondContact O-CB 3.33Å; Y161-F165 PolarHBondContact O-N 3.15Å; I162-F165 PolarHBondContact O-N 2.8Å; F165-R167 PolarHBondContact O-N 2.85Å; F165-E168 PolarHBondContact O-N 3.36Å; F165-K169 VanDerWaalsContact O-CB 3.26Å; F165-K169 WeakPolarHBondContact O-CB 3.02Å; F165-K169 PolarHBondContact O-N 3.37Å
166	Q	90.8	Very high	90.7	Very high	100 Å²	100	84.6 Å²	84.6	47%	0.467	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-46.3	176.7	-74.4	174.2	-11.1	0	0	111.2	I162 T163 E168 K169 E170	I162-Q166 WeakPolarHBondContact O-CG 3.43Å; I162-Q166 PolarHBondContact O-N 3.41Å; T163-Q166 PolarHBondContact O-N 3.19Å; Q166-E168 PolarHBondContact O-N 2.68Å; Q166-K169 WeakPolarHBondContact O-CB 3.16Å; Q166-K169 PolarHBondContact O-N 3.13Å; Q166-E170 WeakPolarHBondContact O-CG 3.42Å; Q166-E170 PolarHBondContact O-N 3.5Å
167	R	93.2	Very high	90.4	Very high	130 Å²	130	77.9 Å²	77.9	49%	0.491	37%	0.366	S	S	.	.	H	α-helix	trans	-58.6	-46.7	176.2	-173.2	-170.4	66	73.3	5.1	112.1	T163 E164 F165 K169 E170 E171	T163-R167 PolarHBondContact O-N 3.02Å; E164-R167 PolarHBondContact O-N 3.34Å; F165-R167 PolarHBondContact O-N 2.85Å; R167-K169 VanDerWaalsContact C-N 3.33Å; R167-E170 PolarHBondContact O-N 2.87Å; R167-E171 IonicContact NH1-OE2 3.68Å; R167-E171 PolarHBondContact NH1-OE2 3.34Å; R167-E171 PolarHBondContact O-N 2.86Å
168	E	91.6	Very high	90.3	Very high	45 Å²	45	78.8 Å²	78.8	21%	0.21	37%	0.365	C	S	.	.	H	α-helix	trans	-72.5	-27.4	179.6	-72	-174.5	-175.8	0	0	113.4	P115 R121 E164 F165 Q166 E171 F172	P115-E168 HydrophobicContact CB-CB 3.72Å; R121-E168 IonicContact CZ-OE1 2.64Å; R121-E168 VanDerWaalsContact CZ-OE1 3.26Å; R121-E168 IonicContact CZ-OE2 3.5Å; R121-E168 VanDerWaalsContact NH1-CD 3.28Å; R121-E168 IonicContact NH1-OE1 3.63Å; R121-E168 PolarHBondContact NH1-OE1 3.19Å; R121-E168 IonicContact NH1-OE2 2.68Å; R121-E168 PolarHBondContact NH1-OE2 3.26Å; R121-E168 IonicContact NH2-OE1 3.58Å; R121-E168 PolarHBondContact NH2-OE1 2.84Å; R121-E168 IonicContact NH2-OE2 3.26Å; R121-E168 PolarHBondContact NH2-OE2 3.13Å; E164-E168 WeakPolarHBondContact O-CG 3.32Å; E164-E168 PolarHBondContact O-N 3.27Å; F165-E168 PolarHBondContact O-N 3.36Å; Q166-E168 PolarHBondContact O-N 2.68Å; E168-E171 PolarHBondContact O-N 3.42Å; E168-F172 WeakPolarHBondContact O-CB 3.31Å; E168-F172 PolarHBondContact O-N 3.29Å
169	K	90.1	Very high	90.1	Very high	99 Å²	99	77 Å²	77	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-45.7	171.5	-173.7	-171.8	173.2	-165.5	0	111.2	P115 F165 Q166 R167 E171 F172 E173	P115-K169 HydrophobicContact CG-CB 4.16Å; F165-K169 VanDerWaalsContact O-CB 3.26Å; F165-K169 WeakPolarHBondContact O-CB 3.02Å; F165-K169 PolarHBondContact O-N 3.37Å; Q166-K169 WeakPolarHBondContact O-CB 3.16Å; Q166-K169 PolarHBondContact O-N 3.13Å; R167-K169 VanDerWaalsContact C-N 3.33Å; K169-E171 VanDerWaalsContact C-N 3.33Å; K169-E171 PolarHBondContact O-N 3.39Å; K169-F172 WeakPolarHBondContact O-CB 3.4Å; K169-F172 PolarHBondContact O-N 2.99Å; K169-E173 VanDerWaalsContact CE-OE1 3.28Å; K169-E173 WeakPolarHBondContact CE-OE1 3.48Å; K169-E173 WeakPolarHBondContact O-CG 3.45Å; K169-E173 PolarHBondContact O-N 2.95Å
170	E	91.3	Very high	89.6	Confident	111 Å²	111	78.6 Å²	78.6	52%	0.519	36%	0.36	S	S	.	.	H	α-helix	trans	-62.5	-41	174.3	-69.8	174.6	-163.3	0	0	112	Q166 R167 E173 K174	Q166-E170 WeakPolarHBondContact O-CG 3.42Å; Q166-E170 PolarHBondContact O-N 3.5Å; R167-E170 PolarHBondContact O-N 2.87Å; E170-E173 PolarHBondContact O-N 3.31Å; E170-K174 WeakPolarHBondContact O-CG 3.27Å; E170-K174 PolarHBondContact O-N 3.19Å
171	E	90.3	Very high	89.2	Confident	92 Å²	92	80.4 Å²	80.4	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-65.2	-41.6	176	-174.9	167.4	-161.8	0	0	111.8	R167 E168 K169 K174 N175	R167-E171 IonicContact NH1-OE2 3.68Å; R167-E171 PolarHBondContact NH1-OE2 3.34Å; R167-E171 PolarHBondContact O-N 2.86Å; E168-E171 PolarHBondContact O-N 3.42Å; K169-E171 VanDerWaalsContact C-N 3.33Å; K169-E171 PolarHBondContact O-N 3.39Å; E171-K174 PolarHBondContact O-N 3.06Å; E171-N175 WeakPolarHBondContact O-CB 3.13Å; E171-N175 PolarHBondContact O-N 2.9Å; E171-N175 PolarHBondContact O-ND2 3.5Å
172	F	90.6	Very high	88.8	Confident	39 Å²	39	84.5 Å²	84.5	17%	0.171	39%	0.39	C	S	.	.	H	α-helix	trans	-61.3	-43.1	172.7	169.2	-98.7	0	0	0	111.9	P112 K113 K114 P115 E168 K169 N175 M176	P112-F172 HydrophobicContact CB-CD2 3.71Å; P112-F172 HydrophobicContact CB-CE2 3.84Å; P112-F172 WeakPolarHBondContact O-CE2 3.44Å; K113-F172 WeakPolarHBondContact O-CD2 3.24Å; K113-F172 WeakPolarHBondContact O-CE2 3.46Å; K114-F172 HydrophobicContact CG-CE2 4.15Å; K114-F172 HydrophobicContact CG-CZ 3.87Å; P115-F172 HydrophobicContact CG-CB 4.41Å; E168-F172 WeakPolarHBondContact O-CB 3.31Å; E168-F172 PolarHBondContact O-N 3.29Å; K169-F172 WeakPolarHBondContact O-CB 3.4Å; K169-F172 PolarHBondContact O-N 2.99Å; F172-N175 PolarHBondContact O-N 2.81Å; F172-M176 HydrophobicContact CE1-CE 4.31Å; F172-M176 HydrophobicContact CE2-CE 3.51Å; F172-M176 HydrophobicContact CZ-CE 3.39Å; F172-M176 WeakPolarHBondContact O-CB 3.33Å; F172-M176 PolarHBondContact O-N 3.21Å
173	E	88.3	Confident	88.3	Confident	101 Å²	101	84 Å²	84	47%	0.472	39%	0.386	S	S	.	.	H	α-helix	trans	-63.6	-42.7	177.5	-76.2	173.5	-169.4	0	0	111.7	K169 E170 M176 A177	K169-E173 VanDerWaalsContact CE-OE1 3.28Å; K169-E173 WeakPolarHBondContact CE-OE1 3.48Å; K169-E173 WeakPolarHBondContact O-CG 3.45Å; K169-E173 PolarHBondContact O-N 2.95Å; E170-E173 PolarHBondContact O-N 3.31Å; E173-M176 PolarHBondContact O-N 2.9Å; E173-A177 WeakPolarHBondContact O-CB 3.26Å; E173-A177 PolarHBondContact O-N 3.31Å
174	K	89.8	Confident	87.5	Confident	145 Å²	145	84 Å²	84	63%	0.63	39%	0.387	S	S	*	.	H	α-helix	trans	-62.5	-48.2	173.5	-73.3	172.5	-177.8	169.8	0	112	E170 E171 M176 A177 R178	E170-K174 WeakPolarHBondContact O-CG 3.27Å; E170-K174 PolarHBondContact O-N 3.19Å; E171-K174 PolarHBondContact O-N 3.06Å; K174-M176 VanDerWaalsContact C-N 3.28Å; K174-M176 PolarHBondContact O-N 3.36Å; K174-A177 WeakPolarHBondContact O-CB 3.26Å; K174-A177 PolarHBondContact O-N 3.03Å; K174-R178 PolarHBondContact O-N 3.49Å
175	N	87.7	Confident	86.6	Confident	69 Å²	69	86 Å²	86	37%	0.369	40%	0.4	S	S	.	.	H	α-helix	trans	-64.9	-34.1	178.1	-70.7	-22.5	0	0	0	111.6	P112 E171 F172 R178 F179	P112-N175 HydrophobicContact CB-CB 4.04Å; P112-N175 VanDerWaalsContact CG-C 3.49Å; P112-N175 HydrophobicContact CG-CB 3.8Å; P112-N175 WeakPolarHBondContact CG-O 3.38Å; E171-N175 WeakPolarHBondContact O-CB 3.13Å; E171-N175 PolarHBondContact O-N 2.9Å; E171-N175 PolarHBondContact O-ND2 3.5Å; F172-N175 PolarHBondContact O-N 2.81Å; N175-R178 PolarHBondContact O-N 3.33Å; N175-F179 VanDerWaalsContact O-CB 3.32Å; N175-F179 WeakPolarHBondContact O-CB 3.25Å; N175-F179 PolarHBondContact O-N 3.36Å
176	M	85.6	Confident	85.6	Confident	13 Å²	13	84.4 Å²	84.4	6%	0.064	39%	0.394	C	S	.	.	H	α-helix	trans	-72.4	-35.9	176	-171.4	64.4	67.5	0	0	111.7	F111 P112 F172 E173 K174 F179 R180	F111-M176 HydrophobicContact CE1-CE 4.27Å; F111-M176 HydrophobicContact CE2-CE 4.21Å; F111-M176 HydrophobicContact CE2-SD 4.37Å; F111-M176 HydrophobicContact CZ-CE 3.93Å; P112-M176 HydrophobicContact CB-CE 4.06Å; P112-M176 HydrophobicContact CG-CB 4.34Å; P112-M176 HydrophobicContact CG-CE 4.11Å; P112-M176 HydrophobicContact CG-SD 4.44Å; F172-M176 HydrophobicContact CE1-CE 4.31Å; F172-M176 HydrophobicContact CE2-CE 3.51Å; F172-M176 HydrophobicContact CZ-CE 3.39Å; F172-M176 WeakPolarHBondContact O-CB 3.33Å; F172-M176 PolarHBondContact O-N 3.21Å; E173-M176 PolarHBondContact O-N 2.9Å; K174-M176 VanDerWaalsContact C-N 3.28Å; K174-M176 PolarHBondContact O-N 3.36Å; M176-F179 PolarHBondContact O-N 3.23Å; M176-F179 HydrophobicContact SD-CD1 4.4Å; M176-R180 VanDerWaalsContact CG-CZ 3.5Å; M176-R180 VanDerWaalsContact O-CG 3.29Å; M176-R180 WeakPolarHBondContact O-CG 3.28Å; M176-R180 PolarHBondContact O-N 3.46Å
177	A	86	Confident	84.4	Confident	51 Å²	51	82.5 Å²	82.5	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-63.4	-45.9	171.4	0	0	0	0	0	111	E173 K174 F179 R180 E181	E173-A177 WeakPolarHBondContact O-CB 3.26Å; E173-A177 PolarHBondContact O-N 3.31Å; K174-A177 WeakPolarHBondContact O-CB 3.26Å; K174-A177 PolarHBondContact O-N 3.03Å; A177-F179 PolarHBondContact O-N 3.23Å; A177-R180 WeakPolarHBondContact O-CB 3.04Å; A177-R180 PolarHBondContact O-N 3.32Å; A177-E181 PolarHBondContact O-N 3.39Å; A177-E181 VanDerWaalsContact O-N 3.09Å
178	R	86.4	Confident	82.6	Confident	146 Å²	146	81.5 Å²	81.5	55%	0.551	39%	0.386	S	S	*	.	H	α-helix	trans	-59.3	-45.7	174	-168.1	-171.9	-159.4	165.1	14.7	112.2	K174 N175 R180 E181 E182	K174-R178 PolarHBondContact O-N 3.49Å; N175-R178 PolarHBondContact O-N 3.33Å; R178-R180 VanDerWaalsContact C-N 3.28Å; R178-R180 PolarHBondContact O-N 3.3Å; R178-E181 PolarHBondContact O-N 2.8Å; R178-E182 WeakPolarHBondContact CD-OE1 3.38Å; R178-E182 HydrophobicContact CG-CG 4.23Å; R178-E182 VanDerWaalsContact CG-OE1 3.26Å; R178-E182 WeakPolarHBondContact CG-OE1 3.41Å; R178-E182 IonicContact CZ-OE1 3.52Å; R178-E182 IonicContact NE-OE1 3.12Å; R178-E182 PolarHBondContact NE-OE1 3.4Å; R178-E182 IonicContact NE-OE2 3.43Å; R178-E182 IonicContact NH2-OE1 3.03Å; R178-E182 WeakPolarHBondContact O-CB 3.39Å; R178-E182 WeakPolarHBondContact O-CG 3.44Å; R178-E182 PolarHBondContact O-N 3.48Å
179	F	86.9	Confident	80.5	Confident	3 Å²	3	87.7 Å²	87.7	1%	0.013	42%	0.415	C	S	.	.	H	α-helix	trans	-60.7	-37.4	177	-177.6	-97.2	0	0	0	112.4	L105 H108 D110 F111 P112 N175 M176 A177 E181 H183 L186 M187	L105-F179 HydrophobicContact CD1-CE1 4.14Å; L105-F179 HydrophobicContact CD1-CZ 4.04Å; H108-F179 HydrophobicContact CB-CE2 4.45Å; H108-F179 HydrophobicContact CB-CZ 4.41Å; H108-F179 AromaticContact CE1-CE2 3.98Å; H108-F179 AromaticContact CG-CE2 3.99Å; H108-F179 AromaticContact ND1-CE2 3.55Å; D110-F179 HydrophobicContact CB-CD2 4.13Å; D110-F179 HydrophobicContact CB-CE2 4.26Å; D110-F179 WeakPolarHBondContact O-CD2 3.44Å; F111-F179 HydrophobicContact CB-CE2 4.33Å; F111-F179 HydrophobicContact CB-CZ 4.29Å; F111-F179 HydrophobicContact CD2-CD1 4.17Å; F111-F179 AromaticContact CD2-CE1 3.65Å; F111-F179 HydrophobicContact CD2-CE1 3.65Å; F111-F179 AromaticContact CD2-CZ 3.89Å; F111-F179 HydrophobicContact CD2-CZ 3.89Å; F111-F179 HydrophobicContact CE2-CE1 4.26Å; P112-F179 HydrophobicContact CG-CB 4.18Å; N175-F179 VanDerWaalsContact O-CB 3.32Å; N175-F179 WeakPolarHBondContact O-CB 3.25Å; N175-F179 PolarHBondContact O-N 3.36Å; M176-F179 PolarHBondContact O-N 3.23Å; M176-F179 HydrophobicContact SD-CD1 4.4Å; A177-F179 PolarHBondContact O-N 3.23Å; F179-E181 VanDerWaalsContact C-N 3.32Å; F179-H183 AromaticContact CD2-CD2 3.41Å; F179-H183 VanDerWaalsContact CD2-CD2 3.41Å; F179-H183 WeakPolarHBondContact CD2-CD2 3.5Å; F179-H183 HydrophobicContact CE2-CB 4.31Å; F179-H183 AromaticContact CE2-CD2 3.37Å; F179-H183 WeakPolarHBondContact CE2-CD2 3.36Å; F179-H183 AromaticContact CE2-CG 3.94Å; F179-H183 AromaticContact CE2-NE2 3.98Å; F179-H183 HydrophobicContact CZ-CB 4.26Å; F179-H183 WeakPolarHBondContact O-CB 3.3Å; F179-H183 PolarHBondContact O-N 3.3Å; F179-L186 HydrophobicContact CZ-CD1 4.47Å; F179-M187 HydrophobicContact CD1-CG 4.28Å; F179-M187 HydrophobicContact CD1-SD 4.09Å; F179-M187 HydrophobicContact CE1-CG 4.12Å; F179-M187 HydrophobicContact CE1-SD 3.83Å
180	R	81.9	Confident	78.3	Confident	132 Å²	132	91.7 Å²	91.7	50%	0.498	43%	0.428	S	S	.	.	H	α-helix	trans	-65	-35.8	173.8	-74.9	173.8	-170	122	-3.5	112.9	M176 A177 R178 M187	M176-R180 VanDerWaalsContact CG-CZ 3.5Å; M176-R180 VanDerWaalsContact O-CG 3.29Å; M176-R180 WeakPolarHBondContact O-CG 3.28Å; M176-R180 PolarHBondContact O-N 3.46Å; A177-R180 WeakPolarHBondContact O-CB 3.04Å; A177-R180 PolarHBondContact O-N 3.32Å; R178-R180 VanDerWaalsContact C-N 3.28Å; R178-R180 PolarHBondContact O-N 3.3Å; R180-M187 HydrophobicContact CG-CE 3.47Å; R180-M187 VanDerWaalsContact CG-CE 3.47Å; R180-M187 HydrophobicContact CG-CG 4.13Å; R180-M187 HydrophobicContact CG-SD 4.45Å
181	E	84.8	Confident	75.9	Confident	159 Å²	159	94.2 Å²	94.2	74%	0.743	44%	0.437	S	S	*	.	H	α-helix	trans	-76.7	-41.6	178.9	-172.3	176.3	-176.5	0	0	112.2	A177 R178 F179 P184	A177-E181 PolarHBondContact O-N 3.39Å; A177-E181 VanDerWaalsContact O-N 3.09Å; R178-E181 PolarHBondContact O-N 2.8Å; F179-E181 VanDerWaalsContact C-N 3.32Å; E181-P184 WeakPolarHBondContact O-CD 3.3Å
182	E	82.2	Confident	73.3	Confident	105 Å²	105	98.7 Å²	98.7	49%	0.491	46%	0.455	S	S	.	.	H	α-helix	trans	-79.5	-24.8	-177.7	-70	174.5	178.6	0	0	112.8	R178 P184	R178-E182 WeakPolarHBondContact CD-OE1 3.38Å; R178-E182 HydrophobicContact CG-CG 4.23Å; R178-E182 VanDerWaalsContact CG-OE1 3.26Å; R178-E182 WeakPolarHBondContact CG-OE1 3.41Å; R178-E182 IonicContact CZ-OE1 3.52Å; R178-E182 IonicContact NE-OE1 3.12Å; R178-E182 PolarHBondContact NE-OE1 3.4Å; R178-E182 IonicContact NE-OE2 3.43Å; R178-E182 IonicContact NH2-OE1 3.03Å; R178-E182 WeakPolarHBondContact O-CB 3.39Å; R178-E182 WeakPolarHBondContact O-CG 3.44Å; R178-E182 PolarHBondContact O-N 3.48Å; E182-P184 VanDerWaalsContact C-CD 3.44Å
183	H	80.6	Confident	70.5	Confident	41 Å²	41	100.5 Å²	100.5	19%	0.19	47%	0.472	C	S	.	.			trans	-128.3	60.6	-179.7	-56.3	-79.9	0	0	0	113.4	H108 D110 F179 D185 L186 M187	H108-H183 AromaticContact CE1-CE1 3.42Å; H108-H183 PolarHBondContact CE1-CE1 2.88Å; H108-H183 VanDerWaalsContact CE1-CE1 3.42Å; H108-H183 AromaticContact CE1-NE2 3.48Å; H108-H183 PolarHBondContact CE1-NE2 2.96Å; H108-H183 AromaticContact NE2-CE1 3.56Å; H108-H183 AromaticContact NE2-ND1 3.86Å; D110-H183 IonicContact OD2-NE2 3.75Å; F179-H183 AromaticContact CD2-CD2 3.41Å; F179-H183 VanDerWaalsContact CD2-CD2 3.41Å; F179-H183 WeakPolarHBondContact CD2-CD2 3.5Å; F179-H183 HydrophobicContact CE2-CB 4.31Å; F179-H183 AromaticContact CE2-CD2 3.37Å; F179-H183 WeakPolarHBondContact CE2-CD2 3.36Å; F179-H183 AromaticContact CE2-CG 3.94Å; F179-H183 AromaticContact CE2-NE2 3.98Å; F179-H183 HydrophobicContact CZ-CB 4.26Å; F179-H183 WeakPolarHBondContact O-CB 3.3Å; F179-H183 PolarHBondContact O-N 3.3Å; H183-D185 VanDerWaalsContact C-N 3.3Å; H183-D185 PolarHBondContact O-N 3.39Å; H183-L186 HydrophobicContact CB-CB 4.13Å; H183-L186 HydrophobicContact CB-CD1 4.01Å; H183-L186 HydrophobicContact CB-CG 4.25Å; H183-L186 PolarHBondContact O-N 3.19Å; H183-M187 PolarHBondContact O-N 3.45Å
184	P	77.1	Confident	68.2	Low	73 Å²	73	104.3 Å²	104.3	47%	0.474	50%	0.496	S	S	.	.	H	α-helix	trans	-60.9	-38.3	-179.1	25.2	-33.4	0	0	0	112.1	E181 E182 L186 M187 E188	E181-P184 WeakPolarHBondContact O-CD 3.3Å; E182-P184 VanDerWaalsContact C-CD 3.44Å; P184-L186 PolarHBondContact O-N 2.85Å; P184-M187 PolarHBondContact O-N 3.38Å; P184-M187 VanDerWaalsContact O-N 3.15Å; P184-E188 PolarHBondContact O-N 3.23Å
185	D	70.4	Confident	66.2	Low	100 Å²	100	103.6 Å²	103.6	54%	0.535	50%	0.498	S	S	.	.	H	α-helix	trans	-68.5	-19	-178.7	-64.2	-27.3	0	0	0	114.4	N98 H183	N98-D185 PolarHBondContact ND2-O 2.97Å; H183-D185 VanDerWaalsContact C-N 3.3Å; H183-D185 PolarHBondContact O-N 3.39Å
186	L	71.7	Confident	64.1	Low	19 Å²	19	106.1 Å²	106.1	10%	0.099	52%	0.519	C	S	.	.	H	α-helix	trans	-91.4	-24.7	175.8	-66.5	-176.1	0	0	0	112.1	N98 K101 L105 F179 H183 P184	N98-L186 HydrophobicContact CB-CD2 3.97Å; K101-L186 HydrophobicContact CB-CD2 4.15Å; L105-L186 HydrophobicContact CD1-CB 3.73Å; L105-L186 HydrophobicContact CD1-CD1 4.32Å; F179-L186 HydrophobicContact CZ-CD1 4.47Å; H183-L186 HydrophobicContact CB-CB 4.13Å; H183-L186 HydrophobicContact CB-CD1 4.01Å; H183-L186 HydrophobicContact CB-CG 4.25Å; H183-L186 PolarHBondContact O-N 3.19Å; P184-L186 PolarHBondContact O-N 2.85Å
187	M	65.2	Low	62.7	Low	60 Å²	60	111.4 Å²	111.4	30%	0.296	54%	0.543	S	S	.	.	H	α-helix	trans	-97.6	-17	-177.7	-70.4	-62.5	-70.9	0	0	113.7	L105 F179 R180 H183 P184 E189	L105-M187 HydrophobicContact CD2-SD 4.08Å; F179-M187 HydrophobicContact CD1-CG 4.28Å; F179-M187 HydrophobicContact CD1-SD 4.09Å; F179-M187 HydrophobicContact CE1-CG 4.12Å; F179-M187 HydrophobicContact CE1-SD 3.83Å; R180-M187 HydrophobicContact CG-CE 3.47Å; R180-M187 VanDerWaalsContact CG-CE 3.47Å; R180-M187 HydrophobicContact CG-CG 4.13Å; R180-M187 HydrophobicContact CG-SD 4.45Å; H183-M187 PolarHBondContact O-N 3.45Å; P184-M187 PolarHBondContact O-N 3.38Å; P184-M187 VanDerWaalsContact O-N 3.15Å; M187-E189 VanDerWaalsContact C-N 3.32Å; M187-E189 PolarHBondContact O-N 2.82Å
188	E	56	Low	60.9	Low	108 Å²	108	117.7 Å²	117.7	51%	0.505	56%	0.561	S	S	.	*			trans	-63.9	95.5	172.1	-145.5	-178.9	-169.2	0	0	108.4	P184 R190 K191	P184-E188 PolarHBondContact O-N 3.23Å; E188-R190 PolarHBondContact O-N 2.65Å; E188-K191 IonicContact OE1-NZ 3.66Å; E188-K191 PolarHBondContact OE1-NZ 2.76Å
189	E	47.8	Very low	59.6	Low	176 Å²	176	116.5 Å²	116.5	82%	0.822	57%	0.572	S	S	*	*			trans	-47.7	126.3	158.1	-77.8	-172.3	161.9	0	0	105.9	M187 K191	M187-E189 VanDerWaalsContact C-N 3.32Å; M187-E189 PolarHBondContact O-N 2.82Å; E189-K191 PolarHBondContact O-N 3.07Å
190	R	44	Very low	58.6	Low	182 Å²	182	120.4 Å²	120.4	69%	0.687	59%	0.589	S	S	*	*			trans	-43.8	110.9	170.7	-86.8	-169.9	176	-140.6	-0.7	106.3	E94 E188 K192	E94-R190 IonicContact OE2-NH2 2.97Å; E94-R190 PolarHBondContact OE2-NH2 3.32Å; E188-R190 PolarHBondContact O-N 2.65Å; R190-K192 PolarHBondContact O-N 3.05Å
191	K	40.3	Very low	57.9	Low	165 Å²	165	117.1 Å²	117.1	72%	0.717	58%	0.584	S	S	*	*			trans	-42	115.1	160.2	-77.5	169.9	178.3	143.7	0	103.9	E188 E189 S193	E188-K191 IonicContact OE1-NZ 3.66Å; E188-K191 PolarHBondContact OE1-NZ 2.76Å; E189-K191 PolarHBondContact O-N 3.07Å; K191-S193 PolarHBondContact O-N 2.78Å
192	K	36	Very low	56.9	Low	185 Å²	185	112.9 Å²	112.9	80%	0.804	57%	0.57	S	S	*	*			trans	-42.9	115.5	175.9	-78.5	173.2	178	171	0	104.2	R190	R190-K192 PolarHBondContact O-N 3.05Å
193	S	31.7	Very low	56	Low	77 Å²	77	113.3 Å²	113.3	54%	0.538	57%	0.572	S	S	.	*			trans	-36	146.7	-176.6	45.8	0	0	0	0	110.9	K191 L195	K191-S193 PolarHBondContact O-N 2.78Å; S193-L195 PolarHBondContact O-N 3.27Å; S193-L195 WeakPolarHBondContact OG-CD1 3.46Å
194	D	40.7	Very low	55.5	Low	181 Å²	181	116 Å²	116	97%	0.968	59%	0.585	S	S	*	*	S	Bend	trans	-57.2	30.6	169	-71.2	-45	0	0	0	114.5
195	L	46.7	Very low	55.3	Low	130 Å²	130	117.2 Å²	117.2	68%	0.681	59%	0.587	S	S	*	*	S	Bend	trans	-74.6	133.5	160	-69.8	171.6	0	0	0	107.7	S193 E197	S193-L195 PolarHBondContact O-N 3.27Å; S193-L195 WeakPolarHBondContact OG-CD1 3.46Å; L195-E197 PolarHBondContact O-N 3.15Å; L195-E197 VanDerWaalsContact O-N 3.09Å
196	P	44.7	Very low	55.7	Low	122 Å²	122	114.4 Å²	114.4	79%	0.792	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-50.7	121.9	172.9	-23.2	31.4	0	0	0	109.7	K198	P196-K198 PolarHBondContact O-N 2.91Å
197	E	54.8	Low	55.7	Low	125 Å²	125	116.2 Å²	116.2	58%	0.584	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-54.2	131.1	172.1	-163.2	177.1	-160.4	0	0	107.1	L195 K200	L195-E197 PolarHBondContact O-N 3.15Å; L195-E197 VanDerWaalsContact O-N 3.09Å; E197-K200 WeakPolarHBondContact OE1-CE 3.46Å; E197-K200 IonicContact OE1-NZ 3.33Å; E197-K200 VanDerWaalsContact OE2-CE 3.3Å; E197-K200 WeakPolarHBondContact OE2-CE 3.41Å; E197-K200 IonicContact OE2-NZ 2.72Å; E197-K200 PolarHBondContact OE2-NZ 3.3Å
198	K	48.6	Very low	56.1	Low	182 Å²	182	117.1 Å²	117.1	79%	0.791	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-51.6	133.6	176.8	-73.3	179.3	179.1	178.1	0	107.9	P196 K200	P196-K198 PolarHBondContact O-N 2.91Å; K198-K200 PolarHBondContact O-N 3.29Å
199	P	59.8	Low	57.1	Low	122 Å²	122	118 Å²	118	79%	0.792	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-54.4	122.6	-178.8	19.6	-29.8	0	0	0	108.8
200	K	66.5	Low	58.4	Low	85 Å²	85	112.8 Å²	112.8	37%	0.37	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-61.5	138	178.7	-71.9	166.7	-177.9	145.1	0	108.2	E197 K198 Q204 L205	E197-K200 WeakPolarHBondContact OE1-CE 3.46Å; E197-K200 IonicContact OE1-NZ 3.33Å; E197-K200 VanDerWaalsContact OE2-CE 3.3Å; E197-K200 WeakPolarHBondContact OE2-CE 3.41Å; E197-K200 IonicContact OE2-NZ 2.72Å; E197-K200 PolarHBondContact OE2-NZ 3.3Å; K198-K200 PolarHBondContact O-N 3.29Å; K200-Q204 HydrophobicContact CB-CB 4.16Å; K200-L205 HydrophobicContact CB-CD2 3.8Å; K200-L205 HydrophobicContact CB-CG 3.94Å; K200-L205 HydrophobicContact CD-CD2 4.07Å
201	T	66.8	Low	59.8	Low	63 Å²	63	107.5 Å²	107.5	39%	0.387	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-65.2	154.3	176.1	66.5	0	0	0	0	109.8	Q203 Q204 L205	T201-Q203 PolarHBondContact O-N 3.43Å; T201-Q203 VanDerWaalsContact O-N 3.17Å; T201-Q204 VanDerWaalsContact N-OE1 3.08Å; T201-Q204 WeakPolarHBondContact O-CA 3.2Å; T201-Q204 WeakPolarHBondContact O-CB 3.38Å; T201-Q204 PolarHBondContact O-N 3.08Å; T201-Q204 VanDerWaalsContact OG1-CG 3.28Å; T201-Q204 WeakPolarHBondContact OG1-CG 3.43Å; T201-Q204 PolarHBondContact OG1-N 3.3Å; T201-L205 PolarHBondContact O-N 3.19Å
202	P	62.8	Low	61.6	Low	69 Å²	69	107.4 Å²	107.4	45%	0.448	54%	0.542	S	S	.	.	H	α-helix	trans	-50.6	-39.6	174.9	-30.2	36.6	0	0	0	113.2	Q204 L205 W206	P202-Q204 PolarHBondContact O-N 3.44Å; P202-L205 PolarHBondContact O-N 3.34Å; P202-W206 PolarHBondContact O-N 2.91Å
203	Q	63.5	Low	63.3	Low	115 Å²	115	100.2 Å²	100.2	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-39.6	174.6	-169.4	-179.4	18	0	0	112.9	T201 Y207 L240	T201-Q203 PolarHBondContact O-N 3.43Å; T201-Q203 VanDerWaalsContact O-N 3.17Å; Q203-Y207 VanDerWaalsContact O-CB 3.3Å; Q203-Y207 WeakPolarHBondContact O-CB 2.96Å; Q203-Y207 PolarHBondContact O-N 3.23Å; Q203-L240 HydrophobicContact CB-CD1 4.24Å; Q203-L240 HydrophobicContact CG-CD1 4.3Å
204	Q	71	Confident	65.3	Low	97 Å²	97	98.2 Å²	98.2	45%	0.453	50%	0.498	S	S	.	.	H	α-helix	trans	-69.5	-35	175.7	-73.8	170	-10.7	0	0	112	K200 T201 P202 N208	K200-Q204 HydrophobicContact CB-CB 4.16Å; T201-Q204 VanDerWaalsContact N-OE1 3.08Å; T201-Q204 WeakPolarHBondContact O-CA 3.2Å; T201-Q204 WeakPolarHBondContact O-CB 3.38Å; T201-Q204 PolarHBondContact O-N 3.08Å; T201-Q204 VanDerWaalsContact OG1-CG 3.28Å; T201-Q204 WeakPolarHBondContact OG1-CG 3.43Å; T201-Q204 PolarHBondContact OG1-N 3.3Å; P202-Q204 PolarHBondContact O-N 3.44Å; Q204-N208 WeakPolarHBondContact O-CB 3.36Å; Q204-N208 VanDerWaalsContact O-CG 3.24Å; Q204-N208 PolarHBondContact O-N 3.47Å; Q204-N208 PolarHBondContact O-ND2 2.57Å
205	L	71.6	Confident	66.9	Low	98 Å²	98	94 Å²	94	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-67.2	-46	175.7	-69.2	174.4	0	0	0	111	K200 T201 P202 N208 H209	K200-L205 HydrophobicContact CB-CD2 3.8Å; K200-L205 HydrophobicContact CB-CG 3.94Å; K200-L205 HydrophobicContact CD-CD2 4.07Å; T201-L205 PolarHBondContact O-N 3.19Å; P202-L205 PolarHBondContact O-N 3.34Å; L205-N208 PolarHBondContact O-N 3.16Å; L205-H209 WeakPolarHBondContact O-CB 3.27Å; L205-H209 PolarHBondContact O-N 2.7Å
206	W	78.8	Confident	68.3	Low	42 Å²	42	96.3 Å²	96.3	16%	0.159	48%	0.478	C	S	.	.	H	α-helix	trans	-59.9	-50.5	174.2	176.3	81.8	0	0	0	111.6	P202 N208 H209 E210 V239	P202-W206 PolarHBondContact O-N 2.91Å; W206-N208 VanDerWaalsContact C-N 3.29Å; W206-N208 PolarHBondContact O-N 3.42Å; W206-H209 WeakPolarHBondContact O-CB 3.29Å; W206-H209 PolarHBondContact O-N 3.24Å; W206-E210 HydrophobicContact CZ2-CB 4.4Å; W206-E210 HydrophobicContact CZ2-CG 4.18Å; W206-E210 WeakPolarHBondContact O-CB 3.49Å; W206-E210 PolarHBondContact O-N 3.29Å; W206-V239 HydrophobicContact CZ2-CB 4.35Å; W206-V239 HydrophobicContact CZ2-CG1 4.1Å
207	Y	72.2	Confident	69.6	Low	56 Å²	56	96.8 Å²	96.8	22%	0.22	47%	0.473	C	S	.	.	H	α-helix	trans	-59.1	-39.5	179.4	-178.5	-97.3	0	0	0	112.4	Q203 K211 L230 L231	Q203-Y207 VanDerWaalsContact O-CB 3.3Å; Q203-Y207 WeakPolarHBondContact O-CB 2.96Å; Q203-Y207 PolarHBondContact O-N 3.23Å; Y207-K211 HydrophobicContact CE1-CD 4.1Å; Y207-K211 WeakPolarHBondContact O-CB 3.2Å; Y207-K211 PolarHBondContact O-N 3.3Å; Y207-L230 HydrophobicContact CE2-CB 4.15Å; Y207-L230 HydrophobicContact CE2-CD1 4.33Å; Y207-L231 HydrophobicContact CE2-CD2 4.45Å; Y207-L231 HydrophobicContact CE2-CG 4.42Å
208	N	74.3	Confident	70.1	Confident	79 Å²	79	95 Å²	95	42%	0.422	46%	0.464	S	S	.	.	H	α-helix	trans	-69	-37.7	176.3	-76.1	-48.3	0	0	0	112.7	Q204 L205 W206 K212	Q204-N208 WeakPolarHBondContact O-CB 3.36Å; Q204-N208 VanDerWaalsContact O-CG 3.24Å; Q204-N208 PolarHBondContact O-N 3.47Å; Q204-N208 PolarHBondContact O-ND2 2.57Å; L205-N208 PolarHBondContact O-N 3.16Å; W206-N208 VanDerWaalsContact C-N 3.29Å; W206-N208 PolarHBondContact O-N 3.42Å; N208-K212 WeakPolarHBondContact O-CB 3.01Å; N208-K212 PolarHBondContact O-N 3.28Å; N208-K212 VanDerWaalsContact O-N 3.13Å
209	H	76.9	Confident	71.1	Confident	128 Å²	128	91.3 Å²	91.3	59%	0.593	46%	0.459	S	S	*	.	H	α-helix	trans	-63.6	-49.8	174.6	177.4	-88.2	0	0	0	110.7	L205 W206 K212 A213	L205-H209 WeakPolarHBondContact O-CB 3.27Å; L205-H209 PolarHBondContact O-N 2.7Å; W206-H209 WeakPolarHBondContact O-CB 3.29Å; W206-H209 PolarHBondContact O-N 3.24Å; H209-K212 WeakPolarHBondContact O-CB 3.19Å; H209-K212 PolarHBondContact O-N 3.42Å; H209-K212 VanDerWaalsContact O-N 3.15Å; H209-A213 PolarHBondContact O-N 3.17Å
210	E	74.5	Confident	71.1	Confident	66 Å²	66	94.4 Å²	94.4	31%	0.308	46%	0.463	S	S	.	.	H	α-helix	trans	-70	-40.7	-176	-154	59.1	-150.5	0	0	111.7	W206 K212 A213 Y214 L230	W206-E210 HydrophobicContact CZ2-CB 4.4Å; W206-E210 HydrophobicContact CZ2-CG 4.18Å; W206-E210 WeakPolarHBondContact O-CB 3.49Å; W206-E210 PolarHBondContact O-N 3.29Å; E210-K212 PolarHBondContact O-N 3.22Å; E210-A213 PolarHBondContact O-N 3.45Å; E210-A213 VanDerWaalsContact O-N 3.14Å; E210-Y214 VanDerWaalsContact O-CB 3.31Å; E210-Y214 WeakPolarHBondContact O-CB 3.48Å; E210-Y214 PolarHBondContact O-N 3.06Å; E210-L230 HydrophobicContact CB-CD2 3.98Å; E210-L230 HydrophobicContact CG-CD2 3.44Å; E210-L230 VanDerWaalsContact CG-CD2 3.44Å
211	K	74.1	Confident	71	Confident	70 Å²	70	92 Å²	92	30%	0.304	46%	0.456	S	S	.	.	H	α-helix	trans	-55.5	-41.1	169.8	175.7	169.4	-177.8	179.3	0	112.2	Y207 M215 L226 L230	Y207-K211 HydrophobicContact CE1-CD 4.1Å; Y207-K211 WeakPolarHBondContact O-CB 3.2Å; Y207-K211 PolarHBondContact O-N 3.3Å; K211-M215 HydrophobicContact CG-CG 4.39Å; K211-M215 VanDerWaalsContact O-CB 3.25Å; K211-M215 WeakPolarHBondContact O-CB 3.48Å; K211-M215 WeakPolarHBondContact O-CG 3.41Å; K211-M215 PolarHBondContact O-N 3.09Å; K211-L226 HydrophobicContact CD-CD2 3.99Å; K211-L226 HydrophobicContact CG-CD1 4.38Å; K211-L226 HydrophobicContact CG-CD2 3.95Å; K211-L230 HydrophobicContact CB-CD1 3.97Å
212	K	76.8	Confident	70.9	Confident	164 Å²	164	92 Å²	92	71%	0.713	46%	0.458	S	S	*	.	H	α-helix	trans	-71.1	-36.8	179	-171.5	178.7	-179.5	-178.9	0	111.9	N208 H209 E210 K216	N208-K212 WeakPolarHBondContact O-CB 3.01Å; N208-K212 PolarHBondContact O-N 3.28Å; N208-K212 VanDerWaalsContact O-N 3.13Å; H209-K212 WeakPolarHBondContact O-CB 3.19Å; H209-K212 PolarHBondContact O-N 3.42Å; H209-K212 VanDerWaalsContact O-N 3.15Å; E210-K212 PolarHBondContact O-N 3.22Å; K212-K216 WeakPolarHBondContact O-CB 3.46Å; K212-K216 PolarHBondContact O-N 3.29Å
213	A	73.6	Confident	70.4	Confident	34 Å²	34	96.1 Å²	96.1	28%	0.281	47%	0.471	S	S	.	.	H	α-helix	trans	-68.3	-47.3	175.8	0	0	0	0	0	111.5	H209 E210 K216 L217	H209-A213 PolarHBondContact O-N 3.17Å; E210-A213 PolarHBondContact O-N 3.45Å; E210-A213 VanDerWaalsContact O-N 3.14Å; A213-K216 WeakPolarHBondContact O-CB 3.2Å; A213-K216 PolarHBondContact O-N 3.07Å; A213-K216 VanDerWaalsContact O-N 3.14Å; A213-L217 WeakPolarHBondContact O-CG 3.27Å; A213-L217 PolarHBondContact O-N 3.24Å; A213-L217 VanDerWaalsContact O-N 3.14Å
214	Y	72.2	Confident	70.1	Confident	35 Å²	35	98.3 Å²	98.3	14%	0.137	48%	0.479	C	S	.	.	H	α-helix	trans	-63.4	-46.9	178.9	-170.6	-73.4	0	0	0	111.7	E210 K216 L217 H218 V221 L226 D229 L230	E210-Y214 VanDerWaalsContact O-CB 3.31Å; E210-Y214 WeakPolarHBondContact O-CB 3.48Å; E210-Y214 PolarHBondContact O-N 3.06Å; Y214-K216 PolarHBondContact O-N 2.96Å; Y214-K216 VanDerWaalsContact O-N 3.15Å; Y214-L217 PolarHBondContact O-N 2.91Å; Y214-H218 HydrophobicContact CD1-CB 4.3Å; Y214-H218 HydrophobicContact CE1-CB 3.93Å; Y214-H218 AromaticContact CE1-CD2 3.97Å; Y214-H218 AromaticContact CZ-CD2 3.95Å; Y214-H218 PolarHBondContact O-N 3.26Å; Y214-V221 HydrophobicContact CE1-CB 4.16Å; Y214-V221 HydrophobicContact CE1-CG1 3.81Å; Y214-V221 HydrophobicContact CE1-CG2 4.43Å; Y214-L226 HydrophobicContact CD1-CD1 3.64Å; Y214-L226 HydrophobicContact CD1-CG 4.39Å; Y214-L226 HydrophobicContact CE1-CD1 4.24Å; Y214-L226 HydrophobicContact CG-CD1 4.41Å; Y214-D229 HydrophobicContact CE2-CB 3.8Å; Y214-D229 PolarHBondContact OH-OD2 3.1Å; Y214-L230 HydrophobicContact CD2-CD2 4.26Å; Y214-L230 HydrophobicContact CG-CD2 4.45Å
215	M	74.4	Confident	69.8	Low	92 Å²	92	98.3 Å²	98.3	45%	0.453	48%	0.479	S	S	.	.	H	α-helix	trans	-60.1	-25.3	174.8	-75	-71.7	-66.7	0	0	113.4	K211 L226	K211-M215 HydrophobicContact CG-CG 4.39Å; K211-M215 VanDerWaalsContact O-CB 3.25Å; K211-M215 WeakPolarHBondContact O-CB 3.48Å; K211-M215 WeakPolarHBondContact O-CG 3.41Å; K211-M215 PolarHBondContact O-N 3.09Å; M215-L226 HydrophobicContact CG-CD1 3.56Å; M215-L226 HydrophobicContact SD-CD1 3.53Å; M215-L226 VanDerWaalsContact SD-CD1 3.53Å
216	K	77.4	Confident	69.5	Low	178 Å²	178	93.8 Å²	93.8	77%	0.774	46%	0.456	S	S	*	.	H	α-helix	trans	-80.5	-30.2	177.3	-170.8	179.9	179.3	-172.8	0	112.1	K212 A213 Y214	K212-K216 WeakPolarHBondContact O-CB 3.46Å; K212-K216 PolarHBondContact O-N 3.29Å; A213-K216 WeakPolarHBondContact O-CB 3.2Å; A213-K216 PolarHBondContact O-N 3.07Å; A213-K216 VanDerWaalsContact O-N 3.14Å; Y214-K216 PolarHBondContact O-N 2.96Å; Y214-K216 VanDerWaalsContact O-N 3.15Å
217	L	71.6	Confident	68.5	Low	133 Å²	133	97.6 Å²	97.6	70%	0.696	47%	0.473	S	S	*	.	H	α-helix	trans	-85.9	-25.8	178	-66.5	170.8	0	0	0	112.1	A213 Y214	A213-L217 WeakPolarHBondContact O-CG 3.27Å; A213-L217 PolarHBondContact O-N 3.24Å; A213-L217 VanDerWaalsContact O-N 3.14Å; Y214-L217 PolarHBondContact O-N 2.91Å
218	H	65.4	Low	68.1	Low	86 Å²	86	101.3 Å²	101.3	40%	0.398	49%	0.493	S	S	.	.			trans	-132.2	79.4	-177.8	-61	-83.6	0	0	0	111.8	Y214 E220 V221	Y214-H218 HydrophobicContact CD1-CB 4.3Å; Y214-H218 HydrophobicContact CE1-CB 3.93Å; Y214-H218 AromaticContact CE1-CD2 3.97Å; Y214-H218 AromaticContact CZ-CD2 3.95Å; Y214-H218 PolarHBondContact O-N 3.26Å; H218-E220 PolarHBondContact O-N 3.47Å; H218-V221 HydrophobicContact CB-CB 4.03Å; H218-V221 HydrophobicContact CB-CG2 3.55Å; H218-V221 PolarHBondContact O-N 3.17Å
219	P	69.3	Low	67.5	Low	106 Å²	106	101.9 Å²	101.9	69%	0.688	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-18.7	-176.2	-21.4	33.3	0	0	0	115.2
220	E	59.2	Low	66.7	Low	186 Å²	186	96.3 Å²	96.3	87%	0.869	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	1.4	-173	-69.4	-75	154.1	0	0	113.7	H218	H218-E220 PolarHBondContact O-N 3.47Å
221	V	64.4	Low	65.8	Low	36 Å²	36	97.4 Å²	97.4	22%	0.218	48%	0.478	C	S	.	.			trans	-80	138.9	-173.4	167.7	0	0	0	0	112.4	Y214 H218 E225	Y214-V221 HydrophobicContact CE1-CB 4.16Å; Y214-V221 HydrophobicContact CE1-CG1 3.81Å; Y214-V221 HydrophobicContact CE1-CG2 4.43Å; H218-V221 HydrophobicContact CB-CB 4.03Å; H218-V221 HydrophobicContact CB-CG2 3.55Å; H218-V221 PolarHBondContact O-N 3.17Å; V221-E225 HydrophobicContact CG1-CB 3.54Å
222	S	64.5	Low	64.8	Low	63 Å²	63	95.2 Å²	95.2	44%	0.441	48%	0.475	S	S	.	.			trans	-68.1	150.7	-179	176.9	0	0	0	0	112.2	K224 E225 L226	S222-K224 PolarHBondContact O-N 2.94Å; S222-E225 PolarHBondContact N-OE2 3.5Å; S222-E225 VanDerWaalsContact N-OE2 3.1Å; S222-E225 PolarHBondContact O-N 3.16Å; S222-L226 WeakPolarHBondContact O-CB 3.34Å; S222-L226 PolarHBondContact O-N 3.46Å
