G4VEY7_SCHMA Loading...

GIT2 AlphaSync

AlphaFold DB , UniProt , Accession G4VEY7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 250 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	52.3	Low	63.8	Low	202 Å²	202	133.2 Å²	133.2	100%	0.995	67%	0.665	S	S	*	*				0	-21.1	0	-71	-158.8	-71.3	0	0	114.6
2	H	54.9	Low	66.3	Low	178 Å²	178	125 Å²	125	82%	0.824	63%	0.625	S	S	*	*	H	α-helix	trans	-77.8	-15.3	179.6	-114.6	16.3	0	0	0	115.9
3	M	58	Low	68.4	Low	166 Å²	166	120.1 Å²	120.1	82%	0.818	60%	0.602	S	S	*	*	H	α-helix	trans	-81.5	-33.4	-179.1	-78.3	-175.5	167.7	0	0	114	V7	M3-V7 WeakPolarHBondContact O-CG2 3.31Å; M3-V7 PolarHBondContact O-N 2.78Å
4	E	59.6	Low	70.2	Confident	144 Å²	144	114.5 Å²	114.5	67%	0.673	58%	0.58	S	S	*	*	H	α-helix	trans	-69.5	-43	-175.3	-75.2	165.8	168.6	0	0	112.7	L6 V7 E8	E4-L6 VanDerWaalsContact C-N 3.33Å; E4-L6 PolarHBondContact O-N 3Å; E4-V7 PolarHBondContact O-N 3.02Å; E4-E8 PolarHBondContact O-N 3.41Å; E4-E8 VanDerWaalsContact O-N 3.08Å
5	L	59.3	Low	71.8	Confident	112 Å²	112	108.5 Å²	108.5	59%	0.586	56%	0.555	S	S	*	*	H	α-helix	trans	-62.4	-36.6	178.8	-87.9	158.9	0	0	0	113.5	E8 M9	L5-E8 PolarHBondContact O-N 3.4Å; L5-M9 PolarHBondContact O-N 3.34Å
6	L	60.1	Low	73.4	Confident	111 Å²	111	101.8 Å²	101.8	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-72.7	-33.3	-179.1	-140.9	115.8	0	0	0	111.4	E4 H10	E4-L6 VanDerWaalsContact C-N 3.33Å; E4-L6 PolarHBondContact O-N 3Å; L6-H10 PolarHBondContact O-CD2 2.75Å; L6-H10 VanDerWaalsContact O-CD2 3.23Å
7	V	61.9	Low	74.7	Confident	104 Å²	104	98.8 Å²	98.8	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-68.2	-40.8	174.4	174.9	0	0	0	0	110.6	M3 E4 M9 H10 S11	M3-V7 WeakPolarHBondContact O-CG2 3.31Å; M3-V7 PolarHBondContact O-N 2.78Å; E4-V7 PolarHBondContact O-N 3.02Å; V7-M9 PolarHBondContact O-N 3.27Å; V7-H10 CarbonylContact O-C 3.53Å; V7-H10 PolarHBondContact O-N 3.17Å; V7-S11 PolarHBondContact O-N 3.22Å
8	E	63.3	Low	75.9	Confident	130 Å²	130	99.4 Å²	99.4	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-62.4	-40.6	176.1	-75.5	-178.9	-177.1	0	0	112.8	E4 L5 H10 S11 S14	E4-E8 PolarHBondContact O-N 3.41Å; E4-E8 VanDerWaalsContact O-N 3.08Å; L5-E8 PolarHBondContact O-N 3.4Å; E8-H10 PolarHBondContact O-N 3.23Å; E8-S11 WeakPolarHBondContact O-CB 3.3Å; E8-S11 PolarHBondContact O-N 3.39Å; E8-S14 WeakPolarHBondContact O-CB 3.32Å
9	M	66.5	Low	77	Confident	132 Å²	132	94.4 Å²	94.4	65%	0.65	48%	0.477	S	S	*	.	H	α-helix	trans	-60.5	-33.1	177.9	-78.5	-173.5	61.7	0	0	112.9	L5 V7 S14	L5-M9 PolarHBondContact O-N 3.34Å; V7-M9 PolarHBondContact O-N 3.27Å; M9-S14 PolarHBondContact O-OG 3.03Å; M9-S14 VanDerWaalsContact O-OG 3.07Å
10	H	74.9	Confident	78	Confident	148 Å²	148	91.5 Å²	91.5	69%	0.685	46%	0.462	S	S	*	.	H	α-helix	trans	-101.6	4.7	-178.3	-63.6	-54.9	0	0	0	114	L6 V7 E8	L6-H10 PolarHBondContact O-CD2 2.75Å; L6-H10 VanDerWaalsContact O-CD2 3.23Å; V7-H10 CarbonylContact O-C 3.53Å; V7-H10 PolarHBondContact O-N 3.17Å; E8-H10 PolarHBondContact O-N 3.23Å
11	S	91	Very high	78.9	Confident	38 Å²	38	94.1 Å²	94.1	27%	0.266	47%	0.466	S	S	.	.	S	Bend	trans	-62.6	147.7	175.3	172.4	0	0	0	0	111.4	V7 E8 L13 S14 A15	V7-S11 PolarHBondContact O-N 3.22Å; E8-S11 WeakPolarHBondContact O-CB 3.3Å; E8-S11 PolarHBondContact O-N 3.39Å; S11-L13 PolarHBondContact O-N 2.93Å; S11-L13 PolarHBondContact OG-N 2.99Å; S11-S14 WeakPolarHBondContact O-CB 3.46Å; S11-S14 PolarHBondContact O-N 3.37Å; S11-S14 VanDerWaalsContact O-N 3.13Å; S11-A15 PolarHBondContact O-N 3.37Å
12	N	94	Very high	81	Confident	35 Å²	35	85.8 Å²	85.8	19%	0.187	43%	0.427	C	S	.	.	H	α-helix	trans	-53.8	-37	172	-76.2	-45.4	0	0	0	111.5	A15 A16 F45 L48 T49 E52	N12-A15 PolarHBondContact O-N 2.64Å; N12-A16 WeakPolarHBondContact O-CB 3.27Å; N12-A16 PolarHBondContact O-N 3Å; N12-F45 WeakPolarHBondContact OD1-CD1 3.41Å; N12-L48 HydrophobicContact CB-CB 4.24Å; N12-T49 VanDerWaalsContact C-OG1 3.25Å; N12-T49 WeakPolarHBondContact CB-OG1 3.49Å; N12-E52 PolarHBondContact ND2-OE1 2.96Å
13	L	93.7	Very high	83.1	Confident	61 Å²	61	77.3 Å²	77.3	32%	0.319	39%	0.388	S	S	.	.	H	α-helix	trans	-66	-43.7	178.6	-175.5	58	0	0	0	111.9	S11 A16 H17 M46 T49	S11-L13 PolarHBondContact O-N 2.93Å; S11-L13 PolarHBondContact OG-N 2.99Å; L13-A16 PolarHBondContact O-N 2.92Å; L13-H17 WeakPolarHBondContact CD1-NE2 3.49Å; L13-H17 PolarHBondContact O-CD2 3.41Å; L13-H17 VanDerWaalsContact O-CD2 3.28Å; L13-H17 PolarHBondContact O-N 2.87Å; L13-H17 VanDerWaalsContact O-N 3.07Å; L13-M46 HydrophobicContact CD1-CE 3.92Å; L13-M46 HydrophobicContact CD1-SD 3.98Å; L13-T49 HydrophobicContact CB-CG2 3.88Å; L13-T49 HydrophobicContact CD1-CG2 4.26Å; L13-T49 HydrophobicContact CG-CG2 4.49Å; L13-T49 PolarHBondContact N-OG1 3.48Å; L13-T49 VanDerWaalsContact N-OG1 3.08Å
14	S	93.6	Very high	84.9	Confident	42 Å²	42	74 Å²	74	29%	0.294	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-44.9	175.2	172.3	0	0	0	0	111.2	E8 M9 S11 A16 H17 F18	E8-S14 WeakPolarHBondContact O-CB 3.32Å; M9-S14 PolarHBondContact O-OG 3.03Å; M9-S14 VanDerWaalsContact O-OG 3.07Å; S11-S14 WeakPolarHBondContact O-CB 3.46Å; S11-S14 PolarHBondContact O-N 3.37Å; S11-S14 VanDerWaalsContact O-N 3.13Å; S14-A16 PolarHBondContact O-N 3.27Å; S14-H17 PolarHBondContact O-N 2.87Å; S14-F18 WeakPolarHBondContact O-CB 3.45Å; S14-F18 PolarHBondContact O-N 3.4Å
15	A	94.8	Very high	86.7	Confident	25 Å²	25	72 Å²	72	21%	0.207	36%	0.36	C	S	.	.	H	α-helix	trans	-61.5	-42.8	175.7	0	0	0	0	0	111.6	S11 N12 H17 F18 N19 F45	S11-A15 PolarHBondContact O-N 3.37Å; N12-A15 PolarHBondContact O-N 2.64Å; A15-H17 PolarHBondContact O-N 3.22Å; A15-F18 PolarHBondContact O-N 2.89Å; A15-N19 PolarHBondContact O-N 3.18Å; A15-N19 PolarHBondContact O-ND2 3.45Å; A15-F45 HydrophobicContact CB-CB 4.43Å; A15-F45 HydrophobicContact CB-CD1 3.93Å; A15-F45 HydrophobicContact CB-CD2 3.83Å; A15-F45 HydrophobicContact CB-CE1 4.09Å; A15-F45 HydrophobicContact CB-CE2 3.97Å; A15-F45 HydrophobicContact CB-CG 3.81Å; A15-F45 HydrophobicContact CB-CZ 4.11Å
16	A	96	Very high	88.4	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-49.8	177.7	0	0	0	0	0	111.6	N12 L13 S14 N19 E20 S42 F45 M46	N12-A16 WeakPolarHBondContact O-CB 3.27Å; N12-A16 PolarHBondContact O-N 3Å; L13-A16 PolarHBondContact O-N 2.92Å; S14-A16 PolarHBondContact O-N 3.27Å; A16-N19 PolarHBondContact O-N 3.4Å; A16-E20 PolarHBondContact O-N 3.02Å; A16-S42 WeakPolarHBondContact O-CB 3.35Å; A16-S42 PolarHBondContact O-OG 2.96Å; A16-F45 HydrophobicContact CB-CB 3.76Å; A16-M46 HydrophobicContact CB-CB 4.34Å; A16-M46 HydrophobicContact CB-CE 3.83Å
17	H	96.2	Very high	90.1	Very high	51 Å²	51	64.4 Å²	64.4	24%	0.236	32%	0.321	C	S	.	.	H	α-helix	trans	-68.5	-35	178.9	-70.7	-48.4	0	0	0	113.5	L13 S14 A15 E20 R21	L13-H17 WeakPolarHBondContact CD1-NE2 3.49Å; L13-H17 PolarHBondContact O-CD2 3.41Å; L13-H17 VanDerWaalsContact O-CD2 3.28Å; L13-H17 PolarHBondContact O-N 2.87Å; L13-H17 VanDerWaalsContact O-N 3.07Å; S14-H17 PolarHBondContact O-N 2.87Å; A15-H17 PolarHBondContact O-N 3.22Å; H17-E20 IonicContact ND1-OE2 3.92Å; H17-E20 PolarHBondContact ND1-OE2 3.18Å; H17-E20 PolarHBondContact O-N 2.92Å; H17-R21 WeakPolarHBondContact O-CG 3.44Å; H17-R21 PolarHBondContact O-N 3.24Å
18	F	95.7	Very high	91.6	Very high	111 Å²	111	67.5 Å²	67.5	49%	0.487	33%	0.326	S	S	.	.	H	α-helix	trans	-58.8	-49	172.7	173.5	-96.9	0	0	0	111	S14 A15 E20 R21 C22	S14-F18 WeakPolarHBondContact O-CB 3.45Å; S14-F18 PolarHBondContact O-N 3.4Å; A15-F18 PolarHBondContact O-N 2.89Å; F18-E20 VanDerWaalsContact C-N 3.34Å; F18-E20 PolarHBondContact O-N 2.93Å; F18-R21 PolarHBondContact O-N 2.93Å; F18-C22 PolarHBondContact O-N 2.88Å; F18-C22 PolarHBondContact O-SG 3.37Å; F18-C22 VanDerWaalsContact O-SG 3.38Å
19	N	96.9	Very high	93	Very high	4 Å²	4	66 Å²	66	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-37.1	178.5	-71.6	-75.7	0	0	0	111.8	A15 A16 R21 C22 A23 Y38 K41	A15-N19 PolarHBondContact O-N 3.18Å; A15-N19 PolarHBondContact O-ND2 3.45Å; A16-N19 PolarHBondContact O-N 3.4Å; N19-R21 VanDerWaalsContact C-N 3.35Å; N19-R21 PolarHBondContact O-N 3.21Å; N19-C22 WeakPolarHBondContact O-CB 3.23Å; N19-C22 PolarHBondContact O-N 2.91Å; N19-A23 WeakPolarHBondContact O-CB 3.3Å; N19-A23 PolarHBondContact O-N 3.38Å; N19-Y38 HydrophobicContact CB-CD1 4.47Å; N19-Y38 WeakPolarHBondContact OD1-CD1 3.4Å; N19-K41 VanDerWaalsContact OD1-CD 3.28Å; N19-K41 WeakPolarHBondContact OD1-CD 3.3Å
20	E	97.3	Very high	94.2	Very high	35 Å²	35	62 Å²	62	16%	0.164	32%	0.318	C	S	.	.	H	α-helix	trans	-59.6	-43.9	173.9	-171.5	-167.5	167.4	0	0	111.9	A16 H17 F18 A23 K24 Y39 L70	A16-E20 PolarHBondContact O-N 3.02Å; H17-E20 IonicContact ND1-OE2 3.92Å; H17-E20 PolarHBondContact ND1-OE2 3.18Å; H17-E20 PolarHBondContact O-N 2.92Å; F18-E20 VanDerWaalsContact C-N 3.34Å; F18-E20 PolarHBondContact O-N 2.93Å; E20-A23 WeakPolarHBondContact O-CB 3.34Å; E20-A23 PolarHBondContact O-N 2.77Å; E20-K24 WeakPolarHBondContact O-CG 3.49Å; E20-K24 PolarHBondContact O-N 3.03Å; E20-K24 VanDerWaalsContact OE1-CE 3.22Å; E20-K24 WeakPolarHBondContact OE1-CE 3.46Å; E20-K24 IonicContact OE1-NZ 3.68Å; E20-K24 PolarHBondContact OE1-NZ 3.44Å; E20-Y39 HydrophobicContact CG-CE1 4.34Å; E20-L70 HydrophobicContact CB-CD2 4.21Å; E20-L70 HydrophobicContact CG-CD2 3.75Å
21	R	97.6	Very high	95.1	Very high	147 Å²	147	58.8 Å²	58.8	56%	0.555	31%	0.306	S	S	*	.	H	α-helix	trans	-62.2	-43.6	175.4	-70.7	-171.2	-62.6	-90.4	6.1	111.7	H17 F18 N19 A23 K24 Q25	H17-R21 WeakPolarHBondContact O-CG 3.44Å; H17-R21 PolarHBondContact O-N 3.24Å; F18-R21 PolarHBondContact O-N 2.93Å; N19-R21 VanDerWaalsContact C-N 3.35Å; N19-R21 PolarHBondContact O-N 3.21Å; R21-A23 VanDerWaalsContact C-N 3.34Å; R21-A23 PolarHBondContact O-N 3.35Å; R21-K24 PolarHBondContact O-N 3.49Å; R21-Q25 PolarHBondContact O-N 3.41Å
22	C	97	Very high	95.3	Very high	27 Å²	27	58 Å²	58	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-44.2	174.1	-67	0	0	0	0	111.6	F18 N19 K24 Q25 C26 Y38	F18-C22 PolarHBondContact O-N 2.88Å; F18-C22 PolarHBondContact O-SG 3.37Å; F18-C22 VanDerWaalsContact O-SG 3.38Å; N19-C22 WeakPolarHBondContact O-CB 3.23Å; N19-C22 PolarHBondContact O-N 2.91Å; C22-K24 PolarHBondContact O-N 3.33Å; C22-Q25 WeakPolarHBondContact O-CB 3.45Å; C22-Q25 PolarHBondContact O-N 3.3Å; C22-Q25 VanDerWaalsContact O-N 3.15Å; C22-C26 PolarHBondContact O-N 3.06Å; C22-C26 PolarHBondContact O-SG 2.99Å; C22-C26 VanDerWaalsContact O-SG 3.42Å; C22-Y38 HydrophobicContact CB-CD1 3.7Å; C22-Y38 HydrophobicContact CB-CD2 3.93Å; C22-Y38 HydrophobicContact CB-CE1 3.86Å; C22-Y38 HydrophobicContact CB-CE2 4.1Å; C22-Y38 HydrophobicContact CB-CG 3.75Å
23	A	97.3	Very high	95.4	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.4	-46.3	177.7	0	0	0	0	0	111.8	N19 E20 R21 Q25 C26 M27 Y39	N19-A23 WeakPolarHBondContact O-CB 3.3Å; N19-A23 PolarHBondContact O-N 3.38Å; E20-A23 WeakPolarHBondContact O-CB 3.34Å; E20-A23 PolarHBondContact O-N 2.77Å; R21-A23 VanDerWaalsContact C-N 3.34Å; R21-A23 PolarHBondContact O-N 3.35Å; A23-Q25 VanDerWaalsContact C-N 3.29Å; A23-Q25 PolarHBondContact O-N 3.29Å; A23-C26 WeakPolarHBondContact O-CB 3.19Å; A23-C26 PolarHBondContact O-N 2.66Å; A23-M27 WeakPolarHBondContact O-CG 3.28Å; A23-M27 PolarHBondContact O-N 3Å; A23-Y39 HydrophobicContact CB-CD1 3.86Å; A23-Y39 HydrophobicContact CB-CD2 3.68Å; A23-Y39 HydrophobicContact CB-CE1 3.81Å; A23-Y39 HydrophobicContact CB-CE2 3.63Å; A23-Y39 HydrophobicContact CB-CG 3.77Å
24	K	96.9	Very high	95.5	Very high	96 Å²	96	59 Å²	59	42%	0.417	30%	0.304	S	S	.	.	H	α-helix	trans	-60.9	-36.7	175.1	-71.4	177.3	-176	170.1	0	112.1	E20 R21 C22 M27 K28	E20-K24 WeakPolarHBondContact O-CG 3.49Å; E20-K24 PolarHBondContact O-N 3.03Å; E20-K24 VanDerWaalsContact OE1-CE 3.22Å; E20-K24 WeakPolarHBondContact OE1-CE 3.46Å; E20-K24 IonicContact OE1-NZ 3.68Å; E20-K24 PolarHBondContact OE1-NZ 3.44Å; R21-K24 PolarHBondContact O-N 3.49Å; C22-K24 PolarHBondContact O-N 3.33Å; K24-M27 PolarHBondContact O-N 3.05Å; K24-K28 WeakPolarHBondContact O-CG 3.27Å; K24-K28 PolarHBondContact O-N 3.35Å
25	Q	96.8	Very high	95.7	Very high	104 Å²	104	57 Å²	57	49%	0.486	29%	0.29	S	S	.	.	H	α-helix	trans	-68.3	-43.1	174.9	-173.9	60.4	23	0	0	111.9	R21 C22 A23 M27 K28 V29	R21-Q25 PolarHBondContact O-N 3.41Å; C22-Q25 WeakPolarHBondContact O-CB 3.45Å; C22-Q25 PolarHBondContact O-N 3.3Å; C22-Q25 VanDerWaalsContact O-N 3.15Å; A23-Q25 VanDerWaalsContact C-N 3.29Å; A23-Q25 PolarHBondContact O-N 3.29Å; Q25-M27 VanDerWaalsContact C-N 3.26Å; Q25-M27 PolarHBondContact O-N 3.42Å; Q25-K28 WeakPolarHBondContact O-CB 2.9Å; Q25-K28 PolarHBondContact O-N 2.9Å; Q25-K28 VanDerWaalsContact O-N 3.1Å; Q25-V29 WeakPolarHBondContact O-CG2 3.33Å; Q25-V29 PolarHBondContact O-N 3.12Å; Q25-V29 VanDerWaalsContact O-N 3.11Å
