A0A2K6QK45_RHIRO Loading...

small monomeric GTPase

AlphaFold DB , UniProt , Accession A0A2K6QK45, Species RHIRO (Rhinopithecus roxellana, Golden snub-nosed monkey), Gene RASL10A, Length 203 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	44.8	Very low	83	Confident	244 Å²	244	44.6 Å²	44.6	100%	1.202	26%	0.26	S	S	*	.				0	127.3	0	-72.5	172.3	170.2	0	0	107.5
2	G	58.8	Low	83.5	Confident	19 Å²	19	41.9 Å²	41.9	20%	0.196	25%	0.247	C	C	.	.			trans	-70.9	153.6	171.6	0	0	0	0	0	109.7	V52	G2-V52 WeakPolarHBondContact CA-O 3.43Å; G2-V52 PolarHBondContact N-O 2.99Å
3	G	78.3	Confident	83.9	Confident	49 Å²	49	46.1 Å²	46.1	51%	0.505	28%	0.276	S	S	.	.			trans	-64.1	176.9	-177.9	0	0	0	0	0	113.9	Y53	G3-Y53 WeakPolarHBondContact O-CD1 3.36Å
4	S	85.8	Confident	84.3	Confident	76 Å²	76	45.1 Å²	45.1	53%	0.531	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	143.6	171.6	-172.2	0	0	0	0	111.2	D54	S4-D54 CarbonylContact C-O 3.16Å; S4-D54 VanDerWaalsContact CA-O 3.25Å; S4-D54 WeakPolarHBondContact CA-O 3.48Å; S4-D54 PolarHBondContact OG-O 2.73Å
5	L	90.4	Very high	85	Confident	9 Å²	9	42.3 Å²	42.3	5%	0.047	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	123.6	176.8	-75	170.7	0	0	0	111.5	D54 L55 S56 D87 L175 A178 L179	L5-D54 PolarHBondContact N-O 3.45Å; L5-L55 HydrophobicContact CB-CD2 3.76Å; L5-L55 HydrophobicContact CD1-CD2 4.26Å; L5-L55 CarbonylContact O-C 3.54Å; L5-L55 WeakPolarHBondContact O-CA 3.28Å; L5-S56 PolarHBondContact O-N 3.34Å; L5-D87 HydrophobicContact CD2-CB 3.99Å; L5-L175 HydrophobicContact CD1-CD2 3.69Å; L5-A178 HydrophobicContact CD1-CB 4.41Å; L5-A178 HydrophobicContact CD2-CB 4Å; L5-L179 HydrophobicContact CD1-CD2 3.82Å; L5-L179 HydrophobicContact CD1-CG 4.03Å; L5-L179 HydrophobicContact CG-CD2 4.47Å
6	R	90.9	Very high	85.7	Confident	82 Å²	82	40.7 Å²	40.7	31%	0.309	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	116.8	178.2	-60.6	165.8	-64.3	169.3	10.6	109.3	S56 D85 D87 A88	R6-S56 CarbonylContact C-O 3.49Å; R6-S56 WeakPolarHBondContact CA-O 3.46Å; R6-D85 WeakPolarHBondContact CB-O 3.25Å; R6-D85 WeakPolarHBondContact CD-O 3.46Å; R6-D85 VanDerWaalsContact CZ-C 3.45Å; R6-D85 IonicContact CZ-OD1 3.46Å; R6-D85 PolarHBondContact NE-O 3.4Å; R6-D85 PolarHBondContact NH1-O 2.84Å; R6-D85 IonicContact NH1-OD1 2.7Å; R6-D85 PolarHBondContact NH1-OD1 2.74Å; R6-D85 IonicContact NH2-OD1 2.71Å; R6-D87 WeakPolarHBondContact CB-OD2 3.39Å; R6-D87 IonicContact CZ-OD1 2.73Å; R6-D87 IonicContact CZ-OD2 3.89Å; R6-D87 PolarHBondContact N-OD2 2.95Å; R6-D87 IonicContact NE-OD1 3.29Å; R6-D87 IonicContact NE-OD2 3.74Å; R6-D87 PolarHBondContact NE-OD2 2.88Å; R6-D87 VanDerWaalsContact NE-OD2 3.14Å; R6-D87 IonicContact NH2-OD1 3.4Å; R6-D87 PolarHBondContact NH2-OD1 3.04Å; R6-D87 IonicContact NH2-OD2 2.79Å; R6-D87 WeakPolarHBondContact O-CA 3.12Å; R6-D87 PolarHBondContact O-N 3.44Å; R6-A88 PolarHBondContact O-N 3.33Å
7	V	92.5	Very high	86.2	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.6	-178.7	176	0	0	0	0	109.4	V9 S56 I57 R58 A88 V90 L174	V7-V9 HydrophobicContact CG1-CG2 4.3Å; V7-S56 PolarHBondContact N-O 2.88Å; V7-I57 HydrophobicContact CB-CG1 4.48Å; V7-I57 WeakPolarHBondContact O-CA 3.15Å; V7-R58 PolarHBondContact O-N 2.98Å; V7-A88 WeakPolarHBondContact CA-O 3.1Å; V7-A88 HydrophobicContact CG2-CB 4.46Å; V7-V90 HydrophobicContact CG1-CG2 4.13Å; V7-L174 HydrophobicContact CB-CD2 4.38Å; V7-L174 HydrophobicContact CG1-CD2 3.53Å; V7-L174 HydrophobicContact CG2-CD2 3.89Å
8	A	92.1	Very high	86.6	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	130.3	169.1	0	0	0	0	0	110.6	L10 T86 A88 F89 V90	A8-L10 HydrophobicContact CB-CD1 4.39Å; A8-L10 HydrophobicContact CB-CD2 4.18Å; A8-L10 HydrophobicContact CB-CG 4.18Å; A8-T86 HydrophobicContact CB-CG2 3.76Å; A8-A88 PolarHBondContact N-O 3.4Å; A8-F89 HydrophobicContact CB-CD1 3.89Å; A8-F89 HydrophobicContact CB-CE1 4.07Å; A8-V90 PolarHBondContact O-N 3.17Å
9	V	94.1	Very high	87.1	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112	174.8	-174.1	0	0	0	0	108.7	V7 K17 I21 I57 R58 V90 V92	V7-V9 HydrophobicContact CG1-CG2 4.3Å; V9-K17 HydrophobicContact CG1-CB 3.98Å; V9-K17 HydrophobicContact CG1-CG 4.27Å; V9-I21 HydrophobicContact CB-CD1 3.93Å; V9-I21 HydrophobicContact CG1-CD1 4.24Å; V9-I21 HydrophobicContact CG2-CD1 3.85Å; V9-I21 HydrophobicContact CG2-CG1 4.08Å; V9-I57 HydrophobicContact CG2-CG2 3.86Å; V9-R58 PolarHBondContact N-O 2.78Å; V9-V90 WeakPolarHBondContact CA-O 3.17Å; V9-V90 HydrophobicContact CB-CB 4.47Å; V9-V90 HydrophobicContact CG1-CB 4.28Å; V9-V90 HydrophobicContact CG1-CG1 4.36Å; V9-V90 HydrophobicContact CG2-CB 4.19Å; V9-V90 HydrophobicContact CG2-CG2 4.4Å; V9-V92 HydrophobicContact CG1-CG2 3.77Å
10	L	92.5	Very high	87.6	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.042	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	160.5	-168	-49.8	175.3	0	0	0	110.8	A8 V62 L83 F89 V90 L91 V92 L107 I111	A8-L10 HydrophobicContact CB-CD1 4.39Å; A8-L10 HydrophobicContact CB-CD2 4.18Å; A8-L10 HydrophobicContact CB-CG 4.18Å; L10-V62 HydrophobicContact CB-CG2 4.35Å; L10-V62 HydrophobicContact CD1-CG2 3.75Å; L10-V62 HydrophobicContact CD2-CG2 3.66Å; L10-V62 HydrophobicContact CG-CG2 4.11Å; L10-L83 HydrophobicContact CD1-CD2 4.24Å; L10-F89 HydrophobicContact CD1-CD1 4.05Å; L10-V90 PolarHBondContact N-O 3.43Å; L10-L91 HydrophobicContact CB-CD2 3.93Å; L10-L91 HydrophobicContact CD1-CD2 4.14Å; L10-L91 HydrophobicContact CG-CD2 4.46Å; L10-L91 CarbonylContact O-C 3.59Å; L10-L91 WeakPolarHBondContact O-CA 3.2Å; L10-V92 PolarHBondContact O-N 3.44Å; L10-L107 HydrophobicContact CB-CD1 3.65Å; L10-I111 HydrophobicContact CD1-CD1 4.31Å
11	G	92.3	Very high	88	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.01	21%	0.211	C	C	.	.			trans	147.9	171.4	-178.6	0	0	0	0	0	111.4	K17 V92	G11-K17 PolarHBondContact O-NZ 2.84Å; G11-V92 WeakPolarHBondContact CA-O 3.18Å
12	A	89.8	Confident	90.4	Very high	12 Å²	12	25.7 Å²	25.7	10%	0.099	17%	0.168	C	C	.	.	S	Bend	trans	-59.6	160.1	-176.6	0	0	0	0	0	113.3	V15 K17 Y103	A12-V15 HydrophobicContact CB-CG1 3.81Å; A12-V15 WeakPolarHBondContact O-CG1 3.31Å; A12-V15 WeakPolarHBondContact O-CG2 3.45Å; A12-K17 PolarHBondContact O-NZ 3.26Å; A12-Y103 HydrophobicContact CB-CD1 4.35Å; A12-Y103 HydrophobicContact CB-CD2 3.67Å; A12-Y103 HydrophobicContact CB-CE2 4.26Å; A12-Y103 HydrophobicContact CB-CG 3.78Å
13	P	88.3	Confident	92.2	Very high	96 Å²	96	25.4 Å²	25.4	62%	0.623	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	143.3	169.9	-26.8	36	0	0	0	112	V15	P13-V15 PolarHBondContact O-N 3.08Å; P13-V15 VanDerWaalsContact O-N 3.13Å
14	G	90.3	Very high	93	Very high	32 Å²	32	23.6 Å²	23.6	33%	0.33	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	-0.9	175	0	0	0	0	0	116.9	G16 K130	G14-G16 PolarHBondContact O-N 3.49Å; G14-K130 WeakPolarHBondContact O-CE 3.49Å; G14-K130 PolarHBondContact O-NZ 3.34Å
15	V	94.6	Very high	93.5	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.018	12%	0.124	C	C	.	.	S	Bend	trans	-70.2	-17.8	176.7	-58	0	0	0	0	113.3	A12 P13 K17 V92 D94 N129	A12-V15 HydrophobicContact CB-CG1 3.81Å; A12-V15 WeakPolarHBondContact O-CG1 3.31Å; A12-V15 WeakPolarHBondContact O-CG2 3.45Å; P13-V15 PolarHBondContact O-N 3.08Å; P13-V15 VanDerWaalsContact O-N 3.13Å; V15-K17 HydrophobicContact CG2-CD 4.43Å; V15-K17 HydrophobicContact CG2-CG 3.7Å; V15-V92 HydrophobicContact CB-CG1 4.3Å; V15-V92 HydrophobicContact CG2-CB 3.96Å; V15-V92 HydrophobicContact CG2-CG1 3.81Å; V15-D94 HydrophobicContact CG1-CB 4.38Å; V15-N129 PolarHBondContact O-ND2 3.17Å
16	G	95	Very high	93.6	Very high	17 Å²	17	27.1 Å²	27.1	18%	0.175	15%	0.148	C	C	.	.			trans	100.6	29.5	175.2	0	0	0	0	0	115.7	G14 A19 I20	G14-G16 PolarHBondContact O-N 3.49Å; G16-A19 PolarHBondContact O-N 3Å; G16-I20 WeakPolarHBondContact O-CG1 3.33Å; G16-I20 PolarHBondContact O-N 3.13Å
17	K	94.9	Very high	93.8	Very high	10 Å²	10	25.6 Å²	25.6	4%	0.043	16%	0.157	C	C	.	.	H	α-helix	trans	-52.4	-59.8	174.1	-56.5	-178.2	-64.8	-86.1	0	112.1	V9 G11 A12 V15 A19 I20 I21 D61 V92	V9-K17 HydrophobicContact CG1-CB 3.98Å; V9-K17 HydrophobicContact CG1-CG 4.27Å; G11-K17 PolarHBondContact O-NZ 2.84Å; A12-K17 PolarHBondContact O-NZ 3.26Å; V15-K17 HydrophobicContact CG2-CD 4.43Å; V15-K17 HydrophobicContact CG2-CG 3.7Å; K17-A19 VanDerWaalsContact C-N 3.26Å; K17-A19 PolarHBondContact O-N 3.44Å; K17-I20 WeakPolarHBondContact O-CB 3.34Å; K17-I20 PolarHBondContact O-N 3.21Å; K17-I20 VanDerWaalsContact O-N 3.11Å; K17-I21 WeakPolarHBondContact O-CG1 3.49Å; K17-I21 PolarHBondContact O-N 3.29Å; K17-D61 VanDerWaalsContact CE-OD1 3.27Å; K17-D61 WeakPolarHBondContact CE-OD1 2.81Å; K17-D61 IonicContact NZ-OD1 3.87Å; K17-D61 PolarHBondContact NZ-OD1 2.86Å; K17-D61 IonicContact NZ-OD2 3.97Å; K17-V92 HydrophobicContact CG-CB 4.22Å; K17-V92 HydrophobicContact CG-CG2 4.34Å
18	T	93.9	Very high	93.6	Very high	30 Å²	30	28.4 Å²	28.4	18%	0.184	17%	0.172	C	C	.	.	H	α-helix	trans	-57.5	-38	177	-49.3	0	0	0	0	112.2	I21 R22 T36 D59	T18-I21 PolarHBondContact O-N 3.41Å; T18-R22 HydrophobicContact CG2-CG 4.25Å; T18-R22 WeakPolarHBondContact O-CB 3.4Å; T18-R22 VanDerWaalsContact O-CG 3.27Å; T18-R22 WeakPolarHBondContact O-CG 3.1Å; T18-R22 PolarHBondContact O-N 2.83Å; T18-T36 PolarHBondContact OG1-OG1 3.46Å; T18-D59 WeakPolarHBondContact CA-OD2 3.46Å; T18-D59 WeakPolarHBondContact CB-OD2 3.34Å; T18-D59 VanDerWaalsContact CG2-OD2 3.32Å; T18-D59 WeakPolarHBondContact CG2-OD2 3.49Å; T18-D59 VanDerWaalsContact OG1-CG 3.31Å; T18-D59 PolarHBondContact OG1-OD1 3.31Å; T18-D59 PolarHBondContact OG1-OD2 3.15Å
19	A	95.7	Very high	93.5	Very high	12 Å²	12	32.3 Å²	32.3	10%	0.099	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-41.3	177.7	0	0	0	0	0	112	G16 K17 Q23 Y29 A161	G16-A19 PolarHBondContact O-N 3Å; K17-A19 VanDerWaalsContact C-N 3.26Å; K17-A19 PolarHBondContact O-N 3.44Å; A19-Q23 WeakPolarHBondContact O-CB 3.46Å; A19-Q23 PolarHBondContact O-N 3.23Å; A19-Y29 HydrophobicContact CB-CD2 3.96Å; A19-Y29 HydrophobicContact CB-CE2 3.84Å; A19-A161 HydrophobicContact CB-CB 3.86Å
20	I	97.4	Very high	92.8	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-61.9	-45.1	174.5	-69.9	168.1	0	0	0	110.5	G16 K17 Q23 F24 V92 V127 N129 A161 V167 L170 F171	G16-I20 WeakPolarHBondContact O-CG1 3.33Å; G16-I20 PolarHBondContact O-N 3.13Å; K17-I20 WeakPolarHBondContact O-CB 3.34Å; K17-I20 PolarHBondContact O-N 3.21Å; K17-I20 VanDerWaalsContact O-N 3.11Å; I20-Q23 PolarHBondContact O-N 3.44Å; I20-F24 WeakPolarHBondContact O-CB 3.26Å; I20-F24 PolarHBondContact O-N 2.91Å; I20-V92 HydrophobicContact CD1-CG1 3.68Å; I20-V92 HydrophobicContact CD1-CG2 4.03Å; I20-V127 HydrophobicContact CD1-CG1 4.3Å; I20-N129 HydrophobicContact CD1-CB 4.07Å; I20-A161 HydrophobicContact CG1-CB 3.95Å; I20-V167 HydrophobicContact CG2-CG1 4.41Å; I20-L170 HydrophobicContact CG2-CD1 3.96Å; I20-F171 HydrophobicContact CG2-CE2 3.89Å; I20-F171 HydrophobicContact CG2-CZ 4.38Å
21	I	96.1	Very high	92	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-48.3	-178.9	-63.3	167.3	0	0	0	110.5	V9 K17 T18 Q23 F24 L25 Y42 I57 D59	V9-I21 HydrophobicContact CB-CD1 3.93Å; V9-I21 HydrophobicContact CG1-CD1 4.24Å; V9-I21 HydrophobicContact CG2-CD1 3.85Å; V9-I21 HydrophobicContact CG2-CG1 4.08Å; K17-I21 WeakPolarHBondContact O-CG1 3.49Å; K17-I21 PolarHBondContact O-N 3.29Å; T18-I21 PolarHBondContact O-N 3.41Å; I21-Q23 VanDerWaalsContact C-N 3.31Å; I21-Q23 PolarHBondContact O-N 2.98Å; I21-F24 WeakPolarHBondContact O-CB 3.44Å; I21-F24 PolarHBondContact O-N 3.45Å; I21-F24 VanDerWaalsContact O-N 3.16Å; I21-L25 HydrophobicContact CG2-CD1 3.69Å; I21-L25 HydrophobicContact CG2-CG 4.23Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.41Å; I21-L25 PolarHBondContact O-N 2.94Å; I21-Y42 HydrophobicContact CG2-CD2 3.63Å; I21-Y42 HydrophobicContact CG2-CE2 3.74Å; I21-Y42 HydrophobicContact CG2-CG 4.04Å; I21-I57 HydrophobicContact CD1-CG2 3.92Å; I21-I57 HydrophobicContact CG1-CG2 4.07Å; I21-I57 HydrophobicContact CG2-CG2 4.28Å; I21-D59 HydrophobicContact CD1-CB 3.44Å; I21-D59 VanDerWaalsContact CD1-CB 3.44Å
22	R	94.8	Very high	91.4	Very high	79 Å²	79	53 Å²	53	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-60.9	-41	176.5	-71.8	-179	70	82.4	3.5	112.2	T18 F24 L25 F26 G27 D28	T18-R22 HydrophobicContact CG2-CG 4.25Å; T18-R22 WeakPolarHBondContact O-CB 3.4Å; T18-R22 VanDerWaalsContact O-CG 3.27Å; T18-R22 WeakPolarHBondContact O-CG 3.1Å; T18-R22 PolarHBondContact O-N 2.83Å; R22-F24 VanDerWaalsContact C-N 3.27Å; R22-F24 PolarHBondContact O-N 3.14Å; R22-L25 PolarHBondContact O-N 3.42Å; R22-F26 HydrophobicContact CB-CD2 4.25Å; R22-F26 HydrophobicContact CG-CD2 4.31Å; R22-F26 WeakPolarHBondContact O-CA 3.45Å; R22-F26 WeakPolarHBondContact O-CB 3.46Å; R22-F26 PolarHBondContact O-N 2.94Å; R22-G27 PolarHBondContact O-N 3.46Å; R22-D28 CarbonylContact C-O 3.58Å; R22-D28 IonicContact CZ-OD2 3.74Å; R22-D28 IonicContact NE-OD2 2.94Å; R22-D28 PolarHBondContact NE-OD2 3.47Å; R22-D28 IonicContact NH2-OD2 2.57Å; R22-D28 PolarHBondContact NH2-OD2 2.84Å
23	Q	96.3	Very high	90.8	Very high	14 Å²	14	58.8 Å²	58.8	7%	0.065	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-37.7	177.3	-168.6	65.1	45	0	0	111.4	A19 I20 I21 G27 D28 A161 N164 V167	A19-Q23 WeakPolarHBondContact O-CB 3.46Å; A19-Q23 PolarHBondContact O-N 3.23Å; I20-Q23 PolarHBondContact O-N 3.44Å; I21-Q23 VanDerWaalsContact C-N 3.31Å; I21-Q23 PolarHBondContact O-N 2.98Å; Q23-G27 VanDerWaalsContact NE2-C 3.26Å; Q23-G27 PolarHBondContact NE2-O 3.48Å; Q23-G27 WeakPolarHBondContact O-CA 3.23Å; Q23-G27 PolarHBondContact O-N 2.89Å; Q23-D28 WeakPolarHBondContact CA-O 3.38Å; Q23-D28 PolarHBondContact N-O 3.19Å; Q23-D28 PolarHBondContact OE1-O 3.46Å; Q23-A161 WeakPolarHBondContact CG-O 3.28Å; Q23-A161 PolarHBondContact OE1-O 3.24Å; Q23-N164 HydrophobicContact CG-CB 3.91Å; Q23-N164 WeakPolarHBondContact CG-OD1 3.28Å; Q23-N164 VanDerWaalsContact NE2-CB 3.32Å; Q23-N164 VanDerWaalsContact NE2-CG 3.25Å; Q23-N164 PolarHBondContact NE2-ND2 2.97Å; Q23-V167 HydrophobicContact CB-CG1 4.19Å; Q23-V167 HydrophobicContact CB-CG2 4.34Å; Q23-V167 HydrophobicContact CG-CB 4.37Å; Q23-V167 HydrophobicContact CG-CG1 4.28Å; Q23-V167 HydrophobicContact CG-CG2 3.97Å
