A0A087WTV6_HUMAN Loading...

Pyrroline-5-carboxylate reductase 2

Oxidoreductase that catalyzes the last step in proline biosynthesis, which corresponds to the reduction of pyrroline-5-carboxylate to L-proline using NAD(P)H. At physiologic concentrations, has higher specific activity in the presence of NADH. Involved in cellular response to oxidative stress. In some cell types, such as erythrocytes, its primary function may be the generation of NADP(+).

AlphaFold DB , UniProt , Accession A0A087WTV6, Species HUMAN (Homo sapiens, Human), Gene PYCR2, Length 246 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	84	Confident	90.3	Very high	141 Å²	141	33.3 Å²	33.3	70%	0.695	19%	0.186	S	C	*	.				0	93.9	0	-150.5	171.4	87.1	0	0	110.4	L25 D64 V65	M1-L25 HydrophobicContact CE-CD1 3.76Å; M1-D64 WeakPolarHBondContact CA-OD2 3.38Å; M1-D64 PolarHBondContact N-OD2 2.93Å; M1-V65 HydrophobicContact CG-CG2 4.44Å; M1-V65 HydrophobicContact SD-CG2 4.48Å
2	S	92.3	Very high	90.1	Very high	25 Å²	25	30.6 Å²	30.6	18%	0.175	17%	0.171	C	C	.	.			trans	-106.3	149.7	166.1	49.1	0	0	0	0	110.1	K29 H62 S63 D64 V65	S2-K29 WeakPolarHBondContact CA-O 3.34Å; S2-K29 WeakPolarHBondContact CB-O 3.36Å; S2-H62 WeakPolarHBondContact CB-O 3.31Å; S2-H62 PolarHBondContact OG-O 3.05Å; S2-S63 WeakPolarHBondContact OG-CA 3.32Å; S2-D64 PolarHBondContact N-OD2 3.41Å; S2-D64 PolarHBondContact O-N 3.36Å; S2-D64 PolarHBondContact OG-N 2.85Å; S2-V65 PolarHBondContact O-N 3.21Å; S2-V65 VanDerWaalsContact O-N 3.14Å
3	V	95.1	Very high	90.2	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.03	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.6	-176.8	176.9	0	0	0	0	109.7	F5 F19 L25 K29 I30 I31 V65 F67	V3-F5 HydrophobicContact CG1-CD2 4.33Å; V3-F5 HydrophobicContact CG1-CE2 3.74Å; V3-F5 HydrophobicContact CG1-CZ 3.99Å; V3-F19 HydrophobicContact CG1-CE2 4.47Å; V3-L25 HydrophobicContact CB-CD2 3.81Å; V3-L25 HydrophobicContact CG2-CD1 3.84Å; V3-L25 HydrophobicContact CG2-CD2 3.57Å; V3-L25 HydrophobicContact CG2-CG 4.35Å; V3-K29 PolarHBondContact N-O 3.47Å; V3-I30 CarbonylContact O-C 3.56Å; V3-I30 VanDerWaalsContact O-CA 3.29Å; V3-I30 WeakPolarHBondContact O-CA 3.27Å; V3-I31 PolarHBondContact O-N 3.32Å; V3-V65 CarbonylContact C-O 3.36Å; V3-V65 WeakPolarHBondContact CA-O 3.17Å; V3-V65 HydrophobicContact CG2-CB 4.46Å; V3-F67 HydrophobicContact CG1-CD2 3.53Å; V3-F67 HydrophobicContact CG1-CE2 3.55Å
4	G	95.5	Very high	89.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.3	176.3	0	0	0	0	0	111.9	I31 S63 V65 L66 F67	G4-I31 CarbonylContact C-O 3.5Å; G4-I31 VanDerWaalsContact CA-O 3.26Å; G4-I31 WeakPolarHBondContact CA-O 3.49Å; G4-S63 WeakPolarHBondContact CA-OG 3.16Å; G4-S63 PolarHBondContact N-OG 3.14Å; G4-V65 PolarHBondContact N-O 3.25Å; G4-L66 CarbonylContact O-C 3.52Å; G4-L66 WeakPolarHBondContact O-CA 3.2Å; G4-F67 PolarHBondContact O-N 3.46Å
5	F	94.5	Very high	89.8	Confident	1 Å²	1	34.5 Å²	34.5	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	117.5	168.7	-67	-85.8	0	0	0	109.1	V3 A12 L15 A16 F19 I30 I31 A32 S33 F67	V3-F5 HydrophobicContact CG1-CD2 4.33Å; V3-F5 HydrophobicContact CG1-CE2 3.74Å; V3-F5 HydrophobicContact CG1-CZ 3.99Å; F5-A12 HydrophobicContact CB-CB 4.03Å; F5-A12 HydrophobicContact CD1-CB 3.9Å; F5-A12 HydrophobicContact CG-CB 4.01Å; F5-L15 HydrophobicContact CE1-CB 3.75Å; F5-L15 HydrophobicContact CE1-CD1 3.81Å; F5-L15 HydrophobicContact CE1-CG 4.45Å; F5-L15 HydrophobicContact CZ-CB 3.76Å; F5-A16 HydrophobicContact CE2-CB 4.27Å; F5-F19 HydrophobicContact CZ-CD2 4.22Å; F5-F19 AromaticContact CZ-CE2 3.86Å; F5-F19 HydrophobicContact CZ-CE2 3.86Å; F5-I30 HydrophobicContact CD2-CG2 3.58Å; F5-I30 HydrophobicContact CE2-CG2 3.49Å; F5-I30 VanDerWaalsContact CE2-CG2 3.49Å; F5-I31 PolarHBondContact N-O 2.84Å; F5-A32 HydrophobicContact CB-CB 3.93Å; F5-A32 CarbonylContact O-C 3.25Å; F5-A32 VanDerWaalsContact O-CA 3.26Å; F5-A32 WeakPolarHBondContact O-CA 3.47Å; F5-S33 PolarHBondContact O-N 3.3Å; F5-F67 WeakPolarHBondContact CA-O 3.19Å; F5-F67 HydrophobicContact CD1-CB 3.49Å; F5-F67 VanDerWaalsContact CD1-CB 3.49Å; F5-F67 HydrophobicContact CD1-CD2 4.31Å; F5-F67 HydrophobicContact CD1-CG 4.06Å; F5-F67 HydrophobicContact CE1-CB 3.7Å; F5-F67 HydrophobicContact CE1-CD1 4.42Å; F5-F67 AromaticContact CE1-CD2 3.81Å; F5-F67 HydrophobicContact CE1-CD2 3.81Å; F5-F67 AromaticContact CE1-CG 3.72Å; F5-F67 HydrophobicContact CE1-CG 3.72Å; F5-F67 HydrophobicContact CG-CB 4.35Å; F5-F67 HydrophobicContact CZ-CD2 4.1Å; F5-F67 HydrophobicContact CZ-CG 4.45Å
6	I	91.6	Very high	89.9	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	110.2	164.1	-60.2	-172.1	0	0	0	107.1	N56 T59 V60 L66 F67 L68 A69 V70 I78 I82	I6-N56 HydrophobicContact CD1-CB 4.24Å; I6-T59 HydrophobicContact CG1-CG2 4.24Å; I6-V60 HydrophobicContact CD1-CG2 4.27Å; I6-L66 HydrophobicContact CD1-CD1 4.35Å; I6-L66 HydrophobicContact CD1-CD2 3.7Å; I6-L66 HydrophobicContact CD1-CG 4.29Å; I6-L66 HydrophobicContact CG1-CD1 4.29Å; I6-L66 HydrophobicContact CG1-CD2 4.22Å; I6-L66 HydrophobicContact CG1-CG 4.29Å; I6-F67 PolarHBondContact N-O 3.39Å; I6-L68 HydrophobicContact CB-CD2 4.13Å; I6-L68 HydrophobicContact CD1-CD2 3.91Å; I6-L68 HydrophobicContact CG1-CD2 4.31Å; I6-A69 CarbonylContact O-C 3.57Å; I6-A69 WeakPolarHBondContact O-CA 3.41Å; I6-A69 PolarHBondContact O-N 3.49Å; I6-V70 HydrophobicContact CG2-CG1 4.18Å; I6-V70 WeakPolarHBondContact O-CG1 3.46Å; I6-I78 HydrophobicContact CD1-CG2 3.83Å; I6-I78 HydrophobicContact CG2-CD1 3.64Å; I6-I78 HydrophobicContact CG2-CG1 4.23Å; I6-I78 HydrophobicContact CG2-CG2 3.9Å; I6-I82 HydrophobicContact CD1-CD1 3.33Å; I6-I82 HydrophobicContact CD1-CG2 4.29Å
7	G	90.3	Very high	90	Very high	9 Å²	9	39.4 Å²	39.4	9%	0.093	20%	0.204	C	C	.	.			trans	103.6	124.3	-169.1	0	0	0	0	0	112	A12 S33	G7-A12 WeakPolarHBondContact O-CB 3.42Å; G7-S33 CarbonylContact C-O 3.56Å; G7-S33 VanDerWaalsContact C-O 3.25Å; G7-S33 WeakPolarHBondContact CA-O 3.36Å; G7-S33 PolarHBondContact N-O 3.29Å
8	A	90.8	Very high	89.8	Confident	2 Å²	2	39.4 Å²	39.4	2%	0.017	22%	0.216	C	C	.	.			trans	-106.9	39	178.3	0	0	0	0	0	112.7	A32 S33 T41 V42 L45	A8-A32 HydrophobicContact CB-CB 4.44Å; A8-S33 PolarHBondContact N-O 3.44Å; A8-T41 WeakPolarHBondContact O-CB 3.39Å; A8-T41 PolarHBondContact O-OG1 3.18Å; A8-V42 HydrophobicContact CB-CG2 3.7Å; A8-L45 HydrophobicContact CB-CD1 3.97Å
9	G	87.9	Confident	89.9	Confident	30 Å²	30	39.8 Å²	39.8	31%	0.309	22%	0.215	S	C	.	.	S	Bend	trans	-80.4	-167.5	178.8	0	0	0	0	0	113.8	L11 A12 Y13	G9-L11 VanDerWaalsContact C-N 3.29Å; G9-L11 PolarHBondContact O-N 3.4Å; G9-A12 PolarHBondContact O-N 3.34Å; G9-Y13 PolarHBondContact O-N 3.06Å; G9-Y13 VanDerWaalsContact O-N 3.07Å
10	Q	86	Confident	89.9	Confident	135 Å²	135	40 Å²	40	63%	0.631	22%	0.218	S	C	*	.	H	α-helix	trans	-59.5	-38.2	179.4	-63.9	-63.2	-11.1	0	0	112.7	Y13 A14 T41	Q10-Y13 PolarHBondContact O-N 2.54Å; Q10-A14 WeakPolarHBondContact O-CB 3.17Å; Q10-A14 PolarHBondContact O-N 3.46Å; Q10-T41 HydrophobicContact CG-CG2 4.33Å
11	L	84.8	Confident	89.7	Confident	17 Å²	17	42.2 Å²	42.2	9%	0.089	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-47.3	178.9	-178.3	64.8	0	0	0	112.1	G9 Y13 A14 L15 A69 C95 I101	G9-L11 VanDerWaalsContact C-N 3.29Å; G9-L11 PolarHBondContact O-N 3.4Å; L11-Y13 VanDerWaalsContact C-N 3.3Å; L11-Y13 PolarHBondContact O-N 3.04Å; L11-A14 PolarHBondContact O-N 3.32Å; L11-L15 HydrophobicContact CD1-CD1 4.08Å; L11-L15 HydrophobicContact CD1-CG 4.25Å; L11-L15 HydrophobicContact CG-CD1 4.02Å; L11-L15 WeakPolarHBondContact O-CG 3.35Å; L11-L15 PolarHBondContact O-N 2.64Å; L11-A69 HydrophobicContact CD2-CB 4.21Å; L11-C95 HydrophobicContact CD2-CB 3.46Å; L11-C95 VanDerWaalsContact CD2-CB 3.46Å; L11-I101 HydrophobicContact CB-CD1 4.23Å; L11-I101 HydrophobicContact CB-CG1 4.11Å; L11-I101 HydrophobicContact CD1-CG1 4.23Å; L11-I101 HydrophobicContact CD2-CD1 4.16Å; L11-I101 HydrophobicContact CD2-CG1 3.98Å; L11-I101 HydrophobicContact CG-CG1 4.33Å
12	A	88.9	Confident	89.8	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-40.6	177.7	0	0	0	0	0	111.2	F5 G7 G9 A16 A69	F5-A12 HydrophobicContact CB-CB 4.03Å; F5-A12 HydrophobicContact CD1-CB 3.9Å; F5-A12 HydrophobicContact CG-CB 4.01Å; G7-A12 WeakPolarHBondContact O-CB 3.42Å; G9-A12 PolarHBondContact O-N 3.34Å; A12-A16 WeakPolarHBondContact O-CB 3.05Å; A12-A16 PolarHBondContact O-N 3.37Å; A12-A69 HydrophobicContact CB-CB 4.29Å
13	Y	90.4	Very high	89.5	Confident	59 Å²	59	40.7 Å²	40.7	23%	0.231	26%	0.26	C	S	.	.	H	α-helix	trans	-60.9	-47.6	173.2	176.6	-106.1	0	0	0	112.6	G9 Q10 L11 R17 A44 L45 M48	G9-Y13 PolarHBondContact O-N 3.06Å; G9-Y13 VanDerWaalsContact O-N 3.07Å; Q10-Y13 PolarHBondContact O-N 2.54Å; L11-Y13 VanDerWaalsContact C-N 3.3Å; L11-Y13 PolarHBondContact O-N 3.04Å; Y13-R17 VanDerWaalsContact O-CB 3.23Å; Y13-R17 WeakPolarHBondContact O-CB 3.38Å; Y13-R17 PolarHBondContact O-N 3.2Å; Y13-A44 HydrophobicContact CD2-CB 3.94Å; Y13-A44 HydrophobicContact CE2-CB 3.47Å; Y13-A44 VanDerWaalsContact CE2-CB 3.47Å; Y13-L45 HydrophobicContact CD2-CD2 4.11Å; Y13-L45 HydrophobicContact CD2-CG 4.09Å; Y13-M48 HydrophobicContact CD2-SD 3.98Å; Y13-M48 HydrophobicContact CE2-SD 3.46Å; Y13-M48 WeakPolarHBondContact CE2-SD 3.4Å
14	A	86.5	Confident	89	Confident	45 Å²	45	46 Å²	46	37%	0.372	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-45.9	179.8	0	0	0	0	0	112.1	Q10 L11 R17 G18	Q10-A14 WeakPolarHBondContact O-CB 3.17Å; Q10-A14 PolarHBondContact O-N 3.46Å; L11-A14 PolarHBondContact O-N 3.32Å; A14-R17 PolarHBondContact O-N 2.94Å; A14-G18 PolarHBondContact O-N 2.96Å
15	L	88.9	Confident	88.7	Confident	46 Å²	46	46.5 Å²	46.5	24%	0.241	29%	0.29	C	S	.	.	H	α-helix	trans	-67.2	-46.4	178.4	-71.1	173.3	0	0	0	111.8	F5 L11 R17 G18 F19 F67	F5-L15 HydrophobicContact CE1-CB 3.75Å; F5-L15 HydrophobicContact CE1-CD1 3.81Å; F5-L15 HydrophobicContact CE1-CG 4.45Å; F5-L15 HydrophobicContact CZ-CB 3.76Å; L11-L15 HydrophobicContact CD1-CD1 4.08Å; L11-L15 HydrophobicContact CD1-CG 4.25Å; L11-L15 HydrophobicContact CG-CD1 4.02Å; L11-L15 WeakPolarHBondContact O-CG 3.35Å; L11-L15 PolarHBondContact O-N 2.64Å; L15-R17 VanDerWaalsContact C-N 3.29Å; L15-R17 PolarHBondContact O-N 3.18Å; L15-G18 PolarHBondContact O-N 2.92Å; L15-G18 VanDerWaalsContact O-N 3.17Å; L15-F19 HydrophobicContact CB-CE2 4.18Å; L15-F19 HydrophobicContact CB-CZ 4.44Å; L15-F19 HydrophobicContact CD2-CZ 4.3Å; L15-F19 WeakPolarHBondContact O-CD2 3.29Å; L15-F19 VanDerWaalsContact O-CG 3.24Å; L15-F19 WeakPolarHBondContact O-CG 3.48Å; L15-F19 PolarHBondContact O-N 2.98Å; L15-F67 HydrophobicContact CD1-CD1 4.28Å
16	A	91.3	Very high	88.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60	-41.4	177	0	0	0	0	0	111.6	F5 A12 T20 I30 L45 M48 V50	F5-A16 HydrophobicContact CE2-CB 4.27Å; A12-A16 WeakPolarHBondContact O-CB 3.05Å; A12-A16 PolarHBondContact O-N 3.37Å; A16-T20 WeakPolarHBondContact O-CB 3.01Å; A16-T20 VanDerWaalsContact O-CG2 3.29Å; A16-T20 WeakPolarHBondContact O-CG2 3.37Å; A16-T20 PolarHBondContact O-N 3.18Å; A16-T20 VanDerWaalsContact O-N 3.09Å; A16-T20 PolarHBondContact O-OG1 3.27Å; A16-I30 HydrophobicContact CB-CD1 4.07Å; A16-I30 HydrophobicContact CB-CG2 4.43Å; A16-L45 HydrophobicContact CB-CD2 3.76Å; A16-M48 HydrophobicContact CB-CE 4.05Å; A16-V50 HydrophobicContact CB-CG2 4.39Å
17	R	90.8	Very high	88.5	Confident	152 Å²	152	50.1 Å²	50.1	57%	0.574	32%	0.316	S	S	*	.	H	α-helix	trans	-67.3	-40.3	175.9	-172.5	-180	175.6	-148.9	-1.2	111.6	Y13 A14 L15 T20 A21 M48	Y13-R17 VanDerWaalsContact O-CB 3.23Å; Y13-R17 WeakPolarHBondContact O-CB 3.38Å; Y13-R17 PolarHBondContact O-N 3.2Å; A14-R17 PolarHBondContact O-N 2.94Å; L15-R17 VanDerWaalsContact C-N 3.29Å; L15-R17 PolarHBondContact O-N 3.18Å; R17-T20 WeakPolarHBondContact CA-OG1 3.43Å; R17-T20 PolarHBondContact O-OG1 3.15Å; R17-T20 VanDerWaalsContact O-OG1 3.04Å; R17-A21 WeakPolarHBondContact O-CB 3.4Å; R17-A21 PolarHBondContact O-N 3.31Å; R17-M48 HydrophobicContact CB-CE 4.03Å; R17-M48 HydrophobicContact CB-SD 4.14Å; R17-M48 HydrophobicContact CG-SD 4.46Å
18	G	87.3	Confident	88.6	Confident	40 Å²	40	55.3 Å²	55.3	41%	0.412	34%	0.338	S	S	.	.	H	α-helix	trans	-62.1	-49.2	176.2	0	0	0	0	0	112.4	A14 L15 T20 A21 A22	A14-G18 PolarHBondContact O-N 2.96Å; L15-G18 PolarHBondContact O-N 2.92Å; L15-G18 VanDerWaalsContact O-N 3.17Å; G18-T20 PolarHBondContact O-N 2.55Å; G18-A21 PolarHBondContact O-N 3.17Å; G18-A22 VanDerWaalsContact O-CB 3.24Å; G18-A22 WeakPolarHBondContact O-CB 3.27Å; G18-A22 PolarHBondContact O-N 3.21Å
19	F	90.4	Very high	88.8	Confident	47 Å²	47	60 Å²	60	21%	0.206	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-39.7	179.4	-63.2	-28.4	0	0	0	113	V3 F5 L15 G23 I24 L25 F67	V3-F19 HydrophobicContact CG1-CE2 4.47Å; F5-F19 HydrophobicContact CZ-CD2 4.22Å; F5-F19 AromaticContact CZ-CE2 3.86Å; F5-F19 HydrophobicContact CZ-CE2 3.86Å; L15-F19 HydrophobicContact CB-CE2 4.18Å; L15-F19 HydrophobicContact CB-CZ 4.44Å; L15-F19 HydrophobicContact CD2-CZ 4.3Å; L15-F19 WeakPolarHBondContact O-CD2 3.29Å; L15-F19 VanDerWaalsContact O-CG 3.24Å; L15-F19 WeakPolarHBondContact O-CG 3.48Å; L15-F19 PolarHBondContact O-N 2.98Å; F19-G23 PolarHBondContact O-N 3.37Å; F19-I24 PolarHBondContact O-N 3.42Å; F19-L25 HydrophobicContact CB-CB 4.27Å; F19-L25 PolarHBondContact O-N 2.99Å; F19-F67 HydrophobicContact CE2-CE2 4.03Å; F19-F67 HydrophobicContact CE2-CZ 4.13Å; F19-F67 HydrophobicContact CZ-CE2 4.29Å; F19-F67 AromaticContact CZ-CZ 3.93Å; F19-F67 HydrophobicContact CZ-CZ 3.93Å
20	T	90.6	Very high	89.2	Confident	44 Å²	44	58.6 Å²	58.6	27%	0.27	34%	0.343	S	S	.	.	H	α-helix	trans	-72.2	-43.6	177.7	49.5	0	0	0	0	111.9	A16 R17 G18 A22 G23 L25 A27 I30	A16-T20 WeakPolarHBondContact O-CB 3.01Å; A16-T20 VanDerWaalsContact O-CG2 3.29Å; A16-T20 WeakPolarHBondContact O-CG2 3.37Å; A16-T20 PolarHBondContact O-N 3.18Å; A16-T20 VanDerWaalsContact O-N 3.09Å; A16-T20 PolarHBondContact O-OG1 3.27Å; R17-T20 WeakPolarHBondContact CA-OG1 3.43Å; R17-T20 PolarHBondContact O-OG1 3.15Å; R17-T20 VanDerWaalsContact O-OG1 3.04Å; G18-T20 PolarHBondContact O-N 2.55Å; T20-A22 VanDerWaalsContact C-N 3.32Å; T20-A22 PolarHBondContact O-N 3.42Å; T20-G23 PolarHBondContact O-N 3Å; T20-G23 VanDerWaalsContact O-N 3.13Å; T20-L25 WeakPolarHBondContact CA-O 3.26Å; T20-L25 WeakPolarHBondContact CG2-O 3.22Å; T20-A27 HydrophobicContact CG2-CB 3.95Å; T20-I30 HydrophobicContact CG2-CD1 3.92Å
21	A	86.5	Confident	89.7	Confident	87 Å²	87	52.8 Å²	52.8	72%	0.719	32%	0.316	S	S	*	.	H	α-helix	trans	-65.8	-33.8	177.7	0	0	0	0	0	112.8	R17 G18 G23	R17-A21 WeakPolarHBondContact O-CB 3.4Å; R17-A21 PolarHBondContact O-N 3.31Å; G18-A21 PolarHBondContact O-N 3.17Å; A21-G23 PolarHBondContact O-N 3.5Å
22	A	85.6	Confident	90.2	Very high	66 Å²	66	52 Å²	52	55%	0.545	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-5.3	175.5	0	0	0	0	0	113.6	G18 T20 I24	G18-A22 VanDerWaalsContact O-CB 3.24Å; G18-A22 WeakPolarHBondContact O-CB 3.27Å; G18-A22 PolarHBondContact O-N 3.21Å; T20-A22 VanDerWaalsContact C-N 3.32Å; T20-A22 PolarHBondContact O-N 3.42Å; A22-I24 HydrophobicContact CB-CD1 3.72Å; A22-I24 HydrophobicContact CB-CG1 3.83Å; A22-I24 PolarHBondContact O-N 3.13Å
23	G	86.2	Confident	90.5	Very high	68 Å²	68	52 Å²	52	70%	0.701	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	10.5	-178.1	0	0	0	0	0	114.7	F19 T20 A21	F19-G23 PolarHBondContact O-N 3.37Å; T20-G23 PolarHBondContact O-N 3Å; T20-G23 VanDerWaalsContact O-N 3.13Å; A21-G23 PolarHBondContact O-N 3.5Å
