TBC3D_HUMAN Loading...

TBC1 domain family member 3D

Acts as a GTPase activating protein for RAB5. Does not act on RAB4 or RAB11 (By similarity).

AlphaFold DB , UniProt , Accession A0A087WVF3, Species HUMAN (Homo sapiens, Human), Gene TBC1D3D, Length 549 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	56.3	Low	70	Confident	204 Å²	204	114.1 Å²	114.1	100%	1.005	62%	0.617	S	S	*	*				0	-35.3	0	-80.3	175	172.7	0	0	110.1	V3 V4	M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 2.82Å; M1-V3 VanDerWaalsContact O-N 3.16Å; M1-V4 PolarHBondContact O-N 3.24Å; M1-V4 VanDerWaalsContact O-N 3.16Å
2	D	60.8	Low	71.5	Confident	120 Å²	120	107.7 Å²	107.7	64%	0.642	59%	0.591	S	S	*	*	H	α-helix	trans	-50.3	-39	-179.9	-51	-11	0	0	0	116	V4 E5 V6	D2-V4 VanDerWaalsContact C-N 3.31Å; D2-V4 PolarHBondContact O-N 3.34Å; D2-E5 PolarHBondContact O-N 3.35Å; D2-V6 WeakPolarHBondContact O-CB 3.47Å; D2-V6 WeakPolarHBondContact O-CG2 3.03Å; D2-V6 PolarHBondContact O-N 3.18Å
3	V	63.5	Low	72.9	Confident	124 Å²	124	107.6 Å²	107.6	75%	0.752	58%	0.584	S	S	*	*	H	α-helix	trans	-64.3	-34.4	-177.2	-176.6	0	0	0	0	112.6	M1 A7	M1-V3 VanDerWaalsContact C-N 3.33Å; M1-V3 PolarHBondContact O-N 2.82Å; M1-V3 VanDerWaalsContact O-N 3.16Å; V3-A7 WeakPolarHBondContact O-CB 3.31Å; V3-A7 PolarHBondContact O-N 3.04Å; V3-A7 VanDerWaalsContact O-N 3.1Å
4	V	64.4	Low	74.1	Confident	116 Å²	116	103.9 Å²	103.9	70%	0.703	56%	0.561	S	S	*	*	H	α-helix	trans	-76.3	-38.9	-178.8	179.3	0	0	0	0	110.8	M1 D2 A7 G8	M1-V4 PolarHBondContact O-N 3.24Å; M1-V4 VanDerWaalsContact O-N 3.16Å; D2-V4 VanDerWaalsContact C-N 3.31Å; D2-V4 PolarHBondContact O-N 3.34Å; V4-A7 PolarHBondContact O-N 3.29Å; V4-G8 PolarHBondContact O-N 2.69Å
5	E	65.8	Low	75.3	Confident	144 Å²	144	100.4 Å²	100.4	67%	0.673	54%	0.536	S	S	*	.	H	α-helix	trans	-66.9	-42	175.6	-71.6	-172.6	159.6	0	0	111.8	D2 A7 G8 S9	D2-E5 PolarHBondContact O-N 3.35Å; E5-A7 PolarHBondContact O-N 3.15Å; E5-G8 PolarHBondContact O-N 2.84Å; E5-S9 WeakPolarHBondContact O-CB 3.45Å; E5-S9 PolarHBondContact O-N 3.25Å
6	V	68.4	Low	76.4	Confident	101 Å²	101	99.8 Å²	99.8	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-62.6	-43.7	176.3	173	0	0	0	0	110.9	D2 S9 W10	D2-V6 WeakPolarHBondContact O-CB 3.47Å; D2-V6 WeakPolarHBondContact O-CG2 3.03Å; D2-V6 PolarHBondContact O-N 3.18Å; V6-S9 PolarHBondContact O-N 3.49Å; V6-W10 PolarHBondContact O-N 3.39Å; V6-W10 VanDerWaalsContact O-N 3.08Å
7	A	69.4	Low	77.4	Confident	39 Å²	39	97.6 Å²	97.6	32%	0.322	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-47.2	175.8	0	0	0	0	0	111.5	V3 V4 E5 S9 W10 W11	V3-A7 WeakPolarHBondContact O-CB 3.31Å; V3-A7 PolarHBondContact O-N 3.04Å; V3-A7 VanDerWaalsContact O-N 3.1Å; V4-A7 PolarHBondContact O-N 3.29Å; E5-A7 PolarHBondContact O-N 3.15Å; A7-S9 VanDerWaalsContact C-N 3.33Å; A7-S9 PolarHBondContact O-N 2.58Å; A7-W10 PolarHBondContact O-N 3.5Å; A7-W11 PolarHBondContact O-N 2.92Å
8	G	74.1	Confident	78.2	Confident	42 Å²	42	92.4 Å²	92.4	43%	0.433	49%	0.491	S	S	.	.	H	α-helix	trans	-59.3	-40.7	178.6	0	0	0	0	0	113.5	V4 E5 A12	V4-G8 PolarHBondContact O-N 2.69Å; E5-G8 PolarHBondContact O-N 2.84Å; G8-A12 WeakPolarHBondContact O-CB 3.49Å; G8-A12 PolarHBondContact O-N 2.87Å; G8-A12 VanDerWaalsContact O-N 3.09Å
9	S	80.7	Confident	79.1	Confident	82 Å²	82	88.2 Å²	88.2	57%	0.573	47%	0.468	S	S	*	.	H	α-helix	trans	-63.7	-42.9	174.8	174.2	0	0	0	0	112.2	E5 V6 A7 A12 Q13	E5-S9 WeakPolarHBondContact O-CB 3.45Å; E5-S9 PolarHBondContact O-N 3.25Å; V6-S9 PolarHBondContact O-N 3.49Å; A7-S9 VanDerWaalsContact C-N 3.33Å; A7-S9 PolarHBondContact O-N 2.58Å; S9-A12 PolarHBondContact O-N 3.21Å; S9-Q13 PolarHBondContact O-N 3.41Å
10	W	82.6	Confident	79.8	Confident	148 Å²	148	87.6 Å²	87.6	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-64.8	-43.9	179	-168.6	80.9	0	0	0	112.4	V6 A7 A12 Q13 E14	V6-W10 PolarHBondContact O-N 3.39Å; V6-W10 VanDerWaalsContact O-N 3.08Å; A7-W10 PolarHBondContact O-N 3.5Å; W10-A12 VanDerWaalsContact C-N 3.32Å; W10-A12 PolarHBondContact O-N 3.21Å; W10-Q13 PolarHBondContact O-N 3.43Å; W10-E14 PolarHBondContact O-N 3.29Å
11	W	83.5	Confident	80.4	Confident	135 Å²	135	86.8 Å²	86.8	51%	0.511	46%	0.456	S	S	.	.	H	α-helix	trans	-63.1	-37.7	175.5	-65.5	117.4	0	0	0	112.5	A7 R15	A7-W11 PolarHBondContact O-N 2.92Å; W11-R15 WeakPolarHBondContact O-CB 3.45Å; W11-R15 PolarHBondContact O-N 3.43Å
12	A	87.9	Confident	82.2	Confident	37 Å²	37	77.1 Å²	77.1	31%	0.306	41%	0.408	S	S	.	.	H	α-helix	trans	-66.5	-41.2	176.4	0	0	0	0	0	112.1	G8 S9 W10 R15 E16	G8-A12 WeakPolarHBondContact O-CB 3.49Å; G8-A12 PolarHBondContact O-N 2.87Å; G8-A12 VanDerWaalsContact O-N 3.09Å; S9-A12 PolarHBondContact O-N 3.21Å; W10-A12 VanDerWaalsContact C-N 3.32Å; W10-A12 PolarHBondContact O-N 3.21Å; A12-R15 PolarHBondContact O-N 3.26Å; A12-E16 PolarHBondContact O-N 3.43Å
13	Q	89.9	Confident	83.6	Confident	107 Å²	107	75.2 Å²	75.2	50%	0.5	40%	0.395	S	S	.	.	H	α-helix	trans	-64.6	-47.4	177	-174.2	61.1	49.2	0	0	111.6	S9 W10 R15 E16 D17	S9-Q13 PolarHBondContact O-N 3.41Å; W10-Q13 PolarHBondContact O-N 3.43Å; Q13-R15 VanDerWaalsContact C-N 3.29Å; Q13-R15 PolarHBondContact O-N 3.05Å; Q13-E16 PolarHBondContact O-N 3.24Å; Q13-E16 VanDerWaalsContact O-N 3.15Å; Q13-D17 PolarHBondContact NE2-OD1 3.25Å; Q13-D17 PolarHBondContact O-N 3.02Å
14	E	89.5	Confident	84.8	Confident	56 Å²	56	75.6 Å²	75.6	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-64.1	-36.7	179.5	-173.6	61.3	-150.1	0	0	111.7	W10 D17 I18 Q143	W10-E14 PolarHBondContact O-N 3.29Å; E14-D17 PolarHBondContact O-N 3.4Å; E14-I18 HydrophobicContact CG-CD1 4.37Å; E14-I18 WeakPolarHBondContact O-CG1 3.25Å; E14-I18 PolarHBondContact O-N 3.39Å; E14-Q143 HydrophobicContact CG-CG 4.36Å; E14-Q143 VanDerWaalsContact CG-NE2 3.28Å
15	R	93.2	Very high	85.7	Confident	51 Å²	51	70.6 Å²	70.6	19%	0.192	36%	0.359	C	S	.	.	H	α-helix	trans	-59.2	-49.1	172.1	176	174.5	67.4	-130.4	-7.1	111.1	W11 A12 Q13 D17 I18 I19 K136 R137 S139 I142	W11-R15 WeakPolarHBondContact O-CB 3.45Å; W11-R15 PolarHBondContact O-N 3.43Å; A12-R15 PolarHBondContact O-N 3.26Å; Q13-R15 VanDerWaalsContact C-N 3.29Å; Q13-R15 PolarHBondContact O-N 3.05Å; R15-D17 VanDerWaalsContact C-N 3.32Å; R15-D17 PolarHBondContact O-N 3.12Å; R15-I18 PolarHBondContact O-N 3.22Å; R15-I19 WeakPolarHBondContact O-CG1 3.16Å; R15-I19 PolarHBondContact O-N 2.81Å; R15-K136 VanDerWaalsContact CD-O 3.32Å; R15-K136 WeakPolarHBondContact CD-O 3.45Å; R15-R137 PolarHBondContact NE-O 3.1Å; R15-R137 PolarHBondContact NH2-O 3.4Å; R15-S139 WeakPolarHBondContact CD-O 3.4Å; R15-I142 HydrophobicContact CB-CD1 4.48Å; R15-I142 HydrophobicContact CB-CG2 3.93Å; R15-I142 HydrophobicContact CG-CB 4.49Å; R15-I142 HydrophobicContact CG-CD1 3.7Å; R15-I142 HydrophobicContact CG-CG2 3.94Å
16	E	92.7	Very high	85.7	Confident	91 Å²	91	68.6 Å²	68.6	43%	0.425	35%	0.349	S	S	.	.	H	α-helix	trans	-61.1	-42.5	179	-168.5	59.6	-148	0	0	111.2	A12 Q13 I18 I19 M20	A12-E16 PolarHBondContact O-N 3.43Å; Q13-E16 PolarHBondContact O-N 3.24Å; Q13-E16 VanDerWaalsContact O-N 3.15Å; E16-I18 VanDerWaalsContact C-N 3.33Å; E16-I18 PolarHBondContact O-N 3.43Å; E16-I19 PolarHBondContact O-N 2.88Å; E16-M20 HydrophobicContact CG-CG 4.35Å; E16-M20 VanDerWaalsContact O-CB 3.29Å; E16-M20 WeakPolarHBondContact O-CB 3.05Å; E16-M20 VanDerWaalsContact O-CG 3.24Å; E16-M20 WeakPolarHBondContact O-CG 3.27Å; E16-M20 PolarHBondContact O-N 3.3Å
17	D	92.7	Very high	85.4	Confident	63 Å²	63	74.6 Å²	74.6	34%	0.337	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-39.8	177.5	-72.4	-2.8	0	0	0	112.2	Q13 E14 R15 K21	Q13-D17 PolarHBondContact NE2-OD1 3.25Å; Q13-D17 PolarHBondContact O-N 3.02Å; E14-D17 PolarHBondContact O-N 3.4Å; R15-D17 VanDerWaalsContact C-N 3.32Å; R15-D17 PolarHBondContact O-N 3.12Å; D17-K21 WeakPolarHBondContact O-CD 3.42Å; D17-K21 VanDerWaalsContact O-CG 3.26Å; D17-K21 WeakPolarHBondContact O-CG 3.18Å; D17-K21 PolarHBondContact O-N 3.21Å; D17-K21 VanDerWaalsContact O-N 3.12Å
18	I	93.1	Very high	84.7	Confident	4 Å²	4	74 Å²	74	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-65.9	-50.1	174.4	-68.3	167.6	0	0	0	110.6	E14 R15 E16 M20 K21 Y22 I142 Q143 D146	E14-I18 HydrophobicContact CG-CD1 4.37Å; E14-I18 WeakPolarHBondContact O-CG1 3.25Å; E14-I18 PolarHBondContact O-N 3.39Å; R15-I18 PolarHBondContact O-N 3.22Å; E16-I18 VanDerWaalsContact C-N 3.33Å; E16-I18 PolarHBondContact O-N 3.43Å; I18-M20 VanDerWaalsContact C-N 3.3Å; I18-M20 PolarHBondContact O-N 3.43Å; I18-K21 WeakPolarHBondContact O-CB 3.41Å; I18-K21 PolarHBondContact O-N 3.46Å; I18-K21 VanDerWaalsContact O-N 3.09Å; I18-Y22 HydrophobicContact CG2-CD2 4.13Å; I18-Y22 HydrophobicContact CG2-CE2 4.03Å; I18-Y22 WeakPolarHBondContact O-CD2 2.96Å; I18-Y22 PolarHBondContact O-N 2.95Å; I18-I142 HydrophobicContact CB-CD1 4.08Å; I18-I142 HydrophobicContact CB-CG1 4.47Å; I18-I142 HydrophobicContact CD1-CG2 4.37Å; I18-I142 HydrophobicContact CG2-CD1 3.85Å; I18-I142 HydrophobicContact CG2-CG1 3.97Å; I18-Q143 HydrophobicContact CD1-CB 4.5Å; I18-Q143 HydrophobicContact CD1-CG 3.86Å; I18-D146 HydrophobicContact CD1-CB 4.38Å; I18-D146 HydrophobicContact CG2-CB 4.01Å
19	I	93.8	Very high	83.5	Confident	12 Å²	12	74.2 Å²	74.2	6%	0.062	36%	0.358	C	S	.	.	H	α-helix	trans	-57.1	-46.7	178.5	-67.8	-59.7	0	0	0	110.5	R15 E16 K21 Y22 E23 K136 I142 L171 L175	R15-I19 WeakPolarHBondContact O-CG1 3.16Å; R15-I19 PolarHBondContact O-N 2.81Å; E16-I19 PolarHBondContact O-N 2.88Å; I19-K21 VanDerWaalsContact C-N 3.25Å; I19-K21 PolarHBondContact O-N 2.89Å; I19-Y22 PolarHBondContact O-N 2.94Å; I19-E23 HydrophobicContact CG2-CG 4.14Å; I19-E23 WeakPolarHBondContact O-CG 3.43Å; I19-E23 PolarHBondContact O-N 2.75Å; I19-K136 HydrophobicContact CD1-CB 4.14Å; I19-K136 HydrophobicContact CD1-CG 3.88Å; I19-K136 HydrophobicContact CG1-CB 4.43Å; I19-K136 HydrophobicContact CG2-CD 4.43Å; I19-I142 HydrophobicContact CD1-CD1 3.54Å; I19-I142 HydrophobicContact CG1-CD1 3.68Å; I19-L171 HydrophobicContact CD1-CD2 4.08Å; I19-L175 HydrophobicContact CD1-CD1 3.89Å
20	M	93.1	Very high	81.7	Confident	76 Å²	76	76.4 Å²	76.4	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-60	-33.4	178.1	-76.4	-59.8	-59.5	0	0	112.9	E16 I18 K24	E16-M20 HydrophobicContact CG-CG 4.35Å; E16-M20 VanDerWaalsContact O-CB 3.29Å; E16-M20 WeakPolarHBondContact O-CB 3.05Å; E16-M20 VanDerWaalsContact O-CG 3.24Å; E16-M20 WeakPolarHBondContact O-CG 3.27Å; E16-M20 PolarHBondContact O-N 3.3Å; I18-M20 VanDerWaalsContact C-N 3.3Å; I18-M20 PolarHBondContact O-N 3.43Å; M20-K24 WeakPolarHBondContact O-CB 3.17Å; M20-K24 WeakPolarHBondContact O-CG 3.3Å; M20-K24 PolarHBondContact O-N 3.4Å
21	K	93.4	Very high	79.6	Confident	71 Å²	71	74.7 Å²	74.7	31%	0.309	37%	0.37	S	S	.	.	H	α-helix	trans	-65.6	-41.2	173.9	-72.1	161.1	-172.8	163.9	0	112	D17 I18 I19 G25 A28 Y163	D17-K21 WeakPolarHBondContact O-CD 3.42Å; D17-K21 VanDerWaalsContact O-CG 3.26Å; D17-K21 WeakPolarHBondContact O-CG 3.18Å; D17-K21 PolarHBondContact O-N 3.21Å; D17-K21 VanDerWaalsContact O-N 3.12Å; I18-K21 WeakPolarHBondContact O-CB 3.41Å; I18-K21 PolarHBondContact O-N 3.46Å; I18-K21 VanDerWaalsContact O-N 3.09Å; I19-K21 VanDerWaalsContact C-N 3.25Å; I19-K21 PolarHBondContact O-N 2.89Å; K21-G25 PolarHBondContact O-N 2.76Å; K21-A28 HydrophobicContact CB-CB 3.92Å; K21-A28 HydrophobicContact CG-CB 4.15Å; K21-A28 WeakPolarHBondContact O-CB 3.38Å; K21-Y163 HydrophobicContact CB-CD1 4.05Å; K21-Y163 HydrophobicContact CB-CD2 4.46Å; K21-Y163 HydrophobicContact CB-CE1 3.8Å; K21-Y163 HydrophobicContact CB-CE2 4.24Å; K21-Y163 HydrophobicContact CB-CG 4.39Å; K21-Y163 HydrophobicContact CD-CE1 4.44Å
22	Y	92.8	Very high	77.3	Confident	1 Å²	1	78 Å²	78	0%	0.004	39%	0.392	C	S	.	.	H	α-helix	trans	-70.6	-38	176.5	-81.5	-86.3	0	0	0	113.2	I18 I19 G25 D146 V149 R162 Y163 Q167 R168 L171	I18-Y22 HydrophobicContact CG2-CD2 4.13Å; I18-Y22 HydrophobicContact CG2-CE2 4.03Å; I18-Y22 WeakPolarHBondContact O-CD2 2.96Å; I18-Y22 PolarHBondContact O-N 2.95Å; I19-Y22 PolarHBondContact O-N 2.94Å; Y22-G25 PolarHBondContact O-N 3.12Å; Y22-G25 VanDerWaalsContact O-N 3.16Å; Y22-D146 WeakPolarHBondContact CE2-OD1 3.23Å; Y22-D146 PolarHBondContact OH-OD1 2.9Å; Y22-D146 VanDerWaalsContact OH-OD1 3.12Å; Y22-V149 HydrophobicContact CE1-CG1 4.31Å; Y22-V149 WeakPolarHBondContact OH-CB 3.43Å; Y22-V149 WeakPolarHBondContact OH-CG1 3.39Å; Y22-R162 PolarHBondContact OH-NH1 3.31Å; Y22-Y163 HydrophobicContact CD1-CD1 4.05Å; Y22-Y163 AromaticContact CD2-CD1 3.88Å; Y22-Y163 HydrophobicContact CD2-CD1 3.88Å; Y22-Y163 HydrophobicContact CD2-CE1 4.21Å; Y22-Y163 HydrophobicContact CE1-CD1 4.07Å; Y22-Y163 AromaticContact CE2-CD1 3.89Å; Y22-Y163 HydrophobicContact CE2-CD1 3.89Å; Y22-Y163 AromaticContact CE2-CE1 3.99Å; Y22-Y163 HydrophobicContact CE2-CE1 3.99Å; Y22-Y163 AromaticContact CG-CD1 3.99Å; Y22-Y163 HydrophobicContact CG-CD1 3.99Å; Y22-Y163 AromaticContact CZ-CD1 4Å; Y22-Q167 HydrophobicContact CE1-CB 4.03Å; Y22-Q167 WeakPolarHBondContact CE1-O 3.35Å; Y22-R168 HydrophobicContact CD1-CB 3.9Å; Y22-R168 HydrophobicContact CD1-CG 4.39Å; Y22-R168 WeakPolarHBondContact O-CD 3.32Å; Y22-L171 HydrophobicContact CD1-CB 4.35Å; Y22-L171 HydrophobicContact CD1-CD2 4.15Å; Y22-L171 HydrophobicContact CD2-CD1 4.44Å; Y22-L171 HydrophobicContact CD2-CD2 3.5Å; Y22-L171 VanDerWaalsContact CD2-CD2 3.5Å; Y22-L171 HydrophobicContact CD2-CG 4.46Å; Y22-L171 HydrophobicContact CE1-CB 4.06Å; Y22-L171 HydrophobicContact CE1-CD2 4.37Å; Y22-L171 HydrophobicContact CE2-CD1 3.85Å; Y22-L171 HydrophobicContact CE2-CD2 3.77Å; Y22-L171 HydrophobicContact CE2-CG 4.27Å; Y22-L171 HydrophobicContact CG-CD2 3.67Å
23	E	90.9	Very high	74.9	Confident	80 Å²	80	82 Å²	82	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-68.1	-38.7	178.3	-65.8	-63.4	177.6	0	0	112.1	I19 G25 K136	I19-E23 HydrophobicContact CG2-CG 4.14Å; I19-E23 WeakPolarHBondContact O-CG 3.43Å; I19-E23 PolarHBondContact O-N 2.75Å; E23-G25 PolarHBondContact O-N 2.66Å; E23-K136 IonicContact OE1-NZ 2.72Å; E23-K136 PolarHBondContact OE1-NZ 3.43Å
24	K	88.8	Confident	72.2	Confident	132 Å²	132	86.4 Å²	86.4	57%	0.574	43%	0.425	S	S	*	.	H	α-helix	trans	-68.8	-18.1	171.9	-76	175.2	-178.2	176.1	0	113.3	M20 A28	M20-K24 WeakPolarHBondContact O-CB 3.17Å; M20-K24 WeakPolarHBondContact O-CG 3.3Å; M20-K24 PolarHBondContact O-N 3.4Å; K24-A28 HydrophobicContact CB-CB 3.7Å; K24-A28 HydrophobicContact CD-CB 4.36Å
25	G	83.5	Confident	69.7	Low	11 Å²	11	86.1 Å²	86.1	11%	0.113	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	60.8	-142.7	-177.8	0	0	0	0	0	113	K21 Y22 E23 R27 A28 Y163	K21-G25 PolarHBondContact O-N 2.76Å; Y22-G25 PolarHBondContact O-N 3.12Å; Y22-G25 VanDerWaalsContact O-N 3.16Å; E23-G25 PolarHBondContact O-N 2.66Å; G25-R27 PolarHBondContact O-N 3.24Å; G25-A28 VanDerWaalsContact O-CB 3.27Å; G25-A28 WeakPolarHBondContact O-CB 3.37Å; G25-A28 PolarHBondContact O-N 3.21Å; G25-Y163 VanDerWaalsContact CA-O 3.3Å; G25-Y163 WeakPolarHBondContact CA-O 3.22Å
26	H	66.8	Low	66.8	Low	102 Å²	102	88.7 Å²	88.7	47%	0.472	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-54.9	-22.9	-178.3	-68.2	-103.8	0	0	0	114.8	A28 D161 G164	H26-A28 PolarHBondContact O-N 3.24Å; H26-D161 WeakPolarHBondContact CE1-CB 3.49Å; H26-D161 IonicContact CE1-OD2 3.38Å; H26-D161 PolarHBondContact CE1-OD2 3.44Å; H26-G164 WeakPolarHBondContact NE2-CA 3.43Å
27	R	60.6	Low	63.9	Low	227 Å²	227	92.9 Å²	92.9	86%	0.857	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-73.8	-12.4	178.3	-67.6	-174	-178	-175.7	2.5	113.4	G25 G29	G25-R27 PolarHBondContact O-N 3.24Å; R27-G29 PolarHBondContact O-N 3.2Å
28	A	56.4	Low	61.1	Low	27 Å²	27	95.8 Å²	95.8	22%	0.223	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-78.1	-13.7	-171.6	0	0	0	0	0	116.4	K21 K24 G25 H26 Y163	K21-A28 HydrophobicContact CB-CB 3.92Å; K21-A28 HydrophobicContact CG-CB 4.15Å; K21-A28 WeakPolarHBondContact O-CB 3.38Å; K24-A28 HydrophobicContact CB-CB 3.7Å; K24-A28 HydrophobicContact CD-CB 4.36Å; G25-A28 VanDerWaalsContact O-CB 3.27Å; G25-A28 WeakPolarHBondContact O-CB 3.37Å; G25-A28 PolarHBondContact O-N 3.21Å; H26-A28 PolarHBondContact O-N 3.24Å; A28-Y163 HydrophobicContact CB-CD2 4.3Å
29	G	47.7	Very low	58.3	Low	45 Å²	45	101.6 Å²	101.6	46%	0.464	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-115.8	13.9	-164.7	0	0	0	0	0	116.8	R27 P31	R27-G29 PolarHBondContact O-N 3.2Å; G29-P31 WeakPolarHBondContact O-CD 3.39Å
30	L	43.1	Very low	55.4	Low	129 Å²	129	112.7 Å²	112.7	68%	0.675	57%	0.566	S	S	*	*			trans	-106.9	110.4	-175.8	-77.5	164.1	0	0	0	113
31	P	38.7	Very low	52.7	Low	111 Å²	111	112.6 Å²	112.6	72%	0.721	57%	0.573	S	S	*	*	S	Bend	trans	-111.6	101.7	135.1	29.6	-17.5	0	0	0	108	G29 D33	G29-P31 WeakPolarHBondContact O-CD 3.39Å; P31-D33 PolarHBondContact O-N 3.17Å
32	E	36.1	Very low	50.6	Low	206 Å²	206	112.4 Å²	112.4	96%	0.963	57%	0.571	S	S	*	*	S	Bend	trans	33.7	42	175.6	-73	-167.3	150.6	0	0	116.7
33	D	36.2	Very low	49	Very low	121 Å²	121	114.9 Å²	114.9	65%	0.647	58%	0.584	S	S	*	*			trans	-101.9	121.6	177	-165.2	12.1	0	0	0	110.2	P31 G35	P31-D33 PolarHBondContact O-N 3.17Å; D33-G35 PolarHBondContact O-N 3.29Å
34	K	33.4	Very low	47.7	Very low	199 Å²	199	114.8 Å²	114.8	87%	0.865	59%	0.586	S	S	*	*			trans	-69.7	73.9	180	-67.2	178.7	180	171.9	0	109.3
35	G	37	Very low	47.3	Very low	50 Å²	50	109.2 Å²	109.2	52%	0.515	56%	0.563	S	S	.	*			trans	-51	148.7	152.8	0	0	0	0	0	108.8	D33 K37	D33-G35 PolarHBondContact O-N 3.29Å; G35-K37 PolarHBondContact O-N 3.26Å
36	P	32.5	Very low	47.2	Very low	104 Å²	104	109.3 Å²	109.3	68%	0.675	56%	0.561	S	S	*	*	S	Bend	trans	-52.7	123	-174.9	-15.3	25.7	0	0	0	108.1
37	K	32.3	Very low	47.8	Very low	179 Å²	179	106.2 Å²	106.2	78%	0.778	55%	0.548	S	S	*	.			trans	-36.5	135.7	179.5	-72.7	177.7	177.5	177.6	0	109.1	G35 F39	G35-K37 PolarHBondContact O-N 3.26Å; K37-F39 WeakPolarHBondContact O-CA 3.18Å; K37-F39 PolarHBondContact O-N 2.99Å
38	P	33.5	Very low	48.7	Very low	124 Å²	124	99.1 Å²	99.1	81%	0.805	53%	0.525	S	S	*	.			trans	-51.9	105.2	178.7	19.1	-28.7	0	0	0	108	R40	P38-R40 PolarHBondContact O-N 2.99Å
39	F	33.7	Very low	49.9	Very low	126 Å²	126	98.8 Å²	98.8	55%	0.553	52%	0.519	S	S	*	.			trans	-76.3	99.6	-169.4	-144.6	-91.1	0	0	0	106	K37 S41 Y42	K37-F39 WeakPolarHBondContact O-CA 3.18Å; K37-F39 PolarHBondContact O-N 2.99Å; F39-S41 PolarHBondContact O-N 3.14Å; F39-Y42 WeakPolarHBondContact O-CD2 3.42Å
40	R	33.1	Very low	51.6	Low	245 Å²	245	97.3 Å²	97.3	93%	0.925	50%	0.503	S	S	*	.	S	Bend	trans	-65.9	117.2	179	-157.9	-179.2	-86.5	-135.5	0.2	106.5	P38	P38-R40 PolarHBondContact O-N 2.99Å
41	S	35.6	Very low	53.6	Low	75 Å²	75	92.5 Å²	92.5	52%	0.524	48%	0.478	S	S	.	.			trans	91.2	66	-173	-154.4	0	0	0	0	115.7	F39 N43	F39-S41 PolarHBondContact O-N 3.14Å; S41-N43 PolarHBondContact O-N 3.4Å
42	Y	49.8	Very low	55.7	Low	67 Å²	67	88.6 Å²	88.6	26%	0.263	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-61.8	-20.4	168.1	-78.7	-92.8	0	0	0	112.6	F39 N44 N45 V46 R160 W468	F39-Y42 WeakPolarHBondContact O-CD2 3.42Å; Y42-N44 PolarHBondContact O-N 3.16Å; Y42-N45 PolarHBondContact O-N 3.32Å; Y42-N45 VanDerWaalsContact O-N 3.1Å; Y42-V46 HydrophobicContact CD1-CG2 4.36Å; Y42-R160 VanDerWaalsContact CE1-NH1 3.31Å; Y42-W468 VanDerWaalsContact C-CH2 3.49Å; Y42-W468 HydrophobicContact CG-CZ2 4.44Å; Y42-W468 WeakPolarHBondContact O-CH2 3.34Å; Y42-W468 VanDerWaalsContact O-CZ2 3.27Å; Y42-W468 WeakPolarHBondContact O-CZ2 3.49Å
43	N	59	Low	57.9	Low	52 Å²	52	82 Å²	82	28%	0.278	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-58.6	-27.2	-160.5	-107.8	24.6	0	0	0	114.9	S41 W468	S41-N43 PolarHBondContact O-N 3.4Å; N43-W468 VanDerWaalsContact CA-CZ2 3.46Å; N43-W468 HydrophobicContact CB-CH2 4.48Å; N43-W468 HydrophobicContact CB-CZ2 4.42Å; N43-W468 WeakPolarHBondContact OD1-CZ2 3.18Å
44	N	65	Low	60	Low	78 Å²	78	85.6 Å²	85.6	42%	0.417	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-96	-12	-175.5	-62.7	-9.6	0	0	0	113.9	Y42 E56 L57	Y42-N44 PolarHBondContact O-N 3.16Å; N44-E56 HydrophobicContact CB-CB 4.31Å; N44-E56 HydrophobicContact CB-CG 3.97Å; N44-E56 PolarHBondContact ND2-OE1 2.85Å; N44-L57 WeakPolarHBondContact O-CB 3.43Å; N44-L57 PolarHBondContact O-N 3.15Å
45	N	79.4	Confident	62.2	Low	16 Å²	16	81 Å²	81	9%	0.086	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-4.6	-171.3	-69.7	21.1	0	0	0	113.5	Y42 H53 E56	Y42-N45 PolarHBondContact O-N 3.32Å; Y42-N45 VanDerWaalsContact O-N 3.1Å; N45-H53 WeakPolarHBondContact O-CB 3.15Å; N45-H53 PolarHBondContact O-N 2.96Å; N45-E56 WeakPolarHBondContact OD1-CA 3.15Å; N45-E56 VanDerWaalsContact OD1-CG 3.24Å; N45-E56 WeakPolarHBondContact OD1-CG 3.44Å; N45-E56 PolarHBondContact OD1-N 3.46Å
46	V	81	Confident	64.2	Low	13 Å²	13	84.8 Å²	84.8	8%	0.079	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-109.3	129.4	-176.4	-170.8	0	0	0	0	109.3	Y42 G50 I51 V52 I157 W468	Y42-V46 HydrophobicContact CD1-CG2 4.36Å; V46-G50 VanDerWaalsContact CG1-C 3.45Å; V46-I51 CarbonylContact C-O 3.28Å; V46-I51 VanDerWaalsContact CA-O 3.28Å; V46-I51 WeakPolarHBondContact CA-O 3.38Å; V46-V52 HydrophobicContact CG2-CG2 4.08Å; V46-I157 HydrophobicContact CG2-CD1 4.36Å; V46-W468 HydrophobicContact CB-CH2 3.4Å; V46-W468 VanDerWaalsContact CB-CH2 3.4Å; V46-W468 HydrophobicContact CB-CZ2 4.38Å; V46-W468 HydrophobicContact CB-CZ3 3.63Å; V46-W468 HydrophobicContact CG1-CH2 4.33Å; V46-W468 HydrophobicContact CG1-CZ3 4.2Å; V46-W468 HydrophobicContact CG2-CH2 3.46Å; V46-W468 VanDerWaalsContact CG2-CH2 3.46Å; V46-W468 HydrophobicContact CG2-CZ2 4Å; V46-W468 HydrophobicContact CG2-CZ3 4.16Å
47	D	79.8	Confident	66.3	Low	37 Å²	37	82.7 Å²	82.7	20%	0.198	41%	0.41	C	S	.	.			trans	-74.9	172.7	178.6	78.7	4	0	0	0	112.2	L49 G50 I51 H53 L57	D47-L49 PolarHBondContact O-N 3.16Å; D47-L49 VanDerWaalsContact OD1-C 3.31Å; D47-L49 VanDerWaalsContact OD1-CA 3.32Å; D47-L49 WeakPolarHBondContact OD1-CA 3.35Å; D47-L49 WeakPolarHBondContact OD1-CB 3.34Å; D47-L49 PolarHBondContact OD1-N 3.1Å; D47-G50 PolarHBondContact O-N 3.16Å; D47-G50 PolarHBondContact OD1-N 2.96Å; D47-I51 PolarHBondContact N-O 3.06Å; D47-I51 WeakPolarHBondContact OD1-CB 3.47Å; D47-I51 PolarHBondContact OD1-N 3.37Å; D47-H53 IonicContact OD2-NE2 2.89Å; D47-L57 HydrophobicContact CB-CD1 3.86Å
48	H	79.2	Confident	68.6	Low	78 Å²	78	79.1 Å²	79.1	36%	0.361	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-10.2	178.7	70.4	-74	0	0	0	114.7
49	L	81	Confident	70.6	Confident	20 Å²	20	79 Å²	79	11%	0.105	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	3	176.3	-60.9	175.1	0	0	0	112.5	D47 M104 H156 L279 G280 L283	D47-L49 PolarHBondContact O-N 3.16Å; D47-L49 VanDerWaalsContact OD1-C 3.31Å; D47-L49 VanDerWaalsContact OD1-CA 3.32Å; D47-L49 WeakPolarHBondContact OD1-CA 3.35Å; D47-L49 WeakPolarHBondContact OD1-CB 3.34Å; D47-L49 PolarHBondContact OD1-N 3.1Å; L49-M104 HydrophobicContact CD2-SD 4.46Å; L49-H156 PolarHBondContact O-CD2 3.11Å; L49-H156 VanDerWaalsContact O-CD2 3.27Å; L49-H156 PolarHBondContact O-NE2 3.38Å; L49-L279 HydrophobicContact CB-CD2 4.29Å; L49-L279 HydrophobicContact CD1-CB 4.36Å; L49-G280 VanDerWaalsContact CD1-N 3.33Å; L49-L283 HydrophobicContact CD2-CD1 4.29Å
50	G	84.3	Confident	72.7	Confident	13 Å²	13	78.2 Å²	78.2	13%	0.134	41%	0.405	C	S	.	.	S	Bend	trans	84.6	10.9	-179.5	0	0	0	0	0	114.6	V46 D47 H156 I157	V46-G50 VanDerWaalsContact CG1-C 3.45Å; D47-G50 PolarHBondContact O-N 3.16Å; D47-G50 PolarHBondContact OD1-N 2.96Å; G50-H156 CarbonylContact O-C 3.57Å; G50-H156 WeakPolarHBondContact O-CA 3.45Å; G50-I157 PolarHBondContact O-N 3.46Å
51	I	84.2	Confident	75	Confident	29 Å²	29	69.8 Å²	69.8	15%	0.149	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-81.3	126.2	176.4	-57	-59.7	0	0	0	110	V46 D47 H53 K155 H156 L279	V46-I51 CarbonylContact C-O 3.28Å; V46-I51 VanDerWaalsContact CA-O 3.28Å; V46-I51 WeakPolarHBondContact CA-O 3.38Å; D47-I51 PolarHBondContact N-O 3.06Å; D47-I51 WeakPolarHBondContact OD1-CB 3.47Å; D47-I51 PolarHBondContact OD1-N 3.37Å; I51-H53 PolarHBondContact O-CD2 2.92Å; I51-H53 VanDerWaalsContact O-CD2 3.32Å; I51-K155 CarbonylContact C-O 3.48Å; I51-K155 WeakPolarHBondContact CA-O 3.44Å; I51-K155 HydrophobicContact CG2-CB 4.07Å; I51-H156 HydrophobicContact CD1-CB 4.09Å; I51-L279 HydrophobicContact CD1-CB 4.36Å; I51-L279 HydrophobicContact CD1-CD2 3.72Å; I51-L279 HydrophobicContact CG1-CD2 4.22Å
52	V	84.1	Confident	77.2	Confident	28 Å²	28	70.3 Å²	70.3	17%	0.17	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-85	128.8	177.4	-172.5	0	0	0	0	110	V46 K155 I157	V46-V52 HydrophobicContact CG2-CG2 4.08Å; V52-K155 PolarHBondContact N-O 3.47Å; V52-I157 HydrophobicContact CG2-CB 4.1Å; V52-I157 HydrophobicContact CG2-CG1 4.44Å
53	H	81	Confident	78.6	Confident	69 Å²	69	73.5 Å²	73.5	32%	0.319	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-103.7	151.3	173.3	-64.1	-95.9	0	0	0	110.8	N45 D47 I51 T55 L57	N45-H53 WeakPolarHBondContact O-CB 3.15Å; N45-H53 PolarHBondContact O-N 2.96Å; D47-H53 IonicContact OD2-NE2 2.89Å; I51-H53 PolarHBondContact O-CD2 2.92Å; I51-H53 VanDerWaalsContact O-CD2 3.32Å; H53-T55 VanDerWaalsContact C-N 3.3Å; H53-L57 HydrophobicContact CB-CD2 4.31Å
54	E	80.5	Confident	79.5	Confident	196 Å²	196	75 Å²	75	92%	0.916	41%	0.407	S	S	*	.	S	Bend	trans	-69.2	-32.5	176.9	-67.4	176.5	-178	0	0	111.8
55	T	80.7	Confident	80.3	Confident	102 Å²	102	72.8 Å²	72.8	63%	0.626	40%	0.399	S	S	*	.	S	Bend	trans	-107.5	155.8	179.4	58.4	0	0	0	0	111.1	H53 L57	H53-T55 VanDerWaalsContact C-N 3.3Å; T55-L57 PolarHBondContact O-N 2.91Å
56	E	79.3	Confident	80.6	Confident	129 Å²	129	77.3 Å²	77.3	60%	0.603	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-55.2	136.2	167.9	-66.4	-166.7	143.6	0	0	110.5	N44 N45	N44-E56 HydrophobicContact CB-CB 4.31Å; N44-E56 HydrophobicContact CB-CG 3.97Å; N44-E56 PolarHBondContact ND2-OE1 2.85Å; N45-E56 WeakPolarHBondContact OD1-CA 3.15Å; N45-E56 VanDerWaalsContact OD1-CG 3.24Å; N45-E56 WeakPolarHBondContact OD1-CG 3.44Å; N45-E56 PolarHBondContact OD1-N 3.46Å
57	L	76.7	Confident	80.6	Confident	60 Å²	60	79.7 Å²	79.7	31%	0.314	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-73.6	140.5	176	-71.5	172.4	0	0	0	109.4	N44 D47 H53 T55	N44-L57 WeakPolarHBondContact O-CB 3.43Å; N44-L57 PolarHBondContact O-N 3.15Å; D47-L57 HydrophobicContact CB-CD1 3.86Å; H53-L57 HydrophobicContact CB-CD2 4.31Å; T55-L57 PolarHBondContact O-N 2.91Å
58	P	79	Confident	80.7	Confident	104 Å²	104	79.4 Å²	79.4	68%	0.675	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-60.7	155.5	170.3	28.2	-34.3	0	0	0	110.1	L60	P58-L60 PolarHBondContact O-N 2.97Å
59	P	76.9	Confident	81	Confident	121 Å²	121	83.6 Å²	83.6	79%	0.786	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-51.8	141	172	-25.1	33.5	0	0	0	111.1	T61	P59-T61 PolarHBondContact O-N 3.21Å; P59-T61 VanDerWaalsContact O-N 3.16Å
60	L	76.2	Confident	81.3	Confident	110 Å²	110	88.7 Å²	88.7	58%	0.576	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-50.3	124.6	178.8	-75.5	170.5	0	0	0	110.5	P58 E64 I68	P58-L60 PolarHBondContact O-N 2.97Å; L60-E64 HydrophobicContact CD2-CB 4.03Å; L60-I68 HydrophobicContact CD1-CD1 4.06Å; L60-I68 HydrophobicContact CD2-CD1 4.2Å
61	T	81.4	Confident	81.3	Confident	69 Å²	69	89.6 Å²	89.6	42%	0.423	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-64.4	152.4	174.9	64.3	0	0	0	0	109.9	P59 R63 E64 A65	P59-T61 PolarHBondContact O-N 3.21Å; P59-T61 VanDerWaalsContact O-N 3.16Å; T61-R63 PolarHBondContact O-N 3.44Å; T61-E64 WeakPolarHBondContact CB-OE2 3.33Å; T61-E64 WeakPolarHBondContact CG2-OE2 3.05Å; T61-E64 PolarHBondContact N-OE2 3.03Å; T61-E64 PolarHBondContact O-N 3.44Å; T61-E64 VanDerWaalsContact OG1-CG 3.28Å; T61-E64 WeakPolarHBondContact OG1-CG 3.23Å; T61-E64 PolarHBondContact OG1-N 2.87Å; T61-E64 PolarHBondContact OG1-OE2 3.18Å; T61-A65 PolarHBondContact O-N 3.09Å
62	A	82	Confident	81.2	Confident	85 Å²	85	92.6 Å²	92.6	70%	0.702	47%	0.473	S	S	*	.	H	α-helix	trans	-54.9	-28.4	175.5	0	0	0	0	0	112.7	K66	A62-K66 WeakPolarHBondContact O-CB 3.46Å; A62-K66 PolarHBondContact O-N 3.24Å
63	R	79.2	Confident	81.4	Confident	134 Å²	134	94.8 Å²	94.8	51%	0.506	49%	0.489	S	S	.	.	H	α-helix	trans	-69.6	-48.1	175	-175.9	178.5	174.8	-178.7	-4.2	111.9	T61 K66 Q67 R334 D335	T61-R63 PolarHBondContact O-N 3.44Å; R63-K66 WeakPolarHBondContact O-CB 3.38Å; R63-K66 PolarHBondContact O-N 3.3Å; R63-Q67 PolarHBondContact O-N 2.69Å; R63-R334 PolarHBondContact NH2-O 2.83Å; R63-D335 IonicContact NH2-OD1 2.74Å; R63-D335 PolarHBondContact NH2-OD1 3.03Å
64	E	79	Confident	81.9	Confident	85 Å²	85	93.8 Å²	93.8	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-64.3	-46.3	177.8	-71.4	157.4	155.5	0	0	110.9	L60 T61 K66 Q67 I68	L60-E64 HydrophobicContact CD2-CB 4.03Å; T61-E64 WeakPolarHBondContact CB-OE2 3.33Å; T61-E64 WeakPolarHBondContact CG2-OE2 3.05Å; T61-E64 PolarHBondContact N-OE2 3.03Å; T61-E64 PolarHBondContact O-N 3.44Å; T61-E64 VanDerWaalsContact OG1-CG 3.28Å; T61-E64 WeakPolarHBondContact OG1-CG 3.23Å; T61-E64 PolarHBondContact OG1-N 2.87Å; T61-E64 PolarHBondContact OG1-OE2 3.18Å; E64-K66 PolarHBondContact O-N 3.38Å; E64-Q67 WeakPolarHBondContact O-CA 3.46Å; E64-Q67 WeakPolarHBondContact O-CB 3.47Å; E64-Q67 PolarHBondContact O-N 3.31Å; E64-I68 WeakPolarHBondContact O-CG1 3.28Å; E64-I68 PolarHBondContact O-N 3.07Å
65	A	81.7	Confident	82.3	Confident	31 Å²	31	88.1 Å²	88.1	26%	0.256	46%	0.455	S	S	.	.	H	α-helix	trans	-60.1	-34.9	175.1	0	0	0	0	0	112.3	T61 R69	T61-A65 PolarHBondContact O-N 3.09Å; A65-R69 WeakPolarHBondContact O-CB 3.36Å; A65-R69 VanDerWaalsContact O-CG 3.31Å; A65-R69 WeakPolarHBondContact O-CG 3Å; A65-R69 PolarHBondContact O-N 3.17Å; A65-R69 VanDerWaalsContact O-N 3.11Å; A65-R69 PolarHBondContact O-NE 3.18Å
66	K	85.3	Confident	82.8	Confident	110 Å²	110	86.4 Å²	86.4	48%	0.478	45%	0.447	S	S	.	.	H	α-helix	trans	-69.4	-36.2	172.9	-174.7	176.9	-172.3	175.2	0	111.9	A62 R63 E64 R70	A62-K66 WeakPolarHBondContact O-CB 3.46Å; A62-K66 PolarHBondContact O-N 3.24Å; R63-K66 WeakPolarHBondContact O-CB 3.38Å; R63-K66 PolarHBondContact O-N 3.3Å; E64-K66 PolarHBondContact O-N 3.38Å; K66-R70 WeakPolarHBondContact O-CB 3.34Å; K66-R70 WeakPolarHBondContact O-CD 3.44Å; K66-R70 WeakPolarHBondContact O-CG 3.44Å; K66-R70 PolarHBondContact O-N 2.85Å
67	Q	81.9	Confident	83.5	Confident	64 Å²	64	84.8 Å²	84.8	30%	0.299	44%	0.438	S	S	.	.	H	α-helix	trans	-66.8	-48.8	175.6	-179.6	172.7	-13.1	0	0	111.4	R63 E64 R69 R70 E71	R63-Q67 PolarHBondContact O-N 2.69Å; E64-Q67 WeakPolarHBondContact O-CA 3.46Å; E64-Q67 WeakPolarHBondContact O-CB 3.47Å; E64-Q67 PolarHBondContact O-N 3.31Å; Q67-R69 VanDerWaalsContact C-N 3.33Å; Q67-R69 PolarHBondContact O-N 2.95Å; Q67-R70 CarbonylContact O-C 3.56Å; Q67-R70 WeakPolarHBondContact O-CA 3.33Å; Q67-R70 WeakPolarHBondContact O-CB 3.36Å; Q67-R70 PolarHBondContact O-N 3.15Å; Q67-E71 PolarHBondContact NE2-OE1 3.08Å; Q67-E71 PolarHBondContact O-N 3.05Å
68	I	81.2	Confident	84.3	Confident	30 Å²	30	82 Å²	82	15%	0.154	42%	0.424	C	S	.	.	H	α-helix	trans	-56.6	-47.8	176.3	-66.1	167.8	0	0	0	110.3	L60 E64 R70 E71 I72	L60-I68 HydrophobicContact CD1-CD1 4.06Å; L60-I68 HydrophobicContact CD2-CD1 4.2Å; E64-I68 WeakPolarHBondContact O-CG1 3.28Å; E64-I68 PolarHBondContact O-N 3.07Å; I68-R70 VanDerWaalsContact C-N 3.31Å; I68-R70 PolarHBondContact O-N 2.8Å; I68-E71 PolarHBondContact O-N 2.66Å; I68-E71 VanDerWaalsContact O-N 3.14Å; I68-I72 HydrophobicContact CG2-CD1 3.83Å; I68-I72 HydrophobicContact CG2-CG1 4.49Å; I68-I72 WeakPolarHBondContact O-CG1 3.24Å; I68-I72 PolarHBondContact O-N 2.89Å
69	R	85.4	Confident	84.9	Confident	166 Å²	166	79.8 Å²	79.8	63%	0.626	41%	0.408	S	S	*	.	H	α-helix	trans	-58.5	-40.5	174.9	-76.9	-175.8	-72.8	176.7	-5.9	112.9	A65 Q67 S73	A65-R69 WeakPolarHBondContact O-CB 3.36Å; A65-R69 VanDerWaalsContact O-CG 3.31Å; A65-R69 WeakPolarHBondContact O-CG 3Å; A65-R69 PolarHBondContact O-N 3.17Å; A65-R69 VanDerWaalsContact O-N 3.11Å; A65-R69 PolarHBondContact O-NE 3.18Å; Q67-R69 VanDerWaalsContact C-N 3.33Å; Q67-R69 PolarHBondContact O-N 2.95Å; R69-S73 WeakPolarHBondContact O-CB 3.31Å; R69-S73 PolarHBondContact O-N 3.25Å
70	R	86.9	Confident	85.7	Confident	127 Å²	127	78.6 Å²	78.6	48%	0.479	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-40.5	176	-77	167	171.5	-173.4	-4.1	111.8	K66 Q67 I68 S73 R74	K66-R70 WeakPolarHBondContact O-CB 3.34Å; K66-R70 WeakPolarHBondContact O-CD 3.44Å; K66-R70 WeakPolarHBondContact O-CG 3.44Å; K66-R70 PolarHBondContact O-N 2.85Å; Q67-R70 CarbonylContact O-C 3.56Å; Q67-R70 WeakPolarHBondContact O-CA 3.33Å; Q67-R70 WeakPolarHBondContact O-CB 3.36Å; Q67-R70 PolarHBondContact O-N 3.15Å; I68-R70 VanDerWaalsContact C-N 3.31Å; I68-R70 PolarHBondContact O-N 2.8Å; R70-S73 PolarHBondContact O-N 2.99Å; R70-S73 PolarHBondContact O-OG 2.64Å; R70-R74 WeakPolarHBondContact O-CD 3.26Å; R70-R74 WeakPolarHBondContact O-CG 3.46Å; R70-R74 PolarHBondContact O-N 3.08Å