24	F	96.2	Very high	90.2	Very high	11 Å²	11	64.1 Å²	64.1	5%	0.048	31%	0.311	C	S	.	.	H	α-helix	trans	-67.4	-47.5	175.2	176.1	-119.2	0	0	0	112.1	I20 I21 R22 V46 L55 I57 V167 L168 F171 L202	I20-F24 WeakPolarHBondContact O-CB 3.26Å; I20-F24 PolarHBondContact O-N 2.91Å; I21-F24 WeakPolarHBondContact O-CB 3.44Å; I21-F24 PolarHBondContact O-N 3.45Å; I21-F24 VanDerWaalsContact O-N 3.16Å; R22-F24 VanDerWaalsContact C-N 3.27Å; R22-F24 PolarHBondContact O-N 3.14Å; F24-V46 HydrophobicContact CE1-CG1 4.45Å; F24-V46 HydrophobicContact CZ-CG1 4.03Å; F24-L55 HydrophobicContact CE1-CD1 4.41Å; F24-I57 HydrophobicContact CD1-CD1 4.07Å; F24-I57 HydrophobicContact CE1-CD1 3.97Å; F24-V167 HydrophobicContact CB-CG1 3.75Å; F24-L168 HydrophobicContact CD2-CD1 4.49Å; F24-L168 HydrophobicContact CE2-CD1 4.01Å; F24-F171 HydrophobicContact CB-CD2 3.74Å; F24-F171 HydrophobicContact CB-CE2 3.44Å; F24-F171 VanDerWaalsContact CB-CE2 3.44Å; F24-F171 HydrophobicContact CB-CZ 4.2Å; F24-F171 HydrophobicContact CD1-CD1 4.07Å; F24-F171 AromaticContact CD1-CD2 3.76Å; F24-F171 HydrophobicContact CD1-CD2 3.76Å; F24-F171 HydrophobicContact CD1-CE1 4.06Å; F24-F171 AromaticContact CD1-CE2 3.76Å; F24-F171 HydrophobicContact CD1-CE2 3.76Å; F24-F171 AromaticContact CD1-CG 3.93Å; F24-F171 HydrophobicContact CD1-CG 3.93Å; F24-F171 AromaticContact CD1-CZ 3.9Å; F24-F171 HydrophobicContact CD1-CZ 3.9Å; F24-F171 HydrophobicContact CD2-CB 4.08Å; F24-F171 AromaticContact CD2-CD2 3.46Å; F24-F171 HydrophobicContact CD2-CD2 3.46Å; F24-F171 VanDerWaalsContact CD2-CD2 3.46Å; F24-F171 HydrophobicContact CD2-CE2 4.09Å; F24-F171 AromaticContact CD2-CG 3.86Å; F24-F171 HydrophobicContact CD2-CG 3.86Å; F24-F171 HydrophobicContact CE1-CB 4.36Å; F24-F171 AromaticContact CE1-CD1 3.93Å; F24-F171 HydrophobicContact CE1-CD1 3.93Å; F24-F171 HydrophobicContact CE1-CD2 4.21Å; F24-F171 HydrophobicContact CE1-CE1 4.26Å; F24-F171 AromaticContact CE1-CG 3.9Å; F24-F171 HydrophobicContact CE1-CG 3.9Å; F24-F171 HydrophobicContact CE2-CB 3.65Å; F24-F171 AromaticContact CE2-CD2 3.94Å; F24-F171 HydrophobicContact CE2-CD2 3.94Å; F24-F171 AromaticContact CE2-CG 3.83Å; F24-F171 HydrophobicContact CE2-CG 3.83Å; F24-F171 HydrophobicContact CG-CD1 4.48Å; F24-F171 AromaticContact CG-CD2 3.36Å; F24-F171 HydrophobicContact CG-CD2 3.36Å; F24-F171 AromaticContact CG-CE2 3.49Å; F24-F171 HydrophobicContact CG-CE2 3.49Å; F24-F171 VanDerWaalsContact CG-CE2 3.49Å; F24-F171 AromaticContact CG-CG 3.91Å; F24-F171 HydrophobicContact CG-CG 3.91Å; F24-F171 HydrophobicContact CG-CZ 4.12Å; F24-F171 HydrophobicContact CZ-CB 3.8Å; F24-F171 HydrophobicContact CZ-CD1 4.22Å; F24-F171 HydrophobicContact CZ-CD2 4.27Å; F24-F171 AromaticContact CZ-CG 3.84Å; F24-F171 HydrophobicContact CZ-CG 3.84Å; F24-L202 HydrophobicContact CD2-CD1 4.23Å; F24-L202 HydrophobicContact CE1-CD2 4.26Å; F24-L202 HydrophobicContact CE2-CD1 4.12Å; F24-L202 HydrophobicContact CE2-CD2 3.93Å; F24-L202 HydrophobicContact CE2-CG 4.38Å; F24-L202 HydrophobicContact CZ-CD2 3.71Å; F24-L202 WeakPolarHBondContact O-CD1 3.16Å
25	L	95.3	Very high	89.6	Confident	36 Å²	36	67.1 Å²	67.1	19%	0.188	33%	0.325	C	S	.	.	H	α-helix	trans	-82.1	-36.1	-171.9	-61	179.8	0	0	0	114	I21 R22 Y42 P44 I57	I21-L25 HydrophobicContact CG2-CD1 3.69Å; I21-L25 HydrophobicContact CG2-CG 4.23Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.41Å; I21-L25 PolarHBondContact O-N 2.94Å; R22-L25 PolarHBondContact O-N 3.42Å; L25-Y42 HydrophobicContact CD1-CD1 3.41Å; L25-Y42 VanDerWaalsContact CD1-CD1 3.41Å; L25-Y42 HydrophobicContact CD1-CD2 4.46Å; L25-Y42 HydrophobicContact CD1-CE1 4.2Å; L25-Y42 HydrophobicContact CD1-CG 3.57Å; L25-P44 HydrophobicContact CD2-CB 3.72Å; L25-P44 HydrophobicContact CD2-CG 3.58Å; L25-I57 HydrophobicContact CD2-CD1 4.27Å
26	F	93.7	Very high	88.6	Confident	123 Å²	123	69.1 Å²	69.1	54%	0.539	34%	0.337	S	S	.	.	H	α-helix	trans	-125.1	-3.5	-166.8	-48.5	-59.6	0	0	0	112.9	R22 D28 Y42	R22-F26 HydrophobicContact CB-CD2 4.25Å; R22-F26 HydrophobicContact CG-CD2 4.31Å; R22-F26 WeakPolarHBondContact O-CA 3.45Å; R22-F26 WeakPolarHBondContact O-CB 3.46Å; R22-F26 PolarHBondContact O-N 2.94Å; F26-D28 HydrophobicContact CB-CB 4.22Å; F26-D28 PolarHBondContact O-N 3.22Å; F26-Y42 HydrophobicContact CE2-CD1 4.46Å; F26-Y42 HydrophobicContact CE2-CE1 4.15Å; F26-Y42 HydrophobicContact CZ-CD1 4.41Å; F26-Y42 HydrophobicContact CZ-CE1 4.43Å
27	G	93.3	Very high	87.4	Confident	49 Å²	49	74.7 Å²	74.7	51%	0.505	36%	0.363	S	S	.	.	S	Bend	trans	65.4	14.7	-173.8	0	0	0	0	0	113.9	R22 Q23	R22-G27 PolarHBondContact O-N 3.46Å; Q23-G27 VanDerWaalsContact NE2-C 3.26Å; Q23-G27 PolarHBondContact NE2-O 3.48Å; Q23-G27 WeakPolarHBondContact O-CA 3.23Å; Q23-G27 PolarHBondContact O-N 2.89Å
28	D	89.4	Confident	86.1	Confident	61 Å²	61	76 Å²	76	33%	0.326	38%	0.38	S	S	.	.			trans	-110.5	140.3	-171.3	172.7	42.8	0	0	0	112.6	R22 Q23 F26	R22-D28 CarbonylContact C-O 3.58Å; R22-D28 IonicContact CZ-OD2 3.74Å; R22-D28 IonicContact NE-OD2 2.94Å; R22-D28 PolarHBondContact NE-OD2 3.47Å; R22-D28 IonicContact NH2-OD2 2.57Å; R22-D28 PolarHBondContact NH2-OD2 2.84Å; Q23-D28 WeakPolarHBondContact CA-O 3.38Å; Q23-D28 PolarHBondContact N-O 3.19Å; Q23-D28 PolarHBondContact OE1-O 3.46Å; F26-D28 HydrophobicContact CB-CB 4.22Å; F26-D28 PolarHBondContact O-N 3.22Å
29	Y	89.7	Confident	85	Confident	83 Å²	83	80 Å²	80	33%	0.325	41%	0.405	S	S	.	.			trans	-123.5	114.4	171.5	179.3	-91.6	0	0	0	109.6	A19 E31 A161 K162	A19-Y29 HydrophobicContact CB-CD2 3.96Å; A19-Y29 HydrophobicContact CB-CE2 3.84Å; Y29-E31 PolarHBondContact O-N 3.16Å; Y29-A161 HydrophobicContact CD2-CB 4.01Å; Y29-A161 HydrophobicContact CE2-CB 4.12Å; Y29-K162 HydrophobicContact CD1-CB 4.48Å; Y29-K162 HydrophobicContact CD1-CG 4.3Å; Y29-K162 HydrophobicContact CD2-CB 4.26Å; Y29-K162 HydrophobicContact CE1-CB 4.27Å; Y29-K162 HydrophobicContact CE1-CG 4.12Å; Y29-K162 HydrophobicContact CE2-CB 4.01Å; Y29-K162 HydrophobicContact CG-CB 4.49Å
30	P	79.8	Confident	84.5	Confident	48 Å²	48	84.3 Å²	84.3	31%	0.312	42%	0.419	S	S	.	.			trans	-69.6	122	178.3	27.1	-32.2	0	0	0	110.6	R32	P30-R32 VanDerWaalsContact C-N 3.27Å; P30-R32 PolarHBondContact O-N 3.44Å
31	E	75.4	Confident	84.1	Confident	186 Å²	186	87.4 Å²	87.4	87%	0.869	44%	0.435	S	S	*	.	S	Bend	trans	-62.4	-33.9	179.5	-68	-169	159.5	0	0	113	Y29	Y29-E31 PolarHBondContact O-N 3.16Å
32	R	78.9	Confident	84	Confident	211 Å²	211	89 Å²	89	80%	0.796	44%	0.442	S	S	*	.	S	Bend	trans	-100.5	122.8	176.4	-63.5	-174.2	-176.2	-165.5	1.7	109.9	P30 R34	P30-R32 VanDerWaalsContact C-N 3.27Å; P30-R32 PolarHBondContact O-N 3.44Å; R32-R34 PolarHBondContact O-N 2.89Å
33	H	76.8	Confident	83.9	Confident	133 Å²	133	94.1 Å²	94.1	62%	0.616	46%	0.461	S	S	*	.			trans	-65.9	121.5	171.3	-177.3	53.9	0	0	0	109.4
34	R	76.1	Confident	83.8	Confident	207 Å²	207	94.8 Å²	94.8	78%	0.781	47%	0.466	S	S	*	.			trans	-110.8	131.6	162.6	-68.1	-172.4	177.6	178.8	-0.1	107.4	R32	R32-R34 PolarHBondContact O-N 2.89Å
35	P	78.3	Confident	83.7	Confident	96 Å²	96	96 Å²	96	62%	0.623	48%	0.478	S	S	*	.			trans	-51	146.5	168.4	-26	35.3	0	0	0	110.3	D37	P35-D37 PolarHBondContact O-N 2.88Å
36	T	73.8	Confident	83.4	Confident	45 Å²	45	94.4 Å²	94.4	28%	0.276	47%	0.47	S	S	.	.			trans	-75.5	113.6	178.8	-47.7	0	0	0	0	108.1	T18 G38 R40	T18-T36 PolarHBondContact OG1-OG1 3.46Å; T36-G38 WeakPolarHBondContact CG2-O 3.26Å; T36-G38 PolarHBondContact O-N 2.87Å; T36-R40 HydrophobicContact CG2-CG 4.24Å
37	D	69.8	Low	83.2	Confident	133 Å²	133	90.5 Å²	90.5	71%	0.711	46%	0.455	S	S	*	.			trans	-67.8	76.5	176.3	-53.9	-45.2	0	0	0	111.2	P35 R40	P35-D37 PolarHBondContact O-N 2.88Å; D37-R40 IonicContact OD2-NH2 3.67Å
38	G	66.8	Low	82.9	Confident	39 Å²	39	88.2 Å²	88.2	40%	0.402	43%	0.431	S	S	.	.	S	Bend	trans	77.4	177.7	-179.8	0	0	0	0	0	115.2	T36 R40	T36-G38 WeakPolarHBondContact CG2-O 3.26Å; T36-G38 PolarHBondContact O-N 2.87Å; G38-R40 PolarHBondContact O-N 2.86Å
39	P	72.4	Confident	82.8	Confident	112 Å²	112	89.8 Å²	89.8	73%	0.727	44%	0.44	S	S	*	.			trans	-65.9	132.9	179.6	25.9	-32.6	0	0	0	111.3	D59	P39-D59 CarbonylContact C-O 3.55Å; P39-D59 WeakPolarHBondContact CA-O 3.4Å
40	R	84.6	Confident	82.5	Confident	103 Å²	103	89.1 Å²	89.1	39%	0.389	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	146.5	177	-61.9	178.5	-177.4	-93	-1.5	110.6	T36 D37 G38 Y42 D59	T36-R40 HydrophobicContact CG2-CG 4.24Å; D37-R40 IonicContact OD2-NH2 3.67Å; G38-R40 PolarHBondContact O-N 2.86Å; R40-Y42 HydrophobicContact CB-CE2 3.88Å; R40-D59 HydrophobicContact CB-CB 4.22Å; R40-D59 PolarHBondContact N-O 3.12Å; R40-D59 PolarHBondContact O-N 3.42Å
41	L	89.6	Confident	82.9	Confident	66 Å²	66	88.3 Å²	88.3	35%	0.346	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	118	178.8	-170.7	58.8	0	0	0	110	S56 R58	L41-S56 WeakPolarHBondContact CD1-OG 3.34Å; L41-R58 HydrophobicContact CD1-CB 4.13Å
42	Y	92.3	Very high	83.5	Confident	34 Å²	34	82.2 Å²	82.2	13%	0.133	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	138.4	177.3	-57.2	-91.4	0	0	0	109.6	I21 L25 F26 R40 S56 I57 D59	I21-Y42 HydrophobicContact CG2-CD2 3.63Å; I21-Y42 HydrophobicContact CG2-CE2 3.74Å; I21-Y42 HydrophobicContact CG2-CG 4.04Å; L25-Y42 HydrophobicContact CD1-CD1 3.41Å; L25-Y42 VanDerWaalsContact CD1-CD1 3.41Å; L25-Y42 HydrophobicContact CD1-CD2 4.46Å; L25-Y42 HydrophobicContact CD1-CE1 4.2Å; L25-Y42 HydrophobicContact CD1-CG 3.57Å; F26-Y42 HydrophobicContact CE2-CD1 4.46Å; F26-Y42 HydrophobicContact CE2-CE1 4.15Å; F26-Y42 HydrophobicContact CZ-CD1 4.41Å; F26-Y42 HydrophobicContact CZ-CE1 4.43Å; R40-Y42 HydrophobicContact CB-CE2 3.88Å; Y42-S56 CarbonylContact O-C 3.42Å; Y42-S56 WeakPolarHBondContact O-CA 3.45Å; Y42-I57 PolarHBondContact N-O 2.73Å; Y42-I57 PolarHBondContact O-N 3.47Å; Y42-D59 HydrophobicContact CD2-CB 4.34Å; Y42-D59 HydrophobicContact CE2-CB 3.76Å
43	R	94.5	Very high	84	Confident	187 Å²	187	74.1 Å²	74.1	71%	0.706	40%	0.4	S	S	*	.			trans	-127.2	68.6	-177.9	-65.4	-174.5	177.3	92.4	-11.2	112.8	L55	R43-L55 CarbonylContact C-O 3.51Å; R43-L55 VanDerWaalsContact CA-O 3.25Å; R43-L55 WeakPolarHBondContact CA-O 3.32Å
44	P	94.1	Very high	84.8	Confident	27 Å²	27	72.3 Å²	72.3	18%	0.175	40%	0.395	C	S	.	.			trans	-81.5	160	175.9	37.8	-38.7	0	0	0	111.5	L25 L55 I57	L25-P44 HydrophobicContact CD2-CB 3.72Å; L25-P44 HydrophobicContact CD2-CG 3.58Å; P44-L55 WeakPolarHBondContact CD-O 3.11Å; P44-L55 HydrophobicContact CG-CB 3.97Å; P44-L55 HydrophobicContact CG-CD1 4.39Å; P44-L55 PolarHBondContact O-N 2.87Å; P44-I57 HydrophobicContact CG-CD1 4.08Å
45	A	92.2	Very high	85.6	Confident	36 Å²	36	62.6 Å²	62.6	30%	0.298	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	144.6	160.5	0	0	0	0	0	109.5	V52 Y53	A45-V52 HydrophobicContact CB-CG1 4.12Å; A45-Y53 CarbonylContact C-O 3.59Å; A45-Y53 WeakPolarHBondContact CA-O 3.35Å
46	V	90.4	Very high	86.3	Confident	3 Å²	3	59 Å²	59	2%	0.018	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.7	179.6	-57.4	0	0	0	0	111.9	F24 V52 Y53 L55 L175 L202	F24-V46 HydrophobicContact CE1-CG1 4.45Å; F24-V46 HydrophobicContact CZ-CG1 4.03Å; V46-V52 CarbonylContact O-C 3.58Å; V46-V52 WeakPolarHBondContact O-CA 3.36Å; V46-Y53 PolarHBondContact N-O 3.44Å; V46-Y53 PolarHBondContact O-N 2.99Å; V46-L55 HydrophobicContact CB-CD1 4.25Å; V46-L55 HydrophobicContact CG1-CD1 3.4Å; V46-L55 HydrophobicContact CG1-CG 3.93Å; V46-L55 HydrophobicContact CG2-CD1 3.77Å; V46-L55 HydrophobicContact CG2-CD2 4.01Å; V46-L55 HydrophobicContact CG2-CG 3.77Å; V46-L175 HydrophobicContact CG2-CD1 3.88Å; V46-L202 HydrophobicContact CG1-CD2 3.86Å
47	L	88.9	Confident	87.3	Confident	41 Å²	41	56.8 Å²	56.8	22%	0.215	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	113.4	171	-175.6	67.8	0	0	0	109.8	V52 C200 S201	L47-V52 HydrophobicContact CD1-CG2 4.01Å; L47-C200 PolarHBondContact O-SG 3.42Å; L47-S201 WeakPolarHBondContact CB-O 3.3Å; L47-S201 PolarHBondContact N-O 2.91Å
48	L	87.1	Confident	88.3	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.3	177.3	-179.1	62.6	0	0	0	110.3	G50 A51 Y53 R172 L175 R176 L179	L48-G50 PolarHBondContact O-N 3.09Å; L48-G50 VanDerWaalsContact O-N 3.13Å; L48-A51 PolarHBondContact N-O 3.12Å; L48-A51 PolarHBondContact O-N 3.17Å; L48-Y53 HydrophobicContact CB-CD2 4.02Å; L48-Y53 HydrophobicContact CB-CE2 4.01Å; L48-R172 HydrophobicContact CD1-CG 3.85Å; L48-L175 HydrophobicContact CD2-CB 3.55Å; L48-L175 HydrophobicContact CD2-CD1 4.34Å; L48-R176 HydrophobicContact CD1-CG 4.36Å; L48-R176 HydrophobicContact CD2-CG 4.28Å; L48-L179 HydrophobicContact CD2-CD1 3.62Å
49	D	86.4	Confident	89.3	Confident	95 Å²	95	52 Å²	52	51%	0.508	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	39.3	176.9	-56.9	-32.7	0	0	0	112.6	R176	D49-R176 IonicContact OD1-CZ 3.75Å; D49-R176 IonicContact OD1-NE 3.79Å; D49-R176 IonicContact OD1-NH2 2.84Å; D49-R176 PolarHBondContact OD1-NH2 2.96Å; D49-R176 IonicContact OD2-CZ 3.92Å; D49-R176 IonicContact OD2-NE 3.26Å; D49-R176 PolarHBondContact OD2-NE 3.28Å; D49-R176 IonicContact OD2-NH2 3.69Å
50	G	84.6	Confident	89.1	Confident	69 Å²	69	47.2 Å²	47.2	71%	0.711	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	-4.3	178	0	0	0	0	0	115.7	L48	L48-G50 PolarHBondContact O-N 3.09Å; L48-G50 VanDerWaalsContact O-N 3.13Å
51	A	87.4	Confident	88	Confident	31 Å²	31	45.4 Å²	45.4	26%	0.256	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.5	178.1	0	0	0	0	0	112	L48 Y53	L48-A51 PolarHBondContact N-O 3.12Å; L48-A51 PolarHBondContact O-N 3.17Å; A51-Y53 HydrophobicContact CB-CD2 4.42Å; A51-Y53 HydrophobicContact CB-CE2 3.6Å; A51-Y53 WeakPolarHBondContact O-CD2 3.29Å; A51-Y53 WeakPolarHBondContact O-CE2 3.08Å
52	V	89.4	Confident	86.3	Confident	57 Å²	57	43.1 Å²	43.1	35%	0.345	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130.5	175.2	-179.1	0	0	0	0	109.4	G2 A45 V46 L47 M203	G2-V52 WeakPolarHBondContact CA-O 3.43Å; G2-V52 PolarHBondContact N-O 2.99Å; A45-V52 HydrophobicContact CB-CG1 4.12Å; V46-V52 CarbonylContact O-C 3.58Å; V46-V52 WeakPolarHBondContact O-CA 3.36Å; L47-V52 HydrophobicContact CD1-CG2 4.01Å; V52-M203 HydrophobicContact CG2-CE 3.76Å
53	Y	89.5	Confident	84.1	Confident	41 Å²	41	42.3 Å²	42.3	16%	0.161	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.2	177.8	-62.7	-89.7	0	0	0	110.5	G3 A45 V46 L48 A51 L179	G3-Y53 WeakPolarHBondContact O-CD1 3.36Å; A45-Y53 CarbonylContact C-O 3.59Å; A45-Y53 WeakPolarHBondContact CA-O 3.35Å; V46-Y53 PolarHBondContact N-O 3.44Å; V46-Y53 PolarHBondContact O-N 2.99Å; L48-Y53 HydrophobicContact CB-CD2 4.02Å; L48-Y53 HydrophobicContact CB-CE2 4.01Å; A51-Y53 HydrophobicContact CB-CD2 4.42Å; A51-Y53 HydrophobicContact CB-CE2 3.6Å; A51-Y53 WeakPolarHBondContact O-CD2 3.29Å; A51-Y53 WeakPolarHBondContact O-CE2 3.08Å; Y53-L179 HydrophobicContact CD1-CD1 4.46Å; Y53-L179 HydrophobicContact CD1-CD2 3.91Å; Y53-L179 HydrophobicContact CD2-CD1 4.46Å; Y53-L179 HydrophobicContact CE1-CD1 3.86Å; Y53-L179 HydrophobicContact CE1-CD2 3.37Å; Y53-L179 HydrophobicContact CE1-CG 4.27Å; Y53-L179 HydrophobicContact CE2-CD1 3.83Å; Y53-L179 VanDerWaalsContact CZ-CD1 3.5Å