24	I	84.7	Confident	90.6	Very high	115 Å²	115	49.6 Å²	49.6	59%	0.59	30%	0.304	S	S	*	.	S	Bend	trans	-75.3	-38.5	-176.7	-59.9	169.7	0	0	0	110.7	F19 A22	F19-I24 PolarHBondContact O-N 3.42Å; A22-I24 HydrophobicContact CB-CD1 3.72Å; A22-I24 HydrophobicContact CB-CG1 3.83Å; A22-I24 PolarHBondContact O-N 3.13Å
25	L	88.5	Confident	90.6	Very high	12 Å²	12	53.2 Å²	53.2	6%	0.063	32%	0.323	C	S	.	.	S	Bend	trans	-139.1	135.9	-179.6	-133.2	98.7	0	0	0	111.3	M1 V3 F19 T20 K29 I30	M1-L25 HydrophobicContact CE-CD1 3.76Å; V3-L25 HydrophobicContact CB-CD2 3.81Å; V3-L25 HydrophobicContact CG2-CD1 3.84Å; V3-L25 HydrophobicContact CG2-CD2 3.57Å; V3-L25 HydrophobicContact CG2-CG 4.35Å; F19-L25 HydrophobicContact CB-CB 4.27Å; F19-L25 PolarHBondContact O-N 2.99Å; T20-L25 WeakPolarHBondContact CA-O 3.26Å; T20-L25 WeakPolarHBondContact CG2-O 3.22Å; L25-K29 HydrophobicContact CD2-CB 3.84Å; L25-K29 HydrophobicContact CG-CB 4.32Å; L25-I30 HydrophobicContact CD2-CD1 4.3Å; L25-I30 HydrophobicContact CD2-CG1 3.51Å
26	S	91.8	Very high	90.5	Very high	60 Å²	60	56.3 Å²	56.3	42%	0.42	34%	0.337	S	S	.	.			trans	-74.3	143.2	171.8	-47.9	0	0	0	0	110.8	H28 K29	S26-H28 VanDerWaalsContact C-N 3.27Å; S26-H28 WeakPolarHBondContact CB-CE1 3.47Å; S26-H28 WeakPolarHBondContact CB-ND1 3.34Å; S26-H28 PolarHBondContact O-N 3.36Å; S26-K29 WeakPolarHBondContact O-CB 3.45Å; S26-K29 PolarHBondContact O-N 3.19Å
27	A	90.6	Very high	90.3	Very high	18 Å²	18	57.6 Å²	57.6	15%	0.149	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-56.5	-37.3	-175.8	0	0	0	0	0	113.8	T20 K29 I30 M48 G49 V50	T20-A27 HydrophobicContact CG2-CB 3.95Å; A27-K29 PolarHBondContact O-N 3.05Å; A27-I30 WeakPolarHBondContact O-CB 3.36Å; A27-I30 PolarHBondContact O-N 3.34Å; A27-M48 WeakPolarHBondContact CB-O 3.36Å; A27-G49 CarbonylContact C-O 3.22Å; A27-V50 HydrophobicContact CB-CG2 4.38Å
28	H	92.9	Very high	90	Very high	117 Å²	117	57.4 Å²	57.4	54%	0.542	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-66.5	-16.7	178	66.9	-94.6	0	0	0	114.2	S26 I30 G49 N51	S26-H28 VanDerWaalsContact C-N 3.27Å; S26-H28 WeakPolarHBondContact CB-CE1 3.47Å; S26-H28 WeakPolarHBondContact CB-ND1 3.34Å; S26-H28 PolarHBondContact O-N 3.36Å; H28-I30 VanDerWaalsContact C-N 3.3Å; H28-G49 PolarHBondContact N-O 3.49Å; H28-N51 PolarHBondContact O-ND2 3.27Å
29	K	94.4	Very high	89.9	Confident	102 Å²	102	58.1 Å²	58.1	44%	0.443	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-89.2	0.1	173.5	-63.4	-172.1	177	175.4	0	112.6	S2 V3 L25 S26 A27	S2-K29 WeakPolarHBondContact CA-O 3.34Å; S2-K29 WeakPolarHBondContact CB-O 3.36Å; V3-K29 PolarHBondContact N-O 3.47Å; L25-K29 HydrophobicContact CD2-CB 3.84Å; L25-K29 HydrophobicContact CG-CB 4.32Å; S26-K29 WeakPolarHBondContact O-CB 3.45Å; S26-K29 PolarHBondContact O-N 3.19Å; A27-K29 PolarHBondContact O-N 3.05Å
30	I	95.9	Very high	89.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.9	175.5	-53.2	178.4	0	0	0	108.2	V3 F5 A16 T20 L25 A27 H28 V50 N51	V3-I30 CarbonylContact O-C 3.56Å; V3-I30 VanDerWaalsContact O-CA 3.29Å; V3-I30 WeakPolarHBondContact O-CA 3.27Å; F5-I30 HydrophobicContact CD2-CG2 3.58Å; F5-I30 HydrophobicContact CE2-CG2 3.49Å; F5-I30 VanDerWaalsContact CE2-CG2 3.49Å; A16-I30 HydrophobicContact CB-CD1 4.07Å; A16-I30 HydrophobicContact CB-CG2 4.43Å; T20-I30 HydrophobicContact CG2-CD1 3.92Å; L25-I30 HydrophobicContact CD2-CD1 4.3Å; L25-I30 HydrophobicContact CD2-CG1 3.51Å; A27-I30 WeakPolarHBondContact O-CB 3.36Å; A27-I30 PolarHBondContact O-N 3.34Å; H28-I30 VanDerWaalsContact C-N 3.3Å; I30-V50 HydrophobicContact CB-CG1 3.97Å; I30-V50 HydrophobicContact CB-CG2 4.21Å; I30-V50 HydrophobicContact CG2-CG1 3.68Å; I30-V50 HydrophobicContact CG2-CG2 4.34Å; I30-N51 WeakPolarHBondContact O-CB 3.44Å; I30-N51 PolarHBondContact O-N 3.12Å
31	I	96.5	Very high	89.8	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.062	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.9	170.4	-176	164.4	0	0	0	109.6	V3 G4 F5 N51 T53 T59 H62 S63	V3-I31 PolarHBondContact O-N 3.32Å; G4-I31 CarbonylContact C-O 3.5Å; G4-I31 VanDerWaalsContact CA-O 3.26Å; G4-I31 WeakPolarHBondContact CA-O 3.49Å; F5-I31 PolarHBondContact N-O 2.84Å; I31-N51 CarbonylContact C-O 3.59Å; I31-N51 VanDerWaalsContact CA-O 3.27Å; I31-N51 WeakPolarHBondContact CA-O 3.29Å; I31-N51 HydrophobicContact CB-CB 4.14Å; I31-N51 HydrophobicContact CG1-CB 4.15Å; I31-T53 HydrophobicContact CD1-CG2 3.92Å; I31-T53 HydrophobicContact CG1-CG2 4.07Å; I31-T59 HydrophobicContact CG2-CG2 4.01Å; I31-H62 HydrophobicContact CD1-CB 4.16Å; I31-H62 HydrophobicContact CG2-CB 4.23Å; I31-S63 WeakPolarHBondContact CG2-OG 3.09Å
32	A	95.6	Very high	90	Very high	1 Å²	1	55 Å²	55	1%	0.008	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	135	176.6	0	0	0	0	0	111.4	F5 A8 L45 V50 N51 L52 T53	F5-A32 HydrophobicContact CB-CB 3.93Å; F5-A32 CarbonylContact O-C 3.25Å; F5-A32 VanDerWaalsContact O-CA 3.26Å; F5-A32 WeakPolarHBondContact O-CA 3.47Å; A8-A32 HydrophobicContact CB-CB 4.44Å; A32-L45 HydrophobicContact CB-CD1 4.43Å; A32-V50 HydrophobicContact CB-CG1 4.36Å; A32-N51 PolarHBondContact N-O 2.81Å; A32-L52 HydrophobicContact CB-CD2 4.04Å; A32-L52 WeakPolarHBondContact O-CA 3.43Å; A32-T53 PolarHBondContact O-N 2.82Å
33	S	94.9	Very high	90.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	141.5	172.7	54.8	0	0	0	0	113.1	F5 G7 A8 T53 N56 T59	F5-S33 PolarHBondContact O-N 3.3Å; G7-S33 CarbonylContact C-O 3.56Å; G7-S33 VanDerWaalsContact C-O 3.25Å; G7-S33 WeakPolarHBondContact CA-O 3.36Å; G7-S33 PolarHBondContact N-O 3.29Å; A8-S33 PolarHBondContact N-O 3.44Å; S33-T53 VanDerWaalsContact CA-O 3.22Å; S33-T53 WeakPolarHBondContact CA-O 3.45Å; S33-N56 WeakPolarHBondContact CB-OD1 3.46Å; S33-N56 PolarHBondContact OG-OD1 2.74Å; S33-T59 VanDerWaalsContact CB-OG1 3.22Å; S33-T59 WeakPolarHBondContact CB-OG1 3.26Å; S33-T59 PolarHBondContact OG-OG1 3.42Å
34	S	91.8	Very high	90.6	Very high	10 Å²	10	52.6 Å²	52.6	7%	0.07	30%	0.295	C	S	.	.			trans	-149.1	141.8	167.6	175.9	0	0	0	0	110.2	E36 M37 T53	S34-E36 VanDerWaalsContact C-N 3.27Å; S34-E36 PolarHBondContact OG-N 3.26Å; S34-E36 PolarHBondContact OG-O 3.27Å; S34-M37 WeakPolarHBondContact O-CE 3.5Å; S34-T53 PolarHBondContact N-O 2.94Å
35	P	88.1	Confident	91	Very high	120 Å²	120	47.1 Å²	47.1	78%	0.779	27%	0.267	S	S	*	.	S	Bend	trans	-65.9	-34.9	172.1	26.4	-32.8	0	0	0	111.2
36	E	87.1	Confident	91.2	Very high	111 Å²	111	53.8 Å²	53.8	52%	0.519	29%	0.291	S	S	.	.			trans	-103.7	117.7	-179.9	-168	168	-151.9	0	0	110.9	S34 L39	S34-E36 VanDerWaalsContact C-N 3.27Å; S34-E36 PolarHBondContact OG-N 3.26Å; S34-E36 PolarHBondContact OG-O 3.27Å; E36-L39 HydrophobicContact CB-CD1 4.22Å; E36-L39 HydrophobicContact CB-CG 4.25Å; E36-L39 HydrophobicContact CG-CD2 4.42Å; E36-L39 HydrophobicContact CG-CG 4.07Å
37	M	85.8	Confident	91.2	Very high	28 Å²	28	59.4 Å²	59.4	14%	0.138	31%	0.309	C	S	.	.			trans	-96.2	-9.8	-175.6	-74.3	-71.5	136.1	0	0	114.1	S34 L39 V42 L52 T53 R54	S34-M37 WeakPolarHBondContact O-CE 3.5Å; M37-L39 VanDerWaalsContact C-N 3.29Å; M37-L39 PolarHBondContact O-N 3.02Å; M37-V42 WeakPolarHBondContact O-CG1 3.33Å; M37-V42 HydrophobicContact SD-CG1 3.79Å; M37-L52 HydrophobicContact SD-CB 4.47Å; M37-T53 WeakPolarHBondContact CE-O 3.28Å; M37-R54 HydrophobicContact CE-CG 3.96Å; M37-R54 HydrophobicContact CG-CG 3.86Å
38	N	85.4	Confident	91.2	Very high	148 Å²	148	61 Å²	61	79%	0.791	31%	0.313	S	S	*	.			trans	-90	6.5	-176.5	-64	-22.4	0	0	0	112.9
39	L	84.8	Confident	91.1	Very high	54 Å²	54	57.2 Å²	57.2	28%	0.283	31%	0.306	S	S	.	.	S	Bend	trans	-70.9	145.3	-180	-65.5	172.9	0	0	0	111.5	E36 M37 T41 V42 S43	E36-L39 HydrophobicContact CB-CD1 4.22Å; E36-L39 HydrophobicContact CB-CG 4.25Å; E36-L39 HydrophobicContact CG-CD2 4.42Å; E36-L39 HydrophobicContact CG-CG 4.07Å; M37-L39 VanDerWaalsContact C-N 3.29Å; M37-L39 PolarHBondContact O-N 3.02Å; L39-T41 PolarHBondContact O-N 3.33Å; L39-V42 HydrophobicContact CB-CB 4.39Å; L39-V42 HydrophobicContact CB-CG2 4Å; L39-V42 WeakPolarHBondContact O-CB 3.46Å; L39-V42 PolarHBondContact O-N 3.04Å; L39-V42 VanDerWaalsContact O-N 3.09Å; L39-S43 PolarHBondContact O-N 3.13Å; L39-S43 VanDerWaalsContact O-N 3.1Å
40	P	89.4	Confident	91.1	Very high	102 Å²	102	52.7 Å²	52.7	66%	0.662	29%	0.287	S	S	*	.	H	α-helix	trans	-60.2	-33.2	177.3	23.3	-32.8	0	0	0	112.3	S43 A44	P40-S43 PolarHBondContact O-N 3.04Å; P40-A44 WeakPolarHBondContact O-CB 3.48Å; P40-A44 PolarHBondContact O-N 3.28Å
41	T	89.8	Confident	91.1	Very high	11 Å²	11	56.8 Å²	56.8	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-65.2	-40.1	175.5	51.8	0	0	0	0	112.3	A8 Q10 L39 A44 L45	A8-T41 WeakPolarHBondContact O-CB 3.39Å; A8-T41 PolarHBondContact O-OG1 3.18Å; Q10-T41 HydrophobicContact CG-CG2 4.33Å; L39-T41 PolarHBondContact O-N 3.33Å; T41-A44 PolarHBondContact O-N 3.36Å; T41-L45 WeakPolarHBondContact O-CB 3.22Å; T41-L45 WeakPolarHBondContact O-CG 3.01Å; T41-L45 PolarHBondContact O-N 3.46Å
42	V	91.1	Very high	91	Very high	1 Å²	1	58 Å²	58	1%	0.006	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-42.7	176.4	175.2	0	0	0	0	110.4	A8 M37 L39 A44 L45 R46 L52	A8-V42 HydrophobicContact CB-CG2 3.7Å; M37-V42 WeakPolarHBondContact O-CG1 3.33Å; M37-V42 HydrophobicContact SD-CG1 3.79Å; L39-V42 HydrophobicContact CB-CB 4.39Å; L39-V42 HydrophobicContact CB-CG2 4Å; L39-V42 WeakPolarHBondContact O-CB 3.46Å; L39-V42 PolarHBondContact O-N 3.04Å; L39-V42 VanDerWaalsContact O-N 3.09Å; V42-A44 VanDerWaalsContact C-N 3.33Å; V42-A44 PolarHBondContact O-N 2.94Å; V42-L45 PolarHBondContact O-N 2.86Å; V42-R46 WeakPolarHBondContact O-CB 3.31Å; V42-R46 PolarHBondContact O-N 2.97Å; V42-L52 HydrophobicContact CG1-CD1 3.73Å; V42-L52 HydrophobicContact CG1-CD2 4.21Å; V42-L52 WeakPolarHBondContact O-CD1 3.42Å
43	S	91.5	Very high	91	Very high	56 Å²	56	58.6 Å²	58.6	39%	0.392	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-42.6	174.1	-170.7	0	0	0	0	111.8	L39 P40 R46 K47	L39-S43 PolarHBondContact O-N 3.13Å; L39-S43 VanDerWaalsContact O-N 3.1Å; P40-S43 PolarHBondContact O-N 3.04Å; S43-R46 WeakPolarHBondContact O-CB 3.46Å; S43-R46 PolarHBondContact O-N 3.39Å; S43-K47 WeakPolarHBondContact O-CG 3.45Å; S43-K47 PolarHBondContact O-N 2.84Å
44	A	92.1	Very high	90.9	Very high	26 Å²	26	67.2 Å²	67.2	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-65.1	-43.8	177.4	0	0	0	0	0	112.5	Y13 P40 T41 V42 R46 K47 M48	Y13-A44 HydrophobicContact CD2-CB 3.94Å; Y13-A44 HydrophobicContact CE2-CB 3.47Å; Y13-A44 VanDerWaalsContact CE2-CB 3.47Å; P40-A44 WeakPolarHBondContact O-CB 3.48Å; P40-A44 PolarHBondContact O-N 3.28Å; T41-A44 PolarHBondContact O-N 3.36Å; V42-A44 VanDerWaalsContact C-N 3.33Å; V42-A44 PolarHBondContact O-N 2.94Å; A44-R46 VanDerWaalsContact C-N 3.34Å; A44-R46 PolarHBondContact O-N 3.23Å; A44-K47 PolarHBondContact O-N 2.7Å; A44-M48 WeakPolarHBondContact O-CG 2.85Å; A44-M48 PolarHBondContact O-N 2.89Å
45	L	92.4	Very high	91	Very high	1 Å²	1	68.9 Å²	68.9	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-60.1	-42.1	174	-77	169.4	0	0	0	111.9	A8 Y13 A16 A32 T41 V42 K47 M48 G49 V50 L52	A8-L45 HydrophobicContact CB-CD1 3.97Å; Y13-L45 HydrophobicContact CD2-CD2 4.11Å; Y13-L45 HydrophobicContact CD2-CG 4.09Å; A16-L45 HydrophobicContact CB-CD2 3.76Å; A32-L45 HydrophobicContact CB-CD1 4.43Å; T41-L45 WeakPolarHBondContact O-CB 3.22Å; T41-L45 WeakPolarHBondContact O-CG 3.01Å; T41-L45 PolarHBondContact O-N 3.46Å; V42-L45 PolarHBondContact O-N 2.86Å; L45-K47 PolarHBondContact O-N 3.46Å; L45-M48 HydrophobicContact CD2-CE 4.48Å; L45-M48 WeakPolarHBondContact O-CB 3.36Å; L45-M48 PolarHBondContact O-N 3.1Å; L45-G49 PolarHBondContact O-N 3.24Å; L45-V50 HydrophobicContact CB-CB 4.28Å; L45-V50 HydrophobicContact CD2-CB 4.33Å; L45-V50 HydrophobicContact CD2-CG1 4.38Å; L45-V50 HydrophobicContact CD2-CG2 4.02Å; L45-V50 WeakPolarHBondContact O-CB 2.91Å; L45-V50 PolarHBondContact O-N 3.29Å; L45-V50 VanDerWaalsContact O-N 3.12Å; L45-L52 HydrophobicContact CB-CD1 4.5Å; L45-L52 HydrophobicContact CB-CD2 4.16Å; L45-L52 HydrophobicContact CD1-CD2 4.33Å
46	R	92.4	Very high	91.3	Very high	151 Å²	151	64.2 Å²	64.2	57%	0.57	33%	0.332	S	S	*	.	H	α-helix	trans	-60.4	-45.9	176.2	-168.4	178	-66.5	-98.3	-3.3	111.5	V42 S43 A44 M48 G49 L52	V42-R46 WeakPolarHBondContact O-CB 3.31Å; V42-R46 PolarHBondContact O-N 2.97Å; S43-R46 WeakPolarHBondContact O-CB 3.46Å; S43-R46 PolarHBondContact O-N 3.39Å; A44-R46 VanDerWaalsContact C-N 3.34Å; A44-R46 PolarHBondContact O-N 3.23Å; R46-M48 PolarHBondContact O-N 3.39Å; R46-G49 PolarHBondContact O-N 3.09Å; R46-L52 HydrophobicContact CB-CD1 3.56Å; R46-L52 HydrophobicContact CG-CD1 4.18Å
47	K	92.7	Very high	91.6	Very high	179 Å²	179	62.8 Å²	62.8	78%	0.778	32%	0.324	S	S	*	.	H	α-helix	trans	-63.5	-30.1	177.8	-72.2	175.9	-176.8	-178.4	0	112.6	S43 A44 L45 G49	S43-K47 WeakPolarHBondContact O-CG 3.45Å; S43-K47 PolarHBondContact O-N 2.84Å; A44-K47 PolarHBondContact O-N 2.7Å; L45-K47 PolarHBondContact O-N 3.46Å; K47-G49 PolarHBondContact O-N 3.42Å
48	M	90.8	Very high	92	Very high	51 Å²	51	65.4 Å²	65.4	25%	0.251	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-11.9	173.1	-74.9	173.5	37.1	0	0	113.7	Y13 A16 R17 A27 A44 L45 R46 V50	Y13-M48 HydrophobicContact CD2-SD 3.98Å; Y13-M48 HydrophobicContact CE2-SD 3.46Å; Y13-M48 WeakPolarHBondContact CE2-SD 3.4Å; A16-M48 HydrophobicContact CB-CE 4.05Å; R17-M48 HydrophobicContact CB-CE 4.03Å; R17-M48 HydrophobicContact CB-SD 4.14Å; R17-M48 HydrophobicContact CG-SD 4.46Å; A27-M48 WeakPolarHBondContact CB-O 3.36Å; A44-M48 WeakPolarHBondContact O-CG 2.85Å; A44-M48 PolarHBondContact O-N 2.89Å; L45-M48 HydrophobicContact CD2-CE 4.48Å; L45-M48 WeakPolarHBondContact O-CB 3.36Å; L45-M48 PolarHBondContact O-N 3.1Å; R46-M48 PolarHBondContact O-N 3.39Å; M48-V50 HydrophobicContact CB-CG2 4.35Å; M48-V50 HydrophobicContact CE-CG2 4.23Å
49	G	91.6	Very high	92.4	Very high	38 Å²	38	58.3 Å²	58.3	39%	0.392	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	21.4	-176.8	0	0	0	0	0	114.2	A27 H28 L45 R46 K47	A27-G49 CarbonylContact C-O 3.22Å; H28-G49 PolarHBondContact N-O 3.49Å; L45-G49 PolarHBondContact O-N 3.24Å; R46-G49 PolarHBondContact O-N 3.09Å; K47-G49 PolarHBondContact O-N 3.42Å
50	V	94.6	Very high	92.7	Very high	6 Å²	6	55.8 Å²	55.8	4%	0.036	28%	0.284	C	S	.	.			trans	-79.6	136.7	173.1	176.2	0	0	0	0	109.7	A16 A27 I30 A32 L45 M48	A16-V50 HydrophobicContact CB-CG2 4.39Å; A27-V50 HydrophobicContact CB-CG2 4.38Å; I30-V50 HydrophobicContact CB-CG1 3.97Å; I30-V50 HydrophobicContact CB-CG2 4.21Å; I30-V50 HydrophobicContact CG2-CG1 3.68Å; I30-V50 HydrophobicContact CG2-CG2 4.34Å; A32-V50 HydrophobicContact CB-CG1 4.36Å; L45-V50 HydrophobicContact CB-CB 4.28Å; L45-V50 HydrophobicContact CD2-CB 4.33Å; L45-V50 HydrophobicContact CD2-CG1 4.38Å; L45-V50 HydrophobicContact CD2-CG2 4.02Å; L45-V50 WeakPolarHBondContact O-CB 2.91Å; L45-V50 PolarHBondContact O-N 3.29Å; L45-V50 VanDerWaalsContact O-N 3.12Å; M48-V50 HydrophobicContact CB-CG2 4.35Å; M48-V50 HydrophobicContact CE-CG2 4.23Å
51	N	95.3	Very high	92.9	Very high	87 Å²	87	57 Å²	57	47%	0.465	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	134	175	-68.7	-30.8	0	0	0	110	H28 I30 I31 A32	H28-N51 PolarHBondContact O-ND2 3.27Å; I30-N51 WeakPolarHBondContact O-CB 3.44Å; I30-N51 PolarHBondContact O-N 3.12Å; I31-N51 CarbonylContact C-O 3.59Å; I31-N51 VanDerWaalsContact CA-O 3.27Å; I31-N51 WeakPolarHBondContact CA-O 3.29Å; I31-N51 HydrophobicContact CB-CB 4.14Å; I31-N51 HydrophobicContact CG1-CB 4.15Å; A32-N51 PolarHBondContact N-O 2.81Å