223	Q	53.7	Low	63.6	Low	154 Å²	154	92.5 Å²	92.5	72%	0.72	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.7	178.5	-158.8	176.9	-18.9	0	0	113	K227	Q223-K227 WeakPolarHBondContact O-CB 3.16Å
224	K	55.9	Low	62.5	Low	161 Å²	161	95.8 Å²	95.8	70%	0.7	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-49.4	175.6	-164.5	178.1	178.4	-175.4	0	111.3	S222 K227 E228	S222-K224 PolarHBondContact O-N 2.94Å; K224-K227 WeakPolarHBondContact O-CB 3.28Å; K224-K227 PolarHBondContact O-N 2.64Å; K224-E228 PolarHBondContact O-N 2.87Å
225	E	64.8	Low	61.3	Low	98 Å²	98	99.8 Å²	99.8	46%	0.458	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-42.8	176.8	-69.6	170.2	152.1	0	0	111.9	V221 S222 K227 E228 D229	V221-E225 HydrophobicContact CG1-CB 3.54Å; S222-E225 PolarHBondContact N-OE2 3.5Å; S222-E225 VanDerWaalsContact N-OE2 3.1Å; S222-E225 PolarHBondContact O-N 3.16Å; E225-K227 PolarHBondContact O-N 2.99Å; E225-K227 VanDerWaalsContact O-N 3.16Å; E225-E228 PolarHBondContact O-N 3.36Å; E225-D229 WeakPolarHBondContact O-CB 3.35Å; E225-D229 PolarHBondContact O-N 2.64Å
226	L	66.5	Low	60.1	Low	3 Å²	3	96.4 Å²	96.4	2%	0.016	50%	0.497	C	S	.	.	H	α-helix	trans	-55.8	-34.2	172.7	-179.3	119.4	0	0	0	112.4	K211 Y214 M215 S222 L230	K211-L226 HydrophobicContact CD-CD2 3.99Å; K211-L226 HydrophobicContact CG-CD1 4.38Å; K211-L226 HydrophobicContact CG-CD2 3.95Å; Y214-L226 HydrophobicContact CD1-CD1 3.64Å; Y214-L226 HydrophobicContact CD1-CG 4.39Å; Y214-L226 HydrophobicContact CE1-CD1 4.24Å; Y214-L226 HydrophobicContact CG-CD1 4.41Å; M215-L226 HydrophobicContact CG-CD1 3.56Å; M215-L226 HydrophobicContact SD-CD1 3.53Å; M215-L226 VanDerWaalsContact SD-CD1 3.53Å; S222-L226 WeakPolarHBondContact O-CB 3.34Å; S222-L226 PolarHBondContact O-N 3.46Å; L226-L230 HydrophobicContact CD1-CD1 4.35Å; L226-L230 HydrophobicContact CD2-CD1 4.13Å; L226-L230 HydrophobicContact CG-CD1 3.83Å; L226-L230 VanDerWaalsContact O-CB 3.26Å; L226-L230 WeakPolarHBondContact O-CB 3.45Å; L226-L230 WeakPolarHBondContact O-CD1 3.42Å; L226-L230 WeakPolarHBondContact O-CG 3.49Å; L226-L230 PolarHBondContact O-N 2.86Å
227	K	57.3	Low	58.8	Low	122 Å²	122	93.1 Å²	93.1	53%	0.53	49%	0.488	S	S	.	.	H	α-helix	trans	-81.9	-34.6	-176.8	-161.5	173.3	-179.2	-165.5	0	111.2	Q223 K224 E225 L231	Q223-K227 WeakPolarHBondContact O-CB 3.16Å; K224-K227 WeakPolarHBondContact O-CB 3.28Å; K224-K227 PolarHBondContact O-N 2.64Å; E225-K227 PolarHBondContact O-N 2.99Å; E225-K227 VanDerWaalsContact O-N 3.16Å; K227-L231 HydrophobicContact CG-CD1 3.59Å; K227-L231 WeakPolarHBondContact O-CB 3.18Å; K227-L231 WeakPolarHBondContact O-CD1 3.08Å; K227-L231 VanDerWaalsContact O-CG 3.27Å; K227-L231 WeakPolarHBondContact O-CG 3.26Å; K227-L231 PolarHBondContact O-N 2.93Å
228	E	63.4	Low	57.6	Low	134 Å²	134	89.5 Å²	89.5	63%	0.626	47%	0.473	S	S	*	.	H	α-helix	trans	-69.8	-47	172.7	-81.8	-175.4	126.3	0	0	112.4	K224 E225 L230 L231 G232	K224-E228 PolarHBondContact O-N 2.87Å; E225-E228 PolarHBondContact O-N 3.36Å; E228-L230 VanDerWaalsContact C-N 3.34Å; E228-L230 PolarHBondContact O-N 2.92Å; E228-L231 CarbonylContact O-C 3.21Å; E228-L231 PolarHBondContact O-N 2.71Å; E228-G232 PolarHBondContact O-N 3.38Å
229	D	61.7	Low	56.9	Low	91 Å²	91	88 Å²	88	49%	0.487	47%	0.47	S	S	.	.	H	α-helix	trans	-66.5	-35.7	-177.3	-78.6	-0.7	0	0	0	112.7	Y214 E225	Y214-D229 HydrophobicContact CE2-CB 3.8Å; Y214-D229 PolarHBondContact OH-OD2 3.1Å; E225-D229 WeakPolarHBondContact O-CB 3.35Å; E225-D229 PolarHBondContact O-N 2.64Å
230	L	60.8	Low	55.9	Low	11 Å²	11	84.4 Å²	84.4	6%	0.058	45%	0.445	C	S	.	.	H	α-helix	trans	-83.9	-19.7	178.3	-65.7	175.4	0	0	0	113.9	Y207 E210 K211 Y214 L226 E228	Y207-L230 HydrophobicContact CE2-CB 4.15Å; Y207-L230 HydrophobicContact CE2-CD1 4.33Å; E210-L230 HydrophobicContact CB-CD2 3.98Å; E210-L230 HydrophobicContact CG-CD2 3.44Å; E210-L230 VanDerWaalsContact CG-CD2 3.44Å; K211-L230 HydrophobicContact CB-CD1 3.97Å; Y214-L230 HydrophobicContact CD2-CD2 4.26Å; Y214-L230 HydrophobicContact CG-CD2 4.45Å; L226-L230 HydrophobicContact CD1-CD1 4.35Å; L226-L230 HydrophobicContact CD2-CD1 4.13Å; L226-L230 HydrophobicContact CG-CD1 3.83Å; L226-L230 VanDerWaalsContact O-CB 3.26Å; L226-L230 WeakPolarHBondContact O-CB 3.45Å; L226-L230 WeakPolarHBondContact O-CD1 3.42Å; L226-L230 WeakPolarHBondContact O-CG 3.49Å; L226-L230 PolarHBondContact O-N 2.86Å; E228-L230 VanDerWaalsContact C-N 3.34Å; E228-L230 PolarHBondContact O-N 2.92Å
231	L	54.6	Low	55.7	Low	89 Å²	89	81.1 Å²	81.1	47%	0.466	43%	0.43	S	S	.	.	H	α-helix	trans	-107.5	11.5	178.7	-64.9	168.4	0	0	0	113	Y207 K227 E228	Y207-L231 HydrophobicContact CE2-CD2 4.45Å; Y207-L231 HydrophobicContact CE2-CG 4.42Å; K227-L231 HydrophobicContact CG-CD1 3.59Å; K227-L231 WeakPolarHBondContact O-CB 3.18Å; K227-L231 WeakPolarHBondContact O-CD1 3.08Å; K227-L231 VanDerWaalsContact O-CG 3.27Å; K227-L231 WeakPolarHBondContact O-CG 3.26Å; K227-L231 PolarHBondContact O-N 2.93Å; E228-L231 CarbonylContact O-C 3.21Å; E228-L231 PolarHBondContact O-N 2.71Å
232	G	54	Low	55.1	Low	23 Å²	23	83.7 Å²	83.7	24%	0.237	44%	0.442	C	S	.	.			trans	-52.7	125.6	171.6	0	0	0	0	0	110.7	E228 D234 L235 A236	E228-G232 PolarHBondContact O-N 3.38Å; G232-D234 VanDerWaalsContact C-N 3.29Å; G232-D234 PolarHBondContact O-N 3.27Å; G232-D234 VanDerWaalsContact O-N 3.16Å; G232-L235 PolarHBondContact O-N 3.3Å; G232-A236 PolarHBondContact O-N 2.8Å
233	P	50.7	Low	54.4	Low	107 Å²	107	83.3 Å²	83.3	70%	0.695	44%	0.44	S	S	*	.	H	α-helix	trans	-61.1	-31.1	-165.2	17	-28.9	0	0	0	114.3	D237	P233-D237 PolarHBondContact O-N 3.04Å
234	D	49.9	Very low	54	Low	103 Å²	103	79.5 Å²	79.5	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-80.2	-33.8	-176.8	-77.8	-30.3	0	0	0	114.1	G232 S238 R449	G232-D234 VanDerWaalsContact C-N 3.29Å; G232-D234 PolarHBondContact O-N 3.27Å; G232-D234 VanDerWaalsContact O-N 3.16Å; D234-S238 PolarHBondContact O-OG 3.1Å; D234-R449 IonicContact OD1-NH2 2.75Å; D234-R449 IonicContact OD2-CZ 3.41Å; D234-R449 IonicContact OD2-NH2 3.5Å; D234-R449 PolarHBondContact OD2-NH2 3.41Å
235	L	47.8	Very low	54.2	Low	119 Å²	119	78.9 Å²	78.9	62%	0.623	42%	0.416	S	S	*	.	H	α-helix	trans	-82.6	-38.2	-179	-88.1	155.7	0	0	0	111.3	G232 S238 V239	G232-L235 PolarHBondContact O-N 3.3Å; L235-S238 PolarHBondContact O-OG 3.11Å; L235-V239 VanDerWaalsContact O-CB 3.27Å; L235-V239 WeakPolarHBondContact O-CB 3.18Å; L235-V239 WeakPolarHBondContact O-CG2 3.14Å; L235-V239 PolarHBondContact O-N 2.95Å; L235-V239 VanDerWaalsContact O-N 3.16Å
236	A	49.8	Very low	54.1	Low	22 Å²	22	78.8 Å²	78.8	18%	0.182	42%	0.422	C	S	.	.	H	α-helix	trans	-65.2	-43.6	178.3	0	0	0	0	0	111.7	G232 L240	G232-A236 PolarHBondContact O-N 2.8Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 3.21Å
237	D	48.6	Very low	53.2	Low	109 Å²	109	83.7 Å²	83.7	58%	0.583	44%	0.441	S	S	*	.	H	α-helix	trans	-72.6	-40.1	-177.1	-107.2	5.1	0	0	0	113.3	P233 Q241	P233-D237 PolarHBondContact O-N 3.04Å; D237-Q241 VanDerWaalsContact O-CB 3.28Å; D237-Q241 WeakPolarHBondContact O-CB 3.17Å; D237-Q241 WeakPolarHBondContact O-CG 3.41Å; D237-Q241 PolarHBondContact O-N 3.29Å
238	S	46.7	Very low	52.9	Low	56 Å²	56	82.3 Å²	82.3	39%	0.392	44%	0.436	S	S	.	.	H	α-helix	trans	-72.2	-43.2	-178.8	58.8	0	0	0	0	112.4	D234 L235 Q241 D242	D234-S238 PolarHBondContact O-OG 3.1Å; L235-S238 PolarHBondContact O-OG 3.11Å; S238-Q241 PolarHBondContact O-N 3.01Å; S238-D242 PolarHBondContact O-N 2.99Å
239	V	52	Low	52.4	Low	56 Å²	56	83.7 Å²	83.7	34%	0.339	44%	0.442	S	S	.	.	H	α-helix	trans	-73.8	-35	178.2	-178.6	0	0	0	0	110.9	W206 L235 S243	W206-V239 HydrophobicContact CZ2-CB 4.35Å; W206-V239 HydrophobicContact CZ2-CG1 4.1Å; L235-V239 VanDerWaalsContact O-CB 3.27Å; L235-V239 WeakPolarHBondContact O-CB 3.18Å; L235-V239 WeakPolarHBondContact O-CG2 3.14Å; L235-V239 PolarHBondContact O-N 2.95Å; L235-V239 VanDerWaalsContact O-N 3.16Å; V239-S243 WeakPolarHBondContact O-CB 3.49Å; V239-S243 PolarHBondContact O-N 2.95Å
240	L	48	Very low	51.7	Low	30 Å²	30	82.3 Å²	82.3	16%	0.157	44%	0.444	C	S	.	.	H	α-helix	trans	-66.4	-40.5	171.7	-173.7	67.3	0	0	0	111	Q203 A236 M244	Q203-L240 HydrophobicContact CB-CD1 4.24Å; Q203-L240 HydrophobicContact CG-CD1 4.3Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 3.21Å; L240-M244 HydrophobicContact CD1-CG 4.44Å; L240-M244 HydrophobicContact CG-CE 4.03Å; L240-M244 HydrophobicContact CG-CG 4.44Å; L240-M244 HydrophobicContact CG-SD 4.22Å; L240-M244 WeakPolarHBondContact O-CB 3.18Å; L240-M244 WeakPolarHBondContact O-CE 3.35Å; L240-M244 WeakPolarHBondContact O-CG 3.11Å; L240-M244 PolarHBondContact O-N 3.39Å
241	Q	54.6	Low	50.7	Low	117 Å²	117	86.1 Å²	86.1	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-61.9	-47.6	174.2	-92.8	-175	3.7	0	0	112.6	D237 S238 M244 R245	D237-Q241 VanDerWaalsContact O-CB 3.28Å; D237-Q241 WeakPolarHBondContact O-CB 3.17Å; D237-Q241 WeakPolarHBondContact O-CG 3.41Å; D237-Q241 PolarHBondContact O-N 3.29Å; S238-Q241 PolarHBondContact O-N 3.01Å; Q241-M244 HydrophobicContact CG-CE 4.26Å; Q241-M244 PolarHBondContact O-N 3.12Å; Q241-R245 WeakPolarHBondContact O-CB 2.96Å; Q241-R245 PolarHBondContact O-N 3.08Å
242	D	52.9	Low	50.5	Low	90 Å²	90	86.9 Å²	86.9	48%	0.481	47%	0.471	S	S	.	.	H	α-helix	trans	-72.9	-35.1	-179.2	-85.1	-10	0	0	0	112.2	S238 R245 V246	S238-D242 PolarHBondContact O-N 2.99Å; D242-R245 WeakPolarHBondContact O-CB 3.41Å; D242-R245 PolarHBondContact O-N 3.21Å; D242-R245 IonicContact OD1-CZ 3.94Å; D242-R245 IonicContact OD1-NE 2.7Å; D242-R245 PolarHBondContact OD1-NE 3.09Å; D242-R245 VanDerWaalsContact OD1-NE 3.12Å; D242-R245 IonicContact OD1-NH2 3.43Å; D242-R245 PolarHBondContact OD1-NH2 3.37Å; D242-V246 WeakPolarHBondContact O-CG2 3.41Å; D242-V246 PolarHBondContact O-N 3.39Å
243	S	49.4	Very low	49.9	Very low	55 Å²	55	92.9 Å²	92.9	39%	0.385	50%	0.498	S	S	.	.	H	α-helix	trans	-66.9	-37.7	171.4	-173.9	0	0	0	0	112.2	V239 Y247	V239-S243 WeakPolarHBondContact O-CB 3.49Å; V239-S243 PolarHBondContact O-N 2.95Å; S243-Y247 VanDerWaalsContact O-CB 3.28Å; S243-Y247 WeakPolarHBondContact O-CB 3.38Å; S243-Y247 PolarHBondContact O-N 3.19Å
244	M	45.6	Very low	49.3	Very low	74 Å²	74	91.4 Å²	91.4	37%	0.365	49%	0.49	S	S	.	.	H	α-helix	trans	-66.4	-40.7	172.6	-78.5	-175.6	-51.4	0	0	110.7	L240 Q241 V246 Y247 H248	L240-M244 HydrophobicContact CD1-CG 4.44Å; L240-M244 HydrophobicContact CG-CE 4.03Å; L240-M244 HydrophobicContact CG-CG 4.44Å; L240-M244 HydrophobicContact CG-SD 4.22Å; L240-M244 WeakPolarHBondContact O-CB 3.18Å; L240-M244 WeakPolarHBondContact O-CE 3.35Å; L240-M244 WeakPolarHBondContact O-CG 3.11Å; L240-M244 PolarHBondContact O-N 3.39Å; Q241-M244 HydrophobicContact CG-CE 4.26Å; Q241-M244 PolarHBondContact O-N 3.12Å; M244-V246 PolarHBondContact O-N 3.36Å; M244-Y247 CarbonylContact O-C 3.53Å; M244-Y247 PolarHBondContact O-N 3.3Å; M244-H248 VanDerWaalsContact C-CD2 3.49Å; M244-H248 WeakPolarHBondContact O-CB 3.22Å; M244-H248 PolarHBondContact O-CD2 3.16Å; M244-H248 PolarHBondContact O-N 3.09Å
245	R	58.5	Low	48.9	Very low	148 Å²	148	92 Å²	92	56%	0.558	49%	0.494	S	S	*	.	H	α-helix	trans	-59.7	-47.7	177.1	-165.9	-163.9	-50.7	-99.6	0.6	111.7	Q241 D242 Y247 H248 E249	Q241-R245 WeakPolarHBondContact O-CB 2.96Å; Q241-R245 PolarHBondContact O-N 3.08Å; D242-R245 WeakPolarHBondContact O-CB 3.41Å; D242-R245 PolarHBondContact O-N 3.21Å; D242-R245 IonicContact OD1-CZ 3.94Å; D242-R245 IonicContact OD1-NE 2.7Å; D242-R245 PolarHBondContact OD1-NE 3.09Å; D242-R245 VanDerWaalsContact OD1-NE 3.12Å; D242-R245 IonicContact OD1-NH2 3.43Å; D242-R245 PolarHBondContact OD1-NH2 3.37Å; R245-Y247 VanDerWaalsContact C-N 3.31Å; R245-Y247 PolarHBondContact O-N 3.43Å; R245-H248 PolarHBondContact O-N 3.25Å; R245-E249 WeakPolarHBondContact O-CB 3.35Å; R245-E249 PolarHBondContact O-N 3.39Å
246	V	63.3	Low	48.5	Very low	95 Å²	95	90 Å²	90	58%	0.576	49%	0.49	S	S	*	.	H	α-helix	trans	-63.7	-38.1	176.2	172.8	0	0	0	0	111.2	D242 M244 E249 A250	D242-V246 WeakPolarHBondContact O-CG2 3.41Å; D242-V246 PolarHBondContact O-N 3.39Å; M244-V246 PolarHBondContact O-N 3.36Å; V246-E249 PolarHBondContact O-N 2.94Å; V246-A250 WeakPolarHBondContact O-CB 3.49Å; V246-A250 PolarHBondContact O-N 3.01Å
247	Y	47.1	Very low	47.9	Very low	107 Å²	107	94 Å²	94	42%	0.42	50%	0.504	S	S	.	.	H	α-helix	trans	-70	-36.9	176.6	-165.9	-91.3	0	0	0	112.7	S243 M244 R245 A250 H251	S243-Y247 VanDerWaalsContact O-CB 3.28Å; S243-Y247 WeakPolarHBondContact O-CB 3.38Å; S243-Y247 PolarHBondContact O-N 3.19Å; M244-Y247 CarbonylContact O-C 3.53Å; M244-Y247 PolarHBondContact O-N 3.3Å; R245-Y247 VanDerWaalsContact C-N 3.31Å; R245-Y247 PolarHBondContact O-N 3.43Å; Y247-A250 PolarHBondContact O-N 3.32Å; Y247-H251 AromaticContact CE1-CD2 3.79Å; Y247-H251 AromaticContact CE2-CD2 3.71Å; Y247-H251 AromaticContact CE2-NE2 3.99Å; Y247-H251 AromaticContact CZ-CD2 3.59Å; Y247-H251 WeakPolarHBondContact O-CB 3.46Å; Y247-H251 PolarHBondContact O-N 2.97Å
248	H	52.7	Low	47.3	Very low	93 Å²	93	96 Å²	96	43%	0.431	51%	0.51	S	S	.	.	H	α-helix	trans	-69.2	-35.2	174.4	-72.7	-55.8	0	0	0	112.3	M244 R245 H251	M244-H248 VanDerWaalsContact C-CD2 3.49Å; M244-H248 WeakPolarHBondContact O-CB 3.22Å; M244-H248 PolarHBondContact O-CD2 3.16Å; M244-H248 PolarHBondContact O-N 3.09Å; R245-H248 PolarHBondContact O-N 3.25Å; H248-H251 CarbonylContact O-C 3.43Å
249	E	51.5	Low	47.1	Very low	162 Å²	162	100.4 Å²	100.4	76%	0.757	52%	0.524	S	S	*	.	H	α-helix	trans	-72.3	-31	175.7	-164.2	166.3	-155.9	0	0	112	R245 V246	R245-E249 WeakPolarHBondContact O-CB 3.35Å; R245-E249 PolarHBondContact O-N 3.39Å; V246-E249 PolarHBondContact O-N 2.94Å
250	A	46.8	Very low	46.7	Very low	63 Å²	63	100.6 Å²	100.6	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-81.8	-20.4	175.3	0	0	0	0	0	114.4	V246 Y247	V246-A250 WeakPolarHBondContact O-CB 3.49Å; V246-A250 PolarHBondContact O-N 3.01Å; Y247-A250 PolarHBondContact O-N 3.32Å
251	H	40.8	Very low	46.7	Very low	91 Å²	91	108.4 Å²	108.4	42%	0.421	55%	0.553	S	S	.	*			trans	-136.5	73	-175.7	-60.6	-48.4	0	0	0	112.7	Y247 H248 D253 S254	Y247-H251 AromaticContact CE1-CD2 3.79Å; Y247-H251 AromaticContact CE2-CD2 3.71Å; Y247-H251 AromaticContact CE2-NE2 3.99Å; Y247-H251 AromaticContact CZ-CD2 3.59Å; Y247-H251 WeakPolarHBondContact O-CB 3.46Å; Y247-H251 PolarHBondContact O-N 2.97Å; H248-H251 CarbonylContact O-C 3.43Å; H251-D253 PolarHBondContact O-N 2.91Å; H251-D253 VanDerWaalsContact O-N 3.15Å; H251-S254 WeakPolarHBondContact O-CB 3.49Å; H251-S254 PolarHBondContact O-N 3.15Å; H251-S254 VanDerWaalsContact O-N 3.13Å
252	P	49.8	Very low	46.9	Very low	104 Å²	104	105.8 Å²	105.8	68%	0.675	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-61.7	-22.3	-177.2	21.1	-31.3	0	0	0	114.7	S254	P252-S254 VanDerWaalsContact C-N 3.33Å; P252-S254 PolarHBondContact O-N 3.28Å
253	D	40.9	Very low	47.7	Very low	150 Å²	150	102.7 Å²	102.7	80%	0.802	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-83.4	-2.8	179	-68.6	-30.1	0	0	0	114.3	H251	H251-D253 PolarHBondContact O-N 2.91Å; H251-D253 VanDerWaalsContact O-N 3.15Å
254	S	39.8	Very low	48.7	Very low	76 Å²	76	100.9 Å²	100.9	53%	0.531	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-90.9	3	-173.2	-155.6	0	0	0	0	114.6	H251 P252	H251-S254 WeakPolarHBondContact O-CB 3.49Å; H251-S254 PolarHBondContact O-N 3.15Å; H251-S254 VanDerWaalsContact O-N 3.13Å; P252-S254 VanDerWaalsContact C-N 3.33Å; P252-S254 PolarHBondContact O-N 3.28Å
255	N	40.5	Very low	50.3	Low	116 Å²	116	101.1 Å²	101.1	62%	0.62	52%	0.523	S	S	*	.			trans	-104.7	23.5	-177.5	-164.9	30.8	0	0	0	115
256	S	39.2	Very low	50.7	Low	77 Å²	77	102 Å²	102	54%	0.538	53%	0.531	S	S	.	.	S	Bend	trans	-103.5	19.9	-176.2	54	0	0	0	0	115.2
257	E	37.9	Very low	51.2	Low	105 Å²	105	100.8 Å²	100.8	49%	0.491	53%	0.531	S	S	.	.			trans	-161.3	41.1	-179.1	-118.7	165.9	-160.3	0	0	115.9	H259 L492 R495	E257-H259 PolarHBondContact O-N 3.06Å; E257-L492 HydrophobicContact CG-CD1 4.29Å; E257-L492 VanDerWaalsContact OE1-CD1 3.31Å; E257-L492 WeakPolarHBondContact OE1-CD1 3.25Å; E257-R495 IonicContact OE2-NE 2.59Å
258	E	36.2	Very low	52.5	Low	152 Å²	152	97 Å²	97	71%	0.71	52%	0.517	S	S	*	.			trans	-84.9	90.2	158.6	-169	157.8	-150.8	0	0	109.2	V260 R261	E258-V260 PolarHBondContact O-N 3.44Å; E258-R261 IonicContact OE1-NH1 3.82Å
259	H	41.1	Very low	53.6	Low	148 Å²	148	96.4 Å²	96.4	69%	0.685	51%	0.511	S	S	*	.			trans	-49.7	113.6	168.7	-153.6	81.6	0	0	0	108.5	E257 R261	E257-H259 PolarHBondContact O-N 3.06Å; H259-R261 PolarHBondContact O-N 2.9Å
260	V	43.9	Very low	54.5	Low	60 Å²	60	93.4 Å²	93.4	36%	0.364	50%	0.497	S	S	.	.			trans	-60.7	100	179.4	-171.7	0	0	0	0	107.6	E258 P425 Y481	E258-V260 PolarHBondContact O-N 3.44Å; V260-P425 HydrophobicContact CG1-CG 3.88Å; V260-Y481 HydrophobicContact CG2-CD1 4.31Å; V260-Y481 HydrophobicContact CG2-CE1 3.89Å
261	R	48.6	Very low	55.9	Low	194 Å²	194	92 Å²	92	73%	0.732	48%	0.48	S	S	*	.			trans	-63.2	145.2	176.2	-64	-172.8	-174.9	98.7	2	107.6	E258 H259 V263	E258-R261 IonicContact OE1-NH1 3.82Å; H259-R261 PolarHBondContact O-N 2.9Å; R261-V263 PolarHBondContact O-N 3.48Å; R261-V263 VanDerWaalsContact O-N 3.07Å
262	S	59.5	Low	57.6	Low	61 Å²	61	90.3 Å²	90.3	43%	0.427	47%	0.472	S	S	.	.			trans	-52.5	121.1	178.9	-171.5	0	0	0	0	110	L264 R269	S262-L264 PolarHBondContact O-N 3.04Å; S262-R269 PolarHBondContact OG-NH2 3.12Å
263	V	67.9	Low	58.9	Low	25 Å²	25	87.2 Å²	87.2	15%	0.152	45%	0.449	C	S	.	.	S	Bend	trans	-68	-9.9	-179.6	169.3	0	0	0	0	112.9	R261 P425 K426 T427	R261-V263 PolarHBondContact O-N 3.48Å; R261-V263 VanDerWaalsContact O-N 3.07Å; V263-P425 HydrophobicContact CG2-CB 4.12Å; V263-P425 HydrophobicContact CG2-CG 3.96Å; V263-K426 VanDerWaalsContact CG1-C 3.41Å; V263-K426 WeakPolarHBondContact CG1-O 3.33Å; V263-T427 HydrophobicContact CG1-CG2 3.98Å
264	L	71.5	Confident	60.7	Low	18 Å²	18	86.6 Å²	86.6	9%	0.094	44%	0.44	C	S	.	.	S	Bend	trans	-94.4	133.4	172	-64.8	177.8	0	0	0	111.3	S262 E268 K272 I471 A475	S262-L264 PolarHBondContact O-N 3.04Å; L264-E268 HydrophobicContact CB-CB 4.33Å; L264-E268 HydrophobicContact CD2-CB 4.08Å; L264-K272 HydrophobicContact CD1-CD 3.89Å; L264-I471 HydrophobicContact CD1-CG2 4.23Å; L264-I471 HydrophobicContact CD2-CB 4.33Å; L264-I471 HydrophobicContact CD2-CG1 4.48Å; L264-I471 HydrophobicContact CD2-CG2 3.73Å; L264-A475 HydrophobicContact CD1-CB 4.18Å
265	T	78.2	Confident	62.3	Low	78 Å²	78	89 Å²	89	48%	0.479	44%	0.441	S	S	.	.			trans	-64.5	162.3	166.9	65.2	0	0	0	0	111.2	A267 E268 R269	T265-A267 PolarHBondContact O-N 2.8Å; T265-E268 WeakPolarHBondContact CB-OE2 3.28Å; T265-E268 WeakPolarHBondContact CG2-OE2 3.1Å; T265-E268 PolarHBondContact N-OE2 3.3Å; T265-E268 PolarHBondContact O-N 3.03Å; T265-E268 WeakPolarHBondContact OG1-CB 3.48Å; T265-E268 WeakPolarHBondContact OG1-CG 3.48Å; T265-E268 PolarHBondContact OG1-N 2.91Å; T265-E268 PolarHBondContact OG1-OE2 3.34Å; T265-R269 WeakPolarHBondContact O-CB 3.46Å; T265-R269 PolarHBondContact O-N 3.32Å
266	K	68.6	Low	64	Low	168 Å²	168	86 Å²	86	73%	0.73	42%	0.424	S	S	*	.	H	α-helix	trans	-56.4	-36.1	176.2	-172.8	178.5	179.9	-177	0	112.4	Q270	K266-Q270 VanDerWaalsContact O-CG 3.27Å; K266-Q270 WeakPolarHBondContact O-CG 3.15Å; K266-Q270 PolarHBondContact O-N 3.4Å; K266-Q270 VanDerWaalsContact O-N 3.13Å
267	A	72	Confident	65.7	Low	68 Å²	68	84.6 Å²	84.6	56%	0.562	42%	0.423	S	S	*	.	H	α-helix	trans	-72.5	-41.6	178.9	0	0	0	0	0	112.1	T265 Q270 L271	T265-A267 PolarHBondContact O-N 2.8Å; A267-Q270 PolarHBondContact O-N 3.41Å; A267-L271 WeakPolarHBondContact O-CB 3.18Å; A267-L271 PolarHBondContact O-N 2.97Å
268	E	75.7	Confident	67.8	Low	27 Å²	27	81.1 Å²	81.1	13%	0.126	41%	0.405	C	S	.	.	H	α-helix	trans	-68.4	-38.9	176.9	-68.3	164.3	143.8	0	0	111.9	L264 T265 L271 K272 I471	L264-E268 HydrophobicContact CB-CB 4.33Å; L264-E268 HydrophobicContact CD2-CB 4.08Å; T265-E268 WeakPolarHBondContact CB-OE2 3.28Å; T265-E268 WeakPolarHBondContact CG2-OE2 3.1Å; T265-E268 PolarHBondContact N-OE2 3.3Å; T265-E268 PolarHBondContact O-N 3.03Å; T265-E268 WeakPolarHBondContact OG1-CB 3.48Å; T265-E268 WeakPolarHBondContact OG1-CG 3.48Å; T265-E268 PolarHBondContact OG1-N 2.91Å; T265-E268 PolarHBondContact OG1-OE2 3.34Å; E268-L271 WeakPolarHBondContact O-CB 2.89Å; E268-L271 PolarHBondContact O-N 2.83Å; E268-L271 VanDerWaalsContact O-N 3.15Å; E268-K272 WeakPolarHBondContact O-CB 3.28Å; E268-K272 PolarHBondContact O-N 3Å; E268-I471 HydrophobicContact CB-CD1 3.92Å; E268-I471 HydrophobicContact CB-CG1 4.11Å; E268-I471 HydrophobicContact CB-CG2 4.45Å; E268-I471 HydrophobicContact CG-CD1 3.83Å; E268-I471 HydrophobicContact CG-CG1 4.07Å
269	R	74.3	Confident	70.1	Confident	82 Å²	82	75.2 Å²	75.2	31%	0.309	38%	0.38	S	S	.	.	H	α-helix	trans	-60	-46	172.3	-179.5	175.8	-76.7	-103.1	4.4	111.5	S262 T265 L271 K272 D273 E358	S262-R269 PolarHBondContact OG-NH2 3.12Å; T265-R269 WeakPolarHBondContact O-CB 3.46Å; T265-R269 PolarHBondContact O-N 3.32Å; R269-L271 VanDerWaalsContact C-N 3.27Å; R269-L271 PolarHBondContact O-N 2.99Å; R269-K272 PolarHBondContact O-N 2.94Å; R269-D273 WeakPolarHBondContact O-CB 3.46Å; R269-D273 VanDerWaalsContact O-CG 3.29Å; R269-D273 PolarHBondContact O-N 3.26Å; R269-E358 IonicContact CZ-OE1 2.68Å; R269-E358 IonicContact NH1-OE1 2.79Å; R269-E358 PolarHBondContact NH1-OE1 3.5Å; R269-E358 IonicContact NH1-OE2 3.09Å; R269-E358 PolarHBondContact NH1-OE2 3.03Å; R269-E358 IonicContact NH2-OE1 3.13Å
270	Q	72.4	Confident	72.1	Confident	98 Å²	98	73.2 Å²	73.2	46%	0.458	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-34.4	174.7	-76	176.2	8	0	0	112.7	K266 A267 K274	K266-Q270 VanDerWaalsContact O-CG 3.27Å; K266-Q270 WeakPolarHBondContact O-CG 3.15Å; K266-Q270 PolarHBondContact O-N 3.4Å; K266-Q270 VanDerWaalsContact O-N 3.13Å; A267-Q270 PolarHBondContact O-N 3.41Å; Q270-K274 WeakPolarHBondContact O-CB 3.19Å; Q270-K274 VanDerWaalsContact O-CG 3.23Å; Q270-K274 WeakPolarHBondContact O-CG 3.28Å; Q270-K274 PolarHBondContact O-N 2.9Å; Q270-K274 VanDerWaalsContact O-N 3.09Å
271	L	75.4	Confident	74.1	Confident	33 Å²	33	76 Å²	76	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-70.1	-42.7	177.3	-158.5	77.6	0	0	0	111.4	A267 E268 R269 K274 F275 K464 I468 I471	A267-L271 WeakPolarHBondContact O-CB 3.18Å; A267-L271 PolarHBondContact O-N 2.97Å; E268-L271 WeakPolarHBondContact O-CB 2.89Å; E268-L271 PolarHBondContact O-N 2.83Å; E268-L271 VanDerWaalsContact O-N 3.15Å; R269-L271 VanDerWaalsContact C-N 3.27Å; R269-L271 PolarHBondContact O-N 2.99Å; L271-K274 PolarHBondContact O-N 3.49Å; L271-F275 PolarHBondContact O-N 2.68Å; L271-K464 HydrophobicContact CD1-CB 3.95Å; L271-K464 HydrophobicContact CD1-CD 4.09Å; L271-K464 HydrophobicContact CD1-CG 4.21Å; L271-K464 HydrophobicContact CD2-CB 4.12Å; L271-K464 WeakPolarHBondContact CD2-O 3.47Å; L271-I468 HydrophobicContact CD2-CD1 4.44Å; L271-I468 HydrophobicContact CD2-CG1 3.8Å; L271-I468 HydrophobicContact CG-CG1 4.21Å; L271-I471 HydrophobicContact CD2-CD1 3.79Å
272	K	76.5	Confident	75.9	Confident	56 Å²	56	68.3 Å²	68.3	24%	0.243	36%	0.361	C	S	.	.	H	α-helix	trans	-60.2	-50.4	173	-176.6	-179.1	179.9	-59.4	0	111.1	L264 E268 R269 K274 F275 D276 I471 A475	L264-K272 HydrophobicContact CD1-CD 3.89Å; E268-K272 WeakPolarHBondContact O-CB 3.28Å; E268-K272 PolarHBondContact O-N 3Å; R269-K272 PolarHBondContact O-N 2.94Å; K272-K274 VanDerWaalsContact C-N 3.3Å; K272-K274 PolarHBondContact O-N 3.46Å; K272-F275 PolarHBondContact O-N 3.02Å; K272-F275 VanDerWaalsContact O-N 3.11Å; K272-D276 VanDerWaalsContact CG-OD2 3.29Å; K272-D276 WeakPolarHBondContact CG-OD2 3.39Å; K272-D276 IonicContact NZ-OD2 3.34Å; K272-D276 PolarHBondContact NZ-OD2 2.94Å; K272-D276 WeakPolarHBondContact O-CB 3.47Å; K272-D276 PolarHBondContact O-N 3.3Å; K272-I471 HydrophobicContact CB-CG2 3.92Å; K272-I471 HydrophobicContact CD-CG2 4.45Å; K272-I471 HydrophobicContact CG-CG2 4.47Å; K272-A475 HydrophobicContact CD-CB 4.27Å
273	D	77.8	Confident	77.2	Confident	39 Å²	39	67.3 Å²	67.3	21%	0.209	35%	0.353	C	S	.	.	H	α-helix	trans	-56.5	-42.9	178.2	-75.4	-32.7	0	0	0	111.6	R269 G277 R278	R269-D273 WeakPolarHBondContact O-CB 3.46Å; R269-D273 VanDerWaalsContact O-CG 3.29Å; R269-D273 PolarHBondContact O-N 3.26Å; D273-G277 PolarHBondContact O-N 2.94Å; D273-R278 HydrophobicContact CB-CB 4.12Å; D273-R278 VanDerWaalsContact O-CB 3.26Å; D273-R278 WeakPolarHBondContact O-CB 3.25Å; D273-R278 PolarHBondContact O-N 3.23Å; D273-R278 WeakPolarHBondContact OD1-CD 3.27Å; D273-R278 IonicContact OD1-NH1 3.48Å; D273-R278 PolarHBondContact OD1-NH1 2.78Å; D273-R278 IonicContact OD2-NH1 2.75Å
274	K	77	Confident	77.9	Confident	138 Å²	138	71.5 Å²	71.5	60%	0.6	38%	0.38	S	S	*	.	H	α-helix	trans	-64.4	-40.7	176.6	-75.8	172.2	-177.1	-178.2	0	112.9	Q270 L271 K272 G277	Q270-K274 WeakPolarHBondContact O-CB 3.19Å; Q270-K274 VanDerWaalsContact O-CG 3.23Å; Q270-K274 WeakPolarHBondContact O-CG 3.28Å; Q270-K274 PolarHBondContact O-N 2.9Å; Q270-K274 VanDerWaalsContact O-N 3.09Å; L271-K274 PolarHBondContact O-N 3.49Å; K272-K274 VanDerWaalsContact C-N 3.3Å; K272-K274 PolarHBondContact O-N 3.46Å; K274-G277 PolarHBondContact O-N 3.3Å
275	F	74.9	Confident	78.8	Confident	125 Å²	125	73.7 Å²	73.7	55%	0.548	39%	0.392	S	S	.	.	H	α-helix	trans	-76.4	-35.6	-178.4	-169.9	-88.2	0	0	0	112.5	L271 K272 G277 I468 K472	L271-F275 PolarHBondContact O-N 2.68Å; K272-F275 PolarHBondContact O-N 3.02Å; K272-F275 VanDerWaalsContact O-N 3.11Å; F275-G277 PolarHBondContact O-N 3.39Å; F275-I468 HydrophobicContact CB-CD1 4.15Å; F275-I468 HydrophobicContact CB-CG2 4.27Å; F275-I468 HydrophobicContact CD1-CG2 3.89Å; F275-I468 HydrophobicContact CD2-CD1 3.48Å; F275-I468 VanDerWaalsContact CD2-CD1 3.48Å; F275-I468 HydrophobicContact CD2-CG2 4.06Å; F275-I468 HydrophobicContact CE1-CG2 4.2Å; F275-I468 HydrophobicContact CE2-CD1 4.1Å; F275-I468 HydrophobicContact CE2-CG2 4.34Å; F275-I468 HydrophobicContact CG-CD1 3.99Å; F275-I468 HydrophobicContact CG-CG2 3.79Å; F275-I468 HydrophobicContact CZ-CG2 4.4Å; F275-K472 VanDerWaalsContact CD1-CE 3.42Å; F275-K472 VanDerWaalsContact CD1-NZ 3.35Å
276	D	75.6	Confident	79.3	Confident	53 Å²	53	70 Å²	70	28%	0.283	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-2.3	174.8	-66.1	-19.6	0	0	0	111.6	K272 R278 F343 K472	K272-D276 VanDerWaalsContact CG-OD2 3.29Å; K272-D276 WeakPolarHBondContact CG-OD2 3.39Å; K272-D276 IonicContact NZ-OD2 3.34Å; K272-D276 PolarHBondContact NZ-OD2 2.94Å; K272-D276 WeakPolarHBondContact O-CB 3.47Å; K272-D276 PolarHBondContact O-N 3.3Å; D276-R278 VanDerWaalsContact C-N 3.34Å; D276-F343 VanDerWaalsContact O-CE2 3.24Å; D276-F343 WeakPolarHBondContact O-CE2 3.46Å; D276-K472 VanDerWaalsContact OD1-CE 3.29Å; D276-K472 WeakPolarHBondContact OD1-CE 2.91Å; D276-K472 IonicContact OD1-NZ 3.42Å; D276-K472 PolarHBondContact OD1-NZ 3.36Å
277	G	74.9	Confident	80.4	Confident	49 Å²	49	65 Å²	65	51%	0.505	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	15.8	175.9	0	0	0	0	0	113.7	D273 K274 F275 P279	D273-G277 PolarHBondContact O-N 2.94Å; K274-G277 PolarHBondContact O-N 3.3Å; F275-G277 PolarHBondContact O-N 3.39Å; G277-P279 WeakPolarHBondContact O-CD 3.47Å
278	R	82.7	Confident	81.3	Confident	32 Å²	32	63.4 Å²	63.4	12%	0.121	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-62.4	123.3	177.1	-171.5	177.3	-179.4	171.5	3.4	109.1	D273 D276 F343 E358 E359	D273-R278 HydrophobicContact CB-CB 4.12Å; D273-R278 VanDerWaalsContact O-CB 3.26Å; D273-R278 WeakPolarHBondContact O-CB 3.25Å; D273-R278 PolarHBondContact O-N 3.23Å; D273-R278 WeakPolarHBondContact OD1-CD 3.27Å; D273-R278 IonicContact OD1-NH1 3.48Å; D273-R278 PolarHBondContact OD1-NH1 2.78Å; D273-R278 IonicContact OD2-NH1 2.75Å; D276-R278 VanDerWaalsContact C-N 3.34Å; R278-F343 HydrophobicContact CB-CE1 4Å; R278-F343 HydrophobicContact CB-CE2 4.27Å; R278-F343 HydrophobicContact CB-CZ 3.86Å; R278-F343 HydrophobicContact CG-CD1 4.21Å; R278-F343 HydrophobicContact CG-CE1 3.82Å; R278-F343 HydrophobicContact CG-CZ 4.21Å; R278-E358 IonicContact NH1-OE2 3.86Å; R278-E358 PolarHBondContact NH1-OE2 3.3Å; R278-E359 IonicContact CZ-OE1 3.75Å; R278-E359 IonicContact NH2-OE1 3.05Å; R278-E359 PolarHBondContact NH2-OE1 3.24Å
279	P	84.5	Confident	82	Confident	28 Å²	28	62.2 Å²	62.2	18%	0.182	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-58.6	147.4	178.8	-27.2	36.9	0	0	0	111.9	G277 Y336 D339 F343	G277-P279 WeakPolarHBondContact O-CD 3.47Å; P279-Y336 HydrophobicContact CB-CD2 3.76Å; P279-Y336 HydrophobicContact CB-CE2 3.77Å; P279-Y336 WeakPolarHBondContact O-CE2 3.14Å; P279-D339 HydrophobicContact CB-CB 4.12Å; P279-D339 HydrophobicContact CG-CB 3.69Å; P279-F343 HydrophobicContact CG-CB 4.38Å
280	T	82.5	Confident	82.8	Confident	105 Å²	105	59 Å²	59	64%	0.644	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-93.4	136.9	178.8	59.8	0	0	0	0	111	Y336	T280-Y336 VanDerWaalsContact C-CE2 3.44Å; T280-Y336 WeakPolarHBondContact O-CD2 3.28Å; T280-Y336 WeakPolarHBondContact O-CE2 3.48Å
281	K	84.8	Confident	83.6	Confident	119 Å²	119	54.8 Å²	54.8	52%	0.517	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-63.4	126.7	-178.6	-73	179.4	179.5	-178.2	0	110.3	Y336 E359	K281-Y336 HydrophobicContact CB-CE2 4.48Å; K281-Y336 WeakPolarHBondContact CE-OH 3.5Å; K281-Y336 HydrophobicContact CG-CE1 4Å; K281-Y336 HydrophobicContact CG-CE2 3.91Å; K281-Y336 VanDerWaalsContact CG-CZ 3.46Å; K281-Y336 VanDerWaalsContact CG-OH 3.25Å; K281-Y336 WeakPolarHBondContact CG-OH 3.3Å; K281-E359 WeakPolarHBondContact CE-OE1 3.44Å; K281-E359 WeakPolarHBondContact CE-OE2 3.35Å; K281-E359 VanDerWaalsContact NZ-CD 3.34Å; K281-E359 IonicContact NZ-OE1 3.67Å; K281-E359 PolarHBondContact NZ-OE1 3.44Å; K281-E359 IonicContact NZ-OE2 3.02Å; K281-E359 PolarHBondContact NZ-OE2 2.88Å
282	P	87.1	Confident	84.2	Confident	33 Å²	33	55.2 Å²	55.2	21%	0.214	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-69.9	160.9	177.2	27	-31.3	0	0	0	110.9	K332 K333 Y336	P282-K332 HydrophobicContact CB-CB 4.09Å; P282-K333 HydrophobicContact CG-CB 4.31Å; P282-Y336 VanDerWaalsContact CD-CG 3.5Å; P282-Y336 HydrophobicContact CG-CG 4.31Å
283	P	87.3	Confident	84.7	Confident	39 Å²	39	54.7 Å²	54.7	25%	0.253	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-52.3	145.9	173	-26.3	35.1	0	0	0	112.1	N285 L289 A292 C329	P283-N285 PolarHBondContact O-N 2.96Å; P283-L289 HydrophobicContact CB-CB 4.38Å; P283-L289 HydrophobicContact CG-CD1 4.24Å; P283-A292 HydrophobicContact CG-CB 4.17Å; P283-C329 PolarHBondContact O-SG 3.14Å
284	P	81.8	Confident	85	Confident	113 Å²	113	54.5 Å²	54.5	73%	0.734	30%	0.301	S	S	*	.	S	Bend	trans	-78.1	-19.3	-167.5	29	-36.2	0	0	0	115
285	N	91.3	Very high	85.2	Confident	65 Å²	65	49.8 Å²	49.8	35%	0.348	28%	0.281	S	S	.	.	S	Bend	trans	-148.4	166.9	-177.8	65.4	51.7	0	0	0	111.5	P283 Y287 S288 L289	P283-N285 PolarHBondContact O-N 2.96Å; N285-Y287 VanDerWaalsContact C-N 3.29Å; N285-Y287 PolarHBondContact O-N 3.12Å; N285-Y287 WeakPolarHBondContact OD1-CA 3.44Å; N285-Y287 WeakPolarHBondContact OD1-CB 3.41Å; N285-Y287 PolarHBondContact OD1-N 2.96Å; N285-S288 PolarHBondContact ND2-OG 3.48Å; N285-S288 PolarHBondContact O-N 2.92Å; N285-S288 PolarHBondContact OD1-N 3.22Å; N285-S288 PolarHBondContact OD1-OG 3.24Å; N285-S288 VanDerWaalsContact OD1-OG 3.13Å; N285-L289 PolarHBondContact O-N 3.37Å
286	G	89.1	Confident	85.6	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-34.3	-179.5	0	0	0	0	0	114.6	L289 Y290 Q326	G286-L289 PolarHBondContact O-N 3.45Å; G286-Y290 WeakPolarHBondContact O-CB 3.36Å; G286-Y290 PolarHBondContact O-N 2.99Å; G286-Q326 VanDerWaalsContact N-OE1 3.12Å