54	D	92.3	Very high	81.5	Confident	95 Å²	95	35 Å²	35	51%	0.508	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.8	170.7	-66.3	-36.8	0	0	0	109.4	S4 L5	S4-D54 CarbonylContact C-O 3.16Å; S4-D54 VanDerWaalsContact CA-O 3.25Å; S4-D54 WeakPolarHBondContact CA-O 3.48Å; S4-D54 PolarHBondContact OG-O 2.73Å; L5-D54 PolarHBondContact N-O 3.45Å
55	L	93.3	Very high	78.7	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	147.9	174.3	-53.9	-175.2	0	0	0	110.9	L5 F24 R43 P44 V46 I57 L175	L5-L55 HydrophobicContact CB-CD2 3.76Å; L5-L55 HydrophobicContact CD1-CD2 4.26Å; L5-L55 CarbonylContact O-C 3.54Å; L5-L55 WeakPolarHBondContact O-CA 3.28Å; F24-L55 HydrophobicContact CE1-CD1 4.41Å; R43-L55 CarbonylContact C-O 3.51Å; R43-L55 VanDerWaalsContact CA-O 3.25Å; R43-L55 WeakPolarHBondContact CA-O 3.32Å; P44-L55 WeakPolarHBondContact CD-O 3.11Å; P44-L55 HydrophobicContact CG-CB 3.97Å; P44-L55 HydrophobicContact CG-CD1 4.39Å; P44-L55 PolarHBondContact O-N 2.87Å; V46-L55 HydrophobicContact CB-CD1 4.25Å; V46-L55 HydrophobicContact CG1-CD1 3.4Å; V46-L55 HydrophobicContact CG1-CG 3.93Å; V46-L55 HydrophobicContact CG2-CD1 3.77Å; V46-L55 HydrophobicContact CG2-CD2 4.01Å; V46-L55 HydrophobicContact CG2-CG 3.77Å; L55-I57 HydrophobicContact CB-CG1 4.29Å; L55-I57 HydrophobicContact CD1-CD1 4.43Å; L55-L175 HydrophobicContact CD1-CD1 4.04Å; L55-L175 HydrophobicContact CD1-CD2 4.13Å; L55-L175 HydrophobicContact CD2-CD1 4.34Å; L55-L175 HydrophobicContact CD2-CD2 3.42Å; L55-L175 VanDerWaalsContact CD2-CD2 3.42Å; L55-L175 HydrophobicContact CG-CD2 4.44Å
56	S	93.2	Very high	76.4	Confident	19 Å²	19	42.2 Å²	42.2	13%	0.133	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	100.1	168.1	-175.8	0	0	0	0	107.7	L5 R6 V7 L41 Y42	L5-S56 PolarHBondContact O-N 3.34Å; R6-S56 CarbonylContact C-O 3.49Å; R6-S56 WeakPolarHBondContact CA-O 3.46Å; V7-S56 PolarHBondContact N-O 2.88Å; L41-S56 WeakPolarHBondContact CD1-OG 3.34Å; Y42-S56 CarbonylContact O-C 3.42Å; Y42-S56 WeakPolarHBondContact O-CA 3.45Å
57	I	93.8	Very high	74.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	112.2	-176.6	-54.4	172.3	0	0	0	108.6	V7 V9 I21 F24 L25 Y42 P44 L55 F171	V7-I57 HydrophobicContact CB-CG1 4.48Å; V7-I57 WeakPolarHBondContact O-CA 3.15Å; V9-I57 HydrophobicContact CG2-CG2 3.86Å; I21-I57 HydrophobicContact CD1-CG2 3.92Å; I21-I57 HydrophobicContact CG1-CG2 4.07Å; I21-I57 HydrophobicContact CG2-CG2 4.28Å; F24-I57 HydrophobicContact CD1-CD1 4.07Å; F24-I57 HydrophobicContact CE1-CD1 3.97Å; L25-I57 HydrophobicContact CD2-CD1 4.27Å; Y42-I57 PolarHBondContact N-O 2.73Å; Y42-I57 PolarHBondContact O-N 3.47Å; P44-I57 HydrophobicContact CG-CD1 4.08Å; L55-I57 HydrophobicContact CB-CG1 4.29Å; L55-I57 HydrophobicContact CD1-CD1 4.43Å; I57-F171 HydrophobicContact CD1-CE1 3.88Å; I57-F171 HydrophobicContact CD1-CZ 4.45Å
58	R	91.6	Very high	71.8	Confident	72 Å²	72	45.5 Å²	45.5	27%	0.272	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.7	174.1	-173.4	176.2	-70.5	114.3	-5.9	110	V7 V9 L41 S82	V7-R58 PolarHBondContact O-N 2.98Å; V9-R58 PolarHBondContact N-O 2.78Å; L41-R58 HydrophobicContact CD1-CB 4.13Å; R58-S82 PolarHBondContact NE-OG 3.48Å; R58-S82 PolarHBondContact NH1-OG 3.29Å; R58-S82 PolarHBondContact NH2-OG 3.37Å
59	D	87.4	Confident	69.7	Low	0 Å²	0	48.2 Å²	48.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	106.7	170.6	-173.7	16.9	0	0	0	108.4	T18 I21 P39 R40 Y42	T18-D59 WeakPolarHBondContact CA-OD2 3.46Å; T18-D59 WeakPolarHBondContact CB-OD2 3.34Å; T18-D59 VanDerWaalsContact CG2-OD2 3.32Å; T18-D59 WeakPolarHBondContact CG2-OD2 3.49Å; T18-D59 VanDerWaalsContact OG1-CG 3.31Å; T18-D59 PolarHBondContact OG1-OD1 3.31Å; T18-D59 PolarHBondContact OG1-OD2 3.15Å; I21-D59 HydrophobicContact CD1-CB 3.44Å; I21-D59 VanDerWaalsContact CD1-CB 3.44Å; P39-D59 CarbonylContact C-O 3.55Å; P39-D59 WeakPolarHBondContact CA-O 3.4Å; R40-D59 HydrophobicContact CB-CB 4.22Å; R40-D59 PolarHBondContact N-O 3.12Å; R40-D59 PolarHBondContact O-N 3.42Å; Y42-D59 HydrophobicContact CD2-CB 4.34Å; Y42-D59 HydrophobicContact CE2-CB 3.76Å
60	G	68.3	Low	67.8	Low	10 Å²	10	47.1 Å²	47.1	10%	0.103	33%	0.334	C	S	.	.			trans	-168.1	153.1	-178.9	0	0	0	0	0	112
61	D	61.5	Low	65.8	Low	65 Å²	65	45.8 Å²	45.8	35%	0.348	32%	0.32	S	S	.	.			trans	-78.2	140.7	166.3	-74.9	-43.3	0	0	0	109.4	K17 A63	K17-D61 VanDerWaalsContact CE-OD1 3.27Å; K17-D61 WeakPolarHBondContact CE-OD1 2.81Å; K17-D61 IonicContact NZ-OD1 3.87Å; K17-D61 PolarHBondContact NZ-OD1 2.86Å; K17-D61 IonicContact NZ-OD2 3.97Å; D61-A63 HydrophobicContact CB-CB 4.41Å; D61-A63 WeakPolarHBondContact CB-O 3.49Å; D61-A63 PolarHBondContact O-N 3.29Å
62	V	53.2	Low	63.6	Low	19 Å²	19	51 Å²	51	12%	0.115	35%	0.351	C	S	.	.	S	Bend	trans	-70.7	-11.7	167.3	-179.3	0	0	0	0	110.8	L10 W75 P76 L107	L10-V62 HydrophobicContact CB-CG2 4.35Å; L10-V62 HydrophobicContact CD1-CG2 3.75Å; L10-V62 HydrophobicContact CD2-CG2 3.66Å; L10-V62 HydrophobicContact CG-CG2 4.11Å; V62-W75 HydrophobicContact CB-CZ3 4.32Å; V62-W75 HydrophobicContact CG1-CE3 4.16Å; V62-W75 HydrophobicContact CG1-CZ3 3.99Å; V62-P76 VanDerWaalsContact O-CG 3.24Å; V62-P76 WeakPolarHBondContact O-CG 3.35Å; V62-L107 HydrophobicContact CB-CD2 3.82Å; V62-L107 HydrophobicContact CG1-CD2 4.15Å; V62-L107 HydrophobicContact CG2-CD2 3.62Å
63	A	46.7	Very low	61.7	Low	16 Å²	16	57.1 Å²	57.1	13%	0.132	38%	0.376	C	S	.	.	S	Bend	trans	-97	121.2	177.7	0	0	0	0	0	108.3	D61 S67	D61-A63 HydrophobicContact CB-CB 4.41Å; D61-A63 WeakPolarHBondContact CB-O 3.49Å; D61-A63 PolarHBondContact O-N 3.29Å; A63-S67 VanDerWaalsContact CA-OG 3.24Å; A63-S67 WeakPolarHBondContact CA-OG 3.35Å; A63-S67 WeakPolarHBondContact CB-OG 3.46Å
64	G	40.9	Very low	59.7	Low	35 Å²	35	60.8 Å²	60.8	36%	0.361	39%	0.394	S	S	.	.			trans	-56.1	173	162.1	0	0	0	0	0	111	G66 S67	G64-G66 PolarHBondContact O-N 3.05Å; G64-S67 PolarHBondContact N-OG 2.94Å; G64-S67 PolarHBondContact O-N 3.39Å; G64-S67 PolarHBondContact O-OG 3.31Å; G64-S67 VanDerWaalsContact O-OG 3.07Å
65	P	34.4	Very low	57.6	Low	150 Å²	150	60 Å²	60	97%	0.974	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	109.8	177.4	23.9	-31.2	0	0	0	110
66	G	43.5	Very low	55.2	Low	63 Å²	63	62.4 Å²	62.4	65%	0.649	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.7	-16.1	173.7	0	0	0	0	0	117.2	G64 S68	G64-G66 PolarHBondContact O-N 3.05Å; G66-S68 PolarHBondContact O-N 2.86Å
67	S	42.3	Very low	52.9	Low	22 Å²	22	65.9 Å²	65.9	15%	0.154	42%	0.417	C	S	.	.			trans	-87.6	109.6	-165.3	15.7	0	0	0	0	114.5	A63 G64 E74	A63-S67 VanDerWaalsContact CA-OG 3.24Å; A63-S67 WeakPolarHBondContact CA-OG 3.35Å; A63-S67 WeakPolarHBondContact CB-OG 3.46Å; G64-S67 PolarHBondContact N-OG 2.94Å; G64-S67 PolarHBondContact O-N 3.39Å; G64-S67 PolarHBondContact O-OG 3.31Å; G64-S67 VanDerWaalsContact O-OG 3.07Å; S67-E74 WeakPolarHBondContact CB-O 3.34Å
68	S	41.5	Very low	50.5	Low	92 Å²	92	68.7 Å²	68.7	64%	0.643	44%	0.435	S	S	*	.			trans	-79.9	137.9	161.4	-76.4	0	0	0	0	110.6	G66 G70	G66-S68 PolarHBondContact O-N 2.86Å; S68-G70 PolarHBondContact O-N 3.45Å
69	P	43.4	Very low	48.2	Very low	57 Å²	57	74 Å²	74	37%	0.37	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	108.5	169.5	-11.6	26.5	0	0	0	109.1	W75 Y103	P69-W75 HydrophobicContact CB-CH2 4.31Å; P69-W75 HydrophobicContact CB-CZ2 3.7Å; P69-W75 HydrophobicContact CG-CH2 4.42Å; P69-W75 HydrophobicContact CG-CZ2 4.22Å; P69-Y103 HydrophobicContact CB-CD2 4.43Å; P69-Y103 HydrophobicContact CG-CD2 3.07Å; P69-Y103 HydrophobicContact CG-CE2 3.31Å; P69-Y103 HydrophobicContact CG-CG 3.89Å
70	G	45.9	Very low	46.4	Very low	73 Å²	73	80.4 Å²	80.4	75%	0.753	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	146.2	-10.5	172.9	0	0	0	0	0	115.8	S68	S68-G70 PolarHBondContact O-N 3.45Å
71	G	43.1	Very low	45.7	Very low	40 Å²	40	81.4 Å²	81.4	41%	0.412	50%	0.495	S	S	.	.			trans	-81.1	142.5	171.2	0	0	0	0	0	112.2	E73	G71-E73 PolarHBondContact O-N 3.23Å
72	P	41.1	Very low	45.3	Very low	140 Å²	140	80 Å²	80	91%	0.909	49%	0.49	S	S	*	.	S	Bend	trans	-62.8	-16.9	174.9	-19.6	30.6	0	0	0	115
73	E	49.5	Very low	45.8	Very low	186 Å²	186	79.6 Å²	79.6	87%	0.869	49%	0.488	S	S	*	.	S	Bend	trans	-117.5	-4.6	-164.6	-82.4	-167.3	128	0	0	117.7	G71	G71-E73 PolarHBondContact O-N 3.23Å
74	E	47	Very low	46.5	Very low	119 Å²	119	84.7 Å²	84.7	56%	0.556	51%	0.509	S	S	*	.			trans	-132.3	69.4	-166.3	-70.7	-174.8	154.5	0	0	114.4	S67	S67-E74 WeakPolarHBondContact CB-O 3.34Å
75	W	48	Very low	48.1	Very low	79 Å²	79	87.3 Å²	87.3	30%	0.299	51%	0.514	S	S	.	.			trans	-126.8	125.2	157.3	-73.2	85.9	0	0	0	108.6	V62 P69 L107	V62-W75 HydrophobicContact CB-CZ3 4.32Å; V62-W75 HydrophobicContact CG1-CE3 4.16Å; V62-W75 HydrophobicContact CG1-CZ3 3.99Å; P69-W75 HydrophobicContact CB-CH2 4.31Å; P69-W75 HydrophobicContact CB-CZ2 3.7Å; P69-W75 HydrophobicContact CG-CH2 4.42Å; P69-W75 HydrophobicContact CG-CZ2 4.22Å; W75-L107 HydrophobicContact CH2-CD2 4.45Å; W75-L107 HydrophobicContact CZ3-CD2 4.23Å
76	P	43.6	Very low	50.5	Low	53 Å²	53	80.2 Å²	80.2	34%	0.344	47%	0.469	S	S	.	.			trans	-55	148.2	178.5	19.8	-30	0	0	0	111.1	V62 R110	V62-P76 VanDerWaalsContact O-CG 3.24Å; V62-P76 WeakPolarHBondContact O-CG 3.35Å; P76-R110 PolarHBondContact O-NH2 3.33Å
77	D	44.2	Very low	52.7	Low	92 Å²	92	79.5 Å²	79.5	49%	0.492	45%	0.45	S	S	.	.			trans	-51.5	137.3	-168.9	-161.7	-38.3	0	0	0	111.3	K79 D80	D77-K79 PolarHBondContact O-N 3.23Å; D77-K79 PolarHBondContact OD1-N 3.37Å; D77-D80 PolarHBondContact O-N 2.88Å
78	P	44.1	Very low	55.1	Low	59 Å²	59	78.5 Å²	78.5	38%	0.383	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-16.7	175.2	-28.8	33.7	0	0	0	116.2	W81 T114	P78-W81 PolarHBondContact O-NE1 3.37Å; P78-T114 HydrophobicContact CB-CG2 4.38Å
79	K	41.6	Very low	57.6	Low	185 Å²	185	74.1 Å²	74.1	80%	0.804	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-21	176.2	-70.8	176.5	178.6	174.2	0	114.5	D77 W81	D77-K79 PolarHBondContact O-N 3.23Å; D77-K79 PolarHBondContact OD1-N 3.37Å; K79-W81 PolarHBondContact O-N 3.45Å
80	D	49.8	Very low	60.1	Low	133 Å²	133	71.5 Å²	71.5	71%	0.711	40%	0.395	S	S	*	.	S	Bend	trans	-75.5	-6.6	178.1	-80.1	-28.9	0	0	0	112.6	D77	D77-D80 PolarHBondContact O-N 2.88Å
81	W	53.3	Low	62.5	Low	31 Å²	31	68 Å²	68	12%	0.117	36%	0.359	C	S	.	.			trans	-104.6	131.7	-177	64.6	-103.9	0	0	0	115	P78 K79 L83 Q84 T114	P78-W81 PolarHBondContact O-NE1 3.37Å; K79-W81 PolarHBondContact O-N 3.45Å; W81-L83 HydrophobicContact CB-CD2 4.37Å; W81-L83 HydrophobicContact CB-CG 3.86Å; W81-L83 HydrophobicContact CD2-CB 3.77Å; W81-L83 HydrophobicContact CD2-CD1 3.62Å; W81-L83 HydrophobicContact CD2-CG 3.32Å; W81-L83 VanDerWaalsContact CE3-C 3.41Å; W81-L83 HydrophobicContact CE3-CB 3.09Å; W81-L83 HydrophobicContact CE3-CD1 3.86Å; W81-L83 HydrophobicContact CE3-CG 3.24Å; W81-L83 HydrophobicContact CG-CD1 4.1Å; W81-L83 HydrophobicContact CG-CG 3.77Å; W81-L83 HydrophobicContact CH2-CB 3.48Å; W81-L83 VanDerWaalsContact CH2-CB 3.48Å; W81-L83 HydrophobicContact CH2-CD1 3.52Å; W81-L83 HydrophobicContact CH2-CG 3.77Å; W81-L83 HydrophobicContact CZ2-CB 4.18Å; W81-L83 HydrophobicContact CZ2-CD1 3.38Å; W81-L83 HydrophobicContact CZ2-CG 3.94Å; W81-L83 HydrophobicContact CZ3-CB 3.02Å; W81-L83 HydrophobicContact CZ3-CD1 3.9Å; W81-L83 HydrophobicContact CZ3-CG 3.58Å; W81-L83 PolarHBondContact O-N 3.18Å; W81-Q84 HydrophobicContact CE3-CG 4.06Å; W81-Q84 HydrophobicContact CZ3-CB 4.46Å; W81-Q84 HydrophobicContact CZ3-CG 3.81Å; W81-T114 HydrophobicContact CD2-CG2 4.35Å; W81-T114 VanDerWaalsContact CE2-CG2 3.46Å; W81-T114 HydrophobicContact CE3-CG2 4.37Å; W81-T114 HydrophobicContact CH2-CG2 3.25Å; W81-T114 HydrophobicContact CZ2-CG2 3Å; W81-T114 WeakPolarHBondContact CZ2-OG1 3.43Å; W81-T114 HydrophobicContact CZ3-CG2 3.8Å
82	S	54.9	Low	65.1	Low	35 Å²	35	66.1 Å²	66.1	25%	0.245	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	19.7	167.9	47.2	0	0	0	0	113.4	R58 Q84 D85 T86	R58-S82 PolarHBondContact NE-OG 3.48Å; R58-S82 PolarHBondContact NH1-OG 3.29Å; R58-S82 PolarHBondContact NH2-OG 3.37Å; S82-Q84 PolarHBondContact O-N 2.96Å; S82-D85 CarbonylContact O-C 3.57Å; S82-D85 WeakPolarHBondContact O-CA 2.98Å; S82-D85 PolarHBondContact O-N 2.94Å; S82-T86 PolarHBondContact O-N 3.14Å; S82-T86 PolarHBondContact O-OG1 3.37Å
83	L	62	Low	67.8	Low	12 Å²	12	59.4 Å²	59.4	6%	0.063	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.3	170.9	-15.2	165.6	0	0	0	112.7	L10 W81 D85 T86 F89 I111	L10-L83 HydrophobicContact CD1-CD2 4.24Å; W81-L83 HydrophobicContact CB-CD2 4.37Å; W81-L83 HydrophobicContact CB-CG 3.86Å; W81-L83 HydrophobicContact CD2-CB 3.77Å; W81-L83 HydrophobicContact CD2-CD1 3.62Å; W81-L83 HydrophobicContact CD2-CG 3.32Å; W81-L83 VanDerWaalsContact CE3-C 3.41Å; W81-L83 HydrophobicContact CE3-CB 3.09Å; W81-L83 HydrophobicContact CE3-CD1 3.86Å; W81-L83 HydrophobicContact CE3-CG 3.24Å; W81-L83 HydrophobicContact CG-CD1 4.1Å; W81-L83 HydrophobicContact CG-CG 3.77Å; W81-L83 HydrophobicContact CH2-CB 3.48Å; W81-L83 VanDerWaalsContact CH2-CB 3.48Å; W81-L83 HydrophobicContact CH2-CD1 3.52Å; W81-L83 HydrophobicContact CH2-CG 3.77Å; W81-L83 HydrophobicContact CZ2-CB 4.18Å; W81-L83 HydrophobicContact CZ2-CD1 3.38Å; W81-L83 HydrophobicContact CZ2-CG 3.94Å; W81-L83 HydrophobicContact CZ3-CB 3.02Å; W81-L83 HydrophobicContact CZ3-CD1 3.9Å; W81-L83 HydrophobicContact CZ3-CG 3.58Å; W81-L83 PolarHBondContact O-N 3.18Å; L83-D85 VanDerWaalsContact C-N 3.27Å; L83-T86 PolarHBondContact O-N 2.85Å; L83-F89 HydrophobicContact CB-CE1 3.69Å; L83-F89 HydrophobicContact CB-CZ 3.65Å; L83-F89 HydrophobicContact CD2-CE1 3.96Å; L83-F89 HydrophobicContact CG-CE1 4.33Å; L83-I111 HydrophobicContact CD1-CG1 4.09Å
84	Q	62.5	Low	70.2	Confident	122 Å²	122	51.4 Å²	51.4	57%	0.57	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-35.3	169.2	-67.8	-170.3	0.9	0	0	109.6	W81 S82 T86	W81-Q84 HydrophobicContact CE3-CG 4.06Å; W81-Q84 HydrophobicContact CZ3-CB 4.46Å; W81-Q84 HydrophobicContact CZ3-CG 3.81Å; S82-Q84 PolarHBondContact O-N 2.96Å; Q84-T86 VanDerWaalsContact C-N 3.3Å; Q84-T86 PolarHBondContact O-N 2.85Å
85	D	73.7	Confident	72.6	Confident	90 Å²	90	45.8 Å²	45.8	48%	0.481	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	27.4	176.3	-83.5	-32	0	0	0	113	R6 S82 L83	R6-D85 WeakPolarHBondContact CB-O 3.25Å; R6-D85 WeakPolarHBondContact CD-O 3.46Å; R6-D85 VanDerWaalsContact CZ-C 3.45Å; R6-D85 IonicContact CZ-OD1 3.46Å; R6-D85 PolarHBondContact NE-O 3.4Å; R6-D85 PolarHBondContact NH1-O 2.84Å; R6-D85 IonicContact NH1-OD1 2.7Å; R6-D85 PolarHBondContact NH1-OD1 2.74Å; R6-D85 IonicContact NH2-OD1 2.71Å; S82-D85 CarbonylContact O-C 3.57Å; S82-D85 WeakPolarHBondContact O-CA 2.98Å; S82-D85 PolarHBondContact O-N 2.94Å; L83-D85 VanDerWaalsContact C-N 3.27Å
