A0A087X7D2_POEFO Loading...

AP-1 complex subunit mu-1

Subunit of clathrin-associated adaptor protein complex 1 that plays a role in protein sorting in the trans-Golgi network (TGN) and endosomes. The AP complexes mediate the recruitment of clathrin to membranes and the recognition of sorting signals within the cytosolic tails of transmembrane cargo molecules.

AlphaFold DB (A0A3B3V8B4), UniProt , Accession A0A087X7D2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 423 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	62.2	Low	91.5	Very high	101 Å²	101	18.4 Å²	18.4	50%	0.498	9%	0.094	S	C	.	.				0	136	0	-77.5	-169.3	-84	0	0	108	R22 K73 A75 S76	M1-R22 PolarHBondContact SD-NH1 2.83Å; M1-R22 PolarHBondContact SD-NH2 2.81Å; M1-K73 HydrophobicContact CE-CD 3.9Å; M1-K73 HydrophobicContact SD-CD 3.72Å; M1-A75 CarbonylContact O-C 3.52Å; M1-A75 VanDerWaalsContact O-CA 3.25Å; M1-A75 WeakPolarHBondContact O-CA 3.32Å; M1-S76 PolarHBondContact O-N 3.41Å
2	S	80.1	Confident	91.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.007	15%	0.152	C	C	.	.			trans	-124.7	-106.6	-164.8	-8.9	0	0	0	0	110.6	S71 A75 L79 G121	S2-S71 PolarHBondContact O-OG 2.99Å; S2-S71 VanDerWaalsContact O-OG 3.08Å; S2-A75 VanDerWaalsContact O-CB 3.25Å; S2-A75 WeakPolarHBondContact O-CB 3.23Å; S2-L79 WeakPolarHBondContact OG-CD2 3.45Å; S2-G121 WeakPolarHBondContact CB-O 3.42Å; S2-G121 PolarHBondContact OG-O 2.84Å
3	A	90.8	Very high	91.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.155	C	C	.	.			trans	-89.9	144.9	-179.9	0	0	0	0	0	111.9	V6 R22 A69 M118 G121	A3-V6 HydrophobicContact CB-CG2 4.03Å; A3-R22 WeakPolarHBondContact O-CD 3.05Å; A3-A69 HydrophobicContact CB-CB 4.1Å; A3-M118 HydrophobicContact CB-CE 4.44Å; A3-M118 HydrophobicContact CB-SD 4.21Å; A3-G121 VanDerWaalsContact O-CA 3.27Å; A3-G121 WeakPolarHBondContact O-CA 3.44Å
4	S	95	Very high	92	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-90.5	-47.4	168.2	-178.3	0	0	0	0	110.9	N20 Y21 R22 D24 V25 T70	S4-N20 PolarHBondContact O-OD1 3.48Å; S4-Y21 PolarHBondContact O-N 3.18Å; S4-R22 PolarHBondContact O-N 2.83Å; S4-D24 PolarHBondContact OG-N 3.16Å; S4-V25 PolarHBondContact OG-N 2.61Å; S4-T70 WeakPolarHBondContact CB-O 3.41Å; S4-T70 PolarHBondContact N-O 3.21Å
5	A	96.8	Very high	92.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	152.7	173.9	0	0	0	0	0	109.6	Y7 R19 N20 M27 A69 T70	A5-Y7 HydrophobicContact CB-CD2 4.49Å; A5-Y7 HydrophobicContact CB-CE2 3.54Å; A5-Y7 WeakPolarHBondContact CB-OH 3.39Å; A5-R19 CarbonylContact C-O 3.57Å; A5-R19 WeakPolarHBondContact CA-O 3.25Å; A5-R19 WeakPolarHBondContact CB-O 3.2Å; A5-N20 HydrophobicContact CB-CB 4.45Å; A5-M27 HydrophobicContact CB-CE 4.39Å; A5-M27 HydrophobicContact CB-SD 3.8Å; A5-A69 CarbonylContact O-C 3.55Å; A5-A69 WeakPolarHBondContact O-CA 3.36Å; A5-T70 PolarHBondContact O-N 2.9Å
