A0A077ZLK0_TRITR Loading...

Protein SMG5

AlphaFold DB , UniProt , Accession A0A077ZLK0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 428 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	52.8	Low	61.3	Low	88 Å²	88	51.4 Å²	51.4	43%	0.433	25%	0.246	S	C	.	.				0	-60.6	0	-72	-50.9	-64.3	0	0	109.3	L3 I4 E5 F34 I37	M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 PolarHBondContact O-N 3.23Å; M1-I4 CarbonylContact O-C 3.57Å; M1-I4 WeakPolarHBondContact O-CA 3.43Å; M1-I4 WeakPolarHBondContact O-CB 3.46Å; M1-I4 PolarHBondContact O-N 2.85Å; M1-E5 PolarHBondContact O-N 2.96Å; M1-F34 HydrophobicContact CE-CE1 4.07Å; M1-I37 HydrophobicContact CG-CD1 3.84Å; M1-I37 HydrophobicContact SD-CD1 3.84Å
2	E	59.8	Low	61.1	Low	130 Å²	130	55.3 Å²	55.3	61%	0.607	26%	0.264	S	S	*	.	H	α-helix	trans	-48	-47.5	176.2	-66.4	176	-176.3	0	0	113.9	I4 E5 L6 H118	E2-I4 VanDerWaalsContact C-N 3.33Å; E2-I4 PolarHBondContact O-N 3.28Å; E2-E5 PolarHBondContact O-N 2.77Å; E2-L6 VanDerWaalsContact O-CB 3.22Å; E2-L6 WeakPolarHBondContact O-CB 3.39Å; E2-L6 PolarHBondContact O-N 3.22Å; E2-H118 IonicContact OE2-CE1 3.58Å; E2-H118 PolarHBondContact OE2-CE1 3.39Å; E2-H118 VanDerWaalsContact OE2-CE1 3.27Å; E2-H118 IonicContact OE2-NE2 2.69Å
3	L	61.2	Low	60.7	Low	9 Å²	9	64.8 Å²	64.8	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-40.5	175.3	-178.6	64.8	0	0	0	112.9	M1 L7 M111 S115 H118 F119	M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 PolarHBondContact O-N 3.23Å; L3-L7 HydrophobicContact CD1-CD1 3.75Å; L3-L7 HydrophobicContact CD1-CG 4.17Å; L3-L7 HydrophobicContact CD2-CD1 4.44Å; L3-L7 HydrophobicContact CG-CD1 3.71Å; L3-L7 HydrophobicContact CG-CG 4.45Å; L3-L7 VanDerWaalsContact O-CB 3.25Å; L3-L7 WeakPolarHBondContact O-CB 3.36Å; L3-L7 WeakPolarHBondContact O-CD1 3.46Å; L3-L7 WeakPolarHBondContact O-CG 3.47Å; L3-L7 PolarHBondContact O-N 3.44Å; L3-M111 HydrophobicContact CD1-CE 3.82Å; L3-S115 WeakPolarHBondContact CD1-O 3.27Å; L3-H118 HydrophobicContact CB-CB 4.14Å; L3-H118 HydrophobicContact CD2-CB 4.32Å; L3-F119 HydrophobicContact CD2-CB 3.84Å; L3-F119 HydrophobicContact CD2-CD2 4.33Å
4	I	62.2	Low	59.7	Low	5 Å²	5	69.1 Å²	69.1	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-70.8	-44.5	-179.4	-63.7	176.1	0	0	0	109.6	M1 E2 L7 Q8 L29 W90	M1-I4 CarbonylContact O-C 3.57Å; M1-I4 WeakPolarHBondContact O-CA 3.43Å; M1-I4 WeakPolarHBondContact O-CB 3.46Å; M1-I4 PolarHBondContact O-N 2.85Å; E2-I4 VanDerWaalsContact C-N 3.33Å; E2-I4 PolarHBondContact O-N 3.28Å; I4-L7 PolarHBondContact O-N 3.42Å; I4-Q8 HydrophobicContact CG2-CG 4.24Å; I4-Q8 VanDerWaalsContact O-CB 3.3Å; I4-Q8 WeakPolarHBondContact O-CB 3.41Å; I4-Q8 WeakPolarHBondContact O-CG 3.46Å; I4-Q8 PolarHBondContact O-N 3.48Å; I4-L29 HydrophobicContact CG2-CD1 3.86Å; I4-L29 HydrophobicContact CG2-CD2 4.23Å; I4-W90 HydrophobicContact CD1-CB 3.84Å; I4-W90 HydrophobicContact CD1-CD2 4.09Å; I4-W90 HydrophobicContact CD1-CE3 4Å; I4-W90 HydrophobicContact CD1-CG 4.04Å
5	E	66.3	Low	58.7	Low	102 Å²	102	65.6 Å²	65.6	48%	0.477	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-43.5	177.7	-71.9	168.8	-175.2	0	0	111.2	M1 E2 Q8 E9	M1-E5 PolarHBondContact O-N 2.96Å; E2-E5 PolarHBondContact O-N 2.77Å; E5-Q8 WeakPolarHBondContact O-CB 3.28Å; E5-Q8 PolarHBondContact O-N 3.39Å; E5-E9 WeakPolarHBondContact O-CB 3.34Å; E5-E9 PolarHBondContact O-N 3.45Å
6	L	66.1	Low	57.5	Low	57 Å²	57	66.5 Å²	66.5	30%	0.298	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-44.6	174.8	-176.4	74.7	0	0	0	111.7	E2 E9 K10 S115	E2-L6 VanDerWaalsContact O-CB 3.22Å; E2-L6 WeakPolarHBondContact O-CB 3.39Å; E2-L6 PolarHBondContact O-N 3.22Å; L6-E9 PolarHBondContact O-N 3.4Å; L6-K10 PolarHBondContact O-N 2.94Å; L6-S115 WeakPolarHBondContact CD2-OG 3.35Å
7	L	61.5	Low	56.4	Low	4 Å²	4	69 Å²	69	2%	0.021	34%	0.339	C	S	.	.	H	α-helix	trans	-70.2	-34	179	-70.3	169.8	0	0	0	111.8	L3 I4 A11 I97 L101 M111	L3-L7 HydrophobicContact CD1-CD1 3.75Å; L3-L7 HydrophobicContact CD1-CG 4.17Å; L3-L7 HydrophobicContact CD2-CD1 4.44Å; L3-L7 HydrophobicContact CG-CD1 3.71Å; L3-L7 HydrophobicContact CG-CG 4.45Å; L3-L7 VanDerWaalsContact O-CB 3.25Å; L3-L7 WeakPolarHBondContact O-CB 3.36Å; L3-L7 WeakPolarHBondContact O-CD1 3.46Å; L3-L7 WeakPolarHBondContact O-CG 3.47Å; L3-L7 PolarHBondContact O-N 3.44Å; I4-L7 PolarHBondContact O-N 3.42Å; L7-A11 WeakPolarHBondContact O-CB 3.44Å; L7-A11 PolarHBondContact O-N 3.05Å; L7-I97 HydrophobicContact CB-CD1 4.17Å; L7-I97 HydrophobicContact CB-CG2 3.69Å; L7-I97 HydrophobicContact CD1-CG2 3.52Å; L7-I97 HydrophobicContact CD2-CG2 4.11Å; L7-I97 HydrophobicContact CG-CG2 3.95Å; L7-L101 HydrophobicContact CD1-CD1 4.49Å; L7-L101 HydrophobicContact CD2-CD1 3.9Å; L7-L101 HydrophobicContact CD2-CD2 4.15Å; L7-L101 HydrophobicContact CD2-CG 4.41Å; L7-M111 HydrophobicContact CD2-CE 3.94Å; L7-M111 HydrophobicContact CD2-SD 3.89Å
8	Q	63	Low	55.7	Low	48 Å²	48	72.1 Å²	72.1	22%	0.224	36%	0.363	C	S	.	.	H	α-helix	trans	-64.9	-43.3	170.5	-78.6	-179.4	-67.7	0	0	111.3	I4 E5 A11 H12 I25 L29	I4-Q8 HydrophobicContact CG2-CG 4.24Å; I4-Q8 VanDerWaalsContact O-CB 3.3Å; I4-Q8 WeakPolarHBondContact O-CB 3.41Å; I4-Q8 WeakPolarHBondContact O-CG 3.46Å; I4-Q8 PolarHBondContact O-N 3.48Å; E5-Q8 WeakPolarHBondContact O-CB 3.28Å; E5-Q8 PolarHBondContact O-N 3.39Å; Q8-A11 PolarHBondContact O-N 3.32Å; Q8-H12 WeakPolarHBondContact O-CB 3.19Å; Q8-H12 PolarHBondContact O-N 3.45Å; Q8-I25 HydrophobicContact CG-CG2 3.83Å; Q8-L29 VanDerWaalsContact CD-CD1 3.43Å; Q8-L29 HydrophobicContact CG-CD1 4.32Å
9	E	65.9	Low	55.7	Low	96 Å²	96	72.1 Å²	72.1	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-62.9	-46.9	178.2	-168.2	-169.7	162.6	0	0	110.7	E5 L6 H12 R13	E5-E9 WeakPolarHBondContact O-CB 3.34Å; E5-E9 PolarHBondContact O-N 3.45Å; L6-E9 PolarHBondContact O-N 3.4Å; E9-H12 PolarHBondContact O-N 2.84Å; E9-R13 WeakPolarHBondContact O-CG 3.42Å; E9-R13 PolarHBondContact O-N 3.25Å; E9-R13 IonicContact OE1-CZ 4Å; E9-R13 IonicContact OE1-NE 3.19Å; E9-R13 IonicContact OE1-NH2 3.76Å; E9-R13 PolarHBondContact OE1-NH2 3.17Å; E9-R13 IonicContact OE2-NH2 2.95Å
10	K	61.6	Low	55.8	Low	22 Å²	22	70.1 Å²	70.1	10%	0.096	36%	0.362	C	S	.	.	H	α-helix	trans	-61.6	-47	175	-77.5	-174.4	163.9	-128.4	0	112.3	L6 H12 R13 Y14 E107 D110	L6-K10 PolarHBondContact O-N 2.94Å; K10-H12 VanDerWaalsContact C-N 3.26Å; K10-H12 PolarHBondContact O-N 3.46Å; K10-R13 PolarHBondContact O-N 3.42Å; K10-R13 VanDerWaalsContact O-N 3.16Å; K10-Y14 PolarHBondContact O-N 2.96Å; K10-E107 PolarHBondContact NZ-O 3.11Å; K10-E107 IonicContact NZ-OE2 2.68Å; K10-D110 PolarHBondContact NZ-O 3.39Å
11	A	54	Low	56	Low	4 Å²	4	66.9 Å²	66.9	3%	0.033	35%	0.345	C	S	.	.	H	α-helix	trans	-59.5	-38.8	175.1	0	0	0	0	0	111.7	L7 Q8 Y14 C15 F21	L7-A11 WeakPolarHBondContact O-CB 3.44Å; L7-A11 PolarHBondContact O-N 3.05Å; Q8-A11 PolarHBondContact O-N 3.32Å; A11-Y14 PolarHBondContact O-N 3.44Å; A11-C15 WeakPolarHBondContact O-CB 3.24Å; A11-C15 PolarHBondContact O-N 3.42Å; A11-C15 PolarHBondContact O-SG 2.96Å; A11-F21 HydrophobicContact CB-CD1 4.13Å; A11-F21 HydrophobicContact CB-CE1 3.82Å
12	H	59.2	Low	56.4	Low	99 Å²	99	64 Å²	64	46%	0.458	33%	0.333	S	S	.	.	H	α-helix	trans	-69.9	-31.9	177.8	-166.3	1.2	0	0	0	112.8	Q8 E9 K10 Y14 T22	Q8-H12 WeakPolarHBondContact O-CB 3.19Å; Q8-H12 PolarHBondContact O-N 3.45Å; E9-H12 PolarHBondContact O-N 2.84Å; K10-H12 VanDerWaalsContact C-N 3.26Å; K10-H12 PolarHBondContact O-N 3.46Å; H12-Y14 VanDerWaalsContact C-N 3.34Å; H12-T22 HydrophobicContact CB-CG2 4.4Å
13	R	55.9	Low	56.6	Low	179 Å²	179	61.8 Å²	61.8	68%	0.675	33%	0.325	S	S	*	.	H	α-helix	trans	-68.3	-34.3	174.1	-70.5	-176.4	-151.7	173.9	6.1	112.4	E9 K10	E9-R13 WeakPolarHBondContact O-CG 3.42Å; E9-R13 PolarHBondContact O-N 3.25Å; E9-R13 IonicContact OE1-CZ 4Å; E9-R13 IonicContact OE1-NE 3.19Å; E9-R13 IonicContact OE1-NH2 3.76Å; E9-R13 PolarHBondContact OE1-NH2 3.17Å; E9-R13 IonicContact OE2-NH2 2.95Å; K10-R13 PolarHBondContact O-N 3.42Å; K10-R13 VanDerWaalsContact O-N 3.16Å
14	Y	46.5	Very low	56.8	Low	125 Å²	125	62.8 Å²	62.8	49%	0.49	33%	0.329	S	S	.	.	H	α-helix	trans	-83.4	-33.9	179.3	-110.2	-99.7	0	0	0	113.4	K10 A11 H12 S16 W100 E107	K10-Y14 PolarHBondContact O-N 2.96Å; A11-Y14 PolarHBondContact O-N 3.44Å; H12-Y14 VanDerWaalsContact C-N 3.34Å; Y14-S16 PolarHBondContact O-N 3.15Å; Y14-W100 HydrophobicContact CG-CZ2 4.37Å; Y14-E107 HydrophobicContact CD2-CG 4.36Å; Y14-E107 VanDerWaalsContact CD2-OE1 3.29Å; Y14-E107 WeakPolarHBondContact CD2-OE1 3.24Å; Y14-E107 HydrophobicContact CE2-CG 4.25Å; Y14-E107 WeakPolarHBondContact CE2-OE1 3.5Å
15	C	44.2	Very low	57	Low	16 Å²	16	62.8 Å²	62.8	11%	0.108	33%	0.329	C	S	.	.	S	Bend	trans	-84.4	104.5	174.7	-65.7	0	0	0	0	108.5	A11 D19	A11-C15 WeakPolarHBondContact O-CB 3.24Å; A11-C15 PolarHBondContact O-N 3.42Å; A11-C15 PolarHBondContact O-SG 2.96Å; C15-D19 HydrophobicContact CB-CB 3.91Å
16	S	40.5	Very low	56.9	Low	80 Å²	80	59.9 Å²	59.9	56%	0.559	32%	0.321	S	S	*	.			trans	-37.3	145.1	165.6	14.7	0	0	0	0	111.3	Y14 T18 D19	Y14-S16 PolarHBondContact O-N 3.15Å; S16-T18 PolarHBondContact O-N 3.47Å; S16-D19 PolarHBondContact O-N 2.87Å; S16-D19 PolarHBondContact OG-OD2 3.14Å
17	S	38	Very low	56.9	Low	109 Å²	109	65.5 Å²	65.5	76%	0.762	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	21.2	-161.5	66.5	0	0	0	0	118.3
18	T	44.7	Very low	57.2	Low	124 Å²	124	66.4 Å²	66.4	76%	0.761	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.9	15.2	175.4	34.5	0	0	0	0	114.1	S16	S16-T18 PolarHBondContact O-N 3.47Å
19	D	54.7	Low	57.3	Low	73 Å²	73	64.6 Å²	64.6	39%	0.39	33%	0.334	S	S	.	.			trans	-80.8	138.3	-175.7	-88	-44.9	0	0	0	114.2	C15 S16 F21 T22	C15-D19 HydrophobicContact CB-CB 3.91Å; S16-D19 PolarHBondContact O-N 2.87Å; S16-D19 PolarHBondContact OG-OD2 3.14Å; D19-F21 PolarHBondContact O-N 2.74Å; D19-T22 PolarHBondContact O-N 3.5Å
20	G	57.2	Low	56.8	Low	32 Å²	32	67 Å²	67	33%	0.33	35%	0.347	S	S	.	.	H	α-helix	trans	-55.4	-24.2	-174.7	0	0	0	0	0	114.4	I23 I24	G20-I23 PolarHBondContact O-N 3.38Å; G20-I24 WeakPolarHBondContact O-CB 3.21Å; G20-I24 WeakPolarHBondContact O-CD1 3.33Å; G20-I24 WeakPolarHBondContact O-CG1 3.44Å; G20-I24 PolarHBondContact O-N 3.37Å
21	F	61.1	Low	56.4	Low	2 Å²	2	71 Å²	71	1%	0.009	37%	0.374	C	S	.	.	H	α-helix	trans	-62.7	-52.5	-177.1	-169.9	-104.3	0	0	0	112.3	A11 D19 I23 I24 I25 V96 W100 V169 I172 L173	A11-F21 HydrophobicContact CB-CD1 4.13Å; A11-F21 HydrophobicContact CB-CE1 3.82Å; D19-F21 PolarHBondContact O-N 2.74Å; F21-I23 VanDerWaalsContact C-N 3.28Å; F21-I23 PolarHBondContact O-N 2.95Å; F21-I24 PolarHBondContact O-N 2.83Å; F21-I24 VanDerWaalsContact O-N 3.15Å; F21-I25 HydrophobicContact CD1-CG1 4.34Å; F21-I25 HydrophobicContact CE1-CG1 4.01Å; F21-I25 HydrophobicContact CZ-CD1 4.34Å; F21-I25 HydrophobicContact CZ-CG1 4.13Å; F21-I25 WeakPolarHBondContact O-CG1 3.28Å; F21-I25 PolarHBondContact O-N 2.9Å; F21-V96 HydrophobicContact CE2-CG1 3.56Å; F21-V96 HydrophobicContact CZ-CG1 3.95Å; F21-W100 HydrophobicContact CE1-CB 4.42Å; F21-W100 HydrophobicContact CE1-CG 4.15Å; F21-W100 HydrophobicContact CE2-CB 4.18Å; F21-W100 HydrophobicContact CE2-CG 4.43Å; F21-W100 HydrophobicContact CZ-CB 3.65Å; F21-W100 AromaticContact CZ-CG 3.82Å; F21-W100 HydrophobicContact CZ-CG 3.82Å; F21-V169 HydrophobicContact CD2-CG1 4.47Å; F21-I172 HydrophobicContact CB-CD1 4.09Å; F21-I172 HydrophobicContact CB-CG2 4.08Å; F21-I172 HydrophobicContact CD2-CG2 3.97Å; F21-I172 HydrophobicContact CG-CG2 4.4Å; F21-L173 HydrophobicContact CD2-CD2 4.26Å; F21-L173 HydrophobicContact CE2-CD1 4.16Å; F21-L173 HydrophobicContact CE2-CD2 3.88Å; F21-L173 HydrophobicContact CE2-CG 4.26Å
22	T	61.5	Low	55.8	Low	29 Å²	29	73.3 Å²	73.3	18%	0.178	39%	0.386	C	S	.	.	H	α-helix	trans	-63.3	-36.8	179.3	-51.9	0	0	0	0	111.3	H12 D19 S26	H12-T22 HydrophobicContact CB-CG2 4.4Å; D19-T22 PolarHBondContact O-N 3.5Å; T22-S26 WeakPolarHBondContact O-CB 3.15Å; T22-S26 PolarHBondContact O-N 3.08Å; T22-S26 PolarHBondContact O-OG 3.39Å
23	I	62.3	Low	54.7	Low	83 Å²	83	74.6 Å²	74.6	43%	0.426	40%	0.396	S	S	.	.	H	α-helix	trans	-65.4	-43.2	175.8	-63.1	174.5	0	0	0	110.3	G20 F21 R27	G20-I23 PolarHBondContact O-N 3.38Å; F21-I23 VanDerWaalsContact C-N 3.28Å; F21-I23 PolarHBondContact O-N 2.95Å; I23-R27 HydrophobicContact CG2-CG 4.48Å; I23-R27 VanDerWaalsContact O-CB 3.32Å; I23-R27 WeakPolarHBondContact O-CB 2.9Å; I23-R27 VanDerWaalsContact O-CG 3.25Å; I23-R27 WeakPolarHBondContact O-CG 3.38Å; I23-R27 PolarHBondContact O-N 3.33Å
24	I	66.3	Low	53.9	Low	29 Å²	29	71.3 Å²	71.3	15%	0.149	39%	0.386	C	S	.	.	H	α-helix	trans	-66.7	-47.6	179.5	-69.7	158	0	0	0	110.8	G20 F21 S26 R27 M28 C168 V169 I172	G20-I24 WeakPolarHBondContact O-CB 3.21Å; G20-I24 WeakPolarHBondContact O-CD1 3.33Å; G20-I24 WeakPolarHBondContact O-CG1 3.44Å; G20-I24 PolarHBondContact O-N 3.37Å; F21-I24 PolarHBondContact O-N 2.83Å; F21-I24 VanDerWaalsContact O-N 3.15Å; I24-S26 PolarHBondContact O-N 3.41Å; I24-R27 PolarHBondContact O-N 2.98Å; I24-M28 HydrophobicContact CG2-CE 3.52Å; I24-M28 HydrophobicContact CG2-CG 4.5Å; I24-M28 HydrophobicContact CG2-SD 4.16Å; I24-M28 WeakPolarHBondContact O-CG 3.4Å; I24-M28 PolarHBondContact O-N 2.83Å; I24-C168 WeakPolarHBondContact CD1-O 3.38Å; I24-C168 HydrophobicContact CG2-CB 3.98Å; I24-V169 HydrophobicContact CB-CG1 4.5Å; I24-V169 HydrophobicContact CD1-CG1 4.16Å; I24-V169 HydrophobicContact CG2-CG1 3.8Å; I24-I172 HydrophobicContact CD1-CD1 3.5Å; I24-I172 VanDerWaalsContact CD1-CD1 3.5Å
25	I	65.5	Low	53.2	Low	5 Å²	5	69.1 Å²	69.1	3%	0.026	38%	0.383	C	S	.	.	H	α-helix	trans	-61.4	-46.3	176.8	-65.4	-62.5	0	0	0	110.5	Q8 F21 R27 M28 L29 A93 V96 I97	Q8-I25 HydrophobicContact CG-CG2 3.83Å; F21-I25 HydrophobicContact CD1-CG1 4.34Å; F21-I25 HydrophobicContact CE1-CG1 4.01Å; F21-I25 HydrophobicContact CZ-CD1 4.34Å; F21-I25 HydrophobicContact CZ-CG1 4.13Å; F21-I25 WeakPolarHBondContact O-CG1 3.28Å; F21-I25 PolarHBondContact O-N 2.9Å; I25-R27 VanDerWaalsContact C-N 3.31Å; I25-R27 PolarHBondContact O-N 3.08Å; I25-M28 PolarHBondContact O-N 3.17Å; I25-L29 HydrophobicContact CG2-CD1 3.8Å; I25-L29 WeakPolarHBondContact O-CG 3.49Å; I25-L29 PolarHBondContact O-N 3.14Å; I25-A93 HydrophobicContact CD1-CB 4.42Å; I25-V96 HydrophobicContact CD1-CB 3.82Å; I25-V96 HydrophobicContact CD1-CG1 3.54Å; I25-I97 HydrophobicContact CD1-CG1 4.13Å
26	S	65.4	Low	52.8	Low	42 Å²	42	72.5 Å²	72.5	29%	0.294	40%	0.4	S	S	.	.	H	α-helix	trans	-58.8	-43	176.1	-62.1	0	0	0	0	111.5	T22 I24 L29 M30	T22-S26 WeakPolarHBondContact O-CB 3.15Å; T22-S26 PolarHBondContact O-N 3.08Å; T22-S26 PolarHBondContact O-OG 3.39Å; I24-S26 PolarHBondContact O-N 3.41Å; S26-L29 PolarHBondContact O-N 3.21Å; S26-M30 VanDerWaalsContact O-CB 3.22Å; S26-M30 WeakPolarHBondContact O-CB 3.36Å; S26-M30 WeakPolarHBondContact O-CG 3.12Å; S26-M30 PolarHBondContact O-N 3.31Å
27	R	66.3	Low	52.4	Low	174 Å²	174	73.1 Å²	73.1	66%	0.657	40%	0.396	S	S	*	.	H	α-helix	trans	-63.7	-42.5	175.9	-79.8	177.8	177.2	-179	0.7	112.7	I23 I24 I25 L29 M30 T31	I23-R27 HydrophobicContact CG2-CG 4.48Å; I23-R27 VanDerWaalsContact O-CB 3.32Å; I23-R27 WeakPolarHBondContact O-CB 2.9Å; I23-R27 VanDerWaalsContact O-CG 3.25Å; I23-R27 WeakPolarHBondContact O-CG 3.38Å; I23-R27 PolarHBondContact O-N 3.33Å; I24-R27 PolarHBondContact O-N 2.98Å; I25-R27 VanDerWaalsContact C-N 3.31Å; I25-R27 PolarHBondContact O-N 3.08Å; R27-L29 PolarHBondContact O-N 3Å; R27-M30 PolarHBondContact O-N 2.87Å; R27-T31 WeakPolarHBondContact O-CG2 3.19Å; R27-T31 PolarHBondContact O-N 3.31Å; R27-T31 VanDerWaalsContact O-N 3.09Å; R27-T31 PolarHBondContact O-OG1 3.39Å
28	M	68.5	Low	51.9	Low	23 Å²	23	69.9 Å²	69.9	11%	0.113	38%	0.38	C	S	.	.	H	α-helix	trans	-61.8	-31.2	176.4	-72.6	176.6	179.4	0	0	112.3	I24 I25 T31 K92 A93 V96 E165 C168	I24-M28 HydrophobicContact CG2-CE 3.52Å; I24-M28 HydrophobicContact CG2-CG 4.5Å; I24-M28 HydrophobicContact CG2-SD 4.16Å; I24-M28 WeakPolarHBondContact O-CG 3.4Å; I24-M28 PolarHBondContact O-N 2.83Å; I25-M28 PolarHBondContact O-N 3.17Å; M28-T31 PolarHBondContact O-OG1 3.42Å; M28-K92 HydrophobicContact SD-CB 4.45Å; M28-A93 HydrophobicContact CB-CB 4.37Å; M28-V96 HydrophobicContact CE-CG2 4.22Å; M28-V96 HydrophobicContact SD-CG2 4.2Å; M28-E165 HydrophobicContact CE-CB 3.48Å; M28-E165 VanDerWaalsContact CE-CB 3.48Å; M28-E165 HydrophobicContact SD-CB 4.27Å; M28-C168 HydrophobicContact CE-CB 4.01Å
29	L	64.6	Low	51.3	Low	10 Å²	10	70 Å²	70	5%	0.052	37%	0.37	C	S	.	.	H	α-helix	trans	-86	-32.8	177.7	-66.2	167.3	0	0	0	112.3	I4 Q8 I25 S26 R27 T31 F34 W90 A93	I4-L29 HydrophobicContact CG2-CD1 3.86Å; I4-L29 HydrophobicContact CG2-CD2 4.23Å; Q8-L29 VanDerWaalsContact CD-CD1 3.43Å; Q8-L29 HydrophobicContact CG-CD1 4.32Å; I25-L29 HydrophobicContact CG2-CD1 3.8Å; I25-L29 WeakPolarHBondContact O-CG 3.49Å; I25-L29 PolarHBondContact O-N 3.14Å; S26-L29 PolarHBondContact O-N 3.21Å; R27-L29 PolarHBondContact O-N 3Å; L29-T31 VanDerWaalsContact C-N 3.34Å; L29-F34 HydrophobicContact CB-CZ 4.06Å; L29-F34 VanDerWaalsContact O-CE2 3.23Å; L29-F34 WeakPolarHBondContact O-CE2 3.35Å; L29-F34 WeakPolarHBondContact O-CZ 3.24Å; L29-W90 HydrophobicContact CD2-CB 3.87Å; L29-A93 HydrophobicContact CD2-CB 3.89Å; L29-A93 HydrophobicContact CG-CB 4.06Å
30	M	55.7	Low	50.2	Low	146 Å²	146	69.1 Å²	69.1	72%	0.719	36%	0.362	S	S	*	.	H	α-helix	trans	-75.5	-17.5	178.6	-70.2	-99.2	174.3	0	0	113.8	S26 R27 D32	S26-M30 VanDerWaalsContact O-CB 3.22Å; S26-M30 WeakPolarHBondContact O-CB 3.36Å; S26-M30 WeakPolarHBondContact O-CG 3.12Å; S26-M30 PolarHBondContact O-N 3.31Å; R27-M30 PolarHBondContact O-N 2.87Å; M30-D32 PolarHBondContact O-N 2.99Å
31	T	51.4	Low	49	Very low	108 Å²	108	72 Å²	72	66%	0.663	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-8.5	174.4	39.9	0	0	0	0	113.8	R27 M28 L29	R27-T31 WeakPolarHBondContact O-CG2 3.19Å; R27-T31 PolarHBondContact O-N 3.31Å; R27-T31 VanDerWaalsContact O-N 3.09Å; R27-T31 PolarHBondContact O-OG1 3.39Å; M28-T31 PolarHBondContact O-OG1 3.42Å; L29-T31 VanDerWaalsContact C-N 3.34Å
32	D	42.8	Very low	47.4	Very low	52 Å²	52	74.8 Å²	74.8	28%	0.278	41%	0.407	S	S	.	.	S	Bend	trans	-107.8	130	171.6	-74.7	-4.7	0	0	0	110.9	M30 F34 S89	M30-D32 PolarHBondContact O-N 2.99Å; D32-F34 WeakPolarHBondContact O-CD2 3.29Å; D32-F34 PolarHBondContact O-N 2.54Å; D32-S89 WeakPolarHBondContact OD2-CB 3.35Å; D32-S89 PolarHBondContact OD2-OG 2.86Å
33	D	35.5	Very low	46	Very low	126 Å²	126	78.3 Å²	78.3	67%	0.674	43%	0.433	S	S	*	.			trans	-50.6	103.2	155.1	-107.5	-26.4	0	0	0	107.6	D35 L36	D33-D35 HydrophobicContact CB-CB 4.36Å; D33-D35 PolarHBondContact O-N 3.16Å; D33-L36 PolarHBondContact O-N 3.28Å
34	F	38.4	Very low	44.5	Very low	109 Å²	109	83.1 Å²	83.1	48%	0.478	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-6.2	175.4	-81.7	-86	0	0	0	113.5	M1 L29 D32 L36	M1-F34 HydrophobicContact CE-CE1 4.07Å; L29-F34 HydrophobicContact CB-CZ 4.06Å; L29-F34 VanDerWaalsContact O-CE2 3.23Å; L29-F34 WeakPolarHBondContact O-CE2 3.35Å; L29-F34 WeakPolarHBondContact O-CZ 3.24Å; D32-F34 WeakPolarHBondContact O-CD2 3.29Å; D32-F34 PolarHBondContact O-N 2.54Å; F34-L36 PolarHBondContact O-N 2.87Å
35	D	33.6	Very low	42.9	Very low	79 Å²	79	87 Å²	87	42%	0.422	46%	0.462	S	S	.	.	H	α-helix	trans	-64.1	-10.7	167.5	-120.4	-1.9	0	0	0	114.1	D33 G38 K39	D33-D35 HydrophobicContact CB-CB 4.36Å; D33-D35 PolarHBondContact O-N 3.16Å; D35-G38 PolarHBondContact O-N 2.89Å; D35-K39 HydrophobicContact CB-CD 4.06Å; D35-K39 HydrophobicContact CB-CG 4.44Å; D35-K39 WeakPolarHBondContact O-CA 3.49Å; D35-K39 WeakPolarHBondContact O-CB 3.35Å; D35-K39 WeakPolarHBondContact O-CG 3.45Å; D35-K39 PolarHBondContact O-N 2.87Å; D35-K39 WeakPolarHBondContact OD2-CE 3.5Å; D35-K39 IonicContact OD2-NZ 3.53Å; D35-K39 PolarHBondContact OD2-NZ 3.48Å
36	L	34	Very low	41.3	Very low	87 Å²	87	90 Å²	90	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-68.3	-37.2	175.5	-97.5	128.6	0	0	0	112.2	D33 F34 F40	D33-L36 PolarHBondContact O-N 3.28Å; F34-L36 PolarHBondContact O-N 2.87Å; L36-F40 HydrophobicContact CB-CE2 4.46Å; L36-F40 HydrophobicContact CD2-CE2 4.19Å; L36-F40 VanDerWaalsContact O-CB 3.26Å; L36-F40 WeakPolarHBondContact O-CB 3.25Å; L36-F40 WeakPolarHBondContact O-CD2 3.46Å; L36-F40 VanDerWaalsContact O-CG 3.24Å; L36-F40 WeakPolarHBondContact O-CG 3.48Å; L36-F40 PolarHBondContact O-N 3.4Å
37	I	33	Very low	39.8	Very low	94 Å²	94	95.5 Å²	95.5	48%	0.482	51%	0.506	S	S	.	.	H	α-helix	trans	-72.4	-28.2	177.2	-58	176.5	0	0	0	111.8	M1	M1-I37 HydrophobicContact CG-CD1 3.84Å; M1-I37 HydrophobicContact SD-CD1 3.84Å
38	G	28.3	Very low	38.4	Very low	41 Å²	41	89.4 Å²	89.4	42%	0.423	49%	0.488	S	S	.	.	H	α-helix	trans	-81.9	-41.8	171.9	0	0	0	0	0	114.9	D35 F40 S41	D35-G38 PolarHBondContact O-N 2.89Å; G38-F40 PolarHBondContact O-N 3.18Å; G38-S41 VanDerWaalsContact O-CB 3.25Å; G38-S41 WeakPolarHBondContact O-CB 3.47Å; G38-S41 PolarHBondContact O-N 3.12Å; G38-S41 VanDerWaalsContact O-N 3.1Å; G38-S41 PolarHBondContact O-OG 3.31Å
39	K	30.8	Very low	36.9	Very low	127 Å²	127	91.5 Å²	91.5	55%	0.552	51%	0.505	S	S	*	.	H	α-helix	trans	-75.1	-8.7	174	-69.5	172.5	179.6	152.1	0	113.2	D35 S41	D35-K39 HydrophobicContact CB-CD 4.06Å; D35-K39 HydrophobicContact CB-CG 4.44Å; D35-K39 WeakPolarHBondContact O-CA 3.49Å; D35-K39 WeakPolarHBondContact O-CB 3.35Å; D35-K39 WeakPolarHBondContact O-CG 3.45Å; D35-K39 PolarHBondContact O-N 2.87Å; D35-K39 WeakPolarHBondContact OD2-CE 3.5Å; D35-K39 IonicContact OD2-NZ 3.53Å; D35-K39 PolarHBondContact OD2-NZ 3.48Å; K39-S41 PolarHBondContact O-N 2.86Å
40	F	32	Very low	35.9	Very low	53 Å²	53	97.3 Å²	97.3	23%	0.232	53%	0.531	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.7	163.2	-96.3	-55.2	0	0	0	111.1	L36 G38 G42 R44 K45 V48	L36-F40 HydrophobicContact CB-CE2 4.46Å; L36-F40 HydrophobicContact CD2-CE2 4.19Å; L36-F40 VanDerWaalsContact O-CB 3.26Å; L36-F40 WeakPolarHBondContact O-CB 3.25Å; L36-F40 WeakPolarHBondContact O-CD2 3.46Å; L36-F40 VanDerWaalsContact O-CG 3.24Å; L36-F40 WeakPolarHBondContact O-CG 3.48Å; L36-F40 PolarHBondContact O-N 3.4Å; G38-F40 PolarHBondContact O-N 3.18Å; F40-G42 PolarHBondContact O-N 3.47Å; F40-R44 HydrophobicContact CD1-CB 4.37Å; F40-R44 HydrophobicContact CE1-CB 4.38Å; F40-K45 HydrophobicContact CB-CD 4.24Å; F40-K45 HydrophobicContact CB-CG 3.84Å; F40-K45 HydrophobicContact CD1-CG 4.19Å; F40-K45 HydrophobicContact CG-CG 4.39Å; F40-K45 WeakPolarHBondContact O-CB 3.35Å; F40-K45 WeakPolarHBondContact O-CD 3.5Å; F40-K45 WeakPolarHBondContact O-CE 3.31Å; F40-K45 WeakPolarHBondContact O-CG 3.48Å; F40-K45 PolarHBondContact O-N 3.36Å; F40-V48 HydrophobicContact CE1-CB 3.85Å; F40-V48 HydrophobicContact CE1-CG1 4.39Å; F40-V48 HydrophobicContact CE1-CG2 3.67Å; F40-V48 HydrophobicContact CZ-CB 4.4Å; F40-V48 HydrophobicContact CZ-CG2 4.07Å
41	S	31.5	Very low	35.2	Very low	92 Å²	92	93 Å²	93	64%	0.643	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.6	-175.3	64.8	0	0	0	0	119.1	G38 K39	G38-S41 VanDerWaalsContact O-CB 3.25Å; G38-S41 WeakPolarHBondContact O-CB 3.47Å; G38-S41 PolarHBondContact O-N 3.12Å; G38-S41 VanDerWaalsContact O-N 3.1Å; G38-S41 PolarHBondContact O-OG 3.31Å; K39-S41 PolarHBondContact O-N 2.86Å
42	G	28.5	Very low	34.7	Very low	62 Å²	62	90 Å²	90	64%	0.639	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-20.9	-166	0	0	0	0	0	119.9	F40	F40-G42 PolarHBondContact O-N 3.47Å
43	S	31.1	Very low	34.8	Very low	103 Å²	103	90.8 Å²	90.8	72%	0.72	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-173.5	-24.4	-179.8	-97.5	0	0	0	0	113.8
44	R	30.9	Very low	35	Very low	184 Å²	184	85.8 Å²	85.8	69%	0.694	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-22.7	176.7	-64.4	-174.2	-152.9	178.9	7.5	113.7	F40 A46 K47 V48	F40-R44 HydrophobicContact CD1-CB 4.37Å; F40-R44 HydrophobicContact CE1-CB 4.38Å; R44-A46 VanDerWaalsContact C-N 3.28Å; R44-A46 PolarHBondContact O-N 3.35Å; R44-K47 PolarHBondContact O-N 3.2Å; R44-V48 PolarHBondContact O-N 2.57Å
45	K	32.1	Very low	35.2	Very low	111 Å²	111	82.9 Å²	82.9	48%	0.483	47%	0.469	S	S	.	.	H	α-helix	trans	-52.9	-49.3	170.3	-107.7	167.5	-158.2	-173.7	0	110.4	F40 K47 V48 S49	F40-K45 HydrophobicContact CB-CD 4.24Å; F40-K45 HydrophobicContact CB-CG 3.84Å; F40-K45 HydrophobicContact CD1-CG 4.19Å; F40-K45 HydrophobicContact CG-CG 4.39Å; F40-K45 WeakPolarHBondContact O-CB 3.35Å; F40-K45 WeakPolarHBondContact O-CD 3.5Å; F40-K45 WeakPolarHBondContact O-CE 3.31Å; F40-K45 WeakPolarHBondContact O-CG 3.48Å; F40-K45 PolarHBondContact O-N 3.36Å; K45-K47 PolarHBondContact O-N 3.03Å; K45-K47 VanDerWaalsContact O-N 3.16Å; K45-V48 PolarHBondContact O-N 3.07Å; K45-S49 WeakPolarHBondContact O-CB 3.23Å; K45-S49 PolarHBondContact O-N 3.4Å; K45-S49 PolarHBondContact O-OG 3.09Å
46	A	31.9	Very low	35.5	Very low	67 Å²	67	81.1 Å²	81.1	55%	0.554	47%	0.47	S	S	*	.	H	α-helix	trans	-60	-28	179	0	0	0	0	0	112.5	R44 H50	R44-A46 VanDerWaalsContact C-N 3.28Å; R44-A46 PolarHBondContact O-N 3.35Å; A46-H50 WeakPolarHBondContact O-CB 3.15Å; A46-H50 PolarHBondContact O-N 3.15Å
47	K	35.2	Very low	35.9	Very low	157 Å²	157	83.1 Å²	83.1	68%	0.683	48%	0.482	S	S	*	.	H	α-helix	trans	-84.8	-41.6	-178.5	-140.1	169.8	-172	173.5	0	112.3	R44 K45 L51	R44-K47 PolarHBondContact O-N 3.2Å; K45-K47 PolarHBondContact O-N 3.03Å; K45-K47 VanDerWaalsContact O-N 3.16Å; K47-L51 VanDerWaalsContact O-CB 3.28Å; K47-L51 WeakPolarHBondContact O-CB 3.49Å; K47-L51 VanDerWaalsContact O-CD1 3.28Å; K47-L51 WeakPolarHBondContact O-CD1 3.41Å; K47-L51 WeakPolarHBondContact O-CG 3.46Å; K47-L51 PolarHBondContact O-N 3.38Å
48	V	36.4	Very low	36.3	Very low	47 Å²	47	81.5 Å²	81.5	29%	0.285	47%	0.473	S	S	.	.	H	α-helix	trans	-80	-41.1	179.1	176.9	0	0	0	0	111.5	F40 R44 K45 H50 L51 L52	F40-V48 HydrophobicContact CE1-CB 3.85Å; F40-V48 HydrophobicContact CE1-CG1 4.39Å; F40-V48 HydrophobicContact CE1-CG2 3.67Å; F40-V48 HydrophobicContact CZ-CB 4.4Å; F40-V48 HydrophobicContact CZ-CG2 4.07Å; R44-V48 PolarHBondContact O-N 2.57Å; K45-V48 PolarHBondContact O-N 3.07Å; V48-H50 VanDerWaalsContact C-N 3.33Å; V48-H50 PolarHBondContact O-N 3.25Å; V48-L51 PolarHBondContact O-N 3.16Å; V48-L52 HydrophobicContact CG1-CD1 3.79Å; V48-L52 HydrophobicContact CG1-CG 4.26Å; V48-L52 WeakPolarHBondContact O-CB 3.18Å; V48-L52 VanDerWaalsContact O-CG 3.24Å; V48-L52 WeakPolarHBondContact O-CG 3.44Å; V48-L52 PolarHBondContact O-N 3.34Å
49	S	37.2	Very low	36.9	Very low	67 Å²	67	86 Å²	86	47%	0.469	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-41	174.3	73.7	0	0	0	0	111.4	K45 L52 S53	K45-S49 WeakPolarHBondContact O-CB 3.23Å; K45-S49 PolarHBondContact O-N 3.4Å; K45-S49 PolarHBondContact O-OG 3.09Å; S49-L52 PolarHBondContact O-N 2.68Å; S49-S53 VanDerWaalsContact O-CB 3.31Å; S49-S53 WeakPolarHBondContact O-CB 3.33Å; S49-S53 PolarHBondContact O-N 2.91Å; S49-S53 PolarHBondContact O-OG 3.29Å
50	H	42.4	Very low	37.2	Very low	132 Å²	132	83.8 Å²	83.8	61%	0.611	50%	0.498	S	S	*	.	H	α-helix	trans	-71.7	-26.9	176.5	-165.1	-60.2	0	0	0	112.9	A46 V48 S53 A54	A46-H50 WeakPolarHBondContact O-CB 3.15Å; A46-H50 PolarHBondContact O-N 3.15Å; V48-H50 VanDerWaalsContact C-N 3.33Å; V48-H50 PolarHBondContact O-N 3.25Å; H50-S53 WeakPolarHBondContact CA-OG 3.18Å; H50-A54 WeakPolarHBondContact O-CB 3.28Å; H50-A54 PolarHBondContact O-N 2.82Å
51	L	41.2	Very low	37.4	Very low	55 Å²	55	90.4 Å²	90.4	29%	0.288	53%	0.527	S	S	.	.	H	α-helix	trans	-76.4	-31.8	171.7	-76.7	169.2	0	0	0	112.3	K47 V48 R80	K47-L51 VanDerWaalsContact O-CB 3.28Å; K47-L51 WeakPolarHBondContact O-CB 3.49Å; K47-L51 VanDerWaalsContact O-CD1 3.28Å; K47-L51 WeakPolarHBondContact O-CD1 3.41Å; K47-L51 WeakPolarHBondContact O-CG 3.46Å; K47-L51 PolarHBondContact O-N 3.38Å; V48-L51 PolarHBondContact O-N 3.16Å; L51-R80 HydrophobicContact CD2-CB 4.23Å
52	L	41.6	Very low	37.8	Very low	44 Å²	44	92.2 Å²	92.2	23%	0.23	53%	0.527	C	S	.	.	H	α-helix	trans	-80.1	-33	177.2	-68.7	172.4	0	0	0	112.5	V48 S49 K81 L125	V48-L52 HydrophobicContact CG1-CD1 3.79Å; V48-L52 HydrophobicContact CG1-CG 4.26Å; V48-L52 WeakPolarHBondContact O-CB 3.18Å; V48-L52 VanDerWaalsContact O-CG 3.24Å; V48-L52 WeakPolarHBondContact O-CG 3.44Å; V48-L52 PolarHBondContact O-N 3.34Å; S49-L52 PolarHBondContact O-N 2.68Å; L52-K81 HydrophobicContact CD2-CG 4.18Å; L52-L125 HydrophobicContact CB-CD2 4.29Å
53	S	44.6	Very low	38.1	Very low	69 Å²	69	95.7 Å²	95.7	48%	0.483	54%	0.535	S	S	.	.	H	α-helix	trans	-86.3	-22.5	178.7	64.5	0	0	0	0	114.4	S49 H50 S55 G56	S49-S53 VanDerWaalsContact O-CB 3.31Å; S49-S53 WeakPolarHBondContact O-CB 3.33Å; S49-S53 PolarHBondContact O-N 2.91Å; S49-S53 PolarHBondContact O-OG 3.29Å; H50-S53 WeakPolarHBondContact CA-OG 3.18Å; S53-S55 PolarHBondContact O-N 3.3Å; S53-S55 VanDerWaalsContact O-N 3.16Å; S53-G56 PolarHBondContact O-N 3.5Å
54	A	41.2	Very low	38.7	Very low	22 Å²	22	98.4 Å²	98.4	18%	0.182	54%	0.542	C	S	.	.	G	3₁₀ helix	trans	-65.3	-16.5	-178.6	0	0	0	0	0	114.9	H50 G56 M77	H50-A54 WeakPolarHBondContact O-CB 3.28Å; H50-A54 PolarHBondContact O-N 2.82Å; A54-G56 VanDerWaalsContact C-N 3.3Å; A54-G56 PolarHBondContact O-N 2.93Å; A54-M77 HydrophobicContact CB-CE 4.35Å; A54-M77 HydrophobicContact CB-SD 4.1Å
55	S	40.8	Very low	39.2	Very low	47 Å²	47	97.6 Å²	97.6	33%	0.329	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-69.9	-23.6	178	168.3	0	0	0	0	112.7	S53 E131	S53-S55 PolarHBondContact O-N 3.3Å; S53-S55 VanDerWaalsContact O-N 3.16Å; S55-E131 PolarHBondContact OG-OE1 2.78Å
56	G	40.3	Very low	40	Very low	43 Å²	43	98.3 Å²	98.3	44%	0.443	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-88.9	-13.6	-176.7	0	0	0	0	0	117.2	S53 A54	S53-G56 PolarHBondContact O-N 3.5Å; A54-G56 VanDerWaalsContact C-N 3.3Å; A54-G56 PolarHBondContact O-N 2.93Å
57	N	42.2	Very low	40.9	Very low	129 Å²	129	100.2 Å²	100.2	69%	0.69	56%	0.561	S	S	*	*	S	Bend	trans	-111.2	3	-165.1	-75.4	-14	0	0	0	115.4	T59	N57-T59 VanDerWaalsContact C-N 3.34Å
58	I	41.6	Very low	42	Very low	59 Å²	59	97.1 Å²	97.1	30%	0.303	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-80	-14.8	-176.5	-66.6	-168.4	0	0	0	113.1	A60 L70 M77	I58-A60 VanDerWaalsContact C-N 3.33Å; I58-A60 PolarHBondContact O-N 3.36Å; I58-L70 HydrophobicContact CG2-CD1 4.16Å; I58-L70 HydrophobicContact CG2-CG 4.36Å; I58-M77 HydrophobicContact CD1-CE 3.16Å; I58-M77 HydrophobicContact CD1-SD 3.96Å; I58-M77 HydrophobicContact CG1-CE 4.15Å
59	T	41.6	Very low	43.3	Very low	135 Å²	135	98.5 Å²	98.5	83%	0.828	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-77.1	-7.4	-175.9	41.3	0	0	0	0	115.5	N57	N57-T59 VanDerWaalsContact C-N 3.34Å
60	A	36.4	Very low	44.3	Very low	81 Å²	81	98.8 Å²	98.8	67%	0.669	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-120.9	-5.1	-170.7	0	0	0	0	0	117.1	I58	I58-A60 VanDerWaalsContact C-N 3.33Å; I58-A60 PolarHBondContact O-N 3.36Å
61	K	37.7	Very low	45.2	Very low	193 Å²	193	93.5 Å²	93.5	84%	0.839	53%	0.534	S	S	*	.	S	Bend	trans	-133.1	9.1	-168.4	-85.7	-171	176.8	179.1	0	118.7
62	M	38.2	Very low	46.5	Very low	129 Å²	129	95.7 Å²	95.7	64%	0.635	54%	0.541	S	S	*	.			trans	-141.3	48.4	179.7	-64.7	-174.1	94.4	0	0	114	D64	M62-D64 PolarHBondContact O-N 2.93Å
63	V	36	Very low	47.8	Very low	136 Å²	136	97.4 Å²	97.4	82%	0.824	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	44.3	-178.7	-172.5	0	0	0	0	112.6
64	D	43.6	Very low	48.8	Very low	159 Å²	159	95.7 Å²	95.7	85%	0.85	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.3	17.6	-178.6	-123.3	-8.4	0	0	0	116.5	M62	M62-D64 PolarHBondContact O-N 2.93Å
65	K	41	Very low	50.4	Low	167 Å²	167	95.4 Å²	95.4	73%	0.726	54%	0.539	S	S	*	.	S	Bend	trans	-138.7	137.7	177	-73.9	-174.6	176.6	175	0	113.1
66	N	48.5	Very low	52.1	Low	126 Å²	126	96.5 Å²	96.5	67%	0.674	54%	0.544	S	S	*	.			trans	-26.7	124	-178.9	-79.1	-19.8	0	0	0	115.4	N68 D69 L70	N66-N68 PolarHBondContact O-N 2.94Å; N66-D69 PolarHBondContact O-N 3.46Å; N66-L70 PolarHBondContact O-N 2.96Å
67	S	51.3	Low	53.8	Low	107 Å²	107	96.4 Å²	96.4	75%	0.748	53%	0.532	S	S	*	.	H	α-helix	trans	-45	-37.9	178.8	171.2	0	0	0	0	114.3	D69 L70 A71	S67-D69 PolarHBondContact O-N 3.45Å; S67-L70 PolarHBondContact O-N 3.09Å; S67-A71 PolarHBondContact O-N 2.81Å; S67-A71 VanDerWaalsContact O-N 3.15Å
68	N	59.5	Low	55.7	Low	93 Å²	93	90.7 Å²	90.7	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-68.2	-32.1	-179.4	-161.8	4.2	0	0	0	113.4	N66 K72	N66-N68 PolarHBondContact O-N 2.94Å; N68-K72 VanDerWaalsContact O-CG 3.27Å; N68-K72 WeakPolarHBondContact O-CG 3.25Å; N68-K72 PolarHBondContact O-N 2.92Å; N68-K72 VanDerWaalsContact O-N 3.16Å
69	D	62.2	Low	57.6	Low	76 Å²	76	88.9 Å²	88.9	41%	0.406	49%	0.494	S	S	.	.	H	α-helix	trans	-77.8	-34.7	179.1	-69	-27	0	0	0	111.6	N66 S67 K72 V73	N66-D69 PolarHBondContact O-N 3.46Å; S67-D69 PolarHBondContact O-N 3.45Å; D69-K72 PolarHBondContact O-N 2.76Å; D69-K72 IonicContact OD1-NZ 2.68Å; D69-K72 PolarHBondContact OD1-NZ 3.5Å; D69-V73 WeakPolarHBondContact O-CG2 3.33Å; D69-V73 PolarHBondContact O-N 3.49Å
70	L	59	Low	59.6	Low	72 Å²	72	88.8 Å²	88.8	38%	0.377	48%	0.479	S	S	.	.	H	α-helix	trans	-62.8	-44.5	174.1	-154.1	76.7	0	0	0	111.1	I58 N66 S67 K72 V73 A74	I58-L70 HydrophobicContact CG2-CD1 4.16Å; I58-L70 HydrophobicContact CG2-CG 4.36Å; N66-L70 PolarHBondContact O-N 2.96Å; S67-L70 PolarHBondContact O-N 3.09Å; L70-K72 PolarHBondContact O-N 3.03Å; L70-V73 PolarHBondContact O-N 3.05Å; L70-A74 WeakPolarHBondContact O-CB 3.4Å; L70-A74 PolarHBondContact O-N 3.17Å
71	A	61.2	Low	61.9	Low	22 Å²	22	85.3 Å²	85.3	18%	0.182	45%	0.449	C	S	.	.	H	α-helix	trans	-65.2	-36.6	177.3	0	0	0	0	0	112.7	S67 C75	S67-A71 PolarHBondContact O-N 2.81Å; S67-A71 VanDerWaalsContact O-N 3.15Å; A71-C75 VanDerWaalsContact O-CB 3.25Å; A71-C75 WeakPolarHBondContact O-CB 3.49Å; A71-C75 PolarHBondContact O-N 2.82Å