86	T	86.3	Confident	75	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.012	23%	0.23	C	C	.	.			trans	-115.7	125.2	176.5	-63.2	0	0	0	0	110.5	A8 S82 L83 Q84 A88 F89 R115	A8-T86 HydrophobicContact CB-CG2 3.76Å; S82-T86 PolarHBondContact O-N 3.14Å; S82-T86 PolarHBondContact O-OG1 3.37Å; L83-T86 PolarHBondContact O-N 2.85Å; Q84-T86 VanDerWaalsContact C-N 3.3Å; Q84-T86 PolarHBondContact O-N 2.85Å; T86-A88 WeakPolarHBondContact CG2-O 3.31Å; T86-F89 HydrophobicContact CG2-CD1 3.84Å; T86-F89 HydrophobicContact CG2-CD2 4.41Å; T86-F89 HydrophobicContact CG2-CE1 3.39Å; T86-F89 HydrophobicContact CG2-CE2 4.07Å; T86-F89 HydrophobicContact CG2-CG 4.31Å; T86-F89 HydrophobicContact CG2-CZ 3.54Å; T86-R115 PolarHBondContact O-NH2 3.2Å
87	D	88.9	Confident	77.6	Confident	47 Å²	47	42.8 Å²	42.8	25%	0.251	23%	0.225	S	C	.	.	S	Bend	trans	-87.4	-24.1	-176	-52.1	-45.8	0	0	0	111.5	L5 R6 P123	L5-D87 HydrophobicContact CD2-CB 3.99Å; R6-D87 WeakPolarHBondContact CB-OD2 3.39Å; R6-D87 IonicContact CZ-OD1 2.73Å; R6-D87 IonicContact CZ-OD2 3.89Å; R6-D87 PolarHBondContact N-OD2 2.95Å; R6-D87 IonicContact NE-OD1 3.29Å; R6-D87 IonicContact NE-OD2 3.74Å; R6-D87 PolarHBondContact NE-OD2 2.88Å; R6-D87 VanDerWaalsContact NE-OD2 3.14Å; R6-D87 IonicContact NH2-OD1 3.4Å; R6-D87 PolarHBondContact NH2-OD1 3.04Å; R6-D87 IonicContact NH2-OD2 2.79Å; R6-D87 WeakPolarHBondContact O-CA 3.12Å; R6-D87 PolarHBondContact O-N 3.44Å; D87-P123 VanDerWaalsContact O-CD 3.32Å; D87-P123 WeakPolarHBondContact O-CD 3.4Å
88	A	92.6	Very high	80.1	Confident	1 Å²	1	41 Å²	41	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	151.6	174.5	0	0	0	0	0	113.4	R6 V7 A8 T86 P123 L174 A178	R6-A88 PolarHBondContact O-N 3.33Å; V7-A88 WeakPolarHBondContact CA-O 3.1Å; V7-A88 HydrophobicContact CG2-CB 4.46Å; A8-A88 PolarHBondContact N-O 3.4Å; T86-A88 WeakPolarHBondContact CG2-O 3.31Å; A88-P123 HydrophobicContact CB-CG 3.85Å; A88-L174 HydrophobicContact CB-CD1 3.85Å; A88-L174 HydrophobicContact CB-CD2 4.24Å; A88-L174 HydrophobicContact CB-CG 3.93Å; A88-A178 HydrophobicContact CB-CB 4.09Å
89	F	93.8	Very high	82.5	Confident	1 Å²	1	43.9 Å²	43.9	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.6	-179.6	-60.7	-83	0	0	0	112.5	A8 L10 L83 T86 L91 I111 A122 P123 I124 L125 L174	A8-F89 HydrophobicContact CB-CD1 3.89Å; A8-F89 HydrophobicContact CB-CE1 4.07Å; L10-F89 HydrophobicContact CD1-CD1 4.05Å; L83-F89 HydrophobicContact CB-CE1 3.69Å; L83-F89 HydrophobicContact CB-CZ 3.65Å; L83-F89 HydrophobicContact CD2-CE1 3.96Å; L83-F89 HydrophobicContact CG-CE1 4.33Å; T86-F89 HydrophobicContact CG2-CD1 3.84Å; T86-F89 HydrophobicContact CG2-CD2 4.41Å; T86-F89 HydrophobicContact CG2-CE1 3.39Å; T86-F89 HydrophobicContact CG2-CE2 4.07Å; T86-F89 HydrophobicContact CG2-CG 4.31Å; T86-F89 HydrophobicContact CG2-CZ 3.54Å; F89-L91 HydrophobicContact CB-CD2 4.37Å; F89-I111 HydrophobicContact CB-CD1 4.37Å; F89-I111 HydrophobicContact CD1-CD1 3.81Å; F89-I111 HydrophobicContact CD1-CG1 4.44Å; F89-I111 HydrophobicContact CD2-CD1 4.36Å; F89-I111 HydrophobicContact CD2-CG2 3.98Å; F89-I111 HydrophobicContact CE1-CD1 4.21Å; F89-I111 HydrophobicContact CE1-CG1 4.35Å; F89-I111 HydrophobicContact CE2-CG2 3.67Å; F89-I111 HydrophobicContact CG-CD1 3.91Å; F89-I111 HydrophobicContact CZ-CG1 4.48Å; F89-I111 HydrophobicContact CZ-CG2 4.07Å; F89-A122 HydrophobicContact CD2-CB 3.99Å; F89-A122 HydrophobicContact CE2-CB 3.77Å; F89-P123 PolarHBondContact N-O 3.23Å; F89-I124 HydrophobicContact CB-CG1 4.18Å; F89-I124 HydrophobicContact CD2-CG1 4.15Å; F89-I124 WeakPolarHBondContact O-CA 3.37Å; F89-L125 PolarHBondContact O-N 3.34Å; F89-L174 WeakPolarHBondContact O-CD1 3.49Å
90	V	96.8	Very high	85.1	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.2	165.3	-176	0	0	0	0	108	V7 A8 V9 L10 V92 L125 V127 L170 L174	V7-V90 HydrophobicContact CG1-CG2 4.13Å; A8-V90 PolarHBondContact O-N 3.17Å; V9-V90 WeakPolarHBondContact CA-O 3.17Å; V9-V90 HydrophobicContact CB-CB 4.47Å; V9-V90 HydrophobicContact CG1-CB 4.28Å; V9-V90 HydrophobicContact CG1-CG1 4.36Å; V9-V90 HydrophobicContact CG2-CB 4.19Å; V9-V90 HydrophobicContact CG2-CG2 4.4Å; L10-V90 PolarHBondContact N-O 3.43Å; V90-V92 HydrophobicContact CG1-CG2 3.81Å; V90-L125 WeakPolarHBondContact CA-O 3.46Å; V90-V127 HydrophobicContact CG1-CB 4.31Å; V90-V127 HydrophobicContact CG1-CG2 3.64Å; V90-L170 HydrophobicContact CG1-CD2 4.16Å; V90-L170 HydrophobicContact CG2-CD2 4.04Å; V90-L174 HydrophobicContact CG2-CD1 3.99Å; V90-L174 HydrophobicContact CG2-CD2 3.44Å; V90-L174 VanDerWaalsContact CG2-CD2 3.44Å; V90-L174 HydrophobicContact CG2-CG 4.27Å
91	L	96.3	Very high	87.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	109	177.1	-52.9	-174.6	0	0	0	109.5	L10 F89 V104 L107 R108 I111 I124 L125 V126 V127	L10-L91 HydrophobicContact CB-CD2 3.93Å; L10-L91 HydrophobicContact CD1-CD2 4.14Å; L10-L91 HydrophobicContact CG-CD2 4.46Å; L10-L91 CarbonylContact O-C 3.59Å; L10-L91 WeakPolarHBondContact O-CA 3.2Å; F89-L91 HydrophobicContact CB-CD2 4.37Å; L91-V104 HydrophobicContact CB-CB 4.42Å; L91-V104 HydrophobicContact CB-CG1 3.67Å; L91-V104 HydrophobicContact CB-CG2 4.04Å; L91-V104 HydrophobicContact CD1-CG1 4.03Å; L91-L107 HydrophobicContact CD1-CB 4.49Å; L91-L107 HydrophobicContact CD2-CB 4.4Å; L91-L107 HydrophobicContact CD2-CD1 4.15Å; L91-R108 HydrophobicContact CD1-CB 3.89Å; L91-I111 HydrophobicContact CD1-CD1 4.42Å; L91-I111 HydrophobicContact CD2-CD1 3.92Å; L91-I124 HydrophobicContact CD1-CG2 3.56Å; L91-I124 HydrophobicContact CG-CG2 3.76Å; L91-L125 PolarHBondContact N-O 2.9Å; L91-V126 HydrophobicContact CB-CG2 4.49Å; L91-V126 CarbonylContact O-C 3.58Å; L91-V126 WeakPolarHBondContact O-CA 3.39Å; L91-V127 PolarHBondContact O-N 2.8Å
92	V	97.8	Very high	89.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.3	-172	-170.8	0	0	0	0	110.4	V9 L10 G11 V15 K17 I20 V90 V104 V127 N129	V9-V92 HydrophobicContact CG1-CG2 3.77Å; L10-V92 PolarHBondContact O-N 3.44Å; G11-V92 WeakPolarHBondContact CA-O 3.18Å; V15-V92 HydrophobicContact CB-CG1 4.3Å; V15-V92 HydrophobicContact CG2-CB 3.96Å; V15-V92 HydrophobicContact CG2-CG1 3.81Å; K17-V92 HydrophobicContact CG-CB 4.22Å; K17-V92 HydrophobicContact CG-CG2 4.34Å; I20-V92 HydrophobicContact CD1-CG1 3.68Å; I20-V92 HydrophobicContact CD1-CG2 4.03Å; V90-V92 HydrophobicContact CG1-CG2 3.81Å; V92-V104 WeakPolarHBondContact O-CG2 3.37Å; V92-V127 WeakPolarHBondContact CA-O 3.34Å; V92-V127 HydrophobicContact CG2-CB 4.46Å; V92-N129 HydrophobicContact CG1-CB 3.83Å
93	Y	98.1	Very high	91	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	160.9	169	77.2	-80.5	0	0	0	110.5	I95 S100 F101 V126 V127 N129 F138 Y156	Y93-I95 HydrophobicContact CE2-CG2 4.12Å; Y93-S100 WeakPolarHBondContact CB-O 3.43Å; Y93-F101 AromaticContact CD1-CD2 3.89Å; Y93-F101 HydrophobicContact CD1-CD2 3.89Å; Y93-F101 HydrophobicContact CD2-CB 3.92Å; Y93-F101 AromaticContact CD2-CD2 3.88Å; Y93-F101 HydrophobicContact CD2-CD2 3.88Å; Y93-F101 HydrophobicContact CD2-CG 4.38Å; Y93-F101 AromaticContact CE1-CD2 3.87Å; Y93-F101 HydrophobicContact CE1-CD2 3.87Å; Y93-F101 HydrophobicContact CE1-CE2 4.21Å; Y93-F101 HydrophobicContact CE2-CB 4.4Å; Y93-F101 AromaticContact CE2-CD2 3.85Å; Y93-F101 HydrophobicContact CE2-CD2 3.85Å; Y93-F101 HydrophobicContact CG-CB 4.28Å; Y93-F101 AromaticContact CG-CD2 3.91Å; Y93-F101 HydrophobicContact CG-CD2 3.91Å; Y93-F101 AromaticContact CZ-CD2 3.86Å; Y93-V126 HydrophobicContact CD1-CG1 4.02Å; Y93-V126 HydrophobicContact CE1-CG1 3.98Å; Y93-V127 VanDerWaalsContact CD1-O 3.29Å; Y93-V127 WeakPolarHBondContact CD1-O 3.39Å; Y93-V127 PolarHBondContact N-O 3.35Å; Y93-N129 PolarHBondContact O-N 2.71Å; Y93-F138 HydrophobicContact CD2-CE1 4.19Å; Y93-F138 AromaticContact CE2-CE1 3.9Å; Y93-F138 HydrophobicContact CE2-CE1 3.9Å; Y93-F138 HydrophobicContact CE2-CZ 4.21Å; Y93-Y156 HydrophobicContact CE1-CE2 4.15Å; Y93-Y156 PolarHBondContact OH-OH 3.21Å
94	D	98.1	Very high	92.6	Very high	17 Å²	17	30.6 Å²	30.6	9%	0.091	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	124	171.6	-179.9	-11.3	0	0	0	108.9	V15 C96 S97 S100 K130	V15-D94 HydrophobicContact CG1-CB 4.38Å; D94-C96 PolarHBondContact O-N 2.83Å; D94-C96 WeakPolarHBondContact OD1-CB 3.5Å; D94-C96 PolarHBondContact OD1-N 2.94Å; D94-S97 PolarHBondContact O-N 3.29Å; D94-S100 PolarHBondContact N-OG 3.49Å; D94-S100 PolarHBondContact O-OG 3.22Å; D94-K130 HydrophobicContact CB-CD 4.44Å; D94-K130 VanDerWaalsContact OD2-CD 3.26Å; D94-K130 WeakPolarHBondContact OD2-CD 3.3Å; D94-K130 VanDerWaalsContact OD2-CE 3.23Å; D94-K130 WeakPolarHBondContact OD2-CE 3.42Å; D94-K130 IonicContact OD2-NZ 3.14Å; D94-K130 PolarHBondContact OD2-NZ 2.87Å
95	I	98.6	Very high	94	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-13.9	-178.8	63.8	158	0	0	0	114.2	Y93 N129 K130 Q134 R137 F138 E158	Y93-I95 HydrophobicContact CE2-CG2 4.12Å; I95-N129 WeakPolarHBondContact CG1-O 3.24Å; I95-N129 WeakPolarHBondContact CG2-O 3.42Å; I95-N129 PolarHBondContact N-O 3.11Å; I95-N129 VanDerWaalsContact N-O 3.15Å; I95-K130 WeakPolarHBondContact CD1-O 3.29Å; I95-Q134 HydrophobicContact CD1-CB 4.3Å; I95-R137 HydrophobicContact CD1-CB 4.38Å; I95-R137 VanDerWaalsContact O-CA 3.28Å; I95-R137 WeakPolarHBondContact O-CA 3.33Å; I95-F138 WeakPolarHBondContact O-CD1 3.29Å; I95-F138 PolarHBondContact O-N 3.2Å; I95-E158 HydrophobicContact CG2-CG 4.42Å
96	C	98.3	Very high	94.8	Very high	35 Å²	35	26.5 Å²	26.5	24%	0.236	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-8.2	176.6	-57.3	0	0	0	0	113.6	D94 R133	D94-C96 PolarHBondContact O-N 2.83Å; D94-C96 WeakPolarHBondContact OD1-CB 3.5Å; D94-C96 PolarHBondContact OD1-N 2.94Å; C96-R133 VanDerWaalsContact SG-CB 3.53Å
97	S	97.6	Very high	94.9	Very high	34 Å²	34	26.5 Å²	26.5	24%	0.238	15%	0.149	C	C	.	.			trans	-119.2	108.1	-176.5	170.8	0	0	0	0	111.1	D94 D99 S100 F101	D94-S97 PolarHBondContact O-N 3.29Å; S97-D99 VanDerWaalsContact C-N 3.31Å; S97-D99 PolarHBondContact O-N 3.02Å; S97-S100 WeakPolarHBondContact CB-OG 3.4Å; S97-S100 PolarHBondContact O-N 3.22Å; S97-S100 PolarHBondContact O-OG 2.73Å; S97-S100 PolarHBondContact OG-N 2.8Å; S97-F101 PolarHBondContact O-N 3.4Å
98	P	96.9	Very high	95	Very high	56 Å²	56	27.3 Å²	27.3	36%	0.364	15%	0.148	S	C	.	.	H	α-helix	trans	-62.1	-39.3	174.9	25.1	-31.2	0	0	0	111.6	S100 F101 D102 F138	P98-S100 PolarHBondContact O-N 2.82Å; P98-F101 WeakPolarHBondContact O-CA 3.17Å; P98-F101 VanDerWaalsContact O-CB 3.3Å; P98-F101 WeakPolarHBondContact O-CB 3.29Å; P98-F101 PolarHBondContact O-N 3.01Å; P98-D102 PolarHBondContact O-N 2.91Å; P98-F138 HydrophobicContact CB-CB 4.3Å; P98-F138 HydrophobicContact CB-CD1 4.27Å; P98-F138 HydrophobicContact CB-CD2 3.86Å; P98-F138 HydrophobicContact CB-CE2 4.22Å; P98-F138 HydrophobicContact CB-CG 3.9Å; P98-F138 HydrophobicContact CG-CB 4.29Å; P98-F138 HydrophobicContact CG-CG 4.38Å
99	D	95.3	Very high	94.8	Very high	119 Å²	119	31.7 Å²	31.7	64%	0.636	17%	0.168	S	C	*	.	H	α-helix	trans	-58.2	-38	178.2	-49.5	-28.1	0	0	0	112	S97 F101 D102 Y103	S97-D99 VanDerWaalsContact C-N 3.31Å; S97-D99 PolarHBondContact O-N 3.02Å; D99-F101 VanDerWaalsContact C-N 3.26Å; D99-F101 PolarHBondContact O-N 2.91Å; D99-D102 PolarHBondContact O-N 2.78Å; D99-Y103 PolarHBondContact O-N 2.87Å
100	S	95.9	Very high	94.2	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-67.6	-26.5	175.8	77.5	0	0	0	0	113.1	Y93 D94 S97 P98 Y103 V104	Y93-S100 WeakPolarHBondContact CB-O 3.43Å; D94-S100 PolarHBondContact N-OG 3.49Å; D94-S100 PolarHBondContact O-OG 3.22Å; S97-S100 WeakPolarHBondContact CB-OG 3.4Å; S97-S100 PolarHBondContact O-N 3.22Å; S97-S100 PolarHBondContact O-OG 2.73Å; S97-S100 PolarHBondContact OG-N 2.8Å; P98-S100 PolarHBondContact O-N 2.82Å; S100-Y103 WeakPolarHBondContact O-CB 3.37Å; S100-V104 PolarHBondContact O-N 3.22Å
101	F	97.3	Very high	93.7	Very high	13 Å²	13	33.5 Å²	33.5	6%	0.057	18%	0.176	C	C	.	.	H	α-helix	trans	-77	-38.8	173.6	-174.5	-99.5	0	0	0	111.4	Y93 S97 P98 D99 Y103 V104 K105 F138 L144 L147 V148 W152	Y93-F101 AromaticContact CD1-CD2 3.89Å; Y93-F101 HydrophobicContact CD1-CD2 3.89Å; Y93-F101 HydrophobicContact CD2-CB 3.92Å; Y93-F101 AromaticContact CD2-CD2 3.88Å; Y93-F101 HydrophobicContact CD2-CD2 3.88Å; Y93-F101 HydrophobicContact CD2-CG 4.38Å; Y93-F101 AromaticContact CE1-CD2 3.87Å; Y93-F101 HydrophobicContact CE1-CD2 3.87Å; Y93-F101 HydrophobicContact CE1-CE2 4.21Å; Y93-F101 HydrophobicContact CE2-CB 4.4Å; Y93-F101 AromaticContact CE2-CD2 3.85Å; Y93-F101 HydrophobicContact CE2-CD2 3.85Å; Y93-F101 HydrophobicContact CG-CB 4.28Å; Y93-F101 AromaticContact CG-CD2 3.91Å; Y93-F101 HydrophobicContact CG-CD2 3.91Å; Y93-F101 AromaticContact CZ-CD2 3.86Å; S97-F101 PolarHBondContact O-N 3.4Å; P98-F101 WeakPolarHBondContact O-CA 3.17Å; P98-F101 VanDerWaalsContact O-CB 3.3Å; P98-F101 WeakPolarHBondContact O-CB 3.29Å; P98-F101 PolarHBondContact O-N 3.01Å; D99-F101 VanDerWaalsContact C-N 3.26Å; D99-F101 PolarHBondContact O-N 2.91Å; F101-Y103 VanDerWaalsContact C-N 3.3Å; F101-Y103 PolarHBondContact O-N 2.9Å; F101-V104 WeakPolarHBondContact O-CB 3.5Å; F101-V104 PolarHBondContact O-N 2.98Å; F101-V104 VanDerWaalsContact O-N 3.15Å; F101-K105 PolarHBondContact O-N 3.36Å; F101-F138 HydrophobicContact CB-CE1 4.21Å; F101-F138 HydrophobicContact CB-CZ 3.74Å; F101-F138 HydrophobicContact CD1-CZ 4.5Å; F101-F138 HydrophobicContact CG-CZ 4.03Å; F101-L144 HydrophobicContact CD1-CD2 4.31Å; F101-L144 HydrophobicContact CE1-CD2 3.9Å; F101-L144 HydrophobicContact CE2-CD2 4.19Å; F101-L144 HydrophobicContact CZ-CD2 3.84Å; F101-L147 HydrophobicContact CE1-CD2 4.03Å; F101-L147 HydrophobicContact CZ-CD2 4.11Å; F101-V148 HydrophobicContact CE2-CG2 4.18Å; F101-V148 HydrophobicContact CZ-CG2 4.15Å; F101-W152 AromaticContact CE1-CH2 3.77Å; F101-W152 HydrophobicContact CE1-CH2 3.77Å; F101-W152 HydrophobicContact CE1-CZ2 4.1Å; F101-W152 HydrophobicContact CE2-CH2 4.04Å; F101-W152 HydrophobicContact CE2-CZ3 4.39Å; F101-W152 AromaticContact CZ-CH2 3.41Å; F101-W152 HydrophobicContact CZ-CH2 3.41Å; F101-W152 VanDerWaalsContact CZ-CH2 3.41Å; F101-W152 AromaticContact CZ-CZ2 3.98Å; F101-W152 HydrophobicContact CZ-CZ2 3.98Å; F101-W152 HydrophobicContact CZ-CZ3 4.11Å
102	D	94.9	Very high	93.1	Very high	91 Å²	91	35.8 Å²	35.8	49%	0.487	19%	0.194	S	C	.	.	H	α-helix	trans	-63.7	-36.9	172	-73.3	-33.4	0	0	0	111.7	P98 D99 V104 K105 A106	P98-D102 PolarHBondContact O-N 2.91Å; D99-D102 PolarHBondContact O-N 2.78Å; D102-V104 VanDerWaalsContact C-N 3.33Å; D102-V104 PolarHBondContact O-N 3.42Å; D102-K105 WeakPolarHBondContact O-CB 3.38Å; D102-K105 PolarHBondContact O-N 2.85Å; D102-K105 VanDerWaalsContact O-N 3.15Å; D102-A106 PolarHBondContact O-N 2.9Å