26	C	95.9	Very high	95.8	Very high	19 Å²	19	56.5 Å²	56.5	13%	0.128	28%	0.283	C	S	.	.	H	α-helix	trans	-58.4	-39.6	174.1	-71.3	0	0	0	0	111.9	C22 A23 K28 V29 G30 N31 A35	C22-C26 PolarHBondContact O-N 3.06Å; C22-C26 PolarHBondContact O-SG 2.99Å; C22-C26 VanDerWaalsContact O-SG 3.42Å; A23-C26 WeakPolarHBondContact O-CB 3.19Å; A23-C26 PolarHBondContact O-N 2.66Å; C26-K28 PolarHBondContact O-N 3.43Å; C26-V29 PolarHBondContact O-N 2.84Å; C26-G30 PolarHBondContact O-N 2.63Å; C26-G30 VanDerWaalsContact O-N 3.09Å; C26-N31 HydrophobicContact CB-CB 4.44Å; C26-N31 WeakPolarHBondContact CB-O 3.42Å; C26-N31 PolarHBondContact O-N 3Å; C26-A35 HydrophobicContact CB-CB 3.89Å
27	M	94.5	Very high	95.9	Very high	44 Å²	44	63 Å²	63	22%	0.217	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-39.7	174	-71.7	-58.9	-70.8	0	0	113	A23 K24 Q25 G30 I32 A35 Y39 V77 K80	A23-M27 WeakPolarHBondContact O-CG 3.28Å; A23-M27 PolarHBondContact O-N 3Å; K24-M27 PolarHBondContact O-N 3.05Å; Q25-M27 VanDerWaalsContact C-N 3.26Å; Q25-M27 PolarHBondContact O-N 3.42Å; M27-G30 PolarHBondContact O-N 2.89Å; M27-I32 HydrophobicContact CE-CD1 4.06Å; M27-I32 HydrophobicContact SD-CD1 3.82Å; M27-A35 HydrophobicContact CG-CB 3.66Å; M27-A35 HydrophobicContact SD-CB 3.5Å; M27-A35 VanDerWaalsContact SD-CB 3.5Å; M27-Y39 HydrophobicContact CG-CE2 4.49Å; M27-V77 HydrophobicContact CE-CG2 3.99Å; M27-V77 HydrophobicContact CG-CG2 4.31Å; M27-V77 HydrophobicContact SD-CB 4.26Å; M27-V77 HydrophobicContact SD-CG1 3.71Å; M27-V77 HydrophobicContact SD-CG2 3.68Å; M27-K80 HydrophobicContact CE-CD 3.66Å
28	K	93.9	Very high	95.9	Very high	168 Å²	168	63.9 Å²	63.9	73%	0.73	31%	0.311	S	S	*	.	H	α-helix	trans	-65.9	-36.8	176.4	-69.4	174.5	-175.8	177.6	0	112.7	K24 Q25 C26 G30	K24-K28 WeakPolarHBondContact O-CG 3.27Å; K24-K28 PolarHBondContact O-N 3.35Å; Q25-K28 WeakPolarHBondContact O-CB 2.9Å; Q25-K28 PolarHBondContact O-N 2.9Å; Q25-K28 VanDerWaalsContact O-N 3.1Å; C26-K28 PolarHBondContact O-N 3.43Å; K28-G30 PolarHBondContact O-N 3.16Å
29	V	93.2	Very high	96.1	Very high	100 Å²	100	59.3 Å²	59.3	61%	0.606	29%	0.29	S	S	*	.	H	α-helix	trans	-76.2	-14.5	177.8	178.6	0	0	0	0	111.8	Q25 C26 N31	Q25-V29 WeakPolarHBondContact O-CG2 3.33Å; Q25-V29 PolarHBondContact O-N 3.12Å; Q25-V29 VanDerWaalsContact O-N 3.11Å; C26-V29 PolarHBondContact O-N 2.84Å; V29-N31 VanDerWaalsContact C-N 3.34Å
30	G	91.6	Very high	96.1	Very high	47 Å²	47	65.2 Å²	65.2	49%	0.485	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	8.7	-174.4	0	0	0	0	0	113.7	C26 M27 K28 I32	C26-G30 PolarHBondContact O-N 2.63Å; C26-G30 VanDerWaalsContact O-N 3.09Å; M27-G30 PolarHBondContact O-N 2.89Å; K28-G30 PolarHBondContact O-N 3.16Å; G30-I32 PolarHBondContact O-N 2.94Å; G30-I32 VanDerWaalsContact O-N 3.11Å
31	N	94	Very high	96.1	Very high	81 Å²	81	67.3 Å²	67.3	43%	0.433	32%	0.324	S	S	.	.			trans	-82.4	86.3	173.9	-175.7	-5.8	0	0	0	110.2	C26 V29 G34 A35	C26-N31 HydrophobicContact CB-CB 4.44Å; C26-N31 WeakPolarHBondContact CB-O 3.42Å; C26-N31 PolarHBondContact O-N 3Å; V29-N31 VanDerWaalsContact C-N 3.34Å; N31-G34 PolarHBondContact OD1-N 3.36Å; N31-A35 PolarHBondContact O-N 3.43Å; N31-A35 VanDerWaalsContact O-N 3.16Å
32	I	95.2	Very high	96.1	Very high	22 Å²	22	60.3 Å²	60.3	11%	0.113	30%	0.298	C	S	.	.	H	α-helix	trans	-67.1	-39.7	-177	-54.5	-57.5	0	0	0	112.1	M27 G30 G34 A35 I36 V77 K81 I84	M27-I32 HydrophobicContact CE-CD1 4.06Å; M27-I32 HydrophobicContact SD-CD1 3.82Å; G30-I32 PolarHBondContact O-N 2.94Å; G30-I32 VanDerWaalsContact O-N 3.11Å; I32-G34 PolarHBondContact O-N 3.43Å; I32-A35 WeakPolarHBondContact O-CB 3.44Å; I32-A35 PolarHBondContact O-N 3.16Å; I32-I36 HydrophobicContact CG2-CD1 4.26Å; I32-I36 WeakPolarHBondContact O-CG1 3.28Å; I32-I36 PolarHBondContact O-N 3.38Å; I32-V77 HydrophobicContact CG2-CG1 3.71Å; I32-K81 HydrophobicContact CG2-CB 3.75Å; I32-K81 HydrophobicContact CG2-CG 4.48Å; I32-I84 HydrophobicContact CD1-CD1 4.36Å; I32-I84 HydrophobicContact CG1-CD1 3.68Å
33	E	95.3	Very high	96.2	Very high	103 Å²	103	59.7 Å²	59.7	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-42.7	179.5	-63.5	-66.6	-175.8	0	0	112.1	A35 I36 Y37 K81	E33-A35 VanDerWaalsContact C-N 3.31Å; E33-A35 PolarHBondContact O-N 2.98Å; E33-I36 PolarHBondContact O-N 3.03Å; E33-Y37 PolarHBondContact O-N 3.5Å; E33-K81 WeakPolarHBondContact OE1-CE 3.46Å; E33-K81 IonicContact OE1-NZ 2.84Å; E33-K81 PolarHBondContact OE1-NZ 3.46Å; E33-K81 IonicContact OE2-NZ 2.64Å; E33-K81 PolarHBondContact OE2-NZ 3.48Å
34	G	95.8	Very high	96.2	Very high	14 Å²	14	61.9 Å²	61.9	14%	0.144	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-42.7	173.6	0	0	0	0	0	111.6	N31 I32 I36 Y37 Y38	N31-G34 PolarHBondContact OD1-N 3.36Å; I32-G34 PolarHBondContact O-N 3.43Å; G34-I36 PolarHBondContact O-N 3.44Å; G34-Y37 PolarHBondContact O-N 3.44Å; G34-Y38 WeakPolarHBondContact O-CD2 3.35Å; G34-Y38 PolarHBondContact O-N 2.93Å
35	A	97	Very high	96.2	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-44	176.6	0	0	0	0	0	112.3	C26 M27 N31 I32 E33 Y37 Y38 Y39 V77	C26-A35 HydrophobicContact CB-CB 3.89Å; M27-A35 HydrophobicContact CG-CB 3.66Å; M27-A35 HydrophobicContact SD-CB 3.5Å; M27-A35 VanDerWaalsContact SD-CB 3.5Å; N31-A35 PolarHBondContact O-N 3.43Å; N31-A35 VanDerWaalsContact O-N 3.16Å; I32-A35 WeakPolarHBondContact O-CB 3.44Å; I32-A35 PolarHBondContact O-N 3.16Å; E33-A35 VanDerWaalsContact C-N 3.31Å; E33-A35 PolarHBondContact O-N 2.98Å; A35-Y37 VanDerWaalsContact C-N 3.34Å; A35-Y37 PolarHBondContact O-N 3.32Å; A35-Y38 PolarHBondContact O-N 3.45Å; A35-Y39 WeakPolarHBondContact O-CB 3.47Å; A35-Y39 WeakPolarHBondContact O-CD2 3.49Å; A35-Y39 PolarHBondContact O-N 2.96Å; A35-V77 HydrophobicContact CB-CG1 3.91Å
36	I	97.3	Very high	96.2	Very high	13 Å²	13	55 Å²	55	7%	0.067	28%	0.279	C	S	.	.	H	α-helix	trans	-58.8	-46.6	175.6	-67.5	170.9	0	0	0	110.6	I32 E33 G34 Y39 K40 L74 V77 V78 K81	I32-I36 HydrophobicContact CG2-CD1 4.26Å; I32-I36 WeakPolarHBondContact O-CG1 3.28Å; I32-I36 PolarHBondContact O-N 3.38Å; E33-I36 PolarHBondContact O-N 3.03Å; G34-I36 PolarHBondContact O-N 3.44Å; I36-Y39 PolarHBondContact O-N 3.34Å; I36-K40 HydrophobicContact CG2-CD 4.22Å; I36-K40 WeakPolarHBondContact O-CG 3.31Å; I36-K40 PolarHBondContact O-N 2.95Å; I36-L74 HydrophobicContact CB-CD1 4.46Å; I36-L74 HydrophobicContact CG2-CD1 4.08Å; I36-V77 HydrophobicContact CD1-CG1 4.33Å; I36-V77 HydrophobicContact CG1-CB 4.36Å; I36-V77 HydrophobicContact CG1-CG1 3.54Å; I36-V78 HydrophobicContact CD1-CG2 4.1Å; I36-V78 HydrophobicContact CG1-CG2 4.26Å; I36-K81 HydrophobicContact CD1-CB 4.34Å; I36-K81 HydrophobicContact CD1-CD 3.57Å
37	Y	97.6	Very high	96.2	Very high	136 Å²	136	57 Å²	57	53%	0.533	29%	0.287	S	S	.	.	H	α-helix	trans	-58.8	-49.5	179	172.3	-100.7	0	0	0	111.9	E33 G34 A35 K40 K41	E33-Y37 PolarHBondContact O-N 3.5Å; G34-Y37 PolarHBondContact O-N 3.44Å; A35-Y37 VanDerWaalsContact C-N 3.34Å; A35-Y37 PolarHBondContact O-N 3.32Å; Y37-K40 PolarHBondContact O-N 2.93Å; Y37-K41 PolarHBondContact O-N 2.9Å
38	Y	98	Very high	96.3	Very high	71 Å²	71	58.2 Å²	58.2	28%	0.278	29%	0.294	S	S	.	.	H	α-helix	trans	-69.1	-37	-179.3	-75	-64	0	0	0	113.1	N19 C22 G34 A35 K41 S42	N19-Y38 HydrophobicContact CB-CD1 4.47Å; N19-Y38 WeakPolarHBondContact OD1-CD1 3.4Å; C22-Y38 HydrophobicContact CB-CD1 3.7Å; C22-Y38 HydrophobicContact CB-CD2 3.93Å; C22-Y38 HydrophobicContact CB-CE1 3.86Å; C22-Y38 HydrophobicContact CB-CE2 4.1Å; C22-Y38 HydrophobicContact CB-CG 3.75Å; G34-Y38 WeakPolarHBondContact O-CD2 3.35Å; G34-Y38 PolarHBondContact O-N 2.93Å; A35-Y38 PolarHBondContact O-N 3.45Å; Y38-K41 PolarHBondContact O-N 3.37Å; Y38-S42 WeakPolarHBondContact O-CB 3.39Å; Y38-S42 PolarHBondContact O-N 2.96Å
39	Y	98.1	Very high	96.3	Very high	14 Å²	14	50.6 Å²	50.6	6%	0.055	26%	0.262	C	S	.	.	H	α-helix	trans	-64.1	-42.4	173.9	-82.1	-56.2	0	0	0	112	E20 A23 M27 A35 I36 K41 S42 I43 L70 V77	E20-Y39 HydrophobicContact CG-CE1 4.34Å; A23-Y39 HydrophobicContact CB-CD1 3.86Å; A23-Y39 HydrophobicContact CB-CD2 3.68Å; A23-Y39 HydrophobicContact CB-CE1 3.81Å; A23-Y39 HydrophobicContact CB-CE2 3.63Å; A23-Y39 HydrophobicContact CB-CG 3.77Å; M27-Y39 HydrophobicContact CG-CE2 4.49Å; A35-Y39 WeakPolarHBondContact O-CB 3.47Å; A35-Y39 WeakPolarHBondContact O-CD2 3.49Å; A35-Y39 PolarHBondContact O-N 2.96Å; I36-Y39 PolarHBondContact O-N 3.34Å; Y39-K41 VanDerWaalsContact C-N 3.31Å; Y39-K41 PolarHBondContact O-N 3.3Å; Y39-S42 PolarHBondContact O-N 3.27Å; Y39-I43 VanDerWaalsContact O-CG1 3.31Å; Y39-I43 WeakPolarHBondContact O-CG1 3.4Å; Y39-I43 PolarHBondContact O-N 3.05Å; Y39-L70 HydrophobicContact CD1-CD2 4.06Å; Y39-L70 HydrophobicContact CE1-CD2 4.24Å; Y39-V77 HydrophobicContact CD2-CG2 3.75Å; Y39-V77 HydrophobicContact CE2-CG2 3.45Å; Y39-V77 VanDerWaalsContact CE2-CG2 3.45Å
40	K	98	Very high	96.3	Very high	128 Å²	128	49.1 Å²	49.1	56%	0.557	25%	0.245	S	C	*	.	H	α-helix	trans	-58.8	-44	173.8	-75.1	179.6	176.6	-174.5	0	111.8	I36 Y37 I43 A44 L74	I36-K40 HydrophobicContact CG2-CD 4.22Å; I36-K40 WeakPolarHBondContact O-CG 3.31Å; I36-K40 PolarHBondContact O-N 2.95Å; Y37-K40 PolarHBondContact O-N 2.93Å; K40-I43 PolarHBondContact O-N 3.17Å; K40-A44 PolarHBondContact O-N 2.86Å; K40-L74 HydrophobicContact CG-CD1 4.2Å; K40-L74 HydrophobicContact CG-CD2 4.17Å
41	K	97.6	Very high	96.4	Very high	79 Å²	79	53.9 Å²	53.9	34%	0.343	26%	0.255	S	S	.	.	H	α-helix	trans	-65.4	-39.7	177.3	-172.6	166.1	173.4	177.4	0	112.3	N19 Y37 Y38 Y39 A44 F45	N19-K41 VanDerWaalsContact OD1-CD 3.28Å; N19-K41 WeakPolarHBondContact OD1-CD 3.3Å; Y37-K41 PolarHBondContact O-N 2.9Å; Y38-K41 PolarHBondContact O-N 3.37Å; Y39-K41 VanDerWaalsContact C-N 3.31Å; Y39-K41 PolarHBondContact O-N 3.3Å; K41-A44 PolarHBondContact O-N 3.42Å; K41-F45 HydrophobicContact CD-CE2 4.24Å; K41-F45 HydrophobicContact CG-CD2 3.98Å; K41-F45 HydrophobicContact CG-CE2 3.63Å; K41-F45 WeakPolarHBondContact O-CD2 3.47Å; K41-F45 PolarHBondContact O-N 2.69Å; K41-F45 VanDerWaalsContact O-N 3.13Å
42	S	97.3	Very high	96.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-44.8	175	-175.6	0	0	0	0	111.8	A16 Y38 Y39 A44 F45 M46 L70	A16-S42 WeakPolarHBondContact O-CB 3.35Å; A16-S42 PolarHBondContact O-OG 2.96Å; Y38-S42 WeakPolarHBondContact O-CB 3.39Å; Y38-S42 PolarHBondContact O-N 2.96Å; Y39-S42 PolarHBondContact O-N 3.27Å; S42-A44 PolarHBondContact O-N 3.37Å; S42-F45 PolarHBondContact O-N 3.07Å; S42-M46 WeakPolarHBondContact O-CB 3.37Å; S42-M46 PolarHBondContact O-N 2.92Å; S42-L70 WeakPolarHBondContact OG-CD1 3.42Å
43	I	98	Very high	96.1	Very high	14 Å²	14	56.2 Å²	56.2	7%	0.072	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-45.6	175.7	-68.5	164.3	0	0	0	110.8	Y39 K40 F45 M46 E47 L67 L70 K71 L74	Y39-I43 VanDerWaalsContact O-CG1 3.31Å; Y39-I43 WeakPolarHBondContact O-CG1 3.4Å; Y39-I43 PolarHBondContact O-N 3.05Å; K40-I43 PolarHBondContact O-N 3.17Å; I43-F45 VanDerWaalsContact C-N 3.34Å; I43-F45 PolarHBondContact O-N 3.49Å; I43-M46 PolarHBondContact O-N 3.2Å; I43-M46 VanDerWaalsContact O-N 3.15Å; I43-E47 HydrophobicContact CG2-CG 4.39Å; I43-E47 WeakPolarHBondContact O-CG 3.28Å; I43-E47 PolarHBondContact O-N 3.05Å; I43-L67 HydrophobicContact CG2-CD2 4.47Å; I43-L70 HydrophobicContact CD1-CB 4.39Å; I43-L70 HydrophobicContact CG1-CB 3.73Å; I43-L70 HydrophobicContact CG1-CD1 4.5Å; I43-K71 HydrophobicContact CD1-CG 4.04Å; I43-L74 HydrophobicContact CD1-CB 4.22Å; I43-L74 HydrophobicContact CD1-CD2 3.77Å
44	A	97.6	Very high	95.9	Very high	47 Å²	47	58.5 Å²	58.5	39%	0.388	28%	0.276	S	S	.	.	H	α-helix	trans	-59.4	-43.3	179.1	0	0	0	0	0	112.2	K40 K41 S42 E47 L48	K40-A44 PolarHBondContact O-N 2.86Å; K41-A44 PolarHBondContact O-N 3.42Å; S42-A44 PolarHBondContact O-N 3.37Å; A44-E47 PolarHBondContact O-N 2.92Å; A44-L48 WeakPolarHBondContact O-CG 3.48Å; A44-L48 PolarHBondContact O-N 3.43Å; A44-L48 VanDerWaalsContact O-N 3.11Å
45	F	97.3	Very high	95.4	Very high	53 Å²	53	65.9 Å²	65.9	23%	0.232	31%	0.306	C	S	.	.	H	α-helix	trans	-68.9	-35.7	175.4	-75.5	-60.9	0	0	0	113.1	N12 A15 A16 K41 S42 I43 E47 L48 T49	N12-F45 WeakPolarHBondContact OD1-CD1 3.41Å; A15-F45 HydrophobicContact CB-CB 4.43Å; A15-F45 HydrophobicContact CB-CD1 3.93Å; A15-F45 HydrophobicContact CB-CD2 3.83Å; A15-F45 HydrophobicContact CB-CE1 4.09Å; A15-F45 HydrophobicContact CB-CE2 3.97Å; A15-F45 HydrophobicContact CB-CG 3.81Å; A15-F45 HydrophobicContact CB-CZ 4.11Å; A16-F45 HydrophobicContact CB-CB 3.76Å; K41-F45 HydrophobicContact CD-CE2 4.24Å; K41-F45 HydrophobicContact CG-CD2 3.98Å; K41-F45 HydrophobicContact CG-CE2 3.63Å; K41-F45 WeakPolarHBondContact O-CD2 3.47Å; K41-F45 PolarHBondContact O-N 2.69Å; K41-F45 VanDerWaalsContact O-N 3.13Å; S42-F45 PolarHBondContact O-N 3.07Å; I43-F45 VanDerWaalsContact C-N 3.34Å; I43-F45 PolarHBondContact O-N 3.49Å; F45-E47 VanDerWaalsContact C-N 3.31Å; F45-L48 HydrophobicContact CD1-CD1 4.09Å; F45-L48 WeakPolarHBondContact O-CB 3.1Å; F45-L48 PolarHBondContact O-N 3.21Å; F45-T49 PolarHBondContact O-N 3.37Å; F45-T49 PolarHBondContact O-OG1 3.36Å