71	E	84.1	Confident	86.5	Confident	32 Å²	32	73.4 Å²	73.4	15%	0.15	37%	0.368	C	S	.	.	H	α-helix	trans	-63.6	-48.4	176.5	-72.5	176.3	-164.7	0	0	110.9	Q67 I68 S73 R74 P103	Q67-E71 PolarHBondContact NE2-OE1 3.08Å; Q67-E71 PolarHBondContact O-N 3.05Å; I68-E71 PolarHBondContact O-N 2.66Å; I68-E71 VanDerWaalsContact O-N 3.14Å; E71-S73 VanDerWaalsContact C-N 3.32Å; E71-S73 PolarHBondContact O-N 3.35Å; E71-R74 WeakPolarHBondContact O-CB 2.89Å; E71-R74 PolarHBondContact O-N 3.03Å; E71-P103 WeakPolarHBondContact O-CG 3.46Å
72	I	82.8	Confident	87.1	Confident	92 Å²	92	72.1 Å²	72.1	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-58.1	-44.2	175.7	-65.2	168.2	0	0	0	110.9	I68 R74 K75	I68-I72 HydrophobicContact CG2-CD1 3.83Å; I68-I72 HydrophobicContact CG2-CG1 4.49Å; I68-I72 WeakPolarHBondContact O-CG1 3.24Å; I68-I72 PolarHBondContact O-N 2.89Å; I72-R74 PolarHBondContact O-N 2.83Å; I72-K75 WeakPolarHBondContact O-CB 3.46Å; I72-K75 PolarHBondContact O-N 3Å
73	S	88.3	Confident	87.5	Confident	74 Å²	74	71.7 Å²	71.7	52%	0.517	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-19.2	179.5	78.9	0	0	0	0	114.2	R69 R70 E71	R69-S73 WeakPolarHBondContact O-CB 3.31Å; R69-S73 PolarHBondContact O-N 3.25Å; R70-S73 PolarHBondContact O-N 2.99Å; R70-S73 PolarHBondContact O-OG 2.64Å; E71-S73 VanDerWaalsContact C-N 3.32Å; E71-S73 PolarHBondContact O-N 3.35Å
74	R	90.6	Very high	88.1	Confident	49 Å²	49	68.5 Å²	68.5	19%	0.185	36%	0.355	C	S	.	.	H	α-helix	trans	-84.7	-15.9	178.4	-68.9	163.7	179.3	178.8	-2.9	112.3	R70 E71 I72 S76 K77 W78 K100 P103	R70-R74 WeakPolarHBondContact O-CD 3.26Å; R70-R74 WeakPolarHBondContact O-CG 3.46Å; R70-R74 PolarHBondContact O-N 3.08Å; E71-R74 WeakPolarHBondContact O-CB 2.89Å; E71-R74 PolarHBondContact O-N 3.03Å; I72-R74 PolarHBondContact O-N 2.83Å; R74-S76 PolarHBondContact O-N 3Å; R74-K77 PolarHBondContact O-N 3.29Å; R74-W78 VanDerWaalsContact O-CD1 3.25Å; R74-W78 PolarHBondContact O-N 3.48Å; R74-K100 PolarHBondContact NH1-O 3.41Å; R74-P103 HydrophobicContact CB-CG 4.1Å
75	K	90.2	Very high	88.8	Confident	76 Å²	76	66.4 Å²	66.4	33%	0.33	34%	0.343	S	S	.	.	H	α-helix	trans	-49.5	-53.6	-176	-174.8	-168.3	-179.9	-176	0	112.2	I72 K77 W78 V79 N105 I106	I72-K75 WeakPolarHBondContact O-CB 3.46Å; I72-K75 PolarHBondContact O-N 3Å; K75-K77 VanDerWaalsContact C-N 3.3Å; K75-K77 PolarHBondContact O-N 2.87Å; K75-W78 WeakPolarHBondContact O-CB 3.31Å; K75-W78 PolarHBondContact O-N 2.86Å; K75-V79 HydrophobicContact CG-CG2 4.26Å; K75-V79 WeakPolarHBondContact O-CG2 3.24Å; K75-V79 PolarHBondContact O-N 2.87Å; K75-N105 WeakPolarHBondContact CE-ND2 3.5Å; K75-I106 HydrophobicContact CG-CD1 4.01Å; K75-I106 HydrophobicContact CG-CG1 4.2Å
76	S	90.9	Very high	89.2	Confident	66 Å²	66	71 Å²	71	46%	0.462	36%	0.359	S	S	.	.	H	α-helix	trans	-51.8	-48.8	-177.2	53.1	0	0	0	0	112.1	R74 W78 V79 D80	R74-S76 PolarHBondContact O-N 3Å; S76-W78 PolarHBondContact O-N 3.46Å; S76-V79 WeakPolarHBondContact O-CB 3.27Å; S76-V79 PolarHBondContact O-N 2.62Å; S76-V79 VanDerWaalsContact O-N 3.07Å; S76-D80 PolarHBondContact O-N 2.81Å
77	K	93	Very high	89.5	Confident	96 Å²	96	72.1 Å²	72.1	42%	0.417	36%	0.364	S	S	.	.	H	α-helix	trans	-64.2	-27.8	-179.4	-64.5	173.1	-179.3	160.1	0	113.5	R74 K75 M81	R74-K77 PolarHBondContact O-N 3.29Å; K75-K77 VanDerWaalsContact C-N 3.3Å; K75-K77 PolarHBondContact O-N 2.87Å; K77-M81 WeakPolarHBondContact O-CG 3.47Å; K77-M81 PolarHBondContact O-N 3.45Å
78	W	93.7	Very high	89.9	Confident	1 Å²	1	70.6 Å²	70.6	0%	0.004	36%	0.356	C	S	.	.	H	α-helix	trans	-79.9	-37.9	174.3	-74.7	100.3	0	0	0	111.9	R74 K75 S76 D80 M81 L82 L94 R97 A98 M102 P103 I106 M110	R74-W78 VanDerWaalsContact O-CD1 3.25Å; R74-W78 PolarHBondContact O-N 3.48Å; K75-W78 WeakPolarHBondContact O-CB 3.31Å; K75-W78 PolarHBondContact O-N 2.86Å; S76-W78 PolarHBondContact O-N 3.46Å; W78-D80 VanDerWaalsContact C-N 3.32Å; W78-M81 HydrophobicContact CB-CE 4.43Å; W78-M81 HydrophobicContact CD2-CE 3.57Å; W78-M81 HydrophobicContact CE3-CE 3.37Å; W78-M81 HydrophobicContact CG-CE 4.05Å; W78-M81 HydrophobicContact CH2-CE 4.45Å; W78-M81 HydrophobicContact CZ3-CE 3.84Å; W78-M81 PolarHBondContact O-N 2.92Å; W78-M81 VanDerWaalsContact O-N 3.15Å; W78-L82 PolarHBondContact O-N 3.15Å; W78-L94 HydrophobicContact CH2-CD1 4.47Å; W78-L94 HydrophobicContact CZ3-CD1 3.88Å; W78-R97 HydrophobicContact CH2-CB 4.02Å; W78-R97 HydrophobicContact CZ2-CB 3.68Å; W78-A98 HydrophobicContact CH2-CB 4.43Å; W78-M102 HydrophobicContact CD2-CG 4.2Å; W78-M102 HydrophobicContact CE3-CG 4.25Å; W78-M102 HydrophobicContact CH2-CB 4.26Å; W78-M102 HydrophobicContact CH2-CE 3.76Å; W78-M102 HydrophobicContact CH2-CG 4.08Å; W78-M102 HydrophobicContact CZ2-CB 3.97Å; W78-M102 HydrophobicContact CZ2-CG 3.98Å; W78-M102 HydrophobicContact CZ3-CE 3.77Å; W78-M102 HydrophobicContact CZ3-CG 4.21Å; W78-M102 HydrophobicContact CZ3-SD 4.42Å; W78-P103 VanDerWaalsContact NE1-CD 3.26Å; W78-I106 HydrophobicContact CB-CB 4.48Å; W78-I106 HydrophobicContact CB-CG1 4.23Å; W78-I106 HydrophobicContact CB-CG2 3.81Å; W78-I106 HydrophobicContact CG-CG2 4.34Å; W78-M110 HydrophobicContact CE3-CE 3.5Å; W78-M110 HydrophobicContact CE3-CG 4.36Å; W78-M110 HydrophobicContact CZ3-CE 3.74Å; W78-M110 HydrophobicContact CZ3-CG 4.04Å; W78-M110 HydrophobicContact CZ3-SD 4.32Å
79	V	93	Very high	90.2	Very high	57 Å²	57	72.9 Å²	72.9	35%	0.345	37%	0.365	S	S	.	.	H	α-helix	trans	-60.1	-44	171.7	175.7	0	0	0	0	110.4	K75 S76 M81 L82 G83 I106	K75-V79 HydrophobicContact CG-CG2 4.26Å; K75-V79 WeakPolarHBondContact O-CG2 3.24Å; K75-V79 PolarHBondContact O-N 2.87Å; S76-V79 WeakPolarHBondContact O-CB 3.27Å; S76-V79 PolarHBondContact O-N 2.62Å; S76-V79 VanDerWaalsContact O-N 3.07Å; V79-M81 PolarHBondContact O-N 2.58Å; V79-L82 PolarHBondContact O-N 3.32Å; V79-L82 VanDerWaalsContact O-N 3.12Å; V79-G83 PolarHBondContact O-N 3.02Å; V79-I106 HydrophobicContact CG2-CD1 3.84Å
80	D	92.9	Very high	90.2	Very high	97 Å²	97	70 Å²	70	52%	0.519	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-36.2	175	-57.9	-22.3	0	0	0	112.3	S76 W78	S76-D80 PolarHBondContact O-N 2.81Å; W78-D80 VanDerWaalsContact C-N 3.32Å
81	M	93.9	Very high	90.4	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-74.2	-32.5	177.9	-72.9	-174.7	-54.3	0	0	112.6	K77 W78 V79 D84 W85 Y88 K93 R97	K77-M81 WeakPolarHBondContact O-CG 3.47Å; K77-M81 PolarHBondContact O-N 3.45Å; W78-M81 HydrophobicContact CB-CE 4.43Å; W78-M81 HydrophobicContact CD2-CE 3.57Å; W78-M81 HydrophobicContact CE3-CE 3.37Å; W78-M81 HydrophobicContact CG-CE 4.05Å; W78-M81 HydrophobicContact CH2-CE 4.45Å; W78-M81 HydrophobicContact CZ3-CE 3.84Å; W78-M81 PolarHBondContact O-N 2.92Å; W78-M81 VanDerWaalsContact O-N 3.15Å; V79-M81 PolarHBondContact O-N 2.58Å; M81-D84 CarbonylContact O-C 3.59Å; M81-W85 WeakPolarHBondContact O-CA 3.4Å; M81-W85 PolarHBondContact O-N 3.39Å; M81-Y88 HydrophobicContact CB-CD2 4Å; M81-Y88 HydrophobicContact CB-CG 4.15Å; M81-Y88 HydrophobicContact CG-CD1 4.04Å; M81-Y88 HydrophobicContact CG-CD2 3.91Å; M81-Y88 HydrophobicContact CG-CE1 4.32Å; M81-Y88 HydrophobicContact CG-CE2 4.15Å; M81-Y88 HydrophobicContact CG-CG 3.83Å; M81-K93 HydrophobicContact SD-CG 4.49Å; M81-R97 HydrophobicContact CE-CB 3.99Å; M81-R97 HydrophobicContact CE-CG 3.95Å; M81-R97 HydrophobicContact SD-CG 4.24Å
82	L	92.5	Very high	90.7	Very high	42 Å²	42	73.1 Å²	73.1	22%	0.22	38%	0.384	C	S	.	.	H	α-helix	trans	-70.2	-37.4	174.1	-74.1	169	0	0	0	111.7	W78 V79 D84 I106 P109 M110 V113	W78-L82 PolarHBondContact O-N 3.15Å; V79-L82 PolarHBondContact O-N 3.32Å; V79-L82 VanDerWaalsContact O-N 3.12Å; L82-D84 VanDerWaalsContact C-N 3.28Å; L82-D84 PolarHBondContact O-N 3.19Å; L82-I106 HydrophobicContact CD1-CG2 4.03Å; L82-P109 HydrophobicContact CD1-CB 3.97Å; L82-M110 HydrophobicContact CD1-CE 4.46Å; L82-M110 HydrophobicContact CD2-CB 4.47Å; L82-M110 HydrophobicContact CD2-CE 3.52Å; L82-M110 HydrophobicContact CD2-SD 4.04Å; L82-M110 HydrophobicContact CG-CE 3.69Å; L82-V113 HydrophobicContact CD2-CB 4.4Å; L82-V113 HydrophobicContact CD2-CG2 4.15Å
83	G	91.9	Very high	91.2	Very high	75 Å²	75	73.2 Å²	73.2	77%	0.773	38%	0.381	S	S	*	.	H	α-helix	trans	-65.7	-26.8	178.9	0	0	0	0	0	114.4	V79	V79-G83 PolarHBondContact O-N 3.02Å
84	D	91.8	Very high	91.4	Very high	68 Å²	68	69.9 Å²	69.9	36%	0.364	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	52.2	177.6	-168.8	-1.1	0	0	0	110.2	M81 L82 E86 K87 Y88	M81-D84 CarbonylContact O-C 3.59Å; L82-D84 VanDerWaalsContact C-N 3.28Å; L82-D84 PolarHBondContact O-N 3.19Å; D84-E86 VanDerWaalsContact C-N 3.27Å; D84-E86 PolarHBondContact O-N 3.46Å; D84-K87 PolarHBondContact O-N 2.95Å; D84-K87 VanDerWaalsContact OD1-CB 3.23Å; D84-K87 WeakPolarHBondContact OD1-CB 3.49Å; D84-K87 WeakPolarHBondContact OD2-CD 3.4Å; D84-K87 IonicContact OD2-NZ 4Å; D84-Y88 HydrophobicContact CB-CD2 4.16Å; D84-Y88 HydrophobicContact CB-CE2 4.06Å; D84-Y88 WeakPolarHBondContact O-CD2 3.4Å; D84-Y88 PolarHBondContact O-N 3.08Å
85	W	91.8	Very high	91.5	Very high	40 Å²	40	69.8 Å²	69.8	15%	0.152	36%	0.36	C	S	.	.	H	α-helix	trans	-57	-39.9	-172.4	177.3	-120.3	0	0	0	113	M81 K87 Y88 K89 L94 M110 V113 L114	M81-W85 WeakPolarHBondContact O-CA 3.4Å; M81-W85 PolarHBondContact O-N 3.39Å; W85-K87 PolarHBondContact O-N 3.49Å; W85-Y88 PolarHBondContact O-N 3.32Å; W85-K89 HydrophobicContact CD2-CB 3.96Å; W85-K89 VanDerWaalsContact CE2-CB 3.48Å; W85-K89 HydrophobicContact CE3-CB 4.43Å; W85-K89 HydrophobicContact CH2-CB 4.1Å; W85-K89 HydrophobicContact CZ2-CB 3.58Å; W85-K89 HydrophobicContact CZ3-CB 4.5Å; W85-K89 WeakPolarHBondContact O-CB 3.35Å; W85-K89 PolarHBondContact O-N 3.09Å; W85-L94 HydrophobicContact CH2-CD2 3.63Å; W85-L94 HydrophobicContact CZ3-CD1 4.19Å; W85-L94 HydrophobicContact CZ3-CD2 3.79Å; W85-M110 HydrophobicContact CH2-SD 4.19Å; W85-M110 HydrophobicContact CZ3-CE 4.23Å; W85-M110 HydrophobicContact CZ3-SD 3.8Å; W85-V113 HydrophobicContact CB-CG1 4.47Å; W85-V113 VanDerWaalsContact CD1-CG1 3.44Å; W85-V113 HydrophobicContact CD2-CG1 3.31Å; W85-V113 HydrophobicContact CE3-CG1 3.97Å; W85-V113 HydrophobicContact CG-CG1 3.51Å; W85-V113 HydrophobicContact CH2-CG1 4.27Å; W85-V113 HydrophobicContact CZ2-CG1 3.67Å; W85-V113 HydrophobicContact CZ3-CG1 4.41Å; W85-L114 HydrophobicContact CH2-CD2 3.64Å; W85-L114 HydrophobicContact CH2-CG 4.21Å; W85-L114 HydrophobicContact CZ2-CD2 4.12Å
86	E	90.5	Very high	91.6	Very high	127 Å²	127	68.3 Å²	68.3	59%	0.593	36%	0.356	S	S	*	.	H	α-helix	trans	-58.7	-36.2	-179	-74	-61.8	108.4	0	0	112.8	D84 K89	D84-E86 VanDerWaalsContact C-N 3.27Å; D84-E86 PolarHBondContact O-N 3.46Å; E86-K89 IonicContact OE1-NZ 3.31Å; E86-K89 PolarHBondContact OE1-NZ 3.05Å; E86-K89 WeakPolarHBondContact OE2-CE 3.44Å; E86-K89 IonicContact OE2-NZ 2.64Å; E86-K89 PolarHBondContact OE2-NZ 3.47Å
87	K	91.6	Very high	91.8	Very high	134 Å²	134	67.2 Å²	67.2	58%	0.583	34%	0.342	S	S	*	.	H	α-helix	trans	-73.1	-36.6	173.7	179	-177.3	-178	173.2	0	112.8	D84 W85	D84-K87 PolarHBondContact O-N 2.95Å; D84-K87 VanDerWaalsContact OD1-CB 3.23Å; D84-K87 WeakPolarHBondContact OD1-CB 3.49Å; D84-K87 WeakPolarHBondContact OD2-CD 3.4Å; D84-K87 IonicContact OD2-NZ 4Å; W85-K87 PolarHBondContact O-N 3.49Å
88	Y	90.8	Very high	91.8	Very high	32 Å²	32	62.7 Å²	62.7	13%	0.125	32%	0.322	C	S	.	.	H	α-helix	trans	-94.4	-20.5	-170	-70.6	-65.5	0	0	0	115.1	M81 D84 W85 S90 S91 K93	M81-Y88 HydrophobicContact CB-CD2 4Å; M81-Y88 HydrophobicContact CB-CG 4.15Å; M81-Y88 HydrophobicContact CG-CD1 4.04Å; M81-Y88 HydrophobicContact CG-CD2 3.91Å; M81-Y88 HydrophobicContact CG-CE1 4.32Å; M81-Y88 HydrophobicContact CG-CE2 4.15Å; M81-Y88 HydrophobicContact CG-CG 3.83Å; D84-Y88 HydrophobicContact CB-CD2 4.16Å; D84-Y88 HydrophobicContact CB-CE2 4.06Å; D84-Y88 WeakPolarHBondContact O-CD2 3.4Å; D84-Y88 PolarHBondContact O-N 3.08Å; W85-Y88 PolarHBondContact O-N 3.32Å; Y88-S90 PolarHBondContact O-N 3.14Å; Y88-S90 VanDerWaalsContact O-N 3.08Å; Y88-S91 VanDerWaalsContact O-CB 3.27Å; Y88-S91 WeakPolarHBondContact O-CB 3.29Å; Y88-S91 PolarHBondContact O-N 2.83Å; Y88-S91 PolarHBondContact O-OG 3.31Å; Y88-K93 HydrophobicContact CD1-CD 4.06Å; Y88-K93 HydrophobicContact CE1-CD 3.5Å; Y88-K93 PolarHBondContact OH-NZ 3.45Å; Y88-K93 VanDerWaalsContact OH-NZ 3.13Å
89	K	87.6	Confident	91.8	Very high	78 Å²	78	63.3 Å²	63.3	34%	0.339	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-29.9	-173.5	67.3	-177.1	174	-172.4	0	115.1	W85 E86	W85-K89 HydrophobicContact CD2-CB 3.96Å; W85-K89 VanDerWaalsContact CE2-CB 3.48Å; W85-K89 HydrophobicContact CE3-CB 4.43Å; W85-K89 HydrophobicContact CH2-CB 4.1Å; W85-K89 HydrophobicContact CZ2-CB 3.58Å; W85-K89 HydrophobicContact CZ3-CB 4.5Å; W85-K89 WeakPolarHBondContact O-CB 3.35Å; W85-K89 PolarHBondContact O-N 3.09Å; E86-K89 IonicContact OE1-NZ 3.31Å; E86-K89 PolarHBondContact OE1-NZ 3.05Å; E86-K89 WeakPolarHBondContact OE2-CE 3.44Å; E86-K89 IonicContact OE2-NZ 2.64Å; E86-K89 PolarHBondContact OE2-NZ 3.47Å
90	S	84.8	Confident	91.7	Very high	106 Å²	106	64.6 Å²	64.6	74%	0.741	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	14	176.7	-54.2	0	0	0	0	112.6	Y88	Y88-S90 PolarHBondContact O-N 3.14Å; Y88-S90 VanDerWaalsContact O-N 3.08Å
91	S	90.5	Very high	91.6	Very high	24 Å²	24	60.2 Å²	60.2	17%	0.168	30%	0.303	C	S	.	.			trans	-81.8	140.5	-176.6	76.2	0	0	0	0	111.5	Y88 K93 L94	Y88-S91 VanDerWaalsContact O-CB 3.27Å; Y88-S91 WeakPolarHBondContact O-CB 3.29Å; Y88-S91 PolarHBondContact O-N 2.83Å; Y88-S91 PolarHBondContact O-OG 3.31Å; S91-K93 PolarHBondContact O-N 3.31Å; S91-K93 VanDerWaalsContact O-N 3.12Å; S91-L94 WeakPolarHBondContact O-CB 3.43Å; S91-L94 PolarHBondContact O-N 3.47Å; S91-L94 VanDerWaalsContact O-N 3.13Å; S91-L94 PolarHBondContact OG-N 3.48Å
92	R	91.3	Very high	91.5	Very high	201 Å²	201	60.2 Å²	60.2	76%	0.758	30%	0.303	S	S	*	.	H	α-helix	trans	-58	-25.4	167.6	-172.4	178	-70.9	171	-1.3	112	L94 I95 D96	R92-L94 VanDerWaalsContact C-N 3.34Å; R92-L94 PolarHBondContact O-N 2.95Å; R92-I95 PolarHBondContact O-N 3.5Å; R92-D96 VanDerWaalsContact O-CB 3.3Å; R92-D96 WeakPolarHBondContact O-CB 3.35Å; R92-D96 PolarHBondContact O-N 3.43Å
93	K	93.1	Very high	91.5	Very high	94 Å²	94	58.3 Å²	58.3	41%	0.409	29%	0.294	S	S	.	.	H	α-helix	trans	-62.6	-40.8	177.8	-166.1	-174	-178.2	-177.6	0	111.4	M81 Y88 S91 R97	M81-K93 HydrophobicContact SD-CG 4.49Å; Y88-K93 HydrophobicContact CD1-CD 4.06Å; Y88-K93 HydrophobicContact CE1-CD 3.5Å; Y88-K93 PolarHBondContact OH-NZ 3.45Å; Y88-K93 VanDerWaalsContact OH-NZ 3.13Å; S91-K93 PolarHBondContact O-N 3.31Å; S91-K93 VanDerWaalsContact O-N 3.12Å; K93-R97 WeakPolarHBondContact O-CB 3.38Å; K93-R97 WeakPolarHBondContact O-CG 3.45Å; K93-R97 PolarHBondContact O-N 2.95Å; K93-R97 VanDerWaalsContact O-N 3.08Å
94	L	93.1	Very high	91.2	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-52.6	175.5	176.3	64	0	0	0	110.8	W78 W85 S91 R92 D96 R97 A98 M110 L114 V291	W78-L94 HydrophobicContact CH2-CD1 4.47Å; W78-L94 HydrophobicContact CZ3-CD1 3.88Å; W85-L94 HydrophobicContact CH2-CD2 3.63Å; W85-L94 HydrophobicContact CZ3-CD1 4.19Å; W85-L94 HydrophobicContact CZ3-CD2 3.79Å; S91-L94 WeakPolarHBondContact O-CB 3.43Å; S91-L94 PolarHBondContact O-N 3.47Å; S91-L94 VanDerWaalsContact O-N 3.13Å; S91-L94 PolarHBondContact OG-N 3.48Å; R92-L94 VanDerWaalsContact C-N 3.34Å; R92-L94 PolarHBondContact O-N 2.95Å; L94-D96 VanDerWaalsContact C-N 3.34Å; L94-D96 PolarHBondContact O-N 2.88Å; L94-R97 WeakPolarHBondContact O-CB 3.35Å; L94-R97 PolarHBondContact O-N 3.49Å; L94-A98 PolarHBondContact O-N 2.99Å; L94-M110 HydrophobicContact CD1-CE 4.4Å; L94-M110 HydrophobicContact CD1-SD 4.41Å; L94-L114 HydrophobicContact CD2-CD2 4.46Å; L94-V291 HydrophobicContact CD2-CG1 4.22Å; L94-V291 HydrophobicContact CG-CG1 4Å; L94-V291 HydrophobicContact CG-CG2 4.38Å
95	I	92.3	Very high	90.9	Very high	47 Å²	47	55.8 Å²	55.8	24%	0.241	26%	0.261	C	S	.	.	H	α-helix	trans	-54.1	-52.2	177.2	-59.3	174.3	0	0	0	110.1	R92 R97 A98 Y99 V291 E292	R92-I95 PolarHBondContact O-N 3.5Å; I95-R97 PolarHBondContact O-N 3.4Å; I95-R97 VanDerWaalsContact O-N 3.13Å; I95-A98 WeakPolarHBondContact O-CB 3.42Å; I95-A98 PolarHBondContact O-N 2.95Å; I95-A98 VanDerWaalsContact O-N 3.11Å; I95-Y99 HydrophobicContact CG2-CD2 3.99Å; I95-Y99 HydrophobicContact CG2-CE2 3.64Å; I95-Y99 VanDerWaalsContact O-CD2 3.26Å; I95-Y99 WeakPolarHBondContact O-CD2 3.09Å; I95-Y99 PolarHBondContact O-N 2.56Å; I95-V291 HydrophobicContact CB-CG1 4.45Å; I95-V291 HydrophobicContact CG1-CG1 3.88Å; I95-E292 HydrophobicContact CG2-CG 4.47Å; I95-E292 WeakPolarHBondContact CG2-OE1 3.02Å
96	D	93.2	Very high	91	Very high	46 Å²	46	54.2 Å²	54.2	25%	0.246	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-28.1	-179.8	-84.8	27	0	0	0	114.1	R92 L94 K100 R344	R92-D96 VanDerWaalsContact O-CB 3.3Å; R92-D96 WeakPolarHBondContact O-CB 3.35Å; R92-D96 PolarHBondContact O-N 3.43Å; L94-D96 VanDerWaalsContact C-N 3.34Å; L94-D96 PolarHBondContact O-N 2.88Å; D96-K100 WeakPolarHBondContact O-CG 3.07Å; D96-R344 IonicContact OD1-CZ 3.57Å; D96-R344 IonicContact OD1-NH2 2.68Å; D96-R344 PolarHBondContact OD1-NH2 3.09Å; D96-R344 IonicContact OD2-CZ 2.81Å; D96-R344 IonicContact OD2-NH2 2.58Å; D96-R344 PolarHBondContact OD2-NH2 3.02Å
97	R	93.7	Very high	91.1	Very high	43 Å²	43	48.8 Å²	48.8	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-82.1	-39.7	176.6	-69.6	-78.2	171.9	-176.7	-3.1	111.5	W78 M81 K93 L94 I95 Y99 K100 G101	W78-R97 HydrophobicContact CH2-CB 4.02Å; W78-R97 HydrophobicContact CZ2-CB 3.68Å; M81-R97 HydrophobicContact CE-CB 3.99Å; M81-R97 HydrophobicContact CE-CG 3.95Å; M81-R97 HydrophobicContact SD-CG 4.24Å; K93-R97 WeakPolarHBondContact O-CB 3.38Å; K93-R97 WeakPolarHBondContact O-CG 3.45Å; K93-R97 PolarHBondContact O-N 2.95Å; K93-R97 VanDerWaalsContact O-N 3.08Å; L94-R97 WeakPolarHBondContact O-CB 3.35Å; L94-R97 PolarHBondContact O-N 3.49Å; I95-R97 PolarHBondContact O-N 3.4Å; I95-R97 VanDerWaalsContact O-N 3.13Å; R97-Y99 VanDerWaalsContact C-N 3.33Å; R97-Y99 PolarHBondContact O-N 2.72Å; R97-K100 WeakPolarHBondContact O-CA 3.33Å; R97-K100 WeakPolarHBondContact O-CB 3.23Å; R97-K100 PolarHBondContact O-N 3.45Å; R97-G101 PolarHBondContact O-N 3.29Å; R97-G101 VanDerWaalsContact O-N 3.16Å
98	A	93.3	Very high	91.2	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-55.3	-47.5	174.9	0	0	0	0	0	111.3	W78 L94 I95 K100 G101 V291	W78-A98 HydrophobicContact CH2-CB 4.43Å; L94-A98 PolarHBondContact O-N 2.99Å; I95-A98 WeakPolarHBondContact O-CB 3.42Å; I95-A98 PolarHBondContact O-N 2.95Å; I95-A98 VanDerWaalsContact O-N 3.11Å; A98-K100 PolarHBondContact O-N 3.27Å; A98-G101 PolarHBondContact O-N 3.07Å; A98-V291 HydrophobicContact CB-CB 4.21Å; A98-V291 HydrophobicContact CB-CG1 4.3Å; A98-V291 HydrophobicContact CB-CG2 3.96Å
99	Y	93	Very high	91.4	Very high	13 Å²	13	44 Å²	44	5%	0.051	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.8	175.4	-77.7	-81.7	0	0	0	114.4	I95 R97 G101 R284 V288 E292 L340 L343 R344 M347	I95-Y99 HydrophobicContact CG2-CD2 3.99Å; I95-Y99 HydrophobicContact CG2-CE2 3.64Å; I95-Y99 VanDerWaalsContact O-CD2 3.26Å; I95-Y99 WeakPolarHBondContact O-CD2 3.09Å; I95-Y99 PolarHBondContact O-N 2.56Å; R97-Y99 VanDerWaalsContact C-N 3.33Å; R97-Y99 PolarHBondContact O-N 2.72Å; Y99-G101 VanDerWaalsContact C-N 3.31Å; Y99-R284 PolarHBondContact O-NH2 2.72Å; Y99-V288 HydrophobicContact CD1-CG2 4.05Å; Y99-V288 HydrophobicContact CE1-CG1 3.87Å; Y99-V288 HydrophobicContact CE1-CG2 4.15Å; Y99-V288 HydrophobicContact CE2-CG1 4.21Å; Y99-V288 HydrophobicContact CG-CG2 4.32Å; Y99-E292 HydrophobicContact CE2-CG 4.39Å; Y99-E292 WeakPolarHBondContact CE2-OE1 3.47Å; Y99-E292 PolarHBondContact OH-OE1 3.16Å; Y99-L340 HydrophobicContact CD1-CD1 4.28Å; Y99-L343 HydrophobicContact CE1-CB 4.36Å; Y99-L343 HydrophobicContact CE1-CD2 4.05Å; Y99-L343 HydrophobicContact CE1-CG 4.01Å; Y99-R344 HydrophobicContact CD1-CB 3.64Å; Y99-R344 HydrophobicContact CD1-CG 4.04Å; Y99-R344 HydrophobicContact CD2-CG 4.26Å; Y99-R344 HydrophobicContact CE1-CB 3.61Å; Y99-R344 HydrophobicContact CE1-CG 4.04Å; Y99-R344 HydrophobicContact CE2-CG 4.29Å; Y99-R344 HydrophobicContact CG-CB 4.22Å; Y99-R344 HydrophobicContact CG-CG 4.15Å; Y99-M347 WeakPolarHBondContact OH-CG 3.36Å
100	K	91.7	Very high	91.7	Very high	84 Å²	84	40.3 Å²	40.3	37%	0.365	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-27.5	175.2	-71.6	171.2	-176	176.1	0	111.1	R74 D96 R97 A98 R284	R74-K100 PolarHBondContact NH1-O 3.41Å; D96-K100 WeakPolarHBondContact O-CG 3.07Å; R97-K100 WeakPolarHBondContact O-CA 3.33Å; R97-K100 WeakPolarHBondContact O-CB 3.23Å; R97-K100 PolarHBondContact O-N 3.45Å; A98-K100 PolarHBondContact O-N 3.27Å; K100-R284 PolarHBondContact O-NH2 3.24Å; K100-R284 VanDerWaalsContact O-NH2 3.15Å
101	G	90.4	Very high	92.2	Very high	5 Å²	5	35.3 Å²	35.3	5%	0.052	17%	0.167	C	C	.	.			trans	113.3	132.5	-178.4	0	0	0	0	0	111.6	R97 A98 Y99	R97-G101 PolarHBondContact O-N 3.29Å; R97-G101 VanDerWaalsContact O-N 3.16Å; A98-G101 PolarHBondContact O-N 3.07Å; Y99-G101 VanDerWaalsContact C-N 3.31Å
102	M	92.7	Very high	92.4	Very high	1 Å²	1	35 Å²	35	1%	0.005	17%	0.165	C	C	.	.			trans	-84.6	131.4	174.4	-161.8	179.5	-55.5	0	0	109.9	W78 I106 R107 M110 D287	W78-M102 HydrophobicContact CD2-CG 4.2Å; W78-M102 HydrophobicContact CE3-CG 4.25Å; W78-M102 HydrophobicContact CH2-CB 4.26Å; W78-M102 HydrophobicContact CH2-CE 3.76Å; W78-M102 HydrophobicContact CH2-CG 4.08Å; W78-M102 HydrophobicContact CZ2-CB 3.97Å; W78-M102 HydrophobicContact CZ2-CG 3.98Å; W78-M102 HydrophobicContact CZ3-CE 3.77Å; W78-M102 HydrophobicContact CZ3-CG 4.21Å; W78-M102 HydrophobicContact CZ3-SD 4.42Å; M102-I106 HydrophobicContact CG-CB 4.32Å; M102-I106 HydrophobicContact CG-CG2 4.32Å; M102-I106 HydrophobicContact SD-CG2 4.42Å; M102-R107 HydrophobicContact CB-CG 4.3Å; M102-R107 HydrophobicContact CG-CG 4.2Å; M102-R107 PolarHBondContact O-NH2 2.89Å; M102-R107 VanDerWaalsContact O-NH2 3.1Å; M102-R107 VanDerWaalsContact SD-CA 3.58Å; M102-R107 HydrophobicContact SD-CB 4.31Å; M102-R107 HydrophobicContact SD-CG 3.86Å; M102-M110 HydrophobicContact CE-CB 3.96Å; M102-M110 HydrophobicContact CE-CG 3.34Å; M102-M110 HydrophobicContact SD-CB 3.51Å; M102-M110 VanDerWaalsContact SD-CB 3.51Å; M102-M110 HydrophobicContact SD-CG 3.61Å; M102-D287 HydrophobicContact CB-CB 4.46Å; M102-D287 WeakPolarHBondContact CB-OD2 3.29Å; M102-D287 HydrophobicContact CE-CB 4.27Å
103	P	91.1	Very high	92.4	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.013	14%	0.14	C	C	.	.			trans	-59.6	143	172.8	-23.3	33.9	0	0	0	110.9	E71 R74 W78 N105 I106 R107	E71-P103 WeakPolarHBondContact O-CG 3.46Å; R74-P103 HydrophobicContact CB-CG 4.1Å; W78-P103 VanDerWaalsContact NE1-CD 3.26Å; P103-N105 VanDerWaalsContact C-N 3.26Å; P103-N105 WeakPolarHBondContact CB-OD1 3.25Å; P103-N105 PolarHBondContact O-N 2.99Å; P103-I106 HydrophobicContact CB-CG1 4.21Å; P103-I106 HydrophobicContact CG-CG1 4.42Å; P103-I106 PolarHBondContact O-N 3.04Å; P103-R107 PolarHBondContact O-N 3.05Å
104	M	86.7	Confident	92.4	Very high	41 Å²	41	23.8 Å²	23.8	20%	0.202	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-54.4	-41.6	-175.2	-170.3	167.3	64.7	0	0	113.4	L49 I106 R107 Y200 Y472	L49-M104 HydrophobicContact CD2-SD 4.46Å; M104-I106 PolarHBondContact O-N 2.94Å; M104-R107 PolarHBondContact O-N 3.35Å; M104-Y200 HydrophobicContact CG-CE1 3.6Å; M104-Y472 HydrophobicContact CE-CD2 4.48Å; M104-Y472 HydrophobicContact CE-CE1 4.18Å; M104-Y472 HydrophobicContact CE-CE2 3.92Å
105	N	86.3	Confident	92.4	Very high	49 Å²	49	23.8 Å²	23.8	26%	0.262	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-73.7	-8.8	-179.5	61.8	-19.7	0	0	0	114.9	K75 P103 F474	K75-N105 WeakPolarHBondContact CE-ND2 3.5Å; P103-N105 VanDerWaalsContact C-N 3.26Å; P103-N105 WeakPolarHBondContact CB-OD1 3.25Å; P103-N105 PolarHBondContact O-N 2.99Å; N105-F474 HydrophobicContact CB-CE1 3.81Å; N105-F474 HydrophobicContact CB-CE2 4.15Å; N105-F474 HydrophobicContact CB-CZ 3.33Å
106	I	92.4	Very high	92.3	Very high	8 Å²	8	24.4 Å²	24.4	4%	0.041	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-102.1	-16.5	178.2	-59.1	-61.6	0	0	0	112	K75 W78 V79 L82 M102 P103 M104 G108 P109 M110	K75-I106 HydrophobicContact CG-CD1 4.01Å; K75-I106 HydrophobicContact CG-CG1 4.2Å; W78-I106 HydrophobicContact CB-CB 4.48Å; W78-I106 HydrophobicContact CB-CG1 4.23Å; W78-I106 HydrophobicContact CB-CG2 3.81Å; W78-I106 HydrophobicContact CG-CG2 4.34Å; V79-I106 HydrophobicContact CG2-CD1 3.84Å; L82-I106 HydrophobicContact CD1-CG2 4.03Å; M102-I106 HydrophobicContact CG-CB 4.32Å; M102-I106 HydrophobicContact CG-CG2 4.32Å; M102-I106 HydrophobicContact SD-CG2 4.42Å; P103-I106 HydrophobicContact CB-CG1 4.21Å; P103-I106 HydrophobicContact CG-CG1 4.42Å; P103-I106 PolarHBondContact O-N 3.04Å; M104-I106 PolarHBondContact O-N 2.94Å; I106-G108 PolarHBondContact O-N 3.25Å; I106-P109 WeakPolarHBondContact O-CD 3.16Å; I106-M110 HydrophobicContact CG2-CB 4.1Å; I106-M110 VanDerWaalsContact O-CB 3.27Å; I106-M110 WeakPolarHBondContact O-CB 3.32Å; I106-M110 PolarHBondContact O-N 3.11Å
107	R	93.7	Very high	92.3	Very high	12 Å²	12	22.3 Å²	22.3	5%	0.045	12%	0.118	C	C	.	.	H	α-helix	trans	-53.9	-49.3	-177.9	-73.4	-170.2	179.6	106.6	7	113.1	M102 P103 M104 M110 W111 Y200 D287	M102-R107 HydrophobicContact CB-CG 4.3Å; M102-R107 HydrophobicContact CG-CG 4.2Å; M102-R107 PolarHBondContact O-NH2 2.89Å; M102-R107 VanDerWaalsContact O-NH2 3.1Å; M102-R107 VanDerWaalsContact SD-CA 3.58Å; M102-R107 HydrophobicContact SD-CB 4.31Å; M102-R107 HydrophobicContact SD-CG 3.86Å; P103-R107 PolarHBondContact O-N 3.05Å; M104-R107 PolarHBondContact O-N 3.35Å; R107-M110 PolarHBondContact O-N 3.33Å; R107-W111 HydrophobicContact CB-CD2 4.35Å; R107-W111 HydrophobicContact CB-CZ2 4.37Å; R107-W111 HydrophobicContact CG-CZ2 4.33Å; R107-W111 WeakPolarHBondContact O-CB 3.34Å; R107-W111 VanDerWaalsContact O-CD1 3.32Å; R107-W111 PolarHBondContact O-N 3.05Å; R107-Y200 HydrophobicContact CB-CD1 3.84Å; R107-Y200 HydrophobicContact CB-CD2 4.49Å; R107-Y200 HydrophobicContact CB-CE1 4.34Å; R107-Y200 HydrophobicContact CB-CG 3.92Å; R107-D287 IonicContact CZ-OD2 3.32Å; R107-D287 IonicContact NE-OD1 2.72Å; R107-D287 PolarHBondContact NE-OD1 3.36Å; R107-D287 IonicContact NE-OD2 3.5Å; R107-D287 PolarHBondContact NE-OD2 3.12Å; R107-D287 IonicContact NH2-OD2 3.86Å; R107-D287 PolarHBondContact NH2-OD2 2.88Å
108	G	94.1	Very high	92.2	Very high	6 Å²	6	24.1 Å²	24.1	6%	0.062	13%	0.129	C	C	.	.	H	α-helix	trans	-53.3	-65.2	178.8	0	0	0	0	0	112.5	I106 M110 W111 S112 Y200 L201	I106-G108 PolarHBondContact O-N 3.25Å; G108-M110 VanDerWaalsContact C-N 3.3Å; G108-M110 PolarHBondContact O-N 3.47Å; G108-W111 PolarHBondContact O-N 3.02Å; G108-S112 PolarHBondContact O-N 3.07Å; G108-S112 PolarHBondContact O-OG 3.35Å; G108-Y200 VanDerWaalsContact CA-O 3.25Å; G108-Y200 WeakPolarHBondContact CA-O 3.4Å; G108-L201 WeakPolarHBondContact O-CD2 3.14Å
109	P	93.9	Very high	92.1	Very high	61 Å²	61	28.1 Å²	28.1	40%	0.396	15%	0.147	S	C	.	.	H	α-helix	trans	-55.3	-42	179.1	-28	34.8	0	0	0	113.9	L82 I106 V113	L82-P109 HydrophobicContact CD1-CB 3.97Å; I106-P109 WeakPolarHBondContact O-CD 3.16Å; P109-V113 WeakPolarHBondContact O-CG2 3.38Å; P109-V113 PolarHBondContact O-N 3.26Å; P109-V113 VanDerWaalsContact O-N 3.16Å
110	M	94.4	Very high	92	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-71.1	-40.4	-178	-176.4	54.3	74.1	0	0	112.6	W78 L82 W85 L94 M102 I106 R107 G108 V113 L114	W78-M110 HydrophobicContact CE3-CE 3.5Å; W78-M110 HydrophobicContact CE3-CG 4.36Å; W78-M110 HydrophobicContact CZ3-CE 3.74Å; W78-M110 HydrophobicContact CZ3-CG 4.04Å; W78-M110 HydrophobicContact CZ3-SD 4.32Å; L82-M110 HydrophobicContact CD1-CE 4.46Å; L82-M110 HydrophobicContact CD2-CB 4.47Å; L82-M110 HydrophobicContact CD2-CE 3.52Å; L82-M110 HydrophobicContact CD2-SD 4.04Å; L82-M110 HydrophobicContact CG-CE 3.69Å; W85-M110 HydrophobicContact CH2-SD 4.19Å; W85-M110 HydrophobicContact CZ3-CE 4.23Å; W85-M110 HydrophobicContact CZ3-SD 3.8Å; L94-M110 HydrophobicContact CD1-CE 4.4Å; L94-M110 HydrophobicContact CD1-SD 4.41Å; M102-M110 HydrophobicContact CE-CB 3.96Å; M102-M110 HydrophobicContact CE-CG 3.34Å; M102-M110 HydrophobicContact SD-CB 3.51Å; M102-M110 VanDerWaalsContact SD-CB 3.51Å; M102-M110 HydrophobicContact SD-CG 3.61Å; I106-M110 HydrophobicContact CG2-CB 4.1Å; I106-M110 VanDerWaalsContact O-CB 3.27Å; I106-M110 WeakPolarHBondContact O-CB 3.32Å; I106-M110 PolarHBondContact O-N 3.11Å; R107-M110 PolarHBondContact O-N 3.33Å; G108-M110 VanDerWaalsContact C-N 3.3Å; G108-M110 PolarHBondContact O-N 3.47Å; M110-V113 PolarHBondContact O-N 2.68Å; M110-L114 HydrophobicContact CG-CD1 3.86Å; M110-L114 HydrophobicContact CG-CG 4.37Å; M110-L114 WeakPolarHBondContact O-CB 3.22Å; M110-L114 VanDerWaalsContact O-CG 3.24Å; M110-L114 WeakPolarHBondContact O-CG 3.38Å; M110-L114 PolarHBondContact O-N 3.42Å; M110-L114 HydrophobicContact SD-CD1 4.2Å; M110-L114 HydrophobicContact SD-CG 4.13Å
111	W	94.9	Very high	92	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-39.8	176.2	-68.1	3.2	0	0	0	111.3	R107 G108 V113 L114 L115 L196 F197 Y200 L283 W286 D287 L290	R107-W111 HydrophobicContact CB-CD2 4.35Å; R107-W111 HydrophobicContact CB-CZ2 4.37Å; R107-W111 HydrophobicContact CG-CZ2 4.33Å; R107-W111 WeakPolarHBondContact O-CB 3.34Å; R107-W111 VanDerWaalsContact O-CD1 3.32Å; R107-W111 PolarHBondContact O-N 3.05Å; G108-W111 PolarHBondContact O-N 3.02Å; W111-V113 VanDerWaalsContact C-N 3.29Å; W111-V113 PolarHBondContact O-N 3.32Å; W111-L114 PolarHBondContact O-N 3.06Å; W111-L115 WeakPolarHBondContact O-CB 3.5Å; W111-L115 WeakPolarHBondContact O-CG 3.49Å; W111-L115 PolarHBondContact O-N 3.04Å; W111-L196 HydrophobicContact CH2-CD2 4.45Å; W111-L196 HydrophobicContact CH2-CG 4.29Å; W111-F197 AromaticContact CE3-CD1 3.74Å; W111-F197 HydrophobicContact CE3-CD1 3.74Å; W111-F197 HydrophobicContact CE3-CE1 4.12Å; W111-F197 AromaticContact CZ3-CD1 3.91Å; W111-F197 HydrophobicContact CZ3-CD1 3.91Å; W111-F197 HydrophobicContact CZ3-CE1 4.41Å; W111-Y200 HydrophobicContact CE3-CD2 4.4Å; W111-Y200 AromaticContact CH2-CD2 3.74Å; W111-Y200 HydrophobicContact CH2-CD2 3.74Å; W111-Y200 HydrophobicContact CH2-CE2 4.16Å; W111-Y200 AromaticContact CZ3-CD2 3.61Å; W111-Y200 HydrophobicContact CZ3-CD2 3.61Å; W111-Y200 HydrophobicContact CZ3-CE2 4.45Å; W111-Y200 HydrophobicContact CZ3-CG 4.29Å; W111-L283 HydrophobicContact CH2-CD2 3.81Å; W111-L283 HydrophobicContact CZ2-CD2 4.29Å; W111-W286 HydrophobicContact CZ2-CB 4.4Å; W111-D287 PolarHBondContact NE1-OD1 2.93Å; W111-L290 HydrophobicContact CB-CD1 4.28Å; W111-L290 HydrophobicContact CD2-CD1 3.84Å; W111-L290 HydrophobicContact CG-CD1 3.63Å
112	S	94.1	Very high	92.1	Very high	19 Å²	19	31.7 Å²	31.7	13%	0.133	17%	0.167	C	C	.	.	H	α-helix	trans	-55.6	-45.8	173.4	-72	0	0	0	0	112.1	G108 N116 T117 L201	G108-S112 PolarHBondContact O-N 3.07Å; G108-S112 PolarHBondContact O-OG 3.35Å; S112-N116 WeakPolarHBondContact O-CA 3.49Å; S112-N116 PolarHBondContact O-N 3.31Å; S112-T117 VanDerWaalsContact CA-OG1 3.25Å; S112-T117 WeakPolarHBondContact CA-OG1 3.19Å; S112-T117 WeakPolarHBondContact CB-OG1 3.35Å; S112-T117 PolarHBondContact O-N 2.98Å; S112-T117 PolarHBondContact O-OG1 3.44Å; S112-T117 PolarHBondContact OG-OG1 3.46Å; S112-L201 WeakPolarHBondContact OG-CD2 3.02Å
113	V	93	Very high	92.2	Very high	39 Å²	39	37.8 Å²	37.8	24%	0.236	19%	0.193	C	C	.	.	H	α-helix	trans	-72.7	-38.5	179.7	171.5	0	0	0	0	112.1	L82 W85 P109 M110 W111 L115 N116	L82-V113 HydrophobicContact CD2-CB 4.4Å; L82-V113 HydrophobicContact CD2-CG2 4.15Å; W85-V113 HydrophobicContact CB-CG1 4.47Å; W85-V113 VanDerWaalsContact CD1-CG1 3.44Å; W85-V113 HydrophobicContact CD2-CG1 3.31Å; W85-V113 HydrophobicContact CE3-CG1 3.97Å; W85-V113 HydrophobicContact CG-CG1 3.51Å; W85-V113 HydrophobicContact CH2-CG1 4.27Å; W85-V113 HydrophobicContact CZ2-CG1 3.67Å; W85-V113 HydrophobicContact CZ3-CG1 4.41Å; P109-V113 WeakPolarHBondContact O-CG2 3.38Å; P109-V113 PolarHBondContact O-N 3.26Å; P109-V113 VanDerWaalsContact O-N 3.16Å; M110-V113 PolarHBondContact O-N 2.68Å; W111-V113 VanDerWaalsContact C-N 3.29Å; W111-V113 PolarHBondContact O-N 3.32Å; V113-L115 VanDerWaalsContact C-N 3.29Å; V113-L115 PolarHBondContact O-N 2.9Å; V113-N116 PolarHBondContact O-N 3.3Å; V113-N116 PolarHBondContact O-OD1 2.8Å; V113-N116 VanDerWaalsContact O-OD1 3.1Å
114	L	92.5	Very high	92.2	Very high	19 Å²	19	38.9 Å²	38.9	10%	0.099	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-32.9	176.3	-77.2	167.3	0	0	0	112.9	W85 L94 M110 W111 L290 V291	W85-L114 HydrophobicContact CH2-CD2 3.64Å; W85-L114 HydrophobicContact CH2-CG 4.21Å; W85-L114 HydrophobicContact CZ2-CD2 4.12Å; L94-L114 HydrophobicContact CD2-CD2 4.46Å; M110-L114 HydrophobicContact CG-CD1 3.86Å; M110-L114 HydrophobicContact CG-CG 4.37Å; M110-L114 WeakPolarHBondContact O-CB 3.22Å; M110-L114 VanDerWaalsContact O-CG 3.24Å; M110-L114 WeakPolarHBondContact O-CG 3.38Å; M110-L114 PolarHBondContact O-N 3.42Å; M110-L114 HydrophobicContact SD-CD1 4.2Å; M110-L114 HydrophobicContact SD-CG 4.13Å; W111-L114 PolarHBondContact O-N 3.06Å; L114-L290 HydrophobicContact CD1-CB 3.95Å; L114-V291 HydrophobicContact CD1-CG2 3.77Å; L114-V291 HydrophobicContact CD2-CG2 3.98Å