103	Y	90.5	Very high	92.3	Very high	9 Å²	9	42.8 Å²	42.8	4%	0.035	23%	0.227	C	C	.	.	H	α-helix	trans	-55.3	-47.7	169.7	-166.7	-69.2	0	0	0	111.4	A12 P69 D99 S100 F101 K105 A106 L107	A12-Y103 HydrophobicContact CB-CD1 4.35Å; A12-Y103 HydrophobicContact CB-CD2 3.67Å; A12-Y103 HydrophobicContact CB-CE2 4.26Å; A12-Y103 HydrophobicContact CB-CG 3.78Å; P69-Y103 HydrophobicContact CB-CD2 4.43Å; P69-Y103 HydrophobicContact CG-CD2 3.07Å; P69-Y103 HydrophobicContact CG-CE2 3.31Å; P69-Y103 HydrophobicContact CG-CG 3.89Å; D99-Y103 PolarHBondContact O-N 2.87Å; S100-Y103 WeakPolarHBondContact O-CB 3.37Å; F101-Y103 VanDerWaalsContact C-N 3.3Å; F101-Y103 PolarHBondContact O-N 2.9Å; Y103-K105 VanDerWaalsContact C-N 3.32Å; Y103-K105 PolarHBondContact O-N 3.06Å; Y103-A106 PolarHBondContact O-N 2.99Å; Y103-L107 HydrophobicContact CD1-CD1 3.71Å; Y103-L107 HydrophobicContact CD1-CG 3.78Å; Y103-L107 HydrophobicContact CE1-CD1 3.53Å; Y103-L107 HydrophobicContact CE1-CD2 3.95Å; Y103-L107 HydrophobicContact CE1-CG 3.59Å; Y103-L107 WeakPolarHBondContact O-CG 3.46Å; Y103-L107 PolarHBondContact O-N 2.89Å
104	V	93.6	Very high	91.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-37.2	177.7	161.9	0	0	0	0	112.1	L91 V92 S100 F101 D102 L107 R108 V126 W152	L91-V104 HydrophobicContact CB-CB 4.42Å; L91-V104 HydrophobicContact CB-CG1 3.67Å; L91-V104 HydrophobicContact CB-CG2 4.04Å; L91-V104 HydrophobicContact CD1-CG1 4.03Å; V92-V104 WeakPolarHBondContact O-CG2 3.37Å; S100-V104 PolarHBondContact O-N 3.22Å; F101-V104 WeakPolarHBondContact O-CB 3.5Å; F101-V104 PolarHBondContact O-N 2.98Å; F101-V104 VanDerWaalsContact O-N 3.15Å; D102-V104 VanDerWaalsContact C-N 3.33Å; D102-V104 PolarHBondContact O-N 3.42Å; V104-L107 PolarHBondContact O-N 3.14Å; V104-R108 WeakPolarHBondContact O-CB 3.26Å; V104-R108 PolarHBondContact O-N 3.44Å; V104-V126 HydrophobicContact CG1-CG1 3.97Å; V104-V126 HydrophobicContact CG1-CG2 4.21Å; V104-W152 HydrophobicContact CG1-CZ3 4.17Å
105	K	93.5	Very high	90.1	Very high	95 Å²	95	46.1 Å²	46.1	41%	0.413	24%	0.242	S	C	.	.	H	α-helix	trans	-62.1	-46.3	175.9	-176.4	-175.7	174.2	-169.4	0	111.4	F101 D102 Y103 R108 Q109 W152	F101-K105 PolarHBondContact O-N 3.36Å; D102-K105 WeakPolarHBondContact O-CB 3.38Å; D102-K105 PolarHBondContact O-N 2.85Å; D102-K105 VanDerWaalsContact O-N 3.15Å; Y103-K105 VanDerWaalsContact C-N 3.32Å; Y103-K105 PolarHBondContact O-N 3.06Å; K105-R108 PolarHBondContact O-N 2.83Å; K105-Q109 PolarHBondContact O-N 2.83Å; K105-Q109 VanDerWaalsContact O-N 3.17Å; K105-W152 HydrophobicContact CB-CH2 3.86Å; K105-W152 HydrophobicContact CB-CZ2 4.02Å; K105-W152 HydrophobicContact CD-CZ2 4.3Å; K105-W152 HydrophobicContact CG-CH2 4.2Å; K105-W152 HydrophobicContact CG-CZ2 3.85Å
106	A	89.1	Confident	88.7	Confident	31 Å²	31	49.4 Å²	49.4	26%	0.256	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-45.6	176.8	0	0	0	0	0	111.9	D102 Y103 R108 Q109 R110	D102-A106 PolarHBondContact O-N 2.9Å; Y103-A106 PolarHBondContact O-N 2.99Å; A106-R108 VanDerWaalsContact C-N 3.29Å; A106-R108 PolarHBondContact O-N 3.06Å; A106-Q109 PolarHBondContact O-N 3.26Å; A106-R110 PolarHBondContact O-N 3.45Å; A106-R110 VanDerWaalsContact O-N 3.09Å
107	L	88.8	Confident	87.3	Confident	3 Å²	3	53 Å²	53	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-55.9	-44	174.6	-78.1	-176.2	0	0	0	112.4	L10 V62 W75 L91 Y103 V104 Q109 R110 I111	L10-L107 HydrophobicContact CB-CD1 3.65Å; V62-L107 HydrophobicContact CB-CD2 3.82Å; V62-L107 HydrophobicContact CG1-CD2 4.15Å; V62-L107 HydrophobicContact CG2-CD2 3.62Å; W75-L107 HydrophobicContact CH2-CD2 4.45Å; W75-L107 HydrophobicContact CZ3-CD2 4.23Å; L91-L107 HydrophobicContact CD1-CB 4.49Å; L91-L107 HydrophobicContact CD2-CB 4.4Å; L91-L107 HydrophobicContact CD2-CD1 4.15Å; Y103-L107 HydrophobicContact CD1-CD1 3.71Å; Y103-L107 HydrophobicContact CD1-CG 3.78Å; Y103-L107 HydrophobicContact CE1-CD1 3.53Å; Y103-L107 HydrophobicContact CE1-CD2 3.95Å; Y103-L107 HydrophobicContact CE1-CG 3.59Å; Y103-L107 WeakPolarHBondContact O-CG 3.46Å; Y103-L107 PolarHBondContact O-N 2.89Å; V104-L107 PolarHBondContact O-N 3.14Å; L107-Q109 VanDerWaalsContact C-N 3.34Å; L107-Q109 PolarHBondContact O-N 2.96Å; L107-R110 PolarHBondContact O-N 3.22Å; L107-I111 VanDerWaalsContact O-CG1 3.31Å; L107-I111 WeakPolarHBondContact O-CG1 3.09Å; L107-I111 PolarHBondContact O-N 3.45Å
108	R	90.9	Very high	85.9	Confident	63 Å²	63	55.5 Å²	55.5	24%	0.238	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-41.4	179.6	-179.6	-92.7	166.9	-167.6	-5.7	111.7	L91 V104 K105 A106 A112 I124	L91-R108 HydrophobicContact CD1-CB 3.89Å; V104-R108 WeakPolarHBondContact O-CB 3.26Å; V104-R108 PolarHBondContact O-N 3.44Å; K105-R108 PolarHBondContact O-N 2.83Å; A106-R108 VanDerWaalsContact C-N 3.29Å; A106-R108 PolarHBondContact O-N 3.06Å; R108-A112 PolarHBondContact O-N 3.16Å; R108-I124 HydrophobicContact CG-CD1 4.11Å
109	Q	88.1	Confident	84.4	Confident	93 Å²	93	54.9 Å²	54.9	44%	0.435	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-47.6	176.8	-73.4	175.5	-42.6	0	0	110.6	K105 A106 L107 I111 A112 E113	K105-Q109 PolarHBondContact O-N 2.83Å; K105-Q109 VanDerWaalsContact O-N 3.17Å; A106-Q109 PolarHBondContact O-N 3.26Å; L107-Q109 VanDerWaalsContact C-N 3.34Å; L107-Q109 PolarHBondContact O-N 2.96Å; Q109-I111 PolarHBondContact O-N 2.79Å; Q109-A112 WeakPolarHBondContact O-CB 3.49Å; Q109-A112 PolarHBondContact O-N 3.05Å; Q109-E113 WeakPolarHBondContact O-CG 3.15Å; Q109-E113 PolarHBondContact O-N 3.44Å
110	R	82.7	Confident	83.2	Confident	35 Å²	35	53.9 Å²	53.9	13%	0.132	33%	0.326	C	S	.	.	H	α-helix	trans	-62	-41.7	179.4	-167.5	171.6	-172.7	-167.6	-1.4	113.6	P76 A106 L107 A112 E113 T114	P76-R110 PolarHBondContact O-NH2 3.33Å; A106-R110 PolarHBondContact O-N 3.45Å; A106-R110 VanDerWaalsContact O-N 3.09Å; L107-R110 PolarHBondContact O-N 3.22Å; R110-A112 PolarHBondContact O-N 3.26Å; R110-E113 PolarHBondContact O-N 2.79Å; R110-T114 PolarHBondContact O-N 2.85Å; R110-T114 PolarHBondContact O-OG1 3.01Å
111	I	85.1	Confident	82.3	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-59.3	-39.1	175	-70.2	162.2	0	0	0	110.6	L10 L83 F89 L91 L107 Q109 R115 I124	L10-I111 HydrophobicContact CD1-CD1 4.31Å; L83-I111 HydrophobicContact CD1-CG1 4.09Å; F89-I111 HydrophobicContact CB-CD1 4.37Å; F89-I111 HydrophobicContact CD1-CD1 3.81Å; F89-I111 HydrophobicContact CD1-CG1 4.44Å; F89-I111 HydrophobicContact CD2-CD1 4.36Å; F89-I111 HydrophobicContact CD2-CG2 3.98Å; F89-I111 HydrophobicContact CE1-CD1 4.21Å; F89-I111 HydrophobicContact CE1-CG1 4.35Å; F89-I111 HydrophobicContact CE2-CG2 3.67Å; F89-I111 HydrophobicContact CG-CD1 3.91Å; F89-I111 HydrophobicContact CZ-CG1 4.48Å; F89-I111 HydrophobicContact CZ-CG2 4.07Å; L91-I111 HydrophobicContact CD1-CD1 4.42Å; L91-I111 HydrophobicContact CD2-CD1 3.92Å; L107-I111 VanDerWaalsContact O-CG1 3.31Å; L107-I111 WeakPolarHBondContact O-CG1 3.09Å; L107-I111 PolarHBondContact O-N 3.45Å; Q109-I111 PolarHBondContact O-N 2.79Å; I111-R115 WeakPolarHBondContact O-CG 3.38Å; I111-I124 HydrophobicContact CB-CD1 4.5Å; I111-I124 HydrophobicContact CG2-CD1 4Å
112	A	83.6	Confident	81.8	Confident	47 Å²	47	58.1 Å²	58.1	39%	0.388	35%	0.347	S	S	.	.	H	α-helix	trans	-69.7	-38.2	177.9	0	0	0	0	0	112.3	R108 Q109 R110	R108-A112 PolarHBondContact O-N 3.16Å; Q109-A112 WeakPolarHBondContact O-CB 3.49Å; Q109-A112 PolarHBondContact O-N 3.05Å; R110-A112 PolarHBondContact O-N 3.26Å
113	E	81.9	Confident	81.7	Confident	147 Å²	147	54.2 Å²	54.2	69%	0.687	33%	0.327	S	S	*	.	H	α-helix	trans	-71.7	-31.9	-176.3	-74.1	163.4	-170.2	0	0	114	Q109 R110	Q109-E113 WeakPolarHBondContact O-CG 3.15Å; Q109-E113 PolarHBondContact O-N 3.44Å; R110-E113 PolarHBondContact O-N 2.79Å
114	T	75.9	Confident	81.9	Confident	32 Å²	32	54.3 Å²	54.3	20%	0.196	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	2.6	-174.6	-45.4	0	0	0	0	113.1	P78 W81 R110	P78-T114 HydrophobicContact CB-CG2 4.38Å; W81-T114 HydrophobicContact CD2-CG2 4.35Å; W81-T114 VanDerWaalsContact CE2-CG2 3.46Å; W81-T114 HydrophobicContact CE3-CG2 4.37Å; W81-T114 HydrophobicContact CH2-CG2 3.25Å; W81-T114 HydrophobicContact CZ2-CG2 3Å; W81-T114 WeakPolarHBondContact CZ2-OG1 3.43Å; W81-T114 HydrophobicContact CZ3-CG2 3.8Å; R110-T114 PolarHBondContact O-N 2.85Å; R110-T114 PolarHBondContact O-OG1 3.01Å
115	R	72.7	Confident	82.1	Confident	56 Å²	56	54.6 Å²	54.6	21%	0.211	33%	0.329	C	S	.	.	S	Bend	trans	-66.7	131	170	-81.7	-98.9	164.8	-173.7	-24.3	109.3	T86 I111 P120 A122	T86-R115 PolarHBondContact O-NH2 3.2Å; I111-R115 WeakPolarHBondContact O-CG 3.38Å; R115-P120 PolarHBondContact NH1-O 2.81Å; R115-A122 VanDerWaalsContact NH1-N 3.13Å
116	P	69.6	Low	82.3	Confident	69 Å²	69	50 Å²	50	45%	0.448	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-57.8	141	174.1	-22.3	31.8	0	0	0	111.4	G118 A119	P116-G118 PolarHBondContact O-N 3.2Å; P116-A119 HydrophobicContact CB-CB 4.31Å; P116-A119 WeakPolarHBondContact O-CB 3.45Å; P116-A119 PolarHBondContact O-N 3.41Å; P116-A119 VanDerWaalsContact O-N 3.12Å
117	A	69.2	Low	82.8	Confident	111 Å²	111	48.6 Å²	48.6	92%	0.917	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	127.8	174.9	0	0	0	0	0	110.4
118	G	67.5	Low	83.2	Confident	87 Å²	87	48.4 Å²	48.4	90%	0.897	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	-6.1	-179.7	0	0	0	0	0	115.9	P116	P116-G118 PolarHBondContact O-N 3.2Å
119	A	67.2	Low	83.6	Confident	43 Å²	43	45.6 Å²	45.6	36%	0.355	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-73.6	141.9	172.6	0	0	0	0	0	111.2	P116 E121	P116-A119 HydrophobicContact CB-CB 4.31Å; P116-A119 WeakPolarHBondContact O-CB 3.45Å; P116-A119 PolarHBondContact O-N 3.41Å; P116-A119 VanDerWaalsContact O-N 3.12Å; A119-E121 PolarHBondContact O-N 3.41Å
120	P	69.8	Low	84.1	Confident	97 Å²	97	43 Å²	43	63%	0.63	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-60	136.9	173.3	24	-31.6	0	0	0	110.7	R115 A122	R115-P120 PolarHBondContact NH1-O 2.81Å; P120-A122 PolarHBondContact O-N 3.16Å
121	E	77.3	Confident	84.8	Confident	99 Å²	99	43.5 Å²	43.5	46%	0.463	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-66	124.2	179.1	-165.5	178.7	-163.9	0	0	109.4	A119 R181	A119-E121 PolarHBondContact O-N 3.41Å; E121-R181 WeakPolarHBondContact O-CD 3.41Å; E121-R181 PolarHBondContact O-NH1 3.25Å
122	A	85.9	Confident	85.4	Confident	7 Å²	7	45.7 Å²	45.7	6%	0.058	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-68.6	141.6	173.2	0	0	0	0	0	110	F89 R115 P120 I124 R181	F89-A122 HydrophobicContact CD2-CB 3.99Å; F89-A122 HydrophobicContact CE2-CB 3.77Å; R115-A122 VanDerWaalsContact NH1-N 3.13Å; P120-A122 PolarHBondContact O-N 3.16Å; A122-I124 PolarHBondContact O-N 3.41Å; A122-R181 PolarHBondContact O-NH1 3.24Å
123	P	92.5	Very high	86.1	Confident	9 Å²	9	49.4 Å²	49.4	6%	0.058	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-63.3	134	175.4	28.3	-33.3	0	0	0	110.4	D87 A88 F89 C177 A178	D87-P123 VanDerWaalsContact O-CD 3.32Å; D87-P123 WeakPolarHBondContact O-CD 3.4Å; A88-P123 HydrophobicContact CB-CG 3.85Å; F89-P123 PolarHBondContact N-O 3.23Å; P123-C177 HydrophobicContact CB-CB 3.72Å; P123-C177 HydrophobicContact CG-CB 4.15Å; P123-A178 HydrophobicContact CG-CB 4.12Å
124	I	94.8	Very high	86.8	Confident	11 Å²	11	46.8 Å²	46.8	6%	0.056	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.5	172.5	-59.4	177.9	0	0	0	107.6	F89 L91 R108 I111 A122 V126 C154 G155	F89-I124 HydrophobicContact CB-CG1 4.18Å; F89-I124 HydrophobicContact CD2-CG1 4.15Å; F89-I124 WeakPolarHBondContact O-CA 3.37Å; L91-I124 HydrophobicContact CD1-CG2 3.56Å; L91-I124 HydrophobicContact CG-CG2 3.76Å; R108-I124 HydrophobicContact CG-CD1 4.11Å; I111-I124 HydrophobicContact CB-CD1 4.5Å; I111-I124 HydrophobicContact CG2-CD1 4Å; A122-I124 PolarHBondContact O-N 3.41Å; I124-V126 HydrophobicContact CG2-CG2 4.42Å; I124-C154 HydrophobicContact CB-CB 4.34Å; I124-C154 HydrophobicContact CG2-CB 4.38Å; I124-G155 PolarHBondContact O-N 2.99Å
125	L	97.9	Very high	87.8	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.026	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113	170.5	-179	60.1	0	0	0	109.2	F89 V90 L91 V127 L157 L170 L174	F89-L125 PolarHBondContact O-N 3.34Å; V90-L125 WeakPolarHBondContact CA-O 3.46Å; L91-L125 PolarHBondContact N-O 2.9Å; L125-V127 HydrophobicContact CD2-CG2 4.24Å; L125-V127 HydrophobicContact CG-CG2 3.91Å; L125-L157 HydrophobicContact CD1-CB 4.32Å; L125-L170 HydrophobicContact CD2-CD2 4.07Å; L125-L170 HydrophobicContact CD2-CG 3.91Å; L125-L170 WeakPolarHBondContact CD2-O 3.13Å; L125-L174 HydrophobicContact CB-CD1 3.78Å; L125-L174 HydrophobicContact CD2-CB 4.17Å
126	V	98.4	Very high	89	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	130.4	172.8	179.4	0	0	0	0	109.5	L91 Y93 V104 I124 V148 W152 C154 G155 Y156 L157	L91-V126 HydrophobicContact CB-CG2 4.49Å; L91-V126 CarbonylContact O-C 3.58Å; L91-V126 WeakPolarHBondContact O-CA 3.39Å; Y93-V126 HydrophobicContact CD1-CG1 4.02Å; Y93-V126 HydrophobicContact CE1-CG1 3.98Å; V104-V126 HydrophobicContact CG1-CG1 3.97Å; V104-V126 HydrophobicContact CG1-CG2 4.21Å; I124-V126 HydrophobicContact CG2-CG2 4.42Å; V126-V148 HydrophobicContact CB-CG1 3.79Å; V126-V148 HydrophobicContact CB-CG2 4.35Å; V126-V148 HydrophobicContact CG1-CG2 4.22Å; V126-V148 HydrophobicContact CG2-CG1 3.67Å; V126-V148 HydrophobicContact CG2-CG2 4.38Å; V126-W152 HydrophobicContact CG2-CE3 4.22Å; V126-W152 HydrophobicContact CG2-CZ3 4.19Å; V126-C154 HydrophobicContact CG2-CB 4.34Å; V126-G155 PolarHBondContact N-O 3.25Å; V126-Y156 HydrophobicContact CB-CD2 4.41Å; V126-Y156 HydrophobicContact CG1-CD2 4.3Å; V126-Y156 WeakPolarHBondContact O-CA 3.44Å; V126-L157 PolarHBondContact O-N 3.11Å
127	V	98.7	Very high	90.3	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	114	-171.8	179.6	0	0	0	0	110.7	I20 V90 L91 V92 Y93 L125 N129 L157 C159 L170	I20-V127 HydrophobicContact CD1-CG1 4.3Å; V90-V127 HydrophobicContact CG1-CB 4.31Å; V90-V127 HydrophobicContact CG1-CG2 3.64Å; L91-V127 PolarHBondContact O-N 2.8Å; V92-V127 WeakPolarHBondContact CA-O 3.34Å; V92-V127 HydrophobicContact CG2-CB 4.46Å; Y93-V127 VanDerWaalsContact CD1-O 3.29Å; Y93-V127 WeakPolarHBondContact CD1-O 3.39Å; Y93-V127 PolarHBondContact N-O 3.35Å; L125-V127 HydrophobicContact CD2-CG2 4.24Å; L125-V127 HydrophobicContact CG-CG2 3.91Å; V127-N129 PolarHBondContact O-N 2.97Å; V127-L157 CarbonylContact C-O 3.46Å; V127-L157 VanDerWaalsContact CA-O 3.29Å; V127-L157 WeakPolarHBondContact CA-O 3.38Å; V127-C159 HydrophobicContact CG1-CB 4.4Å; V127-C159 WeakPolarHBondContact CG1-SG 3.44Å; V127-L170 HydrophobicContact CB-CD1 4.25Å; V127-L170 HydrophobicContact CG1-CD1 3.65Å; V127-L170 HydrophobicContact CG2-CD1 3.65Å; V127-L170 HydrophobicContact CG2-CG 3.86Å