46	M	96.6	Very high	94.9	Very high	1 Å²	1	69.3 Å²	69.3	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-67.2	-34.7	175.9	-165.2	62.7	72.6	0	0	111.8	L13 A16 S42 I43 T49 R50 I63 Q66 L67 L70	L13-M46 HydrophobicContact CD1-CE 3.92Å; L13-M46 HydrophobicContact CD1-SD 3.98Å; A16-M46 HydrophobicContact CB-CB 4.34Å; A16-M46 HydrophobicContact CB-CE 3.83Å; S42-M46 WeakPolarHBondContact O-CB 3.37Å; S42-M46 PolarHBondContact O-N 2.92Å; I43-M46 PolarHBondContact O-N 3.2Å; I43-M46 VanDerWaalsContact O-N 3.15Å; M46-T49 PolarHBondContact O-N 3.31Å; M46-R50 PolarHBondContact O-N 3.31Å; M46-I63 HydrophobicContact CG-CG2 4.01Å; M46-I63 HydrophobicContact SD-CG2 3.83Å; M46-Q66 HydrophobicContact CE-CB 4.07Å; M46-Q66 VanDerWaalsContact CE-OE1 3.31Å; M46-Q66 HydrophobicContact SD-CB 4.4Å; M46-L67 HydrophobicContact CG-CB 4.03Å; M46-L67 HydrophobicContact CG-CG 4.25Å; M46-L70 HydrophobicContact CB-CD1 4.2Å; M46-L70 HydrophobicContact CE-CD1 4.14Å; M46-L70 HydrophobicContact CG-CD1 4.38Å
47	E	96.6	Very high	94.6	Very high	62 Å²	62	72.6 Å²	72.6	29%	0.29	36%	0.359	S	S	.	.	H	α-helix	trans	-64.2	-41.2	171.9	-76.6	173.2	166.6	0	0	111.1	I43 A44 F45 R50 E51 L67 K71	I43-E47 HydrophobicContact CG2-CG 4.39Å; I43-E47 WeakPolarHBondContact O-CG 3.28Å; I43-E47 PolarHBondContact O-N 3.05Å; A44-E47 PolarHBondContact O-N 2.92Å; F45-E47 VanDerWaalsContact C-N 3.31Å; E47-R50 WeakPolarHBondContact O-CB 3.48Å; E47-R50 PolarHBondContact O-N 2.95Å; E47-E51 WeakPolarHBondContact O-CG 3.27Å; E47-E51 PolarHBondContact O-N 3.38Å; E47-E51 VanDerWaalsContact O-N 3.13Å; E47-L67 HydrophobicContact CG-CD1 3.73Å; E47-L67 HydrophobicContact CG-CG 4.39Å; E47-K71 IonicContact OE1-NZ 2.63Å; E47-K71 PolarHBondContact OE1-NZ 2.92Å
48	L	95.4	Very high	94.3	Very high	70 Å²	70	73 Å²	73	37%	0.366	37%	0.366	S	S	.	.	H	α-helix	trans	-64.1	-43	172.2	-67.4	172.4	0	0	0	112.4	N12 A44 F45 R50 E51 E52	N12-L48 HydrophobicContact CB-CB 4.24Å; A44-L48 WeakPolarHBondContact O-CG 3.48Å; A44-L48 PolarHBondContact O-N 3.43Å; A44-L48 VanDerWaalsContact O-N 3.11Å; F45-L48 HydrophobicContact CD1-CD1 4.09Å; F45-L48 WeakPolarHBondContact O-CB 3.1Å; F45-L48 PolarHBondContact O-N 3.21Å; L48-R50 PolarHBondContact O-N 2.89Å; L48-E51 WeakPolarHBondContact O-CB 3.48Å; L48-E51 PolarHBondContact O-N 2.64Å; L48-E51 VanDerWaalsContact O-N 3.1Å; L48-E52 PolarHBondContact O-N 3.06Å
49	T	94.3	Very high	94.1	Very high	7 Å²	7	74.1 Å²	74.1	4%	0.043	38%	0.376	C	S	.	.	H	α-helix	trans	-60.4	-36.5	174.9	-55.4	0	0	0	0	111.4	N12 L13 F45 M46 E51 E52 I63	N12-T49 VanDerWaalsContact C-OG1 3.25Å; N12-T49 WeakPolarHBondContact CB-OG1 3.49Å; L13-T49 HydrophobicContact CB-CG2 3.88Å; L13-T49 HydrophobicContact CD1-CG2 4.26Å; L13-T49 HydrophobicContact CG-CG2 4.49Å; L13-T49 PolarHBondContact N-OG1 3.48Å; L13-T49 VanDerWaalsContact N-OG1 3.08Å; F45-T49 PolarHBondContact O-N 3.37Å; F45-T49 PolarHBondContact O-OG1 3.36Å; M46-T49 PolarHBondContact O-N 3.31Å; T49-E51 VanDerWaalsContact C-N 3.32Å; T49-E51 PolarHBondContact O-N 2.88Å; T49-E52 WeakPolarHBondContact O-CB 2.96Å; T49-E52 PolarHBondContact O-N 2.98Å; T49-I63 HydrophobicContact CG2-CD1 3.75Å; T49-I63 HydrophobicContact CG2-CG1 4.25Å
50	R	94.7	Very high	93.9	Very high	69 Å²	69	75.8 Å²	75.8	26%	0.26	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-35.6	175.7	-169.4	179.3	61.7	179.8	1.5	112.5	M46 E47 L48 E52 V53 Y60 I63 D64	M46-R50 PolarHBondContact O-N 3.31Å; E47-R50 WeakPolarHBondContact O-CB 3.48Å; E47-R50 PolarHBondContact O-N 2.95Å; L48-R50 PolarHBondContact O-N 2.89Å; R50-E52 PolarHBondContact O-N 2.92Å; R50-V53 PolarHBondContact O-N 3.29Å; R50-Y60 HydrophobicContact CG-CD2 4.11Å; R50-Y60 HydrophobicContact CG-CE2 3.67Å; R50-I63 HydrophobicContact CB-CG2 3.67Å; R50-I63 HydrophobicContact CG-CG2 4.17Å; R50-D64 WeakPolarHBondContact CD-OD1 3.09Å; R50-D64 IonicContact CZ-OD1 3.34Å; R50-D64 IonicContact NE-OD1 3.08Å; R50-D64 IonicContact NH1-OD1 2.74Å; R50-D64 PolarHBondContact NH1-OD1 3.48Å
51	E	93.6	Very high	93.8	Very high	148 Å²	148	74.3 Å²	74.3	69%	0.692	38%	0.384	S	S	*	.	H	α-helix	trans	-69	-23.5	175.9	-69.4	171.7	-169	0	0	112.7	E47 L48 T49 V53	E47-E51 WeakPolarHBondContact O-CG 3.27Å; E47-E51 PolarHBondContact O-N 3.38Å; E47-E51 VanDerWaalsContact O-N 3.13Å; L48-E51 WeakPolarHBondContact O-CB 3.48Å; L48-E51 PolarHBondContact O-N 2.64Å; L48-E51 VanDerWaalsContact O-N 3.1Å; T49-E51 VanDerWaalsContact C-N 3.32Å; T49-E51 PolarHBondContact O-N 2.88Å; E51-V53 VanDerWaalsContact C-N 3.34Å
52	E	91.1	Very high	93.7	Very high	119 Å²	119	73.6 Å²	73.6	56%	0.556	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-15.4	176.3	-67.4	172.7	161.7	0	0	113.4	N12 L48 T49 R50	N12-E52 PolarHBondContact ND2-OE1 2.96Å; L48-E52 PolarHBondContact O-N 3.06Å; T49-E52 WeakPolarHBondContact O-CB 2.96Å; T49-E52 PolarHBondContact O-N 2.98Å; R50-E52 PolarHBondContact O-N 2.92Å
53	V	91.8	Very high	93.6	Very high	33 Å²	33	74 Å²	74	20%	0.2	39%	0.386	C	S	.	.	S	Bend	trans	-109.1	139.4	-175.4	180	0	0	0	0	111	R50 E51 D57 D59 I63	R50-V53 PolarHBondContact O-N 3.29Å; E51-V53 VanDerWaalsContact C-N 3.34Å; V53-D57 HydrophobicContact CG1-CB 3.94Å; V53-D59 HydrophobicContact CG1-CB 4.07Å; V53-I63 HydrophobicContact CB-CD1 4.23Å; V53-I63 HydrophobicContact CG2-CD1 3.58Å
54	E	90.6	Very high	93.5	Very high	151 Å²	151	75.9 Å²	75.9	71%	0.706	40%	0.396	S	S	*	.			trans	-70.5	138.7	179.9	-64.1	-172.3	180	0	0	112	G56 D57	E54-G56 PolarHBondContact O-N 3.15Å; E54-D57 PolarHBondContact O-N 2.86Å
55	E	85.8	Confident	93.4	Very high	169 Å²	169	79.5 Å²	79.5	79%	0.79	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	98.3	176.9	-170.6	176	-175.7	0	0	109.7	Y60	E55-Y60 HydrophobicContact CB-CE2 4.23Å; E55-Y60 HydrophobicContact CG-CE1 4.42Å; E55-Y60 HydrophobicContact CG-CE2 4.38Å
56	G	86.2	Confident	93.4	Very high	72 Å²	72	80 Å²	80	74%	0.742	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	142.1	-19.3	-176.2	0	0	0	0	0	113.8	E54	E54-G56 PolarHBondContact O-N 3.15Å
57	D	91	Very high	93.4	Very high	81 Å²	81	80.1 Å²	80.1	43%	0.433	41%	0.412	S	S	.	.	S	Bend	trans	-73.4	153.4	176.4	-77.5	-22.9	0	0	0	112.3	V53 E54 D59 Y60	V53-D57 HydrophobicContact CG1-CB 3.94Å; E54-D57 PolarHBondContact O-N 2.86Å; D57-D59 PolarHBondContact O-N 3.4Å; D57-Y60 WeakPolarHBondContact O-CB 3.31Å; D57-Y60 PolarHBondContact O-N 3.03Å; D57-Y60 VanDerWaalsContact O-N 3.16Å
58	H	91.8	Very high	93.5	Very high	145 Å²	145	80.2 Å²	80.2	67%	0.671	42%	0.42	S	S	*	.	H	α-helix	trans	-59.9	-35.5	176.5	-171	49.9	0	0	0	111.7	Y60 V61 I62	H58-Y60 VanDerWaalsContact C-N 3.29Å; H58-Y60 PolarHBondContact O-N 3.5Å; H58-V61 PolarHBondContact O-N 3.05Å; H58-I62 WeakPolarHBondContact O-CG1 3.09Å; H58-I62 PolarHBondContact O-N 3.01Å
59	D	92.5	Very high	93.5	Very high	94 Å²	94	80 Å²	80	50%	0.503	42%	0.423	S	S	.	.	H	α-helix	trans	-65.2	-33	179.6	-66	-18.4	0	0	0	111.9	V53 D57 V61 I62 I63	V53-D59 HydrophobicContact CG1-CB 4.07Å; D57-D59 PolarHBondContact O-N 3.4Å; D59-V61 VanDerWaalsContact C-N 3.33Å; D59-V61 PolarHBondContact O-N 3.43Å; D59-I62 PolarHBondContact O-N 3.4Å; D59-I63 WeakPolarHBondContact O-CB 3.45Å; D59-I63 WeakPolarHBondContact O-CD1 3.17Å; D59-I63 VanDerWaalsContact O-CG1 3.25Å; D59-I63 WeakPolarHBondContact O-CG1 3.46Å; D59-I63 PolarHBondContact O-N 3.25Å
60	Y	94.8	Very high	93.7	Very high	49 Å²	49	79.8 Å²	79.8	19%	0.192	42%	0.422	C	S	.	.	H	α-helix	trans	-58.6	-46.5	175.6	-171.6	-84.4	0	0	0	111	R50 E55 D57 H58 I62 I63 D64	R50-Y60 HydrophobicContact CG-CD2 4.11Å; R50-Y60 HydrophobicContact CG-CE2 3.67Å; E55-Y60 HydrophobicContact CB-CE2 4.23Å; E55-Y60 HydrophobicContact CG-CE1 4.42Å; E55-Y60 HydrophobicContact CG-CE2 4.38Å; D57-Y60 WeakPolarHBondContact O-CB 3.31Å; D57-Y60 PolarHBondContact O-N 3.03Å; D57-Y60 VanDerWaalsContact O-N 3.16Å; H58-Y60 VanDerWaalsContact C-N 3.29Å; H58-Y60 PolarHBondContact O-N 3.5Å; Y60-I62 VanDerWaalsContact C-N 3.33Å; Y60-I62 PolarHBondContact O-N 2.92Å; Y60-I63 PolarHBondContact O-N 3.39Å; Y60-D64 WeakPolarHBondContact CE1-OD2 3.41Å; Y60-D64 WeakPolarHBondContact O-CB 3.45Å; Y60-D64 PolarHBondContact O-N 3.32Å
61	V	94.8	Very high	93.8	Very high	97 Å²	97	81.1 Å²	81.1	59%	0.588	43%	0.43	S	S	*	.	H	α-helix	trans	-64.9	-38.2	178.9	-178	0	0	0	0	111.3	H58 D59 L65	H58-V61 PolarHBondContact O-N 3.05Å; D59-V61 VanDerWaalsContact C-N 3.33Å; D59-V61 PolarHBondContact O-N 3.43Å; V61-L65 WeakPolarHBondContact O-CB 3.47Å; V61-L65 PolarHBondContact O-N 3.4Å
62	I	95.4	Very high	94	Very high	65 Å²	65	79.7 Å²	79.7	33%	0.333	43%	0.427	S	S	.	.	H	α-helix	trans	-65.5	-47.4	177.3	-65.2	168.1	0	0	0	110.3	H58 D59 Y60 L65 Q66	H58-I62 WeakPolarHBondContact O-CG1 3.09Å; H58-I62 PolarHBondContact O-N 3.01Å; D59-I62 PolarHBondContact O-N 3.4Å; Y60-I62 VanDerWaalsContact C-N 3.33Å; Y60-I62 PolarHBondContact O-N 2.92Å; I62-L65 PolarHBondContact O-N 3.28Å; I62-Q66 WeakPolarHBondContact O-CG 3.42Å; I62-Q66 PolarHBondContact O-N 3.45Å
63	I	95.7	Very high	94.2	Very high	9 Å²	9	75.1 Å²	75.1	5%	0.046	41%	0.407	C	S	.	.	H	α-helix	trans	-61.5	-46.1	179.4	-70.2	160.6	0	0	0	110.2	M46 T49 R50 V53 D59 Y60 L65 Q66 L67	M46-I63 HydrophobicContact CG-CG2 4.01Å; M46-I63 HydrophobicContact SD-CG2 3.83Å; T49-I63 HydrophobicContact CG2-CD1 3.75Å; T49-I63 HydrophobicContact CG2-CG1 4.25Å; R50-I63 HydrophobicContact CB-CG2 3.67Å; R50-I63 HydrophobicContact CG-CG2 4.17Å; V53-I63 HydrophobicContact CB-CD1 4.23Å; V53-I63 HydrophobicContact CG2-CD1 3.58Å; D59-I63 WeakPolarHBondContact O-CB 3.45Å; D59-I63 WeakPolarHBondContact O-CD1 3.17Å; D59-I63 VanDerWaalsContact O-CG1 3.25Å; D59-I63 WeakPolarHBondContact O-CG1 3.46Å; D59-I63 PolarHBondContact O-N 3.25Å; Y60-I63 PolarHBondContact O-N 3.39Å; I63-L65 VanDerWaalsContact C-N 3.33Å; I63-L65 PolarHBondContact O-N 2.98Å; I63-Q66 PolarHBondContact O-N 3.38Å; I63-L67 VanDerWaalsContact O-CB 3.31Å; I63-L67 WeakPolarHBondContact O-CB 3.47Å; I63-L67 PolarHBondContact O-N 3.45Å
64	D	95.7	Very high	94.5	Very high	53 Å²	53	75 Å²	75	28%	0.283	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-39.6	177.6	-96	-13.2	0	0	0	112.5	R50 Y60 L67 S68	R50-D64 WeakPolarHBondContact CD-OD1 3.09Å; R50-D64 IonicContact CZ-OD1 3.34Å; R50-D64 IonicContact NE-OD1 3.08Å; R50-D64 IonicContact NH1-OD1 2.74Å; R50-D64 PolarHBondContact NH1-OD1 3.48Å; Y60-D64 WeakPolarHBondContact CE1-OD2 3.41Å; Y60-D64 WeakPolarHBondContact O-CB 3.45Å; Y60-D64 PolarHBondContact O-N 3.32Å; D64-L67 PolarHBondContact O-N 3.47Å; D64-S68 PolarHBondContact O-N 2.91Å
65	L	96.5	Very high	94.7	Very high	122 Å²	122	71.2 Å²	71.2	64%	0.639	40%	0.396	S	S	*	.	H	α-helix	trans	-62.6	-45.6	174.2	-179.9	62.2	0	0	0	111.1	V61 I62 I63 L67 S68 S69	V61-L65 WeakPolarHBondContact O-CB 3.47Å; V61-L65 PolarHBondContact O-N 3.4Å; I62-L65 PolarHBondContact O-N 3.28Å; I63-L65 VanDerWaalsContact C-N 3.33Å; I63-L65 PolarHBondContact O-N 2.98Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L65-L67 PolarHBondContact O-N 3.21Å; L65-S68 PolarHBondContact O-N 3.5Å; L65-S68 PolarHBondContact O-OG 3Å; L65-S69 PolarHBondContact O-N 3.28Å
66	Q	96.5	Very high	95.2	Very high	63 Å²	63	67.7 Å²	67.7	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-62.2	-41.5	176.4	-71	-179.2	-13.4	0	0	111.8	M46 I62 I63 S68 S69 L70	M46-Q66 HydrophobicContact CE-CB 4.07Å; M46-Q66 VanDerWaalsContact CE-OE1 3.31Å; M46-Q66 HydrophobicContact SD-CB 4.4Å; I62-Q66 WeakPolarHBondContact O-CG 3.42Å; I62-Q66 PolarHBondContact O-N 3.45Å; I63-Q66 PolarHBondContact O-N 3.38Å; Q66-S68 PolarHBondContact O-N 3.11Å; Q66-S69 WeakPolarHBondContact O-CB 3.49Å; Q66-S69 PolarHBondContact O-N 3.01Å; Q66-L70 WeakPolarHBondContact O-CG 3.33Å; Q66-L70 PolarHBondContact O-N 3.43Å
67	L	97.2	Very high	95.6	Very high	5 Å²	5	64.4 Å²	64.4	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-44.4	176.6	-158.1	172.8	0	0	0	110.8	I43 M46 E47 I63 D64 L65 S69 L70 K71	I43-L67 HydrophobicContact CG2-CD2 4.47Å; M46-L67 HydrophobicContact CG-CB 4.03Å; M46-L67 HydrophobicContact CG-CG 4.25Å; E47-L67 HydrophobicContact CG-CD1 3.73Å; E47-L67 HydrophobicContact CG-CG 4.39Å; I63-L67 VanDerWaalsContact O-CB 3.31Å; I63-L67 WeakPolarHBondContact O-CB 3.47Å; I63-L67 PolarHBondContact O-N 3.45Å; D64-L67 PolarHBondContact O-N 3.47Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L65-L67 PolarHBondContact O-N 3.21Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 2.95Å; L67-L70 PolarHBondContact O-N 3.25Å; L67-K71 HydrophobicContact CD2-CD 3.46Å; L67-K71 VanDerWaalsContact CD2-CD 3.46Å; L67-K71 HydrophobicContact CD2-CG 3.98Å; L67-K71 WeakPolarHBondContact O-CG 3.36Å; L67-K71 PolarHBondContact O-N 3.16Å