72	K	67.7	Low	64.3	Low	101 Å²	101	76.1 Å²	76.1	44%	0.439	41%	0.409	S	S	.	.	H	α-helix	trans	-63.9	-45.8	172.3	-73.5	170.2	-163.9	161.5	0	111.7	N68 D69 L70 C75 V76	N68-K72 VanDerWaalsContact O-CG 3.27Å; N68-K72 WeakPolarHBondContact O-CG 3.25Å; N68-K72 PolarHBondContact O-N 2.92Å; N68-K72 VanDerWaalsContact O-N 3.16Å; D69-K72 PolarHBondContact O-N 2.76Å; D69-K72 IonicContact OD1-NZ 2.68Å; D69-K72 PolarHBondContact OD1-NZ 3.5Å; L70-K72 PolarHBondContact O-N 3.03Å; K72-C75 PolarHBondContact O-N 3.14Å; K72-V76 WeakPolarHBondContact O-CG2 3.31Å; K72-V76 PolarHBondContact O-N 3.41Å
73	V	69.1	Low	66.6	Low	79 Å²	79	76.4 Å²	76.4	48%	0.479	40%	0.403	S	S	.	.	H	α-helix	trans	-62.2	-46.3	178.6	171.7	0	0	0	0	110.6	D69 L70 C75 V76 M77	D69-V73 WeakPolarHBondContact O-CG2 3.33Å; D69-V73 PolarHBondContact O-N 3.49Å; L70-V73 PolarHBondContact O-N 3.05Å; V73-C75 PolarHBondContact O-N 3.32Å; V73-V76 PolarHBondContact O-N 2.65Å; V73-M77 WeakPolarHBondContact O-CG 3.47Å; V73-M77 PolarHBondContact O-N 3.43Å
74	A	66	Low	68.9	Low	33 Å²	33	71.3 Å²	71.3	27%	0.273	38%	0.375	S	S	.	.	H	α-helix	trans	-56.6	-51.1	174.3	0	0	0	0	0	111.1	L70 V76 M77 V78	L70-A74 WeakPolarHBondContact O-CB 3.4Å; L70-A74 PolarHBondContact O-N 3.17Å; A74-V76 VanDerWaalsContact C-N 3.28Å; A74-V76 PolarHBondContact O-N 2.83Å; A74-M77 WeakPolarHBondContact O-CB 3.45Å; A74-M77 PolarHBondContact O-N 2.6Å; A74-V78 WeakPolarHBondContact O-CG2 3.33Å; A74-V78 PolarHBondContact O-N 2.74Å
75	C	74.2	Confident	71	Confident	16 Å²	16	64.4 Å²	64.4	11%	0.108	34%	0.338	C	S	.	.	H	α-helix	trans	-56.7	-38.9	177.3	-176.5	0	0	0	0	113	A71 K72 V73 S79	A71-C75 VanDerWaalsContact O-CB 3.25Å; A71-C75 WeakPolarHBondContact O-CB 3.49Å; A71-C75 PolarHBondContact O-N 2.82Å; K72-C75 PolarHBondContact O-N 3.14Å; V73-C75 PolarHBondContact O-N 3.32Å; C75-S79 VanDerWaalsContact O-CB 3.25Å; C75-S79 WeakPolarHBondContact O-CB 3.39Å; C75-S79 PolarHBondContact O-N 3.47Å; C75-S79 PolarHBondContact O-OG 2.94Å
76	V	77.7	Confident	73.2	Confident	70 Å²	70	58.5 Å²	58.5	42%	0.424	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-41.1	175.6	169.5	0	0	0	0	111.2	K72 V73 A74 S79 R80	K72-V76 WeakPolarHBondContact O-CG2 3.31Å; K72-V76 PolarHBondContact O-N 3.41Å; V73-V76 PolarHBondContact O-N 2.65Å; A74-V76 VanDerWaalsContact C-N 3.28Å; A74-V76 PolarHBondContact O-N 2.83Å; V76-S79 PolarHBondContact O-N 2.67Å; V76-R80 WeakPolarHBondContact O-CG 3.42Å; V76-R80 PolarHBondContact O-N 3.42Å
77	M	76.5	Confident	74.9	Confident	42 Å²	42	59.5 Å²	59.5	21%	0.207	31%	0.314	C	S	.	.	H	α-helix	trans	-66.3	-46.9	176.9	-65.3	-153.6	-46.3	0	0	112	A54 I58 V73 A74 S79 R80 K81	A54-M77 HydrophobicContact CB-CE 4.35Å; A54-M77 HydrophobicContact CB-SD 4.1Å; I58-M77 HydrophobicContact CD1-CE 3.16Å; I58-M77 HydrophobicContact CD1-SD 3.96Å; I58-M77 HydrophobicContact CG1-CE 4.15Å; V73-M77 WeakPolarHBondContact O-CG 3.47Å; V73-M77 PolarHBondContact O-N 3.43Å; A74-M77 WeakPolarHBondContact O-CB 3.45Å; A74-M77 PolarHBondContact O-N 2.6Å; M77-S79 VanDerWaalsContact C-N 3.27Å; M77-S79 PolarHBondContact O-N 3.22Å; M77-R80 WeakPolarHBondContact O-CA 3.38Å; M77-R80 WeakPolarHBondContact O-CB 3.48Å; M77-R80 PolarHBondContact O-N 3.46Å; M77-K81 PolarHBondContact O-N 3.34Å
78	V	80.4	Confident	76.4	Confident	8 Å²	8	56.2 Å²	56.2	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-36.7	177.5	-169.3	0	0	0	0	110.2	A74 R80 K81 L82 P127 E131 I135	A74-V78 WeakPolarHBondContact O-CG2 3.33Å; A74-V78 PolarHBondContact O-N 2.74Å; V78-R80 VanDerWaalsContact C-N 3.3Å; V78-R80 PolarHBondContact O-N 3.22Å; V78-K81 CarbonylContact O-C 3.6Å; V78-K81 WeakPolarHBondContact O-CB 3.2Å; V78-K81 PolarHBondContact O-N 3.29Å; V78-K81 VanDerWaalsContact O-N 3.15Å; V78-L82 PolarHBondContact O-N 3.11Å; V78-P127 HydrophobicContact CG1-CB 3.85Å; V78-P127 HydrophobicContact CG1-CG 4.03Å; V78-E131 HydrophobicContact CG1-CB 3.84Å; V78-E131 HydrophobicContact CG1-CG 4.43Å; V78-E131 HydrophobicContact CG2-CB 3.96Å; V78-E131 HydrophobicContact CG2-CG 3.74Å; V78-I135 HydrophobicContact CB-CD1 3.66Å; V78-I135 HydrophobicContact CB-CG1 4.18Å; V78-I135 HydrophobicContact CG1-CD1 3.21Å; V78-I135 HydrophobicContact CG1-CG1 4.04Å
79	S	82.7	Confident	77.2	Confident	21 Å²	21	52.4 Å²	52.4	15%	0.147	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-31.4	173.1	-62.8	0	0	0	0	113.1	C75 V76 M77 R83	C75-S79 VanDerWaalsContact O-CB 3.25Å; C75-S79 WeakPolarHBondContact O-CB 3.39Å; C75-S79 PolarHBondContact O-N 3.47Å; C75-S79 PolarHBondContact O-OG 2.94Å; V76-S79 PolarHBondContact O-N 2.67Å; M77-S79 VanDerWaalsContact C-N 3.27Å; M77-S79 PolarHBondContact O-N 3.22Å; S79-R83 PolarHBondContact O-N 3.16Å; S79-R83 PolarHBondContact O-NE 2.95Å
80	R	82.8	Confident	78.2	Confident	133 Å²	133	52 Å²	52	50%	0.502	26%	0.263	S	S	.	.	H	α-helix	trans	-71	-40.9	170.8	-74.3	173.4	174.4	166.7	-0.1	111.2	L51 V76 M77 V78 R83 A84	L51-R80 HydrophobicContact CD2-CB 4.23Å; V76-R80 WeakPolarHBondContact O-CG 3.42Å; V76-R80 PolarHBondContact O-N 3.42Å; M77-R80 WeakPolarHBondContact O-CA 3.38Å; M77-R80 WeakPolarHBondContact O-CB 3.48Å; M77-R80 PolarHBondContact O-N 3.46Å; V78-R80 VanDerWaalsContact C-N 3.3Å; V78-R80 PolarHBondContact O-N 3.22Å; R80-R83 PolarHBondContact O-N 2.92Å; R80-A84 PolarHBondContact O-N 2.94Å
81	K	85	Confident	79.6	Confident	8 Å²	8	48.7 Å²	48.7	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-46.5	174.6	-173.1	176.1	177.7	-174.9	0	111.1	L52 M77 V78 R83 A84 L85 L125 L126 P127	L52-K81 HydrophobicContact CD2-CG 4.18Å; M77-K81 PolarHBondContact O-N 3.34Å; V78-K81 CarbonylContact O-C 3.6Å; V78-K81 WeakPolarHBondContact O-CB 3.2Å; V78-K81 PolarHBondContact O-N 3.29Å; V78-K81 VanDerWaalsContact O-N 3.15Å; K81-R83 PolarHBondContact O-N 3.45Å; K81-A84 PolarHBondContact O-N 3.01Å; K81-A84 VanDerWaalsContact O-N 3.16Å; K81-L85 HydrophobicContact CG-CD1 4.15Å; K81-L85 WeakPolarHBondContact O-CG 3.44Å; K81-L85 PolarHBondContact O-N 3.22Å; K81-L125 WeakPolarHBondContact CE-O 3.45Å; K81-L125 PolarHBondContact NZ-O 3.45Å; K81-L126 PolarHBondContact NZ-O 2.86Å; K81-P127 HydrophobicContact CD-CG 4.24Å; K81-P127 HydrophobicContact CG-CG 4.46Å
82	L	88	Confident	80.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-44.7	175.5	-175	63.8	0	0	0	112.2	V78 A84 L85 Q86 I142 T189 C192 F193 I196	V78-L82 PolarHBondContact O-N 3.11Å; L82-A84 VanDerWaalsContact C-N 3.34Å; L82-A84 PolarHBondContact O-N 2.86Å; L82-L85 PolarHBondContact O-N 3.14Å; L82-Q86 PolarHBondContact O-N 3.17Å; L82-I142 HydrophobicContact CD2-CD1 3.88Å; L82-T189 HydrophobicContact CD2-CG2 3.61Å; L82-T189 HydrophobicContact CG-CG2 4.09Å; L82-C192 HydrophobicContact CD1-CB 4.23Å; L82-F193 HydrophobicContact CD1-CB 4.38Å; L82-F193 HydrophobicContact CD2-CB 4.48Å; L82-F193 HydrophobicContact CD2-CD2 4.33Å; L82-I196 HydrophobicContact CD1-CD1 3.47Å; L82-I196 VanDerWaalsContact CD1-CD1 3.47Å
83	R	85.9	Confident	81.8	Confident	135 Å²	135	45.5 Å²	45.5	51%	0.509	23%	0.227	S	C	.	.	H	α-helix	trans	-63.6	-37.6	174.9	-78.2	-179	-69.9	-151.2	-3.3	113	S79 R80 K81 Q86	S79-R83 PolarHBondContact O-N 3.16Å; S79-R83 PolarHBondContact O-NE 2.95Å; R80-R83 PolarHBondContact O-N 2.92Å; K81-R83 PolarHBondContact O-N 3.45Å; R83-Q86 WeakPolarHBondContact O-CB 3.46Å; R83-Q86 PolarHBondContact O-N 2.98Å
84	A	84.6	Confident	82.7	Confident	29 Å²	29	41.8 Å²	41.8	24%	0.24	20%	0.204	C	C	.	.	H	α-helix	trans	-67.1	-42.9	175.9	0	0	0	0	0	111.4	R80 K81 L82 Q86 E87 V88	R80-A84 PolarHBondContact O-N 2.94Å; K81-A84 PolarHBondContact O-N 3.01Å; K81-A84 VanDerWaalsContact O-N 3.16Å; L82-A84 VanDerWaalsContact C-N 3.34Å; L82-A84 PolarHBondContact O-N 2.86Å; A84-Q86 VanDerWaalsContact C-N 3.26Å; A84-Q86 PolarHBondContact O-N 3.13Å; A84-E87 PolarHBondContact O-N 2.62Å; A84-V88 WeakPolarHBondContact O-CG2 3.36Å
85	L	88	Confident	83.9	Confident	14 Å²	14	40.2 Å²	40.2	7%	0.073	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-28.6	176.2	-69.1	169.4	0	0	0	112.3	K81 L82 E87 V88 L91 L126 P127 I196	K81-L85 HydrophobicContact CG-CD1 4.15Å; K81-L85 WeakPolarHBondContact O-CG 3.44Å; K81-L85 PolarHBondContact O-N 3.22Å; L82-L85 PolarHBondContact O-N 3.14Å; L85-E87 PolarHBondContact O-N 3.37Å; L85-V88 WeakPolarHBondContact O-CB 3.32Å; L85-V88 PolarHBondContact O-N 3.05Å; L85-V88 VanDerWaalsContact O-N 3.07Å; L85-L91 HydrophobicContact CB-CD1 3.87Å; L85-L91 HydrophobicContact CD2-CD1 4.03Å; L85-L91 VanDerWaalsContact O-CD1 3.26Å; L85-L91 WeakPolarHBondContact O-CD1 3.5Å; L85-L126 HydrophobicContact CD1-CD2 4.09Å; L85-L126 HydrophobicContact CD2-CD2 4.11Å; L85-P127 HydrophobicContact CD1-CG 4.27Å; L85-I196 HydrophobicContact CD1-CD1 3.9Å
86	Q	87.1	Confident	84.5	Confident	43 Å²	43	39.4 Å²	39.4	20%	0.201	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-34.7	175.7	-163.5	-169.7	-62.7	0	0	112.9	L82 R83 A84 V88 E188 T189 C192	L82-Q86 PolarHBondContact O-N 3.17Å; R83-Q86 WeakPolarHBondContact O-CB 3.46Å; R83-Q86 PolarHBondContact O-N 2.98Å; A84-Q86 VanDerWaalsContact C-N 3.26Å; A84-Q86 PolarHBondContact O-N 3.13Å; Q86-V88 PolarHBondContact O-N 3.32Å; Q86-E188 HydrophobicContact CG-CB 4.14Å; Q86-E188 HydrophobicContact CG-CG 3.44Å; Q86-E188 VanDerWaalsContact CG-CG 3.44Å; Q86-T189 PolarHBondContact OE1-OG1 3.26Å; Q86-C192 HydrophobicContact CB-CB 4.4Å; Q86-C192 HydrophobicContact CG-CB 4.29Å
87	E	83.5	Confident	84.8	Confident	147 Å²	147	36.3 Å²	36.3	69%	0.687	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	1.5	-180	-57.4	-60.7	140.9	0	0	112.8	A84 L85	A84-E87 PolarHBondContact O-N 2.62Å; L85-E87 PolarHBondContact O-N 3.37Å
88	V	82.6	Confident	85.4	Confident	37 Å²	37	34.3 Å²	34.3	22%	0.224	16%	0.158	C	C	.	.			trans	-99.6	93.3	-176.2	-177.9	0	0	0	0	109.1	A84 L85 Q86 W90 L91	A84-V88 WeakPolarHBondContact O-CG2 3.36Å; L85-V88 WeakPolarHBondContact O-CB 3.32Å; L85-V88 PolarHBondContact O-N 3.05Å; L85-V88 VanDerWaalsContact O-N 3.07Å; Q86-V88 PolarHBondContact O-N 3.32Å; V88-W90 HydrophobicContact CG1-CD2 3.74Å; V88-W90 HydrophobicContact CG1-CG 3.72Å; V88-W90 HydrophobicContact CG1-CZ2 3.77Å; V88-W90 PolarHBondContact O-N 3.1Å; V88-L91 HydrophobicContact CB-CD1 4.04Å; V88-L91 HydrophobicContact CB-CG 4.26Å; V88-L91 HydrophobicContact CG1-CD1 4.34Å; V88-L91 HydrophobicContact CG1-CG 4.05Å; V88-L91 WeakPolarHBondContact O-CB 3.39Å; V88-L91 PolarHBondContact O-N 3.29Å
89	S	77.3	Confident	85.7	Confident	14 Å²	14	34 Å²	34	10%	0.098	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.7	-176	71.8	0	0	0	0	113	D32 L91 K92	D32-S89 WeakPolarHBondContact OD2-CB 3.35Å; D32-S89 PolarHBondContact OD2-OG 2.86Å; S89-L91 PolarHBondContact O-N 3.43Å; S89-K92 VanDerWaalsContact O-CB 3.28Å; S89-K92 WeakPolarHBondContact O-CB 3.42Å; S89-K92 PolarHBondContact O-N 2.95Å
90	W	83.4	Confident	85.7	Confident	68 Å²	68	33.4 Å²	33.4	26%	0.258	15%	0.15	S	C	.	.	H	α-helix	trans	-62.7	-19.5	-177	70.6	-110.2	0	0	0	112.9	I4 L29 V88 K92 A93 L94 L122	I4-W90 HydrophobicContact CD1-CB 3.84Å; I4-W90 HydrophobicContact CD1-CD2 4.09Å; I4-W90 HydrophobicContact CD1-CE3 4Å; I4-W90 HydrophobicContact CD1-CG 4.04Å; L29-W90 HydrophobicContact CD2-CB 3.87Å; V88-W90 HydrophobicContact CG1-CD2 3.74Å; V88-W90 HydrophobicContact CG1-CG 3.72Å; V88-W90 HydrophobicContact CG1-CZ2 3.77Å; V88-W90 PolarHBondContact O-N 3.1Å; W90-K92 PolarHBondContact O-N 2.8Å; W90-A93 PolarHBondContact O-N 3.1Å; W90-L94 HydrophobicContact CE3-CB 4.09Å; W90-L94 HydrophobicContact CE3-CD2 4.37Å; W90-L94 HydrophobicContact CZ3-CB 4.21Å; W90-L94 HydrophobicContact CZ3-CD2 3.69Å; W90-L94 WeakPolarHBondContact O-CB 3.36Å; W90-L94 PolarHBondContact O-N 3.49Å; W90-L122 HydrophobicContact CE3-CD1 4.42Å; W90-L122 HydrophobicContact CH2-CD1 3.49Å; W90-L122 VanDerWaalsContact CH2-CD1 3.49Å; W90-L122 HydrophobicContact CH2-CD2 3.73Å; W90-L122 HydrophobicContact CH2-CG 3.57Å; W90-L122 HydrophobicContact CZ2-CD1 4.42Å; W90-L122 HydrophobicContact CZ3-CD1 3.49Å; W90-L122 VanDerWaalsContact CZ3-CD1 3.49Å; W90-L122 HydrophobicContact CZ3-CD2 3.85Å; W90-L122 HydrophobicContact CZ3-CG 3.94Å
91	L	88.5	Confident	85.7	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-34.6	172.2	-73.9	170.5	0	0	0	111.8	L85 V88 S89 K95 L126 L199	L85-L91 HydrophobicContact CB-CD1 3.87Å; L85-L91 HydrophobicContact CD2-CD1 4.03Å; L85-L91 VanDerWaalsContact O-CD1 3.26Å; L85-L91 WeakPolarHBondContact O-CD1 3.5Å; V88-L91 HydrophobicContact CB-CD1 4.04Å; V88-L91 HydrophobicContact CB-CG 4.26Å; V88-L91 HydrophobicContact CG1-CD1 4.34Å; V88-L91 HydrophobicContact CG1-CG 4.05Å; V88-L91 WeakPolarHBondContact O-CB 3.39Å; V88-L91 PolarHBondContact O-N 3.29Å; S89-L91 PolarHBondContact O-N 3.43Å; L91-K95 WeakPolarHBondContact O-CB 3.39Å; L91-K95 PolarHBondContact O-N 2.88Å; L91-L126 HydrophobicContact CD2-CD2 4.05Å; L91-L199 HydrophobicContact CD2-CD1 3.71Å
92	K	88.5	Confident	85.5	Confident	55 Å²	55	29.1 Å²	29.1	24%	0.239	14%	0.136	C	C	.	.	H	α-helix	trans	-64.7	-49.3	175.6	-64	170.9	-178.7	179.2	0	109.7	M28 S89 W90 L94 K95 V96 E165 E188	M28-K92 HydrophobicContact SD-CB 4.45Å; S89-K92 VanDerWaalsContact O-CB 3.28Å; S89-K92 WeakPolarHBondContact O-CB 3.42Å; S89-K92 PolarHBondContact O-N 2.95Å; W90-K92 PolarHBondContact O-N 2.8Å; K92-L94 PolarHBondContact O-N 2.86Å; K92-K95 PolarHBondContact O-N 3.34Å; K92-V96 WeakPolarHBondContact O-CG2 3.42Å; K92-V96 PolarHBondContact O-N 3.22Å; K92-E165 HydrophobicContact CB-CB 4.19Å; K92-E165 HydrophobicContact CB-CG 4.38Å; K92-E188 VanDerWaalsContact CE-OE1 3.26Å; K92-E188 WeakPolarHBondContact CE-OE1 3.31Å; K92-E188 IonicContact NZ-OE1 3.25Å; K92-E188 PolarHBondContact NZ-OE1 3.26Å
93	A	85.5	Confident	85.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.8	-45.9	176.5	0	0	0	0	0	111.6	I25 M28 L29 W90 K95 V96 I97	I25-A93 HydrophobicContact CD1-CB 4.42Å; M28-A93 HydrophobicContact CB-CB 4.37Å; L29-A93 HydrophobicContact CD2-CB 3.89Å; L29-A93 HydrophobicContact CG-CB 4.06Å; W90-A93 PolarHBondContact O-N 3.1Å; A93-K95 PolarHBondContact O-N 2.98Å; A93-V96 PolarHBondContact O-N 3.46Å; A93-I97 WeakPolarHBondContact O-CB 3.45Å; A93-I97 VanDerWaalsContact O-CG1 3.25Å; A93-I97 WeakPolarHBondContact O-CG1 3.47Å; A93-I97 PolarHBondContact O-N 3.39Å
94	L	88.8	Confident	84.6	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-60.5	-44.1	177.7	-178.3	65.7	0	0	0	111.6	W90 K92 V96 I97 C98 L122 L199	W90-L94 HydrophobicContact CE3-CB 4.09Å; W90-L94 HydrophobicContact CE3-CD2 4.37Å; W90-L94 HydrophobicContact CZ3-CB 4.21Å; W90-L94 HydrophobicContact CZ3-CD2 3.69Å; W90-L94 WeakPolarHBondContact O-CB 3.36Å; W90-L94 PolarHBondContact O-N 3.49Å; K92-L94 PolarHBondContact O-N 2.86Å; L94-V96 VanDerWaalsContact C-N 3.33Å; L94-V96 PolarHBondContact O-N 3.36Å; L94-I97 PolarHBondContact O-N 3.23Å; L94-C98 PolarHBondContact O-N 3.07Å; L94-C98 PolarHBondContact O-SG 3.07Å; L94-L122 HydrophobicContact CD2-CD1 3.77Å; L94-L122 HydrophobicContact CD2-CD2 3.36Å; L94-L122 HydrophobicContact CD2-CG 4.21Å; L94-L199 HydrophobicContact CB-CD2 4.39Å; L94-L199 HydrophobicContact CD2-CD1 4.27Å; L94-L199 HydrophobicContact CD2-CD2 3.79Å; L94-L199 HydrophobicContact CG-CD2 3.75Å
95	K	91.1	Very high	84.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.9	-48.4	176.1	-171.1	-78.5	-175.7	-167.4	0	110.9	L91 K92 A93 I97 C98 N99 Q159 E165 D166 R195 C198 L199 Y202	L91-K95 WeakPolarHBondContact O-CB 3.39Å; L91-K95 PolarHBondContact O-N 2.88Å; K92-K95 PolarHBondContact O-N 3.34Å; A93-K95 PolarHBondContact O-N 2.98Å; K95-I97 VanDerWaalsContact C-N 3.34Å; K95-I97 PolarHBondContact O-N 3.48Å; K95-C98 PolarHBondContact O-N 2.79Å; K95-N99 PolarHBondContact NZ-ND2 2.99Å; K95-N99 PolarHBondContact NZ-OD1 3.33Å; K95-N99 PolarHBondContact O-N 2.92Å; K95-Q159 VanDerWaalsContact CE-OE1 3.32Å; K95-E165 HydrophobicContact CD-CG 4.4Å; K95-D166 VanDerWaalsContact NZ-CG 3.27Å; K95-D166 IonicContact NZ-OD1 2.66Å; K95-D166 PolarHBondContact NZ-OD1 3.3Å; K95-D166 IonicContact NZ-OD2 3.05Å; K95-D166 PolarHBondContact NZ-OD2 2.75Å; K95-D166 VanDerWaalsContact NZ-OD2 3.14Å; K95-R195 HydrophobicContact CB-CG 4.08Å; K95-R195 HydrophobicContact CG-CG 4.19Å; K95-C198 HydrophobicContact CG-CB 4.07Å; K95-L199 HydrophobicContact CB-CD2 4.4Å; K95-Y202 HydrophobicContact CG-CE2 4.35Å
96	V	86.8	Confident	83.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-39.6	178.8	173.8	0	0	0	0	111.8	F21 I25 M28 K92 A93 L94 N99 W100 E165 V169 L173	F21-V96 HydrophobicContact CE2-CG1 3.56Å; F21-V96 HydrophobicContact CZ-CG1 3.95Å; I25-V96 HydrophobicContact CD1-CB 3.82Å; I25-V96 HydrophobicContact CD1-CG1 3.54Å; M28-V96 HydrophobicContact CE-CG2 4.22Å; M28-V96 HydrophobicContact SD-CG2 4.2Å; K92-V96 WeakPolarHBondContact O-CG2 3.42Å; K92-V96 PolarHBondContact O-N 3.22Å; A93-V96 PolarHBondContact O-N 3.46Å; L94-V96 VanDerWaalsContact C-N 3.33Å; L94-V96 PolarHBondContact O-N 3.36Å; V96-N99 WeakPolarHBondContact O-CB 3.5Å; V96-N99 PolarHBondContact O-N 3.01Å; V96-W100 PolarHBondContact O-N 3.34Å; V96-E165 HydrophobicContact CG2-CB 3.85Å; V96-E165 HydrophobicContact CG2-CG 3.86Å; V96-V169 HydrophobicContact CG1-CB 4.42Å; V96-V169 HydrophobicContact CG1-CG1 3.7Å; V96-V169 HydrophobicContact CG1-CG2 4.22Å; V96-V169 HydrophobicContact CG2-CG1 4.47Å; V96-V169 HydrophobicContact CG2-CG2 4.4Å; V96-L173 HydrophobicContact CG1-CD1 4.27Å
97	I	83.9	Confident	83.4	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-63.5	-42.9	174.9	-70	165	0	0	0	110.6	L7 I25 A93 L94 K95 W100 L101	L7-I97 HydrophobicContact CB-CD1 4.17Å; L7-I97 HydrophobicContact CB-CG2 3.69Å; L7-I97 HydrophobicContact CD1-CG2 3.52Å; L7-I97 HydrophobicContact CD2-CG2 4.11Å; L7-I97 HydrophobicContact CG-CG2 3.95Å; I25-I97 HydrophobicContact CD1-CG1 4.13Å; A93-I97 WeakPolarHBondContact O-CB 3.45Å; A93-I97 VanDerWaalsContact O-CG1 3.25Å; A93-I97 WeakPolarHBondContact O-CG1 3.47Å; A93-I97 PolarHBondContact O-N 3.39Å; L94-I97 PolarHBondContact O-N 3.23Å; K95-I97 VanDerWaalsContact C-N 3.34Å; K95-I97 PolarHBondContact O-N 3.48Å; I97-W100 WeakPolarHBondContact O-CB 3.34Å; I97-W100 PolarHBondContact O-N 3.17Å; I97-W100 VanDerWaalsContact O-N 3.15Å; I97-L101 HydrophobicContact CG2-CD1 4.13Å; I97-L101 HydrophobicContact CG2-CG 4.35Å; I97-L101 WeakPolarHBondContact O-CG 3.29Å; I97-L101 PolarHBondContact O-N 2.9Å
98	C	88.4	Confident	83.1	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.007	12%	0.122	C	C	.	.	H	α-helix	trans	-64.6	-40	175.8	-66.2	0	0	0	0	112.7	L94 K95 W100 L101 Q102 Y202 F206	L94-C98 PolarHBondContact O-N 3.07Å; L94-C98 PolarHBondContact O-SG 3.07Å; K95-C98 PolarHBondContact O-N 2.79Å; C98-W100 VanDerWaalsContact C-N 3.25Å; C98-W100 PolarHBondContact O-N 3.16Å; C98-L101 PolarHBondContact O-N 3.41Å; C98-Q102 WeakPolarHBondContact O-CG 3.29Å; C98-Q102 PolarHBondContact O-N 3.49Å; C98-Y202 HydrophobicContact CB-CD1 4.33Å; C98-Y202 HydrophobicContact CB-CD2 3.13Å; C98-Y202 HydrophobicContact CB-CE2 3.46Å; C98-Y202 VanDerWaalsContact CB-CE2 3.46Å; C98-Y202 HydrophobicContact CB-CG 3.65Å; C98-F206 HydrophobicContact CB-CZ 4.38Å
99	N	86.8	Confident	82.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-54.2	-44.7	170.1	-82	-32.6	0	0	0	110.9	K95 V96 D166 L173 L175 Y202	K95-N99 PolarHBondContact NZ-ND2 2.99Å; K95-N99 PolarHBondContact NZ-OD1 3.33Å; K95-N99 PolarHBondContact O-N 2.92Å; V96-N99 WeakPolarHBondContact O-CB 3.5Å; V96-N99 PolarHBondContact O-N 3.01Å; N99-D166 PolarHBondContact ND2-OD1 3.08Å; N99-D166 VanDerWaalsContact ND2-OD1 3.12Å; N99-L173 HydrophobicContact CB-CD1 3.61Å; N99-L175 HydrophobicContact CB-CD1 3.6Å; N99-Y202 PolarHBondContact OD1-OH 2.92Å
100	W	83.4	Confident	82.6	Confident	10 Å²	10	35.4 Å²	35.4	4%	0.038	17%	0.165	C	C	.	.	H	α-helix	trans	-67.7	-46.6	179.6	178.6	81.1	0	0	0	111.5	Y14 F21 V96 I97 C98 Q102 L103 H104 E107 L173	Y14-W100 HydrophobicContact CG-CZ2 4.37Å; F21-W100 HydrophobicContact CE1-CB 4.42Å; F21-W100 HydrophobicContact CE1-CG 4.15Å; F21-W100 HydrophobicContact CE2-CB 4.18Å; F21-W100 HydrophobicContact CE2-CG 4.43Å; F21-W100 HydrophobicContact CZ-CB 3.65Å; F21-W100 AromaticContact CZ-CG 3.82Å; F21-W100 HydrophobicContact CZ-CG 3.82Å; V96-W100 PolarHBondContact O-N 3.34Å; I97-W100 WeakPolarHBondContact O-CB 3.34Å; I97-W100 PolarHBondContact O-N 3.17Å; I97-W100 VanDerWaalsContact O-N 3.15Å; C98-W100 VanDerWaalsContact C-N 3.25Å; C98-W100 PolarHBondContact O-N 3.16Å; W100-Q102 PolarHBondContact O-N 3.29Å; W100-L103 WeakPolarHBondContact O-CA 3.34Å; W100-L103 WeakPolarHBondContact O-CB 3.34Å; W100-L103 PolarHBondContact O-N 3.39Å; W100-H104 AromaticContact CD1-CD2 3.44Å; W100-H104 VanDerWaalsContact CD1-CD2 3.44Å; W100-H104 AromaticContact CD1-NE2 3.68Å; W100-H104 AromaticContact CD2-CD2 3.81Å; W100-H104 AromaticContact CE2-CD2 3.36Å; W100-H104 AromaticContact CE2-CG 4Å; W100-H104 AromaticContact CE2-NE2 3.89Å; W100-H104 AromaticContact CG-CD2 3.87Å; W100-H104 HydrophobicContact CZ2-CB 4.49Å; W100-H104 AromaticContact CZ2-CD2 3.94Å; W100-H104 AromaticContact NE1-CD2 3.09Å; W100-H104 PolarHBondContact NE1-CD2 3.01Å; W100-H104 AromaticContact NE1-NE2 3.21Å; W100-H104 PolarHBondContact NE1-NE2 3.39Å; W100-H104 PolarHBondContact O-CD2 3.18Å; W100-H104 VanDerWaalsContact O-CD2 3.25Å; W100-H104 PolarHBondContact O-N 3.38Å; W100-E107 HydrophobicContact CH2-CB 4.05Å; W100-E107 HydrophobicContact CH2-CG 3.61Å; W100-E107 HydrophobicContact CZ2-CG 4.33Å; W100-E107 HydrophobicContact CZ3-CB 4.11Å; W100-E107 HydrophobicContact CZ3-CG 4.19Å; W100-L173 HydrophobicContact CB-CD2 3.97Å; W100-L173 HydrophobicContact CG-CD2 4.28Å
101	L	83.5	Confident	82.2	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-56.7	-35	176.8	-77.2	174.5	0	0	0	113.2	L7 I97 C98 L103 H104 E107 L108 M111 F206	L7-L101 HydrophobicContact CD1-CD1 4.49Å; L7-L101 HydrophobicContact CD2-CD1 3.9Å; L7-L101 HydrophobicContact CD2-CD2 4.15Å; L7-L101 HydrophobicContact CD2-CG 4.41Å; I97-L101 HydrophobicContact CG2-CD1 4.13Å; I97-L101 HydrophobicContact CG2-CG 4.35Å; I97-L101 WeakPolarHBondContact O-CG 3.29Å; I97-L101 PolarHBondContact O-N 2.9Å; C98-L101 PolarHBondContact O-N 3.41Å; L101-L103 PolarHBondContact O-N 3.26Å; L101-H104 CarbonylContact O-C 3.34Å; L101-H104 PolarHBondContact O-N 2.97Å; L101-E107 HydrophobicContact CD2-CB 4.3Å; L101-L108 HydrophobicContact CB-CD1 4.07Å; L101-L108 HydrophobicContact CD1-CD1 4.18Å; L101-L108 HydrophobicContact CD2-CD1 4.19Å; L101-L108 HydrophobicContact CG-CD1 4.39Å; L101-M111 HydrophobicContact CD1-SD 4.05Å; L101-M111 HydrophobicContact CD2-SD 4.16Å; L101-F206 HydrophobicContact CB-CZ 4.14Å; L101-F206 HydrophobicContact CD1-CZ 4.33Å
102	Q	80.8	Confident	81.4	Confident	47 Å²	47	34.8 Å²	34.8	22%	0.22	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-29.5	173.9	-74.9	-179.2	-41.5	0	0	113.7	C98 W100 Y202 E205 F206	C98-Q102 WeakPolarHBondContact O-CG 3.29Å; C98-Q102 PolarHBondContact O-N 3.49Å; W100-Q102 PolarHBondContact O-N 3.29Å; Q102-Y202 VanDerWaalsContact CD-CD1 3.45Å; Q102-Y202 HydrophobicContact CG-CD1 4.05Å; Q102-Y202 HydrophobicContact CG-CE1 4.15Å; Q102-E205 PolarHBondContact NE2-OE2 3.38Å; Q102-F206 HydrophobicContact CG-CE1 4.42Å
103	L	77.9	Confident	80.7	Confident	75 Å²	75	34.2 Å²	34.2	39%	0.393	18%	0.182	S	C	.	.	H	α-helix	trans	-83.9	-15.6	177.7	-65.3	173.5	0	0	0	112.6	W100 L101 P105 L173 L175	W100-L103 WeakPolarHBondContact O-CA 3.34Å; W100-L103 WeakPolarHBondContact O-CB 3.34Å; W100-L103 PolarHBondContact O-N 3.39Å; L101-L103 PolarHBondContact O-N 3.26Å; L103-P105 VanDerWaalsContact C-CD 3.5Å; L103-P105 WeakPolarHBondContact O-CD 3.5Å; L103-L173 HydrophobicContact CD1-CB 4.07Å; L103-L173 HydrophobicContact CD1-CD2 4.1Å; L103-L173 VanDerWaalsContact CD1-O 3.27Å; L103-L173 WeakPolarHBondContact CD1-O 3.17Å; L103-L175 HydrophobicContact CD1-CD1 4.47Å; L103-L175 HydrophobicContact CD1-CD2 4.11Å; L103-L175 HydrophobicContact CD1-CG 4.07Å; L103-L175 HydrophobicContact CD2-CD2 3.55Å; L103-L175 HydrophobicContact CD2-CG 4.36Å; L103-L175 HydrophobicContact CG-CD2 3.91Å; L103-L175 HydrophobicContact CG-CG 4.4Å
104	H	77.2	Confident	80.2	Confident	48 Å²	48	40 Å²	40	22%	0.222	21%	0.213	C	C	.	.			trans	-127.4	67	-173	-66.5	-72.5	0	0	0	111	W100 L101 E106 E107 L108	W100-H104 AromaticContact CD1-CD2 3.44Å; W100-H104 VanDerWaalsContact CD1-CD2 3.44Å; W100-H104 AromaticContact CD1-NE2 3.68Å; W100-H104 AromaticContact CD2-CD2 3.81Å; W100-H104 AromaticContact CE2-CD2 3.36Å; W100-H104 AromaticContact CE2-CG 4Å; W100-H104 AromaticContact CE2-NE2 3.89Å; W100-H104 AromaticContact CG-CD2 3.87Å; W100-H104 HydrophobicContact CZ2-CB 4.49Å; W100-H104 AromaticContact CZ2-CD2 3.94Å; W100-H104 AromaticContact NE1-CD2 3.09Å; W100-H104 PolarHBondContact NE1-CD2 3.01Å; W100-H104 AromaticContact NE1-NE2 3.21Å; W100-H104 PolarHBondContact NE1-NE2 3.39Å; W100-H104 PolarHBondContact O-CD2 3.18Å; W100-H104 VanDerWaalsContact O-CD2 3.25Å; W100-H104 PolarHBondContact O-N 3.38Å; L101-H104 CarbonylContact O-C 3.34Å; L101-H104 PolarHBondContact O-N 2.97Å; H104-E106 VanDerWaalsContact C-OE2 3.3Å; H104-E106 WeakPolarHBondContact CA-OE1 3.02Å; H104-E106 WeakPolarHBondContact CA-OE2 3.28Å; H104-E106 WeakPolarHBondContact CB-OE1 3.31Å; H104-E106 IonicContact CG-OE1 3.26Å; H104-E106 IonicContact ND1-OE1 3.65Å; H104-E106 PolarHBondContact ND1-OE1 2.98Å; H104-E106 PolarHBondContact O-N 3.23Å; H104-E106 VanDerWaalsContact O-N 3.15Å; H104-E107 HydrophobicContact CB-CB 4.15Å; H104-E107 HydrophobicContact CB-CG 4.11Å; H104-E107 WeakPolarHBondContact O-CB 3.04Å; H104-E107 PolarHBondContact O-N 2.69Å; H104-L108 PolarHBondContact O-N 3.2Å
105	P	76.3	Confident	79.6	Confident	59 Å²	59	40.3 Å²	40.3	38%	0.383	22%	0.215	S	C	.	.	H	α-helix	trans	-61.1	-22	-177.5	26.3	-35.9	0	0	0	114	L103 L108 R109	L103-P105 VanDerWaalsContact C-CD 3.5Å; L103-P105 WeakPolarHBondContact O-CD 3.5Å; P105-L108 WeakPolarHBondContact O-CB 3.39Å; P105-R109 PolarHBondContact O-N 2.96Å; P105-R109 VanDerWaalsContact O-N 3.14Å
106	E	78.6	Confident	79.1	Confident	73 Å²	73	40.6 Å²	40.6	34%	0.341	22%	0.216	S	C	.	.	H	α-helix	trans	-61.6	-44.7	170.2	64.8	-72.3	174.6	0	0	112	H104 L108 R109 D110	H104-E106 VanDerWaalsContact C-OE2 3.3Å; H104-E106 WeakPolarHBondContact CA-OE1 3.02Å; H104-E106 WeakPolarHBondContact CA-OE2 3.28Å; H104-E106 WeakPolarHBondContact CB-OE1 3.31Å; H104-E106 IonicContact CG-OE1 3.26Å; H104-E106 IonicContact ND1-OE1 3.65Å; H104-E106 PolarHBondContact ND1-OE1 2.98Å; H104-E106 PolarHBondContact O-N 3.23Å; H104-E106 VanDerWaalsContact O-N 3.15Å; E106-L108 VanDerWaalsContact C-N 3.31Å; E106-L108 PolarHBondContact O-N 2.69Å; E106-R109 WeakPolarHBondContact O-CB 3.49Å; E106-R109 PolarHBondContact O-N 2.82Å; E106-D110 PolarHBondContact O-N 3.03Å; E106-D110 VanDerWaalsContact O-N 3.16Å
107	E	78.1	Confident	78.6	Confident	15 Å²	15	42.9 Å²	42.9	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-69	-35	179.1	-72	-61.3	138	0	0	112	K10 Y14 W100 L101 H104 R109 D110 M111	K10-E107 PolarHBondContact NZ-O 3.11Å; K10-E107 IonicContact NZ-OE2 2.68Å; Y14-E107 HydrophobicContact CD2-CG 4.36Å; Y14-E107 VanDerWaalsContact CD2-OE1 3.29Å; Y14-E107 WeakPolarHBondContact CD2-OE1 3.24Å; Y14-E107 HydrophobicContact CE2-CG 4.25Å; Y14-E107 WeakPolarHBondContact CE2-OE1 3.5Å; W100-E107 HydrophobicContact CH2-CB 4.05Å; W100-E107 HydrophobicContact CH2-CG 3.61Å; W100-E107 HydrophobicContact CZ2-CG 4.33Å; W100-E107 HydrophobicContact CZ3-CB 4.11Å; W100-E107 HydrophobicContact CZ3-CG 4.19Å; L101-E107 HydrophobicContact CD2-CB 4.3Å; H104-E107 HydrophobicContact CB-CB 4.15Å; H104-E107 HydrophobicContact CB-CG 4.11Å; H104-E107 WeakPolarHBondContact O-CB 3.04Å; H104-E107 PolarHBondContact O-N 2.69Å; E107-R109 VanDerWaalsContact C-N 3.3Å; E107-D110 PolarHBondContact O-N 3.14Å; E107-M111 WeakPolarHBondContact O-CG 3.39Å; E107-M111 PolarHBondContact O-N 2.92Å
108	L	77	Confident	78.4	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-41.8	173.2	-158	65.2	0	0	0	111.3	L101 H104 P105 E106 D110 M111 W116 F206 F211	L101-L108 HydrophobicContact CB-CD1 4.07Å; L101-L108 HydrophobicContact CD1-CD1 4.18Å; L101-L108 HydrophobicContact CD2-CD1 4.19Å; L101-L108 HydrophobicContact CG-CD1 4.39Å; H104-L108 PolarHBondContact O-N 3.2Å; P105-L108 WeakPolarHBondContact O-CB 3.39Å; E106-L108 VanDerWaalsContact C-N 3.31Å; E106-L108 PolarHBondContact O-N 2.69Å; L108-D110 VanDerWaalsContact C-N 3.34Å; L108-M111 HydrophobicContact CD1-SD 4.17Å; L108-M111 WeakPolarHBondContact O-CB 3.23Å; L108-M111 PolarHBondContact O-N 3.42Å; L108-W116 HydrophobicContact CD1-CH2 3.35Å; L108-W116 HydrophobicContact CD1-CZ2 3.64Å; L108-W116 HydrophobicContact CG-CH2 3.89Å; L108-W116 HydrophobicContact CG-CZ2 3.84Å; L108-F206 HydrophobicContact CD1-CD1 3.99Å; L108-F206 HydrophobicContact CD1-CE1 3.78Å; L108-F206 HydrophobicContact CD1-CZ 4.11Å; L108-F206 HydrophobicContact CD2-CD1 3.68Å; L108-F206 HydrophobicContact CD2-CE1 3.91Å; L108-F206 HydrophobicContact CG-CD1 4.44Å; L108-F211 HydrophobicContact CB-CE2 4.11Å; L108-F211 HydrophobicContact CB-CZ 4.05Å; L108-F211 HydrophobicContact CD2-CE2 4.19Å; L108-F211 HydrophobicContact CD2-CZ 3.88Å; L108-F211 HydrophobicContact CG-CE2 3.84Å; L108-F211 HydrophobicContact CG-CZ 3.95Å; L108-F211 WeakPolarHBondContact O-CE2 3.24Å
109	R	73.9	Confident	78.2	Confident	172 Å²	172	46.8 Å²	46.8	65%	0.649	25%	0.248	S	C	*	.	H	α-helix	trans	-67.9	-35.8	179	-172	-176.4	-62.6	-154.9	0.7	112.1	P105 E106 E107 M111 F211	P105-R109 PolarHBondContact O-N 2.96Å; P105-R109 VanDerWaalsContact O-N 3.14Å; E106-R109 WeakPolarHBondContact O-CB 3.49Å; E106-R109 PolarHBondContact O-N 2.82Å; E107-R109 VanDerWaalsContact C-N 3.3Å; R109-M111 PolarHBondContact O-N 3.3Å; R109-F211 HydrophobicContact CB-CD2 4.4Å; R109-F211 HydrophobicContact CB-CE2 4.24Å; R109-F211 HydrophobicContact CB-CZ 4.29Å; R109-F211 HydrophobicContact CG-CD2 4.5Å; R109-F211 HydrophobicContact CG-CG 4.38Å
110	D	77	Confident	78	Confident	108 Å²	108	47.2 Å²	47.2	58%	0.578	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	3.2	-179.8	-71.3	-7.8	0	0	0	113	K10 E106 E107 L108	K10-D110 PolarHBondContact NZ-O 3.39Å; E106-D110 PolarHBondContact O-N 3.03Å; E106-D110 VanDerWaalsContact O-N 3.16Å; E107-D110 PolarHBondContact O-N 3.14Å; L108-D110 VanDerWaalsContact C-N 3.34Å
111	M	74.9	Confident	77.9	Confident	14 Å²	14	49.7 Å²	49.7	7%	0.069	27%	0.27	C	S	.	.			trans	-75.4	126.8	173.4	-71.7	-173.1	62.8	0	0	110.6	L3 L7 L101 E107 L108 R109 W116	L3-M111 HydrophobicContact CD1-CE 3.82Å; L7-M111 HydrophobicContact CD2-CE 3.94Å; L7-M111 HydrophobicContact CD2-SD 3.89Å; L101-M111 HydrophobicContact CD1-SD 4.05Å; L101-M111 HydrophobicContact CD2-SD 4.16Å; E107-M111 WeakPolarHBondContact O-CG 3.39Å; E107-M111 PolarHBondContact O-N 2.92Å; L108-M111 HydrophobicContact CD1-SD 4.17Å; L108-M111 WeakPolarHBondContact O-CB 3.23Å; L108-M111 PolarHBondContact O-N 3.42Å; R109-M111 PolarHBondContact O-N 3.3Å; M111-W116 HydrophobicContact CB-CZ2 4.23Å; M111-W116 HydrophobicContact SD-CH2 4.32Å; M111-W116 HydrophobicContact SD-CZ2 4Å
112	G	71.1	Confident	78	Confident	43 Å²	43	50.8 Å²	50.8	44%	0.443	28%	0.276	S	S	.	.			trans	-67.9	155.6	175.1	0	0	0	0	0	112.8	D114 S115	G112-D114 PolarHBondContact O-N 2.94Å; G112-S115 VanDerWaalsContact O-CB 3.22Å; G112-S115 WeakPolarHBondContact O-CB 3.46Å; G112-S115 PolarHBondContact O-N 3.15Å; G112-S115 PolarHBondContact O-OG 3.06Å
113	A	73.3	Confident	78.3	Confident	43 Å²	43	48.6 Å²	48.6	36%	0.355	27%	0.265	S	S	.	.	H	α-helix	trans	-53.8	-36.7	-179.1	0	0	0	0	0	113.6	S115 W116 T117 D227	A113-S115 PolarHBondContact O-N 3.14Å; A113-W116 WeakPolarHBondContact O-CB 3.35Å; A113-W116 PolarHBondContact O-N 3.07Å; A113-W116 VanDerWaalsContact O-N 3.07Å; A113-T117 PolarHBondContact O-N 3.08Å; A113-T117 PolarHBondContact O-OG1 3.42Å; A113-D227 WeakPolarHBondContact CB-OD2 3.2Å
114	D	74.2	Confident	78.8	Confident	122 Å²	122	46.8 Å²	46.8	65%	0.652	26%	0.256	S	S	*	.	H	α-helix	trans	-59.6	-34.7	176.3	-64.8	-29.7	0	0	0	112.7	G112 W116 T117 H118	G112-D114 PolarHBondContact O-N 2.94Å; D114-W116 VanDerWaalsContact C-N 3.3Å; D114-W116 PolarHBondContact O-N 3.45Å; D114-T117 PolarHBondContact O-N 2.91Å; D114-H118 PolarHBondContact O-N 2.95Å; D114-H118 PolarHBondContact O-ND1 2.71Å
115	S	78.1	Confident	79.2	Confident	8 Å²	8	48.5 Å²	48.5	6%	0.056	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-39	178	-52.7	0	0	0	0	110.9	L3 L6 G112 A113 H118 F119	L3-S115 WeakPolarHBondContact CD1-O 3.27Å; L6-S115 WeakPolarHBondContact CD2-OG 3.35Å; G112-S115 VanDerWaalsContact O-CB 3.22Å; G112-S115 WeakPolarHBondContact O-CB 3.46Å; G112-S115 PolarHBondContact O-N 3.15Å; G112-S115 PolarHBondContact O-OG 3.06Å; A113-S115 PolarHBondContact O-N 3.14Å; S115-H118 PolarHBondContact O-N 3.47Å; S115-F119 WeakPolarHBondContact O-CB 3.01Å; S115-F119 PolarHBondContact O-N 3.41Å
116	W	80.2	Confident	79.9	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.019	25%	0.249	C	C	.	.	H	α-helix	trans	-68.2	-42.3	176.1	-68	118.3	0	0	0	111.9	L108 M111 A113 D114 H118 F119 V120 F206 T212 L214	L108-W116 HydrophobicContact CD1-CH2 3.35Å; L108-W116 HydrophobicContact CD1-CZ2 3.64Å; L108-W116 HydrophobicContact CG-CH2 3.89Å; L108-W116 HydrophobicContact CG-CZ2 3.84Å; M111-W116 HydrophobicContact CB-CZ2 4.23Å; M111-W116 HydrophobicContact SD-CH2 4.32Å; M111-W116 HydrophobicContact SD-CZ2 4Å; A113-W116 WeakPolarHBondContact O-CB 3.35Å; A113-W116 PolarHBondContact O-N 3.07Å; A113-W116 VanDerWaalsContact O-N 3.07Å; D114-W116 VanDerWaalsContact C-N 3.3Å; D114-W116 PolarHBondContact O-N 3.45Å; W116-H118 VanDerWaalsContact C-N 3.3Å; W116-H118 PolarHBondContact O-N 3.41Å; W116-F119 HydrophobicContact CE3-CB 4.46Å; W116-F119 HydrophobicContact CE3-CD1 4.22Å; W116-F119 HydrophobicContact CZ3-CD1 4.2Å; W116-F119 PolarHBondContact O-N 2.93Å; W116-V120 WeakPolarHBondContact O-CB 3.19Å; W116-V120 VanDerWaalsContact O-CG2 3.22Å; W116-V120 WeakPolarHBondContact O-CG2 3.37Å; W116-V120 PolarHBondContact O-N 3.22Å; W116-F206 HydrophobicContact CH2-CB 3.92Å; W116-F206 HydrophobicContact CH2-CD1 4.39Å; W116-F206 AromaticContact CH2-CD2 3.9Å; W116-F206 HydrophobicContact CH2-CD2 3.9Å; W116-F206 HydrophobicContact CH2-CE2 4.49Å; W116-F206 AromaticContact CH2-CG 3.82Å; W116-F206 HydrophobicContact CH2-CG 3.82Å; W116-F206 HydrophobicContact CZ3-CB 3.78Å; W116-F206 AromaticContact CZ3-CD2 3.59Å; W116-F206 HydrophobicContact CZ3-CD2 3.59Å; W116-F206 HydrophobicContact CZ3-CE2 4.35Å; W116-F206 AromaticContact CZ3-CG 3.84Å; W116-F206 HydrophobicContact CZ3-CG 3.84Å; W116-T212 HydrophobicContact CD2-CG2 4.35Å; W116-T212 HydrophobicContact CH2-CG2 3.67Å; W116-T212 HydrophobicContact CZ2-CG2 3.4Å; W116-T212 HydrophobicContact CZ3-CG2 4.3Å; W116-L214 HydrophobicContact CB-CD2 4.09Å; W116-L214 HydrophobicContact CE3-CD1 3.76Å; W116-L214 HydrophobicContact CE3-CD2 4.49Å; W116-L214 HydrophobicContact CE3-CG 4.29Å; W116-L214 HydrophobicContact CZ3-CD1 4Å