115	L	92.2	Very high	92.6	Very high	3 Å²	3	42 Å²	42	2%	0.016	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	1.5	-178.9	-66.6	169.5	0	0	0	113	W111 V113 T117 F197 A209 Q212 L213 L290	W111-L115 WeakPolarHBondContact O-CB 3.5Å; W111-L115 WeakPolarHBondContact O-CG 3.49Å; W111-L115 PolarHBondContact O-N 3.04Å; V113-L115 VanDerWaalsContact C-N 3.29Å; V113-L115 PolarHBondContact O-N 2.9Å; L115-T117 HydrophobicContact CB-CG2 4Å; L115-T117 PolarHBondContact O-N 3.35Å; L115-F197 HydrophobicContact CD1-CE1 3.73Å; L115-F197 HydrophobicContact CD1-CZ 3.76Å; L115-A209 HydrophobicContact CD1-CB 3.61Å; L115-Q212 HydrophobicContact CB-CB 4.23Å; L115-Q212 HydrophobicContact CD2-CB 4.44Å; L115-Q212 VanDerWaalsContact O-CB 3.31Å; L115-Q212 WeakPolarHBondContact O-CB 3.23Å; L115-Q212 WeakPolarHBondContact O-CG 3.47Å; L115-Q212 PolarHBondContact O-NE2 3.47Å; L115-L213 HydrophobicContact CD2-CB 4.46Å; L115-L213 HydrophobicContact CD2-CD1 4.23Å; L115-L290 HydrophobicContact CD1-CD2 4.04Å; L115-L290 HydrophobicContact CD2-CD2 3.81Å; L115-L290 HydrophobicContact CG-CD2 4.08Å
116	N	91.8	Very high	92.9	Very high	61 Å²	61	41.7 Å²	41.7	33%	0.326	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	41.3	-175.9	-62.4	-12.9	0	0	0	113.2	S112 V113 E118 E119 M120	S112-N116 WeakPolarHBondContact O-CA 3.49Å; S112-N116 PolarHBondContact O-N 3.31Å; V113-N116 PolarHBondContact O-N 3.3Å; V113-N116 PolarHBondContact O-OD1 2.8Å; V113-N116 VanDerWaalsContact O-OD1 3.1Å; N116-E118 VanDerWaalsContact C-N 3.3Å; N116-E118 PolarHBondContact O-N 2.95Å; N116-E119 HydrophobicContact CB-CB 4.24Å; N116-E119 PolarHBondContact ND2-OE2 3.41Å; N116-E119 PolarHBondContact O-N 3.37Å; N116-M120 PolarHBondContact O-N 2.91Å
117	T	92.1	Very high	93	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.012	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-38.5	-176.7	56.9	0	0	0	0	111.9	S112 L115 M120 K121 W208 A209	S112-T117 VanDerWaalsContact CA-OG1 3.25Å; S112-T117 WeakPolarHBondContact CA-OG1 3.19Å; S112-T117 WeakPolarHBondContact CB-OG1 3.35Å; S112-T117 PolarHBondContact O-N 2.98Å; S112-T117 PolarHBondContact O-OG1 3.44Å; S112-T117 PolarHBondContact OG-OG1 3.46Å; L115-T117 HydrophobicContact CB-CG2 4Å; L115-T117 PolarHBondContact O-N 3.35Å; T117-M120 PolarHBondContact O-N 2.94Å; T117-K121 WeakPolarHBondContact O-CG 3.35Å; T117-K121 PolarHBondContact O-N 2.93Å; T117-W208 HydrophobicContact CG2-CB 4.4Å; T117-A209 HydrophobicContact CG2-CB 3.85Å
118	E	91	Very high	93.1	Very high	81 Å²	81	45.5 Å²	45.5	38%	0.379	25%	0.245	S	C	.	.	H	α-helix	trans	-62.7	-43.8	178.4	-174.9	167.7	-153.3	0	0	112.1	N116 M120 K121 L122 W447	N116-E118 VanDerWaalsContact C-N 3.3Å; N116-E118 PolarHBondContact O-N 2.95Å; E118-M120 VanDerWaalsContact C-N 3.32Å; E118-M120 PolarHBondContact O-N 3.43Å; E118-K121 PolarHBondContact O-N 3.43Å; E118-L122 HydrophobicContact CG-CD1 4.19Å; E118-L122 WeakPolarHBondContact O-CB 3.29Å; E118-L122 VanDerWaalsContact O-CG 3.31Å; E118-L122 WeakPolarHBondContact O-CG 3.5Å; E118-L122 PolarHBondContact O-N 2.85Å; E118-W447 PolarHBondContact OE1-NE1 3Å
119	E	91.2	Very high	93.2	Very high	84 Å²	84	49.5 Å²	49.5	39%	0.393	26%	0.262	S	S	.	.	H	α-helix	trans	-61.8	-41.5	176.1	-173.1	-176.3	176.7	0	0	111.3	N116 L122 K123	N116-E119 HydrophobicContact CB-CB 4.24Å; N116-E119 PolarHBondContact ND2-OE2 3.41Å; N116-E119 PolarHBondContact O-N 3.37Å; E119-L122 PolarHBondContact O-N 3.14Å; E119-K123 HydrophobicContact CG-CD 4.27Å; E119-K123 WeakPolarHBondContact O-CB 3.4Å; E119-K123 VanDerWaalsContact O-CG 3.31Å; E119-K123 WeakPolarHBondContact O-CG 3.47Å; E119-K123 PolarHBondContact O-N 3.17Å; E119-K123 VanDerWaalsContact OE1-CE 3.27Å; E119-K123 WeakPolarHBondContact OE1-CE 3.49Å; E119-K123 IonicContact OE1-NZ 2.98Å; E119-K123 PolarHBondContact OE1-NZ 3.42Å
120	M	91.5	Very high	93.3	Very high	24 Å²	24	52.2 Å²	52.2	12%	0.118	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-41.1	177.6	-71.4	-57.5	-69.4	0	0	112.6	N116 T117 E118 K123 N124 W208 V211 Q212	N116-M120 PolarHBondContact O-N 2.91Å; T117-M120 PolarHBondContact O-N 2.94Å; E118-M120 VanDerWaalsContact C-N 3.32Å; E118-M120 PolarHBondContact O-N 3.43Å; M120-K123 PolarHBondContact O-N 3.27Å; M120-N124 WeakPolarHBondContact O-CB 3.4Å; M120-N124 PolarHBondContact O-N 3.01Å; M120-N124 VanDerWaalsContact O-N 3.12Å; M120-N124 PolarHBondContact O-ND2 3.01Å; M120-W208 HydrophobicContact CB-CB 4.25Å; M120-W208 HydrophobicContact CB-CD2 3.92Å; M120-W208 HydrophobicContact CB-CE3 3.74Å; M120-W208 HydrophobicContact CB-CG 4.16Å; M120-W208 HydrophobicContact CB-CZ3 4.41Å; M120-W208 HydrophobicContact CE-CE3 3.91Å; M120-W208 HydrophobicContact CE-CZ3 3.75Å; M120-W208 HydrophobicContact CG-CE3 4.44Å; M120-V211 HydrophobicContact CE-CG1 4.48Å; M120-Q212 HydrophobicContact CG-CG 3.57Å; M120-Q212 PolarHBondContact SD-OE1 2.86Å
121	K	92.5	Very high	93.3	Very high	44 Å²	44	52.8 Å²	52.8	19%	0.191	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-46.8	174.4	-76.8	-178.6	59.4	154.4	0	112	T117 E118 K123 N124 E204 D205 W208	T117-K121 WeakPolarHBondContact O-CG 3.35Å; T117-K121 PolarHBondContact O-N 2.93Å; E118-K121 PolarHBondContact O-N 3.43Å; K121-K123 VanDerWaalsContact C-N 3.3Å; K121-K123 PolarHBondContact O-N 2.68Å; K121-N124 CarbonylContact O-C 3.56Å; K121-N124 VanDerWaalsContact O-C 3.28Å; K121-N124 PolarHBondContact O-N 3.22Å; K121-N124 VanDerWaalsContact O-N 3.1Å; K121-E204 HydrophobicContact CD-CG 4.16Å; K121-E204 WeakPolarHBondContact CE-OE2 3.1Å; K121-E204 HydrophobicContact CG-CG 4.45Å; K121-E204 IonicContact NZ-OE2 3.18Å; K121-E204 PolarHBondContact NZ-OE2 3.38Å; K121-D205 WeakPolarHBondContact CD-OD1 3.44Å; K121-D205 WeakPolarHBondContact CE-OD1 3.39Å; K121-D205 IonicContact NZ-OD1 3Å; K121-D205 PolarHBondContact NZ-OD1 3.39Å; K121-W208 HydrophobicContact CG-CG 3.94Å
122	L	92.9	Very high	93.4	Very high	109 Å²	109	53.8 Å²	53.8	57%	0.571	28%	0.279	S	S	*	.	H	α-helix	trans	-62.8	-36.6	178.9	-71.8	171.7	0	0	0	112.4	E118 E119 N124	E118-L122 HydrophobicContact CG-CD1 4.19Å; E118-L122 WeakPolarHBondContact O-CB 3.29Å; E118-L122 VanDerWaalsContact O-CG 3.31Å; E118-L122 WeakPolarHBondContact O-CG 3.5Å; E118-L122 PolarHBondContact O-N 2.85Å; E119-L122 PolarHBondContact O-N 3.14Å; L122-N124 VanDerWaalsContact C-N 3.3Å
123	K	93	Very high	93.5	Very high	129 Å²	129	55.8 Å²	55.8	56%	0.561	29%	0.286	S	S	*	.	H	α-helix	trans	-73.6	-19.5	175.3	-72.6	176	-176	173.5	0	113.8	E119 M120 K121 P125	E119-K123 HydrophobicContact CG-CD 4.27Å; E119-K123 WeakPolarHBondContact O-CB 3.4Å; E119-K123 VanDerWaalsContact O-CG 3.31Å; E119-K123 WeakPolarHBondContact O-CG 3.47Å; E119-K123 PolarHBondContact O-N 3.17Å; E119-K123 VanDerWaalsContact OE1-CE 3.27Å; E119-K123 WeakPolarHBondContact OE1-CE 3.49Å; E119-K123 IonicContact OE1-NZ 2.98Å; E119-K123 PolarHBondContact OE1-NZ 3.42Å; M120-K123 PolarHBondContact O-N 3.27Å; K121-K123 VanDerWaalsContact C-N 3.3Å; K121-K123 PolarHBondContact O-N 2.68Å; K123-P125 VanDerWaalsContact C-CD 3.48Å
124	N	92.6	Very high	93.5	Very high	25 Å²	25	58.9 Å²	58.9	13%	0.134	30%	0.297	C	S	.	.	S	Bend	trans	-132.8	56.8	-172.6	-62.5	-88.5	0	0	0	112.2	M120 K121 L122 G126 R127 W208	M120-N124 WeakPolarHBondContact O-CB 3.4Å; M120-N124 PolarHBondContact O-N 3.01Å; M120-N124 VanDerWaalsContact O-N 3.12Å; M120-N124 PolarHBondContact O-ND2 3.01Å; K121-N124 CarbonylContact O-C 3.56Å; K121-N124 VanDerWaalsContact O-C 3.28Å; K121-N124 PolarHBondContact O-N 3.22Å; K121-N124 VanDerWaalsContact O-N 3.1Å; L122-N124 VanDerWaalsContact C-N 3.3Å; N124-G126 PolarHBondContact O-N 3.48Å; N124-R127 HydrophobicContact CB-CB 3.86Å; N124-R127 WeakPolarHBondContact O-CB 3.35Å; N124-R127 PolarHBondContact O-N 3.28Å; N124-R127 VanDerWaalsContact OD1-CD 3.24Å; N124-R127 WeakPolarHBondContact OD1-CD 3.37Å; N124-R127 PolarHBondContact OD1-NH1 2.89Å; N124-W208 HydrophobicContact CB-CH2 3.41Å; N124-W208 VanDerWaalsContact CB-CH2 3.41Å; N124-W208 HydrophobicContact CB-CZ2 3.46Å; N124-W208 VanDerWaalsContact CB-CZ2 3.46Å; N124-W208 HydrophobicContact CB-CZ3 4.46Å
125	P	93.6	Very high	93.6	Very high	107 Å²	107	58 Å²	58	70%	0.695	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	131.1	-177.7	27.3	-35	0	0	0	111.1	K123 R127	K123-P125 VanDerWaalsContact C-CD 3.48Å; P125-R127 PolarHBondContact O-N 2.87Å
126	G	93.2	Very high	93.7	Very high	43 Å²	43	58.9 Å²	58.9	44%	0.443	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	-8.7	178.6	0	0	0	0	0	115.8	N124 Y128 Q129 I130	N124-G126 PolarHBondContact O-N 3.48Å; G126-Y128 VanDerWaalsContact C-N 3.31Å; G126-Y128 PolarHBondContact O-N 3.31Å; G126-Q129 PolarHBondContact O-N 3.45Å; G126-I130 PolarHBondContact O-N 2.63Å
127	R	94.1	Very high	93.7	Very high	91 Å²	91	64.9 Å²	64.9	34%	0.343	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-39.7	-175.4	-169.1	177.7	173.6	166.5	2.3	112.3	N124 P125 Q129 I130 M131 W208	N124-R127 HydrophobicContact CB-CB 3.86Å; N124-R127 WeakPolarHBondContact O-CB 3.35Å; N124-R127 PolarHBondContact O-N 3.28Å; N124-R127 VanDerWaalsContact OD1-CD 3.24Å; N124-R127 WeakPolarHBondContact OD1-CD 3.37Å; N124-R127 PolarHBondContact OD1-NH1 2.89Å; P125-R127 PolarHBondContact O-N 2.87Å; R127-Q129 VanDerWaalsContact C-N 3.34Å; R127-Q129 PolarHBondContact O-N 2.9Å; R127-I130 PolarHBondContact O-N 3.48Å; R127-M131 HydrophobicContact CG-CE 3.89Å; R127-M131 HydrophobicContact CG-CG 4.44Å; R127-M131 HydrophobicContact CG-SD 4.08Å; R127-M131 WeakPolarHBondContact O-CG 3.5Å; R127-M131 PolarHBondContact O-N 3.42Å; R127-W208 HydrophobicContact CB-CZ2 4.48Å
128	Y	95.7	Very high	93.7	Very high	9 Å²	9	67.3 Å²	67.3	4%	0.035	33%	0.331	C	S	.	.	H	α-helix	trans	-57.2	-47.5	177.3	173.7	-109.9	0	0	0	111.8	G126 I130 M131 K132 H172 A176 E203 E204 F207	G126-Y128 VanDerWaalsContact C-N 3.31Å; G126-Y128 PolarHBondContact O-N 3.31Å; Y128-I130 VanDerWaalsContact C-N 3.33Å; Y128-I130 PolarHBondContact O-N 3.41Å; Y128-M131 PolarHBondContact O-N 2.95Å; Y128-K132 HydrophobicContact CE1-CD 4.11Å; Y128-K132 VanDerWaalsContact O-CB 3.3Å; Y128-K132 WeakPolarHBondContact O-CB 3.35Å; Y128-K132 PolarHBondContact O-N 3.27Å; Y128-H172 WeakPolarHBondContact OH-CB 3.14Å; Y128-A176 HydrophobicContact CD2-CB 4Å; Y128-A176 HydrophobicContact CE2-CB 3.66Å; Y128-E203 HydrophobicContact CE1-CG 4.27Å; Y128-E203 WeakPolarHBondContact CE1-OE1 3.09Å; Y128-E203 VanDerWaalsContact CZ-OE1 3.27Å; Y128-E203 VanDerWaalsContact OH-CG 3.27Å; Y128-E203 WeakPolarHBondContact OH-CG 3.41Å; Y128-E203 PolarHBondContact OH-OE1 3.3Å; Y128-E204 HydrophobicContact CD1-CB 3.93Å; Y128-E204 HydrophobicContact CD1-CG 3.83Å; Y128-E204 HydrophobicContact CE1-CB 4.3Å; Y128-E204 HydrophobicContact CG-CB 4.4Å; Y128-E204 HydrophobicContact CG-CG 3.91Å; Y128-F207 HydrophobicContact CD2-CB 3.76Å; Y128-F207 AromaticContact CD2-CD1 3.48Å; Y128-F207 HydrophobicContact CD2-CD1 3.48Å; Y128-F207 VanDerWaalsContact CD2-CD1 3.48Å; Y128-F207 AromaticContact CD2-CD2 3.88Å; Y128-F207 HydrophobicContact CD2-CD2 3.88Å; Y128-F207 HydrophobicContact CD2-CE1 4.04Å; Y128-F207 HydrophobicContact CD2-CE2 4.39Å; Y128-F207 AromaticContact CD2-CG 3.39Å; Y128-F207 HydrophobicContact CD2-CG 3.39Å; Y128-F207 HydrophobicContact CD2-CZ 4.48Å; Y128-F207 HydrophobicContact CE2-CB 3.61Å; Y128-F207 HydrophobicContact CE2-CD1 4.17Å; Y128-F207 AromaticContact CE2-CD2 3.84Å; Y128-F207 HydrophobicContact CE2-CD2 3.84Å; Y128-F207 AromaticContact CE2-CG 3.59Å; Y128-F207 HydrophobicContact CE2-CG 3.59Å; Y128-F207 HydrophobicContact CG-CD1 4.29Å; Y128-F207 HydrophobicContact CG-CG 4.5Å
129	Q	96.2	Very high	93.7	Very high	90 Å²	90	63.6 Å²	63.6	42%	0.421	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-39.6	-179.5	-170.6	58.7	34.9	0	0	111.7	G126 R127 E133	G126-Q129 PolarHBondContact O-N 3.45Å; R127-Q129 VanDerWaalsContact C-N 3.34Å; R127-Q129 PolarHBondContact O-N 2.9Å; Q129-E133 PolarHBondContact NE2-OE1 3.33Å; Q129-E133 WeakPolarHBondContact O-CG 3.39Å; Q129-E133 PolarHBondContact O-N 3.38Å
130	I	96.1	Very high	93.5	Very high	118 Å²	118	67.7 Å²	67.7	61%	0.605	33%	0.333	S	S	*	.	H	α-helix	trans	-62.1	-47.8	175.6	-63.8	168.7	0	0	0	110.9	G126 R127 Y128 E133 K134	G126-I130 PolarHBondContact O-N 2.63Å; R127-I130 PolarHBondContact O-N 3.48Å; Y128-I130 VanDerWaalsContact C-N 3.33Å; Y128-I130 PolarHBondContact O-N 3.41Å; I130-E133 PolarHBondContact O-N 3.4Å; I130-K134 WeakPolarHBondContact O-CB 3.18Å; I130-K134 PolarHBondContact O-N 2.99Å
131	M	95.9	Very high	93.4	Very high	11 Å²	11	69.6 Å²	69.6	5%	0.054	34%	0.342	C	S	.	.	H	α-helix	trans	-67.1	-39	-179.1	-67.7	-179.1	-55.6	0	0	112.1	R127 Y128 K134 G135 A176 E179 Y180 F207	R127-M131 HydrophobicContact CG-CE 3.89Å; R127-M131 HydrophobicContact CG-CG 4.44Å; R127-M131 HydrophobicContact CG-SD 4.08Å; R127-M131 WeakPolarHBondContact O-CG 3.5Å; R127-M131 PolarHBondContact O-N 3.42Å; Y128-M131 PolarHBondContact O-N 2.95Å; M131-K134 PolarHBondContact O-N 3.1Å; M131-G135 PolarHBondContact O-N 3.3Å; M131-A176 HydrophobicContact CB-CB 4.1Å; M131-E179 HydrophobicContact CB-CB 4.24Å; M131-E179 HydrophobicContact CB-CG 4.02Å; M131-E179 HydrophobicContact CG-CG 3.97Å; M131-Y180 HydrophobicContact CE-CD2 4.06Å; M131-Y180 HydrophobicContact SD-CD2 3.72Å; M131-Y180 HydrophobicContact SD-CG 4.27Å; M131-F207 HydrophobicContact CE-CE1 3.5Å; M131-F207 HydrophobicContact CE-CE2 4.26Å; M131-F207 HydrophobicContact CE-CZ 3.26Å; M131-F207 HydrophobicContact SD-CZ 4.4Å
132	K	95.7	Very high	93.5	Very high	21 Å²	21	67.8 Å²	67.8	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-57.8	-52.2	173.6	171.9	178.6	170.6	169.5	0	111.4	Y128 K134 G135 K136 H172 A176 E203	Y128-K132 HydrophobicContact CE1-CD 4.11Å; Y128-K132 VanDerWaalsContact O-CB 3.3Å; Y128-K132 WeakPolarHBondContact O-CB 3.35Å; Y128-K132 PolarHBondContact O-N 3.27Å; K132-K134 PolarHBondContact O-N 2.95Å; K132-G135 PolarHBondContact O-N 3.42Å; K132-K136 WeakPolarHBondContact O-CG 3.31Å; K132-K136 PolarHBondContact O-N 3.27Å; K132-H172 HydrophobicContact CD-CB 3.95Å; K132-H172 VanDerWaalsContact CE-CE1 3.41Å; K132-H172 WeakPolarHBondContact CE-CE1 3.29Å; K132-H172 WeakPolarHBondContact CE-ND1 3.47Å; K132-H172 HydrophobicContact CG-CB 4.13Å; K132-H172 PolarHBondContact NZ-CE1 3.21Å; K132-H172 PolarHBondContact NZ-ND1 3.45Å; K132-A176 HydrophobicContact CB-CB 4.35Å; K132-E203 IonicContact NZ-OE1 2.97Å; K132-E203 PolarHBondContact NZ-OE1 3.08Å; K132-E203 IonicContact NZ-OE2 3.57Å
133	E	95.8	Very high	93.4	Very high	61 Å²	61	65.6 Å²	65.6	29%	0.285	32%	0.321	S	S	.	.	H	α-helix	trans	-67.1	-36.3	-179.7	-67.5	-53.4	130.1	0	0	112.4	Q129 I130 K136 R137	Q129-E133 PolarHBondContact NE2-OE1 3.33Å; Q129-E133 WeakPolarHBondContact O-CG 3.39Å; Q129-E133 PolarHBondContact O-N 3.38Å; I130-E133 PolarHBondContact O-N 3.4Å; E133-K136 IonicContact OE1-NZ 3.57Å; E133-K136 PolarHBondContact OE1-NZ 3.36Å; E133-R137 WeakPolarHBondContact O-CG 3.4Å; E133-R137 PolarHBondContact O-N 3.25Å
134	K	94.4	Very high	93.3	Very high	105 Å²	105	65.3 Å²	65.3	46%	0.457	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-43.8	173.5	-174	170.5	170.5	-160.9	0	111.7	I130 M131 K132 K136 R137 S138 E179	I130-K134 WeakPolarHBondContact O-CB 3.18Å; I130-K134 PolarHBondContact O-N 2.99Å; M131-K134 PolarHBondContact O-N 3.1Å; K132-K134 PolarHBondContact O-N 2.95Å; K134-K136 VanDerWaalsContact C-N 3.34Å; K134-K136 PolarHBondContact O-N 3.19Å; K134-R137 PolarHBondContact O-N 2.96Å; K134-S138 WeakPolarHBondContact O-CB 3.14Å; K134-S138 PolarHBondContact O-N 2.98Å; K134-S138 PolarHBondContact O-OG 3.5Å; K134-E179 HydrophobicContact CB-CG 4.34Å; K134-E179 HydrophobicContact CD-CG 4.05Å; K134-E179 WeakPolarHBondContact CD-OE1 3.41Å; K134-E179 WeakPolarHBondContact CD-OE2 3.32Å; K134-E179 VanDerWaalsContact CE-OE1 3.23Å; K134-E179 WeakPolarHBondContact CE-OE1 3.28Å; K134-E179 WeakPolarHBondContact CE-OE2 3.27Å; K134-E179 HydrophobicContact CG-CG 4.31Å; K134-E179 VanDerWaalsContact NZ-CD 3.32Å; K134-E179 IonicContact NZ-OE1 3.72Å; K134-E179 PolarHBondContact NZ-OE1 2.87Å; K134-E179 IonicContact NZ-OE2 2.76Å; K134-E179 PolarHBondContact NZ-OE2 3.08Å
135	G	93.7	Very high	93.4	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-41.1	177.5	0	0	0	0	0	112.6	M131 K132 R137 S138 S139	M131-G135 PolarHBondContact O-N 3.3Å; K132-G135 PolarHBondContact O-N 3.42Å; G135-R137 PolarHBondContact O-N 3.12Å; G135-S138 PolarHBondContact O-N 3.12Å; G135-S139 WeakPolarHBondContact O-CB 3.47Å; G135-S139 PolarHBondContact O-N 3.13Å
136	K	94.4	Very high	93.4	Very high	21 Å²	21	60.2 Å²	60.2	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-56.2	-36.7	173.1	-69.3	-179.2	-178.2	179.1	0	113	R15 I19 E23 K132 E133 K134 H172 L175	R15-K136 VanDerWaalsContact CD-O 3.32Å; R15-K136 WeakPolarHBondContact CD-O 3.45Å; I19-K136 HydrophobicContact CD1-CB 4.14Å; I19-K136 HydrophobicContact CD1-CG 3.88Å; I19-K136 HydrophobicContact CG1-CB 4.43Å; I19-K136 HydrophobicContact CG2-CD 4.43Å; E23-K136 IonicContact OE1-NZ 2.72Å; E23-K136 PolarHBondContact OE1-NZ 3.43Å; K132-K136 WeakPolarHBondContact O-CG 3.31Å; K132-K136 PolarHBondContact O-N 3.27Å; E133-K136 IonicContact OE1-NZ 3.57Å; E133-K136 PolarHBondContact OE1-NZ 3.36Å; K134-K136 VanDerWaalsContact C-N 3.34Å; K134-K136 PolarHBondContact O-N 3.19Å; K136-H172 WeakPolarHBondContact CE-NE2 3.33Å; K136-L175 HydrophobicContact CG-CD1 4.11Å
137	R	92.3	Very high	93.4	Very high	186 Å²	186	66.6 Å²	66.6	70%	0.702	29%	0.294	S	S	*	.	H	α-helix	trans	-87.8	-23.6	-176.3	-64	175.4	-171.6	178.4	2.5	114.2	R15 E133 K134 G135	R15-R137 PolarHBondContact NE-O 3.1Å; R15-R137 PolarHBondContact NH2-O 3.4Å; E133-R137 WeakPolarHBondContact O-CG 3.4Å; E133-R137 PolarHBondContact O-N 3.25Å; K134-R137 PolarHBondContact O-N 2.96Å; G135-R137 PolarHBondContact O-N 3.12Å
138	S	91.1	Very high	93.3	Very high	53 Å²	53	63.4 Å²	63.4	37%	0.371	28%	0.284	S	S	.	.	H	α-helix	trans	-127.1	-11.7	-165.6	60.3	0	0	0	0	115.5	K134 G135 E140	K134-S138 WeakPolarHBondContact O-CB 3.14Å; K134-S138 PolarHBondContact O-N 2.98Å; K134-S138 PolarHBondContact O-OG 3.5Å; G135-S138 PolarHBondContact O-N 3.12Å; S138-E140 PolarHBondContact O-N 2.74Å
139	S	91.2	Very high	93.1	Very high	4 Å²	4	63 Å²	63	3%	0.028	28%	0.282	C	S	.	.			trans	-57.1	128.5	-179.1	176.4	0	0	0	0	111.9	R15 G135 H141 I142 L175 E178	R15-S139 WeakPolarHBondContact CD-O 3.4Å; G135-S139 WeakPolarHBondContact O-CB 3.47Å; G135-S139 PolarHBondContact O-N 3.13Å; S139-H141 PolarHBondContact OG-N 3.18Å; S139-I142 PolarHBondContact OG-N 2.88Å; S139-I142 VanDerWaalsContact OG-N 3.17Å; S139-L175 VanDerWaalsContact CB-CD2 3.43Å; S139-L175 WeakPolarHBondContact OG-CD2 3.47Å; S139-E178 VanDerWaalsContact CB-OE2 3.25Å; S139-E178 WeakPolarHBondContact CB-OE2 3.47Å; S139-E178 PolarHBondContact OG-OE1 2.92Å; S139-E178 PolarHBondContact OG-OE2 3.33Å
140	E	88.3	Confident	92.9	Very high	169 Å²	169	60.7 Å²	60.7	79%	0.79	28%	0.276	S	S	*	.	S	Bend	trans	-89.4	-21.9	172.4	-61.9	-175.2	164	0	0	110.8	S138 E178	S138-E140 PolarHBondContact O-N 2.74Å; E140-E178 PolarHBondContact N-OE1 3.49Å
141	H	89.5	Confident	92.4	Very high	65 Å²	65	57.4 Å²	57.4	30%	0.301	27%	0.271	S	S	.	.	S	Bend	trans	-95.5	3.7	-174.8	-59.2	97.6	0	0	0	114.1	S139 Q143 R144 I145 E178 Y186	S139-H141 PolarHBondContact OG-N 3.18Å; H141-Q143 VanDerWaalsContact C-N 3.28Å; H141-Q143 PolarHBondContact O-N 3.08Å; H141-Q143 VanDerWaalsContact O-N 3.11Å; H141-R144 WeakPolarHBondContact O-CA 3.5Å; H141-R144 WeakPolarHBondContact O-CB 3.23Å; H141-R144 PolarHBondContact O-N 3.43Å; H141-I145 HydrophobicContact CB-CD1 4.29Å; H141-I145 HydrophobicContact CB-CG1 4.36Å; H141-I145 WeakPolarHBondContact O-CG1 3.27Å; H141-I145 PolarHBondContact O-N 2.99Å; H141-E178 IonicContact CE1-OE1 3.76Å; H141-E178 IonicContact CG-OE1 3.49Å; H141-E178 IonicContact ND1-OE1 2.61Å; H141-E178 PolarHBondContact ND1-OE1 2.94Å; H141-Y186 HydrophobicContact CB-CD1 4.47Å; H141-Y186 HydrophobicContact CB-CG 4.46Å
142	I	93	Very high	92.1	Very high	6 Å²	6	56.9 Å²	56.9	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-52.3	-39.9	-171.6	-167.8	172.2	0	0	0	114.1	R15 I18 I19 S139 R144 I145 D146 L175	R15-I142 HydrophobicContact CB-CD1 4.48Å; R15-I142 HydrophobicContact CB-CG2 3.93Å; R15-I142 HydrophobicContact CG-CB 4.49Å; R15-I142 HydrophobicContact CG-CD1 3.7Å; R15-I142 HydrophobicContact CG-CG2 3.94Å; I18-I142 HydrophobicContact CB-CD1 4.08Å; I18-I142 HydrophobicContact CB-CG1 4.47Å; I18-I142 HydrophobicContact CD1-CG2 4.37Å; I18-I142 HydrophobicContact CG2-CD1 3.85Å; I18-I142 HydrophobicContact CG2-CG1 3.97Å; I19-I142 HydrophobicContact CD1-CD1 3.54Å; I19-I142 HydrophobicContact CG1-CD1 3.68Å; S139-I142 PolarHBondContact OG-N 2.88Å; S139-I142 VanDerWaalsContact OG-N 3.17Å; I142-R144 VanDerWaalsContact C-N 3.31Å; I142-R144 PolarHBondContact O-N 2.94Å; I142-I145 PolarHBondContact O-N 3.24Å; I142-D146 VanDerWaalsContact O-CB 3.3Å; I142-D146 WeakPolarHBondContact O-CB 3.37Å; I142-D146 PolarHBondContact O-N 3.27Å; I142-L175 HydrophobicContact CG1-CD2 4.38Å
143	Q	92	Very high	91.5	Very high	62 Å²	62	57.2 Å²	57.2	29%	0.29	27%	0.271	S	S	.	.	H	α-helix	trans	-64.8	-36.6	178.5	-68.2	-177.4	3.7	0	0	112.4	E14 I18 H141 R147	E14-Q143 HydrophobicContact CG-CG 4.36Å; E14-Q143 VanDerWaalsContact CG-NE2 3.28Å; I18-Q143 HydrophobicContact CD1-CB 4.5Å; I18-Q143 HydrophobicContact CD1-CG 3.86Å; H141-Q143 VanDerWaalsContact C-N 3.28Å; H141-Q143 PolarHBondContact O-N 3.08Å; H141-Q143 VanDerWaalsContact O-N 3.11Å; Q143-R147 WeakPolarHBondContact O-CB 3.31Å; Q143-R147 PolarHBondContact O-N 2.81Å; Q143-R147 VanDerWaalsContact O-N 3.14Å
144	R	91.5	Very high	91.1	Very high	123 Å²	123	58.7 Å²	58.7	46%	0.464	27%	0.274	S	S	.	.	H	α-helix	trans	-70.9	-43.4	176.6	-170.3	179.7	178.2	169.3	1.8	110.2	H141 I142 R147 D148 Y186	H141-R144 WeakPolarHBondContact O-CA 3.5Å; H141-R144 WeakPolarHBondContact O-CB 3.23Å; H141-R144 PolarHBondContact O-N 3.43Å; I142-R144 VanDerWaalsContact C-N 3.31Å; I142-R144 PolarHBondContact O-N 2.94Å; R144-R147 PolarHBondContact O-N 3.01Å; R144-D148 WeakPolarHBondContact O-CB 3.37Å; R144-D148 PolarHBondContact O-N 3.28Å; R144-Y186 HydrophobicContact CB-CE1 4.49Å; R144-Y186 HydrophobicContact CG-CD1 4.23Å; R144-Y186 HydrophobicContact CG-CE1 3.99Å
145	I	93.5	Very high	90.6	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59	-49.3	175	-60.4	173.2	0	0	0	109.9	H141 I142 R147 D148 V149 L171 L174 L175 Y186	H141-I145 HydrophobicContact CB-CD1 4.29Å; H141-I145 HydrophobicContact CB-CG1 4.36Å; H141-I145 WeakPolarHBondContact O-CG1 3.27Å; H141-I145 PolarHBondContact O-N 2.99Å; I142-I145 PolarHBondContact O-N 3.24Å; I145-R147 VanDerWaalsContact C-N 3.34Å; I145-R147 PolarHBondContact O-N 3.3Å; I145-D148 PolarHBondContact O-N 3.43Å; I145-V149 HydrophobicContact CG2-CG2 4.14Å; I145-V149 WeakPolarHBondContact O-CB 3.34Å; I145-V149 VanDerWaalsContact O-CG2 3.25Å; I145-V149 WeakPolarHBondContact O-CG2 3.41Å; I145-V149 PolarHBondContact O-N 3.19Å; I145-L171 HydrophobicContact CB-CD1 4.49Å; I145-L171 HydrophobicContact CG2-CD1 3.72Å; I145-L174 HydrophobicContact CD1-CB 4.42Å; I145-L174 HydrophobicContact CG2-CB 3.79Å; I145-L174 HydrophobicContact CG2-CD1 3.66Å; I145-L174 HydrophobicContact CG2-CG 4.38Å; I145-L175 HydrophobicContact CD1-CD2 3.87Å; I145-Y186 HydrophobicContact CD1-CD2 4.13Å; I145-Y186 HydrophobicContact CD1-CG 4.21Å; I145-Y186 HydrophobicContact CG1-CD1 3.82Å; I145-Y186 HydrophobicContact CG1-CD2 3.71Å; I145-Y186 HydrophobicContact CG1-CE1 3.9Å; I145-Y186 HydrophobicContact CG1-CE2 3.8Å; I145-Y186 HydrophobicContact CG1-CG 3.71Å
146	D	94.3	Very high	90.3	Very high	25 Å²	25	61.6 Å²	61.6	13%	0.134	29%	0.287	C	S	.	.	H	α-helix	trans	-56	-47.7	179.5	-177.6	54.4	0	0	0	112.3	I18 Y22 I142 V149 S150 R162	I18-D146 HydrophobicContact CD1-CB 4.38Å; I18-D146 HydrophobicContact CG2-CB 4.01Å; Y22-D146 WeakPolarHBondContact CE2-OD1 3.23Å; Y22-D146 PolarHBondContact OH-OD1 2.9Å; Y22-D146 VanDerWaalsContact OH-OD1 3.12Å; I142-D146 VanDerWaalsContact O-CB 3.3Å; I142-D146 WeakPolarHBondContact O-CB 3.37Å; I142-D146 PolarHBondContact O-N 3.27Å; D146-V149 PolarHBondContact O-N 3.23Å; D146-S150 WeakPolarHBondContact O-CB 3.46Å; D146-S150 PolarHBondContact O-N 3.14Å; D146-R162 IonicContact OD1-CZ 2.72Å; D146-R162 IonicContact OD1-NH1 3.17Å; D146-R162 IonicContact OD1-NH2 3.97Å; D146-R162 PolarHBondContact OD1-NH2 3.09Å; D146-R162 IonicContact OD2-NH2 3.3Å; D146-R162 PolarHBondContact OD2-NH2 3Å
147	R	92.6	Very high	90	Very high	177 Å²	177	62.6 Å²	62.6	67%	0.668	29%	0.293	S	S	*	.	H	α-helix	trans	-60.4	-47.8	176	-173.2	-175.9	-59.4	-169.8	1.9	111.6	Q143 R144 I145 S150 G151	Q143-R147 WeakPolarHBondContact O-CB 3.31Å; Q143-R147 PolarHBondContact O-N 2.81Å; Q143-R147 VanDerWaalsContact O-N 3.14Å; R144-R147 PolarHBondContact O-N 3.01Å; I145-R147 VanDerWaalsContact C-N 3.34Å; I145-R147 PolarHBondContact O-N 3.3Å; R147-S150 WeakPolarHBondContact O-CB 3.48Å; R147-S150 PolarHBondContact O-N 2.82Å; R147-S150 PolarHBondContact O-OG 3.19Å; R147-G151 PolarHBondContact O-N 2.96Å
148	D	91.5	Very high	89.9	Confident	25 Å²	25	58.6 Å²	58.6	13%	0.134	28%	0.28	C	S	.	.	H	α-helix	trans	-67.4	-39.2	-178.5	-72.7	-24.6	0	0	0	111.3	R144 I145 S150 G151 T152 Y186 R188	R144-D148 WeakPolarHBondContact O-CB 3.37Å; R144-D148 PolarHBondContact O-N 3.28Å; I145-D148 PolarHBondContact O-N 3.43Å; D148-S150 VanDerWaalsContact C-N 3.31Å; D148-S150 PolarHBondContact O-N 2.89Å; D148-G151 PolarHBondContact O-N 3.32Å; D148-T152 PolarHBondContact O-N 3.13Å; D148-T152 VanDerWaalsContact O-N 3.12Å; D148-T152 PolarHBondContact O-OG1 3.29Å; D148-Y186 WeakPolarHBondContact CB-OH 3.43Å; D148-Y186 WeakPolarHBondContact OD2-CE1 3.45Å; D148-Y186 PolarHBondContact OD2-OH 2.98Å; D148-Y186 VanDerWaalsContact OD2-OH 3.14Å; D148-R188 WeakPolarHBondContact OD2-CA 3.1Å; D148-R188 WeakPolarHBondContact OD2-CB 3.33Å; D148-R188 WeakPolarHBondContact OD2-CG 3.49Å
149	V	93.1	Very high	89.8	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-39.4	172.8	170.5	0	0	0	0	111.4	Y22 I145 D146 G151 T152 Q167 L170 L174	Y22-V149 HydrophobicContact CE1-CG1 4.31Å; Y22-V149 WeakPolarHBondContact OH-CB 3.43Å; Y22-V149 WeakPolarHBondContact OH-CG1 3.39Å; I145-V149 HydrophobicContact CG2-CG2 4.14Å; I145-V149 WeakPolarHBondContact O-CB 3.34Å; I145-V149 VanDerWaalsContact O-CG2 3.25Å; I145-V149 WeakPolarHBondContact O-CG2 3.41Å; I145-V149 PolarHBondContact O-N 3.19Å; D146-V149 PolarHBondContact O-N 3.23Å; V149-G151 PolarHBondContact O-N 3.34Å; V149-T152 PolarHBondContact O-N 3.14Å; V149-Q167 HydrophobicContact CG1-CB 3.83Å; V149-Q167 HydrophobicContact CG1-CG 4.12Å; V149-Q167 PolarHBondContact O-NE2 3.32Å; V149-L170 HydrophobicContact CB-CD2 4.43Å; V149-L170 HydrophobicContact CG1-CD2 4.16Å; V149-L170 HydrophobicContact CG2-CD2 3.95Å; V149-L170 HydrophobicContact CG2-CG 3.95Å; V149-L174 HydrophobicContact CG2-CD1 3.86Å
150	S	90.7	Very high	89.6	Confident	42 Å²	42	58.6 Å²	58.6	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-63.5	-23	178.1	83.6	0	0	0	0	113.8	D146 R147 D148 R154	D146-S150 WeakPolarHBondContact O-CB 3.46Å; D146-S150 PolarHBondContact O-N 3.14Å; R147-S150 WeakPolarHBondContact O-CB 3.48Å; R147-S150 PolarHBondContact O-N 2.82Å; R147-S150 PolarHBondContact O-OG 3.19Å; D148-S150 VanDerWaalsContact C-N 3.31Å; D148-S150 PolarHBondContact O-N 2.89Å; S150-R154 WeakPolarHBondContact O-CD 3.45Å; S150-R154 WeakPolarHBondContact O-CG 3.2Å; S150-R154 PolarHBondContact O-NE 3.41Å
151	G	86.9	Confident	89.5	Confident	49 Å²	49	53.7 Å²	53.7	51%	0.505	25%	0.251	S	S	.	.	H	α-helix	trans	-100.7	-12.3	178	0	0	0	0	0	114.9	R147 D148 V149	R147-G151 PolarHBondContact O-N 2.96Å; D148-G151 PolarHBondContact O-N 3.32Å; V149-G151 PolarHBondContact O-N 3.34Å
152	T	88.2	Confident	89.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	127.6	-170.1	-62.6	0	0	0	0	112.2	D148 V149 R154 L170 S191 A195	D148-T152 PolarHBondContact O-N 3.13Å; D148-T152 VanDerWaalsContact O-N 3.12Å; D148-T152 PolarHBondContact O-OG1 3.29Å; V149-T152 PolarHBondContact O-N 3.14Å; T152-R154 PolarHBondContact O-N 2.95Å; T152-L170 HydrophobicContact CG2-CD2 4.13Å; T152-S191 PolarHBondContact OG1-OG 3.2Å; T152-A195 HydrophobicContact CG2-CB 3.42Å; T152-A195 VanDerWaalsContact CG2-CB 3.42Å
153	L	84	Confident	89.6	Confident	28 Å²	28	54.8 Å²	54.8	15%	0.147	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	48	33.8	174.3	-65.9	-177	0	0	0	115.5	K155 H156 F159 A195 L199 I274	L153-K155 PolarHBondContact O-N 3.41Å; L153-H156 HydrophobicContact CB-CB 4.34Å; L153-H156 VanDerWaalsContact O-CB 3.27Å; L153-H156 WeakPolarHBondContact O-CB 3.36Å; L153-H156 PolarHBondContact O-N 2.97Å; L153-F159 HydrophobicContact CB-CB 4.21Å; L153-F159 HydrophobicContact CB-CD2 3.77Å; L153-F159 HydrophobicContact CB-CE2 4.44Å; L153-F159 HydrophobicContact CB-CG 4.15Å; L153-F159 HydrophobicContact CD1-CD2 4.09Å; L153-F159 HydrophobicContact CD1-CE2 3.96Å; L153-A195 HydrophobicContact CD1-CB 3.78Å; L153-A195 HydrophobicContact CG-CB 4.34Å; L153-L199 HydrophobicContact CD1-CD1 4.29Å; L153-I274 HydrophobicContact CD2-CG2 4.39Å
154	R	86.1	Confident	89.5	Confident	91 Å²	91	52 Å²	52	34%	0.343	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.8	-171.7	-64.9	-66.8	-74	164.4	5.3	116.2	S150 T152 H156 F159 R160	S150-R154 WeakPolarHBondContact O-CD 3.45Å; S150-R154 WeakPolarHBondContact O-CG 3.2Å; S150-R154 PolarHBondContact O-NE 3.41Å; T152-R154 PolarHBondContact O-N 2.95Å; R154-H156 VanDerWaalsContact C-N 3.32Å; R154-F159 WeakPolarHBondContact CD-O 3.36Å; R154-F159 PolarHBondContact NH1-O 3.05Å; R154-R160 PolarHBondContact NH1-O 2.82Å; R154-R160 PolarHBondContact NH2-O 2.79Å
155	K	84.2	Confident	89.5	Confident	158 Å²	158	49.9 Å²	49.9	69%	0.687	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-18.1	173.7	-60.1	-173.8	178.1	-177.2	0	112.8	I51 V52 L153	I51-K155 CarbonylContact C-O 3.48Å; I51-K155 WeakPolarHBondContact CA-O 3.44Å; I51-K155 HydrophobicContact CG2-CB 4.07Å; V52-K155 PolarHBondContact N-O 3.47Å; L153-K155 PolarHBondContact O-N 3.41Å
156	H	87.6	Confident	89.5	Confident	9 Å²	9	52.1 Å²	52.1	4%	0.042	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-82.5	135.1	178.9	-169.1	-77.7	0	0	0	110.3	L49 G50 I51 L153 R154 F158 F159 R160 L199	L49-H156 PolarHBondContact O-CD2 3.11Å; L49-H156 VanDerWaalsContact O-CD2 3.27Å; L49-H156 PolarHBondContact O-NE2 3.38Å; G50-H156 CarbonylContact O-C 3.57Å; G50-H156 WeakPolarHBondContact O-CA 3.45Å; I51-H156 HydrophobicContact CD1-CB 4.09Å; L153-H156 HydrophobicContact CB-CB 4.34Å; L153-H156 VanDerWaalsContact O-CB 3.27Å; L153-H156 WeakPolarHBondContact O-CB 3.36Å; L153-H156 PolarHBondContact O-N 2.97Å; R154-H156 VanDerWaalsContact C-N 3.32Å; H156-F158 AromaticContact CE1-CD2 3.39Å; H156-F158 WeakPolarHBondContact CE1-CD2 3.3Å; H156-F158 AromaticContact CE1-CE2 3.98Å; H156-F158 AromaticContact CE1-CG 3.63Å; H156-F158 WeakPolarHBondContact ND1-CB 3.43Å; H156-F158 AromaticContact ND1-CD2 3.92Å; H156-F158 AromaticContact ND1-CG 3.79Å; H156-F158 PolarHBondContact ND1-N 3.17Å; H156-F158 PolarHBondContact O-N 2.9Å; H156-F158 VanDerWaalsContact O-N 3.12Å; H156-F159 PolarHBondContact O-N 3.14Å; H156-R160 PolarHBondContact O-N 2.91Å; H156-R160 VanDerWaalsContact O-N 3.07Å; H156-L199 VanDerWaalsContact CE1-CD2 3.41Å; H156-L199 WeakPolarHBondContact CE1-CD2 3.41Å
157	I	88.8	Confident	89.5	Confident	43 Å²	43	50.9 Å²	50.9	22%	0.221	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-52.6	-39.9	-174	-165.2	172.1	0	0	0	112.8	V46 G50 V52 F159	V46-I157 HydrophobicContact CG2-CD1 4.36Å; G50-I157 PolarHBondContact O-N 3.46Å; V52-I157 HydrophobicContact CG2-CB 4.1Å; V52-I157 HydrophobicContact CG2-CG1 4.44Å; I157-F159 PolarHBondContact O-N 3.04Å
158	F	88.9	Confident	89.7	Confident	101 Å²	101	45.9 Å²	45.9	44%	0.443	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-64.3	-33.7	177.5	-70	-15.4	0	0	0	115.2	H156 K166 L199	H156-F158 AromaticContact CE1-CD2 3.39Å; H156-F158 WeakPolarHBondContact CE1-CD2 3.3Å; H156-F158 AromaticContact CE1-CE2 3.98Å; H156-F158 AromaticContact CE1-CG 3.63Å; H156-F158 WeakPolarHBondContact ND1-CB 3.43Å; H156-F158 AromaticContact ND1-CD2 3.92Å; H156-F158 AromaticContact ND1-CG 3.79Å; H156-F158 PolarHBondContact ND1-N 3.17Å; H156-F158 PolarHBondContact O-N 2.9Å; H156-F158 VanDerWaalsContact O-N 3.12Å; F158-K166 HydrophobicContact CB-CB 4.15Å; F158-K166 HydrophobicContact CB-CG 3.87Å; F158-K166 HydrophobicContact CG-CG 4.2Å; F158-K166 WeakPolarHBondContact O-CB 3.09Å; F158-L199 HydrophobicContact CD2-CD2 3.91Å