68	S	97.3	Very high	95.7	Very high	64 Å²	64	63.5 Å²	63.5	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-40.3	175.3	78.7	0	0	0	0	112.5	D64 L65 Q66 K71 L72	D64-S68 PolarHBondContact O-N 2.91Å; L65-S68 PolarHBondContact O-N 3.5Å; L65-S68 PolarHBondContact O-OG 3Å; Q66-S68 PolarHBondContact O-N 3.11Å; S68-K71 PolarHBondContact O-N 2.93Å; S68-L72 PolarHBondContact O-N 2.98Å
69	S	97	Very high	95.7	Very high	64 Å²	64	59 Å²	59	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-41.6	176.3	-177	0	0	0	0	112.3	L65 Q66 L67 L72 S73	L65-S69 PolarHBondContact O-N 3.28Å; Q66-S69 WeakPolarHBondContact O-CB 3.49Å; Q66-S69 PolarHBondContact O-N 3.01Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 2.95Å; S69-L72 PolarHBondContact O-N 2.95Å; S69-S73 WeakPolarHBondContact O-CB 3.45Å; S69-S73 PolarHBondContact O-N 3.48Å; S69-S73 PolarHBondContact O-OG 2.89Å
70	L	97.5	Very high	95.6	Very high	4 Å²	4	57.8 Å²	57.8	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-41.9	174.6	-72.9	170	0	0	0	111.8	E20 Y39 S42 I43 M46 Q66 L67 S73 L74	E20-L70 HydrophobicContact CB-CD2 4.21Å; E20-L70 HydrophobicContact CG-CD2 3.75Å; Y39-L70 HydrophobicContact CD1-CD2 4.06Å; Y39-L70 HydrophobicContact CE1-CD2 4.24Å; S42-L70 WeakPolarHBondContact OG-CD1 3.42Å; I43-L70 HydrophobicContact CD1-CB 4.39Å; I43-L70 HydrophobicContact CG1-CB 3.73Å; I43-L70 HydrophobicContact CG1-CD1 4.5Å; M46-L70 HydrophobicContact CB-CD1 4.2Å; M46-L70 HydrophobicContact CE-CD1 4.14Å; M46-L70 HydrophobicContact CG-CD1 4.38Å; Q66-L70 WeakPolarHBondContact O-CG 3.33Å; Q66-L70 PolarHBondContact O-N 3.43Å; L67-L70 PolarHBondContact O-N 3.25Å; L70-S73 PolarHBondContact O-N 3.39Å; L70-L74 WeakPolarHBondContact O-CB 3.31Å; L70-L74 PolarHBondContact O-N 3.36Å
71	K	97.7	Very high	95.3	Very high	96 Å²	96	58.5 Å²	58.5	42%	0.417	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-41.6	175.4	-77.9	176.7	172.1	164.2	0	111.8	I43 E47 L67 S68 L74 S75	I43-K71 HydrophobicContact CD1-CG 4.04Å; E47-K71 IonicContact OE1-NZ 2.63Å; E47-K71 PolarHBondContact OE1-NZ 2.92Å; L67-K71 HydrophobicContact CD2-CD 3.46Å; L67-K71 VanDerWaalsContact CD2-CD 3.46Å; L67-K71 HydrophobicContact CD2-CG 3.98Å; L67-K71 WeakPolarHBondContact O-CG 3.36Å; L67-K71 PolarHBondContact O-N 3.16Å; S68-K71 PolarHBondContact O-N 2.93Å; K71-L74 PolarHBondContact O-N 3.3Å; K71-S75 PolarHBondContact O-N 2.83Å
72	L	97.1	Very high	94.8	Very high	119 Å²	119	57.5 Å²	57.5	62%	0.623	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-44.9	174.3	-175.4	143.4	0	0	0	111.6	S68 S69 L74 S75 E76	S68-L72 PolarHBondContact O-N 2.98Å; S69-L72 PolarHBondContact O-N 2.95Å; L72-L74 VanDerWaalsContact C-N 3.33Å; L72-L74 PolarHBondContact O-N 2.67Å; L72-S75 WeakPolarHBondContact O-CB 3.41Å; L72-S75 PolarHBondContact O-N 3.22Å; L72-S75 VanDerWaalsContact O-N 3.16Å; L72-E76 PolarHBondContact O-N 3.45Å
73	S	96.2	Very high	94.1	Very high	22 Å²	22	60.6 Å²	60.6	15%	0.154	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-42.3	177	-59.2	0	0	0	0	111.7	S69 L70 E76 V77	S69-S73 WeakPolarHBondContact O-CB 3.45Å; S69-S73 PolarHBondContact O-N 3.48Å; S69-S73 PolarHBondContact O-OG 2.89Å; L70-S73 PolarHBondContact O-N 3.39Å; S73-E76 PolarHBondContact O-N 3.23Å; S73-V77 WeakPolarHBondContact O-CG2 3.22Å; S73-V77 PolarHBondContact O-N 3.26Å
74	L	96.8	Very high	93.1	Very high	31 Å²	31	64.6 Å²	64.6	16%	0.162	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-44.7	174.5	179.3	66.7	0	0	0	111.4	I36 K40 I43 L70 K71 L72 E76 V77 V78	I36-L74 HydrophobicContact CB-CD1 4.46Å; I36-L74 HydrophobicContact CG2-CD1 4.08Å; K40-L74 HydrophobicContact CG-CD1 4.2Å; K40-L74 HydrophobicContact CG-CD2 4.17Å; I43-L74 HydrophobicContact CD1-CB 4.22Å; I43-L74 HydrophobicContact CD1-CD2 3.77Å; L70-L74 WeakPolarHBondContact O-CB 3.31Å; L70-L74 PolarHBondContact O-N 3.36Å; K71-L74 PolarHBondContact O-N 3.3Å; L72-L74 VanDerWaalsContact C-N 3.33Å; L72-L74 PolarHBondContact O-N 2.67Å; L74-E76 VanDerWaalsContact C-N 3.33Å; L74-E76 PolarHBondContact O-N 3.19Å; L74-V77 PolarHBondContact O-N 3.41Å; L74-V78 HydrophobicContact CD1-CG2 4.39Å; L74-V78 VanDerWaalsContact O-CG2 3.31Å; L74-V78 WeakPolarHBondContact O-CG2 3.37Å; L74-V78 PolarHBondContact O-N 3.19Å
75	S	96.2	Very high	91.9	Very high	72 Å²	72	68 Å²	68	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-60.2	-41.3	176.9	-175	0	0	0	0	112.2	K71 L72 V78 S79	K71-S75 PolarHBondContact O-N 2.83Å; L72-S75 WeakPolarHBondContact O-CB 3.41Å; L72-S75 PolarHBondContact O-N 3.22Å; L72-S75 VanDerWaalsContact O-N 3.16Å; S75-V78 PolarHBondContact O-N 2.93Å; S75-S79 WeakPolarHBondContact O-CB 3.47Å; S75-S79 PolarHBondContact O-N 3.18Å; S75-S79 PolarHBondContact O-OG 3.29Å
76	E	94.8	Very high	90.3	Very high	94 Å²	94	67.3 Å²	67.3	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-44.7	176.1	-171	-168.9	154.9	0	0	111.4	L72 S73 L74 V78 S79 K80	L72-E76 PolarHBondContact O-N 3.45Å; S73-E76 PolarHBondContact O-N 3.23Å; L74-E76 VanDerWaalsContact C-N 3.33Å; L74-E76 PolarHBondContact O-N 3.19Å; E76-V78 PolarHBondContact O-N 3.35Å; E76-S79 WeakPolarHBondContact O-CB 3.47Å; E76-S79 PolarHBondContact O-N 2.95Å; E76-K80 WeakPolarHBondContact O-CG 3.43Å; E76-K80 PolarHBondContact O-N 3.44Å; E76-K80 VanDerWaalsContact OE1-CE 3.27Å; E76-K80 WeakPolarHBondContact OE1-CE 3.46Å; E76-K80 IonicContact OE1-NZ 3.38Å; E76-K80 PolarHBondContact OE1-NZ 2.87Å
77	V	94	Very high	88.2	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.018	38%	0.379	C	S	.	.	H	α-helix	trans	-64.7	-41.5	179	-179	0	0	0	0	111.2	M27 I32 A35 I36 Y39 S73 L74 S79 K80 K81	M27-V77 HydrophobicContact CE-CG2 3.99Å; M27-V77 HydrophobicContact CG-CG2 4.31Å; M27-V77 HydrophobicContact SD-CB 4.26Å; M27-V77 HydrophobicContact SD-CG1 3.71Å; M27-V77 HydrophobicContact SD-CG2 3.68Å; I32-V77 HydrophobicContact CG2-CG1 3.71Å; A35-V77 HydrophobicContact CB-CG1 3.91Å; I36-V77 HydrophobicContact CD1-CG1 4.33Å; I36-V77 HydrophobicContact CG1-CB 4.36Å; I36-V77 HydrophobicContact CG1-CG1 3.54Å; Y39-V77 HydrophobicContact CD2-CG2 3.75Å; Y39-V77 HydrophobicContact CE2-CG2 3.45Å; Y39-V77 VanDerWaalsContact CE2-CG2 3.45Å; S73-V77 WeakPolarHBondContact O-CG2 3.22Å; S73-V77 PolarHBondContact O-N 3.26Å; L74-V77 PolarHBondContact O-N 3.41Å; V77-S79 VanDerWaalsContact C-N 3.32Å; V77-K80 PolarHBondContact O-N 3.04Å; V77-K81 PolarHBondContact O-N 2.94Å
78	V	94.3	Very high	85.7	Confident	62 Å²	62	73.5 Å²	73.5	38%	0.376	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-39	175.4	171.3	0	0	0	0	111	I36 L74 S75 E76 K81 T82	I36-V78 HydrophobicContact CD1-CG2 4.1Å; I36-V78 HydrophobicContact CG1-CG2 4.26Å; L74-V78 HydrophobicContact CD1-CG2 4.39Å; L74-V78 VanDerWaalsContact O-CG2 3.31Å; L74-V78 WeakPolarHBondContact O-CG2 3.37Å; L74-V78 PolarHBondContact O-N 3.19Å; S75-V78 PolarHBondContact O-N 2.93Å; E76-V78 PolarHBondContact O-N 3.35Å; V78-K81 WeakPolarHBondContact O-CB 3.4Å; V78-K81 PolarHBondContact O-N 2.82Å; V78-T82 PolarHBondContact O-N 3.47Å
79	S	91.6	Very high	83.3	Confident	50 Å²	50	78.3 Å²	78.3	35%	0.35	43%	0.432	S	S	.	.	H	α-helix	trans	-63.4	-44.8	175.6	-55.4	0	0	0	0	111.2	S75 E76 V77 K81 T82 E83	S75-S79 WeakPolarHBondContact O-CB 3.47Å; S75-S79 PolarHBondContact O-N 3.18Å; S75-S79 PolarHBondContact O-OG 3.29Å; E76-S79 WeakPolarHBondContact O-CB 3.47Å; E76-S79 PolarHBondContact O-N 2.95Å; V77-S79 VanDerWaalsContact C-N 3.32Å; S79-K81 VanDerWaalsContact C-N 3.29Å; S79-K81 PolarHBondContact O-N 3.4Å; S79-T82 PolarHBondContact O-N 3.1Å; S79-T82 PolarHBondContact O-OG1 3.26Å; S79-E83 PolarHBondContact O-N 2.94Å
80	K	89.5	Confident	80.8	Confident	70 Å²	70	82.4 Å²	82.4	30%	0.304	45%	0.449	S	S	.	.	H	α-helix	trans	-59.5	-37.5	173.2	-73.5	174	-177.6	169.9	0	112.7	M27 E76 V77 T82 E83 I84	M27-K80 HydrophobicContact CE-CD 3.66Å; E76-K80 WeakPolarHBondContact O-CG 3.43Å; E76-K80 PolarHBondContact O-N 3.44Å; E76-K80 VanDerWaalsContact OE1-CE 3.27Å; E76-K80 WeakPolarHBondContact OE1-CE 3.46Å; E76-K80 IonicContact OE1-NZ 3.38Å; E76-K80 PolarHBondContact OE1-NZ 2.87Å; V77-K80 PolarHBondContact O-N 3.04Å; K80-T82 VanDerWaalsContact C-N 3.34Å; K80-T82 PolarHBondContact O-N 3.13Å; K80-E83 PolarHBondContact O-N 3.38Å; K80-I84 WeakPolarHBondContact O-CD1 3.45Å; K80-I84 VanDerWaalsContact O-CG1 3.3Å; K80-I84 WeakPolarHBondContact O-CG1 3.45Å; K80-I84 PolarHBondContact O-N 3.36Å
81	K	88.7	Confident	78.6	Confident	63 Å²	63	88.6 Å²	88.6	27%	0.274	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-43.9	172.7	-178.2	175.1	166.7	171.2	0	111.3	I32 E33 I36 V77 V78 S79 E83 I84 I85	I32-K81 HydrophobicContact CG2-CB 3.75Å; I32-K81 HydrophobicContact CG2-CG 4.48Å; E33-K81 WeakPolarHBondContact OE1-CE 3.46Å; E33-K81 IonicContact OE1-NZ 2.84Å; E33-K81 PolarHBondContact OE1-NZ 3.46Å; E33-K81 IonicContact OE2-NZ 2.64Å; E33-K81 PolarHBondContact OE2-NZ 3.48Å; I36-K81 HydrophobicContact CD1-CB 4.34Å; I36-K81 HydrophobicContact CD1-CD 3.57Å; V77-K81 PolarHBondContact O-N 2.94Å; V78-K81 WeakPolarHBondContact O-CB 3.4Å; V78-K81 PolarHBondContact O-N 2.82Å; S79-K81 VanDerWaalsContact C-N 3.29Å; S79-K81 PolarHBondContact O-N 3.4Å; K81-E83 VanDerWaalsContact C-N 3.35Å; K81-I84 PolarHBondContact O-N 3.47Å; K81-I85 HydrophobicContact CG-CD1 3.82Å; K81-I85 VanDerWaalsContact O-CG1 3.28Å; K81-I85 WeakPolarHBondContact O-CG1 3.48Å; K81-I85 PolarHBondContact O-N 3.36Å; K81-I85 VanDerWaalsContact O-N 3.12Å
82	T	83.9	Confident	75.9	Confident	76 Å²	76	88.8 Å²	88.8	47%	0.466	49%	0.494	S	S	.	.	H	α-helix	trans	-68	-33.1	178.7	57.4	0	0	0	0	113.3	V78 S79 K80 S86	V78-T82 PolarHBondContact O-N 3.47Å; S79-T82 PolarHBondContact O-N 3.1Å; S79-T82 PolarHBondContact O-OG1 3.26Å; K80-T82 VanDerWaalsContact C-N 3.34Å; K80-T82 PolarHBondContact O-N 3.13Å; T82-S86 VanDerWaalsContact O-CB 3.3Å; T82-S86 WeakPolarHBondContact O-CB 3.47Å; T82-S86 PolarHBondContact O-N 3.33Å; T82-S86 PolarHBondContact O-OG 3.19Å
83	E	81.2	Confident	73.6	Confident	130 Å²	130	89.6 Å²	89.6	61%	0.607	50%	0.499	S	S	*	.	H	α-helix	trans	-66.3	-44.9	174.2	-71.2	173.5	-178.8	0	0	111.6	S79 K80 K81 I85 S86 G87	S79-E83 PolarHBondContact O-N 2.94Å; K80-E83 PolarHBondContact O-N 3.38Å; K81-E83 VanDerWaalsContact C-N 3.35Å; E83-I85 VanDerWaalsContact C-N 3.3Å; E83-I85 PolarHBondContact O-N 2.76Å; E83-S86 PolarHBondContact O-N 2.97Å; E83-G87 PolarHBondContact O-N 3.47Å
84	I	74.8	Confident	71	Confident	93 Å²	93	97.5 Å²	97.5	48%	0.477	53%	0.53	S	S	.	.	H	α-helix	trans	-64.4	-36.2	178	-65.8	162.4	0	0	0	111.5	I32 K80 K81	I32-I84 HydrophobicContact CD1-CD1 4.36Å; I32-I84 HydrophobicContact CG1-CD1 3.68Å; K80-I84 WeakPolarHBondContact O-CD1 3.45Å; K80-I84 VanDerWaalsContact O-CG1 3.3Å; K80-I84 WeakPolarHBondContact O-CG1 3.45Å; K80-I84 PolarHBondContact O-N 3.36Å; K81-I84 PolarHBondContact O-N 3.47Å
85	I	71.7	Confident	68.5	Low	125 Å²	125	101.8 Å²	101.8	64%	0.641	56%	0.558	S	S	*	*	H	α-helix	trans	-76.1	-30.9	179.2	-65.5	168.3	0	0	0	111.8	K81 E83	K81-I85 HydrophobicContact CG-CD1 3.82Å; K81-I85 VanDerWaalsContact O-CG1 3.28Å; K81-I85 WeakPolarHBondContact O-CG1 3.48Å; K81-I85 PolarHBondContact O-N 3.36Å; K81-I85 VanDerWaalsContact O-N 3.12Å; E83-I85 VanDerWaalsContact C-N 3.3Å; E83-I85 PolarHBondContact O-N 2.76Å
86	S	63.1	Low	66	Low	107 Å²	107	105.7 Å²	105.7	75%	0.748	57%	0.572	S	S	*	*	H	α-helix	trans	-94.1	-16	-177.1	-53.3	0	0	0	0	113.9	T82 E83	T82-S86 VanDerWaalsContact O-CB 3.3Å; T82-S86 WeakPolarHBondContact O-CB 3.47Å; T82-S86 PolarHBondContact O-N 3.33Å; T82-S86 PolarHBondContact O-OG 3.19Å; E83-S86 PolarHBondContact O-N 2.97Å
87	G	52	Low	63.6	Low	44 Å²	44	106.4 Å²	106.4	45%	0.454	58%	0.584	S	S	.	*			trans	-118.1	80.6	-176.7	0	0	0	0	0	112.1	E83 Q89	E83-G87 PolarHBondContact O-N 3.47Å; G87-Q89 PolarHBondContact O-N 3.1Å
88	D	45.2	Very low	61.2	Low	154 Å²	154	113.3 Å²	113.3	82%	0.824	62%	0.621	S	S	*	*			trans	-51.6	126	154.1	-112.2	-20.9	0	0	0	108
89	Q	46.3	Very low	58.6	Low	166 Å²	166	116.2 Å²	116.2	78%	0.776	64%	0.635	S	S	*	*	S	Bend	trans	103.6	118.4	169.2	-53	170.8	42	0	0	117.3	G87	G87-Q89 PolarHBondContact O-N 3.1Å
90	N	43.4	Very low	56.6	Low	150 Å²	150	121.3 Å²	121.3	80%	0.802	65%	0.653	S	S	*	*			trans	90.7	60.6	158.3	-57.2	-53.8	0	0	0	119.2