117	T	76.3	Confident	80.4	Confident	49 Å²	49	42.3 Å²	42.3	30%	0.301	23%	0.232	S	C	.	.	H	α-helix	trans	-59.2	-41.7	174	-59	0	0	0	0	111.8	A113 D114 S121 S225	A113-T117 PolarHBondContact O-N 3.08Å; A113-T117 PolarHBondContact O-OG1 3.42Å; D114-T117 PolarHBondContact O-N 2.91Å; T117-S121 WeakPolarHBondContact O-CB 3.43Å; T117-S121 PolarHBondContact O-N 3.48Å; T117-S121 PolarHBondContact O-OG 2.9Å; T117-S225 PolarHBondContact OG1-OG 2.94Å
118	H	79.3	Confident	80.8	Confident	79 Å²	79	43.8 Å²	43.8	37%	0.366	24%	0.242	S	C	.	.	H	α-helix	trans	-66.2	-44.5	174.2	-71.9	131.1	0	0	0	112.8	E2 L3 D114 S115 W116 S121 L122	E2-H118 IonicContact OE2-CE1 3.58Å; E2-H118 PolarHBondContact OE2-CE1 3.39Å; E2-H118 VanDerWaalsContact OE2-CE1 3.27Å; E2-H118 IonicContact OE2-NE2 2.69Å; L3-H118 HydrophobicContact CB-CB 4.14Å; L3-H118 HydrophobicContact CD2-CB 4.32Å; D114-H118 PolarHBondContact O-N 2.95Å; D114-H118 PolarHBondContact O-ND1 2.71Å; S115-H118 PolarHBondContact O-N 3.47Å; W116-H118 VanDerWaalsContact C-N 3.3Å; W116-H118 PolarHBondContact O-N 3.41Å; H118-S121 PolarHBondContact O-N 2.92Å; H118-L122 WeakPolarHBondContact O-CB 3.22Å; H118-L122 PolarHBondContact O-N 3Å
119	F	84.4	Confident	81.3	Confident	7 Å²	7	45.6 Å²	45.6	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-45.9	177.9	178.5	-100.9	0	0	0	111.4	L3 S115 W116 S121 L122 V123 A203 F206	L3-F119 HydrophobicContact CD2-CB 3.84Å; L3-F119 HydrophobicContact CD2-CD2 4.33Å; S115-F119 WeakPolarHBondContact O-CB 3.01Å; S115-F119 PolarHBondContact O-N 3.41Å; W116-F119 HydrophobicContact CE3-CB 4.46Å; W116-F119 HydrophobicContact CE3-CD1 4.22Å; W116-F119 HydrophobicContact CZ3-CD1 4.2Å; W116-F119 PolarHBondContact O-N 2.93Å; F119-S121 PolarHBondContact O-N 2.96Å; F119-L122 WeakPolarHBondContact O-CB 3.25Å; F119-L122 PolarHBondContact O-N 2.62Å; F119-V123 HydrophobicContact CD1-CG2 4.2Å; F119-V123 HydrophobicContact CD2-CG2 4.29Å; F119-V123 HydrophobicContact CE1-CG2 3.73Å; F119-V123 HydrophobicContact CE2-CG2 3.85Å; F119-V123 HydrophobicContact CG-CG2 4.46Å; F119-V123 HydrophobicContact CZ-CG2 3.55Å; F119-V123 WeakPolarHBondContact O-CG2 3.39Å; F119-V123 PolarHBondContact O-N 3.12Å; F119-A203 HydrophobicContact CE1-CB 3.83Å; F119-A203 HydrophobicContact CZ-CB 4.21Å; F119-F206 HydrophobicContact CD1-CD2 4.41Å; F119-F206 AromaticContact CE1-CD2 3.71Å; F119-F206 HydrophobicContact CE1-CD2 3.71Å; F119-F206 HydrophobicContact CE1-CE2 4.26Å; F119-F206 HydrophobicContact CE2-CE2 4.26Å; F119-F206 AromaticContact CZ-CD2 3.76Å; F119-F206 HydrophobicContact CZ-CD2 3.76Å; F119-F206 AromaticContact CZ-CE2 3.86Å; F119-F206 HydrophobicContact CZ-CE2 3.86Å
120	V	82	Confident	81.7	Confident	9 Å²	9	41.1 Å²	41.1	6%	0.055	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-49.1	174.9	164.2	0	0	0	0	111.5	W116 L122 V123 N124 L214 F223	W116-V120 WeakPolarHBondContact O-CB 3.19Å; W116-V120 VanDerWaalsContact O-CG2 3.22Å; W116-V120 WeakPolarHBondContact O-CG2 3.37Å; W116-V120 PolarHBondContact O-N 3.22Å; V120-L122 PolarHBondContact O-N 3.46Å; V120-V123 PolarHBondContact O-N 3.44Å; V120-N124 WeakPolarHBondContact CG1-ND2 3.24Å; V120-N124 VanDerWaalsContact O-CB 3.29Å; V120-N124 WeakPolarHBondContact O-CB 3.27Å; V120-N124 VanDerWaalsContact O-CG 3.27Å; V120-N124 PolarHBondContact O-N 3.39Å; V120-N124 PolarHBondContact O-ND2 2.95Å; V120-L214 HydrophobicContact CG2-CD1 4.5Å; V120-L214 HydrophobicContact CG2-CD2 3.14Å; V120-L214 HydrophobicContact CG2-CG 4.38Å; V120-F223 HydrophobicContact CB-CB 4.43Å; V120-F223 VanDerWaalsContact CG1-C 3.44Å; V120-F223 HydrophobicContact CG1-CB 3.87Å; V120-F223 WeakPolarHBondContact CG1-O 3.34Å; V120-F223 HydrophobicContact CG2-CB 4.11Å
121	S	80.9	Confident	82.1	Confident	63 Å²	63	37.4 Å²	37.4	44%	0.441	23%	0.225	S	C	.	.	H	α-helix	trans	-57.3	-42.4	178.4	-63.4	0	0	0	0	110.9	T117 H118 F119 L125	T117-S121 WeakPolarHBondContact O-CB 3.43Å; T117-S121 PolarHBondContact O-N 3.48Å; T117-S121 PolarHBondContact O-OG 2.9Å; H118-S121 PolarHBondContact O-N 2.92Å; F119-S121 PolarHBondContact O-N 2.96Å; S121-L125 WeakPolarHBondContact O-CG 3.35Å; S121-L125 PolarHBondContact O-N 2.94Å
122	L	86.4	Confident	82.9	Confident	26 Å²	26	36.8 Å²	36.8	14%	0.136	22%	0.222	C	C	.	.	H	α-helix	trans	-67.5	-48.8	179	-171.6	159.1	0	0	0	112.4	W90 L94 H118 F119 V120 N124 L125 L126	W90-L122 HydrophobicContact CE3-CD1 4.42Å; W90-L122 HydrophobicContact CH2-CD1 3.49Å; W90-L122 VanDerWaalsContact CH2-CD1 3.49Å; W90-L122 HydrophobicContact CH2-CD2 3.73Å; W90-L122 HydrophobicContact CH2-CG 3.57Å; W90-L122 HydrophobicContact CZ2-CD1 4.42Å; W90-L122 HydrophobicContact CZ3-CD1 3.49Å; W90-L122 VanDerWaalsContact CZ3-CD1 3.49Å; W90-L122 HydrophobicContact CZ3-CD2 3.85Å; W90-L122 HydrophobicContact CZ3-CG 3.94Å; L94-L122 HydrophobicContact CD2-CD1 3.77Å; L94-L122 HydrophobicContact CD2-CD2 3.36Å; L94-L122 HydrophobicContact CD2-CG 4.21Å; H118-L122 WeakPolarHBondContact O-CB 3.22Å; H118-L122 PolarHBondContact O-N 3Å; F119-L122 WeakPolarHBondContact O-CB 3.25Å; F119-L122 PolarHBondContact O-N 2.62Å; V120-L122 PolarHBondContact O-N 3.46Å; L122-N124 VanDerWaalsContact C-N 3.28Å; L122-N124 PolarHBondContact O-N 3.22Å; L122-L125 WeakPolarHBondContact O-CA 3.49Å; L122-L125 WeakPolarHBondContact O-CB 3.37Å; L122-L125 PolarHBondContact O-N 3.07Å; L122-L126 PolarHBondContact O-N 3.44Å
123	V	88	Confident	83.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.2	-36	179.3	174.7	0	0	0	0	111	F119 V120 L125 L126 R200 A203 F223	F119-V123 HydrophobicContact CD1-CG2 4.2Å; F119-V123 HydrophobicContact CD2-CG2 4.29Å; F119-V123 HydrophobicContact CE1-CG2 3.73Å; F119-V123 HydrophobicContact CE2-CG2 3.85Å; F119-V123 HydrophobicContact CG-CG2 4.46Å; F119-V123 HydrophobicContact CZ-CG2 3.55Å; F119-V123 WeakPolarHBondContact O-CG2 3.39Å; F119-V123 PolarHBondContact O-N 3.12Å; V120-V123 PolarHBondContact O-N 3.44Å; V123-L125 PolarHBondContact O-N 3.26Å; V123-L126 VanDerWaalsContact O-CB 3.31Å; V123-L126 WeakPolarHBondContact O-CB 3.34Å; V123-L126 PolarHBondContact O-N 2.94Å; V123-R200 HydrophobicContact CG1-CG 4.37Å; V123-A203 HydrophobicContact CB-CB 4.47Å; V123-A203 HydrophobicContact CG1-CB 3.83Å; V123-A203 HydrophobicContact CG2-CB 4.22Å; V123-F223 HydrophobicContact CB-CD2 4.41Å; V123-F223 HydrophobicContact CG1-CD2 3.68Å; V123-F223 HydrophobicContact CG1-CE2 3.51Å; V123-F223 HydrophobicContact CG1-CZ 4.43Å
124	N	86.5	Confident	84.3	Confident	38 Å²	38	37.9 Å²	37.9	20%	0.203	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-20.4	173.7	-75.3	-27.5	0	0	0	113.5	V120 L122 L126 K222 F223	V120-N124 WeakPolarHBondContact CG1-ND2 3.24Å; V120-N124 VanDerWaalsContact O-CB 3.29Å; V120-N124 WeakPolarHBondContact O-CB 3.27Å; V120-N124 VanDerWaalsContact O-CG 3.27Å; V120-N124 PolarHBondContact O-N 3.39Å; V120-N124 PolarHBondContact O-ND2 2.95Å; L122-N124 VanDerWaalsContact C-N 3.28Å; L122-N124 PolarHBondContact O-N 3.22Å; N124-L126 VanDerWaalsContact C-N 3.31Å; N124-K222 WeakPolarHBondContact OD1-CA 3.43Å; N124-F223 PolarHBondContact ND2-O 2.9Å; N124-F223 WeakPolarHBondContact OD1-CD2 3.46Å; N124-F223 PolarHBondContact OD1-N 3.24Å
125	L	86.4	Confident	84.9	Confident	83 Å²	83	32 Å²	32	44%	0.435	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-14.1	169.5	-68.6	169.6	0	0	0	112.6	L52 K81 S121 L122 V123	L52-L125 HydrophobicContact CB-CD2 4.29Å; K81-L125 WeakPolarHBondContact CE-O 3.45Å; K81-L125 PolarHBondContact NZ-O 3.45Å; S121-L125 WeakPolarHBondContact O-CG 3.35Å; S121-L125 PolarHBondContact O-N 2.94Å; L122-L125 WeakPolarHBondContact O-CA 3.49Å; L122-L125 WeakPolarHBondContact O-CB 3.37Å; L122-L125 PolarHBondContact O-N 3.07Å; V123-L125 PolarHBondContact O-N 3.26Å
126	L	90.7	Very high	85.5	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.01	19%	0.192	C	C	.	.	S	Bend	trans	-80.3	156	176.6	-54.1	179.5	0	0	0	111.2	K81 L85 L91 L122 V123 N124 T128 I196 L199 R200	K81-L126 PolarHBondContact NZ-O 2.86Å; L85-L126 HydrophobicContact CD1-CD2 4.09Å; L85-L126 HydrophobicContact CD2-CD2 4.11Å; L91-L126 HydrophobicContact CD2-CD2 4.05Å; L122-L126 PolarHBondContact O-N 3.44Å; V123-L126 VanDerWaalsContact O-CB 3.31Å; V123-L126 WeakPolarHBondContact O-CB 3.34Å; V123-L126 PolarHBondContact O-N 2.94Å; N124-L126 VanDerWaalsContact C-N 3.31Å; L126-T128 PolarHBondContact O-N 2.78Å; L126-I196 HydrophobicContact CB-CG2 4.02Å; L126-I196 HydrophobicContact CD1-CG2 4.4Å; L126-I196 HydrophobicContact CD2-CG1 4.45Å; L126-L199 HydrophobicContact CD1-CB 3.69Å; L126-L199 HydrophobicContact CD1-CD1 3.8Å; L126-L199 HydrophobicContact CD1-CG 4.41Å; L126-R200 PolarHBondContact O-NH1 2.92Å; L126-R200 VanDerWaalsContact O-NH1 3.13Å
127	P	89.6	Confident	85.8	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-51.7	134.2	171.2	-28.6	35.5	0	0	0	112.6	V78 K81 L85 E131 L132 I196 R200	V78-P127 HydrophobicContact CG1-CB 3.85Å; V78-P127 HydrophobicContact CG1-CG 4.03Å; K81-P127 HydrophobicContact CD-CG 4.24Å; K81-P127 HydrophobicContact CG-CG 4.46Å; L85-P127 HydrophobicContact CD1-CG 4.27Å; P127-E131 WeakPolarHBondContact CA-OE2 3.43Å; P127-E131 HydrophobicContact CB-CB 4.23Å; P127-L132 HydrophobicContact CB-CD2 3.94Å; P127-L132 HydrophobicContact CB-CG 4.06Å; P127-I196 HydrophobicContact CG-CD1 4.14Å; P127-R200 WeakPolarHBondContact O-CD 3.25Å; P127-R200 PolarHBondContact O-NH1 3.16Å
128	T	86.7	Confident	86.3	Confident	46 Å²	46	39.6 Å²	39.6	28%	0.282	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-67.2	164.4	176.1	71.5	0	0	0	0	112.3	L126 S130 E131 L132 R200	L126-T128 PolarHBondContact O-N 2.78Å; T128-S130 VanDerWaalsContact C-N 3.26Å; T128-S130 PolarHBondContact O-N 3.07Å; T128-E131 PolarHBondContact N-OE2 3.22Å; T128-E131 PolarHBondContact O-N 3.38Å; T128-E131 VanDerWaalsContact O-N 3.14Å; T128-E131 WeakPolarHBondContact OG1-CB 3.43Å; T128-E131 VanDerWaalsContact OG1-CG 3.3Å; T128-E131 WeakPolarHBondContact OG1-CG 3.33Å; T128-E131 PolarHBondContact OG1-N 2.8Å; T128-E131 VanDerWaalsContact OG1-N 3.16Å; T128-L132 VanDerWaalsContact O-CG 3.29Å; T128-L132 WeakPolarHBondContact O-CG 3.45Å; T128-L132 PolarHBondContact O-N 2.85Å; T128-R200 VanDerWaalsContact CA-NH1 3.3Å
129	E	86.5	Confident	86.7	Confident	41 Å²	41	38.1 Å²	38.1	19%	0.192	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-40.5	175.5	-77.3	-178.6	-125.2	0	0	112.5	L132 S133 M152 L154 H204	E129-L132 PolarHBondContact O-N 2.95Å; E129-S133 WeakPolarHBondContact O-CB 3.37Å; E129-S133 PolarHBondContact O-N 2.81Å; E129-M152 HydrophobicContact CB-SD 3.88Å; E129-M152 HydrophobicContact CG-SD 4.16Å; E129-L154 HydrophobicContact CG-CB 4.11Å; E129-L154 HydrophobicContact CG-CD1 3.57Å; E129-L154 HydrophobicContact CG-CG 3.75Å; E129-L154 PolarHBondContact OE2-N 3.24Å; E129-H204 IonicContact OE1-CD2 3.9Å; E129-H204 IonicContact OE1-CE1 2.79Å; E129-H204 IonicContact OE1-NE2 2.79Å; E129-H204 PolarHBondContact OE1-NE2 3.23Å
130	S	82.2	Confident	86.8	Confident	78 Å²	78	46.4 Å²	46.4	55%	0.545	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-47.5	173	-177.9	0	0	0	0	111.5	T128 L132 S133 D134	T128-S130 VanDerWaalsContact C-N 3.26Å; T128-S130 PolarHBondContact O-N 3.07Å; S130-L132 VanDerWaalsContact C-N 3.31Å; S130-L132 PolarHBondContact O-N 2.93Å; S130-S133 WeakPolarHBondContact O-CB 3.42Å; S130-S133 PolarHBondContact O-N 2.83Å; S130-D134 WeakPolarHBondContact O-CB 3.28Å; S130-D134 PolarHBondContact O-N 3.01Å
131	E	87	Confident	87.1	Confident	30 Å²	30	52.8 Å²	52.8	14%	0.14	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-36.9	177.2	-73.6	180	142	0	0	112.6	S55 V78 P127 T128 I135	S55-E131 PolarHBondContact OG-OE1 2.78Å; V78-E131 HydrophobicContact CG1-CB 3.84Å; V78-E131 HydrophobicContact CG1-CG 4.43Å; V78-E131 HydrophobicContact CG2-CB 3.96Å; V78-E131 HydrophobicContact CG2-CG 3.74Å; P127-E131 WeakPolarHBondContact CA-OE2 3.43Å; P127-E131 HydrophobicContact CB-CB 4.23Å; T128-E131 PolarHBondContact N-OE2 3.22Å; T128-E131 PolarHBondContact O-N 3.38Å; T128-E131 VanDerWaalsContact O-N 3.14Å; T128-E131 WeakPolarHBondContact OG1-CB 3.43Å; T128-E131 VanDerWaalsContact OG1-CG 3.3Å; T128-E131 WeakPolarHBondContact OG1-CG 3.33Å; T128-E131 PolarHBondContact OG1-N 2.8Å; T128-E131 VanDerWaalsContact OG1-N 3.16Å; E131-I135 WeakPolarHBondContact O-CG1 3.32Å; E131-I135 PolarHBondContact O-N 3.31Å
132	L	90.3	Very high	87.5	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.7	-44.3	175.3	-70.4	169	0	0	0	111.6	P127 T128 E129 S130 D134 I135 N136 F150 L154 F193 I196	P127-L132 HydrophobicContact CB-CD2 3.94Å; P127-L132 HydrophobicContact CB-CG 4.06Å; T128-L132 VanDerWaalsContact O-CG 3.29Å; T128-L132 WeakPolarHBondContact O-CG 3.45Å; T128-L132 PolarHBondContact O-N 2.85Å; E129-L132 PolarHBondContact O-N 2.95Å; S130-L132 VanDerWaalsContact C-N 3.31Å; S130-L132 PolarHBondContact O-N 2.93Å; L132-D134 VanDerWaalsContact C-N 3.35Å; L132-I135 PolarHBondContact O-N 3.47Å; L132-N136 WeakPolarHBondContact O-CB 3.39Å; L132-N136 PolarHBondContact O-N 2.99Å; L132-F150 HydrophobicContact CB-CE2 4.32Å; L132-F150 HydrophobicContact CB-CZ 4.1Å; L132-L154 HydrophobicContact CD1-CD1 3.99Å; L132-F193 HydrophobicContact CB-CE2 4.02Å; L132-F193 HydrophobicContact CB-CZ 3.81Å; L132-F193 HydrophobicContact CD2-CD2 3.76Å; L132-F193 HydrophobicContact CD2-CE1 4.37Å; L132-F193 HydrophobicContact CD2-CE2 3.51Å; L132-F193 HydrophobicContact CD2-CG 4.3Å; L132-F193 HydrophobicContact CD2-CZ 3.84Å; L132-F193 HydrophobicContact CG-CE2 4.38Å; L132-F193 HydrophobicContact CG-CZ 4.38Å; L132-F193 WeakPolarHBondContact O-CE2 3.39Å; L132-I196 HydrophobicContact CD1-CG2 4Å; L132-I196 HydrophobicContact CD2-CG2 4.12Å
133	S	88.1	Confident	87.7	Confident	53 Å²	53	50.2 Å²	50.2	37%	0.371	27%	0.269	S	S	.	.	H	α-helix	trans	-59.4	-46.2	175.7	-171.3	0	0	0	0	111.1	E129 S130 I135 N136 A137	E129-S133 WeakPolarHBondContact O-CB 3.37Å; E129-S133 PolarHBondContact O-N 2.81Å; S130-S133 WeakPolarHBondContact O-CB 3.42Å; S130-S133 PolarHBondContact O-N 2.83Å; S133-I135 PolarHBondContact O-N 3.2Å; S133-N136 PolarHBondContact O-N 3.14Å; S133-A137 WeakPolarHBondContact O-CB 3.43Å; S133-A137 PolarHBondContact O-N 3.01Å
134	D	86.1	Confident	87.8	Confident	56 Å²	56	57 Å²	57	30%	0.299	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-45	175.9	-98.4	-39.5	0	0	0	112.7	S130 L132 N136 A137 R138	S130-D134 WeakPolarHBondContact O-CB 3.28Å; S130-D134 PolarHBondContact O-N 3.01Å; L132-D134 VanDerWaalsContact C-N 3.35Å; D134-N136 VanDerWaalsContact C-N 3.34Å; D134-A137 PolarHBondContact O-N 3.19Å; D134-R138 WeakPolarHBondContact O-CB 3.25Å; D134-R138 VanDerWaalsContact O-CG 3.29Å; D134-R138 WeakPolarHBondContact O-CG 3.3Å; D134-R138 PolarHBondContact O-N 3.11Å; D134-R138 IonicContact OD1-CZ 3.6Å; D134-R138 IonicContact OD1-NE 2.69Å; D134-R138 PolarHBondContact OD1-NE 3.24Å; D134-R138 IonicContact OD1-NH2 3.71Å
135	I	87.9	Confident	88	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-46.5	174.7	-77.4	-179.4	0	0	0	110.5	V78 E131 L132 S133 A137 R138 N139 I142 F193	V78-I135 HydrophobicContact CB-CD1 3.66Å; V78-I135 HydrophobicContact CB-CG1 4.18Å; V78-I135 HydrophobicContact CG1-CD1 3.21Å; V78-I135 HydrophobicContact CG1-CG1 4.04Å; E131-I135 WeakPolarHBondContact O-CG1 3.32Å; E131-I135 PolarHBondContact O-N 3.31Å; L132-I135 PolarHBondContact O-N 3.47Å; S133-I135 PolarHBondContact O-N 3.2Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 2.75Å; I135-R138 PolarHBondContact O-N 3.4Å; I135-N139 HydrophobicContact CG2-CB 4.36Å; I135-N139 WeakPolarHBondContact O-CB 3.36Å; I135-N139 PolarHBondContact O-N 3.29Å; I135-I142 HydrophobicContact CG2-CD1 3.88Å; I135-F193 HydrophobicContact CB-CE2 4.31Å; I135-F193 HydrophobicContact CG2-CD2 4.22Å; I135-F193 HydrophobicContact CG2-CE2 3.97Å
136	N	89.5	Confident	88.1	Confident	38 Å²	38	52.9 Å²	52.9	20%	0.203	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-35.5	-178.3	-171	58.1	0	0	0	111.6	L132 S133 D134 A143 F150 F193	L132-N136 WeakPolarHBondContact O-CB 3.39Å; L132-N136 PolarHBondContact O-N 2.99Å; S133-N136 PolarHBondContact O-N 3.14Å; D134-N136 VanDerWaalsContact C-N 3.34Å; N136-A143 WeakPolarHBondContact O-CB 3.36Å; N136-F150 HydrophobicContact CB-CD1 4.04Å; N136-F150 HydrophobicContact CB-CE1 3.94Å; N136-F150 WeakPolarHBondContact ND2-CD1 3.47Å; N136-F193 HydrophobicContact CB-CZ 4.19Å
137	A	87.7	Confident	87.9	Confident	79 Å²	79	62 Å²	62	65%	0.653	31%	0.311	S	S	*	.	H	α-helix	trans	-71.5	-40.4	175.9	0	0	0	0	0	112.9	S133 D134 I135	S133-A137 WeakPolarHBondContact O-CB 3.43Å; S133-A137 PolarHBondContact O-N 3.01Å; D134-A137 PolarHBondContact O-N 3.19Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 2.75Å
138	R	85.3	Confident	87.6	Confident	103 Å²	103	64.8 Å²	64.8	39%	0.389	34%	0.339	S	S	.	.	H	α-helix	trans	-93.6	-29.8	-170.1	-63.8	171.5	-170.9	-85.1	-4.7	113.7	D134 I135 K140	D134-R138 WeakPolarHBondContact O-CB 3.25Å; D134-R138 VanDerWaalsContact O-CG 3.29Å; D134-R138 WeakPolarHBondContact O-CG 3.3Å; D134-R138 PolarHBondContact O-N 3.11Å; D134-R138 IonicContact OD1-CZ 3.6Å; D134-R138 IonicContact OD1-NE 2.69Å; D134-R138 PolarHBondContact OD1-NE 3.24Å; D134-R138 IonicContact OD1-NH2 3.71Å; I135-R138 PolarHBondContact O-N 3.4Å; R138-K140 PolarHBondContact O-N 2.85Å
139	N	87.5	Confident	87.6	Confident	48 Å²	48	63.6 Å²	63.6	26%	0.257	33%	0.331	S	S	.	.			trans	-93.4	89.7	-179.2	-169.8	-31.6	0	0	0	111.2	I135 K141 I142 A143	I135-N139 HydrophobicContact CG2-CB 4.36Å; I135-N139 WeakPolarHBondContact O-CB 3.36Å; I135-N139 PolarHBondContact O-N 3.29Å; N139-K141 PolarHBondContact O-N 2.96Å; N139-K141 WeakPolarHBondContact OD1-CB 3.01Å; N139-K141 PolarHBondContact OD1-N 3.38Å; N139-I142 HydrophobicContact CB-CB 4.19Å; N139-I142 HydrophobicContact CB-CD1 4.25Å; N139-I142 HydrophobicContact CB-CG1 4.36Å; N139-I142 VanDerWaalsContact ND2-CD1 3.31Å; N139-I142 WeakPolarHBondContact ND2-CD1 3.27Å; N139-I142 PolarHBondContact O-N 3.39Å; N139-I142 VanDerWaalsContact O-N 3.1Å; N139-I142 PolarHBondContact OD1-N 2.87Å; N139-A143 WeakPolarHBondContact O-CB 3.45Å; N139-A143 PolarHBondContact O-N 2.88Å
140	K	87.8	Confident	87.7	Confident	182 Å²	182	62.7 Å²	62.7	79%	0.791	33%	0.327	S	S	*	.	H	α-helix	trans	-52.6	-31.7	-179.1	-64.3	-174	-179.7	-176.9	0	114.2	R138 K144	R138-K140 PolarHBondContact O-N 2.85Å; K140-K144 WeakPolarHBondContact O-CB 3.2Å; K140-K144 PolarHBondContact O-N 3.22Å; K140-K144 VanDerWaalsContact O-N 3.08Å
141	K	88.9	Confident	87.9	Confident	143 Å²	143	62.2 Å²	62.2	62%	0.622	31%	0.313	S	S	*	.	H	α-helix	trans	-69.1	-51.8	179.1	-175.2	-177.2	176.6	-174.8	0	110.5	N139 K144 E145	N139-K141 PolarHBondContact O-N 2.96Å; N139-K141 WeakPolarHBondContact OD1-CB 3.01Å; N139-K141 PolarHBondContact OD1-N 3.38Å; K141-K144 PolarHBondContact O-N 3.5Å; K141-E145 PolarHBondContact O-N 3.3Å
142	I	89.2	Confident	87.6	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-47.3	176.9	-65.9	177.8	0	0	0	109.9	L82 I135 N139 K144 E145 L146 T189 F193	L82-I142 HydrophobicContact CD2-CD1 3.88Å; I135-I142 HydrophobicContact CG2-CD1 3.88Å; N139-I142 HydrophobicContact CB-CB 4.19Å; N139-I142 HydrophobicContact CB-CD1 4.25Å; N139-I142 HydrophobicContact CB-CG1 4.36Å; N139-I142 VanDerWaalsContact ND2-CD1 3.31Å; N139-I142 WeakPolarHBondContact ND2-CD1 3.27Å; N139-I142 PolarHBondContact O-N 3.39Å; N139-I142 VanDerWaalsContact O-N 3.1Å; N139-I142 PolarHBondContact OD1-N 2.87Å; I142-K144 VanDerWaalsContact C-N 3.26Å; I142-K144 PolarHBondContact O-N 3.2Å; I142-E145 PolarHBondContact O-N 3.21Å; I142-L146 HydrophobicContact CG2-CD1 3.4Å; I142-L146 VanDerWaalsContact CG2-CD1 3.4Å; I142-L146 HydrophobicContact CG2-CG 3.9Å; I142-L146 WeakPolarHBondContact O-CB 3.09Å; I142-L146 WeakPolarHBondContact O-CG 3.32Å; I142-L146 PolarHBondContact O-N 2.69Å; I142-T189 HydrophobicContact CD1-CG2 3.79Å; I142-T189 HydrophobicContact CG1-CG2 4.32Å; I142-F193 HydrophobicContact CG2-CD2 4.32Å
143	A	89.8	Confident	87.3	Confident	29 Å²	29	64.4 Å²	64.4	24%	0.24	33%	0.325	C	S	.	.	H	α-helix	trans	-55.3	-39.1	178.6	0	0	0	0	0	113.2	N136 N139 R147	N136-A143 WeakPolarHBondContact O-CB 3.36Å; N139-A143 WeakPolarHBondContact O-CB 3.45Å; N139-A143 PolarHBondContact O-N 2.88Å; A143-R147 PolarHBondContact O-N 2.89Å; A143-R147 VanDerWaalsContact O-N 3.09Å
144	K	90.8	Very high	87.1	Confident	144 Å²	144	61.9 Å²	61.9	63%	0.626	31%	0.308	S	S	*	.	H	α-helix	trans	-67.1	-40.1	177.2	-176.3	179.5	179	-179.5	0	111.7	K140 K141 I142 R184	K140-K144 WeakPolarHBondContact O-CB 3.2Å; K140-K144 PolarHBondContact O-N 3.22Å; K140-K144 VanDerWaalsContact O-N 3.08Å; K141-K144 PolarHBondContact O-N 3.5Å; I142-K144 VanDerWaalsContact C-N 3.26Å; I142-K144 PolarHBondContact O-N 3.2Å; K144-R184 PolarHBondContact O-NH2 2.95Å
145	E	89.5	Confident	86.8	Confident	32 Å²	32	59.7 Å²	59.7	15%	0.15	30%	0.297	C	S	.	.	H	α-helix	trans	-71.3	-40.1	178.4	-69.1	-178.5	-137.8	0	0	111.6	K141 I142 R184 S187 A190	K141-E145 PolarHBondContact O-N 3.3Å; I142-E145 PolarHBondContact O-N 3.21Å; E145-R184 PolarHBondContact O-NH1 2.76Å; E145-R184 VanDerWaalsContact O-NH1 3.15Å; E145-S187 VanDerWaalsContact CD-OG 3.31Å; E145-S187 PolarHBondContact OE1-OG 2.8Å; E145-S187 WeakPolarHBondContact OE2-CB 3.48Å; E145-S187 PolarHBondContact OE2-N 3.19Å; E145-S187 PolarHBondContact OE2-OG 3.15Å; E145-A190 HydrophobicContact CB-CB 4.09Å; E145-A190 WeakPolarHBondContact OE2-CB 3.25Å
146	L	89.5	Confident	85.9	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	30%	0.299	C	S	.	.	S	Bend	trans	-87.9	5.4	-177.8	-60.4	-174.7	0	0	0	115.2	I142 G148 L149 A190 F193 L194	I142-L146 HydrophobicContact CG2-CD1 3.4Å; I142-L146 VanDerWaalsContact CG2-CD1 3.4Å; I142-L146 HydrophobicContact CG2-CG 3.9Å; I142-L146 WeakPolarHBondContact O-CB 3.09Å; I142-L146 WeakPolarHBondContact O-CG 3.32Å; I142-L146 PolarHBondContact O-N 2.69Å; L146-G148 PolarHBondContact O-N 2.94Å; L146-G148 VanDerWaalsContact O-N 3.09Å; L146-L149 WeakPolarHBondContact O-CB 3.39Å; L146-L149 PolarHBondContact O-N 2.85Å; L146-A190 HydrophobicContact CD2-CB 3.94Å; L146-A190 HydrophobicContact CG-CB 4.43Å; L146-F193 HydrophobicContact CD1-CB 4.22Å; L146-F193 HydrophobicContact CD1-CD1 3.22Å; L146-F193 HydrophobicContact CD1-CD2 4.13Å; L146-F193 HydrophobicContact CD1-CE1 3.44Å; L146-F193 VanDerWaalsContact CD1-CE1 3.44Å; L146-F193 HydrophobicContact CD1-CE2 4.29Å; L146-F193 HydrophobicContact CD1-CG 3.6Å; L146-F193 HydrophobicContact CD1-CZ 3.98Å; L146-L194 HydrophobicContact CD2-CD1 4.06Å; L146-L194 HydrophobicContact CD2-CD2 3.87Å; L146-L194 HydrophobicContact CD2-CG 3.74Å
147	R	85.7	Confident	85.7	Confident	194 Å²	194	58.4 Å²	58.4	73%	0.732	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	118.3	-178.8	-175.6	-177.1	-62.9	-139.3	-3.2	111.1	A143 L149	A143-R147 PolarHBondContact O-N 2.89Å; A143-R147 VanDerWaalsContact O-N 3.09Å; R147-L149 PolarHBondContact O-N 3.42Å
148	G	83.5	Confident	85.4	Confident	58 Å²	58	58.3 Å²	58.3	60%	0.598	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-2.4	-177.9	0	0	0	0	0	114.8	L146	L146-G148 PolarHBondContact O-N 2.94Å; L146-G148 VanDerWaalsContact O-N 3.09Å
149	L	86.9	Confident	85.3	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.11	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-9	-177.6	-57.6	178.3	0	0	0	113.2	L146 R147 W157 V161 M186	L146-L149 WeakPolarHBondContact O-CB 3.39Å; L146-L149 PolarHBondContact O-N 2.85Å; R147-L149 PolarHBondContact O-N 3.42Å; L149-W157 PolarHBondContact O-NE1 3.36Å; L149-V161 HydrophobicContact CD1-CG1 4.25Å; L149-V161 HydrophobicContact CD1-CG2 4.06Å; L149-V161 HydrophobicContact CD2-CB 4.32Å; L149-V161 HydrophobicContact CD2-CG1 3.42Å; L149-V161 VanDerWaalsContact CD2-CG1 3.42Å; L149-V161 HydrophobicContact CD2-CG2 3.94Å; L149-V161 HydrophobicContact CG-CG1 4.47Å; L149-V161 HydrophobicContact CG-CG2 4.43Å; L149-M186 HydrophobicContact CD1-CE 3.75Å
150	F	88.7	Confident	84.9	Confident	22 Å²	22	55.1 Å²	55.1	10%	0.096	26%	0.264	C	S	.	.			trans	-135.1	131.8	-179.3	171.9	-102.5	0	0	0	109.9	L132 N136 M152 L154 F193	L132-F150 HydrophobicContact CB-CE2 4.32Å; L132-F150 HydrophobicContact CB-CZ 4.1Å; N136-F150 HydrophobicContact CB-CD1 4.04Å; N136-F150 HydrophobicContact CB-CE1 3.94Å; N136-F150 WeakPolarHBondContact ND2-CD1 3.47Å; F150-M152 HydrophobicContact CD2-CE 4.03Å; F150-M152 HydrophobicContact CE1-CE 4.16Å; F150-M152 HydrophobicContact CE2-CE 3.16Å; F150-M152 HydrophobicContact CE2-SD 4.39Å; F150-M152 HydrophobicContact CZ-CE 3.24Å; F150-M152 HydrophobicContact CZ-CG 4.31Å; F150-M152 HydrophobicContact CZ-SD 3.96Å; F150-L154 HydrophobicContact CD2-CD2 4.38Å; F150-L154 HydrophobicContact CE2-CD2 4.02Å; F150-F193 HydrophobicContact CB-CE1 4.33Å; F150-F193 HydrophobicContact CD1-CE1 4.4Å; F150-F193 HydrophobicContact CD1-CZ 4.37Å; F150-F193 AromaticContact CD2-CE1 3.49Å; F150-F193 HydrophobicContact CD2-CE1 3.49Å; F150-F193 VanDerWaalsContact CD2-CE1 3.49Å; F150-F193 HydrophobicContact CD2-CZ 4.03Å; F150-F193 HydrophobicContact CE1-CZ 4.26Å; F150-F193 AromaticContact CE2-CE1 3.7Å; F150-F193 HydrophobicContact CE2-CE1 3.7Å; F150-F193 AromaticContact CE2-CZ 3.84Å; F150-F193 HydrophobicContact CE2-CZ 3.84Å; F150-F193 AromaticContact CG-CE1 3.83Å; F150-F193 HydrophobicContact CG-CE1 3.83Å; F150-F193 HydrophobicContact CG-CZ 4.24Å; F150-F193 HydrophobicContact CZ-CE1 4.28Å; F150-F193 AromaticContact CZ-CZ 3.97Å; F150-F193 HydrophobicContact CZ-CZ 3.97Å
151	Y	85.7	Confident	84.5	Confident	67 Å²	67	47.3 Å²	47.3	26%	0.263	23%	0.231	S	C	.	.			trans	-152.3	156.1	172.5	61.1	-94.7	0	0	0	109.5	E156 W157 E158	Y151-E156 HydrophobicContact CE2-CB 4.45Å; Y151-E156 WeakPolarHBondContact CE2-O 3.39Å; Y151-E156 PolarHBondContact OH-O 2.62Å; Y151-W157 AromaticContact CD1-CD1 3.69Å; Y151-W157 AromaticContact CE1-CD1 3.65Å; Y151-W157 HydrophobicContact CE1-CG 4.49Å; Y151-W157 HydrophobicContact CE2-CB 4.23Å; Y151-W157 WeakPolarHBondContact OH-CA 3.36Å; Y151-E158 PolarHBondContact OH-N 3.26Å; Y151-E158 VanDerWaalsContact OH-N 3.08Å
152	M	80.5	Confident	84.2	Confident	62 Å²	62	41.5 Å²	41.5	31%	0.305	21%	0.209	S	C	.	.	S	Bend	trans	-100.5	155.1	175.2	-65.9	-66.4	83.6	0	0	110.8	E129 F150 L154	E129-M152 HydrophobicContact CB-SD 3.88Å; E129-M152 HydrophobicContact CG-SD 4.16Å; F150-M152 HydrophobicContact CD2-CE 4.03Å; F150-M152 HydrophobicContact CE1-CE 4.16Å; F150-M152 HydrophobicContact CE2-CE 3.16Å; F150-M152 HydrophobicContact CE2-SD 4.39Å; F150-M152 HydrophobicContact CZ-CE 3.24Å; F150-M152 HydrophobicContact CZ-CG 4.31Å; F150-M152 HydrophobicContact CZ-SD 3.96Å; M152-L154 HydrophobicContact CE-CB 4.33Å; M152-L154 HydrophobicContact CE-CD1 4.44Å; M152-L154 HydrophobicContact CE-CD2 3.3Å; M152-L154 HydrophobicContact CE-CG 3.36Å; M152-L154 HydrophobicContact SD-CG 4.28Å
153	P	84.5	Confident	84.1	Confident	14 Å²	14	41.4 Å²	41.4	9%	0.091	21%	0.208	C	C	.	.			cis	-73.9	155.3	-6.3	35.8	-41.6	0	0	0	112.6	S155 E156 W157 W335	P153-S155 PolarHBondContact O-N 3.35Å; P153-E156 HydrophobicContact CG-CB 4.06Å; P153-E156 HydrophobicContact CG-CG 3.8Å; P153-E156 PolarHBondContact O-N 3.35Å; P153-W157 PolarHBondContact O-N 2.92Å; P153-W335 HydrophobicContact CB-CH2 4.15Å; P153-W335 HydrophobicContact CB-CZ2 3.71Å; P153-W335 HydrophobicContact CG-CH2 3.38Å; P153-W335 HydrophobicContact CG-CZ2 3.48Å; P153-W335 VanDerWaalsContact CG-CZ2 3.48Å; P153-W335 HydrophobicContact CG-CZ3 4.18Å
154	L	84.3	Confident	83.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-66.3	-23.1	177.2	-75.8	-174.6	0	0	0	113.7	E129 L132 F150 M152 E156 W157 C197 R200	E129-L154 HydrophobicContact CG-CB 4.11Å; E129-L154 HydrophobicContact CG-CD1 3.57Å; E129-L154 HydrophobicContact CG-CG 3.75Å; E129-L154 PolarHBondContact OE2-N 3.24Å; L132-L154 HydrophobicContact CD1-CD1 3.99Å; F150-L154 HydrophobicContact CD2-CD2 4.38Å; F150-L154 HydrophobicContact CE2-CD2 4.02Å; M152-L154 HydrophobicContact CE-CB 4.33Å; M152-L154 HydrophobicContact CE-CD1 4.44Å; M152-L154 HydrophobicContact CE-CD2 3.3Å; M152-L154 HydrophobicContact CE-CG 3.36Å; M152-L154 HydrophobicContact SD-CG 4.28Å; L154-E156 PolarHBondContact O-N 2.91Å; L154-W157 HydrophobicContact CD2-CB 3.88Å; L154-W157 HydrophobicContact CD2-CD2 4.25Å; L154-W157 HydrophobicContact CD2-CE3 4.44Å; L154-W157 HydrophobicContact CD2-CG 4Å; L154-W157 PolarHBondContact O-N 3.18Å; L154-W157 VanDerWaalsContact O-N 3.16Å; L154-C197 HydrophobicContact CD1-CB 4.32Å; L154-C197 HydrophobicContact CD2-CB 3.77Å; L154-R200 HydrophobicContact CD1-CB 3.65Å; L154-R200 HydrophobicContact CD1-CG 4.33Å
155	S	79	Confident	83.6	Confident	11 Å²	11	36.9 Å²	36.9	8%	0.077	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-61.4	-22.2	174.7	56.5	0	0	0	0	113.3	P153 R208 S338	P153-S155 PolarHBondContact O-N 3.35Å; S155-R208 PolarHBondContact O-NH2 2.96Å; S155-S338 VanDerWaalsContact CB-OG 3.31Å; S155-S338 WeakPolarHBondContact CB-OG 3.45Å
156	E	70	Confident	83.4	Confident	9 Å²	9	35.4 Å²	35.4	4%	0.042	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-108.4	-5.6	176	-63.8	-172.9	-173.2	0	0	113.7	Y151 P153 L154 W335 R345	Y151-E156 HydrophobicContact CE2-CB 4.45Å; Y151-E156 WeakPolarHBondContact CE2-O 3.39Å; Y151-E156 PolarHBondContact OH-O 2.62Å; P153-E156 HydrophobicContact CG-CB 4.06Å; P153-E156 HydrophobicContact CG-CG 3.8Å; P153-E156 PolarHBondContact O-N 3.35Å; L154-E156 PolarHBondContact O-N 2.91Å; E156-W335 WeakPolarHBondContact OE1-CZ3 3.09Å; E156-R345 IonicContact OE2-CZ 3.91Å; E156-R345 IonicContact OE2-NE 3.01Å; E156-R345 PolarHBondContact OE2-NE 3.03Å; E156-R345 IonicContact OE2-NH2 2.67Å; E156-R345 PolarHBondContact OE2-NH2 2.99Å
157	W	84.8	Confident	82.8	Confident	1 Å²	1	38.6 Å²	38.6	0%	0.004	21%	0.211	C	C	.	.			trans	-69.7	132.5	-177.3	178.6	76.8	0	0	0	111	L149 Y151 P153 L154 Q159 L194 C197 C198 K201	L149-W157 PolarHBondContact O-NE1 3.36Å; Y151-W157 AromaticContact CD1-CD1 3.69Å; Y151-W157 AromaticContact CE1-CD1 3.65Å; Y151-W157 HydrophobicContact CE1-CG 4.49Å; Y151-W157 HydrophobicContact CE2-CB 4.23Å; Y151-W157 WeakPolarHBondContact OH-CA 3.36Å; P153-W157 PolarHBondContact O-N 2.92Å; L154-W157 HydrophobicContact CD2-CB 3.88Å; L154-W157 HydrophobicContact CD2-CD2 4.25Å; L154-W157 HydrophobicContact CD2-CE3 4.44Å; L154-W157 HydrophobicContact CD2-CG 4Å; L154-W157 PolarHBondContact O-N 3.18Å; L154-W157 VanDerWaalsContact O-N 3.16Å; W157-Q159 HydrophobicContact CH2-CB 3.55Å; W157-Q159 HydrophobicContact CH2-CG 3.95Å; W157-Q159 HydrophobicContact CZ2-CB 4.19Å; W157-Q159 HydrophobicContact CZ3-CB 3.92Å; W157-L194 HydrophobicContact CH2-CD2 4.35Å; W157-L194 HydrophobicContact CZ2-CD2 3.81Å; W157-C197 HydrophobicContact CD2-CB 4.36Å; W157-C197 HydrophobicContact CE3-CB 3.98Å; W157-C197 HydrophobicContact CH2-CB 4Å; W157-C197 HydrophobicContact CZ2-CB 4.41Å; W157-C197 HydrophobicContact CZ3-CB 3.78Å; W157-C198 VanDerWaalsContact CZ3-SG 3.6Å; W157-K201 HydrophobicContact CE3-CD 4.35Å; W157-K201 VanDerWaalsContact O-CD 3.23Å; W157-K201 WeakPolarHBondContact O-CD 3.47Å; W157-K201 VanDerWaalsContact O-CE 3.28Å; W157-K201 WeakPolarHBondContact O-CE 3.27Å; W157-K201 PolarHBondContact O-NZ 3.43Å
158	E	80.8	Confident	82.2	Confident	77 Å²	77	32.9 Å²	32.9	36%	0.36	20%	0.2	S	C	.	.			trans	-111.4	136.1	173	-71.7	-61.1	153.8	0	0	110.6	Y151 E160 K201	Y151-E158 PolarHBondContact OH-N 3.26Å; Y151-E158 VanDerWaalsContact OH-N 3.08Å; E158-E160 PolarHBondContact O-N 2.72Å; E158-K201 IonicContact OE1-NZ 3.3Å; E158-K201 PolarHBondContact OE1-NZ 2.91Å; E158-K201 IonicContact OE2-NZ 2.89Å; E158-K201 PolarHBondContact OE2-NZ 3.19Å
159	Q	84.6	Confident	81.8	Confident	6 Å²	6	30.1 Å²	30.1	3%	0.028	17%	0.171	C	C	.	.			trans	-75	100.7	175.5	-178.9	-169.8	-15.8	0	0	109	K95 W157 V161 D166 L177 C198	K95-Q159 VanDerWaalsContact CE-OE1 3.32Å; W157-Q159 HydrophobicContact CH2-CB 3.55Å; W157-Q159 HydrophobicContact CH2-CG 3.95Å; W157-Q159 HydrophobicContact CZ2-CB 4.19Å; W157-Q159 HydrophobicContact CZ3-CB 3.92Å; Q159-V161 VanDerWaalsContact C-N 3.28Å; Q159-V161 VanDerWaalsContact CG-O 3.26Å; Q159-V161 WeakPolarHBondContact CG-O 3.37Å; Q159-V161 PolarHBondContact NE2-O 3.07Å; Q159-V161 PolarHBondContact O-N 2.95Å; Q159-D166 PolarHBondContact NE2-OD2 3.3Å; Q159-L177 HydrophobicContact CB-CD1 4.46Å; Q159-L177 HydrophobicContact CB-CD2 4.03Å; Q159-L177 WeakPolarHBondContact O-CD2 3.27Å; Q159-C198 PolarHBondContact OE1-SG 2.71Å
160	E	79	Confident	81.1	Confident	79 Å²	79	33 Å²	33	37%	0.369	18%	0.183	S	C	.	.			trans	-80.1	-9.7	-179.2	-62.1	-164.3	-172.3	0	0	114.6	E158 R180	E158-E160 PolarHBondContact O-N 2.72Å; E160-R180 IonicContact OE2-NH1 3.17Å; E160-R180 PolarHBondContact OE2-NH1 3.13Å
161	V	79.6	Confident	80.1	Confident	18 Å²	18	38.4 Å²	38.4	11%	0.109	21%	0.213	C	C	.	.	S	Bend	trans	-136.4	125.1	-165.7	-75.4	0	0	0	0	110	L149 Q159 L163 I182 L194	L149-V161 HydrophobicContact CD1-CG1 4.25Å; L149-V161 HydrophobicContact CD1-CG2 4.06Å; L149-V161 HydrophobicContact CD2-CB 4.32Å; L149-V161 HydrophobicContact CD2-CG1 3.42Å; L149-V161 VanDerWaalsContact CD2-CG1 3.42Å; L149-V161 HydrophobicContact CD2-CG2 3.94Å; L149-V161 HydrophobicContact CG-CG1 4.47Å; L149-V161 HydrophobicContact CG-CG2 4.43Å; Q159-V161 VanDerWaalsContact C-N 3.28Å; Q159-V161 VanDerWaalsContact CG-O 3.26Å; Q159-V161 WeakPolarHBondContact CG-O 3.37Å; Q159-V161 PolarHBondContact NE2-O 3.07Å; Q159-V161 PolarHBondContact O-N 2.95Å; V161-L163 PolarHBondContact O-N 3.26Å; V161-I182 HydrophobicContact CB-CD1 3.43Å; V161-I182 VanDerWaalsContact CB-CD1 3.43Å; V161-I182 HydrophobicContact CB-CG1 3.6Å; V161-I182 HydrophobicContact CG1-CD1 4.19Å; V161-I182 HydrophobicContact CG1-CG1 3.95Å; V161-I182 HydrophobicContact CG2-CD1 4.29Å; V161-L194 HydrophobicContact CG2-CD1 3.71Å