287	Y	91.1	Very high	85.7	Confident	61 Å²	61	52.1 Å²	52.1	24%	0.239	30%	0.303	C	S	.	.	H	α-helix	trans	-67.4	-45.5	176.3	172.2	-115.2	0	0	0	112	N285 L289 Y290 C291 S311 W314	N285-Y287 VanDerWaalsContact C-N 3.29Å; N285-Y287 PolarHBondContact O-N 3.12Å; N285-Y287 WeakPolarHBondContact OD1-CA 3.44Å; N285-Y287 WeakPolarHBondContact OD1-CB 3.41Å; N285-Y287 PolarHBondContact OD1-N 2.96Å; Y287-L289 VanDerWaalsContact C-N 3.27Å; Y287-L289 PolarHBondContact O-N 3.41Å; Y287-Y290 WeakPolarHBondContact O-CB 2.81Å; Y287-Y290 PolarHBondContact O-N 3.01Å; Y287-C291 WeakPolarHBondContact CE2-SG 3.22Å; Y287-C291 PolarHBondContact O-N 3.22Å; Y287-C291 PolarHBondContact O-SG 3.34Å; Y287-S311 WeakPolarHBondContact OH-CA 3.49Å; Y287-S311 WeakPolarHBondContact OH-CB 3.49Å; Y287-W314 HydrophobicContact CD2-CB 3.67Å; Y287-W314 AromaticContact CD2-CD1 3.57Å; Y287-W314 AromaticContact CD2-CD2 3.46Å; Y287-W314 HydrophobicContact CD2-CD2 3.46Å; Y287-W314 VanDerWaalsContact CD2-CD2 3.46Å; Y287-W314 AromaticContact CD2-CE2 3.85Å; Y287-W314 HydrophobicContact CD2-CE3 4Å; Y287-W314 AromaticContact CD2-CG 3.28Å; Y287-W314 HydrophobicContact CD2-CG 3.28Å; Y287-W314 AromaticContact CD2-NE1 3.9Å; Y287-W314 HydrophobicContact CE2-CB 3.58Å; Y287-W314 HydrophobicContact CE2-CD2 4.32Å; Y287-W314 AromaticContact CE2-CG 3.7Å; Y287-W314 HydrophobicContact CE2-CG 3.7Å; Y287-W314 HydrophobicContact CG-CD2 4.27Å; Y287-W314 HydrophobicContact CG-CG 4.34Å
288	S	91	Very high	85.5	Confident	36 Å²	36	52 Å²	52	25%	0.252	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-34.4	177	-59.9	0	0	0	0	111.5	N285 A292	N285-S288 PolarHBondContact ND2-OG 3.48Å; N285-S288 PolarHBondContact O-N 2.92Å; N285-S288 PolarHBondContact OD1-N 3.22Å; N285-S288 PolarHBondContact OD1-OG 3.24Å; N285-S288 VanDerWaalsContact OD1-OG 3.13Å; S288-A292 WeakPolarHBondContact O-CB 3.14Å; S288-A292 PolarHBondContact O-N 3.01Å
289	L	90.2	Very high	85.1	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-45.6	172.1	-178.8	64.9	0	0	0	111.5	P283 N285 G286 Y287 C291 A292 E293 R328 C329 K332	P283-L289 HydrophobicContact CB-CB 4.38Å; P283-L289 HydrophobicContact CG-CD1 4.24Å; N285-L289 PolarHBondContact O-N 3.37Å; G286-L289 PolarHBondContact O-N 3.45Å; Y287-L289 VanDerWaalsContact C-N 3.27Å; Y287-L289 PolarHBondContact O-N 3.41Å; L289-C291 PolarHBondContact O-N 2.95Å; L289-A292 PolarHBondContact O-N 2.94Å; L289-E293 HydrophobicContact CD1-CG 4.45Å; L289-E293 WeakPolarHBondContact O-CG 3.29Å; L289-E293 PolarHBondContact O-N 2.98Å; L289-R328 HydrophobicContact CD2-CB 3.93Å; L289-R328 HydrophobicContact CD2-CG 3.96Å; L289-C329 HydrophobicContact CB-CB 4.36Å; L289-C329 HydrophobicContact CD2-CB 3.92Å; L289-K332 HydrophobicContact CD1-CD 3.71Å; L289-K332 HydrophobicContact CD2-CD 4.38Å
290	Y	90.8	Very high	84.9	Confident	15 Å²	15	65 Å²	65	6%	0.059	35%	0.352	C	S	.	.	H	α-helix	trans	-58.8	-46.2	175.1	173.3	-102.7	0	0	0	111.8	G286 Y287 A292 E293 L294 C310 Q313 W314 L317 F325	G286-Y290 WeakPolarHBondContact O-CB 3.36Å; G286-Y290 PolarHBondContact O-N 2.99Å; Y287-Y290 WeakPolarHBondContact O-CB 2.81Å; Y287-Y290 PolarHBondContact O-N 3.01Å; Y290-A292 PolarHBondContact O-N 3.44Å; Y290-E293 PolarHBondContact O-N 3.39Å; Y290-L294 HydrophobicContact CE1-CD2 4.1Å; Y290-L294 WeakPolarHBondContact O-CB 3.48Å; Y290-L294 PolarHBondContact O-N 3.37Å; Y290-C310 WeakPolarHBondContact CE1-O 3.44Å; Y290-Q313 HydrophobicContact CE1-CB 4.26Å; Y290-Q313 WeakPolarHBondContact OH-CB 3.22Å; Y290-Q313 PolarHBondContact OH-OE1 3.17Å; Y290-Q313 VanDerWaalsContact OH-OE1 3.07Å; Y290-W314 HydrophobicContact CD1-CB 4.2Å; Y290-W314 AromaticContact CD1-CE3 3.71Å; Y290-W314 HydrophobicContact CD1-CE3 3.71Å; Y290-W314 HydrophobicContact CD1-CZ3 4.5Å; Y290-W314 HydrophobicContact CD2-CE3 4.44Å; Y290-W314 HydrophobicContact CE1-CB 4.17Å; Y290-W314 HydrophobicContact CE1-CE3 4.45Å; Y290-W314 AromaticContact CG-CE3 3.7Å; Y290-W314 HydrophobicContact CG-CE3 3.7Å; Y290-W314 HydrophobicContact CG-CZ3 4.07Å; Y290-L317 HydrophobicContact CD2-CD1 4.06Å; Y290-L317 HydrophobicContact CE1-CD1 4.47Å; Y290-L317 HydrophobicContact CE2-CD1 3.8Å; Y290-F325 HydrophobicContact CD2-CD1 4.43Å; Y290-F325 HydrophobicContact CD2-CD2 4.27Å; Y290-F325 AromaticContact CD2-CE1 3.92Å; Y290-F325 HydrophobicContact CD2-CE1 3.92Å; Y290-F325 AromaticContact CD2-CE2 3.75Å; Y290-F325 HydrophobicContact CD2-CE2 3.75Å; Y290-F325 AromaticContact CD2-CZ 3.57Å; Y290-F325 HydrophobicContact CD2-CZ 3.57Å; Y290-F325 HydrophobicContact CE2-CE2 4.32Å; Y290-F325 HydrophobicContact CE2-CZ 4.18Å
291	C	88.6	Confident	84.6	Confident	8 Å²	8	62 Å²	62	5%	0.054	33%	0.334	C	S	.	.	H	α-helix	trans	-59.7	-45.6	175.6	-63.1	0	0	0	0	111.6	Y287 L289 E293 L294 M295 C310	Y287-C291 WeakPolarHBondContact CE2-SG 3.22Å; Y287-C291 PolarHBondContact O-N 3.22Å; Y287-C291 PolarHBondContact O-SG 3.34Å; L289-C291 PolarHBondContact O-N 2.95Å; C291-E293 VanDerWaalsContact C-N 3.32Å; C291-E293 PolarHBondContact O-N 3.14Å; C291-L294 PolarHBondContact O-N 3.33Å; C291-M295 VanDerWaalsContact O-CB 3.29Å; C291-M295 WeakPolarHBondContact O-CB 3.38Å; C291-M295 WeakPolarHBondContact O-CG 3.45Å; C291-M295 PolarHBondContact O-N 3.08Å; C291-C310 HydrophobicContact CB-CB 4.24Å; C291-C310 VanDerWaalsContact SG-CB 3.56Å
292	A	87.9	Confident	84.6	Confident	42 Å²	42	59.6 Å²	59.6	35%	0.347	33%	0.33	S	S	.	.	H	α-helix	trans	-62.3	-38.5	179.7	0	0	0	0	0	112.3	P283 S288 L289 Y290 V296	P283-A292 HydrophobicContact CG-CB 4.17Å; S288-A292 WeakPolarHBondContact O-CB 3.14Å; S288-A292 PolarHBondContact O-N 3.01Å; L289-A292 PolarHBondContact O-N 2.94Å; Y290-A292 PolarHBondContact O-N 3.44Å; A292-V296 WeakPolarHBondContact O-CG2 2.98Å
293	E	88.8	Confident	84	Confident	46 Å²	46	61.4 Å²	61.4	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-73.6	-42.2	177.8	-68.4	-174.5	177.6	0	0	111.7	L289 Y290 C291 M295 V296 N297 R328 K332	L289-E293 HydrophobicContact CD1-CG 4.45Å; L289-E293 WeakPolarHBondContact O-CG 3.29Å; L289-E293 PolarHBondContact O-N 2.98Å; Y290-E293 PolarHBondContact O-N 3.39Å; C291-E293 VanDerWaalsContact C-N 3.32Å; C291-E293 PolarHBondContact O-N 3.14Å; E293-M295 VanDerWaalsContact C-N 3.34Å; E293-M295 PolarHBondContact O-N 3.39Å; E293-V296 PolarHBondContact O-N 3.02Å; E293-N297 PolarHBondContact O-OD1 3.07Å; E293-R328 IonicContact OE1-CZ 3.21Å; E293-R328 IonicContact OE1-NE 3.86Å; E293-R328 PolarHBondContact OE1-NE 3.41Å; E293-R328 IonicContact OE1-NH1 2.72Å; E293-R328 PolarHBondContact OE1-NH1 2.87Å; E293-R328 IonicContact OE1-NH2 2.91Å; E293-R328 PolarHBondContact OE1-NH2 3.4Å; E293-R328 IonicContact OE2-CZ 3.64Å; E293-R328 VanDerWaalsContact OE2-CZ 3.28Å; E293-R328 IonicContact OE2-NH1 3.18Å; E293-R328 PolarHBondContact OE2-NH1 3.25Å; E293-R328 IonicContact OE2-NH2 3.93Å; E293-R328 PolarHBondContact OE2-NH2 3.01Å; E293-K332 IonicContact OE1-NZ 3.07Å; E293-K332 PolarHBondContact OE1-NZ 3.23Å
294	L	83.6	Confident	83.7	Confident	35 Å²	35	64.8 Å²	64.8	18%	0.183	36%	0.363	C	S	.	.	H	α-helix	trans	-67.2	-34.8	179.4	-162	71.2	0	0	0	112.5	Y290 C291 V296 N297 M298 C310	Y290-L294 HydrophobicContact CE1-CD2 4.1Å; Y290-L294 WeakPolarHBondContact O-CB 3.48Å; Y290-L294 PolarHBondContact O-N 3.37Å; C291-L294 PolarHBondContact O-N 3.33Å; L294-V296 VanDerWaalsContact C-N 3.27Å; L294-V296 PolarHBondContact O-N 3.3Å; L294-N297 PolarHBondContact O-N 2.81Å; L294-M298 HydrophobicContact CD2-CE 3.93Å; L294-M298 HydrophobicContact CG-CE 3.9Å; L294-M298 PolarHBondContact O-N 3.48Å; L294-C310 HydrophobicContact CD2-CB 4.34Å
295	M	80.6	Confident	83.9	Confident	38 Å²	38	64.4 Å²	64.4	19%	0.187	35%	0.352	C	S	.	.	H	α-helix	trans	-65.1	-26.6	178.1	-78.9	-179.4	171.6	0	0	113.8	C291 E293 N297 R306 M307	C291-M295 VanDerWaalsContact O-CB 3.29Å; C291-M295 WeakPolarHBondContact O-CB 3.38Å; C291-M295 WeakPolarHBondContact O-CG 3.45Å; C291-M295 PolarHBondContact O-N 3.08Å; E293-M295 VanDerWaalsContact C-N 3.34Å; E293-M295 PolarHBondContact O-N 3.39Å; M295-N297 VanDerWaalsContact C-N 3.31Å; M295-R306 HydrophobicContact CE-CB 4.49Å; M295-R306 HydrophobicContact CG-CB 4.43Å; M295-R306 PolarHBondContact O-NH1 3.5Å; M295-M307 HydrophobicContact CE-CB 4.37Å; M295-M307 HydrophobicContact CE-CE 3.39Å; M295-M307 HydrophobicContact CE-SD 3.97Å
296	V	82.4	Confident	83.5	Confident	94 Å²	94	63.8 Å²	63.8	57%	0.57	35%	0.345	S	S	*	.	H	α-helix	trans	-72.4	-29.9	176.9	174.2	0	0	0	0	111.2	A292 E293 L294 K299	A292-V296 WeakPolarHBondContact O-CG2 2.98Å; E293-V296 PolarHBondContact O-N 3.02Å; L294-V296 VanDerWaalsContact C-N 3.27Å; L294-V296 PolarHBondContact O-N 3.3Å; V296-K299 WeakPolarHBondContact O-CE 3.37Å
297	N	78.1	Confident	83.3	Confident	133 Å²	133	68.2 Å²	68.2	71%	0.711	37%	0.366	S	S	*	.	H	α-helix	trans	-87.1	-21.4	-175.7	-69.8	38.6	0	0	0	113.1	E293 L294 M295	E293-N297 PolarHBondContact O-OD1 3.07Å; L294-N297 PolarHBondContact O-N 2.81Å; M295-N297 VanDerWaalsContact C-N 3.31Å
298	M	70.5	Confident	83.2	Confident	47 Å²	47	70 Å²	70	23%	0.232	38%	0.384	C	S	.	.			trans	-110.8	75.7	179.6	-61.1	-169.2	-58.1	0	0	111.1	L294 V301 R306 L309	L294-M298 HydrophobicContact CD2-CE 3.93Å; L294-M298 HydrophobicContact CG-CE 3.9Å; L294-M298 PolarHBondContact O-N 3.48Å; M298-V301 HydrophobicContact CB-CG2 4.41Å; M298-R306 HydrophobicContact CB-CG 4.46Å; M298-R306 HydrophobicContact CE-CG 4.39Å; M298-R306 WeakPolarHBondContact O-CD 3.35Å; M298-L309 HydrophobicContact CE-CB 4.09Å; M298-L309 HydrophobicContact CE-CD1 3.95Å; M298-L309 HydrophobicContact SD-CD1 4.03Å
299	K	74.3	Confident	83	Confident	170 Å²	170	71.5 Å²	71.5	74%	0.739	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-19.3	-176.6	-65	-179.6	-177.2	175.8	0	114.5	V296	V296-K299 WeakPolarHBondContact O-CE 3.37Å
300	N	80.3	Confident	83	Confident	164 Å²	164	71.4 Å²	71.4	88%	0.877	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	9.6	-173.3	-58.3	-19.9	0	0	0	113.8
301	V	77.4	Confident	82.9	Confident	42 Å²	42	72.7 Å²	72.7	26%	0.255	40%	0.399	S	S	.	.	S	Bend	trans	-110.3	132.7	-179.8	178.6	0	0	0	0	108.4	M298 E305 R306 L309	M298-V301 HydrophobicContact CB-CG2 4.41Å; V301-E305 HydrophobicContact CG1-CB 3.57Å; V301-R306 HydrophobicContact CB-CG 3.71Å; V301-R306 HydrophobicContact CG1-CG 3.76Å; V301-R306 WeakPolarHBondContact O-CD 3.24Å; V301-R306 WeakPolarHBondContact O-CG 3.2Å; V301-R306 PolarHBondContact O-NE 3.21Å; V301-L309 HydrophobicContact CG1-CD1 4.15Å
302	P	85.1	Confident	83.1	Confident	67 Å²	67	78.7 Å²	78.7	44%	0.435	42%	0.424	S	S	.	.			trans	-50.2	143.8	176.9	-28.7	35.5	0	0	0	112.8	T304 E305 R306	P302-T304 PolarHBondContact O-N 3.36Å; P302-T304 VanDerWaalsContact O-N 3.16Å; P302-E305 HydrophobicContact CB-CB 4.44Å; P302-E305 HydrophobicContact CB-CG 4.36Å; P302-E305 PolarHBondContact O-N 3.31Å; P302-E305 VanDerWaalsContact O-N 3.1Å; P302-R306 WeakPolarHBondContact O-CG 3.3Å; P302-R306 PolarHBondContact O-N 2.77Å
303	S	74.9	Confident	83.1	Confident	72 Å²	72	81.6 Å²	81.6	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-61.7	-29.8	-171	-161.2	0	0	0	0	114.5	R306 M307	S303-R306 PolarHBondContact OG-NH2 3.19Å; S303-R306 VanDerWaalsContact OG-NH2 3.08Å; S303-M307 PolarHBondContact O-N 3.33Å
304	T	79.6	Confident	83.3	Confident	109 Å²	109	81.8 Å²	81.8	67%	0.669	43%	0.429	S	S	*	.	H	α-helix	trans	-67.2	-49.4	174.2	45	0	0	0	0	110.8	P302 R306 M307 V308	P302-T304 PolarHBondContact O-N 3.36Å; P302-T304 VanDerWaalsContact O-N 3.16Å; T304-R306 PolarHBondContact O-N 3.45Å; T304-M307 WeakPolarHBondContact O-CB 3.35Å; T304-M307 PolarHBondContact O-N 3.05Å; T304-V308 PolarHBondContact O-N 3.49Å
305	E	85.6	Confident	83.7	Confident	106 Å²	106	87.7 Å²	87.7	50%	0.495	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-39.2	175.7	-70.7	177.1	-150.7	0	0	112.6	V301 P302 M307 V308 L309	V301-E305 HydrophobicContact CG1-CB 3.57Å; P302-E305 HydrophobicContact CB-CB 4.44Å; P302-E305 HydrophobicContact CB-CG 4.36Å; P302-E305 PolarHBondContact O-N 3.31Å; P302-E305 VanDerWaalsContact O-N 3.1Å; E305-M307 PolarHBondContact O-N 2.85Å; E305-V308 PolarHBondContact O-N 2.88Å; E305-V308 VanDerWaalsContact O-N 3.15Å; E305-L309 WeakPolarHBondContact O-CG 3.37Å; E305-L309 PolarHBondContact O-N 2.91Å
306	R	84.3	Confident	84.2	Confident	52 Å²	52	92.9 Å²	92.9	20%	0.196	48%	0.479	C	S	.	.	H	α-helix	trans	-57	-39.8	174.8	-69.6	-173.6	-55.2	159.9	-0.3	111.7	M295 M298 V301 P302 S303 T304 C310	M295-R306 HydrophobicContact CE-CB 4.49Å; M295-R306 HydrophobicContact CG-CB 4.43Å; M295-R306 PolarHBondContact O-NH1 3.5Å; M298-R306 HydrophobicContact CB-CG 4.46Å; M298-R306 HydrophobicContact CE-CG 4.39Å; M298-R306 WeakPolarHBondContact O-CD 3.35Å; V301-R306 HydrophobicContact CB-CG 3.71Å; V301-R306 HydrophobicContact CG1-CG 3.76Å; V301-R306 WeakPolarHBondContact O-CD 3.24Å; V301-R306 WeakPolarHBondContact O-CG 3.2Å; V301-R306 PolarHBondContact O-NE 3.21Å; P302-R306 WeakPolarHBondContact O-CG 3.3Å; P302-R306 PolarHBondContact O-N 2.77Å; S303-R306 PolarHBondContact OG-NH2 3.19Å; S303-R306 VanDerWaalsContact OG-NH2 3.08Å; T304-R306 PolarHBondContact O-N 3.45Å; R306-C310 PolarHBondContact O-N 3.5Å; R306-C310 PolarHBondContact O-SG 3.47Å
307	M	85.3	Confident	84.6	Confident	93 Å²	93	89.9 Å²	89.9	46%	0.458	46%	0.459	S	S	.	.	H	α-helix	trans	-69.2	-40.1	178.6	-167.9	63.8	76.7	0	0	112	M295 S303 T304 E305 C310 S311	M295-M307 HydrophobicContact CE-CB 4.37Å; M295-M307 HydrophobicContact CE-CE 3.39Å; M295-M307 HydrophobicContact CE-SD 3.97Å; S303-M307 PolarHBondContact O-N 3.33Å; T304-M307 WeakPolarHBondContact O-CB 3.35Å; T304-M307 PolarHBondContact O-N 3.05Å; E305-M307 PolarHBondContact O-N 2.85Å; M307-C310 WeakPolarHBondContact O-CB 3.36Å; M307-C310 PolarHBondContact O-N 3.01Å; M307-S311 PolarHBondContact O-N 3.44Å
308	V	89.1	Confident	85.4	Confident	100 Å²	100	87.2 Å²	87.2	61%	0.606	45%	0.448	S	S	*	.	H	α-helix	trans	-62.1	-44.6	175.6	176.1	0	0	0	0	110.7	T304 E305 S311 K312	T304-V308 PolarHBondContact O-N 3.49Å; E305-V308 PolarHBondContact O-N 2.88Å; E305-V308 VanDerWaalsContact O-N 3.15Å; V308-S311 PolarHBondContact O-N 3.27Å; V308-K312 PolarHBondContact O-N 3.22Å
309	L	86.6	Confident	86.4	Confident	66 Å²	66	90.8 Å²	90.8	35%	0.346	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-43.6	175.2	-70	173.6	0	0	0	112.2	M298 V301 E305 S311 K312 Q313	M298-L309 HydrophobicContact CE-CB 4.09Å; M298-L309 HydrophobicContact CE-CD1 3.95Å; M298-L309 HydrophobicContact SD-CD1 4.03Å; V301-L309 HydrophobicContact CG1-CD1 4.15Å; E305-L309 WeakPolarHBondContact O-CG 3.37Å; E305-L309 PolarHBondContact O-N 2.91Å; L309-S311 VanDerWaalsContact C-N 3.3Å; L309-S311 PolarHBondContact O-N 3.27Å; L309-K312 PolarHBondContact O-N 3.24Å; L309-Q313 WeakPolarHBondContact O-CB 3.15Å; L309-Q313 WeakPolarHBondContact O-CG 3.18Å; L309-Q313 PolarHBondContact O-N 2.72Å
310	C	88.8	Confident	87.3	Confident	0 Å²	0	90.4 Å²	90.4	0%	0	46%	0.463	C	S	.	.	H	α-helix	trans	-58.1	-42.7	175.1	-68.6	0	0	0	0	111.5	Y290 C291 L294 R306 M307 W314	Y290-C310 WeakPolarHBondContact CE1-O 3.44Å; C291-C310 HydrophobicContact CB-CB 4.24Å; C291-C310 VanDerWaalsContact SG-CB 3.56Å; L294-C310 HydrophobicContact CD2-CB 4.34Å; R306-C310 PolarHBondContact O-N 3.5Å; R306-C310 PolarHBondContact O-SG 3.47Å; M307-C310 WeakPolarHBondContact O-CB 3.36Å; M307-C310 PolarHBondContact O-N 3.01Å; C310-W314 VanDerWaalsContact O-CB 3.22Å; C310-W314 WeakPolarHBondContact O-CB 3.48Å; C310-W314 PolarHBondContact O-N 3.44Å
311	S	90.3	Very high	87.9	Confident	42 Å²	42	85.9 Å²	85.9	29%	0.294	44%	0.436	S	S	.	.	H	α-helix	trans	-67	-44.8	178	-167.1	0	0	0	0	112.2	Y287 M307 V308 L309 W314 K315	Y287-S311 WeakPolarHBondContact OH-CA 3.49Å; Y287-S311 WeakPolarHBondContact OH-CB 3.49Å; M307-S311 PolarHBondContact O-N 3.44Å; V308-S311 PolarHBondContact O-N 3.27Å; L309-S311 VanDerWaalsContact C-N 3.3Å; L309-S311 PolarHBondContact O-N 3.27Å; S311-W314 PolarHBondContact O-N 3.06Å; S311-K315 WeakPolarHBondContact O-CG 3.36Å; S311-K315 PolarHBondContact O-N 2.98Å; S311-K315 VanDerWaalsContact O-N 3.09Å
312	K	91.7	Very high	88.7	Confident	135 Å²	135	85.7 Å²	85.7	59%	0.587	43%	0.432	S	S	*	.	H	α-helix	trans	-60.7	-48.6	178.5	-174.7	176.8	179.6	178.6	0	111.2	V308 L309 K315 M316	V308-K312 PolarHBondContact O-N 3.22Å; L309-K312 PolarHBondContact O-N 3.24Å; K312-K315 PolarHBondContact O-N 2.76Å; K312-M316 WeakPolarHBondContact O-CG 2.87Å; K312-M316 PolarHBondContact O-N 3.46Å
313	Q	88.6	Confident	89	Confident	102 Å²	102	86 Å²	86	48%	0.477	43%	0.43	S	S	.	.	H	α-helix	trans	-69.2	-38.3	179.4	-68.6	-133.9	-16.6	0	0	112.6	Y290 L309 K315 M316 L317	Y290-Q313 HydrophobicContact CE1-CB 4.26Å; Y290-Q313 WeakPolarHBondContact OH-CB 3.22Å; Y290-Q313 PolarHBondContact OH-OE1 3.17Å; Y290-Q313 VanDerWaalsContact OH-OE1 3.07Å; L309-Q313 WeakPolarHBondContact O-CB 3.15Å; L309-Q313 WeakPolarHBondContact O-CG 3.18Å; L309-Q313 PolarHBondContact O-N 2.72Å; Q313-K315 VanDerWaalsContact C-N 3.26Å; Q313-K315 PolarHBondContact O-N 3.4Å; Q313-M316 PolarHBondContact O-N 2.82Å; Q313-L317 WeakPolarHBondContact O-CG 3.05Å; Q313-L317 PolarHBondContact O-N 3Å
314	W	92	Very high	89.9	Confident	51 Å²	51	87.8 Å²	87.8	19%	0.193	43%	0.431	C	S	.	.	H	α-helix	trans	-59.5	-37.2	174.7	-178.6	-101.8	0	0	0	112.5	Y287 Y290 C310 S311 M316 L317 K322 F325	Y287-W314 HydrophobicContact CD2-CB 3.67Å; Y287-W314 AromaticContact CD2-CD1 3.57Å; Y287-W314 AromaticContact CD2-CD2 3.46Å; Y287-W314 HydrophobicContact CD2-CD2 3.46Å; Y287-W314 VanDerWaalsContact CD2-CD2 3.46Å; Y287-W314 AromaticContact CD2-CE2 3.85Å; Y287-W314 HydrophobicContact CD2-CE3 4Å; Y287-W314 AromaticContact CD2-CG 3.28Å; Y287-W314 HydrophobicContact CD2-CG 3.28Å; Y287-W314 AromaticContact CD2-NE1 3.9Å; Y287-W314 HydrophobicContact CE2-CB 3.58Å; Y287-W314 HydrophobicContact CE2-CD2 4.32Å; Y287-W314 AromaticContact CE2-CG 3.7Å; Y287-W314 HydrophobicContact CE2-CG 3.7Å; Y287-W314 HydrophobicContact CG-CD2 4.27Å; Y287-W314 HydrophobicContact CG-CG 4.34Å; Y290-W314 HydrophobicContact CD1-CB 4.2Å; Y290-W314 AromaticContact CD1-CE3 3.71Å; Y290-W314 HydrophobicContact CD1-CE3 3.71Å; Y290-W314 HydrophobicContact CD1-CZ3 4.5Å; Y290-W314 HydrophobicContact CD2-CE3 4.44Å; Y290-W314 HydrophobicContact CE1-CB 4.17Å; Y290-W314 HydrophobicContact CE1-CE3 4.45Å; Y290-W314 AromaticContact CG-CE3 3.7Å; Y290-W314 HydrophobicContact CG-CE3 3.7Å; Y290-W314 HydrophobicContact CG-CZ3 4.07Å; C310-W314 VanDerWaalsContact O-CB 3.22Å; C310-W314 WeakPolarHBondContact O-CB 3.48Å; C310-W314 PolarHBondContact O-N 3.44Å; S311-W314 PolarHBondContact O-N 3.06Å; W314-M316 VanDerWaalsContact C-N 3.31Å; W314-M316 PolarHBondContact O-N 2.93Å; W314-L317 HydrophobicContact CE3-CD1 3.79Å; W314-L317 HydrophobicContact CZ3-CD1 4.3Å; W314-L317 PolarHBondContact O-N 3.13Å; W314-K322 HydrophobicContact CD2-CG 4.34Å; W314-K322 HydrophobicContact CE3-CG 4.45Å; W314-K322 HydrophobicContact CH2-CB 3.97Å; W314-K322 HydrophobicContact CH2-CG 3.87Å; W314-K322 HydrophobicContact CZ2-CB 4.04Å; W314-K322 HydrophobicContact CZ2-CD 4.32Å; W314-K322 HydrophobicContact CZ2-CG 3.74Å; W314-K322 HydrophobicContact CZ3-CG 4.23Å; W314-K322 WeakPolarHBondContact O-CE 3.45Å; W314-K322 PolarHBondContact O-NZ 3.5Å; W314-K322 VanDerWaalsContact O-NZ 3.08Å; W314-F325 HydrophobicContact CH2-CB 4.18Å; W314-F325 HydrophobicContact CZ3-CB 4.02Å; W314-F325 AromaticContact CZ3-CD2 3.98Å; W314-F325 HydrophobicContact CZ3-CD2 3.98Å; W314-F325 HydrophobicContact CZ3-CG 4.18Å
315	K	92.8	Very high	90.6	Very high	159 Å²	159	84.3 Å²	84.3	69%	0.691	41%	0.407	S	S	*	.	H	α-helix	trans	-63.8	-38	174.7	-72.9	176.3	-177.3	-179.5	0	112	S311 K312 Q313 K322	S311-K315 WeakPolarHBondContact O-CG 3.36Å; S311-K315 PolarHBondContact O-N 2.98Å; S311-K315 VanDerWaalsContact O-N 3.09Å; K312-K315 PolarHBondContact O-N 2.76Å; Q313-K315 VanDerWaalsContact C-N 3.26Å; Q313-K315 PolarHBondContact O-N 3.4Å; K315-K322 PolarHBondContact O-NZ 2.9Å
316	M	90.6	Very high	90.9	Very high	147 Å²	147	82.7 Å²	82.7	72%	0.724	40%	0.4	S	S	*	.	H	α-helix	trans	-76.6	-17.2	179.4	-65.7	-178.6	66.4	0	0	114.4	K312 Q313 W314	K312-M316 WeakPolarHBondContact O-CG 2.87Å; K312-M316 PolarHBondContact O-N 3.46Å; Q313-M316 PolarHBondContact O-N 2.82Å; W314-M316 VanDerWaalsContact C-N 3.31Å; W314-M316 PolarHBondContact O-N 2.93Å
317	L	90.7	Very high	91.3	Very high	30 Å²	30	87.2 Å²	87.2	16%	0.157	42%	0.421	C	S	.	.	S	Bend	trans	-67.5	143	175.8	-73.2	172.3	0	0	0	112.3	Y290 Q313 W314 E321 K322 F325	Y290-L317 HydrophobicContact CD2-CD1 4.06Å; Y290-L317 HydrophobicContact CE1-CD1 4.47Å; Y290-L317 HydrophobicContact CE2-CD1 3.8Å; Q313-L317 WeakPolarHBondContact O-CG 3.05Å; Q313-L317 PolarHBondContact O-N 3Å; W314-L317 HydrophobicContact CE3-CD1 3.79Å; W314-L317 HydrophobicContact CZ3-CD1 4.3Å; W314-L317 PolarHBondContact O-N 3.13Å; L317-E321 HydrophobicContact CB-CB 4.32Å; L317-E321 HydrophobicContact CD2-CB 4.06Å; L317-E321 HydrophobicContact CD2-CG 4.4Å; L317-E321 WeakPolarHBondContact CD2-OE2 3.07Å; L317-K322 HydrophobicContact CB-CG 4.2Å; L317-K322 WeakPolarHBondContact O-CE 3.37Å; L317-K322 PolarHBondContact O-NZ 3.29Å; L317-F325 HydrophobicContact CD1-CD2 4.37Å; L317-F325 HydrophobicContact CD1-CE2 4.05Å
318	T	94.9	Very high	91.7	Very high	77 Å²	77	88.1 Å²	88.1	47%	0.472	42%	0.419	S	S	.	.			trans	-67	157	173.4	66	0	0	0	0	111.2	K320 E321 K322	T318-K320 PolarHBondContact O-N 3.5Å; T318-E321 WeakPolarHBondContact CB-OE2 3.48Å; T318-E321 WeakPolarHBondContact CG2-OE2 3.33Å; T318-E321 PolarHBondContact N-OE2 3.42Å; T318-E321 PolarHBondContact O-N 2.78Å; T318-E321 VanDerWaalsContact O-N 3.15Å; T318-E321 VanDerWaalsContact OG1-CD 3.24Å; T318-E321 VanDerWaalsContact OG1-CG 3.25Å; T318-E321 WeakPolarHBondContact OG1-CG 3.39Å; T318-E321 PolarHBondContact OG1-N 2.85Å; T318-E321 PolarHBondContact OG1-OE2 2.95Å; T318-K322 WeakPolarHBondContact O-CG 3.41Å; T318-K322 PolarHBondContact O-N 3.44Å
319	Q	91.7	Very high	91.9	Very high	122 Å²	122	83.7 Å²	83.7	57%	0.57	39%	0.392	S	S	*	.	H	α-helix	trans	-59.9	-36.4	176.4	-171.3	58.5	40.1	0	0	111.8	E321 K322 D323	Q319-E321 VanDerWaalsContact C-N 3.33Å; Q319-E321 PolarHBondContact O-N 3.23Å; Q319-K322 PolarHBondContact O-N 3.45Å; Q319-D323 PolarHBondContact NE2-OD1 2.94Å; Q319-D323 WeakPolarHBondContact O-CB 3.45Å; Q319-D323 PolarHBondContact O-N 3.07Å
320	K	94.3	Very high	92.1	Very high	163 Å²	163	84.9 Å²	84.9	71%	0.709	40%	0.396	S	S	*	.	H	α-helix	trans	-60.2	-42.1	176.1	-173.4	179.3	178.6	-177.6	0	111.9	T318 D323 M324	T318-K320 PolarHBondContact O-N 3.5Å; K320-D323 PolarHBondContact O-N 3Å; K320-M324 WeakPolarHBondContact O-CG 3.15Å; K320-M324 PolarHBondContact O-N 3.01Å
321	E	92.6	Very high	92.3	Very high	68 Å²	68	91.4 Å²	91.4	32%	0.318	43%	0.426	S	S	.	.	H	α-helix	trans	-68.8	-42.8	176.4	-69.8	162.1	138.9	0	0	111.6	L317 T318 Q319 D323 M324 F325	L317-E321 HydrophobicContact CB-CB 4.32Å; L317-E321 HydrophobicContact CD2-CB 4.06Å; L317-E321 HydrophobicContact CD2-CG 4.4Å; L317-E321 WeakPolarHBondContact CD2-OE2 3.07Å; T318-E321 WeakPolarHBondContact CB-OE2 3.48Å; T318-E321 WeakPolarHBondContact CG2-OE2 3.33Å; T318-E321 PolarHBondContact N-OE2 3.42Å; T318-E321 PolarHBondContact O-N 2.78Å; T318-E321 VanDerWaalsContact O-N 3.15Å; T318-E321 VanDerWaalsContact OG1-CD 3.24Å; T318-E321 VanDerWaalsContact OG1-CG 3.25Å; T318-E321 WeakPolarHBondContact OG1-CG 3.39Å; T318-E321 PolarHBondContact OG1-N 2.85Å; T318-E321 PolarHBondContact OG1-OE2 2.95Å; Q319-E321 VanDerWaalsContact C-N 3.33Å; Q319-E321 PolarHBondContact O-N 3.23Å; E321-D323 VanDerWaalsContact C-N 3.28Å; E321-D323 PolarHBondContact O-N 2.82Å; E321-M324 HydrophobicContact CB-CE 4.45Å; E321-M324 HydrophobicContact CG-CE 4.06Å; E321-M324 WeakPolarHBondContact O-CB 3.25Å; E321-M324 PolarHBondContact O-N 3.26Å; E321-M324 VanDerWaalsContact O-N 3.1Å; E321-F325 WeakPolarHBondContact O-CD2 3.48Å; E321-F325 PolarHBondContact O-N 3.2Å
322	K	92.9	Very high	92.3	Very high	39 Å²	39	93.2 Å²	93.2	17%	0.17	43%	0.429	C	S	.	.	H	α-helix	trans	-57.7	-42.4	174.4	-70.4	169.3	170.7	144.2	0	111.6	W314 K315 L317 T318 Q319 M324 F325 Q326	W314-K322 HydrophobicContact CD2-CG 4.34Å; W314-K322 HydrophobicContact CE3-CG 4.45Å; W314-K322 HydrophobicContact CH2-CB 3.97Å; W314-K322 HydrophobicContact CH2-CG 3.87Å; W314-K322 HydrophobicContact CZ2-CB 4.04Å; W314-K322 HydrophobicContact CZ2-CD 4.32Å; W314-K322 HydrophobicContact CZ2-CG 3.74Å; W314-K322 HydrophobicContact CZ3-CG 4.23Å; W314-K322 WeakPolarHBondContact O-CE 3.45Å; W314-K322 PolarHBondContact O-NZ 3.5Å; W314-K322 VanDerWaalsContact O-NZ 3.08Å; K315-K322 PolarHBondContact O-NZ 2.9Å; L317-K322 HydrophobicContact CB-CG 4.2Å; L317-K322 WeakPolarHBondContact O-CE 3.37Å; L317-K322 PolarHBondContact O-NZ 3.29Å; T318-K322 WeakPolarHBondContact O-CG 3.41Å; T318-K322 PolarHBondContact O-N 3.44Å; Q319-K322 PolarHBondContact O-N 3.45Å; K322-M324 VanDerWaalsContact C-N 3.35Å; K322-M324 PolarHBondContact O-N 3.15Å; K322-F325 PolarHBondContact O-N 3.27Å; K322-Q326 PolarHBondContact O-N 2.79Å
323	D	93.1	Very high	92.2	Very high	73 Å²	73	92.9 Å²	92.9	39%	0.39	43%	0.428	S	S	.	.	H	α-helix	trans	-67.2	-33.9	176.8	-66.7	-16	0	0	0	112.1	Q319 K320 E321 Q326 K327	Q319-D323 PolarHBondContact NE2-OD1 2.94Å; Q319-D323 WeakPolarHBondContact O-CB 3.45Å; Q319-D323 PolarHBondContact O-N 3.07Å; K320-D323 PolarHBondContact O-N 3Å; E321-D323 VanDerWaalsContact C-N 3.28Å; E321-D323 PolarHBondContact O-N 2.82Å; D323-Q326 PolarHBondContact O-N 3.27Å; D323-K327 WeakPolarHBondContact O-CB 3.44Å; D323-K327 WeakPolarHBondContact O-CG 3.43Å; D323-K327 PolarHBondContact O-N 3.12Å
324	M	93.6	Very high	92.3	Very high	109 Å²	109	94.9 Å²	94.9	54%	0.537	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-43.8	171.9	-72	-164	-64.6	0	0	111.6	K320 E321 K322 Q326 K327 R328	K320-M324 WeakPolarHBondContact O-CG 3.15Å; K320-M324 PolarHBondContact O-N 3.01Å; E321-M324 HydrophobicContact CB-CE 4.45Å; E321-M324 HydrophobicContact CG-CE 4.06Å; E321-M324 WeakPolarHBondContact O-CB 3.25Å; E321-M324 PolarHBondContact O-N 3.26Å; E321-M324 VanDerWaalsContact O-N 3.1Å; K322-M324 VanDerWaalsContact C-N 3.35Å; K322-M324 PolarHBondContact O-N 3.15Å; M324-Q326 VanDerWaalsContact C-N 3.34Å; M324-K327 PolarHBondContact O-N 3.48Å; M324-R328 WeakPolarHBondContact O-CB 3.43Å; M324-R328 PolarHBondContact O-N 3.3Å
325	F	92.9	Very high	92.2	Very high	37 Å²	37	97.1 Å²	97.1	16%	0.162	45%	0.448	C	S	.	.	H	α-helix	trans	-65.7	-37.3	175.4	-74.6	-70.2	0	0	0	112.2	Y290 W314 L317 E321 K322 R328 C329	Y290-F325 HydrophobicContact CD2-CD1 4.43Å; Y290-F325 HydrophobicContact CD2-CD2 4.27Å; Y290-F325 AromaticContact CD2-CE1 3.92Å; Y290-F325 HydrophobicContact CD2-CE1 3.92Å; Y290-F325 AromaticContact CD2-CE2 3.75Å; Y290-F325 HydrophobicContact CD2-CE2 3.75Å; Y290-F325 AromaticContact CD2-CZ 3.57Å; Y290-F325 HydrophobicContact CD2-CZ 3.57Å; Y290-F325 HydrophobicContact CE2-CE2 4.32Å; Y290-F325 HydrophobicContact CE2-CZ 4.18Å; W314-F325 HydrophobicContact CH2-CB 4.18Å; W314-F325 HydrophobicContact CZ3-CB 4.02Å; W314-F325 AromaticContact CZ3-CD2 3.98Å; W314-F325 HydrophobicContact CZ3-CD2 3.98Å; W314-F325 HydrophobicContact CZ3-CG 4.18Å; L317-F325 HydrophobicContact CD1-CD2 4.37Å; L317-F325 HydrophobicContact CD1-CE2 4.05Å; E321-F325 WeakPolarHBondContact O-CD2 3.48Å; E321-F325 PolarHBondContact O-N 3.2Å; K322-F325 PolarHBondContact O-N 3.27Å; F325-R328 PolarHBondContact O-N 3.39Å; F325-C329 WeakPolarHBondContact O-CB 3.39Å; F325-C329 PolarHBondContact O-N 2.72Å
326	Q	92.2	Very high	92.1	Very high	72 Å²	72	90.5 Å²	90.5	34%	0.336	42%	0.418	S	S	.	.	H	α-helix	trans	-62.9	-47.9	174.3	-176.2	58.2	29.7	0	0	111.6	G286 K322 D323 M324 R328 C329 E330	G286-Q326 VanDerWaalsContact N-OE1 3.12Å; K322-Q326 PolarHBondContact O-N 2.79Å; D323-Q326 PolarHBondContact O-N 3.27Å; M324-Q326 VanDerWaalsContact C-N 3.34Å; Q326-R328 VanDerWaalsContact C-N 3.34Å; Q326-R328 PolarHBondContact O-N 3.04Å; Q326-C329 WeakPolarHBondContact O-CB 3.25Å; Q326-C329 PolarHBondContact O-N 2.79Å; Q326-E330 PolarHBondContact NE2-OE1 2.94Å; Q326-E330 WeakPolarHBondContact O-CG 3.46Å; Q326-E330 PolarHBondContact O-N 2.87Å
327	K	93.8	Very high	91.9	Very high	147 Å²	147	87.2 Å²	87.2	64%	0.639	40%	0.404	S	S	*	.	H	α-helix	trans	-59.6	-42.4	175.4	-75.5	176.7	-178.8	177.7	0	112.4	D323 M324 C329 E330 Q331	D323-K327 WeakPolarHBondContact O-CB 3.44Å; D323-K327 WeakPolarHBondContact O-CG 3.43Å; D323-K327 PolarHBondContact O-N 3.12Å; M324-K327 PolarHBondContact O-N 3.48Å; K327-C329 VanDerWaalsContact C-N 3.34Å; K327-E330 PolarHBondContact O-N 3.31Å; K327-Q331 PolarHBondContact O-N 3.13Å
328	R	92.4	Very high	91.9	Very high	112 Å²	112	88.8 Å²	88.8	42%	0.423	41%	0.414	S	S	.	.	H	α-helix	trans	-67.3	-34.8	177.7	-168.3	174.9	175.6	-163.7	-11.6	112.3	L289 E293 M324 F325 Q326 Q331 K332	L289-R328 HydrophobicContact CD2-CB 3.93Å; L289-R328 HydrophobicContact CD2-CG 3.96Å; E293-R328 IonicContact OE1-CZ 3.21Å; E293-R328 IonicContact OE1-NE 3.86Å; E293-R328 PolarHBondContact OE1-NE 3.41Å; E293-R328 IonicContact OE1-NH1 2.72Å; E293-R328 PolarHBondContact OE1-NH1 2.87Å; E293-R328 IonicContact OE1-NH2 2.91Å; E293-R328 PolarHBondContact OE1-NH2 3.4Å; E293-R328 IonicContact OE2-CZ 3.64Å; E293-R328 VanDerWaalsContact OE2-CZ 3.28Å; E293-R328 IonicContact OE2-NH1 3.18Å; E293-R328 PolarHBondContact OE2-NH1 3.25Å; E293-R328 IonicContact OE2-NH2 3.93Å; E293-R328 PolarHBondContact OE2-NH2 3.01Å; M324-R328 WeakPolarHBondContact O-CB 3.43Å; M324-R328 PolarHBondContact O-N 3.3Å; F325-R328 PolarHBondContact O-N 3.39Å; Q326-R328 VanDerWaalsContact C-N 3.34Å; Q326-R328 PolarHBondContact O-N 3.04Å; R328-Q331 PolarHBondContact O-N 3.15Å; R328-K332 PolarHBondContact O-N 2.59Å
329	C	92.6	Very high	91.5	Very high	6 Å²	6	87.7 Å²	87.7	4%	0.041	41%	0.406	C	S	.	.	H	α-helix	trans	-63.8	-45.5	172.7	-171.7	0	0	0	0	111.3	P283 L289 F325 Q326 K327 Q331 K332 K333	P283-C329 PolarHBondContact O-SG 3.14Å; L289-C329 HydrophobicContact CB-CB 4.36Å; L289-C329 HydrophobicContact CD2-CB 3.92Å; F325-C329 WeakPolarHBondContact O-CB 3.39Å; F325-C329 PolarHBondContact O-N 2.72Å; Q326-C329 WeakPolarHBondContact O-CB 3.25Å; Q326-C329 PolarHBondContact O-N 2.79Å; K327-C329 VanDerWaalsContact C-N 3.34Å; C329-Q331 VanDerWaalsContact C-N 3.33Å; C329-Q331 PolarHBondContact O-N 3.07Å; C329-K332 PolarHBondContact O-N 2.77Å; C329-K333 WeakPolarHBondContact O-CB 3.4Å; C329-K333 PolarHBondContact O-N 2.76Å
330	E	90.9	Very high	91.2	Very high	92 Å²	92	82.9 Å²	82.9	43%	0.43	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-39.1	175.4	-71.8	169	-164.7	0	0	112.1	Q326 K327 K333 K334	Q326-E330 PolarHBondContact NE2-OE1 2.94Å; Q326-E330 WeakPolarHBondContact O-CG 3.46Å; Q326-E330 PolarHBondContact O-N 2.87Å; K327-E330 PolarHBondContact O-N 3.31Å; E330-K333 PolarHBondContact O-N 2.79Å; E330-K334 WeakPolarHBondContact O-CG 3.49Å; E330-K334 PolarHBondContact O-N 3.45Å
331	Q	93.2	Very high	90.7	Very high	136 Å²	136	80.5 Å²	80.5	64%	0.636	38%	0.375	S	S	*	.	H	α-helix	trans	-64.4	-46.1	174.8	-171.9	178.1	11.5	0	0	111.9	K327 R328 C329 K333 K334 Q335	K327-Q331 PolarHBondContact O-N 3.13Å; R328-Q331 PolarHBondContact O-N 3.15Å; C329-Q331 VanDerWaalsContact C-N 3.33Å; C329-Q331 PolarHBondContact O-N 3.07Å; Q331-K333 VanDerWaalsContact C-N 3.27Å; Q331-K333 PolarHBondContact O-N 3.18Å; Q331-K334 PolarHBondContact O-N 2.86Å; Q331-Q335 WeakPolarHBondContact O-CB 3.39Å; Q331-Q335 PolarHBondContact O-N 3.29Å
332	K	89.9	Confident	90.5	Very high	81 Å²	81	84.7 Å²	84.7	35%	0.352	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-35.2	174.9	-80.4	-178.6	170.4	177.7	0	112	P282 L289 E293 R328 C329 Q335 Y336	P282-K332 HydrophobicContact CB-CB 4.09Å; L289-K332 HydrophobicContact CD1-CD 3.71Å; L289-K332 HydrophobicContact CD2-CD 4.38Å; E293-K332 IonicContact OE1-NZ 3.07Å; E293-K332 PolarHBondContact OE1-NZ 3.23Å; R328-K332 PolarHBondContact O-N 2.59Å; C329-K332 PolarHBondContact O-N 2.77Å; K332-Q335 PolarHBondContact O-N 3.28Å; K332-Y336 WeakPolarHBondContact O-CB 3.38Å; K332-Y336 PolarHBondContact O-N 2.77Å