159	F	89.6	Confident	89.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-105.6	4	-176	-66.2	-78.2	0	0	0	112.9	L153 R154 H156 I157 K166 Q167 L170 A195 L198 L199	L153-F159 HydrophobicContact CB-CB 4.21Å; L153-F159 HydrophobicContact CB-CD2 3.77Å; L153-F159 HydrophobicContact CB-CE2 4.44Å; L153-F159 HydrophobicContact CB-CG 4.15Å; L153-F159 HydrophobicContact CD1-CD2 4.09Å; L153-F159 HydrophobicContact CD1-CE2 3.96Å; R154-F159 WeakPolarHBondContact CD-O 3.36Å; R154-F159 PolarHBondContact NH1-O 3.05Å; H156-F159 PolarHBondContact O-N 3.14Å; I157-F159 PolarHBondContact O-N 3.04Å; F159-K166 HydrophobicContact CD1-CB 4.28Å; F159-K166 HydrophobicContact CE1-CB 4.03Å; F159-K166 WeakPolarHBondContact CE1-O 3.36Å; F159-K166 HydrophobicContact CZ-CB 4.36Å; F159-Q167 HydrophobicContact CD1-CG 4.24Å; F159-Q167 PolarHBondContact O-NE2 3.17Å; F159-L170 HydrophobicContact CD1-CD2 4.33Å; F159-L170 HydrophobicContact CE1-CB 4.15Å; F159-L170 HydrophobicContact CE1-CD2 3.87Å; F159-A195 HydrophobicContact CE1-CB 4.05Å; F159-A195 HydrophobicContact CE2-CB 4.02Å; F159-A195 HydrophobicContact CZ-CB 3.62Å; F159-L198 HydrophobicContact CE1-CD2 4.17Å; F159-L198 HydrophobicContact CZ-CB 4.26Å; F159-L198 HydrophobicContact CZ-CD2 4.01Å; F159-L199 HydrophobicContact CD2-CD2 4.24Å; F159-L199 HydrophobicContact CE2-CD2 3.66Å; F159-L199 HydrophobicContact CE2-CG 4.37Å
160	R	86.4	Confident	90.1	Very high	58 Å²	58	46.2 Å²	46.2	22%	0.219	23%	0.226	C	C	.	.	S	Bend	trans	-67.3	-35.7	-176.3	177.5	179.4	167.7	171.5	-2.6	113	Y42 R154 H156	Y42-R160 VanDerWaalsContact CE1-NH1 3.31Å; R154-R160 PolarHBondContact NH1-O 2.82Å; R154-R160 PolarHBondContact NH2-O 2.79Å; H156-R160 PolarHBondContact O-N 2.91Å; H156-R160 VanDerWaalsContact O-N 3.07Å
161	D	86.7	Confident	90.4	Very high	66 Å²	66	44.3 Å²	44.3	35%	0.353	21%	0.212	S	C	.	.	S	Bend	trans	-95.2	137.7	-174	-61.2	-35.6	0	0	0	111.7	H26 G164 Q167	H26-D161 WeakPolarHBondContact CE1-CB 3.49Å; H26-D161 IonicContact CE1-OD2 3.38Å; H26-D161 PolarHBondContact CE1-OD2 3.44Å; D161-G164 PolarHBondContact O-N 2.96Å; D161-Q167 VanDerWaalsContact O-CD 3.27Å; D161-Q167 PolarHBondContact O-OE1 3.24Å
162	R	91.8	Very high	90.8	Very high	61 Å²	61	42.3 Å²	42.3	23%	0.23	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	131.9	-177.3	-172.8	60.9	-179.3	136.4	-2.7	109.8	Y22 D146 G164	Y22-R162 PolarHBondContact OH-NH1 3.31Å; D146-R162 IonicContact OD1-CZ 2.72Å; D146-R162 IonicContact OD1-NH1 3.17Å; D146-R162 IonicContact OD1-NH2 3.97Å; D146-R162 PolarHBondContact OD1-NH2 3.09Å; D146-R162 IonicContact OD2-NH2 3.3Å; D146-R162 PolarHBondContact OD2-NH2 3Å; R162-G164 PolarHBondContact O-N 3.46Å
163	Y	92.2	Very high	91.2	Very high	33 Å²	33	42.3 Å²	42.3	13%	0.129	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	18.6	-173.3	-44.2	-62.8	0	0	0	113.4	K21 Y22 G25 A28	K21-Y163 HydrophobicContact CB-CD1 4.05Å; K21-Y163 HydrophobicContact CB-CD2 4.46Å; K21-Y163 HydrophobicContact CB-CE1 3.8Å; K21-Y163 HydrophobicContact CB-CE2 4.24Å; K21-Y163 HydrophobicContact CB-CG 4.39Å; K21-Y163 HydrophobicContact CD-CE1 4.44Å; Y22-Y163 HydrophobicContact CD1-CD1 4.05Å; Y22-Y163 AromaticContact CD2-CD1 3.88Å; Y22-Y163 HydrophobicContact CD2-CD1 3.88Å; Y22-Y163 HydrophobicContact CD2-CE1 4.21Å; Y22-Y163 HydrophobicContact CE1-CD1 4.07Å; Y22-Y163 AromaticContact CE2-CD1 3.89Å; Y22-Y163 HydrophobicContact CE2-CD1 3.89Å; Y22-Y163 AromaticContact CE2-CE1 3.99Å; Y22-Y163 HydrophobicContact CE2-CE1 3.99Å; Y22-Y163 AromaticContact CG-CD1 3.99Å; Y22-Y163 HydrophobicContact CG-CD1 3.99Å; Y22-Y163 AromaticContact CZ-CD1 4Å; G25-Y163 VanDerWaalsContact CA-O 3.3Å; G25-Y163 WeakPolarHBondContact CA-O 3.22Å; A28-Y163 HydrophobicContact CB-CD2 4.3Å
164	G	90.7	Very high	91.8	Very high	3 Å²	3	41 Å²	41	3%	0.031	18%	0.183	C	C	.	.			trans	-66.4	165.7	174.2	0	0	0	0	0	112.2	H26 D161 R162 K166 Q167 R168	H26-G164 WeakPolarHBondContact NE2-CA 3.43Å; D161-G164 PolarHBondContact O-N 2.96Å; R162-G164 PolarHBondContact O-N 3.46Å; G164-K166 VanDerWaalsContact C-N 3.27Å; G164-K166 PolarHBondContact O-N 2.8Å; G164-K166 VanDerWaalsContact O-N 3.13Å; G164-Q167 PolarHBondContact O-N 3.43Å; G164-R168 PolarHBondContact O-N 3.01Å
165	T	92.1	Very high	92.2	Very high	79 Å²	79	36.7 Å²	36.7	49%	0.485	17%	0.167	S	C	.	.	H	α-helix	trans	-49.4	-45.7	-174.3	-53.5	0	0	0	0	113	R168 E169	T165-R168 WeakPolarHBondContact O-CB 3.42Å; T165-R168 PolarHBondContact O-N 3.32Å; T165-E169 WeakPolarHBondContact O-CG 3.22Å; T165-E169 PolarHBondContact O-N 3.32Å
166	K	93.4	Very high	92.8	Very high	46 Å²	46	29.1 Å²	29.1	20%	0.2	13%	0.134	C	C	.	.	H	α-helix	trans	-75.6	-29	-178.2	-67.3	-75.1	178.6	-166.6	0	113.6	F158 F159 G164 R168 E169 L170 L198	F158-K166 HydrophobicContact CB-CB 4.15Å; F158-K166 HydrophobicContact CB-CG 3.87Å; F158-K166 HydrophobicContact CG-CG 4.2Å; F158-K166 WeakPolarHBondContact O-CB 3.09Å; F159-K166 HydrophobicContact CD1-CB 4.28Å; F159-K166 HydrophobicContact CE1-CB 4.03Å; F159-K166 WeakPolarHBondContact CE1-O 3.36Å; F159-K166 HydrophobicContact CZ-CB 4.36Å; G164-K166 VanDerWaalsContact C-N 3.27Å; G164-K166 PolarHBondContact O-N 2.8Å; G164-K166 VanDerWaalsContact O-N 3.13Å; K166-R168 VanDerWaalsContact C-N 3.34Å; K166-E169 VanDerWaalsContact CD-OE2 3.27Å; K166-E169 WeakPolarHBondContact CD-OE2 3.49Å; K166-E169 WeakPolarHBondContact CE-OE2 3.25Å; K166-E169 IonicContact NZ-OE1 3.93Å; K166-E169 IonicContact NZ-OE2 3.72Å; K166-E169 PolarHBondContact NZ-OE2 2.75Å; K166-L170 VanDerWaalsContact O-CB 3.28Å; K166-L170 WeakPolarHBondContact O-CB 3.28Å; K166-L170 PolarHBondContact O-N 3.38Å; K166-L198 HydrophobicContact CB-CD2 4.48Å; K166-L198 HydrophobicContact CD-CD2 4.05Å; K166-L198 HydrophobicContact CD-CG 4.04Å; K166-L198 WeakPolarHBondContact O-CD2 3.49Å
167	Q	94.5	Very high	93	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.3	-36.9	169.3	-69.7	-157.6	-21.6	0	0	111.6	Y22 V149 F159 D161 G164 L170 L171	Y22-Q167 HydrophobicContact CE1-CB 4.03Å; Y22-Q167 WeakPolarHBondContact CE1-O 3.35Å; V149-Q167 HydrophobicContact CG1-CB 3.83Å; V149-Q167 HydrophobicContact CG1-CG 4.12Å; V149-Q167 PolarHBondContact O-NE2 3.32Å; F159-Q167 HydrophobicContact CD1-CG 4.24Å; F159-Q167 PolarHBondContact O-NE2 3.17Å; D161-Q167 VanDerWaalsContact O-CD 3.27Å; D161-Q167 PolarHBondContact O-OE1 3.24Å; G164-Q167 PolarHBondContact O-N 3.43Å; Q167-L170 PolarHBondContact O-N 3.38Å; Q167-L171 PolarHBondContact O-N 3.24Å
168	R	95.5	Very high	93.2	Very high	72 Å²	72	28 Å²	28	27%	0.272	13%	0.128	S	C	.	.	H	α-helix	trans	-65.7	-49.3	175.3	-179.2	-179.9	67.5	-170.3	-0.3	111.9	Y22 G164 T165 K166 L170 L171 H172	Y22-R168 HydrophobicContact CD1-CB 3.9Å; Y22-R168 HydrophobicContact CD1-CG 4.39Å; Y22-R168 WeakPolarHBondContact O-CD 3.32Å; G164-R168 PolarHBondContact O-N 3.01Å; T165-R168 WeakPolarHBondContact O-CB 3.42Å; T165-R168 PolarHBondContact O-N 3.32Å; K166-R168 VanDerWaalsContact C-N 3.34Å; R168-L170 VanDerWaalsContact C-N 3.25Å; R168-L170 PolarHBondContact O-N 3.38Å; R168-L171 WeakPolarHBondContact O-CB 3.32Å; R168-L171 PolarHBondContact O-N 3.12Å; R168-H172 VanDerWaalsContact CG-CE1 3.44Å; R168-H172 WeakPolarHBondContact CG-CE1 3.43Å; R168-H172 VanDerWaalsContact O-CG 3.25Å; R168-H172 PolarHBondContact O-N 2.93Å; R168-H172 PolarHBondContact O-ND1 3.3Å
169	E	96.7	Very high	93.4	Very high	32 Å²	32	25.8 Å²	25.8	15%	0.15	12%	0.119	C	C	.	.	H	α-helix	trans	-55.3	-43	173.3	-74.1	178.2	-165.1	0	0	111.2	T165 K166 H172 I173 L198 E203	T165-E169 WeakPolarHBondContact O-CG 3.22Å; T165-E169 PolarHBondContact O-N 3.32Å; K166-E169 VanDerWaalsContact CD-OE2 3.27Å; K166-E169 WeakPolarHBondContact CD-OE2 3.49Å; K166-E169 WeakPolarHBondContact CE-OE2 3.25Å; K166-E169 IonicContact NZ-OE1 3.93Å; K166-E169 IonicContact NZ-OE2 3.72Å; K166-E169 PolarHBondContact NZ-OE2 2.75Å; E169-H172 WeakPolarHBondContact O-CB 3.45Å; E169-H172 PolarHBondContact O-N 3.18Å; E169-I173 WeakPolarHBondContact O-CG1 3.31Å; E169-I173 PolarHBondContact O-N 2.92Å; E169-I173 VanDerWaalsContact O-N 3.07Å; E169-L198 HydrophobicContact CB-CD1 4.15Å; E169-L198 HydrophobicContact CB-CD2 3.66Å; E169-L198 HydrophobicContact CB-CG 4.42Å; E169-L198 WeakPolarHBondContact OE2-CD1 3.18Å; E169-E203 HydrophobicContact CB-CB 4.39Å; E169-E203 HydrophobicContact CB-CG 3.99Å; E169-E203 HydrophobicContact CG-CB 4.16Å; E169-E203 HydrophobicContact CG-CG 4.1Å; E169-E203 WeakPolarHBondContact CG-OE2 3.33Å
170	L	96.7	Very high	93.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-45.3	176	179.8	59.9	0	0	0	112.4	V149 T152 F159 K166 Q167 R168 H172 I173 L174 S191 A194 A195 L198	V149-L170 HydrophobicContact CB-CD2 4.43Å; V149-L170 HydrophobicContact CG1-CD2 4.16Å; V149-L170 HydrophobicContact CG2-CD2 3.95Å; V149-L170 HydrophobicContact CG2-CG 3.95Å; T152-L170 HydrophobicContact CG2-CD2 4.13Å; F159-L170 HydrophobicContact CD1-CD2 4.33Å; F159-L170 HydrophobicContact CE1-CB 4.15Å; F159-L170 HydrophobicContact CE1-CD2 3.87Å; K166-L170 VanDerWaalsContact O-CB 3.28Å; K166-L170 WeakPolarHBondContact O-CB 3.28Å; K166-L170 PolarHBondContact O-N 3.38Å; Q167-L170 PolarHBondContact O-N 3.38Å; R168-L170 VanDerWaalsContact C-N 3.25Å; R168-L170 PolarHBondContact O-N 3.38Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 2.82Å; L170-I173 PolarHBondContact O-N 2.79Å; L170-L174 HydrophobicContact CD1-CD1 4.16Å; L170-L174 HydrophobicContact CD1-CG 4.33Å; L170-L174 HydrophobicContact CG-CD1 4.16Å; L170-L174 VanDerWaalsContact O-CG 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.46Å; L170-L174 PolarHBondContact O-N 3.46Å; L170-S191 WeakPolarHBondContact CD1-O 3.26Å; L170-A194 HydrophobicContact CD1-CB 3.45Å; L170-A194 VanDerWaalsContact CD1-CB 3.45Å; L170-A195 HydrophobicContact CD1-CB 4.12Å; L170-A195 HydrophobicContact CD2-CB 3.9Å; L170-L198 HydrophobicContact CB-CD2 4.12Å
171	L	96.6	Very high	93.4	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-56.5	-48.1	174.6	-175.2	86.3	0	0	0	110.8	I19 Y22 I145 Q167 R168 I173 L174 L175	I19-L171 HydrophobicContact CD1-CD2 4.08Å; Y22-L171 HydrophobicContact CD1-CB 4.35Å; Y22-L171 HydrophobicContact CD1-CD2 4.15Å; Y22-L171 HydrophobicContact CD2-CD1 4.44Å; Y22-L171 HydrophobicContact CD2-CD2 3.5Å; Y22-L171 VanDerWaalsContact CD2-CD2 3.5Å; Y22-L171 HydrophobicContact CD2-CG 4.46Å; Y22-L171 HydrophobicContact CE1-CB 4.06Å; Y22-L171 HydrophobicContact CE1-CD2 4.37Å; Y22-L171 HydrophobicContact CE2-CD1 3.85Å; Y22-L171 HydrophobicContact CE2-CD2 3.77Å; Y22-L171 HydrophobicContact CE2-CG 4.27Å; Y22-L171 HydrophobicContact CG-CD2 3.67Å; I145-L171 HydrophobicContact CB-CD1 4.49Å; I145-L171 HydrophobicContact CG2-CD1 3.72Å; Q167-L171 PolarHBondContact O-N 3.24Å; R168-L171 WeakPolarHBondContact O-CB 3.32Å; R168-L171 PolarHBondContact O-N 3.12Å; L171-I173 VanDerWaalsContact C-N 3.34Å; L171-I173 PolarHBondContact O-N 2.91Å; L171-L174 PolarHBondContact O-N 3.46Å; L171-L175 HydrophobicContact CD2-CD1 4.04Å; L171-L175 HydrophobicContact CG-CD1 3.89Å; L171-L175 HydrophobicContact CG-CG 4.33Å; L171-L175 WeakPolarHBondContact O-CG 3.21Å; L171-L175 PolarHBondContact O-N 3.06Å
172	H	96.9	Very high	93.2	Very high	7 Å²	7	28.6 Å²	28.6	3%	0.032	14%	0.139	C	C	.	.	H	α-helix	trans	-57.8	-44.6	-179.9	-64.8	158.3	0	0	0	112.8	Y128 K132 K136 R168 E169 L170 L174 L175 A176 E203	Y128-H172 WeakPolarHBondContact OH-CB 3.14Å; K132-H172 HydrophobicContact CD-CB 3.95Å; K132-H172 VanDerWaalsContact CE-CE1 3.41Å; K132-H172 WeakPolarHBondContact CE-CE1 3.29Å; K132-H172 WeakPolarHBondContact CE-ND1 3.47Å; K132-H172 HydrophobicContact CG-CB 4.13Å; K132-H172 PolarHBondContact NZ-CE1 3.21Å; K132-H172 PolarHBondContact NZ-ND1 3.45Å; K136-H172 WeakPolarHBondContact CE-NE2 3.33Å; R168-H172 VanDerWaalsContact CG-CE1 3.44Å; R168-H172 WeakPolarHBondContact CG-CE1 3.43Å; R168-H172 VanDerWaalsContact O-CG 3.25Å; R168-H172 PolarHBondContact O-N 2.93Å; R168-H172 PolarHBondContact O-ND1 3.3Å; E169-H172 WeakPolarHBondContact O-CB 3.45Å; E169-H172 PolarHBondContact O-N 3.18Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 2.82Å; H172-L174 VanDerWaalsContact C-N 3.32Å; H172-L174 PolarHBondContact O-N 2.97Å; H172-L175 PolarHBondContact O-N 3.25Å; H172-A176 VanDerWaalsContact O-CB 3.31Å; H172-A176 WeakPolarHBondContact O-CB 3.2Å; H172-A176 PolarHBondContact O-N 3.48Å; H172-E203 IonicContact CG-OE1 2.78Å; H172-E203 IonicContact ND1-OE1 3.93Å; H172-E203 IonicContact ND1-OE2 3.57Å; H172-E203 PolarHBondContact ND1-OE2 3.05Å; H172-E203 VanDerWaalsContact ND1-OE2 3.17Å
173	I	96.8	Very high	92.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-43.1	178.9	-68.7	165	0	0	0	110.9	E169 L170 L171 A176 Y177 A194 L198 E203 A206 F207 L210	E169-I173 WeakPolarHBondContact O-CG1 3.31Å; E169-I173 PolarHBondContact O-N 2.92Å; E169-I173 VanDerWaalsContact O-N 3.07Å; L170-I173 PolarHBondContact O-N 2.79Å; L171-I173 VanDerWaalsContact C-N 3.34Å; L171-I173 PolarHBondContact O-N 2.91Å; I173-A176 PolarHBondContact O-N 3.43Å; I173-Y177 WeakPolarHBondContact O-CB 3.44Å; I173-Y177 PolarHBondContact O-N 2.91Å; I173-A194 HydrophobicContact CG2-CB 3.98Å; I173-L198 HydrophobicContact CD1-CD1 3.68Å; I173-E203 HydrophobicContact CD1-CG 4.2Å; I173-E203 WeakPolarHBondContact CD1-O 3.4Å; I173-E203 HydrophobicContact CG1-CG 4.02Å; I173-A206 HydrophobicContact CD1-CB 3.82Å; I173-F207 HydrophobicContact CG1-CB 4.26Å; I173-F207 HydrophobicContact CG2-CB 4.21Å; I173-F207 HydrophobicContact CG2-CD2 4.32Å; I173-L210 HydrophobicContact CG2-CD2 4.13Å
174	L	95.3	Very high	91.8	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-70	-41.2	-178	-62.8	173.4	0	0	0	112	I145 V149 L170 L171 H172 Y177 E178 Y186 L190 A194	I145-L174 HydrophobicContact CD1-CB 4.42Å; I145-L174 HydrophobicContact CG2-CB 3.79Å; I145-L174 HydrophobicContact CG2-CD1 3.66Å; I145-L174 HydrophobicContact CG2-CG 4.38Å; V149-L174 HydrophobicContact CG2-CD1 3.86Å; L170-L174 HydrophobicContact CD1-CD1 4.16Å; L170-L174 HydrophobicContact CD1-CG 4.33Å; L170-L174 HydrophobicContact CG-CD1 4.16Å; L170-L174 VanDerWaalsContact O-CG 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.46Å; L170-L174 PolarHBondContact O-N 3.46Å; L171-L174 PolarHBondContact O-N 3.46Å; H172-L174 VanDerWaalsContact C-N 3.32Å; H172-L174 PolarHBondContact O-N 2.97Å; L174-Y177 PolarHBondContact O-N 3.39Å; L174-E178 PolarHBondContact O-N 3.43Å; L174-Y186 HydrophobicContact CB-CE2 4.27Å; L174-Y186 HydrophobicContact CD1-CE2 4Å; L174-Y186 HydrophobicContact CD2-CE2 4.03Å; L174-Y186 HydrophobicContact CG-CE2 4.3Å; L174-L190 HydrophobicContact CD2-CB 3.87Å; L174-A194 HydrophobicContact CD2-CB 4.07Å
175	L	95.4	Very high	91.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-43.3	173.6	-68.3	173.5	0	0	0	111.7	I19 K136 S139 I142 I145 L171 H172 Y177 E178 E179	I19-L175 HydrophobicContact CD1-CD1 3.89Å; K136-L175 HydrophobicContact CG-CD1 4.11Å; S139-L175 VanDerWaalsContact CB-CD2 3.43Å; S139-L175 WeakPolarHBondContact OG-CD2 3.47Å; I142-L175 HydrophobicContact CG1-CD2 4.38Å; I145-L175 HydrophobicContact CD1-CD2 3.87Å; L171-L175 HydrophobicContact CD2-CD1 4.04Å; L171-L175 HydrophobicContact CG-CD1 3.89Å; L171-L175 HydrophobicContact CG-CG 4.33Å; L171-L175 WeakPolarHBondContact O-CG 3.21Å; L171-L175 PolarHBondContact O-N 3.06Å; H172-L175 PolarHBondContact O-N 3.25Å; L175-Y177 VanDerWaalsContact C-N 3.29Å; L175-Y177 PolarHBondContact O-N 3.49Å; L175-E178 PolarHBondContact O-N 3.36Å; L175-E179 PolarHBondContact O-N 2.93Å
176	A	95.8	Very high	90.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.9	-32.7	176.5	0	0	0	0	0	112.2	Y128 M131 K132 H172 I173 Y180 F207	Y128-A176 HydrophobicContact CD2-CB 4Å; Y128-A176 HydrophobicContact CE2-CB 3.66Å; M131-A176 HydrophobicContact CB-CB 4.1Å; K132-A176 HydrophobicContact CB-CB 4.35Å; H172-A176 VanDerWaalsContact O-CB 3.31Å; H172-A176 WeakPolarHBondContact O-CB 3.2Å; H172-A176 PolarHBondContact O-N 3.48Å; I173-A176 PolarHBondContact O-N 3.43Å; A176-Y180 WeakPolarHBondContact O-CB 3.49Å; A176-Y180 PolarHBondContact O-N 2.93Å; A176-F207 HydrophobicContact CB-CD2 3.95Å; A176-F207 HydrophobicContact CB-CE2 3.77Å
177	Y	93.3	Very high	90.2	Very high	6 Å²	6	32.2 Å²	32.2	2%	0.024	16%	0.164	C	C	.	.	H	α-helix	trans	-70.8	-41.4	177.8	-175.1	-90.2	0	0	0	112.4	I173 L174 L175 E179 Y180 N181 L190 L210 V211 L214	I173-Y177 WeakPolarHBondContact O-CB 3.44Å; I173-Y177 PolarHBondContact O-N 2.91Å; L174-Y177 PolarHBondContact O-N 3.39Å; L175-Y177 VanDerWaalsContact C-N 3.29Å; L175-Y177 PolarHBondContact O-N 3.49Å; Y177-E179 PolarHBondContact O-N 3.34Å; Y177-Y180 WeakPolarHBondContact O-CB 3.4Å; Y177-Y180 PolarHBondContact O-N 3.17Å; Y177-N181 PolarHBondContact O-N 3.05Å; Y177-L190 HydrophobicContact CD1-CD1 3.61Å; Y177-L190 HydrophobicContact CE1-CD1 3.6Å; Y177-L190 HydrophobicContact CE1-CD2 4.46Å; Y177-L210 HydrophobicContact CD2-CD2 3.85Å; Y177-L210 HydrophobicContact CD2-CG 4.19Å; Y177-L210 HydrophobicContact CE2-CD2 4.49Å; Y177-L210 HydrophobicContact CE2-CG 4.41Å; Y177-L210 HydrophobicContact CG-CD2 4.09Å; Y177-V211 HydrophobicContact CD2-CG2 4.17Å; Y177-V211 HydrophobicContact CE2-CG2 4.37Å; Y177-L214 HydrophobicContact CE1-CD1 4.29Å; Y177-L214 HydrophobicContact CE2-CD1 3.57Å; Y177-L214 VanDerWaalsContact CZ-CD1 3.41Å; Y177-L214 WeakPolarHBondContact OH-CD1 3.48Å
178	E	92	Very high	89.6	Confident	23 Å²	23	36.9 Å²	36.9	11%	0.107	18%	0.181	C	C	.	.	H	α-helix	trans	-55.6	-41.6	174	-174.5	-177.2	-178.4	0	0	111.2	S139 E140 H141 L174 L175 N181 P182	S139-E178 VanDerWaalsContact CB-OE2 3.25Å; S139-E178 WeakPolarHBondContact CB-OE2 3.47Å; S139-E178 PolarHBondContact OG-OE1 2.92Å; S139-E178 PolarHBondContact OG-OE2 3.33Å; E140-E178 PolarHBondContact N-OE1 3.49Å; H141-E178 IonicContact CE1-OE1 3.76Å; H141-E178 IonicContact CG-OE1 3.49Å; H141-E178 IonicContact ND1-OE1 2.61Å; H141-E178 PolarHBondContact ND1-OE1 2.94Å; L174-E178 PolarHBondContact O-N 3.43Å; L175-E178 PolarHBondContact O-N 3.36Å; E178-N181 CarbonylContact O-C 3.5Å; E178-P182 WeakPolarHBondContact O-CA 3.3Å
179	E	92.9	Very high	88.8	Confident	53 Å²	53	34 Å²	34	25%	0.248	17%	0.171	C	C	.	.	H	α-helix	trans	-72.3	-33.4	175.2	179	56.5	-145.4	0	0	113.1	M131 K134 L175 Y177	M131-E179 HydrophobicContact CB-CB 4.24Å; M131-E179 HydrophobicContact CB-CG 4.02Å; M131-E179 HydrophobicContact CG-CG 3.97Å; K134-E179 HydrophobicContact CB-CG 4.34Å; K134-E179 HydrophobicContact CD-CG 4.05Å; K134-E179 WeakPolarHBondContact CD-OE1 3.41Å; K134-E179 WeakPolarHBondContact CD-OE2 3.32Å; K134-E179 VanDerWaalsContact CE-OE1 3.23Å; K134-E179 WeakPolarHBondContact CE-OE1 3.28Å; K134-E179 WeakPolarHBondContact CE-OE2 3.27Å; K134-E179 HydrophobicContact CG-CG 4.31Å; K134-E179 VanDerWaalsContact NZ-CD 3.32Å; K134-E179 IonicContact NZ-OE1 3.72Å; K134-E179 PolarHBondContact NZ-OE1 2.87Å; K134-E179 IonicContact NZ-OE2 2.76Å; K134-E179 PolarHBondContact NZ-OE2 3.08Å; L175-E179 PolarHBondContact O-N 2.93Å; Y177-E179 PolarHBondContact O-N 3.34Å
180	Y	90.5	Very high	88.4	Confident	61 Å²	61	33 Å²	33	24%	0.239	17%	0.167	C	C	.	.	H	α-helix	trans	-67.6	-38	179	-178.8	-93.8	0	0	0	112.5	M131 A176 Y177 F207 W208 V211	M131-Y180 HydrophobicContact CE-CD2 4.06Å; M131-Y180 HydrophobicContact SD-CD2 3.72Å; M131-Y180 HydrophobicContact SD-CG 4.27Å; A176-Y180 WeakPolarHBondContact O-CB 3.49Å; A176-Y180 PolarHBondContact O-N 2.93Å; Y177-Y180 WeakPolarHBondContact O-CB 3.4Å; Y177-Y180 PolarHBondContact O-N 3.17Å; Y180-F207 HydrophobicContact CD2-CZ 4.21Å; Y180-F207 HydrophobicContact CG-CZ 4.23Å; Y180-W208 HydrophobicContact CE2-CZ3 4.19Å; Y180-V211 HydrophobicContact CD1-CG1 4.26Å; Y180-V211 HydrophobicContact CD1-CG2 3.98Å; Y180-V211 HydrophobicContact CE1-CB 4.41Å; Y180-V211 HydrophobicContact CE1-CG1 3.49Å; Y180-V211 VanDerWaalsContact CE1-CG1 3.49Å; Y180-V211 HydrophobicContact CE1-CG2 4.07Å; Y180-V211 HydrophobicContact CE2-CG1 4.26Å; Y180-V211 HydrophobicContact CG-CG2 4.27Å; Y180-V211 VanDerWaalsContact CZ-CG1 3.49Å; Y180-V211 WeakPolarHBondContact OH-CG1 3.07Å
181	N	85.5	Confident	88.1	Confident	30 Å²	30	33 Å²	33	16%	0.16	17%	0.167	C	C	.	.			trans	-137.6	77.8	-178.7	-167.9	-2.8	0	0	0	111.5	Y177 E178 E183 V184 G185	Y177-N181 PolarHBondContact O-N 3.05Å; E178-N181 CarbonylContact O-C 3.5Å; N181-E183 PolarHBondContact O-N 3.5Å; N181-V184 WeakPolarHBondContact ND2-CG2 3.38Å; N181-V184 PolarHBondContact O-N 3.07Å; N181-G185 PolarHBondContact O-N 3.48Å; N181-G185 VanDerWaalsContact O-N 3.09Å
182	P	83	Confident	87.7	Confident	92 Å²	92	34.4 Å²	34.4	60%	0.597	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.6	-176.7	25.3	-34.9	0	0	0	113.1	E178 G185	E178-P182 WeakPolarHBondContact O-CA 3.3Å; P182-G185 PolarHBondContact O-N 3.23Å
183	E	78.8	Confident	87.3	Confident	179 Å²	179	34.2 Å²	34.2	84%	0.836	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-38	179	-60.2	-62.7	151.3	0	0	112.6	N181	N181-E183 PolarHBondContact O-N 3.5Å
184	V	76.2	Confident	87.1	Confident	51 Å²	51	34.2 Å²	34.2	31%	0.309	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-32.8	174.2	173.6	0	0	0	0	110.3	N181	N181-V184 WeakPolarHBondContact ND2-CG2 3.38Å; N181-V184 PolarHBondContact O-N 3.07Å
185	G	78.1	Confident	87	Confident	8 Å²	8	34.1 Å²	34.1	8%	0.082	17%	0.172	C	C	.	.			trans	59.5	-152.1	-175.3	0	0	0	0	0	112.1	N181 P182	N181-G185 PolarHBondContact O-N 3.48Å; N181-G185 VanDerWaalsContact O-N 3.09Å; P182-G185 PolarHBondContact O-N 3.23Å
186	Y	82.7	Confident	86.8	Confident	13 Å²	13	34.3 Å²	34.3	5%	0.051	17%	0.173	C	C	.	.			trans	-96.5	124.5	178.5	178.2	-103.7	0	0	0	112.7	H141 R144 I145 D148 L174 L190	H141-Y186 HydrophobicContact CB-CD1 4.47Å; H141-Y186 HydrophobicContact CB-CG 4.46Å; R144-Y186 HydrophobicContact CB-CE1 4.49Å; R144-Y186 HydrophobicContact CG-CD1 4.23Å; R144-Y186 HydrophobicContact CG-CE1 3.99Å; I145-Y186 HydrophobicContact CD1-CD2 4.13Å; I145-Y186 HydrophobicContact CD1-CG 4.21Å; I145-Y186 HydrophobicContact CG1-CD1 3.82Å; I145-Y186 HydrophobicContact CG1-CD2 3.71Å; I145-Y186 HydrophobicContact CG1-CE1 3.9Å; I145-Y186 HydrophobicContact CG1-CE2 3.8Å; I145-Y186 HydrophobicContact CG1-CG 3.71Å; D148-Y186 WeakPolarHBondContact CB-OH 3.43Å; D148-Y186 WeakPolarHBondContact OD2-CE1 3.45Å; D148-Y186 PolarHBondContact OD2-OH 2.98Å; D148-Y186 VanDerWaalsContact OD2-OH 3.14Å; L174-Y186 HydrophobicContact CB-CE2 4.27Å; L174-Y186 HydrophobicContact CD1-CE2 4Å; L174-Y186 HydrophobicContact CD2-CE2 4.03Å; L174-Y186 HydrophobicContact CG-CE2 4.3Å; Y186-L190 HydrophobicContact CD2-CD1 4.35Å; Y186-L190 HydrophobicContact CE2-CB 4.37Å
187	C	82.2	Confident	86.7	Confident	47 Å²	47	34.3 Å²	34.3	32%	0.318	17%	0.173	S	C	.	.			trans	-111.4	137.5	167.7	-178.3	0	0	0	0	110.9	D189 L190	C187-D189 PolarHBondContact O-N 3.07Å; C187-L190 HydrophobicContact CB-CD1 4.37Å; C187-L190 HydrophobicContact CB-CG 4.24Å; C187-L190 VanDerWaalsContact O-CB 3.23Å; C187-L190 WeakPolarHBondContact O-CB 3.26Å; C187-L190 WeakPolarHBondContact O-CG 3.28Å; C187-L190 PolarHBondContact O-N 3.05Å
188	R	81.4	Confident	86.8	Confident	99 Å²	99	34.1 Å²	34.1	37%	0.374	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-36.1	-179.7	174.2	174	66.3	-159.3	-6.9	113.4	D148 L190 S191 R271	D148-R188 WeakPolarHBondContact OD2-CA 3.1Å; D148-R188 WeakPolarHBondContact OD2-CB 3.33Å; D148-R188 WeakPolarHBondContact OD2-CG 3.49Å; R188-L190 PolarHBondContact O-N 2.87Å; R188-S191 PolarHBondContact O-N 3.4Å; R188-R271 VanDerWaalsContact NH2-CZ 3.32Å
189	D	78.8	Confident	86.8	Confident	11 Å²	11	33.9 Å²	33.9	6%	0.059	17%	0.172	C	C	.	.	H	α-helix	trans	-67.5	-22.9	-176.4	-58.5	-33.9	0	0	0	111.9	C187 S191 H192 I193 G267 I270 R271	C187-D189 PolarHBondContact O-N 3.07Å; D189-S191 VanDerWaalsContact C-N 3.32Å; D189-S191 PolarHBondContact O-N 3.18Å; D189-H192 PolarHBondContact O-N 3.25Å; D189-I193 WeakPolarHBondContact O-CG1 3.2Å; D189-I193 PolarHBondContact O-N 2.53Å; D189-G267 WeakPolarHBondContact OD2-CA 3.33Å; D189-I270 HydrophobicContact CB-CD1 4.3Å; D189-R271 IonicContact OD1-NE 2.62Å
190	L	87.2	Confident	86.9	Confident	10 Å²	10	33.4 Å²	33.4	5%	0.052	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-36.1	178.7	-63.1	176.5	0	0	0	112.7	L174 Y177 Y186 C187 R188 H192 I193 A194 L210 L214	L174-L190 HydrophobicContact CD2-CB 3.87Å; Y177-L190 HydrophobicContact CD1-CD1 3.61Å; Y177-L190 HydrophobicContact CE1-CD1 3.6Å; Y177-L190 HydrophobicContact CE1-CD2 4.46Å; Y186-L190 HydrophobicContact CD2-CD1 4.35Å; Y186-L190 HydrophobicContact CE2-CB 4.37Å; C187-L190 HydrophobicContact CB-CD1 4.37Å; C187-L190 HydrophobicContact CB-CG 4.24Å; C187-L190 VanDerWaalsContact O-CB 3.23Å; C187-L190 WeakPolarHBondContact O-CB 3.26Å; C187-L190 WeakPolarHBondContact O-CG 3.28Å; C187-L190 PolarHBondContact O-N 3.05Å; R188-L190 PolarHBondContact O-N 2.87Å; L190-H192 PolarHBondContact O-N 2.83Å; L190-I193 HydrophobicContact CD2-CD1 4.28Å; L190-I193 PolarHBondContact O-N 2.9Å; L190-A194 WeakPolarHBondContact O-CB 3.3Å; L190-A194 PolarHBondContact O-N 3.36Å; L190-L210 HydrophobicContact CD2-CD1 4.24Å; L190-L214 HydrophobicContact CD2-CD1 3.58Å
191	S	90.4	Very high	87.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-56.6	-43.8	179.5	-174.4	0	0	0	0	111.4	T152 L170 R188 D189 A195	T152-S191 PolarHBondContact OG1-OG 3.2Å; L170-S191 WeakPolarHBondContact CD1-O 3.26Å; R188-S191 PolarHBondContact O-N 3.4Å; D189-S191 VanDerWaalsContact C-N 3.32Å; D189-S191 PolarHBondContact O-N 3.18Å; S191-A195 WeakPolarHBondContact O-CB 3.38Å; S191-A195 PolarHBondContact O-N 2.97Å
192	H	87.8	Confident	87.5	Confident	31 Å²	31	32.8 Å²	32.8	14%	0.144	17%	0.173	C	C	.	.	H	α-helix	trans	-69.9	-39.6	-179.2	-76.4	98.2	0	0	0	113.4	D189 L190 L196 I270 I274	D189-H192 PolarHBondContact O-N 3.25Å; L190-H192 PolarHBondContact O-N 2.83Å; H192-L196 PolarHBondContact O-N 3.43Å; H192-L196 VanDerWaalsContact O-N 3.12Å; H192-I270 HydrophobicContact CB-CG2 3.57Å; H192-I274 HydrophobicContact CB-CD1 3.47Å; H192-I274 VanDerWaalsContact CB-CD1 3.47Å
193	I	88.9	Confident	88.2	Confident	3 Å²	3	30 Å²	30	2%	0.015	15%	0.152	C	C	.	.	H	α-helix	trans	-64.5	-51.3	175.4	-54.4	170.1	0	0	0	110.1	D189 L190 A195 L196 F197 L210 L213 L266 I270 W286	D189-I193 WeakPolarHBondContact O-CG1 3.2Å; D189-I193 PolarHBondContact O-N 2.53Å; L190-I193 HydrophobicContact CD2-CD1 4.28Å; L190-I193 PolarHBondContact O-N 2.9Å; I193-A195 VanDerWaalsContact C-N 3.27Å; I193-A195 PolarHBondContact O-N 3.07Å; I193-L196 WeakPolarHBondContact O-CB 3.48Å; I193-L196 PolarHBondContact O-N 3.1Å; I193-L196 VanDerWaalsContact O-N 3.11Å; I193-F197 HydrophobicContact CG2-CD2 3.87Å; I193-F197 HydrophobicContact CG2-CE2 3.5Å; I193-F197 HydrophobicContact CG2-CZ 4.33Å; I193-F197 PolarHBondContact O-N 3.47Å; I193-L210 HydrophobicContact CB-CD1 3.95Å; I193-L210 HydrophobicContact CD1-CD1 4.25Å; I193-L210 HydrophobicContact CG2-CD1 3.63Å; I193-L213 HydrophobicContact CG2-CD2 3.78Å; I193-L266 HydrophobicContact CD1-CD2 4.13Å; I193-L266 HydrophobicContact CD1-CG 4.49Å; I193-I270 HydrophobicContact CD1-CD1 3.19Å; I193-I270 HydrophobicContact CD1-CG1 4.32Å; I193-I270 HydrophobicContact CG1-CD1 3.12Å; I193-I270 HydrophobicContact CG1-CG1 3.79Å; I193-I270 HydrophobicContact CG1-CG2 4.44Å; I193-W286 HydrophobicContact CG1-CH2 4.43Å; I193-W286 HydrophobicContact CG2-CH2 3.86Å
194	A	93.3	Very high	89	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.9	-42.2	-178.2	0	0	0	0	0	110.5	L170 I173 L174 L190 L196 F197 L198 L210	L170-A194 HydrophobicContact CD1-CB 3.45Å; L170-A194 VanDerWaalsContact CD1-CB 3.45Å; I173-A194 HydrophobicContact CG2-CB 3.98Å; L174-A194 HydrophobicContact CD2-CB 4.07Å; L190-A194 WeakPolarHBondContact O-CB 3.3Å; L190-A194 PolarHBondContact O-N 3.36Å; A194-L196 VanDerWaalsContact C-N 3.32Å; A194-L196 PolarHBondContact O-N 3.42Å; A194-F197 PolarHBondContact O-N 3.19Å; A194-L198 WeakPolarHBondContact O-CB 3.25Å; A194-L198 PolarHBondContact O-N 3.13Å; A194-L210 HydrophobicContact CB-CD2 4.3Å
195	A	92.9	Very high	90	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.9	-38.9	176.4	0	0	0	0	0	112.6	T152 L153 F159 L170 S191 I193 L198 L199	T152-A195 HydrophobicContact CG2-CB 3.42Å; T152-A195 VanDerWaalsContact CG2-CB 3.42Å; L153-A195 HydrophobicContact CD1-CB 3.78Å; L153-A195 HydrophobicContact CG-CB 4.34Å; F159-A195 HydrophobicContact CE1-CB 4.05Å; F159-A195 HydrophobicContact CE2-CB 4.02Å; F159-A195 HydrophobicContact CZ-CB 3.62Å; L170-A195 HydrophobicContact CD1-CB 4.12Å; L170-A195 HydrophobicContact CD2-CB 3.9Å; S191-A195 WeakPolarHBondContact O-CB 3.38Å; S191-A195 PolarHBondContact O-N 2.97Å; I193-A195 VanDerWaalsContact C-N 3.27Å; I193-A195 PolarHBondContact O-N 3.07Å; A195-L198 PolarHBondContact O-N 3.25Å; A195-L199 WeakPolarHBondContact O-CG 3.45Å; A195-L199 PolarHBondContact O-N 3.1Å
196	L	91.5	Very high	90.8	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.016	11%	0.111	C	C	.	.	H	α-helix	trans	-63.9	-44.1	176.2	-171.8	74.6	0	0	0	111.9	W111 H192 I193 A194 L198 L199 L279 L283 W286	W111-L196 HydrophobicContact CH2-CD2 4.45Å; W111-L196 HydrophobicContact CH2-CG 4.29Å; H192-L196 PolarHBondContact O-N 3.43Å; H192-L196 VanDerWaalsContact O-N 3.12Å; I193-L196 WeakPolarHBondContact O-CB 3.48Å; I193-L196 PolarHBondContact O-N 3.1Å; I193-L196 VanDerWaalsContact O-N 3.11Å; A194-L196 VanDerWaalsContact C-N 3.32Å; A194-L196 PolarHBondContact O-N 3.42Å; L196-L198 VanDerWaalsContact C-N 3.32Å; L196-L199 HydrophobicContact CD1-CD1 4.28Å; L196-L199 WeakPolarHBondContact O-CB 3.24Å; L196-L199 PolarHBondContact O-N 3.22Å; L196-L279 HydrophobicContact CD1-CD1 4.05Å; L196-L283 HydrophobicContact CD1-CD2 3.62Å; L196-L283 HydrophobicContact CD1-CG 4.49Å; L196-L283 HydrophobicContact CG-CD2 4.34Å; L196-W286 HydrophobicContact CD2-CB 4.36Å; L196-W286 HydrophobicContact CD2-CD2 3.55Å; L196-W286 VanDerWaalsContact CD2-CE2 3.4Å; L196-W286 HydrophobicContact CD2-CE3 4.33Å; L196-W286 HydrophobicContact CD2-CG 3.52Å; L196-W286 HydrophobicContact CD2-CZ2 4.08Å; L196-W286 VanDerWaalsContact CD2-NE1 3.27Å
197	F	93.9	Very high	91.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.8	-41.5	174.8	-73.6	-45.5	0	0	0	111.6	W111 L115 I193 A194 L199 Y200 L201 A206 A209 L210 L213 W286	W111-F197 AromaticContact CE3-CD1 3.74Å; W111-F197 HydrophobicContact CE3-CD1 3.74Å; W111-F197 HydrophobicContact CE3-CE1 4.12Å; W111-F197 AromaticContact CZ3-CD1 3.91Å; W111-F197 HydrophobicContact CZ3-CD1 3.91Å; W111-F197 HydrophobicContact CZ3-CE1 4.41Å; L115-F197 HydrophobicContact CD1-CE1 3.73Å; L115-F197 HydrophobicContact CD1-CZ 3.76Å; I193-F197 HydrophobicContact CG2-CD2 3.87Å; I193-F197 HydrophobicContact CG2-CE2 3.5Å; I193-F197 HydrophobicContact CG2-CZ 4.33Å; I193-F197 PolarHBondContact O-N 3.47Å; A194-F197 PolarHBondContact O-N 3.19Å; F197-L199 PolarHBondContact O-N 2.89Å; F197-L199 VanDerWaalsContact O-N 3.12Å; F197-Y200 PolarHBondContact O-N 3.11Å; F197-L201 HydrophobicContact CB-CD1 4.26Å; F197-L201 HydrophobicContact CD1-CD1 4.2Å; F197-L201 HydrophobicContact CG-CD1 4.49Å; F197-L201 WeakPolarHBondContact O-CB 3.37Å; F197-L201 PolarHBondContact O-N 2.91Å; F197-A206 HydrophobicContact CB-CB 3.89Å; F197-A209 HydrophobicContact CD1-CB 4.11Å; F197-A209 HydrophobicContact CD2-CB 3.99Å; F197-A209 HydrophobicContact CE1-CB 4.23Å; F197-A209 HydrophobicContact CE2-CB 4.08Å; F197-A209 HydrophobicContact CG-CB 4.02Å; F197-A209 HydrophobicContact CZ-CB 4.21Å; F197-L210 HydrophobicContact CD2-CB 4.47Å; F197-L213 HydrophobicContact CE2-CB 4.49Å; F197-L213 HydrophobicContact CE2-CD2 4.05Å; F197-L213 HydrophobicContact CZ-CB 4.47Å; F197-L213 HydrophobicContact CZ-CD2 4.03Å; F197-W286 HydrophobicContact CZ-CZ3 4.18Å
198	L	94.9	Very high	92.1	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.01	9%	0.094	C	C	.	.	H	α-helix	trans	-65.4	-14.6	-178.9	-157.9	66.5	0	0	0	114.2	F159 K166 E169 L170 I173 A194 A195 L196 Y200 A206	F159-L198 HydrophobicContact CE1-CD2 4.17Å; F159-L198 HydrophobicContact CZ-CB 4.26Å; F159-L198 HydrophobicContact CZ-CD2 4.01Å; K166-L198 HydrophobicContact CB-CD2 4.48Å; K166-L198 HydrophobicContact CD-CD2 4.05Å; K166-L198 HydrophobicContact CD-CG 4.04Å; K166-L198 WeakPolarHBondContact O-CD2 3.49Å; E169-L198 HydrophobicContact CB-CD1 4.15Å; E169-L198 HydrophobicContact CB-CD2 3.66Å; E169-L198 HydrophobicContact CB-CG 4.42Å; E169-L198 WeakPolarHBondContact OE2-CD1 3.18Å; L170-L198 HydrophobicContact CB-CD2 4.12Å; I173-L198 HydrophobicContact CD1-CD1 3.68Å; A194-L198 WeakPolarHBondContact O-CB 3.25Å; A194-L198 PolarHBondContact O-N 3.13Å; A195-L198 PolarHBondContact O-N 3.25Å; L196-L198 VanDerWaalsContact C-N 3.32Å; L198-Y200 VanDerWaalsContact C-N 3.29Å; L198-A206 HydrophobicContact CD1-CB 4.01Å
199	L	92.4	Very high	92.7	Very high	19 Å²	19	14.8 Å²	14.8	10%	0.099	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.2	169.7	-65	-177.1	0	0	0	112.8	L153 H156 F158 F159 A195 L196 F197 L279	L153-L199 HydrophobicContact CD1-CD1 4.29Å; H156-L199 VanDerWaalsContact CE1-CD2 3.41Å; H156-L199 WeakPolarHBondContact CE1-CD2 3.41Å; F158-L199 HydrophobicContact CD2-CD2 3.91Å; F159-L199 HydrophobicContact CD2-CD2 4.24Å; F159-L199 HydrophobicContact CE2-CD2 3.66Å; F159-L199 HydrophobicContact CE2-CG 4.37Å; A195-L199 WeakPolarHBondContact O-CG 3.45Å; A195-L199 PolarHBondContact O-N 3.1Å; L196-L199 HydrophobicContact CD1-CD1 4.28Å; L196-L199 WeakPolarHBondContact O-CB 3.24Å; L196-L199 PolarHBondContact O-N 3.22Å; F197-L199 PolarHBondContact O-N 2.89Å; F197-L199 VanDerWaalsContact O-N 3.12Å; L199-L279 HydrophobicContact CD1-CD1 4.35Å; L199-L279 HydrophobicContact CD1-CD2 4.3Å