6	V	97.5	Very high	92.6	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	135.1	175.4	178.1	0	0	0	0	108.5	A3 C18 R19 Y21 V68 A69 F83 L84 I87 M114	A3-V6 HydrophobicContact CB-CG2 4.03Å; V6-C18 CarbonylContact O-C 3.53Å; V6-C18 WeakPolarHBondContact O-CA 3.18Å; V6-R19 PolarHBondContact N-O 3.46Å; V6-R19 PolarHBondContact O-N 3.11Å; V6-Y21 HydrophobicContact CB-CE2 4.04Å; V6-Y21 HydrophobicContact CG2-CD2 4.36Å; V6-Y21 HydrophobicContact CG2-CE2 3.76Å; V6-V68 CarbonylContact C-O 3.56Å; V6-V68 WeakPolarHBondContact CA-O 3.47Å; V6-A69 HydrophobicContact CG2-CB 4.25Å; V6-F83 HydrophobicContact CG2-CE1 4.47Å; V6-L84 HydrophobicContact CG1-CD2 4.15Å; V6-I87 HydrophobicContact CG1-CD1 4.15Å; V6-M114 HydrophobicContact CB-CE 3.91Å; V6-M114 HydrophobicContact CG1-CE 3.88Å
7	Y	97.9	Very high	92.8	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.008	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	146.5	-176.5	-50.5	-104.2	0	0	0	109.1	A5 V15 C18 M27 I30 L67 V68 T70	A5-Y7 HydrophobicContact CB-CD2 4.49Å; A5-Y7 HydrophobicContact CB-CE2 3.54Å; A5-Y7 WeakPolarHBondContact CB-OH 3.39Å; Y7-V15 HydrophobicContact CD1-CG1 4.42Å; Y7-V15 HydrophobicContact CD1-CG2 4.47Å; Y7-C18 HydrophobicContact CD1-CB 3.44Å; Y7-C18 VanDerWaalsContact CD1-CB 3.44Å; Y7-C18 HydrophobicContact CE1-CB 3.93Å; Y7-C18 HydrophobicContact CG-CB 4.19Å; Y7-M27 HydrophobicContact CD1-CE 4.27Å; Y7-M27 HydrophobicContact CE1-CE 3.41Å; Y7-M27 VanDerWaalsContact CE1-CE 3.41Å; Y7-M27 HydrophobicContact CE1-SD 4.02Å; Y7-M27 PolarHBondContact OH-SD 2.9Å; Y7-I30 HydrophobicContact CD1-CB 4.09Å; Y7-I30 HydrophobicContact CD1-CD1 4.21Å; Y7-I30 HydrophobicContact CD1-CG1 3.78Å; Y7-I30 HydrophobicContact CD1-CG2 4.3Å; Y7-I30 HydrophobicContact CD2-CD1 3.84Å; Y7-I30 HydrophobicContact CD2-CG1 4.32Å; Y7-I30 HydrophobicContact CE1-CB 3.9Å; Y7-I30 HydrophobicContact CE1-CG1 4.11Å; Y7-I30 HydrophobicContact CE1-CG2 4.09Å; Y7-I30 HydrophobicContact CE2-CD1 4.28Å; Y7-I30 HydrophobicContact CG-CD1 3.83Å; Y7-I30 HydrophobicContact CG-CG1 3.9Å; Y7-L67 WeakPolarHBondContact O-CA 3.32Å; Y7-V68 WeakPolarHBondContact CD2-O 3.39Å; Y7-V68 PolarHBondContact N-O 2.9Å; Y7-V68 PolarHBondContact O-N 2.86Å; Y7-T70 HydrophobicContact CD2-CG2 4.21Å; Y7-T70 HydrophobicContact CE2-CG2 3.58Å