333	K	89.9	Confident	90.1	Very high	127 Å²	127	83.9 Å²	83.9	55%	0.552	38%	0.384	S	S	*	.	H	α-helix	trans	-64.9	-47.1	173.5	-171.7	-179.6	176.9	-175.9	0	112.1	P282 C329 E330 Q331 Q335 Y336 D337	P282-K333 HydrophobicContact CG-CB 4.31Å; C329-K333 WeakPolarHBondContact O-CB 3.4Å; C329-K333 PolarHBondContact O-N 2.76Å; E330-K333 PolarHBondContact O-N 2.79Å; Q331-K333 VanDerWaalsContact C-N 3.27Å; Q331-K333 PolarHBondContact O-N 3.18Å; K333-Q335 VanDerWaalsContact C-N 3.29Å; K333-Q335 PolarHBondContact O-N 3.34Å; K333-Y336 WeakPolarHBondContact O-CB 3.14Å; K333-Y336 PolarHBondContact O-N 2.63Å; K333-D337 VanDerWaalsContact O-CG 3.26Å; K333-D337 PolarHBondContact O-N 2.81Å
334	K	91.4	Very high	89.5	Confident	145 Å²	145	81.6 Å²	81.6	63%	0.63	37%	0.372	S	S	*	.	H	α-helix	trans	-60.2	-41.6	174.9	-71.3	175.3	-178.3	178.5	0	111.7	E330 Q331 D337 V338	E330-K334 WeakPolarHBondContact O-CG 3.49Å; E330-K334 PolarHBondContact O-N 3.45Å; Q331-K334 PolarHBondContact O-N 2.86Å; K334-D337 PolarHBondContact O-N 3.08Å; K334-V338 WeakPolarHBondContact O-CG2 3.49Å; K334-V338 PolarHBondContact O-N 3.11Å
335	Q	90.1	Very high	88.9	Confident	98 Å²	98	82.3 Å²	82.3	46%	0.458	37%	0.374	S	S	.	.	H	α-helix	trans	-62.6	-44.6	176.5	-173.3	58.2	46	0	0	111.4	Q331 K332 K333 D337 V338 D339	Q331-Q335 WeakPolarHBondContact O-CB 3.39Å; Q331-Q335 PolarHBondContact O-N 3.29Å; K332-Q335 PolarHBondContact O-N 3.28Å; K333-Q335 VanDerWaalsContact C-N 3.29Å; K333-Q335 PolarHBondContact O-N 3.34Å; Q335-D337 VanDerWaalsContact C-N 3.34Å; Q335-D337 PolarHBondContact O-N 3.19Å; Q335-V338 PolarHBondContact O-N 3.13Å; Q335-D339 VanDerWaalsContact NE2-CG 3.3Å; Q335-D339 PolarHBondContact NE2-OD1 3.24Å; Q335-D339 PolarHBondContact NE2-OD2 2.89Å; Q335-D339 VanDerWaalsContact NE2-OD2 3.08Å; Q335-D339 WeakPolarHBondContact O-CB 3.16Å; Q335-D339 VanDerWaalsContact O-CG 3.25Å; Q335-D339 PolarHBondContact O-N 2.76Å
336	Y	90.4	Very high	88.3	Confident	19 Å²	19	84.7 Å²	84.7	8%	0.075	40%	0.395	C	S	.	.	H	α-helix	trans	-58.5	-44	174	171	-97.4	0	0	0	112.5	P279 T280 K281 P282 K332 K333 V338 D339 L340	P279-Y336 HydrophobicContact CB-CD2 3.76Å; P279-Y336 HydrophobicContact CB-CE2 3.77Å; P279-Y336 WeakPolarHBondContact O-CE2 3.14Å; T280-Y336 VanDerWaalsContact C-CE2 3.44Å; T280-Y336 WeakPolarHBondContact O-CD2 3.28Å; T280-Y336 WeakPolarHBondContact O-CE2 3.48Å; K281-Y336 HydrophobicContact CB-CE2 4.48Å; K281-Y336 WeakPolarHBondContact CE-OH 3.5Å; K281-Y336 HydrophobicContact CG-CE1 4Å; K281-Y336 HydrophobicContact CG-CE2 3.91Å; K281-Y336 VanDerWaalsContact CG-CZ 3.46Å; K281-Y336 VanDerWaalsContact CG-OH 3.25Å; K281-Y336 WeakPolarHBondContact CG-OH 3.3Å; P282-Y336 VanDerWaalsContact CD-CG 3.5Å; P282-Y336 HydrophobicContact CG-CG 4.31Å; K332-Y336 WeakPolarHBondContact O-CB 3.38Å; K332-Y336 PolarHBondContact O-N 2.77Å; K333-Y336 WeakPolarHBondContact O-CB 3.14Å; K333-Y336 PolarHBondContact O-N 2.63Å; Y336-V338 VanDerWaalsContact C-N 3.32Å; Y336-V338 PolarHBondContact O-N 3.23Å; Y336-D339 PolarHBondContact O-N 2.93Å; Y336-L340 HydrophobicContact CE1-CD2 3.92Å; Y336-L340 WeakPolarHBondContact O-CB 3.49Å; Y336-L340 PolarHBondContact O-N 3.16Å
337	D	86.7	Confident	87.6	Confident	79 Å²	79	82.7 Å²	82.7	42%	0.422	39%	0.387	S	S	.	.	H	α-helix	trans	-62.4	-40.9	179.1	-64.6	-25.3	0	0	0	111	K333 K334 Q335 Q341	K333-D337 VanDerWaalsContact O-CG 3.26Å; K333-D337 PolarHBondContact O-N 2.81Å; K334-D337 PolarHBondContact O-N 3.08Å; Q335-D337 VanDerWaalsContact C-N 3.34Å; Q335-D337 PolarHBondContact O-N 3.19Å; D337-Q341 WeakPolarHBondContact O-CB 3.36Å; D337-Q341 PolarHBondContact O-N 3.45Å
338	V	90.9	Very high	86.9	Confident	62 Å²	62	79.3 Å²	79.3	38%	0.376	38%	0.38	S	S	.	.	H	α-helix	trans	-65.6	-47.4	175.3	171.7	0	0	0	0	111.6	K334 Q335 Y336 L340 Q341 R342	K334-V338 WeakPolarHBondContact O-CG2 3.49Å; K334-V338 PolarHBondContact O-N 3.11Å; Q335-V338 PolarHBondContact O-N 3.13Å; Y336-V338 VanDerWaalsContact C-N 3.32Å; Y336-V338 PolarHBondContact O-N 3.23Å; V338-L340 VanDerWaalsContact C-N 3.31Å; V338-L340 PolarHBondContact O-N 2.85Å; V338-Q341 PolarHBondContact O-N 3.2Å; V338-R342 WeakPolarHBondContact O-CG 3.25Å; V338-R342 PolarHBondContact O-N 2.94Å
339	D	86.6	Confident	85.7	Confident	55 Å²	55	80.2 Å²	80.2	29%	0.294	39%	0.389	S	S	.	.	H	α-helix	trans	-66.7	-36.4	-179.9	-65.9	-26.3	0	0	0	111	P279 Q335 Y336 R342 F343	P279-D339 HydrophobicContact CB-CB 4.12Å; P279-D339 HydrophobicContact CG-CB 3.69Å; Q335-D339 VanDerWaalsContact NE2-CG 3.3Å; Q335-D339 PolarHBondContact NE2-OD1 3.24Å; Q335-D339 PolarHBondContact NE2-OD2 2.89Å; Q335-D339 VanDerWaalsContact NE2-OD2 3.08Å; Q335-D339 WeakPolarHBondContact O-CB 3.16Å; Q335-D339 VanDerWaalsContact O-CG 3.25Å; Q335-D339 PolarHBondContact O-N 2.76Å; Y336-D339 PolarHBondContact O-N 2.93Å; D339-R342 PolarHBondContact O-N 3.19Å; D339-R342 IonicContact OD1-NH1 3.16Å; D339-F343 WeakPolarHBondContact O-CB 3.43Å; D339-F343 PolarHBondContact O-N 3.35Å
340	L	84.8	Confident	84.1	Confident	21 Å²	21	86.6 Å²	86.6	11%	0.11	42%	0.418	C	S	.	.	H	α-helix	trans	-66.2	-42.1	175.8	179.1	64.1	0	0	0	110.4	Y336 V338 F343 L344	Y336-L340 HydrophobicContact CE1-CD2 3.92Å; Y336-L340 WeakPolarHBondContact O-CB 3.49Å; Y336-L340 PolarHBondContact O-N 3.16Å; V338-L340 VanDerWaalsContact C-N 3.31Å; V338-L340 PolarHBondContact O-N 2.85Å; L340-F343 HydrophobicContact CD1-CD1 4.37Å; L340-F343 WeakPolarHBondContact O-CB 3.45Å; L340-F343 PolarHBondContact O-N 3.15Å; L340-L344 HydrophobicContact CG-CD1 4.44Å; L340-L344 VanDerWaalsContact O-CG 3.3Å; L340-L344 WeakPolarHBondContact O-CG 3.4Å; L340-L344 PolarHBondContact O-N 3.27Å
341	Q	84.7	Confident	82.9	Confident	112 Å²	112	85.6 Å²	85.6	52%	0.523	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-44.9	175.5	-174.2	179.2	-19.3	0	0	111.5	D337 V338 F343 L344 E345	D337-Q341 WeakPolarHBondContact O-CB 3.36Å; D337-Q341 PolarHBondContact O-N 3.45Å; V338-Q341 PolarHBondContact O-N 3.2Å; Q341-F343 VanDerWaalsContact C-N 3.31Å; Q341-F343 PolarHBondContact O-N 2.96Å; Q341-L344 WeakPolarHBondContact O-CB 3.33Å; Q341-L344 PolarHBondContact O-N 3.47Å; Q341-E345 WeakPolarHBondContact CG-OE1 3.45Å; Q341-E345 PolarHBondContact NE2-OE1 3.13Å; Q341-E345 WeakPolarHBondContact O-CG 3.48Å; Q341-E345 PolarHBondContact O-N 3.1Å
342	R	87.6	Confident	81.9	Confident	156 Å²	156	83 Å²	83	59%	0.589	40%	0.398	S	S	*	.	H	α-helix	trans	-60.2	-40.6	174.4	-74.1	176	179	171	-2.4	112.4	V338 D339 E345 S346	V338-R342 WeakPolarHBondContact O-CG 3.25Å; V338-R342 PolarHBondContact O-N 2.94Å; D339-R342 PolarHBondContact O-N 3.19Å; D339-R342 IonicContact OD1-NH1 3.16Å; R342-E345 PolarHBondContact O-N 2.63Å; R342-S346 PolarHBondContact O-N 3.17Å
343	F	84.3	Confident	80.8	Confident	22 Å²	22	83.8 Å²	83.8	10%	0.096	41%	0.406	C	S	.	.	H	α-helix	trans	-61.9	-46.4	174.8	173.1	-105.8	0	0	0	111.2	D276 R278 P279 D339 L340 Q341 E345 S346 L347 V355	D276-F343 VanDerWaalsContact O-CE2 3.24Å; D276-F343 WeakPolarHBondContact O-CE2 3.46Å; R278-F343 HydrophobicContact CB-CE1 4Å; R278-F343 HydrophobicContact CB-CE2 4.27Å; R278-F343 HydrophobicContact CB-CZ 3.86Å; R278-F343 HydrophobicContact CG-CD1 4.21Å; R278-F343 HydrophobicContact CG-CE1 3.82Å; R278-F343 HydrophobicContact CG-CZ 4.21Å; P279-F343 HydrophobicContact CG-CB 4.38Å; D339-F343 WeakPolarHBondContact O-CB 3.43Å; D339-F343 PolarHBondContact O-N 3.35Å; L340-F343 HydrophobicContact CD1-CD1 4.37Å; L340-F343 WeakPolarHBondContact O-CB 3.45Å; L340-F343 PolarHBondContact O-N 3.15Å; Q341-F343 VanDerWaalsContact C-N 3.31Å; Q341-F343 PolarHBondContact O-N 2.96Å; F343-E345 VanDerWaalsContact C-N 3.32Å; F343-E345 PolarHBondContact O-N 3.37Å; F343-S346 PolarHBondContact O-N 3.09Å; F343-S346 VanDerWaalsContact O-N 3.13Å; F343-S346 PolarHBondContact O-OG 3.37Å; F343-L347 HydrophobicContact CD1-CD1 4.12Å; F343-L347 HydrophobicContact CE1-CD1 3.53Å; F343-L347 HydrophobicContact CE1-CG 4.37Å; F343-L347 HydrophobicContact CE2-CD1 4.28Å; F343-L347 HydrophobicContact CE2-CD2 4.26Å; F343-L347 HydrophobicContact CE2-CG 4.33Å; F343-L347 HydrophobicContact CZ-CD1 3.63Å; F343-L347 HydrophobicContact CZ-CD2 4.21Å; F343-L347 HydrophobicContact CZ-CG 4.17Å; F343-L347 WeakPolarHBondContact O-CG 3.45Å; F343-L347 PolarHBondContact O-N 3.42Å; F343-V355 HydrophobicContact CE1-CG1 4.48Å
344	L	80.3	Confident	79.7	Confident	26 Å²	26	83 Å²	83	14%	0.136	40%	0.399	C	S	.	.	H	α-helix	trans	-60.2	-41.5	175	-69.5	172.5	0	0	0	111.8	L340 Q341 S346 L347 R352 V355 L356	L340-L344 HydrophobicContact CG-CD1 4.44Å; L340-L344 VanDerWaalsContact O-CG 3.3Å; L340-L344 WeakPolarHBondContact O-CG 3.4Å; L340-L344 PolarHBondContact O-N 3.27Å; Q341-L344 WeakPolarHBondContact O-CB 3.33Å; Q341-L344 PolarHBondContact O-N 3.47Å; L344-S346 PolarHBondContact O-N 2.98Å; L344-L347 PolarHBondContact O-N 3.3Å; L344-R352 WeakPolarHBondContact O-CD 3.48Å; L344-R352 WeakPolarHBondContact O-CG 3.27Å; L344-V355 HydrophobicContact CD2-CB 3.79Å; L344-V355 HydrophobicContact CD2-CG1 3.6Å; L344-L356 HydrophobicContact CD1-CD2 3.76Å; L344-L356 HydrophobicContact CD1-CG 4.29Å; L344-L356 HydrophobicContact CD2-CG 4.37Å
345	E	81.8	Confident	78.5	Confident	123 Å²	123	76.9 Å²	76.9	58%	0.575	37%	0.374	S	S	*	.	H	α-helix	trans	-65.7	-26.7	177.4	-72	168	-171.5	0	0	112.8	Q341 R342 F343	Q341-E345 WeakPolarHBondContact CG-OE1 3.45Å; Q341-E345 PolarHBondContact NE2-OE1 3.13Å; Q341-E345 WeakPolarHBondContact O-CG 3.48Å; Q341-E345 PolarHBondContact O-N 3.1Å; R342-E345 PolarHBondContact O-N 2.63Å; F343-E345 VanDerWaalsContact C-N 3.32Å; F343-E345 PolarHBondContact O-N 3.37Å
346	S	78.9	Confident	77.5	Confident	87 Å²	87	76.3 Å²	76.3	61%	0.608	37%	0.374	S	S	*	.	H	α-helix	trans	-79.8	-14.7	176.1	75.1	0	0	0	0	114.7	R342 F343 L344	R342-S346 PolarHBondContact O-N 3.17Å; F343-S346 PolarHBondContact O-N 3.09Å; F343-S346 VanDerWaalsContact O-N 3.13Å; F343-S346 PolarHBondContact O-OG 3.37Å; L344-S346 PolarHBondContact O-N 2.98Å
347	L	77.8	Confident	76.2	Confident	30 Å²	30	79.7 Å²	79.7	16%	0.157	40%	0.397	C	S	.	.	S	Bend	trans	-90.6	148.4	-177.7	-70.3	177.8	0	0	0	112.4	F343 L344 E351 R352 V355	F343-L347 HydrophobicContact CD1-CD1 4.12Å; F343-L347 HydrophobicContact CE1-CD1 3.53Å; F343-L347 HydrophobicContact CE1-CG 4.37Å; F343-L347 HydrophobicContact CE2-CD1 4.28Å; F343-L347 HydrophobicContact CE2-CD2 4.26Å; F343-L347 HydrophobicContact CE2-CG 4.33Å; F343-L347 HydrophobicContact CZ-CD1 3.63Å; F343-L347 HydrophobicContact CZ-CD2 4.21Å; F343-L347 HydrophobicContact CZ-CG 4.17Å; F343-L347 WeakPolarHBondContact O-CG 3.45Å; F343-L347 PolarHBondContact O-N 3.42Å; L344-L347 PolarHBondContact O-N 3.3Å; L347-E351 HydrophobicContact CB-CB 4.28Å; L347-E351 HydrophobicContact CD1-CB 4.45Å; L347-R352 HydrophobicContact CB-CG 3.97Å; L347-R352 WeakPolarHBondContact O-CD 3.5Å; L347-R352 WeakPolarHBondContact O-CG 3.29Å; L347-V355 HydrophobicContact CD1-CG2 3.98Å
348	P	79.6	Confident	75.1	Confident	76 Å²	76	79.7 Å²	79.7	49%	0.494	39%	0.394	S	S	.	.			trans	-56.8	147.9	169	-21.8	32.6	0	0	0	112	E350 E351 R352	P348-E350 PolarHBondContact O-N 3.01Å; P348-E350 VanDerWaalsContact O-N 3.1Å; P348-E351 WeakPolarHBondContact O-CA 3.44Å; P348-E351 PolarHBondContact O-N 3.46Å; P348-R352 WeakPolarHBondContact O-CG 3.23Å; P348-R352 PolarHBondContact O-N 2.91Å
349	E	66.5	Low	73.9	Confident	131 Å²	131	78.8 Å²	78.8	61%	0.612	39%	0.386	S	S	*	.	H	α-helix	trans	-51.3	-39.8	-172.9	-179.9	156.9	-132.1	0	0	114.2	E351 R352 D353	E349-E351 VanDerWaalsContact C-N 3.32Å; E349-E351 PolarHBondContact O-N 3.38Å; E349-R352 PolarHBondContact O-N 3.43Å; E349-R352 IonicContact OE1-NH2 2.7Å; E349-R352 PolarHBondContact OE1-NH2 3.41Å; E349-R352 VanDerWaalsContact OE1-NH2 3.16Å; E349-D353 PolarHBondContact O-N 2.86Å
350	E	60.4	Low	72.5	Confident	141 Å²	141	84.3 Å²	84.3	66%	0.659	41%	0.407	S	S	*	.	H	α-helix	trans	-66.5	-30.2	177.4	-65.1	161.6	172.9	0	0	113.3	P348 R354	P348-E350 PolarHBondContact O-N 3.01Å; P348-E350 VanDerWaalsContact O-N 3.1Å; E350-R354 WeakPolarHBondContact O-CG 3.38Å
351	E	65.1	Low	70.8	Confident	70 Å²	70	90.6 Å²	90.6	33%	0.327	44%	0.438	S	S	.	.	H	α-helix	trans	-85.4	-31.8	177.6	-62.3	-165.7	168.3	0	0	111.5	L347 P348 E349 D353 R354 V355 K479	L347-E351 HydrophobicContact CB-CB 4.28Å; L347-E351 HydrophobicContact CD1-CB 4.45Å; P348-E351 WeakPolarHBondContact O-CA 3.44Å; P348-E351 PolarHBondContact O-N 3.46Å; E349-E351 VanDerWaalsContact C-N 3.32Å; E349-E351 PolarHBondContact O-N 3.38Å; E351-D353 PolarHBondContact O-N 2.93Å; E351-R354 PolarHBondContact O-N 3.1Å; E351-V355 WeakPolarHBondContact O-CG2 3.41Å; E351-V355 PolarHBondContact O-N 3.26Å; E351-K479 IonicContact OE1-NZ 2.78Å; E351-K479 PolarHBondContact OE1-NZ 3.13Å; E351-K479 VanDerWaalsContact OE1-NZ 3.07Å
352	R	72.8	Confident	68.9	Low	82 Å²	82	87.7 Å²	87.7	31%	0.309	44%	0.438	S	S	.	.	H	α-helix	trans	-57.8	-48.5	171.6	-58.9	-168.7	-49.2	-141.8	-0.3	111.5	L344 L347 P348 E349 R354 V355 L356	L344-R352 WeakPolarHBondContact O-CD 3.48Å; L344-R352 WeakPolarHBondContact O-CG 3.27Å; L347-R352 HydrophobicContact CB-CG 3.97Å; L347-R352 WeakPolarHBondContact O-CD 3.5Å; L347-R352 WeakPolarHBondContact O-CG 3.29Å; P348-R352 WeakPolarHBondContact O-CG 3.23Å; P348-R352 PolarHBondContact O-N 2.91Å; E349-R352 PolarHBondContact O-N 3.43Å; E349-R352 IonicContact OE1-NH2 2.7Å; E349-R352 PolarHBondContact OE1-NH2 3.41Å; E349-R352 VanDerWaalsContact OE1-NH2 3.16Å; R352-R354 VanDerWaalsContact C-N 3.32Å; R352-R354 PolarHBondContact O-N 3.06Å; R352-V355 PolarHBondContact O-N 2.95Å; R352-L356 WeakPolarHBondContact O-CB 2.98Å; R352-L356 VanDerWaalsContact O-CG 3.23Å; R352-L356 WeakPolarHBondContact O-CG 3.23Å; R352-L356 PolarHBondContact O-N 2.96Å
353	D	66.8	Low	66.6	Low	97 Å²	97	82.5 Å²	82.5	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-65.4	-35.1	-178.3	-86.2	1.1	0	0	0	112.6	E349 E351 T357	E349-D353 PolarHBondContact O-N 2.86Å; E351-D353 PolarHBondContact O-N 2.93Å; D353-T357 WeakPolarHBondContact O-CB 3.32Å; D353-T357 PolarHBondContact O-N 3.5Å; D353-T357 PolarHBondContact O-OG1 3.33Å
354	R	65.9	Low	64.1	Low	110 Å²	110	84.9 Å²	84.9	42%	0.415	46%	0.457	S	S	.	.	H	α-helix	trans	-66.9	-49.6	174.1	-71.1	178.3	-174.9	-132.9	2	111.5	E350 E351 R352 L356 T357 E358 E482	E350-R354 WeakPolarHBondContact O-CG 3.38Å; E351-R354 PolarHBondContact O-N 3.1Å; R352-R354 VanDerWaalsContact C-N 3.32Å; R352-R354 PolarHBondContact O-N 3.06Å; R354-L356 VanDerWaalsContact C-N 3.32Å; R354-L356 PolarHBondContact O-N 3.37Å; R354-T357 PolarHBondContact O-N 3.49Å; R354-T357 VanDerWaalsContact O-N 3.11Å; R354-E358 PolarHBondContact O-N 3.41Å; R354-E482 IonicContact CZ-OE2 2.83Å; R354-E482 IonicContact NH1-OE2 3.87Å; R354-E482 PolarHBondContact NH1-OE2 2.83Å; R354-E482 IonicContact NH2-OE2 2.8Å
355	V	67.4	Low	62.1	Low	17 Å²	17	92.9 Å²	92.9	10%	0.103	49%	0.49	C	S	.	.	H	α-helix	trans	-62.3	-40.3	179	176.7	0	0	0	0	111	F343 L344 L347 E351 R352 T357 E358 E359	F343-V355 HydrophobicContact CE1-CG1 4.48Å; L344-V355 HydrophobicContact CD2-CB 3.79Å; L344-V355 HydrophobicContact CD2-CG1 3.6Å; L347-V355 HydrophobicContact CD1-CG2 3.98Å; E351-V355 WeakPolarHBondContact O-CG2 3.41Å; E351-V355 PolarHBondContact O-N 3.26Å; R352-V355 PolarHBondContact O-N 2.95Å; V355-T357 VanDerWaalsContact C-N 3.33Å; V355-T357 PolarHBondContact O-N 3.06Å; V355-E358 PolarHBondContact O-N 3.5Å; V355-E359 WeakPolarHBondContact O-CB 3.35Å; V355-E359 WeakPolarHBondContact O-CG 3.36Å; V355-E359 PolarHBondContact O-N 3.34Å
356	L	68.8	Low	59.9	Low	86 Å²	86	94.4 Å²	94.4	45%	0.45	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-38.1	174.1	-75.1	170.9	0	0	0	112.4	L344 R352 R354 K360	L344-L356 HydrophobicContact CD1-CD2 3.76Å; L344-L356 HydrophobicContact CD1-CG 4.29Å; L344-L356 HydrophobicContact CD2-CG 4.37Å; R352-L356 WeakPolarHBondContact O-CB 2.98Å; R352-L356 VanDerWaalsContact O-CG 3.23Å; R352-L356 WeakPolarHBondContact O-CG 3.23Å; R352-L356 PolarHBondContact O-N 2.96Å; R354-L356 VanDerWaalsContact C-N 3.32Å; R354-L356 PolarHBondContact O-N 3.37Å; L356-K360 VanDerWaalsContact O-CB 3.28Å; L356-K360 WeakPolarHBondContact O-CB 3.44Å; L356-K360 PolarHBondContact O-N 3Å
357	T	62.8	Low	57.3	Low	90 Å²	90	97.4 Å²	97.4	55%	0.552	51%	0.511	S	S	*	.	H	α-helix	trans	-69.5	-41.2	176.7	-57.7	0	0	0	0	111.6	D353 R354 V355 K360 M361	D353-T357 WeakPolarHBondContact O-CB 3.32Å; D353-T357 PolarHBondContact O-N 3.5Å; D353-T357 PolarHBondContact O-OG1 3.33Å; R354-T357 PolarHBondContact O-N 3.49Å; R354-T357 VanDerWaalsContact O-N 3.11Å; V355-T357 VanDerWaalsContact C-N 3.33Å; V355-T357 PolarHBondContact O-N 3.06Å; T357-K360 PolarHBondContact O-N 2.72Å; T357-M361 PolarHBondContact O-N 2.73Å
358	E	63.2	Low	55	Low	80 Å²	80	101.3 Å²	101.3	37%	0.374	55%	0.548	S	S	.	.	H	α-helix	trans	-63.7	-44.3	174.5	-71.3	-170.3	164.4	0	0	112.2	R269 R278 R354 V355 K360 M361 G362	R269-E358 IonicContact CZ-OE1 2.68Å; R269-E358 IonicContact NH1-OE1 2.79Å; R269-E358 PolarHBondContact NH1-OE1 3.5Å; R269-E358 IonicContact NH1-OE2 3.09Å; R269-E358 PolarHBondContact NH1-OE2 3.03Å; R269-E358 IonicContact NH2-OE1 3.13Å; R278-E358 IonicContact NH1-OE2 3.86Å; R278-E358 PolarHBondContact NH1-OE2 3.3Å; R354-E358 PolarHBondContact O-N 3.41Å; V355-E358 PolarHBondContact O-N 3.5Å; E358-K360 VanDerWaalsContact C-N 3.31Å; E358-K360 PolarHBondContact O-N 2.75Å; E358-M361 PolarHBondContact O-N 3.49Å; E358-G362 PolarHBondContact O-N 3.45Å
359	E	65.2	Low	52.6	Low	43 Å²	43	100.6 Å²	100.6	20%	0.201	55%	0.554	C	S	.	*	H	α-helix	trans	-61.8	-39.7	175.9	-78.9	-60.9	131.9	0	0	111.7	R278 K281 V355 G362 G363	R278-E359 IonicContact CZ-OE1 3.75Å; R278-E359 IonicContact NH2-OE1 3.05Å; R278-E359 PolarHBondContact NH2-OE1 3.24Å; K281-E359 WeakPolarHBondContact CE-OE1 3.44Å; K281-E359 WeakPolarHBondContact CE-OE2 3.35Å; K281-E359 VanDerWaalsContact NZ-CD 3.34Å; K281-E359 IonicContact NZ-OE1 3.67Å; K281-E359 PolarHBondContact NZ-OE1 3.44Å; K281-E359 IonicContact NZ-OE2 3.02Å; K281-E359 PolarHBondContact NZ-OE2 2.88Å; V355-E359 WeakPolarHBondContact O-CB 3.35Å; V355-E359 WeakPolarHBondContact O-CG 3.36Å; V355-E359 PolarHBondContact O-N 3.34Å; E359-G362 PolarHBondContact O-N 3.39Å; E359-G363 PolarHBondContact O-N 3.43Å; E359-G363 VanDerWaalsContact O-N 3.14Å
360	K	58.9	Low	50.8	Low	170 Å²	170	100.5 Å²	100.5	74%	0.739	56%	0.562	S	S	*	*	H	α-helix	trans	-67.7	-34.4	177.6	-167	173.8	-177.3	178.6	0	112.8	L356 T357 E358	L356-K360 VanDerWaalsContact O-CB 3.28Å; L356-K360 WeakPolarHBondContact O-CB 3.44Å; L356-K360 PolarHBondContact O-N 3Å; T357-K360 PolarHBondContact O-N 2.72Å; E358-K360 VanDerWaalsContact C-N 3.31Å; E358-K360 PolarHBondContact O-N 2.75Å
361	M	48.4	Very low	49.3	Very low	154 Å²	154	98.1 Å²	98.1	76%	0.759	57%	0.567	S	S	*	*	H	α-helix	trans	-76.7	-34	177.4	-157.9	123.7	-169.8	0	0	112.3	T357 E358	T357-M361 PolarHBondContact O-N 2.73Å; E358-M361 PolarHBondContact O-N 3.49Å
362	G	45	Very low	47.5	Very low	51 Å²	51	100.6 Å²	100.6	53%	0.526	59%	0.589	S	S	.	*	H	α-helix	trans	-69.9	-29.4	174.7	0	0	0	0	0	114.2	E358 E359	E358-G362 PolarHBondContact O-N 3.45Å; E359-G362 PolarHBondContact O-N 3.39Å
363	G	38.5	Very low	45.2	Very low	46 Å²	46	102.1 Å²	102.1	47%	0.474	61%	0.612	S	S	.	*	H	α-helix	trans	-79.9	-21.3	178	0	0	0	0	0	115.3	E359 K365 L366	E359-G363 PolarHBondContact O-N 3.43Å; E359-G363 VanDerWaalsContact O-N 3.14Å; G363-K365 VanDerWaalsContact C-N 3.26Å; G363-K365 PolarHBondContact O-N 2.89Å; G363-L366 PolarHBondContact O-N 3.25Å
364	A	32.5	Very low	43.5	Very low	73 Å²	73	103.7 Å²	103.7	60%	0.603	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-17.1	-174.2	0	0	0	0	0	114.4
365	K	37.3	Very low	41.7	Very low	193 Å²	193	106.4 Å²	106.4	84%	0.839	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-7.6	178.5	-84.8	-176.6	174.2	177.2	0	114.8	G363	G363-K365 VanDerWaalsContact C-N 3.26Å; G363-K365 PolarHBondContact O-N 2.89Å
366	L	35.6	Very low	39.8	Very low	155 Å²	155	115.2 Å²	115.2	81%	0.812	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.3	2.2	-176	-69.6	176.7	0	0	0	116.7	G363	G363-L366 PolarHBondContact O-N 3.25Å
367	N	25.6	Very low	37.8	Very low	150 Å²	150	116.2 Å²	116.2	80%	0.802	70%	0.702	S	S	*	*			trans	-159.3	96.2	167.7	-100.6	-4.3	0	0	0	111.7	G369	N367-G369 PolarHBondContact O-N 3.44Å
368	A	29.1	Very low	36.2	Very low	113 Å²	113	119 Å²	119	93%	0.934	71%	0.706	S	S	*	*			trans	-85.4	94.6	163.3	0	0	0	0	0	108.6
369	G	28.5	Very low	34.5	Very low	61 Å²	61	120.5 Å²	120.5	63%	0.629	73%	0.725	S	S	*	*			trans	179.9	104.5	176.2	0	0	0	0	0	114.1	N367	N367-G369 PolarHBondContact O-N 3.44Å
370	V	29.4	Very low	33.1	Very low	129 Å²	129	124.6 Å²	124.6	78%	0.782	76%	0.756	S	S	*	*			trans	73.1	102.8	157.3	-164.9	0	0	0	0	116.6
371	A	27.9	Very low	31.4	Very low	91 Å²	91	121.7 Å²	121.7	75%	0.752	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-86	135.8	160.7	0	0	0	0	0	110.3
372	P	27.2	Very low	30.3	Very low	121 Å²	121	121.4 Å²	121.4	79%	0.786	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-88.2	137.5	161.7	32.6	-27	0	0	0	110.6
373	S	25.2	Very low	29.3	Very low	115 Å²	115	128.2 Å²	128.2	80%	0.804	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-91.6	140	171.3	-63.4	0	0	0	0	111
374	P	31	Very low	29.1	Very low	130 Å²	130	132.7 Å²	132.7	84%	0.844	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-94	134.4	164.2	32.2	-25.7	0	0	0	111.3
375	L	28.2	Very low	29.2	Very low	167 Å²	167	134.5 Å²	134.5	87%	0.874	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-102.8	128.4	170.1	-76.6	173.2	0	0	0	110.7
376	R	27.7	Very low	29.5	Very low	202 Å²	202	131 Å²	131	76%	0.762	80%	0.799	S	S	*	*			trans	71.6	118.7	132.2	-158.8	179.8	-166.8	-176.7	7.4	121.1	K378	R376-K378 HydrophobicContact CG-CG 4.41Å; R376-K378 VanDerWaalsContact NH2-CE 3.27Å
377	A	27.5	Very low	29	Very low	107 Å²	107	131.8 Å²	131.8	88%	0.884	80%	0.798	S	S	*	*			trans	-137.5	154.3	136.7	0	0	0	0	0	109.5
378	K	28.8	Very low	29.7	Very low	148 Å²	148	129.9 Å²	129.9	64%	0.643	79%	0.794	S	S	*	*			trans	-109.9	139.7	-155.2	-69.2	168.3	172.2	174.7	0	113.8	R376	R376-K378 HydrophobicContact CG-CG 4.41Å; R376-K378 VanDerWaalsContact NH2-CE 3.27Å
379	S	26.5	Very low	29.5	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	78%	0.784	S	S	*	*			trans	66.6	164.7	133.3	-53.5	0	0	0	0	121.3
380	P	36.1	Very low	29.4	Very low	130 Å²	130	139.6 Å²	139.6	84%	0.844	79%	0.794	S	S	*	*			cis	-132.2	177.3	-2.2	32.8	-10.6	0	0	0	116.5
381	S	23.7	Very low	29.1	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	79%	0.788	S	S	*	*			trans	-92.7	158.3	-176.5	64.7	0	0	0	0	115.3
382	V	25.3	Very low	29	Very low	149 Å²	149	145 Å²	145	90%	0.903	80%	0.795	S	S	*	*			trans	-137.7	143.8	157.3	178.2	0	0	0	0	111.6
383	K	24.7	Very low	29	Very low	194 Å²	194	148.6 Å²	148.6	84%	0.843	80%	0.801	S	S	*	*			trans	-76.4	154	-168.8	-67.6	167.8	167.9	177.9	0	114.7
384	V	32.3	Very low	29	Very low	140 Å²	140	146.8 Å²	146.8	85%	0.848	80%	0.801	S	S	*	*			trans	-98.4	142	155.5	172.9	0	0	0	0	107.7
385	P	35.5	Very low	28.8	Very low	111 Å²	111	149.3 Å²	149.3	72%	0.721	80%	0.802	S	S	*	*				-161.4	-166.6	94.5	41.6	-19.2	0	0	0	115.4
386	P	43.3	Very low	29.4	Very low	119 Å²	119	146 Å²	146	77%	0.773	79%	0.79	S	S	*	*			cis	-129.7	171.7	-29.1	23	1.1	0	0	0	116.1
387	E	25.5	Very low	29.3	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.804	79%	0.793	S	S	*	*			trans	-16.3	167.3	153.9	-82	-92.5	141.8	0	0	120.5
388	P	41.3	Very low	29.1	Very low	109 Å²	109	143.4 Å²	143.4	71%	0.708	78%	0.782	S	S	*	*			cis	-154.5	177.7	39.4	43.9	-21.3	0	0	0	122.5
389	E	24.6	Very low	29.1	Very low	154 Å²	154	147.8 Å²	147.8	72%	0.72	79%	0.794	S	S	*	*			trans	76.6	124.4	147.3	-72.9	-127.4	123.5	0	0	121.7
390	R	25.7	Very low	29.5	Very low	225 Å²	225	148.6 Å²	148.6	85%	0.849	80%	0.797	S	S	*	*				177.3	144.8	78.2	-158	172.6	-166.1	-157.4	4	113.7
391	S	23	Very low	29	Very low	93 Å²	93	147 Å²	147	65%	0.65	80%	0.795	S	S	*	*			trans	-18.5	160.9	163.9	-31.4	0	0	0	0	119.2
392	R	26.7	Very low	29.2	Very low	241 Å²	241	147 Å²	147	91%	0.909	80%	0.801	S	S	*	*			cis	-175.2	159.4	37.9	-155.9	170.8	-178.7	162.3	-1.5	110.7
393	E	26	Very low	29.1	Very low	195 Å²	195	144 Å²	144	91%	0.911	80%	0.801	S	S	*	*			trans	-67.7	165.7	-173.5	-54.2	177.3	132.2	0	0	117.9
394	G	26.6	Very low	29.2	Very low	78 Å²	78	138.9 Å²	138.9	80%	0.804	80%	0.803	S	S	*	*			trans	143.8	96.3	142.4	0	0	0	0	0	117.5
395	E	25.4	Very low	28.8	Very low	183 Å²	183	136.1 Å²	136.1	86%	0.855	80%	0.803	S	S	*	*			trans	-76.4	-179.5	151.2	-122	-150.8	126.6	0	0	109.7
396	P	42	Very low	28.4	Very low	97 Å²	97	135.4 Å²	135.4	63%	0.63	81%	0.806	S	S	*	*			cis	-143.8	-176.3	3.7	34.4	-10.3	0	0	0	116.9
397	E	24.3	Very low	27.7	Very low	176 Å²	176	136.4 Å²	136.4	82%	0.822	81%	0.81	S	S	*	*			trans	80.3	140.5	137.5	-90.1	-97.3	111.5	0	0	125
398	A	23.4	Very low	27.7	Very low	78 Å²	78	132.6 Å²	132.6	65%	0.645	81%	0.808	S	S	*	*			trans	88.7	129.5	145.4	0	0	0	0	0	122.5
399	W	29.1	Very low	27.3	Very low	241 Å²	241	133.8 Å²	133.8	91%	0.913	82%	0.816	S	S	*	*			trans	-70.2	162.5	174.6	-63.1	71.5	0	0	0	113.1
400	P	34.9	Very low	27.5	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	82%	0.822	S	S	*	*				-146.9	171.3	110.4	36.2	-19.3	0	0	0	115.7
401	A	25.3	Very low	27.5	Very low	97 Å²	97	136 Å²	136	80%	0.802	83%	0.826	S	S	*	*			trans	-101.2	163.3	-177.6	0	0	0	0	0	114.4
402	A	28.1	Very low	27.9	Very low	108 Å²	108	142.3 Å²	142.3	89%	0.893	84%	0.836	S	S	*	*			trans	102.6	131.7	140.5	0	0	0	0	0	121.9
403	G	24.4	Very low	28	Very low	86 Å²	86	142.4 Å²	142.4	89%	0.887	84%	0.836	S	S	*	*			trans	111.7	123.3	153.5	0	0	0	0	0	114.6
404	G	24.8	Very low	28.3	Very low	86 Å²	86	141.4 Å²	141.4	89%	0.887	84%	0.837	S	S	*	*			cis	166.4	157.4	2.5	0	0	0	0	0	108.7
405	G	24.7	Very low	28.8	Very low	83 Å²	83	142.2 Å²	142.2	86%	0.856	84%	0.836	S	S	*	*			trans	135.6	116.3	163.9	0	0	0	0	0	116.6
406	A	26.6	Very low	29	Very low	96 Å²	96	144.8 Å²	144.8	79%	0.793	84%	0.838	S	S	*	*			trans	-63.9	156.8	-171.1	0	0	0	0	0	115.5
407	T	28.5	Very low	28.7	Very low	140 Å²	140	150.4 Å²	150.4	86%	0.859	85%	0.852	S	S	*	*				-157.2	146.8	70.4	45.9	0	0	0	0	113.3
408	A	27.2	Very low	29	Very low	92 Å²	92	145.8 Å²	145.8	76%	0.76	84%	0.844	S	S	*	*			trans	-99.4	162.8	173.7	0	0	0	0	0	111.1
409	P	32.1	Very low	29.4	Very low	133 Å²	133	146.8 Å²	146.8	86%	0.864	85%	0.853	S	S	*	*				-138.4	163.1	88.9	31.3	-13.1	0	0	0	115.4
410	R	29.8	Very low	29.7	Very low	225 Å²	225	145.1 Å²	145.1	85%	0.849	85%	0.852	S	S	*	*			trans	-58.4	139.3	-166.2	-65.2	167.5	157.9	-165.4	-3.5	115.9
411	E	25.6	Very low	29.9	Very low	200 Å²	200	146.4 Å²	146.4	94%	0.935	85%	0.851	S	S	*	*				-138.3	121.2	129.6	-125.1	-179.3	154	0	0	109.5
412	R	30.7	Very low	30.8	Very low	227 Å²	227	143.9 Å²	143.9	86%	0.857	83%	0.826	S	S	*	*			trans	-84	143.1	176	-87.8	-171.2	172.1	-88.3	4	108.2
413	R	28.7	Very low	32.2	Very low	243 Å²	243	145.1 Å²	145.1	92%	0.917	81%	0.814	S	S	*	*			trans	116.6	69.4	140.5	-151.1	-179.2	-143.3	160.5	1.4	114.9
414	D	33	Very low	33.8	Very low	173 Å²	173	145.6 Å²	145.6	93%	0.925	80%	0.799	S	S	*	*			trans	-125.9	105.2	150.5	-105.4	-40.5	0	0	0	109.2
415	A	35.8	Very low	36.1	Very low	95 Å²	95	142.3 Å²	142.3	79%	0.785	76%	0.763	S	S	*	*			trans	-164.3	75.5	166.6	0	0	0	0	0	110
416	R	31.2	Very low	38.8	Very low	238 Å²	238	140.7 Å²	140.7	90%	0.898	73%	0.732	S	S	*	*			trans	-170.5	69.2	153.4	-107.1	174.9	-164.6	-91.8	2.2	110.8
417	K	35.3	Very low	41.5	Very low	214 Å²	214	138.3 Å²	138.3	93%	0.93	71%	0.708	S	S	*	*			trans	-101.1	82.2	148.8	-86.6	178.5	179.5	171	0	106.9	A419	K417-A419 PolarHBondContact O-N 2.81Å
418	A	29.2	Very low	43.9	Very low	79 Å²	79	131.7 Å²	131.7	65%	0.653	67%	0.667	S	S	*	*			trans	-57.6	132.9	162.7	0	0	0	0	0	107.7	K420	A418-K420 PolarHBondContact O-N 2.87Å
419	A	32.8	Very low	46.7	Very low	99 Å²	99	129.9 Å²	129.9	82%	0.818	64%	0.643	S	S	*	*			trans	-51.1	112.2	172.7	0	0	0	0	0	108.9	K417 L421	K417-A419 PolarHBondContact O-N 2.81Å; A419-L421 PolarHBondContact O-N 2.82Å
420	K	36.1	Very low	49.2	Very low	206 Å²	206	128 Å²	128	90%	0.896	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-67	124.8	176.2	-71	-175.5	177.5	-171.3	0	107.9	A418	A418-K420 PolarHBondContact O-N 2.87Å
421	L	38.3	Very low	51.8	Low	155 Å²	155	117.9 Å²	117.9	81%	0.812	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-51.9	152	164.8	-76.9	155.8	0	0	0	110.2	A419 E423	A419-L421 PolarHBondContact O-N 2.82Å; L421-E423 PolarHBondContact O-N 3.42Å
422	P	43.9	Very low	54.8	Low	43 Å²	43	109.2 Å²	109.2	28%	0.279	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-59.7	133.3	-179.1	-19.5	32.4	0	0	0	111.3	T424 Y481 Y485	P422-T424 PolarHBondContact O-N 3.03Å; P422-Y481 HydrophobicContact CB-CE2 4.27Å; P422-Y485 HydrophobicContact CB-CD2 4.18Å; P422-Y485 HydrophobicContact CB-CE1 4.42Å; P422-Y485 HydrophobicContact CB-CE2 3.51Å; P422-Y485 HydrophobicContact CG-CD1 4.48Å; P422-Y485 HydrophobicContact CG-CD2 4.47Å; P422-Y485 HydrophobicContact CG-CE1 3.72Å; P422-Y485 HydrophobicContact CG-CE2 3.73Å; P422-Y485 VanDerWaalsContact CG-OH 3.32Å; P422-Y485 WeakPolarHBondContact CG-OH 3.35Å
423	E	56.9	Low	57.6	Low	135 Å²	135	99.7 Å²	99.7	63%	0.631	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-63.5	119.7	177.5	-157.2	174.6	-179.4	0	0	109.1	L421 K426 Y481	L421-E423 PolarHBondContact O-N 3.42Å; E423-K426 WeakPolarHBondContact OE1-CE 3.38Å; E423-K426 IonicContact OE1-NZ 3.2Å; E423-K426 PolarHBondContact OE1-NZ 3.49Å; E423-Y481 VanDerWaalsContact O-CD2 3.23Å; E423-Y481 WeakPolarHBondContact O-CD2 3.47Å; E423-Y481 WeakPolarHBondContact O-CE2 3.4Å
424	T	59.7	Low	60.2	Low	95 Å²	95	94 Å²	94	58%	0.583	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-67.9	148.6	178.8	48	0	0	0	0	110.8	P422 K426	P422-T424 PolarHBondContact O-N 3.03Å; T424-K426 PolarHBondContact O-N 3.25Å
425	P	73.2	Confident	62.7	Low	18 Å²	18	88.5 Å²	88.5	12%	0.117	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-65.7	135.2	-174.6	26.4	-32.2	0	0	0	111.4	V260 V263 Q478 Y481	V260-P425 HydrophobicContact CG1-CG 3.88Å; V263-P425 HydrophobicContact CG2-CB 4.12Å; V263-P425 HydrophobicContact CG2-CG 3.96Å; P425-Q478 HydrophobicContact CB-CB 4.38Å; P425-Y481 HydrophobicContact CB-CG 4.5Å; P425-Y481 HydrophobicContact CG-CD1 4.25Å; P425-Y481 HydrophobicContact CG-CG 4.14Å
426	K	80.1	Confident	65.1	Low	48 Å²	48	85.1 Å²	85.1	21%	0.209	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-90.5	141.9	-175	-67.3	174.1	-175.2	164.8	0	112.3	V263 E423 T424 E430 A474 D477	V263-K426 VanDerWaalsContact CG1-C 3.41Å; V263-K426 WeakPolarHBondContact CG1-O 3.33Å; E423-K426 WeakPolarHBondContact OE1-CE 3.38Å; E423-K426 IonicContact OE1-NZ 3.2Å; E423-K426 PolarHBondContact OE1-NZ 3.49Å; T424-K426 PolarHBondContact O-N 3.25Å; K426-E430 HydrophobicContact CB-CB 4.07Å; K426-A474 WeakPolarHBondContact O-CB 3.41Å; K426-D477 PolarHBondContact N-OD2 2.8Å
427	T	83.8	Confident	67.7	Low	47 Å²	47	76.2 Å²	76.2	29%	0.288	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-60.9	162.2	171.1	62.3	0	0	0	0	112.4	V263 E429 E430 T431	V263-T427 HydrophobicContact CG1-CG2 3.98Å; T427-E429 PolarHBondContact O-N 2.92Å; T427-E430 WeakPolarHBondContact CB-OE2 3.22Å; T427-E430 WeakPolarHBondContact CG2-OE2 3.47Å; T427-E430 PolarHBondContact N-OE2 3.49Å; T427-E430 PolarHBondContact O-N 3.04Å; T427-E430 WeakPolarHBondContact OG1-CB 3.34Å; T427-E430 WeakPolarHBondContact OG1-CG 3.23Å; T427-E430 PolarHBondContact OG1-N 2.86Å; T427-E430 VanDerWaalsContact OG1-N 3.14Å; T427-E430 PolarHBondContact OG1-OE2 2.86Å; T427-T431 WeakPolarHBondContact O-CB 3.46Å; T427-T431 PolarHBondContact O-N 3.38Å; T427-T431 PolarHBondContact O-OG1 2.7Å