162	S	83	Confident	79.4	Confident	21 Å²	21	38.6 Å²	38.6	15%	0.147	22%	0.217	C	C	.	.			trans	-71.5	121.4	-177.4	-43.8	0	0	0	0	113.2	L177 H178 R180 I182	S162-L177 PolarHBondContact OG-O 2.98Å; S162-L177 VanDerWaalsContact OG-O 3.11Å; S162-H178 WeakPolarHBondContact OG-CA 3.44Å; S162-R180 PolarHBondContact OG-O 2.76Å; S162-I182 WeakPolarHBondContact O-CD1 3.38Å
163	L	87.1	Confident	79	Confident	3 Å²	3	36 Å²	36	2%	0.016	21%	0.205	C	C	.	.			trans	-71.7	163.5	174.5	-63	176.4	0	0	0	110.8	V161 E165 D166 A167 A191 L194 R195	V161-L163 PolarHBondContact O-N 3.26Å; L163-E165 HydrophobicContact CB-CG 4.44Å; L163-E165 WeakPolarHBondContact CD1-OE1 3.46Å; L163-E165 PolarHBondContact O-N 2.95Å; L163-E165 VanDerWaalsContact O-N 3.15Å; L163-D166 WeakPolarHBondContact CB-OD2 3.28Å; L163-D166 PolarHBondContact N-OD2 3.16Å; L163-D166 VanDerWaalsContact O-CB 3.29Å; L163-D166 WeakPolarHBondContact O-CB 3.12Å; L163-D166 PolarHBondContact O-N 2.72Å; L163-A167 PolarHBondContact O-N 3.18Å; L163-A191 HydrophobicContact CD2-CB 4.19Å; L163-L194 HydrophobicContact CD1-CB 4.39Å; L163-L194 HydrophobicContact CD2-CB 3.96Å; L163-L194 HydrophobicContact CD2-CD1 4.21Å; L163-R195 HydrophobicContact CD1-CB 3.99Å
164	P	84.4	Confident	78.2	Confident	74 Å²	74	43.4 Å²	43.4	48%	0.481	24%	0.236	S	C	.	.	H	α-helix	trans	-52.6	-38.8	-179.2	-28.9	36.5	0	0	0	114.1	D166	P164-D166 VanDerWaalsContact C-N 3.33Å
165	E	84.5	Confident	77.3	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.019	24%	0.242	C	C	.	.	H	α-helix	trans	-69.5	-27.6	176.7	63.1	-87.9	-152.9	0	0	114	M28 K92 K95 V96 L163 C168 V169 R195	M28-E165 HydrophobicContact CE-CB 3.48Å; M28-E165 VanDerWaalsContact CE-CB 3.48Å; M28-E165 HydrophobicContact SD-CB 4.27Å; K92-E165 HydrophobicContact CB-CB 4.19Å; K92-E165 HydrophobicContact CB-CG 4.38Å; K95-E165 HydrophobicContact CD-CG 4.4Å; V96-E165 HydrophobicContact CG2-CB 3.85Å; V96-E165 HydrophobicContact CG2-CG 3.86Å; L163-E165 HydrophobicContact CB-CG 4.44Å; L163-E165 WeakPolarHBondContact CD1-OE1 3.46Å; L163-E165 PolarHBondContact O-N 2.95Å; L163-E165 VanDerWaalsContact O-N 3.15Å; E165-C168 WeakPolarHBondContact O-CB 3.46Å; E165-C168 PolarHBondContact O-N 3.23Å; E165-V169 PolarHBondContact O-N 3.28Å; E165-R195 VanDerWaalsContact CD-NH2 3.26Å; E165-R195 IonicContact OE1-CZ 3.27Å; E165-R195 VanDerWaalsContact OE1-CZ 3.26Å; E165-R195 IonicContact OE1-NE 3.52Å; E165-R195 PolarHBondContact OE1-NE 3.47Å; E165-R195 IonicContact OE1-NH2 3.56Å; E165-R195 PolarHBondContact OE1-NH2 3.44Å; E165-R195 IonicContact OE2-CZ 3.96Å; E165-R195 IonicContact OE2-NE 2.87Å; E165-R195 IonicContact OE2-NH2 3.56Å; E165-R195 PolarHBondContact OE2-NH2 2.97Å
166	D	84.6	Confident	76.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70.5	-39.9	178	-68.4	-39.9	0	0	0	110.5	K95 N99 Q159 L163 P164 C168 V169 F170 H178	K95-D166 VanDerWaalsContact NZ-CG 3.27Å; K95-D166 IonicContact NZ-OD1 2.66Å; K95-D166 PolarHBondContact NZ-OD1 3.3Å; K95-D166 IonicContact NZ-OD2 3.05Å; K95-D166 PolarHBondContact NZ-OD2 2.75Å; K95-D166 VanDerWaalsContact NZ-OD2 3.14Å; N99-D166 PolarHBondContact ND2-OD1 3.08Å; N99-D166 VanDerWaalsContact ND2-OD1 3.12Å; Q159-D166 PolarHBondContact NE2-OD2 3.3Å; L163-D166 WeakPolarHBondContact CB-OD2 3.28Å; L163-D166 PolarHBondContact N-OD2 3.16Å; L163-D166 VanDerWaalsContact O-CB 3.29Å; L163-D166 WeakPolarHBondContact O-CB 3.12Å; L163-D166 PolarHBondContact O-N 2.72Å; P164-D166 VanDerWaalsContact C-N 3.33Å; D166-C168 PolarHBondContact O-N 3.29Å; D166-V169 CarbonylContact O-C 3.56Å; D166-V169 PolarHBondContact O-N 2.92Å; D166-V169 VanDerWaalsContact O-N 3.08Å; D166-F170 PolarHBondContact O-N 2.84Å; D166-H178 VanDerWaalsContact CB-CD2 3.5Å; D166-H178 WeakPolarHBondContact CB-CD2 3.28Å; D166-H178 WeakPolarHBondContact CB-NE2 2.96Å; D166-H178 PolarHBondContact O-CD2 3.49Å; D166-H178 PolarHBondContact O-NE2 2.79Å; D166-H178 IonicContact OD1-NE2 3.59Å
167	A	76.9	Confident	75.6	Confident	70 Å²	70	52.9 Å²	52.9	58%	0.579	27%	0.273	S	S	*	.	H	α-helix	trans	-58.6	-34.5	174.8	0	0	0	0	0	112.1	L163 V169	L163-A167 PolarHBondContact O-N 3.18Å; A167-V169 VanDerWaalsContact C-N 3.33Å; A167-V169 PolarHBondContact O-N 3.43Å
168	C	73.1	Confident	74.1	Confident	74 Å²	74	53.2 Å²	53.2	50%	0.5	27%	0.274	S	S	.	.	H	α-helix	trans	-68.4	-30.7	177.8	-62.4	0	0	0	0	113	I24 M28 E165 D166	I24-C168 WeakPolarHBondContact CD1-O 3.38Å; I24-C168 HydrophobicContact CG2-CB 3.98Å; M28-C168 HydrophobicContact CE-CB 4.01Å; E165-C168 WeakPolarHBondContact O-CB 3.46Å; E165-C168 PolarHBondContact O-N 3.23Å; D166-C168 PolarHBondContact O-N 3.29Å
169	V	75.3	Confident	72.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-109.6	6.6	-174.9	-60.7	0	0	0	0	113.6	F21 I24 V96 E165 D166 A167 D171 I172 L173	F21-V169 HydrophobicContact CD2-CG1 4.47Å; I24-V169 HydrophobicContact CB-CG1 4.5Å; I24-V169 HydrophobicContact CD1-CG1 4.16Å; I24-V169 HydrophobicContact CG2-CG1 3.8Å; V96-V169 HydrophobicContact CG1-CB 4.42Å; V96-V169 HydrophobicContact CG1-CG1 3.7Å; V96-V169 HydrophobicContact CG1-CG2 4.22Å; V96-V169 HydrophobicContact CG2-CG1 4.47Å; V96-V169 HydrophobicContact CG2-CG2 4.4Å; E165-V169 PolarHBondContact O-N 3.28Å; D166-V169 CarbonylContact O-C 3.56Å; D166-V169 PolarHBondContact O-N 2.92Å; D166-V169 VanDerWaalsContact O-N 3.08Å; A167-V169 VanDerWaalsContact C-N 3.33Å; A167-V169 PolarHBondContact O-N 3.43Å; V169-D171 VanDerWaalsContact C-N 3.33Å; V169-D171 PolarHBondContact O-N 3.09Å; V169-I172 WeakPolarHBondContact O-CA 3.5Å; V169-I172 WeakPolarHBondContact O-CB 3.42Å; V169-I172 PolarHBondContact O-N 3.09Å; V169-L173 HydrophobicContact CB-CD1 4.13Å; V169-L173 HydrophobicContact CB-CG 4.15Å; V169-L173 HydrophobicContact CG2-CD1 3.69Å; V169-L173 HydrophobicContact CG2-CG 4.15Å; V169-L173 PolarHBondContact O-N 3.38Å
170	F	72.7	Confident	71.1	Confident	81 Å²	81	64.2 Å²	64.2	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-54	-49.2	-175	174	-129.1	0	0	0	112.5	D166 I172 K174 H178	D166-F170 PolarHBondContact O-N 2.84Å; F170-I172 PolarHBondContact O-N 3.43Å; F170-K174 WeakPolarHBondContact O-CA 3.46Å; F170-K174 PolarHBondContact O-N 3.01Å; F170-H178 HydrophobicContact CB-CB 4.42Å; F170-H178 HydrophobicContact CD2-CB 2.93Å; F170-H178 AromaticContact CD2-CD2 3.92Å; F170-H178 AromaticContact CD2-CG 3.46Å; F170-H178 VanDerWaalsContact CD2-CG 3.46Å; F170-H178 HydrophobicContact CE2-CB 3.18Å; F170-H178 HydrophobicContact CG-CB 3.91Å; F170-H178 HydrophobicContact CZ-CB 4.34Å
171	D	67.1	Low	69.6	Low	135 Å²	135	66.5 Å²	66.5	72%	0.722	34%	0.338	S	S	*	.	H	α-helix	trans	-66.7	-18.8	-178.2	-65.1	-34	0	0	0	112.8	V169	V169-D171 VanDerWaalsContact C-N 3.33Å; V169-D171 PolarHBondContact O-N 3.09Å
172	I	71.6	Confident	68.4	Low	71 Å²	71	68.2 Å²	68.2	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-94.1	-55.6	-177.1	-54.9	175.7	0	0	0	110.7	F21 I24 V169 F170	F21-I172 HydrophobicContact CB-CD1 4.09Å; F21-I172 HydrophobicContact CB-CG2 4.08Å; F21-I172 HydrophobicContact CD2-CG2 3.97Å; F21-I172 HydrophobicContact CG-CG2 4.4Å; I24-I172 HydrophobicContact CD1-CD1 3.5Å; I24-I172 VanDerWaalsContact CD1-CD1 3.5Å; V169-I172 WeakPolarHBondContact O-CA 3.5Å; V169-I172 WeakPolarHBondContact O-CB 3.42Å; V169-I172 PolarHBondContact O-N 3.09Å; F170-I172 PolarHBondContact O-N 3.43Å
173	L	72.5	Confident	66.7	Low	8 Å²	8	74 Å²	74	4%	0.042	38%	0.38	C	S	.	.	H	α-helix	trans	-87.3	-20.1	-171.8	-60.6	-175.8	0	0	0	113.2	F21 V96 N99 W100 L103 V169 L175	F21-L173 HydrophobicContact CD2-CD2 4.26Å; F21-L173 HydrophobicContact CE2-CD1 4.16Å; F21-L173 HydrophobicContact CE2-CD2 3.88Å; F21-L173 HydrophobicContact CE2-CG 4.26Å; V96-L173 HydrophobicContact CG1-CD1 4.27Å; N99-L173 HydrophobicContact CB-CD1 3.61Å; W100-L173 HydrophobicContact CB-CD2 3.97Å; W100-L173 HydrophobicContact CG-CD2 4.28Å; L103-L173 HydrophobicContact CD1-CB 4.07Å; L103-L173 HydrophobicContact CD1-CD2 4.1Å; L103-L173 VanDerWaalsContact CD1-O 3.27Å; L103-L173 WeakPolarHBondContact CD1-O 3.17Å; V169-L173 HydrophobicContact CB-CD1 4.13Å; V169-L173 HydrophobicContact CB-CG 4.15Å; V169-L173 HydrophobicContact CG2-CD1 3.69Å; V169-L173 HydrophobicContact CG2-CG 4.15Å; V169-L173 PolarHBondContact O-N 3.38Å; L173-L175 HydrophobicContact CB-CD1 4.31Å; L173-L175 HydrophobicContact CB-CG 4.39Å; L173-L175 PolarHBondContact O-N 2.87Å
174	K	67.3	Low	65.4	Low	169 Å²	169	79.5 Å²	79.5	74%	0.735	40%	0.401	S	S	*	.			trans	45.2	25	176.6	-62.1	-176.5	-179.8	175.5	0	115.6	F170	F170-K174 WeakPolarHBondContact O-CA 3.46Å; F170-K174 PolarHBondContact O-N 3.01Å
175	L	65.2	Low	64.6	Low	25 Å²	25	87.8 Å²	87.8	13%	0.131	42%	0.422	C	S	.	.			trans	-66.8	146.1	179.8	-71.4	161.7	0	0	0	110.3	N99 L103 L173 L177 H178	N99-L175 HydrophobicContact CB-CD1 3.6Å; L103-L175 HydrophobicContact CD1-CD1 4.47Å; L103-L175 HydrophobicContact CD1-CD2 4.11Å; L103-L175 HydrophobicContact CD1-CG 4.07Å; L103-L175 HydrophobicContact CD2-CD2 3.55Å; L103-L175 HydrophobicContact CD2-CG 4.36Å; L103-L175 HydrophobicContact CG-CD2 3.91Å; L103-L175 HydrophobicContact CG-CG 4.4Å; L173-L175 HydrophobicContact CB-CD1 4.31Å; L173-L175 HydrophobicContact CB-CG 4.39Å; L173-L175 PolarHBondContact O-N 2.87Å; L175-L177 HydrophobicContact CB-CB 4.4Å; L175-L177 HydrophobicContact CB-CD1 4.5Å; L175-L177 HydrophobicContact CB-CG 4.22Å; L175-L177 HydrophobicContact CD1-CD1 4.4Å; L175-L177 PolarHBondContact O-N 2.98Å; L175-H178 PolarHBondContact O-N 3.09Å; L175-H178 PolarHBondContact O-ND1 3.45Å
176	R	57.7	Low	64.5	Low	171 Å²	171	89.9 Å²	89.9	65%	0.645	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-52.1	-27.5	176.7	-68.2	-173.9	-178.4	171.2	1.9	113.2	H178 Q179	R176-H178 PolarHBondContact O-N 3.19Å; R176-Q179 PolarHBondContact O-N 2.79Å
177	L	55.7	Low	64.7	Low	24 Å²	24	91.4 Å²	91.4	13%	0.126	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-54.9	-17.7	177.3	-50.4	-178.9	0	0	0	114	Q159 S162 L175	Q159-L177 HydrophobicContact CB-CD1 4.46Å; Q159-L177 HydrophobicContact CB-CD2 4.03Å; Q159-L177 WeakPolarHBondContact O-CD2 3.27Å; S162-L177 PolarHBondContact OG-O 2.98Å; S162-L177 VanDerWaalsContact OG-O 3.11Å; L175-L177 HydrophobicContact CB-CB 4.4Å; L175-L177 HydrophobicContact CB-CD1 4.5Å; L175-L177 HydrophobicContact CB-CG 4.22Å; L175-L177 HydrophobicContact CD1-CD1 4.4Å; L175-L177 PolarHBondContact O-N 2.98Å
178	H	54.2	Low	65.3	Low	7 Å²	7	91 Å²	91	3%	0.032	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-103.4	0.7	-174	-54	92.9	0	0	0	114.9	S162 D166 F170 L175 R176 R180	S162-H178 WeakPolarHBondContact OG-CA 3.44Å; D166-H178 VanDerWaalsContact CB-CD2 3.5Å; D166-H178 WeakPolarHBondContact CB-CD2 3.28Å; D166-H178 WeakPolarHBondContact CB-NE2 2.96Å; D166-H178 PolarHBondContact O-CD2 3.49Å; D166-H178 PolarHBondContact O-NE2 2.79Å; D166-H178 IonicContact OD1-NE2 3.59Å; F170-H178 HydrophobicContact CB-CB 4.42Å; F170-H178 HydrophobicContact CD2-CB 2.93Å; F170-H178 AromaticContact CD2-CD2 3.92Å; F170-H178 AromaticContact CD2-CG 3.46Å; F170-H178 VanDerWaalsContact CD2-CG 3.46Å; F170-H178 HydrophobicContact CE2-CB 3.18Å; F170-H178 HydrophobicContact CG-CB 3.91Å; F170-H178 HydrophobicContact CZ-CB 4.34Å; L175-H178 PolarHBondContact O-N 3.09Å; L175-H178 PolarHBondContact O-ND1 3.45Å; R176-H178 PolarHBondContact O-N 3.19Å; H178-R180 VanDerWaalsContact C-N 3.32Å; H178-R180 PolarHBondContact O-N 3.08Å
179	Q	50	Low	66.1	Low	149 Å²	149	89.3 Å²	89.3	70%	0.696	42%	0.417	S	S	*	.	S	Bend	trans	-78	-17.1	-175.9	-68.9	-177.9	-11.4	0	0	113.3	R176	R176-Q179 PolarHBondContact O-N 2.79Å
180	R	51.2	Low	66.9	Low	165 Å²	165	89.3 Å²	89.3	62%	0.623	42%	0.417	S	S	*	.	S	Bend	trans	-102.4	96.2	175	-74.6	-177.2	169.6	-178.9	-1.4	110.1	E160 S162 H178 I182	E160-R180 IonicContact OE2-NH1 3.17Å; E160-R180 PolarHBondContact OE2-NH1 3.13Å; S162-R180 PolarHBondContact OG-O 2.76Å; H178-R180 VanDerWaalsContact C-N 3.32Å; H178-R180 PolarHBondContact O-N 3.08Å; R180-I182 PolarHBondContact O-N 3.5Å; R180-I182 VanDerWaalsContact O-N 3.08Å
181	V	48.7	Very low	67.8	Low	127 Å²	127	85.6 Å²	85.6	77%	0.77	40%	0.401	S	S	*	.			trans	-60.5	112.3	168.9	-179.5	0	0	0	0	108.2	T183	V181-T183 PolarHBondContact O-N 3.06Å; V181-T183 VanDerWaalsContact O-N 3.13Å
182	I	52.7	Low	69	Low	54 Å²	54	79.2 Å²	79.2	28%	0.277	37%	0.367	S	S	.	.			trans	-68	112.2	176.6	-50	173.6	0	0	0	108.5	V161 S162 R180 R184	V161-I182 HydrophobicContact CB-CD1 3.43Å; V161-I182 VanDerWaalsContact CB-CD1 3.43Å; V161-I182 HydrophobicContact CB-CG1 3.6Å; V161-I182 HydrophobicContact CG1-CD1 4.19Å; V161-I182 HydrophobicContact CG1-CG1 3.95Å; V161-I182 HydrophobicContact CG2-CD1 4.29Å; S162-I182 WeakPolarHBondContact O-CD1 3.38Å; R180-I182 PolarHBondContact O-N 3.5Å; R180-I182 VanDerWaalsContact O-N 3.08Å; I182-R184 VanDerWaalsContact C-N 3.26Å; I182-R184 HydrophobicContact CG2-CB 3.77Å; I182-R184 WeakPolarHBondContact CG2-O 3.23Å
183	T	48.8	Very low	70.1	Confident	142 Å²	142	75.9 Å²	75.9	87%	0.871	35%	0.35	S	S	*	.			trans	-79.4	-12.1	168	52.7	0	0	0	0	112.8	V181	V181-T183 PolarHBondContact O-N 3.06Å; V181-T183 VanDerWaalsContact O-N 3.13Å
184	R	59.2	Low	71.1	Confident	120 Å²	120	75.5 Å²	75.5	45%	0.453	35%	0.348	S	S	.	.	S	Bend	trans	-86.2	117.7	-178.2	-165.5	174.6	-176.8	-166.5	-3.9	112.1	K144 E145 I182 M186	K144-R184 PolarHBondContact O-NH2 2.95Å; E145-R184 PolarHBondContact O-NH1 2.76Å; E145-R184 VanDerWaalsContact O-NH1 3.15Å; I182-R184 VanDerWaalsContact C-N 3.26Å; I182-R184 HydrophobicContact CG2-CB 3.77Å; I182-R184 WeakPolarHBondContact CG2-O 3.23Å; R184-M186 PolarHBondContact O-N 2.68Å
185	R	68	Low	72.3	Confident	247 Å²	247	67.6 Å²	67.6	93%	0.932	31%	0.314	S	S	*	.			trans	-60.5	122	166.3	-70.1	-174.7	179.6	176.8	-0	109.6
186	M	82.2	Confident	73.7	Confident	49 Å²	49	66.4 Å²	66.4	24%	0.241	31%	0.308	C	S	.	.			trans	-110.8	145	175.3	-175.9	178.4	-61.8	0	0	109.5	L149 R184 A190 A191 L194	L149-M186 HydrophobicContact CD1-CE 3.75Å; R184-M186 PolarHBondContact O-N 2.68Å; M186-A190 HydrophobicContact CG-CB 3.42Å; M186-A190 VanDerWaalsContact CG-CB 3.42Å; M186-A190 VanDerWaalsContact SD-C 3.57Å; M186-A190 HydrophobicContact SD-CB 3.74Å; M186-A191 HydrophobicContact SD-CB 4.31Å; M186-A191 PolarHBondContact SD-N 3.27Å; M186-L194 HydrophobicContact CE-CD1 3.68Å; M186-L194 HydrophobicContact SD-CD1 3.84Å
187	S	89.3	Confident	75.4	Confident	31 Å²	31	58.3 Å²	58.3	22%	0.217	28%	0.277	C	S	.	.			trans	-70	152.1	172.8	65.4	0	0	0	0	111.6	E145 T189 A190 A191	E145-S187 VanDerWaalsContact CD-OG 3.31Å; E145-S187 PolarHBondContact OE1-OG 2.8Å; E145-S187 WeakPolarHBondContact OE2-CB 3.48Å; E145-S187 PolarHBondContact OE2-N 3.19Å; E145-S187 PolarHBondContact OE2-OG 3.15Å; S187-T189 PolarHBondContact O-N 2.91Å; S187-A190 PolarHBondContact O-N 3.01Å; S187-A190 PolarHBondContact OG-N 2.86Å; S187-A191 PolarHBondContact O-N 2.9Å
188	E	88.6	Confident	77.2	Confident	63 Å²	63	57.2 Å²	57.2	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-29.8	176.8	-170.3	65.2	-163.4	0	0	111.7	Q86 K92 A191 C192 R195	Q86-E188 HydrophobicContact CG-CB 4.14Å; Q86-E188 HydrophobicContact CG-CG 3.44Å; Q86-E188 VanDerWaalsContact CG-CG 3.44Å; K92-E188 VanDerWaalsContact CE-OE1 3.26Å; K92-E188 WeakPolarHBondContact CE-OE1 3.31Å; K92-E188 IonicContact NZ-OE1 3.25Å; K92-E188 PolarHBondContact NZ-OE1 3.26Å; E188-A191 PolarHBondContact O-N 3.33Å; E188-C192 VanDerWaalsContact O-CB 3.24Å; E188-C192 WeakPolarHBondContact O-CB 3.5Å; E188-C192 PolarHBondContact O-N 2.9Å; E188-R195 IonicContact OE1-NH1 3.9Å
189	T	90.7	Very high	79	Confident	37 Å²	37	56.9 Å²	56.9	23%	0.227	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-43.8	174.2	-50.9	0	0	0	0	112	L82 Q86 I142 S187 C192 F193	L82-T189 HydrophobicContact CD2-CG2 3.61Å; L82-T189 HydrophobicContact CG-CG2 4.09Å; Q86-T189 PolarHBondContact OE1-OG1 3.26Å; I142-T189 HydrophobicContact CD1-CG2 3.79Å; I142-T189 HydrophobicContact CG1-CG2 4.32Å; S187-T189 PolarHBondContact O-N 2.91Å; T189-C192 PolarHBondContact O-N 3.22Å; T189-F193 PolarHBondContact O-N 3.37Å
190	A	91.2	Very high	81	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70.3	-36.8	176.1	0	0	0	0	0	111.7	E145 L146 M186 S187 F193 L194	E145-A190 HydrophobicContact CB-CB 4.09Å; E145-A190 WeakPolarHBondContact OE2-CB 3.25Å; L146-A190 HydrophobicContact CD2-CB 3.94Å; L146-A190 HydrophobicContact CG-CB 4.43Å; M186-A190 HydrophobicContact CG-CB 3.42Å; M186-A190 VanDerWaalsContact CG-CB 3.42Å; M186-A190 VanDerWaalsContact SD-C 3.57Å; M186-A190 HydrophobicContact SD-CB 3.74Å; S187-A190 PolarHBondContact O-N 3.01Å; S187-A190 PolarHBondContact OG-N 2.86Å; A190-F193 WeakPolarHBondContact O-CB 3.44Å; A190-F193 PolarHBondContact O-N 3.22Å; A190-L194 PolarHBondContact O-N 3.35Å
191	A	91.4	Very high	82.8	Confident	4 Å²	4	42.9 Å²	42.9	3%	0.033	21%	0.211	C	C	.	.	H	α-helix	trans	-63	-42.2	172.5	0	0	0	0	0	111.8	L163 M186 S187 E188 F193 L194 R195	L163-A191 HydrophobicContact CD2-CB 4.19Å; M186-A191 HydrophobicContact SD-CB 4.31Å; M186-A191 PolarHBondContact SD-N 3.27Å; S187-A191 PolarHBondContact O-N 2.9Å; E188-A191 PolarHBondContact O-N 3.33Å; A191-F193 VanDerWaalsContact C-N 3.35Å; A191-L194 PolarHBondContact O-N 3.16Å; A191-R195 WeakPolarHBondContact O-CB 3.42Å; A191-R195 PolarHBondContact O-N 3.37Å
192	C	92.9	Very high	84.7	Confident	1 Å²	1	37 Å²	37	1%	0.007	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-41	173.7	-175.5	0	0	0	0	111.9	L82 Q86 E188 T189 R195 I196	L82-C192 HydrophobicContact CD1-CB 4.23Å; Q86-C192 HydrophobicContact CB-CB 4.4Å; Q86-C192 HydrophobicContact CG-CB 4.29Å; E188-C192 VanDerWaalsContact O-CB 3.24Å; E188-C192 WeakPolarHBondContact O-CB 3.5Å; E188-C192 PolarHBondContact O-N 2.9Å; T189-C192 PolarHBondContact O-N 3.22Å; C192-R195 WeakPolarHBondContact O-CB 3.48Å; C192-R195 PolarHBondContact O-N 3.35Å; C192-I196 WeakPolarHBondContact O-CG1 3.19Å; C192-I196 PolarHBondContact O-N 2.88Å
193	F	94.2	Very high	86.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-50.4	175.3	-175.9	-74.4	0	0	0	111.5	L82 L132 I135 N136 I142 L146 F150 T189 A190 A191 R195 I196 C197	L82-F193 HydrophobicContact CD1-CB 4.38Å; L82-F193 HydrophobicContact CD2-CB 4.48Å; L82-F193 HydrophobicContact CD2-CD2 4.33Å; L132-F193 HydrophobicContact CB-CE2 4.02Å; L132-F193 HydrophobicContact CB-CZ 3.81Å; L132-F193 HydrophobicContact CD2-CD2 3.76Å; L132-F193 HydrophobicContact CD2-CE1 4.37Å; L132-F193 HydrophobicContact CD2-CE2 3.51Å; L132-F193 HydrophobicContact CD2-CG 4.3Å; L132-F193 HydrophobicContact CD2-CZ 3.84Å; L132-F193 HydrophobicContact CG-CE2 4.38Å; L132-F193 HydrophobicContact CG-CZ 4.38Å; L132-F193 WeakPolarHBondContact O-CE2 3.39Å; I135-F193 HydrophobicContact CB-CE2 4.31Å; I135-F193 HydrophobicContact CG2-CD2 4.22Å; I135-F193 HydrophobicContact CG2-CE2 3.97Å; N136-F193 HydrophobicContact CB-CZ 4.19Å; I142-F193 HydrophobicContact CG2-CD2 4.32Å; L146-F193 HydrophobicContact CD1-CB 4.22Å; L146-F193 HydrophobicContact CD1-CD1 3.22Å; L146-F193 HydrophobicContact CD1-CD2 4.13Å; L146-F193 HydrophobicContact CD1-CE1 3.44Å; L146-F193 VanDerWaalsContact CD1-CE1 3.44Å; L146-F193 HydrophobicContact CD1-CE2 4.29Å; L146-F193 HydrophobicContact CD1-CG 3.6Å; L146-F193 HydrophobicContact CD1-CZ 3.98Å; F150-F193 HydrophobicContact CB-CE1 4.33Å; F150-F193 HydrophobicContact CD1-CE1 4.4Å; F150-F193 HydrophobicContact CD1-CZ 4.37Å; F150-F193 AromaticContact CD2-CE1 3.49Å; F150-F193 HydrophobicContact CD2-CE1 3.49Å; F150-F193 VanDerWaalsContact CD2-CE1 3.49Å; F150-F193 HydrophobicContact CD2-CZ 4.03Å; F150-F193 HydrophobicContact CE1-CZ 4.26Å; F150-F193 AromaticContact CE2-CE1 3.7Å; F150-F193 HydrophobicContact CE2-CE1 3.7Å; F150-F193 AromaticContact CE2-CZ 3.84Å; F150-F193 HydrophobicContact CE2-CZ 3.84Å; F150-F193 AromaticContact CG-CE1 3.83Å; F150-F193 HydrophobicContact CG-CE1 3.83Å; F150-F193 HydrophobicContact CG-CZ 4.24Å; F150-F193 HydrophobicContact CZ-CE1 4.28Å; F150-F193 AromaticContact CZ-CZ 3.97Å; F150-F193 HydrophobicContact CZ-CZ 3.97Å; T189-F193 PolarHBondContact O-N 3.37Å; A190-F193 WeakPolarHBondContact O-CB 3.44Å; A190-F193 PolarHBondContact O-N 3.22Å; A191-F193 VanDerWaalsContact C-N 3.35Å; F193-R195 VanDerWaalsContact C-N 3.32Å; F193-R195 PolarHBondContact O-N 3.08Å; F193-I196 WeakPolarHBondContact O-CB 3.42Å; F193-I196 PolarHBondContact O-N 2.84Å; F193-C197 VanDerWaalsContact CE1-SG 3.54Å; F193-C197 PolarHBondContact O-N 3.1Å; F193-C197 PolarHBondContact O-SG 3.05Å
194	L	92.8	Very high	88	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-36.4	178	-69.6	-176.2	0	0	0	112.1	L146 W157 V161 L163 M186 A190 A191 I196 C197 C198	L146-L194 HydrophobicContact CD2-CD1 4.06Å; L146-L194 HydrophobicContact CD2-CD2 3.87Å; L146-L194 HydrophobicContact CD2-CG 3.74Å; W157-L194 HydrophobicContact CH2-CD2 4.35Å; W157-L194 HydrophobicContact CZ2-CD2 3.81Å; V161-L194 HydrophobicContact CG2-CD1 3.71Å; L163-L194 HydrophobicContact CD1-CB 4.39Å; L163-L194 HydrophobicContact CD2-CB 3.96Å; L163-L194 HydrophobicContact CD2-CD1 4.21Å; M186-L194 HydrophobicContact CE-CD1 3.68Å; M186-L194 HydrophobicContact SD-CD1 3.84Å; A190-L194 PolarHBondContact O-N 3.35Å; A191-L194 PolarHBondContact O-N 3.16Å; L194-I196 VanDerWaalsContact C-N 3.32Å; L194-I196 PolarHBondContact O-N 3.14Å; L194-C197 WeakPolarHBondContact O-CA 3.29Å; L194-C197 VanDerWaalsContact O-CB 3.26Å; L194-C197 WeakPolarHBondContact O-CB 3.32Å; L194-C197 PolarHBondContact O-N 3.23Å; L194-C198 PolarHBondContact O-N 3.18Å; L194-C198 PolarHBondContact O-SG 2.95Å
195	R	93.7	Very high	89.2	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.015	11%	0.11	C	C	.	.	H	α-helix	trans	-59.9	-42	174	-171.8	175.7	-62.1	108.3	9.6	112.4	K95 L163 E165 E188 A191 C192 F193 C197 C198 L199	K95-R195 HydrophobicContact CB-CG 4.08Å; K95-R195 HydrophobicContact CG-CG 4.19Å; L163-R195 HydrophobicContact CD1-CB 3.99Å; E165-R195 VanDerWaalsContact CD-NH2 3.26Å; E165-R195 IonicContact OE1-CZ 3.27Å; E165-R195 VanDerWaalsContact OE1-CZ 3.26Å; E165-R195 IonicContact OE1-NE 3.52Å; E165-R195 PolarHBondContact OE1-NE 3.47Å; E165-R195 IonicContact OE1-NH2 3.56Å; E165-R195 PolarHBondContact OE1-NH2 3.44Å; E165-R195 IonicContact OE2-CZ 3.96Å; E165-R195 IonicContact OE2-NE 2.87Å; E165-R195 IonicContact OE2-NH2 3.56Å; E165-R195 PolarHBondContact OE2-NH2 2.97Å; E188-R195 IonicContact OE1-NH1 3.9Å; A191-R195 WeakPolarHBondContact O-CB 3.42Å; A191-R195 PolarHBondContact O-N 3.37Å; C192-R195 WeakPolarHBondContact O-CB 3.48Å; C192-R195 PolarHBondContact O-N 3.35Å; F193-R195 VanDerWaalsContact C-N 3.32Å; F193-R195 PolarHBondContact O-N 3.08Å; R195-C197 VanDerWaalsContact C-N 3.31Å; R195-C198 WeakPolarHBondContact O-CB 3.49Å; R195-C198 PolarHBondContact O-N 2.84Å; R195-L199 WeakPolarHBondContact O-CG 3.33Å; R195-L199 PolarHBondContact O-N 3.47Å
196	I	94.2	Very high	89.9	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.3	-40.3	173.4	-68.4	159.2	0	0	0	110.5	L82 L85 L126 P127 L132 C192 F193 L194 C198 L199 R200	L82-I196 HydrophobicContact CD1-CD1 3.47Å; L82-I196 VanDerWaalsContact CD1-CD1 3.47Å; L85-I196 HydrophobicContact CD1-CD1 3.9Å; L126-I196 HydrophobicContact CB-CG2 4.02Å; L126-I196 HydrophobicContact CD1-CG2 4.4Å; L126-I196 HydrophobicContact CD2-CG1 4.45Å; P127-I196 HydrophobicContact CG-CD1 4.14Å; L132-I196 HydrophobicContact CD1-CG2 4Å; L132-I196 HydrophobicContact CD2-CG2 4.12Å; C192-I196 WeakPolarHBondContact O-CG1 3.19Å; C192-I196 PolarHBondContact O-N 2.88Å; F193-I196 WeakPolarHBondContact O-CB 3.42Å; F193-I196 PolarHBondContact O-N 2.84Å; L194-I196 VanDerWaalsContact C-N 3.32Å; L194-I196 PolarHBondContact O-N 3.14Å; I196-C198 VanDerWaalsContact C-N 3.34Å; I196-C198 PolarHBondContact O-N 3.37Å; I196-L199 PolarHBondContact O-N 3.06Å; I196-R200 HydrophobicContact CG2-CG 4.45Å; I196-R200 PolarHBondContact O-N 2.89Å
197	C	93.4	Very high	89.6	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-58.7	-46.1	175	-60.7	0	0	0	0	111.2	L154 W157 F193 L194 R195 L199 R200 K201	L154-C197 HydrophobicContact CD1-CB 4.32Å; L154-C197 HydrophobicContact CD2-CB 3.77Å; W157-C197 HydrophobicContact CD2-CB 4.36Å; W157-C197 HydrophobicContact CE3-CB 3.98Å; W157-C197 HydrophobicContact CH2-CB 4Å; W157-C197 HydrophobicContact CZ2-CB 4.41Å; W157-C197 HydrophobicContact CZ3-CB 3.78Å; F193-C197 VanDerWaalsContact CE1-SG 3.54Å; F193-C197 PolarHBondContact O-N 3.1Å; F193-C197 PolarHBondContact O-SG 3.05Å; L194-C197 WeakPolarHBondContact O-CA 3.29Å; L194-C197 VanDerWaalsContact O-CB 3.26Å; L194-C197 WeakPolarHBondContact O-CB 3.32Å; L194-C197 PolarHBondContact O-N 3.23Å; R195-C197 VanDerWaalsContact C-N 3.31Å; C197-L199 PolarHBondContact O-N 3.25Å; C197-R200 PolarHBondContact O-N 3.21Å; C197-K201 WeakPolarHBondContact O-CB 3.27Å; C197-K201 PolarHBondContact O-N 3.46Å
198	C	92.7	Very high	88.7	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.014	6%	0.064	C	C	.	.	H	α-helix	trans	-57.9	-48.9	174.8	-57.9	0	0	0	0	111.6	K95 W157 Q159 L194 R195 I196 R200 K201 Y202	K95-C198 HydrophobicContact CG-CB 4.07Å; W157-C198 VanDerWaalsContact CZ3-SG 3.6Å; Q159-C198 PolarHBondContact OE1-SG 2.71Å; L194-C198 PolarHBondContact O-N 3.18Å; L194-C198 PolarHBondContact O-SG 2.95Å; R195-C198 WeakPolarHBondContact O-CB 3.49Å; R195-C198 PolarHBondContact O-N 2.84Å; I196-C198 VanDerWaalsContact C-N 3.34Å; I196-C198 PolarHBondContact O-N 3.37Å; C198-R200 PolarHBondContact O-N 3.37Å; C198-K201 WeakPolarHBondContact O-CB 3.49Å; C198-K201 PolarHBondContact O-N 3.33Å; C198-Y202 HydrophobicContact CB-CE2 3.84Å; C198-Y202 WeakPolarHBondContact O-CD2 3.42Å; C198-Y202 WeakPolarHBondContact O-CE2 3.39Å; C198-Y202 VanDerWaalsContact O-CG 3.24Å; C198-Y202 PolarHBondContact O-N 2.86Å
199	L	93.2	Very high	87.9	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.1	-41.3	-178.7	-69.1	172.7	0	0	0	113.1	L91 L94 K95 L126 R195 I196 C197 Y202 A203	L91-L199 HydrophobicContact CD2-CD1 3.71Å; L94-L199 HydrophobicContact CB-CD2 4.39Å; L94-L199 HydrophobicContact CD2-CD1 4.27Å; L94-L199 HydrophobicContact CD2-CD2 3.79Å; L94-L199 HydrophobicContact CG-CD2 3.75Å; K95-L199 HydrophobicContact CB-CD2 4.4Å; L126-L199 HydrophobicContact CD1-CB 3.69Å; L126-L199 HydrophobicContact CD1-CD1 3.8Å; L126-L199 HydrophobicContact CD1-CG 4.41Å; R195-L199 WeakPolarHBondContact O-CG 3.33Å; R195-L199 PolarHBondContact O-N 3.47Å; I196-L199 PolarHBondContact O-N 3.06Å; C197-L199 PolarHBondContact O-N 3.25Å; L199-Y202 HydrophobicContact CD2-CD2 4.33Å; L199-Y202 PolarHBondContact O-N 2.95Å; L199-A203 PolarHBondContact O-N 3.04Å; L199-A203 VanDerWaalsContact O-N 3.13Å
200	R	91.5	Very high	86.6	Confident	8 Å²	8	17 Å²	17	3%	0.03	9%	0.094	C	C	.	.	H	α-helix	trans	-68.1	-39.7	174.4	-69.5	-156	93.4	93.1	4.2	112	V123 L126 P127 T128 L154 I196 C197 C198 Y202 A203 H204	V123-R200 HydrophobicContact CG1-CG 4.37Å; L126-R200 PolarHBondContact O-NH1 2.92Å; L126-R200 VanDerWaalsContact O-NH1 3.13Å; P127-R200 WeakPolarHBondContact O-CD 3.25Å; P127-R200 PolarHBondContact O-NH1 3.16Å; T128-R200 VanDerWaalsContact CA-NH1 3.3Å; L154-R200 HydrophobicContact CD1-CB 3.65Å; L154-R200 HydrophobicContact CD1-CG 4.33Å; I196-R200 HydrophobicContact CG2-CG 4.45Å; I196-R200 PolarHBondContact O-N 2.89Å; C197-R200 PolarHBondContact O-N 3.21Å; C198-R200 PolarHBondContact O-N 3.37Å; R200-Y202 VanDerWaalsContact C-N 3.35Å; R200-Y202 PolarHBondContact O-N 3.47Å; R200-A203 WeakPolarHBondContact O-CB 3.31Å; R200-A203 PolarHBondContact O-N 2.59Å; R200-H204 PolarHBondContact O-CD2 2.93Å; R200-H204 VanDerWaalsContact O-CD2 3.27Å; R200-H204 PolarHBondContact O-N 3.46Å; R200-H204 VanDerWaalsContact O-N 3.11Å
201	K	89.4	Confident	85.4	Confident	12 Å²	12	20.8 Å²	20.8	5%	0.052	11%	0.11	C	C	.	.	H	α-helix	trans	-56.2	-50.5	172.3	176.7	-173.9	179	164.3	0	110.3	W157 E158 C197 C198 A203 H204 E205	W157-K201 HydrophobicContact CE3-CD 4.35Å; W157-K201 VanDerWaalsContact O-CD 3.23Å; W157-K201 WeakPolarHBondContact O-CD 3.47Å; W157-K201 VanDerWaalsContact O-CE 3.28Å; W157-K201 WeakPolarHBondContact O-CE 3.27Å; W157-K201 PolarHBondContact O-NZ 3.43Å; E158-K201 IonicContact OE1-NZ 3.3Å; E158-K201 PolarHBondContact OE1-NZ 2.91Å; E158-K201 IonicContact OE2-NZ 2.89Å; E158-K201 PolarHBondContact OE2-NZ 3.19Å; C197-K201 WeakPolarHBondContact O-CB 3.27Å; C197-K201 PolarHBondContact O-N 3.46Å; C198-K201 WeakPolarHBondContact O-CB 3.49Å; C198-K201 PolarHBondContact O-N 3.33Å; K201-A203 PolarHBondContact O-N 3.15Å; K201-H204 WeakPolarHBondContact O-CA 3.42Å; K201-H204 WeakPolarHBondContact O-CB 3.49Å; K201-H204 PolarHBondContact O-N 3.44Å; K201-E205 WeakPolarHBondContact CE-OE1 3.5Å; K201-E205 HydrophobicContact CG-CG 4.3Å; K201-E205 IonicContact NZ-OE1 3.84Å; K201-E205 WeakPolarHBondContact O-CG 3.43Å; K201-E205 PolarHBondContact O-N 3.47Å
202	Y	88.9	Confident	84.3	Confident	4 Å²	4	20.9 Å²	20.9	2%	0.016	11%	0.11	C	C	.	.	H	α-helix	trans	-58.6	-37.1	178.5	-59.8	-45.3	0	0	0	112.5	K95 C98 N99 Q102 C198 L199 R200 H204 E205 F206	K95-Y202 HydrophobicContact CG-CE2 4.35Å; C98-Y202 HydrophobicContact CB-CD1 4.33Å; C98-Y202 HydrophobicContact CB-CD2 3.13Å; C98-Y202 HydrophobicContact CB-CE2 3.46Å; C98-Y202 VanDerWaalsContact CB-CE2 3.46Å; C98-Y202 HydrophobicContact CB-CG 3.65Å; N99-Y202 PolarHBondContact OD1-OH 2.92Å; Q102-Y202 VanDerWaalsContact CD-CD1 3.45Å; Q102-Y202 HydrophobicContact CG-CD1 4.05Å; Q102-Y202 HydrophobicContact CG-CE1 4.15Å; C198-Y202 HydrophobicContact CB-CE2 3.84Å; C198-Y202 WeakPolarHBondContact O-CD2 3.42Å; C198-Y202 WeakPolarHBondContact O-CE2 3.39Å; C198-Y202 VanDerWaalsContact O-CG 3.24Å; C198-Y202 PolarHBondContact O-N 2.86Å; L199-Y202 HydrophobicContact CD2-CD2 4.33Å; L199-Y202 PolarHBondContact O-N 2.95Å; R200-Y202 VanDerWaalsContact C-N 3.35Å; R200-Y202 PolarHBondContact O-N 3.47Å; Y202-H204 VanDerWaalsContact C-N 3.34Å; Y202-H204 PolarHBondContact O-N 3.1Å; Y202-E205 PolarHBondContact O-N 3.12Å; Y202-E205 VanDerWaalsContact O-N 3.16Å; Y202-F206 WeakPolarHBondContact O-CB 3.18Å; Y202-F206 VanDerWaalsContact O-CD2 3.27Å; Y202-F206 WeakPolarHBondContact O-CD2 3.34Å; Y202-F206 WeakPolarHBondContact O-CG 3.39Å; Y202-F206 PolarHBondContact O-N 3.33Å
203	A	87.8	Confident	83.1	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.008	12%	0.116	C	C	.	.	H	α-helix	trans	-60.6	-43.7	173.5	0	0	0	0	0	112.2	F119 V123 L199 R200 K201 E205 F206 M207 F223	F119-A203 HydrophobicContact CE1-CB 3.83Å; F119-A203 HydrophobicContact CZ-CB 4.21Å; V123-A203 HydrophobicContact CB-CB 4.47Å; V123-A203 HydrophobicContact CG1-CB 3.83Å; V123-A203 HydrophobicContact CG2-CB 4.22Å; L199-A203 PolarHBondContact O-N 3.04Å; L199-A203 VanDerWaalsContact O-N 3.13Å; R200-A203 WeakPolarHBondContact O-CB 3.31Å; R200-A203 PolarHBondContact O-N 2.59Å; K201-A203 PolarHBondContact O-N 3.15Å; A203-E205 VanDerWaalsContact C-N 3.32Å; A203-E205 PolarHBondContact O-N 3.31Å; A203-F206 PolarHBondContact O-N 3.15Å; A203-M207 VanDerWaalsContact O-CG 3.31Å; A203-M207 WeakPolarHBondContact O-CG 3.27Å; A203-M207 PolarHBondContact O-N 3.4Å; A203-F223 HydrophobicContact CB-CD1 4.15Å; A203-F223 HydrophobicContact CB-CD2 4.39Å; A203-F223 HydrophobicContact CB-CE1 3.66Å; A203-F223 HydrophobicContact CB-CE2 3.93Å; A203-F223 HydrophobicContact CB-CG 4.5Å; A203-F223 HydrophobicContact CB-CZ 3.54Å
204	H	83.2	Confident	82.2	Confident	15 Å²	15	22 Å²	22	7%	0.069	12%	0.119	C	C	.	.	H	α-helix	trans	-60.2	-40.4	171.4	-72	-65	0	0	0	113.2	E129 R200 K201 Y202 M207 R208	E129-H204 IonicContact OE1-CD2 3.9Å; E129-H204 IonicContact OE1-CE1 2.79Å; E129-H204 IonicContact OE1-NE2 2.79Å; E129-H204 PolarHBondContact OE1-NE2 3.23Å; R200-H204 PolarHBondContact O-CD2 2.93Å; R200-H204 VanDerWaalsContact O-CD2 3.27Å; R200-H204 PolarHBondContact O-N 3.46Å; R200-H204 VanDerWaalsContact O-N 3.11Å; K201-H204 WeakPolarHBondContact O-CA 3.42Å; K201-H204 WeakPolarHBondContact O-CB 3.49Å; K201-H204 PolarHBondContact O-N 3.44Å; Y202-H204 VanDerWaalsContact C-N 3.34Å; Y202-H204 PolarHBondContact O-N 3.1Å; H204-M207 HydrophobicContact CB-CE 4.4Å; H204-M207 VanDerWaalsContact ND1-CE 3.25Å; H204-M207 WeakPolarHBondContact ND1-CE 3.12Å; H204-M207 PolarHBondContact O-N 2.89Å; H204-R208 PolarHBondContact O-N 3.22Å
205	E	82.6	Confident	81.3	Confident	34 Å²	34	29.8 Å²	29.8	16%	0.159	15%	0.148	C	C	.	.	H	α-helix	trans	-69.5	-40.1	178.4	-59.3	-159.7	167.8	0	0	112.8	Q102 K201 Y202 A203 M207 R208 H209	Q102-E205 PolarHBondContact NE2-OE2 3.38Å; K201-E205 WeakPolarHBondContact CE-OE1 3.5Å; K201-E205 HydrophobicContact CG-CG 4.3Å; K201-E205 IonicContact NZ-OE1 3.84Å; K201-E205 WeakPolarHBondContact O-CG 3.43Å; K201-E205 PolarHBondContact O-N 3.47Å; Y202-E205 PolarHBondContact O-N 3.12Å; Y202-E205 VanDerWaalsContact O-N 3.16Å; A203-E205 VanDerWaalsContact C-N 3.32Å; A203-E205 PolarHBondContact O-N 3.31Å; E205-M207 VanDerWaalsContact C-N 3.31Å; E205-M207 PolarHBondContact O-N 3.49Å; E205-R208 VanDerWaalsContact O-CB 3.27Å; E205-R208 WeakPolarHBondContact O-CB 3.26Å; E205-R208 PolarHBondContact O-N 2.81Å; E205-R208 VanDerWaalsContact O-N 3.1Å; E205-R208 IonicContact OE1-NH1 2.69Å; E205-H209 PolarHBondContact O-CD2 2.99Å