8	V	97.7	Very high	93	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	121.9	164.7	-173.3	0	0	0	0	106.9	L16 V17 L65 Y66 L67 I103	V8-L16 WeakPolarHBondContact O-CB 3.36Å; V8-L16 PolarHBondContact O-N 3.44Å; V8-V17 HydrophobicContact CB-CG1 3.62Å; V8-V17 HydrophobicContact CG2-CG1 3.53Å; V8-V17 PolarHBondContact N-O 3.03Å; V8-V17 PolarHBondContact O-N 2.66Å; V8-L65 HydrophobicContact CG1-CB 4.3Å; V8-L65 HydrophobicContact CG1-CD1 4.16Å; V8-L65 HydrophobicContact CG1-CD2 4.14Å; V8-L65 HydrophobicContact CG1-CG 4.45Å; V8-Y66 CarbonylContact C-O 3.56Å; V8-Y66 WeakPolarHBondContact CA-O 3.41Å; V8-L67 HydrophobicContact CG2-CG 4.42Å; V8-I103 HydrophobicContact CG1-CD1 4.31Å; V8-I103 HydrophobicContact CG1-CG1 4.24Å
9	L	97.7	Very high	93.2	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	155.3	-178.8	-40.4	177	0	0	0	110.5	K14 V15 I30 F33 L65 Y66 V68	L9-K14 CarbonylContact C-O 3.57Å; L9-K14 WeakPolarHBondContact CA-O 3.32Å; L9-V15 HydrophobicContact CD2-CB 4.07Å; L9-V15 HydrophobicContact CD2-CG1 4.44Å; L9-V15 HydrophobicContact CD2-CG2 3.59Å; L9-I30 HydrophobicContact CD1-CD1 4.16Å; L9-I30 HydrophobicContact CD1-CG1 4.27Å; L9-I30 HydrophobicContact CD2-CD1 4.41Å; L9-I30 HydrophobicContact CD2-CG1 3.93Å; L9-F33 HydrophobicContact CD1-CD1 3.49Å; L9-F33 VanDerWaalsContact CD1-CD1 3.49Å; L9-F33 HydrophobicContact CD1-CE1 3.85Å; L9-F33 HydrophobicContact CD1-CG 4.41Å; L9-L65 CarbonylContact O-C 3.58Å; L9-L65 VanDerWaalsContact O-CA 3.3Å; L9-L65 WeakPolarHBondContact O-CA 3.48Å; L9-Y66 PolarHBondContact N-O 2.89Å; L9-Y66 PolarHBondContact O-N 2.83Å; L9-V68 HydrophobicContact CD1-CG2 3.82Å; L9-V68 HydrophobicContact CG-CG2 4.24Å
10	D	96.3	Very high	93.3	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.053	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	178.5	165.5	71	12.3	0	0	0	112	K12 G13 K14 L16 Y66	D10-K12 PolarHBondContact O-N 2.88Å; D10-K12 VanDerWaalsContact O-N 3.16Å; D10-K12 VanDerWaalsContact OD1-CA 3.3Å; D10-K12 WeakPolarHBondContact OD1-CA 3.49Å; D10-K12 WeakPolarHBondContact OD1-CB 3.5Å; D10-K12 PolarHBondContact OD1-N 2.91Å; D10-G13 PolarHBondContact O-N 2.95Å; D10-G13 PolarHBondContact OD1-N 3.42Å; D10-K14 PolarHBondContact N-O 3.01Å; D10-K14 PolarHBondContact OD1-N 3.01Å; D10-K14 WeakPolarHBondContact OD2-CB 3.25Å; D10-L16 HydrophobicContact CB-CD1 4.24Å; D10-L16 HydrophobicContact CB-CD2 4.28Å; D10-L16 HydrophobicContact CB-CG 4.31Å; D10-Y66 WeakPolarHBondContact O-CD2 3.32Å