200	Y	93.7	Very high	93.3	Very high	42 Å²	42	14.2 Å²	14.2	17%	0.165	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-12.3	-170.6	-62.4	-73	0	0	0	114.5	M104 R107 G108 W111 F197 L198 L283	M104-Y200 HydrophobicContact CG-CE1 3.6Å; R107-Y200 HydrophobicContact CB-CD1 3.84Å; R107-Y200 HydrophobicContact CB-CD2 4.49Å; R107-Y200 HydrophobicContact CB-CE1 4.34Å; R107-Y200 HydrophobicContact CB-CG 3.92Å; G108-Y200 VanDerWaalsContact CA-O 3.25Å; G108-Y200 WeakPolarHBondContact CA-O 3.4Å; W111-Y200 HydrophobicContact CE3-CD2 4.4Å; W111-Y200 AromaticContact CH2-CD2 3.74Å; W111-Y200 HydrophobicContact CH2-CD2 3.74Å; W111-Y200 HydrophobicContact CH2-CE2 4.16Å; W111-Y200 AromaticContact CZ3-CD2 3.61Å; W111-Y200 HydrophobicContact CZ3-CD2 3.61Å; W111-Y200 HydrophobicContact CZ3-CE2 4.45Å; W111-Y200 HydrophobicContact CZ3-CG 4.29Å; F197-Y200 PolarHBondContact O-N 3.11Å; L198-Y200 VanDerWaalsContact C-N 3.29Å; Y200-L283 HydrophobicContact CD2-CD2 4.28Å; Y200-L283 HydrophobicContact CE2-CD1 4.22Å; Y200-L283 HydrophobicContact CE2-CD2 3.37Å; Y200-L283 HydrophobicContact CE2-CG 4.43Å; Y200-L283 WeakPolarHBondContact OH-CD1 3.45Å
201	L	94.8	Very high	93.5	Very high	7 Å²	7	13.8 Å²	13.8	4%	0.037	7%	0.071	C	C	.	.	S	Bend	trans	-124.3	148.3	-177.1	-62.6	176.1	0	0	0	110.4	G108 S112 F197 D205 A206 A209	G108-L201 WeakPolarHBondContact O-CD2 3.14Å; S112-L201 WeakPolarHBondContact OG-CD2 3.02Å; F197-L201 HydrophobicContact CB-CD1 4.26Å; F197-L201 HydrophobicContact CD1-CD1 4.2Å; F197-L201 HydrophobicContact CG-CD1 4.49Å; F197-L201 WeakPolarHBondContact O-CB 3.37Å; F197-L201 PolarHBondContact O-N 2.91Å; L201-D205 HydrophobicContact CB-CB 4.14Å; L201-D205 HydrophobicContact CD2-CB 4.47Å; L201-A206 HydrophobicContact CB-CB 4.11Å; L201-A209 HydrophobicContact CD1-CB 3.76Å
202	P	95.3	Very high	93.5	Very high	72 Å²	72	15.4 Å²	15.4	47%	0.468	8%	0.078	S	C	.	.			trans	-66.1	162.8	168.9	29.7	-35.2	0	0	0	111.4	E204 D205 A206	P202-E204 PolarHBondContact O-N 2.9Å; P202-D205 HydrophobicContact CG-CB 3.75Å; P202-D205 VanDerWaalsContact CG-CG 3.47Å; P202-D205 VanDerWaalsContact CG-OD2 3.29Å; P202-D205 WeakPolarHBondContact CG-OD2 3.44Å; P202-D205 PolarHBondContact O-N 3.3Å; P202-D205 VanDerWaalsContact O-N 3.1Å; P202-A206 WeakPolarHBondContact O-CB 3.17Å; P202-A206 PolarHBondContact O-N 3.37Å
203	E	96.4	Very high	93.6	Very high	32 Å²	32	14 Å²	14	15%	0.15	7%	0.072	C	C	.	.	H	α-helix	trans	-46.6	-53.9	-172.7	-170	-170.9	115.8	0	0	112.9	Y128 K132 E169 H172 I173 A206 F207	Y128-E203 HydrophobicContact CE1-CG 4.27Å; Y128-E203 WeakPolarHBondContact CE1-OE1 3.09Å; Y128-E203 VanDerWaalsContact CZ-OE1 3.27Å; Y128-E203 VanDerWaalsContact OH-CG 3.27Å; Y128-E203 WeakPolarHBondContact OH-CG 3.41Å; Y128-E203 PolarHBondContact OH-OE1 3.3Å; K132-E203 IonicContact NZ-OE1 2.97Å; K132-E203 PolarHBondContact NZ-OE1 3.08Å; K132-E203 IonicContact NZ-OE2 3.57Å; E169-E203 HydrophobicContact CB-CB 4.39Å; E169-E203 HydrophobicContact CB-CG 3.99Å; E169-E203 HydrophobicContact CG-CB 4.16Å; E169-E203 HydrophobicContact CG-CG 4.1Å; E169-E203 WeakPolarHBondContact CG-OE2 3.33Å; H172-E203 IonicContact CG-OE1 2.78Å; H172-E203 IonicContact ND1-OE1 3.93Å; H172-E203 IonicContact ND1-OE2 3.57Å; H172-E203 PolarHBondContact ND1-OE2 3.05Å; H172-E203 VanDerWaalsContact ND1-OE2 3.17Å; I173-E203 HydrophobicContact CD1-CG 4.2Å; I173-E203 WeakPolarHBondContact CD1-O 3.4Å; I173-E203 HydrophobicContact CG1-CG 4.02Å; E203-A206 PolarHBondContact O-N 3.16Å; E203-F207 PolarHBondContact O-N 3.28Å; E203-F207 VanDerWaalsContact O-N 3.1Å
204	E	96.6	Very high	93.3	Very high	55 Å²	55	14.2 Å²	14.2	26%	0.257	7%	0.073	S	C	.	.	H	α-helix	trans	-68.9	-39.5	-177.8	-173.8	-174.8	-172.1	0	0	112.9	K121 Y128 P202 A206 F207 W208	K121-E204 HydrophobicContact CD-CG 4.16Å; K121-E204 WeakPolarHBondContact CE-OE2 3.1Å; K121-E204 HydrophobicContact CG-CG 4.45Å; K121-E204 IonicContact NZ-OE2 3.18Å; K121-E204 PolarHBondContact NZ-OE2 3.38Å; Y128-E204 HydrophobicContact CD1-CB 3.93Å; Y128-E204 HydrophobicContact CD1-CG 3.83Å; Y128-E204 HydrophobicContact CE1-CB 4.3Å; Y128-E204 HydrophobicContact CG-CB 4.4Å; Y128-E204 HydrophobicContact CG-CG 3.91Å; P202-E204 PolarHBondContact O-N 2.9Å; E204-A206 VanDerWaalsContact C-N 3.3Å; E204-A206 PolarHBondContact O-N 3.28Å; E204-F207 WeakPolarHBondContact O-CB 3.41Å; E204-F207 PolarHBondContact O-N 2.79Å; E204-W208 PolarHBondContact O-N 2.76Å; E204-W208 VanDerWaalsContact O-N 3.07Å
205	D	95.9	Very high	92.7	Very high	23 Å²	23	16.3 Å²	16.3	12%	0.123	9%	0.09	C	C	.	.	H	α-helix	trans	-67.7	-36.4	179.1	-67.2	5.2	0	0	0	110.6	K121 L201 P202 F207 W208 A209	K121-D205 WeakPolarHBondContact CD-OD1 3.44Å; K121-D205 WeakPolarHBondContact CE-OD1 3.39Å; K121-D205 IonicContact NZ-OD1 3Å; K121-D205 PolarHBondContact NZ-OD1 3.39Å; L201-D205 HydrophobicContact CB-CB 4.14Å; L201-D205 HydrophobicContact CD2-CB 4.47Å; P202-D205 HydrophobicContact CG-CB 3.75Å; P202-D205 VanDerWaalsContact CG-CG 3.47Å; P202-D205 VanDerWaalsContact CG-OD2 3.29Å; P202-D205 WeakPolarHBondContact CG-OD2 3.44Å; P202-D205 PolarHBondContact O-N 3.3Å; P202-D205 VanDerWaalsContact O-N 3.1Å; D205-F207 VanDerWaalsContact C-N 3.33Å; D205-W208 PolarHBondContact O-N 2.86Å; D205-A209 VanDerWaalsContact O-CB 3.26Å; D205-A209 WeakPolarHBondContact O-CB 2.97Å; D205-A209 PolarHBondContact O-N 3.33Å
206	A	96.4	Very high	91.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.1	-37.9	174.3	0	0	0	0	0	111.7	I173 F197 L198 L201 P202 E203 E204 A209 L210	I173-A206 HydrophobicContact CD1-CB 3.82Å; F197-A206 HydrophobicContact CB-CB 3.89Å; L198-A206 HydrophobicContact CD1-CB 4.01Å; L201-A206 HydrophobicContact CB-CB 4.11Å; P202-A206 WeakPolarHBondContact O-CB 3.17Å; P202-A206 PolarHBondContact O-N 3.37Å; E203-A206 PolarHBondContact O-N 3.16Å; E204-A206 VanDerWaalsContact C-N 3.3Å; E204-A206 PolarHBondContact O-N 3.28Å; A206-A209 PolarHBondContact O-N 2.99Å; A206-L210 WeakPolarHBondContact O-CB 3.46Å; A206-L210 PolarHBondContact O-N 3.13Å
207	F	96	Very high	90.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.8	-50.7	171.9	169.3	-95.9	0	0	0	111.7	Y128 M131 I173 A176 Y180 E203 E204 D205 A209 L210 V211	Y128-F207 HydrophobicContact CD2-CB 3.76Å; Y128-F207 AromaticContact CD2-CD1 3.48Å; Y128-F207 HydrophobicContact CD2-CD1 3.48Å; Y128-F207 VanDerWaalsContact CD2-CD1 3.48Å; Y128-F207 AromaticContact CD2-CD2 3.88Å; Y128-F207 HydrophobicContact CD2-CD2 3.88Å; Y128-F207 HydrophobicContact CD2-CE1 4.04Å; Y128-F207 HydrophobicContact CD2-CE2 4.39Å; Y128-F207 AromaticContact CD2-CG 3.39Å; Y128-F207 HydrophobicContact CD2-CG 3.39Å; Y128-F207 HydrophobicContact CD2-CZ 4.48Å; Y128-F207 HydrophobicContact CE2-CB 3.61Å; Y128-F207 HydrophobicContact CE2-CD1 4.17Å; Y128-F207 AromaticContact CE2-CD2 3.84Å; Y128-F207 HydrophobicContact CE2-CD2 3.84Å; Y128-F207 AromaticContact CE2-CG 3.59Å; Y128-F207 HydrophobicContact CE2-CG 3.59Å; Y128-F207 HydrophobicContact CG-CD1 4.29Å; Y128-F207 HydrophobicContact CG-CG 4.5Å; M131-F207 HydrophobicContact CE-CE1 3.5Å; M131-F207 HydrophobicContact CE-CE2 4.26Å; M131-F207 HydrophobicContact CE-CZ 3.26Å; M131-F207 HydrophobicContact SD-CZ 4.4Å; I173-F207 HydrophobicContact CG1-CB 4.26Å; I173-F207 HydrophobicContact CG2-CB 4.21Å; I173-F207 HydrophobicContact CG2-CD2 4.32Å; A176-F207 HydrophobicContact CB-CD2 3.95Å; A176-F207 HydrophobicContact CB-CE2 3.77Å; Y180-F207 HydrophobicContact CD2-CZ 4.21Å; Y180-F207 HydrophobicContact CG-CZ 4.23Å; E203-F207 PolarHBondContact O-N 3.28Å; E203-F207 VanDerWaalsContact O-N 3.1Å; E204-F207 WeakPolarHBondContact O-CB 3.41Å; E204-F207 PolarHBondContact O-N 2.79Å; D205-F207 VanDerWaalsContact C-N 3.33Å; F207-A209 VanDerWaalsContact C-N 3.31Å; F207-A209 PolarHBondContact O-N 3.34Å; F207-L210 WeakPolarHBondContact O-CB 3.49Å; F207-L210 PolarHBondContact O-N 3.35Å; F207-L210 VanDerWaalsContact O-N 3.17Å; F207-V211 HydrophobicContact CD1-CG2 4.42Å; F207-V211 HydrophobicContact CE1-CG2 3.88Å; F207-V211 HydrophobicContact CE2-CG2 4Å; F207-V211 HydrophobicContact CZ-CG2 3.63Å; F207-V211 WeakPolarHBondContact O-CG2 3.48Å; F207-V211 PolarHBondContact O-N 3.46Å
208	W	95.4	Very high	89.2	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.5	-32.9	179.4	-69.6	111.6	0	0	0	112.8	T117 M120 K121 N124 R127 Y180 E204 D205 L210 V211 Q212	T117-W208 HydrophobicContact CG2-CB 4.4Å; M120-W208 HydrophobicContact CB-CB 4.25Å; M120-W208 HydrophobicContact CB-CD2 3.92Å; M120-W208 HydrophobicContact CB-CE3 3.74Å; M120-W208 HydrophobicContact CB-CG 4.16Å; M120-W208 HydrophobicContact CB-CZ3 4.41Å; M120-W208 HydrophobicContact CE-CE3 3.91Å; M120-W208 HydrophobicContact CE-CZ3 3.75Å; M120-W208 HydrophobicContact CG-CE3 4.44Å; K121-W208 HydrophobicContact CG-CG 3.94Å; N124-W208 HydrophobicContact CB-CH2 3.41Å; N124-W208 VanDerWaalsContact CB-CH2 3.41Å; N124-W208 HydrophobicContact CB-CZ2 3.46Å; N124-W208 VanDerWaalsContact CB-CZ2 3.46Å; N124-W208 HydrophobicContact CB-CZ3 4.46Å; R127-W208 HydrophobicContact CB-CZ2 4.48Å; Y180-W208 HydrophobicContact CE2-CZ3 4.19Å; E204-W208 PolarHBondContact O-N 2.76Å; E204-W208 VanDerWaalsContact O-N 3.07Å; D205-W208 PolarHBondContact O-N 2.86Å; W208-L210 VanDerWaalsContact C-N 3.34Å; W208-V211 HydrophobicContact CE3-CB 4.29Å; W208-V211 HydrophobicContact CE3-CG1 4.3Å; W208-V211 HydrophobicContact CE3-CG2 4.44Å; W208-V211 HydrophobicContact CZ3-CG1 4.41Å; W208-V211 PolarHBondContact O-N 3.23Å; W208-Q212 VanDerWaalsContact O-CB 3.28Å; W208-Q212 WeakPolarHBondContact O-CB 3.41Å; W208-Q212 WeakPolarHBondContact O-CG 3.43Å; W208-Q212 PolarHBondContact O-N 3.18Å
209	A	93.7	Very high	88	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-44.4	171.3	0	0	0	0	0	111.3	L115 T117 F197 L201 D205 A206 F207 Q212 L213	L115-A209 HydrophobicContact CD1-CB 3.61Å; T117-A209 HydrophobicContact CG2-CB 3.85Å; F197-A209 HydrophobicContact CD1-CB 4.11Å; F197-A209 HydrophobicContact CD2-CB 3.99Å; F197-A209 HydrophobicContact CE1-CB 4.23Å; F197-A209 HydrophobicContact CE2-CB 4.08Å; F197-A209 HydrophobicContact CG-CB 4.02Å; F197-A209 HydrophobicContact CZ-CB 4.21Å; L201-A209 HydrophobicContact CD1-CB 3.76Å; D205-A209 VanDerWaalsContact O-CB 3.26Å; D205-A209 WeakPolarHBondContact O-CB 2.97Å; D205-A209 PolarHBondContact O-N 3.33Å; A206-A209 PolarHBondContact O-N 2.99Å; F207-A209 VanDerWaalsContact C-N 3.31Å; F207-A209 PolarHBondContact O-N 3.34Å; A209-Q212 PolarHBondContact O-N 3.48Å; A209-L213 VanDerWaalsContact O-CB 3.29Å; A209-L213 WeakPolarHBondContact O-CB 3.46Å; A209-L213 PolarHBondContact O-N 3.47Å
210	L	91.9	Very high	86.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.7	-47.9	176.1	-177.6	67.8	0	0	0	111.8	I173 Y177 L190 I193 A194 F197 A206 F207 W208 Q212 L213 L214	I173-L210 HydrophobicContact CG2-CD2 4.13Å; Y177-L210 HydrophobicContact CD2-CD2 3.85Å; Y177-L210 HydrophobicContact CD2-CG 4.19Å; Y177-L210 HydrophobicContact CE2-CD2 4.49Å; Y177-L210 HydrophobicContact CE2-CG 4.41Å; Y177-L210 HydrophobicContact CG-CD2 4.09Å; L190-L210 HydrophobicContact CD2-CD1 4.24Å; I193-L210 HydrophobicContact CB-CD1 3.95Å; I193-L210 HydrophobicContact CD1-CD1 4.25Å; I193-L210 HydrophobicContact CG2-CD1 3.63Å; A194-L210 HydrophobicContact CB-CD2 4.3Å; F197-L210 HydrophobicContact CD2-CB 4.47Å; A206-L210 WeakPolarHBondContact O-CB 3.46Å; A206-L210 PolarHBondContact O-N 3.13Å; F207-L210 WeakPolarHBondContact O-CB 3.49Å; F207-L210 PolarHBondContact O-N 3.35Å; F207-L210 VanDerWaalsContact O-N 3.17Å; W208-L210 VanDerWaalsContact C-N 3.34Å; L210-Q212 VanDerWaalsContact C-N 3.35Å; L210-Q212 PolarHBondContact O-N 3.37Å; L210-L213 PolarHBondContact O-N 3.03Å; L210-L214 HydrophobicContact CD1-CD1 3.89Å; L210-L214 HydrophobicContact CG-CD1 4.01Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 3.39Å
211	V	91.4	Very high	84.3	Confident	1 Å²	1	30 Å²	30	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-57.7	-48.9	177.2	168.7	0	0	0	0	110.8	M120 Y177 Y180 F207 W208 L213 L214 A215	M120-V211 HydrophobicContact CE-CG1 4.48Å; Y177-V211 HydrophobicContact CD2-CG2 4.17Å; Y177-V211 HydrophobicContact CE2-CG2 4.37Å; Y180-V211 HydrophobicContact CD1-CG1 4.26Å; Y180-V211 HydrophobicContact CD1-CG2 3.98Å; Y180-V211 HydrophobicContact CE1-CB 4.41Å; Y180-V211 HydrophobicContact CE1-CG1 3.49Å; Y180-V211 VanDerWaalsContact CE1-CG1 3.49Å; Y180-V211 HydrophobicContact CE1-CG2 4.07Å; Y180-V211 HydrophobicContact CE2-CG1 4.26Å; Y180-V211 HydrophobicContact CG-CG2 4.27Å; Y180-V211 VanDerWaalsContact CZ-CG1 3.49Å; Y180-V211 WeakPolarHBondContact OH-CG1 3.07Å; F207-V211 HydrophobicContact CD1-CG2 4.42Å; F207-V211 HydrophobicContact CE1-CG2 3.88Å; F207-V211 HydrophobicContact CE2-CG2 4Å; F207-V211 HydrophobicContact CZ-CG2 3.63Å; F207-V211 WeakPolarHBondContact O-CG2 3.48Å; F207-V211 PolarHBondContact O-N 3.46Å; W208-V211 HydrophobicContact CE3-CB 4.29Å; W208-V211 HydrophobicContact CE3-CG1 4.3Å; W208-V211 HydrophobicContact CE3-CG2 4.44Å; W208-V211 HydrophobicContact CZ3-CG1 4.41Å; W208-V211 PolarHBondContact O-N 3.23Å; V211-L213 PolarHBondContact O-N 3.16Å; V211-L214 PolarHBondContact O-N 3.13Å; V211-A215 VanDerWaalsContact O-CB 3.26Å; V211-A215 WeakPolarHBondContact O-CB 3.09Å; V211-A215 PolarHBondContact O-N 3.11Å
212	Q	91.1	Very high	81.7	Confident	33 Å²	33	37.5 Å²	37.5	15%	0.154	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-39.4	-178.8	-73.5	-75.9	93.7	0	0	112	L115 M120 W208 A209 L210 L214 S216	L115-Q212 HydrophobicContact CB-CB 4.23Å; L115-Q212 HydrophobicContact CD2-CB 4.44Å; L115-Q212 VanDerWaalsContact O-CB 3.31Å; L115-Q212 WeakPolarHBondContact O-CB 3.23Å; L115-Q212 WeakPolarHBondContact O-CG 3.47Å; L115-Q212 PolarHBondContact O-NE2 3.47Å; M120-Q212 HydrophobicContact CG-CG 3.57Å; M120-Q212 PolarHBondContact SD-OE1 2.86Å; W208-Q212 VanDerWaalsContact O-CB 3.28Å; W208-Q212 WeakPolarHBondContact O-CB 3.41Å; W208-Q212 WeakPolarHBondContact O-CG 3.43Å; W208-Q212 PolarHBondContact O-N 3.18Å; A209-Q212 PolarHBondContact O-N 3.48Å; L210-Q212 VanDerWaalsContact C-N 3.35Å; L210-Q212 PolarHBondContact O-N 3.37Å; Q212-L214 VanDerWaalsContact C-N 3.26Å; Q212-L214 PolarHBondContact O-N 3.11Å; Q212-S216 WeakPolarHBondContact O-CA 3.33Å; Q212-S216 WeakPolarHBondContact O-CB 3.34Å; Q212-S216 PolarHBondContact O-N 2.99Å
213	L	88.1	Confident	78.9	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-40.1	176.1	-170.9	74.9	0	0	0	112.1	L115 I193 F197 A209 L210 V211 H219 W286 Y289 L290	L115-L213 HydrophobicContact CD2-CB 4.46Å; L115-L213 HydrophobicContact CD2-CD1 4.23Å; I193-L213 HydrophobicContact CG2-CD2 3.78Å; F197-L213 HydrophobicContact CE2-CB 4.49Å; F197-L213 HydrophobicContact CE2-CD2 4.05Å; F197-L213 HydrophobicContact CZ-CB 4.47Å; F197-L213 HydrophobicContact CZ-CD2 4.03Å; A209-L213 VanDerWaalsContact O-CB 3.29Å; A209-L213 WeakPolarHBondContact O-CB 3.46Å; A209-L213 PolarHBondContact O-N 3.47Å; L210-L213 PolarHBondContact O-N 3.03Å; V211-L213 PolarHBondContact O-N 3.16Å; L213-H219 HydrophobicContact CD1-CB 4.15Å; L213-W286 HydrophobicContact CD1-CZ3 4.13Å; L213-W286 HydrophobicContact CD2-CH2 3.71Å; L213-W286 HydrophobicContact CD2-CZ3 3.64Å; L213-Y289 HydrophobicContact CD1-CD1 4.5Å; L213-Y289 HydrophobicContact CD1-CE1 3.87Å; L213-L290 HydrophobicContact CD1-CD2 3.81Å
214	L	83.9	Confident	75.9	Confident	9 Å²	9	37 Å²	37	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-84.6	-32.4	-175	-63.8	170	0	0	0	112.4	Y177 L190 L210 V211 Q212 S220 F224 L266	Y177-L214 HydrophobicContact CE1-CD1 4.29Å; Y177-L214 HydrophobicContact CE2-CD1 3.57Å; Y177-L214 VanDerWaalsContact CZ-CD1 3.41Å; Y177-L214 WeakPolarHBondContact OH-CD1 3.48Å; L190-L214 HydrophobicContact CD2-CD1 3.58Å; L210-L214 HydrophobicContact CD1-CD1 3.89Å; L210-L214 HydrophobicContact CG-CD1 4.01Å; L210-L214 WeakPolarHBondContact O-CG 3.44Å; L210-L214 PolarHBondContact O-N 3.39Å; V211-L214 PolarHBondContact O-N 3.13Å; Q212-L214 VanDerWaalsContact C-N 3.26Å; Q212-L214 PolarHBondContact O-N 3.11Å; L214-S220 PolarHBondContact O-OG 3.4Å; L214-F224 HydrophobicContact CD2-CZ 4.41Å; L214-L266 HydrophobicContact CD2-CD2 3.5Å; L214-L266 VanDerWaalsContact CD2-CD2 3.5Å
215	A	80.8	Confident	72.9	Confident	44 Å²	44	39.4 Å²	39.4	36%	0.364	20%	0.2	S	C	.	.	H	α-helix	trans	-90.9	-28.1	-178.3	0	0	0	0	0	114.6	V211 E217	V211-A215 VanDerWaalsContact O-CB 3.26Å; V211-A215 WeakPolarHBondContact O-CB 3.09Å; V211-A215 PolarHBondContact O-N 3.11Å; A215-E217 PolarHBondContact O-N 3.28Å
216	S	71.7	Confident	69.7	Low	27 Å²	27	40.7 Å²	40.7	19%	0.189	21%	0.211	C	C	.	.			trans	-66.6	125.4	-172	168.3	0	0	0	0	112.1	Q212 R218 H219 S220	Q212-S216 WeakPolarHBondContact O-CA 3.33Å; Q212-S216 WeakPolarHBondContact O-CB 3.34Å; Q212-S216 PolarHBondContact O-N 2.99Å; S216-R218 PolarHBondContact O-N 3.29Å; S216-R218 WeakPolarHBondContact OG-CB 3.46Å; S216-R218 PolarHBondContact OG-N 3.3Å; S216-R218 VanDerWaalsContact OG-N 3.14Å; S216-H219 CarbonylContact O-C 3.6Å; S216-H219 PolarHBondContact O-N 3.47Å; S216-H219 PolarHBondContact OG-ND1 2.79Å; S216-S220 WeakPolarHBondContact O-CA 3.14Å; S216-S220 WeakPolarHBondContact O-CB 3.49Å; S216-S220 PolarHBondContact O-N 3.24Å
217	E	66.1	Low	66.8	Low	150 Å²	150	47.1 Å²	47.1	70%	0.701	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-20.6	172	-65.1	-175.8	168.8	0	0	113.6	A215	A215-E217 PolarHBondContact O-N 3.28Å
218	R	66.2	Low	63.7	Low	147 Å²	147	53.6 Å²	53.6	56%	0.555	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-29.3	176.9	-64.7	-173.2	174.4	172.8	0.6	113.3	S216 G293 E294	S216-R218 PolarHBondContact O-N 3.29Å; S216-R218 WeakPolarHBondContact OG-CB 3.46Å; S216-R218 PolarHBondContact OG-N 3.3Å; S216-R218 VanDerWaalsContact OG-N 3.14Å; R218-G293 VanDerWaalsContact O-CA 3.24Å; R218-G293 WeakPolarHBondContact O-CA 3.26Å; R218-E294 PolarHBondContact O-N 2.98Å
219	H	70.8	Confident	60.7	Low	8 Å²	8	57.2 Å²	57.2	4%	0.037	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-12.2	-173.6	-53.8	99.6	0	0	0	112.1	L213 S216 Y289 L290	L213-H219 HydrophobicContact CD1-CB 4.15Å; S216-H219 CarbonylContact O-C 3.6Å; S216-H219 PolarHBondContact O-N 3.47Å; S216-H219 PolarHBondContact OG-ND1 2.79Å; H219-Y289 PolarHBondContact O-OH 3.1Å; H219-L290 PolarHBondContact NE2-O 2.97Å
220	S	58.1	Low	57.8	Low	12 Å²	12	60 Å²	60	8%	0.084	35%	0.352	C	S	.	.			trans	-83.7	127.2	-177.8	-165.7	0	0	0	0	109.2	L214 S216	L214-S220 PolarHBondContact O-OG 3.4Å; S216-S220 WeakPolarHBondContact O-CA 3.14Å; S216-S220 WeakPolarHBondContact O-CB 3.49Å; S216-S220 PolarHBondContact O-N 3.24Å
221	L	49.2	Very low	55.1	Low	10 Å²	10	63.5 Å²	63.5	5%	0.052	37%	0.374	C	S	.	.			trans	-70.6	129.1	162.9	-68	151.9	0	0	0	106.4	G223 F224 L235 P265 L266 E294 L297	L221-G223 PolarHBondContact O-N 3.21Å; L221-F224 HydrophobicContact CB-CD2 4.48Å; L221-F224 HydrophobicContact CD1-CE2 4.41Å; L221-F224 PolarHBondContact O-N 3.24Å; L221-F224 VanDerWaalsContact O-N 3.12Å; L221-L235 HydrophobicContact CD2-CD2 4.27Å; L221-P265 HydrophobicContact CD1-CB 3.67Å; L221-P265 HydrophobicContact CD1-CG 3.77Å; L221-P265 HydrophobicContact CD2-CB 4.31Å; L221-P265 HydrophobicContact CD2-CG 4.22Å; L221-L266 HydrophobicContact CD1-CB 4.17Å; L221-E294 HydrophobicContact CD2-CG 4.07Å; L221-E294 WeakPolarHBondContact CD2-OE1 3.39Å; L221-L297 HydrophobicContact CD1-CD2 3.69Å; L221-L297 HydrophobicContact CD2-CD2 3.22Å; L221-L297 HydrophobicContact CG-CD2 3.76Å
222	Q	39.5	Very low	52.7	Low	164 Å²	164	67.3 Å²	67.3	77%	0.766	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-2.8	177.2	-72.6	-179	-10.5	0	0	115.3
223	G	37.4	Very low	49.9	Very low	36 Å²	36	71.1 Å²	71.1	37%	0.371	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-8.7	176.2	0	0	0	0	0	117.5	L221	L221-G223 PolarHBondContact O-N 3.21Å
224	F	34.1	Very low	47.3	Very low	57 Å²	57	73.1 Å²	73.1	25%	0.25	44%	0.436	C	S	.	.	S	Bend	trans	-80.3	-17.8	176.5	-86.1	-78.8	0	0	0	113.8	L214 L221 S264 L266	L214-F224 HydrophobicContact CD2-CZ 4.41Å; L221-F224 HydrophobicContact CB-CD2 4.48Å; L221-F224 HydrophobicContact CD1-CE2 4.41Å; L221-F224 PolarHBondContact O-N 3.24Å; L221-F224 VanDerWaalsContact O-N 3.12Å; F224-S264 VanDerWaalsContact CZ-CB 3.42Å; F224-S264 WeakPolarHBondContact CZ-OG 3.45Å; F224-L266 HydrophobicContact CE2-CB 4.36Å; F224-L266 HydrophobicContact CE2-CD2 4.45Å
225	H	32.8	Very low	45	Very low	106 Å²	106	76.1 Å²	76.1	49%	0.491	45%	0.452	S	S	.	.	S	Bend	trans	-128	73.7	-178.1	-62.1	-62.4	0	0	0	110.6
226	S	29.1	Very low	43	Very low	50 Å²	50	77.3 Å²	77.3	35%	0.35	45%	0.45	S	S	.	.			trans	-131.8	107.9	161.7	-81.4	0	0	0	0	109.1	N228 T231	S226-N228 WeakPolarHBondContact CB-O 3.39Å; S226-N228 PolarHBondContact O-N 2.88Å; S226-N228 VanDerWaalsContact O-N 3.15Å; S226-T231 PolarHBondContact OG-OG1 3.23Å
227	P	35.7	Very low	41.2	Very low	134 Å²	134	79.9 Å²	79.9	87%	0.87	46%	0.462	S	S	*	.	S	Bend	trans	-62.1	-12.1	170.3	-20.5	32.1	0	0	0	113.4
228	N	30.8	Very low	39.9	Very low	136 Å²	136	78.8 Å²	78.8	73%	0.727	46%	0.456	S	S	*	.	S	Bend	trans	-114.6	109.2	172.5	-69.9	2.8	0	0	0	107.3	S226 G230	S226-N228 WeakPolarHBondContact CB-O 3.39Å; S226-N228 PolarHBondContact O-N 2.88Å; S226-N228 VanDerWaalsContact O-N 3.15Å; N228-G230 PolarHBondContact O-N 3.43Å
229	G	33	Very low	38.5	Very low	76 Å²	76	74.6 Å²	74.6	78%	0.784	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	32.8	-175.8	0	0	0	0	0	117.7
230	G	32.2	Very low	36.9	Very low	58 Å²	58	80 Å²	80	60%	0.598	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-20.5	-179.3	0	0	0	0	0	115.4	N228	N228-G230 PolarHBondContact O-N 3.43Å
231	T	36	Very low	36	Very low	74 Å²	74	85.9 Å²	85.9	45%	0.454	49%	0.494	S	S	.	.	S	Bend	trans	-95.9	-11.7	-169.2	-31.8	0	0	0	0	114.1	S226 Q233	S226-T231 PolarHBondContact OG-OG1 3.23Å; T231-Q233 PolarHBondContact O-N 3.18Å
232	V	39.2	Very low	35.5	Very low	82 Å²	82	89 Å²	89	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-70.3	-25.7	176.1	-177.5	0	0	0	0	111.3	Q236	V232-Q236 WeakPolarHBondContact O-CB 3.24Å; V232-Q236 PolarHBondContact O-N 2.63Å
233	Q	33.9	Very low	35.6	Very low	112 Å²	112	85.1 Å²	85.1	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-65.9	-43.5	178.8	-151.8	70.3	47.9	0	0	112.3	T231 L235 Q236 D237	T231-Q233 PolarHBondContact O-N 3.18Å; Q233-L235 PolarHBondContact O-N 3.38Å; Q233-Q236 PolarHBondContact O-N 3.25Å; Q233-D237 WeakPolarHBondContact O-CB 3.41Å; Q233-D237 PolarHBondContact O-N 3.39Å
234	G	33.2	Very low	35.5	Very low	44 Å²	44	87 Å²	87	45%	0.454	51%	0.513	S	S	.	.	H	α-helix	trans	-67.3	-30.9	-170.9	0	0	0	0	0	115.1	Q238	G234-Q238 PolarHBondContact O-N 3.44Å
235	L	36.1	Very low	35.8	Very low	71 Å²	71	89.4 Å²	89.4	37%	0.372	53%	0.532	S	S	.	.	H	α-helix	trans	-85.5	-29.6	177	-150.9	74	0	0	0	111.8	L221 Q233 D237 Q238 Q239 P265	L221-L235 HydrophobicContact CD2-CD2 4.27Å; Q233-L235 PolarHBondContact O-N 3.38Å; L235-D237 VanDerWaalsContact C-N 3.34Å; L235-Q238 PolarHBondContact O-N 2.98Å; L235-Q239 WeakPolarHBondContact O-CB 3.3Å; L235-Q239 PolarHBondContact O-N 2.61Å; L235-P265 HydrophobicContact CD2-CG 3.47Å; L235-P265 VanDerWaalsContact CD2-CG 3.47Å
236	Q	37	Very low	36	Very low	70 Å²	70	87 Å²	87	33%	0.327	53%	0.528	S	S	.	.	H	α-helix	trans	-64.8	-41.5	170	-165.3	165.6	7.2	0	0	110.6	V232 Q233 Q238 Q239 E240	V232-Q236 WeakPolarHBondContact O-CB 3.24Å; V232-Q236 PolarHBondContact O-N 2.63Å; Q233-Q236 PolarHBondContact O-N 3.25Å; Q236-Q238 PolarHBondContact O-N 2.94Å; Q236-Q239 PolarHBondContact O-N 3.42Å; Q236-E240 WeakPolarHBondContact O-CB 3.43Å; Q236-E240 WeakPolarHBondContact O-CG 3.29Å; Q236-E240 PolarHBondContact O-N 3.19Å
237	D	34.5	Very low	36.2	Very low	81 Å²	81	89.7 Å²	89.7	43%	0.433	53%	0.534	S	S	.	.	H	α-helix	trans	-63.5	-41.5	174.5	-63.9	-22.1	0	0	0	111.4	Q233 L235 H241	Q233-D237 WeakPolarHBondContact O-CB 3.41Å; Q233-D237 PolarHBondContact O-N 3.39Å; L235-D237 VanDerWaalsContact C-N 3.34Å; D237-H241 VanDerWaalsContact O-CB 3.31Å; D237-H241 WeakPolarHBondContact O-CB 3.25Å; D237-H241 PolarHBondContact O-N 3.12Å
238	Q	39	Very low	36	Very low	126 Å²	126	88.4 Å²	88.4	59%	0.589	53%	0.526	S	S	*	.	H	α-helix	trans	-65.9	-39	174.7	-110.8	-162.6	-9.3	0	0	112.6	G234 L235 Q236 H241 V242	G234-Q238 PolarHBondContact O-N 3.44Å; L235-Q238 PolarHBondContact O-N 2.98Å; Q236-Q238 PolarHBondContact O-N 2.94Å; Q238-H241 PolarHBondContact O-N 3.01Å; Q238-V242 VanDerWaalsContact O-CB 3.3Å; Q238-V242 WeakPolarHBondContact O-CB 3.38Å; Q238-V242 WeakPolarHBondContact O-CG2 3.28Å; Q238-V242 PolarHBondContact O-N 3.27Å
239	Q	36.3	Very low	36	Very low	60 Å²	60	92.1 Å²	92.1	28%	0.28	54%	0.536	S	S	.	.	H	α-helix	trans	-67.1	-45.1	178.1	-164.6	89.2	-13.7	0	0	110.7	L235 Q236 V242 V243	L235-Q239 WeakPolarHBondContact O-CB 3.3Å; L235-Q239 PolarHBondContact O-N 2.61Å; Q236-Q239 PolarHBondContact O-N 3.42Å; Q239-V242 PolarHBondContact O-N 3.38Å; Q239-V243 HydrophobicContact CG-CG2 4.48Å; Q239-V243 VanDerWaalsContact O-CB 3.25Å; Q239-V243 WeakPolarHBondContact O-CB 3.42Å; Q239-V243 WeakPolarHBondContact O-CG2 3.37Å; Q239-V243 PolarHBondContact O-N 2.97Å
240	E	37.8	Very low	36.2	Very low	122 Å²	122	94.9 Å²	94.9	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-63.8	-40.7	176.3	-74	-171.7	180	0	0	111.3	Q236 A244	Q236-E240 WeakPolarHBondContact O-CB 3.43Å; Q236-E240 WeakPolarHBondContact O-CG 3.29Å; Q236-E240 PolarHBondContact O-N 3.19Å; E240-A244 WeakPolarHBondContact O-CB 3.4Å; E240-A244 PolarHBondContact O-N 2.9Å
241	H	38.4	Very low	36	Very low	135 Å²	135	100.3 Å²	100.3	63%	0.625	55%	0.55	S	S	*	.	H	α-helix	trans	-69.7	-39.3	177.4	-138.2	-72.2	0	0	0	112.3	D237 Q238 T245	D237-H241 VanDerWaalsContact O-CB 3.31Å; D237-H241 WeakPolarHBondContact O-CB 3.25Å; D237-H241 PolarHBondContact O-N 3.12Å; Q238-H241 PolarHBondContact O-N 3.01Å; H241-T245 VanDerWaalsContact O-CB 3.27Å; H241-T245 WeakPolarHBondContact O-CB 3.19Å; H241-T245 PolarHBondContact O-N 3.46Å; H241-T245 PolarHBondContact O-OG1 2.78Å
242	V	40.4	Very low	35.6	Very low	74 Å²	74	100.1 Å²	100.1	45%	0.448	56%	0.563	S	S	.	*	H	α-helix	trans	-72.2	-34.9	178.3	172.2	0	0	0	0	111.8	Q238 Q239 S246	Q238-V242 VanDerWaalsContact O-CB 3.3Å; Q238-V242 WeakPolarHBondContact O-CB 3.38Å; Q238-V242 WeakPolarHBondContact O-CG2 3.28Å; Q238-V242 PolarHBondContact O-N 3.27Å; Q239-V242 PolarHBondContact O-N 3.38Å; V242-S246 WeakPolarHBondContact O-CB 3.49Å; V242-S246 PolarHBondContact O-N 3.13Å; V242-S246 PolarHBondContact O-OG 3.39Å
243	V	40	Very low	35.4	Very low	84 Å²	84	105 Å²	105	51%	0.509	58%	0.58	S	S	.	*	H	α-helix	trans	-72.9	-42.4	174.6	173.3	0	0	0	0	110.7	Q239 T245 S246	Q239-V243 HydrophobicContact CG-CG2 4.48Å; Q239-V243 VanDerWaalsContact O-CB 3.25Å; Q239-V243 WeakPolarHBondContact O-CB 3.42Å; Q239-V243 WeakPolarHBondContact O-CG2 3.37Å; Q239-V243 PolarHBondContact O-N 2.97Å; V243-T245 PolarHBondContact O-N 3.15Å; V243-S246 PolarHBondContact O-N 3.48Å
244	A	36.4	Very low	35.1	Very low	75 Å²	75	108 Å²	108	62%	0.62	59%	0.593	S	S	*	*	H	α-helix	trans	-66.7	-34.4	177.1	0	0	0	0	0	113	E240	E240-A244 WeakPolarHBondContact O-CB 3.4Å; E240-A244 PolarHBondContact O-N 2.9Å
245	T	39.4	Very low	35	Very low	107 Å²	107	111.6 Å²	111.6	66%	0.656	60%	0.602	S	S	*	*	H	α-helix	trans	-80.7	-15.8	-177.8	-46.4	0	0	0	0	112.8	H241 V243	H241-T245 VanDerWaalsContact O-CB 3.27Å; H241-T245 WeakPolarHBondContact O-CB 3.19Å; H241-T245 PolarHBondContact O-N 3.46Å; H241-T245 PolarHBondContact O-OG1 2.78Å; V243-T245 PolarHBondContact O-N 3.15Å
246	S	38.3	Very low	34.9	Very low	56 Å²	56	117.7 Å²	117.7	39%	0.392	63%	0.626	S	S	.	*	H	α-helix	trans	-109.7	-3.9	-171.8	64.3	0	0	0	0	116.5	V242 V243	V242-S246 WeakPolarHBondContact O-CB 3.49Å; V242-S246 PolarHBondContact O-N 3.13Å; V242-S246 PolarHBondContact O-OG 3.39Å; V243-S246 PolarHBondContact O-N 3.48Å
247	Q	33.9	Very low	34.5	Very low	106 Å²	106	123.8 Å²	123.8	50%	0.495	65%	0.651	S	S	.	*			trans	-151.4	105.3	175.2	-66.3	-75	-79.4	0	0	111.9
248	P	29.8	Very low	34.3	Very low	108 Å²	108	126.4 Å²	126.4	70%	0.701	67%	0.665	S	S	*	*			trans	-90.3	133.4	171	8.4	9.7	0	0	0	112.3
249	K	32.2	Very low	34	Very low	213 Å²	213	127.9 Å²	127.9	93%	0.926	68%	0.676	S	S	*	*	S	Bend	trans	77.6	16.7	149.2	-68.3	-177.3	175.3	177.6	0	122.9
250	T	35.8	Very low	33.7	Very low	134 Å²	134	128.9 Å²	128.9	82%	0.822	69%	0.689	S	S	*	*			trans	-125	16	-179	18.4	0	0	0	0	118.7
251	M	28.1	Very low	33.5	Very low	173 Å²	173	125.6 Å²	125.6	85%	0.852	69%	0.688	S	S	*	*			trans	-125.1	82.8	170.3	-128.2	160.1	-167.1	0	0	110.1
252	G	28.6	Very low	33.5	Very low	70 Å²	70	127.2 Å²	127.2	72%	0.722	70%	0.696	S	S	*	*			trans	-74.5	119.7	171.1	0	0	0	0	0	111	Q254	G252-Q254 PolarHBondContact O-N 3.18Å; G252-Q254 VanDerWaalsContact O-N 3.15Å
253	H	34	Very low	33.4	Very low	185 Å²	185	126.1 Å²	126.1	86%	0.856	69%	0.691	S	S	*	*	S	Bend	trans	65.6	7.1	141.2	-102.5	27.6	0	0	0	123.6
254	Q	28.2	Very low	34	Very low	173 Å²	173	123.5 Å²	123.5	81%	0.808	68%	0.676	S	S	*	*	S	Bend	trans	-119.6	133.1	164.3	-94.8	153.4	-10	0	0	110.3	G252	G252-Q254 PolarHBondContact O-N 3.18Å; G252-Q254 VanDerWaalsContact O-N 3.15Å
255	D	32.2	Very low	34.8	Very low	121 Å²	121	121.3 Å²	121.3	65%	0.647	66%	0.656	S	S	*	*	S	Bend	trans	85.2	19.5	177.2	-50.1	-19.9	0	0	0	119.2	K257	D255-K257 PolarHBondContact O-N 3.5Å; D255-K257 VanDerWaalsContact O-N 3.16Å
256	K	32.4	Very low	35.6	Very low	198 Å²	198	116.6 Å²	116.6	86%	0.861	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	5.1	170	-112.8	-177.6	-179	-175.1	0	115
257	K	29.3	Very low	36.5	Very low	198 Å²	198	114 Å²	114	86%	0.861	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	-4.5	-176.6	-78.9	-173.7	175.6	-178.2	0	116.3	D255	D255-K257 PolarHBondContact O-N 3.5Å; D255-K257 VanDerWaalsContact O-N 3.16Å
258	D	30	Very low	37.4	Very low	137 Å²	137	110.8 Å²	110.8	73%	0.733	60%	0.598	S	S	*	*	S	Bend	trans	-109.2	3.4	179.2	-74.3	-34.2	0	0	0	115	C260	D258-C260 PolarHBondContact O-N 3.2Å
259	L	31.9	Very low	38.7	Very low	156 Å²	156	106 Å²	106	82%	0.817	57%	0.566	S	S	*	*			trans	-82.3	75.4	163	-76.3	105.5	0	0	0	109.3	G261	L259-G261 PolarHBondContact O-N 2.7Å
260	C	31.1	Very low	40	Very low	82 Å²	82	96 Å²	96	55%	0.554	52%	0.523	S	S	*	.			trans	-52.4	122.6	169.8	-176.8	0	0	0	0	109.6	D258 Q262	D258-C260 PolarHBondContact O-N 3.2Å; C260-Q262 PolarHBondContact O-N 2.65Å
261	G	32.8	Very low	41.1	Very low	53 Å²	53	94 Å²	94	55%	0.546	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	42.1	180	0	0	0	0	0	115.1	L259	L259-G261 PolarHBondContact O-N 2.7Å
262	Q	39.3	Very low	42.5	Very low	168 Å²	168	86.7 Å²	86.7	79%	0.785	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	1.5	176.8	-64.4	-168.6	65.3	0	0	113.2	C260 S264	C260-Q262 PolarHBondContact O-N 2.65Å; Q262-S264 PolarHBondContact O-N 3.28Å
263	C	38.3	Very low	44.1	Very low	51 Å²	51	83.7 Å²	83.7	35%	0.345	43%	0.431	S	S	.	.			trans	-74.7	112	176.9	-90.4	0	0	0	0	110.8
264	S	52.5	Low	45.2	Very low	29 Å²	29	76.7 Å²	76.7	20%	0.203	40%	0.4	C	S	.	.			trans	-57.7	153.2	166.1	66.8	0	0	0	0	110.5	F224 Q262 L266 G267 C268	F224-S264 VanDerWaalsContact CZ-CB 3.42Å; F224-S264 WeakPolarHBondContact CZ-OG 3.45Å; Q262-S264 PolarHBondContact O-N 3.28Å; S264-L266 PolarHBondContact O-N 3.12Å; S264-L266 VanDerWaalsContact O-N 3.15Å; S264-G267 CarbonylContact O-C 3.55Å; S264-G267 WeakPolarHBondContact O-CA 3.29Å; S264-G267 PolarHBondContact O-N 3.37Å; S264-G267 PolarHBondContact OG-N 2.97Å; S264-C268 PolarHBondContact O-N 2.91Å
265	P	52.7	Low	46.7	Very low	30 Å²	30	73.6 Å²	73.6	20%	0.195	39%	0.389	C	S	.	.	H	α-helix	trans	-54.7	-30.8	172.4	-23.1	27.5	0	0	0	113	L221 L235 C268 L269 L297	L221-P265 HydrophobicContact CD1-CB 3.67Å; L221-P265 HydrophobicContact CD1-CG 3.77Å; L221-P265 HydrophobicContact CD2-CB 4.31Å; L221-P265 HydrophobicContact CD2-CG 4.22Å; L235-P265 HydrophobicContact CD2-CG 3.47Å; L235-P265 VanDerWaalsContact CD2-CG 3.47Å; P265-C268 PolarHBondContact O-N 3.26Å; P265-L269 PolarHBondContact O-N 3.24Å; P265-L297 HydrophobicContact CB-CD2 3.87Å
266	L	55.8	Low	47.8	Very low	8 Å²	8	68.3 Å²	68.3	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-48.2	171.1	-174.8	64.9	0	0	0	110.8	I193 L214 L221 F224 S264 C268 L269 I270 Y289	I193-L266 HydrophobicContact CD1-CD2 4.13Å; I193-L266 HydrophobicContact CD1-CG 4.49Å; L214-L266 HydrophobicContact CD2-CD2 3.5Å; L214-L266 VanDerWaalsContact CD2-CD2 3.5Å; L221-L266 HydrophobicContact CD1-CB 4.17Å; F224-L266 HydrophobicContact CE2-CB 4.36Å; F224-L266 HydrophobicContact CE2-CD2 4.45Å; S264-L266 PolarHBondContact O-N 3.12Å; S264-L266 VanDerWaalsContact O-N 3.15Å; L266-C268 VanDerWaalsContact C-N 3.31Å; L266-C268 PolarHBondContact O-N 3.38Å; L266-L269 WeakPolarHBondContact O-CB 3.38Å; L266-L269 PolarHBondContact O-N 3.1Å; L266-L269 VanDerWaalsContact O-N 3.09Å; L266-I270 HydrophobicContact CD1-CD1 4.21Å; L266-I270 HydrophobicContact CG-CD1 3.75Å; L266-I270 WeakPolarHBondContact O-CD1 3.46Å; L266-I270 VanDerWaalsContact O-CG1 3.22Å; L266-I270 WeakPolarHBondContact O-CG1 3.4Å; L266-I270 PolarHBondContact O-N 2.91Å; L266-Y289 HydrophobicContact CD1-CE1 4.36Å