52	L	94.7	Very high	93	Very high	37 Å²	37	61.6 Å²	61.6	19%	0.194	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.1	-176.5	-68.4	162.1	0	0	0	110	A32 M37 V42 L45 R46	A32-L52 HydrophobicContact CB-CD2 4.04Å; A32-L52 WeakPolarHBondContact O-CA 3.43Å; M37-L52 HydrophobicContact SD-CB 4.47Å; V42-L52 HydrophobicContact CG1-CD1 3.73Å; V42-L52 HydrophobicContact CG1-CD2 4.21Å; V42-L52 WeakPolarHBondContact O-CD1 3.42Å; L45-L52 HydrophobicContact CB-CD1 4.5Å; L45-L52 HydrophobicContact CB-CD2 4.16Å; L45-L52 HydrophobicContact CD1-CD2 4.33Å; R46-L52 HydrophobicContact CB-CD1 3.56Å; R46-L52 HydrophobicContact CG-CD1 4.18Å
53	T	94.6	Very high	93.1	Very high	14 Å²	14	61.6 Å²	61.6	9%	0.086	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	160.1	176.5	-180	0	0	0	0	110.8	I31 A32 S33 S34 M37 S55 E58 T59	I31-T53 HydrophobicContact CD1-CG2 3.92Å; I31-T53 HydrophobicContact CG1-CG2 4.07Å; A32-T53 PolarHBondContact O-N 2.82Å; S33-T53 VanDerWaalsContact CA-O 3.22Å; S33-T53 WeakPolarHBondContact CA-O 3.45Å; S34-T53 PolarHBondContact N-O 2.94Å; M37-T53 WeakPolarHBondContact CE-O 3.28Å; T53-S55 VanDerWaalsContact CG2-O 3.32Å; T53-S55 WeakPolarHBondContact CG2-O 3.3Å; T53-S55 PolarHBondContact OG1-N 2.88Å; T53-E58 VanDerWaalsContact CB-OE2 3.31Å; T53-E58 WeakPolarHBondContact CB-OE2 3.39Å; T53-E58 HydrophobicContact CG2-CB 4.27Å; T53-E58 PolarHBondContact OG1-OE2 2.91Å; T53-T59 WeakPolarHBondContact CG2-OG1 3.48Å
54	R	93.6	Very high	93.1	Very high	181 Å²	181	61.6 Å²	61.6	68%	0.683	30%	0.295	S	S	*	.	S	Bend	trans	-89.3	-14.3	168.5	-68	-177.7	177.1	-178.3	-0.9	112.3	M37	M37-R54 HydrophobicContact CE-CG 3.96Å; M37-R54 HydrophobicContact CG-CG 3.86Å
55	S	94.2	Very high	93	Very high	45 Å²	45	61.4 Å²	61.4	32%	0.315	29%	0.291	S	S	.	.			trans	-97.9	120.5	-174.1	-176.5	0	0	0	0	111.7	T53 K57 E58 T59	T53-S55 VanDerWaalsContact CG2-O 3.32Å; T53-S55 WeakPolarHBondContact CG2-O 3.3Å; T53-S55 PolarHBondContact OG1-N 2.88Å; S55-K57 VanDerWaalsContact C-N 3.26Å; S55-K57 PolarHBondContact O-N 2.96Å; S55-K57 PolarHBondContact OG-N 3.04Å; S55-E58 PolarHBondContact O-N 2.93Å; S55-E58 PolarHBondContact OG-N 2.78Å; S55-T59 PolarHBondContact O-N 2.92Å; S55-T59 PolarHBondContact O-OG1 2.78Å
56	N	93.1	Very high	92.8	Very high	22 Å²	22	61.4 Å²	61.4	12%	0.118	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-35.2	173.3	-65.7	-28.5	0	0	0	111.5	I6 S33 E58 T59 V60 E81 I82	I6-N56 HydrophobicContact CD1-CB 4.24Å; S33-N56 WeakPolarHBondContact CB-OD1 3.46Å; S33-N56 PolarHBondContact OG-OD1 2.74Å; N56-E58 PolarHBondContact O-N 2.79Å; N56-T59 WeakPolarHBondContact O-CB 3.16Å; N56-T59 PolarHBondContact O-N 2.94Å; N56-V60 WeakPolarHBondContact O-CG2 3.48Å; N56-V60 PolarHBondContact O-N 2.75Å; N56-E81 PolarHBondContact ND2-OE2 2.86Å; N56-I82 HydrophobicContact CB-CG2 3.67Å
57	K	93.2	Very high	92.7	Very high	81 Å²	81	55.5 Å²	55.5	35%	0.352	27%	0.27	S	S	.	.	H	α-helix	trans	-64.5	-39.4	177.7	-60.5	-172.5	173.1	-160.9	0	112.5	S55 V60 K61 E81 D85	S55-K57 VanDerWaalsContact C-N 3.26Å; S55-K57 PolarHBondContact O-N 2.96Å; S55-K57 PolarHBondContact OG-N 3.04Å; K57-V60 PolarHBondContact O-N 2.89Å; K57-K61 WeakPolarHBondContact O-CG 3.47Å; K57-K61 PolarHBondContact O-N 2.91Å; K57-E81 WeakPolarHBondContact CE-O 3.47Å; K57-D85 VanDerWaalsContact CD-OD2 3.27Å; K57-D85 WeakPolarHBondContact CD-OD2 3.5Å; K57-D85 WeakPolarHBondContact CE-OD2 3.46Å; K57-D85 WeakPolarHBondContact CG-OD2 3.45Å; K57-D85 IonicContact NZ-OD2 3.19Å
58	E	93.9	Very high	92.4	Very high	82 Å²	82	47.1 Å²	47.1	38%	0.383	23%	0.234	S	C	.	.	H	α-helix	trans	-65.3	-41.3	175.7	-171.5	179.3	-173	0	0	111.3	T53 S55 N56 V60 K61 H62	T53-E58 VanDerWaalsContact CB-OE2 3.31Å; T53-E58 WeakPolarHBondContact CB-OE2 3.39Å; T53-E58 HydrophobicContact CG2-CB 4.27Å; T53-E58 PolarHBondContact OG1-OE2 2.91Å; S55-E58 PolarHBondContact O-N 2.93Å; S55-E58 PolarHBondContact OG-N 2.78Å; N56-E58 PolarHBondContact O-N 2.79Å; E58-V60 VanDerWaalsContact C-N 3.34Å; E58-V60 PolarHBondContact O-N 3.14Å; E58-K61 PolarHBondContact O-N 2.91Å; E58-H62 PolarHBondContact O-N 2.81Å; E58-H62 VanDerWaalsContact O-N 3.17Å; E58-H62 PolarHBondContact O-ND1 3.22Å
59	T	93.9	Very high	92.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.3	-49.9	171.9	-55.2	0	0	0	0	110.5	I6 I31 S33 T53 S55 N56 K61 H62 S63 L66	I6-T59 HydrophobicContact CG1-CG2 4.24Å; I31-T59 HydrophobicContact CG2-CG2 4.01Å; S33-T59 VanDerWaalsContact CB-OG1 3.22Å; S33-T59 WeakPolarHBondContact CB-OG1 3.26Å; S33-T59 PolarHBondContact OG-OG1 3.42Å; T53-T59 WeakPolarHBondContact CG2-OG1 3.48Å; S55-T59 PolarHBondContact O-N 2.92Å; S55-T59 PolarHBondContact O-OG1 2.78Å; N56-T59 WeakPolarHBondContact O-CB 3.16Å; N56-T59 PolarHBondContact O-N 2.94Å; T59-K61 PolarHBondContact O-N 2.92Å; T59-H62 PolarHBondContact O-N 2.84Å; T59-S63 VanDerWaalsContact O-CB 3.28Å; T59-S63 WeakPolarHBondContact O-CB 3.47Å; T59-S63 PolarHBondContact O-N 3.19Å; T59-S63 PolarHBondContact O-OG 3.22Å; T59-L66 HydrophobicContact CG2-CD1 4.05Å
60	V	92.3	Very high	91.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-48.1	179.2	175.6	0	0	0	0	111.8	I6 N56 K57 E58 H62 S63 L66 I82 D85 V86 H90	I6-V60 HydrophobicContact CD1-CG2 4.27Å; N56-V60 WeakPolarHBondContact O-CG2 3.48Å; N56-V60 PolarHBondContact O-N 2.75Å; K57-V60 PolarHBondContact O-N 2.89Å; E58-V60 VanDerWaalsContact C-N 3.34Å; E58-V60 PolarHBondContact O-N 3.14Å; V60-H62 PolarHBondContact O-N 2.89Å; V60-S63 PolarHBondContact O-N 3.48Å; V60-S63 VanDerWaalsContact O-N 3.15Å; V60-L66 HydrophobicContact CB-CD1 4.34Å; V60-L66 HydrophobicContact CG2-CD1 3.71Å; V60-L66 HydrophobicContact CG2-CD2 3.96Å; V60-I82 HydrophobicContact CG2-CB 3.97Å; V60-I82 HydrophobicContact CG2-CD1 3.9Å; V60-I82 HydrophobicContact CG2-CG1 4.28Å; V60-I82 HydrophobicContact CG2-CG2 4.19Å; V60-D85 HydrophobicContact CG1-CB 4.24Å; V60-V86 HydrophobicContact CG1-CG2 4.02Å; V60-H90 PolarHBondContact O-CD2 3.23Å; V60-H90 PolarHBondContact O-NE2 3.22Å; V60-H90 VanDerWaalsContact O-NE2 3.13Å
61	K	92.9	Very high	91.1	Very high	127 Å²	127	51.1 Å²	51.1	55%	0.552	24%	0.244	S	C	*	.	H	α-helix	trans	-60.3	-32.9	-177.9	-72.6	175.2	-176.6	-178.8	0	113.6	K57 E58 T59 D85	K57-K61 WeakPolarHBondContact O-CG 3.47Å; K57-K61 PolarHBondContact O-N 2.91Å; E58-K61 PolarHBondContact O-N 2.91Å; T59-K61 PolarHBondContact O-N 2.92Å; K61-D85 WeakPolarHBondContact CE-OD1 3.36Å; K61-D85 IonicContact NZ-OD1 3.86Å
62	H	92.3	Very high	89.9	Confident	108 Å²	108	48.2 Å²	48.2	50%	0.5	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	5.1	-177.9	-67.5	92.2	0	0	0	114	S2 I31 E58 T59 V60	S2-H62 WeakPolarHBondContact CB-O 3.31Å; S2-H62 PolarHBondContact OG-O 3.05Å; I31-H62 HydrophobicContact CD1-CB 4.16Å; I31-H62 HydrophobicContact CG2-CB 4.23Å; E58-H62 PolarHBondContact O-N 2.81Å; E58-H62 VanDerWaalsContact O-N 3.17Å; E58-H62 PolarHBondContact O-ND1 3.22Å; T59-H62 PolarHBondContact O-N 2.84Å; V60-H62 PolarHBondContact O-N 2.89Å
63	S	92.4	Very high	88.8	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.007	24%	0.242	C	C	.	.			trans	-118.6	143.1	-173.2	-55.3	0	0	0	0	112	S2 G4 I31 T59 V60 H90	S2-S63 WeakPolarHBondContact OG-CA 3.32Å; G4-S63 WeakPolarHBondContact CA-OG 3.16Å; G4-S63 PolarHBondContact N-OG 3.14Å; I31-S63 WeakPolarHBondContact CG2-OG 3.09Å; T59-S63 VanDerWaalsContact O-CB 3.28Å; T59-S63 WeakPolarHBondContact O-CB 3.47Å; T59-S63 PolarHBondContact O-N 3.19Å; T59-S63 PolarHBondContact O-OG 3.22Å; V60-S63 PolarHBondContact O-N 3.48Å; V60-S63 VanDerWaalsContact O-N 3.15Å; S63-H90 PolarHBondContact O-CD2 2.75Å; S63-H90 PolarHBondContact O-NE2 2.92Å
64	D	91.8	Very high	88.1	Confident	56 Å²	56	53.5 Å²	53.5	30%	0.299	25%	0.253	S	S	.	.	S	Bend	trans	-94.5	-38.5	165.7	-60	-46.3	0	0	0	110.2	M1 S2 H90 I91	M1-D64 WeakPolarHBondContact CA-OD2 3.38Å; M1-D64 PolarHBondContact N-OD2 2.93Å; S2-D64 PolarHBondContact N-OD2 3.41Å; S2-D64 PolarHBondContact O-N 3.36Å; S2-D64 PolarHBondContact OG-N 2.85Å; D64-H90 CarbonylContact O-C 3.59Å; D64-H90 VanDerWaalsContact O-CA 3.3Å; D64-H90 WeakPolarHBondContact O-CA 3.28Å; D64-I91 PolarHBondContact O-N 2.95Å
65	V	90.1	Very high	87.3	Confident	22 Å²	22	45.9 Å²	45.9	13%	0.133	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.3	175.6	-175.2	0	0	0	0	109	M1 S2 V3 G4 F67 I91 V93	M1-V65 HydrophobicContact CG-CG2 4.44Å; M1-V65 HydrophobicContact SD-CG2 4.48Å; S2-V65 PolarHBondContact O-N 3.21Å; S2-V65 VanDerWaalsContact O-N 3.14Å; V3-V65 CarbonylContact C-O 3.36Å; V3-V65 WeakPolarHBondContact CA-O 3.17Å; V3-V65 HydrophobicContact CG2-CB 4.46Å; G4-V65 PolarHBondContact N-O 3.25Å; V65-F67 HydrophobicContact CG1-CD2 4.34Å; V65-F67 HydrophobicContact CG1-CE2 3.83Å; V65-F67 HydrophobicContact CG1-CZ 4.35Å; V65-I91 CarbonylContact C-O 3.55Å; V65-I91 WeakPolarHBondContact CA-O 3.43Å; V65-I91 HydrophobicContact CG1-CB 4.39Å; V65-I91 HydrophobicContact CG2-CB 4.33Å; V65-I91 HydrophobicContact CG2-CD1 4.47Å; V65-V93 HydrophobicContact CG1-CG2 3.95Å
66	L	88.7	Confident	85.9	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	112.7	-173.8	-162.8	94.1	0	0	0	110.8	G4 I6 T59 V60 L68 I82 I91 V92 V93	G4-L66 CarbonylContact O-C 3.52Å; G4-L66 WeakPolarHBondContact O-CA 3.2Å; I6-L66 HydrophobicContact CD1-CD1 4.35Å; I6-L66 HydrophobicContact CD1-CD2 3.7Å; I6-L66 HydrophobicContact CD1-CG 4.29Å; I6-L66 HydrophobicContact CG1-CD1 4.29Å; I6-L66 HydrophobicContact CG1-CD2 4.22Å; I6-L66 HydrophobicContact CG1-CG 4.29Å; T59-L66 HydrophobicContact CG2-CD1 4.05Å; V60-L66 HydrophobicContact CB-CD1 4.34Å; V60-L66 HydrophobicContact CG2-CD1 3.71Å; V60-L66 HydrophobicContact CG2-CD2 3.96Å; L66-L68 HydrophobicContact CD2-CD2 3.86Å; L66-I82 HydrophobicContact CD2-CD1 3.89Å; L66-I91 PolarHBondContact N-O 3.43Å; L66-V92 HydrophobicContact CD2-CG2 4.48Å; L66-V92 CarbonylContact O-C 3.44Å; L66-V92 WeakPolarHBondContact O-CA 3.23Å; L66-V93 PolarHBondContact O-N 3.13Å
67	F	90.3	Very high	85.2	Confident	27 Å²	27	50.5 Å²	50.5	12%	0.118	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.1	173.7	-71.7	-90.9	0	0	0	110.8	V3 G4 F5 I6 L15 F19 V65 A69 V93	V3-F67 HydrophobicContact CG1-CD2 3.53Å; V3-F67 HydrophobicContact CG1-CE2 3.55Å; G4-F67 PolarHBondContact O-N 3.46Å; F5-F67 WeakPolarHBondContact CA-O 3.19Å; F5-F67 HydrophobicContact CD1-CB 3.49Å; F5-F67 VanDerWaalsContact CD1-CB 3.49Å; F5-F67 HydrophobicContact CD1-CD2 4.31Å; F5-F67 HydrophobicContact CD1-CG 4.06Å; F5-F67 HydrophobicContact CE1-CB 3.7Å; F5-F67 HydrophobicContact CE1-CD1 4.42Å; F5-F67 AromaticContact CE1-CD2 3.81Å; F5-F67 HydrophobicContact CE1-CD2 3.81Å; F5-F67 AromaticContact CE1-CG 3.72Å; F5-F67 HydrophobicContact CE1-CG 3.72Å; F5-F67 HydrophobicContact CG-CB 4.35Å; F5-F67 HydrophobicContact CZ-CD2 4.1Å; F5-F67 HydrophobicContact CZ-CG 4.45Å; I6-F67 PolarHBondContact N-O 3.39Å; L15-F67 HydrophobicContact CD1-CD1 4.28Å; F19-F67 HydrophobicContact CE2-CE2 4.03Å; F19-F67 HydrophobicContact CE2-CZ 4.13Å; F19-F67 HydrophobicContact CZ-CE2 4.29Å; F19-F67 AromaticContact CZ-CZ 3.93Å; F19-F67 HydrophobicContact CZ-CZ 3.93Å; V65-F67 HydrophobicContact CG1-CD2 4.34Å; V65-F67 HydrophobicContact CG1-CE2 3.83Å; V65-F67 HydrophobicContact CG1-CZ 4.35Å; F67-A69 PolarHBondContact O-N 3.29Å; F67-V93 CarbonylContact C-O 3.59Å; F67-V93 VanDerWaalsContact CA-O 3.31Å; F67-V93 WeakPolarHBondContact CA-O 3.47Å; F67-V93 HydrophobicContact CD1-CB 3.83Å; F67-V93 HydrophobicContact CD1-CG1 3.77Å; F67-V93 HydrophobicContact CE1-CB 3.95Å; F67-V93 HydrophobicContact CE1-CG1 3.66Å; F67-V93 HydrophobicContact CE1-CG2 4.33Å; F67-V93 HydrophobicContact CG-CB 4.39Å
68	L	86	Confident	84.6	Confident	4 Å²	4	47 Å²	47	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	91.8	170.9	-52.5	177.1	0	0	0	109.1	I6 L66 I75 I78 L79 I82 V92 V93 C95	I6-L68 HydrophobicContact CB-CD2 4.13Å; I6-L68 HydrophobicContact CD1-CD2 3.91Å; I6-L68 HydrophobicContact CG1-CD2 4.31Å; L66-L68 HydrophobicContact CD2-CD2 3.86Å; L68-I75 HydrophobicContact CB-CD1 3.5Å; L68-I75 VanDerWaalsContact CB-CD1 3.5Å; L68-I75 HydrophobicContact CD1-CD1 3.88Å; L68-I75 HydrophobicContact CD1-CG2 4.43Å; L68-I75 HydrophobicContact CG-CD1 4.27Å; L68-I78 HydrophobicContact CD2-CG2 4.19Å; L68-L79 HydrophobicContact CD1-CD2 4.12Å; L68-I82 HydrophobicContact CD2-CD1 4.43Å; L68-V92 HydrophobicContact CD1-CG1 3.75Å; L68-V92 HydrophobicContact CD2-CG1 4.46Å; L68-V92 HydrophobicContact CG-CG1 3.95Å; L68-V93 PolarHBondContact N-O 3.18Å; L68-C95 WeakPolarHBondContact O-CA 3.34Å; L68-C95 WeakPolarHBondContact O-CB 3.34Å; L68-C95 PolarHBondContact O-N 3.44Å
69	A	87	Confident	83.5	Confident	15 Å²	15	46.8 Å²	46.8	12%	0.124	23%	0.228	C	C	.	.			trans	-103.7	42	-176.3	0	0	0	0	0	112.2	I6 L11 A12 F67	I6-A69 CarbonylContact O-C 3.57Å; I6-A69 WeakPolarHBondContact O-CA 3.41Å; I6-A69 PolarHBondContact O-N 3.49Å; L11-A69 HydrophobicContact CD2-CB 4.21Å; A12-A69 HydrophobicContact CB-CB 4.29Å; F67-A69 PolarHBondContact O-N 3.29Å
70	V	83.3	Confident	82.4	Confident	27 Å²	27	53.4 Å²	53.4	16%	0.164	26%	0.263	C	S	.	.	S	Bend	trans	-111.1	171.5	176.9	-65.9	0	0	0	0	111.6	I6 I74 I75 I78	I6-V70 HydrophobicContact CG2-CG1 4.18Å; I6-V70 WeakPolarHBondContact O-CG1 3.46Å; V70-I74 HydrophobicContact CB-CB 4.3Å; V70-I74 HydrophobicContact CG2-CB 4.23Å; V70-I75 HydrophobicContact CG2-CD1 3.33Å; V70-I75 HydrophobicContact CG2-CG1 3.86Å; V70-I78 HydrophobicContact CB-CD1 4.07Å; V70-I78 HydrophobicContact CG1-CD1 3.65Å; V70-I78 HydrophobicContact CG2-CD1 3.6Å
71	K	78.5	Confident	81.8	Confident	137 Å²	137	57.2 Å²	57.2	60%	0.596	28%	0.281	S	S	*	.			trans	-64.6	145.7	173.8	-58.5	-179.4	-176.7	174.9	0	110.4	H73 I74	K71-H73 VanDerWaalsContact C-N 3.34Å; K71-H73 VanDerWaalsContact CB-CE1 3.46Å; K71-H73 WeakPolarHBondContact CB-CE1 3.34Å; K71-H73 PolarHBondContact O-N 2.93Å; K71-I74 HydrophobicContact CB-CD1 3.96Å; K71-I74 HydrophobicContact CB-CG1 4.1Å; K71-I74 HydrophobicContact CD-CD1 4.44Å; K71-I74 HydrophobicContact CG-CD1 4.33Å; K71-I74 WeakPolarHBondContact O-CB 3.28Å; K71-I74 PolarHBondContact O-N 3.31Å
72	P	71	Confident	81.3	Confident	25 Å²	25	51.2 Å²	51.2	16%	0.162	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-53.5	-42	-175.2	-28.6	34.4	0	0	0	115.5	I74 I75 P76 A96 A97	P72-I74 PolarHBondContact O-N 3.07Å; P72-I74 VanDerWaalsContact O-N 3.16Å; P72-I75 WeakPolarHBondContact O-CB 3.24Å; P72-I75 PolarHBondContact O-N 3.43Å; P72-P76 WeakPolarHBondContact O-CD 3.23Å; P72-A96 HydrophobicContact CB-CB 4.38Å; P72-A96 HydrophobicContact CG-CB 4.19Å; P72-A97 HydrophobicContact CG-CB 3.31Å
73	H	71.7	Confident	80.3	Confident	100 Å²	100	48 Å²	48	46%	0.463	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-65.6	-16.6	178.6	57.8	-95.6	0	0	0	113.7	K71 P76 F77	K71-H73 VanDerWaalsContact C-N 3.34Å; K71-H73 VanDerWaalsContact CB-CE1 3.46Å; K71-H73 WeakPolarHBondContact CB-CE1 3.34Å; K71-H73 PolarHBondContact O-N 2.93Å; H73-P76 WeakPolarHBondContact O-CD 3.31Å; H73-F77 WeakPolarHBondContact O-CD2 3.49Å; H73-F77 VanDerWaalsContact O-CE2 3.28Å; H73-F77 WeakPolarHBondContact O-CE2 3.14Å