11	L	94.8	Very high	93.4	Very high	83 Å²	83	39.8 Å²	39.8	44%	0.435	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.2	177.4	-68.8	179.7	0	0	0	114.5	G13 M34 N64 Y66	L11-G13 VanDerWaalsContact C-N 3.34Å; L11-M34 WeakPolarHBondContact O-CE 3.11Å; L11-N64 HydrophobicContact CD1-CB 3.98Å; L11-N64 HydrophobicContact CG-CB 4Å; L11-N64 PolarHBondContact N-O 2.91Å; L11-Y66 HydrophobicContact CD2-CE2 4.15Å
12	K	93.8	Very high	94.9	Very high	183 Å²	183	36.6 Å²	36.6	80%	0.796	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-1.1	177.4	-57.4	-179.5	-178.1	176.5	0	112	D10	D10-K12 PolarHBondContact O-N 2.88Å; D10-K12 VanDerWaalsContact O-N 3.16Å; D10-K12 VanDerWaalsContact OD1-CA 3.3Å; D10-K12 WeakPolarHBondContact OD1-CA 3.49Å; D10-K12 WeakPolarHBondContact OD1-CB 3.5Å; D10-K12 PolarHBondContact OD1-N 2.91Å
13	G	92.7	Very high	95.5	Very high	19 Å²	19	39 Å²	39	20%	0.196	20%	0.203	C	C	.	.			trans	82.2	9.1	-177.1	0	0	0	0	0	114.2	D10 L11	D10-G13 PolarHBondContact O-N 2.95Å; D10-G13 PolarHBondContact OD1-N 3.42Å; L11-G13 VanDerWaalsContact C-N 3.34Å
14	K	95.3	Very high	95.5	Very high	135 Å²	135	41.5 Å²	41.5	59%	0.587	22%	0.217	S	C	*	.			trans	-77.4	134.1	176.9	-176.4	-177.3	174.8	-177.8	0	110.2	L9 D10 L16	L9-K14 CarbonylContact C-O 3.57Å; L9-K14 WeakPolarHBondContact CA-O 3.32Å; D10-K14 PolarHBondContact N-O 3.01Å; D10-K14 PolarHBondContact OD1-N 3.01Å; D10-K14 WeakPolarHBondContact OD2-CB 3.25Å; K14-L16 PolarHBondContact O-N 2.88Å
15	V	97.3	Very high	95.4	Very high	53 Å²	53	41.8 Å²	41.8	32%	0.321	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	119.6	175.6	-174.5	0	0	0	0	110.5	Y7 L9 C18 I30	Y7-V15 HydrophobicContact CD1-CG1 4.42Å; Y7-V15 HydrophobicContact CD1-CG2 4.47Å; L9-V15 HydrophobicContact CD2-CB 4.07Å; L9-V15 HydrophobicContact CD2-CG1 4.44Å; L9-V15 HydrophobicContact CD2-CG2 3.59Å; V15-C18 HydrophobicContact CG1-CB 3.81Å; V15-I30 HydrophobicContact CG2-CG1 4.3Å; V15-I30 HydrophobicContact CG2-CG2 3.78Å
16	L	96	Very high	95.4	Very high	35 Å²	35	46.8 Å²	46.8	18%	0.183	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-46.1	172.2	-60.7	175.3	0	0	0	111	V8 D10 K14 L65 E100 I103	V8-L16 WeakPolarHBondContact O-CB 3.36Å; V8-L16 PolarHBondContact O-N 3.44Å; D10-L16 HydrophobicContact CB-CD1 4.24Å; D10-L16 HydrophobicContact CB-CD2 4.28Å; D10-L16 HydrophobicContact CB-CG 4.31Å; K14-L16 PolarHBondContact O-N 2.88Å; L16-L65 HydrophobicContact CD1-CD2 3.45Å; L16-L65 VanDerWaalsContact CD1-CD2 3.45Å; L16-E100 HydrophobicContact CD1-CB 4.26Å; L16-E100 HydrophobicContact CD1-CG 3.88Å; L16-E100 HydrophobicContact CD2-CG 3.96Å; L16-I103 HydrophobicContact CB-CG2 3.75Å; L16-I103 HydrophobicContact CD1-CB 4.42Å; L16-I103 HydrophobicContact CD1-CG2 4.47Å