267	G	57.3	Low	49.6	Very low	1 Å²	1	59.6 Å²	59.6	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-57.6	-40.9	173.4	0	0	0	0	0	113.2	D189 S264 I270 R271	D189-G267 WeakPolarHBondContact OD2-CA 3.33Å; S264-G267 CarbonylContact O-C 3.55Å; S264-G267 WeakPolarHBondContact O-CA 3.29Å; S264-G267 PolarHBondContact O-N 3.37Å; S264-G267 PolarHBondContact OG-N 2.97Å; G267-I270 PolarHBondContact O-N 3.15Å; G267-R271 WeakPolarHBondContact O-CB 3.41Å; G267-R271 PolarHBondContact O-N 3.09Å
268	C	53.1	Low	52	Low	39 Å²	39	52.6 Å²	52.6	26%	0.264	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-46.4	171.9	-66.9	0	0	0	0	111.5	S264 P265 L266 I270 R271 I272	S264-C268 PolarHBondContact O-N 2.91Å; P265-C268 PolarHBondContact O-N 3.26Å; L266-C268 VanDerWaalsContact C-N 3.31Å; L266-C268 PolarHBondContact O-N 3.38Å; C268-I270 PolarHBondContact O-N 3.28Å; C268-R271 PolarHBondContact O-N 2.82Å; C268-I272 WeakPolarHBondContact O-CB 3.4Å; C268-I272 WeakPolarHBondContact O-CD1 3.48Å; C268-I272 WeakPolarHBondContact O-CG1 3.24Å; C268-I272 PolarHBondContact O-N 3.3Å
269	L	57.6	Low	54.5	Low	8 Å²	8	47.1 Å²	47.1	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-46.2	176.5	-96	159.8	0	0	0	113	P265 L266 I272 L273 L297 I300 T301	P265-L269 PolarHBondContact O-N 3.24Å; L266-L269 WeakPolarHBondContact O-CB 3.38Å; L266-L269 PolarHBondContact O-N 3.1Å; L266-L269 VanDerWaalsContact O-N 3.09Å; L269-I272 PolarHBondContact O-N 3.48Å; L269-L273 HydrophobicContact CD2-CD1 4.21Å; L269-L273 HydrophobicContact CD2-CG 4.47Å; L269-L273 VanDerWaalsContact O-CB 3.22Å; L269-L273 WeakPolarHBondContact O-CB 3.45Å; L269-L273 WeakPolarHBondContact O-CG 3.48Å; L269-L273 PolarHBondContact O-N 3.12Å; L269-L297 HydrophobicContact CD1-CB 4.23Å; L269-L297 HydrophobicContact CD1-CD1 2.97Å; L269-L297 HydrophobicContact CD1-CD2 4.3Å; L269-L297 HydrophobicContact CD1-CG 3.23Å; L269-L297 HydrophobicContact CG-CD1 4.45Å; L269-I300 HydrophobicContact CD2-CB 3.96Å; L269-I300 HydrophobicContact CD2-CG2 3.37Å; L269-T301 WeakPolarHBondContact CD1-OG1 3.48Å; L269-T301 WeakPolarHBondContact CD2-OG1 3.45Å; L269-T301 WeakPolarHBondContact CG-OG1 3.32Å
270	I	59.3	Low	57.1	Low	3 Å²	3	39.9 Å²	39.9	2%	0.015	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-45.8	-178.1	-67	152.1	0	0	0	110.2	D189 H192 I193 L266 G267 C268 I272 L273 I274 W286	D189-I270 HydrophobicContact CB-CD1 4.3Å; H192-I270 HydrophobicContact CB-CG2 3.57Å; I193-I270 HydrophobicContact CD1-CD1 3.19Å; I193-I270 HydrophobicContact CD1-CG1 4.32Å; I193-I270 HydrophobicContact CG1-CD1 3.12Å; I193-I270 HydrophobicContact CG1-CG1 3.79Å; I193-I270 HydrophobicContact CG1-CG2 4.44Å; L266-I270 HydrophobicContact CD1-CD1 4.21Å; L266-I270 HydrophobicContact CG-CD1 3.75Å; L266-I270 WeakPolarHBondContact O-CD1 3.46Å; L266-I270 VanDerWaalsContact O-CG1 3.22Å; L266-I270 WeakPolarHBondContact O-CG1 3.4Å; L266-I270 PolarHBondContact O-N 2.91Å; G267-I270 PolarHBondContact O-N 3.15Å; C268-I270 PolarHBondContact O-N 3.28Å; I270-I272 VanDerWaalsContact C-N 3.32Å; I270-I272 PolarHBondContact O-N 3.24Å; I270-L273 PolarHBondContact O-N 3.12Å; I270-I274 HydrophobicContact CG2-CD1 3.71Å; I270-I274 WeakPolarHBondContact O-CB 3.33Å; I270-I274 WeakPolarHBondContact O-CG1 3.21Å; I270-I274 PolarHBondContact O-N 2.91Å; I270-W286 HydrophobicContact CG1-CZ2 4.12Å
271	R	58.5	Low	59.7	Low	91 Å²	91	36.3 Å²	36.3	34%	0.343	21%	0.211	S	C	.	.	H	α-helix	trans	-57.6	-47.7	174.5	-165.3	85.6	72	96.3	21.2	111.1	R188 D189 G267 C268 L273 I274 D275	R188-R271 VanDerWaalsContact NH2-CZ 3.32Å; D189-R271 IonicContact OD1-NE 2.62Å; G267-R271 WeakPolarHBondContact O-CB 3.41Å; G267-R271 PolarHBondContact O-N 3.09Å; C268-R271 PolarHBondContact O-N 2.82Å; R271-L273 VanDerWaalsContact C-N 3.35Å; R271-L273 PolarHBondContact O-N 3.49Å; R271-I274 PolarHBondContact O-N 3.11Å; R271-D275 WeakPolarHBondContact CD-OD2 3.16Å; R271-D275 WeakPolarHBondContact O-CB 3.32Å; R271-D275 PolarHBondContact O-N 3.03Å
272	I	57.7	Low	62.3	Low	20 Å²	20	33.9 Å²	33.9	10%	0.103	19%	0.185	C	C	.	.	H	α-helix	trans	-67	-38.8	-177.3	-63.9	166.4	0	0	0	111.1	C268 L269 I270 T301 A304 Q308	C268-I272 WeakPolarHBondContact O-CB 3.4Å; C268-I272 WeakPolarHBondContact O-CD1 3.48Å; C268-I272 WeakPolarHBondContact O-CG1 3.24Å; C268-I272 PolarHBondContact O-N 3.3Å; L269-I272 PolarHBondContact O-N 3.48Å; I270-I272 VanDerWaalsContact C-N 3.32Å; I270-I272 PolarHBondContact O-N 3.24Å; I272-T301 HydrophobicContact CD1-CG2 3.98Å; I272-A304 HydrophobicContact CB-CB 4.24Å; I272-A304 HydrophobicContact CG2-CB 3.21Å; I272-Q308 HydrophobicContact CG2-CG 3.97Å; I272-Q308 PolarHBondContact O-NE2 2.81Å; I272-Q308 VanDerWaalsContact O-NE2 3.13Å
273	L	61.7	Low	64.7	Low	6 Å²	6	25.9 Å²	25.9	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-71.9	-30.5	-179.7	-71.3	172.6	0	0	0	113	L269 I270 R271 I277 T282 L285 I300 A304	L269-L273 HydrophobicContact CD2-CD1 4.21Å; L269-L273 HydrophobicContact CD2-CG 4.47Å; L269-L273 VanDerWaalsContact O-CB 3.22Å; L269-L273 WeakPolarHBondContact O-CB 3.45Å; L269-L273 WeakPolarHBondContact O-CG 3.48Å; L269-L273 PolarHBondContact O-N 3.12Å; I270-L273 PolarHBondContact O-N 3.12Å; R271-L273 VanDerWaalsContact C-N 3.35Å; R271-L273 PolarHBondContact O-N 3.49Å; L273-I277 HydrophobicContact CD2-CD1 4.2Å; L273-I277 WeakPolarHBondContact O-CB 3.36Å; L273-T282 HydrophobicContact CB-CG2 3.92Å; L273-T282 PolarHBondContact O-OG1 3.17Å; L273-L285 HydrophobicContact CD2-CB 4.09Å; L273-L285 HydrophobicContact CD2-CD1 3.32Å; L273-L285 HydrophobicContact CD2-CG 4.32Å; L273-I300 HydrophobicContact CD2-CG2 4.44Å; L273-A304 HydrophobicContact CD2-CB 4.35Å
274	I	58.6	Low	67.2	Low	38 Å²	38	23.8 Å²	23.8	20%	0.195	13%	0.133	C	C	.	.	H	α-helix	trans	-100.3	-40.9	-172.4	-65.3	171.7	0	0	0	112.1	L153 H192 I270 R271 G276	L153-I274 HydrophobicContact CD2-CG2 4.39Å; H192-I274 HydrophobicContact CB-CD1 3.47Å; H192-I274 VanDerWaalsContact CB-CD1 3.47Å; I270-I274 HydrophobicContact CG2-CD1 3.71Å; I270-I274 WeakPolarHBondContact O-CB 3.33Å; I270-I274 WeakPolarHBondContact O-CG1 3.21Å; I270-I274 PolarHBondContact O-N 2.91Å; R271-I274 PolarHBondContact O-N 3.11Å; I274-G276 VanDerWaalsContact C-N 3.33Å; I274-G276 PolarHBondContact O-N 3.41Å
275	D	57.8	Low	68.9	Low	109 Å²	109	22.5 Å²	22.5	58%	0.583	12%	0.124	S	C	*	.	H	α-helix	trans	-82	-13.2	-174.6	-68.6	-22.2	0	0	0	113.1	R271	R271-D275 WeakPolarHBondContact CD-OD2 3.16Å; R271-D275 WeakPolarHBondContact O-CB 3.32Å; R271-D275 PolarHBondContact O-N 3.03Å
276	G	57.1	Low	70.7	Confident	10 Å²	10	21.4 Å²	21.4	10%	0.103	12%	0.116	C	C	.	.	S	Bend	trans	-136	1	-172.3	0	0	0	0	0	117	I274 R311	I274-G276 VanDerWaalsContact C-N 3.33Å; I274-G276 PolarHBondContact O-N 3.41Å; G276-R311 WeakPolarHBondContact O-CD 3.33Å; G276-R311 PolarHBondContact O-NE 2.82Å; G276-R311 PolarHBondContact O-NH1 3.46Å
277	I	69.1	Low	72.5	Confident	15 Å²	15	21 Å²	21	8%	0.077	11%	0.114	C	C	.	.	S	Bend	trans	-132.4	153.1	-171.9	-62.7	178	0	0	0	110.2	L273 L281 A304 V307	L273-I277 HydrophobicContact CD2-CD1 4.2Å; L273-I277 WeakPolarHBondContact O-CB 3.36Å; I277-L281 HydrophobicContact CG2-CB 3.61Å; I277-L281 HydrophobicContact CG2-CD2 3.57Å; I277-L281 HydrophobicContact CG2-CG 3.67Å; I277-A304 HydrophobicContact CD1-CB 3.63Å; I277-V307 HydrophobicContact CD1-CB 4.4Å; I277-V307 HydrophobicContact CD1-CG1 4.4Å; I277-V307 HydrophobicContact CG1-CG1 4Å
278	S	79.8	Confident	74.2	Confident	51 Å²	51	21 Å²	21	36%	0.357	11%	0.113	S	C	.	.			trans	-66.4	145	175.5	53.4	0	0	0	0	110.7	G280 L281 T282	S278-G280 PolarHBondContact O-N 3.28Å; S278-G280 VanDerWaalsContact O-N 3.17Å; S278-L281 PolarHBondContact O-N 2.94Å; S278-L281 VanDerWaalsContact O-N 3.12Å; S278-T282 PolarHBondContact O-N 3.43Å; S278-T282 PolarHBondContact O-OG1 2.97Å
279	L	83.2	Confident	76	Confident	22 Å²	22	19.5 Å²	19.5	12%	0.115	10%	0.102	C	C	.	.	H	α-helix	trans	-53.5	-38.6	177.2	179.7	59.8	0	0	0	111.8	L49 I51 L196 L199 L281 T282 L283	L49-L279 HydrophobicContact CB-CD2 4.29Å; L49-L279 HydrophobicContact CD1-CB 4.36Å; I51-L279 HydrophobicContact CD1-CB 4.36Å; I51-L279 HydrophobicContact CD1-CD2 3.72Å; I51-L279 HydrophobicContact CG1-CD2 4.22Å; L196-L279 HydrophobicContact CD1-CD1 4.05Å; L199-L279 HydrophobicContact CD1-CD1 4.35Å; L199-L279 HydrophobicContact CD1-CD2 4.3Å; L279-L281 PolarHBondContact O-N 3.17Å; L279-T282 WeakPolarHBondContact O-CB 3.39Å; L279-T282 PolarHBondContact O-N 2.99Å; L279-L283 HydrophobicContact CD1-CD1 4.32Å; L279-L283 HydrophobicContact CD1-CG 4.17Å; L279-L283 HydrophobicContact CG-CD1 4.02Å; L279-L283 HydrophobicContact CG-CG 4.36Å; L279-L283 VanDerWaalsContact O-CG 3.25Å; L279-L283 WeakPolarHBondContact O-CG 3.29Å; L279-L283 PolarHBondContact O-N 3.33Å
280	G	85.8	Confident	77.6	Confident	4 Å²	4	19.3 Å²	19.3	4%	0.041	10%	0.101	C	C	.	.	H	α-helix	trans	-57.7	-49.4	177.1	0	0	0	0	0	113.3	L49 S278 T282 L283 R284 E336	L49-G280 VanDerWaalsContact CD1-N 3.33Å; S278-G280 PolarHBondContact O-N 3.28Å; S278-G280 VanDerWaalsContact O-N 3.17Å; G280-T282 VanDerWaalsContact C-N 3.34Å; G280-T282 PolarHBondContact O-N 3.35Å; G280-L283 PolarHBondContact O-N 3.37Å; G280-R284 WeakPolarHBondContact O-CG 3.4Å; G280-R284 PolarHBondContact O-N 3.41Å; G280-R284 VanDerWaalsContact O-N 3.13Å; G280-E336 VanDerWaalsContact C-OE1 3.29Å; G280-E336 WeakPolarHBondContact CA-OE1 3.46Å
281	L	85.9	Confident	79.1	Confident	6 Å²	6	20.5 Å²	20.5	3%	0.031	11%	0.108	C	C	.	.	H	α-helix	trans	-66.9	-38.4	177.4	178.4	56.4	0	0	0	111.1	I277 S278 L279 L283 R284 L285 E336 V339 L340	I277-L281 HydrophobicContact CG2-CB 3.61Å; I277-L281 HydrophobicContact CG2-CD2 3.57Å; I277-L281 HydrophobicContact CG2-CG 3.67Å; S278-L281 PolarHBondContact O-N 2.94Å; S278-L281 VanDerWaalsContact O-N 3.12Å; L279-L281 PolarHBondContact O-N 3.17Å; L281-L283 PolarHBondContact O-N 3.44Å; L281-R284 PolarHBondContact O-N 2.68Å; L281-L285 HydrophobicContact CD1-CD1 4Å; L281-L285 HydrophobicContact CD1-CD2 4.39Å; L281-L285 HydrophobicContact CD1-CG 3.95Å; L281-L285 HydrophobicContact CG-CD1 3.87Å; L281-L285 HydrophobicContact CG-CG 4.29Å; L281-L285 VanDerWaalsContact O-CG 3.28Å; L281-L285 WeakPolarHBondContact O-CG 3.5Å; L281-L285 PolarHBondContact O-N 3.23Å; L281-E336 HydrophobicContact CB-CG 4.22Å; L281-E336 HydrophobicContact CD1-CB 4.39Å; L281-E336 PolarHBondContact N-OE1 3.35Å; L281-E336 VanDerWaalsContact N-OE1 3.12Å; L281-V339 HydrophobicContact CD1-CB 4.09Å; L281-V339 HydrophobicContact CD1-CG1 3.96Å; L281-V339 HydrophobicContact CD1-CG2 4.49Å; L281-V339 HydrophobicContact CD2-CB 4.44Å; L281-V339 HydrophobicContact CD2-CG1 4.1Å; L281-V339 HydrophobicContact CD2-CG2 4.14Å; L281-L340 HydrophobicContact CD1-CD2 3.52Å
282	T	86.7	Confident	80.6	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.012	10%	0.102	C	C	.	.	H	α-helix	trans	-56	-53.2	174.8	-64.7	0	0	0	0	110.7	L273 S278 L279 G280 R284 L285 W286	L273-T282 HydrophobicContact CB-CG2 3.92Å; L273-T282 PolarHBondContact O-OG1 3.17Å; S278-T282 PolarHBondContact O-N 3.43Å; S278-T282 PolarHBondContact O-OG1 2.97Å; L279-T282 WeakPolarHBondContact O-CB 3.39Å; L279-T282 PolarHBondContact O-N 2.99Å; G280-T282 VanDerWaalsContact C-N 3.34Å; G280-T282 PolarHBondContact O-N 3.35Å; T282-R284 VanDerWaalsContact C-N 3.26Å; T282-R284 PolarHBondContact O-N 3.18Å; T282-L285 PolarHBondContact O-N 3.13Å; T282-L285 VanDerWaalsContact O-N 3.08Å; T282-W286 PolarHBondContact O-N 3.38Å
283	L	89.8	Confident	82	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-56.1	-40.9	178.1	-67.6	167.2	0	0	0	112.8	L49 W111 L196 Y200 L279 G280 L281 W286 D287	L49-L283 HydrophobicContact CD2-CD1 4.29Å; W111-L283 HydrophobicContact CH2-CD2 3.81Å; W111-L283 HydrophobicContact CZ2-CD2 4.29Å; L196-L283 HydrophobicContact CD1-CD2 3.62Å; L196-L283 HydrophobicContact CD1-CG 4.49Å; L196-L283 HydrophobicContact CG-CD2 4.34Å; Y200-L283 HydrophobicContact CD2-CD2 4.28Å; Y200-L283 HydrophobicContact CE2-CD1 4.22Å; Y200-L283 HydrophobicContact CE2-CD2 3.37Å; Y200-L283 HydrophobicContact CE2-CG 4.43Å; Y200-L283 WeakPolarHBondContact OH-CD1 3.45Å; L279-L283 HydrophobicContact CD1-CD1 4.32Å; L279-L283 HydrophobicContact CD1-CG 4.17Å; L279-L283 HydrophobicContact CG-CD1 4.02Å; L279-L283 HydrophobicContact CG-CG 4.36Å; L279-L283 VanDerWaalsContact O-CG 3.25Å; L279-L283 WeakPolarHBondContact O-CG 3.29Å; L279-L283 PolarHBondContact O-N 3.33Å; G280-L283 PolarHBondContact O-N 3.37Å; L281-L283 PolarHBondContact O-N 3.44Å; L283-W286 WeakPolarHBondContact O-CB 3.32Å; L283-W286 PolarHBondContact O-N 3.27Å; L283-D287 PolarHBondContact O-N 3.3Å
284	R	91.1	Very high	83	Confident	7 Å²	7	20.8 Å²	20.8	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-69.5	-34.8	178.1	-71.4	-166.5	65.2	-176.7	2.6	113.9	Y99 K100 G280 L281 T282 W286 D287 V288 E336 D337 L340	Y99-R284 PolarHBondContact O-NH2 2.72Å; K100-R284 PolarHBondContact O-NH2 3.24Å; K100-R284 VanDerWaalsContact O-NH2 3.15Å; G280-R284 WeakPolarHBondContact O-CG 3.4Å; G280-R284 PolarHBondContact O-N 3.41Å; G280-R284 VanDerWaalsContact O-N 3.13Å; L281-R284 PolarHBondContact O-N 2.68Å; T282-R284 VanDerWaalsContact C-N 3.26Å; T282-R284 PolarHBondContact O-N 3.18Å; R284-W286 VanDerWaalsContact C-N 3.33Å; R284-D287 PolarHBondContact O-N 2.55Å; R284-V288 WeakPolarHBondContact O-CG2 3.27Å; R284-V288 PolarHBondContact O-N 3.06Å; R284-E336 VanDerWaalsContact CD-OE2 3.29Å; R284-E336 WeakPolarHBondContact CD-OE2 3.33Å; R284-E336 IonicContact NH1-OE2 2.63Å; R284-D337 IonicContact CZ-OD1 3.51Å; R284-D337 VanDerWaalsContact CZ-OD1 3.3Å; R284-D337 IonicContact NH1-OD1 3.89Å; R284-D337 PolarHBondContact NH1-OD1 3.33Å; R284-D337 IonicContact NH2-OD1 3.44Å; R284-D337 PolarHBondContact NH2-OD1 3.21Å; R284-L340 HydrophobicContact CB-CD2 4.07Å
285	L	89.3	Confident	84.2	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-70	-36.4	174.8	-66.8	171.4	0	0	0	110.3	L273 L281 T282 V288 Y289 I300 L340 L343	L273-L285 HydrophobicContact CD2-CB 4.09Å; L273-L285 HydrophobicContact CD2-CD1 3.32Å; L273-L285 HydrophobicContact CD2-CG 4.32Å; L281-L285 HydrophobicContact CD1-CD1 4Å; L281-L285 HydrophobicContact CD1-CD2 4.39Å; L281-L285 HydrophobicContact CD1-CG 3.95Å; L281-L285 HydrophobicContact CG-CD1 3.87Å; L281-L285 HydrophobicContact CG-CG 4.29Å; L281-L285 VanDerWaalsContact O-CG 3.28Å; L281-L285 WeakPolarHBondContact O-CG 3.5Å; L281-L285 PolarHBondContact O-N 3.23Å; T282-L285 PolarHBondContact O-N 3.13Å; T282-L285 VanDerWaalsContact O-N 3.08Å; L285-V288 PolarHBondContact O-N 2.85Å; L285-Y289 WeakPolarHBondContact O-CB 3.43Å; L285-Y289 PolarHBondContact O-N 3.49Å; L285-I300 HydrophobicContact CB-CG2 4.09Å; L285-I300 HydrophobicContact CD1-CG2 4.2Å; L285-I300 HydrophobicContact CD2-CG1 4.33Å; L285-I300 HydrophobicContact CD2-CG2 4.25Å; L285-I300 HydrophobicContact CG-CG2 4.4Å; L285-L340 HydrophobicContact CD2-CD1 4.14Å; L285-L340 HydrophobicContact CD2-CD2 4.38Å; L285-L343 HydrophobicContact CD2-CD2 3.79Å
286	W	90.1	Very high	85.6	Confident	7 Å²	7	19.6 Å²	19.6	3%	0.027	11%	0.105	C	C	.	.	H	α-helix	trans	-63.8	-43.9	170.7	-83.8	94.6	0	0	0	112.7	W111 I193 L196 F197 L213 I270 T282 L283 R284 V288 Y289 L290	W111-W286 HydrophobicContact CZ2-CB 4.4Å; I193-W286 HydrophobicContact CG1-CH2 4.43Å; I193-W286 HydrophobicContact CG2-CH2 3.86Å; L196-W286 HydrophobicContact CD2-CB 4.36Å; L196-W286 HydrophobicContact CD2-CD2 3.55Å; L196-W286 VanDerWaalsContact CD2-CE2 3.4Å; L196-W286 HydrophobicContact CD2-CE3 4.33Å; L196-W286 HydrophobicContact CD2-CG 3.52Å; L196-W286 HydrophobicContact CD2-CZ2 4.08Å; L196-W286 VanDerWaalsContact CD2-NE1 3.27Å; F197-W286 HydrophobicContact CZ-CZ3 4.18Å; L213-W286 HydrophobicContact CD1-CZ3 4.13Å; L213-W286 HydrophobicContact CD2-CH2 3.71Å; L213-W286 HydrophobicContact CD2-CZ3 3.64Å; I270-W286 HydrophobicContact CG1-CZ2 4.12Å; T282-W286 PolarHBondContact O-N 3.38Å; L283-W286 WeakPolarHBondContact O-CB 3.32Å; L283-W286 PolarHBondContact O-N 3.27Å; R284-W286 VanDerWaalsContact C-N 3.33Å; W286-V288 PolarHBondContact O-N 2.95Å; W286-Y289 HydrophobicContact CE3-CD1 4.19Å; W286-Y289 HydrophobicContact CZ3-CD1 4.2Å; W286-Y289 HydrophobicContact CZ3-CE1 4.48Å; W286-Y289 PolarHBondContact O-N 3.44Å; W286-Y289 VanDerWaalsContact O-N 3.14Å; W286-L290 HydrophobicContact CE3-CG 4.45Å; W286-L290 WeakPolarHBondContact O-CB 2.76Å; W286-L290 WeakPolarHBondContact O-CG 3.42Å; W286-L290 PolarHBondContact O-N 3.23Å
287	D	93.3	Very high	86.7	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-54.9	-41.1	174.7	-67.6	-28.5	0	0	0	111.3	M102 R107 W111 L283 R284 V291	M102-D287 HydrophobicContact CB-CB 4.46Å; M102-D287 WeakPolarHBondContact CB-OD2 3.29Å; M102-D287 HydrophobicContact CE-CB 4.27Å; R107-D287 IonicContact CZ-OD2 3.32Å; R107-D287 IonicContact NE-OD1 2.72Å; R107-D287 PolarHBondContact NE-OD1 3.36Å; R107-D287 IonicContact NE-OD2 3.5Å; R107-D287 PolarHBondContact NE-OD2 3.12Å; R107-D287 IonicContact NH2-OD2 3.86Å; R107-D287 PolarHBondContact NH2-OD2 2.88Å; W111-D287 PolarHBondContact NE1-OD1 2.93Å; L283-D287 PolarHBondContact O-N 3.3Å; R284-D287 PolarHBondContact O-N 2.55Å; D287-V291 VanDerWaalsContact O-CG2 3.28Å; D287-V291 WeakPolarHBondContact O-CG2 3.31Å
288	V	92.9	Very high	87.1	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-72.8	-43.5	176.8	175	0	0	0	0	111.5	Y99 R284 L285 W286 L290 V291 E292 A296 L340 L343	Y99-V288 HydrophobicContact CD1-CG2 4.05Å; Y99-V288 HydrophobicContact CE1-CG1 3.87Å; Y99-V288 HydrophobicContact CE1-CG2 4.15Å; Y99-V288 HydrophobicContact CE2-CG1 4.21Å; Y99-V288 HydrophobicContact CG-CG2 4.32Å; R284-V288 WeakPolarHBondContact O-CG2 3.27Å; R284-V288 PolarHBondContact O-N 3.06Å; L285-V288 PolarHBondContact O-N 2.85Å; W286-V288 PolarHBondContact O-N 2.95Å; V288-L290 PolarHBondContact O-N 3.17Å; V288-V291 PolarHBondContact O-N 2.78Å; V288-E292 HydrophobicContact CG1-CG 3.93Å; V288-E292 WeakPolarHBondContact O-CB 3.41Å; V288-E292 PolarHBondContact O-N 2.82Å; V288-A296 HydrophobicContact CG1-CB 4.48Å; V288-L340 HydrophobicContact CG2-CD1 3.72Å; V288-L343 HydrophobicContact CB-CD2 4.38Å; V288-L343 HydrophobicContact CG1-CD2 3.93Å
289	Y	90.6	Very high	87.4	Confident	9 Å²	9	20.7 Å²	20.7	4%	0.035	10%	0.103	C	C	.	.	H	α-helix	trans	-61.1	-44.2	-179.8	178.4	-118.8	0	0	0	112.3	L213 H219 L266 L285 W286 V291 G293 L297	L213-Y289 HydrophobicContact CD1-CD1 4.5Å; L213-Y289 HydrophobicContact CD1-CE1 3.87Å; H219-Y289 PolarHBondContact O-OH 3.1Å; L266-Y289 HydrophobicContact CD1-CE1 4.36Å; L285-Y289 WeakPolarHBondContact O-CB 3.43Å; L285-Y289 PolarHBondContact O-N 3.49Å; W286-Y289 HydrophobicContact CE3-CD1 4.19Å; W286-Y289 HydrophobicContact CZ3-CD1 4.2Å; W286-Y289 HydrophobicContact CZ3-CE1 4.48Å; W286-Y289 PolarHBondContact O-N 3.44Å; W286-Y289 VanDerWaalsContact O-N 3.14Å; Y289-V291 PolarHBondContact O-N 3.15Å; Y289-G293 WeakPolarHBondContact CD2-O 3.48Å; Y289-G293 VanDerWaalsContact O-CA 3.31Å; Y289-G293 WeakPolarHBondContact O-CA 3.44Å; Y289-G293 PolarHBondContact O-N 2.63Å; Y289-L297 HydrophobicContact CD2-CD1 4.17Å; Y289-L297 HydrophobicContact CE2-CB 4.22Å; Y289-L297 HydrophobicContact CE2-CD1 3.4Å; Y289-L297 HydrophobicContact CE2-CG 4.45Å
290	L	91.3	Very high	87.5	Confident	4 Å²	4	19.8 Å²	19.8	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-64.2	-29.2	179	-68	174.7	0	0	0	112.4	W111 L114 L115 L213 H219 W286 V288	W111-L290 HydrophobicContact CB-CD1 4.28Å; W111-L290 HydrophobicContact CD2-CD1 3.84Å; W111-L290 HydrophobicContact CG-CD1 3.63Å; L114-L290 HydrophobicContact CD1-CB 3.95Å; L115-L290 HydrophobicContact CD1-CD2 4.04Å; L115-L290 HydrophobicContact CD2-CD2 3.81Å; L115-L290 HydrophobicContact CG-CD2 4.08Å; L213-L290 HydrophobicContact CD1-CD2 3.81Å; H219-L290 PolarHBondContact NE2-O 2.97Å; W286-L290 HydrophobicContact CE3-CG 4.45Å; W286-L290 WeakPolarHBondContact O-CB 2.76Å; W286-L290 WeakPolarHBondContact O-CG 3.42Å; W286-L290 PolarHBondContact O-N 3.23Å; V288-L290 PolarHBondContact O-N 3.17Å
291	V	91.8	Very high	87	Confident	27 Å²	27	20 Å²	20	16%	0.164	10%	0.099	C	C	.	.	H	α-helix	trans	-86.7	-43.1	179.8	172.4	0	0	0	0	113	L94 I95 A98 L114 D287 V288 Y289	L94-V291 HydrophobicContact CD2-CG1 4.22Å; L94-V291 HydrophobicContact CG-CG1 4Å; L94-V291 HydrophobicContact CG-CG2 4.38Å; I95-V291 HydrophobicContact CB-CG1 4.45Å; I95-V291 HydrophobicContact CG1-CG1 3.88Å; A98-V291 HydrophobicContact CB-CB 4.21Å; A98-V291 HydrophobicContact CB-CG1 4.3Å; A98-V291 HydrophobicContact CB-CG2 3.96Å; L114-V291 HydrophobicContact CD1-CG2 3.77Å; L114-V291 HydrophobicContact CD2-CG2 3.98Å; D287-V291 VanDerWaalsContact O-CG2 3.28Å; D287-V291 WeakPolarHBondContact O-CG2 3.31Å; V288-V291 PolarHBondContact O-N 2.78Å; Y289-V291 PolarHBondContact O-N 3.15Å
292	E	89.5	Confident	86.6	Confident	45 Å²	45	26.1 Å²	26.1	21%	0.21	12%	0.122	C	C	.	.	H	α-helix	trans	-90.2	-21.7	-175.4	-66.1	-95.7	-140.7	0	0	113.1	I95 Y99 V288 A296 M347	I95-E292 HydrophobicContact CG2-CG 4.47Å; I95-E292 WeakPolarHBondContact CG2-OE1 3.02Å; Y99-E292 HydrophobicContact CE2-CG 4.39Å; Y99-E292 WeakPolarHBondContact CE2-OE1 3.47Å; Y99-E292 PolarHBondContact OH-OE1 3.16Å; V288-E292 HydrophobicContact CG1-CG 3.93Å; V288-E292 WeakPolarHBondContact O-CB 3.41Å; V288-E292 PolarHBondContact O-N 2.82Å; E292-A296 HydrophobicContact CB-CB 3.77Å; E292-M347 HydrophobicContact CB-CE 4.14Å; E292-M347 HydrophobicContact CG-CE 4.24Å
293	G	85.9	Confident	86.2	Confident	5 Å²	5	26.6 Å²	26.6	5%	0.052	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	74.6	-155.4	-178.8	0	0	0	0	0	114.2	R218 Y289 Q295 A296	R218-G293 VanDerWaalsContact O-CA 3.24Å; R218-G293 WeakPolarHBondContact O-CA 3.26Å; Y289-G293 WeakPolarHBondContact CD2-O 3.48Å; Y289-G293 VanDerWaalsContact O-CA 3.31Å; Y289-G293 WeakPolarHBondContact O-CA 3.44Å; Y289-G293 PolarHBondContact O-N 2.63Å; G293-Q295 PolarHBondContact O-N 3.44Å; G293-Q295 VanDerWaalsContact O-N 3.08Å; G293-A296 PolarHBondContact O-N 3.32Å
294	E	83.1	Confident	85.5	Confident	74 Å²	74	26.6 Å²	26.6	35%	0.346	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-52.3	-33	-174.9	-168.3	-172.9	-169.3	0	0	113.7	R218 L221 A296 L297	R218-E294 PolarHBondContact O-N 2.98Å; L221-E294 HydrophobicContact CD2-CG 4.07Å; L221-E294 WeakPolarHBondContact CD2-OE1 3.39Å; E294-A296 PolarHBondContact O-N 2.98Å; E294-A296 VanDerWaalsContact O-N 3.15Å; E294-L297 WeakPolarHBondContact O-CB 3.33Å; E294-L297 PolarHBondContact O-N 3.5Å
295	Q	84.3	Confident	84.5	Confident	122 Å²	122	31 Å²	31	57%	0.57	14%	0.144	S	C	*	.	G	3₁₀ helix	trans	-61.2	-27.6	-179.7	-65.7	-179.5	63.1	0	0	113.4	G293 L297 P299 M347	G293-Q295 PolarHBondContact O-N 3.44Å; G293-Q295 VanDerWaalsContact O-N 3.08Å; Q295-L297 VanDerWaalsContact C-N 3.33Å; Q295-P299 VanDerWaalsContact O-CD 3.28Å; Q295-P299 WeakPolarHBondContact O-CD 3.06Å; Q295-M347 HydrophobicContact CB-CE 4.25Å
296	A	86.2	Confident	83.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-79.8	-17.9	177.1	0	0	0	0	0	112.9	V288 E292 G293 E294 M298 P299 I300 M347	V288-A296 HydrophobicContact CG1-CB 4.48Å; E292-A296 HydrophobicContact CB-CB 3.77Å; G293-A296 PolarHBondContact O-N 3.32Å; E294-A296 PolarHBondContact O-N 2.98Å; E294-A296 VanDerWaalsContact O-N 3.15Å; A296-M298 PolarHBondContact O-N 2.98Å; A296-P299 WeakPolarHBondContact O-CD 3.27Å; A296-I300 HydrophobicContact CB-CD1 3.81Å; A296-I300 HydrophobicContact CB-CG1 4.4Å; A296-I300 WeakPolarHBondContact O-CB 3.38Å; A296-I300 WeakPolarHBondContact O-CD1 3.15Å; A296-I300 WeakPolarHBondContact O-CG1 3.47Å; A296-I300 PolarHBondContact O-N 3.37Å; A296-M347 HydrophobicContact CB-CE 3.99Å; A296-M347 HydrophobicContact CB-SD 4.24Å
297	L	81.3	Confident	82.9	Confident	7 Å²	7	36.1 Å²	36.1	4%	0.037	17%	0.167	C	C	.	.	H	α-helix	trans	-57.1	-54	-172.5	-163	85.2	0	0	0	112.2	L221 P265 L269 Y289 E294 Q295 I300 T301	L221-L297 HydrophobicContact CD1-CD2 3.69Å; L221-L297 HydrophobicContact CD2-CD2 3.22Å; L221-L297 HydrophobicContact CG-CD2 3.76Å; P265-L297 HydrophobicContact CB-CD2 3.87Å; L269-L297 HydrophobicContact CD1-CB 4.23Å; L269-L297 HydrophobicContact CD1-CD1 2.97Å; L269-L297 HydrophobicContact CD1-CD2 4.3Å; L269-L297 HydrophobicContact CD1-CG 3.23Å; L269-L297 HydrophobicContact CG-CD1 4.45Å; Y289-L297 HydrophobicContact CD2-CD1 4.17Å; Y289-L297 HydrophobicContact CE2-CB 4.22Å; Y289-L297 HydrophobicContact CE2-CD1 3.4Å; Y289-L297 HydrophobicContact CE2-CG 4.45Å; E294-L297 WeakPolarHBondContact O-CB 3.33Å; E294-L297 PolarHBondContact O-N 3.5Å; Q295-L297 VanDerWaalsContact C-N 3.33Å; L297-I300 PolarHBondContact O-N 3.24Å; L297-T301 WeakPolarHBondContact O-CB 3.33Å; L297-T301 PolarHBondContact O-N 3.4Å; L297-T301 PolarHBondContact O-OG1 2.96Å
298	M	78.3	Confident	81.6	Confident	81 Å²	81	38 Å²	38	40%	0.399	18%	0.176	S	C	.	.	H	α-helix	trans	-66.8	-46.4	-177.6	-175.9	57.8	62.8	0	0	112.5	A296 I300 T301 R302	A296-M298 PolarHBondContact O-N 2.98Å; M298-I300 PolarHBondContact O-N 3.34Å; M298-T301 PolarHBondContact O-N 3.26Å; M298-R302 WeakPolarHBondContact O-CB 3.46Å; M298-R302 PolarHBondContact O-N 3.36Å
299	P	85.5	Confident	80.3	Confident	10 Å²	10	41 Å²	41	7%	0.065	19%	0.19	C	C	.	.	H	α-helix	trans	-58.6	-41.4	172.5	-30.3	40.2	0	0	0	114.3	Q295 A296 R302 I303 L343 M347 L350	Q295-P299 VanDerWaalsContact O-CD 3.28Å; Q295-P299 WeakPolarHBondContact O-CD 3.06Å; A296-P299 WeakPolarHBondContact O-CD 3.27Å; P299-R302 PolarHBondContact O-N 3.2Å; P299-I303 WeakPolarHBondContact O-CG1 3.33Å; P299-I303 PolarHBondContact O-N 2.99Å; P299-L343 HydrophobicContact CB-CD1 3.58Å; P299-M347 HydrophobicContact CB-CG 4.47Å; P299-M347 HydrophobicContact CB-SD 4.1Å; P299-M347 HydrophobicContact CG-SD 3.69Å; P299-L350 HydrophobicContact CG-CD2 4.39Å
300	I	84.1	Confident	78.9	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.015	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-48.5	175.8	-67.3	168.3	0	0	0	109.5	L269 L273 L285 A296 L297 M298 R302 I303 A304 L343	L269-I300 HydrophobicContact CD2-CB 3.96Å; L269-I300 HydrophobicContact CD2-CG2 3.37Å; L273-I300 HydrophobicContact CD2-CG2 4.44Å; L285-I300 HydrophobicContact CB-CG2 4.09Å; L285-I300 HydrophobicContact CD1-CG2 4.2Å; L285-I300 HydrophobicContact CD2-CG1 4.33Å; L285-I300 HydrophobicContact CD2-CG2 4.25Å; L285-I300 HydrophobicContact CG-CG2 4.4Å; A296-I300 HydrophobicContact CB-CD1 3.81Å; A296-I300 HydrophobicContact CB-CG1 4.4Å; A296-I300 WeakPolarHBondContact O-CB 3.38Å; A296-I300 WeakPolarHBondContact O-CD1 3.15Å; A296-I300 WeakPolarHBondContact O-CG1 3.47Å; A296-I300 PolarHBondContact O-N 3.37Å; L297-I300 PolarHBondContact O-N 3.24Å; M298-I300 PolarHBondContact O-N 3.34Å; I300-R302 VanDerWaalsContact C-N 3.29Å; I300-R302 PolarHBondContact O-N 3.4Å; I300-I303 PolarHBondContact O-N 3.12Å; I300-I303 VanDerWaalsContact O-N 3.11Å; I300-A304 WeakPolarHBondContact O-CB 3.39Å; I300-A304 PolarHBondContact O-N 2.96Å; I300-L343 HydrophobicContact CD1-CD2 4.49Å; I300-L343 HydrophobicContact CG1-CD1 3.81Å; I300-L343 HydrophobicContact CG1-CD2 3.82Å; I300-L343 HydrophobicContact CG1-CG 4.5Å
301	T	75.5	Confident	77.3	Confident	10 Å²	10	48.7 Å²	48.7	6%	0.061	22%	0.221	C	C	.	.	H	α-helix	trans	-56	-46.4	179.5	-53.2	0	0	0	0	110.7	L269 I272 L297 M298 I303 A304 F305	L269-T301 WeakPolarHBondContact CD1-OG1 3.48Å; L269-T301 WeakPolarHBondContact CD2-OG1 3.45Å; L269-T301 WeakPolarHBondContact CG-OG1 3.32Å; I272-T301 HydrophobicContact CD1-CG2 3.98Å; L297-T301 WeakPolarHBondContact O-CB 3.33Å; L297-T301 PolarHBondContact O-N 3.4Å; L297-T301 PolarHBondContact O-OG1 2.96Å; M298-T301 PolarHBondContact O-N 3.26Å; T301-I303 PolarHBondContact O-N 3.27Å; T301-A304 PolarHBondContact O-N 2.72Å; T301-F305 WeakPolarHBondContact O-CB 3.39Å; T301-F305 PolarHBondContact O-N 3.07Å
302	R	77.2	Confident	75.6	Confident	133 Å²	133	52.8 Å²	52.8	50%	0.502	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-40	179.4	-171.9	175.5	-170.1	167.5	4.4	112.7	M298 P299 I300 K306	M298-R302 WeakPolarHBondContact O-CB 3.46Å; M298-R302 PolarHBondContact O-N 3.36Å; P299-R302 PolarHBondContact O-N 3.2Å; I300-R302 VanDerWaalsContact C-N 3.29Å; I300-R302 PolarHBondContact O-N 3.4Å; R302-K306 WeakPolarHBondContact O-CB 3.45Å; R302-K306 VanDerWaalsContact O-CG 3.29Å; R302-K306 WeakPolarHBondContact O-CG 3.44Å; R302-K306 PolarHBondContact O-N 2.85Å
303	I	79.7	Confident	74	Confident	13 Å²	13	53.4 Å²	53.4	7%	0.067	25%	0.248	C	C	.	.	H	α-helix	trans	-67.3	-45.9	176.6	-76.2	175.9	0	0	0	110.1	P299 I300 T301 F305 K306 V307 W332 V339 L343	P299-I303 WeakPolarHBondContact O-CG1 3.33Å; P299-I303 PolarHBondContact O-N 2.99Å; I300-I303 PolarHBondContact O-N 3.12Å; I300-I303 VanDerWaalsContact O-N 3.11Å; T301-I303 PolarHBondContact O-N 3.27Å; I303-F305 VanDerWaalsContact C-N 3.35Å; I303-F305 PolarHBondContact O-N 3.15Å; I303-K306 WeakPolarHBondContact O-CB 3.36Å; I303-K306 PolarHBondContact O-N 2.95Å; I303-K306 VanDerWaalsContact O-N 3.14Å; I303-V307 WeakPolarHBondContact O-CG2 3.46Å; I303-V307 PolarHBondContact O-N 2.88Å; I303-W332 HydrophobicContact CG2-CZ3 4.46Å; I303-V339 HydrophobicContact CG2-CG1 3.44Å; I303-V339 VanDerWaalsContact CG2-CG1 3.44Å; I303-L343 HydrophobicContact CD1-CB 3.46Å; I303-L343 VanDerWaalsContact CD1-CB 3.46Å; I303-L343 HydrophobicContact CD1-CD1 3.72Å; I303-L343 HydrophobicContact CD1-CG 4.16Å
304	A	73.8	Confident	72.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-42.3	-177.6	0	0	0	0	0	110.5	I272 L273 I277 I300 T301 K306 V307 Q308	I272-A304 HydrophobicContact CB-CB 4.24Å; I272-A304 HydrophobicContact CG2-CB 3.21Å; L273-A304 HydrophobicContact CD2-CB 4.35Å; I277-A304 HydrophobicContact CD1-CB 3.63Å; I300-A304 WeakPolarHBondContact O-CB 3.39Å; I300-A304 PolarHBondContact O-N 2.96Å; T301-A304 PolarHBondContact O-N 2.72Å; A304-K306 PolarHBondContact O-N 3.32Å; A304-V307 WeakPolarHBondContact O-CB 3.13Å; A304-V307 PolarHBondContact O-N 3.45Å; A304-Q308 PolarHBondContact O-N 3Å
305	F	70.2	Confident	70.6	Confident	99 Å²	99	59.7 Å²	59.7	43%	0.434	28%	0.284	S	S	.	.	H	α-helix	trans	-60.4	-44.2	170.8	-174.5	-95	0	0	0	112.5	T301 I303 V307 Q308 Q309	T301-F305 WeakPolarHBondContact O-CB 3.39Å; T301-F305 PolarHBondContact O-N 3.07Å; I303-F305 VanDerWaalsContact C-N 3.35Å; I303-F305 PolarHBondContact O-N 3.15Å; F305-V307 VanDerWaalsContact C-N 3.27Å; F305-V307 PolarHBondContact O-N 3.28Å; F305-Q308 PolarHBondContact O-N 2.9Å; F305-Q309 HydrophobicContact CE1-CB 4.32Å; F305-Q309 WeakPolarHBondContact O-CB 3.49Å; F305-Q309 PolarHBondContact O-N 3.16Å
306	K	75.5	Confident	68.6	Low	101 Å²	101	57.4 Å²	57.4	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-61.5	-34.4	175.4	-79.8	176.8	176.3	-176.4	0	112.8	R302 I303 A304 K310	R302-K306 WeakPolarHBondContact O-CB 3.45Å; R302-K306 VanDerWaalsContact O-CG 3.29Å; R302-K306 WeakPolarHBondContact O-CG 3.44Å; R302-K306 PolarHBondContact O-N 2.85Å; I303-K306 WeakPolarHBondContact O-CB 3.36Å; I303-K306 PolarHBondContact O-N 2.95Å; I303-K306 VanDerWaalsContact O-N 3.14Å; A304-K306 PolarHBondContact O-N 3.32Å; K306-K310 WeakPolarHBondContact O-CB 3.32Å; K306-K310 WeakPolarHBondContact O-CD 3.33Å; K306-K310 VanDerWaalsContact O-CG 3.23Å; K306-K310 WeakPolarHBondContact O-CG 3.43Å
307	V	70.2	Confident	66.3	Low	15 Å²	15	68.2 Å²	68.2	9%	0.091	32%	0.322	C	S	.	.	H	α-helix	trans	-69	-44.6	175.2	172.9	0	0	0	0	109.9	I277 I303 A304 F305 R311 W332	I277-V307 HydrophobicContact CD1-CB 4.4Å; I277-V307 HydrophobicContact CD1-CG1 4.4Å; I277-V307 HydrophobicContact CG1-CG1 4Å; I303-V307 WeakPolarHBondContact O-CG2 3.46Å; I303-V307 PolarHBondContact O-N 2.88Å; A304-V307 WeakPolarHBondContact O-CB 3.13Å; A304-V307 PolarHBondContact O-N 3.45Å; F305-V307 VanDerWaalsContact C-N 3.27Å; F305-V307 PolarHBondContact O-N 3.28Å; V307-R311 PolarHBondContact O-N 3.19Å; V307-W332 HydrophobicContact CG2-CE3 4.27Å
308	Q	66.3	Low	64.1	Low	39 Å²	39	74.6 Å²	74.6	18%	0.182	37%	0.366	C	S	.	.	H	α-helix	trans	-67.6	-48.9	179.2	-72.9	-165.9	-32.6	0	0	113.8	I272 A304 F305 K310 R311 L312	I272-Q308 HydrophobicContact CG2-CG 3.97Å; I272-Q308 PolarHBondContact O-NE2 2.81Å; I272-Q308 VanDerWaalsContact O-NE2 3.13Å; A304-Q308 PolarHBondContact O-N 3Å; F305-Q308 PolarHBondContact O-N 2.9Å; Q308-K310 PolarHBondContact O-N 3.18Å; Q308-K310 VanDerWaalsContact O-N 3.14Å; Q308-R311 WeakPolarHBondContact O-CA 3.27Å; Q308-R311 WeakPolarHBondContact O-CB 3.25Å; Q308-R311 PolarHBondContact O-N 3.3Å; Q308-L312 PolarHBondContact O-N 3.25Å