74	I	80.2	Confident	79.5	Confident	62 Å²	62	52.8 Å²	52.8	32%	0.318	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-88.7	-23.5	179.4	-48.4	179.7	0	0	0	111.2	V70 K71 P72 P76 F77 I78	V70-I74 HydrophobicContact CB-CB 4.3Å; V70-I74 HydrophobicContact CG2-CB 4.23Å; K71-I74 HydrophobicContact CB-CD1 3.96Å; K71-I74 HydrophobicContact CB-CG1 4.1Å; K71-I74 HydrophobicContact CD-CD1 4.44Å; K71-I74 HydrophobicContact CG-CD1 4.33Å; K71-I74 WeakPolarHBondContact O-CB 3.28Å; K71-I74 PolarHBondContact O-N 3.31Å; P72-I74 PolarHBondContact O-N 3.07Å; P72-I74 VanDerWaalsContact O-N 3.16Å; I74-P76 VanDerWaalsContact C-CD 3.44Å; I74-F77 PolarHBondContact O-N 2.9Å; I74-I78 HydrophobicContact CB-CD1 4.47Å; I74-I78 HydrophobicContact CG2-CD1 3.64Å; I74-I78 HydrophobicContact CG2-CG1 4.22Å; I74-I78 PolarHBondContact O-N 3.09Å; I74-I78 VanDerWaalsContact O-N 3.14Å
75	I	75.8	Confident	79	Confident	21 Å²	21	51.8 Å²	51.8	11%	0.108	29%	0.285	C	S	.	.	H	α-helix	trans	-53.5	-45.6	-177.6	-65.9	-73.9	0	0	0	113.1	L68 V70 P72 F77 I78 L79 A96	L68-I75 HydrophobicContact CB-CD1 3.5Å; L68-I75 VanDerWaalsContact CB-CD1 3.5Å; L68-I75 HydrophobicContact CD1-CD1 3.88Å; L68-I75 HydrophobicContact CD1-CG2 4.43Å; L68-I75 HydrophobicContact CG-CD1 4.27Å; V70-I75 HydrophobicContact CG2-CD1 3.33Å; V70-I75 HydrophobicContact CG2-CG1 3.86Å; P72-I75 WeakPolarHBondContact O-CB 3.24Å; P72-I75 PolarHBondContact O-N 3.43Å; I75-F77 PolarHBondContact O-N 3.44Å; I75-I78 PolarHBondContact O-N 3.17Å; I75-L79 HydrophobicContact CG2-CD1 3.67Å; I75-L79 HydrophobicContact CG2-CG 4.06Å; I75-L79 WeakPolarHBondContact O-CG 3.39Å; I75-L79 PolarHBondContact O-N 3.37Å; I75-A96 HydrophobicContact CD1-CB 3.72Å; I75-A96 HydrophobicContact CG1-CB 3.45Å; I75-A96 VanDerWaalsContact CG1-CB 3.45Å
76	P	65.2	Low	78.3	Confident	18 Å²	18	53.1 Å²	53.1	12%	0.117	29%	0.293	C	S	.	.	H	α-helix	trans	-58.2	-46.7	179.8	-25.5	36.5	0	0	0	113	P72 H73 I74 I78 L79 D80 K202	P72-P76 WeakPolarHBondContact O-CD 3.23Å; H73-P76 WeakPolarHBondContact O-CD 3.31Å; I74-P76 VanDerWaalsContact C-CD 3.44Å; P76-I78 VanDerWaalsContact C-N 3.28Å; P76-I78 PolarHBondContact O-N 2.85Å; P76-L79 PolarHBondContact O-N 3.47Å; P76-D80 PolarHBondContact O-N 2.9Å; P76-K202 VanDerWaalsContact CG-NZ 3.25Å
77	F	77.9	Confident	78	Confident	146 Å²	146	58.5 Å²	58.5	64%	0.64	32%	0.318	S	S	*	.	H	α-helix	trans	-62.3	-38.2	179.7	-58.6	-76.2	0	0	0	111.8	H73 I74 I75 E81	H73-F77 WeakPolarHBondContact O-CD2 3.49Å; H73-F77 VanDerWaalsContact O-CE2 3.28Å; H73-F77 WeakPolarHBondContact O-CE2 3.14Å; I74-F77 PolarHBondContact O-N 2.9Å; I75-F77 PolarHBondContact O-N 3.44Å; F77-E81 VanDerWaalsContact O-CB 3.31Å; F77-E81 WeakPolarHBondContact O-CB 3.39Å; F77-E81 PolarHBondContact O-N 2.94Å
78	I	81.5	Confident	77.2	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.036	36%	0.357	C	S	.	.	H	α-helix	trans	-69.1	-43.2	176.7	-77.1	162.2	0	0	0	111.2	I6 L68 V70 I74 I75 P76 D80 E81 I82	I6-I78 HydrophobicContact CD1-CG2 3.83Å; I6-I78 HydrophobicContact CG2-CD1 3.64Å; I6-I78 HydrophobicContact CG2-CG1 4.23Å; I6-I78 HydrophobicContact CG2-CG2 3.9Å; L68-I78 HydrophobicContact CD2-CG2 4.19Å; V70-I78 HydrophobicContact CB-CD1 4.07Å; V70-I78 HydrophobicContact CG1-CD1 3.65Å; V70-I78 HydrophobicContact CG2-CD1 3.6Å; I74-I78 HydrophobicContact CB-CD1 4.47Å; I74-I78 HydrophobicContact CG2-CD1 3.64Å; I74-I78 HydrophobicContact CG2-CG1 4.22Å; I74-I78 PolarHBondContact O-N 3.09Å; I74-I78 VanDerWaalsContact O-N 3.14Å; I75-I78 PolarHBondContact O-N 3.17Å; P76-I78 VanDerWaalsContact C-N 3.28Å; P76-I78 PolarHBondContact O-N 2.85Å; I78-D80 VanDerWaalsContact C-N 3.31Å; I78-D80 PolarHBondContact O-N 2.85Å; I78-E81 PolarHBondContact O-N 2.91Å; I78-I82 HydrophobicContact CG2-CD1 3.72Å; I78-I82 HydrophobicContact CG2-CG1 4.44Å; I78-I82 VanDerWaalsContact O-CG1 3.23Å; I78-I82 WeakPolarHBondContact O-CG1 3.44Å; I78-I82 PolarHBondContact O-N 3.31Å
79	L	69.9	Low	77.2	Confident	79 Å²	79	68.1 Å²	68.1	41%	0.414	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-39.1	177.8	-71.7	175.6	0	0	0	111.4	L68 I75 P76 G83	L68-L79 HydrophobicContact CD1-CD2 4.12Å; I75-L79 HydrophobicContact CG2-CD1 3.67Å; I75-L79 HydrophobicContact CG2-CG 4.06Å; I75-L79 WeakPolarHBondContact O-CG 3.39Å; I75-L79 PolarHBondContact O-N 3.37Å; P76-L79 PolarHBondContact O-N 3.47Å; L79-G83 WeakPolarHBondContact O-CA 3.37Å; L79-G83 PolarHBondContact O-N 2.76Å
80	D	70.5	Confident	76.7	Confident	138 Å²	138	68.2 Å²	68.2	74%	0.738	38%	0.376	S	S	*	.	H	α-helix	trans	-66.5	-38.3	173.6	-68.8	-18.5	0	0	0	111.5	P76 I78	P76-D80 PolarHBondContact O-N 2.9Å; I78-D80 VanDerWaalsContact C-N 3.31Å; I78-D80 PolarHBondContact O-N 2.85Å
81	E	80.9	Confident	76.4	Confident	81 Å²	81	71.9 Å²	71.9	38%	0.379	39%	0.393	S	S	.	.	H	α-helix	trans	-67.5	-46.1	178.8	-173.7	-166.1	166.6	0	0	112.7	N56 K57 F77 I78	N56-E81 PolarHBondContact ND2-OE2 2.86Å; K57-E81 WeakPolarHBondContact CE-O 3.47Å; F77-E81 VanDerWaalsContact O-CB 3.31Å; F77-E81 WeakPolarHBondContact O-CB 3.39Å; F77-E81 PolarHBondContact O-N 2.94Å; I78-E81 PolarHBondContact O-N 2.91Å
82	I	82.9	Confident	76.3	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-101.2	-10	-171	77.4	-171	0	0	0	113.8	I6 N56 V60 L66 L68 I78 A84 D85 V86	I6-I82 HydrophobicContact CD1-CD1 3.33Å; I6-I82 HydrophobicContact CD1-CG2 4.29Å; N56-I82 HydrophobicContact CB-CG2 3.67Å; V60-I82 HydrophobicContact CG2-CB 3.97Å; V60-I82 HydrophobicContact CG2-CD1 3.9Å; V60-I82 HydrophobicContact CG2-CG1 4.28Å; V60-I82 HydrophobicContact CG2-CG2 4.19Å; L66-I82 HydrophobicContact CD2-CD1 3.89Å; L68-I82 HydrophobicContact CD2-CD1 4.43Å; I78-I82 HydrophobicContact CG2-CD1 3.72Å; I78-I82 HydrophobicContact CG2-CG1 4.44Å; I78-I82 VanDerWaalsContact O-CG1 3.23Å; I78-I82 WeakPolarHBondContact O-CG1 3.44Å; I78-I82 PolarHBondContact O-N 3.31Å; I82-A84 PolarHBondContact O-N 2.83Å; I82-A84 VanDerWaalsContact O-N 3.13Å; I82-D85 WeakPolarHBondContact O-CA 3.42Å; I82-D85 WeakPolarHBondContact O-CB 3.41Å; I82-D85 PolarHBondContact O-N 3.25Å; I82-V86 HydrophobicContact CD1-CG2 4.47Å; I82-V86 HydrophobicContact CG1-CG2 4.08Å; I82-V86 PolarHBondContact O-N 2.88Å
83	G	70.3	Confident	76.6	Confident	41 Å²	41	69.6 Å²	69.6	42%	0.423	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-34.5	-170.5	0	0	0	0	0	113.6	L79 D85	L79-G83 WeakPolarHBondContact O-CA 3.37Å; L79-G83 PolarHBondContact O-N 2.76Å; G83-D85 VanDerWaalsContact C-N 3.34Å
84	A	76.7	Confident	76.9	Confident	101 Å²	101	68.4 Å²	68.4	84%	0.835	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-23.5	175.9	0	0	0	0	0	114	I82	I82-A84 PolarHBondContact O-N 2.83Å; I82-A84 VanDerWaalsContact O-N 3.13Å
85	D	81.4	Confident	76.6	Confident	35 Å²	35	66.3 Å²	66.3	19%	0.187	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-15.9	179.8	-67.3	-78.5	0	0	0	112	K57 V60 K61 I82 G83 Q87	K57-D85 VanDerWaalsContact CD-OD2 3.27Å; K57-D85 WeakPolarHBondContact CD-OD2 3.5Å; K57-D85 WeakPolarHBondContact CE-OD2 3.46Å; K57-D85 WeakPolarHBondContact CG-OD2 3.45Å; K57-D85 IonicContact NZ-OD2 3.19Å; V60-D85 HydrophobicContact CG1-CB 4.24Å; K61-D85 WeakPolarHBondContact CE-OD1 3.36Å; K61-D85 IonicContact NZ-OD1 3.86Å; I82-D85 WeakPolarHBondContact O-CA 3.42Å; I82-D85 WeakPolarHBondContact O-CB 3.41Å; I82-D85 PolarHBondContact O-N 3.25Å; G83-D85 VanDerWaalsContact C-N 3.34Å; D85-Q87 PolarHBondContact O-N 3.44Å
86	V	75	Confident	76.1	Confident	49 Å²	49	66.3 Å²	66.3	30%	0.297	39%	0.387	S	S	.	.			trans	-77.5	116.6	177.2	178	0	0	0	0	110.3	V60 I82 H90 V92	V60-V86 HydrophobicContact CG1-CG2 4.02Å; I82-V86 HydrophobicContact CD1-CG2 4.47Å; I82-V86 HydrophobicContact CG1-CG2 4.08Å; I82-V86 PolarHBondContact O-N 2.88Å; V86-H90 HydrophobicContact CG1-CB 4.16Å; V86-V92 HydrophobicContact CG1-CG2 4.23Å
87	Q	81.1	Confident	75.8	Confident	114 Å²	114	67.5 Å²	67.5	53%	0.533	40%	0.398	S	S	.	.			trans	-101.9	164.6	173.8	-56.3	-171.4	0.5	0	0	112.3	D85 R89 H90	D85-Q87 PolarHBondContact O-N 3.44Å; Q87-R89 HydrophobicContact CB-CG 4.34Å; Q87-R89 PolarHBondContact O-N 3.4Å; Q87-H90 PolarHBondContact N-CE1 2.95Å; Q87-H90 PolarHBondContact N-ND1 3.33Å; Q87-H90 PolarHBondContact O-N 3.07Å; Q87-H90 PolarHBondContact O-ND1 3.34Å
88	A	75.4	Confident	74.5	Confident	114 Å²	114	61.3 Å²	61.3	94%	0.942	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.2	-179.7	0	0	0	0	0	115.5	H90	A88-H90 VanDerWaalsContact C-N 3.3Å
89	R	83.9	Confident	72.8	Confident	119 Å²	119	66.1 Å²	66.1	45%	0.449	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.6	174.6	73.8	-179.5	-168.8	-106.9	-3.7	113.9	Q87	Q87-R89 HydrophobicContact CB-CG 4.34Å; Q87-R89 PolarHBondContact O-N 3.4Å
90	H	78	Confident	71.8	Confident	18 Å²	18	65.3 Å²	65.3	8%	0.083	40%	0.403	C	S	.	.			trans	-86.6	134	-173.3	-56.1	88.4	0	0	0	110.9	V60 S63 D64 V86 Q87 A88	V60-H90 PolarHBondContact O-CD2 3.23Å; V60-H90 PolarHBondContact O-NE2 3.22Å; V60-H90 VanDerWaalsContact O-NE2 3.13Å; S63-H90 PolarHBondContact O-CD2 2.75Å; S63-H90 PolarHBondContact O-NE2 2.92Å; D64-H90 CarbonylContact O-C 3.59Å; D64-H90 VanDerWaalsContact O-CA 3.3Å; D64-H90 WeakPolarHBondContact O-CA 3.28Å; V86-H90 HydrophobicContact CG1-CB 4.16Å; Q87-H90 PolarHBondContact N-CE1 2.95Å; Q87-H90 PolarHBondContact N-ND1 3.33Å; Q87-H90 PolarHBondContact O-N 3.07Å; Q87-H90 PolarHBondContact O-ND1 3.34Å; A88-H90 VanDerWaalsContact C-N 3.3Å
91	I	77.5	Confident	70.8	Confident	104 Å²	104	62.2 Å²	62.2	53%	0.533	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	111.5	171.1	-58.2	176.9	0	0	0	108.1	D64 V65 L66 V93	D64-I91 PolarHBondContact O-N 2.95Å; V65-I91 CarbonylContact C-O 3.55Å; V65-I91 WeakPolarHBondContact CA-O 3.43Å; V65-I91 HydrophobicContact CG1-CB 4.39Å; V65-I91 HydrophobicContact CG2-CB 4.33Å; V65-I91 HydrophobicContact CG2-CD1 4.47Å; L66-I91 PolarHBondContact N-O 3.43Å; I91-V93 HydrophobicContact CG2-CG2 4.14Å
92	V	75.6	Confident	69.4	Low	63 Å²	63	59.6 Å²	59.6	38%	0.382	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	116.4	178.9	-175.7	0	0	0	0	109.8	L66 L68 V86	L66-V92 HydrophobicContact CD2-CG2 4.48Å; L66-V92 CarbonylContact O-C 3.44Å; L66-V92 WeakPolarHBondContact O-CA 3.23Å; L68-V92 HydrophobicContact CD1-CG1 3.75Å; L68-V92 HydrophobicContact CD2-CG1 4.46Å; L68-V92 HydrophobicContact CG-CG1 3.95Å; V86-V92 HydrophobicContact CG1-CG2 4.23Å
93	V	78.1	Confident	68	Low	50 Å²	50	62.3 Å²	62.3	30%	0.303	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	106.1	179	-175	0	0	0	0	108.5	V65 L66 F67 L68 I91	V65-V93 HydrophobicContact CG1-CG2 3.95Å; L66-V93 PolarHBondContact O-N 3.13Å; F67-V93 CarbonylContact C-O 3.59Å; F67-V93 VanDerWaalsContact CA-O 3.31Å; F67-V93 WeakPolarHBondContact CA-O 3.47Å; F67-V93 HydrophobicContact CD1-CB 3.83Å; F67-V93 HydrophobicContact CD1-CG1 3.77Å; F67-V93 HydrophobicContact CE1-CB 3.95Å; F67-V93 HydrophobicContact CE1-CG1 3.66Å; F67-V93 HydrophobicContact CE1-CG2 4.33Å; F67-V93 HydrophobicContact CG-CB 4.39Å; L68-V93 PolarHBondContact N-O 3.18Å; I91-V93 HydrophobicContact CG2-CG2 4.14Å
94	S	76.3	Confident	67.2	Low	76 Å²	76	63.1 Å²	63.1	53%	0.531	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	127.1	175.8	-173	0	0	0	0	110.9
95	C	74.8	Confident	66.3	Low	18 Å²	18	64 Å²	64	12%	0.122	38%	0.379	C	S	.	.			trans	-113.9	11.4	172.9	-62.6	0	0	0	0	113	L11 L68 A97	L11-C95 HydrophobicContact CD2-CB 3.46Å; L11-C95 VanDerWaalsContact CD2-CB 3.46Å; L68-C95 WeakPolarHBondContact O-CA 3.34Å; L68-C95 WeakPolarHBondContact O-CB 3.34Å; L68-C95 PolarHBondContact O-N 3.44Å; C95-A97 PolarHBondContact O-N 3.27Å; C95-A97 VanDerWaalsContact O-N 3.08Å
96	A	64.2	Low	65.5	Low	21 Å²	21	64.9 Å²	64.9	17%	0.174	38%	0.381	C	S	.	.			trans	-71.4	102.7	-179.3	0	0	0	0	0	111.6	P72 I75	P72-A96 HydrophobicContact CB-CB 4.38Å; P72-A96 HydrophobicContact CG-CB 4.19Å; I75-A96 HydrophobicContact CD1-CB 3.72Å; I75-A96 HydrophobicContact CG1-CB 3.45Å; I75-A96 VanDerWaalsContact CG1-CB 3.45Å
97	A	60.3	Low	65	Low	42 Å²	42	64.6 Å²	64.6	35%	0.347	38%	0.384	S	S	.	.	S	Bend	trans	49.8	146.9	173.2	0	0	0	0	0	118.8	P72 C95 T191	P72-A97 HydrophobicContact CG-CB 3.31Å; C95-A97 PolarHBondContact O-N 3.27Å; C95-A97 VanDerWaalsContact O-N 3.08Å; A97-T191 HydrophobicContact CB-CG2 3.86Å; A97-T191 WeakPolarHBondContact O-CG2 3.34Å
98	G	51.1	Low	64.4	Low	16 Å²	16	65.6 Å²	65.6	17%	0.165	39%	0.387	C	S	.	.	S	Bend	trans	137.5	-68.9	174.1	0	0	0	0	0	112.2	S187 T191	G98-S187 PolarHBondContact O-OG 2.98Å; G98-T191 VanDerWaalsContact CA-OG1 3.25Å; G98-T191 WeakPolarHBondContact CA-OG1 3.22Å; G98-T191 PolarHBondContact N-OG1 3.05Å
99	V	44.6	Very low	64.2	Low	108 Å²	108	66.9 Å²	66.9	66%	0.655	38%	0.375	S	S	*	.	S	Bend	trans	-128.5	-38.6	-162	-173	0	0	0	0	113.3	S103	V99-S103 WeakPolarHBondContact O-CB 3.25Å; V99-S103 PolarHBondContact O-N 3.33Å; V99-S103 PolarHBondContact O-OG 3.33Å
100	T	50	Low	63.8	Low	63 Å²	63	63.4 Å²	63.4	39%	0.387	37%	0.371	S	S	.	.	H	α-helix	trans	-82.1	-42.1	-167.7	56.4	0	0	0	0	114.6	S103 V104	T100-S103 PolarHBondContact O-OG 3.39Å; T100-V104 VanDerWaalsContact O-CG2 3.3Å; T100-V104 WeakPolarHBondContact O-CG2 3.49Å; T100-V104 PolarHBondContact O-N 2.95Å
101	I	47.9	Very low	63.8	Low	72 Å²	72	64 Å²	64	37%	0.369	38%	0.375	S	S	.	.	H	α-helix	trans	-74.2	-43.6	178	-61.6	176.1	0	0	0	110.9	L11 S103 V104 E105	L11-I101 HydrophobicContact CB-CD1 4.23Å; L11-I101 HydrophobicContact CB-CG1 4.11Å; L11-I101 HydrophobicContact CD1-CG1 4.23Å; L11-I101 HydrophobicContact CD2-CD1 4.16Å; L11-I101 HydrophobicContact CD2-CG1 3.98Å; L11-I101 HydrophobicContact CG-CG1 4.33Å; I101-S103 VanDerWaalsContact C-N 3.32Å; I101-S103 PolarHBondContact O-N 2.99Å; I101-V104 PolarHBondContact O-N 3.01Å; I101-E105 HydrophobicContact CG2-CG 4.45Å; I101-E105 PolarHBondContact O-N 3.27Å
102	S	51.9	Low	64	Low	26 Å²	26	63 Å²	63	18%	0.182	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-39.2	178.2	-177.7	0	0	0	0	112.2	E105 K106 S187	S102-E105 PolarHBondContact O-N 3.48Å; S102-K106 VanDerWaalsContact O-CB 3.29Å; S102-K106 WeakPolarHBondContact O-CB 3.24Å; S102-K106 VanDerWaalsContact O-CD 3.31Å; S102-K106 WeakPolarHBondContact O-CD 3.44Å; S102-K106 WeakPolarHBondContact O-CG 3.46Å; S102-K106 PolarHBondContact O-N 3.28Å; S102-K106 WeakPolarHBondContact OG-CE 3.44Å; S102-K106 PolarHBondContact OG-NZ 3.08Å; S102-S187 WeakPolarHBondContact CB-OG 3.47Å; S102-S187 PolarHBondContact OG-OG 3.35Å
103	S	54	Low	64.5	Low	59 Å²	59	63 Å²	63	41%	0.413	38%	0.377	S	S	.	.	H	α-helix	trans	-66.3	-37.7	177.3	51.1	0	0	0	0	112.5	V99 T100 I101 A107	V99-S103 WeakPolarHBondContact O-CB 3.25Å; V99-S103 PolarHBondContact O-N 3.33Å; V99-S103 PolarHBondContact O-OG 3.33Å; T100-S103 PolarHBondContact O-OG 3.39Å; I101-S103 VanDerWaalsContact C-N 3.32Å; I101-S103 PolarHBondContact O-N 2.99Å; S103-A107 WeakPolarHBondContact O-CB 3.33Å; S103-A107 PolarHBondContact O-N 3.08Å
104	V	52.8	Low	64.9	Low	58 Å²	58	65 Å²	65	35%	0.352	39%	0.386	S	S	.	.	H	α-helix	trans	-67.3	-44.2	175.9	172.9	0	0	0	0	111.4	T100 I101 A107 F108	T100-V104 VanDerWaalsContact O-CG2 3.3Å; T100-V104 WeakPolarHBondContact O-CG2 3.49Å; T100-V104 PolarHBondContact O-N 2.95Å; I101-V104 PolarHBondContact O-N 3.01Å; V104-A107 WeakPolarHBondContact O-CB 3.5Å; V104-A107 PolarHBondContact O-N 3.35Å; V104-F108 HydrophobicContact CG1-CD2 3.99Å; V104-F108 HydrophobicContact CG1-CE2 3.43Å; V104-F108 VanDerWaalsContact CG1-CE2 3.43Å; V104-F108 HydrophobicContact CG1-CZ 4.23Å; V104-F108 WeakPolarHBondContact O-CD2 3.34Å; V104-F108 PolarHBondContact O-N 2.89Å; V104-F108 VanDerWaalsContact O-N 3.1Å
105	E	59.5	Low	65.4	Low	118 Å²	118	61.4 Å²	61.4	55%	0.551	36%	0.361	S	S	*	.	H	α-helix	trans	-65.2	-42.1	176.8	-70.9	175.3	167.3	0	0	112.3	I101 S102 A107 F108 M109	I101-E105 HydrophobicContact CG2-CG 4.45Å; I101-E105 PolarHBondContact O-N 3.27Å; S102-E105 PolarHBondContact O-N 3.48Å; E105-A107 VanDerWaalsContact C-N 3.29Å; E105-A107 PolarHBondContact O-N 3.26Å; E105-F108 PolarHBondContact O-N 3.46Å; E105-M109 PolarHBondContact O-N 3.37Å