91	I	53	Low	54.2	Low	134 Å²	134	123.5 Å²	123.5	69%	0.687	68%	0.677	S	S	*	*			trans	-120.7	88.6	143.5	-54.2	176.1	0	0	0	107.6	L93	I91-L93 VanDerWaalsContact C-N 3.28Å; I91-L93 HydrophobicContact CG2-CG 4.49Å; I91-L93 PolarHBondContact O-N 3.46Å
92	S	39.9	Very low	51.9	Low	99 Å²	99	124.3 Å²	124.3	69%	0.692	69%	0.688	S	S	*	*			trans	-65.6	93	165.4	-178	0	0	0	0	107.7	K94	S92-K94 VanDerWaalsContact C-N 3.26Å; S92-K94 PolarHBondContact O-N 3.49Å
93	L	48.2	Very low	49.9	Very low	137 Å²	137	131 Å²	131	72%	0.717	71%	0.706	S	S	*	*			trans	-62.5	93.3	159.7	-69.7	163	0	0	0	106.7	I91 T95	I91-L93 VanDerWaalsContact C-N 3.28Å; I91-L93 HydrophobicContact CG2-CG 4.49Å; I91-L93 PolarHBondContact O-N 3.46Å; L93-T95 PolarHBondContact O-N 3.25Å
94	K	42.4	Very low	48	Very low	188 Å²	188	130.7 Å²	130.7	82%	0.817	71%	0.709	S	S	*	*			trans	-73.2	88.9	165.6	-80.7	-171	175.9	-175.7	0	108.2	S92	S92-K94 VanDerWaalsContact C-N 3.26Å; S92-K94 PolarHBondContact O-N 3.49Å
95	T	44	Very low	46.8	Very low	121 Å²	121	133.9 Å²	133.9	74%	0.742	72%	0.719	S	S	*	*			trans	-59.4	126.5	158.7	-56.9	0	0	0	0	108.9	L93	L93-T95 PolarHBondContact O-N 3.25Å
96	I	44.8	Very low	45.4	Very low	154 Å²	154	136.6 Å²	136.6	79%	0.79	73%	0.727	S	S	*	*			trans	-66.9	135.1	168.8	-62	161.2	0	0	0	107.9
97	P	43	Very low	44.8	Very low	109 Å²	109	138.8 Å²	138.8	71%	0.708	73%	0.728	S	S	*	*				-136.9	134.9	128.7	30	-13.9	0	0	0	113
98	D	43.4	Very low	44.5	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	74%	0.737	S	S	*	*			trans	43.6	113.8	138.4	-73.8	-17.6	0	0	0	121.3
99	D	41.1	Very low	44.6	Very low	124 Å²	124	140.2 Å²	140.2	66%	0.663	74%	0.736	S	S	*	*				80.7	135.5	114.5	-141.3	1.6	0	0	0	120.4
100	H	49.1	Very low	45	Very low	157 Å²	157	138.1 Å²	138.1	73%	0.727	74%	0.737	S	S	*	*			trans	81.6	98	164.1	-53.1	-36.9	0	0	0	120.9
101	S	39.8	Very low	45.2	Very low	116 Å²	116	135.5 Å²	135.5	81%	0.811	73%	0.728	S	S	*	*				98.7	133.7	120.2	-159.9	0	0	0	0	119.1
102	P	39.4	Very low	44.9	Very low	80 Å²	80	133.9 Å²	133.9	52%	0.519	73%	0.729	S	S	.	*			trans	-113.7	166.7	-158.9	18.5	7.5	0	0	0	113.9
103	Y	42.4	Very low	45.5	Very low	215 Å²	215	138.3 Å²	138.3	84%	0.843	73%	0.732	S	S	*	*			trans	72.9	114	166.8	-31.7	-70.3	0	0	0	116.2
104	D	41.3	Very low	45.9	Very low	124 Å²	124	139.3 Å²	139.3	66%	0.663	74%	0.737	S	S	*	*				178.7	147.2	99.8	-140.9	-9.3	0	0	0	112.5
105	K	48.9	Very low	46.3	Very low	160 Å²	160	136 Å²	136	70%	0.696	73%	0.734	S	S	*	*			trans	58.7	105.5	157.1	-73.6	148	-174.1	151	0	120
106	K	43	Very low	46.6	Very low	182 Å²	182	138.1 Å²	138.1	79%	0.791	74%	0.741	S	S	*	*				78.4	117.8	76.1	-84.1	-169.9	-178.7	-173.4	0	114.9
107	I	49.5	Very low	46.6	Very low	153 Å²	153	135.6 Å²	135.6	79%	0.785	74%	0.737	S	S	*	*			trans	97.7	122.5	135.6	-64.3	161.6	0	0	0	118.4
108	A	46.9	Very low	46.7	Very low	76 Å²	76	135.3 Å²	135.3	63%	0.628	74%	0.737	S	S	*	*			trans	72.8	104.5	146.1	0	0	0	0	0	119.7
109	D	47.5	Very low	46.8	Very low	153 Å²	153	134.8 Å²	134.8	82%	0.818	73%	0.734	S	S	*	*				163.3	129.4	103.7	-85.4	-24.7	0	0	0	110.5
110	P	53.4	Low	47	Very low	121 Å²	121	137.5 Å²	137.5	79%	0.786	74%	0.743	S	S	*	*			trans	-103.6	134.5	155.2	34.8	-23.7	0	0	0	108.3
111	P	48.2	Very low	46.9	Very low	95 Å²	95	136.3 Å²	136.3	62%	0.617	75%	0.747	S	S	*	*				-159	150	98.8	35.8	-16.5	0	0	0	114.4	Y113	P111-Y113 HydrophobicContact CB-CE1 4.2Å
112	S	45.9	Very low	47.1	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	74%	0.739	S	S	*	*			trans	-170.4	118.4	132.9	-157.6	0	0	0	0	111
113	Y	53.2	Low	47.4	Very low	192 Å²	192	137.6 Å²	137.6	75%	0.753	75%	0.748	S	S	*	*			trans	-73.5	113.8	173	-2.3	-91.4	0	0	0	107.8	P111	P111-Y113 HydrophobicContact CB-CE1 4.2Å
114	L	57.5	Low	47.6	Very low	157 Å²	157	136.1 Å²	136.1	82%	0.822	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-87.4	125.1	168.1	-71.3	175.7	0	0	0	109.2
115	P	50.4	Low	47.9	Very low	118 Å²	118	139 Å²	139	77%	0.766	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-77.4	141.9	177.5	30.3	-31.5	0	0	0	111.5	S117	P115-S117 PolarHBondContact O-N 2.88Å
116	L	49.7	Very low	47.8	Very low	167 Å²	167	139.9 Å²	139.9	87%	0.874	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-53.9	123.3	175.6	-93.5	64.8	0	0	0	111.9	S118	L116-S118 PolarHBondContact O-N 3.21Å
117	S	44.9	Very low	48	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	77%	0.766	S	S	*	*			trans	-80.5	106.8	168.1	-167	0	0	0	0	109.9	P115 N119	P115-S117 PolarHBondContact O-N 2.88Å; S117-N119 PolarHBondContact O-N 3.25Å; S117-N119 PolarHBondContact OG-OD1 3.43Å
118	S	44.3	Very low	47.6	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	77%	0.766	S	S	*	*			trans	-70.1	100.7	165.3	150.9	0	0	0	0	109.2	L116 Q120	L116-S118 PolarHBondContact O-N 3.21Å; S118-Q120 PolarHBondContact O-N 2.95Å
119	N	47.1	Very low	47.1	Very low	136 Å²	136	139 Å²	139	73%	0.727	78%	0.781	S	S	*	*			trans	-88.9	95.6	166	-71.1	-9.2	0	0	0	109.1	S117 T121	S117-N119 PolarHBondContact O-N 3.25Å; S117-N119 PolarHBondContact OG-OD1 3.43Å; N119-T121 PolarHBondContact O-N 3.11Å
120	Q	45.5	Very low	47.2	Very low	182 Å²	182	135.4 Å²	135.4	85%	0.85	77%	0.773	S	S	*	*			trans	-67.9	111.7	152.2	-80.6	179.7	7	0	0	107.6	S118	S118-Q120 PolarHBondContact O-N 2.95Å
121	T	46.9	Very low	47	Very low	131 Å²	131	135.8 Å²	135.8	80%	0.804	77%	0.772	S	S	*	*			trans	-129.8	128.7	154.9	51.1	0	0	0	0	109.5	N119	N119-T121 PolarHBondContact O-N 3.11Å
122	S	42.8	Very low	47.5	Very low	93 Å²	93	140.3 Å²	140.3	65%	0.65	78%	0.782	S	S	*	*			trans	-52.5	151.3	176.8	44.3	0	0	0	0	113
123	N	46.3	Very low	48.2	Very low	131 Å²	131	142.3 Å²	142.3	70%	0.701	78%	0.784	S	S	*	*				162.6	122.7	114.3	-76.4	-42.3	0	0	0	113.3
124	K	47.3	Very low	49.1	Very low	183 Å²	183	138.6 Å²	138.6	80%	0.796	78%	0.784	S	S	*	*			trans	78.9	116.2	139.1	-66.1	173.8	-178.6	175.7	0	121
125	K	46.7	Very low	50	Low	186 Å²	186	136.6 Å²	136.6	81%	0.809	77%	0.769	S	S	*	*			trans	81	100.4	138.8	-73.5	-177.2	172.9	-176	0	119
126	E	46.8	Very low	51.5	Low	178 Å²	178	134.5 Å²	134.5	83%	0.832	75%	0.754	S	S	*	*				32.4	102.3	124.5	-63.5	176.4	170.5	0	0	116.9
127	Q	46.7	Very low	53.3	Low	201 Å²	201	134.1 Å²	134.1	94%	0.939	75%	0.747	S	S	*	*			trans	-178.4	131.8	135.6	-100.1	165.3	43.5	0	0	110.6
128	G	41.8	Very low	55.4	Low	77 Å²	77	136.2 Å²	136.2	79%	0.794	74%	0.744	S	S	*	*			trans	87.3	98	154.3	0	0	0	0	0	116.7	A130	G128-A130 PolarHBondContact O-N 3.04Å
129	A	36.1	Very low	57.7	Low	113 Å²	113	135.7 Å²	135.7	93%	0.934	73%	0.731	S	S	*	*			trans	-59	99.9	166.4	0	0	0	0	0	111.9
130	A	48.8	Very low	59.7	Low	78 Å²	78	132 Å²	132	65%	0.645	71%	0.713	S	S	*	*			trans	-147.5	93.3	150.7	0	0	0	0	0	106.2	G128 K132	G128-A130 PolarHBondContact O-N 3.04Å; A130-K132 PolarHBondContact O-N 3.13Å
131	V	49.6	Very low	62	Low	129 Å²	129	131.2 Å²	131.2	78%	0.782	70%	0.702	S	S	*	*			trans	-67.4	86.4	173.6	-179.4	0	0	0	0	106.9	L133	V131-L133 VanDerWaalsContact C-N 3.33Å; V131-L133 HydrophobicContact CG1-CD1 4.45Å; V131-L133 PolarHBondContact O-N 3.35Å
132	K	59.9	Low	64.2	Low	190 Å²	190	130.3 Å²	130.3	83%	0.826	69%	0.689	S	S	*	*			trans	-63.1	103.1	159.9	-67.6	-177.5	179.2	-179.4	0	104.6	A130	A130-K132 PolarHBondContact O-N 3.13Å
133	L	61	Low	66.6	Low	143 Å²	143	130.2 Å²	130.2	75%	0.749	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-50.7	129.5	170.3	-99.4	84.5	0	0	0	106.8	V131 K135	V131-L133 VanDerWaalsContact C-N 3.33Å; V131-L133 HydrophobicContact CG1-CD1 4.45Å; V131-L133 PolarHBondContact O-N 3.35Å; L133-K135 PolarHBondContact O-N 2.83Å; L133-K135 VanDerWaalsContact O-N 3.17Å
134	P	71.7	Confident	69	Low	115 Å²	115	128.9 Å²	128.9	75%	0.747	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-55.3	128.2	173.7	21.6	-29.5	0	0	0	107.4	T136	P134-T136 PolarHBondContact O-N 2.85Å
135	K	75.1	Confident	71.3	Confident	114 Å²	114	124.5 Å²	124.5	50%	0.496	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-50.2	130	179.5	-68.3	-176.8	-178	-172.2	0	108.2	L133 Q139 E143	L133-K135 PolarHBondContact O-N 2.83Å; L133-K135 VanDerWaalsContact O-N 3.17Å; K135-Q139 HydrophobicContact CB-CB 4.39Å; K135-E143 WeakPolarHBondContact CD-OE1 3.49Å; K135-E143 VanDerWaalsContact CE-OE1 3.3Å; K135-E143 WeakPolarHBondContact CE-OE1 3.49Å; K135-E143 IonicContact NZ-OE1 2.65Å; K135-E143 PolarHBondContact NZ-OE1 2.89Å; K135-E143 IonicContact NZ-OE2 2.75Å; K135-E143 PolarHBondContact NZ-OE2 3.25Å
136	T	83.4	Confident	73.7	Confident	74 Å²	74	119 Å²	119	45%	0.454	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-59.9	147.9	175.3	57.2	0	0	0	0	108.7	P134 F138 Q139 T140	P134-T136 PolarHBondContact O-N 2.85Å; T136-F138 PolarHBondContact O-N 2.98Å; T136-Q139 PolarHBondContact O-N 3.28Å; T136-Q139 VanDerWaalsContact OG1-CG 3.31Å; T136-Q139 WeakPolarHBondContact OG1-CG 3.36Å; T136-Q139 PolarHBondContact OG1-N 3.49Å; T136-T140 PolarHBondContact O-N 3.11Å; T136-T140 PolarHBondContact O-OG1 3.22Å
137	E	86.6	Confident	76	Confident	159 Å²	159	113.4 Å²	113.4	74%	0.743	62%	0.62	S	S	*	*	H	α-helix	trans	-53.9	-29.7	177.1	-65.8	-174.5	168.2	0	0	112.1	R141	E137-R141 VanDerWaalsContact O-CB 3.27Å; E137-R141 WeakPolarHBondContact O-CB 3.43Å; E137-R141 PolarHBondContact O-N 3.42Å
138	F	89.5	Confident	78.4	Confident	145 Å²	145	107.5 Å²	107.5	64%	0.636	59%	0.594	S	S	*	*	H	α-helix	trans	-63.4	-51.8	172.2	-176.5	-92.1	0	0	0	112.6	T136 T140 R141 E142	T136-F138 PolarHBondContact O-N 2.98Å; F138-T140 VanDerWaalsContact C-N 3.35Å; F138-T140 PolarHBondContact O-N 2.89Å; F138-R141 WeakPolarHBondContact O-CB 3.45Å; F138-R141 PolarHBondContact O-N 3.36Å; F138-E142 PolarHBondContact O-N 3.09Å
139	Q	91.4	Very high	81.1	Confident	92 Å²	92	107.9 Å²	107.9	43%	0.43	58%	0.576	S	S	.	*	H	α-helix	trans	-60.3	-43.8	177.1	-77.1	170.5	-9.2	0	0	111.8	K135 T136 R141 E142 E143	K135-Q139 HydrophobicContact CB-CB 4.39Å; T136-Q139 PolarHBondContact O-N 3.28Å; T136-Q139 VanDerWaalsContact OG1-CG 3.31Å; T136-Q139 WeakPolarHBondContact OG1-CG 3.36Å; T136-Q139 PolarHBondContact OG1-N 3.49Å; Q139-R141 VanDerWaalsContact C-N 3.3Å; Q139-R141 PolarHBondContact O-N 3.31Å; Q139-E142 PolarHBondContact O-N 2.96Å; Q139-E143 WeakPolarHBondContact O-CG 3.49Å; Q139-E143 PolarHBondContact O-N 3.44Å
140	T	89.9	Confident	84	Confident	57 Å²	57	108 Å²	108	35%	0.35	56%	0.557	S	S	.	*	H	α-helix	trans	-61.7	-40.4	176.7	-54.7	0	0	0	0	111.3	T136 F138 L144	T136-T140 PolarHBondContact O-N 3.11Å; T136-T140 PolarHBondContact O-OG1 3.22Å; F138-T140 VanDerWaalsContact C-N 3.35Å; F138-T140 PolarHBondContact O-N 2.89Å; T140-L144 HydrophobicContact CG2-CD1 4.27Å; T140-L144 WeakPolarHBondContact O-CB 3.16Å; T140-L144 VanDerWaalsContact O-CG 3.23Å; T140-L144 WeakPolarHBondContact O-CG 3.47Å; T140-L144 PolarHBondContact O-N 3.13Å
141	R	93.5	Very high	86.3	Confident	167 Å²	167	108.9 Å²	108.9	63%	0.63	55%	0.55	S	S	*	*	H	α-helix	trans	-65.8	-42.6	176.5	-172.5	-175.8	-57.4	-87.1	-2.1	111.9	E137 F138 Q139 L144 V145	E137-R141 VanDerWaalsContact O-CB 3.27Å; E137-R141 WeakPolarHBondContact O-CB 3.43Å; E137-R141 PolarHBondContact O-N 3.42Å; F138-R141 WeakPolarHBondContact O-CB 3.45Å; F138-R141 PolarHBondContact O-N 3.36Å; Q139-R141 VanDerWaalsContact C-N 3.3Å; Q139-R141 PolarHBondContact O-N 3.31Å; R141-L144 PolarHBondContact O-N 3.16Å; R141-V145 VanDerWaalsContact O-CG2 3.27Å; R141-V145 WeakPolarHBondContact O-CG2 3.46Å; R141-V145 PolarHBondContact O-N 3.41Å
142	E	94.4	Very high	88.6	Confident	111 Å²	111	109.6 Å²	109.6	52%	0.519	54%	0.539	S	S	.	.	H	α-helix	trans	-62.1	-47	177	-175.3	177	-169.2	0	0	111.5	F138 Q139 L144 V145 T146	F138-E142 PolarHBondContact O-N 3.09Å; Q139-E142 PolarHBondContact O-N 2.96Å; E142-L144 VanDerWaalsContact C-N 3.33Å; E142-L144 PolarHBondContact O-N 3.36Å; E142-V145 PolarHBondContact O-N 3.48Å; E142-T146 PolarHBondContact O-N 2.94Å; E142-T146 PolarHBondContact O-OG1 3.23Å
143	E	92.5	Very high	90.4	Very high	91 Å²	91	106.5 Å²	106.5	43%	0.425	53%	0.526	S	S	.	.	H	α-helix	trans	-59.6	-42.4	175.4	-71.8	175.4	-175.3	0	0	112.2	K135 Q139 T146 C147	K135-E143 WeakPolarHBondContact CD-OE1 3.49Å; K135-E143 VanDerWaalsContact CE-OE1 3.3Å; K135-E143 WeakPolarHBondContact CE-OE1 3.49Å; K135-E143 IonicContact NZ-OE1 2.65Å; K135-E143 PolarHBondContact NZ-OE1 2.89Å; K135-E143 IonicContact NZ-OE2 2.75Å; K135-E143 PolarHBondContact NZ-OE2 3.25Å; Q139-E143 WeakPolarHBondContact O-CG 3.49Å; Q139-E143 PolarHBondContact O-N 3.44Å; E143-T146 PolarHBondContact O-N 2.65Å; E143-C147 WeakPolarHBondContact O-CB 3.38Å; E143-C147 PolarHBondContact O-N 3.43Å