128	G	98.6	Very high	91.6	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	102.4	168.5	0	0	0	0	0	110.6	L157 E158 C159	G128-L157 PolarHBondContact N-O 2.91Å; G128-E158 CarbonylContact O-C 3.57Å; G128-E158 WeakPolarHBondContact O-CA 3.45Å; G128-E158 WeakPolarHBondContact O-CB 3.43Å; G128-C159 PolarHBondContact O-N 2.84Å
129	N	98.6	Very high	92.9	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.016	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	170.2	178.7	-167	28	0	0	0	111.9	V15 I20 V92 Y93 I95 V127 R131 C159 A161	V15-N129 PolarHBondContact O-ND2 3.17Å; I20-N129 HydrophobicContact CD1-CB 4.07Å; V92-N129 HydrophobicContact CG1-CB 3.83Å; Y93-N129 PolarHBondContact O-N 2.71Å; I95-N129 WeakPolarHBondContact CG1-O 3.24Å; I95-N129 WeakPolarHBondContact CG2-O 3.42Å; I95-N129 PolarHBondContact N-O 3.11Å; I95-N129 VanDerWaalsContact N-O 3.15Å; V127-N129 PolarHBondContact O-N 2.97Å; N129-R131 VanDerWaalsContact C-N 3.35Å; N129-C159 CarbonylContact C-O 3.53Å; N129-C159 WeakPolarHBondContact CA-O 3.3Å; N129-C159 PolarHBondContact OD1-O 2.83Å; N129-C159 PolarHBondContact OD1-SG 3.46Å; N129-C159 VanDerWaalsContact OD1-SG 3.36Å; N129-A161 PolarHBondContact OD1-N 3.29Å
130	K	97.9	Very high	94.4	Very high	40 Å²	40	56.2 Å²	56.2	17%	0.174	27%	0.268	C	S	.	.			trans	64.6	36.2	-177.9	-45.8	-169.5	-161.2	166.2	0	112.9	G14 D94 I95 D132 R133 C159	G14-K130 WeakPolarHBondContact O-CE 3.49Å; G14-K130 PolarHBondContact O-NZ 3.34Å; D94-K130 HydrophobicContact CB-CD 4.44Å; D94-K130 VanDerWaalsContact OD2-CD 3.26Å; D94-K130 WeakPolarHBondContact OD2-CD 3.3Å; D94-K130 VanDerWaalsContact OD2-CE 3.23Å; D94-K130 WeakPolarHBondContact OD2-CE 3.42Å; D94-K130 IonicContact OD2-NZ 3.14Å; D94-K130 PolarHBondContact OD2-NZ 2.87Å; I95-K130 WeakPolarHBondContact CD1-O 3.29Å; K130-D132 VanDerWaalsContact C-OD1 3.27Å; K130-D132 WeakPolarHBondContact CA-OD1 3.46Å; K130-D132 PolarHBondContact O-N 3.04Å; K130-R133 WeakPolarHBondContact O-CB 3.46Å; K130-R133 PolarHBondContact O-N 2.83Å; K130-C159 PolarHBondContact N-O 3.07Å
131	R	98.1	Very high	95.6	Very high	44 Å²	44	57 Å²	57	17%	0.166	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-52.7	-27.6	176.6	179.4	60.3	-177.4	173.9	11.1	113.6	N129 R133 Q134 E158 C159 W165	N129-R131 VanDerWaalsContact C-N 3.35Å; R131-R133 PolarHBondContact O-N 3.15Å; R131-R133 VanDerWaalsContact O-N 3.14Å; R131-Q134 VanDerWaalsContact O-CB 3.3Å; R131-Q134 WeakPolarHBondContact O-CB 3.47Å; R131-Q134 PolarHBondContact O-N 3Å; R131-E158 WeakPolarHBondContact CD-OE2 3.27Å; R131-E158 IonicContact CZ-OE2 4Å; R131-E158 VanDerWaalsContact CZ-OE2 3.29Å; R131-E158 IonicContact NE-OE2 3.36Å; R131-E158 PolarHBondContact NE-OE2 3.06Å; R131-E158 IonicContact NH1-OE2 2.97Å; R131-E158 PolarHBondContact NH1-OE2 3.27Å; R131-C159 VanDerWaalsContact CB-O 3.24Å; R131-C159 WeakPolarHBondContact CB-O 3.39Å; R131-C159 PolarHBondContact N-O 2.82Å; R131-W165 HydrophobicContact CB-CE3 4.18Å; R131-W165 HydrophobicContact CB-CZ3 4.11Å; R131-W165 HydrophobicContact CG-CE3 4.04Å; R131-W165 HydrophobicContact CG-CH2 4.31Å; R131-W165 HydrophobicContact CG-CZ3 3.67Å
132	D	97.9	Very high	96.6	Very high	53 Å²	53	62.8 Å²	62.8	28%	0.283	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-54.1	-26.7	171.6	47.4	-68.9	0	0	0	114.3	K130 S160 Y163	K130-D132 VanDerWaalsContact C-OD1 3.27Å; K130-D132 WeakPolarHBondContact CA-OD1 3.46Å; K130-D132 PolarHBondContact O-N 3.04Å; D132-S160 WeakPolarHBondContact OD1-CB 3.39Å; D132-S160 PolarHBondContact OD1-OG 2.71Å; D132-Y163 HydrophobicContact CB-CD2 3.62Å; D132-Y163 HydrophobicContact CB-CE2 3.41Å; D132-Y163 VanDerWaalsContact CB-CE2 3.41Å
133	R	97.4	Very high	97.1	Very high	125 Å²	125	65 Å²	65	47%	0.472	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-95.3	22.1	177.9	-56.6	-176.5	-179.7	-168.2	-5.1	113.3	C96 K130 R131 R135 L136	C96-R133 VanDerWaalsContact SG-CB 3.53Å; K130-R133 WeakPolarHBondContact O-CB 3.46Å; K130-R133 PolarHBondContact O-N 2.83Å; R131-R133 PolarHBondContact O-N 3.15Å; R131-R133 VanDerWaalsContact O-N 3.14Å; R133-R135 PolarHBondContact O-N 3.47Å; R133-L136 PolarHBondContact O-N 3.47Å
134	Q	97.1	Very high	97.4	Very high	91 Å²	91	65.4 Å²	65.4	43%	0.425	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-49.7	-23.5	-177	58.9	-179.9	-10.1	0	0	116.4	I95 R131 L136 R137	I95-Q134 HydrophobicContact CD1-CB 4.3Å; R131-Q134 VanDerWaalsContact O-CB 3.3Å; R131-Q134 WeakPolarHBondContact O-CB 3.47Å; R131-Q134 PolarHBondContact O-N 3Å; Q134-L136 VanDerWaalsContact C-N 3.31Å; Q134-R137 WeakPolarHBondContact O-CB 3.25Å; Q134-R137 WeakPolarHBondContact O-CD 3.42Å; Q134-R137 VanDerWaalsContact O-CG 3.29Å; Q134-R137 WeakPolarHBondContact O-CG 3.49Å
135	R	97.4	Very high	97.5	Very high	240 Å²	240	65.1 Å²	65.1	91%	0.906	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-70.1	-26.3	175.5	-66	-176	178	-178.9	-0.4	113.1	R133	R133-R135 PolarHBondContact O-N 3.47Å
136	L	97.1	Very high	97.5	Very high	126 Å²	126	66.8 Å²	66.8	66%	0.66	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-98.7	13.1	-179.3	-58.1	177.2	0	0	0	112.4	R133 Q134	R133-L136 PolarHBondContact O-N 3.47Å; Q134-L136 VanDerWaalsContact C-N 3.31Å
137	R	97.3	Very high	97.5	Very high	58 Å²	58	70.5 Å²	70.5	22%	0.219	33%	0.329	C	S	.	.			trans	-67.1	146.4	-174.9	75.1	-177.9	-48.6	178.6	11	111.5	I95 Q134 G139 R141 E158	I95-R137 HydrophobicContact CD1-CB 4.38Å; I95-R137 VanDerWaalsContact O-CA 3.28Å; I95-R137 WeakPolarHBondContact O-CA 3.33Å; Q134-R137 WeakPolarHBondContact O-CB 3.25Å; Q134-R137 WeakPolarHBondContact O-CD 3.42Å; Q134-R137 VanDerWaalsContact O-CG 3.29Å; Q134-R137 WeakPolarHBondContact O-CG 3.49Å; R137-G139 WeakPolarHBondContact CD-O 3.4Å; R137-G139 PolarHBondContact NE-O 3.33Å; R137-G139 PolarHBondContact NH2-O 3.32Å; R137-R141 VanDerWaalsContact NH2-CB 3.29Å; R137-E158 IonicContact CZ-OE1 3.63Å; R137-E158 IonicContact NH2-OE1 3.72Å; R137-E158 PolarHBondContact NH2-OE1 3.19Å
138	F	97	Very high	97.5	Very high	72 Å²	72	70.5 Å²	70.5	32%	0.316	33%	0.329	S	S	.	.	S	Bend	trans	-80	-22.3	-179.1	71.9	-98.9	0	0	0	113.9	Y93 I95 P98 F101 L144	Y93-F138 HydrophobicContact CD2-CE1 4.19Å; Y93-F138 AromaticContact CE2-CE1 3.9Å; Y93-F138 HydrophobicContact CE2-CE1 3.9Å; Y93-F138 HydrophobicContact CE2-CZ 4.21Å; I95-F138 WeakPolarHBondContact O-CD1 3.29Å; I95-F138 PolarHBondContact O-N 3.2Å; P98-F138 HydrophobicContact CB-CB 4.3Å; P98-F138 HydrophobicContact CB-CD1 4.27Å; P98-F138 HydrophobicContact CB-CD2 3.86Å; P98-F138 HydrophobicContact CB-CE2 4.22Å; P98-F138 HydrophobicContact CB-CG 3.9Å; P98-F138 HydrophobicContact CG-CB 4.29Å; P98-F138 HydrophobicContact CG-CG 4.38Å; F101-F138 HydrophobicContact CB-CE1 4.21Å; F101-F138 HydrophobicContact CB-CZ 3.74Å; F101-F138 HydrophobicContact CD1-CZ 4.5Å; F101-F138 HydrophobicContact CG-CZ 4.03Å; F138-L144 HydrophobicContact CE1-CD1 4.49Å; F138-L144 HydrophobicContact CE2-CD1 4.06Å; F138-L144 HydrophobicContact CE2-CD2 4.13Å; F138-L144 HydrophobicContact CZ-CD1 3.76Å; F138-L144 HydrophobicContact CZ-CD2 4.22Å
139	G	94.8	Very high	97.4	Very high	13 Å²	13	76.8 Å²	76.8	13%	0.134	35%	0.353	C	S	.	.	S	Bend	trans	-157.2	159.7	-173	0	0	0	0	0	114.5	R137 R141	R137-G139 WeakPolarHBondContact CD-O 3.4Å; R137-G139 PolarHBondContact NE-O 3.33Å; R137-G139 PolarHBondContact NH2-O 3.32Å; G139-R141 PolarHBondContact O-N 2.98Å
140	P	97	Very high	97.2	Very high	88 Å²	88	86.8 Å²	86.8	57%	0.571	39%	0.39	S	S	*	.			trans	-69.4	127.4	-174.7	24.2	-30.4	0	0	0	112.5	R142 A143 L144	P140-R142 PolarHBondContact O-N 3.05Å; P140-R142 VanDerWaalsContact O-N 3.11Å; P140-A143 HydrophobicContact CG-CB 3.87Å; P140-A143 PolarHBondContact O-N 3.26Å; P140-L144 PolarHBondContact O-N 3.14Å
141	R	96.8	Very high	97.1	Very high	112 Å²	112	87.4 Å²	87.4	42%	0.423	41%	0.409	S	S	.	.	H	α-helix	trans	-50.9	-43	-178.9	175.3	169.7	107	-174.7	6.8	112.1	R137 G139 A143 L144 A145 Y156 E158	R137-R141 VanDerWaalsContact NH2-CB 3.29Å; G139-R141 PolarHBondContact O-N 2.98Å; R141-A143 VanDerWaalsContact C-N 3.3Å; R141-A143 PolarHBondContact O-N 3.18Å; R141-L144 PolarHBondContact O-N 2.84Å; R141-A145 WeakPolarHBondContact O-CB 3.46Å; R141-A145 PolarHBondContact O-N 3.36Å; R141-Y156 HydrophobicContact CG-CE1 4.12Å; R141-E158 WeakPolarHBondContact CB-OE1 3.45Å; R141-E158 WeakPolarHBondContact CD-OE1 3.47Å; R141-E158 WeakPolarHBondContact CD-OE2 3.38Å; R141-E158 WeakPolarHBondContact CG-OE1 3.3Å
142	R	97.3	Very high	96.9	Very high	221 Å²	221	86.5 Å²	86.5	83%	0.834	41%	0.405	S	S	*	.	H	α-helix	trans	-63.3	-39	-175.1	-69.1	-174.8	179.4	173.9	0.2	111.3	P140 A146	P140-R142 PolarHBondContact O-N 3.05Å; P140-R142 VanDerWaalsContact O-N 3.11Å; R142-A146 VanDerWaalsContact O-CB 3.26Å; R142-A146 WeakPolarHBondContact O-CB 3.44Å; R142-A146 PolarHBondContact O-N 3.4Å
143	A	97.4	Very high	96.8	Very high	54 Å²	54	93.9 Å²	93.9	45%	0.446	43%	0.429	S	S	.	.	H	α-helix	trans	-68.5	-49.2	177.4	0	0	0	0	0	111.3	P140 R141 A145 A146 L147	P140-A143 HydrophobicContact CG-CB 3.87Å; P140-A143 PolarHBondContact O-N 3.26Å; R141-A143 VanDerWaalsContact C-N 3.3Å; R141-A143 PolarHBondContact O-N 3.18Å; A143-A145 VanDerWaalsContact C-N 3.33Å; A143-A145 PolarHBondContact O-N 3.22Å; A143-A146 PolarHBondContact O-N 2.99Å; A143-L147 WeakPolarHBondContact O-CB 3.4Å; A143-L147 PolarHBondContact O-N 2.92Å
144	L	97.5	Very high	96.7	Very high	17 Å²	17	88.4 Å²	88.4	9%	0.089	41%	0.41	C	S	.	.	H	α-helix	trans	-59.7	-44.6	177.4	-64.1	175.7	0	0	0	111.6	F101 F138 P140 R141 A146 L147 V148 Y156	F101-L144 HydrophobicContact CD1-CD2 4.31Å; F101-L144 HydrophobicContact CE1-CD2 3.9Å; F101-L144 HydrophobicContact CE2-CD2 4.19Å; F101-L144 HydrophobicContact CZ-CD2 3.84Å; F138-L144 HydrophobicContact CE1-CD1 4.49Å; F138-L144 HydrophobicContact CE2-CD1 4.06Å; F138-L144 HydrophobicContact CE2-CD2 4.13Å; F138-L144 HydrophobicContact CZ-CD1 3.76Å; F138-L144 HydrophobicContact CZ-CD2 4.22Å; P140-L144 PolarHBondContact O-N 3.14Å; R141-L144 PolarHBondContact O-N 2.84Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 2.8Å; L144-L147 PolarHBondContact O-N 2.77Å; L144-V148 VanDerWaalsContact O-CG2 3.31Å; L144-V148 WeakPolarHBondContact O-CG2 3.46Å; L144-V148 PolarHBondContact O-N 3.19Å; L144-Y156 HydrophobicContact CB-CE2 4.42Å
145	A	97.9	Very high	96.6	Very high	6 Å²	6	85.3 Å²	85.3	5%	0.05	40%	0.402	C	S	.	.	H	α-helix	trans	-64.8	-37.2	177.6	0	0	0	0	0	112.6	R141 A143 R149 Y156	R141-A145 WeakPolarHBondContact O-CB 3.46Å; R141-A145 PolarHBondContact O-N 3.36Å; A143-A145 VanDerWaalsContact C-N 3.33Å; A143-A145 PolarHBondContact O-N 3.22Å; A145-R149 VanDerWaalsContact O-CB 3.29Å; A145-R149 WeakPolarHBondContact O-CB 3.31Å; A145-R149 VanDerWaalsContact O-CG 3.3Å; A145-R149 WeakPolarHBondContact O-CG 3.2Å; A145-R149 PolarHBondContact O-N 3.03Å; A145-Y156 HydrophobicContact CB-CD1 3.51Å; A145-Y156 HydrophobicContact CB-CE1 3.65Å; A145-Y156 HydrophobicContact CB-CG 4.06Å
146	A	98.3	Very high	96.7	Very high	39 Å²	39	74.1 Å²	74.1	32%	0.322	36%	0.36	S	S	.	.	H	α-helix	trans	-67.9	-44	175.4	0	0	0	0	0	111.2	R142 A143 L144 R150	R142-A146 VanDerWaalsContact O-CB 3.26Å; R142-A146 WeakPolarHBondContact O-CB 3.44Å; R142-A146 PolarHBondContact O-N 3.4Å; A143-A146 PolarHBondContact O-N 2.99Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 2.8Å; A146-R150 VanDerWaalsContact O-CB 3.23Å; A146-R150 WeakPolarHBondContact O-CB 3.29Å; A146-R150 PolarHBondContact O-N 3.41Å
147	L	97.6	Very high	96.7	Very high	78 Å²	78	68.5 Å²	68.5	41%	0.408	33%	0.33	S	S	.	.	I	π-helix	trans	-57	-51.5	175.2	175.4	62.9	0	0	0	111.2	F101 A143 L144 G151 W152	F101-L147 HydrophobicContact CE1-CD2 4.03Å; F101-L147 HydrophobicContact CZ-CD2 4.11Å; A143-L147 WeakPolarHBondContact O-CB 3.4Å; A143-L147 PolarHBondContact O-N 2.92Å; L144-L147 PolarHBondContact O-N 2.77Å; L147-G151 CarbonylContact O-C 3.58Å; L147-G151 WeakPolarHBondContact O-CA 3.48Å; L147-G151 PolarHBondContact O-N 2.62Å; L147-W152 HydrophobicContact CD2-CZ2 4.03Å; L147-W152 HydrophobicContact CG-CZ2 4.23Å; L147-W152 PolarHBondContact O-N 3.5Å
148	V	97.9	Very high	96.8	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.322	C	S	.	.	I	π-helix	trans	-65.9	-48.4	-178.3	173.1	0	0	0	0	111.6	F101 V126 L144 W152 R153 C154 G155 Y156	F101-V148 HydrophobicContact CE2-CG2 4.18Å; F101-V148 HydrophobicContact CZ-CG2 4.15Å; V126-V148 HydrophobicContact CB-CG1 3.79Å; V126-V148 HydrophobicContact CB-CG2 4.35Å; V126-V148 HydrophobicContact CG1-CG2 4.22Å; V126-V148 HydrophobicContact CG2-CG1 3.67Å; V126-V148 HydrophobicContact CG2-CG2 4.38Å; L144-V148 VanDerWaalsContact O-CG2 3.31Å; L144-V148 WeakPolarHBondContact O-CG2 3.46Å; L144-V148 PolarHBondContact O-N 3.19Å; V148-W152 HydrophobicContact CB-CE3 4.33Å; V148-W152 HydrophobicContact CG1-CE3 4.32Å; V148-W152 HydrophobicContact CG2-CD2 4.36Å; V148-W152 HydrophobicContact CG2-CE3 3.78Å; V148-W152 HydrophobicContact CG2-CH2 4.41Å; V148-W152 HydrophobicContact CG2-CZ3 3.81Å; V148-W152 CarbonylContact O-C 3.51Å; V148-W152 WeakPolarHBondContact O-CA 3.46Å; V148-W152 WeakPolarHBondContact O-CB 3.33Å; V148-W152 PolarHBondContact O-N 3.33Å; V148-R153 PolarHBondContact O-N 3.27Å; V148-R153 VanDerWaalsContact O-N 3.12Å; V148-C154 HydrophobicContact CG1-CB 3.83Å; V148-C154 PolarHBondContact O-N 2.96Å; V148-C154 VanDerWaalsContact O-N 3.09Å; V148-G155 WeakPolarHBondContact CG1-O 3.38Å; V148-Y156 HydrophobicContact CB-CD2 3.96Å; V148-Y156 HydrophobicContact CB-CG 4.45Å; V148-Y156 HydrophobicContact CG1-CD2 4.12Å; V148-Y156 HydrophobicContact CG1-CG 4.49Å; V148-Y156 HydrophobicContact CG2-CD2 3.87Å; V148-Y156 HydrophobicContact CG2-CE2 4.42Å
149	R	97	Very high	96.9	Very high	133 Å²	133	62.6 Å²	62.6	50%	0.502	31%	0.307	S	S	.	.	I	π-helix	trans	-74.6	-39	-174.5	-67.3	-169.3	-172.4	111.5	-0.3	113.4	A145 R153 C154 Y156	A145-R149 VanDerWaalsContact O-CB 3.29Å; A145-R149 WeakPolarHBondContact O-CB 3.31Å; A145-R149 VanDerWaalsContact O-CG 3.3Å; A145-R149 WeakPolarHBondContact O-CG 3.2Å; A145-R149 PolarHBondContact O-N 3.03Å; R149-R153 WeakPolarHBondContact O-CA 3.38Å; R149-C154 WeakPolarHBondContact CA-O 3.46Å; R149-Y156 PolarHBondContact NH2-O 3.35Å
150	R	95.4	Very high	97	Very high	212 Å²	212	62.1 Å²	62.1	80%	0.8	30%	0.301	S	S	*	.	I	π-helix	trans	-96.6	-45.3	-174.9	-57.6	-179.1	176.2	-174.1	-2.6	111.8	A146	A146-R150 VanDerWaalsContact O-CB 3.23Å; A146-R150 WeakPolarHBondContact O-CB 3.29Å; A146-R150 PolarHBondContact O-N 3.41Å