106	K	64.3	Low	66.2	Low	55 Å²	55	64.6 Å²	64.6	24%	0.239	38%	0.377	C	S	.	.	H	α-helix	trans	-59.7	-39.9	173.4	-74.7	164.4	179.8	163.2	0	111.8	S102 F108 M109 A110 A183	S102-K106 VanDerWaalsContact O-CB 3.29Å; S102-K106 WeakPolarHBondContact O-CB 3.24Å; S102-K106 VanDerWaalsContact O-CD 3.31Å; S102-K106 WeakPolarHBondContact O-CD 3.44Å; S102-K106 WeakPolarHBondContact O-CG 3.46Å; S102-K106 PolarHBondContact O-N 3.28Å; S102-K106 WeakPolarHBondContact OG-CE 3.44Å; S102-K106 PolarHBondContact OG-NZ 3.08Å; K106-F108 VanDerWaalsContact C-N 3.35Å; K106-M109 PolarHBondContact O-N 3.03Å; K106-A110 WeakPolarHBondContact O-CB 3.37Å; K106-A110 PolarHBondContact O-N 3.44Å; K106-A183 VanDerWaalsContact NZ-C 3.32Å; K106-A183 PolarHBondContact NZ-O 3.16Å
107	A	63.8	Low	67.6	Low	42 Å²	42	65.3 Å²	65.3	35%	0.347	39%	0.386	S	S	.	.	H	α-helix	trans	-63.9	-40.1	176.4	0	0	0	0	0	111.7	S103 V104 E105 A110 L111	S103-A107 WeakPolarHBondContact O-CB 3.33Å; S103-A107 PolarHBondContact O-N 3.08Å; V104-A107 WeakPolarHBondContact O-CB 3.5Å; V104-A107 PolarHBondContact O-N 3.35Å; E105-A107 VanDerWaalsContact C-N 3.29Å; E105-A107 PolarHBondContact O-N 3.26Å; A107-A110 PolarHBondContact O-N 3.43Å; A107-L111 WeakPolarHBondContact O-CB 3.38Å; A107-L111 VanDerWaalsContact O-CG 3.3Å; A107-L111 WeakPolarHBondContact O-CG 3.3Å; A107-L111 PolarHBondContact O-N 3.21Å
108	F	69.6	Low	69	Low	136 Å²	136	64 Å²	64	60%	0.596	38%	0.376	S	S	*	.	H	α-helix	trans	-65.6	-41.3	174	-69.6	-54.3	0	0	0	112.7	V104 E105 K106 A110 L111 D112	V104-F108 HydrophobicContact CG1-CD2 3.99Å; V104-F108 HydrophobicContact CG1-CE2 3.43Å; V104-F108 VanDerWaalsContact CG1-CE2 3.43Å; V104-F108 HydrophobicContact CG1-CZ 4.23Å; V104-F108 WeakPolarHBondContact O-CD2 3.34Å; V104-F108 PolarHBondContact O-N 2.89Å; V104-F108 VanDerWaalsContact O-N 3.1Å; E105-F108 PolarHBondContact O-N 3.46Å; K106-F108 VanDerWaalsContact C-N 3.35Å; F108-A110 PolarHBondContact O-N 3.29Å; F108-L111 HydrophobicContact CD1-CD1 4.39Å; F108-L111 PolarHBondContact O-N 3.44Å; F108-D112 PolarHBondContact O-N 3.18Å
109	M	70.9	Confident	71.1	Confident	140 Å²	140	66 Å²	66	69%	0.69	39%	0.385	S	S	*	.	H	α-helix	trans	-61.4	-43.3	174.2	-70.8	179	65.7	0	0	112.1	E105 K106 L111 D112 A113	E105-M109 PolarHBondContact O-N 3.37Å; K106-M109 PolarHBondContact O-N 3.03Å; M109-L111 VanDerWaalsContact C-N 3.32Å; M109-L111 PolarHBondContact O-N 3.42Å; M109-D112 PolarHBondContact O-N 3.4Å; M109-A113 WeakPolarHBondContact O-CB 3.34Å; M109-A113 PolarHBondContact O-N 3.3Å
110	A	74.6	Confident	73.5	Confident	46 Å²	46	69.7 Å²	69.7	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-62.4	-40.9	176.1	0	0	0	0	0	111.6	K106 A107 F108 A113 L114	K106-A110 WeakPolarHBondContact O-CB 3.37Å; K106-A110 PolarHBondContact O-N 3.44Å; A107-A110 PolarHBondContact O-N 3.43Å; F108-A110 PolarHBondContact O-N 3.29Å; A110-A113 PolarHBondContact O-N 3.28Å; A110-L114 WeakPolarHBondContact O-CB 3.48Å; A110-L114 VanDerWaalsContact O-CG 3.23Å; A110-L114 WeakPolarHBondContact O-CG 3.47Å; A110-L114 PolarHBondContact O-N 3.44Å
111	L	79.1	Confident	75.8	Confident	32 Å²	32	74.3 Å²	74.3	17%	0.168	41%	0.412	C	S	.	.	H	α-helix	trans	-64.2	-42	176.4	-77.7	169.3	0	0	0	113.1	A107 F108 M109 L114 A115 G132 A133 L136	A107-L111 WeakPolarHBondContact O-CB 3.38Å; A107-L111 VanDerWaalsContact O-CG 3.3Å; A107-L111 WeakPolarHBondContact O-CG 3.3Å; A107-L111 PolarHBondContact O-N 3.21Å; F108-L111 HydrophobicContact CD1-CD1 4.39Å; F108-L111 PolarHBondContact O-N 3.44Å; M109-L111 VanDerWaalsContact C-N 3.32Å; M109-L111 PolarHBondContact O-N 3.42Å; L111-L114 PolarHBondContact O-N 2.82Å; L111-A115 WeakPolarHBondContact O-CB 3.18Å; L111-A115 PolarHBondContact O-N 3.08Å; L111-G132 WeakPolarHBondContact CD2-O 3.28Å; L111-A133 HydrophobicContact CD2-CB 4.06Å; L111-L136 HydrophobicContact CD1-CD1 4.35Å; L111-L136 HydrophobicContact CD2-CD1 3.52Å; L111-L136 HydrophobicContact CD2-CG 4.11Å; L111-L136 HydrophobicContact CG-CD1 3.61Å
112	D	80.4	Confident	78	Confident	82 Å²	82	74 Å²	74	44%	0.439	43%	0.426	S	S	.	.	H	α-helix	trans	-65.5	-42.8	179.6	-155.6	41.5	0	0	0	110.8	F108 M109 A115 D116 R125	F108-D112 PolarHBondContact O-N 3.18Å; M109-D112 PolarHBondContact O-N 3.4Å; D112-A115 PolarHBondContact O-N 3.19Å; D112-D116 PolarHBondContact O-N 3.39Å; D112-R125 IonicContact OD1-CZ 3.73Å; D112-R125 IonicContact OD1-NH2 2.71Å; D112-R125 PolarHBondContact OD1-NH2 3.01Å; D112-R125 IonicContact OD2-NH2 2.66Å
113	A	85.9	Confident	79.9	Confident	62 Å²	62	76 Å²	76	51%	0.512	43%	0.434	S	S	.	.	H	α-helix	trans	-64	-41.2	174.5	0	0	0	0	0	112.9	M109 A110 A115 D116 G117	M109-A113 WeakPolarHBondContact O-CB 3.34Å; M109-A113 PolarHBondContact O-N 3.3Å; A110-A113 PolarHBondContact O-N 3.28Å; A113-A115 VanDerWaalsContact C-N 3.31Å; A113-A115 PolarHBondContact O-N 2.91Å; A113-D116 PolarHBondContact O-N 3.48Å; A113-G117 PolarHBondContact O-N 2.97Å
114	L	86.4	Confident	81.8	Confident	93 Å²	93	77.1 Å²	77.1	49%	0.487	44%	0.44	S	S	.	.	H	α-helix	trans	-62.5	-40.7	173.4	-74.9	170.4	0	0	0	111.3	A110 L111 G117 G118 L136	A110-L114 WeakPolarHBondContact O-CB 3.48Å; A110-L114 VanDerWaalsContact O-CG 3.23Å; A110-L114 WeakPolarHBondContact O-CG 3.47Å; A110-L114 PolarHBondContact O-N 3.44Å; L111-L114 PolarHBondContact O-N 2.82Å; L114-G117 PolarHBondContact O-N 3.48Å; L114-G118 PolarHBondContact O-N 3.17Å; L114-L136 HydrophobicContact CD1-CD1 4.45Å; L114-L136 HydrophobicContact CD1-CD2 4.4Å; L114-L136 HydrophobicContact CD1-CG 4.37Å
115	A	86.4	Confident	83.7	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-67.5	-39.1	177.2	0	0	0	0	0	111.8	L111 D112 A113 G118 V119 R125 A128 I129	L111-A115 WeakPolarHBondContact O-CB 3.18Å; L111-A115 PolarHBondContact O-N 3.08Å; D112-A115 PolarHBondContact O-N 3.19Å; A113-A115 VanDerWaalsContact C-N 3.31Å; A113-A115 PolarHBondContact O-N 2.91Å; A115-G118 PolarHBondContact O-N 2.99Å; A115-V119 VanDerWaalsContact O-CG2 3.28Å; A115-V119 WeakPolarHBondContact O-CG2 3.37Å; A115-V119 PolarHBondContact O-N 2.96Å; A115-R125 VanDerWaalsContact CB-NH1 3.31Å; A115-R125 PolarHBondContact O-NH1 3.38Å; A115-A128 HydrophobicContact CB-CB 4.17Å; A115-I129 HydrophobicContact CB-CB 4.49Å; A115-I129 HydrophobicContact CB-CG1 3.62Å
116	D	93.3	Very high	85	Confident	86 Å²	86	82.2 Å²	82.2	46%	0.46	45%	0.448	S	S	.	.	H	α-helix	trans	-62.5	-43.5	174.1	-75.6	-12	0	0	0	111	D112 A113 G118 V119 K120 R125	D112-D116 PolarHBondContact O-N 3.39Å; A113-D116 PolarHBondContact O-N 3.48Å; D116-G118 PolarHBondContact O-N 2.93Å; D116-V119 PolarHBondContact O-N 3.19Å; D116-K120 WeakPolarHBondContact O-CB 3.3Å; D116-K120 PolarHBondContact O-N 3.21Å; D116-R125 IonicContact OD1-CZ 3.61Å; D116-R125 VanDerWaalsContact OD1-CZ 3.23Å; D116-R125 IonicContact OD1-NH1 3.8Å; D116-R125 PolarHBondContact OD1-NH1 3.19Å; D116-R125 IonicContact OD1-NH2 3.23Å; D116-R125 PolarHBondContact OD1-NH2 3.46Å
117	G	92.1	Very high	85.7	Confident	36 Å²	36	83.1 Å²	83.1	37%	0.371	46%	0.455	S	S	.	.	H	α-helix	trans	-59.6	-44.9	173.3	0	0	0	0	0	112.3	A113 L114 K120 M121	A113-G117 PolarHBondContact O-N 2.97Å; L114-G117 PolarHBondContact O-N 3.48Å; G117-K120 WeakPolarHBondContact O-CB 3.21Å; G117-K120 PolarHBondContact O-N 3.41Å; G117-M121 WeakPolarHBondContact O-CG 3.39Å; G117-M121 PolarHBondContact O-N 3.05Å; G117-M121 VanDerWaalsContact O-N 3.15Å
118	G	89.8	Confident	86.6	Confident	13 Å²	13	81.4 Å²	81.4	13%	0.134	44%	0.441	C	S	.	.	H	α-helix	trans	-61.3	-43.7	175.5	0	0	0	0	0	112.9	L114 A115 D116 M121 G122 L123	L114-G118 PolarHBondContact O-N 3.17Å; A115-G118 PolarHBondContact O-N 2.99Å; D116-G118 PolarHBondContact O-N 2.93Å; G118-M121 CarbonylContact O-C 3.5Å; G118-M121 PolarHBondContact O-N 3.31Å; G118-M121 VanDerWaalsContact O-N 3.16Å; G118-G122 PolarHBondContact O-N 3.1Å; G118-L123 VanDerWaalsContact O-CB 3.3Å; G118-L123 WeakPolarHBondContact O-CB 3.5Å; G118-L123 PolarHBondContact O-N 3.27Å
119	V	96.3	Very high	87	Confident	60 Å²	60	78.5 Å²	78.5	36%	0.364	43%	0.431	S	S	.	.	H	α-helix	trans	-64	-41.3	176.2	171	0	0	0	0	111.4	A115 D116 M121 G122 L123 R125 A128	A115-V119 VanDerWaalsContact O-CG2 3.28Å; A115-V119 WeakPolarHBondContact O-CG2 3.37Å; A115-V119 PolarHBondContact O-N 2.96Å; D116-V119 PolarHBondContact O-N 3.19Å; V119-M121 PolarHBondContact O-N 3.41Å; V119-G122 PolarHBondContact O-N 3.17Å; V119-L123 WeakPolarHBondContact CA-O 3.25Å; V119-L123 WeakPolarHBondContact CG2-O 3.37Å; V119-R125 HydrophobicContact CG2-CB 4.05Å; V119-A128 HydrophobicContact CG2-CB 4.31Å
120	K	95.3	Very high	87.4	Confident	185 Å²	185	77 Å²	77	80%	0.804	42%	0.422	S	S	*	.	H	α-helix	trans	-58.4	-30.8	174.6	-175.2	179.1	179.2	-177.2	0	112.3	D116 G117 G122	D116-K120 WeakPolarHBondContact O-CB 3.3Å; D116-K120 PolarHBondContact O-N 3.21Å; G117-K120 WeakPolarHBondContact O-CB 3.21Å; G117-K120 PolarHBondContact O-N 3.41Å; K120-G122 VanDerWaalsContact C-N 3.33Å
121	M	96.9	Very high	87.5	Confident	160 Å²	160	79.4 Å²	79.4	79%	0.788	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	8.6	175.7	-58.5	-52.9	-64.2	0	0	113.8	G117 G118 V119	G117-M121 WeakPolarHBondContact O-CG 3.39Å; G117-M121 PolarHBondContact O-N 3.05Å; G117-M121 VanDerWaalsContact O-N 3.15Å; G118-M121 CarbonylContact O-C 3.5Å; G118-M121 PolarHBondContact O-N 3.31Å; G118-M121 VanDerWaalsContact O-N 3.16Å; V119-M121 PolarHBondContact O-N 3.41Å
122	G	94.9	Very high	87.3	Confident	65 Å²	65	78.3 Å²	78.3	67%	0.67	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.4	6	172.7	0	0	0	0	0	115.8	G118 V119 K120	G118-G122 PolarHBondContact O-N 3.1Å; V119-G122 PolarHBondContact O-N 3.17Å; K120-G122 VanDerWaalsContact C-N 3.33Å
123	L	91	Very high	87.1	Confident	68 Å²	68	76.4 Å²	76.4	36%	0.356	42%	0.42	S	S	.	.			trans	-75.7	143.3	176.9	-63.4	178.3	0	0	0	111.9	G118 V119 R125 A128 L131	G118-L123 VanDerWaalsContact O-CB 3.3Å; G118-L123 WeakPolarHBondContact O-CB 3.5Å; G118-L123 PolarHBondContact O-N 3.27Å; V119-L123 WeakPolarHBondContact CA-O 3.25Å; V119-L123 WeakPolarHBondContact CG2-O 3.37Å; L123-R125 PolarHBondContact O-N 2.67Å; L123-A128 HydrophobicContact CB-CB 4.13Å; L123-A128 HydrophobicContact CD1-CB 4.42Å; L123-L131 HydrophobicContact CD1-CD1 4.35Å
124	P	94.8	Very high	86.8	Confident	83 Å²	83	79.3 Å²	79.3	54%	0.539	42%	0.423	S	S	.	.			trans	-60	136.2	166.6	-22.4	33.1	0	0	0	111.2	R126 L127 A128	P124-R126 VanDerWaalsContact C-N 3.3Å; P124-R126 PolarHBondContact O-N 3.39Å; P124-L127 HydrophobicContact CB-CB 4.32Å; P124-L127 WeakPolarHBondContact O-CB 3.38Å; P124-L127 PolarHBondContact O-N 3.21Å; P124-A128 PolarHBondContact O-N 2.95Å
125	R	93.4	Very high	86.3	Confident	88 Å²	88	77.9 Å²	77.9	33%	0.332	43%	0.425	S	S	.	.	H	α-helix	trans	-49.7	-47.2	-176.7	179.4	55.9	166.9	-158.8	-10.6	113.3	D112 A115 D116 V119 L123 L127 A128 I129	D112-R125 IonicContact OD1-CZ 3.73Å; D112-R125 IonicContact OD1-NH2 2.71Å; D112-R125 PolarHBondContact OD1-NH2 3.01Å; D112-R125 IonicContact OD2-NH2 2.66Å; A115-R125 VanDerWaalsContact CB-NH1 3.31Å; A115-R125 PolarHBondContact O-NH1 3.38Å; D116-R125 IonicContact OD1-CZ 3.61Å; D116-R125 VanDerWaalsContact OD1-CZ 3.23Å; D116-R125 IonicContact OD1-NH1 3.8Å; D116-R125 PolarHBondContact OD1-NH1 3.19Å; D116-R125 IonicContact OD1-NH2 3.23Å; D116-R125 PolarHBondContact OD1-NH2 3.46Å; V119-R125 HydrophobicContact CG2-CB 4.05Å; L123-R125 PolarHBondContact O-N 2.67Å; R125-L127 VanDerWaalsContact C-N 3.32Å; R125-L127 PolarHBondContact O-N 2.66Å; R125-A128 PolarHBondContact O-N 2.94Å; R125-I129 HydrophobicContact CG-CD1 4.03Å; R125-I129 WeakPolarHBondContact O-CG1 3.49Å; R125-I129 PolarHBondContact O-N 3.49Å
126	R	86.6	Confident	86	Confident	195 Å²	195	81.1 Å²	81.1	74%	0.736	44%	0.442	S	S	*	.	H	α-helix	trans	-59.8	-42.8	179.8	-177.4	177.2	173.9	174.7	-0.8	111.9	P124 Q130	P124-R126 VanDerWaalsContact C-N 3.3Å; P124-R126 PolarHBondContact O-N 3.39Å; R126-Q130 WeakPolarHBondContact O-CG 3.26Å; R126-Q130 PolarHBondContact O-N 3Å
127	L	78	Confident	85.1	Confident	74 Å²	74	82 Å²	82	39%	0.387	45%	0.446	S	S	.	.	H	α-helix	trans	-69.3	-42.6	179.1	-178.1	60.7	0	0	0	111	P124 R125 I129 Q130 L131	P124-L127 HydrophobicContact CB-CB 4.32Å; P124-L127 WeakPolarHBondContact O-CB 3.38Å; P124-L127 PolarHBondContact O-N 3.21Å; R125-L127 VanDerWaalsContact C-N 3.32Å; R125-L127 PolarHBondContact O-N 2.66Å; L127-I129 VanDerWaalsContact C-N 3.35Å; L127-I129 PolarHBondContact O-N 2.97Å; L127-Q130 PolarHBondContact O-N 3.48Å; L127-L131 HydrophobicContact CD1-CD1 4.06Å; L127-L131 HydrophobicContact CD1-CD2 4.5Å; L127-L131 HydrophobicContact CD1-CG 4.01Å; L127-L131 HydrophobicContact CD2-CD1 4.47Å; L127-L131 HydrophobicContact CG-CD1 3.86Å; L127-L131 HydrophobicContact CG-CG 4.24Å; L127-L131 WeakPolarHBondContact O-CB 3.5Å; L127-L131 WeakPolarHBondContact O-CG 3.45Å; L127-L131 PolarHBondContact O-N 2.75Å
128	A	81.8	Confident	84.2	Confident	5 Å²	5	81.6 Å²	81.6	4%	0.041	44%	0.442	C	S	.	.	H	α-helix	trans	-59.5	-43.3	178.5	0	0	0	0	0	112.2	A115 V119 L123 P124 R125 G132	A115-A128 HydrophobicContact CB-CB 4.17Å; V119-A128 HydrophobicContact CG2-CB 4.31Å; L123-A128 HydrophobicContact CB-CB 4.13Å; L123-A128 HydrophobicContact CD1-CB 4.42Å; P124-A128 PolarHBondContact O-N 2.95Å; R125-A128 PolarHBondContact O-N 2.94Å; A128-G132 PolarHBondContact O-N 2.92Å
129	I	79.9	Confident	83.6	Confident	76 Å²	76	83.8 Å²	83.8	39%	0.39	46%	0.458	S	S	.	.	H	α-helix	trans	-61.7	-46.9	174.8	-66.4	168.7	0	0	0	111	A115 R125 L127 G132 A133	A115-I129 HydrophobicContact CB-CB 4.49Å; A115-I129 HydrophobicContact CB-CG1 3.62Å; R125-I129 HydrophobicContact CG-CD1 4.03Å; R125-I129 WeakPolarHBondContact O-CG1 3.49Å; R125-I129 PolarHBondContact O-N 3.49Å; L127-I129 VanDerWaalsContact C-N 3.35Å; L127-I129 PolarHBondContact O-N 2.97Å; I129-G132 PolarHBondContact O-N 3.38Å; I129-A133 VanDerWaalsContact O-CB 3.3Å; I129-A133 WeakPolarHBondContact O-CB 3.26Å; I129-A133 PolarHBondContact O-N 3.4Å
130	Q	78	Confident	82.7	Confident	109 Å²	109	83.3 Å²	83.3	51%	0.509	46%	0.461	S	S	.	.	H	α-helix	trans	-64.1	-43.9	-178.3	-74.2	-179.8	-47.6	0	0	112.2	R126 L127 A133 Q134	R126-Q130 WeakPolarHBondContact O-CG 3.26Å; R126-Q130 PolarHBondContact O-N 3Å; L127-Q130 PolarHBondContact O-N 3.48Å; Q130-A133 PolarHBondContact O-N 3.29Å; Q130-Q134 WeakPolarHBondContact O-CB 3.49Å; Q130-Q134 PolarHBondContact O-N 2.67Å
131	L	77.1	Confident	81.6	Confident	95 Å²	95	80.4 Å²	80.4	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-65.4	-44.6	177.5	-68.8	175.8	0	0	0	111.6	L123 L127 A133 Q134 A135	L123-L131 HydrophobicContact CD1-CD1 4.35Å; L127-L131 HydrophobicContact CD1-CD1 4.06Å; L127-L131 HydrophobicContact CD1-CD2 4.5Å; L127-L131 HydrophobicContact CD1-CG 4.01Å; L127-L131 HydrophobicContact CD2-CD1 4.47Å; L127-L131 HydrophobicContact CG-CD1 3.86Å; L127-L131 HydrophobicContact CG-CG 4.24Å; L127-L131 WeakPolarHBondContact O-CB 3.5Å; L127-L131 WeakPolarHBondContact O-CG 3.45Å; L127-L131 PolarHBondContact O-N 2.75Å; L131-A133 PolarHBondContact O-N 2.9Å; L131-Q134 PolarHBondContact O-N 2.84Å; L131-A135 VanDerWaalsContact O-CB 3.31Å; L131-A135 WeakPolarHBondContact O-CB 3.41Å; L131-A135 PolarHBondContact O-N 2.96Å
132	G	74.8	Confident	80.9	Confident	10 Å²	10	77.8 Å²	77.8	10%	0.103	44%	0.435	C	S	.	.	H	α-helix	trans	-60.1	-45.7	175.9	0	0	0	0	0	112.3	L111 A128 I129 A135 L136	L111-G132 WeakPolarHBondContact CD2-O 3.28Å; A128-G132 PolarHBondContact O-N 2.92Å; I129-G132 PolarHBondContact O-N 3.38Å; G132-A135 PolarHBondContact O-N 2.86Å; G132-L136 PolarHBondContact O-N 3.01Å