144	L	96.4	Very high	92.2	Very high	104 Å²	104	104 Å²	104	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-40.8	175.8	-73.8	172	0	0	0	111.9	T140 R141 E142 C147 I148	T140-L144 HydrophobicContact CG2-CD1 4.27Å; T140-L144 WeakPolarHBondContact O-CB 3.16Å; T140-L144 VanDerWaalsContact O-CG 3.23Å; T140-L144 WeakPolarHBondContact O-CG 3.47Å; T140-L144 PolarHBondContact O-N 3.13Å; R141-L144 PolarHBondContact O-N 3.16Å; E142-L144 VanDerWaalsContact C-N 3.33Å; E142-L144 PolarHBondContact O-N 3.36Å; L144-C147 PolarHBondContact O-N 3.28Å; L144-I148 WeakPolarHBondContact O-CB 3.48Å; L144-I148 WeakPolarHBondContact O-CD1 3.49Å; L144-I148 WeakPolarHBondContact O-CG1 3.28Å; L144-I148 PolarHBondContact O-N 3.29Å
145	V	96.3	Very high	93.4	Very high	91 Å²	91	102.9 Å²	102.9	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-62.8	-44.3	175.6	169.8	0	0	0	0	110.7	R141 E142 I148 E149	R141-V145 VanDerWaalsContact O-CG2 3.27Å; R141-V145 WeakPolarHBondContact O-CG2 3.46Å; R141-V145 PolarHBondContact O-N 3.41Å; E142-V145 PolarHBondContact O-N 3.48Å; V145-I148 PolarHBondContact O-N 3.02Å; V145-E149 PolarHBondContact O-N 3.36Å
146	T	95.5	Very high	94.5	Very high	71 Å²	71	102.7 Å²	102.7	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-45.7	175.5	-60.7	0	0	0	0	111.6	E142 E143 I148 E149 E150	E142-T146 PolarHBondContact O-N 2.94Å; E142-T146 PolarHBondContact O-OG1 3.23Å; E143-T146 PolarHBondContact O-N 2.65Å; T146-I148 VanDerWaalsContact C-N 3.35Å; T146-I148 PolarHBondContact O-N 3.23Å; T146-E149 PolarHBondContact O-N 3.26Å; T146-E149 VanDerWaalsContact O-N 3.16Å; T146-E150 WeakPolarHBondContact O-CG 3.25Å; T146-E150 PolarHBondContact O-N 3.38Å
147	C	96	Very high	95.2	Very high	59 Å²	59	103.2 Å²	103.2	40%	0.399	51%	0.506	S	S	.	.	H	α-helix	trans	-60.5	-43.1	177.1	-178.4	0	0	0	0	111.8	E143 L144 E149 E150 L151	E143-C147 WeakPolarHBondContact O-CB 3.38Å; E143-C147 PolarHBondContact O-N 3.43Å; L144-C147 PolarHBondContact O-N 3.28Å; C147-E149 VanDerWaalsContact C-N 3.31Å; C147-E149 PolarHBondContact O-N 2.98Å; C147-E150 PolarHBondContact O-N 3.15Å; C147-L151 WeakPolarHBondContact O-CB 3.45Å; C147-L151 VanDerWaalsContact O-CG 3.28Å; C147-L151 WeakPolarHBondContact O-CG 3.33Å; C147-L151 PolarHBondContact O-N 3.08Å
148	I	97.4	Very high	95.7	Very high	77 Å²	77	100.4 Å²	100.4	40%	0.395	50%	0.495	S	S	.	.	H	α-helix	trans	-61.6	-41.7	175.7	-71.4	164.9	0	0	0	110.9	L144 V145 T146 L151 R152	L144-I148 WeakPolarHBondContact O-CB 3.48Å; L144-I148 WeakPolarHBondContact O-CD1 3.49Å; L144-I148 WeakPolarHBondContact O-CG1 3.28Å; L144-I148 PolarHBondContact O-N 3.29Å; V145-I148 PolarHBondContact O-N 3.02Å; T146-I148 VanDerWaalsContact C-N 3.35Å; T146-I148 PolarHBondContact O-N 3.23Å; I148-L151 PolarHBondContact O-N 3.24Å; I148-R152 VanDerWaalsContact CG2-CZ 3.41Å; I148-R152 WeakPolarHBondContact O-CG 3.46Å; I148-R152 PolarHBondContact O-N 3.45Å
149	E	97.3	Very high	96.1	Very high	86 Å²	86	96 Å²	96	40%	0.402	49%	0.486	S	S	.	.	H	α-helix	trans	-67	-40.1	178.7	-173.1	57.1	-155.8	0	0	112.3	V145 T146 C147 R152 K153	V145-E149 PolarHBondContact O-N 3.36Å; T146-E149 PolarHBondContact O-N 3.26Å; T146-E149 VanDerWaalsContact O-N 3.16Å; C147-E149 VanDerWaalsContact C-N 3.31Å; C147-E149 PolarHBondContact O-N 2.98Å; E149-R152 PolarHBondContact O-N 3.24Å; E149-R152 IonicContact OE2-NH1 3.43Å; E149-K153 WeakPolarHBondContact O-CG 3.43Å; E149-K153 PolarHBondContact O-N 3.32Å
150	E	97.6	Very high	96.4	Very high	114 Å²	114	95 Å²	95	53%	0.533	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-44.8	172.9	-72.5	176.2	176.2	0	0	111.8	T146 C147 R152 K153 L154	T146-E150 WeakPolarHBondContact O-CG 3.25Å; T146-E150 PolarHBondContact O-N 3.38Å; C147-E150 PolarHBondContact O-N 3.15Å; E150-R152 VanDerWaalsContact C-N 3.32Å; E150-R152 PolarHBondContact O-N 2.71Å; E150-K153 WeakPolarHBondContact O-CB 3.49Å; E150-K153 PolarHBondContact O-N 3.49Å; E150-L154 WeakPolarHBondContact O-CG 3.45Å; E150-L154 PolarHBondContact O-N 2.97Å
151	L	98.2	Very high	96.8	Very high	98 Å²	98	96.4 Å²	96.4	51%	0.513	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-40.4	175.6	-72.7	172.4	0	0	0	111.8	C147 I148 L154 V155	C147-L151 WeakPolarHBondContact O-CB 3.45Å; C147-L151 VanDerWaalsContact O-CG 3.28Å; C147-L151 WeakPolarHBondContact O-CG 3.33Å; C147-L151 PolarHBondContact O-N 3.08Å; I148-L151 PolarHBondContact O-N 3.24Å; L151-L154 PolarHBondContact O-N 3.34Å; L151-V155 VanDerWaalsContact O-CG2 3.28Å; L151-V155 WeakPolarHBondContact O-CG2 3.41Å; L151-V155 PolarHBondContact O-N 3.47Å
152	R	97.7	Very high	97	Very high	144 Å²	144	93.1 Å²	93.1	54%	0.543	49%	0.486	S	S	.	.	H	α-helix	trans	-60.1	-46.8	173.8	-75.9	177.2	-177.1	137.6	2.4	111.7	I148 E149 E150 L154 V155 D156	I148-R152 VanDerWaalsContact CG2-CZ 3.41Å; I148-R152 WeakPolarHBondContact O-CG 3.46Å; I148-R152 PolarHBondContact O-N 3.45Å; E149-R152 PolarHBondContact O-N 3.24Å; E149-R152 IonicContact OE2-NH1 3.43Å; E150-R152 VanDerWaalsContact C-N 3.32Å; E150-R152 PolarHBondContact O-N 2.71Å; R152-L154 VanDerWaalsContact C-N 3.31Å; R152-L154 PolarHBondContact O-N 3.28Å; R152-V155 PolarHBondContact O-N 2.71Å; R152-V155 VanDerWaalsContact O-N 3.17Å; R152-D156 PolarHBondContact O-N 2.85Å
153	K	97.5	Very high	97.1	Very high	125 Å²	125	91.4 Å²	91.4	54%	0.543	49%	0.486	S	S	.	.	H	α-helix	trans	-59.1	-41.2	176	-70.7	170.9	-176.6	171.8	0	112.5	E149 E150 D156 M157	E149-K153 WeakPolarHBondContact O-CG 3.43Å; E149-K153 PolarHBondContact O-N 3.32Å; E150-K153 WeakPolarHBondContact O-CB 3.49Å; E150-K153 PolarHBondContact O-N 3.49Å; K153-D156 PolarHBondContact O-N 3.07Å; K153-M157 WeakPolarHBondContact O-CB 3.46Å; K153-M157 PolarHBondContact O-N 3.4Å
154	L	98.2	Very high	97.4	Very high	90 Å²	90	93.8 Å²	93.8	47%	0.471	49%	0.491	S	S	.	.	H	α-helix	trans	-65.8	-42.1	176.1	-68.7	177.9	0	0	0	111.7	E150 L151 R152 M157 L158	E150-L154 WeakPolarHBondContact O-CG 3.45Å; E150-L154 PolarHBondContact O-N 2.97Å; L151-L154 PolarHBondContact O-N 3.34Å; R152-L154 VanDerWaalsContact C-N 3.31Å; R152-L154 PolarHBondContact O-N 3.28Å; L154-M157 HydrophobicContact CD2-CE 3.42Å; L154-M157 VanDerWaalsContact CD2-CE 3.42Å; L154-M157 PolarHBondContact O-N 3.45Å; L154-L158 WeakPolarHBondContact O-CB 3.48Å; L154-L158 WeakPolarHBondContact O-CG 3.21Å; L154-L158 PolarHBondContact O-N 2.95Å
155	V	98.2	Very high	97.4	Very high	92 Å²	92	92.7 Å²	92.7	56%	0.558	49%	0.489	S	S	*	.	H	α-helix	trans	-62	-45.4	175.6	169.4	0	0	0	0	111	L151 R152 M157 L158 A159	L151-V155 VanDerWaalsContact O-CG2 3.28Å; L151-V155 WeakPolarHBondContact O-CG2 3.41Å; L151-V155 PolarHBondContact O-N 3.47Å; R152-V155 PolarHBondContact O-N 2.71Å; R152-V155 VanDerWaalsContact O-N 3.17Å; V155-M157 PolarHBondContact O-N 3.38Å; V155-L158 PolarHBondContact O-N 3.3Å; V155-A159 WeakPolarHBondContact O-CB 3.49Å; V155-A159 PolarHBondContact O-N 3.05Å
156	D	97.4	Very high	97.5	Very high	109 Å²	109	96.6 Å²	96.6	58%	0.583	49%	0.493	S	S	*	.	H	α-helix	trans	-63.4	-41.7	177.9	-70.5	-21.5	0	0	0	111.7	R152 K153 A159 S160	R152-D156 PolarHBondContact O-N 2.85Å; K153-D156 PolarHBondContact O-N 3.07Å; D156-A159 PolarHBondContact O-N 3.37Å; D156-S160 WeakPolarHBondContact O-CB 3.37Å; D156-S160 PolarHBondContact O-N 3Å
157	M	97.4	Very high	97.6	Very high	86 Å²	86	98.4 Å²	98.4	42%	0.424	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-48.3	174.3	175.4	171.8	38.7	0	0	111.4	K153 L154 V155 A159 S160 Q161	K153-M157 WeakPolarHBondContact O-CB 3.46Å; K153-M157 PolarHBondContact O-N 3.4Å; L154-M157 HydrophobicContact CD2-CE 3.42Å; L154-M157 VanDerWaalsContact CD2-CE 3.42Å; L154-M157 PolarHBondContact O-N 3.45Å; V155-M157 PolarHBondContact O-N 3.38Å; M157-A159 VanDerWaalsContact C-N 3.33Å; M157-A159 PolarHBondContact O-N 3.04Å; M157-S160 PolarHBondContact O-N 2.91Å; M157-S160 PolarHBondContact O-OG 3.42Å; M157-Q161 WeakPolarHBondContact O-CG 3.39Å; M157-Q161 PolarHBondContact O-N 3.27Å
158	L	98.4	Very high	97.6	Very high	99 Å²	99	100.2 Å²	100.2	52%	0.518	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-39.2	177.4	-72.8	172	0	0	0	111.8	L154 V155 S160 Q161 L162	L154-L158 WeakPolarHBondContact O-CB 3.48Å; L154-L158 WeakPolarHBondContact O-CG 3.21Å; L154-L158 PolarHBondContact O-N 2.95Å; V155-L158 PolarHBondContact O-N 3.3Å; L158-S160 VanDerWaalsContact C-N 3.34Å; L158-S160 PolarHBondContact O-N 3.28Å; L158-Q161 PolarHBondContact O-N 3.5Å; L158-L162 WeakPolarHBondContact O-CB 3.46Å; L158-L162 WeakPolarHBondContact O-CG 3.41Å; L158-L162 PolarHBondContact O-N 3.13Å
159	A	97.8	Very high	97.6	Very high	53 Å²	53	100.4 Å²	100.4	44%	0.438	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-42.1	174.6	0	0	0	0	0	111.7	V155 D156 M157 L162 S163	V155-A159 WeakPolarHBondContact O-CB 3.49Å; V155-A159 PolarHBondContact O-N 3.05Å; D156-A159 PolarHBondContact O-N 3.37Å; M157-A159 VanDerWaalsContact C-N 3.33Å; M157-A159 PolarHBondContact O-N 3.04Å; A159-L162 PolarHBondContact O-N 3.31Å; A159-S163 WeakPolarHBondContact O-CB 3.31Å; A159-S163 PolarHBondContact O-N 2.96Å
160	S	96.8	Very high	97.6	Very high	70 Å²	70	99.3 Å²	99.3	49%	0.49	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-41.1	175.6	78.3	0	0	0	0	112.3	D156 M157 L158 S163 R164	D156-S160 WeakPolarHBondContact O-CB 3.37Å; D156-S160 PolarHBondContact O-N 3Å; M157-S160 PolarHBondContact O-N 2.91Å; M157-S160 PolarHBondContact O-OG 3.42Å; L158-S160 VanDerWaalsContact C-N 3.34Å; L158-S160 PolarHBondContact O-N 3.28Å; S160-S163 PolarHBondContact O-N 3.46Å; S160-R164 PolarHBondContact O-N 2.93Å
161	Q	98	Very high	97.6	Very high	88 Å²	88	97.6 Å²	97.6	41%	0.411	50%	0.496	S	S	.	.	H	α-helix	trans	-65.8	-43.1	176.7	-71.8	-177.7	3.7	0	0	111.8	M157 L158 S163 R164 V165	M157-Q161 WeakPolarHBondContact O-CG 3.39Å; M157-Q161 PolarHBondContact O-N 3.27Å; L158-Q161 PolarHBondContact O-N 3.5Å; Q161-S163 VanDerWaalsContact C-N 3.34Å; Q161-S163 PolarHBondContact O-N 2.96Å; Q161-R164 PolarHBondContact O-N 2.9Å; Q161-V165 WeakPolarHBondContact O-CG2 3.43Å; Q161-V165 PolarHBondContact O-N 3.44Å
162	L	97.9	Very high	97.6	Very high	97 Å²	97	96 Å²	96	51%	0.508	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-41.8	174.8	-76.9	175	0	0	0	111.8	L158 A159 V165 R166	L158-L162 WeakPolarHBondContact O-CB 3.46Å; L158-L162 WeakPolarHBondContact O-CG 3.41Å; L158-L162 PolarHBondContact O-N 3.13Å; A159-L162 PolarHBondContact O-N 3.31Å; L162-V165 PolarHBondContact O-N 3.14Å; L162-R166 WeakPolarHBondContact O-CB 3.42Å; L162-R166 VanDerWaalsContact O-CG 3.31Å; L162-R166 WeakPolarHBondContact O-CG 3.41Å; L162-R166 PolarHBondContact O-N 2.71Å
163	S	96.9	Very high	97.5	Very high	75 Å²	75	96.3 Å²	96.3	52%	0.524	49%	0.487	S	S	.	.	H	α-helix	trans	-59.9	-47.7	174.9	-168.3	0	0	0	0	111.3	A159 S160 Q161 V165 R166 Q167	A159-S163 WeakPolarHBondContact O-CB 3.31Å; A159-S163 PolarHBondContact O-N 2.96Å; S160-S163 PolarHBondContact O-N 3.46Å; Q161-S163 VanDerWaalsContact C-N 3.34Å; Q161-S163 PolarHBondContact O-N 2.96Å; S163-V165 PolarHBondContact O-N 3.07Å; S163-R166 PolarHBondContact O-N 3.11Å; S163-Q167 PolarHBondContact O-N 3.44Å
164	R	97.6	Very high	97.5	Very high	142 Å²	142	97.1 Å²	97.1	54%	0.536	49%	0.493	S	S	.	.	H	α-helix	trans	-59.3	-46	176.8	-174.5	179.5	67.7	90.9	-1.5	112.6	S160 Q161 Q167 M168	S160-R164 PolarHBondContact O-N 2.93Å; Q161-R164 PolarHBondContact O-N 2.9Å; R164-Q167 PolarHBondContact O-N 3.38Å; R164-M168 HydrophobicContact CG-SD 4.39Å; R164-M168 WeakPolarHBondContact O-CG 3.11Å; R164-M168 PolarHBondContact O-N 2.95Å
165	V	97.5	Very high	97.4	Very high	80 Å²	80	99.6 Å²	99.6	49%	0.485	50%	0.496	S	S	.	.	H	α-helix	trans	-65.7	-39.7	179	171.1	0	0	0	0	111.3	Q161 L162 S163 Q167 M168 L169	Q161-V165 WeakPolarHBondContact O-CG2 3.43Å; Q161-V165 PolarHBondContact O-N 3.44Å; L162-V165 PolarHBondContact O-N 3.14Å; S163-V165 PolarHBondContact O-N 3.07Å; V165-Q167 VanDerWaalsContact C-N 3.33Å; V165-Q167 PolarHBondContact O-N 3.32Å; V165-M168 PolarHBondContact O-N 3.46Å; V165-L169 WeakPolarHBondContact O-CB 3.35Å; V165-L169 PolarHBondContact O-N 3.25Å
166	R	97.7	Very high	97.2	Very high	173 Å²	173	102.2 Å²	102.2	65%	0.653	50%	0.496	S	S	*	.	H	α-helix	trans	-61.9	-41.4	174.6	-76.4	174.7	176.9	152.3	-0.2	111.8	L162 S163 L169 S170	L162-R166 WeakPolarHBondContact O-CB 3.42Å; L162-R166 VanDerWaalsContact O-CG 3.31Å; L162-R166 WeakPolarHBondContact O-CG 3.41Å; L162-R166 PolarHBondContact O-N 2.71Å; S163-R166 PolarHBondContact O-N 3.11Å; R166-L169 PolarHBondContact O-N 3.47Å; R166-S170 PolarHBondContact O-N 2.9Å; R166-S170 PolarHBondContact O-OG 3.38Å
167	Q	97.9	Very high	97.1	Very high	109 Å²	109	102.4 Å²	102.4	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-49.3	175.1	-177	-174.8	-15.1	0	0	111.6	S163 R164 V165 L169 S170 E171	S163-Q167 PolarHBondContact O-N 3.44Å; R164-Q167 PolarHBondContact O-N 3.38Å; V165-Q167 VanDerWaalsContact C-N 3.33Å; V165-Q167 PolarHBondContact O-N 3.32Å; Q167-L169 VanDerWaalsContact C-N 3.26Å; Q167-L169 PolarHBondContact O-N 2.93Å; Q167-S170 WeakPolarHBondContact CA-OG 3.41Å; Q167-S170 PolarHBondContact O-N 3.44Å; Q167-S170 VanDerWaalsContact O-N 3.14Å; Q167-S170 PolarHBondContact O-OG 3.49Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.33Å; Q167-E171 PolarHBondContact NE2-OE1 2.99Å; Q167-E171 WeakPolarHBondContact O-CG 3.4Å; Q167-E171 PolarHBondContact O-N 3.24Å