17	V	96.3	Very high	95.2	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.024	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	148.9	173.2	63.3	0	0	0	0	109.5	V8 I103 I110 Y111 M114	V8-V17 HydrophobicContact CB-CG1 3.62Å; V8-V17 HydrophobicContact CG2-CG1 3.53Å; V8-V17 PolarHBondContact N-O 3.03Å; V8-V17 PolarHBondContact O-N 2.66Å; V17-I103 HydrophobicContact CB-CG2 4.21Å; V17-I103 HydrophobicContact CG1-CG2 3.86Å; V17-I110 HydrophobicContact CG1-CG2 4.07Å; V17-I110 HydrophobicContact CG2-CG2 4.09Å; V17-Y111 HydrophobicContact CG2-CD1 4.34Å; V17-Y111 HydrophobicContact CG2-CE1 3.82Å; V17-Y111 HydrophobicContact CG2-CE2 4.04Å; V17-M114 HydrophobicContact CG1-SD 4.41Å; V17-M114 HydrophobicContact CG2-SD 4.12Å
18	C	96	Very high	95.1	Very high	38 Å²	38	51.3 Å²	51.3	26%	0.257	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	145.8	175.1	66.2	0	0	0	0	111.4	V6 Y7 V15 M27 Y111	V6-C18 CarbonylContact O-C 3.53Å; V6-C18 WeakPolarHBondContact O-CA 3.18Å; Y7-C18 HydrophobicContact CD1-CB 3.44Å; Y7-C18 VanDerWaalsContact CD1-CB 3.44Å; Y7-C18 HydrophobicContact CE1-CB 3.93Å; Y7-C18 HydrophobicContact CG-CB 4.19Å; V15-C18 HydrophobicContact CG1-CB 3.81Å; C18-M27 HydrophobicContact CB-CE 3.66Å; C18-M27 WeakPolarHBondContact SG-CE 2.96Å; C18-Y111 WeakPolarHBondContact O-CE1 3.35Å
19	R	96.3	Very high	95	Very high	86 Å²	86	53.3 Å²	53.3	33%	0.325	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.8	174.2	-172.2	67.4	-178.8	142.5	0.7	109.3	A5 V6 Y21 M114 D115	A5-R19 CarbonylContact C-O 3.57Å; A5-R19 WeakPolarHBondContact CA-O 3.25Å; A5-R19 WeakPolarHBondContact CB-O 3.2Å; V6-R19 PolarHBondContact N-O 3.46Å; V6-R19 PolarHBondContact O-N 3.11Å; R19-Y21 HydrophobicContact CB-CE2 4.07Å; R19-Y21 HydrophobicContact CG-CD1 4.14Å; R19-Y21 HydrophobicContact CG-CD2 4.47Å; R19-Y21 HydrophobicContact CG-CE1 3.57Å; R19-Y21 HydrophobicContact CG-CE2 3.95Å; R19-Y21 VanDerWaalsContact CG-CZ 3.49Å; R19-M114 HydrophobicContact CB-CB 4.27Å; R19-M114 HydrophobicContact CB-CE 3.46Å; R19-M114 VanDerWaalsContact CB-CE 3.46Å; R19-M114 HydrophobicContact CB-SD 4.07Å; R19-M114 HydrophobicContact CG-CB 4.29Å; R19-D115 IonicContact CZ-OD1 2.85Å; R19-D115 IonicContact NE-OD1 3.66Å; R19-D115 PolarHBondContact NE-OD1 3.23Å; R19-D115 IonicContact NH2-OD1 2.93Å; R19-D115 PolarHBondContact NH2-OD1 3.1Å