428	A	78.5	Confident	70.1	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-57.9	-39.8	176.2	0	0	0	0	0	111.2	W432 W459 I471 A474	A428-W432 PolarHBondContact O-N 3.28Å; A428-W432 VanDerWaalsContact O-N 3.13Å; A428-W459 HydrophobicContact CB-CH2 3.91Å; A428-W459 HydrophobicContact CB-CZ2 3.99Å; A428-W459 WeakPolarHBondContact O-CH2 3.31Å; A428-I471 HydrophobicContact CB-CB 4.34Å; A428-I471 HydrophobicContact CB-CG1 3.67Å; A428-A474 HydrophobicContact CB-CB 4.16Å
429	E	86.9	Confident	72.9	Confident	55 Å²	55	69.8 Å²	69.8	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-63.6	-53.2	174.4	-177.6	162.6	-165.6	0	0	111.5	T427 T431 W432 Q433 W459	T427-E429 PolarHBondContact O-N 2.92Å; E429-T431 VanDerWaalsContact C-N 3.27Å; E429-T431 PolarHBondContact O-N 3.14Å; E429-W432 PolarHBondContact O-N 3.44Å; E429-W432 VanDerWaalsContact O-N 3.16Å; E429-Q433 HydrophobicContact CG-CG 4.15Å; E429-Q433 WeakPolarHBondContact O-CB 3.33Å; E429-Q433 VanDerWaalsContact O-CG 3.24Å; E429-Q433 WeakPolarHBondContact O-CG 3.38Å; E429-Q433 PolarHBondContact O-N 3.46Å; E429-Q433 PolarHBondContact OE1-NE2 3.25Å; E429-W459 HydrophobicContact CB-CD2 4.05Å; E429-W459 HydrophobicContact CB-CG 4.3Å; E429-W459 HydrophobicContact CB-CZ2 4.02Å; E429-W459 HydrophobicContact CG-CB 4.41Å; E429-W459 HydrophobicContact CG-CD2 4Å; E429-W459 HydrophobicContact CG-CG 3.78Å
430	E	84.4	Confident	75.5	Confident	92 Å²	92	67.2 Å²	67.2	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-35.3	179.6	-72	164.4	144.3	0	0	112.7	K426 T427 Q433 H434	K426-E430 HydrophobicContact CB-CB 4.07Å; T427-E430 WeakPolarHBondContact CB-OE2 3.22Å; T427-E430 WeakPolarHBondContact CG2-OE2 3.47Å; T427-E430 PolarHBondContact N-OE2 3.49Å; T427-E430 PolarHBondContact O-N 3.04Å; T427-E430 WeakPolarHBondContact OG1-CB 3.34Å; T427-E430 WeakPolarHBondContact OG1-CG 3.23Å; T427-E430 PolarHBondContact OG1-N 2.86Å; T427-E430 VanDerWaalsContact OG1-N 3.14Å; T427-E430 PolarHBondContact OG1-OE2 2.86Å; E430-Q433 PolarHBondContact O-N 3.43Å; E430-H434 VanDerWaalsContact O-CB 3.25Å; E430-H434 WeakPolarHBondContact O-CB 3.45Å; E430-H434 PolarHBondContact O-N 2.89Å
431	T	82.9	Confident	77.9	Confident	13 Å²	13	59.8 Å²	59.8	8%	0.08	33%	0.326	C	S	.	.	H	α-helix	trans	-66.4	-41.4	177.5	-57.3	0	0	0	0	111.2	T427 E429 S435 W470 K473	T427-T431 WeakPolarHBondContact O-CB 3.46Å; T427-T431 PolarHBondContact O-N 3.38Å; T427-T431 PolarHBondContact O-OG1 2.7Å; E429-T431 VanDerWaalsContact C-N 3.27Å; E429-T431 PolarHBondContact O-N 3.14Å; T431-S435 PolarHBondContact O-N 3.31Å; T431-W470 HydrophobicContact CG2-CE3 4.14Å; T431-K473 HydrophobicContact CG2-CB 4.12Å; T431-K473 HydrophobicContact CG2-CD 3.61Å; T431-K473 HydrophobicContact CG2-CG 3.75Å
432	W	89.6	Confident	80.2	Confident	18 Å²	18	56 Å²	56	7%	0.068	32%	0.317	C	S	.	.	H	α-helix	trans	-68.5	-47.8	172.9	169.3	75	0	0	0	111.1	A428 E429 H434 S435 V436 M455 A458 W459 M462 W470	A428-W432 PolarHBondContact O-N 3.28Å; A428-W432 VanDerWaalsContact O-N 3.13Å; E429-W432 PolarHBondContact O-N 3.44Å; E429-W432 VanDerWaalsContact O-N 3.16Å; W432-H434 VanDerWaalsContact C-N 3.31Å; W432-H434 PolarHBondContact O-N 3.29Å; W432-S435 WeakPolarHBondContact O-CA 3.49Å; W432-S435 WeakPolarHBondContact O-CB 3.33Å; W432-S435 PolarHBondContact O-N 2.99Å; W432-S435 PolarHBondContact O-OG 3.44Å; W432-V436 HydrophobicContact CD2-CG2 4.3Å; W432-V436 HydrophobicContact CH2-CG2 4.17Å; W432-V436 HydrophobicContact CZ2-CG2 3.94Å; W432-V436 HydrophobicContact CZ3-CG2 4.45Å; W432-V436 PolarHBondContact O-N 3.43Å; W432-M455 HydrophobicContact CH2-CB 4.07Å; W432-M455 WeakPolarHBondContact CH2-O 3.32Å; W432-M455 HydrophobicContact CZ3-CB 3.93Å; W432-M455 WeakPolarHBondContact CZ3-O 3.47Å; W432-A458 HydrophobicContact CH2-CB 3.87Å; W432-A458 HydrophobicContact CZ2-CB 4.24Å; W432-W459 HydrophobicContact CB-CE3 3.79Å; W432-W459 HydrophobicContact CB-CH2 4.48Å; W432-W459 HydrophobicContact CB-CZ3 3.48Å; W432-W459 VanDerWaalsContact CB-CZ3 3.48Å; W432-W459 AromaticContact CD2-CE3 3.63Å; W432-W459 HydrophobicContact CD2-CE3 3.63Å; W432-W459 HydrophobicContact CD2-CZ3 4.19Å; W432-W459 HydrophobicContact CE3-CB 3.92Å; W432-W459 HydrophobicContact CE3-CD2 4.22Å; W432-W459 AromaticContact CE3-CE3 3.57Å; W432-W459 HydrophobicContact CE3-CE3 3.57Å; W432-W459 HydrophobicContact CE3-CG 4.38Å; W432-W459 HydrophobicContact CE3-CZ3 4.45Å; W432-W459 AromaticContact CG-CE3 3.73Å; W432-W459 HydrophobicContact CG-CE3 3.73Å; W432-W459 AromaticContact CG-CZ3 3.78Å; W432-W459 HydrophobicContact CG-CZ3 3.78Å; W432-W459 HydrophobicContact CH2-CB 4.22Å; W432-W459 HydrophobicContact CZ3-CB 3.61Å; W432-W459 HydrophobicContact CZ3-CE3 4.4Å; W432-M462 HydrophobicContact CD2-CE 3.62Å; W432-M462 HydrophobicContact CE3-CE 4.19Å; W432-M462 HydrophobicContact CG-CE 4.01Å; W432-M462 HydrophobicContact CH2-CE 4.22Å; W432-M462 HydrophobicContact CZ2-CE 3.63Å; W432-M462 HydrophobicContact CZ3-CE 4.48Å; W432-W470 HydrophobicContact CB-CB 4.23Å; W432-W470 HydrophobicContact CB-CD2 3.68Å; W432-W470 HydrophobicContact CB-CE3 3.97Å; W432-W470 HydrophobicContact CB-CG 3.76Å; W432-W470 AromaticContact CD1-CD1 3.98Å; W432-W470 AromaticContact CD1-CD2 3.97Å; W432-W470 AromaticContact CD1-CE2 3.45Å; W432-W470 VanDerWaalsContact CD1-CE2 3.45Å; W432-W470 AromaticContact CD1-CZ2 3.71Å; W432-W470 AromaticContact CD1-NE1 3.45Å; W432-W470 HydrophobicContact CG-CD2 4.23Å; W432-W470 HydrophobicContact CG-CG 4.37Å
433	Q	89	Confident	82.3	Confident	27 Å²	27	60.8 Å²	60.8	13%	0.126	33%	0.334	C	S	.	.	H	α-helix	trans	-54.6	-48.5	179.6	-76.2	-177.4	-3.3	0	0	110.5	E429 E430 S435 V436 T437 M455	E429-Q433 HydrophobicContact CG-CG 4.15Å; E429-Q433 WeakPolarHBondContact O-CB 3.33Å; E429-Q433 VanDerWaalsContact O-CG 3.24Å; E429-Q433 WeakPolarHBondContact O-CG 3.38Å; E429-Q433 PolarHBondContact O-N 3.46Å; E429-Q433 PolarHBondContact OE1-NE2 3.25Å; E430-Q433 PolarHBondContact O-N 3.43Å; Q433-S435 PolarHBondContact O-N 3.31Å; Q433-V436 CarbonylContact O-C 3.55Å; Q433-V436 PolarHBondContact O-N 2.96Å; Q433-V436 VanDerWaalsContact O-N 3.08Å; Q433-T437 VanDerWaalsContact C-OG1 3.26Å; Q433-T437 WeakPolarHBondContact O-CA 3.41Å; Q433-T437 WeakPolarHBondContact O-CB 3.45Å; Q433-T437 PolarHBondContact O-N 2.7Å; Q433-T437 PolarHBondContact O-OG1 3.28Å; Q433-M455 HydrophobicContact CB-CE 3.34Å; Q433-M455 HydrophobicContact CG-CB 4.39Å; Q433-M455 HydrophobicContact CG-CE 3.67Å; Q433-M455 WeakPolarHBondContact O-CE 3.5Å
434	H	83.1	Confident	83.8	Confident	125 Å²	125	59 Å²	59	58%	0.579	32%	0.322	S	S	*	.	H	α-helix	trans	-60.3	-28.5	177.5	-168	-72.8	0	0	0	113.5	E430 W432 T437	E430-H434 VanDerWaalsContact O-CB 3.25Å; E430-H434 WeakPolarHBondContact O-CB 3.45Å; E430-H434 PolarHBondContact O-N 2.89Å; W432-H434 VanDerWaalsContact C-N 3.31Å; W432-H434 PolarHBondContact O-N 3.29Å; H434-T437 WeakPolarHBondContact CA-OG1 3.42Å
435	S	85.2	Confident	85.1	Confident	57 Å²	57	65.4 Å²	65.4	40%	0.399	34%	0.335	S	S	.	.	H	α-helix	trans	-75.8	-28.7	177.2	76.7	0	0	0	0	113.3	T431 W432 Q433 W470	T431-S435 PolarHBondContact O-N 3.31Å; W432-S435 WeakPolarHBondContact O-CA 3.49Å; W432-S435 WeakPolarHBondContact O-CB 3.33Å; W432-S435 PolarHBondContact O-N 2.99Å; W432-S435 PolarHBondContact O-OG 3.44Å; Q433-S435 PolarHBondContact O-N 3.31Å; S435-W470 WeakPolarHBondContact OG-CH2 3.06Å; S435-W470 WeakPolarHBondContact OG-CZ3 3.29Å
436	V	87.2	Confident	85.4	Confident	24 Å²	24	69.1 Å²	69.1	15%	0.145	36%	0.362	C	S	.	.	H	α-helix	trans	-108.4	-4	-176.7	-56.3	0	0	0	0	113.5	W432 Q433 G438 D439 Y440 M455	W432-V436 HydrophobicContact CD2-CG2 4.3Å; W432-V436 HydrophobicContact CH2-CG2 4.17Å; W432-V436 HydrophobicContact CZ2-CG2 3.94Å; W432-V436 HydrophobicContact CZ3-CG2 4.45Å; W432-V436 PolarHBondContact O-N 3.43Å; Q433-V436 CarbonylContact O-C 3.55Å; Q433-V436 PolarHBondContact O-N 2.96Å; Q433-V436 VanDerWaalsContact O-N 3.08Å; V436-G438 VanDerWaalsContact C-N 3.27Å; V436-G438 PolarHBondContact O-N 2.85Å; V436-D439 PolarHBondContact O-N 2.85Å; V436-D439 VanDerWaalsContact O-N 3.11Å; V436-Y440 HydrophobicContact CB-CD2 3.95Å; V436-Y440 HydrophobicContact CB-CE2 4.09Å; V436-Y440 HydrophobicContact CG2-CD2 3.91Å; V436-Y440 HydrophobicContact CG2-CE2 3.99Å; V436-Y440 WeakPolarHBondContact O-CD2 3.34Å; V436-Y440 PolarHBondContact O-N 3.32Å; V436-M455 HydrophobicContact CG2-CE 3.93Å; V436-M455 HydrophobicContact CG2-CG 4.24Å; V436-M455 HydrophobicContact CG2-SD 4.47Å
437	T	85.6	Confident	85.8	Confident	50 Å²	50	69.4 Å²	69.4	31%	0.307	37%	0.366	S	S	.	.	H	α-helix	trans	-56.1	-40.5	-174.9	-64.6	0	0	0	0	111.9	Q433 H434 D439 L441	Q433-T437 VanDerWaalsContact C-OG1 3.26Å; Q433-T437 WeakPolarHBondContact O-CA 3.41Å; Q433-T437 WeakPolarHBondContact O-CB 3.45Å; Q433-T437 PolarHBondContact O-N 2.7Å; Q433-T437 PolarHBondContact O-OG1 3.28Å; H434-T437 WeakPolarHBondContact CA-OG1 3.42Å; T437-D439 PolarHBondContact O-N 3.19Å; T437-L441 HydrophobicContact CG2-CD1 3.63Å; T437-L441 HydrophobicContact CG2-CG 4.11Å; T437-L441 VanDerWaalsContact O-CB 3.3Å; T437-L441 WeakPolarHBondContact O-CB 3.43Å; T437-L441 WeakPolarHBondContact O-CG 3.42Å; T437-L441 PolarHBondContact O-N 3.06Å
438	G	85.7	Confident	85.6	Confident	52 Å²	52	76.2 Å²	76.2	54%	0.536	39%	0.386	S	S	.	.	H	α-helix	trans	-61.5	-44.7	178.5	0	0	0	0	0	112.7	V436 A442	V436-G438 VanDerWaalsContact C-N 3.27Å; V436-G438 PolarHBondContact O-N 2.85Å; G438-A442 WeakPolarHBondContact O-CB 3.22Å; G438-A442 PolarHBondContact O-N 3.42Å
439	D	87.6	Confident	85.9	Confident	106 Å²	106	84.3 Å²	84.3	57%	0.567	42%	0.417	S	S	*	.	H	α-helix	trans	-70.2	-40.1	-178.3	-62.8	-19.7	0	0	0	111.9	V436 T437 A442 K443	V436-D439 PolarHBondContact O-N 2.85Å; V436-D439 VanDerWaalsContact O-N 3.11Å; T437-D439 PolarHBondContact O-N 3.19Å; D439-A442 PolarHBondContact O-N 3.42Å; D439-K443 WeakPolarHBondContact O-CB 3.45Å; D439-K443 WeakPolarHBondContact O-CG 3.21Å; D439-K443 PolarHBondContact O-N 3.11Å
440	Y	87.6	Confident	85.9	Confident	45 Å²	45	87.7 Å²	87.7	18%	0.176	43%	0.431	C	S	.	.	H	α-helix	trans	-71.3	-38.8	177.5	-85	-103.9	0	0	0	111.8	V436 A442 K443 Y444 A454 M455 A458	V436-Y440 HydrophobicContact CB-CD2 3.95Å; V436-Y440 HydrophobicContact CB-CE2 4.09Å; V436-Y440 HydrophobicContact CG2-CD2 3.91Å; V436-Y440 HydrophobicContact CG2-CE2 3.99Å; V436-Y440 WeakPolarHBondContact O-CD2 3.34Å; V436-Y440 PolarHBondContact O-N 3.32Å; Y440-A442 VanDerWaalsContact C-N 3.31Å; Y440-A442 PolarHBondContact O-N 2.91Å; Y440-K443 PolarHBondContact O-N 3.3Å; Y440-Y444 HydrophobicContact CD1-CD2 4.44Å; Y440-Y444 AromaticContact CD1-CE2 3.98Å; Y440-Y444 HydrophobicContact CD1-CE2 3.98Å; Y440-Y444 VanDerWaalsContact O-CD2 3.28Å; Y440-Y444 WeakPolarHBondContact O-CD2 3.42Å; Y440-Y444 PolarHBondContact O-N 3.33Å; Y440-A454 HydrophobicContact CD1-CB 3.96Å; Y440-A454 HydrophobicContact CE1-CB 3.92Å; Y440-M455 VanDerWaalsContact CB-SD 3.59Å; Y440-M455 HydrophobicContact CD1-CG 3.42Å; Y440-M455 VanDerWaalsContact CD1-CG 3.42Å; Y440-M455 HydrophobicContact CD1-SD 4.39Å; Y440-M455 HydrophobicContact CD2-CG 3.82Å; Y440-M455 HydrophobicContact CD2-SD 4.42Å; Y440-M455 HydrophobicContact CE1-CG 3.87Å; Y440-M455 HydrophobicContact CE2-CG 4.23Å; Y440-M455 HydrophobicContact CG-CG 3.38Å; Y440-M455 HydrophobicContact CG-SD 3.91Å; Y440-A458 WeakPolarHBondContact OH-CB 3.39Å
441	L	86.5	Confident	86	Confident	50 Å²	50	83.4 Å²	83.4	26%	0.262	41%	0.411	S	S	.	.	H	α-helix	trans	-62.6	-39.1	172.6	-73.3	174	0	0	0	111.7	T437 R445 S446 R448 A451	T437-L441 HydrophobicContact CG2-CD1 3.63Å; T437-L441 HydrophobicContact CG2-CG 4.11Å; T437-L441 VanDerWaalsContact O-CB 3.3Å; T437-L441 WeakPolarHBondContact O-CB 3.43Å; T437-L441 WeakPolarHBondContact O-CG 3.42Å; T437-L441 PolarHBondContact O-N 3.06Å; L441-R445 PolarHBondContact O-N 3.47Å; L441-S446 WeakPolarHBondContact O-CA 3.25Å; L441-S446 PolarHBondContact O-N 2.93Å; L441-R448 HydrophobicContact CD2-CB 4.22Å; L441-R448 HydrophobicContact CD2-CG 4.39Å; L441-A451 HydrophobicContact CD2-CB 3.89Å; L441-A451 HydrophobicContact CG-CB 4.42Å
442	A	87.9	Confident	86.1	Confident	76 Å²	76	87 Å²	87	63%	0.628	43%	0.427	S	S	*	.	H	α-helix	trans	-64.1	-44.2	174.5	0	0	0	0	0	112	G438 D439 Y440 Y444 R445	G438-A442 WeakPolarHBondContact O-CB 3.22Å; G438-A442 PolarHBondContact O-N 3.42Å; D439-A442 PolarHBondContact O-N 3.42Å; Y440-A442 VanDerWaalsContact C-N 3.31Å; Y440-A442 PolarHBondContact O-N 2.91Å; A442-Y444 VanDerWaalsContact C-N 3.34Å; A442-Y444 PolarHBondContact O-N 3.02Å; A442-R445 PolarHBondContact O-N 3.34Å
443	K	86.8	Confident	86.1	Confident	144 Å²	144	88.8 Å²	88.8	63%	0.626	45%	0.446	S	S	*	.	H	α-helix	trans	-62.2	-37.3	178.5	-75.2	170.6	-176.1	-179.4	0	113.2	D439 Y440	D439-K443 WeakPolarHBondContact O-CB 3.45Å; D439-K443 WeakPolarHBondContact O-CG 3.21Å; D439-K443 PolarHBondContact O-N 3.11Å; Y440-K443 PolarHBondContact O-N 3.3Å
444	Y	88.9	Confident	86.1	Confident	96 Å²	96	88.4 Å²	88.4	38%	0.376	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	23.4	-177.9	-69.1	-80.1	0	0	0	113.6	Y440 A442 S446 D447 K450 A451 A454	Y440-Y444 HydrophobicContact CD1-CD2 4.44Å; Y440-Y444 AromaticContact CD1-CE2 3.98Å; Y440-Y444 HydrophobicContact CD1-CE2 3.98Å; Y440-Y444 VanDerWaalsContact O-CD2 3.28Å; Y440-Y444 WeakPolarHBondContact O-CD2 3.42Å; Y440-Y444 PolarHBondContact O-N 3.33Å; A442-Y444 VanDerWaalsContact C-N 3.34Å; A442-Y444 PolarHBondContact O-N 3.02Å; Y444-S446 VanDerWaalsContact C-N 3.27Å; Y444-S446 PolarHBondContact O-N 3.38Å; Y444-D447 WeakPolarHBondContact O-CB 3.42Å; Y444-D447 PolarHBondContact O-N 2.9Å; Y444-K450 HydrophobicContact CD1-CB 3.74Å; Y444-K450 HydrophobicContact CE1-CB 4.33Å; Y444-K450 HydrophobicContact CG-CB 4.11Å; Y444-A451 HydrophobicContact CD2-CB 4.11Å; Y444-A451 HydrophobicContact CG-CB 4.49Å; Y444-A454 HydrophobicContact CD2-CB 4.43Å; Y444-A454 HydrophobicContact CE2-CB 3.43Å; Y444-A454 VanDerWaalsContact CE2-CB 3.43Å; Y444-A454 VanDerWaalsContact OH-CB 3.25Å; Y444-A454 WeakPolarHBondContact OH-CB 3.32Å
445	R	86.7	Confident	86.3	Confident	230 Å²	230	82.8 Å²	82.8	87%	0.868	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	40.2	177.8	-60.7	-173.1	172.3	92.6	-2	113.7	L441 A442 D447	L441-R445 PolarHBondContact O-N 3.47Å; A442-R445 PolarHBondContact O-N 3.34Å; R445-D447 PolarHBondContact O-N 3.4Å
446	S	80.1	Confident	86.4	Confident	97 Å²	97	83.3 Å²	83.3	68%	0.678	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	13.3	-175.7	-50.2	0	0	0	0	115.3	L441 Y444 R448	L441-S446 WeakPolarHBondContact O-CA 3.25Å; L441-S446 PolarHBondContact O-N 2.93Å; Y444-S446 VanDerWaalsContact C-N 3.27Å; Y444-S446 PolarHBondContact O-N 3.38Å; S446-R448 PolarHBondContact O-N 3.34Å
447	D	88.1	Confident	86.6	Confident	54 Å²	54	84.9 Å²	84.9	29%	0.289	43%	0.433	S	S	.	.			trans	-69.2	94.6	167.1	-172.1	-27.6	0	0	0	108.9	Y444 R445 R449 K450 A451	Y444-D447 WeakPolarHBondContact O-CB 3.42Å; Y444-D447 PolarHBondContact O-N 2.9Å; R445-D447 PolarHBondContact O-N 3.4Å; D447-R449 PolarHBondContact O-N 2.98Å; D447-R449 PolarHBondContact OD1-N 3.32Å; D447-K450 HydrophobicContact CB-CB 4.21Å; D447-K450 HydrophobicContact CB-CD 4.45Å; D447-K450 HydrophobicContact CB-CG 4.5Å; D447-K450 PolarHBondContact O-N 3.42Å; D447-K450 PolarHBondContact OD1-N 2.93Å; D447-K450 VanDerWaalsContact OD1-N 3.09Å; D447-K450 WeakPolarHBondContact OD2-CD 3.5Å; D447-K450 WeakPolarHBondContact OD2-CE 3.47Å; D447-K450 WeakPolarHBondContact OD2-CG 3.39Å; D447-K450 IonicContact OD2-NZ 3.19Å; D447-K450 PolarHBondContact OD2-NZ 3.42Å; D447-A451 VanDerWaalsContact O-CB 3.28Å; D447-A451 WeakPolarHBondContact O-CB 3.46Å; D447-A451 PolarHBondContact O-N 3.47Å
448	R	80.3	Confident	86.8	Confident	189 Å²	189	83.5 Å²	83.5	71%	0.713	43%	0.426	S	S	*	.	H	α-helix	trans	-61.4	-32.3	-175.2	-170.7	171.2	178.7	145	-1.1	112.4	L441 S446 Q452	L441-R448 HydrophobicContact CD2-CB 4.22Å; L441-R448 HydrophobicContact CD2-CG 4.39Å; S446-R448 PolarHBondContact O-N 3.34Å; R448-Q452 WeakPolarHBondContact O-CB 3.16Å; R448-Q452 PolarHBondContact O-N 2.95Å
449	R	82.8	Confident	86.8	Confident	170 Å²	170	81.8 Å²	81.8	64%	0.642	40%	0.404	S	S	*	.	H	α-helix	trans	-73.6	-46.3	-179.6	-71.7	-175.2	176.1	177	-4.4	111.2	D234 D447 Q452 A453	D234-R449 IonicContact OD1-NH2 2.75Å; D234-R449 IonicContact OD2-CZ 3.41Å; D234-R449 IonicContact OD2-NH2 3.5Å; D234-R449 PolarHBondContact OD2-NH2 3.41Å; D447-R449 PolarHBondContact O-N 2.98Å; D447-R449 PolarHBondContact OD1-N 3.32Å; R449-Q452 PolarHBondContact O-N 3.19Å; R449-A453 WeakPolarHBondContact O-CB 3.07Å; R449-A453 PolarHBondContact O-N 2.91Å
450	K	87.1	Confident	86.7	Confident	127 Å²	127	86 Å²	86	55%	0.552	41%	0.412	S	S	*	.	H	α-helix	trans	-67.4	-39.9	176.9	-69.1	-178	-169.7	154.8	0	112.4	Y444 D447 Q452 A454	Y444-K450 HydrophobicContact CD1-CB 3.74Å; Y444-K450 HydrophobicContact CE1-CB 4.33Å; Y444-K450 HydrophobicContact CG-CB 4.11Å; D447-K450 HydrophobicContact CB-CB 4.21Å; D447-K450 HydrophobicContact CB-CD 4.45Å; D447-K450 HydrophobicContact CB-CG 4.5Å; D447-K450 PolarHBondContact O-N 3.42Å; D447-K450 PolarHBondContact OD1-N 2.93Å; D447-K450 VanDerWaalsContact OD1-N 3.09Å; D447-K450 WeakPolarHBondContact OD2-CD 3.5Å; D447-K450 WeakPolarHBondContact OD2-CE 3.47Å; D447-K450 WeakPolarHBondContact OD2-CG 3.39Å; D447-K450 IonicContact OD2-NZ 3.19Å; D447-K450 PolarHBondContact OD2-NZ 3.42Å; K450-Q452 VanDerWaalsContact C-N 3.35Å; K450-A454 VanDerWaalsContact O-CB 3.27Å; K450-A454 WeakPolarHBondContact O-CB 3.41Å; K450-A454 PolarHBondContact O-N 3.39Å
451	A	87.5	Confident	86.6	Confident	1 Å²	1	88.5 Å²	88.5	1%	0.008	44%	0.435	C	S	.	.	H	α-helix	trans	-59.5	-46	173.9	0	0	0	0	0	111.4	L441 Y444 D447 A454 M455	L441-A451 HydrophobicContact CD2-CB 3.89Å; L441-A451 HydrophobicContact CG-CB 4.42Å; Y444-A451 HydrophobicContact CD2-CB 4.11Å; Y444-A451 HydrophobicContact CG-CB 4.49Å; D447-A451 VanDerWaalsContact O-CB 3.28Å; D447-A451 WeakPolarHBondContact O-CB 3.46Å; D447-A451 PolarHBondContact O-N 3.47Å; A451-A454 PolarHBondContact O-N 2.98Å; A451-M455 WeakPolarHBondContact O-CB 3.23Å; A451-M455 WeakPolarHBondContact O-CG 3.25Å; A451-M455 PolarHBondContact O-N 2.77Å
452	Q	85.8	Confident	86.6	Confident	89 Å²	89	87.6 Å²	87.6	42%	0.416	43%	0.43	S	S	.	.	H	α-helix	trans	-66.1	-46.6	179.5	-173.9	170.7	-11	0	0	112.4	R448 R449 K450 A454 M455 E456	R448-Q452 WeakPolarHBondContact O-CB 3.16Å; R448-Q452 PolarHBondContact O-N 2.95Å; R449-Q452 PolarHBondContact O-N 3.19Å; K450-Q452 VanDerWaalsContact C-N 3.35Å; Q452-A454 VanDerWaalsContact C-N 3.31Å; Q452-A454 PolarHBondContact O-N 2.68Å; Q452-M455 WeakPolarHBondContact O-CB 3.22Å; Q452-M455 PolarHBondContact O-N 3.05Å; Q452-M455 VanDerWaalsContact O-N 3.12Å; Q452-E456 PolarHBondContact NE2-OE1 3.14Å; Q452-E456 WeakPolarHBondContact O-CG 3.44Å; Q452-E456 PolarHBondContact O-N 3.46Å
453	A	87.9	Confident	86.4	Confident	56 Å²	56	88.8 Å²	88.8	46%	0.463	42%	0.423	S	S	.	.	H	α-helix	trans	-60.2	-40.4	176.5	0	0	0	0	0	112.3	R449 M455 E456 A457	R449-A453 WeakPolarHBondContact O-CB 3.07Å; R449-A453 PolarHBondContact O-N 2.91Å; A453-M455 VanDerWaalsContact C-N 3.35Å; A453-E456 PolarHBondContact O-N 3.01Å; A453-A457 WeakPolarHBondContact O-CB 3.47Å; A453-A457 PolarHBondContact O-N 3.07Å
454	A	88.9	Confident	86.2	Confident	18 Å²	18	89.4 Å²	89.4	15%	0.149	43%	0.426	C	S	.	.	H	α-helix	trans	-67.6	-34.9	175.9	0	0	0	0	0	112.6	Y440 Y444 K450 A451 Q452 A458	Y440-A454 HydrophobicContact CD1-CB 3.96Å; Y440-A454 HydrophobicContact CE1-CB 3.92Å; Y444-A454 HydrophobicContact CD2-CB 4.43Å; Y444-A454 HydrophobicContact CE2-CB 3.43Å; Y444-A454 VanDerWaalsContact CE2-CB 3.43Å; Y444-A454 VanDerWaalsContact OH-CB 3.25Å; Y444-A454 WeakPolarHBondContact OH-CB 3.32Å; K450-A454 VanDerWaalsContact O-CB 3.27Å; K450-A454 WeakPolarHBondContact O-CB 3.41Å; K450-A454 PolarHBondContact O-N 3.39Å; A451-A454 PolarHBondContact O-N 2.98Å; Q452-A454 VanDerWaalsContact C-N 3.31Å; Q452-A454 PolarHBondContact O-N 2.68Å; A454-A458 WeakPolarHBondContact O-CB 3.46Å; A454-A458 PolarHBondContact O-N 2.93Å
455	M	89.1	Confident	85.9	Confident	8 Å²	8	91.3 Å²	91.3	4%	0.039	44%	0.436	C	S	.	.	H	α-helix	trans	-67.2	-47.3	173.6	-71	163.5	57	0	0	110.9	W432 Q433 V436 Y440 A451 Q452 A453 A457 A458 W459	W432-M455 HydrophobicContact CH2-CB 4.07Å; W432-M455 WeakPolarHBondContact CH2-O 3.32Å; W432-M455 HydrophobicContact CZ3-CB 3.93Å; W432-M455 WeakPolarHBondContact CZ3-O 3.47Å; Q433-M455 HydrophobicContact CB-CE 3.34Å; Q433-M455 HydrophobicContact CG-CB 4.39Å; Q433-M455 HydrophobicContact CG-CE 3.67Å; Q433-M455 WeakPolarHBondContact O-CE 3.5Å; V436-M455 HydrophobicContact CG2-CE 3.93Å; V436-M455 HydrophobicContact CG2-CG 4.24Å; V436-M455 HydrophobicContact CG2-SD 4.47Å; Y440-M455 VanDerWaalsContact CB-SD 3.59Å; Y440-M455 HydrophobicContact CD1-CG 3.42Å; Y440-M455 VanDerWaalsContact CD1-CG 3.42Å; Y440-M455 HydrophobicContact CD1-SD 4.39Å; Y440-M455 HydrophobicContact CD2-CG 3.82Å; Y440-M455 HydrophobicContact CD2-SD 4.42Å; Y440-M455 HydrophobicContact CE1-CG 3.87Å; Y440-M455 HydrophobicContact CE2-CG 4.23Å; Y440-M455 HydrophobicContact CG-CG 3.38Å; Y440-M455 HydrophobicContact CG-SD 3.91Å; A451-M455 WeakPolarHBondContact O-CB 3.23Å; A451-M455 WeakPolarHBondContact O-CG 3.25Å; A451-M455 PolarHBondContact O-N 2.77Å; Q452-M455 WeakPolarHBondContact O-CB 3.22Å; Q452-M455 PolarHBondContact O-N 3.05Å; Q452-M455 VanDerWaalsContact O-N 3.12Å; A453-M455 VanDerWaalsContact C-N 3.35Å; M455-A457 VanDerWaalsContact C-N 3.32Å; M455-A457 PolarHBondContact O-N 2.77Å; M455-A458 PolarHBondContact O-N 2.9Å; M455-W459 PolarHBondContact O-N 2.87Å
456	E	87.4	Confident	85.8	Confident	67 Å²	67	84.8 Å²	84.8	31%	0.313	42%	0.415	S	S	.	.	H	α-helix	trans	-59.4	-41.5	176.1	-71.1	175.4	-163.3	0	0	111.9	Q452 A453 W459 R460	Q452-E456 PolarHBondContact NE2-OE1 3.14Å; Q452-E456 WeakPolarHBondContact O-CG 3.44Å; Q452-E456 PolarHBondContact O-N 3.46Å; A453-E456 PolarHBondContact O-N 3.01Å; E456-W459 PolarHBondContact O-N 3.48Å; E456-R460 WeakPolarHBondContact O-CB 3.37Å; E456-R460 VanDerWaalsContact O-CG 3.3Å; E456-R460 WeakPolarHBondContact O-CG 3.48Å; E456-R460 PolarHBondContact O-N 2.93Å
457	A	90.1	Very high	86	Confident	58 Å²	58	82 Å²	82	48%	0.479	39%	0.391	S	S	.	.	H	α-helix	trans	-61.9	-46.6	175	0	0	0	0	0	112	A453 M455 W459 R460 S461	A453-A457 WeakPolarHBondContact O-CB 3.47Å; A453-A457 PolarHBondContact O-N 3.07Å; M455-A457 VanDerWaalsContact C-N 3.32Å; M455-A457 PolarHBondContact O-N 2.77Å; A457-W459 VanDerWaalsContact C-N 3.35Å; A457-W459 PolarHBondContact O-N 3.21Å; A457-R460 PolarHBondContact O-N 3.3Å; A457-S461 PolarHBondContact O-N 3.06Å; A457-S461 PolarHBondContact O-OG 2.71Å
458	A	89.6	Confident	85.5	Confident	21 Å²	21	80.2 Å²	80.2	17%	0.174	38%	0.381	C	S	.	.	H	α-helix	trans	-66.2	-34.7	177.2	0	0	0	0	0	112.7	W432 Y440 A454 M455 S461 M462	W432-A458 HydrophobicContact CH2-CB 3.87Å; W432-A458 HydrophobicContact CZ2-CB 4.24Å; Y440-A458 WeakPolarHBondContact OH-CB 3.39Å; A454-A458 WeakPolarHBondContact O-CB 3.46Å; A454-A458 PolarHBondContact O-N 2.93Å; M455-A458 PolarHBondContact O-N 2.9Å; A458-S461 WeakPolarHBondContact CA-OG 3.47Å; A458-S461 PolarHBondContact O-OG 2.85Å; A458-M462 PolarHBondContact O-N 3.37Å
459	W	85.9	Confident	85.5	Confident	15 Å²	15	74.9 Å²	74.9	6%	0.057	37%	0.371	C	S	.	.	H	α-helix	trans	-64.7	-43.7	171.4	-179.8	-106.3	0	0	0	111.4	A428 E429 W432 M455 E456 A457 S461 M462 K467 W470	A428-W459 HydrophobicContact CB-CH2 3.91Å; A428-W459 HydrophobicContact CB-CZ2 3.99Å; A428-W459 WeakPolarHBondContact O-CH2 3.31Å; E429-W459 HydrophobicContact CB-CD2 4.05Å; E429-W459 HydrophobicContact CB-CG 4.3Å; E429-W459 HydrophobicContact CB-CZ2 4.02Å; E429-W459 HydrophobicContact CG-CB 4.41Å; E429-W459 HydrophobicContact CG-CD2 4Å; E429-W459 HydrophobicContact CG-CG 3.78Å; W432-W459 HydrophobicContact CB-CE3 3.79Å; W432-W459 HydrophobicContact CB-CH2 4.48Å; W432-W459 HydrophobicContact CB-CZ3 3.48Å; W432-W459 VanDerWaalsContact CB-CZ3 3.48Å; W432-W459 AromaticContact CD2-CE3 3.63Å; W432-W459 HydrophobicContact CD2-CE3 3.63Å; W432-W459 HydrophobicContact CD2-CZ3 4.19Å; W432-W459 HydrophobicContact CE3-CB 3.92Å; W432-W459 HydrophobicContact CE3-CD2 4.22Å; W432-W459 AromaticContact CE3-CE3 3.57Å; W432-W459 HydrophobicContact CE3-CE3 3.57Å; W432-W459 HydrophobicContact CE3-CG 4.38Å; W432-W459 HydrophobicContact CE3-CZ3 4.45Å; W432-W459 AromaticContact CG-CE3 3.73Å; W432-W459 HydrophobicContact CG-CE3 3.73Å; W432-W459 AromaticContact CG-CZ3 3.78Å; W432-W459 HydrophobicContact CG-CZ3 3.78Å; W432-W459 HydrophobicContact CH2-CB 4.22Å; W432-W459 HydrophobicContact CZ3-CB 3.61Å; W432-W459 HydrophobicContact CZ3-CE3 4.4Å; M455-W459 PolarHBondContact O-N 2.87Å; E456-W459 PolarHBondContact O-N 3.48Å; A457-W459 VanDerWaalsContact C-N 3.35Å; A457-W459 PolarHBondContact O-N 3.21Å; W459-S461 VanDerWaalsContact C-N 3.34Å; W459-S461 PolarHBondContact O-N 3.2Å; W459-M462 HydrophobicContact CB-CE 4.31Å; W459-M462 HydrophobicContact CD2-CE 4.06Å; W459-M462 HydrophobicContact CE3-CE 3.22Å; W459-M462 HydrophobicContact CZ3-CE 3.83Å; W459-M462 PolarHBondContact O-N 3.06Å; W459-K467 HydrophobicContact CH2-CB 4.18Å; W459-K467 HydrophobicContact CH2-CG 4.05Å; W459-K467 HydrophobicContact CZ2-CD 4.25Å; W459-K467 HydrophobicContact CZ2-CG 4.27Å; W459-K467 HydrophobicContact CZ3-CG 4.28Å; W459-K467 WeakPolarHBondContact O-CE 3.44Å; W459-K467 PolarHBondContact O-NZ 3.4Å; W459-W470 HydrophobicContact CH2-CB 3.99Å; W459-W470 HydrophobicContact CZ3-CB 4.06Å; W459-W470 HydrophobicContact CZ3-CG 4.18Å
460	R	86.2	Confident	85.7	Confident	196 Å²	196	69.5 Å²	69.5	74%	0.74	35%	0.351	S	S	*	.	H	α-helix	trans	-62.6	-41	177.4	-73.9	176.2	-179.3	-158.8	3.3	112	E456 A457	E456-R460 WeakPolarHBondContact O-CB 3.37Å; E456-R460 VanDerWaalsContact O-CG 3.3Å; E456-R460 WeakPolarHBondContact O-CG 3.48Å; E456-R460 PolarHBondContact O-N 2.93Å; A457-R460 PolarHBondContact O-N 3.3Å
461	S	85.7	Confident	85.4	Confident	96 Å²	96	63.5 Å²	63.5	67%	0.671	33%	0.325	S	S	*	.	H	α-helix	trans	-79.5	-16.4	-179.7	66.2	0	0	0	0	114.9	A457 A458 W459	A457-S461 PolarHBondContact O-N 3.06Å; A457-S461 PolarHBondContact O-OG 2.71Å; A458-S461 WeakPolarHBondContact CA-OG 3.47Å; A458-S461 PolarHBondContact O-OG 2.85Å; W459-S461 VanDerWaalsContact C-N 3.34Å; W459-S461 PolarHBondContact O-N 3.2Å
462	M	85.6	Confident	85.1	Confident	32 Å²	32	67 Å²	67	16%	0.158	34%	0.34	C	S	.	.	S	Bend	trans	-59.5	141.2	179.3	-105	-169.3	-68	0	0	112.8	W432 A458 W459 E466 K467	W432-M462 HydrophobicContact CD2-CE 3.62Å; W432-M462 HydrophobicContact CE3-CE 4.19Å; W432-M462 HydrophobicContact CG-CE 4.01Å; W432-M462 HydrophobicContact CH2-CE 4.22Å; W432-M462 HydrophobicContact CZ2-CE 3.63Å; W432-M462 HydrophobicContact CZ3-CE 4.48Å; A458-M462 PolarHBondContact O-N 3.37Å; W459-M462 HydrophobicContact CB-CE 4.31Å; W459-M462 HydrophobicContact CD2-CE 4.06Å; W459-M462 HydrophobicContact CE3-CE 3.22Å; W459-M462 HydrophobicContact CZ3-CE 3.83Å; W459-M462 PolarHBondContact O-N 3.06Å; M462-E466 HydrophobicContact CG-CB 4.2Å; M462-E466 HydrophobicContact SD-CB 4.02Å; M462-K467 HydrophobicContact CB-CG 4.21Å; M462-K467 VanDerWaalsContact O-CE 3.25Å; M462-K467 WeakPolarHBondContact O-CE 3.47Å
463	E	84.6	Confident	84.9	Confident	101 Å²	101	68 Å²	68	47%	0.472	34%	0.343	S	S	.	.			trans	-67.3	152.1	177.7	-70.2	-171.5	-172.9	0	0	111.2	K465 E466 K467	E463-K465 HydrophobicContact CB-CG 4.15Å; E463-K465 PolarHBondContact O-N 3.32Å; E463-K465 VanDerWaalsContact O-N 3.1Å; E463-K465 IonicContact OE1-NZ 3.19Å; E463-K465 VanDerWaalsContact OE2-CD 3.23Å; E463-K465 WeakPolarHBondContact OE2-CD 3.41Å; E463-K465 WeakPolarHBondContact OE2-CE 3.36Å; E463-K465 IonicContact OE2-NZ 3.28Å; E463-K465 PolarHBondContact OE2-NZ 2.87Å; E463-E466 HydrophobicContact CB-CG 4.21Å; E463-E466 PolarHBondContact N-OE2 2.91Å; E463-E466 PolarHBondContact O-N 3.5Å; E463-K467 PolarHBondContact O-N 3.14Å
464	K	82.6	Confident	84.6	Confident	157 Å²	157	65.4 Å²	65.4	68%	0.683	32%	0.321	S	S	*	.	H	α-helix	trans	-52.6	-37.2	177.4	-70.2	175	-176.7	169.2	0	112.1	L271 E466 K467 I468	L271-K464 HydrophobicContact CD1-CB 3.95Å; L271-K464 HydrophobicContact CD1-CD 4.09Å; L271-K464 HydrophobicContact CD1-CG 4.21Å; L271-K464 HydrophobicContact CD2-CB 4.12Å; L271-K464 WeakPolarHBondContact CD2-O 3.47Å; K464-E466 VanDerWaalsContact C-N 3.34Å; K464-E466 PolarHBondContact O-N 3.48Å; K464-K467 PolarHBondContact O-N 3.01Å; K464-I468 WeakPolarHBondContact O-CG1 3.49Å
465	K	81.8	Confident	84.2	Confident	136 Å²	136	65.8 Å²	65.8	59%	0.591	32%	0.324	S	S	*	.	H	α-helix	trans	-66.3	-33.7	179.5	72.6	-166.9	-166	-141.6	0	113.1	E463	E463-K465 HydrophobicContact CB-CG 4.15Å; E463-K465 PolarHBondContact O-N 3.32Å; E463-K465 VanDerWaalsContact O-N 3.1Å; E463-K465 IonicContact OE1-NZ 3.19Å; E463-K465 VanDerWaalsContact OE2-CD 3.23Å; E463-K465 WeakPolarHBondContact OE2-CD 3.41Å; E463-K465 WeakPolarHBondContact OE2-CE 3.36Å; E463-K465 IonicContact OE2-NZ 3.28Å; E463-K465 PolarHBondContact OE2-NZ 2.87Å
466	E	84.5	Confident	83.7	Confident	92 Å²	92	71.9 Å²	71.9	43%	0.43	35%	0.353	S	S	.	.	H	α-helix	trans	-77.5	-25.1	-178.7	-59.5	176.7	131.6	0	0	112.2	M462 E463 K464 P469	M462-E466 HydrophobicContact CG-CB 4.2Å; M462-E466 HydrophobicContact SD-CB 4.02Å; E463-E466 HydrophobicContact CB-CG 4.21Å; E463-E466 PolarHBondContact N-OE2 2.91Å; E463-E466 PolarHBondContact O-N 3.5Å; K464-E466 VanDerWaalsContact C-N 3.34Å; K464-E466 PolarHBondContact O-N 3.48Å; E466-P469 WeakPolarHBondContact O-CD 3.28Å
467	K	83.9	Confident	83.2	Confident	39 Å²	39	70.8 Å²	70.8	17%	0.17	35%	0.349	C	S	.	.	H	α-helix	trans	-76.3	-23.8	175.8	-64.8	-179	179	179.8	0	113.5	W459 M462 E463 K464 W470 I471	W459-K467 HydrophobicContact CH2-CB 4.18Å; W459-K467 HydrophobicContact CH2-CG 4.05Å; W459-K467 HydrophobicContact CZ2-CD 4.25Å; W459-K467 HydrophobicContact CZ2-CG 4.27Å; W459-K467 HydrophobicContact CZ3-CG 4.28Å; W459-K467 WeakPolarHBondContact O-CE 3.44Å; W459-K467 PolarHBondContact O-NZ 3.4Å; M462-K467 HydrophobicContact CB-CG 4.21Å; M462-K467 VanDerWaalsContact O-CE 3.25Å; M462-K467 WeakPolarHBondContact O-CE 3.47Å; E463-K467 PolarHBondContact O-N 3.14Å; K464-K467 PolarHBondContact O-N 3.01Å; K467-W470 PolarHBondContact O-N 2.93Å; K467-I471 HydrophobicContact CB-CD1 3.96Å; K467-I471 VanDerWaalsContact O-CG1 3.29Å; K467-I471 WeakPolarHBondContact O-CG1 3.25Å; K467-I471 PolarHBondContact O-N 3.25Å
468	I	77.9	Confident	82.5	Confident	17 Å²	17	68.7 Å²	68.7	9%	0.087	33%	0.329	C	S	.	.	H	α-helix	trans	-59.3	-46.3	-173.4	-67.6	167.1	0	0	0	113.2	L271 F275 K464 W470 I471 K472	L271-I468 HydrophobicContact CD2-CD1 4.44Å; L271-I468 HydrophobicContact CD2-CG1 3.8Å; L271-I468 HydrophobicContact CG-CG1 4.21Å; F275-I468 HydrophobicContact CB-CD1 4.15Å; F275-I468 HydrophobicContact CB-CG2 4.27Å; F275-I468 HydrophobicContact CD1-CG2 3.89Å; F275-I468 HydrophobicContact CD2-CD1 3.48Å; F275-I468 VanDerWaalsContact CD2-CD1 3.48Å; F275-I468 HydrophobicContact CD2-CG2 4.06Å; F275-I468 HydrophobicContact CE1-CG2 4.2Å; F275-I468 HydrophobicContact CE2-CD1 4.1Å; F275-I468 HydrophobicContact CE2-CG2 4.34Å; F275-I468 HydrophobicContact CG-CD1 3.99Å; F275-I468 HydrophobicContact CG-CG2 3.79Å; F275-I468 HydrophobicContact CZ-CG2 4.4Å; K464-I468 WeakPolarHBondContact O-CG1 3.49Å; I468-W470 VanDerWaalsContact C-N 3.26Å; I468-W470 PolarHBondContact O-N 3.37Å; I468-I471 PolarHBondContact O-N 3.28Å; I468-K472 HydrophobicContact CG2-CD 4.27Å; I468-K472 HydrophobicContact CG2-CG 4.39Å; I468-K472 WeakPolarHBondContact O-CG 3.45Å; I468-K472 PolarHBondContact O-N 3.37Å
469	P	81.8	Confident	81.7	Confident	77 Å²	77	70.8 Å²	70.8	50%	0.5	33%	0.334	S	S	.	.	H	α-helix	trans	-57.5	-38.9	177	-25.7	35.6	0	0	0	113	E466 K472 K473	E466-P469 WeakPolarHBondContact O-CD 3.28Å; P469-K472 PolarHBondContact O-N 2.91Å; P469-K473 WeakPolarHBondContact O-CB 3.5Å; P469-K473 PolarHBondContact O-N 2.77Å