168	M	97.1	Very high	97	Very high	98 Å²	98	100.7 Å²	100.7	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-60.2	-38	177.1	-69.3	179.2	67.8	0	0	112	R164 V165 E171 E172	R164-M168 HydrophobicContact CG-SD 4.39Å; R164-M168 WeakPolarHBondContact O-CG 3.11Å; R164-M168 PolarHBondContact O-N 2.95Å; V165-M168 PolarHBondContact O-N 3.46Å; M168-E171 PolarHBondContact O-N 3.2Å; M168-E172 WeakPolarHBondContact O-CB 3.34Å; M168-E172 PolarHBondContact O-N 3.24Å
169	L	97.1	Very high	96.7	Very high	81 Å²	81	100.5 Å²	100.5	42%	0.424	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-39.9	175.8	-178.8	68.9	0	0	0	112.1	V165 R166 Q167 R173	V165-L169 WeakPolarHBondContact O-CB 3.35Å; V165-L169 PolarHBondContact O-N 3.25Å; R166-L169 PolarHBondContact O-N 3.47Å; Q167-L169 VanDerWaalsContact C-N 3.26Å; Q167-L169 PolarHBondContact O-N 2.93Å; L169-R173 WeakPolarHBondContact O-CB 3.34Å; L169-R173 VanDerWaalsContact O-CG 3.27Å; L169-R173 WeakPolarHBondContact O-CG 3.5Å; L169-R173 PolarHBondContact O-N 3.4Å
170	S	96.8	Very high	96.3	Very high	63 Å²	63	102.6 Å²	102.6	44%	0.441	50%	0.495	S	S	.	.	H	α-helix	trans	-66.5	-43	174.5	46.9	0	0	0	0	112.2	R166 Q167 E172 R173 E174	R166-S170 PolarHBondContact O-N 2.9Å; R166-S170 PolarHBondContact O-OG 3.38Å; Q167-S170 WeakPolarHBondContact CA-OG 3.41Å; Q167-S170 PolarHBondContact O-N 3.44Å; Q167-S170 VanDerWaalsContact O-N 3.14Å; Q167-S170 PolarHBondContact O-OG 3.49Å; S170-E172 VanDerWaalsContact C-N 3.33Å; S170-E172 PolarHBondContact O-N 3.23Å; S170-R173 PolarHBondContact O-N 2.94Å; S170-E174 WeakPolarHBondContact O-CB 3.27Å; S170-E174 PolarHBondContact O-N 3.08Å
171	E	97.6	Very high	96	Very high	78 Å²	78	101.7 Å²	101.7	36%	0.364	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-42	176.6	-70.9	170.2	-170.1	0	0	111.3	Q167 M168 E174 R175	Q167-E171 WeakPolarHBondContact CG-OE1 3.33Å; Q167-E171 PolarHBondContact NE2-OE1 2.99Å; Q167-E171 WeakPolarHBondContact O-CG 3.4Å; Q167-E171 PolarHBondContact O-N 3.24Å; M168-E171 PolarHBondContact O-N 3.2Å; E171-E174 PolarHBondContact O-N 2.96Å; E171-R175 WeakPolarHBondContact O-CG 3.47Å; E171-R175 PolarHBondContact O-N 3.24Å
172	E	97.3	Very high	95.7	Very high	65 Å²	65	103.5 Å²	103.5	30%	0.304	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-39.1	177.4	-176.1	57.8	-158.3	0	0	112.4	M168 S170 E174 R175 R176	M168-E172 WeakPolarHBondContact O-CB 3.34Å; M168-E172 PolarHBondContact O-N 3.24Å; S170-E172 VanDerWaalsContact C-N 3.33Å; S170-E172 PolarHBondContact O-N 3.23Å; E172-E174 VanDerWaalsContact C-N 3.34Å; E172-R175 PolarHBondContact O-N 3.38Å; E172-R175 IonicContact OE2-CZ 3.07Å; E172-R175 IonicContact OE2-NE 2.64Å; E172-R175 PolarHBondContact OE2-NE 3.45Å; E172-R175 VanDerWaalsContact OE2-NE 3.08Å; E172-R175 IonicContact OE2-NH2 3.88Å; E172-R175 PolarHBondContact OE2-NH2 2.92Å; E172-R176 WeakPolarHBondContact O-CG 3.44Å; E172-R176 PolarHBondContact O-N 2.74Å; E172-R176 IonicContact OE1-NE 3.4Å; E172-R176 PolarHBondContact OE1-NE 3.08Å
173	R	97.4	Very high	95.2	Very high	149 Å²	149	102.4 Å²	102.4	56%	0.562	50%	0.495	S	S	*	.	H	α-helix	trans	-62.7	-42.4	173	-77.3	172.2	176.4	159.5	-2.3	111.6	L169 S170 R176 L177	L169-R173 WeakPolarHBondContact O-CB 3.34Å; L169-R173 VanDerWaalsContact O-CG 3.27Å; L169-R173 WeakPolarHBondContact O-CG 3.5Å; L169-R173 PolarHBondContact O-N 3.4Å; S170-R173 PolarHBondContact O-N 2.94Å; R173-R176 PolarHBondContact O-N 3.35Å; R173-L177 WeakPolarHBondContact O-CB 3.45Å; R173-L177 VanDerWaalsContact O-CG 3.31Å; R173-L177 WeakPolarHBondContact O-CG 3.36Å; R173-L177 PolarHBondContact O-N 3.26Å
174	E	97	Very high	94.6	Very high	142 Å²	142	104.8 Å²	104.8	66%	0.664	50%	0.5	S	S	*	.	H	α-helix	trans	-63.6	-42.9	176.3	-174.2	170.9	-157.1	0	0	111.6	S170 E171 E172 R176 L177 A178	S170-E174 WeakPolarHBondContact O-CB 3.27Å; S170-E174 PolarHBondContact O-N 3.08Å; E171-E174 PolarHBondContact O-N 2.96Å; E172-E174 VanDerWaalsContact C-N 3.34Å; E174-R176 PolarHBondContact O-N 2.92Å; E174-L177 PolarHBondContact O-N 2.77Å; E174-A178 WeakPolarHBondContact O-CB 3.47Å; E174-A178 PolarHBondContact O-N 3.39Å
175	R	96.4	Very high	94.1	Very high	142 Å²	142	103 Å²	103	54%	0.536	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-45.8	172.9	-76.3	-164.4	-70.3	-123	-0.4	112.7	E171 E172 A178 I179	E171-R175 WeakPolarHBondContact O-CG 3.47Å; E171-R175 PolarHBondContact O-N 3.24Å; E172-R175 PolarHBondContact O-N 3.38Å; E172-R175 IonicContact OE2-CZ 3.07Å; E172-R175 IonicContact OE2-NE 2.64Å; E172-R175 PolarHBondContact OE2-NE 3.45Å; E172-R175 VanDerWaalsContact OE2-NE 3.08Å; E172-R175 IonicContact OE2-NH2 3.88Å; E172-R175 PolarHBondContact OE2-NH2 2.92Å; R175-A178 PolarHBondContact O-N 3.28Å; R175-I179 WeakPolarHBondContact O-CG1 3.48Å; R175-I179 PolarHBondContact O-N 3.01Å
176	R	94.1	Very high	93.3	Very high	148 Å²	148	103.9 Å²	103.9	56%	0.558	52%	0.519	S	S	*	.	H	α-helix	trans	-61.2	-46.3	177	-72.8	176.6	-171.9	-162.5	-0.8	111.5	E172 R173 E174 A178 I179 E180	E172-R176 WeakPolarHBondContact O-CG 3.44Å; E172-R176 PolarHBondContact O-N 2.74Å; E172-R176 IonicContact OE1-NE 3.4Å; E172-R176 PolarHBondContact OE1-NE 3.08Å; R173-R176 PolarHBondContact O-N 3.35Å; E174-R176 PolarHBondContact O-N 2.92Å; R176-A178 VanDerWaalsContact C-N 3.31Å; R176-A178 PolarHBondContact O-N 3.28Å; R176-I179 PolarHBondContact O-N 3.49Å; R176-E180 WeakPolarHBondContact O-CB 3.31Å; R176-E180 VanDerWaalsContact O-CG 3.29Å; R176-E180 WeakPolarHBondContact O-CG 3.29Å; R176-E180 PolarHBondContact O-N 3.35Å
177	L	95.2	Very high	92	Very high	113 Å²	113	98.4 Å²	98.4	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-60.5	-39.9	176.6	-74	170.5	0	0	0	112.1	R173 E174 E180 A181	R173-L177 WeakPolarHBondContact O-CB 3.45Å; R173-L177 VanDerWaalsContact O-CG 3.31Å; R173-L177 WeakPolarHBondContact O-CG 3.36Å; R173-L177 PolarHBondContact O-N 3.26Å; E174-L177 PolarHBondContact O-N 2.77Å; L177-E180 PolarHBondContact O-N 2.93Å; L177-A181 WeakPolarHBondContact O-CB 3.39Å; L177-A181 PolarHBondContact O-N 3.14Å
178	A	94.8	Very high	90.2	Very high	50 Å²	50	95.6 Å²	95.6	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-63.1	-46.6	175.6	0	0	0	0	0	111.8	E174 R175 R176 A181 E182	E174-A178 WeakPolarHBondContact O-CB 3.47Å; E174-A178 PolarHBondContact O-N 3.39Å; R175-A178 PolarHBondContact O-N 3.28Å; R176-A178 VanDerWaalsContact C-N 3.31Å; R176-A178 PolarHBondContact O-N 3.28Å; A178-A181 PolarHBondContact O-N 3.35Å; A178-E182 WeakPolarHBondContact O-CG 3.44Å; A178-E182 PolarHBondContact O-N 2.94Å
179	I	91.7	Very high	88.1	Confident	95 Å²	95	95.5 Å²	95.5	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-43	177.3	-67.1	166.9	0	0	0	111.2	R175 R176 A181 E182 L183	R175-I179 WeakPolarHBondContact O-CG1 3.48Å; R175-I179 PolarHBondContact O-N 3.01Å; R176-I179 PolarHBondContact O-N 3.49Å; I179-A181 VanDerWaalsContact C-N 3.32Å; I179-A181 PolarHBondContact O-N 3.35Å; I179-E182 PolarHBondContact O-N 3Å; I179-L183 HydrophobicContact CG2-CD1 4.02Å; I179-L183 HydrophobicContact CG2-CG 4.3Å; I179-L183 WeakPolarHBondContact O-CB 3.19Å; I179-L183 WeakPolarHBondContact O-CG 3.43Å; I179-L183 PolarHBondContact O-N 3.31Å
180	E	89.6	Confident	86.2	Confident	96 Å²	96	99 Å²	99	45%	0.449	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176	-74.8	169.9	-166.9	0	0	111.1	R176 L177 L183 I184	R176-E180 WeakPolarHBondContact O-CB 3.31Å; R176-E180 VanDerWaalsContact O-CG 3.29Å; R176-E180 WeakPolarHBondContact O-CG 3.29Å; R176-E180 PolarHBondContact O-N 3.35Å; L177-E180 PolarHBondContact O-N 2.93Å; E180-L183 PolarHBondContact O-N 2.87Å; E180-I184 VanDerWaalsContact O-CG1 3.24Å; E180-I184 WeakPolarHBondContact O-CG1 3.35Å; E180-I184 PolarHBondContact O-N 2.91Å
181	A	91.4	Very high	84.2	Confident	51 Å²	51	104.7 Å²	104.7	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-64.2	-40	174.9	0	0	0	0	0	112.7	L177 A178 I179 S185	L177-A181 WeakPolarHBondContact O-CB 3.39Å; L177-A181 PolarHBondContact O-N 3.14Å; A178-A181 PolarHBondContact O-N 3.35Å; I179-A181 VanDerWaalsContact C-N 3.32Å; I179-A181 PolarHBondContact O-N 3.35Å; A181-S185 WeakPolarHBondContact O-CB 3.42Å; A181-S185 PolarHBondContact O-N 2.91Å; A181-S185 PolarHBondContact O-OG 2.82Å
182	E	90.6	Very high	81.9	Confident	126 Å²	126	109.9 Å²	109.9	59%	0.589	57%	0.57	S	S	*	*	H	α-helix	trans	-65.4	-40.9	174.3	-75.3	179.9	-175.3	0	0	112.2	A178 I179 S185 S186	A178-E182 WeakPolarHBondContact O-CG 3.44Å; A178-E182 PolarHBondContact O-N 2.94Å; I179-E182 PolarHBondContact O-N 3Å; E182-S185 PolarHBondContact O-N 3.11Å; E182-S186 VanDerWaalsContact O-CB 3.25Å; E182-S186 WeakPolarHBondContact O-CB 3.44Å; E182-S186 PolarHBondContact O-N 3.1Å; E182-S186 PolarHBondContact O-OG 3.24Å
183	L	87.1	Confident	79.5	Confident	75 Å²	75	110.1 Å²	110.1	39%	0.393	58%	0.579	S	S	.	*	H	α-helix	trans	-66.4	-40.5	177.4	-76.9	173.1	0	0	0	111.9	I179 E180 S185 G187 G188 F189	I179-L183 HydrophobicContact CG2-CD1 4.02Å; I179-L183 HydrophobicContact CG2-CG 4.3Å; I179-L183 WeakPolarHBondContact O-CB 3.19Å; I179-L183 WeakPolarHBondContact O-CG 3.43Å; I179-L183 PolarHBondContact O-N 3.31Å; E180-L183 PolarHBondContact O-N 2.87Å; L183-S185 VanDerWaalsContact C-N 3.35Å; L183-G187 PolarHBondContact O-N 3.46Å; L183-G188 PolarHBondContact O-N 3.25Å; L183-G188 VanDerWaalsContact O-N 3.15Å; L183-F189 HydrophobicContact CB-CD2 3.7Å; L183-F189 HydrophobicContact CB-CE2 3.2Å; L183-F189 HydrophobicContact CB-CZ 3.98Å; L183-F189 HydrophobicContact CD1-CE2 4.16Å; L183-F189 HydrophobicContact CD1-CZ 4.09Å; L183-F189 HydrophobicContact CG-CE2 4.31Å
184	I	85.2	Confident	76.9	Confident	124 Å²	124	110.9 Å²	110.9	64%	0.636	59%	0.594	S	S	*	*	H	α-helix	trans	-62	-44.6	172.5	-68.3	165.2	0	0	0	109.9	E180 F189	E180-I184 VanDerWaalsContact O-CG1 3.24Å; E180-I184 WeakPolarHBondContact O-CG1 3.35Å; E180-I184 PolarHBondContact O-N 2.91Å; I184-F189 HydrophobicContact CG1-CD2 3.89Å; I184-F189 HydrophobicContact CG1-CE2 3.7Å
185	S	86.6	Confident	74.6	Confident	104 Å²	104	111.4 Å²	111.4	73%	0.727	60%	0.597	S	S	*	*	H	α-helix	trans	-70.4	-35	-178.3	-57.4	0	0	0	0	113.5	A181 E182 L183 G187	A181-S185 WeakPolarHBondContact O-CB 3.42Å; A181-S185 PolarHBondContact O-N 2.91Å; A181-S185 PolarHBondContact O-OG 2.82Å; E182-S185 PolarHBondContact O-N 3.11Å; L183-S185 VanDerWaalsContact C-N 3.35Å; S185-G187 VanDerWaalsContact C-N 3.27Å; S185-G187 PolarHBondContact O-N 2.85Å
186	S	81.6	Confident	72.1	Confident	100 Å²	100	109.8 Å²	109.8	70%	0.699	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-1.1	-178	-55.2	0	0	0	0	113.3	E182 G188	E182-S186 VanDerWaalsContact O-CB 3.25Å; E182-S186 WeakPolarHBondContact O-CB 3.44Å; E182-S186 PolarHBondContact O-N 3.1Å; E182-S186 PolarHBondContact O-OG 3.24Å; S186-G188 PolarHBondContact O-N 2.95Å
187	G	69.4	Low	69.7	Low	57 Å²	57	109.1 Å²	109.1	59%	0.588	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.8	18.3	-176.6	0	0	0	0	0	113.8	L183 S185 F189	L183-G187 PolarHBondContact O-N 3.46Å; S185-G187 VanDerWaalsContact C-N 3.27Å; S185-G187 PolarHBondContact O-N 2.85Å; G187-F189 PolarHBondContact O-N 3.46Å
188	G	60.3	Low	67.5	Low	51 Å²	51	107.3 Å²	107.3	53%	0.526	61%	0.608	S	S	.	*			trans	-74.2	-8.6	-178.1	0	0	0	0	0	114.1	L183 S186 N190	L183-G188 PolarHBondContact O-N 3.25Å; L183-G188 VanDerWaalsContact O-N 3.15Å; S186-G188 PolarHBondContact O-N 2.95Å; G188-N190 PolarHBondContact O-N 3.41Å
189	F	53.5	Low	65.6	Low	95 Å²	95	115 Å²	115	42%	0.417	63%	0.628	S	S	.	*			trans	-82.8	84.3	172.6	-79.9	-79.2	0	0	0	111	L183 I184 G187 Y191	L183-F189 HydrophobicContact CB-CD2 3.7Å; L183-F189 HydrophobicContact CB-CE2 3.2Å; L183-F189 HydrophobicContact CB-CZ 3.98Å; L183-F189 HydrophobicContact CD1-CE2 4.16Å; L183-F189 HydrophobicContact CD1-CZ 4.09Å; L183-F189 HydrophobicContact CG-CE2 4.31Å; I184-F189 HydrophobicContact CG1-CD2 3.89Å; I184-F189 HydrophobicContact CG1-CE2 3.7Å; G187-F189 PolarHBondContact O-N 3.46Å; F189-Y191 VanDerWaalsContact C-N 3.3Å; F189-Y191 HydrophobicContact CB-CD2 4.21Å; F189-Y191 HydrophobicContact CB-CE2 4.33Å; F189-Y191 HydrophobicContact CD1-CE2 4.39Å; F189-Y191 PolarHBondContact O-N 3.32Å
190	N	56.9	Low	63.7	Low	154 Å²	154	118.7 Å²	118.7	82%	0.824	64%	0.643	S	S	*	*			trans	-71.6	91.5	156.6	-86.7	-38.9	0	0	0	108.4	G188 Q192	G188-N190 PolarHBondContact O-N 3.41Å; N190-Q192 PolarHBondContact O-N 3.5Å