20	N	96.4	Very high	94.9	Very high	57 Å²	57	53.8 Å²	53.8	31%	0.305	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	120.5	172.6	-167.3	-5.3	0	0	0	109.4	S4 A5 R22 G23 M27	S4-N20 PolarHBondContact O-OD1 3.48Å; A5-N20 HydrophobicContact CB-CB 4.45Å; N20-R22 PolarHBondContact OD1-N 2.67Å; N20-G23 PolarHBondContact OD1-N 2.99Å; N20-M27 HydrophobicContact CB-CE 4.2Å; N20-M27 HydrophobicContact CB-SD 3.69Å
21	Y	95.6	Very high	94.9	Very high	24 Å²	24	60.6 Å²	60.6	9%	0.094	32%	0.315	C	S	.	.	S	Bend	trans	-98.7	-24	-178.6	-63.6	-75.2	0	0	0	113	S4 V6 R19 M114 M118 F120	S4-Y21 PolarHBondContact O-N 3.18Å; V6-Y21 HydrophobicContact CB-CE2 4.04Å; V6-Y21 HydrophobicContact CG2-CD2 4.36Å; V6-Y21 HydrophobicContact CG2-CE2 3.76Å; R19-Y21 HydrophobicContact CB-CE2 4.07Å; R19-Y21 HydrophobicContact CG-CD1 4.14Å; R19-Y21 HydrophobicContact CG-CD2 4.47Å; R19-Y21 HydrophobicContact CG-CE1 3.57Å; R19-Y21 HydrophobicContact CG-CE2 3.95Å; R19-Y21 VanDerWaalsContact CG-CZ 3.49Å; Y21-M114 VanDerWaalsContact CE1-O 3.32Å; Y21-M114 WeakPolarHBondContact CE1-O 3.23Å; Y21-M114 PolarHBondContact OH-O 2.77Å; Y21-M118 HydrophobicContact CD1-CB 4.33Å; Y21-M118 HydrophobicContact CD1-CG 3.93Å; Y21-M118 VanDerWaalsContact CD1-O 3.32Å; Y21-M118 WeakPolarHBondContact CD1-O 3.43Å; Y21-M118 HydrophobicContact CD1-SD 4.38Å; Y21-M118 HydrophobicContact CD2-CG 4.29Å; Y21-M118 HydrophobicContact CD2-SD 3.65Å; Y21-M118 HydrophobicContact CE1-CB 3.77Å; Y21-M118 HydrophobicContact CE1-CG 3.86Å; Y21-M118 WeakPolarHBondContact CE1-O 3.47Å; Y21-M118 HydrophobicContact CE1-SD 4.35Å; Y21-M118 HydrophobicContact CE2-CB 4.46Å; Y21-M118 HydrophobicContact CE2-CG 4.2Å; Y21-M118 HydrophobicContact CE2-SD 3.6Å; Y21-M118 VanDerWaalsContact CE2-SD 3.6Å; Y21-M118 HydrophobicContact CG-CG 4.14Å; Y21-M118 HydrophobicContact CG-SD 4.04Å; Y21-F120 WeakPolarHBondContact O-CD2 3.24Å
22	R	92.8	Very high	94.9	Very high	34 Å²	34	60.2 Å²	60.2	13%	0.128	31%	0.311	C	S	.	.	S	Bend	trans	-129.8	-27.1	-169.5	-58.6	-171.3	67.3	-176.8	4	115.2	M1 A3 S4 N20 D24 F120	M1-R22 PolarHBondContact SD-NH1 2.83Å; M1-R22 PolarHBondContact SD-NH2 2.81Å; A3-R22 WeakPolarHBondContact O-CD 3.05Å; S4-R22 PolarHBondContact O-N 2.83Å; N20-R22 PolarHBondContact OD1-N 2.67Å; R22-D24 HydrophobicContact CB-CB 4.41Å; R22-D24 IonicContact CZ-OD2 3.8Å; R22-D24 IonicContact NE-OD2 3.79Å; R22-D24 PolarHBondContact NE-OD2 2.9Å; R22-D24 IonicContact NH1-OD2 3.65Å; R22-D24 IonicContact NH2-OD2 3.1Å; R22-D24 PolarHBondContact NH2-OD2 2.92Å; R22-D24 PolarHBondContact O-N 3.42Å; R22-F120 HydrophobicContact CB-CD2 4.4Å; R22-F120 HydrophobicContact CB-CE2 4.14Å; R22-F120 HydrophobicContact CG-CD2 3.88Å; R22-F120 HydrophobicContact CG-CE2 3.98Å; R22-F120 HydrophobicContact CG-CG 4.29Å; R22-F120 HydrophobicContact CG-CZ 4.48Å