309	Q	66.5	Low	62.8	Low	63 Å²	63	72.3 Å²	72.3	29%	0.294	36%	0.363	S	S	.	.	H	α-helix	trans	-55.8	-35.7	179.6	-168.9	-174.5	13.2	0	0	111.6	F305 T313	F305-Q309 HydrophobicContact CE1-CB 4.32Å; F305-Q309 WeakPolarHBondContact O-CB 3.49Å; F305-Q309 PolarHBondContact O-N 3.16Å; Q309-T313 WeakPolarHBondContact O-CG2 3.48Å; Q309-T313 PolarHBondContact O-N 3.12Å; Q309-T313 VanDerWaalsContact O-N 3.09Å; Q309-T313 PolarHBondContact O-OG1 3.31Å
310	K	61	Low	60.9	Low	80 Å²	80	76.5 Å²	76.5	35%	0.348	39%	0.39	S	S	.	.	H	α-helix	trans	-75.4	-23.2	177.2	-70.9	-178.1	179.5	-171.1	0	113.9	K306 Q308 T313 V329	K306-K310 WeakPolarHBondContact O-CB 3.32Å; K306-K310 WeakPolarHBondContact O-CD 3.33Å; K306-K310 VanDerWaalsContact O-CG 3.23Å; K306-K310 WeakPolarHBondContact O-CG 3.43Å; Q308-K310 PolarHBondContact O-N 3.18Å; Q308-K310 VanDerWaalsContact O-N 3.14Å; K310-T313 WeakPolarHBondContact CA-OG1 3.16Å; K310-T313 PolarHBondContact O-OG1 3.35Å; K310-V329 HydrophobicContact CB-CG2 4.01Å; K310-V329 WeakPolarHBondContact O-CG2 3.39Å
311	R	58.2	Low	58.6	Low	96 Å²	96	84.9 Å²	84.9	36%	0.362	42%	0.421	S	S	.	.	H	α-helix	trans	-77.1	-41	170	-71.2	-177	179	-158.5	2.1	111.3	G276 V307 Q308 K314	G276-R311 WeakPolarHBondContact O-CD 3.33Å; G276-R311 PolarHBondContact O-NE 2.82Å; G276-R311 PolarHBondContact O-NH1 3.46Å; V307-R311 PolarHBondContact O-N 3.19Å; Q308-R311 WeakPolarHBondContact O-CA 3.27Å; Q308-R311 WeakPolarHBondContact O-CB 3.25Å; Q308-R311 PolarHBondContact O-N 3.3Å; R311-K314 WeakPolarHBondContact O-CB 3.41Å; R311-K314 PolarHBondContact O-N 2.73Å; R311-K314 VanDerWaalsContact O-N 3.11Å
312	L	55.8	Low	56.8	Low	113 Å²	113	85.6 Å²	85.6	59%	0.592	43%	0.428	S	S	*	.	H	α-helix	trans	-66.2	-40.4	178.7	-69	172.7	0	0	0	112.5	Q308 K314 T315	Q308-L312 PolarHBondContact O-N 3.25Å; L312-K314 PolarHBondContact O-N 3.27Å; L312-K314 VanDerWaalsContact O-N 3.13Å; L312-T315 PolarHBondContact O-N 3.01Å; L312-T315 VanDerWaalsContact O-N 3.11Å
313	T	54.9	Low	55	Low	58 Å²	58	88 Å²	88	36%	0.356	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.4	173.7	46.5	0	0	0	0	113.7	Q309 K310	Q309-T313 WeakPolarHBondContact O-CG2 3.48Å; Q309-T313 PolarHBondContact O-N 3.12Å; Q309-T313 VanDerWaalsContact O-N 3.09Å; Q309-T313 PolarHBondContact O-OG1 3.31Å; K310-T313 WeakPolarHBondContact CA-OG1 3.16Å; K310-T313 PolarHBondContact O-OG1 3.35Å
314	K	48.4	Very low	52.9	Low	82 Å²	82	92.4 Å²	92.4	36%	0.357	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-23.9	175.3	-131.2	178.1	-176.7	-175.5	0	112.2	R311 L312 N326 V329	R311-K314 WeakPolarHBondContact O-CB 3.41Å; R311-K314 PolarHBondContact O-N 2.73Å; R311-K314 VanDerWaalsContact O-N 3.11Å; L312-K314 PolarHBondContact O-N 3.27Å; L312-K314 VanDerWaalsContact O-N 3.13Å; K314-N326 WeakPolarHBondContact CE-OD1 3.41Å; K314-N326 WeakPolarHBondContact CG-OD1 3.44Å; K314-V329 HydrophobicContact CD-CB 4.32Å; K314-V329 HydrophobicContact CD-CG1 4.06Å; K314-V329 HydrophobicContact CD-CG2 4.23Å
315	T	49.8	Very low	50.9	Low	129 Å²	129	93.2 Å²	93.2	79%	0.791	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-22.3	-177.1	-48.8	0	0	0	0	112.6	L312	L312-T315 PolarHBondContact O-N 3.01Å; L312-T315 VanDerWaalsContact O-N 3.11Å
316	S	42.2	Very low	49.3	Very low	73 Å²	73	91.2 Å²	91.2	51%	0.51	46%	0.456	S	S	.	.	S	Bend	trans	-103.4	114.2	177.4	68.7	0	0	0	0	112.2
317	R	37.7	Very low	47.2	Very low	227 Å²	227	95.7 Å²	95.7	86%	0.857	47%	0.47	S	S	*	.			trans	89.3	107.2	164.8	-53.9	176.8	86.5	170	5.3	116.9	G319	R317-G319 PolarHBondContact O-N 3.05Å
318	C	35.6	Very low	45.4	Very low	142 Å²	142	99.2 Å²	99.2	96%	0.959	48%	0.484	S	S	*	.			trans	-59	121.3	164.5	-166.3	0	0	0	0	110.5
319	G	50.6	Low	44	Very low	32 Å²	32	97.9 Å²	97.9	33%	0.33	48%	0.479	S	S	.	.	S	Bend	trans	172.1	169	176.1	0	0	0	0	0	112.8	R317 W321 A322	R317-G319 PolarHBondContact O-N 3.05Å; G319-W321 PolarHBondContact O-N 3.34Å; G319-A322 VanDerWaalsContact O-CB 3.31Å; G319-A322 WeakPolarHBondContact O-CB 3.47Å; G319-A322 PolarHBondContact O-N 2.83Å
320	P	46.7	Very low	42.9	Very low	99 Å²	99	98.9 Å²	98.9	64%	0.643	49%	0.486	S	S	*	.	H	α-helix	trans	-53.5	-26.6	177.5	-25.5	33.8	0	0	0	114	A322 R323 F324	P320-A322 VanDerWaalsContact C-N 3.34Å; P320-A322 PolarHBondContact O-N 2.76Å; P320-R323 WeakPolarHBondContact O-CB 3.45Å; P320-R323 PolarHBondContact O-N 3.24Å; P320-F324 PolarHBondContact O-N 3.05Å
321	W	34.6	Very low	41.9	Very low	178 Å²	178	98.3 Å²	98.3	67%	0.674	49%	0.489	S	S	*	.	H	α-helix	trans	-63	-35.3	173.9	-167.3	-112.1	0	0	0	113.2	G319 R323 F324 C325	G319-W321 PolarHBondContact O-N 3.34Å; W321-R323 VanDerWaalsContact C-N 3.29Å; W321-R323 PolarHBondContact O-N 3.04Å; W321-F324 HydrophobicContact CE3-CB 4.48Å; W321-F324 HydrophobicContact CE3-CD1 4.29Å; W321-F324 HydrophobicContact CH2-CD1 4.09Å; W321-F324 HydrophobicContact CH2-CE1 4.2Å; W321-F324 AromaticContact CZ3-CD1 3.92Å; W321-F324 HydrophobicContact CZ3-CD1 3.92Å; W321-F324 HydrophobicContact CZ3-CE1 4.27Å; W321-F324 HydrophobicContact CZ3-CG 4.5Å; W321-F324 PolarHBondContact O-N 2.93Å; W321-F324 VanDerWaalsContact O-N 3.16Å; W321-C325 WeakPolarHBondContact O-CB 3.46Å; W321-C325 PolarHBondContact O-N 3.28Å; W321-C325 PolarHBondContact O-SG 2.92Å
322	A	38.4	Very low	41.4	Very low	25 Å²	25	95.9 Å²	95.9	21%	0.207	48%	0.48	C	S	.	.	H	α-helix	trans	-62.1	-37.2	173.6	0	0	0	0	0	111.3	G319 P320 C325 N326	G319-A322 VanDerWaalsContact O-CB 3.31Å; G319-A322 WeakPolarHBondContact O-CB 3.47Å; G319-A322 PolarHBondContact O-N 2.83Å; P320-A322 VanDerWaalsContact C-N 3.34Å; P320-A322 PolarHBondContact O-N 2.76Å; A322-C325 PolarHBondContact O-N 2.96Å; A322-N326 VanDerWaalsContact O-CB 3.29Å; A322-N326 WeakPolarHBondContact O-CB 3.26Å; A322-N326 PolarHBondContact O-N 3.2Å; A322-N326 PolarHBondContact O-ND2 2.74Å; A322-N326 PolarHBondContact O-OD1 3.26Å
323	R	39.5	Very low	41	Very low	185 Å²	185	93.2 Å²	93.2	70%	0.698	48%	0.475	S	S	*	.	H	α-helix	trans	-66.4	-37.8	174.2	-71.2	-171.1	-74.9	-152.1	-2.9	112.5	P320 W321 N326 R327	P320-R323 WeakPolarHBondContact O-CB 3.45Å; P320-R323 PolarHBondContact O-N 3.24Å; W321-R323 VanDerWaalsContact C-N 3.29Å; W321-R323 PolarHBondContact O-N 3.04Å; R323-N326 PolarHBondContact O-N 3Å; R323-R327 PolarHBondContact O-N 3.1Å
324	F	34.8	Very low	41	Very low	104 Å²	104	99.7 Å²	99.7	46%	0.456	49%	0.492	S	S	.	.	H	α-helix	trans	-67.6	-46.9	175	-173.5	-98.9	0	0	0	111.6	P320 W321 N326 R327 F328	P320-F324 PolarHBondContact O-N 3.05Å; W321-F324 HydrophobicContact CE3-CB 4.48Å; W321-F324 HydrophobicContact CE3-CD1 4.29Å; W321-F324 HydrophobicContact CH2-CD1 4.09Å; W321-F324 HydrophobicContact CH2-CE1 4.2Å; W321-F324 AromaticContact CZ3-CD1 3.92Å; W321-F324 HydrophobicContact CZ3-CD1 3.92Å; W321-F324 HydrophobicContact CZ3-CE1 4.27Å; W321-F324 HydrophobicContact CZ3-CG 4.5Å; W321-F324 PolarHBondContact O-N 2.93Å; W321-F324 VanDerWaalsContact O-N 3.16Å; F324-N326 VanDerWaalsContact C-N 3.29Å; F324-N326 PolarHBondContact O-N 3.27Å; F324-R327 PolarHBondContact O-N 3.27Å; F324-F328 HydrophobicContact CD1-CD2 4.17Å; F324-F328 HydrophobicContact CD1-CE2 4.29Å; F324-F328 HydrophobicContact CD2-CE2 4.35Å; F324-F328 AromaticContact CE1-CD2 3.85Å; F324-F328 HydrophobicContact CE1-CD2 3.85Å; F324-F328 AromaticContact CE1-CE2 3.62Å; F324-F328 HydrophobicContact CE1-CE2 3.62Å; F324-F328 HydrophobicContact CE2-CD2 4.4Å; F324-F328 AromaticContact CE2-CE2 3.7Å; F324-F328 HydrophobicContact CE2-CE2 3.7Å; F324-F328 AromaticContact CZ-CD2 3.99Å; F324-F328 HydrophobicContact CZ-CD2 3.99Å; F324-F328 AromaticContact CZ-CE2 3.3Å; F324-F328 HydrophobicContact CZ-CE2 3.3Å; F324-F328 HydrophobicContact CZ-CZ 4.14Å; F324-F328 WeakPolarHBondContact O-CD2 3.32Å; F324-F328 PolarHBondContact O-N 3.3Å
325	C	31.4	Very low	42.2	Very low	17 Å²	17	97.4 Å²	97.4	12%	0.115	48%	0.484	C	S	.	.	H	α-helix	trans	-60.2	-38.4	173.7	-71.4	0	0	0	0	111.8	W321 A322 R327 F328 V329	W321-C325 WeakPolarHBondContact O-CB 3.46Å; W321-C325 PolarHBondContact O-N 3.28Å; W321-C325 PolarHBondContact O-SG 2.92Å; A322-C325 PolarHBondContact O-N 2.96Å; C325-R327 PolarHBondContact O-N 2.98Å; C325-F328 PolarHBondContact O-N 3.42Å; C325-V329 WeakPolarHBondContact O-CB 3.03Å; C325-V329 VanDerWaalsContact O-CG2 3.23Å; C325-V329 WeakPolarHBondContact O-CG2 3.3Å; C325-V329 PolarHBondContact O-N 3.13Å
326	N	37.5	Very low	43.7	Very low	58 Å²	58	93.3 Å²	93.3	31%	0.31	46%	0.456	S	S	.	.	H	α-helix	trans	-58.2	-47.5	175	-72.1	-12.2	0	0	0	111.7	K314 A322 R323 F324 F328 V329 D330	K314-N326 WeakPolarHBondContact CE-OD1 3.41Å; K314-N326 WeakPolarHBondContact CG-OD1 3.44Å; A322-N326 VanDerWaalsContact O-CB 3.29Å; A322-N326 WeakPolarHBondContact O-CB 3.26Å; A322-N326 PolarHBondContact O-N 3.2Å; A322-N326 PolarHBondContact O-ND2 2.74Å; A322-N326 PolarHBondContact O-OD1 3.26Å; R323-N326 PolarHBondContact O-N 3Å; F324-N326 VanDerWaalsContact C-N 3.29Å; F324-N326 PolarHBondContact O-N 3.27Å; N326-F328 VanDerWaalsContact C-N 3.29Å; N326-F328 PolarHBondContact O-N 3.36Å; N326-V329 PolarHBondContact O-N 2.97Å; N326-D330 WeakPolarHBondContact O-CB 3.27Å; N326-D330 PolarHBondContact O-N 3.22Å
327	R	30.3	Very low	45.8	Very low	194 Å²	194	92.1 Å²	92.1	73%	0.732	44%	0.444	S	S	*	.	H	α-helix	trans	-60.4	-37.8	179.3	-169.3	172.6	173.2	-173.5	-2.2	112.7	R323 F324 C325 T331	R323-R327 PolarHBondContact O-N 3.1Å; F324-R327 PolarHBondContact O-N 3.27Å; C325-R327 PolarHBondContact O-N 2.98Å; R327-T331 PolarHBondContact O-N 3.25Å; R327-T331 PolarHBondContact O-OG1 3.35Å
328	F	33.2	Very low	48.1	Very low	89 Å²	89	82.8 Å²	82.8	39%	0.39	41%	0.412	S	S	.	.	H	α-helix	trans	-77.8	-38	175.5	-82.1	-84.4	0	0	0	113	F324 C325 N326 D330 T331 W332	F324-F328 HydrophobicContact CD1-CD2 4.17Å; F324-F328 HydrophobicContact CD1-CE2 4.29Å; F324-F328 HydrophobicContact CD2-CE2 4.35Å; F324-F328 AromaticContact CE1-CD2 3.85Å; F324-F328 HydrophobicContact CE1-CD2 3.85Å; F324-F328 AromaticContact CE1-CE2 3.62Å; F324-F328 HydrophobicContact CE1-CE2 3.62Å; F324-F328 HydrophobicContact CE2-CD2 4.4Å; F324-F328 AromaticContact CE2-CE2 3.7Å; F324-F328 HydrophobicContact CE2-CE2 3.7Å; F324-F328 AromaticContact CZ-CD2 3.99Å; F324-F328 HydrophobicContact CZ-CD2 3.99Å; F324-F328 AromaticContact CZ-CE2 3.3Å; F324-F328 HydrophobicContact CZ-CE2 3.3Å; F324-F328 HydrophobicContact CZ-CZ 4.14Å; F324-F328 WeakPolarHBondContact O-CD2 3.32Å; F324-F328 PolarHBondContact O-N 3.3Å; C325-F328 PolarHBondContact O-N 3.42Å; N326-F328 VanDerWaalsContact C-N 3.29Å; N326-F328 PolarHBondContact O-N 3.36Å; F328-D330 VanDerWaalsContact C-N 3.3Å; F328-D330 PolarHBondContact O-N 3.05Å; F328-T331 WeakPolarHBondContact O-CB 3.41Å; F328-T331 PolarHBondContact O-N 3.06Å; F328-T331 VanDerWaalsContact O-N 3.13Å; F328-W332 VanDerWaalsContact O-CD1 3.24Å; F328-W332 PolarHBondContact O-N 3.35Å
329	V	38	Very low	50.5	Low	12 Å²	12	76 Å²	76	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-64.8	-37.8	175.2	174.1	0	0	0	0	110.2	K310 K314 C325 N326 T331 W332 A333	K310-V329 HydrophobicContact CB-CG2 4.01Å; K310-V329 WeakPolarHBondContact O-CG2 3.39Å; K314-V329 HydrophobicContact CD-CB 4.32Å; K314-V329 HydrophobicContact CD-CG1 4.06Å; K314-V329 HydrophobicContact CD-CG2 4.23Å; C325-V329 WeakPolarHBondContact O-CB 3.03Å; C325-V329 VanDerWaalsContact O-CG2 3.23Å; C325-V329 WeakPolarHBondContact O-CG2 3.3Å; C325-V329 PolarHBondContact O-N 3.13Å; N326-V329 PolarHBondContact O-N 2.97Å; V329-T331 PolarHBondContact O-N 3.24Å; V329-W332 PolarHBondContact O-N 2.99Å; V329-A333 HydrophobicContact CG1-CB 4.28Å; V329-A333 WeakPolarHBondContact O-CA 3.44Å; V329-A333 WeakPolarHBondContact O-CB 3.41Å; V329-A333 PolarHBondContact O-N 3.37Å
330	D	42.3	Very low	52.4	Low	83 Å²	83	74.6 Å²	74.6	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-33.2	173.8	-67.6	-17.1	0	0	0	111.7	N326 F328 W332 R334	N326-D330 WeakPolarHBondContact O-CB 3.27Å; N326-D330 PolarHBondContact O-N 3.22Å; F328-D330 VanDerWaalsContact C-N 3.3Å; F328-D330 PolarHBondContact O-N 3.05Å; D330-W332 PolarHBondContact O-N 2.91Å; D330-R334 WeakPolarHBondContact O-CB 3.45Å; D330-R334 PolarHBondContact O-N 3.2Å
331	T	39.9	Very low	54.5	Low	69 Å²	69	76.4 Å²	76.4	42%	0.423	35%	0.349	S	S	.	.	H	α-helix	trans	-66.9	-36.3	176.6	-50.7	0	0	0	0	112	R327 F328 V329	R327-T331 PolarHBondContact O-N 3.25Å; R327-T331 PolarHBondContact O-OG1 3.35Å; F328-T331 WeakPolarHBondContact O-CB 3.41Å; F328-T331 PolarHBondContact O-N 3.06Å; F328-T331 VanDerWaalsContact O-N 3.13Å; V329-T331 PolarHBondContact O-N 3.24Å
332	W	46.9	Very low	57	Low	45 Å²	45	72.4 Å²	72.4	17%	0.17	34%	0.338	C	S	.	.	H	α-helix	trans	-96.4	-28	-176.4	-72.9	73.4	0	0	0	113.6	I303 V307 F328 V329 D330 V339 H342	I303-W332 HydrophobicContact CG2-CZ3 4.46Å; V307-W332 HydrophobicContact CG2-CE3 4.27Å; F328-W332 VanDerWaalsContact O-CD1 3.24Å; F328-W332 PolarHBondContact O-N 3.35Å; V329-W332 PolarHBondContact O-N 2.99Å; D330-W332 PolarHBondContact O-N 2.91Å; W332-V339 HydrophobicContact CD2-CG2 4.44Å; W332-V339 HydrophobicContact CE3-CB 4.18Å; W332-V339 HydrophobicContact CE3-CG1 4.2Å; W332-V339 HydrophobicContact CE3-CG2 3.54Å; W332-V339 HydrophobicContact CZ3-CB 4.1Å; W332-V339 HydrophobicContact CZ3-CG1 3.95Å; W332-V339 HydrophobicContact CZ3-CG2 3.98Å; W332-H342 HydrophobicContact CH2-CB 3.65Å; W332-H342 AromaticContact CH2-CD2 3.77Å; W332-H342 AromaticContact CH2-CE1 3.88Å; W332-H342 AromaticContact CH2-CG 3.37Å; W332-H342 AromaticContact CH2-ND1 3.45Å; W332-H342 WeakPolarHBondContact CH2-ND1 3.11Å; W332-H342 AromaticContact CZ2-CD2 3.89Å; W332-H342 AromaticContact CZ2-CE1 3.58Å; W332-H342 AromaticContact CZ2-CG 3.84Å; W332-H342 AromaticContact CZ2-ND1 3.65Å; W332-H342 AromaticContact CZ2-NE2 3.73Å; W332-H342 HydrophobicContact CZ3-CB 4.33Å
333	A	49.2	Very low	59.5	Low	57 Å²	57	71.2 Å²	71.2	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-79.5	-17.7	177.3	0	0	0	0	0	112.6	V329	V329-A333 HydrophobicContact CG1-CB 4.28Å; V329-A333 WeakPolarHBondContact O-CA 3.44Å; V329-A333 WeakPolarHBondContact O-CB 3.41Å; V329-A333 PolarHBondContact O-N 3.37Å
334	R	54.3	Low	62	Low	193 Å²	193	65.5 Å²	65.5	73%	0.728	31%	0.306	S	S	*	.	S	Bend	trans	-111.3	-2.5	179.7	-73.3	-174.4	168.6	-146.3	-4	115.9	R63 D330	R63-R334 PolarHBondContact NH2-O 2.83Å; D330-R334 WeakPolarHBondContact O-CB 3.45Å; D330-R334 PolarHBondContact O-N 3.2Å
335	D	74.2	Confident	64.6	Low	34 Å²	34	62.9 Å²	62.9	18%	0.182	30%	0.304	C	S	.	.			trans	-140.3	83.9	178.9	-159.8	55.7	0	0	0	112.6	R63 D337 T338 V339	R63-D335 IonicContact NH2-OD1 2.74Å; R63-D335 PolarHBondContact NH2-OD1 3.03Å; D335-D337 PolarHBondContact O-N 3.43Å; D335-D337 VanDerWaalsContact O-N 3.15Å; D335-T338 WeakPolarHBondContact O-CB 3.46Å; D335-T338 PolarHBondContact O-N 3.18Å; D335-T338 VanDerWaalsContact OD2-CB 3.3Å; D335-T338 WeakPolarHBondContact OD2-CB 3.21Å; D335-T338 PolarHBondContact OD2-N 2.79Å; D335-T338 PolarHBondContact OD2-OG1 2.79Å; D335-V339 PolarHBondContact O-N 2.77Å
336	E	81.5	Confident	67.3	Low	43 Å²	43	64 Å²	64	20%	0.201	31%	0.312	C	S	.	.	H	α-helix	trans	-49.5	-37.9	172	-57.9	-178.4	167.5	0	0	111.5	G280 L281 R284 T338 V339 L340	G280-E336 VanDerWaalsContact C-OE1 3.29Å; G280-E336 WeakPolarHBondContact CA-OE1 3.46Å; L281-E336 HydrophobicContact CB-CG 4.22Å; L281-E336 HydrophobicContact CD1-CB 4.39Å; L281-E336 PolarHBondContact N-OE1 3.35Å; L281-E336 VanDerWaalsContact N-OE1 3.12Å; R284-E336 VanDerWaalsContact CD-OE2 3.29Å; R284-E336 WeakPolarHBondContact CD-OE2 3.33Å; R284-E336 IonicContact NH1-OE2 2.63Å; E336-T338 VanDerWaalsContact C-N 3.3Å; E336-T338 PolarHBondContact O-N 3.45Å; E336-V339 WeakPolarHBondContact O-CB 3.46Å; E336-V339 PolarHBondContact O-N 3.07Å; E336-V339 VanDerWaalsContact O-N 3.1Å; E336-L340 WeakPolarHBondContact O-CD2 3.35Å; E336-L340 PolarHBondContact O-N 3.29Å
337	D	85.9	Confident	69.7	Low	49 Å²	49	61.6 Å²	61.6	26%	0.262	30%	0.299	S	S	.	.	H	α-helix	trans	-59.3	-37.6	176.2	-82.8	-17	0	0	0	113.1	R284 D335 L340 K341	R284-D337 IonicContact CZ-OD1 3.51Å; R284-D337 VanDerWaalsContact CZ-OD1 3.3Å; R284-D337 IonicContact NH1-OD1 3.89Å; R284-D337 PolarHBondContact NH1-OD1 3.33Å; R284-D337 IonicContact NH2-OD1 3.44Å; R284-D337 PolarHBondContact NH2-OD1 3.21Å; D335-D337 PolarHBondContact O-N 3.43Å; D335-D337 VanDerWaalsContact O-N 3.15Å; D337-L340 PolarHBondContact O-N 3.18Å; D337-K341 WeakPolarHBondContact O-CB 3.46Å; D337-K341 WeakPolarHBondContact O-CG 3.38Å; D337-K341 PolarHBondContact O-N 2.97Å
338	T	85.6	Confident	72.5	Confident	30 Å²	30	58 Å²	58	18%	0.184	29%	0.288	C	S	.	.	H	α-helix	trans	-67.7	-40	175.2	-70.5	0	0	0	0	111.1	D335 E336 K341 H342	D335-T338 WeakPolarHBondContact O-CB 3.46Å; D335-T338 PolarHBondContact O-N 3.18Å; D335-T338 VanDerWaalsContact OD2-CB 3.3Å; D335-T338 WeakPolarHBondContact OD2-CB 3.21Å; D335-T338 PolarHBondContact OD2-N 2.79Å; D335-T338 PolarHBondContact OD2-OG1 2.79Å; E336-T338 VanDerWaalsContact C-N 3.3Å; E336-T338 PolarHBondContact O-N 3.45Å; T338-K341 PolarHBondContact O-N 2.97Å; T338-H342 PolarHBondContact O-N 3.35Å; T338-H342 PolarHBondContact O-ND1 2.81Å
339	V	85.8	Confident	75	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-49	174.7	-173.8	0	0	0	0	110.5	L281 I303 W332 D335 E336 K341 H342 L343	L281-V339 HydrophobicContact CD1-CB 4.09Å; L281-V339 HydrophobicContact CD1-CG1 3.96Å; L281-V339 HydrophobicContact CD1-CG2 4.49Å; L281-V339 HydrophobicContact CD2-CB 4.44Å; L281-V339 HydrophobicContact CD2-CG1 4.1Å; L281-V339 HydrophobicContact CD2-CG2 4.14Å; I303-V339 HydrophobicContact CG2-CG1 3.44Å; I303-V339 VanDerWaalsContact CG2-CG1 3.44Å; W332-V339 HydrophobicContact CD2-CG2 4.44Å; W332-V339 HydrophobicContact CE3-CB 4.18Å; W332-V339 HydrophobicContact CE3-CG1 4.2Å; W332-V339 HydrophobicContact CE3-CG2 3.54Å; W332-V339 HydrophobicContact CZ3-CB 4.1Å; W332-V339 HydrophobicContact CZ3-CG1 3.95Å; W332-V339 HydrophobicContact CZ3-CG2 3.98Å; D335-V339 PolarHBondContact O-N 2.77Å; E336-V339 WeakPolarHBondContact O-CB 3.46Å; E336-V339 PolarHBondContact O-N 3.07Å; E336-V339 VanDerWaalsContact O-N 3.1Å; V339-K341 VanDerWaalsContact C-N 3.34Å; V339-K341 PolarHBondContact O-N 3.38Å; V339-H342 WeakPolarHBondContact O-CB 3.41Å; V339-H342 PolarHBondContact O-N 3.16Å; V339-H342 VanDerWaalsContact O-N 3.17Å; V339-L343 PolarHBondContact O-N 3Å
340	L	90.1	Very high	76.9	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-67.9	-32.1	-179	-84.8	-60.8	0	0	0	112.4	Y99 L281 R284 L285 V288 E336 D337 L343 R344	Y99-L340 HydrophobicContact CD1-CD1 4.28Å; L281-L340 HydrophobicContact CD1-CD2 3.52Å; R284-L340 HydrophobicContact CB-CD2 4.07Å; L285-L340 HydrophobicContact CD2-CD1 4.14Å; L285-L340 HydrophobicContact CD2-CD2 4.38Å; V288-L340 HydrophobicContact CG2-CD1 3.72Å; E336-L340 WeakPolarHBondContact O-CD2 3.35Å; E336-L340 PolarHBondContact O-N 3.29Å; D337-L340 PolarHBondContact O-N 3.18Å; L340-L343 HydrophobicContact CD1-CD2 3.92Å; L340-L343 PolarHBondContact O-N 3Å; L340-R344 WeakPolarHBondContact O-CB 3.36Å; L340-R344 PolarHBondContact O-N 2.87Å
341	K	90.5	Very high	78.6	Confident	137 Å²	137	63.4 Å²	63.4	60%	0.596	32%	0.317	S	S	*	.	H	α-helix	trans	-63.3	-43.9	170.3	-76.8	168.1	-170.9	167.3	0	111.9	D337 T338 V339 R344 A345	D337-K341 WeakPolarHBondContact O-CB 3.46Å; D337-K341 WeakPolarHBondContact O-CG 3.38Å; D337-K341 PolarHBondContact O-N 2.97Å; T338-K341 PolarHBondContact O-N 2.97Å; V339-K341 VanDerWaalsContact C-N 3.34Å; V339-K341 PolarHBondContact O-N 3.38Å; K341-R344 PolarHBondContact O-N 2.81Å; K341-A345 WeakPolarHBondContact O-CB 3.28Å; K341-A345 PolarHBondContact O-N 3.23Å
342	H	88.6	Confident	80.4	Confident	94 Å²	94	69 Å²	69	44%	0.435	33%	0.33	S	S	.	.	H	α-helix	trans	-65.1	-40.8	176	-76.3	87.9	0	0	0	111.7	W332 T338 V339 A345 S346	W332-H342 HydrophobicContact CH2-CB 3.65Å; W332-H342 AromaticContact CH2-CD2 3.77Å; W332-H342 AromaticContact CH2-CE1 3.88Å; W332-H342 AromaticContact CH2-CG 3.37Å; W332-H342 AromaticContact CH2-ND1 3.45Å; W332-H342 WeakPolarHBondContact CH2-ND1 3.11Å; W332-H342 AromaticContact CZ2-CD2 3.89Å; W332-H342 AromaticContact CZ2-CE1 3.58Å; W332-H342 AromaticContact CZ2-CG 3.84Å; W332-H342 AromaticContact CZ2-ND1 3.65Å; W332-H342 AromaticContact CZ2-NE2 3.73Å; W332-H342 HydrophobicContact CZ3-CB 4.33Å; T338-H342 PolarHBondContact O-N 3.35Å; T338-H342 PolarHBondContact O-ND1 2.81Å; V339-H342 WeakPolarHBondContact O-CB 3.41Å; V339-H342 PolarHBondContact O-N 3.16Å; V339-H342 VanDerWaalsContact O-N 3.17Å; H342-A345 PolarHBondContact O-N 2.96Å; H342-S346 WeakPolarHBondContact O-CB 3.42Å; H342-S346 PolarHBondContact O-N 3.45Å
343	L	89.5	Confident	81.4	Confident	0 Å²	0	74 Å²	74	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-57.3	-50.9	173	-179	62.4	0	0	0	110.7	Y99 L285 V288 P299 I300 I303 V339 L340 A345 S346 M347	Y99-L343 HydrophobicContact CE1-CB 4.36Å; Y99-L343 HydrophobicContact CE1-CD2 4.05Å; Y99-L343 HydrophobicContact CE1-CG 4.01Å; L285-L343 HydrophobicContact CD2-CD2 3.79Å; V288-L343 HydrophobicContact CB-CD2 4.38Å; V288-L343 HydrophobicContact CG1-CD2 3.93Å; P299-L343 HydrophobicContact CB-CD1 3.58Å; I300-L343 HydrophobicContact CD1-CD2 4.49Å; I300-L343 HydrophobicContact CG1-CD1 3.81Å; I300-L343 HydrophobicContact CG1-CD2 3.82Å; I300-L343 HydrophobicContact CG1-CG 4.5Å; I303-L343 HydrophobicContact CD1-CB 3.46Å; I303-L343 VanDerWaalsContact CD1-CB 3.46Å; I303-L343 HydrophobicContact CD1-CD1 3.72Å; I303-L343 HydrophobicContact CD1-CG 4.16Å; V339-L343 PolarHBondContact O-N 3Å; L340-L343 HydrophobicContact CD1-CD2 3.92Å; L340-L343 PolarHBondContact O-N 3Å; L343-A345 VanDerWaalsContact C-N 3.29Å; L343-A345 PolarHBondContact O-N 3.12Å; L343-S346 WeakPolarHBondContact O-CA 3.46Å; L343-S346 WeakPolarHBondContact O-CB 3.41Å; L343-S346 PolarHBondContact O-N 3.26Å; L343-M347 HydrophobicContact CD1-CG 4.35Å; L343-M347 HydrophobicContact CG-CG 4.48Å; L343-M347 WeakPolarHBondContact O-CG 3.35Å; L343-M347 PolarHBondContact O-N 2.92Å
344	R	91.6	Very high	81.9	Confident	65 Å²	65	77.4 Å²	77.4	25%	0.245	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-39.4	178.9	-164.4	170.8	-178.6	-168.5	-6.6	112.6	D96 Y99 L340 K341 K348	D96-R344 IonicContact OD1-CZ 3.57Å; D96-R344 IonicContact OD1-NH2 2.68Å; D96-R344 PolarHBondContact OD1-NH2 3.09Å; D96-R344 IonicContact OD2-CZ 2.81Å; D96-R344 IonicContact OD2-NH2 2.58Å; D96-R344 PolarHBondContact OD2-NH2 3.02Å; Y99-R344 HydrophobicContact CD1-CB 3.64Å; Y99-R344 HydrophobicContact CD1-CG 4.04Å; Y99-R344 HydrophobicContact CD2-CG 4.26Å; Y99-R344 HydrophobicContact CE1-CB 3.61Å; Y99-R344 HydrophobicContact CE1-CG 4.04Å; Y99-R344 HydrophobicContact CE2-CG 4.29Å; Y99-R344 HydrophobicContact CG-CB 4.22Å; Y99-R344 HydrophobicContact CG-CG 4.15Å; L340-R344 WeakPolarHBondContact O-CB 3.36Å; L340-R344 PolarHBondContact O-N 2.87Å; K341-R344 PolarHBondContact O-N 2.81Å; R344-K348 WeakPolarHBondContact O-CG 3.28Å; R344-K348 PolarHBondContact O-N 3.03Å
345	A	90.5	Very high	81.9	Confident	49 Å²	49	71.2 Å²	71.2	41%	0.405	36%	0.356	S	S	.	.	H	α-helix	trans	-66.5	-38.9	175.3	0	0	0	0	0	111.9	K341 H342 L343 K349	K341-A345 WeakPolarHBondContact O-CB 3.28Å; K341-A345 PolarHBondContact O-N 3.23Å; H342-A345 PolarHBondContact O-N 2.96Å; L343-A345 VanDerWaalsContact C-N 3.29Å; L343-A345 PolarHBondContact O-N 3.12Å; A345-K349 WeakPolarHBondContact O-CG 3.39Å; A345-K349 PolarHBondContact O-N 3.14Å
346	S	87.5	Confident	81	Confident	40 Å²	40	76 Å²	76	28%	0.28	38%	0.382	S	S	.	.	H	α-helix	trans	-64.4	-44.5	174.9	-166.1	0	0	0	0	111.6	H342 L343 K349 L350	H342-S346 WeakPolarHBondContact O-CB 3.42Å; H342-S346 PolarHBondContact O-N 3.45Å; L343-S346 WeakPolarHBondContact O-CA 3.46Å; L343-S346 WeakPolarHBondContact O-CB 3.41Å; L343-S346 PolarHBondContact O-N 3.26Å; S346-K349 WeakPolarHBondContact O-CB 3.28Å; S346-K349 PolarHBondContact O-N 3.33Å; S346-L350 PolarHBondContact O-N 2.87Å; S346-L350 VanDerWaalsContact O-N 3.07Å
347	M	88.9	Confident	79	Confident	8 Å²	8	79.1 Å²	79.1	4%	0.039	40%	0.399	C	S	.	.	H	α-helix	trans	-60.5	-47.5	177.1	-73.2	-69.2	-72.6	0	0	111.4	Y99 E292 Q295 A296 P299 L343 K349 L350 T351	Y99-M347 WeakPolarHBondContact OH-CG 3.36Å; E292-M347 HydrophobicContact CB-CE 4.14Å; E292-M347 HydrophobicContact CG-CE 4.24Å; Q295-M347 HydrophobicContact CB-CE 4.25Å; A296-M347 HydrophobicContact CB-CE 3.99Å; A296-M347 HydrophobicContact CB-SD 4.24Å; P299-M347 HydrophobicContact CB-CG 4.47Å; P299-M347 HydrophobicContact CB-SD 4.1Å; P299-M347 HydrophobicContact CG-SD 3.69Å; L343-M347 HydrophobicContact CD1-CG 4.35Å; L343-M347 HydrophobicContact CG-CG 4.48Å; L343-M347 WeakPolarHBondContact O-CG 3.35Å; L343-M347 PolarHBondContact O-N 2.92Å; M347-K349 VanDerWaalsContact C-N 3.26Å; M347-K349 PolarHBondContact O-N 2.93Å; M347-L350 WeakPolarHBondContact O-CB 3.44Å; M347-L350 PolarHBondContact O-N 3.02Å; M347-T351 PolarHBondContact O-N 2.7Å; M347-T351 PolarHBondContact O-OG1 3.43Å; M347-T351 VanDerWaalsContact O-OG1 3.08Å
348	K	87.9	Confident	76.8	Confident	118 Å²	118	81.8 Å²	81.8	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-58.4	-35.3	175.1	-74.4	179.6	178.6	-173.6	0	113.5	R344 R352	R344-K348 WeakPolarHBondContact O-CG 3.28Å; R344-K348 PolarHBondContact O-N 3.03Å; K348-R352 WeakPolarHBondContact O-CG 3.43Å; K348-R352 PolarHBondContact O-N 2.93Å
349	K	85.8	Confident	74.6	Confident	143 Å²	143	86 Å²	86	62%	0.622	45%	0.446	S	S	*	.	H	α-helix	trans	-68.7	-37.8	175.8	-73.4	176.3	179.7	-174.6	0	111.5	A345 S346 M347 K353	A345-K349 WeakPolarHBondContact O-CG 3.39Å; A345-K349 PolarHBondContact O-N 3.14Å; S346-K349 WeakPolarHBondContact O-CB 3.28Å; S346-K349 PolarHBondContact O-N 3.33Å; M347-K349 VanDerWaalsContact C-N 3.26Å; M347-K349 PolarHBondContact O-N 2.93Å; K349-K353 PolarHBondContact O-N 3.38Å
350	L	78.5	Confident	72.4	Confident	69 Å²	69	91.9 Å²	91.9	36%	0.361	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-46.5	177.3	-172.1	65.4	0	0	0	111.2	P299 S346 M347 R352 K353 Q354	P299-L350 HydrophobicContact CG-CD2 4.39Å; S346-L350 PolarHBondContact O-N 2.87Å; S346-L350 VanDerWaalsContact O-N 3.07Å; M347-L350 WeakPolarHBondContact O-CB 3.44Å; M347-L350 PolarHBondContact O-N 3.02Å; L350-R352 VanDerWaalsContact C-N 3.27Å; L350-R352 PolarHBondContact O-N 2.93Å; L350-K353 PolarHBondContact O-N 3.08Å; L350-K353 VanDerWaalsContact O-N 3.17Å; L350-Q354 PolarHBondContact O-N 3.35Å
351	T	78.8	Confident	69.7	Low	86 Å²	86	96.4 Å²	96.4	53%	0.528	52%	0.523	S	S	.	.	H	α-helix	trans	-59.9	-36.7	177.8	-44.7	0	0	0	0	112.5	M347 G355	M347-T351 PolarHBondContact O-N 2.7Å; M347-T351 PolarHBondContact O-OG1 3.43Å; M347-T351 VanDerWaalsContact O-OG1 3.08Å; T351-G355 PolarHBondContact O-N 2.8Å
352	R	76	Confident	67.1	Low	186 Å²	186	99 Å²	99	70%	0.702	53%	0.534	S	S	*	.	H	α-helix	trans	-63.6	-49.4	174.9	-74.7	176.6	-179.9	-172.3	-2.6	111.7	K348 L350 Q354 G355 D356	K348-R352 WeakPolarHBondContact O-CG 3.43Å; K348-R352 PolarHBondContact O-N 2.93Å; L350-R352 VanDerWaalsContact C-N 3.27Å; L350-R352 PolarHBondContact O-N 2.93Å; R352-Q354 VanDerWaalsContact C-N 3.27Å; R352-Q354 PolarHBondContact O-N 2.78Å; R352-G355 PolarHBondContact O-N 3.32Å; R352-D356 PolarHBondContact O-N 2.78Å
353	K	69.3	Low	64.6	Low	152 Å²	152	100.4 Å²	100.4	66%	0.661	55%	0.552	S	S	*	*	H	α-helix	trans	-61.4	-34.2	179	-71.1	-173.2	174.3	-162.4	0	113.1	K349 L350 G355 D356	K349-K353 PolarHBondContact O-N 3.38Å; L350-K353 PolarHBondContact O-N 3.08Å; L350-K353 VanDerWaalsContact O-N 3.17Å; K353-G355 VanDerWaalsContact C-N 3.32Å; K353-D356 PolarHBondContact O-N 3.38Å
354	Q	58.6	Low	62	Low	128 Å²	128	109.4 Å²	109.4	60%	0.598	59%	0.594	S	S	*	*	H	α-helix	trans	-70.2	-30.1	176.4	-159.4	68.1	31.8	0	0	112.3	L350 R352 D356	L350-Q354 PolarHBondContact O-N 3.35Å; R352-Q354 VanDerWaalsContact C-N 3.27Å; R352-Q354 PolarHBondContact O-N 2.78Å; Q354-D356 VanDerWaalsContact C-N 3.35Å
355	G	54.7	Low	59.1	Low	63 Å²	63	116 Å²	116	65%	0.649	63%	0.627	S	S	*	*	H	α-helix	trans	-76.1	-18.9	175.9	0	0	0	0	0	114.5	T351 R352 K353	T351-G355 PolarHBondContact O-N 2.8Å; R352-G355 PolarHBondContact O-N 3.32Å; K353-G355 VanDerWaalsContact C-N 3.32Å
356	D	55.1	Low	56.5	Low	135 Å²	135	116.9 Å²	116.9	72%	0.722	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-3.2	179.6	-63.3	-34.5	0	0	0	113.1	R352 K353 Q354	R352-D356 PolarHBondContact O-N 2.78Å; K353-D356 PolarHBondContact O-N 3.38Å; Q354-D356 VanDerWaalsContact C-N 3.35Å
357	L	40.2	Very low	54.1	Low	107 Å²	107	120.3 Å²	120.3	56%	0.56	67%	0.665	S	S	*	*	S	Bend	trans	-81.1	130.6	177.3	-79.5	162	0	0	0	110.7
358	P	39.7	Very low	51.4	Low	105 Å²	105	125.4 Å²	125.4	68%	0.682	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-61.5	145.8	173.3	25.7	-32.3	0	0	0	110.2
359	P	39.1	Very low	48.9	Very low	118 Å²	118	124.2 Å²	124.2	77%	0.766	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-57.1	142.5	176	23.8	-32.2	0	0	0	110	A361	P359-A361 PolarHBondContact O-N 2.72Å
360	P	40.4	Very low	46.3	Very low	124 Å²	124	123.5 Å²	123.5	81%	0.805	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-56.7	134.7	177.5	22.8	-31.4	0	0	0	109.5	K362	P360-K362 PolarHBondContact O-N 2.81Å
361	A	33.4	Very low	44.2	Very low	98 Å²	98	131.3 Å²	131.3	81%	0.81	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-51.6	129.9	178.7	0	0	0	0	0	109.8	P359	P359-A361 PolarHBondContact O-N 2.72Å
362	K	34.5	Very low	42.2	Very low	191 Å²	191	133.1 Å²	133.1	83%	0.83	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-55.6	138.5	172	-71.2	-179.3	178.8	178.4	0	107.9	P360 E364	P360-K362 PolarHBondContact O-N 2.81Å; K362-E364 PolarHBondContact O-N 2.9Å
363	P	36.7	Very low	40.5	Very low	124 Å²	124	130.7 Å²	130.7	81%	0.805	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-57	118.2	169.6	-14	25.9	0	0	0	107.5	Q365	P363-Q365 PolarHBondContact O-N 3.23Å
364	E	34	Very low	39	Very low	189 Å²	189	129.3 Å²	129.3	88%	0.883	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-55.4	126.1	172.1	-72.5	-167.8	143.3	0	0	108.4	K362 G366	K362-E364 PolarHBondContact O-N 2.9Å; E364-G366 PolarHBondContact O-N 3.04Å
365	Q	32.3	Very low	37.7	Very low	202 Å²	202	128.3 Å²	128.3	94%	0.944	79%	0.791	S	S	*	*			trans	-68	83.2	163.3	-78.7	-173.3	-18.1	0	0	107.5	P363 S367	P363-Q365 PolarHBondContact O-N 3.23Å; Q365-S367 PolarHBondContact O-N 3.01Å
366	G	35.1	Very low	36.9	Very low	69 Å²	69	131.3 Å²	131.3	71%	0.711	80%	0.801	S	S	*	*			trans	-70.1	104.7	172.1	0	0	0	0	0	109.8	E364	E364-G366 PolarHBondContact O-N 3.04Å
367	S	36.7	Very low	36.2	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	81%	0.812	S	S	*	*			trans	-39.8	138.5	170.7	-176.6	0	0	0	0	113.8	Q365 A369	Q365-S367 PolarHBondContact O-N 3.01Å; S367-A369 PolarHBondContact O-N 3.02Å
368	S	32.7	Very low	35.9	Very low	115 Å²	115	135.5 Å²	135.5	80%	0.804	83%	0.826	S	S	*	*			trans	-57.2	115.3	169.5	52.3	0	0	0	0	112.4
369	A	35.3	Very low	35.8	Very low	94 Å²	94	134.3 Å²	134.3	78%	0.777	83%	0.832	S	S	*	*			trans	-155.3	108.4	153	0	0	0	0	0	109.6	S367	S367-A369 PolarHBondContact O-N 3.02Å
370	S	32.1	Very low	35.5	Very low	127 Å²	127	138.4 Å²	138.4	89%	0.888	84%	0.838	S	S	*	*			trans	-67.1	134	171.9	38.5	0	0	0	0	110.7
371	R	34.3	Very low	35.3	Very low	234 Å²	234	139.6 Å²	139.6	88%	0.883	84%	0.843	S	S	*	*			trans	-132.4	122.4	163.6	-161.6	175.2	-174.1	-177.2	1.7	108.9
372	P	36.5	Very low	35.3	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	84%	0.842	S	S	*	*			trans	-85.6	144.1	-178.1	32.3	-30.5	0	0	0	111.3
373	V	39.8	Very low	35.2	Very low	135 Å²	135	139.5 Å²	139.5	82%	0.818	85%	0.846	S	S	*	*			trans	-124.1	139.4	169.6	177.6	0	0	0	0	108.6
374	P	37.5	Very low	35.1	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	85%	0.847	S	S	*	*			trans	-88	158.8	-157	-3.4	23.7	0	0	0	114.8
375	A	31.9	Very low	35.1	Very low	107 Å²	107	137.3 Å²	137.3	88%	0.884	84%	0.843	S	S	*	*			trans	-70.7	145.1	178.9	0	0	0	0	0	114.2
376	S	38.7	Very low	35.1	Very low	125 Å²	125	134.7 Å²	134.7	87%	0.874	84%	0.836	S	S	*	*			trans	-123.9	141.5	160.1	-169.2	0	0	0	0	110.8
377	R	38.4	Very low	35.1	Very low	248 Å²	248	143.5 Å²	143.5	94%	0.936	85%	0.847	S	S	*	*			trans	-84.9	156.2	-168.6	-76.6	173.6	166	-169.5	-3.1	113.3
378	G	35.9	Very low	34.9	Very low	83 Å²	83	147.9 Å²	147.9	86%	0.856	86%	0.855	S	S	*	*			trans	119.5	131.1	155.1	0	0	0	0	0	112.1
379	G	35.8	Very low	35.1	Very low	79 Å²	79	146.7 Å²	146.7	81%	0.814	85%	0.853	S	S	*	*			cis	-165.5	161.1	4.7	0	0	0	0	0	108.2
380	K	34.5	Very low	35.1	Very low	204 Å²	204	148 Å²	148	89%	0.887	85%	0.853	S	S	*	*			trans	-73.4	149.2	-168.4	-54.7	159.4	-179.1	178.9	0	111.7
381	T	35.5	Very low	35.2	Very low	150 Å²	150	148.1 Å²	148.1	92%	0.92	85%	0.851	S	S	*	*				-164.8	136.6	125.7	-60.1	0	0	0	0	110
382	L	32.3	Very low	35.1	Very low	151 Å²	151	140.1 Å²	140.1	79%	0.791	84%	0.841	S	S	*	*			trans	-103.7	138	-171.6	175.7	84.7	0	0	0	109.3
383	C	34.4	Very low	35	Very low	135 Å²	135	140.1 Å²	140.1	91%	0.912	84%	0.841	S	S	*	*			trans	-156.6	118	150.3	-97.9	0	0	0	0	110.5
384	K	34.3	Very low	34.5	Very low	190 Å²	190	139.6 Å²	139.6	83%	0.826	84%	0.841	S	S	*	*			trans	-70	149.8	171.7	-90.3	-178.7	165.9	-172.2	0	111.5