151	G	94.9	Very high	97.1	Very high	54 Å²	54	58 Å²	58	56%	0.557	27%	0.274	S	S	*	.	I	π-helix	trans	-73.2	-50.8	179.5	0	0	0	0	0	111.9	L147	L147-G151 CarbonylContact O-C 3.58Å; L147-G151 WeakPolarHBondContact O-CA 3.48Å; L147-G151 PolarHBondContact O-N 2.62Å
152	W	94.8	Very high	97.1	Very high	24 Å²	24	57.4 Å²	57.4	9%	0.091	28%	0.275	C	S	.	.	S	Bend	trans	-94.2	-8.5	-175.8	-50.8	-11.3	0	0	0	113.8	F101 V104 K105 V126 L147 V148 C154	F101-W152 AromaticContact CE1-CH2 3.77Å; F101-W152 HydrophobicContact CE1-CH2 3.77Å; F101-W152 HydrophobicContact CE1-CZ2 4.1Å; F101-W152 HydrophobicContact CE2-CH2 4.04Å; F101-W152 HydrophobicContact CE2-CZ3 4.39Å; F101-W152 AromaticContact CZ-CH2 3.41Å; F101-W152 HydrophobicContact CZ-CH2 3.41Å; F101-W152 VanDerWaalsContact CZ-CH2 3.41Å; F101-W152 AromaticContact CZ-CZ2 3.98Å; F101-W152 HydrophobicContact CZ-CZ2 3.98Å; F101-W152 HydrophobicContact CZ-CZ3 4.11Å; V104-W152 HydrophobicContact CG1-CZ3 4.17Å; K105-W152 HydrophobicContact CB-CH2 3.86Å; K105-W152 HydrophobicContact CB-CZ2 4.02Å; K105-W152 HydrophobicContact CD-CZ2 4.3Å; K105-W152 HydrophobicContact CG-CH2 4.2Å; K105-W152 HydrophobicContact CG-CZ2 3.85Å; V126-W152 HydrophobicContact CG2-CE3 4.22Å; V126-W152 HydrophobicContact CG2-CZ3 4.19Å; L147-W152 HydrophobicContact CD2-CZ2 4.03Å; L147-W152 HydrophobicContact CG-CZ2 4.23Å; L147-W152 PolarHBondContact O-N 3.5Å; V148-W152 HydrophobicContact CB-CE3 4.33Å; V148-W152 HydrophobicContact CG1-CE3 4.32Å; V148-W152 HydrophobicContact CG2-CD2 4.36Å; V148-W152 HydrophobicContact CG2-CE3 3.78Å; V148-W152 HydrophobicContact CG2-CH2 4.41Å; V148-W152 HydrophobicContact CG2-CZ3 3.81Å; V148-W152 CarbonylContact O-C 3.51Å; V148-W152 WeakPolarHBondContact O-CA 3.46Å; V148-W152 WeakPolarHBondContact O-CB 3.33Å; V148-W152 PolarHBondContact O-N 3.33Å; W152-C154 HydrophobicContact CB-CB 4.37Å; W152-C154 PolarHBondContact O-N 2.85Å; W152-C154 PolarHBondContact O-SG 2.85Å
153	R	93.8	Very high	97.1	Very high	208 Å²	208	53.9 Å²	53.9	79%	0.785	26%	0.263	S	S	*	.			trans	54.7	30.9	-176.3	-56.2	-177.6	178.6	-153.9	-0.1	113.3	V148 R149	V148-R153 PolarHBondContact O-N 3.27Å; V148-R153 VanDerWaalsContact O-N 3.12Å; R149-R153 WeakPolarHBondContact O-CA 3.38Å
154	C	95.8	Very high	97	Very high	11 Å²	11	55.2 Å²	55.2	7%	0.074	26%	0.262	C	S	.	.			trans	-104.2	159.1	-179.7	-65.6	0	0	0	0	111.1	I124 V126 V148 R149 W152	I124-C154 HydrophobicContact CB-CB 4.34Å; I124-C154 HydrophobicContact CG2-CB 4.38Å; V126-C154 HydrophobicContact CG2-CB 4.34Å; V148-C154 HydrophobicContact CG1-CB 3.83Å; V148-C154 PolarHBondContact O-N 2.96Å; V148-C154 VanDerWaalsContact O-N 3.09Å; R149-C154 WeakPolarHBondContact CA-O 3.46Å; W152-C154 HydrophobicContact CB-CB 4.37Å; W152-C154 PolarHBondContact O-N 2.85Å; W152-C154 PolarHBondContact O-SG 2.85Å
155	G	96.6	Very high	97.1	Very high	25 Å²	25	59.2 Å²	59.2	26%	0.258	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	151.2	167.2	0	0	0	0	0	110.8	I124 V126 V148	I124-G155 PolarHBondContact O-N 2.99Å; V126-G155 PolarHBondContact N-O 3.25Å; V148-G155 WeakPolarHBondContact CG1-O 3.38Å
156	Y	98.3	Very high	97.1	Very high	5 Å²	5	61.2 Å²	61.2	2%	0.02	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131	173.9	-179.5	-90.2	0	0	0	110.9	Y93 V126 R141 L144 A145 V148 R149 E158	Y93-Y156 HydrophobicContact CE1-CE2 4.15Å; Y93-Y156 PolarHBondContact OH-OH 3.21Å; V126-Y156 HydrophobicContact CB-CD2 4.41Å; V126-Y156 HydrophobicContact CG1-CD2 4.3Å; V126-Y156 WeakPolarHBondContact O-CA 3.44Å; R141-Y156 HydrophobicContact CG-CE1 4.12Å; L144-Y156 HydrophobicContact CB-CE2 4.42Å; A145-Y156 HydrophobicContact CB-CD1 3.51Å; A145-Y156 HydrophobicContact CB-CE1 3.65Å; A145-Y156 HydrophobicContact CB-CG 4.06Å; V148-Y156 HydrophobicContact CB-CD2 3.96Å; V148-Y156 HydrophobicContact CB-CG 4.45Å; V148-Y156 HydrophobicContact CG1-CD2 4.12Å; V148-Y156 HydrophobicContact CG1-CG 4.49Å; V148-Y156 HydrophobicContact CG2-CD2 3.87Å; V148-Y156 HydrophobicContact CG2-CE2 4.42Å; R149-Y156 PolarHBondContact NH2-O 3.35Å; Y156-E158 HydrophobicContact CE1-CG 3.96Å; Y156-E158 WeakPolarHBondContact OH-CG 3.49Å; Y156-E158 PolarHBondContact OH-OE1 3.35Å
157	L	98.2	Very high	97.1	Very high	8 Å²	8	59.4 Å²	59.4	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	153.8	173.9	-179.2	138.4	0	0	0	110.1	L125 V126 V127 G128 C159 H166 R169 L170	L125-L157 HydrophobicContact CD1-CB 4.32Å; V126-L157 PolarHBondContact O-N 3.11Å; V127-L157 CarbonylContact C-O 3.46Å; V127-L157 VanDerWaalsContact CA-O 3.29Å; V127-L157 WeakPolarHBondContact CA-O 3.38Å; G128-L157 PolarHBondContact N-O 2.91Å; L157-C159 HydrophobicContact CD2-CB 4.03Å; L157-H166 HydrophobicContact CD1-CB 4.49Å; L157-H166 HydrophobicContact CD2-CB 4.01Å; L157-R169 HydrophobicContact CD1-CB 4.44Å; L157-R169 HydrophobicContact CD1-CG 3.82Å; L157-L170 HydrophobicContact CD2-CB 4.05Å; L157-L170 HydrophobicContact CD2-CG 4.49Å
158	E	98.5	Very high	97	Very high	7 Å²	7	59.2 Å²	59.2	3%	0.033	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143	166.3	-71	177.7	-174.5	0	0	108.6	I95 G128 R131 R137 R141 Y156 W165 H166	I95-E158 HydrophobicContact CG2-CG 4.42Å; G128-E158 CarbonylContact O-C 3.57Å; G128-E158 WeakPolarHBondContact O-CA 3.45Å; G128-E158 WeakPolarHBondContact O-CB 3.43Å; R131-E158 WeakPolarHBondContact CD-OE2 3.27Å; R131-E158 IonicContact CZ-OE2 4Å; R131-E158 VanDerWaalsContact CZ-OE2 3.29Å; R131-E158 IonicContact NE-OE2 3.36Å; R131-E158 PolarHBondContact NE-OE2 3.06Å; R131-E158 IonicContact NH1-OE2 2.97Å; R131-E158 PolarHBondContact NH1-OE2 3.27Å; R137-E158 IonicContact CZ-OE1 3.63Å; R137-E158 IonicContact NH2-OE1 3.72Å; R137-E158 PolarHBondContact NH2-OE1 3.19Å; R141-E158 WeakPolarHBondContact CB-OE1 3.45Å; R141-E158 WeakPolarHBondContact CD-OE1 3.47Å; R141-E158 WeakPolarHBondContact CD-OE2 3.38Å; R141-E158 WeakPolarHBondContact CG-OE1 3.3Å; Y156-E158 HydrophobicContact CE1-CG 3.96Å; Y156-E158 WeakPolarHBondContact OH-CG 3.49Å; Y156-E158 PolarHBondContact OH-OE1 3.35Å; E158-W165 HydrophobicContact CB-CZ3 4.39Å; E158-W165 WeakPolarHBondContact O-CZ3 3.46Å; E158-H166 PolarHBondContact O-ND1 3.26Å
159	C	98.6	Very high	96.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	29%	0.291	C	S	.	.			trans	-137.3	166.1	178.7	69.9	0	0	0	0	111.8	V127 G128 N129 K130 R131 L157 W165 H166	V127-C159 HydrophobicContact CG1-CB 4.4Å; V127-C159 WeakPolarHBondContact CG1-SG 3.44Å; G128-C159 PolarHBondContact O-N 2.84Å; N129-C159 CarbonylContact C-O 3.53Å; N129-C159 WeakPolarHBondContact CA-O 3.3Å; N129-C159 PolarHBondContact OD1-O 2.83Å; N129-C159 PolarHBondContact OD1-SG 3.46Å; N129-C159 VanDerWaalsContact OD1-SG 3.36Å; K130-C159 PolarHBondContact N-O 3.07Å; R131-C159 VanDerWaalsContact CB-O 3.24Å; R131-C159 WeakPolarHBondContact CB-O 3.39Å; R131-C159 PolarHBondContact N-O 2.82Å; L157-C159 HydrophobicContact CD2-CB 4.03Å; C159-W165 VanDerWaalsContact CA-O 3.29Å; C159-W165 WeakPolarHBondContact CA-O 3.14Å; C159-W165 VanDerWaalsContact CB-O 3.26Å; C159-W165 WeakPolarHBondContact CB-O 3.45Å; C159-H166 HydrophobicContact CB-CB 4.21Å
160	S	98.4	Very high	96.9	Very high	3 Å²	3	58.9 Å²	58.9	2%	0.021	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-127.8	109.2	162.7	175.7	0	0	0	0	107.8	D132 K162 Y163 N164 W165	D132-S160 WeakPolarHBondContact OD1-CB 3.39Å; D132-S160 PolarHBondContact OD1-OG 2.71Å; S160-K162 PolarHBondContact O-N 3.27Å; S160-K162 PolarHBondContact OG-N 3.19Å; S160-Y163 PolarHBondContact O-N 3.36Å; S160-Y163 PolarHBondContact OG-N 3Å; S160-N164 PolarHBondContact O-N 2.87Å; S160-N164 VanDerWaalsContact O-N 3.14Å; S160-W165 PolarHBondContact N-O 3.48Å; S160-W165 PolarHBondContact O-N 3.32Å
161	A	97.8	Very high	96.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-41.2	171.1	0	0	0	0	0	110.9	A19 I20 Q23 Y29 N129 Y163 N164	A19-A161 HydrophobicContact CB-CB 3.86Å; I20-A161 HydrophobicContact CG1-CB 3.95Å; Q23-A161 WeakPolarHBondContact CG-O 3.28Å; Q23-A161 PolarHBondContact OE1-O 3.24Å; Y29-A161 HydrophobicContact CD2-CB 4.01Å; Y29-A161 HydrophobicContact CE2-CB 4.12Å; N129-A161 PolarHBondContact OD1-N 3.29Å; A161-Y163 VanDerWaalsContact C-N 3.31Å; A161-Y163 PolarHBondContact O-N 2.88Å; A161-N164 PolarHBondContact O-N 2.95Å; A161-N164 VanDerWaalsContact O-N 3.16Å
162	K	96.6	Very high	96.8	Very high	99 Å²	99	50.4 Å²	50.4	43%	0.43	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-41.7	-179.2	-176	-179.1	179.1	-174	0	113.6	Y29 S160	Y29-K162 HydrophobicContact CD1-CB 4.48Å; Y29-K162 HydrophobicContact CD1-CG 4.3Å; Y29-K162 HydrophobicContact CD2-CB 4.26Å; Y29-K162 HydrophobicContact CE1-CB 4.27Å; Y29-K162 HydrophobicContact CE1-CG 4.12Å; Y29-K162 HydrophobicContact CE2-CB 4.01Å; Y29-K162 HydrophobicContact CG-CB 4.49Å; S160-K162 PolarHBondContact O-N 3.27Å; S160-K162 PolarHBondContact OG-N 3.19Å
163	Y	97	Very high	96.8	Very high	148 Å²	148	52 Å²	52	58%	0.58	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.8	17.2	-178.2	-64.1	-65.7	0	0	0	113.3	D132 S160 A161 W165	D132-Y163 HydrophobicContact CB-CD2 3.62Å; D132-Y163 HydrophobicContact CB-CE2 3.41Å; D132-Y163 VanDerWaalsContact CB-CE2 3.41Å; S160-Y163 PolarHBondContact O-N 3.36Å; S160-Y163 PolarHBondContact OG-N 3Å; A161-Y163 VanDerWaalsContact C-N 3.31Å; A161-Y163 PolarHBondContact O-N 2.88Å; Y163-W165 PolarHBondContact O-N 3.49Å
164	N	97.3	Very high	96.8	Very high	81 Å²	81	42.2 Å²	42.2	43%	0.433	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	28.2	-174.4	-160.2	6.6	0	0	0	113.9	Q23 S160 A161 H166 V167	Q23-N164 HydrophobicContact CG-CB 3.91Å; Q23-N164 WeakPolarHBondContact CG-OD1 3.28Å; Q23-N164 VanDerWaalsContact NE2-CB 3.32Å; Q23-N164 VanDerWaalsContact NE2-CG 3.25Å; Q23-N164 PolarHBondContact NE2-ND2 2.97Å; S160-N164 PolarHBondContact O-N 2.87Å; S160-N164 VanDerWaalsContact O-N 3.14Å; A161-N164 PolarHBondContact O-N 2.95Å; A161-N164 VanDerWaalsContact O-N 3.16Å; N164-H166 PolarHBondContact O-N 2.74Å; N164-V167 WeakPolarHBondContact OD1-CB 3.44Å
165	W	98.3	Very high	96.6	Very high	101 Å²	101	41.9 Å²	41.9	38%	0.383	19%	0.188	S	C	.	.	B	Isolated β-bridge	trans	-86.7	119.7	-172.8	-173.9	80.7	0	0	0	109.7	R131 E158 C159 S160 Y163 V167	R131-W165 HydrophobicContact CB-CE3 4.18Å; R131-W165 HydrophobicContact CB-CZ3 4.11Å; R131-W165 HydrophobicContact CG-CE3 4.04Å; R131-W165 HydrophobicContact CG-CH2 4.31Å; R131-W165 HydrophobicContact CG-CZ3 3.67Å; E158-W165 HydrophobicContact CB-CZ3 4.39Å; E158-W165 WeakPolarHBondContact O-CZ3 3.46Å; C159-W165 VanDerWaalsContact CA-O 3.29Å; C159-W165 WeakPolarHBondContact CA-O 3.14Å; C159-W165 VanDerWaalsContact CB-O 3.26Å; C159-W165 WeakPolarHBondContact CB-O 3.45Å; S160-W165 PolarHBondContact N-O 3.48Å; S160-W165 PolarHBondContact O-N 3.32Å; Y163-W165 PolarHBondContact O-N 3.49Å; W165-V167 PolarHBondContact O-N 3.37Å
166	H	98.3	Very high	96.3	Very high	49 Å²	49	44.6 Å²	44.6	23%	0.227	19%	0.19	C	C	.	.	S	Bend	trans	62.6	9.2	-176.7	-67.7	174.7	0	0	0	116.8	L157 E158 C159 N164 R169 L170	L157-H166 HydrophobicContact CD1-CB 4.49Å; L157-H166 HydrophobicContact CD2-CB 4.01Å; E158-H166 PolarHBondContact O-ND1 3.26Å; C159-H166 HydrophobicContact CB-CB 4.21Å; N164-H166 PolarHBondContact O-N 2.74Å; H166-R169 HydrophobicContact CB-CB 4.28Å; H166-R169 PolarHBondContact NE2-NH1 3.44Å; H166-R169 PolarHBondContact O-N 2.96Å; H166-L170 WeakPolarHBondContact O-CB 3.49Å; H166-L170 PolarHBondContact O-N 2.93Å
167	V	97.8	Very high	95.8	Very high	0 Å²	0	47 Å²	47	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-49.1	178.8	175.9	0	0	0	0	111.3	I20 Q23 F24 N164 W165 R169 L170 F171	I20-V167 HydrophobicContact CG2-CG1 4.41Å; Q23-V167 HydrophobicContact CB-CG1 4.19Å; Q23-V167 HydrophobicContact CB-CG2 4.34Å; Q23-V167 HydrophobicContact CG-CB 4.37Å; Q23-V167 HydrophobicContact CG-CG1 4.28Å; Q23-V167 HydrophobicContact CG-CG2 3.97Å; F24-V167 HydrophobicContact CB-CG1 3.75Å; N164-V167 WeakPolarHBondContact OD1-CB 3.44Å; W165-V167 PolarHBondContact O-N 3.37Å; V167-R169 VanDerWaalsContact C-N 3.3Å; V167-R169 PolarHBondContact O-N 3.29Å; V167-L170 WeakPolarHBondContact O-CB 3.19Å; V167-L170 PolarHBondContact O-N 3.15Å; V167-F171 HydrophobicContact CG1-CD2 4.49Å; V167-F171 HydrophobicContact CG1-CE2 4.43Å; V167-F171 WeakPolarHBondContact O-CD2 3.4Å; V167-F171 PolarHBondContact O-N 3.15Å
168	L	95.5	Very high	95.3	Very high	75 Å²	75	46.9 Å²	46.9	39%	0.393	21%	0.207	S	C	.	.	H	α-helix	trans	-62.7	-37.7	175	-177.9	61.7	0	0	0	112.3	F24 L170 F171 R172	F24-L168 HydrophobicContact CD2-CD1 4.49Å; F24-L168 HydrophobicContact CE2-CD1 4.01Å; L168-L170 VanDerWaalsContact C-N 3.35Å; L168-L170 PolarHBondContact O-N 2.99Å; L168-F171 PolarHBondContact O-N 2.98Å; L168-R172 WeakPolarHBondContact O-CB 3.38Å; L168-R172 PolarHBondContact O-N 3.34Å
169	R	96.4	Very high	94.7	Very high	125 Å²	125	48.3 Å²	48.3	47%	0.472	22%	0.215	S	C	.	.	H	α-helix	trans	-62.6	-42.1	178.4	-179.9	-178.6	172.9	169.9	6.4	111.5	L157 H166 V167 R172 E173	L157-R169 HydrophobicContact CD1-CB 4.44Å; L157-R169 HydrophobicContact CD1-CG 3.82Å; H166-R169 HydrophobicContact CB-CB 4.28Å; H166-R169 PolarHBondContact NE2-NH1 3.44Å; H166-R169 PolarHBondContact O-N 2.96Å; V167-R169 VanDerWaalsContact C-N 3.3Å; V167-R169 PolarHBondContact O-N 3.29Å; R169-R172 PolarHBondContact O-N 3.48Å; R169-E173 IonicContact NE-OE2 3.94Å; R169-E173 WeakPolarHBondContact O-CB 3.14Å; R169-E173 PolarHBondContact O-N 3.01Å
170	L	96.6	Very high	93.8	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-54.1	-56.7	176.2	-179.9	173.2	0	0	0	110.5	I20 V90 L125 V127 L157 H166 V167 L168 R172 E173 L174	I20-L170 HydrophobicContact CG2-CD1 3.96Å; V90-L170 HydrophobicContact CG1-CD2 4.16Å; V90-L170 HydrophobicContact CG2-CD2 4.04Å; L125-L170 HydrophobicContact CD2-CD2 4.07Å; L125-L170 HydrophobicContact CD2-CG 3.91Å; L125-L170 WeakPolarHBondContact CD2-O 3.13Å; V127-L170 HydrophobicContact CB-CD1 4.25Å; V127-L170 HydrophobicContact CG1-CD1 3.65Å; V127-L170 HydrophobicContact CG2-CD1 3.65Å; V127-L170 HydrophobicContact CG2-CG 3.86Å; L157-L170 HydrophobicContact CD2-CB 4.05Å; L157-L170 HydrophobicContact CD2-CG 4.49Å; H166-L170 WeakPolarHBondContact O-CB 3.49Å; H166-L170 PolarHBondContact O-N 2.93Å; V167-L170 WeakPolarHBondContact O-CB 3.19Å; V167-L170 PolarHBondContact O-N 3.15Å; L168-L170 VanDerWaalsContact C-N 3.35Å; L168-L170 PolarHBondContact O-N 2.99Å; L170-R172 PolarHBondContact O-N 2.89Å; L170-E173 PolarHBondContact O-N 3.09Å; L170-L174 WeakPolarHBondContact O-CB 3.26Å; L170-L174 PolarHBondContact O-N 3.41Å