133	A	76.6	Confident	80.2	Confident	42 Å²	42	78.2 Å²	78.2	35%	0.347	42%	0.422	S	S	.	.	H	α-helix	trans	-62	-44.8	178.1	0	0	0	0	0	112.1	L111 I129 Q130 L131 L136 L137	L111-A133 HydrophobicContact CD2-CB 4.06Å; I129-A133 VanDerWaalsContact O-CB 3.3Å; I129-A133 WeakPolarHBondContact O-CB 3.26Å; I129-A133 PolarHBondContact O-N 3.4Å; Q130-A133 PolarHBondContact O-N 3.29Å; L131-A133 PolarHBondContact O-N 2.9Å; A133-L136 PolarHBondContact O-N 3.31Å; A133-L137 WeakPolarHBondContact O-CB 3.15Å; A133-L137 PolarHBondContact O-N 3.39Å
134	Q	78.6	Confident	79.7	Confident	122 Å²	122	82 Å²	82	57%	0.57	44%	0.441	S	S	*	.	H	α-helix	trans	-68.3	-36.5	179.2	-168.6	60.9	37.6	0	0	112.1	Q130 L131 L137 G138	Q130-Q134 WeakPolarHBondContact O-CB 3.49Å; Q130-Q134 PolarHBondContact O-N 2.67Å; L131-Q134 PolarHBondContact O-N 2.84Å; Q134-L137 PolarHBondContact O-N 3.07Å; Q134-G138 PolarHBondContact O-N 3.38Å
135	A	76.9	Confident	79.3	Confident	63 Å²	63	83.8 Å²	83.8	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-46	175.9	0	0	0	0	0	111.6	L131 G132 G138 A139	L131-A135 VanDerWaalsContact O-CB 3.31Å; L131-A135 WeakPolarHBondContact O-CB 3.41Å; L131-A135 PolarHBondContact O-N 2.96Å; G132-A135 PolarHBondContact O-N 2.86Å; A135-G138 PolarHBondContact O-N 3.13Å; A135-A139 WeakPolarHBondContact O-CB 3.28Å; A135-A139 PolarHBondContact O-N 2.85Å
136	L	79.1	Confident	78.9	Confident	69 Å²	69	81.4 Å²	81.4	36%	0.361	44%	0.443	S	S	.	.	H	α-helix	trans	-65.2	-42.7	175.8	-69.1	-172.6	0	0	0	112.2	L111 L114 G132 A133 A139 A140	L111-L136 HydrophobicContact CD1-CD1 4.35Å; L111-L136 HydrophobicContact CD2-CD1 3.52Å; L111-L136 HydrophobicContact CD2-CG 4.11Å; L111-L136 HydrophobicContact CG-CD1 3.61Å; L114-L136 HydrophobicContact CD1-CD1 4.45Å; L114-L136 HydrophobicContact CD1-CD2 4.4Å; L114-L136 HydrophobicContact CD1-CG 4.37Å; G132-L136 PolarHBondContact O-N 3.01Å; A133-L136 PolarHBondContact O-N 3.31Å; L136-A139 PolarHBondContact O-N 3.3Å; L136-A140 VanDerWaalsContact O-CB 3.32Å; L136-A140 WeakPolarHBondContact O-CB 3.39Å; L136-A140 PolarHBondContact O-N 3.47Å
137	L	75	Confident	79	Confident	104 Å²	104	81.9 Å²	81.9	55%	0.545	45%	0.454	S	S	.	.	H	α-helix	trans	-60.7	-45.9	176.6	177.8	64.4	0	0	0	111.5	A133 Q134 A140 K141	A133-L137 WeakPolarHBondContact O-CB 3.15Å; A133-L137 PolarHBondContact O-N 3.39Å; Q134-L137 PolarHBondContact O-N 3.07Å; L137-A140 PolarHBondContact O-N 3.3Å; L137-K141 VanDerWaalsContact O-CB 3.27Å; L137-K141 WeakPolarHBondContact O-CB 3.27Å; L137-K141 PolarHBondContact O-N 2.89Å
138	G	72.8	Confident	79.5	Confident	27 Å²	27	82.7 Å²	82.7	28%	0.278	46%	0.456	S	S	.	.	H	α-helix	trans	-63.1	-46.5	178.4	0	0	0	0	0	112.2	Q134 A135 A140 K141 M142	Q134-G138 PolarHBondContact O-N 3.38Å; A135-G138 PolarHBondContact O-N 3.13Å; G138-A140 PolarHBondContact O-N 2.97Å; G138-K141 PolarHBondContact O-N 3.47Å; G138-M142 WeakPolarHBondContact O-CB 3.3Å; G138-M142 VanDerWaalsContact O-CG 3.27Å; G138-M142 WeakPolarHBondContact O-CG 3.36Å; G138-M142 PolarHBondContact O-N 2.96Å
139	A	77.6	Confident	80	Confident	59 Å²	59	88.5 Å²	88.5	49%	0.488	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-44.5	177.3	0	0	0	0	0	112.2	A135 L136 M142 L143	A135-A139 WeakPolarHBondContact O-CB 3.28Å; A135-A139 PolarHBondContact O-N 2.85Å; L136-A139 PolarHBondContact O-N 3.3Å; A139-M142 PolarHBondContact O-N 3.47Å; A139-L143 PolarHBondContact O-N 3.32Å; A139-L143 VanDerWaalsContact O-N 3.11Å
140	A	76.8	Confident	80.5	Confident	50 Å²	50	88.1 Å²	88.1	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-44.5	176.4	0	0	0	0	0	111.4	L136 L137 G138 L143 L144	L136-A140 VanDerWaalsContact O-CB 3.32Å; L136-A140 WeakPolarHBondContact O-CB 3.39Å; L136-A140 PolarHBondContact O-N 3.47Å; L137-A140 PolarHBondContact O-N 3.3Å; G138-A140 PolarHBondContact O-N 2.97Å; A140-L143 PolarHBondContact O-N 3.5Å; A140-L144 VanDerWaalsContact O-CG 3.3Å; A140-L144 WeakPolarHBondContact O-CG 3.32Å; A140-L144 PolarHBondContact O-N 3.46Å
141	K	74	Confident	81	Confident	125 Å²	125	85 Å²	85	54%	0.543	48%	0.475	S	S	.	.	H	α-helix	trans	-62.9	-44.8	177.6	-176	172.7	-179	-179.9	0	112.1	L137 G138 L143 L144 D145	L137-K141 VanDerWaalsContact O-CB 3.27Å; L137-K141 WeakPolarHBondContact O-CB 3.27Å; L137-K141 PolarHBondContact O-N 2.89Å; G138-K141 PolarHBondContact O-N 3.47Å; K141-L143 PolarHBondContact O-N 2.86Å; K141-L144 PolarHBondContact O-N 2.89Å; K141-L144 VanDerWaalsContact O-N 3.13Å; K141-D145 WeakPolarHBondContact CE-OD2 3.31Å; K141-D145 VanDerWaalsContact CG-OD2 3.28Å; K141-D145 WeakPolarHBondContact CG-OD2 3.49Å; K141-D145 WeakPolarHBondContact O-CB 3.35Å; K141-D145 VanDerWaalsContact O-CG 3.31Å; K141-D145 PolarHBondContact O-N 3.49Å
142	M	82.3	Confident	81.6	Confident	104 Å²	104	84.9 Å²	84.9	51%	0.512	47%	0.471	S	S	.	.	H	α-helix	trans	-57.9	-37.5	175.6	-75.9	177.3	67.2	0	0	112.4	G138 A139 S146	G138-M142 WeakPolarHBondContact O-CB 3.3Å; G138-M142 VanDerWaalsContact O-CG 3.27Å; G138-M142 WeakPolarHBondContact O-CG 3.36Å; G138-M142 PolarHBondContact O-N 2.96Å; A139-M142 PolarHBondContact O-N 3.47Å; M142-S146 WeakPolarHBondContact O-CB 3.43Å; M142-S146 PolarHBondContact O-N 2.94Å
143	L	80.1	Confident	82.3	Confident	74 Å²	74	85.5 Å²	85.5	39%	0.387	47%	0.472	S	S	.	.	H	α-helix	trans	-71.8	-38.3	176.2	179.6	63.6	0	0	0	112.4	A139 A140 K141 S146 P150 L153	A139-L143 PolarHBondContact O-N 3.32Å; A139-L143 VanDerWaalsContact O-N 3.11Å; A140-L143 PolarHBondContact O-N 3.5Å; K141-L143 PolarHBondContact O-N 2.86Å; L143-S146 VanDerWaalsContact O-O 3.05Å; L143-P150 HydrophobicContact CD1-CB 4.34Å; L143-P150 HydrophobicContact CD1-CG 3.74Å; L143-P150 HydrophobicContact CD2-CG 4.31Å; L143-L153 HydrophobicContact CB-CD1 4.14Å; L143-L153 HydrophobicContact CD1-CD1 3.85Å
144	L	79.1	Confident	82.9	Confident	147 Å²	147	86.8 Å²	86.8	77%	0.77	47%	0.47	S	S	*	.	H	α-helix	trans	-71.2	-33.3	178.9	-69	171.9	0	0	0	112.7	A140 K141	A140-L144 VanDerWaalsContact O-CG 3.3Å; A140-L144 WeakPolarHBondContact O-CG 3.32Å; A140-L144 PolarHBondContact O-N 3.46Å; K141-L144 PolarHBondContact O-N 2.89Å; K141-L144 VanDerWaalsContact O-N 3.13Å
145	D	85.9	Confident	83.4	Confident	121 Å²	121	84.5 Å²	84.5	65%	0.647	46%	0.461	S	S	*	.	S	Bend	trans	-87.5	-7.2	-178.4	-64.9	-14.3	0	0	0	112.6	K141	K141-D145 WeakPolarHBondContact CE-OD2 3.31Å; K141-D145 VanDerWaalsContact CG-OD2 3.28Å; K141-D145 WeakPolarHBondContact CG-OD2 3.49Å; K141-D145 WeakPolarHBondContact O-CB 3.35Å; K141-D145 VanDerWaalsContact O-CG 3.31Å; K141-D145 PolarHBondContact O-N 3.49Å
146	S	86.1	Confident	84	Confident	38 Å²	38	86.1 Å²	86.1	27%	0.266	46%	0.461	S	S	.	.			trans	-117.8	144.6	-175.7	-175.3	0	0	0	0	111.6	M142 L143 Q148	M142-S146 WeakPolarHBondContact O-CB 3.43Å; M142-S146 PolarHBondContact O-N 2.94Å; L143-S146 VanDerWaalsContact O-O 3.05Å; S146-Q148 VanDerWaalsContact C-N 3.28Å; S146-Q148 WeakPolarHBondContact OG-CB 3.3Å; S146-Q148 WeakPolarHBondContact OG-CG 3.43Å; S146-Q148 PolarHBondContact OG-N 3.35Å; S146-Q148 VanDerWaalsContact OG-N 3.15Å
147	E	89.4	Confident	84.4	Confident	205 Å²	205	87.1 Å²	87.1	96%	0.958	47%	0.47	S	S	*	.			trans	-86.6	0.9	170.4	-61.8	-170.6	168	0	0	112.8
148	Q	88.6	Confident	84.9	Confident	91 Å²	91	83.4 Å²	83.4	43%	0.425	45%	0.453	S	S	.	.	S	Bend	trans	-74	146.4	-178.2	-65.1	-179.3	-0.2	0	0	112.2	S146 L153 N156	S146-Q148 VanDerWaalsContact C-N 3.28Å; S146-Q148 WeakPolarHBondContact OG-CB 3.3Å; S146-Q148 WeakPolarHBondContact OG-CG 3.43Å; S146-Q148 PolarHBondContact OG-N 3.35Å; S146-Q148 VanDerWaalsContact OG-N 3.15Å; Q148-L153 HydrophobicContact CB-CD2 4.24Å; Q148-L153 HydrophobicContact CB-CG 4.24Å; Q148-N156 PolarHBondContact OE1-ND2 2.9Å
149	H	91.6	Very high	85.7	Confident	127 Å²	127	86 Å²	86	59%	0.588	47%	0.466	S	S	*	.			trans	-62.8	141.3	174.5	-172.2	-93.6	0	0	0	111.3	C151 Q152 L153	H149-C151 VanDerWaalsContact C-N 3.25Å; H149-C151 VanDerWaalsContact CE1-SG 3.52Å; H149-C151 WeakPolarHBondContact ND1-CB 3.44Å; H149-C151 PolarHBondContact ND1-N 3.05Å; H149-C151 VanDerWaalsContact ND1-N 3.16Å; H149-C151 PolarHBondContact O-N 3.49Å; H149-C151 VanDerWaalsContact O-N 3.13Å; H149-Q152 WeakPolarHBondContact O-CA 3.3Å; H149-Q152 VanDerWaalsContact O-CB 3.28Å; H149-Q152 WeakPolarHBondContact O-CB 3.48Å; H149-Q152 PolarHBondContact O-N 2.93Å; H149-L153 PolarHBondContact O-N 3.47Å
150	P	89.3	Confident	86.3	Confident	68 Å²	68	89.7 Å²	89.7	44%	0.442	49%	0.485	S	S	.	.	H	α-helix	trans	-54	-36	-179.6	-26	30	0	0	0	114.7	L143 Q152 L153 K154	L143-P150 HydrophobicContact CD1-CB 4.34Å; L143-P150 HydrophobicContact CD1-CG 3.74Å; L143-P150 HydrophobicContact CD2-CG 4.31Å; P150-Q152 VanDerWaalsContact C-N 3.28Å; P150-Q152 PolarHBondContact O-N 3.45Å; P150-L153 PolarHBondContact O-N 3.26Å; P150-K154 WeakPolarHBondContact O-CB 3.41Å; P150-K154 PolarHBondContact O-N 3.41Å
151	C	89.4	Confident	86.9	Confident	45 Å²	45	90.4 Å²	90.4	30%	0.304	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-36.2	175.4	-65.7	0	0	0	0	112.2	H149 K154 D155	H149-C151 VanDerWaalsContact C-N 3.25Å; H149-C151 VanDerWaalsContact CE1-SG 3.52Å; H149-C151 WeakPolarHBondContact ND1-CB 3.44Å; H149-C151 PolarHBondContact ND1-N 3.05Å; H149-C151 VanDerWaalsContact ND1-N 3.16Å; H149-C151 PolarHBondContact O-N 3.49Å; H149-C151 VanDerWaalsContact O-N 3.13Å; C151-K154 WeakPolarHBondContact O-CB 3.48Å; C151-K154 PolarHBondContact O-N 3.4Å; C151-D155 PolarHBondContact O-N 2.99Å
152	Q	90.8	Very high	87.9	Confident	91 Å²	91	85.5 Å²	85.5	43%	0.425	48%	0.483	S	S	.	.	H	α-helix	trans	-67.6	-44.3	177.1	-173	62.6	52.9	0	0	110.9	H149 P150 K154 D155 N156	H149-Q152 WeakPolarHBondContact O-CA 3.3Å; H149-Q152 VanDerWaalsContact O-CB 3.28Å; H149-Q152 WeakPolarHBondContact O-CB 3.48Å; H149-Q152 PolarHBondContact O-N 2.93Å; P150-Q152 VanDerWaalsContact C-N 3.28Å; P150-Q152 PolarHBondContact O-N 3.45Å; Q152-K154 VanDerWaalsContact C-N 3.27Å; Q152-K154 PolarHBondContact O-N 2.97Å; Q152-D155 PolarHBondContact O-N 2.96Å; Q152-D155 VanDerWaalsContact O-N 3.13Å; Q152-N156 PolarHBondContact NE2-OD1 3.32Å; Q152-N156 PolarHBondContact O-N 3.47Å; Q152-N156 PolarHBondContact O-ND2 2.91Å; Q152-N156 PolarHBondContact O-OD1 3.32Å
153	L	87.9	Confident	88.2	Confident	23 Å²	23	84.6 Å²	84.6	12%	0.12	49%	0.492	C	S	.	.	H	α-helix	trans	-60.3	-39	175.1	-67.8	176.4	0	0	0	111.7	L143 Q148 H149 P150 N156 V157	L143-L153 HydrophobicContact CB-CD1 4.14Å; L143-L153 HydrophobicContact CD1-CD1 3.85Å; Q148-L153 HydrophobicContact CB-CD2 4.24Å; Q148-L153 HydrophobicContact CB-CG 4.24Å; H149-L153 PolarHBondContact O-N 3.47Å; P150-L153 PolarHBondContact O-N 3.26Å; L153-N156 PolarHBondContact O-N 2.62Å; L153-V157 WeakPolarHBondContact O-CG2 3.43Å; L153-V157 PolarHBondContact O-N 2.84Å
154	K	89.2	Confident	88.5	Confident	69 Å²	69	83.9 Å²	83.9	30%	0.3	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-44.1	173.3	178.3	-143	62.6	155.3	0	111.4	P150 C151 Q152 V157 C158 L168	P150-K154 WeakPolarHBondContact O-CB 3.41Å; P150-K154 PolarHBondContact O-N 3.41Å; C151-K154 WeakPolarHBondContact O-CB 3.48Å; C151-K154 PolarHBondContact O-N 3.4Å; Q152-K154 VanDerWaalsContact C-N 3.27Å; Q152-K154 PolarHBondContact O-N 2.97Å; K154-V157 PolarHBondContact O-N 3.36Å; K154-C158 PolarHBondContact O-N 2.88Å; K154-C158 PolarHBondContact O-SG 3.5Å; K154-L168 HydrophobicContact CD-CD1 3.99Å; K154-L168 HydrophobicContact CG-CD1 3.98Å
155	D	90.7	Very high	89.1	Confident	74 Å²	74	80.2 Å²	80.2	40%	0.396	47%	0.471	S	S	.	.	H	α-helix	trans	-67.7	-35.7	179.1	-65.2	-21.9	0	0	0	111.8	C151 Q152 V157 C158	C151-D155 PolarHBondContact O-N 2.99Å; Q152-D155 PolarHBondContact O-N 2.96Å; Q152-D155 VanDerWaalsContact O-N 3.13Å; D155-V157 PolarHBondContact O-N 3.2Å; D155-V157 VanDerWaalsContact O-N 3.17Å; D155-C158 PolarHBondContact O-N 2.96Å
156	N	88.4	Confident	89.3	Confident	97 Å²	97	80.5 Å²	80.5	52%	0.519	47%	0.468	S	S	.	.	H	α-helix	trans	-62.4	-22.2	175.5	-64	-13.5	0	0	0	113.2	Q148 Q152 L153	Q148-N156 PolarHBondContact OE1-ND2 2.9Å; Q152-N156 PolarHBondContact NE2-OD1 3.32Å; Q152-N156 PolarHBondContact O-N 3.47Å; Q152-N156 PolarHBondContact O-ND2 2.91Å; Q152-N156 PolarHBondContact O-OD1 3.32Å; L153-N156 PolarHBondContact O-N 2.62Å
157	V	87	Confident	89.6	Confident	90 Å²	90	81.3 Å²	81.3	55%	0.545	48%	0.478	S	S	.	.	H	α-helix	trans	-89.8	-18.2	175.5	179.9	0	0	0	0	111.9	L153 K154 D155 T164	L153-V157 WeakPolarHBondContact O-CG2 3.43Å; L153-V157 PolarHBondContact O-N 2.84Å; K154-V157 PolarHBondContact O-N 3.36Å; D155-V157 PolarHBondContact O-N 3.2Å; D155-V157 VanDerWaalsContact O-N 3.17Å; V157-T164 HydrophobicContact CG1-CG2 4.27Å
158	C	86.9	Confident	89.7	Confident	26 Å²	26	73.3 Å²	73.3	18%	0.176	44%	0.441	C	S	.	.			trans	-94	108.5	-175.9	-64.6	0	0	0	0	111.4	K154 D155 L168	K154-C158 PolarHBondContact O-N 2.88Å; K154-C158 PolarHBondContact O-SG 3.5Å; D155-C158 PolarHBondContact O-N 2.96Å; C158-L168 WeakPolarHBondContact SG-CD1 3.28Å
159	S	88.5	Confident	90	Very high	81 Å²	81	75.3 Å²	75.3	57%	0.566	45%	0.45	S	S	*	.			trans	-78.2	144.4	166.6	-48.1	0	0	0	0	111	G161 G162	S159-G161 PolarHBondContact O-N 3.38Å; S159-G162 PolarHBondContact O-N 2.94Å
160	P	89.4	Confident	90.1	Very high	137 Å²	137	77.2 Å²	77.2	89%	0.89	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	125.1	174.1	-26.4	34.9	0	0	0	111.7	G162	P160-G162 PolarHBondContact O-N 3.49Å
161	G	90.9	Very high	90.2	Very high	66 Å²	66	77.5 Å²	77.5	68%	0.68	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	5.1	-177.8	0	0	0	0	0	115.9	S159	S159-G161 PolarHBondContact O-N 3.38Å
162	G	93.8	Very high	90.4	Very high	22 Å²	22	79.2 Å²	79.2	23%	0.227	46%	0.458	C	S	.	.			trans	-73.8	172.5	-176.2	0	0	0	0	0	115.1	S159 P160 T164 I165 H166	S159-G162 PolarHBondContact O-N 2.94Å; P160-G162 PolarHBondContact O-N 3.49Å; G162-T164 VanDerWaalsContact C-N 3.3Å; G162-T164 PolarHBondContact O-N 3.05Å; G162-I165 VanDerWaalsContact O-CG2 3.23Å; G162-I165 WeakPolarHBondContact O-CG2 3.34Å; G162-I165 PolarHBondContact O-N 3.37Å; G162-H166 PolarHBondContact O-ND1 2.91Å
163	A	88.9	Confident	90.6	Very high	85 Å²	85	78.9 Å²	78.9	70%	0.702	47%	0.466	S	S	*	.	H	α-helix	trans	-62.4	-36.4	178.2	0	0	0	0	0	112.8	I165 H166 A167	A163-I165 PolarHBondContact O-N 2.88Å; A163-H166 PolarHBondContact O-N 3.33Å; A163-A167 PolarHBondContact O-N 3.34Å; A163-A167 VanDerWaalsContact O-N 3.11Å
164	T	87.1	Confident	90.8	Very high	58 Å²	58	80.4 Å²	80.4	36%	0.356	49%	0.487	S	S	.	.	H	α-helix	trans	-61.1	-42.5	-178	-46	0	0	0	0	112.2	V157 G162 H166 A167 L168	V157-T164 HydrophobicContact CG1-CG2 4.27Å; G162-T164 VanDerWaalsContact C-N 3.3Å; G162-T164 PolarHBondContact O-N 3.05Å; T164-H166 VanDerWaalsContact C-N 3.33Å; T164-H166 PolarHBondContact O-N 2.94Å; T164-A167 PolarHBondContact O-N 2.93Å; T164-L168 HydrophobicContact CG2-CD1 4.4Å; T164-L168 WeakPolarHBondContact O-CG 3.49Å; T164-L168 PolarHBondContact O-N 3.48Å
165	I	90.3	Very high	91	Very high	71 Å²	71	78.2 Å²	78.2	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-70.2	-32.4	-177.5	-166.7	62.6	0	0	0	112	G162 A163 L168 H169	G162-I165 VanDerWaalsContact O-CG2 3.23Å; G162-I165 WeakPolarHBondContact O-CG2 3.34Å; G162-I165 PolarHBondContact O-N 3.37Å; A163-I165 PolarHBondContact O-N 2.88Å; I165-L168 HydrophobicContact CD1-CD1 4.29Å; I165-L168 PolarHBondContact O-N 3.27Å; I165-H169 WeakPolarHBondContact O-CB 3.11Å; I165-H169 PolarHBondContact O-N 3.29Å