470	W	85.3	Confident	81.4	Confident	57 Å²	57	77.4 Å²	77.4	22%	0.216	36%	0.359	C	S	.	.	H	α-helix	trans	-74.4	-38.2	180	-52.7	109.7	0	0	0	112.3	T431 W432 S435 W459 K467 I468 K472 K473 A474	T431-W470 HydrophobicContact CG2-CE3 4.14Å; W432-W470 HydrophobicContact CB-CB 4.23Å; W432-W470 HydrophobicContact CB-CD2 3.68Å; W432-W470 HydrophobicContact CB-CE3 3.97Å; W432-W470 HydrophobicContact CB-CG 3.76Å; W432-W470 AromaticContact CD1-CD1 3.98Å; W432-W470 AromaticContact CD1-CD2 3.97Å; W432-W470 AromaticContact CD1-CE2 3.45Å; W432-W470 VanDerWaalsContact CD1-CE2 3.45Å; W432-W470 AromaticContact CD1-CZ2 3.71Å; W432-W470 AromaticContact CD1-NE1 3.45Å; W432-W470 HydrophobicContact CG-CD2 4.23Å; W432-W470 HydrophobicContact CG-CG 4.37Å; S435-W470 WeakPolarHBondContact OG-CH2 3.06Å; S435-W470 WeakPolarHBondContact OG-CZ3 3.29Å; W459-W470 HydrophobicContact CH2-CB 3.99Å; W459-W470 HydrophobicContact CZ3-CB 4.06Å; W459-W470 HydrophobicContact CZ3-CG 4.18Å; K467-W470 PolarHBondContact O-N 2.93Å; I468-W470 VanDerWaalsContact C-N 3.26Å; I468-W470 PolarHBondContact O-N 3.37Å; W470-K472 VanDerWaalsContact C-N 3.34Å; W470-K473 HydrophobicContact CE3-CD 4.44Å; W470-K473 HydrophobicContact CZ3-CD 4.46Å; W470-K473 PolarHBondContact O-N 3.03Å; W470-A474 WeakPolarHBondContact O-CB 3.42Å; W470-A474 PolarHBondContact O-N 3.11Å
471	I	81.9	Confident	80.7	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-60.8	-42.4	171.2	-71.2	165.6	0	0	0	111.1	L264 E268 L271 K272 A428 K467 I468 A475	L264-I471 HydrophobicContact CD1-CG2 4.23Å; L264-I471 HydrophobicContact CD2-CB 4.33Å; L264-I471 HydrophobicContact CD2-CG1 4.48Å; L264-I471 HydrophobicContact CD2-CG2 3.73Å; E268-I471 HydrophobicContact CB-CD1 3.92Å; E268-I471 HydrophobicContact CB-CG1 4.11Å; E268-I471 HydrophobicContact CB-CG2 4.45Å; E268-I471 HydrophobicContact CG-CD1 3.83Å; E268-I471 HydrophobicContact CG-CG1 4.07Å; L271-I471 HydrophobicContact CD2-CD1 3.79Å; K272-I471 HydrophobicContact CB-CG2 3.92Å; K272-I471 HydrophobicContact CD-CG2 4.45Å; K272-I471 HydrophobicContact CG-CG2 4.47Å; A428-I471 HydrophobicContact CB-CB 4.34Å; A428-I471 HydrophobicContact CB-CG1 3.67Å; K467-I471 HydrophobicContact CB-CD1 3.96Å; K467-I471 VanDerWaalsContact O-CG1 3.29Å; K467-I471 WeakPolarHBondContact O-CG1 3.25Å; K467-I471 PolarHBondContact O-N 3.25Å; I468-I471 PolarHBondContact O-N 3.28Å; I471-A475 WeakPolarHBondContact O-CB 3.36Å; I471-A475 PolarHBondContact O-N 2.9Å
472	K	80.4	Confident	79.9	Confident	75 Å²	75	69 Å²	69	33%	0.326	32%	0.316	S	S	.	.	H	α-helix	trans	-64.9	-45	175.1	-73.5	-172	176.3	-141.8	0	111.4	F275 D276 I468 P469 W470 A475 E476	F275-K472 VanDerWaalsContact CD1-CE 3.42Å; F275-K472 VanDerWaalsContact CD1-NZ 3.35Å; D276-K472 VanDerWaalsContact OD1-CE 3.29Å; D276-K472 WeakPolarHBondContact OD1-CE 2.91Å; D276-K472 IonicContact OD1-NZ 3.42Å; D276-K472 PolarHBondContact OD1-NZ 3.36Å; I468-K472 HydrophobicContact CG2-CD 4.27Å; I468-K472 HydrophobicContact CG2-CG 4.39Å; I468-K472 WeakPolarHBondContact O-CG 3.45Å; I468-K472 PolarHBondContact O-N 3.37Å; P469-K472 PolarHBondContact O-N 2.91Å; W470-K472 VanDerWaalsContact C-N 3.34Å; K472-A475 PolarHBondContact O-N 2.92Å; K472-E476 WeakPolarHBondContact O-CB 3.26Å; K472-E476 PolarHBondContact O-N 3.37Å
473	K	82.1	Confident	79	Confident	109 Å²	109	72.3 Å²	72.3	47%	0.474	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-39.6	179	-167.9	172.3	177.1	-177.9	0	112.8	T431 P469 W470 E476 D477	T431-K473 HydrophobicContact CG2-CB 4.12Å; T431-K473 HydrophobicContact CG2-CD 3.61Å; T431-K473 HydrophobicContact CG2-CG 3.75Å; P469-K473 WeakPolarHBondContact O-CB 3.5Å; P469-K473 PolarHBondContact O-N 2.77Å; W470-K473 HydrophobicContact CE3-CD 4.44Å; W470-K473 HydrophobicContact CZ3-CD 4.46Å; W470-K473 PolarHBondContact O-N 3.03Å; K473-E476 PolarHBondContact O-N 3.05Å; K473-D477 WeakPolarHBondContact O-CB 3.4Å; K473-D477 PolarHBondContact O-N 3.46Å
474	A	82.6	Confident	77.8	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.008	34%	0.344	C	S	.	.	H	α-helix	trans	-66.9	-38.9	173.4	0	0	0	0	0	112.4	K426 A428 W470 E476 D477 Q478	K426-A474 WeakPolarHBondContact O-CB 3.41Å; A428-A474 HydrophobicContact CB-CB 4.16Å; W470-A474 WeakPolarHBondContact O-CB 3.42Å; W470-A474 PolarHBondContact O-N 3.11Å; A474-E476 VanDerWaalsContact C-N 3.32Å; A474-E476 PolarHBondContact O-N 3.42Å; A474-D477 PolarHBondContact O-N 2.75Å; A474-Q478 WeakPolarHBondContact O-CB 3.37Å; A474-Q478 PolarHBondContact O-N 3.17Å
475	A	79	Confident	76.4	Confident	26 Å²	26	72.6 Å²	72.6	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-65.7	-35.5	174.1	0	0	0	0	0	112.5	L264 K272 I471 K472 K479	L264-A475 HydrophobicContact CD1-CB 4.18Å; K272-A475 HydrophobicContact CD-CB 4.27Å; I471-A475 WeakPolarHBondContact O-CB 3.36Å; I471-A475 PolarHBondContact O-N 2.9Å; K472-A475 PolarHBondContact O-N 2.92Å; A475-K479 WeakPolarHBondContact O-CB 3.27Å; A475-K479 PolarHBondContact O-N 3.45Å
476	E	78.9	Confident	75	Confident	137 Å²	137	70.1 Å²	70.1	64%	0.64	33%	0.329	S	S	*	.	H	α-helix	trans	-72.3	-39.3	175.3	-173.6	173.1	-159.9	0	0	112.1	K472 K473 A474 Q478 K479 R480	K472-E476 WeakPolarHBondContact O-CB 3.26Å; K472-E476 PolarHBondContact O-N 3.37Å; K473-E476 PolarHBondContact O-N 3.05Å; A474-E476 VanDerWaalsContact C-N 3.32Å; A474-E476 PolarHBondContact O-N 3.42Å; E476-Q478 VanDerWaalsContact C-N 3.35Å; E476-K479 CarbonylContact O-C 3.33Å; E476-K479 WeakPolarHBondContact O-CA 3.29Å; E476-K479 WeakPolarHBondContact O-CB 3.29Å; E476-K479 PolarHBondContact O-N 3.47Å; E476-K479 VanDerWaalsContact O-N 3.14Å; E476-R480 WeakPolarHBondContact O-CB 3.49Å; E476-R480 PolarHBondContact O-N 2.92Å
477	D	77.3	Confident	73.3	Confident	44 Å²	44	70.2 Å²	70.2	24%	0.235	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-39.2	174.6	-166.2	55.1	0	0	0	111.6	K426 K473 A474 K479 R480 Y481	K426-D477 PolarHBondContact N-OD2 2.8Å; K473-D477 WeakPolarHBondContact O-CB 3.4Å; K473-D477 PolarHBondContact O-N 3.46Å; A474-D477 PolarHBondContact O-N 2.75Å; D477-K479 PolarHBondContact O-N 3.35Å; D477-R480 WeakPolarHBondContact O-CB 3.46Å; D477-R480 PolarHBondContact O-N 3.48Å; D477-Y481 WeakPolarHBondContact O-CB 3.16Å; D477-Y481 PolarHBondContact O-N 3.25Å
478	Q	75.9	Confident	71.6	Confident	14 Å²	14	73.6 Å²	73.6	7%	0.065	36%	0.357	C	S	.	.	H	α-helix	trans	-57.3	-46.3	167.9	179	66.6	23.8	0	0	111.6	P425 A474 E476 Y481 E482	P425-Q478 HydrophobicContact CB-CB 4.38Å; A474-Q478 WeakPolarHBondContact O-CB 3.37Å; A474-Q478 PolarHBondContact O-N 3.17Å; E476-Q478 VanDerWaalsContact C-N 3.35Å; Q478-Y481 PolarHBondContact O-N 3.45Å; Q478-E482 WeakPolarHBondContact CG-OE1 3.39Å; Q478-E482 PolarHBondContact NE2-OE1 3.36Å; Q478-E482 WeakPolarHBondContact O-CB 3.32Å; Q478-E482 WeakPolarHBondContact O-CG 3.41Å; Q478-E482 PolarHBondContact O-N 3.34Å
479	K	72.6	Confident	70	Confident	64 Å²	64	82.2 Å²	82.2	28%	0.278	39%	0.389	S	S	.	.	H	α-helix	trans	-63	-41.8	176.2	-172.5	-179.4	-177.9	178.2	0	111.4	E351 A475 E476 D477 Y481 E482 V483	E351-K479 IonicContact OE1-NZ 2.78Å; E351-K479 PolarHBondContact OE1-NZ 3.13Å; E351-K479 VanDerWaalsContact OE1-NZ 3.07Å; A475-K479 WeakPolarHBondContact O-CB 3.27Å; A475-K479 PolarHBondContact O-N 3.45Å; E476-K479 CarbonylContact O-C 3.33Å; E476-K479 WeakPolarHBondContact O-CA 3.29Å; E476-K479 WeakPolarHBondContact O-CB 3.29Å; E476-K479 PolarHBondContact O-N 3.47Å; E476-K479 VanDerWaalsContact O-N 3.14Å; D477-K479 PolarHBondContact O-N 3.35Å; K479-Y481 VanDerWaalsContact C-N 3.34Å; K479-Y481 PolarHBondContact O-N 3.41Å; K479-E482 PolarHBondContact O-N 3.43Å; K479-V483 HydrophobicContact CG-CG2 4.42Å; K479-V483 WeakPolarHBondContact O-CB 3.42Å; K479-V483 WeakPolarHBondContact O-CG2 3.42Å; K479-V483 PolarHBondContact O-N 2.79Å
480	R	78.7	Confident	67.9	Low	155 Å²	155	86 Å²	86	59%	0.585	40%	0.4	S	S	*	.	H	α-helix	trans	-60.9	-43.7	176	179.9	-172	178.3	-168.5	1	111	E476 D477 R484	E476-R480 WeakPolarHBondContact O-CB 3.49Å; E476-R480 PolarHBondContact O-N 2.92Å; D477-R480 WeakPolarHBondContact O-CB 3.46Å; D477-R480 PolarHBondContact O-N 3.48Å; R480-R484 WeakPolarHBondContact O-CB 3.48Å; R480-R484 PolarHBondContact O-N 3.39Å
481	Y	70.7	Confident	65.8	Low	53 Å²	53	88.1 Å²	88.1	21%	0.208	41%	0.414	C	S	.	.	H	α-helix	trans	-64.3	-48.7	177.2	-171.7	-90.5	0	0	0	111.1	V260 P422 E423 P425 D477 Q478 K479 V483 R484 Y485	V260-Y481 HydrophobicContact CG2-CD1 4.31Å; V260-Y481 HydrophobicContact CG2-CE1 3.89Å; P422-Y481 HydrophobicContact CB-CE2 4.27Å; E423-Y481 VanDerWaalsContact O-CD2 3.23Å; E423-Y481 WeakPolarHBondContact O-CD2 3.47Å; E423-Y481 WeakPolarHBondContact O-CE2 3.4Å; P425-Y481 HydrophobicContact CB-CG 4.5Å; P425-Y481 HydrophobicContact CG-CD1 4.25Å; P425-Y481 HydrophobicContact CG-CG 4.14Å; D477-Y481 WeakPolarHBondContact O-CB 3.16Å; D477-Y481 PolarHBondContact O-N 3.25Å; Q478-Y481 PolarHBondContact O-N 3.45Å; K479-Y481 VanDerWaalsContact C-N 3.34Å; K479-Y481 PolarHBondContact O-N 3.41Å; Y481-V483 VanDerWaalsContact C-N 3.33Å; Y481-V483 PolarHBondContact O-N 2.88Å; Y481-R484 PolarHBondContact O-N 3.34Å; Y481-Y485 PolarHBondContact O-N 3Å
482	E	68.9	Low	64	Low	62 Å²	62	91.4 Å²	91.4	29%	0.29	43%	0.432	S	S	.	.	H	α-helix	trans	-61.3	-34.6	176.9	-74	172.1	-170	0	0	113.8	R354 Q478 K479 Y485 P486	R354-E482 IonicContact CZ-OE2 2.83Å; R354-E482 IonicContact NH1-OE2 3.87Å; R354-E482 PolarHBondContact NH1-OE2 2.83Å; R354-E482 IonicContact NH2-OE2 2.8Å; Q478-E482 WeakPolarHBondContact CG-OE1 3.39Å; Q478-E482 PolarHBondContact NE2-OE1 3.36Å; Q478-E482 WeakPolarHBondContact O-CB 3.32Å; Q478-E482 WeakPolarHBondContact O-CG 3.41Å; Q478-E482 PolarHBondContact O-N 3.34Å; K479-E482 PolarHBondContact O-N 3.43Å; E482-Y485 CarbonylContact O-C 3.37Å; E482-P486 VanDerWaalsContact O-CA 3.24Å; E482-P486 WeakPolarHBondContact O-CA 3.49Å
483	V	68.6	Low	62.3	Low	101 Å²	101	95.1 Å²	95.1	61%	0.612	45%	0.45	S	S	*	.	H	α-helix	trans	-78.2	-37.4	177.9	169.7	0	0	0	0	111.5	K479 Y481	K479-V483 HydrophobicContact CG-CG2 4.42Å; K479-V483 WeakPolarHBondContact O-CB 3.42Å; K479-V483 WeakPolarHBondContact O-CG2 3.42Å; K479-V483 PolarHBondContact O-N 2.79Å; Y481-V483 VanDerWaalsContact C-N 3.33Å; Y481-V483 PolarHBondContact O-N 2.88Å
484	R	58	Low	60.3	Low	161 Å²	161	97.5 Å²	97.5	61%	0.608	47%	0.465	S	S	*	.	H	α-helix	trans	-77.7	-28.8	-179.2	-167.4	176.9	-173.5	-160.2	0.7	112.6	R480 Y481	R480-R484 WeakPolarHBondContact O-CB 3.48Å; R480-R484 PolarHBondContact O-N 3.39Å; Y481-R484 PolarHBondContact O-N 3.34Å
485	Y	54.3	Low	58.2	Low	104 Å²	104	105 Å²	105	41%	0.408	49%	0.493	S	S	.	.	S	Bend	trans	-131.8	76.6	175	-66	-85.5	0	0	0	107.5	P422 Y481 E482 P487	P422-Y485 HydrophobicContact CB-CD2 4.18Å; P422-Y485 HydrophobicContact CB-CE1 4.42Å; P422-Y485 HydrophobicContact CB-CE2 3.51Å; P422-Y485 HydrophobicContact CG-CD1 4.48Å; P422-Y485 HydrophobicContact CG-CD2 4.47Å; P422-Y485 HydrophobicContact CG-CE1 3.72Å; P422-Y485 HydrophobicContact CG-CE2 3.73Å; P422-Y485 VanDerWaalsContact CG-OH 3.32Å; P422-Y485 WeakPolarHBondContact CG-OH 3.35Å; Y481-Y485 PolarHBondContact O-N 3Å; E482-Y485 CarbonylContact O-C 3.37Å; Y485-P487 WeakPolarHBondContact O-CD 3.42Å; Y485-P487 VanDerWaalsContact O-N 3.1Å
486	P	50.9	Low	55.8	Low	84 Å²	84	106.8 Å²	106.8	55%	0.545	51%	0.508	S	S	.	.			trans	-56.1	122.3	170.4	23.8	-30.3	0	0	0	106.3	E482 D488	E482-P486 VanDerWaalsContact O-CA 3.24Å; E482-P486 WeakPolarHBondContact O-CA 3.49Å; P486-D488 PolarHBondContact O-N 3.25Å
487	P	50.2	Low	53.5	Low	94 Å²	94	104 Å²	104	61%	0.61	51%	0.509	S	S	*	.			trans	-54.7	124.8	172.1	21.9	-29.6	0	0	0	105.4	Y485 R489	Y485-P487 WeakPolarHBondContact O-CD 3.42Å; Y485-P487 VanDerWaalsContact O-N 3.1Å; P487-R489 WeakPolarHBondContact O-CA 3.41Å; P487-R489 PolarHBondContact O-N 3.23Å
488	D	46.4	Very low	51.4	Low	109 Å²	109	106.5 Å²	106.5	58%	0.583	53%	0.527	S	S	*	.			trans	-49.8	93.4	-173.1	-81.7	-35.7	0	0	0	109.2	P486 E490 L491 L492	P486-D488 PolarHBondContact O-N 3.25Å; D488-E490 PolarHBondContact O-N 3.25Å; D488-L491 HydrophobicContact CB-CB 3.73Å; D488-L491 HydrophobicContact CB-CD1 4.25Å; D488-L491 PolarHBondContact O-N 3.24Å; D488-L491 VanDerWaalsContact O-N 3.11Å; D488-L492 WeakPolarHBondContact O-CB 3.32Å; D488-L492 PolarHBondContact O-N 2.92Å
489	R	45.6	Very low	49.6	Very low	199 Å²	199	113.1 Å²	113.1	75%	0.751	57%	0.569	S	S	*	*	H	α-helix	trans	-66.9	-26	-174.6	-168.3	179	178.8	176.6	1.2	108.8	P487 E493	P487-R489 WeakPolarHBondContact O-CA 3.41Å; P487-R489 PolarHBondContact O-N 3.23Å; R489-E493 VanDerWaalsContact O-CB 3.25Å; R489-E493 WeakPolarHBondContact O-CB 3.24Å; R489-E493 WeakPolarHBondContact O-CG 3.45Å; R489-E493 PolarHBondContact O-N 3.4Å
490	E	38.3	Very low	48	Very low	157 Å²	157	112.6 Å²	112.6	73%	0.734	58%	0.581	S	S	*	*	H	α-helix	trans	-72.1	-42.1	174.6	-152.8	167.1	-163.9	0	0	112.1	D488 M494	D488-E490 PolarHBondContact O-N 3.25Å; E490-M494 WeakPolarHBondContact O-CB 3.28Å; E490-M494 VanDerWaalsContact O-CG 3.24Å; E490-M494 WeakPolarHBondContact O-CG 3.39Å; E490-M494 PolarHBondContact O-N 2.94Å; E490-M494 VanDerWaalsContact O-N 3.1Å
491	L	41.3	Very low	45.8	Very low	100 Å²	100	112.8 Å²	112.8	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-74.8	-32.8	173.5	-99.2	156.2	0	0	0	112.7	D488 M494 R495	D488-L491 HydrophobicContact CB-CB 3.73Å; D488-L491 HydrophobicContact CB-CD1 4.25Å; D488-L491 PolarHBondContact O-N 3.24Å; D488-L491 VanDerWaalsContact O-N 3.11Å; L491-M494 CarbonylContact O-C 3.55Å; L491-M494 PolarHBondContact O-N 3.04Å; L491-R495 WeakPolarHBondContact O-CB 3.25Å; L491-R495 PolarHBondContact O-N 2.93Å
492	L	43.6	Very low	44.5	Very low	71 Å²	71	121.3 Å²	121.3	37%	0.372	62%	0.621	S	S	.	*	H	α-helix	trans	-74.2	-31.3	175.2	-158.4	71.6	0	0	0	112	E257 D488 M494 A496	E257-L492 HydrophobicContact CG-CD1 4.29Å; E257-L492 VanDerWaalsContact OE1-CD1 3.31Å; E257-L492 WeakPolarHBondContact OE1-CD1 3.25Å; D488-L492 WeakPolarHBondContact O-CB 3.32Å; D488-L492 PolarHBondContact O-N 2.92Å; L492-M494 VanDerWaalsContact C-N 3.28Å; L492-A496 VanDerWaalsContact O-CB 3.22Å; L492-A496 WeakPolarHBondContact O-CB 3.45Å; L492-A496 PolarHBondContact O-N 3.26Å
493	E	44	Very low	43.3	Very low	152 Å²	152	124.8 Å²	124.8	71%	0.71	64%	0.635	S	S	*	*	H	α-helix	trans	-68.9	-27.2	166.9	-86.5	-178.1	161.7	0	0	112.3	R489	R489-E493 VanDerWaalsContact O-CB 3.25Å; R489-E493 WeakPolarHBondContact O-CB 3.24Å; R489-E493 WeakPolarHBondContact O-CG 3.45Å; R489-E493 PolarHBondContact O-N 3.4Å
494	M	40.5	Very low	42.5	Very low	160 Å²	160	122.6 Å²	122.6	79%	0.788	62%	0.623	S	S	*	*	H	α-helix	trans	-88.2	-21.1	175.6	-71.4	-170.8	70.8	0	0	114.6	E490 L491 L492	E490-M494 WeakPolarHBondContact O-CB 3.28Å; E490-M494 VanDerWaalsContact O-CG 3.24Å; E490-M494 WeakPolarHBondContact O-CG 3.39Å; E490-M494 PolarHBondContact O-N 2.94Å; E490-M494 VanDerWaalsContact O-N 3.1Å; L491-M494 CarbonylContact O-C 3.55Å; L491-M494 PolarHBondContact O-N 3.04Å; L492-M494 VanDerWaalsContact C-N 3.28Å
495	R	37.8	Very low	42	Very low	157 Å²	157	124 Å²	124	59%	0.592	63%	0.633	S	S	*	*	H	α-helix	trans	-113.3	-7	-176	-168.8	165.7	172.2	128.6	-4.5	114.6	E257 L491 A497	E257-R495 IonicContact OE2-NE 2.59Å; L491-R495 WeakPolarHBondContact O-CB 3.25Å; L491-R495 PolarHBondContact O-N 2.93Å; R495-A497 VanDerWaalsContact C-N 3.27Å; R495-A497 PolarHBondContact O-N 3.21Å
496	A	29.1	Very low	42.3	Very low	65 Å²	65	120.5 Å²	120.5	54%	0.537	62%	0.62	S	S	.	*	S	Bend	trans	-64.7	92.8	155.5	0	0	0	0	0	108.5	L492	L492-A496 VanDerWaalsContact O-CB 3.22Å; L492-A496 WeakPolarHBondContact O-CB 3.45Å; L492-A496 PolarHBondContact O-N 3.26Å
497	A	30.4	Very low	42.4	Very low	79 Å²	79	124 Å²	124	65%	0.653	63%	0.634	S	S	*	*			trans	-47.5	132.7	164.7	0	0	0	0	0	108.2	R495 V499	R495-A497 VanDerWaalsContact C-N 3.27Å; R495-A497 PolarHBondContact O-N 3.21Å; A497-V499 PolarHBondContact O-N 3.45Å
498	P	33.9	Very low	43.1	Very low	96 Å²	96	122.4 Å²	122.4	62%	0.623	64%	0.635	S	S	*	*			trans	-64.3	105	-172.4	26	-32.9	0	0	0	108.4	G500	P498-G500 CarbonylContact O-C 3.48Å; P498-G500 PolarHBondContact O-N 3.38Å
499	V	37.1	Very low	44.5	Very low	153 Å²	153	120.6 Å²	120.6	93%	0.927	62%	0.623	S	S	*	*	S	Bend	trans	-61.6	95.4	163.3	176.3	0	0	0	0	106.1	A497	A497-V499 PolarHBondContact O-N 3.45Å
500	G	39	Very low	45.9	Very low	53 Å²	53	112.5 Å²	112.5	55%	0.546	60%	0.596	S	S	.	*	S	Bend	trans	71.6	119.8	-166.2	0	0	0	0	0	111	P498 R502	P498-G500 CarbonylContact O-C 3.48Å; P498-G500 PolarHBondContact O-N 3.38Å; G500-R502 VanDerWaalsContact C-N 3.3Å; G500-R502 PolarHBondContact O-N 2.85Å
501	Q	33.6	Very low	47.5	Very low	159 Å²	159	114.4 Å²	114.4	74%	0.743	60%	0.602	S	S	*	*			trans	-50.4	100.2	162.7	-70.3	-165.6	-40	0	0	108.7	K503	Q501-K503 PolarHBondContact O-N 3.12Å
502	R	41.8	Very low	49.1	Very low	232 Å²	232	117 Å²	117	88%	0.875	61%	0.609	S	S	*	*			trans	-60.2	113.5	155.3	-75.3	-170.3	173.2	-174.8	1.3	103.6	G500	G500-R502 VanDerWaalsContact C-N 3.3Å; G500-R502 PolarHBondContact O-N 2.85Å
503	K	45.3	Very low	50.7	Low	135 Å²	135	114.5 Å²	114.5	59%	0.587	60%	0.597	S	S	*	*			trans	-39.9	137.1	173.6	-58.8	171.7	-174.5	170.4	0	108.1	Q501 K505 F591	Q501-K503 PolarHBondContact O-N 3.12Å; K503-K505 PolarHBondContact O-N 3.47Å; K503-F591 HydrophobicContact CB-CZ 4.46Å
504	P	50.6	Low	52.4	Low	55 Å²	55	108.2 Å²	108.2	36%	0.357	57%	0.569	S	S	.	*			trans	-48.4	113.6	163.3	-21	31.3	0	0	0	106.5	F506 F591	P504-F506 VanDerWaalsContact C-N 3.26Å; P504-F506 HydrophobicContact CB-CD2 4.24Å; P504-F506 HydrophobicContact CB-CE2 3.76Å; P504-F506 HydrophobicContact CB-CZ 3.97Å; P504-F506 HydrophobicContact CG-CE2 4.34Å; P504-F506 VanDerWaalsContact O-CD2 3.28Å; P504-F506 WeakPolarHBondContact O-CD2 3.25Å; P504-F506 PolarHBondContact O-N 2.95Å; P504-F591 VanDerWaalsContact CD-CE2 3.47Å; P504-F591 HydrophobicContact CG-CD2 4.1Å; P504-F591 HydrophobicContact CG-CE2 4.02Å; P504-F591 HydrophobicContact CG-CG 4.46Å; P504-F591 HydrophobicContact CG-CZ 4.31Å
505	K	47.5	Very low	54	Low	189 Å²	189	105.8 Å²	105.8	82%	0.822	56%	0.563	S	S	*	*			trans	-76.5	93.9	174.7	-84.2	-179.7	178.2	178.3	0	104.4	K503 D507	K503-K505 PolarHBondContact O-N 3.47Å; K505-D507 PolarHBondContact O-N 3.03Å
506	F	62.2	Low	56.4	Low	31 Å²	31	100.8 Å²	100.8	14%	0.136	55%	0.552	C	S	.	*			trans	-71.5	113.1	167.4	-57.9	-90	0	0	0	106.9	P504 G508 E509 W576 L580 Y588 F591	P504-F506 VanDerWaalsContact C-N 3.26Å; P504-F506 HydrophobicContact CB-CD2 4.24Å; P504-F506 HydrophobicContact CB-CE2 3.76Å; P504-F506 HydrophobicContact CB-CZ 3.97Å; P504-F506 HydrophobicContact CG-CE2 4.34Å; P504-F506 VanDerWaalsContact O-CD2 3.28Å; P504-F506 WeakPolarHBondContact O-CD2 3.25Å; P504-F506 PolarHBondContact O-N 2.95Å; F506-G508 PolarHBondContact O-N 2.67Å; F506-E509 HydrophobicContact CB-CB 4.49Å; F506-E509 WeakPolarHBondContact O-CB 3.24Å; F506-E509 PolarHBondContact O-N 2.79Å; F506-W576 HydrophobicContact CB-CH2 3.25Å; F506-W576 HydrophobicContact CB-CZ2 3.32Å; F506-W576 HydrophobicContact CD1-CH2 4.17Å; F506-W576 HydrophobicContact CD2-CH2 4.3Å; F506-W576 AromaticContact CG-CH2 3.7Å; F506-W576 HydrophobicContact CG-CH2 3.7Å; F506-W576 HydrophobicContact CG-CZ2 4.23Å; F506-L580 HydrophobicContact CD1-CD2 4.42Å; F506-Y588 HydrophobicContact CD1-CD2 4.21Å; F506-Y588 AromaticContact CD2-CD2 3.76Å; F506-Y588 HydrophobicContact CD2-CD2 3.76Å; F506-Y588 HydrophobicContact CD2-CE2 4.04Å; F506-Y588 AromaticContact CE1-CD2 3.96Å; F506-Y588 HydrophobicContact CE1-CD2 3.96Å; F506-Y588 AromaticContact CE2-CD2 3.49Å; F506-Y588 HydrophobicContact CE2-CD2 3.49Å; F506-Y588 VanDerWaalsContact CE2-CD2 3.49Å; F506-Y588 HydrophobicContact CE2-CE2 4.03Å; F506-Y588 HydrophobicContact CG-CD2 4.13Å; F506-Y588 AromaticContact CZ-CD2 3.61Å; F506-Y588 HydrophobicContact CZ-CD2 3.61Å; F506-Y588 HydrophobicContact CZ-CG 4.31Å; F506-F591 HydrophobicContact CE2-CD1 4.4Å
507	D	52.4	Low	58.9	Low	157 Å²	157	98.1 Å²	98.1	84%	0.84	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	134.1	179.5	-95.7	-43.9	0	0	0	110.5	K505 W576	K505-D507 PolarHBondContact O-N 3.03Å; D507-W576 PolarHBondContact O-NE1 3.42Å
508	G	64	Low	61.5	Low	61 Å²	61	98 Å²	98	63%	0.629	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	4.9	-176.5	0	0	0	0	0	116.1	F506 P510 W576	F506-G508 PolarHBondContact O-N 2.67Å; G508-P510 WeakPolarHBondContact O-CD 3.16Å; G508-W576 PolarHBondContact O-NE1 2.84Å
509	E	76.4	Confident	63.9	Low	72 Å²	72	97.3 Å²	97.3	34%	0.336	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-55.8	123.2	173.4	-172.4	-179.1	-169.1	0	0	109.6	F506 K511 L573 W576	F506-E509 HydrophobicContact CB-CB 4.49Å; F506-E509 WeakPolarHBondContact O-CB 3.24Å; F506-E509 PolarHBondContact O-N 2.79Å; E509-K511 PolarHBondContact O-N 3.35Å; E509-L573 HydrophobicContact CG-CD1 4.3Å; E509-W576 HydrophobicContact CB-CH2 4.01Å; E509-W576 HydrophobicContact CB-CZ2 3.9Å; E509-W576 HydrophobicContact CB-CZ3 4.49Å; E509-W576 HydrophobicContact CG-CH2 4.18Å; E509-W576 HydrophobicContact CG-CZ3 4.24Å
510	P	74.7	Confident	66.3	Low	28 Å²	28	90.9 Å²	90.9	18%	0.182	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-53.6	140.8	176.7	-28	36.2	0	0	0	111.2	G508 Y569 H572 W576	G508-P510 WeakPolarHBondContact O-CD 3.16Å; P510-Y569 HydrophobicContact CB-CD2 3.95Å; P510-Y569 HydrophobicContact CB-CE2 3.63Å; P510-Y569 VanDerWaalsContact O-CE2 3.22Å; P510-Y569 WeakPolarHBondContact O-CE2 3.43Å; P510-Y569 PolarHBondContact O-OH 3.5Å; P510-H572 HydrophobicContact CB-CB 4.34Å; P510-H572 HydrophobicContact CG-CB 4.06Å; P510-W576 HydrophobicContact CG-CB 4.24Å
511	K	72.1	Confident	68.6	Low	197 Å²	197	89 Å²	89	86%	0.857	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-77.6	136.6	175.6	-70.9	-178	-179.6	175.3	0	110.5	E509 Y569	E509-K511 PolarHBondContact O-N 3.35Å; K511-Y569 WeakPolarHBondContact O-CD2 3.41Å; K511-Y569 WeakPolarHBondContact O-CE2 3.26Å
512	K	74.9	Confident	71	Confident	156 Å²	156	82.2 Å²	82.2	68%	0.678	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-64.3	130	179.4	-67.6	-176	179.9	-158.1	0	110.8	Y569	K512-Y569 HydrophobicContact CG-CE1 3.94Å; K512-Y569 HydrophobicContact CG-CE2 4.2Å; K512-Y569 VanDerWaalsContact CG-OH 3.25Å; K512-Y569 WeakPolarHBondContact CG-OH 3.25Å
513	P	77.3	Confident	73	Confident	18 Å²	18	75.9 Å²	75.9	12%	0.117	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-68.4	160.8	172.6	30.8	-36.3	0	0	0	110.1	Q565 Q566 Y569	P513-Q565 HydrophobicContact CB-CB 3.78Å; P513-Q565 HydrophobicContact CG-CB 4.37Å; P513-Q566 HydrophobicContact CG-CG 3.89Å; P513-Y569 HydrophobicContact CG-CG 4.06Å
514	P	79.7	Confident	75	Confident	20 Å²	20	73 Å²	73	13%	0.13	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-55.4	147	175.9	-27.5	38.5	0	0	0	112.4	Q519 M520 V562	P514-Q519 HydrophobicContact CB-CB 3.75Å; P514-M520 HydrophobicContact CB-CG 3.95Å; P514-M520 HydrophobicContact CB-SD 3.94Å; P514-M520 HydrophobicContact CG-CG 4.11Å; P514-M520 HydrophobicContact CG-SD 3.43Å; P514-M520 WeakPolarHBondContact CG-SD 3.39Å; P514-V562 VanDerWaalsContact O-CG1 3.32Å; P514-V562 WeakPolarHBondContact O-CG1 3.35Å
515	V	74.1	Confident	76.4	Confident	108 Å²	108	71.2 Å²	71.2	66%	0.655	37%	0.366	S	S	*	.	S	Bend	trans	-97	-2.1	-172.5	-65.7	0	0	0	0	113.3
516	S	87.4	Confident	78	Confident	52 Å²	52	64.2 Å²	64.2	36%	0.364	34%	0.337	S	S	.	.	S	Bend	trans	-145.3	144.3	-177.9	173.5	0	0	0	0	111.2	Y518 Q519 M520	S516-Y518 PolarHBondContact O-N 3.45Å; S516-Y518 PolarHBondContact OG-N 2.9Å; S516-Q519 WeakPolarHBondContact O-CA 3.47Å; S516-Q519 WeakPolarHBondContact O-CB 3.32Å; S516-Q519 PolarHBondContact O-N 3.19Å; S516-M520 PolarHBondContact O-N 3.05Å; S516-M520 VanDerWaalsContact O-N 3.14Å
517	G	82.9	Confident	79	Confident	9 Å²	9	67.7 Å²	67.7	9%	0.093	36%	0.362	C	S	.	.	H	α-helix	trans	-57	-31.4	176.2	0	0	0	0	0	112.6	M520 F521	G517-M520 PolarHBondContact O-N 3.31Å; G517-F521 WeakPolarHBondContact O-CB 3.47Å; G517-F521 PolarHBondContact O-N 3.45Å
518	Y	85.4	Confident	80.2	Confident	76 Å²	76	64.4 Å²	64.4	30%	0.298	34%	0.344	S	S	.	.	H	α-helix	trans	-64.8	-39.7	173.1	174.9	-114.8	0	0	0	112.4	S516 F521 S522 I543 W547	S516-Y518 PolarHBondContact O-N 3.45Å; S516-Y518 PolarHBondContact OG-N 2.9Å; Y518-F521 PolarHBondContact O-N 3.22Å; Y518-S522 WeakPolarHBondContact O-CB 3.21Å; Y518-S522 PolarHBondContact O-N 2.96Å; Y518-S522 PolarHBondContact O-OG 2.94Å; Y518-I543 HydrophobicContact CE2-CG2 4.19Å; Y518-W547 HydrophobicContact CD2-CB 3.75Å; Y518-W547 AromaticContact CD2-CD1 3.54Å; Y518-W547 AromaticContact CD2-CD2 3.56Å; Y518-W547 HydrophobicContact CD2-CD2 3.56Å; Y518-W547 AromaticContact CD2-CE2 3.89Å; Y518-W547 HydrophobicContact CD2-CE3 4.17Å; Y518-W547 AromaticContact CD2-CG 3.33Å; Y518-W547 HydrophobicContact CD2-CG 3.33Å; Y518-W547 AromaticContact CD2-NE1 3.86Å; Y518-W547 HydrophobicContact CE2-CB 3.73Å; Y518-W547 HydrophobicContact CE2-CD2 4.45Å; Y518-W547 AromaticContact CE2-CG 3.82Å; Y518-W547 HydrophobicContact CE2-CG 3.82Å; Y518-W547 HydrophobicContact CG-CD2 4.36Å; Y518-W547 HydrophobicContact CG-CG 4.4Å
519	Q	84.1	Confident	80.4	Confident	83 Å²	83	62.7 Å²	62.7	39%	0.388	33%	0.326	S	S	.	.	H	α-helix	trans	-68.3	-40.6	179.1	-70.6	178.3	-21.6	0	0	111.2	P514 S516 S522 Q523	P514-Q519 HydrophobicContact CB-CB 3.75Å; S516-Q519 WeakPolarHBondContact O-CA 3.47Å; S516-Q519 WeakPolarHBondContact O-CB 3.32Å; S516-Q519 PolarHBondContact O-N 3.19Å; Q519-S522 WeakPolarHBondContact CA-OG 3.38Å; Q519-S522 PolarHBondContact O-N 3.41Å; Q519-S522 PolarHBondContact O-OG 3.24Å; Q519-Q523 VanDerWaalsContact O-CB 3.31Å; Q519-Q523 WeakPolarHBondContact O-CB 3.38Å; Q519-Q523 PolarHBondContact O-N 3.08Å
520	M	86.8	Confident	80.3	Confident	18 Å²	18	64.7 Å²	64.7	9%	0.089	34%	0.336	C	S	.	.	H	α-helix	trans	-57.6	-50.6	172	-84.3	-58.2	-57.9	0	0	111.8	P514 S516 G517 S522 Q523 E524 V562	P514-M520 HydrophobicContact CB-CG 3.95Å; P514-M520 HydrophobicContact CB-SD 3.94Å; P514-M520 HydrophobicContact CG-CG 4.11Å; P514-M520 HydrophobicContact CG-SD 3.43Å; P514-M520 WeakPolarHBondContact CG-SD 3.39Å; S516-M520 PolarHBondContact O-N 3.05Å; S516-M520 VanDerWaalsContact O-N 3.14Å; G517-M520 PolarHBondContact O-N 3.31Å; M520-S522 VanDerWaalsContact C-N 3.33Å; M520-S522 PolarHBondContact O-N 3.47Å; M520-Q523 PolarHBondContact O-N 2.88Å; M520-E524 PolarHBondContact O-N 3.19Å; M520-V562 HydrophobicContact CB-CG2 4.03Å; M520-V562 HydrophobicContact CG-CB 4.46Å; M520-V562 HydrophobicContact CG-CG2 3.19Å
521	F	87.6	Confident	80	Confident	12 Å²	12	63.5 Å²	63.5	5%	0.053	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-42.5	178.1	175	-107.7	0	0	0	112.6	G517 Y518 Q523 E524 L525 I543 R546 W547 L550 Y558	G517-F521 WeakPolarHBondContact O-CB 3.47Å; G517-F521 PolarHBondContact O-N 3.45Å; Y518-F521 PolarHBondContact O-N 3.22Å; F521-Q523 VanDerWaalsContact C-N 3.34Å; F521-Q523 PolarHBondContact O-N 3.26Å; F521-E524 PolarHBondContact O-N 2.92Å; F521-L525 HydrophobicContact CD1-CD1 4.11Å; F521-L525 HydrophobicContact CD2-CD1 4.35Å; F521-L525 HydrophobicContact CE1-CD1 3.45Å; F521-L525 VanDerWaalsContact CE1-CD1 3.45Å; F521-L525 HydrophobicContact CE2-CD1 3.72Å; F521-L525 HydrophobicContact CE2-CG 4.18Å; F521-L525 HydrophobicContact CZ-CD1 3.26Å; F521-L525 HydrophobicContact CZ-CG 4.21Å; F521-L525 PolarHBondContact O-N 2.92Å; F521-I543 HydrophobicContact CD1-CG2 4.2Å; F521-I543 HydrophobicContact CE1-CG2 4.25Å; F521-R546 HydrophobicContact CE1-CB 4.21Å; F521-R546 HydrophobicContact CZ-CB 3.99Å; F521-W547 HydrophobicContact CB-CE3 3.62Å; F521-W547 HydrophobicContact CB-CZ3 3.55Å; F521-W547 HydrophobicContact CD1-CB 3.93Å; F521-W547 HydrophobicContact CD1-CD2 4.19Å; F521-W547 AromaticContact CD1-CE3 3.41Å; F521-W547 HydrophobicContact CD1-CE3 3.41Å; F521-W547 VanDerWaalsContact CD1-CE3 3.41Å; F521-W547 HydrophobicContact CD1-CG 4.44Å; F521-W547 HydrophobicContact CD1-CZ3 4.25Å; F521-W547 HydrophobicContact CD2-CE3 4.36Å; F521-W547 HydrophobicContact CE1-CB 3.75Å; F521-W547 HydrophobicContact CE1-CE3 4.09Å; F521-W547 AromaticContact CG-CE3 3.53Å; F521-W547 HydrophobicContact CG-CE3 3.53Å; F521-W547 AromaticContact CG-CZ3 3.91Å; F521-W547 HydrophobicContact CG-CZ3 3.91Å; F521-L550 HydrophobicContact CD1-CD1 4.49Å; F521-L550 HydrophobicContact CD2-CD1 3.9Å; F521-L550 HydrophobicContact CE1-CD1 4.22Å; F521-L550 HydrophobicContact CE2-CD1 3.62Å; F521-L550 HydrophobicContact CE2-CG 4.44Å; F521-L550 HydrophobicContact CG-CD1 4.29Å; F521-L550 HydrophobicContact CZ-CD1 3.75Å; F521-L550 HydrophobicContact CZ-CG 4.33Å; F521-Y558 HydrophobicContact CB-CD1 4.33Å; F521-Y558 HydrophobicContact CB-CD2 4.3Å; F521-Y558 HydrophobicContact CB-CE1 4.41Å; F521-Y558 HydrophobicContact CB-CE2 4.37Å; F521-Y558 HydrophobicContact CB-CG 4.29Å; F521-Y558 HydrophobicContact CD2-CD2 4.33Å; F521-Y558 HydrophobicContact CD2-CE1 4.22Å; F521-Y558 AromaticContact CD2-CE2 3.62Å; F521-Y558 HydrophobicContact CD2-CE2 3.62Å; F521-Y558 AromaticContact CD2-CZ 3.56Å; F521-Y558 HydrophobicContact CE2-CE2 4.3Å; F521-Y558 HydrophobicContact CG-CE2 4.34Å
522	S	84	Confident	80.1	Confident	18 Å²	18	59.1 Å²	59.1	13%	0.126	31%	0.313	C	S	.	.	H	α-helix	trans	-65.2	-38.3	176.6	72.4	0	0	0	0	112.2	Y518 Q519 M520 L526	Y518-S522 WeakPolarHBondContact O-CB 3.21Å; Y518-S522 PolarHBondContact O-N 2.96Å; Y518-S522 PolarHBondContact O-OG 2.94Å; Q519-S522 WeakPolarHBondContact CA-OG 3.38Å; Q519-S522 PolarHBondContact O-N 3.41Å; Q519-S522 PolarHBondContact O-OG 3.24Å; M520-S522 VanDerWaalsContact C-N 3.33Å; M520-S522 PolarHBondContact O-N 3.47Å; S522-L526 WeakPolarHBondContact O-CB 3.36Å; S522-L526 VanDerWaalsContact O-CD1 3.28Å; S522-L526 WeakPolarHBondContact O-CD1 3.41Å; S522-L526 WeakPolarHBondContact O-CG 3.5Å; S522-L526 PolarHBondContact O-N 2.9Å
523	Q	84.3	Confident	80.1	Confident	98 Å²	98	58.4 Å²	58.4	46%	0.458	31%	0.312	S	S	.	.	H	α-helix	trans	-67.6	-42.2	178.7	-177.1	170.4	17.1	0	0	111.1	Q519 M520 F521 L526 T527	Q519-Q523 VanDerWaalsContact O-CB 3.31Å; Q519-Q523 WeakPolarHBondContact O-CB 3.38Å; Q519-Q523 PolarHBondContact O-N 3.08Å; M520-Q523 PolarHBondContact O-N 2.88Å; F521-Q523 VanDerWaalsContact C-N 3.34Å; F521-Q523 PolarHBondContact O-N 3.26Å; Q523-L526 PolarHBondContact O-N 2.77Å; Q523-T527 VanDerWaalsContact O-CB 3.29Å; Q523-T527 WeakPolarHBondContact O-CB 3.44Å; Q523-T527 PolarHBondContact O-N 3.01Å; Q523-T527 PolarHBondContact O-OG1 3.1Å
524	E	85.9	Confident	79.8	Confident	76 Å²	76	61.7 Å²	61.7	36%	0.355	33%	0.325	S	S	.	.	H	α-helix	trans	-60.4	-50.7	175.5	-176.3	173.8	179.9	0	0	111	M520 F521 L526 T527 N528 Y558	M520-E524 PolarHBondContact O-N 3.19Å; F521-E524 PolarHBondContact O-N 2.92Å; E524-L526 VanDerWaalsContact C-N 3.28Å; E524-L526 PolarHBondContact O-N 2.87Å; E524-T527 PolarHBondContact O-N 3.49Å; E524-T527 VanDerWaalsContact O-N 3.08Å; E524-N528 WeakPolarHBondContact CG-ND2 3.38Å; E524-N528 WeakPolarHBondContact O-CB 3.06Å; E524-N528 PolarHBondContact O-N 3.43Å; E524-N528 PolarHBondContact O-OD1 2.91Å; E524-N528 VanDerWaalsContact O-OD1 3.11Å; E524-Y558 VanDerWaalsContact OE2-CE1 3.26Å; E524-Y558 WeakPolarHBondContact OE2-CE1 3.27Å
525	L	81.4	Confident	79.6	Confident	17 Å²	17	63.5 Å²	63.5	9%	0.089	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-28.5	179.1	-77.7	178.6	0	0	0	114.3	F521 L531 I543	F521-L525 HydrophobicContact CD1-CD1 4.11Å; F521-L525 HydrophobicContact CD2-CD1 4.35Å; F521-L525 HydrophobicContact CE1-CD1 3.45Å; F521-L525 VanDerWaalsContact CE1-CD1 3.45Å; F521-L525 HydrophobicContact CE2-CD1 3.72Å; F521-L525 HydrophobicContact CE2-CG 4.18Å; F521-L525 HydrophobicContact CZ-CD1 3.26Å; F521-L525 HydrophobicContact CZ-CG 4.21Å; F521-L525 PolarHBondContact O-N 2.92Å; L525-L531 HydrophobicContact CB-CD1 4.34Å; L525-I543 HydrophobicContact CB-CD1 4.17Å; L525-I543 HydrophobicContact CB-CG1 3.99Å; L525-I543 HydrophobicContact CD1-CB 4.5Å; L525-I543 HydrophobicContact CD1-CG1 3.96Å; L525-I543 HydrophobicContact CD1-CG2 4.36Å