206	F	82.7	Confident	80.3	Confident	3 Å²	3	31.6 Å²	31.6	1%	0.013	16%	0.158	C	C	.	.	H	α-helix	trans	-67.8	-32.1	177.4	-62.1	-24.6	0	0	0	112.2	C98 L101 Q102 L108 W116 F119 Y202 A203 R208 H209 T212 L214	C98-F206 HydrophobicContact CB-CZ 4.38Å; L101-F206 HydrophobicContact CB-CZ 4.14Å; L101-F206 HydrophobicContact CD1-CZ 4.33Å; Q102-F206 HydrophobicContact CG-CE1 4.42Å; L108-F206 HydrophobicContact CD1-CD1 3.99Å; L108-F206 HydrophobicContact CD1-CE1 3.78Å; L108-F206 HydrophobicContact CD1-CZ 4.11Å; L108-F206 HydrophobicContact CD2-CD1 3.68Å; L108-F206 HydrophobicContact CD2-CE1 3.91Å; L108-F206 HydrophobicContact CG-CD1 4.44Å; W116-F206 HydrophobicContact CH2-CB 3.92Å; W116-F206 HydrophobicContact CH2-CD1 4.39Å; W116-F206 AromaticContact CH2-CD2 3.9Å; W116-F206 HydrophobicContact CH2-CD2 3.9Å; W116-F206 HydrophobicContact CH2-CE2 4.49Å; W116-F206 AromaticContact CH2-CG 3.82Å; W116-F206 HydrophobicContact CH2-CG 3.82Å; W116-F206 HydrophobicContact CZ3-CB 3.78Å; W116-F206 AromaticContact CZ3-CD2 3.59Å; W116-F206 HydrophobicContact CZ3-CD2 3.59Å; W116-F206 HydrophobicContact CZ3-CE2 4.35Å; W116-F206 AromaticContact CZ3-CG 3.84Å; W116-F206 HydrophobicContact CZ3-CG 3.84Å; F119-F206 HydrophobicContact CD1-CD2 4.41Å; F119-F206 AromaticContact CE1-CD2 3.71Å; F119-F206 HydrophobicContact CE1-CD2 3.71Å; F119-F206 HydrophobicContact CE1-CE2 4.26Å; F119-F206 HydrophobicContact CE2-CE2 4.26Å; F119-F206 AromaticContact CZ-CD2 3.76Å; F119-F206 HydrophobicContact CZ-CD2 3.76Å; F119-F206 AromaticContact CZ-CE2 3.86Å; F119-F206 HydrophobicContact CZ-CE2 3.86Å; Y202-F206 WeakPolarHBondContact O-CB 3.18Å; Y202-F206 VanDerWaalsContact O-CD2 3.27Å; Y202-F206 WeakPolarHBondContact O-CD2 3.34Å; Y202-F206 WeakPolarHBondContact O-CG 3.39Å; Y202-F206 PolarHBondContact O-N 3.33Å; A203-F206 PolarHBondContact O-N 3.15Å; F206-R208 PolarHBondContact O-N 2.6Å; F206-H209 WeakPolarHBondContact O-CB 3.5Å; F206-H209 PolarHBondContact O-N 3.43Å; F206-H209 VanDerWaalsContact O-N 3.12Å; F206-T212 HydrophobicContact CB-CG2 4.48Å; F206-T212 VanDerWaalsContact O-CG2 3.27Å; F206-T212 WeakPolarHBondContact O-CG2 2.92Å; F206-T212 PolarHBondContact O-OG1 3.11Å; F206-L214 HydrophobicContact CB-CD1 4.02Å
207	M	76.3	Confident	79.4	Confident	27 Å²	27	34.2 Å²	34.2	13%	0.133	17%	0.172	C	C	.	.	H	α-helix	trans	-60.4	-29	170.1	-76	-165.4	-47.7	0	0	113.8	A203 H204 E205 H209 L214 I216 F223	A203-M207 VanDerWaalsContact O-CG 3.31Å; A203-M207 WeakPolarHBondContact O-CG 3.27Å; A203-M207 PolarHBondContact O-N 3.4Å; H204-M207 HydrophobicContact CB-CE 4.4Å; H204-M207 VanDerWaalsContact ND1-CE 3.25Å; H204-M207 WeakPolarHBondContact ND1-CE 3.12Å; H204-M207 PolarHBondContact O-N 2.89Å; E205-M207 VanDerWaalsContact C-N 3.31Å; E205-M207 PolarHBondContact O-N 3.49Å; M207-H209 PolarHBondContact O-N 2.87Å; M207-L214 HydrophobicContact CB-CB 4.41Å; M207-L214 HydrophobicContact CG-CB 3.62Å; M207-L214 HydrophobicContact CG-CD1 4.44Å; M207-I216 HydrophobicContact CE-CD1 3.5Å; M207-I216 VanDerWaalsContact CE-CD1 3.5Å; M207-I216 HydrophobicContact CE-CG1 3.93Å; M207-I216 HydrophobicContact SD-CD1 3.92Å; M207-I216 HydrophobicContact SD-CG1 3.6Å; M207-F223 HydrophobicContact CE-CD1 4.27Å; M207-F223 HydrophobicContact CE-CE1 3.72Å; M207-F223 HydrophobicContact CG-CD1 4.17Å; M207-F223 HydrophobicContact CG-CE1 4.31Å; M207-F223 HydrophobicContact SD-CD1 3.54Å; M207-F223 VanDerWaalsContact SD-CD1 3.54Å; M207-F223 HydrophobicContact SD-CE1 3.63Å
208	R	70.4	Confident	77.7	Confident	73 Å²	73	40 Å²	40	28%	0.275	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.6	177.5	-62.5	171.7	173	148	0.1	112.2	S155 H204 E205 F206 S338	S155-R208 PolarHBondContact O-NH2 2.96Å; H204-R208 PolarHBondContact O-N 3.22Å; E205-R208 VanDerWaalsContact O-CB 3.27Å; E205-R208 WeakPolarHBondContact O-CB 3.26Å; E205-R208 PolarHBondContact O-N 2.81Å; E205-R208 VanDerWaalsContact O-N 3.1Å; E205-R208 IonicContact OE1-NH1 2.69Å; F206-R208 PolarHBondContact O-N 2.6Å; R208-S338 VanDerWaalsContact NE-CB 3.32Å; R208-S338 PolarHBondContact NE-O 3.3Å; R208-S338 VanDerWaalsContact NH2-CB 3.34Å; R208-S338 PolarHBondContact NH2-O 2.82Å
209	H	71.7	Confident	75.7	Confident	73 Å²	73	44.7 Å²	44.7	34%	0.338	24%	0.236	S	C	.	.	S	Bend	trans	-91.2	105.4	180	-67.3	-65.5	0	0	0	110.1	E205 F206 M207 F211 T212	E205-H209 PolarHBondContact O-CD2 2.99Å; F206-H209 WeakPolarHBondContact O-CB 3.5Å; F206-H209 PolarHBondContact O-N 3.43Å; F206-H209 VanDerWaalsContact O-N 3.12Å; M207-H209 PolarHBondContact O-N 2.87Å; H209-F211 HydrophobicContact CB-CD1 3.97Å; H209-F211 HydrophobicContact CB-CE1 3.52Å; H209-F211 HydrophobicContact CB-CE2 4.13Å; H209-F211 HydrophobicContact CB-CG 4.47Å; H209-F211 HydrophobicContact CB-CZ 3.61Å; H209-F211 AromaticContact CG-CE1 3.82Å; H209-F211 AromaticContact CG-CZ 3.84Å; H209-F211 AromaticContact ND1-CE1 3.82Å; H209-F211 PolarHBondContact O-N 2.79Å; H209-T212 HydrophobicContact CB-CG2 3.83Å; H209-T212 WeakPolarHBondContact O-CG2 3.41Å; H209-T212 PolarHBondContact O-N 3.5Å; H209-T212 PolarHBondContact O-OG1 2.91Å
210	A	63.9	Low	74.5	Confident	97 Å²	97	47.9 Å²	47.9	80%	0.802	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-52	-29.4	-176	0	0	0	0	0	114.4	T212 G213	A210-T212 PolarHBondContact O-N 3.26Å; A210-G213 PolarHBondContact O-N 3.39Å
211	F	67.3	Low	73.2	Confident	79 Å²	79	53.2 Å²	53.2	35%	0.346	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-70.1	-15.5	179.4	63	-105	0	0	0	114.3	L108 R109 H209 G213	L108-F211 HydrophobicContact CB-CE2 4.11Å; L108-F211 HydrophobicContact CB-CZ 4.05Å; L108-F211 HydrophobicContact CD2-CE2 4.19Å; L108-F211 HydrophobicContact CD2-CZ 3.88Å; L108-F211 HydrophobicContact CG-CE2 3.84Å; L108-F211 HydrophobicContact CG-CZ 3.95Å; L108-F211 WeakPolarHBondContact O-CE2 3.24Å; R109-F211 HydrophobicContact CB-CD2 4.4Å; R109-F211 HydrophobicContact CB-CE2 4.24Å; R109-F211 HydrophobicContact CB-CZ 4.29Å; R109-F211 HydrophobicContact CG-CD2 4.5Å; R109-F211 HydrophobicContact CG-CG 4.38Å; H209-F211 HydrophobicContact CB-CD1 3.97Å; H209-F211 HydrophobicContact CB-CE1 3.52Å; H209-F211 HydrophobicContact CB-CE2 4.13Å; H209-F211 HydrophobicContact CB-CG 4.47Å; H209-F211 HydrophobicContact CB-CZ 3.61Å; H209-F211 AromaticContact CG-CE1 3.82Å; H209-F211 AromaticContact CG-CZ 3.84Å; H209-F211 AromaticContact ND1-CE1 3.82Å; H209-F211 PolarHBondContact O-N 2.79Å; F211-G213 VanDerWaalsContact C-N 3.29Å
212	T	66.9	Low	72.6	Confident	6 Å²	6	57.4 Å²	57.4	4%	0.037	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-78.7	-17.6	178.6	68	0	0	0	0	112.2	W116 F206 H209 A210 L214	W116-T212 HydrophobicContact CD2-CG2 4.35Å; W116-T212 HydrophobicContact CH2-CG2 3.67Å; W116-T212 HydrophobicContact CZ2-CG2 3.4Å; W116-T212 HydrophobicContact CZ3-CG2 4.3Å; F206-T212 HydrophobicContact CB-CG2 4.48Å; F206-T212 VanDerWaalsContact O-CG2 3.27Å; F206-T212 WeakPolarHBondContact O-CG2 2.92Å; F206-T212 PolarHBondContact O-OG1 3.11Å; H209-T212 HydrophobicContact CB-CG2 3.83Å; H209-T212 WeakPolarHBondContact O-CG2 3.41Å; H209-T212 PolarHBondContact O-N 3.5Å; H209-T212 PolarHBondContact O-OG1 2.91Å; A210-T212 PolarHBondContact O-N 3.26Å; T212-L214 PolarHBondContact O-N 3.45Å; T212-L214 VanDerWaalsContact O-N 3.09Å; T212-L214 WeakPolarHBondContact OG1-CG 3.33Å; T212-L214 PolarHBondContact OG1-N 3.16Å
213	G	68.3	Low	72	Confident	12 Å²	12	57.5 Å²	57.5	12%	0.124	30%	0.302	C	S	.	.			trans	64.2	9.2	-177.4	0	0	0	0	0	114.1	A210 F211 Q226	A210-G213 PolarHBondContact O-N 3.39Å; F211-G213 VanDerWaalsContact C-N 3.29Å; G213-Q226 PolarHBondContact O-N 3.48Å; G213-Q226 VanDerWaalsContact O-N 3.13Å
214	L	74	Confident	71.6	Confident	13 Å²	13	59.6 Å²	59.6	7%	0.068	32%	0.315	C	S	.	.			trans	-77.4	138.3	-175.7	-62.4	-175.8	0	0	0	111.7	W116 V120 F206 M207 T212 V224	W116-L214 HydrophobicContact CB-CD2 4.09Å; W116-L214 HydrophobicContact CE3-CD1 3.76Å; W116-L214 HydrophobicContact CE3-CD2 4.49Å; W116-L214 HydrophobicContact CE3-CG 4.29Å; W116-L214 HydrophobicContact CZ3-CD1 4Å; V120-L214 HydrophobicContact CG2-CD1 4.5Å; V120-L214 HydrophobicContact CG2-CD2 3.14Å; V120-L214 HydrophobicContact CG2-CG 4.38Å; F206-L214 HydrophobicContact CB-CD1 4.02Å; M207-L214 HydrophobicContact CB-CB 4.41Å; M207-L214 HydrophobicContact CG-CB 3.62Å; M207-L214 HydrophobicContact CG-CD1 4.44Å; T212-L214 PolarHBondContact O-N 3.45Å; T212-L214 VanDerWaalsContact O-N 3.09Å; T212-L214 WeakPolarHBondContact OG1-CG 3.33Å; T212-L214 PolarHBondContact OG1-N 3.16Å; L214-V224 CarbonylContact C-O 3.59Å; L214-V224 WeakPolarHBondContact CA-O 3.43Å
215	R	75.5	Confident	71	Confident	162 Å²	162	59.2 Å²	59.2	61%	0.611	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	164.3	176.4	-59.4	-175.2	-178.9	-172.1	0.1	110.2	F223 V224	R215-F223 CarbonylContact O-C 3.59Å; R215-F223 VanDerWaalsContact O-CA 3.32Å; R215-F223 WeakPolarHBondContact O-CA 3.49Å; R215-V224 PolarHBondContact N-O 3.47Å; R215-V224 PolarHBondContact O-N 3.11Å
216	I	73	Confident	70.1	Confident	42 Å²	42	63 Å²	63	22%	0.215	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	129.9	163.8	-75	167.1	0	0	0	108.3	M207 N218 K222 F223	M207-I216 HydrophobicContact CE-CD1 3.5Å; M207-I216 VanDerWaalsContact CE-CD1 3.5Å; M207-I216 HydrophobicContact CE-CG1 3.93Å; M207-I216 HydrophobicContact SD-CD1 3.92Å; M207-I216 HydrophobicContact SD-CG1 3.6Å; I216-N218 PolarHBondContact O-N 3.01Å; I216-K222 CarbonylContact C-O 3.44Å; I216-K222 WeakPolarHBondContact CA-O 3.49Å; I216-F223 HydrophobicContact CD1-CD1 4.47Å; I216-F223 HydrophobicContact CD1-CE1 4.07Å; I216-F223 HydrophobicContact CG1-CD1 3.92Å; I216-F223 HydrophobicContact CG1-CE1 4.04Å
217	D	73.9	Confident	68.8	Low	56 Å²	56	67.9 Å²	67.9	30%	0.299	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	109.2	162.2	167.8	19.5	0	0	0	108.6	S219 T220 L221 K222 V224	D217-S219 VanDerWaalsContact CG-OG 3.25Å; D217-S219 PolarHBondContact O-N 3.43Å; D217-S219 WeakPolarHBondContact OD1-CB 3.32Å; D217-S219 PolarHBondContact OD1-N 2.76Å; D217-S219 PolarHBondContact OD1-OG 3.13Å; D217-S219 PolarHBondContact OD2-OG 2.85Å; D217-S219 VanDerWaalsContact OD2-OG 3.08Å; D217-T220 VanDerWaalsContact CG-OG1 3.3Å; D217-T220 PolarHBondContact O-N 3.21Å; D217-T220 WeakPolarHBondContact OD2-CB 3.36Å; D217-T220 VanDerWaalsContact OD2-CG2 3.24Å; D217-T220 WeakPolarHBondContact OD2-CG2 3.4Å; D217-T220 PolarHBondContact OD2-OG1 3.23Å; D217-L221 WeakPolarHBondContact O-CA 3.26Å; D217-L221 PolarHBondContact O-N 3.32Å; D217-K222 PolarHBondContact N-O 3.48Å; D217-V224 HydrophobicContact CB-CG2 3.59Å
218	N	58.7	Low	67.4	Low	120 Å²	120	70.2 Å²	70.2	64%	0.642	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.5	-177.9	-65.4	-26.9	0	0	0	113.2	I216	I216-N218 PolarHBondContact O-N 3.01Å
219	S	50	Low	65.6	Low	102 Å²	102	71.3 Å²	71.3	71%	0.713	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-30.2	179.2	72	0	0	0	0	112.6	D217	D217-S219 VanDerWaalsContact CG-OG 3.25Å; D217-S219 PolarHBondContact O-N 3.43Å; D217-S219 WeakPolarHBondContact OD1-CB 3.32Å; D217-S219 PolarHBondContact OD1-N 2.76Å; D217-S219 PolarHBondContact OD1-OG 3.13Å; D217-S219 PolarHBondContact OD2-OG 2.85Å; D217-S219 VanDerWaalsContact OD2-OG 3.08Å
220	T	67.4	Low	63.7	Low	67 Å²	67	75.5 Å²	75.5	41%	0.411	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-8.5	-176.7	62.8	0	0	0	0	114.1	D217 K222	D217-T220 VanDerWaalsContact CG-OG1 3.3Å; D217-T220 PolarHBondContact O-N 3.21Å; D217-T220 WeakPolarHBondContact OD2-CB 3.36Å; D217-T220 VanDerWaalsContact OD2-CG2 3.24Å; D217-T220 WeakPolarHBondContact OD2-CG2 3.4Å; D217-T220 PolarHBondContact OD2-OG1 3.23Å; T220-K222 PolarHBondContact O-N 2.91Å
221	L	65.4	Low	62.1	Low	119 Å²	119	77.7 Å²	77.7	62%	0.623	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	33.4	-172.5	-59.9	175.3	0	0	0	112.8	D217	D217-L221 WeakPolarHBondContact O-CA 3.26Å; D217-L221 PolarHBondContact O-N 3.32Å
222	K	75.9	Confident	60.2	Low	100 Å²	100	81.4 Å²	81.4	44%	0.435	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	149.9	178.4	-71	178.6	-178.2	175.4	0	110.5	N124 I216 D217 T220	N124-K222 WeakPolarHBondContact OD1-CA 3.43Å; I216-K222 CarbonylContact C-O 3.44Å; I216-K222 WeakPolarHBondContact CA-O 3.49Å; D217-K222 PolarHBondContact N-O 3.48Å; T220-K222 PolarHBondContact O-N 2.91Å
223	F	77.7	Confident	58.3	Low	6 Å²	6	86.2 Å²	86.2	3%	0.026	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	144.8	169.2	-59.9	-84.4	0	0	0	109.6	V120 V123 N124 A203 M207 R215 I216	V120-F223 HydrophobicContact CB-CB 4.43Å; V120-F223 VanDerWaalsContact CG1-C 3.44Å; V120-F223 HydrophobicContact CG1-CB 3.87Å; V120-F223 WeakPolarHBondContact CG1-O 3.34Å; V120-F223 HydrophobicContact CG2-CB 4.11Å; V123-F223 HydrophobicContact CB-CD2 4.41Å; V123-F223 HydrophobicContact CG1-CD2 3.68Å; V123-F223 HydrophobicContact CG1-CE2 3.51Å; V123-F223 HydrophobicContact CG1-CZ 4.43Å; N124-F223 PolarHBondContact ND2-O 2.9Å; N124-F223 WeakPolarHBondContact OD1-CD2 3.46Å; N124-F223 PolarHBondContact OD1-N 3.24Å; A203-F223 HydrophobicContact CB-CD1 4.15Å; A203-F223 HydrophobicContact CB-CD2 4.39Å; A203-F223 HydrophobicContact CB-CE1 3.66Å; A203-F223 HydrophobicContact CB-CE2 3.93Å; A203-F223 HydrophobicContact CB-CG 4.5Å; A203-F223 HydrophobicContact CB-CZ 3.54Å; M207-F223 HydrophobicContact CE-CD1 4.27Å; M207-F223 HydrophobicContact CE-CE1 3.72Å; M207-F223 HydrophobicContact CG-CD1 4.17Å; M207-F223 HydrophobicContact CG-CE1 4.31Å; M207-F223 HydrophobicContact SD-CD1 3.54Å; M207-F223 VanDerWaalsContact SD-CD1 3.54Å; M207-F223 HydrophobicContact SD-CE1 3.63Å; R215-F223 CarbonylContact O-C 3.59Å; R215-F223 VanDerWaalsContact O-CA 3.32Å; R215-F223 WeakPolarHBondContact O-CA 3.49Å; I216-F223 HydrophobicContact CD1-CD1 4.47Å; I216-F223 HydrophobicContact CD1-CE1 4.07Å; I216-F223 HydrophobicContact CG1-CD1 3.92Å; I216-F223 HydrophobicContact CG1-CE1 4.04Å
224	V	77.9	Confident	56.4	Low	45 Å²	45	91.2 Å²	91.2	27%	0.273	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	138.6	-178.1	-175.9	0	0	0	0	108.1	L214 R215 D217 S228	L214-V224 CarbonylContact C-O 3.59Å; L214-V224 WeakPolarHBondContact CA-O 3.43Å; R215-V224 PolarHBondContact N-O 3.47Å; R215-V224 PolarHBondContact O-N 3.11Å; D217-V224 HydrophobicContact CB-CG2 3.59Å; V224-S228 WeakPolarHBondContact CG1-OG 3.39Å
225	S	71.5	Confident	54.1	Low	7 Å²	7	99.5 Å²	99.5	5%	0.049	54%	0.536	C	S	.	.			trans	-93.5	148.2	172.9	-177.4	0	0	0	0	109.5	T117 D227 S228	T117-S225 PolarHBondContact OG1-OG 2.94Å; S225-D227 PolarHBondContact O-N 3.27Å; S225-S228 PolarHBondContact O-N 3.46Å; S225-S228 VanDerWaalsContact O-N 3.16Å; S225-S228 PolarHBondContact O-OG 3.44Å
226	Q	63.5	Low	51.7	Low	114 Å²	114	100 Å²	100	53%	0.533	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-56.7	-22.9	-175.3	-171.9	166.3	-26.6	0	0	114	G213	G213-Q226 PolarHBondContact O-N 3.48Å; G213-Q226 VanDerWaalsContact O-N 3.13Å
227	D	56.4	Low	49.6	Very low	105 Å²	105	102.5 Å²	102.5	56%	0.561	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-93.3	-1.7	-176.4	-63.1	-31	0	0	0	114.8	A113 S225 S229	A113-D227 WeakPolarHBondContact CB-OD2 3.2Å; S225-D227 PolarHBondContact O-N 3.27Å; D227-S229 VanDerWaalsContact C-N 3.26Å; D227-S229 PolarHBondContact O-N 3.02Å
228	S	46.2	Very low	47.4	Very low	77 Å²	77	106.7 Å²	106.7	54%	0.538	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-82	5.4	179.3	58.5	0	0	0	0	115	V224 S225 N230	V224-S228 WeakPolarHBondContact CG1-OG 3.39Å; S225-S228 PolarHBondContact O-N 3.46Å; S225-S228 VanDerWaalsContact O-N 3.16Å; S225-S228 PolarHBondContact O-OG 3.44Å; S228-N230 VanDerWaalsContact C-N 3.27Å; S228-N230 PolarHBondContact O-N 3.34Å
229	S	33.3	Very low	46	Very low	96 Å²	96	108.3 Å²	108.3	67%	0.671	60%	0.598	S	S	*	*			trans	-86	66.4	167.8	69	0	0	0	0	110.9	D227 D231	D227-S229 VanDerWaalsContact C-N 3.26Å; D227-S229 PolarHBondContact O-N 3.02Å; S229-D231 VanDerWaalsContact C-N 3.27Å; S229-D231 PolarHBondContact O-N 3.24Å
230	N	31.6	Very low	45	Very low	160 Å²	160	110.9 Å²	110.9	86%	0.856	60%	0.603	S	S	*	*			trans	-79.2	92	154.8	-96.8	-14.7	0	0	0	107.2	S228 D232	S228-N230 VanDerWaalsContact C-N 3.27Å; S228-N230 PolarHBondContact O-N 3.34Å; N230-D232 PolarHBondContact O-N 2.73Å; N230-D232 VanDerWaalsContact O-N 3.09Å
231	D	29.6	Very low	43.4	Very low	143 Å²	143	112.9 Å²	112.9	77%	0.765	62%	0.617	S	S	*	*			trans	-66.1	93.4	170.1	-158.9	12.1	0	0	0	108.7	S229 T233	S229-D231 VanDerWaalsContact C-N 3.27Å; S229-D231 PolarHBondContact O-N 3.24Å; D231-T233 PolarHBondContact O-N 3.49Å
232	D	27.6	Very low	41.4	Very low	157 Å²	157	115.2 Å²	115.2	84%	0.84	63%	0.627	S	S	*	*			trans	-69.1	84.5	157.5	-98.4	-22.1	0	0	0	107.3	N230	N230-D232 PolarHBondContact O-N 2.73Å; N230-D232 VanDerWaalsContact O-N 3.09Å
233	T	27.4	Very low	39.1	Very low	108 Å²	108	119.4 Å²	119.4	66%	0.663	65%	0.645	S	S	*	*	S	Bend		172.5	120	124.3	35.2	0	0	0	0	112.3	D231	D231-T233 PolarHBondContact O-N 3.49Å
234	T	27.4	Very low	36.7	Very low	116 Å²	116	125.1 Å²	125.1	71%	0.712	69%	0.686	S	S	*	*			trans	73.4	99.2	149.9	40.2	0	0	0	0	120.9
235	K	25.6	Very low	34.3	Very low	188 Å²	188	128.1 Å²	128.1	82%	0.817	71%	0.709	S	S	*	*				65.2	109.6	129	-59.1	178	-178.3	-180	0	118.4
236	L	26	Very low	32.1	Very low	173 Å²	173	133.4 Å²	133.4	91%	0.906	74%	0.74	S	S	*	*				-173.9	147.9	96	-98.1	137.8	0	0	0	111
237	P	28.4	Very low	30.5	Very low	93 Å²	93	137 Å²	137	60%	0.604	75%	0.754	S	S	*	*			trans	-115.8	168.7	-148.7	42.2	-32.2	0	0	0	115.2
238	L	27.1	Very low	29.4	Very low	145 Å²	145	139.3 Å²	139.3	76%	0.759	77%	0.766	S	S	*	*			trans	64.9	113.8	137.8	-83.1	162.9	0	0	0	116.2
239	L	29.2	Very low	28.9	Very low	153 Å²	153	141.3 Å²	141.3	80%	0.801	78%	0.777	S	S	*	*				175.2	136.1	67.9	-89.4	140.2	0	0	0	111.8
240	L	30.1	Very low	28.9	Very low	157 Å²	157	143.5 Å²	143.5	82%	0.822	78%	0.78	S	S	*	*			trans	-81.3	172.4	141.5	-70	159.8	0	0	0	107.8
241	P	32.8	Very low	28.9	Very low	108 Å²	108	141.8 Å²	141.8	70%	0.701	77%	0.771	S	S	*	*			cis	-151	-172.3	21	36.7	-11.4	0	0	0	117.2
242	M	24.9	Very low	29.2	Very low	168 Å²	168	141.2 Å²	141.2	83%	0.828	77%	0.768	S	S	*	*			trans	82	113.4	144	-97.3	164.5	98.5	0	0	123.8
243	K	26.3	Very low	29.6	Very low	188 Å²	188	141.7 Å²	141.7	82%	0.817	77%	0.769	S	S	*	*			trans	27.2	119.3	135.2	-63.2	178.4	177.3	178.6	0	119.9
244	S	27.7	Very low	29.8	Very low	126 Å²	126	140.4 Å²	140.4	88%	0.881	77%	0.769	S	S	*	*				165.2	156.4	106.5	55.1	0	0	0	0	113.2
245	S	27.2	Very low	30.3	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	78%	0.779	S	S	*	*			trans	-57.3	160.4	-167.1	-51.1	0	0	0	0	118.4
246	V	26.9	Very low	30.6	Very low	117 Å²	117	142.6 Å²	142.6	71%	0.709	78%	0.779	S	S	*	*				140.9	110.1	124.2	175.9	0	0	0	0	114.8
247	K	29.4	Very low	30.9	Very low	189 Å²	189	137.9 Å²	137.9	82%	0.822	77%	0.772	S	S	*	*			trans	71.5	107.2	144.2	-64.9	170.5	-171.2	-179.1	0	122.8
248	L	33	Very low	31	Very low	155 Å²	155	139.1 Å²	139.1	81%	0.812	77%	0.773	S	S	*	*				8.5	154.8	127.1	-76.5	159.1	0	0	0	119.7
249	P	34.8	Very low	31.2	Very low	119 Å²	119	140.4 Å²	140.4	77%	0.773	78%	0.78	S	S	*	*			cis	-144.8	154.3	40.1	34.8	-12.1	0	0	0	120.1
250	L	34.5	Very low	31.4	Very low	141 Å²	141	140.3 Å²	140.3	74%	0.738	78%	0.775	S	S	*	*			trans	7.8	125	141.9	-139.6	71.4	0	0	0	119.1
251	D	31.7	Very low	31.7	Very low	125 Å²	125	140.1 Å²	140.1	67%	0.668	77%	0.774	S	S	*	*				177.8	133.9	114.3	-96.6	-2.5	0	0	0	113.6
252	N	34.2	Very low	31.6	Very low	131 Å²	131	144.5 Å²	144.5	70%	0.701	78%	0.776	S	S	*	*			trans	77.6	97.8	146.7	-54.4	-22.6	0	0	0	120.2
253	I	37.7	Very low	31.9	Very low	167 Å²	167	144.9 Å²	144.9	86%	0.856	78%	0.776	S	S	*	*				164.5	121.4	104.8	-79.3	154.1	0	0	0	109.5
254	A	31	Very low	32.1	Very low	80 Å²	80	141 Å²	141	66%	0.661	77%	0.773	S	S	*	*			trans	-73.6	147.3	176.1	0	0	0	0	0	112.5
255	H	38.7	Very low	32.1	Very low	199 Å²	199	141.5 Å²	141.5	92%	0.921	77%	0.773	S	S	*	*				-161.8	139.2	124.7	-94.2	-57.9	0	0	0	111
256	D	31.9	Very low	32.2	Very low	152 Å²	152	139.7 Å²	139.7	81%	0.813	77%	0.772	S	S	*	*			trans	-83.9	161.9	-160.6	-172.7	17	0	0	0	113.8
257	G	31.1	Very low	32.1	Very low	73 Å²	73	142.2 Å²	142.2	75%	0.753	78%	0.781	S	S	*	*			trans	166.9	52	177.4	0	0	0	0	0	116
258	D	30.2	Very low	32.1	Very low	120 Å²	120	138 Å²	138	64%	0.642	78%	0.775	S	S	*	*			trans	-51.6	130.7	175	-110.7	-11.7	0	0	0	114.7	Q260	D258-Q260 HydrophobicContact CB-CG 4.45Å; D258-Q260 PolarHBondContact OD2-NE2 3.02Å
259	L	32.1	Very low	31.7	Very low	172 Å²	172	135.8 Å²	135.8	90%	0.901	77%	0.773	S	S	*	*			trans	-117.3	77.3	161	-109.9	158.6	0	0	0	107.8	I261	L259-I261 PolarHBondContact O-N 3.4Å
260	Q	32.3	Very low	31.6	Very low	150 Å²	150	136.3 Å²	136.3	70%	0.701	77%	0.774	S	S	*	*			trans	-72.6	113	172.3	-68.3	-177.2	18.1	0	0	109.5	D258 R262	D258-Q260 HydrophobicContact CB-CG 4.45Å; D258-Q260 PolarHBondContact OD2-NE2 3.02Å; Q260-R262 PolarHBondContact O-N 3.26Å
261	I	37	Very low	31.6	Very low	154 Å²	154	134.1 Å²	134.1	79%	0.79	77%	0.767	S	S	*	*			trans	-66.8	99.3	168.6	-62.4	171.8	0	0	0	107.5	L259 Q263	L259-I261 PolarHBondContact O-N 3.4Å; I261-Q263 PolarHBondContact O-N 3.21Å
262	R	30.8	Very low	32.2	Very low	200 Å²	200	134.9 Å²	134.9	76%	0.755	77%	0.766	S	S	*	*			trans	-80.7	96	-175.7	-153.2	178.9	-173.6	-153.4	1.8	109.7	Q260	Q260-R262 PolarHBondContact O-N 3.26Å
263	Q	32.1	Very low	33	Very low	176 Å²	176	132.1 Å²	132.1	82%	0.822	76%	0.757	S	S	*	*			trans	-82.4	110	166.8	-67.8	-177	4	0	0	108.8	I261	I261-Q263 PolarHBondContact O-N 3.21Å
264	S	29.7	Very low	33.9	Very low	107 Å²	107	127 Å²	127	75%	0.748	73%	0.727	S	S	*	*			trans	-72.9	133.7	170	-71.5	0	0	0	0	110.6
265	P	28	Very low	35.5	Very low	135 Å²	135	124 Å²	124	88%	0.877	70%	0.7	S	S	*	*			trans	-86.7	120.5	172.5	32.6	-27.4	0	0	0	109.5
266	G	29.2	Very low	37.2	Very low	72 Å²	72	118.4 Å²	118.4	74%	0.742	68%	0.681	S	S	*	*			trans	-172	87	-178	0	0	0	0	0	113.9	S268	G266-S268 PolarHBondContact O-N 3.07Å
267	N	25.2	Very low	39.9	Very low	169 Å²	169	112.4 Å²	112.4	90%	0.904	65%	0.649	S	S	*	*			trans	-24.4	111.7	169.3	-60.3	-23.5	0	0	0	116.8
268	S	28.5	Very low	42.8	Very low	101 Å²	101	109 Å²	109	71%	0.706	61%	0.614	S	S	*	*				-168.7	144.7	129.7	56.8	0	0	0	0	109.3	G266 T270	G266-S268 PolarHBondContact O-N 3.07Å; S268-T270 PolarHBondContact O-N 3.44Å
269	S	26	Very low	45.9	Very low	109 Å²	109	103.2 Å²	103.2	76%	0.762	58%	0.583	S	S	*	*			trans	-56.9	96.3	-174.4	50	0	0	0	0	113.5	T271	S269-T271 VanDerWaalsContact C-N 3.28Å; S269-T271 PolarHBondContact O-N 3.05Å
270	T	31.1	Very low	48.8	Very low	130 Å²	130	95 Å²	95	80%	0.798	54%	0.54	S	S	*	.			trans	-76.8	78.3	174.8	53.5	0	0	0	0	110.9	S268 H272	S268-T270 PolarHBondContact O-N 3.44Å; T270-H272 VanDerWaalsContact C-N 3.34Å; T270-H272 PolarHBondContact O-N 3.3Å; T270-H272 VanDerWaalsContact O-N 3.09Å
271	T	36.2	Very low	51.8	Low	94 Å²	94	87.9 Å²	87.9	58%	0.577	51%	0.507	S	S	*	.			trans	-74.9	82.4	166.5	36.5	0	0	0	0	109.8	S269 S273	S269-T271 VanDerWaalsContact C-N 3.28Å; S269-T271 PolarHBondContact O-N 3.05Å; T271-S273 PolarHBondContact O-N 3.43Å
272	H	43.5	Very low	54.6	Low	141 Å²	141	80.6 Å²	80.6	65%	0.653	47%	0.469	S	S	*	.	S	Bend	trans	36.1	16	162.7	-68.9	-69.4	0	0	0	120.8	T270 R340	T270-H272 VanDerWaalsContact C-N 3.34Å; T270-H272 PolarHBondContact O-N 3.3Å; T270-H272 VanDerWaalsContact O-N 3.09Å; H272-R340 PolarHBondContact O-NH1 2.92Å
273	S	50.7	Low	57.5	Low	73 Å²	73	71 Å²	71	51%	0.51	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-78.5	139.1	-174.4	56.5	0	0	0	0	111.4	T271	T271-S273 PolarHBondContact O-N 3.43Å
274	R	57.2	Low	60.4	Low	59 Å²	59	65.2 Å²	65.2	22%	0.223	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-56.4	147.1	171.4	-91.9	-177.3	165.5	133.3	-5.3	110.4
275	P	64.5	Low	63.4	Low	17 Å²	17	60.1 Å²	60.1	11%	0.11	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-57.3	140.6	173.8	-12.6	23	0	0	0	110.6	T277 N300 Q301 T303	P275-T277 PolarHBondContact O-N 3.13Å; P275-N300 WeakPolarHBondContact CG-O 3.46Å; P275-Q301 WeakPolarHBondContact CB-O 3.38Å; P275-T303 WeakPolarHBondContact CD-OG1 3.24Å
276	T	74.2	Confident	66.6	Low	83 Å²	83	53.7 Å²	53.7	51%	0.509	33%	0.33	S	S	.	.	S	Bend	trans	-83.8	0.4	-175.1	52.7	0	0	0	0	113.8	H381 H382	T276-H381 WeakPolarHBondContact CA-ND1 3.41Å; T276-H381 VanDerWaalsContact O-CA 3.23Å; T276-H381 WeakPolarHBondContact O-CA 3.42Å; T276-H381 WeakPolarHBondContact O-CB 3.48Å; T276-H381 PolarHBondContact O-ND1 3.24Å; T276-H382 PolarHBondContact O-N 2.87Å; T276-H382 VanDerWaalsContact O-N 3.1Å
277	T	88.8	Confident	69.6	Low	25 Å²	25	51 Å²	51	15%	0.153	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.5	-177.6	-54	0	0	0	0	109.9	P275 L279 F302 T303 H382	P275-T277 PolarHBondContact O-N 3.13Å; T277-L279 HydrophobicContact CG2-CD2 4.26Å; T277-F302 HydrophobicContact CG2-CD1 3.64Å; T277-F302 HydrophobicContact CG2-CE1 3.95Å; T277-F302 WeakPolarHBondContact O-CA 3.46Å; T277-T303 PolarHBondContact O-N 3.09Å; T277-H382 CarbonylContact C-O 3.55Å; T277-H382 VanDerWaalsContact CA-O 3.27Å; T277-H382 WeakPolarHBondContact CA-O 3.15Å; T277-H382 HydrophobicContact CG2-CB 4.17Å
278	F	91.2	Very high	72.7	Confident	1 Å²	1	45.8 Å²	45.8	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133.6	175.5	-65.3	-75.4	0	0	0	111.2	T303 V305 M343 L372 Y378 H381 H382 V383 V384	F278-T303 CarbonylContact C-O 3.52Å; F278-T303 WeakPolarHBondContact CA-O 3.29Å; F278-T303 HydrophobicContact CD1-CG2 3.81Å; F278-T303 HydrophobicContact CE1-CG2 3.81Å; F278-V305 HydrophobicContact CB-CG2 4.11Å; F278-V305 HydrophobicContact CD1-CG2 3.62Å; F278-V305 HydrophobicContact CG-CG2 4.24Å; F278-M343 HydrophobicContact CE1-SD 3.87Å; F278-L372 HydrophobicContact CB-CD1 3.84Å; F278-L372 HydrophobicContact CD1-CD1 4.42Å; F278-L372 HydrophobicContact CD2-CB 4.44Å; F278-L372 HydrophobicContact CD2-CD1 4.32Å; F278-L372 HydrophobicContact CD2-CD2 4.39Å; F278-L372 HydrophobicContact CE2-CD2 4.36Å; F278-L372 HydrophobicContact CG-CD1 3.97Å; F278-L372 HydrophobicContact CG-CD2 4.48Å; F278-Y378 HydrophobicContact CE2-CD1 4.19Å; F278-Y378 HydrophobicContact CE2-CE1 4.44Å; F278-Y378 HydrophobicContact CE2-CG 4.28Å; F278-Y378 HydrophobicContact CZ-CD1 4.04Å; F278-Y378 AromaticContact CZ-CE1 3.84Å; F278-Y378 HydrophobicContact CZ-CE1 3.84Å; F278-Y378 HydrophobicContact CZ-CG 4.44Å; F278-H381 HydrophobicContact CD2-CB 3.7Å; F278-H381 HydrophobicContact CE2-CB 3.61Å; F278-H381 AromaticContact CE2-CD2 3.35Å; F278-H381 WeakPolarHBondContact CE2-CD2 3.32Å; F278-H381 AromaticContact CE2-CG 3.48Å; F278-H381 VanDerWaalsContact CE2-CG 3.48Å; F278-H382 PolarHBondContact N-O 3.26Å; F278-V383 HydrophobicContact CB-CG1 4.38Å; F278-V383 HydrophobicContact CB-CG2 4.42Å; F278-V383 HydrophobicContact CD2-CG2 4.34Å; F278-V383 WeakPolarHBondContact O-CA 3.4Å; F278-V384 PolarHBondContact O-N 3.29Å
279	L	94.9	Very high	75.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	100.5	176.1	-56.5	180	0	0	0	108.2	T277 L296 F302 T303 I304 V305 V384 L386 F419	T277-L279 HydrophobicContact CG2-CD2 4.26Å; L279-L296 HydrophobicContact CD1-CD1 3.98Å; L279-L296 HydrophobicContact CD1-CD2 4.39Å; L279-F302 HydrophobicContact CD1-CB 3.52Å; L279-F302 HydrophobicContact CD1-CD1 3.83Å; L279-F302 HydrophobicContact CD1-CD2 4.18Å; L279-F302 HydrophobicContact CD1-CG 3.57Å; L279-F302 HydrophobicContact CD2-CD1 4.16Å; L279-F302 HydrophobicContact CG-CB 3.93Å; L279-F302 HydrophobicContact CG-CD1 4.05Å; L279-F302 HydrophobicContact CG-CG 4.16Å; L279-T303 PolarHBondContact N-O 2.73Å; L279-I304 CarbonylContact O-C 3.56Å; L279-I304 WeakPolarHBondContact O-CA 3.41Å; L279-V305 PolarHBondContact O-N 2.93Å; L279-V384 CarbonylContact C-O 3.57Å; L279-V384 WeakPolarHBondContact CA-O 3.31Å; L279-V384 HydrophobicContact CD2-CB 3.93Å; L279-V384 HydrophobicContact CD2-CG2 4.31Å; L279-L386 HydrophobicContact CB-CD1 3.98Å; L279-L386 HydrophobicContact CB-CG 4.39Å; L279-L386 HydrophobicContact CD1-CD1 3.97Å; L279-L386 HydrophobicContact CD2-CD1 4.23Å; L279-L386 HydrophobicContact CD2-CG 4.45Å; L279-L386 HydrophobicContact CG-CD1 4.28Å; L279-F419 HydrophobicContact CD1-CE1 3.88Å; L279-F419 HydrophobicContact CD1-CZ 4.24Å; L279-F419 HydrophobicContact CD2-CE1 4.01Å; L279-F419 HydrophobicContact CD2-CE2 4.23Å; L279-F419 HydrophobicContact CD2-CZ 3.63Å
280	I	94.4	Very high	79	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	125.3	174.2	-58.4	171.6	0	0	0	107.5	V305 L365 M368 Y369 L372 V383 V384 L385 L386	I280-V305 WeakPolarHBondContact CA-O 3.15Å; I280-V305 HydrophobicContact CG1-CB 4.21Å; I280-L365 HydrophobicContact CG2-CB 4.41Å; I280-L365 HydrophobicContact CG2-CD2 3.72Å; I280-M368 HydrophobicContact CD1-CB 4.1Å; I280-M368 HydrophobicContact CD1-CG 3.86Å; I280-M368 HydrophobicContact CG1-CG 4.19Å; I280-Y369 HydrophobicContact CD1-CD2 4.09Å; I280-Y369 HydrophobicContact CD1-CG 4.38Å; I280-Y369 VanDerWaalsContact CD1-N 3.34Å; I280-L372 HydrophobicContact CD1-CD1 4Å; I280-L372 HydrophobicContact CG1-CD1 3.97Å; I280-V383 HydrophobicContact CD1-CG1 3.66Å; I280-V383 HydrophobicContact CG1-CG1 4.09Å; I280-V384 PolarHBondContact N-O 3.31Å; I280-L385 HydrophobicContact CG2-CG 4.49Å; I280-L385 CarbonylContact O-C 3.56Å; I280-L385 WeakPolarHBondContact O-CA 3.28Å; I280-L386 PolarHBondContact O-N 3.39Å
281	V	95.4	Very high	81.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142.1	-176	-63.1	0	0	0	0	111.5	L286 M293 I304 V305 I306 L386	V281-L286 HydrophobicContact CB-CG 4.46Å; V281-L286 HydrophobicContact CG2-CD1 4.01Å; V281-L286 HydrophobicContact CG2-CD2 4.03Å; V281-L286 HydrophobicContact CG2-CG 3.94Å; V281-M293 HydrophobicContact CG1-CE 4.13Å; V281-M293 HydrophobicContact CG1-SD 3.65Å; V281-I304 HydrophobicContact CB-CG2 4.49Å; V281-I304 HydrophobicContact CG1-CG2 3.9Å; V281-I304 HydrophobicContact CG2-CG2 3.7Å; V281-V305 PolarHBondContact N-O 3.21Å; V281-V305 VanDerWaalsContact N-O 3.07Å; V281-I306 HydrophobicContact CG2-CD1 4.45Å; V281-I306 HydrophobicContact CG2-CG1 3.71Å; V281-L386 HydrophobicContact CG1-CB 4.23Å; V281-L386 HydrophobicContact CG1-CD1 4.46Å
282	D	94	Very high	84.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.19	C	C	.	.			trans	-91	175.9	172	71.6	13.6	0	0	0	112.9	L284 S285 L286 L365 L386 T387 Y389	D282-L284 VanDerWaalsContact C-N 3.31Å; D282-L284 PolarHBondContact O-N 3.27Å; D282-L284 PolarHBondContact OD1-N 2.8Å; D282-L284 VanDerWaalsContact OD1-N 3.14Å; D282-S285 WeakPolarHBondContact OD1-CB 3.5Å; D282-S285 PolarHBondContact OD1-N 3.18Å; D282-S285 PolarHBondContact OD1-OG 2.69Å; D282-L286 PolarHBondContact O-N 2.87Å; D282-L365 HydrophobicContact CB-CD1 3.82Å; D282-L386 PolarHBondContact N-O 3.41Å; D282-T387 WeakPolarHBondContact OD2-CA 3.04Å; D282-T387 WeakPolarHBondContact OD2-CB 3.19Å; D282-T387 PolarHBondContact OD2-OG1 3.07Å; D282-Y389 HydrophobicContact CB-CE2 4.42Å; D282-Y389 WeakPolarHBondContact OD2-CD2 3.4Å; D282-Y389 WeakPolarHBondContact OD2-CE2 3.3Å
283	V	93	Very high	87.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-38.9	179.6	72	0	0	0	0	112.3	L286 C287 V310 Q313 L314 W317	V283-L286 PolarHBondContact O-N 2.63Å; V283-C287 WeakPolarHBondContact O-CB 3.31Å; V283-C287 PolarHBondContact O-N 3.32Å; V283-C287 VanDerWaalsContact O-N 3.07Å; V283-C287 PolarHBondContact O-SG 3.29Å; V283-V310 HydrophobicContact CB-CG1 4.25Å; V283-Q313 HydrophobicContact CB-CG 4.47Å; V283-Q313 HydrophobicContact CG1-CG 4.46Å; V283-Q313 VanDerWaalsContact CG1-OE1 3.23Å; V283-Q313 HydrophobicContact CG2-CB 4.47Å; V283-Q313 HydrophobicContact CG2-CG 4.21Å; V283-L314 HydrophobicContact CG2-CD2 3.59Å; V283-L314 HydrophobicContact CG2-CG 3.92Å; V283-W317 HydrophobicContact CB-CZ3 4.35Å; V283-W317 HydrophobicContact CG1-CH2 3.64Å; V283-W317 HydrophobicContact CG1-CZ3 3.67Å; V283-W317 HydrophobicContact CG2-CE3 3.82Å; V283-W317 HydrophobicContact CG2-CH2 4.32Å; V283-W317 HydrophobicContact CG2-CZ3 3.68Å
284	L	92.3	Very high	89	Confident	54 Å²	54	28 Å²	28	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-70.4	-40.7	-175.2	-71.1	-172.9	0	0	0	111.1	D282 L286 C287 S288 W317 D388 Y389	D282-L284 VanDerWaalsContact C-N 3.31Å; D282-L284 PolarHBondContact O-N 3.27Å; D282-L284 PolarHBondContact OD1-N 2.8Å; D282-L284 VanDerWaalsContact OD1-N 3.14Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 2.63Å; L284-C287 PolarHBondContact O-N 3.08Å; L284-S288 VanDerWaalsContact O-CB 3.28Å; L284-S288 WeakPolarHBondContact O-CB 3.49Å; L284-S288 PolarHBondContact O-N 2.81Å; L284-S288 PolarHBondContact O-OG 3.44Å; L284-W317 HydrophobicContact CD2-CH2 4.33Å; L284-W317 HydrophobicContact CD2-CZ3 4.16Å; L284-D388 HydrophobicContact CB-CB 4.42Å; L284-Y389 HydrophobicContact CD1-CD1 3.34Å; L284-Y389 HydrophobicContact CD1-CE1 3.24Å; L284-Y389 HydrophobicContact CD1-CG 4.22Å; L284-Y389 HydrophobicContact CG-CD1 4.47Å; L284-Y389 HydrophobicContact CG-CE1 4Å
285	S	93.9	Very high	90.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-44.7	177.6	-57.9	0	0	0	0	111.1	D282 K289 L386 T387 D388 V416	D282-S285 WeakPolarHBondContact OD1-CB 3.5Å; D282-S285 PolarHBondContact OD1-N 3.18Å; D282-S285 PolarHBondContact OD1-OG 2.69Å; S285-K289 CarbonylContact O-C 3.57Å; S285-K289 PolarHBondContact O-N 2.92Å; S285-L386 PolarHBondContact OG-O 3.42Å; S285-T387 VanDerWaalsContact OG-CA 3.24Å; S285-T387 WeakPolarHBondContact OG-CA 3.07Å; S285-D388 PolarHBondContact OG-N 2.9Å; S285-V416 WeakPolarHBondContact OG-CG2 3.23Å
286	L	93.9	Very high	91.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-40.3	176.2	-72.7	166.6	0	0	0	112	V281 D282 V283 L284 L290 M293 I306 V310 L314 A327 W330 I331	V281-L286 HydrophobicContact CB-CG 4.46Å; V281-L286 HydrophobicContact CG2-CD1 4.01Å; V281-L286 HydrophobicContact CG2-CD2 4.03Å; V281-L286 HydrophobicContact CG2-CG 3.94Å; D282-L286 PolarHBondContact O-N 2.87Å; V283-L286 PolarHBondContact O-N 2.63Å; L284-L286 VanDerWaalsContact C-N 3.33Å; L284-L286 PolarHBondContact O-N 2.63Å; L286-L290 WeakPolarHBondContact O-CB 3.25Å; L286-M293 HydrophobicContact CD2-CG 4.33Å; L286-I306 HydrophobicContact CD1-CD1 4.12Å; L286-I306 HydrophobicContact CD1-CG1 4.46Å; L286-I306 HydrophobicContact CD1-CG2 4.27Å; L286-I306 HydrophobicContact CD2-CD1 4.11Å; L286-V310 HydrophobicContact CD1-CG1 3.72Å; L286-L314 HydrophobicContact CD1-CD1 4.05Å; L286-A327 HydrophobicContact CB-CB 4.25Å; L286-W330 HydrophobicContact CD2-CE3 4.33Å; L286-W330 HydrophobicContact CD2-CZ3 3.7Å; L286-I331 HydrophobicContact CD1-CD1 4.14Å