191	Y	54.2	Low	61.8	Low	183 Å²	183	120.3 Å²	120.3	72%	0.718	66%	0.655	S	S	*	*			trans	-64.2	102.1	161.8	-90	-93.4	0	0	0	108.3	F189 S193	F189-Y191 VanDerWaalsContact C-N 3.3Å; F189-Y191 HydrophobicContact CB-CD2 4.21Å; F189-Y191 HydrophobicContact CB-CE2 4.33Å; F189-Y191 HydrophobicContact CD1-CE2 4.39Å; F189-Y191 PolarHBondContact O-N 3.32Å; Y191-S193 PolarHBondContact O-N 2.94Å
192	Q	50.5	Low	59.8	Low	188 Å²	188	125.6 Å²	125.6	88%	0.879	67%	0.665	S	S	*	*			trans	-73.4	59.3	152.5	-81.9	174.7	-18.4	0	0	108.7	N190	N190-Q192 PolarHBondContact O-N 3.5Å
193	S	47.1	Very low	58	Low	70 Å²	70	126.7 Å²	126.7	49%	0.49	68%	0.675	S	S	.	*			trans	-106.5	85.8	163.7	63.1	0	0	0	0	107.4	Y191 E195	Y191-S193 PolarHBondContact O-N 2.94Å; S193-E195 PolarHBondContact O-N 3.04Å
194	N	42.4	Very low	56.7	Low	164 Å²	164	130.5 Å²	130.5	88%	0.877	70%	0.695	S	S	*	*			trans	-71.2	73.1	158.6	-70.7	-38.7	0	0	0	107.8
195	E	47.8	Very low	55.5	Low	154 Å²	154	131.5 Å²	131.5	72%	0.72	70%	0.702	S	S	*	*			trans	-177.4	101.4	157.7	-106.9	167.3	-163.2	0	0	105.9	S193 L197	S193-E195 PolarHBondContact O-N 3.04Å; E195-L197 PolarHBondContact O-N 3.25Å
196	S	44.8	Very low	54.2	Low	107 Å²	107	134.3 Å²	134.3	75%	0.748	71%	0.709	S	S	*	*			trans	-59.9	90.2	158.7	52.8	0	0	0	0	106.9	T198	S196-T198 PolarHBondContact O-N 2.79Å
197	L	43.7	Very low	53.2	Low	135 Å²	135	132.3 Å²	132.3	71%	0.707	70%	0.704	S	S	*	*			trans	-73	75.6	169.8	-139.6	141.5	0	0	0	105.9	E195 Y199	E195-L197 PolarHBondContact O-N 3.25Å; L197-Y199 PolarHBondContact O-N 3.33Å
198	T	48.2	Very low	52.6	Low	75 Å²	75	138.1 Å²	138.1	46%	0.46	71%	0.713	S	S	.	*			trans	-59.6	134.1	170.6	44.2	0	0	0	0	107	S196 Q200	S196-T198 PolarHBondContact O-N 2.79Å; T198-Q200 PolarHBondContact O-N 2.82Å
199	Y	54.2	Low	53	Low	211 Å²	211	140.1 Å²	140.1	83%	0.827	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	17.1	177.8	-159.4	-94.8	0	0	0	113.4	L197	L197-Y199 PolarHBondContact O-N 3.33Å
200	Q	52.7	Low	53.6	Low	172 Å²	172	143.3 Å²	143.3	80%	0.804	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	0.2	-172.2	-74.9	-99.6	-55.3	0	0	113.3	T198	T198-Q200 PolarHBondContact O-N 2.82Å
201	N	50.2	Low	54.1	Low	131 Å²	131	142.7 Å²	142.7	70%	0.701	73%	0.725	S	S	*	*			trans	-111.3	19.5	-179.7	-64.8	-40.9	0	0	0	113.9	D203	N201-D203 PolarHBondContact O-N 3.29Å
202	Y	49.2	Very low	54.3	Low	161 Å²	161	143 Å²	143	63%	0.631	73%	0.725	S	S	*	*			trans	-82	95.2	163.5	-74	-79.9	0	0	0	107.2	D204	Y202-D204 PolarHBondContact O-N 2.77Å
203	D	53.6	Low	54.7	Low	149 Å²	149	139 Å²	139	80%	0.797	72%	0.715	S	S	*	*			trans	-61.9	118.3	158.6	-78.7	-41.4	0	0	0	107	N201 D205	N201-D203 PolarHBondContact O-N 3.29Å; D203-D205 PolarHBondContact O-N 2.98Å
204	D	58.7	Low	55.2	Low	155 Å²	155	141.3 Å²	141.3	83%	0.829	73%	0.73	S	S	*	*			trans	-66	37.4	179.8	-67.3	-56.6	0	0	0	113.6	Y202 D206	Y202-D204 PolarHBondContact O-N 2.77Å; D204-D206 PolarHBondContact O-N 3.15Å
205	D	59.2	Low	55.9	Low	145 Å²	145	139.3 Å²	139.3	78%	0.775	72%	0.723	S	S	*	*			trans	-96.1	72.4	-178.6	-105.1	-29.3	0	0	0	111.3	D203 G207	D203-D205 PolarHBondContact O-N 2.98Å; D205-G207 PolarHBondContact O-N 3.26Å
206	D	60	Low	55.7	Low	164 Å²	164	138.3 Å²	138.3	88%	0.877	72%	0.722	S	S	*	*			trans	-74.2	25.9	167.1	-62.8	-28.3	0	0	0	112.4	D204 F208	D204-D206 PolarHBondContact O-N 3.15Å; D206-F208 PolarHBondContact O-N 2.95Å
207	G	61.2	Low	55.6	Low	57 Å²	57	139.6 Å²	139.6	59%	0.588	73%	0.726	S	S	*	*			trans	-76.2	105.2	177.2	0	0	0	0	0	111.1	D205 D209	D205-G207 PolarHBondContact O-N 3.26Å; G207-D209 VanDerWaalsContact C-N 3.31Å; G207-D209 PolarHBondContact O-N 3.36Å
208	F	55.8	Low	55.5	Low	180 Å²	180	136.3 Å²	136.3	79%	0.789	73%	0.725	S	S	*	*			trans	-63.2	91.5	166.1	-174.7	-104.3	0	0	0	109.5	D206 E210	D206-F208 PolarHBondContact O-N 2.95Å; F208-E210 HydrophobicContact CD1-CG 3.73Å; F208-E210 HydrophobicContact CE1-CG 3.54Å; F208-E210 PolarHBondContact O-N 3.38Å
209	D	68.4	Low	55.4	Low	93 Å²	93	139 Å²	139	50%	0.497	74%	0.736	S	S	.	*			trans	-86.4	101.9	172.9	179.8	13.5	0	0	0	110	G207 N211 R212	G207-D209 VanDerWaalsContact C-N 3.31Å; G207-D209 PolarHBondContact O-N 3.36Å; D209-N211 PolarHBondContact O-N 3.18Å; D209-N211 VanDerWaalsContact O-N 3.1Å; D209-N211 WeakPolarHBondContact OD1-CA 3.35Å; D209-N211 WeakPolarHBondContact OD1-CB 3.25Å; D209-N211 PolarHBondContact OD1-N 3.05Å; D209-R212 HydrophobicContact CB-CB 4.23Å; D209-R212 WeakPolarHBondContact O-CB 3.38Å; D209-R212 PolarHBondContact O-N 3.04Å; D209-R212 VanDerWaalsContact O-N 3.11Å
210	E	67.8	Low	55	Low	162 Å²	162	135.1 Å²	135.1	76%	0.757	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-14.9	176.1	-53.3	-169.3	-178.4	0	0	113.2	F208	F208-E210 HydrophobicContact CD1-CG 3.73Å; F208-E210 HydrophobicContact CE1-CG 3.54Å; F208-E210 PolarHBondContact O-N 3.38Å
211	N	65.8	Low	54.6	Low	141 Å²	141	136.6 Å²	136.6	75%	0.754	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	6.4	179.9	-60.6	-62.3	0	0	0	113.3	D209 P213	D209-N211 PolarHBondContact O-N 3.18Å; D209-N211 VanDerWaalsContact O-N 3.1Å; D209-N211 WeakPolarHBondContact OD1-CA 3.35Å; D209-N211 WeakPolarHBondContact OD1-CB 3.25Å; D209-N211 PolarHBondContact OD1-N 3.05Å; N211-P213 WeakPolarHBondContact O-CD 3.24Å; N211-P213 VanDerWaalsContact O-N 3.09Å
212	R	59	Low	54.3	Low	190 Å²	190	137.6 Å²	137.6	72%	0.717	74%	0.742	S	S	*	*			trans	-64.5	112.5	177.6	-162.9	175.3	-156.6	-124.1	6.1	109.3	D209 C214	D209-R212 HydrophobicContact CB-CB 4.23Å; D209-R212 WeakPolarHBondContact O-CB 3.38Å; D209-R212 PolarHBondContact O-N 3.04Å; D209-R212 VanDerWaalsContact O-N 3.11Å; R212-C214 PolarHBondContact O-N 2.96Å
213	P	58.4	Low	54.1	Low	103 Å²	103	135.5 Å²	135.5	67%	0.669	75%	0.746	S	S	*	*			trans	-65.8	130.6	-179.5	26.6	-30.6	0	0	0	108.1	N211 V215	N211-P213 WeakPolarHBondContact O-CD 3.24Å; N211-P213 VanDerWaalsContact O-N 3.09Å; P213-V215 PolarHBondContact O-N 3.24Å
214	C	57.5	Low	53.6	Low	119 Å²	119	134 Å²	134	80%	0.804	75%	0.746	S	S	*	*			trans	-54.6	111.5	170.4	-65.1	0	0	0	0	107.5	R212 L216	R212-C214 PolarHBondContact O-N 2.96Å; C214-L216 PolarHBondContact O-N 2.81Å
215	V	56.7	Low	52.9	Low	122 Å²	122	133 Å²	133	74%	0.739	74%	0.74	S	S	*	*			trans	-72	65.1	167.3	-96	0	0	0	0	108.4	P213	P213-V215 PolarHBondContact O-N 3.24Å
216	L	45.4	Very low	52.2	Low	132 Å²	132	132.7 Å²	132.7	69%	0.691	74%	0.738	S	S	*	*			trans	-107.9	51.2	162.2	-156.6	77.3	0	0	0	107.6	C214 G218 L219	C214-L216 PolarHBondContact O-N 2.81Å; L216-G218 PolarHBondContact O-N 3.44Å; L216-G218 VanDerWaalsContact O-N 3.14Å; L216-L219 HydrophobicContact CD2-CD1 4.14Å
217	T	41.7	Very low	51.4	Low	134 Å²	134	133.5 Å²	133.5	82%	0.822	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	86.5	173.1	42.7	0	0	0	0	108.4
218	G	42	Very low	50.6	Low	67 Å²	67	137.4 Å²	137.4	69%	0.691	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-177.6	-8.3	175.6	0	0	0	0	0	118.3	L216	L216-G218 PolarHBondContact O-N 3.44Å; L216-G218 VanDerWaalsContact O-N 3.14Å
219	L	46.3	Very low	49.8	Very low	131 Å²	131	134.3 Å²	134.3	69%	0.686	74%	0.738	S	S	*	*			trans	-99.5	101.8	-179	-73.3	167.8	0	0	0	111.9	L216 K221	L216-L219 HydrophobicContact CD2-CD1 4.14Å; L219-K221 PolarHBondContact O-N 3.33Å
220	T	45.3	Very low	48.5	Very low	129 Å²	129	137.5 Å²	137.5	79%	0.791	76%	0.755	S	S	*	*			trans	-53.8	128.1	158.3	36.1	0	0	0	0	109.7	L222	T220-L222 PolarHBondContact O-N 2.91Å; T220-L222 VanDerWaalsContact O-N 3.11Å
221	K	44.2	Very low	47.2	Very low	204 Å²	204	138 Å²	138	89%	0.887	76%	0.762	S	S	*	*			trans	-20	103.7	175.2	-80	173.2	171.2	174.5	0	114.6	L219 T223	L219-K221 PolarHBondContact O-N 3.33Å; K221-T223 PolarHBondContact O-N 2.81Å
222	L	45	Very low	46	Very low	151 Å²	151	136.8 Å²	136.8	79%	0.791	76%	0.761	S	S	*	*			trans	-80.9	107	155.2	-84.1	158.4	0	0	0	107.6	T220 C224	T220-L222 PolarHBondContact O-N 2.91Å; T220-L222 VanDerWaalsContact O-N 3.11Å; L222-C224 PolarHBondContact O-N 2.82Å
223	T	45	Very low	45.2	Very low	117 Å²	117	132.2 Å²	132.2	72%	0.718	76%	0.759	S	S	*	*			trans	-64.3	114.7	166.8	36.6	0	0	0	0	109	K221 L225	K221-T223 PolarHBondContact O-N 2.81Å; T223-L225 PolarHBondContact O-N 3.44Å; T223-L225 VanDerWaalsContact O-N 3.13Å
224	C	41.5	Very low	44.4	Very low	117 Å²	117	132.5 Å²	132.5	79%	0.791	76%	0.763	S	S	*	*			trans	-60.2	110.7	171.7	-50.8	0	0	0	0	109.4	L222 N226	L222-C224 PolarHBondContact O-N 2.82Å; C224-N226 PolarHBondContact O-N 2.74Å
225	L	44.5	Very low	43.8	Very low	136 Å²	136	131.9 Å²	131.9	71%	0.712	77%	0.766	S	S	*	*			trans	-78.8	101.4	168.5	-70.6	175.3	0	0	0	108.6	T223 F227	T223-L225 PolarHBondContact O-N 3.44Å; T223-L225 VanDerWaalsContact O-N 3.13Å; L225-F227 HydrophobicContact CB-CD2 4.31Å; L225-F227 HydrophobicContact CB-CE2 3.8Å; L225-F227 HydrophobicContact CB-CZ 4.37Å; L225-F227 HydrophobicContact CD1-CE2 4.21Å; L225-F227 HydrophobicContact CD1-CZ 4.3Å; L225-F227 PolarHBondContact O-N 3.33Å
226	N	45.7	Very low	43.2	Very low	137 Å²	137	135.4 Å²	135.4	73%	0.733	78%	0.775	S	S	*	*			trans	-71.1	113.6	164	-77.2	-24.1	0	0	0	108.6	C224	C224-N226 PolarHBondContact O-N 2.74Å
227	F	41.5	Very low	43.3	Very low	182 Å²	182	134 Å²	134	80%	0.798	78%	0.782	S	S	*	*			trans	-100.5	80.5	162.8	-69.6	-76	0	0	0	108.6	L225	L225-F227 HydrophobicContact CB-CD2 4.31Å; L225-F227 HydrophobicContact CB-CE2 3.8Å; L225-F227 HydrophobicContact CB-CZ 4.37Å; L225-F227 HydrophobicContact CD1-CE2 4.21Å; L225-F227 HydrophobicContact CD1-CZ 4.3Å; L225-F227 PolarHBondContact O-N 3.33Å
228	N	44.4	Very low	43.3	Very low	139 Å²	139	135.5 Å²	135.5	74%	0.743	79%	0.785	S	S	*	*			trans	-78.9	122.5	160.8	-82.9	-23.2	0	0	0	108.1
229	T	38.8	Very low	43.4	Very low	114 Å²	114	138 Å²	138	70%	0.699	79%	0.792	S	S	*	*			trans	13.5	121.7	143.3	47.6	0	0	0	0	117.1
230	D	42.9	Very low	43.6	Very low	160 Å²	160	136.5 Å²	136.5	86%	0.856	79%	0.793	S	S	*	*				-171.9	118.4	117.3	-84.8	-25.1	0	0	0	110.7
231	L	38.9	Very low	43.7	Very low	172 Å²	172	137 Å²	137	90%	0.901	79%	0.79	S	S	*	*			trans	-103.3	131.9	170.2	-155	96.5	0	0	0	106.7
232	P	42.3	Very low	44.1	Very low	116 Å²	116	135.6 Å²	135.6	75%	0.753	79%	0.787	S	S	*	*			trans	-134.2	112.6	150.3	29.8	-12.6	0	0	0	113
233	S	41.2	Very low	44.4	Very low	94 Å²	94	134.7 Å²	134.7	66%	0.657	78%	0.783	S	S	*	*				24.4	110.5	124.1	157.6	0	0	0	0	118.5
234	S	41	Very low	44.9	Very low	110 Å²	110	134 Å²	134	77%	0.769	78%	0.783	S	S	*	*				44.7	120.3	127.6	20.5	0	0	0	0	120.8
235	A	44.8	Very low	45.5	Very low	105 Å²	105	133.6 Å²	133.6	87%	0.868	78%	0.777	S	S	*	*				-174	136.3	126.8	0	0	0	0	0	111.4
236	E	43.8	Very low	45.9	Very low	197 Å²	197	134.8 Å²	134.8	92%	0.921	78%	0.783	S	S	*	*			trans	-73.1	153.3	175.7	-55.6	-160.4	144.3	0	0	113.4
237	A	47.7	Very low	46.1	Very low	101 Å²	101	136.9 Å²	136.9	84%	0.835	79%	0.788	S	S	*	*			trans	-170.1	120.3	145.1	0	0	0	0	0	111.6
238	D	42.4	Very low	46.9	Very low	166 Å²	166	136.3 Å²	136.3	89%	0.888	79%	0.788	S	S	*	*			trans	-57.5	147.5	163.5	-76.2	-45.7	0	0	0	113
239	S	45	Very low	47.5	Very low	121 Å²	121	135.3 Å²	135.3	85%	0.846	79%	0.789	S	S	*	*			trans	-171	143.4	130.9	52.1	0	0	0	0	112.8
240	S	49.2	Very low	48.5	Very low	99 Å²	99	145 Å²	145	69%	0.692	81%	0.813	S	S	*	*			trans	-76.8	160.3	-174.6	51.9	0	0	0	0	115.3
241	N	48.6	Very low	48.7	Very low	139 Å²	139	144.3 Å²	144.3	74%	0.743	81%	0.811	S	S	*	*				165.6	117.3	128.1	-80.5	-9.5	0	0	0	108.5
242	E	52.7	Low	49.3	Very low	175 Å²	175	142.8 Å²	142.8	82%	0.818	81%	0.806	S	S	*	*				55.7	125.4	87.9	-57.7	-79.7	127.8	0	0	110
243	D	50.7	Low	49.6	Very low	132 Å²	132	144.3 Å²	144.3	71%	0.706	81%	0.809	S	S	*	*			cis	178.4	152.4	33.4	178	16.1	0	0	0	106.3
244	S	55.4	Low	50.1	Low	103 Å²	103	147.3 Å²	147.3	72%	0.72	82%	0.818	S	S	*	*			trans	156.7	95.7	140.8	-71.9	0	0	0	0	114.5
245	T	54.1	Low	50.7	Low	108 Å²	108	149.6 Å²	149.6	66%	0.663	82%	0.821	S	S	*	*				69.1	101.2	114.9	-46.6	0	0	0	0	121.4
246	L	53.7	Low	51.1	Low	160 Å²	160	152.6 Å²	152.6	84%	0.838	82%	0.818	S	S	*	*				41.7	124.4	121.8	-61.1	164.9	0	0	0	120.4
247	H	49.9	Very low	51.6	Low	181 Å²	181	149.4 Å²	149.4	84%	0.838	81%	0.811	S	S	*	*				-174.3	138.5	96.7	-152.1	-57.7	0	0	0	112.3
248	E	56.5	Low	51.9	Low	170 Å²	170	153.2 Å²	153.2	79%	0.794	81%	0.809	S	S	*	*			trans	-57.9	169.2	-178	-103.6	-175.9	124.3	0	0	119.1
249	P	57.9	Low	52.7	Low	119 Å²	119	152.1 Å²	152.1	77%	0.773	80%	0.803	S	S	*	*			trans	-96.1	171.1	-173.7	40	-32.9	0	0	0	114.4
250	R	58.8	Low	53.4	Low	318 Å²	318	154.9 Å²	154.9	100%	1.2	80%	0.799	S	S	*	*			trans	-138.9	0	151.6	-160	-179.8	-170.2	173.5	4.4	109.2

Retrieved 250 of 250 residues in 132.6 ms (Link to these results)

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