171	F	95.1	Very high	92.4	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.009	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-39.9	-177.9	-77.4	-81.7	0	0	0	111.5	I20 F24 I57 V167 L168 E173 L174 L175	I20-F171 HydrophobicContact CG2-CE2 3.89Å; I20-F171 HydrophobicContact CG2-CZ 4.38Å; F24-F171 HydrophobicContact CB-CD2 3.74Å; F24-F171 HydrophobicContact CB-CE2 3.44Å; F24-F171 VanDerWaalsContact CB-CE2 3.44Å; F24-F171 HydrophobicContact CB-CZ 4.2Å; F24-F171 HydrophobicContact CD1-CD1 4.07Å; F24-F171 AromaticContact CD1-CD2 3.76Å; F24-F171 HydrophobicContact CD1-CD2 3.76Å; F24-F171 HydrophobicContact CD1-CE1 4.06Å; F24-F171 AromaticContact CD1-CE2 3.76Å; F24-F171 HydrophobicContact CD1-CE2 3.76Å; F24-F171 AromaticContact CD1-CG 3.93Å; F24-F171 HydrophobicContact CD1-CG 3.93Å; F24-F171 AromaticContact CD1-CZ 3.9Å; F24-F171 HydrophobicContact CD1-CZ 3.9Å; F24-F171 HydrophobicContact CD2-CB 4.08Å; F24-F171 AromaticContact CD2-CD2 3.46Å; F24-F171 HydrophobicContact CD2-CD2 3.46Å; F24-F171 VanDerWaalsContact CD2-CD2 3.46Å; F24-F171 HydrophobicContact CD2-CE2 4.09Å; F24-F171 AromaticContact CD2-CG 3.86Å; F24-F171 HydrophobicContact CD2-CG 3.86Å; F24-F171 HydrophobicContact CE1-CB 4.36Å; F24-F171 AromaticContact CE1-CD1 3.93Å; F24-F171 HydrophobicContact CE1-CD1 3.93Å; F24-F171 HydrophobicContact CE1-CD2 4.21Å; F24-F171 HydrophobicContact CE1-CE1 4.26Å; F24-F171 AromaticContact CE1-CG 3.9Å; F24-F171 HydrophobicContact CE1-CG 3.9Å; F24-F171 HydrophobicContact CE2-CB 3.65Å; F24-F171 AromaticContact CE2-CD2 3.94Å; F24-F171 HydrophobicContact CE2-CD2 3.94Å; F24-F171 AromaticContact CE2-CG 3.83Å; F24-F171 HydrophobicContact CE2-CG 3.83Å; F24-F171 HydrophobicContact CG-CD1 4.48Å; F24-F171 AromaticContact CG-CD2 3.36Å; F24-F171 HydrophobicContact CG-CD2 3.36Å; F24-F171 AromaticContact CG-CE2 3.49Å; F24-F171 HydrophobicContact CG-CE2 3.49Å; F24-F171 VanDerWaalsContact CG-CE2 3.49Å; F24-F171 AromaticContact CG-CG 3.91Å; F24-F171 HydrophobicContact CG-CG 3.91Å; F24-F171 HydrophobicContact CG-CZ 4.12Å; F24-F171 HydrophobicContact CZ-CB 3.8Å; F24-F171 HydrophobicContact CZ-CD1 4.22Å; F24-F171 HydrophobicContact CZ-CD2 4.27Å; F24-F171 AromaticContact CZ-CG 3.84Å; F24-F171 HydrophobicContact CZ-CG 3.84Å; I57-F171 HydrophobicContact CD1-CE1 3.88Å; I57-F171 HydrophobicContact CD1-CZ 4.45Å; V167-F171 HydrophobicContact CG1-CD2 4.49Å; V167-F171 HydrophobicContact CG1-CE2 4.43Å; V167-F171 WeakPolarHBondContact O-CD2 3.4Å; V167-F171 PolarHBondContact O-N 3.15Å; L168-F171 PolarHBondContact O-N 2.98Å; F171-E173 PolarHBondContact O-N 2.7Å; F171-L174 PolarHBondContact O-N 2.81Å; F171-L175 WeakPolarHBondContact O-CB 3.23Å; F171-L175 WeakPolarHBondContact O-CG 3.37Å; F171-L175 PolarHBondContact O-N 3.32Å
172	R	93.8	Very high	90.8	Very high	86 Å²	86	61.5 Å²	61.5	33%	0.325	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-43.2	175.1	-168.2	-179.8	73.4	165	2.3	112.7	L48 L168 R169 L170 R176	L48-R172 HydrophobicContact CD1-CG 3.85Å; L168-R172 WeakPolarHBondContact O-CB 3.38Å; L168-R172 PolarHBondContact O-N 3.34Å; R169-R172 PolarHBondContact O-N 3.48Å; L170-R172 PolarHBondContact O-N 2.89Å; R172-R176 WeakPolarHBondContact O-CB 3.2Å; R172-R176 VanDerWaalsContact O-CG 3.31Å; R172-R176 WeakPolarHBondContact O-CG 3.34Å; R172-R176 PolarHBondContact O-N 2.99Å; R172-R176 VanDerWaalsContact O-N 3.14Å
173	E	94	Very high	88.7	Confident	58 Å²	58	66.1 Å²	66.1	27%	0.271	30%	0.303	S	S	.	.	H	α-helix	trans	-67.5	-43.5	179.4	-170	168.1	158.6	0	0	111.3	R169 L170 F171 C177	R169-E173 IonicContact NE-OE2 3.94Å; R169-E173 WeakPolarHBondContact O-CB 3.14Å; R169-E173 PolarHBondContact O-N 3.01Å; L170-E173 PolarHBondContact O-N 3.09Å; F171-E173 PolarHBondContact O-N 2.7Å; E173-C177 PolarHBondContact O-N 2.86Å; E173-C177 VanDerWaalsContact O-N 3.15Å; E173-C177 PolarHBondContact O-SG 3.26Å
174	L	94	Very high	86.1	Confident	3 Å²	3	64 Å²	64	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-58.8	-51.8	175.5	-175.1	77.6	0	0	0	112	V7 A88 F89 V90 L125 L170 F171 R176 C177 A178	V7-L174 HydrophobicContact CB-CD2 4.38Å; V7-L174 HydrophobicContact CG1-CD2 3.53Å; V7-L174 HydrophobicContact CG2-CD2 3.89Å; A88-L174 HydrophobicContact CB-CD1 3.85Å; A88-L174 HydrophobicContact CB-CD2 4.24Å; A88-L174 HydrophobicContact CB-CG 3.93Å; F89-L174 WeakPolarHBondContact O-CD1 3.49Å; V90-L174 HydrophobicContact CG2-CD1 3.99Å; V90-L174 HydrophobicContact CG2-CD2 3.44Å; V90-L174 VanDerWaalsContact CG2-CD2 3.44Å; V90-L174 HydrophobicContact CG2-CG 4.27Å; L125-L174 HydrophobicContact CB-CD1 3.78Å; L125-L174 HydrophobicContact CD2-CB 4.17Å; L170-L174 WeakPolarHBondContact O-CB 3.26Å; L170-L174 PolarHBondContact O-N 3.41Å; F171-L174 PolarHBondContact O-N 2.81Å; L174-R176 PolarHBondContact O-N 2.57Å; L174-C177 WeakPolarHBondContact O-CB 3.32Å; L174-C177 PolarHBondContact O-N 2.92Å; L174-A178 PolarHBondContact O-N 2.98Å
175	L	91.7	Very high	83.5	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-65.3	-38.9	-175.8	-66.4	173.2	0	0	0	111.8	L5 V46 L48 L55 F171 C177 A178 L179	L5-L175 HydrophobicContact CD1-CD2 3.69Å; V46-L175 HydrophobicContact CG2-CD1 3.88Å; L48-L175 HydrophobicContact CD2-CB 3.55Å; L48-L175 HydrophobicContact CD2-CD1 4.34Å; L55-L175 HydrophobicContact CD1-CD1 4.04Å; L55-L175 HydrophobicContact CD1-CD2 4.13Å; L55-L175 HydrophobicContact CD2-CD1 4.34Å; L55-L175 HydrophobicContact CD2-CD2 3.42Å; L55-L175 VanDerWaalsContact CD2-CD2 3.42Å; L55-L175 HydrophobicContact CG-CD2 4.44Å; F171-L175 WeakPolarHBondContact O-CB 3.23Å; F171-L175 WeakPolarHBondContact O-CG 3.37Å; F171-L175 PolarHBondContact O-N 3.32Å; L175-C177 VanDerWaalsContact C-N 3.34Å; L175-C177 PolarHBondContact O-N 2.89Å; L175-A178 PolarHBondContact O-N 2.81Å; L175-L179 WeakPolarHBondContact O-CB 3.37Å; L175-L179 VanDerWaalsContact O-CG 3.28Å; L175-L179 WeakPolarHBondContact O-CG 3.27Å; L175-L179 PolarHBondContact O-N 3.5Å
176	R	90.6	Very high	80.7	Confident	81 Å²	81	67.1 Å²	67.1	31%	0.306	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-43.6	173.6	-77.1	177.7	173.9	168.5	-0.5	111.9	L48 D49 R172 L174 A178 L179 V180	L48-R176 HydrophobicContact CD1-CG 4.36Å; L48-R176 HydrophobicContact CD2-CG 4.28Å; D49-R176 IonicContact OD1-CZ 3.75Å; D49-R176 IonicContact OD1-NE 3.79Å; D49-R176 IonicContact OD1-NH2 2.84Å; D49-R176 PolarHBondContact OD1-NH2 2.96Å; D49-R176 IonicContact OD2-CZ 3.92Å; D49-R176 IonicContact OD2-NE 3.26Å; D49-R176 PolarHBondContact OD2-NE 3.28Å; D49-R176 IonicContact OD2-NH2 3.69Å; R172-R176 WeakPolarHBondContact O-CB 3.2Å; R172-R176 VanDerWaalsContact O-CG 3.31Å; R172-R176 WeakPolarHBondContact O-CG 3.34Å; R172-R176 PolarHBondContact O-N 2.99Å; R172-R176 VanDerWaalsContact O-N 3.14Å; L174-R176 PolarHBondContact O-N 2.57Å; R176-A178 VanDerWaalsContact C-N 3.33Å; R176-A178 PolarHBondContact O-N 3.34Å; R176-L179 PolarHBondContact O-N 3.19Å; R176-V180 VanDerWaalsContact O-CG2 3.28Å; R176-V180 WeakPolarHBondContact O-CG2 3.11Å; R176-V180 PolarHBondContact O-N 3.13Å; R176-V180 VanDerWaalsContact O-N 3.08Å
177	C	88.3	Confident	77.7	Confident	57 Å²	57	70.5 Å²	70.5	39%	0.385	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-39.8	175.6	-70.3	0	0	0	0	112.1	P123 E173 L174 L175 R181	P123-C177 HydrophobicContact CB-CB 3.72Å; P123-C177 HydrophobicContact CG-CB 4.15Å; E173-C177 PolarHBondContact O-N 2.86Å; E173-C177 VanDerWaalsContact O-N 3.15Å; E173-C177 PolarHBondContact O-SG 3.26Å; L174-C177 WeakPolarHBondContact O-CB 3.32Å; L174-C177 PolarHBondContact O-N 2.92Å; L175-C177 VanDerWaalsContact C-N 3.34Å; L175-C177 PolarHBondContact O-N 2.89Å; C177-R181 WeakPolarHBondContact O-CG 3.43Å; C177-R181 PolarHBondContact O-N 2.59Å
178	A	87.6	Confident	75.1	Confident	5 Å²	5	74.3 Å²	74.3	4%	0.041	40%	0.399	C	S	.	.	H	α-helix	trans	-65.1	-46.2	177.8	0	0	0	0	0	111.6	L5 A88 P123 L174 L175 R176 V180 R181 A182	L5-A178 HydrophobicContact CD1-CB 4.41Å; L5-A178 HydrophobicContact CD2-CB 4Å; A88-A178 HydrophobicContact CB-CB 4.09Å; P123-A178 HydrophobicContact CG-CB 4.12Å; L174-A178 PolarHBondContact O-N 2.98Å; L175-A178 PolarHBondContact O-N 2.81Å; R176-A178 VanDerWaalsContact C-N 3.33Å; R176-A178 PolarHBondContact O-N 3.34Å; A178-V180 PolarHBondContact O-N 2.75Å; A178-R181 PolarHBondContact O-N 3.34Å; A178-A182 VanDerWaalsContact O-CB 3.26Å; A178-A182 WeakPolarHBondContact O-CB 3.24Å; A178-A182 PolarHBondContact O-N 3.07Å
179	L	84.8	Confident	72.6	Confident	37 Å²	37	77.7 Å²	77.7	19%	0.194	42%	0.417	C	S	.	.	H	α-helix	trans	-69.2	-33.5	-178.3	-69.5	174.1	0	0	0	113.9	L5 L48 Y53 L175 R176 R181	L5-L179 HydrophobicContact CD1-CD2 3.82Å; L5-L179 HydrophobicContact CD1-CG 4.03Å; L5-L179 HydrophobicContact CG-CD2 4.47Å; L48-L179 HydrophobicContact CD2-CD1 3.62Å; Y53-L179 HydrophobicContact CD1-CD1 4.46Å; Y53-L179 HydrophobicContact CD1-CD2 3.91Å; Y53-L179 HydrophobicContact CD2-CD1 4.46Å; Y53-L179 HydrophobicContact CE1-CD1 3.86Å; Y53-L179 HydrophobicContact CE1-CD2 3.37Å; Y53-L179 HydrophobicContact CE1-CG 4.27Å; Y53-L179 HydrophobicContact CE2-CD1 3.83Å; Y53-L179 VanDerWaalsContact CZ-CD1 3.5Å; L175-L179 WeakPolarHBondContact O-CB 3.37Å; L175-L179 VanDerWaalsContact O-CG 3.28Å; L175-L179 WeakPolarHBondContact O-CG 3.27Å; L175-L179 PolarHBondContact O-N 3.5Å; R176-L179 PolarHBondContact O-N 3.19Å; L179-R181 VanDerWaalsContact C-N 3.25Å; L179-R181 PolarHBondContact O-N 3.36Å
180	V	79.8	Confident	70	Confident	105 Å²	105	83.1 Å²	83.1	64%	0.636	44%	0.437	S	S	*	.	H	α-helix	trans	-62.8	-37.1	173.8	168.8	0	0	0	0	110.9	R176 A178	R176-V180 VanDerWaalsContact O-CG2 3.28Å; R176-V180 WeakPolarHBondContact O-CG2 3.11Å; R176-V180 PolarHBondContact O-N 3.13Å; R176-V180 VanDerWaalsContact O-N 3.08Å; A178-V180 PolarHBondContact O-N 2.75Å
181	R	69	Low	67.6	Low	116 Å²	116	90.5 Å²	90.5	44%	0.438	48%	0.476	S	S	.	.	H	α-helix	trans	-85	-28.5	-178.4	-68.1	179.8	174	-166.9	1	113	E121 A122 C177 A178 L179 R183	E121-R181 WeakPolarHBondContact O-CD 3.41Å; E121-R181 PolarHBondContact O-NH1 3.25Å; A122-R181 PolarHBondContact O-NH1 3.24Å; C177-R181 WeakPolarHBondContact O-CG 3.43Å; C177-R181 PolarHBondContact O-N 2.59Å; A178-R181 PolarHBondContact O-N 3.34Å; L179-R181 VanDerWaalsContact C-N 3.25Å; L179-R181 PolarHBondContact O-N 3.36Å; R181-R183 PolarHBondContact O-N 2.78Å
182	A	63.8	Low	65.1	Low	60 Å²	60	99.4 Å²	99.4	50%	0.496	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	17.6	175.8	0	0	0	0	0	113.6	A178 P184	A178-A182 VanDerWaalsContact O-CB 3.26Å; A178-A182 WeakPolarHBondContact O-CB 3.24Å; A178-A182 PolarHBondContact O-N 3.07Å; A182-P184 WeakPolarHBondContact O-CD 3.24Å
183	R	54.3	Low	62.7	Low	196 Å²	196	99.3 Å²	99.3	74%	0.74	54%	0.543	S	S	*	.			trans	-88	92	170	-76.9	-178	172.6	178.8	-2.5	110.5	R181	R181-R183 PolarHBondContact O-N 2.78Å
184	P	41.9	Very low	60.4	Low	103 Å²	103	100.4 Å²	100.4	67%	0.669	56%	0.562	S	S	*	*			trans	-67.6	151.2	147.3	30.3	-28.4	0	0	0	108.1	A182 H186	A182-P184 WeakPolarHBondContact O-CD 3.24Å; P184-H186 VanDerWaalsContact C-N 3.35Å; P184-H186 PolarHBondContact O-N 3.22Å
185	A	41.2	Very low	57.9	Low	106 Å²	106	107.7 Å²	107.7	88%	0.876	60%	0.6	S	S	*	*			trans	-57.6	90	178.7	0	0	0	0	0	111.5
186	H	39.5	Very low	55.8	Low	141 Å²	141	115.8 Å²	115.8	65%	0.653	64%	0.638	S	S	*	*			trans	-91.5	115.7	166.8	-127.6	-76.8	0	0	0	108	P184 A188	P184-H186 VanDerWaalsContact C-N 3.35Å; P184-H186 PolarHBondContact O-N 3.22Å; H186-A188 PolarHBondContact O-N 3.32Å
187	P	36.8	Very low	53.8	Low	121 Å²	121	117.4 Å²	117.4	79%	0.786	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-64.8	-7.9	-174.9	22.9	-31.6	0	0	0	114.2
188	A	41.8	Very low	51.8	Low	80 Å²	80	117.7 Å²	117.7	66%	0.661	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-83.9	-11.8	-171.3	0	0	0	0	0	115.6	H186	H186-A188 PolarHBondContact O-N 3.32Å
189	L	44.5	Very low	49.6	Very low	145 Å²	145	128.1 Å²	128.1	76%	0.759	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-99.4	14.4	-174.6	-79.7	162.2	0	0	0	114.5	L191	L189-L191 PolarHBondContact O-N 3.07Å
190	R	41.8	Very low	47.3	Very low	240 Å²	240	127.8 Å²	127.8	91%	0.906	70%	0.704	S	S	*	*	S	Bend	trans	-75.5	-1.9	174.6	-93.4	-168.4	173.9	177.9	0.2	115
191	L	44.6	Very low	45.8	Very low	154 Å²	154	125.5 Å²	125.5	81%	0.806	69%	0.693	S	S	*	*	S	Bend	trans	-126.4	91	178.8	-83.8	148.4	0	0	0	109.6	L189	L189-L191 PolarHBondContact O-N 3.07Å
192	Q	42.4	Very low	44.8	Very low	189 Å²	189	123.5 Å²	123.5	88%	0.883	69%	0.691	S	S	*	*			trans	166.2	76.3	134.4	-88.2	164	-6	0	0	109	A194	Q192-A194 PolarHBondContact O-N 3.34Å
193	G	44.5	Very low	43.8	Very low	84 Å²	84	129.6 Å²	129.6	87%	0.866	71%	0.711	S	S	*	*			trans	-74.6	107.6	146.5	0	0	0	0	0	107.3
194	A	45.5	Very low	43.3	Very low	81 Å²	81	126.3 Å²	126.3	67%	0.669	71%	0.71	S	S	*	*			trans	175.6	120.8	154.4	0	0	0	0	0	110.6	Q192	Q192-A194 PolarHBondContact O-N 3.34Å
195	L	41.7	Very low	43.4	Very low	156 Å²	156	127.5 Å²	127.5	82%	0.817	71%	0.712	S	S	*	*			trans	85.7	112.8	148.7	-55.7	165.4	0	0	0	119.8
196	H	48.3	Very low	43.5	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.806	70%	0.703	S	S	*	*				109.3	146.7	129.2	-86.8	17.9	0	0	0	120.7
197	P	47.2	Very low	43.7	Very low	115 Å²	115	128 Å²	128	75%	0.747	71%	0.706	S	S	*	*			trans	-89.8	121.8	-156	31.9	-26.4	0	0	0	113.8
198	A	47	Very low	44.2	Very low	64 Å²	64	128.4 Å²	128.4	53%	0.529	70%	0.701	S	S	.	*			trans	35.4	105.5	140.5	0	0	0	0	0	120.1
199	R	41.5	Very low	44.3	Very low	224 Å²	224	131.7 Å²	131.7	85%	0.845	70%	0.703	S	S	*	*			trans	-141.2	139	144.3	-72.6	-170.1	166	-174.1	-4.6	110.3
200	C	36.9	Very low	44.3	Very low	30 Å²	30	130.7 Å²	130.7	20%	0.203	70%	0.699	C	S	.	*			trans	-118	127	168.4	-179.3	0	0	0	0	105.6	L47	L47-C200 PolarHBondContact O-SG 3.42Å
201	S	47.8	Very low	44.5	Very low	57 Å²	57	122.3 Å²	122.3	40%	0.399	68%	0.683	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139.9	141.3	-176.7	38	0	0	0	0	108.6	L47	L47-S201 WeakPolarHBondContact CB-O 3.3Å; L47-S201 PolarHBondContact N-O 2.91Å
202	L	47.4	Very low	44.5	Very low	74 Å²	74	119.7 Å²	119.7	39%	0.387	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.3	134.3	172.5	-68.9	158.2	0	0	0	107.5	F24 V46	F24-L202 HydrophobicContact CD2-CD1 4.23Å; F24-L202 HydrophobicContact CE1-CD2 4.26Å; F24-L202 HydrophobicContact CE2-CD1 4.12Å; F24-L202 HydrophobicContact CE2-CD2 3.93Å; F24-L202 HydrophobicContact CE2-CG 4.38Å; F24-L202 HydrophobicContact CZ-CD2 3.71Å; F24-L202 WeakPolarHBondContact O-CD1 3.16Å; V46-L202 HydrophobicContact CG1-CD2 3.86Å
203	M	43.5	Very low	44.7	Very low	188 Å²	188	113.4 Å²	113.4	93%	0.926	65%	0.654	S	S	*	*			trans	-103	0	170.5	-76.1	-164.4	-76	0	0	109.4	V52	V52-M203 HydrophobicContact CG2-CE 3.76Å

Retrieved 203 of 203 residues in 496.9 ms (Link to these results)

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