287	C	92.7	Very high	92.5	Very high	16 Å²	16	24.8 Å²	24.8	11%	0.108	13%	0.132	C	C	.	.	H	α-helix	trans	-76.6	-39.2	-177.6	-67.1	0	0	0	0	113.4	V283 L284 S323 V324	V283-C287 WeakPolarHBondContact O-CB 3.31Å; V283-C287 PolarHBondContact O-N 3.32Å; V283-C287 VanDerWaalsContact O-N 3.07Å; V283-C287 PolarHBondContact O-SG 3.29Å; L284-C287 PolarHBondContact O-N 3.08Å; C287-S323 VanDerWaalsContact O-CB 3.25Å; C287-S323 WeakPolarHBondContact O-CB 3.4Å; C287-V324 WeakPolarHBondContact SG-CG2 3.36Å
288	S	91	Very high	92.3	Very high	58 Å²	58	29.9 Å²	29.9	41%	0.406	15%	0.154	S	C	.	.	H	α-helix	trans	-89.6	-33	-172.2	60.5	0	0	0	0	112.9	L284 D388	L284-S288 VanDerWaalsContact O-CB 3.28Å; L284-S288 WeakPolarHBondContact O-CB 3.49Å; L284-S288 PolarHBondContact O-N 2.81Å; L284-S288 PolarHBondContact O-OG 3.44Å; S288-D388 PolarHBondContact OG-OD2 3.16Å
289	K	92.6	Very high	92	Very high	66 Å²	66	31.3 Å²	31.3	29%	0.287	16%	0.164	S	C	.	.			trans	-128.3	35.5	-171.3	-54.4	-59.2	176	-177.8	0	112.7	S285 S291 F292 M293 V416	S285-K289 CarbonylContact O-C 3.57Å; S285-K289 PolarHBondContact O-N 2.92Å; K289-S291 PolarHBondContact O-N 3.04Å; K289-S291 VanDerWaalsContact O-N 3.1Å; K289-F292 HydrophobicContact CB-CB 4.31Å; K289-F292 HydrophobicContact CB-CD2 3.86Å; K289-F292 HydrophobicContact CB-CG 4.22Å; K289-F292 HydrophobicContact CD-CD2 4.08Å; K289-F292 HydrophobicContact CD-CE2 3.85Å; K289-F292 HydrophobicContact CD-CZ 4.5Å; K289-F292 HydrophobicContact CG-CD2 4.13Å; K289-F292 HydrophobicContact CG-CE2 4.37Å; K289-F292 WeakPolarHBondContact O-CB 3.41Å; K289-F292 PolarHBondContact O-N 2.72Å; K289-M293 PolarHBondContact O-N 2.95Å; K289-V416 HydrophobicContact CB-CG1 3.83Å; K289-V416 HydrophobicContact CG-CB 4.15Å; K289-V416 HydrophobicContact CG-CG1 3.98Å
290	L	93.5	Very high	91.3	Very high	19 Å²	19	36.2 Å²	36.2	10%	0.099	19%	0.19	C	C	.	.	H	α-helix	trans	-53.1	-34.8	-179.5	-171.4	60.4	0	0	0	113.6	L286 M293 K294 Q326 A327 W330	L286-L290 WeakPolarHBondContact O-CB 3.25Å; L290-M293 PolarHBondContact O-N 3.49Å; L290-K294 WeakPolarHBondContact O-CG 3.33Å; L290-K294 PolarHBondContact O-N 3.34Å; L290-K294 VanDerWaalsContact O-N 3.07Å; L290-Q326 HydrophobicContact CD2-CB 3.86Å; L290-A327 HydrophobicContact CD1-CB 4.32Å; L290-W330 HydrophobicContact CD1-CB 4.13Å; L290-W330 HydrophobicContact CD1-CD2 3.71Å; L290-W330 HydrophobicContact CD1-CE3 3.39Å; L290-W330 HydrophobicContact CD1-CG 4.04Å; L290-W330 HydrophobicContact CD1-CZ3 4.09Å; L290-W330 HydrophobicContact CD2-CB 4.34Å
291	S	92.5	Very high	90.9	Very high	63 Å²	63	40.3 Å²	40.3	44%	0.441	21%	0.209	S	C	.	.	H	α-helix	trans	-61.1	-42.4	175.9	50.7	0	0	0	0	112.3	K289 M293 K294 E295	K289-S291 PolarHBondContact O-N 3.04Å; K289-S291 VanDerWaalsContact O-N 3.1Å; S291-M293 VanDerWaalsContact C-N 3.32Å; S291-M293 PolarHBondContact O-N 2.82Å; S291-K294 WeakPolarHBondContact O-CB 3.47Å; S291-K294 PolarHBondContact O-N 3.44Å; S291-E295 PolarHBondContact O-N 3Å
292	F	94.1	Very high	90.6	Very high	47 Å²	47	41.2 Å²	41.2	21%	0.206	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-39.5	178.2	-61.5	-7.2	0	0	0	110.7	K289 K294 E295 L296 V416 Y420	K289-F292 HydrophobicContact CB-CB 4.31Å; K289-F292 HydrophobicContact CB-CD2 3.86Å; K289-F292 HydrophobicContact CB-CG 4.22Å; K289-F292 HydrophobicContact CD-CD2 4.08Å; K289-F292 HydrophobicContact CD-CE2 3.85Å; K289-F292 HydrophobicContact CD-CZ 4.5Å; K289-F292 HydrophobicContact CG-CD2 4.13Å; K289-F292 HydrophobicContact CG-CE2 4.37Å; K289-F292 WeakPolarHBondContact O-CB 3.41Å; K289-F292 PolarHBondContact O-N 2.72Å; F292-K294 VanDerWaalsContact C-N 3.32Å; F292-K294 PolarHBondContact O-N 2.77Å; F292-E295 PolarHBondContact O-N 3.24Å; F292-L296 WeakPolarHBondContact O-CB 3.45Å; F292-L296 WeakPolarHBondContact O-CG 3.4Å; F292-L296 PolarHBondContact O-N 3.22Å; F292-V416 HydrophobicContact CD2-CG1 4.17Å; F292-Y420 HydrophobicContact CB-CD1 4.49Å; F292-Y420 HydrophobicContact CB-CD2 3.66Å; F292-Y420 HydrophobicContact CB-CE2 3.85Å; F292-Y420 HydrophobicContact CB-CG 4.03Å; F292-Y420 AromaticContact CD1-CD1 3.7Å; F292-Y420 HydrophobicContact CD1-CD1 3.7Å; F292-Y420 HydrophobicContact CD1-CD2 4.32Å; F292-Y420 AromaticContact CD1-CE1 3.52Å; F292-Y420 HydrophobicContact CD1-CE1 3.52Å; F292-Y420 HydrophobicContact CD1-CE2 4.2Å; F292-Y420 HydrophobicContact CD1-CG 4.1Å; F292-Y420 AromaticContact CD1-CZ 3.84Å; F292-Y420 AromaticContact CD2-CD1 3.82Å; F292-Y420 HydrophobicContact CD2-CD1 3.82Å; F292-Y420 HydrophobicContact CD2-CD2 4.21Å; F292-Y420 HydrophobicContact CD2-CE1 4.48Å; F292-Y420 AromaticContact CD2-CG 3.68Å; F292-Y420 HydrophobicContact CD2-CG 3.68Å; F292-Y420 AromaticContact CE1-CD1 3.76Å; F292-Y420 HydrophobicContact CE1-CD1 3.76Å; F292-Y420 AromaticContact CE1-CE1 3.67Å; F292-Y420 HydrophobicContact CE1-CE1 3.67Å; F292-Y420 AromaticContact CE2-CD1 3.86Å; F292-Y420 HydrophobicContact CE2-CD1 3.86Å; F292-Y420 HydrophobicContact CE2-CG 4.11Å; F292-Y420 AromaticContact CG-CD1 3.76Å; F292-Y420 HydrophobicContact CG-CD1 3.76Å; F292-Y420 AromaticContact CG-CD2 3.84Å; F292-Y420 HydrophobicContact CG-CD2 3.84Å; F292-Y420 AromaticContact CG-CE1 3.98Å; F292-Y420 HydrophobicContact CG-CE1 3.98Å; F292-Y420 HydrophobicContact CG-CE2 4.09Å; F292-Y420 AromaticContact CG-CG 3.68Å; F292-Y420 HydrophobicContact CG-CG 3.68Å; F292-Y420 AromaticContact CZ-CD1 3.84Å; F292-Y420 HydrophobicContact CZ-CD1 3.84Å; F292-Y420 HydrophobicContact CZ-CE1 4.22Å
293	M	93.4	Very high	90.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-41.5	176.3	-59	-61.1	144.4	0	0	112	V281 L286 K289 L290 S291 L296 V297 I304 W330 L386 V416	V281-M293 HydrophobicContact CG1-CE 4.13Å; V281-M293 HydrophobicContact CG1-SD 3.65Å; L286-M293 HydrophobicContact CD2-CG 4.33Å; K289-M293 PolarHBondContact O-N 2.95Å; L290-M293 PolarHBondContact O-N 3.49Å; S291-M293 VanDerWaalsContact C-N 3.32Å; S291-M293 PolarHBondContact O-N 2.82Å; M293-L296 PolarHBondContact O-N 3.31Å; M293-L296 HydrophobicContact SD-CD1 4.46Å; M293-V297 WeakPolarHBondContact O-CB 3.33Å; M293-V297 WeakPolarHBondContact O-CG2 3.49Å; M293-V297 PolarHBondContact O-N 2.96Å; M293-I304 HydrophobicContact CB-CD1 3.92Å; M293-I304 HydrophobicContact CG-CD1 4.41Å; M293-I304 WeakPolarHBondContact O-CD1 3.49Å; M293-I304 HydrophobicContact SD-CD1 3.66Å; M293-W330 HydrophobicContact CB-CH2 3.7Å; M293-W330 HydrophobicContact CB-CZ2 4.26Å; M293-W330 HydrophobicContact CB-CZ3 4.06Å; M293-L386 HydrophobicContact CE-CD1 4.3Å; M293-V416 HydrophobicContact CE-CB 4.44Å; M293-V416 HydrophobicContact CE-CG1 3.29Å; M293-V416 HydrophobicContact CE-CG2 4.25Å
294	K	92.3	Very high	90.3	Very high	81 Å²	81	41.2 Å²	41.2	35%	0.352	21%	0.213	S	C	.	.	H	α-helix	trans	-60.7	-48	174.9	-74.1	171.1	176.3	-175.8	0	111.8	L290 S291 F292 V297 Q298 W330	L290-K294 WeakPolarHBondContact O-CG 3.33Å; L290-K294 PolarHBondContact O-N 3.34Å; L290-K294 VanDerWaalsContact O-N 3.07Å; S291-K294 WeakPolarHBondContact O-CB 3.47Å; S291-K294 PolarHBondContact O-N 3.44Å; F292-K294 VanDerWaalsContact C-N 3.32Å; F292-K294 PolarHBondContact O-N 2.77Å; K294-V297 PolarHBondContact O-N 2.95Å; K294-Q298 WeakPolarHBondContact O-CB 3.33Å; K294-Q298 WeakPolarHBondContact O-CG 3.5Å; K294-Q298 PolarHBondContact O-N 2.89Å; K294-W330 HydrophobicContact CG-CD2 4.31Å; K294-W330 HydrophobicContact CG-CG 4.29Å; K294-W330 HydrophobicContact CG-CZ2 4.27Å
295	E	90.6	Very high	90.3	Very high	90 Å²	90	38.6 Å²	38.6	42%	0.421	20%	0.2	S	C	.	.	H	α-helix	trans	-65.1	-42.9	179.4	-70.4	178.6	-113	0	0	111.5	S291 F292 V297 Q298 S299 Y420	S291-E295 PolarHBondContact O-N 3Å; F292-E295 PolarHBondContact O-N 3.24Å; E295-V297 PolarHBondContact O-N 3.15Å; E295-Q298 PolarHBondContact O-N 3.02Å; E295-S299 PolarHBondContact O-N 2.9Å; E295-Y420 HydrophobicContact CB-CE2 4.2Å; E295-Y420 WeakPolarHBondContact CB-OH 2.85Å; E295-Y420 PolarHBondContact OE1-OH 3.09Å; E295-Y420 PolarHBondContact OE2-OH 3.31Å
296	L	91	Very high	90.2	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-42.3	175.5	-72.1	169.7	0	0	0	112.2	L279 F292 M293 S299 F302 I304 L386 F419 Y420 W423	L279-L296 HydrophobicContact CD1-CD1 3.98Å; L279-L296 HydrophobicContact CD1-CD2 4.39Å; F292-L296 WeakPolarHBondContact O-CB 3.45Å; F292-L296 WeakPolarHBondContact O-CG 3.4Å; F292-L296 PolarHBondContact O-N 3.22Å; M293-L296 PolarHBondContact O-N 3.31Å; M293-L296 HydrophobicContact SD-CD1 4.46Å; L296-S299 WeakPolarHBondContact O-CB 3.27Å; L296-S299 PolarHBondContact O-N 3.26Å; L296-S299 PolarHBondContact O-OG 2.81Å; L296-F302 HydrophobicContact CB-CD2 4.37Å; L296-F302 HydrophobicContact CD2-CD2 3.61Å; L296-F302 HydrophobicContact CD2-CE2 3.59Å; L296-I304 HydrophobicContact CB-CD1 4.21Å; L296-L386 HydrophobicContact CD1-CD1 4.44Å; L296-F419 HydrophobicContact CD1-CE1 4.47Å; L296-F419 HydrophobicContact CD2-CE1 4.05Å; L296-Y420 HydrophobicContact CD1-CD2 4.39Å; L296-Y420 HydrophobicContact CD2-CD2 4.3Å; L296-Y420 HydrophobicContact CG-CD2 4.16Å; L296-Y420 HydrophobicContact CG-CE2 4.25Å; L296-W423 HydrophobicContact CD2-CD2 3.92Å; L296-W423 HydrophobicContact CD2-CE3 3.74Å; L296-W423 HydrophobicContact CD2-CG 4.46Å; L296-W423 HydrophobicContact CD2-CZ3 4.08Å
297	V	86.8	Confident	90	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.4	-42.9	175	164.9	0	0	0	0	111.3	M293 K294 E295 S299 N300 I304 W330 N339 C341	M293-V297 WeakPolarHBondContact O-CB 3.33Å; M293-V297 WeakPolarHBondContact O-CG2 3.49Å; M293-V297 PolarHBondContact O-N 2.96Å; K294-V297 PolarHBondContact O-N 2.95Å; E295-V297 PolarHBondContact O-N 3.15Å; V297-S299 VanDerWaalsContact C-N 3.28Å; V297-S299 PolarHBondContact O-N 3.02Å; V297-N300 PolarHBondContact O-N 3.21Å; V297-I304 HydrophobicContact CG2-CB 4.14Å; V297-I304 HydrophobicContact CG2-CD1 3.48Å; V297-I304 VanDerWaalsContact CG2-CD1 3.48Å; V297-I304 HydrophobicContact CG2-CG1 3.65Å; V297-W330 HydrophobicContact CB-CZ2 4.34Å; V297-W330 HydrophobicContact CG2-CH2 4.1Å; V297-W330 HydrophobicContact CG2-CZ2 3.86Å; V297-N339 WeakPolarHBondContact CG1-ND2 3.41Å; V297-C341 HydrophobicContact CG1-CB 4.15Å
298	Q	84.9	Confident	89.6	Confident	131 Å²	131	40.7 Å²	40.7	61%	0.612	21%	0.209	S	C	*	.	H	α-helix	trans	-67.6	-27.1	179.6	-73.7	172.4	-2.6	0	0	113.1	K294 E295 N300	K294-Q298 WeakPolarHBondContact O-CB 3.33Å; K294-Q298 WeakPolarHBondContact O-CG 3.5Å; K294-Q298 PolarHBondContact O-N 2.89Å; E295-Q298 PolarHBondContact O-N 3.02Å; Q298-N300 PolarHBondContact O-N 3.25Å; Q298-N300 PolarHBondContact O-ND2 3.18Å
299	S	85.7	Confident	89.4	Confident	31 Å²	31	38.1 Å²	38.1	22%	0.217	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.4	176.3	78.3	0	0	0	0	113.6	E295 L296 V297 Q301 W423	E295-S299 PolarHBondContact O-N 2.9Å; L296-S299 WeakPolarHBondContact O-CB 3.27Å; L296-S299 PolarHBondContact O-N 3.26Å; L296-S299 PolarHBondContact O-OG 2.81Å; V297-S299 VanDerWaalsContact C-N 3.28Å; V297-S299 PolarHBondContact O-N 3.02Å; S299-Q301 PolarHBondContact O-N 2.98Å; S299-Q301 VanDerWaalsContact O-N 3.11Å; S299-Q301 PolarHBondContact OG-N 2.86Å; S299-Q301 VanDerWaalsContact OG-N 3.12Å; S299-W423 VanDerWaalsContact CB-CZ2 3.43Å
300	N	80.1	Confident	89.4	Confident	104 Å²	104	35 Å²	35	56%	0.556	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	18.8	-170.4	-59.9	-63.3	0	0	0	114.8	P275 V297 Q298 C341	P275-N300 WeakPolarHBondContact CG-O 3.46Å; V297-N300 PolarHBondContact O-N 3.21Å; Q298-N300 PolarHBondContact O-N 3.25Å; Q298-N300 PolarHBondContact O-ND2 3.18Å; N300-C341 PolarHBondContact OD1-SG 3.37Å
301	Q	84.7	Confident	89.1	Confident	86 Å²	86	35.1 Å²	35.1	40%	0.402	18%	0.179	S	C	.	.	S	Bend	trans	-94.6	-17.4	175.2	-66.3	-179.5	15.5	0	0	113	P275 S299 E427	P275-Q301 WeakPolarHBondContact CB-O 3.38Å; S299-Q301 PolarHBondContact O-N 2.98Å; S299-Q301 VanDerWaalsContact O-N 3.11Å; S299-Q301 PolarHBondContact OG-N 2.86Å; S299-Q301 VanDerWaalsContact OG-N 3.12Å; Q301-E427 PolarHBondContact NE2-OE1 3.24Å
302	F	90.3	Very high	88.9	Confident	18 Å²	18	36.1 Å²	36.1	8%	0.079	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.8	-174.6	-52.7	-74.1	0	0	0	111.3	T277 L279 L296 C341 F419 W423	T277-F302 HydrophobicContact CG2-CD1 3.64Å; T277-F302 HydrophobicContact CG2-CE1 3.95Å; T277-F302 WeakPolarHBondContact O-CA 3.46Å; L279-F302 HydrophobicContact CD1-CB 3.52Å; L279-F302 HydrophobicContact CD1-CD1 3.83Å; L279-F302 HydrophobicContact CD1-CD2 4.18Å; L279-F302 HydrophobicContact CD1-CG 3.57Å; L279-F302 HydrophobicContact CD2-CD1 4.16Å; L279-F302 HydrophobicContact CG-CB 3.93Å; L279-F302 HydrophobicContact CG-CD1 4.05Å; L279-F302 HydrophobicContact CG-CG 4.16Å; L296-F302 HydrophobicContact CB-CD2 4.37Å; L296-F302 HydrophobicContact CD2-CD2 3.61Å; L296-F302 HydrophobicContact CD2-CE2 3.59Å; F302-C341 WeakPolarHBondContact O-CB 3.44Å; F302-F419 HydrophobicContact CD1-CZ 4.38Å; F302-F419 HydrophobicContact CE1-CE1 4.43Å; F302-F419 AromaticContact CE1-CZ 3.82Å; F302-F419 HydrophobicContact CE1-CZ 3.82Å; F302-F419 HydrophobicContact CZ-CE1 4.34Å; F302-F419 HydrophobicContact CZ-CZ 4.04Å; F302-W423 AromaticContact CE2-CD1 3.66Å; F302-W423 HydrophobicContact CE2-CD2 4.14Å; F302-W423 AromaticContact CE2-CE2 3.79Å; F302-W423 HydrophobicContact CE2-CG 4.06Å; F302-W423 HydrophobicContact CE2-CZ2 4.44Å; F302-W423 AromaticContact CE2-NE1 3.47Å; F302-W423 AromaticContact CZ-CD1 3.59Å; F302-W423 HydrophobicContact CZ-CG 4.15Å; F302-W423 AromaticContact CZ-NE1 3.82Å
303	T	88.6	Confident	88.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	112.2	165.5	-56.4	0	0	0	0	109.1	P275 T277 F278 L279 C341 M343	P275-T303 WeakPolarHBondContact CD-OG1 3.24Å; T277-T303 PolarHBondContact O-N 3.09Å; F278-T303 CarbonylContact C-O 3.52Å; F278-T303 WeakPolarHBondContact CA-O 3.29Å; F278-T303 HydrophobicContact CD1-CG2 3.81Å; F278-T303 HydrophobicContact CE1-CG2 3.81Å; L279-T303 PolarHBondContact N-O 2.73Å; T303-C341 CarbonylContact C-O 3.57Å; T303-C341 WeakPolarHBondContact CA-O 3.46Å; T303-M343 HydrophobicContact CG2-CB 4.3Å; T303-M343 HydrophobicContact CG2-CG 3.67Å; T303-M343 HydrophobicContact CG2-SD 3.49Å; T303-M343 WeakPolarHBondContact CG2-SD 3.41Å
304	I	92.4	Very high	88.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.7	175.3	-60.6	-161.5	0	0	0	109	L279 V281 M293 L296 V297 I306 W330 C341 L342 M343	L279-I304 CarbonylContact O-C 3.56Å; L279-I304 WeakPolarHBondContact O-CA 3.41Å; V281-I304 HydrophobicContact CB-CG2 4.49Å; V281-I304 HydrophobicContact CG1-CG2 3.9Å; V281-I304 HydrophobicContact CG2-CG2 3.7Å; M293-I304 HydrophobicContact CB-CD1 3.92Å; M293-I304 HydrophobicContact CG-CD1 4.41Å; M293-I304 WeakPolarHBondContact O-CD1 3.49Å; M293-I304 HydrophobicContact SD-CD1 3.66Å; L296-I304 HydrophobicContact CB-CD1 4.21Å; V297-I304 HydrophobicContact CG2-CB 4.14Å; V297-I304 HydrophobicContact CG2-CD1 3.48Å; V297-I304 VanDerWaalsContact CG2-CD1 3.48Å; V297-I304 HydrophobicContact CG2-CG1 3.65Å; I304-I306 HydrophobicContact CG2-CG1 4.21Å; I304-W330 HydrophobicContact CD1-CH2 4.35Å; I304-C341 PolarHBondContact N-O 2.9Å; I304-L342 HydrophobicContact CB-CD1 3.87Å; I304-L342 HydrophobicContact CG2-CD1 3.84Å; I304-L342 CarbonylContact O-C 3.56Å; I304-L342 WeakPolarHBondContact O-CA 3.35Å; I304-M343 PolarHBondContact O-N 3.38Å
305	V	91.3	Very high	88.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.7	-179.5	-176.2	0	0	0	0	109.6	F278 L279 I280 V281 M343 M368 L372	F278-V305 HydrophobicContact CB-CG2 4.11Å; F278-V305 HydrophobicContact CD1-CG2 3.62Å; F278-V305 HydrophobicContact CG-CG2 4.24Å; L279-V305 PolarHBondContact O-N 2.93Å; I280-V305 WeakPolarHBondContact CA-O 3.15Å; I280-V305 HydrophobicContact CG1-CB 4.21Å; V281-V305 PolarHBondContact N-O 3.21Å; V281-V305 VanDerWaalsContact N-O 3.07Å; V305-M343 CarbonylContact C-O 3.58Å; V305-M343 WeakPolarHBondContact CA-O 3.33Å; V305-M343 HydrophobicContact CG2-CB 4.41Å; V305-M368 HydrophobicContact CG1-CG 3.88Å; V305-M368 HydrophobicContact CG1-SD 4.01Å; V305-L372 HydrophobicContact CB-CD1 4.44Å; V305-L372 HydrophobicContact CG1-CD1 4.34Å; V305-L372 HydrophobicContact CG2-CD1 3.93Å
306	I	91.3	Very high	88.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.3	178.9	-53.6	-176.4	0	0	0	108.4	V281 L286 I304 V310 T311 I331 L342 M343 V344 R345	V281-I306 HydrophobicContact CG2-CD1 4.45Å; V281-I306 HydrophobicContact CG2-CG1 3.71Å; L286-I306 HydrophobicContact CD1-CD1 4.12Å; L286-I306 HydrophobicContact CD1-CG1 4.46Å; L286-I306 HydrophobicContact CD1-CG2 4.27Å; L286-I306 HydrophobicContact CD2-CD1 4.11Å; I304-I306 HydrophobicContact CG2-CG1 4.21Å; I306-V310 HydrophobicContact CG2-CB 4.08Å; I306-V310 HydrophobicContact CG2-CG1 4.02Å; I306-T311 HydrophobicContact CG2-CG2 3.76Å; I306-I331 HydrophobicContact CD1-CD1 3.65Å; I306-I331 HydrophobicContact CD1-CG1 3.59Å; I306-I331 HydrophobicContact CD1-CG2 4.3Å; I306-L342 HydrophobicContact CD1-CD1 3.8Å; I306-L342 HydrophobicContact CG1-CD1 4.24Å; I306-M343 PolarHBondContact N-O 3.29Å; I306-V344 HydrophobicContact CB-CG2 4.36Å; I306-V344 CarbonylContact O-C 3.53Å; I306-V344 VanDerWaalsContact O-CA 3.28Å; I306-V344 WeakPolarHBondContact O-CA 3.45Å; I306-R345 PolarHBondContact O-N 3.45Å
307	C	89.8	Confident	88	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	151.8	176.5	-64.9	0	0	0	0	111.3	S309 V310 T311 R345 E364 L365 M368	C307-S309 VanDerWaalsContact C-N 3.27Å; C307-S309 PolarHBondContact O-N 3.22Å; C307-V310 HydrophobicContact CB-CG2 4.2Å; C307-V310 WeakPolarHBondContact O-CA 3.29Å; C307-V310 WeakPolarHBondContact O-CB 3.41Å; C307-V310 PolarHBondContact O-N 3.29Å; C307-T311 PolarHBondContact O-N 3Å; C307-T311 VanDerWaalsContact O-N 3.17Å; C307-R345 CarbonylContact C-O 3.54Å; C307-R345 VanDerWaalsContact CA-O 3.29Å; C307-R345 WeakPolarHBondContact CA-O 3.42Å; C307-E364 HydrophobicContact CB-CG 3.97Å; C307-L365 HydrophobicContact CB-CD2 4.28Å; C307-M368 VanDerWaalsContact SG-CB 3.59Å
308	I	85.9	Confident	87.9	Confident	60 Å²	60	46.8 Å²	46.8	31%	0.308	23%	0.226	S	C	.	.	H	α-helix	trans	-61.5	-37.6	178.5	-64.4	-156.9	0	0	0	111.4	V310 T311 D312 V344 R345 T346 E364	I308-V310 PolarHBondContact O-N 2.93Å; I308-T311 WeakPolarHBondContact CA-OG1 3.46Å; I308-T311 CarbonylContact O-C 3.49Å; I308-T311 PolarHBondContact O-N 3.14Å; I308-T311 PolarHBondContact O-OG1 3.37Å; I308-D312 VanDerWaalsContact O-CG 3.28Å; I308-D312 PolarHBondContact O-N 3.31Å; I308-V344 HydrophobicContact CG1-CG1 4.5Å; I308-R345 PolarHBondContact N-O 3.21Å; I308-R345 VanDerWaalsContact N-O 3.11Å; I308-T346 HydrophobicContact CB-CG2 4.17Å; I308-T346 HydrophobicContact CD1-CG2 3.25Å; I308-T346 HydrophobicContact CG1-CG2 3.63Å; I308-E364 PolarHBondContact N-OE1 3.39Å
309	S	86.7	Confident	87.6	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-59.2	-31.6	173.4	54.3	0	0	0	0	113.8	C307 Q313 E364	C307-S309 VanDerWaalsContact C-N 3.27Å; C307-S309 PolarHBondContact O-N 3.22Å; S309-Q313 VanDerWaalsContact O-CB 3.31Å; S309-Q313 WeakPolarHBondContact O-CB 3.5Å; S309-Q313 PolarHBondContact O-N 3.06Å; S309-E364 WeakPolarHBondContact CB-OE2 3.36Å; S309-E364 WeakPolarHBondContact OG-CB 3.25Å; S309-E364 PolarHBondContact OG-OE2 3.21Å
310	V	91.2	Very high	87.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-70	-41.1	174.1	176.8	0	0	0	0	110.2	V283 L286 I306 C307 I308 Q313 L314 V361 L365	V283-V310 HydrophobicContact CB-CG1 4.25Å; L286-V310 HydrophobicContact CD1-CG1 3.72Å; I306-V310 HydrophobicContact CG2-CB 4.08Å; I306-V310 HydrophobicContact CG2-CG1 4.02Å; C307-V310 HydrophobicContact CB-CG2 4.2Å; C307-V310 WeakPolarHBondContact O-CA 3.29Å; C307-V310 WeakPolarHBondContact O-CB 3.41Å; C307-V310 PolarHBondContact O-N 3.29Å; I308-V310 PolarHBondContact O-N 2.93Å; V310-Q313 PolarHBondContact O-N 3.46Å; V310-L314 WeakPolarHBondContact O-CG 3.4Å; V310-L314 PolarHBondContact O-N 3.34Å; V310-V361 HydrophobicContact CG2-CG1 3.85Å; V310-L365 HydrophobicContact CG2-CD2 3.82Å
311	T	88.5	Confident	87.5	Confident	22 Å²	22	45.9 Å²	45.9	14%	0.135	25%	0.251	C	S	.	.	H	α-helix	trans	-65	-40.5	174.3	56.3	0	0	0	0	112.1	I306 C307 I308 L314 H315 V344	I306-T311 HydrophobicContact CG2-CG2 3.76Å; C307-T311 PolarHBondContact O-N 3Å; C307-T311 VanDerWaalsContact O-N 3.17Å; I308-T311 WeakPolarHBondContact CA-OG1 3.46Å; I308-T311 CarbonylContact O-C 3.49Å; I308-T311 PolarHBondContact O-N 3.14Å; I308-T311 PolarHBondContact O-OG1 3.37Å; T311-L314 WeakPolarHBondContact O-CB 3.02Å; T311-L314 PolarHBondContact O-N 2.84Å; T311-H315 PolarHBondContact O-CD2 3.15Å; T311-H315 PolarHBondContact O-N 3.38Å; T311-V344 HydrophobicContact CG2-CG1 3.99Å
312	D	87.7	Confident	87.7	Confident	84 Å²	84	46.7 Å²	46.7	45%	0.449	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-44.9	176.7	-66.8	-21.7	0	0	0	110.6	I308 L314 H315 E316	I308-D312 VanDerWaalsContact O-CG 3.28Å; I308-D312 PolarHBondContact O-N 3.31Å; D312-L314 PolarHBondContact O-N 3.23Å; D312-H315 PolarHBondContact O-N 2.92Å; D312-H315 VanDerWaalsContact O-N 3.14Å; D312-E316 PolarHBondContact O-N 3.03Å
313	Q	88.4	Confident	87.6	Confident	33 Å²	33	47.3 Å²	47.3	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-38.9	176.9	-167.4	172.9	31.5	0	0	112.3	V283 S309 V310 E316 W317	V283-Q313 HydrophobicContact CB-CG 4.47Å; V283-Q313 HydrophobicContact CG1-CG 4.46Å; V283-Q313 VanDerWaalsContact CG1-OE1 3.23Å; V283-Q313 HydrophobicContact CG2-CB 4.47Å; V283-Q313 HydrophobicContact CG2-CG 4.21Å; S309-Q313 VanDerWaalsContact O-CB 3.31Å; S309-Q313 WeakPolarHBondContact O-CB 3.5Å; S309-Q313 PolarHBondContact O-N 3.06Å; V310-Q313 PolarHBondContact O-N 3.46Å; Q313-E316 PolarHBondContact O-N 3.09Å; Q313-W317 HydrophobicContact CG-CD2 4.34Å; Q313-W317 HydrophobicContact CG-CZ2 3.96Å; Q313-W317 PolarHBondContact O-N 3.14Å
314	L	90	Very high	87.7	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-45.4	171	-73.8	172.2	0	0	0	111.2	V283 L286 V310 T311 D312 E316 W317 K318 V324 A327 I328 I331	V283-L314 HydrophobicContact CG2-CD2 3.59Å; V283-L314 HydrophobicContact CG2-CG 3.92Å; L286-L314 HydrophobicContact CD1-CD1 4.05Å; V310-L314 WeakPolarHBondContact O-CG 3.4Å; V310-L314 PolarHBondContact O-N 3.34Å; T311-L314 WeakPolarHBondContact O-CB 3.02Å; T311-L314 PolarHBondContact O-N 2.84Å; D312-L314 PolarHBondContact O-N 3.23Å; L314-E316 VanDerWaalsContact C-N 3.31Å; L314-E316 PolarHBondContact O-N 3.28Å; L314-W317 CarbonylContact O-C 3.58Å; L314-W317 PolarHBondContact O-N 2.68Å; L314-W317 VanDerWaalsContact O-N 3.15Å; L314-K318 PolarHBondContact O-N 3.24Å; L314-V324 HydrophobicContact CB-CG1 4.23Å; L314-V324 HydrophobicContact CD2-CB 4.45Å; L314-V324 HydrophobicContact CD2-CG1 3.94Å; L314-V324 HydrophobicContact CD2-CG2 4.33Å; L314-V324 WeakPolarHBondContact O-CG1 3.39Å; L314-A327 HydrophobicContact CD2-CB 4.26Å; L314-I328 HydrophobicContact CB-CD1 4.08Å; L314-I328 HydrophobicContact CB-CG1 3.83Å; L314-I328 HydrophobicContact CD1-CG1 4.41Å; L314-I331 HydrophobicContact CD1-CD1 3.56Å
315	H	87.8	Confident	87.5	Confident	96 Å²	96	53.2 Å²	53.2	44%	0.444	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-37.2	178.9	-82.8	-68.1	0	0	0	112.5	T311 D312 K318	T311-H315 PolarHBondContact O-CD2 3.15Å; T311-H315 PolarHBondContact O-N 3.38Å; D312-H315 PolarHBondContact O-N 2.92Å; D312-H315 VanDerWaalsContact O-N 3.14Å; H315-K318 VanDerWaalsContact O-CB 3.28Å; H315-K318 WeakPolarHBondContact O-CB 3.39Å; H315-K318 PolarHBondContact O-N 3.12Å
316	E	86.6	Confident	87.6	Confident	146 Å²	146	58.1 Å²	58.1	68%	0.682	31%	0.309	S	S	*	.	H	α-helix	trans	-62	-42.8	172.4	-169.7	-178.7	174.6	0	0	111.5	D312 Q313 L314 K318	D312-E316 PolarHBondContact O-N 3.03Å; Q313-E316 PolarHBondContact O-N 3.09Å; L314-E316 VanDerWaalsContact C-N 3.31Å; L314-E316 PolarHBondContact O-N 3.28Å; E316-K318 VanDerWaalsContact C-N 3.33Å; E316-K318 PolarHBondContact O-N 2.66Å
317	W	88.8	Confident	87.7	Confident	79 Å²	79	58.1 Å²	58.1	30%	0.299	31%	0.309	S	S	.	.	H	α-helix	trans	-82.7	-5.5	-178.1	-63	2.7	0	0	0	114.2	V283 L284 Q313 L314 A319 G320 M321 V324	V283-W317 HydrophobicContact CB-CZ3 4.35Å; V283-W317 HydrophobicContact CG1-CH2 3.64Å; V283-W317 HydrophobicContact CG1-CZ3 3.67Å; V283-W317 HydrophobicContact CG2-CE3 3.82Å; V283-W317 HydrophobicContact CG2-CH2 4.32Å; V283-W317 HydrophobicContact CG2-CZ3 3.68Å; L284-W317 HydrophobicContact CD2-CH2 4.33Å; L284-W317 HydrophobicContact CD2-CZ3 4.16Å; Q313-W317 HydrophobicContact CG-CD2 4.34Å; Q313-W317 HydrophobicContact CG-CZ2 3.96Å; Q313-W317 PolarHBondContact O-N 3.14Å; L314-W317 CarbonylContact O-C 3.58Å; L314-W317 PolarHBondContact O-N 2.68Å; L314-W317 VanDerWaalsContact O-N 3.15Å; W317-A319 PolarHBondContact O-N 3.03Å; W317-G320 PolarHBondContact O-N 2.97Å; W317-M321 HydrophobicContact CE3-SD 4.29Å; W317-M321 PolarHBondContact O-N 3.04Å; W317-V324 HydrophobicContact CB-CB 4.47Å; W317-V324 HydrophobicContact CB-CG1 4.05Å; W317-V324 HydrophobicContact CB-CG2 3.82Å; W317-V324 HydrophobicContact CE3-CG2 4.21Å
318	K	84.8	Confident	87.6	Confident	89 Å²	89	58.5 Å²	58.5	39%	0.387	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-33.4	-173.7	-174.3	176.1	-178.6	167.7	0	113.6	L314 H315 E316 V324 R325 I328	L314-K318 PolarHBondContact O-N 3.24Å; H315-K318 VanDerWaalsContact O-CB 3.28Å; H315-K318 WeakPolarHBondContact O-CB 3.39Å; H315-K318 PolarHBondContact O-N 3.12Å; E316-K318 VanDerWaalsContact C-N 3.33Å; E316-K318 PolarHBondContact O-N 2.66Å; K318-V324 HydrophobicContact CB-CG1 4.49Å; K318-R325 HydrophobicContact CG-CG 4.04Å; K318-R325 VanDerWaalsContact O-CG 3.31Å; K318-R325 WeakPolarHBondContact O-CG 3.05Å; K318-I328 HydrophobicContact CB-CD1 3.9Å; K318-I328 HydrophobicContact CD-CD1 3.92Å; K318-I328 HydrophobicContact CG-CD1 3.88Å
319	A	79.6	Confident	87.8	Confident	96 Å²	96	58.1 Å²	58.1	79%	0.793	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-28.7	179.4	0	0	0	0	0	113.3	W317	W317-A319 PolarHBondContact O-N 3.03Å
320	G	78.8	Confident	88	Confident	68 Å²	68	58.5 Å²	58.5	70%	0.701	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-21.5	-167.9	0	0	0	0	0	115.9	W317	W317-G320 PolarHBondContact O-N 2.97Å
321	M	85.2	Confident	88	Confident	82 Å²	82	59.2 Å²	59.2	40%	0.404	32%	0.321	S	S	.	.			trans	-138.1	129.8	-168.2	-61.2	179.5	75.1	0	0	112.9	W317 S323 V324 R325	W317-M321 HydrophobicContact CE3-SD 4.29Å; W317-M321 PolarHBondContact O-N 3.04Å; M321-S323 VanDerWaalsContact C-N 3.34Å; M321-V324 HydrophobicContact CB-CB 3.98Å; M321-V324 HydrophobicContact CB-CG2 3.6Å; M321-V324 HydrophobicContact CG-CG2 4.28Å; M321-V324 PolarHBondContact O-N 2.87Å; M321-V324 HydrophobicContact SD-CG2 3.98Å; M321-R325 PolarHBondContact O-N 3.15Å
322	L	87.4	Confident	87.8	Confident	104 Å²	104	62.6 Å²	62.6	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-63.4	-40.7	174.7	179.6	65.2	0	0	0	111.8	V324 R325 Q326	L322-V324 VanDerWaalsContact C-N 3.3Å; L322-V324 PolarHBondContact O-N 3.49Å; L322-R325 WeakPolarHBondContact O-CB 3.46Å; L322-R325 PolarHBondContact O-N 2.69Å; L322-R325 VanDerWaalsContact O-N 3.16Å; L322-Q326 HydrophobicContact CG-CG 4.5Å; L322-Q326 WeakPolarHBondContact O-CG 3.36Å; L322-Q326 PolarHBondContact O-N 2.92Å
323	S	89.1	Confident	87.5	Confident	31 Å²	31	64.8 Å²	64.8	22%	0.217	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-40.4	177.8	46.8	0	0	0	0	112.4	C287 M321 Q326 A327	C287-S323 VanDerWaalsContact O-CB 3.25Å; C287-S323 WeakPolarHBondContact O-CB 3.4Å; M321-S323 VanDerWaalsContact C-N 3.34Å; S323-Q326 PolarHBondContact O-N 3.24Å; S323-A327 WeakPolarHBondContact O-CB 3.36Å; S323-A327 PolarHBondContact O-N 2.66Å
324	V	90.3	Very high	87.2	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-45.6	174.8	172.7	0	0	0	0	110.9	C287 L314 W317 K318 M321 L322 Q326 A327 I328	C287-V324 WeakPolarHBondContact SG-CG2 3.36Å; L314-V324 HydrophobicContact CB-CG1 4.23Å; L314-V324 HydrophobicContact CD2-CB 4.45Å; L314-V324 HydrophobicContact CD2-CG1 3.94Å; L314-V324 HydrophobicContact CD2-CG2 4.33Å; L314-V324 WeakPolarHBondContact O-CG1 3.39Å; W317-V324 HydrophobicContact CB-CB 4.47Å; W317-V324 HydrophobicContact CB-CG1 4.05Å; W317-V324 HydrophobicContact CB-CG2 3.82Å; W317-V324 HydrophobicContact CE3-CG2 4.21Å; K318-V324 HydrophobicContact CB-CG1 4.49Å; M321-V324 HydrophobicContact CB-CB 3.98Å; M321-V324 HydrophobicContact CB-CG2 3.6Å; M321-V324 HydrophobicContact CG-CG2 4.28Å; M321-V324 PolarHBondContact O-N 2.87Å; M321-V324 HydrophobicContact SD-CG2 3.98Å; L322-V324 VanDerWaalsContact C-N 3.3Å; L322-V324 PolarHBondContact O-N 3.49Å; V324-Q326 VanDerWaalsContact C-N 3.29Å; V324-Q326 PolarHBondContact O-N 3.3Å; V324-A327 PolarHBondContact O-N 2.78Å; V324-I328 HydrophobicContact CG1-CD1 3.89Å; V324-I328 HydrophobicContact CG1-CG1 4.43Å; V324-I328 WeakPolarHBondContact O-CG1 3.29Å; V324-I328 PolarHBondContact O-N 3.13Å
325	R	89.4	Confident	86.4	Confident	123 Å²	123	68 Å²	68	46%	0.464	35%	0.35	S	S	.	.	H	α-helix	trans	-61.1	-39.3	176.3	-66.6	-171.3	-67.7	-138.1	0.2	112.2	K318 M321 L322 A329	K318-R325 HydrophobicContact CG-CG 4.04Å; K318-R325 VanDerWaalsContact O-CG 3.31Å; K318-R325 WeakPolarHBondContact O-CG 3.05Å; M321-R325 PolarHBondContact O-N 3.15Å; L322-R325 WeakPolarHBondContact O-CB 3.46Å; L322-R325 PolarHBondContact O-N 2.69Å; L322-R325 VanDerWaalsContact O-N 3.16Å; R325-A329 VanDerWaalsContact O-CB 3.3Å; R325-A329 WeakPolarHBondContact O-CB 3.17Å; R325-A329 PolarHBondContact O-N 3.26Å
326	Q	92.4	Very high	85.3	Confident	104 Å²	104	66.2 Å²	66.2	49%	0.486	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-40.5	175.9	-70.8	174.2	-28.8	0	0	112	L290 L322 S323 V324 W330	L290-Q326 HydrophobicContact CD2-CB 3.86Å; L322-Q326 HydrophobicContact CG-CG 4.5Å; L322-Q326 WeakPolarHBondContact O-CG 3.36Å; L322-Q326 PolarHBondContact O-N 2.92Å; S323-Q326 PolarHBondContact O-N 3.24Å; V324-Q326 VanDerWaalsContact C-N 3.29Å; V324-Q326 PolarHBondContact O-N 3.3Å; Q326-W330 WeakPolarHBondContact O-CB 3.31Å; Q326-W330 PolarHBondContact O-N 3.05Å
327	A	92.8	Very high	84.5	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.2	-48.3	176.2	0	0	0	0	0	111.3	L286 L290 L314 S323 V324 A329 W330 I331	L286-A327 HydrophobicContact CB-CB 4.25Å; L290-A327 HydrophobicContact CD1-CB 4.32Å; L314-A327 HydrophobicContact CD2-CB 4.26Å; S323-A327 WeakPolarHBondContact O-CB 3.36Å; S323-A327 PolarHBondContact O-N 2.66Å; V324-A327 PolarHBondContact O-N 2.78Å; A327-A329 PolarHBondContact O-N 3.32Å; A327-W330 PolarHBondContact O-N 2.9Å; A327-I331 VanDerWaalsContact O-CG1 3.25Å; A327-I331 WeakPolarHBondContact O-CG1 3.24Å; A327-I331 PolarHBondContact O-N 3.45Å
328	I	89.3	Confident	83.4	Confident	7 Å²	7	60.3 Å²	60.3	4%	0.036	32%	0.322	C	S	.	.	H	α-helix	trans	-57.2	-50.8	175.2	-67.8	169.8	0	0	0	110.6	L314 K318 V324 W330 I331 E332	L314-I328 HydrophobicContact CB-CD1 4.08Å; L314-I328 HydrophobicContact CB-CG1 3.83Å; L314-I328 HydrophobicContact CD1-CG1 4.41Å; K318-I328 HydrophobicContact CB-CD1 3.9Å; K318-I328 HydrophobicContact CD-CD1 3.92Å; K318-I328 HydrophobicContact CG-CD1 3.88Å; V324-I328 HydrophobicContact CG1-CD1 3.89Å; V324-I328 HydrophobicContact CG1-CG1 4.43Å; V324-I328 WeakPolarHBondContact O-CG1 3.29Å; V324-I328 PolarHBondContact O-N 3.13Å; I328-W330 VanDerWaalsContact C-N 3.26Å; I328-W330 PolarHBondContact O-N 3.33Å; I328-I331 PolarHBondContact O-N 2.82Å; I328-E332 HydrophobicContact CG2-CG 4.18Å; I328-E332 VanDerWaalsContact CG2-OE1 3.32Å; I328-E332 WeakPolarHBondContact CG2-OE1 3.44Å; I328-E332 WeakPolarHBondContact O-CB 2.7Å; I328-E332 VanDerWaalsContact O-CG 3.32Å; I328-E332 WeakPolarHBondContact O-CG 3.35Å; I328-E332 PolarHBondContact O-N 2.99Å
329	A	89.2	Confident	82.7	Confident	52 Å²	52	57.9 Å²	57.9	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-35.8	-179.9	0	0	0	0	0	112.5	R325 A327 Y333	R325-A329 VanDerWaalsContact O-CB 3.3Å; R325-A329 WeakPolarHBondContact O-CB 3.17Å; R325-A329 PolarHBondContact O-N 3.26Å; A327-A329 PolarHBondContact O-N 3.32Å; A329-Y333 WeakPolarHBondContact O-CB 3.46Å; A329-Y333 PolarHBondContact O-N 3.47Å
330	W	91.7	Very high	82.2	Confident	12 Å²	12	57.9 Å²	57.9	5%	0.045	29%	0.293	C	S	.	.	H	α-helix	trans	-69.2	-45.7	174.9	173.3	63	0	0	0	112.2	L286 L290 M293 K294 V297 I304 Q326 A327 I328 E332 Y333 E334 L342	L286-W330 HydrophobicContact CD2-CE3 4.33Å; L286-W330 HydrophobicContact CD2-CZ3 3.7Å; L290-W330 HydrophobicContact CD1-CB 4.13Å; L290-W330 HydrophobicContact CD1-CD2 3.71Å; L290-W330 HydrophobicContact CD1-CE3 3.39Å; L290-W330 HydrophobicContact CD1-CG 4.04Å; L290-W330 HydrophobicContact CD1-CZ3 4.09Å; L290-W330 HydrophobicContact CD2-CB 4.34Å; M293-W330 HydrophobicContact CB-CH2 3.7Å; M293-W330 HydrophobicContact CB-CZ2 4.26Å; M293-W330 HydrophobicContact CB-CZ3 4.06Å; K294-W330 HydrophobicContact CG-CD2 4.31Å; K294-W330 HydrophobicContact CG-CG 4.29Å; K294-W330 HydrophobicContact CG-CZ2 4.27Å; V297-W330 HydrophobicContact CB-CZ2 4.34Å; V297-W330 HydrophobicContact CG2-CH2 4.1Å; V297-W330 HydrophobicContact CG2-CZ2 3.86Å; I304-W330 HydrophobicContact CD1-CH2 4.35Å; Q326-W330 WeakPolarHBondContact O-CB 3.31Å; Q326-W330 PolarHBondContact O-N 3.05Å; A327-W330 PolarHBondContact O-N 2.9Å; I328-W330 VanDerWaalsContact C-N 3.26Å; I328-W330 PolarHBondContact O-N 3.33Å; W330-E332 PolarHBondContact O-N 3.16Å; W330-Y333 WeakPolarHBondContact O-CB 3.36Å; W330-Y333 PolarHBondContact O-N 3.03Å; W330-E334 HydrophobicContact CD2-CG 4.25Å; W330-E334 HydrophobicContact CG-CG 4.37Å; W330-E334 HydrophobicContact CZ2-CG 4.01Å; W330-E334 PolarHBondContact NE1-OE1 3.39Å; W330-E334 WeakPolarHBondContact O-CG 3.38Å; W330-E334 PolarHBondContact O-N 3.01Å; W330-L342 HydrophobicContact CH2-CD1 3.94Å; W330-L342 HydrophobicContact CZ3-CD1 4.33Å
331	I	89.5	Confident	82.4	Confident	14 Å²	14	54.9 Å²	54.9	7%	0.072	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-48.5	176.8	-65.6	164.2	0	0	0	110	L286 I306 L314 A327 I328 Y333 E334 W335 V344	L286-I331 HydrophobicContact CD1-CD1 4.14Å; I306-I331 HydrophobicContact CD1-CD1 3.65Å; I306-I331 HydrophobicContact CD1-CG1 3.59Å; I306-I331 HydrophobicContact CD1-CG2 4.3Å; L314-I331 HydrophobicContact CD1-CD1 3.56Å; A327-I331 VanDerWaalsContact O-CG1 3.25Å; A327-I331 WeakPolarHBondContact O-CG1 3.24Å; A327-I331 PolarHBondContact O-N 3.45Å; I328-I331 PolarHBondContact O-N 2.82Å; I331-Y333 VanDerWaalsContact C-N 3.31Å; I331-Y333 PolarHBondContact O-N 2.99Å; I331-E334 PolarHBondContact O-N 3.21Å; I331-W335 WeakPolarHBondContact O-CB 3.29Å; I331-W335 PolarHBondContact O-N 3.18Å; I331-V344 HydrophobicContact CG2-CG2 4.15Å