166	H	92	Very high	90.9	Very high	126 Å²	126	79.3 Å²	79.3	58%	0.583	49%	0.485	S	S	*	.	H	α-helix	trans	-66.5	-42.3	173.4	-69.7	84.2	0	0	0	111.7	G162 A163 T164 H169 F170	G162-H166 PolarHBondContact O-ND1 2.91Å; A163-H166 PolarHBondContact O-N 3.33Å; T164-H166 VanDerWaalsContact C-N 3.33Å; T164-H166 PolarHBondContact O-N 2.94Å; H166-H169 PolarHBondContact O-N 2.86Å; H166-F170 PolarHBondContact O-N 2.8Å
167	A	91.1	Very high	90.8	Very high	56 Å²	56	80.1 Å²	80.1	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-44	175	0	0	0	0	0	111.6	A163 T164 H169 F170 L171	A163-A167 PolarHBondContact O-N 3.34Å; A163-A167 VanDerWaalsContact O-N 3.11Å; T164-A167 PolarHBondContact O-N 2.93Å; A167-H169 VanDerWaalsContact C-N 3.35Å; A167-H169 PolarHBondContact O-N 3.02Å; A167-F170 PolarHBondContact O-N 2.9Å; A167-L171 WeakPolarHBondContact O-CG 3.29Å; A167-L171 PolarHBondContact O-N 2.99Å; A167-L171 VanDerWaalsContact O-N 3.13Å
168	L	91.3	Very high	91	Very high	36 Å²	36	78.5 Å²	78.5	19%	0.188	47%	0.474	C	S	.	.	H	α-helix	trans	-60.7	-43.1	175.9	-73.5	174.1	0	0	0	111.9	K154 C158 T164 I165 F170 L171 E172	K154-L168 HydrophobicContact CD-CD1 3.99Å; K154-L168 HydrophobicContact CG-CD1 3.98Å; C158-L168 WeakPolarHBondContact SG-CD1 3.28Å; T164-L168 HydrophobicContact CG2-CD1 4.4Å; T164-L168 WeakPolarHBondContact O-CG 3.49Å; T164-L168 PolarHBondContact O-N 3.48Å; I165-L168 HydrophobicContact CD1-CD1 4.29Å; I165-L168 PolarHBondContact O-N 3.27Å; L168-F170 VanDerWaalsContact C-N 3.28Å; L168-F170 PolarHBondContact O-N 3.48Å; L168-L171 PolarHBondContact O-N 2.92Å; L168-L171 VanDerWaalsContact O-N 3.14Å; L168-E172 WeakPolarHBondContact O-CG 3.31Å; L168-E172 PolarHBondContact O-N 2.85Å
169	H	95.5	Very high	90.8	Very high	134 Å²	134	82.5 Å²	82.5	62%	0.62	49%	0.493	S	S	*	.	H	α-helix	trans	-57.6	-40.9	177.6	179	-107.2	0	0	0	112.3	I165 H166 A167 E172 S173	I165-H169 WeakPolarHBondContact O-CB 3.11Å; I165-H169 PolarHBondContact O-N 3.29Å; H166-H169 PolarHBondContact O-N 2.86Å; A167-H169 VanDerWaalsContact C-N 3.35Å; A167-H169 PolarHBondContact O-N 3.02Å; H169-E172 PolarHBondContact O-N 3.46Å; H169-S173 WeakPolarHBondContact O-CB 3.13Å; H169-S173 PolarHBondContact O-N 3.08Å; H169-S173 PolarHBondContact O-OG 3.2Å
170	F	93.7	Very high	90.3	Very high	166 Å²	166	82.7 Å²	82.7	73%	0.728	49%	0.487	S	S	*	.	H	α-helix	trans	-66.4	-41.6	176.2	-171.8	-97.3	0	0	0	112.3	H166 A167 L168 S173 G174	H166-F170 PolarHBondContact O-N 2.8Å; A167-F170 PolarHBondContact O-N 2.9Å; L168-F170 VanDerWaalsContact C-N 3.28Å; L168-F170 PolarHBondContact O-N 3.48Å; F170-S173 PolarHBondContact O-N 3.28Å; F170-G174 PolarHBondContact O-N 2.92Å; F170-G174 VanDerWaalsContact O-N 3.09Å
171	L	90.9	Very high	89.9	Confident	74 Å²	74	81.3 Å²	81.3	39%	0.387	47%	0.471	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176	-68.6	174.9	0	0	0	112.2	A167 L168 G174 G175 F176	A167-L171 WeakPolarHBondContact O-CG 3.29Å; A167-L171 PolarHBondContact O-N 2.99Å; A167-L171 VanDerWaalsContact O-N 3.13Å; L168-L171 PolarHBondContact O-N 2.92Å; L168-L171 VanDerWaalsContact O-N 3.14Å; L171-G174 PolarHBondContact O-N 2.83Å; L171-G175 PolarHBondContact O-N 3.27Å; L171-F176 HydrophobicContact CB-CB 4Å; L171-F176 HydrophobicContact CB-CG 4.36Å; L171-F176 HydrophobicContact CD2-CD2 4.24Å; L171-F176 HydrophobicContact CD2-CG 4.39Å; L171-F176 WeakPolarHBondContact O-CB 3.42Å; L171-F176 PolarHBondContact O-N 3.25Å
172	E	94.2	Very high	89.4	Confident	82 Å²	82	82.1 Å²	82.1	38%	0.383	46%	0.46	S	S	.	.	H	α-helix	trans	-67.1	-39.8	177	-63.7	-66.2	175.9	0	0	111.3	L168 H169 G174 G175 R177	L168-E172 WeakPolarHBondContact O-CG 3.31Å; L168-E172 PolarHBondContact O-N 2.85Å; H169-E172 PolarHBondContact O-N 3.46Å; E172-G174 PolarHBondContact O-N 3.15Å; E172-G175 PolarHBondContact O-N 3.11Å; E172-R177 VanDerWaalsContact CD-NE 3.35Å; E172-R177 IonicContact OE1-CZ 2.62Å; E172-R177 IonicContact OE1-NE 2.8Å; E172-R177 PolarHBondContact OE1-NE 3.31Å; E172-R177 IonicContact OE1-NH2 2.83Å; E172-R177 PolarHBondContact OE1-NH2 3.5Å; E172-R177 WeakPolarHBondContact OE2-CD 3.3Å; E172-R177 IonicContact OE2-NE 3.2Å; E172-R177 PolarHBondContact OE2-NE 2.87Å
173	S	94.9	Very high	88.3	Confident	83 Å²	83	82.8 Å²	82.8	58%	0.58	46%	0.463	S	S	*	.	H	α-helix	trans	-59.9	-32.5	175.1	-59.6	0	0	0	0	112.4	H169 F170 G175	H169-S173 WeakPolarHBondContact O-CB 3.13Å; H169-S173 PolarHBondContact O-N 3.08Å; H169-S173 PolarHBondContact O-OG 3.2Å; F170-S173 PolarHBondContact O-N 3.28Å; S173-G175 VanDerWaalsContact C-N 3.31Å
174	G	92.3	Very high	87.5	Confident	56 Å²	56	82.9 Å²	82.9	58%	0.577	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	2.8	174.9	0	0	0	0	0	115	F170 L171 E172	F170-G174 PolarHBondContact O-N 2.92Å; F170-G174 VanDerWaalsContact O-N 3.09Å; L171-G174 PolarHBondContact O-N 2.83Å; E172-G174 PolarHBondContact O-N 3.15Å
175	G	92.6	Very high	86.9	Confident	22 Å²	22	85.1 Å²	85.1	23%	0.227	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	33.7	-177.5	0	0	0	0	0	113.6	L171 E172 S173 R177 S178 L179	L171-G175 PolarHBondContact O-N 3.27Å; E172-G175 PolarHBondContact O-N 3.11Å; S173-G175 VanDerWaalsContact C-N 3.31Å; G175-R177 PolarHBondContact O-N 3.28Å; G175-R177 VanDerWaalsContact O-N 3.13Å; G175-S178 PolarHBondContact O-N 2.92Å; G175-S178 PolarHBondContact O-OG 3.35Å; G175-L179 WeakPolarHBondContact O-CG 3.47Å; G175-L179 PolarHBondContact O-N 2.94Å
176	F	89.6	Confident	86.1	Confident	97 Å²	97	84.5 Å²	84.5	43%	0.425	47%	0.467	S	S	.	.	H	α-helix	trans	-51.8	-40.8	-176.7	178.8	-105.2	0	0	0	113.5	L171 L180	L171-F176 HydrophobicContact CB-CB 4Å; L171-F176 HydrophobicContact CB-CG 4.36Å; L171-F176 HydrophobicContact CD2-CD2 4.24Å; L171-F176 HydrophobicContact CD2-CG 4.39Å; L171-F176 WeakPolarHBondContact O-CB 3.42Å; L171-F176 PolarHBondContact O-N 3.25Å; F176-L180 HydrophobicContact CD1-CD1 4.21Å; F176-L180 HydrophobicContact CE1-CD1 3.6Å; F176-L180 HydrophobicContact CE2-CD1 4.46Å; F176-L180 HydrophobicContact CZ-CD1 3.76Å; F176-L180 HydrophobicContact CZ-CG 4.42Å; F176-L180 PolarHBondContact O-N 2.9Å
177	R	86.1	Confident	84.8	Confident	115 Å²	115	79.7 Å²	79.7	43%	0.434	45%	0.447	S	S	.	.	H	α-helix	trans	-63.9	-46.1	177.4	-63.2	-177.7	-174.1	-102.9	-9.1	112.6	E172 G175 L179 L180 I181	E172-R177 VanDerWaalsContact CD-NE 3.35Å; E172-R177 IonicContact OE1-CZ 2.62Å; E172-R177 IonicContact OE1-NE 2.8Å; E172-R177 PolarHBondContact OE1-NE 3.31Å; E172-R177 IonicContact OE1-NH2 2.83Å; E172-R177 PolarHBondContact OE1-NH2 3.5Å; E172-R177 WeakPolarHBondContact OE2-CD 3.3Å; E172-R177 IonicContact OE2-NE 3.2Å; E172-R177 PolarHBondContact OE2-NE 2.87Å; G175-R177 PolarHBondContact O-N 3.28Å; G175-R177 VanDerWaalsContact O-N 3.13Å; R177-L179 VanDerWaalsContact C-N 3.31Å; R177-L179 PolarHBondContact O-N 3.22Å; R177-L180 PolarHBondContact O-N 3.16Å; R177-I181 VanDerWaalsContact O-CG1 3.31Å; R177-I181 WeakPolarHBondContact O-CG1 3.39Å; R177-I181 PolarHBondContact O-N 3.15Å
178	S	90.9	Very high	83.6	Confident	55 Å²	55	79 Å²	79	39%	0.385	44%	0.438	S	S	.	.	H	α-helix	trans	-66.7	-36.4	-177.8	59.9	0	0	0	0	110.9	G175 L180 I181 N182	G175-S178 PolarHBondContact O-N 2.92Å; G175-S178 PolarHBondContact O-OG 3.35Å; S178-L180 VanDerWaalsContact C-N 3.34Å; S178-L180 PolarHBondContact O-N 2.86Å; S178-I181 PolarHBondContact O-N 2.81Å; S178-N182 VanDerWaalsContact O-CB 3.3Å; S178-N182 WeakPolarHBondContact O-CB 3.45Å; S178-N182 PolarHBondContact O-N 3.41Å; S178-N182 PolarHBondContact O-ND2 2.96Å; S178-N182 PolarHBondContact O-OD1 3.03Å
179	L	83.4	Confident	82.9	Confident	110 Å²	110	80.7 Å²	80.7	58%	0.576	45%	0.447	S	S	*	.	H	α-helix	trans	-58.8	-43.9	173.6	-65.8	176.1	0	0	0	112.2	G175 R177 A183	G175-L179 WeakPolarHBondContact O-CG 3.47Å; G175-L179 PolarHBondContact O-N 2.94Å; R177-L179 VanDerWaalsContact C-N 3.31Å; R177-L179 PolarHBondContact O-N 3.22Å; L179-A183 VanDerWaalsContact O-CB 3.22Å; L179-A183 WeakPolarHBondContact O-CB 3.43Å; L179-A183 PolarHBondContact O-N 3.45Å
180	L	77.3	Confident	81.9	Confident	86 Å²	86	80 Å²	80	45%	0.45	44%	0.439	S	S	.	.	H	α-helix	trans	-66.8	-42.4	177.2	-68.9	176.3	0	0	0	112.3	F176 R177 S178 A183 V184	F176-L180 HydrophobicContact CD1-CD1 4.21Å; F176-L180 HydrophobicContact CE1-CD1 3.6Å; F176-L180 HydrophobicContact CE2-CD1 4.46Å; F176-L180 HydrophobicContact CZ-CD1 3.76Å; F176-L180 HydrophobicContact CZ-CG 4.42Å; F176-L180 PolarHBondContact O-N 2.9Å; R177-L180 PolarHBondContact O-N 3.16Å; S178-L180 VanDerWaalsContact C-N 3.34Å; S178-L180 PolarHBondContact O-N 2.86Å; L180-A183 PolarHBondContact O-N 3.06Å; L180-V184 WeakPolarHBondContact O-CG2 3.45Å; L180-V184 PolarHBondContact O-N 3.29Å
181	I	80.4	Confident	80.6	Confident	108 Å²	108	73.5 Å²	73.5	55%	0.554	41%	0.413	S	S	*	.	H	α-helix	trans	-60.4	-52.8	176.7	-67.5	163.9	0	0	0	109.9	R177 S178 A183 V184 E185	R177-I181 VanDerWaalsContact O-CG1 3.31Å; R177-I181 WeakPolarHBondContact O-CG1 3.39Å; R177-I181 PolarHBondContact O-N 3.15Å; S178-I181 PolarHBondContact O-N 2.81Å; I181-A183 VanDerWaalsContact C-N 3.25Å; I181-A183 PolarHBondContact O-N 3.17Å; I181-V184 PolarHBondContact O-N 3.26Å; I181-E185 WeakPolarHBondContact O-CB 3.24Å; I181-E185 PolarHBondContact O-N 3.46Å
182	N	81.4	Confident	79.6	Confident	82 Å²	82	78.2 Å²	78.2	44%	0.439	43%	0.425	S	S	.	.	H	α-helix	trans	-60.3	-36.8	179.5	-66	-5.9	0	0	0	111.3	S178 E185 A186	S178-N182 VanDerWaalsContact O-CB 3.3Å; S178-N182 WeakPolarHBondContact O-CB 3.45Å; S178-N182 PolarHBondContact O-N 3.41Å; S178-N182 PolarHBondContact O-ND2 2.96Å; S178-N182 PolarHBondContact O-OD1 3.03Å; N182-E185 PolarHBondContact O-N 3.42Å; N182-A186 WeakPolarHBondContact O-CB 3.27Å; N182-A186 PolarHBondContact O-N 3.22Å
183	A	70.9	Confident	78.7	Confident	36 Å²	36	78.2 Å²	78.2	30%	0.298	43%	0.426	S	S	.	.	H	α-helix	trans	-70.5	-31.3	177.3	0	0	0	0	0	113	K106 L179 L180 I181 S187	K106-A183 VanDerWaalsContact NZ-C 3.32Å; K106-A183 PolarHBondContact NZ-O 3.16Å; L179-A183 VanDerWaalsContact O-CB 3.22Å; L179-A183 WeakPolarHBondContact O-CB 3.43Å; L179-A183 PolarHBondContact O-N 3.45Å; L180-A183 PolarHBondContact O-N 3.06Å; I181-A183 VanDerWaalsContact C-N 3.25Å; I181-A183 PolarHBondContact O-N 3.17Å; A183-S187 VanDerWaalsContact O-CB 3.3Å; A183-S187 WeakPolarHBondContact O-CB 3.38Å; A183-S187 PolarHBondContact O-N 3.22Å
184	V	70.8	Confident	77.4	Confident	87 Å²	87	77.3 Å²	77.3	53%	0.527	41%	0.414	S	S	.	.	H	α-helix	trans	-72.9	-44.8	172.1	171.7	0	0	0	0	110.3	L180 I181 S187 C188	L180-V184 WeakPolarHBondContact O-CG2 3.45Å; L180-V184 PolarHBondContact O-N 3.29Å; I181-V184 PolarHBondContact O-N 3.26Å; V184-S187 PolarHBondContact O-N 3.35Å; V184-C188 WeakPolarHBondContact O-CB 3.02Å; V184-C188 PolarHBondContact O-N 3.16Å
185	E	75.9	Confident	76.2	Confident	106 Å²	106	78.8 Å²	78.8	50%	0.495	41%	0.406	S	S	.	.	H	α-helix	trans	-57.9	-54.1	176.2	179.1	176.3	-149.9	0	0	111.3	I181 N182 S187 C188 I189	I181-E185 WeakPolarHBondContact O-CB 3.24Å; I181-E185 PolarHBondContact O-N 3.46Å; N182-E185 PolarHBondContact O-N 3.42Å; E185-S187 VanDerWaalsContact C-N 3.28Å; E185-S187 PolarHBondContact O-N 2.86Å; E185-C188 CarbonylContact O-C 3.6Å; E185-C188 WeakPolarHBondContact O-CB 3.27Å; E185-C188 PolarHBondContact O-N 3.13Å; E185-I189 HydrophobicContact CG-CD1 3.63Å; E185-I189 HydrophobicContact CG-CG1 4.24Å; E185-I189 WeakPolarHBondContact O-CG1 3.4Å; E185-I189 PolarHBondContact O-N 3.46Å
186	A	71.9	Confident	75.1	Confident	58 Å²	58	80.2 Å²	80.2	48%	0.479	41%	0.412	S	S	.	.	H	α-helix	trans	-57.9	-40.4	178.5	0	0	0	0	0	112.2	N182 R190	N182-A186 WeakPolarHBondContact O-CB 3.27Å; N182-A186 PolarHBondContact O-N 3.22Å; A186-R190 VanDerWaalsContact O-CB 3.27Å; A186-R190 WeakPolarHBondContact O-CB 3.43Å; A186-R190 PolarHBondContact O-N 3.28Å
187	S	65.3	Low	74.2	Confident	24 Å²	24	79.9 Å²	79.9	17%	0.168	41%	0.413	C	S	.	.	H	α-helix	trans	-62.7	-43	174.6	-174.9	0	0	0	0	111.9	G98 S102 A183 V184 E185 T191	G98-S187 PolarHBondContact O-OG 2.98Å; S102-S187 WeakPolarHBondContact CB-OG 3.47Å; S102-S187 PolarHBondContact OG-OG 3.35Å; A183-S187 VanDerWaalsContact O-CB 3.3Å; A183-S187 WeakPolarHBondContact O-CB 3.38Å; A183-S187 PolarHBondContact O-N 3.22Å; V184-S187 PolarHBondContact O-N 3.35Å; E185-S187 VanDerWaalsContact C-N 3.28Å; E185-S187 PolarHBondContact O-N 2.86Å; S187-T191 WeakPolarHBondContact O-CB 3.46Å; S187-T191 PolarHBondContact O-N 3.13Å; S187-T191 PolarHBondContact O-OG1 2.97Å
188	C	67.3	Low	73	Confident	42 Å²	42	75 Å²	75	28%	0.284	40%	0.397	S	S	.	.	H	α-helix	trans	-68.3	-46.5	178.9	-169.5	0	0	0	0	111.7	V184 E185 R190 T191 R192	V184-C188 WeakPolarHBondContact O-CB 3.02Å; V184-C188 PolarHBondContact O-N 3.16Å; E185-C188 CarbonylContact O-C 3.6Å; E185-C188 WeakPolarHBondContact O-CB 3.27Å; E185-C188 PolarHBondContact O-N 3.13Å; C188-R190 PolarHBondContact O-N 3.02Å; C188-T191 WeakPolarHBondContact O-CB 3.41Å; C188-T191 PolarHBondContact O-N 3.24Å; C188-R192 WeakPolarHBondContact O-CG 3.48Å; C188-R192 PolarHBondContact O-N 3.19Å
189	I	76.4	Confident	71.6	Confident	71 Å²	71	75.5 Å²	75.5	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-56.5	-51.4	175.3	-68.8	172	0	0	0	109.5	E185 T191 R192 E193	E185-I189 HydrophobicContact CG-CD1 3.63Å; E185-I189 HydrophobicContact CG-CG1 4.24Å; E185-I189 WeakPolarHBondContact O-CG1 3.4Å; E185-I189 PolarHBondContact O-N 3.46Å; I189-T191 VanDerWaalsContact C-N 3.26Å; I189-T191 PolarHBondContact O-N 3.43Å; I189-R192 WeakPolarHBondContact O-CB 3.21Å; I189-R192 PolarHBondContact O-N 3.45Å; I189-R192 VanDerWaalsContact O-N 3.08Å; I189-E193 HydrophobicContact CG2-CG 4.41Å; I189-E193 WeakPolarHBondContact O-CG 3.46Å; I189-E193 PolarHBondContact O-N 2.98Å
190	R	73.1	Confident	70.6	Confident	119 Å²	119	76.8 Å²	76.8	45%	0.449	40%	0.399	S	S	.	.	H	α-helix	trans	-61.2	-37.2	179.7	-176	55.4	-179.9	163.5	2.8	112.5	A186 C188 E193 L194	A186-R190 VanDerWaalsContact O-CB 3.27Å; A186-R190 WeakPolarHBondContact O-CB 3.43Å; A186-R190 PolarHBondContact O-N 3.28Å; C188-R190 PolarHBondContact O-N 3.02Å; R190-E193 VanDerWaalsContact CD-OE2 3.24Å; R190-E193 WeakPolarHBondContact CD-OE2 3.38Å; R190-E193 IonicContact CZ-OE2 3.01Å; R190-E193 IonicContact NE-OE2 3.99Å; R190-E193 IonicContact NH1-OE2 3.98Å; R190-E193 PolarHBondContact NH1-OE2 3.07Å; R190-E193 WeakPolarHBondContact O-CB 3.23Å; R190-E193 PolarHBondContact O-N 3.29Å; R190-L194 HydrophobicContact CG-CD1 4.25Å; R190-L194 HydrophobicContact CG-CG 4.47Å; R190-L194 WeakPolarHBondContact O-CB 3.42Å; R190-L194 VanDerWaalsContact O-CG 3.26Å; R190-L194 WeakPolarHBondContact O-CG 3.45Å; R190-L194 PolarHBondContact O-N 3.42Å
191	T	66.6	Low	69.5	Low	31 Å²	31	79.7 Å²	79.7	19%	0.19	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-43.2	175.9	-60.6	0	0	0	0	111.3	A97 G98 S187 C188 I189 E193 L194 Q195	A97-T191 HydrophobicContact CB-CG2 3.86Å; A97-T191 WeakPolarHBondContact O-CG2 3.34Å; G98-T191 VanDerWaalsContact CA-OG1 3.25Å; G98-T191 WeakPolarHBondContact CA-OG1 3.22Å; G98-T191 PolarHBondContact N-OG1 3.05Å; S187-T191 WeakPolarHBondContact O-CB 3.46Å; S187-T191 PolarHBondContact O-N 3.13Å; S187-T191 PolarHBondContact O-OG1 2.97Å; C188-T191 WeakPolarHBondContact O-CB 3.41Å; C188-T191 PolarHBondContact O-N 3.24Å; I189-T191 VanDerWaalsContact C-N 3.26Å; I189-T191 PolarHBondContact O-N 3.43Å; T191-E193 VanDerWaalsContact C-N 3.35Å; T191-L194 PolarHBondContact O-N 3.32Å; T191-Q195 WeakPolarHBondContact O-CB 3.47Å; T191-Q195 PolarHBondContact O-N 2.84Å