526	L	81	Confident	79.2	Confident	41 Å²	41	62.3 Å²	62.3	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-79.4	-26.7	174.5	-69.5	164.6	0	0	0	112.8	S522 Q523 E524 L536 R539 M540 I543	S522-L526 WeakPolarHBondContact O-CB 3.36Å; S522-L526 VanDerWaalsContact O-CD1 3.28Å; S522-L526 WeakPolarHBondContact O-CD1 3.41Å; S522-L526 WeakPolarHBondContact O-CG 3.5Å; S522-L526 PolarHBondContact O-N 2.9Å; Q523-L526 PolarHBondContact O-N 2.77Å; E524-L526 VanDerWaalsContact C-N 3.28Å; E524-L526 PolarHBondContact O-N 2.87Å; L526-L536 HydrophobicContact CD2-CD1 4.44Å; L526-R539 HydrophobicContact CD2-CB 3.97Å; L526-M540 HydrophobicContact CD1-CE 3.29Å; L526-M540 HydrophobicContact CD1-SD 4.37Å; L526-M540 HydrophobicContact CD2-CE 4.08Å; L526-M540 HydrophobicContact CG-CE 4.29Å; L526-I543 HydrophobicContact CD1-CD1 4.12Å; L526-I543 HydrophobicContact CD2-CD1 3.65Å; L526-I543 HydrophobicContact CG-CD1 3.56Å
527	T	82.1	Confident	78.7	Confident	105 Å²	105	68.2 Å²	68.2	64%	0.644	35%	0.347	S	S	*	.	H	α-helix	trans	-87.5	-31.2	-178.1	-52.5	0	0	0	0	111.7	Q523 E524 G529	Q523-T527 VanDerWaalsContact O-CB 3.29Å; Q523-T527 WeakPolarHBondContact O-CB 3.44Å; Q523-T527 PolarHBondContact O-N 3.01Å; Q523-T527 PolarHBondContact O-OG1 3.1Å; E524-T527 PolarHBondContact O-N 3.49Å; E524-T527 VanDerWaalsContact O-N 3.08Å; T527-G529 PolarHBondContact O-N 3.11Å
528	N	77.6	Confident	78.6	Confident	88 Å²	88	72.5 Å²	72.5	47%	0.471	36%	0.364	S	S	.	.	S	Bend	trans	-70.9	-7.9	179.5	-65.5	-1.2	0	0	0	113.4	E524 E530	E524-N528 WeakPolarHBondContact CG-ND2 3.38Å; E524-N528 WeakPolarHBondContact O-CB 3.06Å; E524-N528 PolarHBondContact O-N 3.43Å; E524-N528 PolarHBondContact O-OD1 2.91Å; E524-N528 VanDerWaalsContact O-OD1 3.11Å; N528-E530 PolarHBondContact O-N 2.87Å
529	G	68.9	Low	78.5	Confident	25 Å²	25	71.3 Å²	71.3	26%	0.258	36%	0.359	S	S	.	.			trans	74.3	-6.5	170.3	0	0	0	0	0	116.2	T527 L531 N532	T527-G529 PolarHBondContact O-N 3.11Å; G529-L531 PolarHBondContact O-N 2.6Å; G529-L531 VanDerWaalsContact O-N 3.11Å; G529-N532 VanDerWaalsContact CA-ND2 3.3Å; G529-N532 WeakPolarHBondContact CA-ND2 3.44Å; G529-N532 WeakPolarHBondContact O-CB 3.35Å; G529-N532 VanDerWaalsContact O-CG 3.3Å; G529-N532 PolarHBondContact O-N 2.94Å; G529-N532 VanDerWaalsContact O-N 3.14Å; G529-N532 PolarHBondContact O-ND2 3.02Å
530	E	74.4	Confident	78.4	Confident	114 Å²	114	70.9 Å²	70.9	53%	0.533	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-28	179.5	-67.5	-178.9	-171.5	0	0	113.7	N528 H533 R546	N528-E530 PolarHBondContact O-N 2.87Å; E530-H533 PolarHBondContact O-CE1 3.2Å; E530-H533 PolarHBondContact O-ND1 3.48Å; E530-R546 IonicContact OE2-NH1 3.6Å
531	L	69.1	Low	78.3	Confident	2 Å²	2	74 Å²	74	1%	0.01	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	6.5	-176	-68.9	168.4	0	0	0	113.6	L525 G529 H533 F534 R539 E542 I543	L525-L531 HydrophobicContact CB-CD1 4.34Å; G529-L531 PolarHBondContact O-N 2.6Å; G529-L531 VanDerWaalsContact O-N 3.11Å; L531-H533 PolarHBondContact O-N 2.9Å; L531-F534 HydrophobicContact CD2-CD2 4.13Å; L531-F534 PolarHBondContact O-N 2.96Å; L531-R539 HydrophobicContact CB-CG 3.92Å; L531-R539 WeakPolarHBondContact O-CD 3.46Å; L531-R539 WeakPolarHBondContact O-CG 3.34Å; L531-E542 HydrophobicContact CD2-CB 4.4Å; L531-E542 HydrophobicContact CD2-CG 3.8Å; L531-I543 HydrophobicContact CD1-CD1 4.1Å; L531-I543 HydrophobicContact CD1-CG1 3.67Å
532	N	74.1	Confident	78.2	Confident	105 Å²	105	76.1 Å²	76.1	56%	0.561	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-12.4	-171.9	-76.8	-14.1	0	0	0	115.6	G529 F534 R539	G529-N532 VanDerWaalsContact CA-ND2 3.3Å; G529-N532 WeakPolarHBondContact CA-ND2 3.44Å; G529-N532 WeakPolarHBondContact O-CB 3.35Å; G529-N532 VanDerWaalsContact O-CG 3.3Å; G529-N532 PolarHBondContact O-N 2.94Å; G529-N532 VanDerWaalsContact O-N 3.14Å; G529-N532 PolarHBondContact O-ND2 3.02Å; N532-F534 VanDerWaalsContact C-N 3.35Å; N532-R539 PolarHBondContact OD1-NH1 2.72Å; N532-R539 VanDerWaalsContact OD1-NH1 3.15Å
533	H	73.5	Confident	78.4	Confident	141 Å²	141	75.2 Å²	75.2	65%	0.653	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-13.3	175.3	56.4	-82.2	0	0	0	113.3	E530 L531	E530-H533 PolarHBondContact O-CE1 3.2Å; E530-H533 PolarHBondContact O-ND1 3.48Å; L531-H533 PolarHBondContact O-N 2.9Å
534	F	71	Confident	78.5	Confident	88 Å²	88	71.5 Å²	71.5	39%	0.386	37%	0.37	S	S	.	.	S	Bend	trans	-98.3	149.6	175.8	-71.8	-63.5	0	0	0	111.9	L531 N532 E538 R539	L531-F534 HydrophobicContact CD2-CD2 4.13Å; L531-F534 PolarHBondContact O-N 2.96Å; N532-F534 VanDerWaalsContact C-N 3.35Å; F534-E538 HydrophobicContact CB-CB 3.91Å; F534-E538 HydrophobicContact CD1-CB 4.26Å; F534-E538 HydrophobicContact CG-CB 4.35Å; F534-R539 HydrophobicContact CB-CG 3.85Å; F534-R539 WeakPolarHBondContact O-CG 3.34Å
535	S	75.8	Confident	78.7	Confident	58 Å²	58	73.6 Å²	73.6	41%	0.406	38%	0.378	S	S	.	.			trans	-62.1	153.6	173	70.1	0	0	0	0	110.8	K537 E538 R539	S535-K537 PolarHBondContact O-N 2.96Å; S535-E538 VanDerWaalsContact CB-OE2 3.29Å; S535-E538 WeakPolarHBondContact CB-OE2 3.39Å; S535-E538 PolarHBondContact N-OE2 2.92Å; S535-E538 PolarHBondContact O-N 3.3Å; S535-E538 WeakPolarHBondContact OG-CG 3.23Å; S535-E538 PolarHBondContact OG-N 3.14Å; S535-E538 PolarHBondContact OG-OE2 3.48Å; S535-R539 WeakPolarHBondContact O-CG 3.31Å; S535-R539 PolarHBondContact O-N 3.19Å
536	L	66.8	Low	79	Confident	83 Å²	83	77 Å²	77	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-53	-34.2	-178.5	-176.6	64.4	0	0	0	112.9	L526 M540	L526-L536 HydrophobicContact CD2-CD1 4.44Å; L536-M540 HydrophobicContact CD1-CE 3.64Å; L536-M540 HydrophobicContact CG-CE 4.43Å; L536-M540 VanDerWaalsContact O-CG 3.27Å; L536-M540 WeakPolarHBondContact O-CG 3.32Å; L536-M540 PolarHBondContact O-N 3Å; L536-M540 VanDerWaalsContact O-N 3.12Å
537	K	75.1	Confident	79.4	Confident	175 Å²	175	76.9 Å²	76.9	76%	0.761	39%	0.386	S	S	*	.	H	α-helix	trans	-66.7	-43.9	176.9	-168.7	178.7	179.5	-175	0	111.8	S535 M540 V541	S535-K537 PolarHBondContact O-N 2.96Å; K537-M540 PolarHBondContact O-N 3.36Å; K537-V541 WeakPolarHBondContact O-CG2 3.33Å; K537-V541 PolarHBondContact O-N 3.07Å
538	E	81.9	Confident	79.6	Confident	100 Å²	100	78.5 Å²	78.5	47%	0.467	39%	0.387	S	S	.	.	H	α-helix	trans	-69.9	-37.9	176.5	-70	160.3	154.2	0	0	111.8	F534 S535 M540 V541 E542	F534-E538 HydrophobicContact CB-CB 3.91Å; F534-E538 HydrophobicContact CD1-CB 4.26Å; F534-E538 HydrophobicContact CG-CB 4.35Å; S535-E538 VanDerWaalsContact CB-OE2 3.29Å; S535-E538 WeakPolarHBondContact CB-OE2 3.39Å; S535-E538 PolarHBondContact N-OE2 2.92Å; S535-E538 PolarHBondContact O-N 3.3Å; S535-E538 WeakPolarHBondContact OG-CG 3.23Å; S535-E538 PolarHBondContact OG-N 3.14Å; S535-E538 PolarHBondContact OG-OE2 3.48Å; E538-M540 VanDerWaalsContact C-N 3.31Å; E538-M540 PolarHBondContact O-N 3.42Å; E538-V541 PolarHBondContact O-N 2.83Å; E538-E542 WeakPolarHBondContact O-CB 3.13Å; E538-E542 PolarHBondContact O-N 3.47Å
539	R	82.6	Confident	80.2	Confident	51 Å²	51	83 Å²	83	19%	0.192	40%	0.402	C	S	.	.	H	α-helix	trans	-56.8	-44.7	173.3	-66.3	-164.7	-76.8	176.1	-6	111.5	L526 L531 N532 F534 S535 E542 I543	L526-R539 HydrophobicContact CD2-CB 3.97Å; L531-R539 HydrophobicContact CB-CG 3.92Å; L531-R539 WeakPolarHBondContact O-CD 3.46Å; L531-R539 WeakPolarHBondContact O-CG 3.34Å; N532-R539 PolarHBondContact OD1-NH1 2.72Å; N532-R539 VanDerWaalsContact OD1-NH1 3.15Å; F534-R539 HydrophobicContact CB-CG 3.85Å; F534-R539 WeakPolarHBondContact O-CG 3.34Å; S535-R539 WeakPolarHBondContact O-CG 3.31Å; S535-R539 PolarHBondContact O-N 3.19Å; R539-E542 PolarHBondContact O-N 3.17Å; R539-I543 WeakPolarHBondContact O-CB 3.13Å; R539-I543 WeakPolarHBondContact O-CD1 3.3Å; R539-I543 WeakPolarHBondContact O-CG1 3.39Å; R539-I543 PolarHBondContact O-N 3.31Å
540	M	81.6	Confident	81.2	Confident	74 Å²	74	83.3 Å²	83.3	37%	0.365	40%	0.397	S	S	.	.	H	α-helix	trans	-66.7	-37.3	178.8	-67.4	-64	158.2	0	0	112.9	L526 L536 K537 E538 G544	L526-M540 HydrophobicContact CD1-CE 3.29Å; L526-M540 HydrophobicContact CD1-SD 4.37Å; L526-M540 HydrophobicContact CD2-CE 4.08Å; L526-M540 HydrophobicContact CG-CE 4.29Å; L536-M540 HydrophobicContact CD1-CE 3.64Å; L536-M540 HydrophobicContact CG-CE 4.43Å; L536-M540 VanDerWaalsContact O-CG 3.27Å; L536-M540 WeakPolarHBondContact O-CG 3.32Å; L536-M540 PolarHBondContact O-N 3Å; L536-M540 VanDerWaalsContact O-N 3.12Å; K537-M540 PolarHBondContact O-N 3.36Å; E538-M540 VanDerWaalsContact C-N 3.31Å; E538-M540 PolarHBondContact O-N 3.42Å; M540-G544 PolarHBondContact O-N 3.29Å
541	V	85.9	Confident	82.1	Confident	83 Å²	83	80.6 Å²	80.6	50%	0.503	39%	0.391	S	S	.	.	H	α-helix	trans	-65.6	-43.9	175.9	172.3	0	0	0	0	110.7	K537 E538 G544 K545	K537-V541 WeakPolarHBondContact O-CG2 3.33Å; K537-V541 PolarHBondContact O-N 3.07Å; E538-V541 PolarHBondContact O-N 2.83Å; V541-G544 PolarHBondContact O-N 3.2Å; V541-K545 WeakPolarHBondContact O-CG 3.49Å; V541-K545 PolarHBondContact O-N 3.42Å
542	E	85.9	Confident	82.9	Confident	56 Å²	56	86.3 Å²	86.3	26%	0.262	42%	0.418	S	S	.	.	H	α-helix	trans	-68.2	-41.1	179.5	-174.9	54.1	-151.1	0	0	112.1	L531 E538 R539 G544 K545 R546	L531-E542 HydrophobicContact CD2-CB 4.4Å; L531-E542 HydrophobicContact CD2-CG 3.8Å; E538-E542 WeakPolarHBondContact O-CB 3.13Å; E538-E542 PolarHBondContact O-N 3.47Å; R539-E542 PolarHBondContact O-N 3.17Å; E542-G544 VanDerWaalsContact C-N 3.32Å; E542-G544 PolarHBondContact O-N 3.25Å; E542-K545 PolarHBondContact O-N 3.03Å; E542-R546 WeakPolarHBondContact O-CG 3.28Å; E542-R546 PolarHBondContact O-N 3.47Å; E542-R546 IonicContact OE1-CZ 3.07Å; E542-R546 IonicContact OE1-NE 3.76Å; E542-R546 PolarHBondContact OE1-NE 3.03Å; E542-R546 IonicContact OE1-NH2 3.96Å
543	I	86.4	Confident	83.7	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-60.9	-41.8	173.2	-70.8	165.1	0	0	0	111	Y518 F521 L525 L526 L531 R539 R546 W547	Y518-I543 HydrophobicContact CE2-CG2 4.19Å; F521-I543 HydrophobicContact CD1-CG2 4.2Å; F521-I543 HydrophobicContact CE1-CG2 4.25Å; L525-I543 HydrophobicContact CB-CD1 4.17Å; L525-I543 HydrophobicContact CB-CG1 3.99Å; L525-I543 HydrophobicContact CD1-CB 4.5Å; L525-I543 HydrophobicContact CD1-CG1 3.96Å; L525-I543 HydrophobicContact CD1-CG2 4.36Å; L526-I543 HydrophobicContact CD1-CD1 4.12Å; L526-I543 HydrophobicContact CD2-CD1 3.65Å; L526-I543 HydrophobicContact CG-CD1 3.56Å; L531-I543 HydrophobicContact CD1-CD1 4.1Å; L531-I543 HydrophobicContact CD1-CG1 3.67Å; R539-I543 WeakPolarHBondContact O-CB 3.13Å; R539-I543 WeakPolarHBondContact O-CD1 3.3Å; R539-I543 WeakPolarHBondContact O-CG1 3.39Å; R539-I543 PolarHBondContact O-N 3.31Å; I543-R546 PolarHBondContact O-N 3.35Å; I543-W547 WeakPolarHBondContact O-CB 3.46Å; I543-W547 PolarHBondContact O-N 3.34Å
544	G	87.2	Confident	84.3	Confident	20 Å²	20	82.4 Å²	82.4	21%	0.206	41%	0.409	C	S	.	.	H	α-helix	trans	-60.1	-44.7	175.1	0	0	0	0	0	112.4	M540 V541 E542 W547 Q548	M540-G544 PolarHBondContact O-N 3.29Å; V541-G544 PolarHBondContact O-N 3.2Å; E542-G544 VanDerWaalsContact C-N 3.32Å; E542-G544 PolarHBondContact O-N 3.25Å; G544-W547 PolarHBondContact O-N 2.85Å; G544-Q548 WeakPolarHBondContact O-CG 3.13Å; G544-Q548 PolarHBondContact O-N 3.49Å; G544-Q548 VanDerWaalsContact O-N 3.13Å
545	K	90.4	Very high	85.2	Confident	119 Å²	119	79.9 Å²	79.9	52%	0.517	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-45.2	175.6	-72.3	177.1	-178.8	178.5	0	111.9	V541 E542 Q548 K549	V541-K545 WeakPolarHBondContact O-CG 3.49Å; V541-K545 PolarHBondContact O-N 3.42Å; E542-K545 PolarHBondContact O-N 3.03Å; K545-Q548 PolarHBondContact O-N 2.77Å; K545-K549 WeakPolarHBondContact O-CG 3.34Å; K545-K549 PolarHBondContact O-N 3.41Å
546	R	87.6	Confident	85.8	Confident	88 Å²	88	80.7 Å²	80.7	33%	0.332	40%	0.397	S	S	.	.	H	α-helix	trans	-66.1	-38.1	178.8	-69.1	-177.3	-174.4	-162.5	1.1	112.2	F521 E530 E542 I543 Q548 K549 L550	F521-R546 HydrophobicContact CE1-CB 4.21Å; F521-R546 HydrophobicContact CZ-CB 3.99Å; E530-R546 IonicContact OE2-NH1 3.6Å; E542-R546 WeakPolarHBondContact O-CG 3.28Å; E542-R546 PolarHBondContact O-N 3.47Å; E542-R546 IonicContact OE1-CZ 3.07Å; E542-R546 IonicContact OE1-NE 3.76Å; E542-R546 PolarHBondContact OE1-NE 3.03Å; E542-R546 IonicContact OE1-NH2 3.96Å; I543-R546 PolarHBondContact O-N 3.35Å; R546-Q548 VanDerWaalsContact C-N 3.34Å; R546-Q548 PolarHBondContact O-N 3.36Å; R546-K549 PolarHBondContact O-N 2.91Å; R546-L550 PolarHBondContact O-N 3.34Å
547	W	89.1	Confident	87	Confident	39 Å²	39	82.9 Å²	82.9	15%	0.148	40%	0.403	C	S	.	.	H	α-helix	trans	-62.4	-40.8	175.3	177.7	-106.6	0	0	0	112.2	Y518 F521 I543 G544 K549 L550 K555 Y558	Y518-W547 HydrophobicContact CD2-CB 3.75Å; Y518-W547 AromaticContact CD2-CD1 3.54Å; Y518-W547 AromaticContact CD2-CD2 3.56Å; Y518-W547 HydrophobicContact CD2-CD2 3.56Å; Y518-W547 AromaticContact CD2-CE2 3.89Å; Y518-W547 HydrophobicContact CD2-CE3 4.17Å; Y518-W547 AromaticContact CD2-CG 3.33Å; Y518-W547 HydrophobicContact CD2-CG 3.33Å; Y518-W547 AromaticContact CD2-NE1 3.86Å; Y518-W547 HydrophobicContact CE2-CB 3.73Å; Y518-W547 HydrophobicContact CE2-CD2 4.45Å; Y518-W547 AromaticContact CE2-CG 3.82Å; Y518-W547 HydrophobicContact CE2-CG 3.82Å; Y518-W547 HydrophobicContact CG-CD2 4.36Å; Y518-W547 HydrophobicContact CG-CG 4.4Å; F521-W547 HydrophobicContact CB-CE3 3.62Å; F521-W547 HydrophobicContact CB-CZ3 3.55Å; F521-W547 HydrophobicContact CD1-CB 3.93Å; F521-W547 HydrophobicContact CD1-CD2 4.19Å; F521-W547 AromaticContact CD1-CE3 3.41Å; F521-W547 HydrophobicContact CD1-CE3 3.41Å; F521-W547 VanDerWaalsContact CD1-CE3 3.41Å; F521-W547 HydrophobicContact CD1-CG 4.44Å; F521-W547 HydrophobicContact CD1-CZ3 4.25Å; F521-W547 HydrophobicContact CD2-CE3 4.36Å; F521-W547 HydrophobicContact CE1-CB 3.75Å; F521-W547 HydrophobicContact CE1-CE3 4.09Å; F521-W547 AromaticContact CG-CE3 3.53Å; F521-W547 HydrophobicContact CG-CE3 3.53Å; F521-W547 AromaticContact CG-CZ3 3.91Å; F521-W547 HydrophobicContact CG-CZ3 3.91Å; I543-W547 WeakPolarHBondContact O-CB 3.46Å; I543-W547 PolarHBondContact O-N 3.34Å; G544-W547 PolarHBondContact O-N 2.85Å; W547-K549 VanDerWaalsContact C-N 3.3Å; W547-K549 PolarHBondContact O-N 2.87Å; W547-L550 HydrophobicContact CD2-CD1 4.5Å; W547-L550 HydrophobicContact CE3-CD1 3.64Å; W547-L550 HydrophobicContact CZ3-CD1 4.05Å; W547-L550 WeakPolarHBondContact O-CB 3.24Å; W547-L550 PolarHBondContact O-N 3.18Å; W547-K555 HydrophobicContact CH2-CB 4.05Å; W547-K555 HydrophobicContact CH2-CG 3.87Å; W547-K555 HydrophobicContact CZ2-CB 4.22Å; W547-K555 HydrophobicContact CZ2-CD 4.29Å; W547-K555 HydrophobicContact CZ2-CG 3.85Å; W547-K555 HydrophobicContact CZ3-CG 4.22Å; W547-K555 WeakPolarHBondContact O-CE 3.4Å; W547-K555 PolarHBondContact O-NZ 3.41Å; W547-Y558 HydrophobicContact CH2-CD2 4.47Å; W547-Y558 AromaticContact CZ3-CD2 3.77Å; W547-Y558 HydrophobicContact CZ3-CD2 3.77Å; W547-Y558 HydrophobicContact CZ3-CG 4.24Å
548	Q	87.5	Confident	87.6	Confident	140 Å²	140	76.1 Å²	76.1	65%	0.654	37%	0.373	S	S	*	.	H	α-helix	trans	-64.3	-37.1	177	-69.7	-63	-7.8	0	0	112.1	G544 K545 R546 L550 K555	G544-Q548 WeakPolarHBondContact O-CG 3.13Å; G544-Q548 PolarHBondContact O-N 3.49Å; G544-Q548 VanDerWaalsContact O-N 3.13Å; K545-Q548 PolarHBondContact O-N 2.77Å; R546-Q548 VanDerWaalsContact C-N 3.34Å; R546-Q548 PolarHBondContact O-N 3.36Å; Q548-L550 VanDerWaalsContact C-N 3.28Å; Q548-L550 PolarHBondContact O-N 3Å; Q548-K555 PolarHBondContact O-NZ 3.13Å
549	K	90.1	Very high	88	Confident	183 Å²	183	76.8 Å²	76.8	80%	0.796	38%	0.375	S	S	*	.	H	α-helix	trans	-70.8	-15.5	176.7	-70.5	-179.3	178	-176.2	0	114.6	K545 R546 W547	K545-K549 WeakPolarHBondContact O-CG 3.34Å; K545-K549 PolarHBondContact O-N 3.41Å; R546-K549 PolarHBondContact O-N 2.91Å; W547-K549 VanDerWaalsContact C-N 3.3Å; W547-K549 PolarHBondContact O-N 2.87Å
550	L	90.3	Very high	88.4	Confident	30 Å²	30	81.3 Å²	81.3	16%	0.157	40%	0.396	C	S	.	.	S	Bend	trans	-69.9	140.4	177.3	-70.6	176.1	0	0	0	111.9	F521 R546 W547 Q548 Q554 K555 Y558	F521-L550 HydrophobicContact CD1-CD1 4.49Å; F521-L550 HydrophobicContact CD2-CD1 3.9Å; F521-L550 HydrophobicContact CE1-CD1 4.22Å; F521-L550 HydrophobicContact CE2-CD1 3.62Å; F521-L550 HydrophobicContact CE2-CG 4.44Å; F521-L550 HydrophobicContact CG-CD1 4.29Å; F521-L550 HydrophobicContact CZ-CD1 3.75Å; F521-L550 HydrophobicContact CZ-CG 4.33Å; R546-L550 PolarHBondContact O-N 3.34Å; W547-L550 HydrophobicContact CD2-CD1 4.5Å; W547-L550 HydrophobicContact CE3-CD1 3.64Å; W547-L550 HydrophobicContact CZ3-CD1 4.05Å; W547-L550 WeakPolarHBondContact O-CB 3.24Å; W547-L550 PolarHBondContact O-N 3.18Å; Q548-L550 VanDerWaalsContact C-N 3.28Å; Q548-L550 PolarHBondContact O-N 3Å; L550-Q554 HydrophobicContact CB-CB 4.27Å; L550-Q554 HydrophobicContact CD2-CB 4.18Å; L550-K555 HydrophobicContact CB-CG 4.14Å; L550-K555 VanDerWaalsContact O-CE 3.25Å; L550-K555 WeakPolarHBondContact O-CE 3.46Å; L550-K555 PolarHBondContact O-NZ 3.36Å; L550-K555 VanDerWaalsContact O-NZ 3.17Å; L550-Y558 HydrophobicContact CD1-CD2 4.32Å; L550-Y558 HydrophobicContact CD1-CE2 3.88Å
551	S	91.6	Very high	88.5	Confident	58 Å²	58	80.4 Å²	80.4	41%	0.406	39%	0.391	S	S	.	.			trans	-63.9	156.5	171.5	65.7	0	0	0	0	111.7	A553 Q554 K555	S551-A553 VanDerWaalsContact C-N 3.25Å; S551-A553 PolarHBondContact O-N 3.49Å; S551-Q554 PolarHBondContact O-N 2.85Å; S551-Q554 VanDerWaalsContact O-N 3.1Å; S551-Q554 VanDerWaalsContact OG-CD 3.31Å; S551-Q554 VanDerWaalsContact OG-CG 3.32Å; S551-Q554 WeakPolarHBondContact OG-CG 3.37Å; S551-Q554 PolarHBondContact OG-N 3.38Å; S551-Q554 PolarHBondContact OG-OE1 3.07Å; S551-K555 PolarHBondContact O-N 3.2Å
552	Q	86.8	Confident	88.6	Confident	121 Å²	121	76.8 Å²	76.8	57%	0.565	37%	0.369	S	S	*	.	H	α-helix	trans	-58.8	-38.5	177.7	-170.7	57.7	39.7	0	0	111.9	Q554 K555 D556	Q552-Q554 VanDerWaalsContact C-N 3.32Å; Q552-Q554 PolarHBondContact O-N 3.01Å; Q552-K555 PolarHBondContact O-N 2.9Å; Q552-D556 PolarHBondContact NE2-OD1 3.15Å; Q552-D556 WeakPolarHBondContact O-CB 3.38Å; Q552-D556 PolarHBondContact O-N 2.67Å
553	A	90.3	Very high	88.7	Confident	73 Å²	73	78.9 Å²	78.9	60%	0.603	38%	0.379	S	S	*	.	H	α-helix	trans	-61.1	-36.9	176	0	0	0	0	0	113.2	S551 K557	S551-A553 VanDerWaalsContact C-N 3.25Å; S551-A553 PolarHBondContact O-N 3.49Å; A553-K557 PolarHBondContact O-N 2.95Å
554	Q	86.9	Confident	88.9	Confident	91 Å²	91	84.2 Å²	84.2	43%	0.425	40%	0.403	S	S	.	.	H	α-helix	trans	-72	-39.7	175.1	-72.2	164.9	-44.1	0	0	111.5	L550 S551 Q552 D556 K557 Y558	L550-Q554 HydrophobicContact CB-CB 4.27Å; L550-Q554 HydrophobicContact CD2-CB 4.18Å; S551-Q554 PolarHBondContact O-N 2.85Å; S551-Q554 VanDerWaalsContact O-N 3.1Å; S551-Q554 VanDerWaalsContact OG-CD 3.31Å; S551-Q554 VanDerWaalsContact OG-CG 3.32Å; S551-Q554 WeakPolarHBondContact OG-CG 3.37Å; S551-Q554 PolarHBondContact OG-N 3.38Å; S551-Q554 PolarHBondContact OG-OE1 3.07Å; Q552-Q554 VanDerWaalsContact C-N 3.32Å; Q552-Q554 PolarHBondContact O-N 3.01Å; Q554-D556 VanDerWaalsContact C-N 3.3Å; Q554-D556 PolarHBondContact O-N 3.05Å; Q554-K557 WeakPolarHBondContact O-CB 3.48Å; Q554-K557 PolarHBondContact O-N 3.1Å; Q554-Y558 WeakPolarHBondContact O-CD2 3.45Å; Q554-Y558 PolarHBondContact O-N 3.03Å
555	K	90.3	Very high	88.8	Confident	36 Å²	36	86.5 Å²	86.5	16%	0.157	41%	0.409	C	S	.	.	H	α-helix	trans	-62.2	-39.4	173.7	-68.3	172.8	177.3	159.8	0	111.4	W547 Q548 L550 S551 Q552 Y558 K559	W547-K555 HydrophobicContact CH2-CB 4.05Å; W547-K555 HydrophobicContact CH2-CG 3.87Å; W547-K555 HydrophobicContact CZ2-CB 4.22Å; W547-K555 HydrophobicContact CZ2-CD 4.29Å; W547-K555 HydrophobicContact CZ2-CG 3.85Å; W547-K555 HydrophobicContact CZ3-CG 4.22Å; W547-K555 WeakPolarHBondContact O-CE 3.4Å; W547-K555 PolarHBondContact O-NZ 3.41Å; Q548-K555 PolarHBondContact O-NZ 3.13Å; L550-K555 HydrophobicContact CB-CG 4.14Å; L550-K555 VanDerWaalsContact O-CE 3.25Å; L550-K555 WeakPolarHBondContact O-CE 3.46Å; L550-K555 PolarHBondContact O-NZ 3.36Å; L550-K555 VanDerWaalsContact O-NZ 3.17Å; S551-K555 PolarHBondContact O-N 3.2Å; Q552-K555 PolarHBondContact O-N 2.9Å; K555-Y558 PolarHBondContact O-N 3.33Å; K555-K559 PolarHBondContact O-N 2.96Å
556	D	88.4	Confident	88.4	Confident	74 Å²	74	84.7 Å²	84.7	40%	0.396	40%	0.402	S	S	.	.	H	α-helix	trans	-68.3	-33.3	176.4	-66.1	-23.1	0	0	0	112.1	Q552 Q554 K559 K560	Q552-D556 PolarHBondContact NE2-OD1 3.15Å; Q552-D556 WeakPolarHBondContact O-CB 3.38Å; Q552-D556 PolarHBondContact O-N 2.67Å; Q554-D556 VanDerWaalsContact C-N 3.3Å; Q554-D556 PolarHBondContact O-N 3.05Å; D556-K559 WeakPolarHBondContact O-CB 3.3Å; D556-K559 PolarHBondContact O-N 3.3Å; D556-K560 WeakPolarHBondContact O-CB 3.34Å; D556-K560 PolarHBondContact O-N 3.04Å
557	K	90.9	Very high	88.4	Confident	129 Å²	129	85.4 Å²	85.4	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-59.7	-47.5	170.4	-175.7	-174.6	176.9	-173.3	0	111.4	A553 Q554 K559 K560 Q561	A553-K557 PolarHBondContact O-N 2.95Å; Q554-K557 WeakPolarHBondContact O-CB 3.48Å; Q554-K557 PolarHBondContact O-N 3.1Å; K557-K559 VanDerWaalsContact C-N 3.32Å; K557-K559 PolarHBondContact O-N 3.31Å; K557-K560 PolarHBondContact O-N 3.41Å; K557-Q561 WeakPolarHBondContact O-CG 3.45Å; K557-Q561 PolarHBondContact O-N 2.93Å
558	Y	88.9	Confident	88.2	Confident	33 Å²	33	88.8 Å²	88.8	13%	0.129	43%	0.434	C	S	.	.	H	α-helix	trans	-66.1	-35.6	176.7	-69.4	-65.1	0	0	0	112.3	F521 E524 W547 L550 Q554 K555 Q561 V562	F521-Y558 HydrophobicContact CB-CD1 4.33Å; F521-Y558 HydrophobicContact CB-CD2 4.3Å; F521-Y558 HydrophobicContact CB-CE1 4.41Å; F521-Y558 HydrophobicContact CB-CE2 4.37Å; F521-Y558 HydrophobicContact CB-CG 4.29Å; F521-Y558 HydrophobicContact CD2-CD2 4.33Å; F521-Y558 HydrophobicContact CD2-CE1 4.22Å; F521-Y558 AromaticContact CD2-CE2 3.62Å; F521-Y558 HydrophobicContact CD2-CE2 3.62Å; F521-Y558 AromaticContact CD2-CZ 3.56Å; F521-Y558 HydrophobicContact CE2-CE2 4.3Å; F521-Y558 HydrophobicContact CG-CE2 4.34Å; E524-Y558 VanDerWaalsContact OE2-CE1 3.26Å; E524-Y558 WeakPolarHBondContact OE2-CE1 3.27Å; W547-Y558 HydrophobicContact CH2-CD2 4.47Å; W547-Y558 AromaticContact CZ3-CD2 3.77Å; W547-Y558 HydrophobicContact CZ3-CD2 3.77Å; W547-Y558 HydrophobicContact CZ3-CG 4.24Å; L550-Y558 HydrophobicContact CD1-CD2 4.32Å; L550-Y558 HydrophobicContact CD1-CE2 3.88Å; Q554-Y558 WeakPolarHBondContact O-CD2 3.45Å; Q554-Y558 PolarHBondContact O-N 3.03Å; K555-Y558 PolarHBondContact O-N 3.33Å; Y558-Q561 PolarHBondContact O-N 3.25Å; Y558-V562 WeakPolarHBondContact O-CG2 3.38Å; Y558-V562 PolarHBondContact O-N 3.41Å
559	K	88.8	Confident	88.1	Confident	114 Å²	114	83.8 Å²	83.8	50%	0.496	41%	0.409	S	S	.	.	H	α-helix	trans	-61.5	-45.3	172.4	-175.1	-174.8	172.9	-169.1	0	111.5	K555 D556 K557 Q561 V562 E563	K555-K559 PolarHBondContact O-N 2.96Å; D556-K559 WeakPolarHBondContact O-CB 3.3Å; D556-K559 PolarHBondContact O-N 3.3Å; K557-K559 VanDerWaalsContact C-N 3.32Å; K557-K559 PolarHBondContact O-N 3.31Å; K559-Q561 PolarHBondContact O-N 3.47Å; K559-V562 WeakPolarHBondContact O-CB 3.44Å; K559-V562 PolarHBondContact O-N 2.91Å; K559-E563 VanDerWaalsContact CE-OE1 3.25Å; K559-E563 WeakPolarHBondContact CE-OE1 3.23Å; K559-E563 WeakPolarHBondContact O-CG 3.14Å; K559-E563 PolarHBondContact O-N 3.47Å
560	K	91.2	Very high	87.8	Confident	146 Å²	146	81.2 Å²	81.2	64%	0.635	40%	0.398	S	S	*	.	H	α-helix	trans	-62.3	-41.5	176.4	-172.1	-179.5	177.5	-175.2	0	112	D556 K557 V562 E563 E564	D556-K560 WeakPolarHBondContact O-CB 3.34Å; D556-K560 PolarHBondContact O-N 3.04Å; K557-K560 PolarHBondContact O-N 3.41Å; K560-V562 VanDerWaalsContact C-N 3.33Å; K560-V562 PolarHBondContact O-N 3.07Å; K560-E563 PolarHBondContact O-N 2.84Å; K560-E564 WeakPolarHBondContact O-CB 3.27Å; K560-E564 PolarHBondContact O-N 3.11Å
561	Q	83.9	Confident	87.6	Confident	56 Å²	56	82.3 Å²	82.3	26%	0.262	41%	0.411	S	S	.	.	H	α-helix	trans	-63.5	-36.8	174.9	-73.3	177.1	-9.3	0	0	112.6	K557 Y558 K559 Q565	K557-Q561 WeakPolarHBondContact O-CG 3.45Å; K557-Q561 PolarHBondContact O-N 2.93Å; Y558-Q561 PolarHBondContact O-N 3.25Å; K559-Q561 PolarHBondContact O-N 3.47Å; Q561-Q565 WeakPolarHBondContact O-CB 3.11Å; Q561-Q565 WeakPolarHBondContact O-CG 3.22Å; Q561-Q565 PolarHBondContact O-N 3.42Å
562	V	88.6	Confident	87.2	Confident	7 Å²	7	85.5 Å²	85.5	4%	0.042	42%	0.42	C	S	.	.	H	α-helix	trans	-62.9	-46.8	172.1	167.5	0	0	0	0	111.2	P514 M520 Y558 K559 K560 E564 Q565 Q566	P514-V562 VanDerWaalsContact O-CG1 3.32Å; P514-V562 WeakPolarHBondContact O-CG1 3.35Å; M520-V562 HydrophobicContact CB-CG2 4.03Å; M520-V562 HydrophobicContact CG-CB 4.46Å; M520-V562 HydrophobicContact CG-CG2 3.19Å; Y558-V562 WeakPolarHBondContact O-CG2 3.38Å; Y558-V562 PolarHBondContact O-N 3.41Å; K559-V562 WeakPolarHBondContact O-CB 3.44Å; K559-V562 PolarHBondContact O-N 2.91Å; K560-V562 VanDerWaalsContact C-N 3.33Å; K560-V562 PolarHBondContact O-N 3.07Å; V562-E564 VanDerWaalsContact C-N 3.35Å; V562-E564 PolarHBondContact O-N 3.16Å; V562-Q565 PolarHBondContact O-N 2.95Å; V562-Q566 HydrophobicContact CG1-CG 4.33Å; V562-Q566 WeakPolarHBondContact O-CB 3.14Å; V562-Q566 WeakPolarHBondContact O-CG 3.45Å; V562-Q566 PolarHBondContact O-N 3.25Å
563	E	87.3	Confident	86.9	Confident	100 Å²	100	81.5 Å²	81.5	47%	0.467	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-43.1	179.8	-72.1	171.3	-172.1	0	0	111.3	K559 K560 Q566 V567	K559-E563 VanDerWaalsContact CE-OE1 3.25Å; K559-E563 WeakPolarHBondContact CE-OE1 3.23Å; K559-E563 WeakPolarHBondContact O-CG 3.14Å; K559-E563 PolarHBondContact O-N 3.47Å; K560-E563 PolarHBondContact O-N 2.84Å; E563-Q566 PolarHBondContact O-N 3.44Å; E563-V567 WeakPolarHBondContact O-CG2 3.46Å; E563-V567 PolarHBondContact O-N 2.96Å
564	E	91	Very high	86.6	Confident	111 Å²	111	83.6 Å²	83.6	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-49.8	175.8	-175.3	168.3	-150.3	0	0	111.9	K560 V562 Q566 V567 E568	K560-E564 WeakPolarHBondContact O-CB 3.27Å; K560-E564 PolarHBondContact O-N 3.11Å; V562-E564 VanDerWaalsContact C-N 3.35Å; V562-E564 PolarHBondContact O-N 3.16Å; E564-Q566 VanDerWaalsContact C-N 3.26Å; E564-Q566 PolarHBondContact O-N 3.09Å; E564-V567 WeakPolarHBondContact O-CB 3.22Å; E564-V567 PolarHBondContact O-N 3.43Å; E564-V567 VanDerWaalsContact O-N 3.09Å; E564-E568 PolarHBondContact O-N 3.3Å
565	Q	84.3	Confident	86.6	Confident	68 Å²	68	82.1 Å²	82.1	32%	0.318	40%	0.403	S	S	.	.	H	α-helix	trans	-63.7	-31.2	176.3	-74.2	-172.5	34.8	0	0	112.8	P513 Q561 V562 Y569	P513-Q565 HydrophobicContact CB-CB 3.78Å; P513-Q565 HydrophobicContact CG-CB 4.37Å; Q561-Q565 WeakPolarHBondContact O-CB 3.11Å; Q561-Q565 WeakPolarHBondContact O-CG 3.22Å; Q561-Q565 PolarHBondContact O-N 3.42Å; V562-Q565 PolarHBondContact O-N 2.95Å; Q565-Y569 WeakPolarHBondContact O-CB 3.46Å; Q565-Y569 PolarHBondContact O-N 2.93Å
566	Q	83.8	Confident	86.4	Confident	81 Å²	81	82.3 Å²	82.3	38%	0.379	40%	0.402	S	S	.	.	H	α-helix	trans	-68.1	-37.4	173.7	-77.2	177.4	15.2	0	0	112.2	P513 V562 E563 E564 K570	P513-Q566 HydrophobicContact CG-CG 3.89Å; V562-Q566 HydrophobicContact CG1-CG 4.33Å; V562-Q566 WeakPolarHBondContact O-CB 3.14Å; V562-Q566 WeakPolarHBondContact O-CG 3.45Å; V562-Q566 PolarHBondContact O-N 3.25Å; E563-Q566 PolarHBondContact O-N 3.44Å; E564-Q566 VanDerWaalsContact C-N 3.26Å; E564-Q566 PolarHBondContact O-N 3.09Å; Q566-K570 WeakPolarHBondContact O-CB 3.44Å; Q566-K570 PolarHBondContact O-N 3.01Å
567	V	86.8	Confident	86.2	Confident	104 Å²	104	80.6 Å²	80.6	63%	0.63	40%	0.395	S	S	*	.	H	α-helix	trans	-66.8	-47.7	174.6	171.8	0	0	0	0	110.5	E563 E564 Y569 K570 A571	E563-V567 WeakPolarHBondContact O-CG2 3.46Å; E563-V567 PolarHBondContact O-N 2.96Å; E564-V567 WeakPolarHBondContact O-CB 3.22Å; E564-V567 PolarHBondContact O-N 3.43Å; E564-V567 VanDerWaalsContact O-N 3.09Å; V567-Y569 VanDerWaalsContact C-N 3.34Å; V567-Y569 PolarHBondContact O-N 3.23Å; V567-K570 PolarHBondContact O-N 3.3Å; V567-A571 PolarHBondContact O-N 3Å
568	E	85.5	Confident	85.9	Confident	109 Å²	109	82.4 Å²	82.4	51%	0.509	40%	0.402	S	S	.	.	H	α-helix	trans	-60	-44.5	175.7	-71.9	-179.3	178.8	0	0	111.8	E564 K570 A571 H572	E564-E568 PolarHBondContact O-N 3.3Å; E568-K570 VanDerWaalsContact C-N 3.33Å; E568-K570 PolarHBondContact O-N 3.24Å; E568-A571 PolarHBondContact O-N 3.47Å; E568-H572 WeakPolarHBondContact O-CB 3.1Å; E568-H572 PolarHBondContact O-CD2 3.45Å; E568-H572 PolarHBondContact O-N 2.9Å
569	Y	84.4	Confident	85.6	Confident	35 Å²	35	84.9 Å²	84.9	14%	0.137	43%	0.43	C	S	.	.	H	α-helix	trans	-59.1	-44.4	175.9	174.9	-104.2	0	0	0	112.2	P510 K511 K512 P513 Q565 V567 H572 L573	P510-Y569 HydrophobicContact CB-CD2 3.95Å; P510-Y569 HydrophobicContact CB-CE2 3.63Å; P510-Y569 VanDerWaalsContact O-CE2 3.22Å; P510-Y569 WeakPolarHBondContact O-CE2 3.43Å; P510-Y569 PolarHBondContact O-OH 3.5Å; K511-Y569 WeakPolarHBondContact O-CD2 3.41Å; K511-Y569 WeakPolarHBondContact O-CE2 3.26Å; K512-Y569 HydrophobicContact CG-CE1 3.94Å; K512-Y569 HydrophobicContact CG-CE2 4.2Å; K512-Y569 VanDerWaalsContact CG-OH 3.25Å; K512-Y569 WeakPolarHBondContact CG-OH 3.25Å; P513-Y569 HydrophobicContact CG-CG 4.06Å; Q565-Y569 WeakPolarHBondContact O-CB 3.46Å; Q565-Y569 PolarHBondContact O-N 2.93Å; V567-Y569 VanDerWaalsContact C-N 3.34Å; V567-Y569 PolarHBondContact O-N 3.23Å; Y569-H572 PolarHBondContact O-N 3.3Å; Y569-L573 HydrophobicContact CE1-CD2 4.23Å; Y569-L573 VanDerWaalsContact O-CB 3.27Å; Y569-L573 WeakPolarHBondContact O-CB 3.49Å; Y569-L573 PolarHBondContact O-N 3.43Å
570	K	83.6	Confident	85.3	Confident	129 Å²	129	80.7 Å²	80.7	56%	0.561	41%	0.413	S	S	*	.	H	α-helix	trans	-63.5	-43.3	178.3	-173.1	-176.8	175.1	-168	0	110.9	Q566 V567 E568 L573 E574	Q566-K570 WeakPolarHBondContact O-CB 3.44Å; Q566-K570 PolarHBondContact O-N 3.01Å; V567-K570 PolarHBondContact O-N 3.3Å; E568-K570 VanDerWaalsContact C-N 3.33Å; E568-K570 PolarHBondContact O-N 3.24Å; K570-L573 PolarHBondContact O-N 2.86Å; K570-E574 VanDerWaalsContact CE-OE1 3.23Å; K570-E574 WeakPolarHBondContact CE-OE1 2.95Å; K570-E574 WeakPolarHBondContact O-CB 3.41Å; K570-E574 WeakPolarHBondContact O-CG 3.48Å; K570-E574 PolarHBondContact O-N 2.97Å
571	A	87.6	Confident	84.8	Confident	53 Å²	53	75.7 Å²	75.7	44%	0.438	40%	0.396	S	S	.	.	H	α-helix	trans	-63.2	-44.4	175.7	0	0	0	0	0	112	V567 E568 L573 E574 A575	V567-A571 PolarHBondContact O-N 3Å; E568-A571 PolarHBondContact O-N 3.47Å; A571-L573 VanDerWaalsContact C-N 3.33Å; A571-L573 PolarHBondContact O-N 3.4Å; A571-E574 PolarHBondContact O-N 3.27Å; A571-A575 WeakPolarHBondContact O-CB 3.37Å; A571-A575 PolarHBondContact O-N 3.1Å
572	H	83.3	Confident	84.6	Confident	126 Å²	126	77.6 Å²	77.6	58%	0.583	41%	0.413	S	S	*	.	H	α-helix	trans	-62.4	-39.4	175	-88.6	-125.8	0	0	0	112.2	P510 E568 Y569 A575 W576	P510-H572 HydrophobicContact CB-CB 4.34Å; P510-H572 HydrophobicContact CG-CB 4.06Å; E568-H572 WeakPolarHBondContact O-CB 3.1Å; E568-H572 PolarHBondContact O-CD2 3.45Å; E568-H572 PolarHBondContact O-N 2.9Å; Y569-H572 PolarHBondContact O-N 3.3Å; H572-A575 PolarHBondContact O-N 3.03Å; H572-W576 WeakPolarHBondContact O-CB 3.33Å; H572-W576 PolarHBondContact O-N 2.94Å
573	L	79.7	Confident	83.7	Confident	36 Å²	36	84.5 Å²	84.5	19%	0.188	45%	0.445	C	S	.	.	H	α-helix	trans	-66.4	-44.2	177.2	-171.1	68.1	0	0	0	111	E509 Y569 K570 A571 W576 V577	E509-L573 HydrophobicContact CG-CD1 4.3Å; Y569-L573 HydrophobicContact CE1-CD2 4.23Å; Y569-L573 VanDerWaalsContact O-CB 3.27Å; Y569-L573 WeakPolarHBondContact O-CB 3.49Å; Y569-L573 PolarHBondContact O-N 3.43Å; K570-L573 PolarHBondContact O-N 2.86Å; A571-L573 VanDerWaalsContact C-N 3.33Å; A571-L573 PolarHBondContact O-N 3.4Å; L573-W576 HydrophobicContact CD1-CE3 4.11Å; L573-W576 HydrophobicContact CD1-CZ3 4.45Å; L573-W576 PolarHBondContact O-N 3.45Å; L573-V577 WeakPolarHBondContact O-CB 3.15Å; L573-V577 VanDerWaalsContact O-CG2 3.22Å; L573-V577 WeakPolarHBondContact O-CG2 3.06Å; L573-V577 PolarHBondContact O-N 3.27Å