332	E	85	Confident	82.4	Confident	94 Å²	94	51.2 Å²	51.2	44%	0.439	24%	0.243	S	C	.	.	H	α-helix	trans	-58.6	-43.5	176.3	-72.5	173.4	172.3	0	0	111	I328 W330 V336	I328-E332 HydrophobicContact CG2-CG 4.18Å; I328-E332 VanDerWaalsContact CG2-OE1 3.32Å; I328-E332 WeakPolarHBondContact CG2-OE1 3.44Å; I328-E332 WeakPolarHBondContact O-CB 2.7Å; I328-E332 VanDerWaalsContact O-CG 3.32Å; I328-E332 WeakPolarHBondContact O-CG 3.35Å; I328-E332 PolarHBondContact O-N 2.99Å; W330-E332 PolarHBondContact O-N 3.16Å; E332-V336 VanDerWaalsContact O-CB 3.28Å; E332-V336 WeakPolarHBondContact O-CB 3.43Å; E332-V336 WeakPolarHBondContact O-CG2 3.46Å; E332-V336 PolarHBondContact O-N 2.93Å
333	Y	82.3	Confident	82.1	Confident	129 Å²	129	46.3 Å²	46.3	51%	0.506	22%	0.217	S	C	.	.	H	α-helix	trans	-59.9	-56.2	176	175.4	-91.4	0	0	0	111.8	A329 W330 I331 W335 V336 H337	A329-Y333 WeakPolarHBondContact O-CB 3.46Å; A329-Y333 PolarHBondContact O-N 3.47Å; W330-Y333 WeakPolarHBondContact O-CB 3.36Å; W330-Y333 PolarHBondContact O-N 3.03Å; I331-Y333 VanDerWaalsContact C-N 3.31Å; I331-Y333 PolarHBondContact O-N 2.99Å; Y333-W335 VanDerWaalsContact C-N 3.3Å; Y333-W335 PolarHBondContact O-N 2.96Å; Y333-V336 PolarHBondContact O-N 3.33Å; Y333-H337 AromaticContact CD2-CE1 3.36Å; Y333-H337 WeakPolarHBondContact CD2-CE1 3.44Å; Y333-H337 AromaticContact CD2-ND1 3.61Å; Y333-H337 AromaticContact CE2-CE1 3.09Å; Y333-H337 WeakPolarHBondContact CE2-CE1 3.14Å; Y333-H337 AromaticContact CE2-ND1 3.55Å; Y333-H337 AromaticContact CE2-NE2 3.68Å; Y333-H337 AromaticContact CG-ND1 3.87Å; Y333-H337 AromaticContact CZ-CE1 3.64Å; Y333-H337 AromaticContact CZ-ND1 3.76Å; Y333-H337 AromaticContact CZ-NE2 3.97Å; Y333-H337 PolarHBondContact O-N 3.34Å; Y333-H337 PolarHBondContact O-ND1 2.95Å
334	E	82.1	Confident	81.8	Confident	16 Å²	16	45.9 Å²	45.9	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-63.3	-36.8	-178.2	-67.2	-64.7	166.2	0	0	112.2	W330 I331 H337 S338 N339 L342	W330-E334 HydrophobicContact CD2-CG 4.25Å; W330-E334 HydrophobicContact CG-CG 4.37Å; W330-E334 HydrophobicContact CZ2-CG 4.01Å; W330-E334 PolarHBondContact NE1-OE1 3.39Å; W330-E334 WeakPolarHBondContact O-CG 3.38Å; W330-E334 PolarHBondContact O-N 3.01Å; I331-E334 PolarHBondContact O-N 3.21Å; E334-H337 CarbonylContact O-C 3.6Å; E334-H337 PolarHBondContact O-N 3.47Å; E334-S338 PolarHBondContact O-N 2.74Å; E334-S338 VanDerWaalsContact O-N 3.07Å; E334-N339 HydrophobicContact CB-CB 4.34Å; E334-N339 PolarHBondContact O-N 3.28Å; E334-N339 VanDerWaalsContact OE2-CB 3.27Å; E334-N339 WeakPolarHBondContact OE2-CB 2.81Å; E334-N339 PolarHBondContact OE2-ND2 2.87Å; E334-L342 HydrophobicContact CB-CB 4.37Å; E334-L342 HydrophobicContact CB-CD2 3.32Å; E334-L342 HydrophobicContact CB-CG 4.43Å; E334-L342 HydrophobicContact CG-CD2 4.14Å
335	W	71.7	Confident	80.9	Confident	86 Å²	86	48.2 Å²	48.2	33%	0.326	22%	0.222	S	C	.	.	H	α-helix	trans	-63.7	-48.3	175.6	-177.8	-95.6	0	0	0	111.7	P153 E156 I331 Y333 H337 S338 V344	P153-W335 HydrophobicContact CB-CH2 4.15Å; P153-W335 HydrophobicContact CB-CZ2 3.71Å; P153-W335 HydrophobicContact CG-CH2 3.38Å; P153-W335 HydrophobicContact CG-CZ2 3.48Å; P153-W335 VanDerWaalsContact CG-CZ2 3.48Å; P153-W335 HydrophobicContact CG-CZ3 4.18Å; E156-W335 WeakPolarHBondContact OE1-CZ3 3.09Å; I331-W335 WeakPolarHBondContact O-CB 3.29Å; I331-W335 PolarHBondContact O-N 3.18Å; Y333-W335 VanDerWaalsContact C-N 3.3Å; Y333-W335 PolarHBondContact O-N 2.96Å; W335-H337 VanDerWaalsContact C-N 3.31Å; W335-H337 PolarHBondContact O-N 3.32Å; W335-S338 WeakPolarHBondContact O-CA 3.22Å; W335-S338 PolarHBondContact O-N 3.24Å; W335-V344 HydrophobicContact CE3-CB 3.92Å; W335-V344 HydrophobicContact CE3-CG2 3.6Å; W335-V344 HydrophobicContact CH2-CB 3.94Å; W335-V344 HydrophobicContact CZ3-CB 3.41Å; W335-V344 VanDerWaalsContact CZ3-CB 3.41Å; W335-V344 HydrophobicContact CZ3-CG2 3.65Å
336	V	66.3	Low	79.8	Confident	58 Å²	58	44.8 Å²	44.8	35%	0.352	22%	0.215	S	C	.	.	H	α-helix	trans	-63.2	-38.7	177.9	168.2	0	0	0	0	111.2	E332 Y333 S338	E332-V336 VanDerWaalsContact O-CB 3.28Å; E332-V336 WeakPolarHBondContact O-CB 3.43Å; E332-V336 WeakPolarHBondContact O-CG2 3.46Å; E332-V336 PolarHBondContact O-N 2.93Å; Y333-V336 PolarHBondContact O-N 3.33Å; V336-S338 PolarHBondContact O-N 3.44Å
337	H	69	Low	78.1	Confident	93 Å²	93	40 Å²	40	43%	0.431	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	5.1	174.8	-64.4	79	0	0	0	112.8	Y333 E334 W335 N339	Y333-H337 AromaticContact CD2-CE1 3.36Å; Y333-H337 WeakPolarHBondContact CD2-CE1 3.44Å; Y333-H337 AromaticContact CD2-ND1 3.61Å; Y333-H337 AromaticContact CE2-CE1 3.09Å; Y333-H337 WeakPolarHBondContact CE2-CE1 3.14Å; Y333-H337 AromaticContact CE2-ND1 3.55Å; Y333-H337 AromaticContact CE2-NE2 3.68Å; Y333-H337 AromaticContact CG-ND1 3.87Å; Y333-H337 AromaticContact CZ-CE1 3.64Å; Y333-H337 AromaticContact CZ-ND1 3.76Å; Y333-H337 AromaticContact CZ-NE2 3.97Å; Y333-H337 PolarHBondContact O-N 3.34Å; Y333-H337 PolarHBondContact O-ND1 2.95Å; E334-H337 CarbonylContact O-C 3.6Å; E334-H337 PolarHBondContact O-N 3.47Å; W335-H337 VanDerWaalsContact C-N 3.31Å; W335-H337 PolarHBondContact O-N 3.32Å; H337-N339 VanDerWaalsContact C-N 3.27Å; H337-N339 PolarHBondContact O-N 3.15Å
338	S	65.6	Low	76.2	Confident	8 Å²	8	44 Å²	44	6%	0.056	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	40.4	176	-61.7	0	0	0	0	112.6	S155 R208 E334 W335 V336 R340	S155-S338 VanDerWaalsContact CB-OG 3.31Å; S155-S338 WeakPolarHBondContact CB-OG 3.45Å; R208-S338 VanDerWaalsContact NE-CB 3.32Å; R208-S338 PolarHBondContact NE-O 3.3Å; R208-S338 VanDerWaalsContact NH2-CB 3.34Å; R208-S338 PolarHBondContact NH2-O 2.82Å; E334-S338 PolarHBondContact O-N 2.74Å; E334-S338 VanDerWaalsContact O-N 3.07Å; W335-S338 WeakPolarHBondContact O-CA 3.22Å; W335-S338 PolarHBondContact O-N 3.24Å; V336-S338 PolarHBondContact O-N 3.44Å; S338-R340 PolarHBondContact O-N 3.37Å
339	N	69.3	Low	74.1	Confident	39 Å²	39	48 Å²	48	21%	0.209	24%	0.243	C	C	.	.			trans	-61.5	121.9	-178.6	-168	-26.9	0	0	0	110.9	V297 E334 H337 C341 L342	V297-N339 WeakPolarHBondContact CG1-ND2 3.41Å; E334-N339 HydrophobicContact CB-CB 4.34Å; E334-N339 PolarHBondContact O-N 3.28Å; E334-N339 VanDerWaalsContact OE2-CB 3.27Å; E334-N339 WeakPolarHBondContact OE2-CB 2.81Å; E334-N339 PolarHBondContact OE2-ND2 2.87Å; H337-N339 VanDerWaalsContact C-N 3.27Å; H337-N339 PolarHBondContact O-N 3.15Å; N339-C341 PolarHBondContact O-N 3.46Å; N339-C341 WeakPolarHBondContact OD1-CB 3.22Å; N339-C341 PolarHBondContact OD1-N 2.91Å; N339-L342 PolarHBondContact O-N 3.16Å; N339-L342 VanDerWaalsContact O-N 3.14Å
340	R	70	Confident	71.5	Confident	96 Å²	96	46.8 Å²	46.8	36%	0.362	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.2	-176.4	-63.1	-173.1	-64.8	158.6	6.4	113.3	H272 S338	H272-R340 PolarHBondContact O-NH1 2.92Å; S338-R340 PolarHBondContact O-N 3.37Å
341	C	82.6	Confident	68.9	Low	4 Å²	4	52.1 Å²	52.1	3%	0.027	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.8	179.2	-58.3	0	0	0	0	112.4	V297 N300 F302 T303 I304 N339	V297-C341 HydrophobicContact CG1-CB 4.15Å; N300-C341 PolarHBondContact OD1-SG 3.37Å; F302-C341 WeakPolarHBondContact O-CB 3.44Å; T303-C341 CarbonylContact C-O 3.57Å; T303-C341 WeakPolarHBondContact CA-O 3.46Å; I304-C341 PolarHBondContact N-O 2.9Å; N339-C341 PolarHBondContact O-N 3.46Å; N339-C341 WeakPolarHBondContact OD1-CB 3.22Å; N339-C341 PolarHBondContact OD1-N 2.91Å
342	L	84.5	Confident	66.2	Low	5 Å²	5	59.1 Å²	59.1	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.3	169.4	-170.9	74.4	0	0	0	109.5	I304 I306 W330 E334 N339	I304-L342 HydrophobicContact CB-CD1 3.87Å; I304-L342 HydrophobicContact CG2-CD1 3.84Å; I304-L342 CarbonylContact O-C 3.56Å; I304-L342 WeakPolarHBondContact O-CA 3.35Å; I306-L342 HydrophobicContact CD1-CD1 3.8Å; I306-L342 HydrophobicContact CG1-CD1 4.24Å; W330-L342 HydrophobicContact CH2-CD1 3.94Å; W330-L342 HydrophobicContact CZ3-CD1 4.33Å; E334-L342 HydrophobicContact CB-CB 4.37Å; E334-L342 HydrophobicContact CB-CD2 3.32Å; E334-L342 HydrophobicContact CB-CG 4.43Å; E334-L342 HydrophobicContact CG-CD2 4.14Å; N339-L342 PolarHBondContact O-N 3.16Å; N339-L342 VanDerWaalsContact O-N 3.14Å
343	M	82.4	Confident	64	Low	2 Å²	2	59.2 Å²	59.2	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.3	177.3	-74.7	178.5	54.1	0	0	109.9	F278 T303 I304 V305 I306 R345	F278-M343 HydrophobicContact CE1-SD 3.87Å; T303-M343 HydrophobicContact CG2-CB 4.3Å; T303-M343 HydrophobicContact CG2-CG 3.67Å; T303-M343 HydrophobicContact CG2-SD 3.49Å; T303-M343 WeakPolarHBondContact CG2-SD 3.41Å; I304-M343 PolarHBondContact O-N 3.38Å; V305-M343 CarbonylContact C-O 3.58Å; V305-M343 WeakPolarHBondContact CA-O 3.33Å; V305-M343 HydrophobicContact CG2-CB 4.41Å; I306-M343 PolarHBondContact N-O 3.29Å; M343-R345 HydrophobicContact CB-CG 4.43Å; M343-R345 HydrophobicContact CE-CG 3.94Å
344	V	81.4	Confident	61.7	Low	22 Å²	22	63.4 Å²	63.4	13%	0.133	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.7	170.5	-174.3	0	0	0	0	108.3	I306 I308 T311 I331 W335	I306-V344 HydrophobicContact CB-CG2 4.36Å; I306-V344 CarbonylContact O-C 3.53Å; I306-V344 VanDerWaalsContact O-CA 3.28Å; I306-V344 WeakPolarHBondContact O-CA 3.45Å; I308-V344 HydrophobicContact CG1-CG1 4.5Å; T311-V344 HydrophobicContact CG2-CG1 3.99Å; I331-V344 HydrophobicContact CG2-CG2 4.15Å; W335-V344 HydrophobicContact CE3-CB 3.92Å; W335-V344 HydrophobicContact CE3-CG2 3.6Å; W335-V344 HydrophobicContact CH2-CB 3.94Å; W335-V344 HydrophobicContact CZ3-CB 3.41Å; W335-V344 VanDerWaalsContact CZ3-CB 3.41Å; W335-V344 HydrophobicContact CZ3-CG2 3.65Å
345	R	71.6	Confident	59.3	Low	49 Å²	49	72.6 Å²	72.6	19%	0.185	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	147.9	-168.2	-70.2	-64.9	-177.2	136.8	-4.3	113.1	E156 I306 C307 I308 M343 M368	E156-R345 IonicContact OE2-CZ 3.91Å; E156-R345 IonicContact OE2-NE 3.01Å; E156-R345 PolarHBondContact OE2-NE 3.03Å; E156-R345 IonicContact OE2-NH2 2.67Å; E156-R345 PolarHBondContact OE2-NH2 2.99Å; I306-R345 PolarHBondContact O-N 3.45Å; C307-R345 CarbonylContact C-O 3.54Å; C307-R345 VanDerWaalsContact CA-O 3.29Å; C307-R345 WeakPolarHBondContact CA-O 3.42Å; I308-R345 PolarHBondContact N-O 3.21Å; I308-R345 VanDerWaalsContact N-O 3.11Å; M343-R345 HydrophobicContact CB-CG 4.43Å; M343-R345 HydrophobicContact CE-CG 3.94Å; R345-M368 HydrophobicContact CB-CE 3.51Å; R345-M368 HydrophobicContact CB-SD 4.31Å
346	T	67.7	Low	57.7	Low	51 Å²	51	72.2 Å²	72.2	31%	0.313	38%	0.382	S	S	.	.			trans	-82.4	142.8	159.8	47.2	0	0	0	0	109.6	I308 D348 M368	I308-T346 HydrophobicContact CB-CG2 4.17Å; I308-T346 HydrophobicContact CD1-CG2 3.25Å; I308-T346 HydrophobicContact CG1-CG2 3.63Å; T346-D348 PolarHBondContact O-N 3.45Å; T346-D348 PolarHBondContact OG1-OD1 3.18Å; T346-M368 VanDerWaalsContact C-CE 3.45Å; T346-M368 WeakPolarHBondContact O-CE 3.28Å
347	S	55.8	Low	56.6	Low	2 Å²	2	77.5 Å²	77.5	1%	0.014	40%	0.403	C	S	.	.			trans	-68.6	114.5	157.9	67.9	0	0	0	0	106.9	S349 C350	S347-S349 PolarHBondContact O-N 3.37Å; S347-C350 PolarHBondContact O-N 3.16Å
348	D	53	Low	55.7	Low	86 Å²	86	80.9 Å²	80.9	46%	0.46	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	59.1	-167	-66.8	-23.6	0	0	0	114.4	T346	T346-D348 PolarHBondContact O-N 3.45Å; T346-D348 PolarHBondContact OG1-OD1 3.18Å
349	S	44.5	Very low	55.6	Low	91 Å²	91	82.3 Å²	82.3	64%	0.636	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.3	-2.5	157.3	-25	0	0	0	0	111.6	S347	S347-S349 PolarHBondContact O-N 3.37Å
350	C	35.8	Very low	56.2	Low	26 Å²	26	83.1 Å²	83.1	18%	0.176	44%	0.44	C	S	.	.			trans	-97.3	13.6	-175.3	-78.6	0	0	0	0	114.7	S347 E352 K353	S347-C350 PolarHBondContact O-N 3.16Å; C350-E352 PolarHBondContact O-N 3.33Å; C350-E352 VanDerWaalsContact O-N 3.08Å; C350-K353 HydrophobicContact CB-CD 4.49Å; C350-K353 HydrophobicContact CB-CG 4.42Å; C350-K353 PolarHBondContact O-N 3.33Å
351	S	35.8	Very low	57	Low	124 Å²	124	79.6 Å²	79.6	87%	0.867	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	3.2	176.3	87.1	0	0	0	0	114.2
352	E	33.8	Very low	57.4	Low	160 Å²	160	79.7 Å²	79.7	75%	0.748	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	23.1	172.3	-63.8	-170.3	168.7	0	0	112.5	C350 W354	C350-E352 PolarHBondContact O-N 3.33Å; C350-E352 VanDerWaalsContact O-N 3.08Å; E352-W354 VanDerWaalsContact O-CD1 3.22Å; E352-W354 PolarHBondContact O-N 3.27Å
353	K	39.2	Very low	57.6	Low	96 Å²	96	80.9 Å²	80.9	42%	0.417	44%	0.436	S	S	.	.			trans	-62.2	105.9	171.7	-82.7	-176.8	-176.8	169.3	0	109.4	C350 A359 E364	C350-K353 HydrophobicContact CB-CD 4.49Å; C350-K353 HydrophobicContact CB-CG 4.42Å; C350-K353 PolarHBondContact O-N 3.33Å; K353-A359 HydrophobicContact CD-CB 4.48Å; K353-E364 IonicContact NZ-OE2 2.66Å; K353-E364 PolarHBondContact NZ-OE2 3.07Å
354	W	32.8	Very low	57.9	Low	218 Å²	218	81 Å²	81	83%	0.826	44%	0.436	S	S	*	.			trans	-65.9	139.7	162.9	-67.1	82.9	0	0	0	108.6	E352 G356	E352-W354 VanDerWaalsContact O-CD1 3.22Å; E352-W354 PolarHBondContact O-N 3.27Å; W354-G356 PolarHBondContact O-N 3.49Å
355	E	33.5	Very low	58.4	Low	208 Å²	208	80 Å²	80	97%	0.972	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	109.5	169.8	-67.4	175.7	164.8	0	0	109.1
356	G	36.7	Very low	59.4	Low	78 Å²	78	77.6 Å²	77.6	80%	0.804	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.2	-13.4	169	0	0	0	0	0	117.9	W354	W354-G356 PolarHBondContact O-N 3.49Å
357	E	42.8	Very low	60.4	Low	169 Å²	169	78 Å²	78	79%	0.79	42%	0.417	S	S	*	.			trans	-89.3	116.7	175.3	-153.5	167	-152.3	0	0	109.6	A359	E357-A359 PolarHBondContact O-N 3.48Å
358	L	51.3	Low	62	Low	165 Å²	165	78 Å²	78	86%	0.864	42%	0.417	S	S	*	.			trans	-58	109.6	174.6	-100.6	96.5	0	0	0	108.1	D360	L358-D360 PolarHBondContact O-N 3.08Å; L358-D360 VanDerWaalsContact O-N 3.15Å
359	A	62.6	Low	63.8	Low	37 Å²	37	74.5 Å²	74.5	31%	0.306	40%	0.397	S	S	.	.			trans	-61.5	118.9	178.2	0	0	0	0	0	109.2	K353 E357 V361	K353-A359 HydrophobicContact CD-CB 4.48Å; E357-A359 PolarHBondContact O-N 3.48Å; A359-V361 PolarHBondContact O-N 3.36Å
360	D	82.2	Confident	65.8	Low	56 Å²	56	72.5 Å²	72.5	30%	0.299	38%	0.378	S	S	.	.			trans	-65.3	101.6	169.7	-173	-34.7	0	0	0	108.4	L358 T362 L363 E364 R398 Q402	L358-D360 PolarHBondContact O-N 3.08Å; L358-D360 VanDerWaalsContact O-N 3.15Å; D360-T362 VanDerWaalsContact C-N 3.29Å; D360-T362 PolarHBondContact O-N 3.39Å; D360-T362 PolarHBondContact OD1-N 2.94Å; D360-T362 PolarHBondContact OD1-OG1 3.44Å; D360-L363 HydrophobicContact CB-CB 3.85Å; D360-L363 WeakPolarHBondContact O-CB 3.39Å; D360-L363 PolarHBondContact O-N 3.23Å; D360-L363 PolarHBondContact OD1-N 3.06Å; D360-E364 PolarHBondContact O-N 2.99Å; D360-E364 VanDerWaalsContact O-N 3.17Å; D360-R398 IonicContact OD2-NH1 3.91Å; D360-Q402 VanDerWaalsContact CG-NE2 3.31Å; D360-Q402 PolarHBondContact OD1-NE2 2.92Å; D360-Q402 PolarHBondContact OD2-NE2 3.34Å
361	V	87.3	Confident	68.1	Low	23 Å²	23	72.7 Å²	72.7	14%	0.139	38%	0.377	C	S	.	.	H	α-helix	trans	-58.5	-44.2	-176.9	-175.2	0	0	0	0	110.1	V310 A359 L363 E364 L365	V310-V361 HydrophobicContact CG2-CG1 3.85Å; A359-V361 PolarHBondContact O-N 3.36Å; V361-L363 VanDerWaalsContact C-N 3.29Å; V361-L363 PolarHBondContact O-N 3.43Å; V361-E364 PolarHBondContact O-N 3.37Å; V361-E364 VanDerWaalsContact O-N 3.16Å; V361-L365 WeakPolarHBondContact O-CG 3.22Å; V361-L365 PolarHBondContact O-N 3.47Å; V361-L365 VanDerWaalsContact O-N 3.11Å
362	T	90.9	Very high	70.4	Confident	6 Å²	6	67 Å²	67	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-37.7	180	49.8	0	0	0	0	112.1	D360 E364 L365 V366 E395 R398 I399 Q402	D360-T362 VanDerWaalsContact C-N 3.29Å; D360-T362 PolarHBondContact O-N 3.39Å; D360-T362 PolarHBondContact OD1-N 2.94Å; D360-T362 PolarHBondContact OD1-OG1 3.44Å; T362-E364 PolarHBondContact O-N 3.18Å; T362-L365 PolarHBondContact O-N 3.34Å; T362-V366 WeakPolarHBondContact O-CG2 3.34Å; T362-V366 PolarHBondContact O-N 3.24Å; T362-V366 VanDerWaalsContact O-N 3.12Å; T362-E395 HydrophobicContact CG2-CB 4.21Å; T362-R398 WeakPolarHBondContact OG1-CD 3.11Å; T362-I399 HydrophobicContact CG2-CD1 4.31Å; T362-I399 HydrophobicContact CG2-CG1 3.83Å; T362-Q402 PolarHBondContact O-OE1 2.86Å; T362-Q402 PolarHBondContact OG1-NE2 2.75Å; T362-Q402 PolarHBondContact OG1-OE1 3.29Å
363	L	89.1	Confident	72.8	Confident	29 Å²	29	63 Å²	63	15%	0.152	32%	0.319	C	S	.	.	H	α-helix	trans	-66	-39.9	177	-179.4	58.6	0	0	0	111.7	D360 V361 L365 V366 R367 Q402 Y406	D360-L363 HydrophobicContact CB-CB 3.85Å; D360-L363 WeakPolarHBondContact O-CB 3.39Å; D360-L363 PolarHBondContact O-N 3.23Å; D360-L363 PolarHBondContact OD1-N 3.06Å; V361-L363 VanDerWaalsContact C-N 3.29Å; V361-L363 PolarHBondContact O-N 3.43Å; L363-L365 VanDerWaalsContact C-N 3.33Å; L363-V366 PolarHBondContact O-N 2.91Å; L363-R367 HydrophobicContact CD1-CG 4.35Å; L363-R367 WeakPolarHBondContact O-CG 3.41Å; L363-R367 PolarHBondContact O-N 3.23Å; L363-Q402 VanDerWaalsContact CA-OE1 3.28Å; L363-Q402 HydrophobicContact CD1-CB 4.35Å; L363-Q402 HydrophobicContact CD1-CG 4.3Å; L363-Y406 HydrophobicContact CD1-CD2 3.74Å; L363-Y406 HydrophobicContact CD1-CE1 4.39Å; L363-Y406 HydrophobicContact CD1-CE2 3.32Å; L363-Y406 HydrophobicContact CD1-CG 4.45Å
364	E	88.8	Confident	74.6	Confident	5 Å²	5	64.4 Å²	64.4	2%	0.023	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-37.9	177.6	-169.3	167.8	162.1	0	0	111.7	C307 I308 S309 K353 D360 V361 T362 R367 M368	C307-E364 HydrophobicContact CB-CG 3.97Å; I308-E364 PolarHBondContact N-OE1 3.39Å; S309-E364 WeakPolarHBondContact CB-OE2 3.36Å; S309-E364 WeakPolarHBondContact OG-CB 3.25Å; S309-E364 PolarHBondContact OG-OE2 3.21Å; K353-E364 IonicContact NZ-OE2 2.66Å; K353-E364 PolarHBondContact NZ-OE2 3.07Å; D360-E364 PolarHBondContact O-N 2.99Å; D360-E364 VanDerWaalsContact O-N 3.17Å; V361-E364 PolarHBondContact O-N 3.37Å; V361-E364 VanDerWaalsContact O-N 3.16Å; T362-E364 PolarHBondContact O-N 3.18Å; E364-R367 PolarHBondContact O-N 3.31Å; E364-M368 WeakPolarHBondContact O-CB 3.5Å; E364-M368 PolarHBondContact O-N 2.82Å
365	L	92	Very high	76.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-45.1	174.1	-59.7	174.8	0	0	0	111.6	I280 D282 C307 V310 V361 T362 L363 M368 Y369 L385	I280-L365 HydrophobicContact CG2-CB 4.41Å; I280-L365 HydrophobicContact CG2-CD2 3.72Å; D282-L365 HydrophobicContact CB-CD1 3.82Å; C307-L365 HydrophobicContact CB-CD2 4.28Å; V310-L365 HydrophobicContact CG2-CD2 3.82Å; V361-L365 WeakPolarHBondContact O-CG 3.22Å; V361-L365 PolarHBondContact O-N 3.47Å; V361-L365 VanDerWaalsContact O-N 3.11Å; T362-L365 PolarHBondContact O-N 3.34Å; L363-L365 VanDerWaalsContact C-N 3.33Å; L365-M368 WeakPolarHBondContact O-CB 3.4Å; L365-M368 PolarHBondContact O-N 3.43Å; L365-Y369 PolarHBondContact O-N 3.02Å; L365-L385 HydrophobicContact CB-CD1 3.86Å
366	V	91.6	Very high	77.2	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-43.7	177.7	172.4	0	0	0	0	111.3	T362 L363 M368 Y369 E370 I399 Q402 A403 V408 I411	T362-V366 WeakPolarHBondContact O-CG2 3.34Å; T362-V366 PolarHBondContact O-N 3.24Å; T362-V366 VanDerWaalsContact O-N 3.12Å; L363-V366 PolarHBondContact O-N 2.91Å; V366-M368 VanDerWaalsContact C-N 3.31Å; V366-M368 PolarHBondContact O-N 3.26Å; V366-Y369 WeakPolarHBondContact O-CB 3.49Å; V366-Y369 PolarHBondContact O-N 3.29Å; V366-E370 PolarHBondContact O-N 2.97Å; V366-I399 HydrophobicContact CG2-CG2 3.95Å; V366-Q402 HydrophobicContact CG2-CB 4.14Å; V366-A403 HydrophobicContact CG1-CB 4.12Å; V366-V408 HydrophobicContact CG1-CB 4.44Å; V366-V408 HydrophobicContact CG1-CG2 3.88Å; V366-I411 HydrophobicContact CG2-CD1 4.15Å
367	R	88.7	Confident	78.1	Confident	60 Å²	60	54.9 Å²	54.9	23%	0.226	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-34.7	176	-72.5	-179.9	177.9	180	1.6	112.3	L363 E364 Y369 E370 L371 Y406	L363-R367 HydrophobicContact CD1-CG 4.35Å; L363-R367 WeakPolarHBondContact O-CG 3.41Å; L363-R367 PolarHBondContact O-N 3.23Å; E364-R367 PolarHBondContact O-N 3.31Å; R367-Y369 VanDerWaalsContact C-N 3.35Å; R367-E370 PolarHBondContact O-N 2.8Å; R367-L371 VanDerWaalsContact O-CB 3.29Å; R367-L371 WeakPolarHBondContact O-CB 3.43Å; R367-L371 PolarHBondContact O-N 2.91Å; R367-Y406 PolarHBondContact NH2-OH 2.83Å; R367-Y406 VanDerWaalsContact NH2-OH 3.09Å
368	M	88.8	Confident	79	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-64.9	-41.3	173.4	-175.2	60.5	67.9	0	0	111.2	I280 V305 C307 R345 T346 E364 L365 V366 E370 L371 L372	I280-M368 HydrophobicContact CD1-CB 4.1Å; I280-M368 HydrophobicContact CD1-CG 3.86Å; I280-M368 HydrophobicContact CG1-CG 4.19Å; V305-M368 HydrophobicContact CG1-CG 3.88Å; V305-M368 HydrophobicContact CG1-SD 4.01Å; C307-M368 VanDerWaalsContact SG-CB 3.59Å; R345-M368 HydrophobicContact CB-CE 3.51Å; R345-M368 HydrophobicContact CB-SD 4.31Å; T346-M368 VanDerWaalsContact C-CE 3.45Å; T346-M368 WeakPolarHBondContact O-CE 3.28Å; E364-M368 WeakPolarHBondContact O-CB 3.5Å; E364-M368 PolarHBondContact O-N 2.82Å; L365-M368 WeakPolarHBondContact O-CB 3.4Å; L365-M368 PolarHBondContact O-N 3.43Å; V366-M368 VanDerWaalsContact C-N 3.31Å; V366-M368 PolarHBondContact O-N 3.26Å; M368-E370 PolarHBondContact O-N 3.19Å; M368-L371 HydrophobicContact CE-CD2 4.49Å; M368-L371 WeakPolarHBondContact O-CB 3.49Å; M368-L371 PolarHBondContact O-N 3.34Å; M368-L371 HydrophobicContact SD-CD2 3.86Å; M368-L372 HydrophobicContact CG-CD1 4.18Å; M368-L372 HydrophobicContact CG-CG 4.45Å; M368-L372 WeakPolarHBondContact O-CG 3.37Å; M368-L372 PolarHBondContact O-N 3.24Å; M368-L372 HydrophobicContact SD-CD1 4.4Å; M368-L372 HydrophobicContact SD-CG 4.22Å
369	Y	91.1	Very high	79.1	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.047	25%	0.245	C	C	.	.	H	α-helix	trans	-57.1	-51.2	174.7	-170	-84.1	0	0	0	111.2	I280 L365 V366 R367 L371 L372 I373 V383 L385 V408 D410 I411 D412	I280-Y369 HydrophobicContact CD1-CD2 4.09Å; I280-Y369 HydrophobicContact CD1-CG 4.38Å; I280-Y369 VanDerWaalsContact CD1-N 3.34Å; L365-Y369 PolarHBondContact O-N 3.02Å; V366-Y369 WeakPolarHBondContact O-CB 3.49Å; V366-Y369 PolarHBondContact O-N 3.29Å; R367-Y369 VanDerWaalsContact C-N 3.35Å; Y369-L371 VanDerWaalsContact C-N 3.32Å; Y369-L371 PolarHBondContact O-N 3.48Å; Y369-L372 PolarHBondContact O-N 3.05Å; Y369-I373 HydrophobicContact CD1-CD1 3.66Å; Y369-I373 HydrophobicContact CE1-CD1 3.12Å; Y369-I373 HydrophobicContact CE1-CG1 4.29Å; Y369-I373 WeakPolarHBondContact O-CG1 3.26Å; Y369-I373 PolarHBondContact O-N 3.2Å; Y369-V383 HydrophobicContact CD2-CB 4.12Å; Y369-V383 HydrophobicContact CD2-CG1 3.49Å; Y369-V383 VanDerWaalsContact CD2-CG1 3.49Å; Y369-V383 HydrophobicContact CE2-CB 3.82Å; Y369-V383 HydrophobicContact CE2-CG1 3.69Å; Y369-V383 WeakPolarHBondContact CE2-O 3.46Å; Y369-V383 HydrophobicContact CG-CG1 4.13Å; Y369-V383 PolarHBondContact OH-O 3.09Å; Y369-V383 VanDerWaalsContact OH-O 3.09Å; Y369-L385 HydrophobicContact CD2-CB 4.44Å; Y369-V408 HydrophobicContact CD1-CG1 3.52Å; Y369-V408 HydrophobicContact CE1-CG1 4.02Å; Y369-D410 PolarHBondContact OH-O 2.98Å; Y369-I411 HydrophobicContact CD1-CB 4.48Å; Y369-I411 HydrophobicContact CD1-CD1 4.48Å; Y369-I411 HydrophobicContact CD1-CG1 3.97Å; Y369-I411 HydrophobicContact CD2-CD1 4.44Å; Y369-I411 HydrophobicContact CD2-CG1 3.9Å; Y369-I411 HydrophobicContact CE1-CB 4.18Å; Y369-I411 HydrophobicContact CE1-CG1 3.97Å; Y369-I411 HydrophobicContact CE2-CG1 3.95Å; Y369-I411 HydrophobicContact CG-CD1 4.23Å; Y369-I411 HydrophobicContact CG-CG1 3.94Å; Y369-D412 PolarHBondContact OH-N 3.03Å; Y369-D412 VanDerWaalsContact OH-N 3.14Å
370	E	87.6	Confident	78.8	Confident	50 Å²	50	51.7 Å²	51.7	23%	0.234	27%	0.27	C	S	.	.	H	α-helix	trans	-58.3	-43.8	175.7	-170.6	-172.8	-167.3	0	0	112.3	V366 R367 M368 L372 I373 K374 V408	V366-E370 PolarHBondContact O-N 2.97Å; R367-E370 PolarHBondContact O-N 2.8Å; M368-E370 PolarHBondContact O-N 3.19Å; E370-L372 PolarHBondContact O-N 3.32Å; E370-I373 PolarHBondContact O-N 2.86Å; E370-K374 HydrophobicContact CG-CD 3.7Å; E370-K374 HydrophobicContact CG-CG 4.23Å; E370-K374 WeakPolarHBondContact O-CB 3.26Å; E370-K374 PolarHBondContact O-N 2.99Å; E370-K374 WeakPolarHBondContact OE1-CE 3.5Å; E370-K374 IonicContact OE1-NZ 3.93Å; E370-K374 PolarHBondContact OE1-NZ 2.8Å; E370-V408 HydrophobicContact CB-CG2 3.82Å; E370-V408 HydrophobicContact CG-CG2 4.13Å
371	L	84.3	Confident	78.3	Confident	29 Å²	29	51.1 Å²	51.1	15%	0.152	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-47.6	-179.5	-173.5	77.9	0	0	0	111.7	R367 M368 Y369 I373 K374 K375	R367-L371 VanDerWaalsContact O-CB 3.29Å; R367-L371 WeakPolarHBondContact O-CB 3.43Å; R367-L371 PolarHBondContact O-N 2.91Å; M368-L371 HydrophobicContact CE-CD2 4.49Å; M368-L371 WeakPolarHBondContact O-CB 3.49Å; M368-L371 PolarHBondContact O-N 3.34Å; M368-L371 HydrophobicContact SD-CD2 3.86Å; Y369-L371 VanDerWaalsContact C-N 3.32Å; Y369-L371 PolarHBondContact O-N 3.48Å; L371-I373 VanDerWaalsContact C-N 3.31Å; L371-I373 PolarHBondContact O-N 3.48Å; L371-K374 PolarHBondContact O-N 3.36Å; L371-K375 HydrophobicContact CD1-CD 3.35Å; L371-K375 HydrophobicContact CD1-CG 3.87Å; L371-K375 VanDerWaalsContact CD1-NZ 3.3Å; L371-K375 HydrophobicContact CG-CD 4.35Å; L371-K375 WeakPolarHBondContact O-CB 3.35Å; L371-K375 PolarHBondContact O-N 2.99Å
372	L	83.8	Confident	78.2	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-70.4	-28.1	-176.7	-67.9	176.6	0	0	0	112.6	F278 I280 V305 M368 Y369 E370 Y378 V383	F278-L372 HydrophobicContact CB-CD1 3.84Å; F278-L372 HydrophobicContact CD1-CD1 4.42Å; F278-L372 HydrophobicContact CD2-CB 4.44Å; F278-L372 HydrophobicContact CD2-CD1 4.32Å; F278-L372 HydrophobicContact CD2-CD2 4.39Å; F278-L372 HydrophobicContact CE2-CD2 4.36Å; F278-L372 HydrophobicContact CG-CD1 3.97Å; F278-L372 HydrophobicContact CG-CD2 4.48Å; I280-L372 HydrophobicContact CD1-CD1 4Å; I280-L372 HydrophobicContact CG1-CD1 3.97Å; V305-L372 HydrophobicContact CB-CD1 4.44Å; V305-L372 HydrophobicContact CG1-CD1 4.34Å; V305-L372 HydrophobicContact CG2-CD1 3.93Å; M368-L372 HydrophobicContact CG-CD1 4.18Å; M368-L372 HydrophobicContact CG-CG 4.45Å; M368-L372 WeakPolarHBondContact O-CG 3.37Å; M368-L372 PolarHBondContact O-N 3.24Å; M368-L372 HydrophobicContact SD-CD1 4.4Å; M368-L372 HydrophobicContact SD-CG 4.22Å; Y369-L372 PolarHBondContact O-N 3.05Å; E370-L372 PolarHBondContact O-N 3.32Å; L372-Y378 HydrophobicContact CD2-CD2 4.3Å; L372-Y378 HydrophobicContact CD2-CE2 4.25Å; L372-V383 HydrophobicContact CB-CG1 4.31Å; L372-V383 HydrophobicContact CB-CG2 3.72Å; L372-V383 HydrophobicContact CD1-CG1 4.11Å
373	I	83.8	Confident	78.2	Confident	75 Å²	75	54.3 Å²	54.3	39%	0.385	28%	0.278	S	S	.	.	H	α-helix	trans	-78.2	-46.7	173.6	-67.4	-178.9	0	0	0	111.4	Y369 E370 L371 V383	Y369-I373 HydrophobicContact CD1-CD1 3.66Å; Y369-I373 HydrophobicContact CE1-CD1 3.12Å; Y369-I373 HydrophobicContact CE1-CG1 4.29Å; Y369-I373 WeakPolarHBondContact O-CG1 3.26Å; Y369-I373 PolarHBondContact O-N 3.2Å; E370-I373 PolarHBondContact O-N 2.86Å; L371-I373 VanDerWaalsContact C-N 3.31Å; L371-I373 PolarHBondContact O-N 3.48Å; I373-V383 HydrophobicContact CG1-CB 4.21Å; I373-V383 HydrophobicContact CG1-CG2 3.76Å
374	K	77.2	Confident	78.4	Confident	127 Å²	127	53 Å²	53	55%	0.552	27%	0.271	S	S	*	.	H	α-helix	trans	-88.4	-31.4	-167.6	-66.9	-172.5	-175.7	172.2	0	114.5	E370 L371	E370-K374 HydrophobicContact CG-CD 3.7Å; E370-K374 HydrophobicContact CG-CG 4.23Å; E370-K374 WeakPolarHBondContact O-CB 3.26Å; E370-K374 PolarHBondContact O-N 2.99Å; E370-K374 WeakPolarHBondContact OE1-CE 3.5Å; E370-K374 IonicContact OE1-NZ 3.93Å; E370-K374 PolarHBondContact OE1-NZ 2.8Å; L371-K374 PolarHBondContact O-N 3.36Å
375	K	66.9	Low	78.8	Confident	96 Å²	96	52.7 Å²	52.7	42%	0.417	27%	0.27	S	S	.	.	S	Bend	trans	-91.8	126.8	-172	-73	-160.5	-170.8	163.8	0	112.7	L371 Y378	L371-K375 HydrophobicContact CD1-CD 3.35Å; L371-K375 HydrophobicContact CD1-CG 3.87Å; L371-K375 VanDerWaalsContact CD1-NZ 3.3Å; L371-K375 HydrophobicContact CG-CD 4.35Å; L371-K375 WeakPolarHBondContact O-CB 3.35Å; L371-K375 PolarHBondContact O-N 2.99Å; K375-Y378 WeakPolarHBondContact O-CB 3.5Å; K375-Y378 PolarHBondContact O-N 3.17Å
376	P	54.2	Low	78.9	Confident	110 Å²	110	52.7 Å²	52.7	71%	0.714	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	145.3	163.2	-21	31.3	0	0	0	110.8	Y378	P376-Y378 VanDerWaalsContact CA-N 3.32Å
377	P	55.4	Low	79	Confident	98 Å²	98	52.8 Å²	52.8	64%	0.636	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	cis	-92.4	22.7	21.7	36.6	-36	0	0	0	114.7	P379	P377-P379 WeakPolarHBondContact O-CD 3.34Å
378	Y	61.7	Low	79.1	Confident	39 Å²	39	52.2 Å²	52.2	15%	0.153	27%	0.272	C	S	.	.			trans	-106.6	35.2	-161.6	-64.2	-34.1	0	0	0	117.9	F278 L372 K375 P376 M380 H381	F278-Y378 HydrophobicContact CE2-CD1 4.19Å; F278-Y378 HydrophobicContact CE2-CE1 4.44Å; F278-Y378 HydrophobicContact CE2-CG 4.28Å; F278-Y378 HydrophobicContact CZ-CD1 4.04Å; F278-Y378 AromaticContact CZ-CE1 3.84Å; F278-Y378 HydrophobicContact CZ-CE1 3.84Å; F278-Y378 HydrophobicContact CZ-CG 4.44Å; L372-Y378 HydrophobicContact CD2-CD2 4.3Å; L372-Y378 HydrophobicContact CD2-CE2 4.25Å; K375-Y378 WeakPolarHBondContact O-CB 3.5Å; K375-Y378 PolarHBondContact O-N 3.17Å; P376-Y378 VanDerWaalsContact CA-N 3.32Å; Y378-M380 PolarHBondContact O-N 3.18Å; Y378-H381 WeakPolarHBondContact CA-CD2 3.32Å; Y378-H381 WeakPolarHBondContact CB-CD2 3.48Å; Y378-H381 AromaticContact CD1-CD2 3.22Å; Y378-H381 WeakPolarHBondContact CD1-CD2 3.32Å; Y378-H381 AromaticContact CD1-NE2 3.24Å; Y378-H381 WeakPolarHBondContact CD1-NE2 3.24Å; Y378-H381 AromaticContact CG-CD2 3.5Å; Y378-H381 PolarHBondContact O-N 2.99Å
379	P	52.3	Low	79.2	Confident	100 Å²	100	53.4 Å²	53.4	65%	0.649	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-0.7	-167.6	32	-36.6	0	0	0	115.8	P377	P377-P379 WeakPolarHBondContact O-CD 3.34Å
380	M	58.2	Low	78.9	Confident	165 Å²	165	56.1 Å²	56.1	81%	0.813	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.4	23.3	-174.8	-65.7	-69.1	167.2	0	0	112.6	Y378	Y378-M380 PolarHBondContact O-N 3.18Å
381	H	69.8	Low	78.7	Confident	44 Å²	44	57.9 Å²	57.9	20%	0.204	31%	0.314	C	S	.	.			trans	-93.9	135.8	-174.2	-66.2	-46	0	0	0	113.1	T276 F278 Y378	T276-H381 WeakPolarHBondContact CA-ND1 3.41Å; T276-H381 VanDerWaalsContact O-CA 3.23Å; T276-H381 WeakPolarHBondContact O-CA 3.42Å; T276-H381 WeakPolarHBondContact O-CB 3.48Å; T276-H381 PolarHBondContact O-ND1 3.24Å; F278-H381 HydrophobicContact CD2-CB 3.7Å; F278-H381 HydrophobicContact CE2-CB 3.61Å; F278-H381 AromaticContact CE2-CD2 3.35Å; F278-H381 WeakPolarHBondContact CE2-CD2 3.32Å; F278-H381 AromaticContact CE2-CG 3.48Å; F278-H381 VanDerWaalsContact CE2-CG 3.48Å; Y378-H381 WeakPolarHBondContact CA-CD2 3.32Å; Y378-H381 WeakPolarHBondContact CB-CD2 3.48Å; Y378-H381 AromaticContact CD1-CD2 3.22Å; Y378-H381 WeakPolarHBondContact CD1-CD2 3.32Å; Y378-H381 AromaticContact CD1-NE2 3.24Å; Y378-H381 WeakPolarHBondContact CD1-NE2 3.24Å; Y378-H381 AromaticContact CG-CD2 3.5Å; Y378-H381 PolarHBondContact O-N 2.99Å
382	H	86.2	Confident	78.8	Confident	93 Å²	93	62.5 Å²	62.5	43%	0.431	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.8	170.5	-173.6	-113.2	0	0	0	107.9	T276 T277 F278 V384 D412	T276-H382 PolarHBondContact O-N 2.87Å; T276-H382 VanDerWaalsContact O-N 3.1Å; T277-H382 CarbonylContact C-O 3.55Å; T277-H382 VanDerWaalsContact CA-O 3.27Å; T277-H382 WeakPolarHBondContact CA-O 3.15Å; T277-H382 HydrophobicContact CG2-CB 4.17Å; F278-H382 PolarHBondContact N-O 3.26Å; H382-V384 WeakPolarHBondContact CE1-CG2 3.28Å; H382-D412 IonicContact CE1-OD2 2.82Å; H382-D412 IonicContact NE2-OD2 3.84Å
383	V	91.1	Very high	79	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.018	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.1	-178.4	-170.8	0	0	0	0	108.3	F278 I280 Y369 L372 I373	F278-V383 HydrophobicContact CB-CG1 4.38Å; F278-V383 HydrophobicContact CB-CG2 4.42Å; F278-V383 HydrophobicContact CD2-CG2 4.34Å; F278-V383 WeakPolarHBondContact O-CA 3.4Å; I280-V383 HydrophobicContact CD1-CG1 3.66Å; I280-V383 HydrophobicContact CG1-CG1 4.09Å; Y369-V383 HydrophobicContact CD2-CB 4.12Å; Y369-V383 HydrophobicContact CD2-CG1 3.49Å; Y369-V383 VanDerWaalsContact CD2-CG1 3.49Å; Y369-V383 HydrophobicContact CE2-CB 3.82Å; Y369-V383 HydrophobicContact CE2-CG1 3.69Å; Y369-V383 WeakPolarHBondContact CE2-O 3.46Å; Y369-V383 HydrophobicContact CG-CG1 4.13Å; Y369-V383 PolarHBondContact OH-O 3.09Å; Y369-V383 VanDerWaalsContact OH-O 3.09Å; L372-V383 HydrophobicContact CB-CG1 4.31Å; L372-V383 HydrophobicContact CB-CG2 3.72Å; L372-V383 HydrophobicContact CD1-CG1 4.11Å; I373-V383 HydrophobicContact CG1-CB 4.21Å; I373-V383 HydrophobicContact CG1-CG2 3.76Å
384	V	94	Very high	79.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.9	177	-173.6	0	0	0	0	108.4	F278 L279 I280 H382 L386 D412 R414	F278-V384 PolarHBondContact O-N 3.29Å; L279-V384 CarbonylContact C-O 3.57Å; L279-V384 WeakPolarHBondContact CA-O 3.31Å; L279-V384 HydrophobicContact CD2-CB 3.93Å; L279-V384 HydrophobicContact CD2-CG2 4.31Å; I280-V384 PolarHBondContact N-O 3.31Å; H382-V384 WeakPolarHBondContact CE1-CG2 3.28Å; V384-L386 HydrophobicContact CG1-CD2 3.79Å; V384-L386 HydrophobicContact CG1-CG 4.47Å; V384-D412 WeakPolarHBondContact CA-O 3.49Å; V384-R414 HydrophobicContact CG1-CB 4.19Å; V384-R414 HydrophobicContact CG1-CG 3.93Å