192	R	71.4	Confident	68.1	Low	172 Å²	172	80 Å²	80	65%	0.649	41%	0.407	S	S	*	.	H	α-helix	trans	-63.4	-40.3	174.8	-68.7	174.5	-172.8	165	2.8	111.8	C188 I189 Q195 S196	C188-R192 WeakPolarHBondContact O-CG 3.48Å; C188-R192 PolarHBondContact O-N 3.19Å; I189-R192 WeakPolarHBondContact O-CB 3.21Å; I189-R192 PolarHBondContact O-N 3.45Å; I189-R192 VanDerWaalsContact O-N 3.08Å; R192-Q195 PolarHBondContact O-N 3.39Å; R192-S196 WeakPolarHBondContact O-CB 3.45Å; R192-S196 PolarHBondContact O-N 2.82Å; R192-S196 PolarHBondContact O-OG 2.87Å
193	E	74.7	Confident	66.5	Low	83 Å²	83	81.9 Å²	81.9	39%	0.388	42%	0.416	S	S	.	.	H	α-helix	trans	-60.4	-51.7	173.8	-71.9	172.5	-175.4	0	0	111.3	I189 R190 T191 Q195 S196 M197	I189-E193 HydrophobicContact CG2-CG 4.41Å; I189-E193 WeakPolarHBondContact O-CG 3.46Å; I189-E193 PolarHBondContact O-N 2.98Å; R190-E193 VanDerWaalsContact CD-OE2 3.24Å; R190-E193 WeakPolarHBondContact CD-OE2 3.38Å; R190-E193 IonicContact CZ-OE2 3.01Å; R190-E193 IonicContact NE-OE2 3.99Å; R190-E193 IonicContact NH1-OE2 3.98Å; R190-E193 PolarHBondContact NH1-OE2 3.07Å; R190-E193 WeakPolarHBondContact O-CB 3.23Å; R190-E193 PolarHBondContact O-N 3.29Å; T191-E193 VanDerWaalsContact C-N 3.35Å; E193-Q195 VanDerWaalsContact C-N 3.25Å; E193-Q195 PolarHBondContact O-N 3.18Å; E193-S196 WeakPolarHBondContact CA-OG 3.35Å; E193-S196 PolarHBondContact O-N 3.37Å; E193-S196 VanDerWaalsContact O-N 3.07Å; E193-S196 PolarHBondContact O-OG 3.13Å; E193-M197 VanDerWaalsContact O-CG 3.28Å; E193-M197 WeakPolarHBondContact O-CG 3.28Å; E193-M197 PolarHBondContact O-N 3.42Å
194	L	66.9	Low	65.2	Low	64 Å²	64	83.6 Å²	83.6	34%	0.335	43%	0.426	S	S	.	.	H	α-helix	trans	-59.7	-38.1	178.8	-72.3	173.3	0	0	0	111.9	R190 T191 M197 A198	R190-L194 HydrophobicContact CG-CD1 4.25Å; R190-L194 HydrophobicContact CG-CG 4.47Å; R190-L194 WeakPolarHBondContact O-CB 3.42Å; R190-L194 VanDerWaalsContact O-CG 3.26Å; R190-L194 WeakPolarHBondContact O-CG 3.45Å; R190-L194 PolarHBondContact O-N 3.42Å; T191-L194 PolarHBondContact O-N 3.32Å; L194-M197 HydrophobicContact CD2-SD 4.46Å; L194-A198 WeakPolarHBondContact O-CB 3.15Å; L194-A198 PolarHBondContact O-N 3.31Å
195	Q	66.4	Low	63.9	Low	87 Å²	87	83.8 Å²	83.8	41%	0.407	43%	0.429	S	S	.	.	H	α-helix	trans	-64.3	-47	173.6	-173.3	58.8	44.4	0	0	111	T191 R192 E193 M197 A198 D199	T191-Q195 WeakPolarHBondContact O-CB 3.47Å; T191-Q195 PolarHBondContact O-N 2.84Å; R192-Q195 PolarHBondContact O-N 3.39Å; E193-Q195 VanDerWaalsContact C-N 3.25Å; E193-Q195 PolarHBondContact O-N 3.18Å; Q195-M197 VanDerWaalsContact C-N 3.32Å; Q195-M197 PolarHBondContact O-N 3.37Å; Q195-A198 PolarHBondContact O-N 3.41Å; Q195-D199 PolarHBondContact NE2-OD1 3.13Å; Q195-D199 VanDerWaalsContact NE2-OD1 3.08Å; Q195-D199 PolarHBondContact NE2-OD2 2.92Å; Q195-D199 PolarHBondContact O-N 3.29Å
196	S	71.4	Confident	62.5	Low	51 Å²	51	82.1 Å²	82.1	36%	0.357	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-36.8	177.9	73.9	0	0	0	0	113	R192 E193 D199 Q200	R192-S196 WeakPolarHBondContact O-CB 3.45Å; R192-S196 PolarHBondContact O-N 2.82Å; R192-S196 PolarHBondContact O-OG 2.87Å; E193-S196 WeakPolarHBondContact CA-OG 3.35Å; E193-S196 PolarHBondContact O-N 3.37Å; E193-S196 VanDerWaalsContact O-N 3.07Å; E193-S196 PolarHBondContact O-OG 3.13Å; S196-D199 PolarHBondContact O-N 3.11Å; S196-Q200 WeakPolarHBondContact O-CB 3.47Å; S196-Q200 VanDerWaalsContact O-CG 3.26Å; S196-Q200 WeakPolarHBondContact O-CG 3.31Å; S196-Q200 PolarHBondContact O-N 3.48Å
197	M	69.9	Low	61.2	Low	91 Å²	91	82 Å²	82	45%	0.448	43%	0.432	S	S	.	.	H	α-helix	trans	-66.1	-43.9	174.7	-67.8	171.3	73.4	0	0	110.9	E193 L194 Q195 D199 Q200 E201	E193-M197 VanDerWaalsContact O-CG 3.28Å; E193-M197 WeakPolarHBondContact O-CG 3.28Å; E193-M197 PolarHBondContact O-N 3.42Å; L194-M197 HydrophobicContact CD2-SD 4.46Å; Q195-M197 VanDerWaalsContact C-N 3.32Å; Q195-M197 PolarHBondContact O-N 3.37Å; M197-D199 VanDerWaalsContact C-N 3.32Å; M197-D199 PolarHBondContact O-N 2.8Å; M197-Q200 PolarHBondContact O-N 3.27Å; M197-E201 PolarHBondContact O-N 3.45Å
198	A	60.3	Low	60.4	Low	12 Å²	12	85.9 Å²	85.9	10%	0.099	45%	0.45	C	S	.	.	H	α-helix	trans	-65.2	-35.2	176.5	0	0	0	0	0	112.5	L194 Q195 K202	L194-A198 WeakPolarHBondContact O-CB 3.15Å; L194-A198 PolarHBondContact O-N 3.31Å; Q195-A198 PolarHBondContact O-N 3.41Å; A198-K202 WeakPolarHBondContact O-CG 3.42Å; A198-K202 PolarHBondContact O-N 2.95Å
199	D	62.4	Low	59.4	Low	65 Å²	65	91.2 Å²	91.2	35%	0.348	47%	0.469	S	S	.	.	H	α-helix	trans	-72.2	-34.9	176.5	-65.3	-29.5	0	0	0	111.6	Q195 S196 M197 K202 I203	Q195-D199 PolarHBondContact NE2-OD1 3.13Å; Q195-D199 VanDerWaalsContact NE2-OD1 3.08Å; Q195-D199 PolarHBondContact NE2-OD2 2.92Å; Q195-D199 PolarHBondContact O-N 3.29Å; S196-D199 PolarHBondContact O-N 3.11Å; M197-D199 VanDerWaalsContact C-N 3.32Å; M197-D199 PolarHBondContact O-N 2.8Å; D199-K202 PolarHBondContact O-N 3.47Å; D199-I203 WeakPolarHBondContact O-CD1 3.39Å; D199-I203 WeakPolarHBondContact O-CG1 3.3Å; D199-I203 PolarHBondContact O-N 2.9Å
200	Q	61.8	Low	58.1	Low	138 Å²	138	95.3 Å²	95.3	65%	0.645	48%	0.484	S	S	*	.	H	α-helix	trans	-67.3	-39.6	173	-74.5	175.2	16.5	0	0	112.7	S196 M197 K202 I203	S196-Q200 WeakPolarHBondContact O-CB 3.47Å; S196-Q200 VanDerWaalsContact O-CG 3.26Å; S196-Q200 WeakPolarHBondContact O-CG 3.31Å; S196-Q200 PolarHBondContact O-N 3.48Å; M197-Q200 PolarHBondContact O-N 3.27Å; Q200-K202 VanDerWaalsContact C-N 3.28Å; Q200-K202 PolarHBondContact O-N 3.25Å; Q200-I203 PolarHBondContact O-N 3.48Å
201	E	55	Low	56.9	Low	146 Å²	146	93.7 Å²	93.7	68%	0.682	49%	0.487	S	S	*	.	H	α-helix	trans	-62.1	-35.4	175.3	-77.4	-178.8	168.4	0	0	112	M197 I203 S204	M197-E201 PolarHBondContact O-N 3.45Å; E201-I203 VanDerWaalsContact C-N 3.35Å; E201-I203 PolarHBondContact O-N 3.32Å; E201-S204 PolarHBondContact O-OG 3.14Å
202	K	49.7	Very low	55.8	Low	114 Å²	114	97.3 Å²	97.3	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-69.2	-22.7	175.3	-75.2	177.5	178.1	-177.2	0	115	P76 A198 D199 Q200 S204	P76-K202 VanDerWaalsContact CG-NZ 3.25Å; A198-K202 WeakPolarHBondContact O-CG 3.42Å; A198-K202 PolarHBondContact O-N 2.95Å; D199-K202 PolarHBondContact O-N 3.47Å; Q200-K202 VanDerWaalsContact C-N 3.28Å; Q200-K202 PolarHBondContact O-N 3.25Å; K202-S204 PolarHBondContact O-N 3.38Å
203	I	48.1	Very low	54.8	Low	122 Å²	122	94.3 Å²	94.3	63%	0.626	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-0.9	-175.4	-69.1	164.5	0	0	0	112.9	D199 Q200 E201	D199-I203 WeakPolarHBondContact O-CD1 3.39Å; D199-I203 WeakPolarHBondContact O-CG1 3.3Å; D199-I203 PolarHBondContact O-N 2.9Å; Q200-I203 PolarHBondContact O-N 3.48Å; E201-I203 VanDerWaalsContact C-N 3.35Å; E201-I203 PolarHBondContact O-N 3.32Å
204	S	44.8	Very low	53.5	Low	72 Å²	72	94.9 Å²	94.9	50%	0.503	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	66.3	-179.8	70.5	0	0	0	0	115.8	E201 K202	E201-S204 PolarHBondContact O-OG 3.14Å; K202-S204 PolarHBondContact O-N 3.38Å
205	P	43.7	Very low	52.7	Low	91 Å²	91	100.8 Å²	100.8	59%	0.591	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	-16.8	137	5.2	12.5	0	0	0	112.6
206	A	45.4	Very low	51.7	Low	71 Å²	71	101.5 Å²	101.5	59%	0.587	54%	0.535	S	S	*	.	H	α-helix	trans	-86.6	-29.9	-178.7	0	0	0	0	0	113	L208 K209 K210	A206-L208 VanDerWaalsContact C-N 3.26Å; A206-L208 PolarHBondContact O-N 3.19Å; A206-K209 PolarHBondContact O-N 2.71Å; A206-K210 PolarHBondContact O-N 3.35Å
207	A	45.6	Very low	50.3	Low	55 Å²	55	107 Å²	107	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-60.8	-37.9	168.2	0	0	0	0	0	111.1	K209 K210 T211	A207-K209 PolarHBondContact O-N 3.09Å; A207-K210 PolarHBondContact O-N 3Å; A207-T211 PolarHBondContact O-N 3.38Å; A207-T211 VanDerWaalsContact O-N 3.08Å; A207-T211 PolarHBondContact O-OG1 3.27Å
208	L	47.6	Very low	49.1	Very low	106 Å²	106	110.1 Å²	110.1	56%	0.555	57%	0.57	S	S	*	*	H	α-helix	trans	-60.2	-38.2	175.4	-84	156.5	0	0	0	113.2	A206 L212	A206-L208 VanDerWaalsContact C-N 3.26Å; A206-L208 PolarHBondContact O-N 3.19Å; L208-L212 VanDerWaalsContact O-CB 3.25Å; L208-L212 WeakPolarHBondContact O-CB 3.23Å; L208-L212 WeakPolarHBondContact O-CG 3.38Å; L208-L212 PolarHBondContact O-N 3.31Å
209	K	46.7	Very low	48.1	Very low	154 Å²	154	117.9 Å²	117.9	67%	0.67	60%	0.604	S	S	*	*	H	α-helix	trans	-72.8	-36.7	178.1	-92.8	-176	177.5	179.3	0	113.2	A206 A207 L213	A206-K209 PolarHBondContact O-N 2.71Å; A207-K209 PolarHBondContact O-N 3.09Å; K209-L213 WeakPolarHBondContact O-CB 3.48Å; K209-L213 WeakPolarHBondContact O-CD1 3.47Å; K209-L213 WeakPolarHBondContact O-CG 3.47Å; K209-L213 PolarHBondContact O-N 2.83Å
210	K	49.2	Very low	46.6	Very low	157 Å²	157	119.1 Å²	119.1	68%	0.683	62%	0.618	S	S	*	*	H	α-helix	trans	-70.6	-39.2	177.9	-156.4	175.2	-177.1	-179.1	0	111.3	A206 A207 D214	A206-K210 PolarHBondContact O-N 3.35Å; A207-K210 PolarHBondContact O-N 3Å; K210-D214 PolarHBondContact O-N 2.96Å
211	T	47.8	Very low	45.3	Very low	85 Å²	85	118.2 Å²	118.2	52%	0.521	62%	0.624	S	S	.	*	H	α-helix	trans	-72	-31.7	175.3	-33.5	0	0	0	0	113	A207 R215	A207-T211 PolarHBondContact O-N 3.38Å; A207-T211 VanDerWaalsContact O-N 3.08Å; A207-T211 PolarHBondContact O-OG1 3.27Å; T211-R215 WeakPolarHBondContact O-CG 3.34Å; T211-R215 PolarHBondContact O-N 3.27Å
212	L	44.2	Very low	44	Very low	107 Å²	107	118 Å²	118	56%	0.56	63%	0.633	S	S	*	*	H	α-helix	trans	-74.6	-38.6	174.4	-82.3	170.3	0	0	0	113.1	L208 R215 V216	L208-L212 VanDerWaalsContact O-CB 3.25Å; L208-L212 WeakPolarHBondContact O-CB 3.23Å; L208-L212 WeakPolarHBondContact O-CG 3.38Å; L208-L212 PolarHBondContact O-N 3.31Å; L212-R215 PolarHBondContact O-N 2.97Å; L212-V216 VanDerWaalsContact O-CG2 3.28Å; L212-V216 WeakPolarHBondContact O-CG2 3.39Å; L212-V216 PolarHBondContact O-N 3.44Å
213	L	48.7	Very low	43.1	Very low	109 Å²	109	118.7 Å²	118.7	57%	0.571	65%	0.647	S	S	*	*	H	α-helix	trans	-67.8	-33.8	176.5	-84.8	157	0	0	0	112.7	K209 K217	K209-L213 WeakPolarHBondContact O-CB 3.48Å; K209-L213 WeakPolarHBondContact O-CD1 3.47Å; K209-L213 WeakPolarHBondContact O-CG 3.47Å; K209-L213 PolarHBondContact O-N 2.83Å; L213-K217 PolarHBondContact O-N 2.94Å
214	D	49	Very low	42.2	Very low	96 Å²	96	117.7 Å²	117.7	51%	0.513	65%	0.65	S	S	.	*	H	α-helix	trans	-75.3	-27	175.4	-77.6	-19.3	0	0	0	112.7	K210	K210-D214 PolarHBondContact O-N 2.96Å
215	R	49.6	Very low	41.4	Very low	187 Å²	187	120 Å²	120	71%	0.706	66%	0.661	S	S	*	*	H	α-helix	trans	-79	-33.4	172.8	-76	-164.5	177.7	-169.9	0.8	113.9	T211 L212 K217 L218	T211-R215 WeakPolarHBondContact O-CG 3.34Å; T211-R215 PolarHBondContact O-N 3.27Å; L212-R215 PolarHBondContact O-N 2.97Å; R215-K217 VanDerWaalsContact C-N 3.25Å; R215-K217 PolarHBondContact O-N 2.76Å; R215-L218 PolarHBondContact O-N 3.24Å
216	V	45.2	Very low	40.7	Very low	102 Å²	102	123.3 Å²	123.3	62%	0.618	67%	0.673	S	S	*	*	H	α-helix	trans	-69.5	-22.4	176.5	171.8	0	0	0	0	112.4	L212 L218	L212-V216 VanDerWaalsContact O-CG2 3.28Å; L212-V216 WeakPolarHBondContact O-CG2 3.39Å; L212-V216 PolarHBondContact O-N 3.44Å; V216-L218 VanDerWaalsContact C-N 3.34Å
217	K	43	Very low	39.8	Very low	168 Å²	168	126.8 Å²	126.8	73%	0.73	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-11.3	174.9	-76.2	-178.8	178.2	179	0	114.9	L213 R215	L213-K217 PolarHBondContact O-N 2.94Å; R215-K217 VanDerWaalsContact C-N 3.25Å; R215-K217 PolarHBondContact O-N 2.76Å
218	L	44.6	Very low	39.7	Very low	155 Å²	155	129.9 Å²	129.9	81%	0.812	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-11.9	179.8	-84.4	156.1	0	0	0	113.5	R215 V216	R215-L218 PolarHBondContact O-N 3.24Å; V216-L218 VanDerWaalsContact C-N 3.34Å
219	E	39.3	Very low	38.8	Very low	176 Å²	176	130.8 Å²	130.8	82%	0.822	72%	0.718	S	S	*	*			trans	-125.7	76.4	177.4	-70.6	-176.3	174.4	0	0	111
220	S	29.6	Very low	37.9	Very low	91 Å²	91	128.8 Å²	128.8	64%	0.636	72%	0.723	S	S	*	*			trans	-137.9	119.9	155.9	63.9	0	0	0	0	109.5
221	P	34.3	Very low	37.7	Very low	119 Å²	119	127.2 Å²	127.2	77%	0.773	73%	0.73	S	S	*	*			trans	-78.7	123.3	-178.9	30.9	-30.5	0	0	0	109.9	V223	P221-V223 PolarHBondContact O-N 2.95Å
222	T	28.8	Very low	36.7	Very low	141 Å²	141	127 Å²	127	87%	0.865	74%	0.744	S	S	*	*			trans	-76.9	104.2	164.8	44.2	0	0	0	0	109.1
223	V	30.2	Very low	36.1	Very low	129 Å²	129	131.2 Å²	131.2	78%	0.782	76%	0.758	S	S	*	*			trans	-94.8	120.3	161.9	175.8	0	0	0	0	108.5	P221	P221-V223 PolarHBondContact O-N 2.95Å
224	S	28.4	Very low	35.1	Very low	100 Å²	100	133 Å²	133	70%	0.699	77%	0.767	S	S	*	*			trans	-162.8	92.3	153.2	55	0	0	0	0	108.7
225	T	28.3	Very low	34.2	Very low	121 Å²	121	135.1 Å²	135.1	74%	0.742	78%	0.778	S	S	*	*				84.1	103.4	104.3	50.4	0	0	0	0	116.9
226	L	28.5	Very low	33.3	Very low	161 Å²	161	132.1 Å²	132.1	84%	0.843	78%	0.78	S	S	*	*			trans	49.5	119.3	136.5	-64.6	163	0	0	0	121.8
227	T	27.8	Very low	32.6	Very low	143 Å²	143	138.9 Å²	138.9	88%	0.877	80%	0.795	S	S	*	*				-175.3	155.9	107.5	28.9	0	0	0	0	111.4
228	P	42.2	Very low	32.1	Very low	121 Å²	121	135.6 Å²	135.6	79%	0.786	79%	0.793	S	S	*	*			trans	-109.7	140.6	-168.6	37.6	-26.3	0	0	0	114.4
229	S	29	Very low	31.5	Very low	124 Å²	124	135.9 Å²	135.9	87%	0.867	79%	0.794	S	S	*	*			trans	-164.4	134.5	148.7	55.2	0	0	0	0	111.8
230	S	28.9	Very low	31.2	Very low	112 Å²	112	131.7 Å²	131.7	78%	0.783	79%	0.79	S	S	*	*			trans	-80.1	-168.7	-177.8	53.8	0	0	0	0	113.5
231	P	44	Very low	31.4	Very low	125 Å²	125	135.3 Å²	135.3	81%	0.812	80%	0.801	S	S	*	*				-124.8	158.2	-68.6	35.7	-19.7	0	0	0	111.4
232	G	27.5	Very low	31.4	Very low	80 Å²	80	133.4 Å²	133.4	83%	0.825	80%	0.804	S	S	*	*			trans	-164.7	111.9	178.4	0	0	0	0	0	115.3
233	K	30.6	Very low	31.5	Very low	195 Å²	195	130.2 Å²	130.2	85%	0.848	80%	0.798	S	S	*	*			trans	-46.7	152.2	171.5	-63.9	165.6	173.9	175.4	0	113.6
234	L	29	Very low	31.8	Very low	146 Å²	146	134.4 Å²	134.4	76%	0.764	81%	0.806	S	S	*	*				175.2	125.1	115.9	-112.2	74.1	0	0	0	113.7
235	L	29.5	Very low	32.2	Very low	142 Å²	142	138.6 Å²	138.6	74%	0.743	81%	0.811	S	S	*	*			trans	71.8	102.7	132.9	-70.6	164.5	0	0	0	123.2
236	T	31.1	Very low	33	Very low	123 Å²	123	144 Å²	144	76%	0.755	84%	0.836	S	S	*	*				-11.1	138.6	128	43.1	0	0	0	0	120.9
237	R	31	Very low	33.2	Very low	245 Å²	245	143.2 Å²	143.2	93%	0.925	84%	0.836	S	S	*	*			trans	-172.5	113.8	134.8	-108	178	170.5	-168.4	-2.9	107.4
238	S	31.8	Very low	33.5	Very low	98 Å²	98	143.2 Å²	143.2	69%	0.685	83%	0.834	S	S	*	*				74.8	104.6	60.3	-178.5	0	0	0	0	115.8
239	L	31.8	Very low	33	Very low	161 Å²	161	144.4 Å²	144.4	84%	0.843	84%	0.836	S	S	*	*			trans	72.9	131.8	136.3	-75.6	162.9	0	0	0	122.5
240	A	33.8	Very low	33.3	Very low	89 Å²	89	145.6 Å²	145.6	74%	0.736	84%	0.835	S	S	*	*			trans	132.3	144.5	135.1	0	0	0	0	0	112.4
241	L	33.8	Very low	33.6	Very low	166 Å²	166	147.8 Å²	147.8	87%	0.869	84%	0.838	S	S	*	*			cis	174.8	145.4	-18.5	-122.8	144.9	0	0	0	105.2
242	G	32.5	Very low	32.9	Very low	80 Å²	80	149.3 Å²	149.3	83%	0.825	84%	0.84	S	S	*	*			trans	76.2	144	155.1	0	0	0	0	0	116.3
243	G	32.3	Very low	33.2	Very low	73 Å²	73	154.2 Å²	154.2	75%	0.753	84%	0.841	S	S	*	*			cis	172.9	128.5	6.2	0	0	0	0	0	104.6
244	K	36	Very low	33.4	Very low	217 Å²	217	151.1 Å²	151.1	94%	0.943	84%	0.84	S	S	*	*				113.8	113.4	100.3	-123.2	-175.5	-177.6	-175.7	0	109.9
245	K	36.4	Very low	33.8	Very low	188 Å²	188	151.5 Å²	151.5	82%	0.817	85%	0.846	S	S	*	*			trans	-76	139.1	154.1	-74.1	175.8	171.9	179.9	0	107.4
246	D	46	Very low	34.2	Very low	236 Å²	236	152.4 Å²	152.4	100%	1.262	86%	0.856	S	S	*	*				-162.9	0	100.5	-77.4	-28.1	0	0	0	109.2

Retrieved 246 of 246 residues in 68.8 ms (Link to these results)

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