385	G	34.1	Very low	34.2	Very low	77 Å²	77	138 Å²	138	79%	0.794	84%	0.838	S	S	*	*			trans	-162.9	97.3	162.1	0	0	0	0	0	110.3
386	D	32.2	Very low	34.1	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	84%	0.838	S	S	*	*			trans	-67.1	128.8	175.4	-71.8	-53.5	0	0	0	111.6
387	R	34.8	Very low	33.7	Very low	253 Å²	253	146.5 Å²	146.5	96%	0.955	83%	0.833	S	S	*	*			trans	-148.5	117.9	143.4	-83	-154	174.8	177.1	-1.1	110.4
388	Q	32.5	Very low	33.2	Very low	203 Å²	203	140.2 Å²	140.2	95%	0.949	82%	0.824	S	S	*	*			trans	-83.9	131.3	178.7	-153.8	156	-6.9	0	0	109
389	A	35.8	Very low	32.8	Very low	90 Å²	90	146 Å²	146	74%	0.744	82%	0.82	S	S	*	*			trans	-127	144.8	169.3	0	0	0	0	0	109.1
390	P	36.6	Very low	32.4	Very low	122 Å²	122	147.2 Å²	147.2	79%	0.792	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-78	160.4	-162.3	31.5	-34.2	0	0	0	113.5
391	P	33.3	Very low	31.9	Very low	130 Å²	130	144 Å²	144	84%	0.844	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-80.2	126.6	-172.7	32	-31.7	0	0	0	111.9
392	G	31.7	Very low	31.5	Very low	65 Å²	65	148 Å²	148	67%	0.67	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.4	150.9	168.6	0	0	0	0	0	112.4
393	P	34.8	Very low	31.1	Very low	123 Å²	123	145.1 Å²	145.1	80%	0.799	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.3	151.7	-168.5	31	-33.9	0	0	0	112.9
394	P	29	Very low	30.8	Very low	125 Å²	125	143.3 Å²	143.3	81%	0.812	79%	0.791	S	S	*	*			trans	-88.8	113.4	-175.9	33.9	-29	0	0	0	110.8
395	A	31.6	Very low	30.5	Very low	90 Å²	90	139.6 Å²	139.6	74%	0.744	79%	0.789	S	S	*	*			trans	-106.5	82.8	164.1	0	0	0	0	0	109.7	F397	A395-F397 PolarHBondContact O-N 2.94Å
396	R	29.7	Very low	30.2	Very low	238 Å²	238	141.6 Å²	141.6	90%	0.898	79%	0.788	S	S	*	*			trans	-70.2	112.9	164.3	-77.5	179.8	174.4	-173	-1.3	108.5
397	F	29.7	Very low	30.1	Very low	173 Å²	173	140.6 Å²	140.6	76%	0.759	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-87.2	120.5	158	-80	-78	0	0	0	109.2	A395	A395-F397 PolarHBondContact O-N 2.94Å
398	P	28.7	Very low	29.8	Very low	116 Å²	116	140.4 Å²	140.4	75%	0.753	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74.9	124.9	166.8	6.6	9.2	0	0	0	108.6
399	R	27.3	Very low	29.6	Very low	203 Å²	203	135 Å²	135	77%	0.766	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-59	135.8	168.1	-71.2	-172.2	177.9	-152.9	1.5	109.6	I401	R399-I401 PolarHBondContact O-N 2.97Å; R399-I401 VanDerWaalsContact O-N 3.12Å
400	P	26.7	Very low	29.4	Very low	106 Å²	106	137 Å²	137	69%	0.688	78%	0.784	S	S	*	*			trans	-72.4	105.4	166.7	-3.6	20.1	0	0	0	108.5	W402	P400-W402 PolarHBondContact O-N 2.86Å
401	I	25.7	Very low	28.9	Very low	137 Å²	137	143 Å²	143	70%	0.703	79%	0.791	S	S	*	*			trans	-73.8	103.7	168.7	-63.6	173.3	0	0	0	107.4	R399 S403	R399-I401 PolarHBondContact O-N 2.97Å; R399-I401 VanDerWaalsContact O-N 3.12Å; I401-S403 VanDerWaalsContact C-N 3.32Å; I401-S403 WeakPolarHBondContact CG2-OG 3.2Å; I401-S403 PolarHBondContact O-N 3.26Å
402	W	25.4	Very low	28.7	Very low	232 Å²	232	141.9 Å²	141.9	88%	0.879	79%	0.786	S	S	*	*			trans	-84.2	81.8	161.2	-80.5	15.9	0	0	0	108.8	P400	P400-W402 PolarHBondContact O-N 2.86Å
403	S	25.1	Very low	28.5	Very low	92 Å²	92	143.7 Å²	143.7	64%	0.643	79%	0.789	S	S	*	*			trans	-138.7	93.6	165.9	67.4	0	0	0	0	109.9	I401	I401-S403 VanDerWaalsContact C-N 3.32Å; I401-S403 WeakPolarHBondContact CG2-OG 3.2Å; I401-S403 PolarHBondContact O-N 3.26Å
404	A	27.4	Very low	28.3	Very low	97 Å²	97	144.1 Å²	144.1	80%	0.802	79%	0.789	S	S	*	*			trans	-173.3	104.6	148	0	0	0	0	0	108.2
405	S	27.7	Very low	28.3	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-59.4	138.2	159	-53.1	0	0	0	0	108.6
406	P	29.4	Very low	28.2	Very low	118 Å²	118	145.3 Å²	145.3	77%	0.766	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.5	139.9	174.8	27.1	-30.9	0	0	0	109.4
407	P	30.1	Very low	28.2	Very low	127 Å²	127	140 Å²	140	83%	0.825	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.3	136.1	-179.2	26.7	-31	0	0	0	110.5	A409	P407-A409 PolarHBondContact O-N 3.05Å
408	R	28	Very low	28.3	Very low	249 Å²	249	135.2 Å²	135.2	94%	0.94	79%	0.787	S	S	*	*			trans	-70.2	115.8	178.9	-141.2	-177.7	-73.4	-148.5	-0.6	108.9
409	A	28.8	Very low	28.2	Very low	90 Å²	90	133.7 Å²	133.7	74%	0.744	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.8	145.3	171.1	0	0	0	0	0	111.2	P407	P407-A409 PolarHBondContact O-N 3.05Å
410	P	30	Very low	28.3	Very low	131 Å²	131	129 Å²	129	85%	0.851	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.6	153.9	-174.9	-4.2	23	0	0	0	112.9
411	R	25.7	Very low	28.2	Very low	249 Å²	249	130.3 Å²	130.3	94%	0.94	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-76.9	147.7	179.5	-66.4	175.2	169.2	-158.5	-3.9	112.9
412	S	30.5	Very low	28.3	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	81%	0.809	S	S	*	*			trans	-149.6	102.2	144	55.2	0	0	0	0	107.6
413	S	28.1	Very low	28.3	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	80%	0.804	S	S	*	*				52.4	120.5	108	57.9	0	0	0	0	113
414	T	29.2	Very low	28.4	Very low	131 Å²	131	134 Å²	134	80%	0.804	81%	0.811	S	S	*	*				-170	148.1	62.6	-46	0	0	0	0	109.6
415	P	28.8	Very low	28.2	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	80%	0.799	S	S	*	*			trans	-96.5	160.8	-173.1	36.9	-32.2	0	0	0	113.2
416	C	29.3	Very low	28.1	Very low	130 Å²	130	138.2 Å²	138.2	88%	0.878	80%	0.801	S	S	*	*			trans	178.8	160.8	136.9	-96.5	0	0	0	0	113.5
417	P	31	Very low	28.1	Very low	125 Å²	125	138.4 Å²	138.4	81%	0.812	80%	0.802	S	S	*	*			trans	-124.1	176.1	-142.7	41.8	-27.1	0	0	0	115.4
418	G	30.9	Very low	27.9	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	81%	0.807	S	S	*	*			trans	144.1	112.6	166.7	0	0	0	0	0	110.3
419	G	27.1	Very low	27.9	Very low	84 Å²	84	131.2 Å²	131.2	87%	0.866	80%	0.797	S	S	*	*				82.5	129.9	85.7	0	0	0	0	0	108.9
420	A	29.2	Very low	27.8	Very low	104 Å²	104	133.2 Å²	133.2	86%	0.86	80%	0.8	S	S	*	*			cis	-161.2	170.3	12.2	0	0	0	0	0	109.1
421	V	25.2	Very low	27.6	Very low	134 Å²	134	135.9 Å²	135.9	81%	0.812	80%	0.802	S	S	*	*			trans	-48.6	142	175.3	174.1	0	0	0	0	114.6
422	R	28.3	Very low	27.6	Very low	225 Å²	225	127.4 Å²	127.4	85%	0.849	79%	0.791	S	S	*	*			trans	-156.8	122.4	133.1	-123.1	-175.4	177.4	-168.9	-2.5	113.7
423	E	23.9	Very low	27.4	Very low	164 Å²	164	129 Å²	129	77%	0.766	80%	0.796	S	S	*	*			trans	-70.3	141.4	160.2	-122.7	166.2	177.1	0	0	108.8
424	D	27.1	Very low	27.3	Very low	150 Å²	150	129.2 Å²	129.2	80%	0.802	80%	0.795	S	S	*	*			trans	-145.5	136.9	154.2	-91.5	-37.6	0	0	0	110
425	T	23	Very low	27.3	Very low	87 Å²	87	128.3 Å²	128.3	53%	0.534	79%	0.794	S	S	.	*			trans	-116.7	155.7	-171.1	-50.1	0	0	0	0	109.9
426	Y	25.7	Very low	27.5	Very low	211 Å²	211	129.1 Å²	129.1	83%	0.827	80%	0.799	S	S	*	*			trans	88.9	161.5	158	-56.1	-69.2	0	0	0	118.7
427	P	29.8	Very low	27.3	Very low	121 Å²	121	127.1 Å²	127.1	79%	0.786	79%	0.793	S	S	*	*			cis	-134.2	178	-18.9	21.3	3.6	0	0	0	114.9
428	V	26.2	Very low	27	Very low	154 Å²	154	129 Å²	129	93%	0.933	80%	0.795	S	S	*	*			trans	-56.2	139.1	168.9	172.1	0	0	0	0	112.9
429	G	27.9	Very low	26.9	Very low	72 Å²	72	130.3 Å²	130.3	74%	0.742	80%	0.799	S	S	*	*			trans	-172.6	138.3	172.2	0	0	0	0	0	113
430	T	26.2	Very low	26.9	Very low	131 Å²	131	135.1 Å²	135.1	80%	0.804	80%	0.799	S	S	*	*			trans	-79.3	152.2	-158.5	-28	0	0	0	0	115.3
431	Q	26.5	Very low	26.8	Very low	188 Å²	188	134.2 Å²	134.2	88%	0.879	80%	0.8	S	S	*	*			trans	68.3	123.3	155	-89.8	178.6	18.9	0	0	120.1
432	G	26.3	Very low	27.1	Very low	70 Å²	70	131 Å²	131	72%	0.722	79%	0.793	S	S	*	*			trans	154.1	92.2	163.6	0	0	0	0	0	110.6	P434	G432-P434 VanDerWaalsContact O-CD 3.23Å; G432-P434 WeakPolarHBondContact O-CD 3.31Å
433	V	25.7	Very low	27.4	Very low	140 Å²	140	125.7 Å²	125.7	85%	0.848	79%	0.788	S	S	*	*			trans	-66.4	125.8	170.8	175.1	0	0	0	0	108.6
434	P	27.3	Very low	28	Very low	108 Å²	108	126.4 Å²	126.4	70%	0.701	79%	0.791	S	S	*	*			trans	-111.8	113	158.5	21.8	-0.8	0	0	0	108.6	G432 P436	G432-P434 VanDerWaalsContact O-CD 3.23Å; G432-P434 WeakPolarHBondContact O-CD 3.31Å; P434-P436 WeakPolarHBondContact O-CD 3.44Å
435	S	27.1	Very low	28.6	Very low	112 Å²	112	120.4 Å²	120.4	78%	0.783	77%	0.765	S	S	*	*			trans	-50.9	125.5	158.9	-63.5	0	0	0	0	109.3	A437	S435-A437 PolarHBondContact O-N 3.11Å
436	P	33.4	Very low	29.3	Very low	128 Å²	128	119.4 Å²	119.4	83%	0.831	76%	0.762	S	S	*	*			trans	-84.9	111.6	171.4	-6.7	25.4	0	0	0	108.9	P434	P434-P436 WeakPolarHBondContact O-CD 3.44Å
437	A	25.3	Very low	30.1	Very low	89 Å²	89	115.1 Å²	115.1	74%	0.736	74%	0.744	S	S	*	*			trans	-51.5	157.9	168.8	0	0	0	0	0	113.3	S435 A439	S435-A437 PolarHBondContact O-N 3.11Å; A437-A439 PolarHBondContact O-N 3.25Å
438	L	26.1	Very low	30.3	Very low	163 Å²	163	115.1 Å²	115.1	85%	0.853	73%	0.728	S	S	*	*			trans	-45	116.4	170.5	-80.5	89.9	0	0	0	111.8
439	A	27.8	Very low	30.9	Very low	102 Å²	102	113.5 Å²	113.5	84%	0.843	71%	0.709	S	S	*	*			trans	-102.1	104.3	158.7	0	0	0	0	0	108.1	A437	A437-A439 PolarHBondContact O-N 3.25Å
440	Q	26.9	Very low	31.1	Very low	184 Å²	184	111.4 Å²	111.4	86%	0.86	68%	0.681	S	S	*	*			trans	-66.6	138.3	169.2	-68.5	-165.2	-17	0	0	110.3
441	G	27.6	Very low	31.4	Very low	86 Å²	86	110 Å²	110	89%	0.887	67%	0.665	S	S	*	*			trans	97.1	86.2	165.1	0	0	0	0	0	115.5
442	G	30.2	Very low	31.8	Very low	65 Å²	65	108.8 Å²	108.8	67%	0.67	65%	0.652	S	S	*	*			trans	-146.3	153.2	164.9	0	0	0	0	0	110.7
443	P	34.5	Very low	32.3	Very low	114 Å²	114	111.9 Å²	111.9	74%	0.74	65%	0.653	S	S	*	*			trans	-66.3	144.2	-163.4	-12	26.2	0	0	0	112.9	G445 S446	P443-G445 PolarHBondContact O-N 3.49Å; P443-S446 PolarHBondContact O-N 3.06Å
444	Q	36.5	Very low	32.6	Very low	179 Å²	179	109 Å²	109	84%	0.836	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.3	120.1	170.3	-87.9	-179.9	-11.2	0	0	110.4
445	G	40.5	Very low	32.7	Very low	24 Å²	24	107.1 Å²	107.1	25%	0.247	62%	0.622	C	S	.	*	T	Hydrogen-bonded Turn	trans	108.4	10.6	177.4	0	0	0	0	0	116.7	P443 W447	P443-G445 PolarHBondContact O-N 3.49Å; G445-W447 PolarHBondContact O-N 2.76Å
446	S	38.4	Very low	32.8	Very low	67 Å²	67	107.4 Å²	107.4	47%	0.469	62%	0.62	S	S	.	*			trans	-60.7	125.2	176.6	175.9	0	0	0	0	112.8	P443 A482	P443-S446 PolarHBondContact O-N 3.06Å; S446-A482 VanDerWaalsContact O-CB 3.32Å; S446-A482 WeakPolarHBondContact O-CB 3.47Å; S446-A482 PolarHBondContact O-N 3.43Å
447	W	42.7	Very low	32.6	Very low	120 Å²	120	113.3 Å²	113.3	46%	0.455	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80	125.8	168.8	-70	89.6	0	0	0	109.2	E118 G445 W479	E118-W447 PolarHBondContact OE1-NE1 3Å; G445-W447 PolarHBondContact O-N 2.76Å; W447-W479 HydrophobicContact CB-CE3 3.62Å; W447-W479 HydrophobicContact CB-CZ3 3.96Å; W447-W479 HydrophobicContact CE3-CB 3.75Å; W447-W479 HydrophobicContact CZ3-CB 4.16Å; W447-W479 WeakPolarHBondContact O-CZ3 3.09Å
448	R	34.3	Very low	32.8	Very low	121 Å²	121	115 Å²	115	46%	0.457	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.6	135.2	172.2	60.9	177.8	-165.8	-142.8	4	110.4	L450 V480	R448-L450 HydrophobicContact CG-CD1 4.44Å; R448-L450 HydrophobicContact CG-CG 4.28Å; R448-L450 VanDerWaalsContact NE-CD1 3.3Å; R448-L450 PolarHBondContact O-N 3.09Å; R448-V480 HydrophobicContact CG-CB 4.39Å; R448-V480 VanDerWaalsContact CG-O 3.26Å; R448-V480 WeakPolarHBondContact CG-O 3.45Å; R448-V480 PolarHBondContact N-O 3.31Å; R448-V480 PolarHBondContact O-N 3.34Å
449	F	38.1	Very low	32.8	Very low	120 Å²	120	111.6 Å²	111.6	53%	0.526	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.4	109.9	169.7	-176.2	-96	0	0	0	108	S477 W479	F449-S477 WeakPolarHBondContact CE2-OG 3.27Å; F449-S477 WeakPolarHBondContact CZ-OG 3.33Å; F449-W479 HydrophobicContact CB-CE3 4.33Å; F449-W479 HydrophobicContact CB-CH2 4.43Å; F449-W479 HydrophobicContact CB-CZ3 4.23Å; F449-W479 HydrophobicContact CD2-CZ2 4.39Å
450	L	31.3	Very low	33	Very low	28 Å²	28	113.5 Å²	113.5	15%	0.147	61%	0.611	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.8	119	177.1	-89.2	171.9	0	0	0	110.1	R448 S477 C478 V480	R448-L450 HydrophobicContact CG-CD1 4.44Å; R448-L450 HydrophobicContact CG-CG 4.28Å; R448-L450 VanDerWaalsContact NE-CD1 3.3Å; R448-L450 PolarHBondContact O-N 3.09Å; L450-S477 VanDerWaalsContact O-CA 3.28Å; L450-S477 WeakPolarHBondContact O-CA 3.44Å; L450-C478 PolarHBondContact N-O 2.85Å; L450-C478 PolarHBondContact O-N 3.22Å; L450-C478 VanDerWaalsContact O-N 3.08Å; L450-V480 HydrophobicContact CB-CG2 4.14Å; L450-V480 HydrophobicContact CD1-CB 3.83Å; L450-V480 HydrophobicContact CD1-CG1 4.28Å; L450-V480 HydrophobicContact CD1-CG2 3.63Å; L450-V480 HydrophobicContact CG-CG2 4.36Å
451	Q	33	Very low	33.2	Very low	103 Å²	103	112.5 Å²	112.5	48%	0.481	61%	0.612	S	S	.	*			trans	-72.8	136.5	166.5	-165.4	169	-1.9	0	0	108.6	N453 S454 Q476	Q451-N453 PolarHBondContact O-N 2.94Å; Q451-S454 PolarHBondContact O-N 3.08Å; Q451-S454 VanDerWaalsContact O-N 3.08Å; Q451-Q476 WeakPolarHBondContact CA-O 3.44Å
452	W	35.1	Very low	33.4	Very low	161 Å²	161	113.8 Å²	113.8	61%	0.61	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-54.1	-23.8	-171.5	-177	-97.5	0	0	0	114.2	S454 M455	W452-S454 PolarHBondContact O-N 2.73Å; W452-S454 VanDerWaalsContact O-N 3.1Å; W452-M455 HydrophobicContact CD2-CE 4.43Å; W452-M455 HydrophobicContact CE3-CE 3.5Å; W452-M455 VanDerWaalsContact CE3-CE 3.5Å; W452-M455 HydrophobicContact CH2-CE 4.25Å; W452-M455 HydrophobicContact CZ3-CE 3.39Å
453	N	36.9	Very low	33.3	Very low	136 Å²	136	119.1 Å²	119.1	73%	0.727	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-72.5	1.8	179.8	-58.6	-7.9	0	0	0	114.1	Q451	Q451-N453 PolarHBondContact O-N 2.94Å
454	S	31	Very low	33.2	Very low	80 Å²	80	118 Å²	118	56%	0.559	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-124.4	10.4	-172.9	-48.2	0	0	0	0	114.7	Q451 W452	Q451-S454 PolarHBondContact O-N 3.08Å; Q451-S454 VanDerWaalsContact O-N 3.08Å; W452-S454 PolarHBondContact O-N 2.73Å; W452-S454 VanDerWaalsContact O-N 3.1Å
455	M	29.9	Very low	32.7	Very low	68 Å²	68	119 Å²	119	34%	0.335	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-91.6	131.9	178.5	-86.9	-157.2	-70.3	0	0	113.3	W452	W452-M455 HydrophobicContact CD2-CE 4.43Å; W452-M455 HydrophobicContact CE3-CE 3.5Å; W452-M455 VanDerWaalsContact CE3-CE 3.5Å; W452-M455 HydrophobicContact CH2-CE 4.25Å; W452-M455 HydrophobicContact CZ3-CE 3.39Å
456	P	28.9	Very low	32.2	Very low	117 Å²	117	119.2 Å²	119.2	76%	0.76	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-66.3	143	165.8	26.8	-29.4	0	0	0	110.3	L458	P456-L458 PolarHBondContact O-N 3.01Å
457	R	28.9	Very low	32	Very low	252 Å²	252	119.4 Å²	119.4	95%	0.951	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-53.4	124.2	-173.1	-62.1	-175.3	-174.2	-148.3	2.5	111.4
458	L	30.5	Very low	31.6	Very low	126 Å²	126	118 Å²	118	66%	0.66	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-67.3	150.7	173.4	-84.8	160.2	0	0	0	111	P456	P456-L458 PolarHBondContact O-N 3.01Å
459	P	26.5	Very low	31.6	Very low	91 Å²	91	118 Å²	118	59%	0.591	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-57.8	135.5	-179.5	-21.8	32.1	0	0	0	112.8	D461	P459-D461 PolarHBondContact O-N 2.85Å
460	T	31.2	Very low	31.2	Very low	141 Å²	141	121.4 Å²	121.4	87%	0.865	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	3	-171.4	-14.3	0	0	0	0	115.4	L462	T460-L462 VanDerWaalsContact C-N 3.34Å
461	D	31.7	Very low	31.4	Very low	163 Å²	163	128 Å²	128	87%	0.872	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	5.8	-179.1	-72.1	-22.3	0	0	0	113.7	P459	P459-D461 PolarHBondContact O-N 2.85Å
462	L	30.8	Very low	31.3	Very low	113 Å²	113	125.8 Å²	125.8	59%	0.592	63%	0.633	S	S	*	*	S	Bend	trans	-97.3	103.9	169	-77	165.4	0	0	0	108	T460 V464	T460-L462 VanDerWaalsContact C-N 3.34Å; L462-V464 HydrophobicContact CB-CG2 3.84Å; L462-V464 HydrophobicContact CD2-CG2 4.36Å; L462-V464 PolarHBondContact O-N 3.43Å
463	D	29.5	Very low	31	Very low	177 Å²	177	124 Å²	124	95%	0.947	64%	0.635	S	S	*	*			trans	-63.4	63.4	166	-88.5	-33.5	0	0	0	110.6
464	V	31.6	Very low	30.8	Very low	90 Å²	90	122.6 Å²	122.6	55%	0.545	62%	0.623	S	S	.	*			trans	-115.5	44.4	179.7	-169.6	0	0	0	0	108.4	L462 F469	L462-V464 HydrophobicContact CB-CG2 3.84Å; L462-V464 HydrophobicContact CD2-CG2 4.36Å; L462-V464 PolarHBondContact O-N 3.43Å; V464-F469 HydrophobicContact CG1-CE2 4.28Å; V464-F469 HydrophobicContact CG1-CZ 4.49Å
465	E	25.6	Very low	30.8	Very low	201 Å²	201	126.5 Å²	126.5	94%	0.939	63%	0.625	S	S	*	*			trans	-104.3	62.1	162.2	-71.4	-157.7	158.7	0	0	109.7
466	G	30.2	Very low	31	Very low	29 Å²	29	129.1 Å²	129.1	30%	0.299	64%	0.637	S	S	.	*			trans	-105.4	138.1	175	0	0	0	0	0	112.1	W468	G466-W468 PolarHBondContact O-N 3.25Å
467	P	33.4	Very low	31.2	Very low	70 Å²	70	125.3 Å²	125.3	46%	0.455	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-69.7	14	-173.3	28.6	-35	0	0	0	116.1	F469	P467-F469 VanDerWaalsContact C-N 3.31Å; P467-F469 PolarHBondContact O-N 3.39Å
468	W	35.2	Very low	31.5	Very low	92 Å²	92	115.6 Å²	115.6	35%	0.348	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-73.8	-13.9	-171.7	-70.9	96.5	0	0	0	115.3	Y42 N43 V46 G466 R470	Y42-W468 VanDerWaalsContact C-CH2 3.49Å; Y42-W468 HydrophobicContact CG-CZ2 4.44Å; Y42-W468 WeakPolarHBondContact O-CH2 3.34Å; Y42-W468 VanDerWaalsContact O-CZ2 3.27Å; Y42-W468 WeakPolarHBondContact O-CZ2 3.49Å; N43-W468 VanDerWaalsContact CA-CZ2 3.46Å; N43-W468 HydrophobicContact CB-CH2 4.48Å; N43-W468 HydrophobicContact CB-CZ2 4.42Å; N43-W468 WeakPolarHBondContact OD1-CZ2 3.18Å; V46-W468 HydrophobicContact CB-CH2 3.4Å; V46-W468 VanDerWaalsContact CB-CH2 3.4Å; V46-W468 HydrophobicContact CB-CZ2 4.38Å; V46-W468 HydrophobicContact CB-CZ3 3.63Å; V46-W468 HydrophobicContact CG1-CH2 4.33Å; V46-W468 HydrophobicContact CG1-CZ3 4.2Å; V46-W468 HydrophobicContact CG2-CH2 3.46Å; V46-W468 VanDerWaalsContact CG2-CH2 3.46Å; V46-W468 HydrophobicContact CG2-CZ2 4Å; V46-W468 HydrophobicContact CG2-CZ3 4.16Å; G466-W468 PolarHBondContact O-N 3.25Å; W468-R470 PolarHBondContact O-N 3.16Å
469	F	33.9	Very low	31.9	Very low	120 Å²	120	116.4 Å²	116.4	53%	0.526	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-91.3	9.5	-173.9	-62.9	-79.8	0	0	0	114.5	V464 P467	V464-F469 HydrophobicContact CG1-CE2 4.28Å; V464-F469 HydrophobicContact CG1-CZ 4.49Å; P467-F469 VanDerWaalsContact C-N 3.31Å; P467-F469 PolarHBondContact O-N 3.39Å
470	R	30.8	Very low	32.4	Very low	191 Å²	191	114.1 Å²	114.1	72%	0.721	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-85.9	-16.8	-175.8	-73.9	-168.1	-170.7	178.4	3.9	115.6	W468	W468-R470 PolarHBondContact O-N 3.16Å
471	H	34.9	Very low	32.9	Very low	166 Å²	166	112.6 Å²	112.6	77%	0.769	54%	0.54	S	S	*	.	S	Bend	trans	-115.6	-5	-173.6	-66.9	-57.2	0	0	0	115.5
472	Y	30.9	Very low	33.1	Very low	58 Å²	58	106.5 Å²	106.5	23%	0.227	51%	0.512	C	S	.	.	S	Bend	trans	-117.6	119.9	163.2	-82.2	-86.1	0	0	0	108.5	M104 F474	M104-Y472 HydrophobicContact CE-CD2 4.48Å; M104-Y472 HydrophobicContact CE-CE1 4.18Å; M104-Y472 HydrophobicContact CE-CE2 3.92Å; Y472-F474 PolarHBondContact O-N 3.44Å
473	D	29.7	Very low	33.4	Very low	122 Å²	122	106.3 Å²	106.3	65%	0.652	51%	0.511	S	S	*	.			trans	-72.3	64.9	176.3	-142.8	6.5	0	0	0	110.1	R475	D473-R475 PolarHBondContact O-N 3.1Å; D473-R475 WeakPolarHBondContact OD1-CB 3.24Å
474	F	30.7	Very low	33.6	Very low	108 Å²	108	100.1 Å²	100.1	47%	0.474	48%	0.481	S	S	.	.			trans	-75.2	2.5	161.7	-88.1	-83.1	0	0	0	111.2	N105 Y472 Q476	N105-F474 HydrophobicContact CB-CE1 3.81Å; N105-F474 HydrophobicContact CB-CE2 4.15Å; N105-F474 HydrophobicContact CB-CZ 3.33Å; Y472-F474 PolarHBondContact O-N 3.44Å; F474-Q476 PolarHBondContact O-N 3Å; F474-Q476 VanDerWaalsContact O-N 3.09Å
475	R	31.7	Very low	33.6	Very low	161 Å²	161	103.5 Å²	103.5	61%	0.608	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	4.7	-171.2	-71.8	-171.9	161.8	-149.3	-7.7	116.5	D473	D473-R475 PolarHBondContact O-N 3.1Å; D473-R475 WeakPolarHBondContact OD1-CB 3.24Å
476	Q	33.7	Very low	34	Very low	124 Å²	124	101 Å²	101	58%	0.579	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.5	-10.6	-175.7	-64.4	-163	-1.6	0	0	115.8	Q451 F474	Q451-Q476 WeakPolarHBondContact CA-O 3.44Å; F474-Q476 PolarHBondContact O-N 3Å; F474-Q476 VanDerWaalsContact O-N 3.09Å
477	S	34.3	Very low	34.1	Very low	36 Å²	36	105.3 Å²	105.3	25%	0.252	50%	0.496	S	S	.	.			trans	-173.7	139.5	-178.4	25.3	0	0	0	0	115.7	F449 L450	F449-S477 WeakPolarHBondContact CE2-OG 3.27Å; F449-S477 WeakPolarHBondContact CZ-OG 3.33Å; L450-S477 VanDerWaalsContact O-CA 3.28Å; L450-S477 WeakPolarHBondContact O-CA 3.44Å
478	C	34.8	Very low	34.1	Very low	49 Å²	49	109 Å²	109	33%	0.331	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.5	162.9	61.6	0	0	0	0	109.6	L450 V480	L450-C478 PolarHBondContact N-O 2.85Å; L450-C478 PolarHBondContact O-N 3.22Å; L450-C478 VanDerWaalsContact O-N 3.08Å; C478-V480 VanDerWaalsContact SG-CG2 3.52Å
479	W	38.4	Very low	33.7	Very low	143 Å²	143	111.7 Å²	111.7	54%	0.542	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	120.7	168.9	-74.3	100.8	0	0	0	107.7	W447 F449	W447-W479 HydrophobicContact CB-CE3 3.62Å; W447-W479 HydrophobicContact CB-CZ3 3.96Å; W447-W479 HydrophobicContact CE3-CB 3.75Å; W447-W479 HydrophobicContact CZ3-CB 4.16Å; W447-W479 WeakPolarHBondContact O-CZ3 3.09Å; F449-W479 HydrophobicContact CB-CE3 4.33Å; F449-W479 HydrophobicContact CB-CH2 4.43Å; F449-W479 HydrophobicContact CB-CZ3 4.23Å; F449-W479 HydrophobicContact CD2-CZ2 4.39Å
480	V	38.2	Very low	33.2	Very low	43 Å²	43	110.3 Å²	110.3	26%	0.261	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.4	177.1	-173.6	0	0	0	0	107.5	R448 L450 C478 A482	R448-V480 HydrophobicContact CG-CB 4.39Å; R448-V480 VanDerWaalsContact CG-O 3.26Å; R448-V480 WeakPolarHBondContact CG-O 3.45Å; R448-V480 PolarHBondContact N-O 3.31Å; R448-V480 PolarHBondContact O-N 3.34Å; L450-V480 HydrophobicContact CB-CG2 4.14Å; L450-V480 HydrophobicContact CD1-CB 3.83Å; L450-V480 HydrophobicContact CD1-CG1 4.28Å; L450-V480 HydrophobicContact CD1-CG2 3.63Å; L450-V480 HydrophobicContact CG-CG2 4.36Å; C478-V480 VanDerWaalsContact SG-CG2 3.52Å; V480-A482 PolarHBondContact O-N 3.1Å
481	R	40.2	Very low	32.9	Very low	109 Å²	109	106.3 Å²	106.3	41%	0.411	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	126.3	173.6	-164.9	175.4	-175.3	-163.9	-1.4	109	I483	R481-I483 PolarHBondContact O-N 2.69Å
482	A	37.5	Very low	32.4	Very low	34 Å²	34	103.5 Å²	103.5	28%	0.281	54%	0.535	S	S	.	.			trans	-70.2	111.4	171.1	0	0	0	0	0	108.4	S446 V480	S446-A482 VanDerWaalsContact O-CB 3.32Å; S446-A482 WeakPolarHBondContact O-CB 3.47Å; S446-A482 PolarHBondContact O-N 3.43Å; V480-A482 PolarHBondContact O-N 3.1Å
483	I	35.9	Very low	32	Very low	109 Å²	109	112.9 Å²	112.9	56%	0.559	57%	0.57	S	S	*	*			trans	-75	128.8	172.7	-61.5	174.6	0	0	0	107.2	R481 D487	R481-I483 PolarHBondContact O-N 2.69Å; I483-D487 HydrophobicContact CG2-CB 3.29Å
484	S	33.2	Very low	31.7	Very low	47 Å²	47	115 Å²	115	33%	0.329	58%	0.576	S	S	.	*			trans	-60.3	149.1	176.6	-178	0	0	0	0	110.1	E486 D487	S484-E486 PolarHBondContact O-N 3.03Å; S484-D487 PolarHBondContact O-N 2.94Å
485	Q	33	Very low	31.5	Very low	162 Å²	162	114 Å²	114	76%	0.757	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-60.2	-15.5	178.1	-161.4	171.5	0.6	0	0	112.8
486	E	32.6	Very low	31.1	Very low	149 Å²	149	114.6 Å²	114.6	70%	0.696	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-76.5	-22.1	173.8	-78.3	165.1	147.2	0	0	114.4	S484 Q488	S484-E486 PolarHBondContact O-N 3.03Å; E486-Q488 VanDerWaalsContact C-N 3.32Å
487	D	33.1	Very low	30.9	Very low	118 Å²	118	117.6 Å²	117.6	63%	0.631	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-85.6	-4.4	176.3	-79.1	-29.9	0	0	0	112.5	I483 S484 L489	I483-D487 HydrophobicContact CG2-CB 3.29Å; S484-D487 PolarHBondContact O-N 2.94Å; D487-L489 VanDerWaalsContact C-N 3.28Å
488	Q	32.9	Very low	30.5	Very low	149 Å²	149	121.2 Å²	121.2	70%	0.696	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-84.5	0.1	173.7	-69.3	-173	29.9	0	0	113.3	E486	E486-Q488 VanDerWaalsContact C-N 3.32Å
489	L	26.7	Very low	30	Very low	148 Å²	148	123.3 Å²	123.3	78%	0.775	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-116	25.8	-177.2	-69.4	172.5	0	0	0	113.8	D487 P491	D487-L489 VanDerWaalsContact C-N 3.28Å; L489-P491 WeakPolarHBondContact O-CD 3.23Å
490	A	24.7	Very low	29.4	Very low	90 Å²	90	124.3 Å²	124.3	74%	0.744	67%	0.665	S	S	*	*			trans	-80.8	112.5	163.3	0	0	0	0	0	109.5
491	P	24.2	Very low	28.9	Very low	108 Å²	108	132.8 Å²	132.8	70%	0.701	69%	0.693	S	S	*	*			trans	-82.9	156.5	-163	33.7	-35.3	0	0	0	114	L489	L489-P491 WeakPolarHBondContact O-CD 3.23Å
492	C	23.2	Very low	28.5	Very low	107 Å²	107	133.9 Å²	133.9	72%	0.723	71%	0.711	S	S	*	*			trans	29.5	116	146.4	-65.1	0	0	0	0	119.7
493	W	24	Very low	28	Very low	254 Å²	254	143.3 Å²	143.3	96%	0.962	74%	0.74	S	S	*	*			trans	-117.7	88.8	136.6	-82.6	85.3	0	0	0	108.7
494	Q	23	Very low	27.6	Very low	166 Å²	166	143.7 Å²	143.7	78%	0.776	75%	0.752	S	S	*	*			trans	-78.6	118.9	151.8	-80.7	-177.6	-50.6	0	0	106.7
495	A	26.6	Very low	27.5	Very low	88 Å²	88	145.9 Å²	145.9	73%	0.727	77%	0.773	S	S	*	*			trans	-107	102.6	158.3	0	0	0	0	0	106.8
496	E	23.1	Very low	27.3	Very low	174 Å²	174	148 Å²	148	81%	0.813	78%	0.78	S	S	*	*			trans	-61.9	133.5	167	-65.2	-173.3	148.4	0	0	109.9
497	H	29	Very low	27.1	Very low	186 Å²	186	145.1 Å²	145.1	86%	0.861	78%	0.781	S	S	*	*			trans	-123	131.7	152.3	-98.4	-73	0	0	0	108.3
498	P	26.4	Very low	26.9	Very low	112 Å²	112	144.1 Å²	144.1	73%	0.727	79%	0.789	S	S	*	*			trans	-91.6	147.2	-165.2	35.7	-34.1	0	0	0	113.9
499	A	25	Very low	27	Very low	94 Å²	94	142.5 Å²	142.5	78%	0.777	79%	0.792	S	S	*	*			trans	59.7	136.3	139.8	0	0	0	0	0	122.8
500	E	26	Very low	27.2	Very low	163 Å²	163	140.3 Å²	140.3	76%	0.762	79%	0.789	S	S	*	*			trans	105	121.7	147.6	-65.9	-159.3	160.2	0	0	121.1
501	R	27.1	Very low	27.6	Very low	221 Å²	221	142.2 Å²	142.2	83%	0.834	79%	0.791	S	S	*	*			trans	74.3	120.4	155.4	-71.1	-179.3	-162	-146	2.8	116.2
502	V	31.9	Very low	28	Very low	133 Å²	133	143.7 Å²	143.7	81%	0.806	79%	0.794	S	S	*	*			cis	-155.5	128.8	29.7	172.2	0	0	0	0	108.9
503	R	26	Very low	28.6	Very low	232 Å²	232	143.1 Å²	143.1	88%	0.875	79%	0.791	S	S	*	*			trans	-81.3	145.9	159.2	-74.4	179.4	177.6	173.3	-0.7	108.9
504	S	28.2	Very low	29.2	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	78%	0.778	S	S	*	*				156.6	151.9	111.9	-68.1	0	0	0	0	114.4
505	A	31.6	Very low	29.9	Very low	92 Å²	92	137.5 Å²	137.5	76%	0.76	78%	0.779	S	S	*	*			trans	89.1	88.3	168.5	0	0	0	0	0	115.5
506	F	27.3	Very low	30	Very low	207 Å²	207	136.7 Å²	136.7	91%	0.908	78%	0.779	S	S	*	*				63.7	109	61.2	-84.9	-86.2	0	0	0	116.6
507	A	28.3	Very low	30.5	Very low	88 Å²	88	135.1 Å²	135.1	73%	0.727	78%	0.782	S	S	*	*				68.5	110.2	129.3	0	0	0	0	0	123.6
508	A	29.5	Very low	30.7	Very low	97 Å²	97	131.5 Å²	131.5	80%	0.802	78%	0.775	S	S	*	*				76.6	168.5	127.8	0	0	0	0	0	120.4
509	P	35.2	Very low	30.8	Very low	116 Å²	116	134.8 Å²	134.8	75%	0.753	78%	0.778	S	S	*	*				-131.8	179.8	-86	37.6	-19.2	0	0	0	115.7
510	S	31.3	Very low	30.9	Very low	101 Å²	101	141 Å²	141	71%	0.706	78%	0.781	S	S	*	*			trans	91.4	145.4	151.3	75.1	0	0	0	0	122
511	T	31.8	Very low	30.9	Very low	130 Å²	130	137.9 Å²	137.9	80%	0.798	78%	0.783	S	S	*	*			trans	73.2	135.4	165.3	59	0	0	0	0	116.9
512	D	33.4	Very low	31.1	Very low	140 Å²	140	139 Å²	139	75%	0.749	79%	0.787	S	S	*	*			cis	-167.2	160.8	4.8	-147.8	-18.8	0	0	0	109.3
513	S	35.4	Very low	30.9	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	79%	0.785	S	S	*	*			trans	62.4	139.5	149.1	61.3	0	0	0	0	119.9
514	D	37	Very low	30.9	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	78%	0.78	S	S	*	*			cis	-163.4	152.9	15.3	-134.8	-3.6	0	0	0	113.1
515	Q	38.3	Very low	31	Very low	172 Å²	172	139 Å²	139	80%	0.804	78%	0.78	S	S	*	*			trans	66.3	117.8	150	-70	172.3	42.6	0	0	121.7
516	G	28.1	Very low	31	Very low	70 Å²	70	144 Å²	144	72%	0.722	79%	0.788	S	S	*	*			trans	-115.3	-168.1	175.8	0	0	0	0	0	114.3
517	T	34.2	Very low	30.9	Very low	141 Å²	141	140.8 Å²	140.8	87%	0.865	79%	0.79	S	S	*	*			trans	-167.6	123.9	156.6	-2.6	0	0	0	0	109.2
518	P	33.4	Very low	31.2	Very low	110 Å²	110	141.3 Å²	141.3	71%	0.714	79%	0.793	S	S	*	*			trans	-109.8	129.9	174.5	34.3	-23.3	0	0	0	110.7
519	F	27.8	Very low	31.3	Very low	182 Å²	182	142.5 Å²	142.5	80%	0.798	79%	0.793	S	S	*	*			trans	-158.8	121	162.2	-103.3	-73.8	0	0	0	115.3
520	R	26.9	Very low	31.2	Very low	225 Å²	225	144 Å²	144	85%	0.849	80%	0.801	S	S	*	*			trans	35.5	139.5	139.1	-73.7	-175.6	169	168.2	-4.9	123.6
521	A	27.2	Very low	31.2	Very low	97 Å²	97	145.4 Å²	145.4	80%	0.802	81%	0.81	S	S	*	*			trans	-42.5	142.1	155.9	0	0	0	0	0	115.3
522	R	30.1	Very low	31.2	Very low	244 Å²	244	142.1 Å²	142.1	92%	0.921	80%	0.802	S	S	*	*			trans	-158.8	154.8	151	-112.2	-179.4	-172	175.8	2.5	112.6
523	D	27.7	Very low	31.2	Very low	141 Å²	141	141.7 Å²	141.7	75%	0.754	81%	0.807	S	S	*	*			trans	-66.7	161.1	-162.2	-65.8	-63	0	0	0	119
524	E	26.6	Very low	30.6	Very low	167 Å²	167	142.5 Å²	142.5	78%	0.78	81%	0.811	S	S	*	*			trans	29.7	120	139.4	-64.3	-171.6	119.1	0	0	120.7
525	Q	30.2	Very low	30.2	Very low	173 Å²	173	144.5 Å²	144.5	81%	0.808	82%	0.821	S	S	*	*				144.2	105.4	123.7	-85.3	170.7	-2.3	0	0	111.1
526	Q	31.1	Very low	29.6	Very low	199 Å²	199	142 Å²	142	93%	0.93	82%	0.821	S	S	*	*			trans	176	99.2	131.4	-94.4	154.8	16	0	0	109.8
527	C	26	Very low	29.4	Very low	139 Å²	139	141.5 Å²	141.5	94%	0.939	82%	0.816	S	S	*	*			trans	-111	135.7	165.6	-88.2	0	0	0	0	109.3
528	A	33.5	Very low	29.1	Very low	98 Å²	98	142.8 Å²	142.8	81%	0.81	82%	0.817	S	S	*	*			trans	-133.3	149.3	152.3	0	0	0	0	0	108.5
529	P	31.6	Very low	28.6	Very low	123 Å²	123	146.7 Å²	146.7	80%	0.799	83%	0.825	S	S	*	*			trans	-106.9	142.4	-138.4	36.1	-28.6	0	0	0	113.2
530	T	34.6	Very low	28.6	Very low	148 Å²	148	145.1 Å²	145.1	91%	0.908	82%	0.824	S	S	*	*			trans	-137.8	121.9	153.1	29.7	0	0	0	0	109.8
531	S	29.7	Very low	28.5	Very low	130 Å²	130	142.4 Å²	142.4	91%	0.909	82%	0.821	S	S	*	*			trans	-70.7	122.4	-166.1	49.1	0	0	0	0	113.9
532	G	32.3	Very low	28.4	Very low	60 Å²	60	144.1 Å²	144.1	62%	0.619	83%	0.827	S	S	*	*			trans	-148.5	136.8	160.1	0	0	0	0	0	108.9	C534	G532-C534 PolarHBondContact O-N 3.21Å
533	P	32.9	Very low	28.2	Very low	132 Å²	132	136.7 Å²	136.7	86%	0.857	81%	0.813	S	S	*	*			trans	-75.2	113.7	-167	29.1	-31.5	0	0	0	111.5	L535	P533-L535 PolarHBondContact O-N 3.35Å
534	C	24.2	Very low	28.3	Very low	111 Å²	111	137.7 Å²	137.7	75%	0.75	81%	0.813	S	S	*	*			trans	-65.2	119.9	158.8	-90.4	0	0	0	0	109.5	G532 C536	G532-C534 PolarHBondContact O-N 3.21Å; C534-C536 VanDerWaalsContact C-N 3.3Å; C534-C536 PolarHBondContact O-N 3.28Å
535	L	28.9	Very low	28.5	Very low	172 Å²	172	138.2 Å²	138.2	90%	0.901	81%	0.813	S	S	*	*			trans	-88.5	74.4	162.7	-81.2	165.4	0	0	0	109.2	P533 G537	P533-L535 PolarHBondContact O-N 3.35Å; L535-G537 PolarHBondContact O-N 3.45Å
536	C	24.1	Very low	28.3	Very low	119 Å²	119	135.2 Å²	135.2	80%	0.804	81%	0.809	S	S	*	*			trans	-74.2	99.7	153.1	-42.3	0	0	0	0	106	C534	C534-C536 VanDerWaalsContact C-N 3.3Å; C534-C536 PolarHBondContact O-N 3.28Å
537	G	24.3	Very low	28.1	Very low	60 Å²	60	132 Å²	132	62%	0.619	80%	0.804	S	S	*	*			trans	168.5	58	-178.8	0	0	0	0	0	116.1	L535	L535-G537 PolarHBondContact O-N 3.45Å
538	L	27.3	Very low	28.2	Very low	169 Å²	169	128.6 Å²	128.6	89%	0.885	79%	0.793	S	S	*	*			trans	-144.6	82.9	150.2	-83.8	179.5	0	0	0	108.8
539	H	23.3	Very low	28	Very low	191 Å²	191	137.8 Å²	137.8	88%	0.884	82%	0.815	S	S	*	*			trans	-68.6	115.6	157.5	-127.4	-79.9	0	0	0	107.2
540	L	27.8	Very low	27.8	Very low	149 Å²	149	138.5 Å²	138.5	78%	0.78	82%	0.816	S	S	*	*			trans	-154.8	100.6	156.8	-115.2	123.1	0	0	0	109.1
541	E	24.3	Very low	27.4	Very low	169 Å²	169	138 Å²	138	79%	0.79	81%	0.811	S	S	*	*			trans	20.5	93	158.8	-67.9	177.6	137.6	0	0	118.1
542	S	25.6	Very low	27.3	Very low	133 Å²	133	138.4 Å²	138.4	93%	0.93	81%	0.806	S	S	*	*			trans	-100.2	89.7	151.4	-59	0	0	0	0	107.7
543	S	26.5	Very low	27	Very low	87 Å²	87	143.1 Å²	143.1	61%	0.608	82%	0.817	S	S	*	*			trans	-125	135.3	168.1	48.3	0	0	0	0	109.2
544	Q	29.1	Very low	26.6	Very low	162 Å²	162	143.8 Å²	143.8	76%	0.757	81%	0.814	S	S	*	*			trans	90.4	90.9	174.6	-51.1	178.5	14	0	0	116.5
545	F	31.2	Very low	26.8	Very low	178 Å²	178	145.9 Å²	145.9	78%	0.781	82%	0.819	S	S	*	*				165.5	154.2	106.9	-86.3	-70	0	0	0	110.4
546	P	26.8	Very low	26.6	Very low	111 Å²	111	144.1 Å²	144.1	72%	0.721	81%	0.813	S	S	*	*			trans	-100.9	175.1	-142	10.4	14.1	0	0	0	113.7
547	P	26.7	Very low	26.8	Very low	130 Å²	130	146 Å²	146	84%	0.844	81%	0.814	S	S	*	*			trans	-84.7	144.8	-174.9	34.6	-31.8	0	0	0	112.7
548	G	27.3	Very low	27.1	Very low	68 Å²	68	153.2 Å²	153.2	70%	0.701	83%	0.83	S	S	*	*			trans	116.7	93.6	162.5	0	0	0	0	0	115.1
549	F	28.6	Very low	27	Very low	291 Å²	291	151.7 Å²	151.7	100%	1.276	83%	0.825	S	S	*	*			trans	-175	0	130.4	-106.9	-74.4	0	0	0	110

Retrieved 549 of 549 residues in 320.1 ms (Link to these results)

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