385	L	95.4	Very high	79.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	111.8	170	-166.9	161.9	0	0	0	108.5	I280 L365 Y369 T387 I399 I411 D412 V413 R414	I280-L385 HydrophobicContact CG2-CG 4.49Å; I280-L385 CarbonylContact O-C 3.56Å; I280-L385 WeakPolarHBondContact O-CA 3.28Å; L365-L385 HydrophobicContact CB-CD1 3.86Å; Y369-L385 HydrophobicContact CD2-CB 4.44Å; L385-T387 HydrophobicContact CD2-CG2 4.29Å; L385-I399 HydrophobicContact CD1-CG2 4.08Å; L385-I399 HydrophobicContact CD2-CD1 4.17Å; L385-I411 HydrophobicContact CD1-CD1 4.19Å; L385-D412 PolarHBondContact N-O 3.45Å; L385-V413 HydrophobicContact CB-CG2 4.26Å; L385-V413 HydrophobicContact CD2-CG1 4.04Å; L385-V413 CarbonylContact O-C 3.6Å; L385-V413 WeakPolarHBondContact O-CA 3.36Å; L385-R414 PolarHBondContact O-N 3.34Å
386	L	95.5	Very high	81	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.1	176.4	-62.7	-174	0	0	0	110.2	L279 I280 V281 D282 S285 M293 L296 V384 R414 V416 F419	L279-L386 HydrophobicContact CB-CD1 3.98Å; L279-L386 HydrophobicContact CB-CG 4.39Å; L279-L386 HydrophobicContact CD1-CD1 3.97Å; L279-L386 HydrophobicContact CD2-CD1 4.23Å; L279-L386 HydrophobicContact CD2-CG 4.45Å; L279-L386 HydrophobicContact CG-CD1 4.28Å; I280-L386 PolarHBondContact O-N 3.39Å; V281-L386 HydrophobicContact CG1-CB 4.23Å; V281-L386 HydrophobicContact CG1-CD1 4.46Å; D282-L386 PolarHBondContact N-O 3.41Å; S285-L386 PolarHBondContact OG-O 3.42Å; M293-L386 HydrophobicContact CE-CD1 4.3Å; L296-L386 HydrophobicContact CD1-CD1 4.44Å; V384-L386 HydrophobicContact CG1-CD2 3.79Å; V384-L386 HydrophobicContact CG1-CG 4.47Å; L386-R414 WeakPolarHBondContact CA-O 3.25Å; L386-R414 HydrophobicContact CD2-CB 4.14Å; L386-V416 HydrophobicContact CB-CG2 4.25Å; L386-F419 HydrophobicContact CD1-CD1 4.11Å; L386-F419 HydrophobicContact CD1-CE1 4.45Å; L386-F419 HydrophobicContact CD2-CB 3.78Å; L386-F419 HydrophobicContact CD2-CD1 4.02Å; L386-F419 HydrophobicContact CD2-CD2 4.14Å; L386-F419 HydrophobicContact CD2-CG 3.7Å
387	T	93.6	Very high	82.8	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	147.3	-179.8	179.7	0	0	0	0	111.5	D282 S285 L385 Y389 F396 V413 R414 N415 V416	D282-T387 WeakPolarHBondContact OD2-CA 3.04Å; D282-T387 WeakPolarHBondContact OD2-CB 3.19Å; D282-T387 PolarHBondContact OD2-OG1 3.07Å; S285-T387 VanDerWaalsContact OG-CA 3.24Å; S285-T387 WeakPolarHBondContact OG-CA 3.07Å; L385-T387 HydrophobicContact CD2-CG2 4.29Å; T387-Y389 WeakPolarHBondContact OG1-CB 3.1Å; T387-Y389 WeakPolarHBondContact OG1-CD2 3.46Å; T387-Y389 PolarHBondContact OG1-N 2.94Å; T387-F396 HydrophobicContact CG2-CD2 4.16Å; T387-F396 HydrophobicContact CG2-CE2 4.29Å; T387-V413 HydrophobicContact CG2-CG1 3.48Å; T387-V413 VanDerWaalsContact CG2-CG1 3.48Å; T387-R414 PolarHBondContact N-O 2.82Å; T387-N415 VanDerWaalsContact O-CA 3.28Å; T387-N415 WeakPolarHBondContact O-CA 2.98Å; T387-V416 PolarHBondContact O-N 2.81Å
388	D	90.9	Very high	84.5	Confident	49 Å²	49	60.8 Å²	60.8	26%	0.262	31%	0.309	S	S	.	.			trans	-104.3	13.2	168.1	-142.1	28.7	0	0	0	111.8	L284 S285 S288 S390 N415 V416	L284-D388 HydrophobicContact CB-CB 4.42Å; S285-D388 PolarHBondContact OG-N 2.9Å; S288-D388 PolarHBondContact OG-OD2 3.16Å; D388-S390 PolarHBondContact O-N 2.84Å; D388-N415 PolarHBondContact OD1-ND2 2.72Å; D388-V416 HydrophobicContact CB-CG2 4.41Å
389	Y	89.3	Confident	86	Confident	25 Å²	25	59 Å²	59	10%	0.098	30%	0.302	C	S	.	.			trans	-60.8	133.3	168.8	-69.8	-54.9	0	0	0	110.1	D282 L284 T387 E395 I399	D282-Y389 HydrophobicContact CB-CE2 4.42Å; D282-Y389 WeakPolarHBondContact OD2-CD2 3.4Å; D282-Y389 WeakPolarHBondContact OD2-CE2 3.3Å; L284-Y389 HydrophobicContact CD1-CD1 3.34Å; L284-Y389 HydrophobicContact CD1-CE1 3.24Å; L284-Y389 HydrophobicContact CD1-CG 4.22Å; L284-Y389 HydrophobicContact CG-CD1 4.47Å; L284-Y389 HydrophobicContact CG-CE1 4Å; T387-Y389 WeakPolarHBondContact OG1-CB 3.1Å; T387-Y389 WeakPolarHBondContact OG1-CD2 3.46Å; T387-Y389 PolarHBondContact OG1-N 2.94Å; Y389-E395 HydrophobicContact CD1-CB 3.66Å; Y389-E395 HydrophobicContact CD1-CG 4.07Å; Y389-E395 HydrophobicContact CD2-CB 3.79Å; Y389-E395 HydrophobicContact CE1-CB 3.47Å; Y389-E395 VanDerWaalsContact CE1-CB 3.47Å; Y389-E395 HydrophobicContact CE1-CG 3.51Å; Y389-E395 HydrophobicContact CE2-CB 3.65Å; Y389-E395 HydrophobicContact CE2-CG 4.37Å; Y389-E395 HydrophobicContact CG-CB 3.87Å; Y389-I399 HydrophobicContact CD2-CD1 4.19Å; Y389-I399 HydrophobicContact CE2-CD1 4.4Å
390	S	85.4	Confident	87.9	Confident	70 Å²	70	59 Å²	59	49%	0.49	29%	0.29	S	S	.	.			trans	-64.5	147.9	170.9	76.2	0	0	0	0	109.9	D388 N392 S393 F396	D388-S390 PolarHBondContact O-N 2.84Å; S390-N392 PolarHBondContact O-N 3.31Å; S390-S393 WeakPolarHBondContact O-CB 3.19Å; S390-S393 PolarHBondContact O-N 3.22Å; S390-S393 PolarHBondContact OG-N 3.07Å; S390-F396 WeakPolarHBondContact O-CB 3.22Å
391	C	83.7	Confident	89.5	Confident	86 Å²	86	54 Å²	54	58%	0.581	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.6	176.3	57.9	0	0	0	0	114	F396	C391-F396 HydrophobicContact CB-CD1 4.5Å; C391-F396 HydrophobicContact CB-CE1 4.31Å
392	N	85.3	Confident	90.5	Very high	127 Å²	127	52.5 Å²	52.5	68%	0.679	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-7.7	177.2	-66.6	-33.1	0	0	0	113.8	S390 K397	S390-N392 PolarHBondContact O-N 3.31Å; N392-K397 WeakPolarHBondContact O-CE 3.07Å; N392-K397 PolarHBondContact O-NZ 2.89Å
393	S	89	Confident	90.8	Very high	19 Å²	19	48.2 Å²	48.2	13%	0.133	25%	0.248	C	C	.	.	S	Bend	trans	-71.7	149.4	-177.6	105.1	0	0	0	0	110.9	S390 E395 F396 K397	S390-S393 WeakPolarHBondContact O-CB 3.19Å; S390-S393 PolarHBondContact O-N 3.22Å; S390-S393 PolarHBondContact OG-N 3.07Å; S393-E395 VanDerWaalsContact C-N 3.26Å; S393-E395 VanDerWaalsContact CB-OE2 3.24Å; S393-E395 WeakPolarHBondContact CB-OE2 2.96Å; S393-E395 PolarHBondContact O-N 3.18Å; S393-E395 PolarHBondContact OG-N 3.38Å; S393-E395 PolarHBondContact OG-OE2 2.88Å; S393-F396 PolarHBondContact O-N 2.88Å; S393-F396 PolarHBondContact OG-N 3.37Å; S393-F396 VanDerWaalsContact OG-N 3.14Å; S393-K397 WeakPolarHBondContact O-CG 3.35Å; S393-K397 PolarHBondContact O-N 2.84Å
394	E	89.9	Confident	90.8	Very high	117 Å²	117	56.7 Å²	56.7	55%	0.547	29%	0.285	S	S	.	.	H	α-helix	trans	-67.6	-31.4	179.7	-68.4	-58.5	118	0	0	111.3	K397 R398	E394-K397 PolarHBondContact O-N 3.22Å; E394-K397 IonicContact OE1-NZ 2.77Å; E394-K397 PolarHBondContact OE1-NZ 3.23Å; E394-R398 WeakPolarHBondContact O-CB 3.33Å; E394-R398 PolarHBondContact O-N 3.34Å
395	E	89.3	Confident	90.6	Very high	77 Å²	77	63.3 Å²	63.3	36%	0.36	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-44.3	175.5	-55.5	81.1	-177.9	0	0	111.7	T362 Y389 S393 K397 R398 I399	T362-E395 HydrophobicContact CG2-CB 4.21Å; Y389-E395 HydrophobicContact CD1-CB 3.66Å; Y389-E395 HydrophobicContact CD1-CG 4.07Å; Y389-E395 HydrophobicContact CD2-CB 3.79Å; Y389-E395 HydrophobicContact CE1-CB 3.47Å; Y389-E395 VanDerWaalsContact CE1-CB 3.47Å; Y389-E395 HydrophobicContact CE1-CG 3.51Å; Y389-E395 HydrophobicContact CE2-CB 3.65Å; Y389-E395 HydrophobicContact CE2-CG 4.37Å; Y389-E395 HydrophobicContact CG-CB 3.87Å; S393-E395 VanDerWaalsContact C-N 3.26Å; S393-E395 VanDerWaalsContact CB-OE2 3.24Å; S393-E395 WeakPolarHBondContact CB-OE2 2.96Å; S393-E395 PolarHBondContact O-N 3.18Å; S393-E395 PolarHBondContact OG-N 3.38Å; S393-E395 PolarHBondContact OG-OE2 2.88Å; E395-K397 PolarHBondContact O-N 2.79Å; E395-R398 WeakPolarHBondContact O-CB 3.21Å; E395-R398 PolarHBondContact O-N 2.89Å; E395-R398 VanDerWaalsContact O-N 3.15Å; E395-I399 WeakPolarHBondContact O-CG1 3.25Å; E395-I399 PolarHBondContact O-N 3.43Å
396	F	90.1	Very high	90.1	Very high	41 Å²	41	66.9 Å²	66.9	18%	0.18	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-46.1	176.3	-172	-92.8	0	0	0	111.1	T387 S390 C391 S393 R398 I399 Y400 V413	T387-F396 HydrophobicContact CG2-CD2 4.16Å; T387-F396 HydrophobicContact CG2-CE2 4.29Å; S390-F396 WeakPolarHBondContact O-CB 3.22Å; C391-F396 HydrophobicContact CB-CD1 4.5Å; C391-F396 HydrophobicContact CB-CE1 4.31Å; S393-F396 PolarHBondContact O-N 2.88Å; S393-F396 PolarHBondContact OG-N 3.37Å; S393-F396 VanDerWaalsContact OG-N 3.14Å; F396-R398 VanDerWaalsContact C-N 3.29Å; F396-R398 PolarHBondContact O-N 3.21Å; F396-I399 PolarHBondContact O-N 2.99Å; F396-Y400 HydrophobicContact CD1-CD2 4.19Å; F396-Y400 HydrophobicContact CD1-CE2 4.14Å; F396-Y400 AromaticContact CE1-CD2 3.9Å; F396-Y400 HydrophobicContact CE1-CD2 3.9Å; F396-Y400 AromaticContact CE1-CE2 3.47Å; F396-Y400 HydrophobicContact CE1-CE2 3.47Å; F396-Y400 VanDerWaalsContact CE1-CE2 3.47Å; F396-Y400 HydrophobicContact CE2-CE2 4.09Å; F396-Y400 HydrophobicContact CZ-CD2 4.3Å; F396-Y400 AromaticContact CZ-CE2 3.46Å; F396-Y400 HydrophobicContact CZ-CE2 3.46Å; F396-Y400 VanDerWaalsContact CZ-CE2 3.46Å; F396-Y400 WeakPolarHBondContact O-CD2 3.35Å; F396-Y400 PolarHBondContact O-N 3.39Å; F396-V413 HydrophobicContact CD2-CG1 4.4Å; F396-V413 HydrophobicContact CE2-CG1 3.84Å
397	K	91.8	Very high	89.7	Confident	101 Å²	101	71 Å²	71	44%	0.439	36%	0.359	S	S	.	.	H	α-helix	trans	-62.5	-37.8	175.3	-64.8	174.3	-160.2	159.1	0	111.7	N392 S393 E394 E395 Y400 A401	N392-K397 WeakPolarHBondContact O-CE 3.07Å; N392-K397 PolarHBondContact O-NZ 2.89Å; S393-K397 WeakPolarHBondContact O-CG 3.35Å; S393-K397 PolarHBondContact O-N 2.84Å; E394-K397 PolarHBondContact O-N 3.22Å; E394-K397 IonicContact OE1-NZ 2.77Å; E394-K397 PolarHBondContact OE1-NZ 3.23Å; E395-K397 PolarHBondContact O-N 2.79Å; K397-Y400 PolarHBondContact O-N 3.16Å; K397-A401 WeakPolarHBondContact O-CB 3.18Å; K397-A401 PolarHBondContact O-N 2.87Å
398	R	92	Very high	89.3	Confident	120 Å²	120	71.5 Å²	71.5	45%	0.453	36%	0.362	S	S	.	.	H	α-helix	trans	-65.2	-40.7	179.5	-171.3	-179.9	-65.9	176.9	4.6	112.1	D360 T362 E394 E395 F396 Y400 A401 Q402	D360-R398 IonicContact OD2-NH1 3.91Å; T362-R398 WeakPolarHBondContact OG1-CD 3.11Å; E394-R398 WeakPolarHBondContact O-CB 3.33Å; E394-R398 PolarHBondContact O-N 3.34Å; E395-R398 WeakPolarHBondContact O-CB 3.21Å; E395-R398 PolarHBondContact O-N 2.89Å; E395-R398 VanDerWaalsContact O-N 3.15Å; F396-R398 VanDerWaalsContact C-N 3.29Å; F396-R398 PolarHBondContact O-N 3.21Å; R398-Y400 PolarHBondContact O-N 2.94Å; R398-A401 PolarHBondContact O-N 3.15Å; R398-Q402 HydrophobicContact CG-CG 4.2Å; R398-Q402 WeakPolarHBondContact O-CB 3.45Å; R398-Q402 VanDerWaalsContact O-CG 3.28Å; R398-Q402 WeakPolarHBondContact O-CG 3.4Å; R398-Q402 PolarHBondContact O-N 3.38Å
399	I	92.5	Very high	88.8	Confident	0 Å²	0	77 Å²	77	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-56.2	-49.7	175.1	-68.7	168.2	0	0	0	110.7	T362 V366 L385 Y389 E395 F396 Q402 A403 I411 V413	T362-I399 HydrophobicContact CG2-CD1 4.31Å; T362-I399 HydrophobicContact CG2-CG1 3.83Å; V366-I399 HydrophobicContact CG2-CG2 3.95Å; L385-I399 HydrophobicContact CD1-CG2 4.08Å; L385-I399 HydrophobicContact CD2-CD1 4.17Å; Y389-I399 HydrophobicContact CD2-CD1 4.19Å; Y389-I399 HydrophobicContact CE2-CD1 4.4Å; E395-I399 WeakPolarHBondContact O-CG1 3.25Å; E395-I399 PolarHBondContact O-N 3.43Å; F396-I399 PolarHBondContact O-N 2.99Å; I399-Q402 PolarHBondContact O-N 3.37Å; I399-A403 WeakPolarHBondContact O-CB 3.17Å; I399-A403 PolarHBondContact O-N 2.97Å; I399-I411 HydrophobicContact CG2-CD1 4Å; I399-V413 HydrophobicContact CG2-CG2 3.9Å
400	Y	92	Very high	88.4	Confident	102 Å²	102	83 Å²	83	40%	0.4	42%	0.42	S	S	.	.	H	α-helix	trans	-67.3	-38.6	178.3	-80.1	-81.3	0	0	0	113	F396 K397 R398 A403 K404 I411 V413	F396-Y400 HydrophobicContact CD1-CD2 4.19Å; F396-Y400 HydrophobicContact CD1-CE2 4.14Å; F396-Y400 AromaticContact CE1-CD2 3.9Å; F396-Y400 HydrophobicContact CE1-CD2 3.9Å; F396-Y400 AromaticContact CE1-CE2 3.47Å; F396-Y400 HydrophobicContact CE1-CE2 3.47Å; F396-Y400 VanDerWaalsContact CE1-CE2 3.47Å; F396-Y400 HydrophobicContact CE2-CE2 4.09Å; F396-Y400 HydrophobicContact CZ-CD2 4.3Å; F396-Y400 AromaticContact CZ-CE2 3.46Å; F396-Y400 HydrophobicContact CZ-CE2 3.46Å; F396-Y400 VanDerWaalsContact CZ-CE2 3.46Å; F396-Y400 WeakPolarHBondContact O-CD2 3.35Å; F396-Y400 PolarHBondContact O-N 3.39Å; K397-Y400 PolarHBondContact O-N 3.16Å; R398-Y400 PolarHBondContact O-N 2.94Å; Y400-A403 PolarHBondContact O-N 2.89Å; Y400-K404 WeakPolarHBondContact O-CB 3.3Å; Y400-K404 PolarHBondContact O-N 3.33Å; Y400-I411 HydrophobicContact CD1-CG2 4.1Å; Y400-I411 HydrophobicContact CE1-CG2 4Å; Y400-V413 HydrophobicContact CE2-CB 4.15Å; Y400-V413 HydrophobicContact CE2-CG2 4.16Å
401	A	91.9	Very high	88.6	Confident	59 Å²	59	80.6 Å²	80.6	49%	0.488	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-44.4	176.3	0	0	0	0	0	111.6	K397 R398 K404 E405	K397-A401 WeakPolarHBondContact O-CB 3.18Å; K397-A401 PolarHBondContact O-N 2.87Å; R398-A401 PolarHBondContact O-N 3.15Å; A401-K404 PolarHBondContact O-N 3.21Å; A401-E405 WeakPolarHBondContact O-CB 2.83Å; A401-E405 PolarHBondContact O-N 3.03Å
402	Q	92	Very high	89	Confident	12 Å²	12	78.1 Å²	78.1	6%	0.056	38%	0.382	C	S	.	.	H	α-helix	trans	-67.8	-41.8	176.5	-72.8	168.9	-18.7	0	0	111.7	D360 T362 L363 V366 R398 I399 K404 E405 Y406	D360-Q402 VanDerWaalsContact CG-NE2 3.31Å; D360-Q402 PolarHBondContact OD1-NE2 2.92Å; D360-Q402 PolarHBondContact OD2-NE2 3.34Å; T362-Q402 PolarHBondContact O-OE1 2.86Å; T362-Q402 PolarHBondContact OG1-NE2 2.75Å; T362-Q402 PolarHBondContact OG1-OE1 3.29Å; L363-Q402 VanDerWaalsContact CA-OE1 3.28Å; L363-Q402 HydrophobicContact CD1-CB 4.35Å; L363-Q402 HydrophobicContact CD1-CG 4.3Å; V366-Q402 HydrophobicContact CG2-CB 4.14Å; R398-Q402 HydrophobicContact CG-CG 4.2Å; R398-Q402 WeakPolarHBondContact O-CB 3.45Å; R398-Q402 VanDerWaalsContact O-CG 3.28Å; R398-Q402 WeakPolarHBondContact O-CG 3.4Å; R398-Q402 PolarHBondContact O-N 3.38Å; I399-Q402 PolarHBondContact O-N 3.37Å; Q402-K404 VanDerWaalsContact C-N 3.25Å; Q402-K404 PolarHBondContact O-N 2.88Å; Q402-E405 PolarHBondContact O-N 3.24Å; Q402-Y406 WeakPolarHBondContact O-CB 3.42Å; Q402-Y406 VanDerWaalsContact O-CD2 3.29Å; Q402-Y406 WeakPolarHBondContact O-CD2 3.21Å; Q402-Y406 PolarHBondContact O-N 3.5Å
403	A	91.3	Very high	89.4	Confident	3 Å²	3	72.8 Å²	72.8	3%	0.025	35%	0.354	C	S	.	.	H	α-helix	trans	-57.5	-42.1	175	0	0	0	0	0	111.4	V366 I399 Y400 S407 V408 I411	V366-A403 HydrophobicContact CG1-CB 4.12Å; I399-A403 WeakPolarHBondContact O-CB 3.17Å; I399-A403 PolarHBondContact O-N 2.97Å; Y400-A403 PolarHBondContact O-N 2.89Å; A403-S407 PolarHBondContact O-N 3.38Å; A403-S407 VanDerWaalsContact O-N 3.16Å; A403-V408 HydrophobicContact CB-CB 4.21Å; A403-V408 PolarHBondContact O-N 3.18Å; A403-I411 HydrophobicContact CB-CB 4.25Å; A403-I411 HydrophobicContact CB-CD1 4.07Å; A403-I411 HydrophobicContact CB-CG2 3.75Å
404	K	91	Very high	89.6	Confident	182 Å²	182	75.4 Å²	75.4	79%	0.791	36%	0.361	S	S	*	.	H	α-helix	trans	-66.3	-43.3	175	-172.5	178.2	-178.9	179.8	0	112.7	Y400 A401 Q402 Y406 S407	Y400-K404 WeakPolarHBondContact O-CB 3.3Å; Y400-K404 PolarHBondContact O-N 3.33Å; A401-K404 PolarHBondContact O-N 3.21Å; Q402-K404 VanDerWaalsContact C-N 3.25Å; Q402-K404 PolarHBondContact O-N 2.88Å; K404-Y406 VanDerWaalsContact C-N 3.34Å; K404-S407 PolarHBondContact O-N 3.39Å
405	E	89.9	Confident	89.8	Confident	139 Å²	139	72.2 Å²	72.2	65%	0.65	35%	0.348	S	S	*	.	H	α-helix	trans	-62.1	-41.4	178.4	-175.6	-178	171	0	0	111.9	A401 Q402 S407	A401-E405 WeakPolarHBondContact O-CB 2.83Å; A401-E405 PolarHBondContact O-N 3.03Å; Q402-E405 PolarHBondContact O-N 3.24Å; E405-S407 VanDerWaalsContact C-N 3.35Å
406	Y	85.9	Confident	90	Very high	75 Å²	75	68.5 Å²	68.5	29%	0.294	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	11.8	-177.3	-72.7	-93.5	0	0	0	113.8	L363 R367 Q402 K404 V408	L363-Y406 HydrophobicContact CD1-CD2 3.74Å; L363-Y406 HydrophobicContact CD1-CE1 4.39Å; L363-Y406 HydrophobicContact CD1-CE2 3.32Å; L363-Y406 HydrophobicContact CD1-CG 4.45Å; R367-Y406 PolarHBondContact NH2-OH 2.83Å; R367-Y406 VanDerWaalsContact NH2-OH 3.09Å; Q402-Y406 WeakPolarHBondContact O-CB 3.42Å; Q402-Y406 VanDerWaalsContact O-CD2 3.29Å; Q402-Y406 WeakPolarHBondContact O-CD2 3.21Å; Q402-Y406 PolarHBondContact O-N 3.5Å; K404-Y406 VanDerWaalsContact C-N 3.34Å; Y406-V408 VanDerWaalsContact C-N 3.25Å; Y406-V408 PolarHBondContact O-N 3.27Å
407	S	86.3	Confident	90	Very high	86 Å²	86	67.5 Å²	67.5	60%	0.601	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	39.9	177.8	-52.8	0	0	0	0	113.5	A403 K404 E405 E409	A403-S407 PolarHBondContact O-N 3.38Å; A403-S407 VanDerWaalsContact O-N 3.16Å; K404-S407 PolarHBondContact O-N 3.39Å; E405-S407 VanDerWaalsContact C-N 3.35Å; S407-E409 PolarHBondContact O-N 2.96Å
408	V	86.4	Confident	90	Very high	12 Å²	12	68.2 Å²	68.2	7%	0.073	34%	0.34	C	S	.	.			trans	-89	93.6	169.8	-174.1	0	0	0	0	107.2	V366 Y369 E370 A403 Y406 I411	V366-V408 HydrophobicContact CG1-CB 4.44Å; V366-V408 HydrophobicContact CG1-CG2 3.88Å; Y369-V408 HydrophobicContact CD1-CG1 3.52Å; Y369-V408 HydrophobicContact CE1-CG1 4.02Å; E370-V408 HydrophobicContact CB-CG2 3.82Å; E370-V408 HydrophobicContact CG-CG2 4.13Å; A403-V408 HydrophobicContact CB-CB 4.21Å; A403-V408 PolarHBondContact O-N 3.18Å; Y406-V408 VanDerWaalsContact C-N 3.25Å; Y406-V408 PolarHBondContact O-N 3.27Å; V408-I411 HydrophobicContact CG1-CB 4.49Å
409	E	78.9	Confident	90.1	Very high	163 Å²	163	63.3 Å²	63.3	76%	0.762	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	143.4	178.5	-64.2	-177.8	172.2	0	0	110.8	S407 I411	S407-E409 PolarHBondContact O-N 2.96Å; E409-I411 PolarHBondContact O-N 2.97Å
410	D	82	Confident	90.1	Very high	153 Å²	153	63.9 Å²	63.9	82%	0.818	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	44	172.5	-59.6	-30	0	0	0	116.1	Y369 D412	Y369-D410 PolarHBondContact OH-O 2.98Å; D410-D412 PolarHBondContact O-N 3.38Å; D410-D412 VanDerWaalsContact O-N 3.08Å
411	I	90.4	Very high	90	Very high	18 Å²	18	61.1 Å²	61.1	9%	0.092	32%	0.322	C	S	.	.			trans	-58.2	114.3	174.3	-166.5	172	0	0	0	111.5	V366 Y369 L385 I399 Y400 A403 V408 E409 V413	V366-I411 HydrophobicContact CG2-CD1 4.15Å; Y369-I411 HydrophobicContact CD1-CB 4.48Å; Y369-I411 HydrophobicContact CD1-CD1 4.48Å; Y369-I411 HydrophobicContact CD1-CG1 3.97Å; Y369-I411 HydrophobicContact CD2-CD1 4.44Å; Y369-I411 HydrophobicContact CD2-CG1 3.9Å; Y369-I411 HydrophobicContact CE1-CB 4.18Å; Y369-I411 HydrophobicContact CE1-CG1 3.97Å; Y369-I411 HydrophobicContact CE2-CG1 3.95Å; Y369-I411 HydrophobicContact CG-CD1 4.23Å; Y369-I411 HydrophobicContact CG-CG1 3.94Å; L385-I411 HydrophobicContact CD1-CD1 4.19Å; I399-I411 HydrophobicContact CG2-CD1 4Å; Y400-I411 HydrophobicContact CD1-CG2 4.1Å; Y400-I411 HydrophobicContact CE1-CG2 4Å; A403-I411 HydrophobicContact CB-CB 4.25Å; A403-I411 HydrophobicContact CB-CD1 4.07Å; A403-I411 HydrophobicContact CB-CG2 3.75Å; V408-I411 HydrophobicContact CG1-CB 4.49Å; E409-I411 PolarHBondContact O-N 2.97Å; I411-V413 HydrophobicContact CD1-CG2 4.06Å; I411-V413 HydrophobicContact CG1-CG2 3.85Å; I411-V413 HydrophobicContact CG2-CG2 4.15Å; I411-V413 PolarHBondContact O-N 2.48Å
412	D	92.2	Very high	90	Very high	35 Å²	35	61.7 Å²	61.7	19%	0.187	32%	0.315	C	S	.	.			trans	-82.5	93.2	175.7	-169.7	1.5	0	0	0	109.9	Y369 H382 V384 L385 D410 R414	Y369-D412 PolarHBondContact OH-N 3.03Å; Y369-D412 VanDerWaalsContact OH-N 3.14Å; H382-D412 IonicContact CE1-OD2 2.82Å; H382-D412 IonicContact NE2-OD2 3.84Å; V384-D412 WeakPolarHBondContact CA-O 3.49Å; L385-D412 PolarHBondContact N-O 3.45Å; D410-D412 PolarHBondContact O-N 3.38Å; D410-D412 VanDerWaalsContact O-N 3.08Å; D412-R414 WeakPolarHBondContact OD1-CG 3.32Å; D412-R414 IonicContact OD1-CZ 3.81Å; D412-R414 IonicContact OD1-NE 2.9Å; D412-R414 PolarHBondContact OD1-NE 2.82Å; D412-R414 IonicContact OD1-NH2 3.78Å; D412-R414 IonicContact OD2-CZ 3.43Å; D412-R414 IonicContact OD2-NE 3.08Å; D412-R414 PolarHBondContact OD2-NE 2.65Å; D412-R414 VanDerWaalsContact OD2-NE 3.08Å; D412-R414 IonicContact OD2-NH2 2.95Å; D412-R414 PolarHBondContact OD2-NH2 3.06Å
413	V	93.4	Very high	89.9	Confident	15 Å²	15	62.2 Å²	62.2	9%	0.091	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.2	174.9	-175.4	0	0	0	0	109.7	L385 T387 F396 I399 Y400 I411	L385-V413 HydrophobicContact CB-CG2 4.26Å; L385-V413 HydrophobicContact CD2-CG1 4.04Å; L385-V413 CarbonylContact O-C 3.6Å; L385-V413 WeakPolarHBondContact O-CA 3.36Å; T387-V413 HydrophobicContact CG2-CG1 3.48Å; T387-V413 VanDerWaalsContact CG2-CG1 3.48Å; F396-V413 HydrophobicContact CD2-CG1 4.4Å; F396-V413 HydrophobicContact CE2-CG1 3.84Å; I399-V413 HydrophobicContact CG2-CG2 3.9Å; Y400-V413 HydrophobicContact CE2-CB 4.15Å; Y400-V413 HydrophobicContact CE2-CG2 4.16Å; I411-V413 HydrophobicContact CD1-CG2 4.06Å; I411-V413 HydrophobicContact CG1-CG2 3.85Å; I411-V413 HydrophobicContact CG2-CG2 4.15Å; I411-V413 PolarHBondContact O-N 2.48Å
414	R	93.6	Very high	89.7	Confident	74 Å²	74	64.8 Å²	64.8	28%	0.279	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.9	-178.1	-60.5	-167.8	-175.5	-160.8	7.4	113.1	V384 L385 L386 T387 D412 F419 E422	V384-R414 HydrophobicContact CG1-CB 4.19Å; V384-R414 HydrophobicContact CG1-CG 3.93Å; L385-R414 PolarHBondContact O-N 3.34Å; L386-R414 WeakPolarHBondContact CA-O 3.25Å; L386-R414 HydrophobicContact CD2-CB 4.14Å; T387-R414 PolarHBondContact N-O 2.82Å; D412-R414 WeakPolarHBondContact OD1-CG 3.32Å; D412-R414 IonicContact OD1-CZ 3.81Å; D412-R414 IonicContact OD1-NE 2.9Å; D412-R414 PolarHBondContact OD1-NE 2.82Å; D412-R414 IonicContact OD1-NH2 3.78Å; D412-R414 IonicContact OD2-CZ 3.43Å; D412-R414 IonicContact OD2-NE 3.08Å; D412-R414 PolarHBondContact OD2-NE 2.65Å; D412-R414 VanDerWaalsContact OD2-NE 3.08Å; D412-R414 IonicContact OD2-NH2 2.95Å; D412-R414 PolarHBondContact OD2-NH2 3.06Å; R414-F419 HydrophobicContact CB-CB 4.41Å; R414-E422 IonicContact NH1-OE1 3.88Å; R414-E422 IonicContact NH1-OE2 3.14Å; R414-E422 PolarHBondContact NH1-OE2 2.88Å
415	N	93	Very high	89.4	Confident	49 Å²	49	63.7 Å²	63.7	26%	0.262	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	136.7	166.4	-177.3	-90.9	0	0	0	110.2	T387 D388 G417 D418 F419	T387-N415 VanDerWaalsContact O-CA 3.28Å; T387-N415 WeakPolarHBondContact O-CA 2.98Å; D388-N415 PolarHBondContact OD1-ND2 2.72Å; N415-G417 VanDerWaalsContact C-N 3.34Å; N415-G417 PolarHBondContact O-N 2.94Å; N415-G417 WeakPolarHBondContact OD1-CA 3.46Å; N415-G417 PolarHBondContact OD1-N 2.89Å; N415-D418 HydrophobicContact CB-CB 4.16Å; N415-D418 PolarHBondContact O-N 2.83Å; N415-D418 PolarHBondContact OD1-N 2.85Å; N415-F419 WeakPolarHBondContact O-CB 3.22Å; N415-F419 PolarHBondContact O-N 2.68Å
416	V	92.7	Very high	88.9	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-45.5	-179.2	-171.4	0	0	0	0	111.9	S285 K289 F292 M293 L386 T387 D388 Y420	S285-V416 WeakPolarHBondContact OG-CG2 3.23Å; K289-V416 HydrophobicContact CB-CG1 3.83Å; K289-V416 HydrophobicContact CG-CB 4.15Å; K289-V416 HydrophobicContact CG-CG1 3.98Å; F292-V416 HydrophobicContact CD2-CG1 4.17Å; M293-V416 HydrophobicContact CE-CB 4.44Å; M293-V416 HydrophobicContact CE-CG1 3.29Å; M293-V416 HydrophobicContact CE-CG2 4.25Å; L386-V416 HydrophobicContact CB-CG2 4.25Å; T387-V416 PolarHBondContact O-N 2.81Å; D388-V416 HydrophobicContact CB-CG2 4.41Å; V416-Y420 VanDerWaalsContact O-CB 3.23Å; V416-Y420 WeakPolarHBondContact O-CB 2.76Å; V416-Y420 PolarHBondContact O-N 2.84Å
417	G	90.5	Very high	87.7	Confident	20 Å²	20	65 Å²	65	21%	0.206	33%	0.331	C	S	.	.	H	α-helix	trans	-66	-41.6	-178.5	0	0	0	0	0	112.5	N415 Y420 A421	N415-G417 VanDerWaalsContact C-N 3.34Å; N415-G417 PolarHBondContact O-N 2.94Å; N415-G417 WeakPolarHBondContact OD1-CA 3.46Å; N415-G417 PolarHBondContact OD1-N 2.89Å; G417-Y420 PolarHBondContact O-N 3.38Å; G417-A421 WeakPolarHBondContact O-CB 2.95Å; G417-A421 PolarHBondContact O-N 3.33Å
418	D	92	Very high	85.7	Confident	116 Å²	116	70.8 Å²	70.8	62%	0.62	34%	0.341	S	S	*	.	H	α-helix	trans	-66.6	-45.6	178.1	-66.2	-24.9	0	0	0	111.6	N415 Y420 A421 E422	N415-D418 HydrophobicContact CB-CB 4.16Å; N415-D418 PolarHBondContact O-N 2.83Å; N415-D418 PolarHBondContact OD1-N 2.85Å; D418-Y420 VanDerWaalsContact C-N 3.33Å; D418-Y420 PolarHBondContact O-N 2.79Å; D418-A421 PolarHBondContact O-N 3.19Å; D418-E422 WeakPolarHBondContact O-CB 3.42Å; D418-E422 PolarHBondContact O-N 3.3Å
419	F	94	Very high	85.6	Confident	16 Å²	16	73.8 Å²	73.8	7%	0.07	36%	0.355	C	S	.	.	H	α-helix	trans	-59.6	-45.4	175.7	179.3	-94.2	0	0	0	111.4	L279 L296 F302 L386 R414 N415 E422 W423	L279-F419 HydrophobicContact CD1-CE1 3.88Å; L279-F419 HydrophobicContact CD1-CZ 4.24Å; L279-F419 HydrophobicContact CD2-CE1 4.01Å; L279-F419 HydrophobicContact CD2-CE2 4.23Å; L279-F419 HydrophobicContact CD2-CZ 3.63Å; L296-F419 HydrophobicContact CD1-CE1 4.47Å; L296-F419 HydrophobicContact CD2-CE1 4.05Å; F302-F419 HydrophobicContact CD1-CZ 4.38Å; F302-F419 HydrophobicContact CE1-CE1 4.43Å; F302-F419 AromaticContact CE1-CZ 3.82Å; F302-F419 HydrophobicContact CE1-CZ 3.82Å; F302-F419 HydrophobicContact CZ-CE1 4.34Å; F302-F419 HydrophobicContact CZ-CZ 4.04Å; L386-F419 HydrophobicContact CD1-CD1 4.11Å; L386-F419 HydrophobicContact CD1-CE1 4.45Å; L386-F419 HydrophobicContact CD2-CB 3.78Å; L386-F419 HydrophobicContact CD2-CD1 4.02Å; L386-F419 HydrophobicContact CD2-CD2 4.14Å; L386-F419 HydrophobicContact CD2-CG 3.7Å; R414-F419 HydrophobicContact CB-CB 4.41Å; N415-F419 WeakPolarHBondContact O-CB 3.22Å; N415-F419 PolarHBondContact O-N 2.68Å; F419-E422 PolarHBondContact O-N 3.26Å; F419-W423 WeakPolarHBondContact O-CB 3.35Å; F419-W423 PolarHBondContact O-N 2.83Å
420	Y	92	Very high	86	Confident	13 Å²	13	69.1 Å²	69.1	5%	0.051	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-43.6	179.3	-166.5	-105.6	0	0	0	112.2	F292 E295 L296 V416 G417 D418 E422 W423 I424	F292-Y420 HydrophobicContact CB-CD1 4.49Å; F292-Y420 HydrophobicContact CB-CD2 3.66Å; F292-Y420 HydrophobicContact CB-CE2 3.85Å; F292-Y420 HydrophobicContact CB-CG 4.03Å; F292-Y420 AromaticContact CD1-CD1 3.7Å; F292-Y420 HydrophobicContact CD1-CD1 3.7Å; F292-Y420 HydrophobicContact CD1-CD2 4.32Å; F292-Y420 AromaticContact CD1-CE1 3.52Å; F292-Y420 HydrophobicContact CD1-CE1 3.52Å; F292-Y420 HydrophobicContact CD1-CE2 4.2Å; F292-Y420 HydrophobicContact CD1-CG 4.1Å; F292-Y420 AromaticContact CD1-CZ 3.84Å; F292-Y420 AromaticContact CD2-CD1 3.82Å; F292-Y420 HydrophobicContact CD2-CD1 3.82Å; F292-Y420 HydrophobicContact CD2-CD2 4.21Å; F292-Y420 HydrophobicContact CD2-CE1 4.48Å; F292-Y420 AromaticContact CD2-CG 3.68Å; F292-Y420 HydrophobicContact CD2-CG 3.68Å; F292-Y420 AromaticContact CE1-CD1 3.76Å; F292-Y420 HydrophobicContact CE1-CD1 3.76Å; F292-Y420 AromaticContact CE1-CE1 3.67Å; F292-Y420 HydrophobicContact CE1-CE1 3.67Å; F292-Y420 AromaticContact CE2-CD1 3.86Å; F292-Y420 HydrophobicContact CE2-CD1 3.86Å; F292-Y420 HydrophobicContact CE2-CG 4.11Å; F292-Y420 AromaticContact CG-CD1 3.76Å; F292-Y420 HydrophobicContact CG-CD1 3.76Å; F292-Y420 AromaticContact CG-CD2 3.84Å; F292-Y420 HydrophobicContact CG-CD2 3.84Å; F292-Y420 AromaticContact CG-CE1 3.98Å; F292-Y420 HydrophobicContact CG-CE1 3.98Å; F292-Y420 HydrophobicContact CG-CE2 4.09Å; F292-Y420 AromaticContact CG-CG 3.68Å; F292-Y420 HydrophobicContact CG-CG 3.68Å; F292-Y420 AromaticContact CZ-CD1 3.84Å; F292-Y420 HydrophobicContact CZ-CD1 3.84Å; F292-Y420 HydrophobicContact CZ-CE1 4.22Å; E295-Y420 HydrophobicContact CB-CE2 4.2Å; E295-Y420 WeakPolarHBondContact CB-OH 2.85Å; E295-Y420 PolarHBondContact OE1-OH 3.09Å; E295-Y420 PolarHBondContact OE2-OH 3.31Å; L296-Y420 HydrophobicContact CD1-CD2 4.39Å; L296-Y420 HydrophobicContact CD2-CD2 4.3Å; L296-Y420 HydrophobicContact CG-CD2 4.16Å; L296-Y420 HydrophobicContact CG-CE2 4.25Å; V416-Y420 VanDerWaalsContact O-CB 3.23Å; V416-Y420 WeakPolarHBondContact O-CB 2.76Å; V416-Y420 PolarHBondContact O-N 2.84Å; G417-Y420 PolarHBondContact O-N 3.38Å; D418-Y420 VanDerWaalsContact C-N 3.33Å; D418-Y420 PolarHBondContact O-N 2.79Å; Y420-E422 PolarHBondContact O-N 2.99Å; Y420-W423 AromaticContact CD2-CE3 3.89Å; Y420-W423 HydrophobicContact CD2-CE3 3.89Å; Y420-W423 HydrophobicContact CD2-CZ3 4.21Å; Y420-W423 AromaticContact CE2-CE3 3.61Å; Y420-W423 HydrophobicContact CE2-CE3 3.61Å; Y420-W423 AromaticContact CE2-CZ3 3.46Å; Y420-W423 HydrophobicContact CE2-CZ3 3.46Å; Y420-W423 VanDerWaalsContact CE2-CZ3 3.46Å; Y420-W423 AromaticContact CZ-CZ3 3.95Å; Y420-W423 PolarHBondContact O-N 3.26Å; Y420-I424 HydrophobicContact CD1-CD1 3.69Å; Y420-I424 HydrophobicContact CD1-CG1 4.37Å; Y420-I424 HydrophobicContact CE1-CD1 3.16Å; Y420-I424 HydrophobicContact CE1-CG1 4.04Å; Y420-I424 WeakPolarHBondContact O-CG1 3.24Å; Y420-I424 PolarHBondContact O-N 3.32Å
421	A	90.7	Very high	86.2	Confident	43 Å²	43	64.4 Å²	64.4	36%	0.355	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-36.9	176.4	0	0	0	0	0	112.5	G417 D418 K425	G417-A421 WeakPolarHBondContact O-CB 2.95Å; G417-A421 PolarHBondContact O-N 3.33Å; D418-A421 PolarHBondContact O-N 3.19Å; A421-K425 WeakPolarHBondContact O-CB 3.07Å; A421-K425 VanDerWaalsContact O-CG 3.25Å; A421-K425 WeakPolarHBondContact O-CG 3.19Å; A421-K425 PolarHBondContact O-N 2.72Å; A421-K425 VanDerWaalsContact O-N 3.16Å
422	E	91	Very high	86	Confident	71 Å²	71	67.1 Å²	67.1	33%	0.332	32%	0.319	S	S	.	.	H	α-helix	trans	-65.2	-43	173	-170.3	-169.7	153.5	0	0	111.5	R414 D418 F419 Y420 K425 K426	R414-E422 IonicContact NH1-OE1 3.88Å; R414-E422 IonicContact NH1-OE2 3.14Å; R414-E422 PolarHBondContact NH1-OE2 2.88Å; D418-E422 WeakPolarHBondContact O-CB 3.42Å; D418-E422 PolarHBondContact O-N 3.3Å; F419-E422 PolarHBondContact O-N 3.26Å; Y420-E422 PolarHBondContact O-N 2.99Å; E422-K425 PolarHBondContact O-N 3.41Å; E422-K426 WeakPolarHBondContact O-CG 3.26Å; E422-K426 PolarHBondContact O-N 3.16Å; E422-K426 WeakPolarHBondContact OE1-CE 3.25Å; E422-K426 IonicContact OE1-NZ 2.68Å; E422-K426 PolarHBondContact OE1-NZ 2.79Å
423	W	90.3	Very high	85.6	Confident	23 Å²	23	69.1 Å²	69.1	9%	0.087	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-47.6	178.8	173.7	59.6	0	0	0	112	L296 S299 F302 F419 Y420 K425 K426 E427	L296-W423 HydrophobicContact CD2-CD2 3.92Å; L296-W423 HydrophobicContact CD2-CE3 3.74Å; L296-W423 HydrophobicContact CD2-CG 4.46Å; L296-W423 HydrophobicContact CD2-CZ3 4.08Å; S299-W423 VanDerWaalsContact CB-CZ2 3.43Å; F302-W423 AromaticContact CE2-CD1 3.66Å; F302-W423 HydrophobicContact CE2-CD2 4.14Å; F302-W423 AromaticContact CE2-CE2 3.79Å; F302-W423 HydrophobicContact CE2-CG 4.06Å; F302-W423 HydrophobicContact CE2-CZ2 4.44Å; F302-W423 AromaticContact CE2-NE1 3.47Å; F302-W423 AromaticContact CZ-CD1 3.59Å; F302-W423 HydrophobicContact CZ-CG 4.15Å; F302-W423 AromaticContact CZ-NE1 3.82Å; F419-W423 WeakPolarHBondContact O-CB 3.35Å; F419-W423 PolarHBondContact O-N 2.83Å; Y420-W423 AromaticContact CD2-CE3 3.89Å; Y420-W423 HydrophobicContact CD2-CE3 3.89Å; Y420-W423 HydrophobicContact CD2-CZ3 4.21Å; Y420-W423 AromaticContact CE2-CE3 3.61Å; Y420-W423 HydrophobicContact CE2-CE3 3.61Å; Y420-W423 AromaticContact CE2-CZ3 3.46Å; Y420-W423 HydrophobicContact CE2-CZ3 3.46Å; Y420-W423 VanDerWaalsContact CE2-CZ3 3.46Å; Y420-W423 AromaticContact CZ-CZ3 3.95Å; Y420-W423 PolarHBondContact O-N 3.26Å; W423-K425 VanDerWaalsContact C-N 3.31Å; W423-K425 PolarHBondContact O-N 3.46Å; W423-K426 WeakPolarHBondContact O-CB 3.45Å; W423-K426 PolarHBondContact O-N 3.36Å; W423-E427 VanDerWaalsContact CZ2-CD 3.42Å; W423-E427 VanDerWaalsContact CZ2-OE1 3.24Å; W423-E427 WeakPolarHBondContact CZ2-OE1 3.49Å; W423-E427 WeakPolarHBondContact CZ2-OE2 3.01Å; W423-E427 PolarHBondContact NE1-OE1 3.01Å; W423-E427 PolarHBondContact O-N 3.1Å
424	I	87.2	Confident	85	Confident	57 Å²	57	72.7 Å²	72.7	29%	0.292	34%	0.343	S	S	.	.	H	α-helix	trans	-57	-45	175	-73.6	-178.1	0	0	0	110.7	Y420 K426 E427 Y428	Y420-I424 HydrophobicContact CD1-CD1 3.69Å; Y420-I424 HydrophobicContact CD1-CG1 4.37Å; Y420-I424 HydrophobicContact CE1-CD1 3.16Å; Y420-I424 HydrophobicContact CE1-CG1 4.04Å; Y420-I424 WeakPolarHBondContact O-CG1 3.24Å; Y420-I424 PolarHBondContact O-N 3.32Å; I424-K426 PolarHBondContact O-N 2.92Å; I424-K426 VanDerWaalsContact O-N 3.13Å; I424-E427 PolarHBondContact O-N 3.31Å; I424-Y428 HydrophobicContact CG2-CD2 3.66Å; I424-Y428 HydrophobicContact CG2-CE2 4.03Å; I424-Y428 WeakPolarHBondContact O-CD2 3Å; I424-Y428 PolarHBondContact O-N 2.69Å
425	K	84.8	Confident	84.4	Confident	160 Å²	160	72.6 Å²	72.6	70%	0.696	35%	0.347	S	S	*	.	H	α-helix	trans	-64	-16.2	177.6	-74.3	172.9	-176.4	175.7	0	114.6	A421 E422 W423	A421-K425 WeakPolarHBondContact O-CB 3.07Å; A421-K425 VanDerWaalsContact O-CG 3.25Å; A421-K425 WeakPolarHBondContact O-CG 3.19Å; A421-K425 PolarHBondContact O-N 2.72Å; A421-K425 VanDerWaalsContact O-N 3.16Å; E422-K425 PolarHBondContact O-N 3.41Å; W423-K425 VanDerWaalsContact C-N 3.31Å; W423-K425 PolarHBondContact O-N 3.46Å
426	K	79.3	Confident	83.8	Confident	152 Å²	152	74.5 Å²	74.5	66%	0.661	35%	0.354	S	S	*	.	H	α-helix	trans	-89.1	-24.6	174.2	-72.3	177.1	-174.6	168.3	0	112	E422 W423 I424	E422-K426 WeakPolarHBondContact O-CG 3.26Å; E422-K426 PolarHBondContact O-N 3.16Å; E422-K426 WeakPolarHBondContact OE1-CE 3.25Å; E422-K426 IonicContact OE1-NZ 2.68Å; E422-K426 PolarHBondContact OE1-NZ 2.79Å; W423-K426 WeakPolarHBondContact O-CB 3.45Å; W423-K426 PolarHBondContact O-N 3.36Å; I424-K426 PolarHBondContact O-N 2.92Å; I424-K426 VanDerWaalsContact O-N 3.13Å
427	E	61.4	Low	83	Confident	88 Å²	88	80.7 Å²	80.7	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-88.9	-23.8	177.5	-68.7	-161.6	153.6	0	0	113.8	Q301 W423 I424	Q301-E427 PolarHBondContact NE2-OE1 3.24Å; W423-E427 VanDerWaalsContact CZ2-CD 3.42Å; W423-E427 VanDerWaalsContact CZ2-OE1 3.24Å; W423-E427 WeakPolarHBondContact CZ2-OE1 3.49Å; W423-E427 WeakPolarHBondContact CZ2-OE2 3.01Å; W423-E427 PolarHBondContact NE1-OE1 3.01Å; W423-E427 PolarHBondContact O-N 3.1Å; I424-E427 PolarHBondContact O-N 3.31Å
428	Y	43.2	Very low	82.4	Confident	209 Å²	209	86.2 Å²	86.2	82%	0.82	40%	0.4	S	S	*	.			trans	-114	0	176.9	-66.7	-89.5	0	0	0	111.2	I424	I424-Y428 HydrophobicContact CG2-CD2 3.66Å; I424-Y428 HydrophobicContact CG2-CE2 4.03Å; I424-Y428 WeakPolarHBondContact O-CD2 3Å; I424-Y428 PolarHBondContact O-N 2.69Å

Retrieved 428 of 428 residues in 2885.2 ms (Link to these results)

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