574	E	84.1	Confident	83.2	Confident	117 Å²	117	83.3 Å²	83.3	55%	0.547	44%	0.442	S	S	.	.	H	α-helix	trans	-63.7	-42.2	176.2	-74.2	175.8	-169.2	0	0	111.9	K570 A571 K578	K570-E574 VanDerWaalsContact CE-OE1 3.23Å; K570-E574 WeakPolarHBondContact CE-OE1 2.95Å; K570-E574 WeakPolarHBondContact O-CB 3.41Å; K570-E574 WeakPolarHBondContact O-CG 3.48Å; K570-E574 PolarHBondContact O-N 2.97Å; A571-E574 PolarHBondContact O-N 3.27Å; E574-K578 WeakPolarHBondContact O-CB 3.29Å; E574-K578 PolarHBondContact O-N 2.98Å
575	A	86.6	Confident	82.6	Confident	61 Å²	61	82.7 Å²	82.7	50%	0.504	44%	0.435	S	S	.	.	H	α-helix	trans	-64.3	-43.4	175.4	0	0	0	0	0	112	A571 H572 K578 A579	A571-A575 WeakPolarHBondContact O-CB 3.37Å; A571-A575 PolarHBondContact O-N 3.1Å; H572-A575 PolarHBondContact O-N 3.03Å; A575-K578 WeakPolarHBondContact O-CB 3.42Å; A575-K578 PolarHBondContact O-N 2.88Å; A575-A579 PolarHBondContact O-N 2.98Å
576	W	86.2	Confident	82.1	Confident	39 Å²	39	82.2 Å²	82.2	15%	0.148	44%	0.442	C	S	.	.	H	α-helix	trans	-63.9	-48.2	176.5	175.4	82.8	0	0	0	111.1	F506 D507 G508 E509 P510 H572 L573 K578 A579 L580 Y588	F506-W576 HydrophobicContact CB-CH2 3.25Å; F506-W576 HydrophobicContact CB-CZ2 3.32Å; F506-W576 HydrophobicContact CD1-CH2 4.17Å; F506-W576 HydrophobicContact CD2-CH2 4.3Å; F506-W576 AromaticContact CG-CH2 3.7Å; F506-W576 HydrophobicContact CG-CH2 3.7Å; F506-W576 HydrophobicContact CG-CZ2 4.23Å; D507-W576 PolarHBondContact O-NE1 3.42Å; G508-W576 PolarHBondContact O-NE1 2.84Å; E509-W576 HydrophobicContact CB-CH2 4.01Å; E509-W576 HydrophobicContact CB-CZ2 3.9Å; E509-W576 HydrophobicContact CB-CZ3 4.49Å; E509-W576 HydrophobicContact CG-CH2 4.18Å; E509-W576 HydrophobicContact CG-CZ3 4.24Å; P510-W576 HydrophobicContact CG-CB 4.24Å; H572-W576 WeakPolarHBondContact O-CB 3.33Å; H572-W576 PolarHBondContact O-N 2.94Å; L573-W576 HydrophobicContact CD1-CE3 4.11Å; L573-W576 HydrophobicContact CD1-CZ3 4.45Å; L573-W576 PolarHBondContact O-N 3.45Å; W576-K578 PolarHBondContact O-N 3.08Å; W576-A579 WeakPolarHBondContact O-CA 3.3Å; W576-A579 WeakPolarHBondContact O-CB 3.41Å; W576-A579 PolarHBondContact O-N 2.65Å; W576-L580 HydrophobicContact CD2-CD1 3.74Å; W576-L580 HydrophobicContact CE3-CD1 3.67Å; W576-L580 HydrophobicContact CH2-CD1 3.64Å; W576-L580 HydrophobicContact CZ2-CD1 3.75Å; W576-L580 HydrophobicContact CZ2-CD2 4.48Å; W576-L580 HydrophobicContact CZ3-CD1 3.6Å; W576-L580 WeakPolarHBondContact O-CD1 3.37Å; W576-L580 PolarHBondContact O-N 3.22Å; W576-Y588 AromaticContact CH2-CD2 3.98Å; W576-Y588 HydrophobicContact CH2-CD2 3.98Å; W576-Y588 AromaticContact CH2-CE2 3.9Å; W576-Y588 HydrophobicContact CH2-CE2 3.9Å; W576-Y588 AromaticContact CZ3-CD2 3.81Å; W576-Y588 HydrophobicContact CZ3-CD2 3.81Å; W576-Y588 HydrophobicContact CZ3-CE1 4.43Å; W576-Y588 AromaticContact CZ3-CE2 3.51Å; W576-Y588 HydrophobicContact CZ3-CE2 3.51Å; W576-Y588 HydrophobicContact CZ3-CG 4.42Å; W576-Y588 AromaticContact CZ3-CZ 3.86Å
577	V	83.4	Confident	81.8	Confident	39 Å²	39	81.8 Å²	81.8	24%	0.236	45%	0.445	C	S	.	.	H	α-helix	trans	-54.8	-40.1	173.6	170.7	0	0	0	0	111	L573 A579 L580 R585 Y588	L573-V577 WeakPolarHBondContact O-CB 3.15Å; L573-V577 VanDerWaalsContact O-CG2 3.22Å; L573-V577 WeakPolarHBondContact O-CG2 3.06Å; L573-V577 PolarHBondContact O-N 3.27Å; V577-A579 VanDerWaalsContact C-N 3.32Å; V577-A579 PolarHBondContact O-N 3.38Å; V577-L580 PolarHBondContact O-N 3.11Å; V577-R585 HydrophobicContact CG1-CG 4.44Å; V577-R585 WeakPolarHBondContact O-CD 3.39Å; V577-R585 WeakPolarHBondContact O-CG 3.5Å; V577-Y588 HydrophobicContact CG2-CD1 3.72Å; V577-Y588 HydrophobicContact CG2-CE1 3.48Å; V577-Y588 VanDerWaalsContact CG2-CE1 3.48Å
578	K	86	Confident	81.4	Confident	166 Å²	166	78.3 Å²	78.3	72%	0.722	42%	0.421	S	S	*	.	H	α-helix	trans	-68.7	-29.2	177.5	-169.9	177.6	178.7	-178.3	0	113.3	E574 A575 W576	E574-K578 WeakPolarHBondContact O-CB 3.29Å; E574-K578 PolarHBondContact O-N 2.98Å; A575-K578 WeakPolarHBondContact O-CB 3.42Å; A575-K578 PolarHBondContact O-N 2.88Å; W576-K578 PolarHBondContact O-N 3.08Å
579	A	82.9	Confident	80.9	Confident	86 Å²	86	80.6 Å²	80.6	71%	0.711	43%	0.429	S	S	*	.	H	α-helix	trans	-79.6	-14.3	178.8	0	0	0	0	0	114	A575 W576 V577	A575-A579 PolarHBondContact O-N 2.98Å; W576-A579 WeakPolarHBondContact O-CA 3.3Å; W576-A579 WeakPolarHBondContact O-CB 3.41Å; W576-A579 PolarHBondContact O-N 2.65Å; V577-A579 VanDerWaalsContact C-N 3.32Å; V577-A579 PolarHBondContact O-N 3.38Å
580	L	81.3	Confident	80.6	Confident	26 Å²	26	85.3 Å²	85.3	14%	0.136	45%	0.453	C	S	.	.	S	Bend	trans	-69.9	155.2	175.4	-83.6	126.5	0	0	0	112.8	F506 W576 V577 D584 R585	F506-L580 HydrophobicContact CD1-CD2 4.42Å; W576-L580 HydrophobicContact CD2-CD1 3.74Å; W576-L580 HydrophobicContact CE3-CD1 3.67Å; W576-L580 HydrophobicContact CH2-CD1 3.64Å; W576-L580 HydrophobicContact CZ2-CD1 3.75Å; W576-L580 HydrophobicContact CZ2-CD2 4.48Å; W576-L580 HydrophobicContact CZ3-CD1 3.6Å; W576-L580 WeakPolarHBondContact O-CD1 3.37Å; W576-L580 PolarHBondContact O-N 3.22Å; V577-L580 PolarHBondContact O-N 3.11Å; L580-D584 HydrophobicContact CB-CB 4.22Å; L580-D584 HydrophobicContact CD2-CB 3.41Å; L580-D584 VanDerWaalsContact CD2-CB 3.41Å; L580-D584 HydrophobicContact CG-CB 4.43Å; L580-R585 HydrophobicContact CB-CG 3.77Å; L580-R585 PolarHBondContact O-NE 3.4Å; L580-R585 PolarHBondContact O-NH2 3.05Å
581	S	81.9	Confident	80	Confident	40 Å²	40	81.8 Å²	81.8	28%	0.28	44%	0.438	S	S	.	.			trans	-58.8	154.8	173.3	80.7	0	0	0	0	110.8	Q583 D584 R585	S581-Q583 PolarHBondContact O-N 3.35Å; S581-D584 WeakPolarHBondContact CB-OD2 3.38Å; S581-D584 PolarHBondContact O-N 3.23Å; S581-D584 WeakPolarHBondContact OG-CB 3.43Å; S581-D584 PolarHBondContact OG-N 3.11Å; S581-D584 PolarHBondContact OG-OD2 3.33Å; S581-R585 WeakPolarHBondContact O-CB 3.38Å; S581-R585 WeakPolarHBondContact O-CG 3.22Å; S581-R585 PolarHBondContact O-N 3.06Å; S581-R585 PolarHBondContact O-NE 2.94Å
582	P	79.1	Confident	78.7	Confident	96 Å²	96	81.5 Å²	81.5	62%	0.623	43%	0.432	S	S	*	.	H	α-helix	trans	-56.4	-32.8	176.7	-25	34.5	0	0	0	113.5	A586	P582-A586 PolarHBondContact O-N 2.89Å
583	Q	70	Confident	77.7	Confident	152 Å²	152	78 Å²	78	71%	0.71	42%	0.422	S	S	*	.	H	α-helix	trans	-71.7	-47	177	-70.1	147	-24.5	0	0	111	S581 R585 A586 V587	S581-Q583 PolarHBondContact O-N 3.35Å; Q583-R585 VanDerWaalsContact C-N 3.33Å; Q583-R585 PolarHBondContact O-N 3.14Å; Q583-A586 WeakPolarHBondContact O-CB 3.44Å; Q583-A586 PolarHBondContact O-N 3.11Å; Q583-A586 VanDerWaalsContact O-N 3.16Å; Q583-V587 WeakPolarHBondContact O-CG2 3.39Å; Q583-V587 PolarHBondContact O-N 3.3Å; Q583-V587 VanDerWaalsContact O-N 3.11Å
584	D	76.1	Confident	76.6	Confident	76 Å²	76	79 Å²	79	41%	0.406	43%	0.432	S	S	.	.	H	α-helix	trans	-69.8	-31	179.6	-58.4	-41.4	0	0	0	112.6	L580 S581 A586 V587 Y588	L580-D584 HydrophobicContact CB-CB 4.22Å; L580-D584 HydrophobicContact CD2-CB 3.41Å; L580-D584 VanDerWaalsContact CD2-CB 3.41Å; L580-D584 HydrophobicContact CG-CB 4.43Å; S581-D584 WeakPolarHBondContact CB-OD2 3.38Å; S581-D584 PolarHBondContact O-N 3.23Å; S581-D584 WeakPolarHBondContact OG-CB 3.43Å; S581-D584 PolarHBondContact OG-N 3.11Å; S581-D584 PolarHBondContact OG-OD2 3.33Å; D584-A586 VanDerWaalsContact C-N 3.34Å; D584-V587 PolarHBondContact O-N 3.3Å; D584-Y588 VanDerWaalsContact O-CB 3.3Å; D584-Y588 WeakPolarHBondContact O-CB 3.36Å; D584-Y588 PolarHBondContact O-N 2.82Å
585	R	77.3	Confident	75.1	Confident	98 Å²	98	78.7 Å²	78.7	37%	0.37	43%	0.429	S	S	.	.	H	α-helix	trans	-62	-40.2	170.9	-83.8	-176.1	-87	178.9	-7.8	112.2	V577 L580 S581 Q583 K589	V577-R585 HydrophobicContact CG1-CG 4.44Å; V577-R585 WeakPolarHBondContact O-CD 3.39Å; V577-R585 WeakPolarHBondContact O-CG 3.5Å; L580-R585 HydrophobicContact CB-CG 3.77Å; L580-R585 PolarHBondContact O-NE 3.4Å; L580-R585 PolarHBondContact O-NH2 3.05Å; S581-R585 WeakPolarHBondContact O-CB 3.38Å; S581-R585 WeakPolarHBondContact O-CG 3.22Å; S581-R585 PolarHBondContact O-N 3.06Å; S581-R585 PolarHBondContact O-NE 2.94Å; Q583-R585 VanDerWaalsContact C-N 3.33Å; Q583-R585 PolarHBondContact O-N 3.14Å; R585-K589 VanDerWaalsContact O-CB 3.27Å; R585-K589 WeakPolarHBondContact O-CB 3.19Å; R585-K589 PolarHBondContact O-N 2.89Å
586	A	75.6	Confident	73.1	Confident	57 Å²	57	85.1 Å²	85.1	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-66.6	-46	177.3	0	0	0	0	0	110.7	P582 Q583 D584 Y588 K589 E590	P582-A586 PolarHBondContact O-N 2.89Å; Q583-A586 WeakPolarHBondContact O-CB 3.44Å; Q583-A586 PolarHBondContact O-N 3.11Å; Q583-A586 VanDerWaalsContact O-N 3.16Å; D584-A586 VanDerWaalsContact C-N 3.34Å; A586-Y588 PolarHBondContact O-N 3.43Å; A586-K589 PolarHBondContact O-N 3.23Å; A586-E590 WeakPolarHBondContact O-CB 3.48Å; A586-E590 PolarHBondContact O-N 2.62Å
587	V	77.1	Confident	71	Confident	73 Å²	73	91.9 Å²	91.9	44%	0.442	47%	0.465	S	S	.	.	H	α-helix	trans	-61.2	-43.4	175.7	177	0	0	0	0	111.4	Q583 D584 E590 F591	Q583-V587 WeakPolarHBondContact O-CG2 3.39Å; Q583-V587 PolarHBondContact O-N 3.3Å; Q583-V587 VanDerWaalsContact O-N 3.11Å; D584-V587 PolarHBondContact O-N 3.3Å; V587-E590 PolarHBondContact O-N 2.96Å; V587-F591 WeakPolarHBondContact O-CB 3.48Å; V587-F591 PolarHBondContact O-N 3.23Å
588	Y	77.3	Confident	68.7	Low	30 Å²	30	94.2 Å²	94.2	12%	0.118	48%	0.483	C	S	.	.	H	α-helix	trans	-65.1	-40.1	176.5	-173.4	-93.8	0	0	0	112.4	F506 W576 V577 D584 A586 F591 S592	F506-Y588 HydrophobicContact CD1-CD2 4.21Å; F506-Y588 AromaticContact CD2-CD2 3.76Å; F506-Y588 HydrophobicContact CD2-CD2 3.76Å; F506-Y588 HydrophobicContact CD2-CE2 4.04Å; F506-Y588 AromaticContact CE1-CD2 3.96Å; F506-Y588 HydrophobicContact CE1-CD2 3.96Å; F506-Y588 AromaticContact CE2-CD2 3.49Å; F506-Y588 HydrophobicContact CE2-CD2 3.49Å; F506-Y588 VanDerWaalsContact CE2-CD2 3.49Å; F506-Y588 HydrophobicContact CE2-CE2 4.03Å; F506-Y588 HydrophobicContact CG-CD2 4.13Å; F506-Y588 AromaticContact CZ-CD2 3.61Å; F506-Y588 HydrophobicContact CZ-CD2 3.61Å; F506-Y588 HydrophobicContact CZ-CG 4.31Å; W576-Y588 AromaticContact CH2-CD2 3.98Å; W576-Y588 HydrophobicContact CH2-CD2 3.98Å; W576-Y588 AromaticContact CH2-CE2 3.9Å; W576-Y588 HydrophobicContact CH2-CE2 3.9Å; W576-Y588 AromaticContact CZ3-CD2 3.81Å; W576-Y588 HydrophobicContact CZ3-CD2 3.81Å; W576-Y588 HydrophobicContact CZ3-CE1 4.43Å; W576-Y588 AromaticContact CZ3-CE2 3.51Å; W576-Y588 HydrophobicContact CZ3-CE2 3.51Å; W576-Y588 HydrophobicContact CZ3-CG 4.42Å; W576-Y588 AromaticContact CZ3-CZ 3.86Å; V577-Y588 HydrophobicContact CG2-CD1 3.72Å; V577-Y588 HydrophobicContact CG2-CE1 3.48Å; V577-Y588 VanDerWaalsContact CG2-CE1 3.48Å; D584-Y588 VanDerWaalsContact O-CB 3.3Å; D584-Y588 WeakPolarHBondContact O-CB 3.36Å; D584-Y588 PolarHBondContact O-N 2.82Å; A586-Y588 PolarHBondContact O-N 3.43Å; Y588-F591 PolarHBondContact O-N 3.25Å; Y588-S592 VanDerWaalsContact O-CB 3.25Å; Y588-S592 WeakPolarHBondContact O-CB 3.48Å; Y588-S592 PolarHBondContact O-N 3.48Å; Y588-S592 PolarHBondContact O-OG 3.44Å
589	K	76.6	Confident	66.4	Low	158 Å²	158	91 Å²	91	69%	0.687	48%	0.482	S	S	*	.	H	α-helix	trans	-67.7	-38.4	177.5	-168.6	177.7	-179.3	-176.2	0	111.8	R585 A586 S592 S593	R585-K589 VanDerWaalsContact O-CB 3.27Å; R585-K589 WeakPolarHBondContact O-CB 3.19Å; R585-K589 PolarHBondContact O-N 2.89Å; A586-K589 PolarHBondContact O-N 3.23Å; K589-S592 WeakPolarHBondContact CA-OG 3.36Å; K589-S592 PolarHBondContact O-OG 3.25Å; K589-S593 VanDerWaalsContact O-CB 3.23Å; K589-S593 WeakPolarHBondContact O-CB 3.42Å; K589-S593 PolarHBondContact O-N 3.03Å; K589-S593 PolarHBondContact O-OG 2.97Å
590	E	76.8	Confident	64.2	Low	133 Å²	133	90.2 Å²	90.2	62%	0.621	47%	0.471	S	S	*	.	H	α-helix	trans	-68.2	-42.3	175.1	-171.9	172.2	-169.2	0	0	111.8	A586 V587 S593 S594	A586-E590 WeakPolarHBondContact O-CB 3.48Å; A586-E590 PolarHBondContact O-N 2.62Å; V587-E590 PolarHBondContact O-N 2.96Å; E590-S593 WeakPolarHBondContact CA-OG 3.33Å; E590-S593 PolarHBondContact O-OG 3.26Å; E590-S593 VanDerWaalsContact O-OG 3.05Å; E590-S594 VanDerWaalsContact O-CB 3.25Å; E590-S594 WeakPolarHBondContact O-CB 3.4Å; E590-S594 PolarHBondContact O-N 2.9Å; E590-S594 PolarHBondContact O-OG 2.92Å
591	F	70.4	Confident	61.9	Low	56 Å²	56	93.7 Å²	93.7	25%	0.246	50%	0.498	C	S	.	.	H	α-helix	trans	-67.7	-44.2	176.7	-172.7	-101.9	0	0	0	112.6	K503 P504 F506 V587 Y588 S594 K595	K503-F591 HydrophobicContact CB-CZ 4.46Å; P504-F591 VanDerWaalsContact CD-CE2 3.47Å; P504-F591 HydrophobicContact CG-CD2 4.1Å; P504-F591 HydrophobicContact CG-CE2 4.02Å; P504-F591 HydrophobicContact CG-CG 4.46Å; P504-F591 HydrophobicContact CG-CZ 4.31Å; F506-F591 HydrophobicContact CE2-CD1 4.4Å; V587-F591 WeakPolarHBondContact O-CB 3.48Å; V587-F591 PolarHBondContact O-N 3.23Å; Y588-F591 PolarHBondContact O-N 3.25Å; F591-S594 PolarHBondContact O-N 3.5Å; F591-K595 PolarHBondContact O-N 3.46Å; F591-K595 VanDerWaalsContact O-N 3.14Å
592	S	61.5	Low	59.7	Low	46 Å²	46	100.3 Å²	100.3	32%	0.322	52%	0.522	S	S	.	.	H	α-helix	trans	-69.1	-33.9	178.4	59.3	0	0	0	0	113.2	Y588 K589 R596	Y588-S592 VanDerWaalsContact O-CB 3.25Å; Y588-S592 WeakPolarHBondContact O-CB 3.48Å; Y588-S592 PolarHBondContact O-N 3.48Å; Y588-S592 PolarHBondContact O-OG 3.44Å; K589-S592 WeakPolarHBondContact CA-OG 3.36Å; K589-S592 PolarHBondContact O-OG 3.25Å; S592-R596 PolarHBondContact O-N 3.32Å
593	S	61.9	Low	57.4	Low	53 Å²	53	99.3 Å²	99.3	37%	0.371	52%	0.521	S	S	.	.	H	α-helix	trans	-74.5	-35.8	173.9	57	0	0	0	0	112.8	K589 E590 K595 R596 R597	K589-S593 VanDerWaalsContact O-CB 3.23Å; K589-S593 WeakPolarHBondContact O-CB 3.42Å; K589-S593 PolarHBondContact O-N 3.03Å; K589-S593 PolarHBondContact O-OG 2.97Å; E590-S593 WeakPolarHBondContact CA-OG 3.33Å; E590-S593 PolarHBondContact O-OG 3.26Å; E590-S593 VanDerWaalsContact O-OG 3.05Å; S593-K595 VanDerWaalsContact C-N 3.27Å; S593-K595 PolarHBondContact O-N 2.84Å; S593-R596 PolarHBondContact O-N 2.95Å; S593-R596 VanDerWaalsContact O-N 3.07Å; S593-R597 PolarHBondContact O-N 3.24Å
594	S	57.2	Low	55.5	Low	57 Å²	57	99.2 Å²	99.2	40%	0.399	53%	0.531	S	S	.	.	H	α-helix	trans	-61.8	-34.9	172.3	-65.3	0	0	0	0	112.3	E590 F591 R596 R597 S598	E590-S594 VanDerWaalsContact O-CB 3.25Å; E590-S594 WeakPolarHBondContact O-CB 3.4Å; E590-S594 PolarHBondContact O-N 2.9Å; E590-S594 PolarHBondContact O-OG 2.92Å; F591-S594 PolarHBondContact O-N 3.5Å; S594-R596 VanDerWaalsContact C-N 3.31Å; S594-R596 PolarHBondContact O-N 3.35Å; S594-R597 PolarHBondContact O-N 3.37Å; S594-S598 PolarHBondContact O-N 2.84Å
595	K	52.1	Low	53.5	Low	110 Å²	110	101.9 Å²	101.9	48%	0.478	55%	0.55	S	S	.	*	H	α-helix	trans	-67.3	-27.9	173.3	-165.8	166.6	-173.3	151.9	0	113.8	F591 S593 S598 S599	F591-K595 PolarHBondContact O-N 3.46Å; F591-K595 VanDerWaalsContact O-N 3.14Å; S593-K595 VanDerWaalsContact C-N 3.27Å; S593-K595 PolarHBondContact O-N 2.84Å; K595-S598 PolarHBondContact O-OG 3.4Å; K595-S599 PolarHBondContact O-OG 3.42Å
596	R	43.7	Very low	51.2	Low	196 Å²	196	102.4 Å²	102.4	74%	0.74	57%	0.569	S	S	*	*	H	α-helix	trans	-80.2	-31.7	172.3	-62.9	-177	81.3	-178.6	4.2	111.7	S592 S593 S594 S599 S600	S592-R596 PolarHBondContact O-N 3.32Å; S593-R596 PolarHBondContact O-N 2.95Å; S593-R596 VanDerWaalsContact O-N 3.07Å; S594-R596 VanDerWaalsContact C-N 3.31Å; S594-R596 PolarHBondContact O-N 3.35Å; R596-S599 WeakPolarHBondContact CA-OG 3.44Å; R596-S599 PolarHBondContact O-N 2.82Å; R596-S599 PolarHBondContact O-OG 3.34Å; R596-S600 PolarHBondContact O-N 3.21Å; R596-S600 PolarHBondContact O-OG 3.46Å
597	R	42.4	Very low	49.5	Very low	181 Å²	181	105.6 Å²	105.6	68%	0.683	59%	0.585	S	S	*	*	H	α-helix	trans	-71.2	-35.9	173.3	-76.6	176.3	66.3	-173.3	0.6	113.2	S593 S594 S599 S600 S601	S593-R597 PolarHBondContact O-N 3.24Å; S594-R597 PolarHBondContact O-N 3.37Å; R597-S599 PolarHBondContact O-N 2.86Å; R597-S600 WeakPolarHBondContact CA-OG 3.49Å; R597-S600 CarbonylContact O-C 3.57Å; R597-S600 PolarHBondContact O-N 3.43Å; R597-S600 PolarHBondContact O-OG 2.85Å; R597-S601 PolarHBondContact O-N 3.36Å
598	S	35.2	Very low	47.3	Very low	88 Å²	88	108.7 Å²	108.7	62%	0.615	60%	0.603	S	S	*	*	H	α-helix	trans	-70.4	-21.6	174.7	80.1	0	0	0	0	113	S594 K595	S594-S598 PolarHBondContact O-N 2.84Å; K595-S598 PolarHBondContact O-OG 3.4Å
599	S	37.1	Very low	45.1	Very low	99 Å²	99	111.4 Å²	111.4	69%	0.692	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-11.7	166.6	57.5	0	0	0	0	114.3	K595 R596 R597	K595-S599 PolarHBondContact O-OG 3.42Å; R596-S599 WeakPolarHBondContact CA-OG 3.44Å; R596-S599 PolarHBondContact O-N 2.82Å; R596-S599 PolarHBondContact O-OG 3.34Å; R597-S599 PolarHBondContact O-N 2.86Å
600	S	37.8	Very low	43	Very low	70 Å²	70	114 Å²	114	49%	0.49	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.9	1.1	-179.7	79.2	0	0	0	0	114.2	R596 R597 K602	R596-S600 PolarHBondContact O-N 3.21Å; R596-S600 PolarHBondContact O-OG 3.46Å; R597-S600 WeakPolarHBondContact CA-OG 3.49Å; R597-S600 CarbonylContact O-C 3.57Å; R597-S600 PolarHBondContact O-N 3.43Å; R597-S600 PolarHBondContact O-OG 2.85Å; S600-K602 PolarHBondContact O-N 2.93Å; S600-K602 VanDerWaalsContact O-N 3.12Å
601	S	32.5	Very low	40.6	Very low	99 Å²	99	113.9 Å²	113.9	69%	0.692	65%	0.651	S	S	*	*			trans	-79.2	19.7	176.7	63.1	0	0	0	0	113.6	R597	R597-S601 PolarHBondContact O-N 3.36Å
602	K	35.6	Very low	38.6	Very low	179 Å²	179	122.5 Å²	122.5	78%	0.778	68%	0.682	S	S	*	*	S	Bend	trans	-110.1	58.1	160.5	-134.9	-176.5	-173.5	-169.3	0	108.7	S600	S600-K602 PolarHBondContact O-N 2.93Å; S600-K602 VanDerWaalsContact O-N 3.12Å
603	A	30.8	Very low	37.1	Very low	74 Å²	74	126.9 Å²	126.9	61%	0.612	71%	0.707	S	S	*	*			trans	-154	90.2	167.1	0	0	0	0	0	107.8	V605	A603-V605 PolarHBondContact O-N 3Å
604	T	30.7	Very low	35.6	Very low	150 Å²	150	130.5 Å²	130.5	92%	0.92	73%	0.727	S	S	*	*			trans	-66.4	115.9	164.7	40.3	0	0	0	0	108.6
605	V	34.3	Very low	34.4	Very low	133 Å²	133	133 Å²	133	81%	0.806	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-98.9	121.5	165.1	176.3	0	0	0	0	107.3	A603	A603-V605 PolarHBondContact O-N 3Å
606	S	28.7	Very low	33.3	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-102.8	146.1	154.4	-70.5	0	0	0	0	108.7
607	P	39.6	Very low	32.6	Very low	124 Å²	124	132 Å²	132	81%	0.805	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-87.9	134.4	-168.9	34.3	-30.8	0	0	0	111
608	V	31.7	Very low	31.9	Very low	138 Å²	138	132.6 Å²	132.6	84%	0.836	78%	0.778	S	S	*	*			trans	-111.6	117.7	166.7	169.2	0	0	0	0	109.4
609	A	31	Very low	31.6	Very low	87 Å²	87	134.5 Å²	134.5	72%	0.719	79%	0.786	S	S	*	*			trans	-64.9	135.3	171.1	0	0	0	0	0	111
610	K	30.9	Very low	31.2	Very low	212 Å²	212	133.4 Å²	133.4	92%	0.922	79%	0.79	S	S	*	*			trans	-86.4	110.7	172.1	-74.8	178	176.8	167.7	0	109.6
611	V	28.3	Very low	30.7	Very low	130 Å²	130	133.6 Å²	133.6	79%	0.788	80%	0.803	S	S	*	*			trans	-93.1	125	163.4	174.3	0	0	0	0	108.7
612	R	28	Very low	30.6	Very low	238 Å²	238	133.8 Å²	133.8	90%	0.898	81%	0.81	S	S	*	*			trans	-70.4	134	168.7	-95.6	177.1	168	175.5	-3.2	109.5
613	V	30.4	Very low	30.3	Very low	137 Å²	137	136.9 Å²	136.9	83%	0.83	82%	0.817	S	S	*	*			trans	-133	128.5	151.9	-179.9	0	0	0	0	109.3
614	T	30.1	Very low	30.1	Very low	130 Å²	130	137.4 Å²	137.4	80%	0.798	82%	0.821	S	S	*	*			trans	-79.1	137.9	176.4	47	0	0	0	0	111.4
615	A	30.3	Very low	30.1	Very low	110 Å²	110	137 Å²	137	91%	0.909	82%	0.818	S	S	*	*			trans	-152.5	129.1	147.8	0	0	0	0	0	110.1
616	K	29.8	Very low	30	Very low	217 Å²	217	136.5 Å²	136.5	94%	0.943	82%	0.816	S	S	*	*			trans	-121.2	136.9	-175.8	175	-177.1	-179	176.6	0	107.4
617	G	28.6	Very low	30.7	Very low	66 Å²	66	137.2 Å²	137.2	68%	0.68	82%	0.818	S	S	*	*			trans	156	99.7	161.3	0	0	0	0	0	111.6
618	K	28.3	Very low	30.1	Very low	195 Å²	195	135.1 Å²	135.1	85%	0.848	82%	0.819	S	S	*	*				82.2	131.9	72.7	-174.9	151.7	-179.3	-180	0	109.8
619	V	29.7	Very low	30	Very low	128 Å²	128	135.2 Å²	135.2	78%	0.776	82%	0.82	S	S	*	*			cis	-150.3	146.5	18.5	-155.6	0	0	0	0	106.7
620	G	27.3	Very low	29.8	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	82%	0.82	S	S	*	*				110.8	140.4	98.7	0	0	0	0	0	110.7
621	G	27.6	Very low	29.7	Very low	74 Å²	74	131.9 Å²	131.9	76%	0.763	82%	0.817	S	S	*	*			cis	164.5	136.1	-1.4	0	0	0	0	0	108.3
622	A	31	Very low	29.7	Very low	102 Å²	102	129.3 Å²	129.3	84%	0.843	82%	0.817	S	S	*	*			trans	63.8	150	159.9	0	0	0	0	0	117.9
623	R	29.6	Very low	29.8	Very low	245 Å²	245	127.4 Å²	127.4	93%	0.925	82%	0.815	S	S	*	*			cis	-164.2	168.5	12.5	-149.2	169.7	157.7	-162.4	-6.4	109.8
624	A	27	Very low	29.8	Very low	84 Å²	84	132.7 Å²	132.7	69%	0.694	82%	0.82	S	S	*	*			trans	-61.5	167.3	-172.4	0	0	0	0	0	118.9
625	V	29.7	Very low	29.6	Very low	141 Å²	141	131.3 Å²	131.3	86%	0.855	82%	0.821	S	S	*	*				178.2	160	114.1	157.1	0	0	0	0	110.2
626	T	32.8	Very low	29.8	Very low	124 Å²	124	135 Å²	135	76%	0.761	82%	0.822	S	S	*	*			trans	-98.4	-155.3	-147.8	55.9	0	0	0	0	114.8
627	P	42.2	Very low	29.8	Very low	124 Å²	124	129.2 Å²	129.2	81%	0.805	82%	0.815	S	S	*	*				-117.8	170.9	-119	28.4	-3.4	0	0	0	114.3
628	G	27.7	Very low	29.6	Very low	80 Å²	80	136.1 Å²	136.1	83%	0.825	82%	0.822	S	S	*	*			trans	-146.4	127.3	174.5	0	0	0	0	0	112.4
629	V	29.2	Very low	29.5	Very low	140 Å²	140	138.2 Å²	138.2	85%	0.848	82%	0.824	S	S	*	*			trans	-97.9	145.5	-169.8	167.9	0	0	0	0	111.5
630	A	27.4	Very low	29.7	Very low	89 Å²	89	136 Å²	136	74%	0.736	82%	0.819	S	S	*	*			trans	155.8	105.3	139.1	0	0	0	0	0	109.9
631	V	29	Very low	30	Very low	140 Å²	140	141.4 Å²	141.4	85%	0.848	82%	0.821	S	S	*	*				61.1	116.8	83.2	-178.5	0	0	0	0	114.5
632	G	28.1	Very low	29.9	Very low	76 Å²	76	146.7 Å²	146.7	78%	0.784	83%	0.826	S	S	*	*			trans	175.3	74.1	171.9	0	0	0	0	0	117.8
633	K	30.8	Very low	30	Very low	197 Å²	197	147.8 Å²	147.8	86%	0.857	82%	0.818	S	S	*	*			trans	-23.7	137.7	168	-64.7	165.4	178.8	174	0	121
634	R	29.1	Very low	29.7	Very low	249 Å²	249	144.7 Å²	144.7	94%	0.94	82%	0.816	S	S	*	*				41.8	124.1	122	-172.3	-172.2	-103	-179.3	-5.3	119.7
635	A	26.2	Very low	29.9	Very low	100 Å²	100	146.1 Å²	146.1	83%	0.826	82%	0.821	S	S	*	*			trans	-168.1	134.1	130.9	0	0	0	0	0	113.7
636	M	35.3	Very low	29.6	Very low	189 Å²	189	146.6 Å²	146.6	93%	0.931	82%	0.819	S	S	*	*			trans	-73.3	150.8	161.3	-85.9	-102.3	-141.8	0	0	110.6
637	A	29	Very low	29.4	Very low	95 Å²	95	145.1 Å²	145.1	79%	0.785	81%	0.813	S	S	*	*			trans	-154.9	122.8	147.8	0	0	0	0	0	112
638	Y	25.3	Very low	28.7	Very low	210 Å²	210	146.1 Å²	146.1	82%	0.824	81%	0.812	S	S	*	*			trans	-65.7	153.8	163	69.5	-76.2	0	0	0	110.9
639	R	26.5	Very low	28.7	Very low	239 Å²	239	151.3 Å²	151.3	90%	0.902	82%	0.815	S	S	*	*			trans	-155.3	129.1	138	-157.8	166.3	-174.4	127.7	-2	110.9
640	A	33	Very low	28.8	Very low	81 Å²	81	152.6 Å²	152.6	67%	0.669	81%	0.811	S	S	*	*			trans	-97.5	153.1	-178.9	0	0	0	0	0	111.8
641	K	33.7	Very low	28.8	Very low	190 Å²	190	157.4 Å²	157.4	83%	0.826	82%	0.819	S	S	*	*			trans	37.1	138	143.4	-67	-156	173.5	-169.9	0	121.8
642	Q	26.1	Very low	28.8	Very low	186 Å²	186	158.2 Å²	158.2	87%	0.869	81%	0.813	S	S	*	*			trans	-146	132.7	132.6	-144.1	161	17.8	0	0	111.5
643	D	31.3	Very low	28.7	Very low	124 Å²	124	163.5 Å²	163.5	66%	0.663	81%	0.814	S	S	*	*			trans	-68.9	156.3	172	-90.8	-64.3	0	0	0	112.6
644	M	25.3	Very low	28.5	Very low	181 Å²	181	159.8 Å²	159.8	89%	0.892	81%	0.813	S	S	*	*			trans	-144.2	132.2	138	-74.3	-56.4	168.7	0	0	109.6
645	S	30.1	Very low	28.4	Very low	113 Å²	113	151.7 Å²	151.7	79%	0.79	81%	0.808	S	S	*	*			trans	-100.7	142.4	176.9	165.6	0	0	0	0	108.6
646	D	24.3	Very low	28.4	Very low	152 Å²	152	152.1 Å²	152.1	81%	0.813	80%	0.804	S	S	*	*			trans	-163.9	147.2	136.1	-137.5	-1.4	0	0	0	115.7
647	S	27.2	Very low	28.1	Very low	92 Å²	92	148.2 Å²	148.2	64%	0.643	80%	0.796	S	S	*	*			trans	6.2	138.9	168	-89.7	0	0	0	0	127.3
648	D	28.7	Very low	27.9	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	80%	0.799	S	S	*	*				25.9	130.2	127.1	-86.6	-51.9	0	0	0	120.8
649	E	27.7	Very low	28.2	Very low	189 Å²	189	145.4 Å²	145.4	88%	0.883	79%	0.789	S	S	*	*				-171	133	114.6	-99.9	176.8	-163.3	0	0	111.6
650	E	30.5	Very low	28.3	Very low	167 Å²	167	141.4 Å²	141.4	78%	0.78	79%	0.786	S	S	*	*			trans	-62.3	152	164.2	-64.3	-98.4	155.7	0	0	110.4
651	E	28.5	Very low	28.1	Very low	190 Å²	190	145.5 Å²	145.5	89%	0.888	79%	0.791	S	S	*	*			trans	-162.3	145.9	147.8	-93.8	-96.3	176.2	0	0	110.4
652	E	27	Very low	27.9	Very low	157 Å²	157	143.2 Å²	143.2	73%	0.734	79%	0.788	S	S	*	*			trans	-99.4	163.7	-163.1	-87.3	-98.6	-175.3	0	0	111.8
653	K	26.6	Very low	28	Very low	187 Å²	187	141.7 Å²	141.7	81%	0.813	79%	0.785	S	S	*	*			trans	72.5	123.6	139.6	-165.3	177.8	-170	176.6	0	121.7
654	S	26.9	Very low	28	Very low	119 Å²	119	143.7 Å²	143.7	83%	0.832	79%	0.791	S	S	*	*			trans	143.3	135	130.8	60.9	0	0	0	0	109.9
655	G	27.1	Very low	28.1	Very low	80 Å²	80	141 Å²	141	83%	0.825	79%	0.785	S	S	*	*			cis	99.6	65.6	21.6	0	0	0	0	0	111.2
656	S	25.3	Very low	28.2	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	79%	0.785	S	S	*	*			trans	-156.8	110	162	-146.8	0	0	0	0	104.6
657	S	30	Very low	28.2	Very low	108 Å²	108	137.8 Å²	137.8	76%	0.755	79%	0.787	S	S	*	*			cis	43.5	87	49.7	-155.6	0	0	0	0	111.2
658	D	25.5	Very low	28.2	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	80%	0.797	S	S	*	*			trans	-141.2	132.8	135.6	-128	-28.9	0	0	0	109.5
659	S	30.7	Very low	28.3	Very low	88 Å²	88	137.3 Å²	137.3	62%	0.615	80%	0.795	S	S	*	*			trans	-100.9	141.6	-179.1	-66	0	0	0	0	107.7
660	D	28.6	Very low	28.3	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	79%	0.789	S	S	*	*			trans	-164.1	96.3	152.2	-85	-41.4	0	0	0	104.7
661	E	29.5	Very low	28.2	Very low	166 Å²	166	131.7 Å²	131.7	78%	0.776	78%	0.784	S	S	*	*				57.8	103.3	90.4	-64.8	-159.6	170.9	0	0	114
662	D	29.5	Very low	28.3	Very low	143 Å²	143	131 Å²	131	77%	0.765	78%	0.781	S	S	*	*			trans	52.3	117	137.7	-51	-29.7	0	0	0	121.2
663	D	27.5	Very low	28.4	Very low	154 Å²	154	131.2 Å²	131.2	82%	0.824	79%	0.787	S	S	*	*				-147.4	124.5	128.3	-150.4	-24.2	0	0	0	111.3
664	E	30.6	Very low	28.7	Very low	166 Å²	166	130.3 Å²	130.3	78%	0.776	79%	0.786	S	S	*	*			trans	-89.9	114.9	-179.1	-77.8	-89	174.5	0	0	109.1
665	T	29	Very low	29.1	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	79%	0.79	S	S	*	*			trans	-144.3	112.2	154.7	62.6	0	0	0	0	113
666	S	30.8	Very low	29.5	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	79%	0.79	S	S	*	*			trans	11.4	128	143.3	59	0	0	0	0	117.7
667	G	25.9	Very low	29.7	Very low	82 Å²	82	140.1 Å²	140.1	85%	0.845	80%	0.796	S	S	*	*			cis	117.1	104.8	48.2	0	0	0	0	0	108.7
668	S	26.7	Very low	29.8	Very low	124 Å²	124	142.1 Å²	142.1	87%	0.867	80%	0.798	S	S	*	*			trans	-141.4	110.3	164.1	-172.8	0	0	0	0	109.3	D670	S668-D670 PolarHBondContact O-N 3.16Å
669	S	29.9	Very low	30	Very low	103 Å²	103	141.8 Å²	141.8	72%	0.72	80%	0.796	S	S	*	*			trans	-60.4	118.7	177	-173.8	0	0	0	0	110.7
670	D	27.3	Very low	30	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	80%	0.802	S	S	*	*			trans	-88.1	106.4	166.6	-158.8	-116.5	0	0	0	106.4	S668	S668-D670 PolarHBondContact O-N 3.16Å
671	S	29.5	Very low	30.2	Very low	96 Å²	96	145.5 Å²	145.5	67%	0.671	80%	0.803	S	S	*	*			trans	-96.1	98.9	177.7	-68.5	0	0	0	0	108.6
672	E	29.6	Very low	30.4	Very low	176 Å²	176	146.2 Å²	146.2	82%	0.822	81%	0.806	S	S	*	*			trans	-77.3	107	160	-58.3	-175.1	136.8	0	0	106.7
673	D	29.9	Very low	30.7	Very low	160 Å²	160	148 Å²	148	86%	0.856	81%	0.81	S	S	*	*			trans	-91.9	125.1	171.7	-102.5	-47.6	0	0	0	109.1
674	E	33.1	Very low	30.9	Very low	169 Å²	169	148.4 Å²	148.4	79%	0.79	81%	0.812	S	S	*	*			trans	-75.4	141.1	179.4	-60.7	-172.2	142.3	0	0	110.9	E676	E674-E676 PolarHBondContact O-N 3.18Å
675	D	35.5	Very low	31	Very low	171 Å²	171	148.3 Å²	148.3	91%	0.914	82%	0.817	S	S	*	*			trans	-71.9	98.1	170.5	-70.4	-58.3	0	0	0	109.7
676	E	34.3	Very low	31.1	Very low	179 Å²	179	150 Å²	150	84%	0.836	82%	0.821	S	S	*	*			trans	-97.9	112.2	163.7	-76.2	-171.6	158.9	0	0	110.2	E674	E674-E676 PolarHBondContact O-N 3.18Å
677	N	31.4	Very low	31.3	Very low	163 Å²	163	153.3 Å²	153.3	87%	0.872	82%	0.824	S	S	*	*			trans	-70.9	119.6	161.3	-80.9	-50.9	0	0	0	108
678	D	30.3	Very low	31.4	Very low	149 Å²	149	155 Å²	155	80%	0.797	82%	0.824	S	S	*	*			trans	-89.4	108	166.2	-135.7	-7.1	0	0	0	107.1
679	D	31.3	Very low	31.7	Very low	151 Å²	151	154.8 Å²	154.8	81%	0.807	82%	0.822	S	S	*	*			trans	-88.6	107.2	166.8	-117.2	-35.6	0	0	0	106.1	E681	D679-E681 PolarHBondContact O-N 3.18Å
680	D	30.6	Very low	31.8	Very low	141 Å²	141	153.5 Å²	153.5	75%	0.754	81%	0.813	S	S	*	*			trans	-73.9	100.6	172.8	-78.9	-56.4	0	0	0	109.2
681	E	33	Very low	32.1	Very low	180 Å²	180	154.9 Å²	154.9	84%	0.841	82%	0.815	S	S	*	*			trans	-87.8	108.8	161.5	-73.2	-174	167.8	0	0	109	D679	D679-E681 PolarHBondContact O-N 3.18Å
682	E	32.9	Very low	32.2	Very low	181 Å²	181	158.7 Å²	158.7	85%	0.846	82%	0.822	S	S	*	*			trans	-83	112.2	167	-69.5	-89.9	172.8	0	0	108.1
683	E	35.4	Very low	32.4	Very low	181 Å²	181	155.6 Å²	155.6	85%	0.846	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-88.9	125.3	169.1	-83.2	-173.3	154.3	0	0	110.2
684	D	32.9	Very low	32.6	Very low	163 Å²	163	152.6 Å²	152.6	87%	0.872	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.9	127.3	173.1	-76.9	-53.5	0	0	0	111.9	D686	D684-D686 PolarHBondContact O-N 3.02Å
685	D	32.5	Very low	32.8	Very low	164 Å²	164	152.8 Å²	152.8	88%	0.877	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-65.4	119.7	162	-91.2	-55.7	0	0	0	109.7
686	D	31.3	Very low	33	Very low	158 Å²	158	151.7 Å²	151.7	85%	0.845	81%	0.805	S	S	*	*			trans	-144.7	146.1	153.8	-118.1	-29.7	0	0	0	113.3	D684	D684-D686 PolarHBondContact O-N 3.02Å
687	Q	34	Very low	33.3	Very low	185 Å²	185	149.6 Å²	149.6	86%	0.864	80%	0.8	S	S	*	*			trans	-77.1	144.9	-144.5	-59.1	-178.8	-40.4	0	0	115.7
688	S	29	Very low	34.1	Very low	119 Å²	119	146.7 Å²	146.7	83%	0.832	79%	0.792	S	S	*	*			trans	-69.4	126	162.5	179.5	0	0	0	0	111
689	S	31.4	Very low	34.8	Very low	119 Å²	119	150.8 Å²	150.8	83%	0.832	82%	0.815	S	S	*	*			trans	-135.2	117.3	150	-165.8	0	0	0	0	108.7
690	S	31.8	Very low	34.9	Very low	76 Å²	76	150.8 Å²	150.8	53%	0.531	82%	0.815	S	S	.	*			trans	-74.5	141	179	46	0	0	0	0	112.7
691	E	34.3	Very low	35.2	Very low	171 Å²	171	151.3 Å²	151.3	80%	0.799	82%	0.818	S	S	*	*			trans	68.6	134.6	134.4	-58.4	166	-153.5	0	0	115.3
692	E	31.7	Very low	35.3	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	82%	0.817	S	S	*	*				-176.5	141.9	51.1	50.3	-139.4	94.3	0	0	111.9
693	S	33.3	Very low	35.4	Very low	112 Å²	112	147.9 Å²	147.9	78%	0.783	82%	0.815	S	S	*	*			trans	43.7	138.1	141.2	-58.8	0	0	0	0	125.9
694	S	35.2	Very low	35.4	Very low	97 Å²	97	145.8 Å²	145.8	68%	0.678	81%	0.813	S	S	*	*			trans	84.3	110.7	136.2	54.2	0	0	0	0	121.7
695	E	37.7	Very low	35.6	Very low	173 Å²	173	144.7 Å²	144.7	81%	0.808	81%	0.809	S	S	*	*				65.8	128.7	119.3	-69.6	-174.8	116.5	0	0	122.2
696	L	38.7	Very low	35.8	Very low	147 Å²	147	143.3 Å²	143.3	77%	0.77	81%	0.805	S	S	*	*			trans	91.2	128.5	136.9	-72.4	159.3	0	0	0	121.4
697	D	40.9	Very low	36.2	Very low	135 Å²	135	142.2 Å²	142.2	72%	0.722	80%	0.801	S	S	*	*			trans	88.5	125.8	141.9	-120.7	-96.6	0	0	0	121.7
698	S	47.9	Very low	36.3	Very low	102 Å²	102	138.6 Å²	138.6	71%	0.713	80%	0.796	S	S	*	*			trans	19.4	137.1	142.1	-39.6	0	0	0	0	118.7
699	D	44.2	Very low	37	Very low	236 Å²	236	140.4 Å²	140.4	100%	1.262	79%	0.793	S	S	*	*				-160.1	0	51.9	-177.9	-111	0	0	0	109.6

Retrieved 699 of 699 residues in 648.9 ms (Link to these results)

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