23	G	91.9	Very high	95.1	Very high	51 Å²	51	51.5 Å²	51.5	53%	0.526	27%	0.273	S	S	.	.	S	Bend	trans	71.5	10.6	-172.1	0	0	0	0	0	114.9	N20 V25	N20-G23 PolarHBondContact OD1-N 2.99Å; G23-V25 VanDerWaalsContact C-N 3.32Å
24	D	91.6	Very high	95.2	Very high	53 Å²	53	52.4 Å²	52.4	28%	0.283	27%	0.273	S	S	.	.	S	Bend	trans	-77.2	-18.3	-177.7	-77.2	-16.4	0	0	0	113.1	S4 R22 K73	S4-D24 PolarHBondContact OG-N 3.16Å; R22-D24 HydrophobicContact CB-CB 4.41Å; R22-D24 IonicContact CZ-OD2 3.8Å; R22-D24 IonicContact NE-OD2 3.79Å; R22-D24 PolarHBondContact NE-OD2 2.9Å; R22-D24 IonicContact NH1-OD2 3.65Å; R22-D24 IonicContact NH2-OD2 3.1Å; R22-D24 PolarHBondContact NH2-OD2 2.92Å; R22-D24 PolarHBondContact O-N 3.42Å; D24-K73 IonicContact OD1-NZ 3.35Å; D24-K73 IonicContact OD2-NZ 2.7Å; D24-K73 PolarHBondContact OD2-NZ 3.32Å
25	V	93.9	Very high	95.2	Very high	6 Å²	6	50 Å²	50	4%	0.036	27%	0.269	C	S	.	.	S	Bend	trans	-126	134	-178.9	-179.1	0	0	0	0	107.9	S4 G23 E29 V55 K72	S4-V25 PolarHBondContact OG-N 2.61Å; G23-V25 VanDerWaalsContact C-N 3.32Å; V25-E29 HydrophobicContact CG1-CB 4.11Å; V25-E29 HydrophobicContact CG1-CG 4.1Å; V25-V55 HydrophobicContact CG1-CG1 3.8Å; V25-V55 HydrophobicContact CG1-CG2 4.06Å; V25-V55 HydrophobicContact CG2-CG1 4.43Å; V25-K72 HydrophobicContact CG2-CB 4Å
26	D	95.1	Very high	95.1	Very high	104 Å²	104	49.1 Å²	49.1	56%	0.556	26%	0.262	S	S	*	.			trans	-66.5	137	173.6	-170.2	-5.6	0	0	0	109.6	S28 E29	D26-S28 PolarHBondContact O-N 3.35Å; D26-S28 PolarHBondContact OD1-N 3.32Å; D26-S28 PolarHBondContact OD1-OG 2.85Å; D26-S28 PolarHBondContact OD2-OG 2.82Å; D26-E29 HydrophobicContact CB-CG 4.31Å; D26-E29 WeakPolarHBondContact O-CB 3.24Å; D26-E29 PolarHBondContact O-N 3.31Å
27	M	94.3	Very high	95.1	Very high	51 Å²	51	47.6 Å²	47.6	25%	0.251	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-65.2	-24.4	-178.8	-61.9	-62.9	-76.4	0	0	112	A5 Y7 C18 N20 E29 I30	A5-M27 HydrophobicContact CB-CE 4.39Å; A5-M27 HydrophobicContact CB-SD 3.8Å; Y7-M27 HydrophobicContact CD1-CE 4.27Å; Y7-M27 HydrophobicContact CE1-CE 3.41Å; Y7-M27 VanDerWaalsContact CE1-CE 3.41Å; Y7-M27 HydrophobicContact CE1-SD 4.02Å; Y7-M27 PolarHBondContact OH-SD 2.9Å; C18-M27 HydrophobicContact CB-CE 3.66Å; C18-M27 WeakPolarHBondContact SG-CE 2.96Å; N20-M27 HydrophobicContact CB-CE 4.2Å; N20-M27 HydrophobicContact CB-SD 3.69Å; M27-E29 VanDerWaalsContact C-N 3.26Å; M27-E29 PolarHBondContact O-N 2.51Å; M27-I30 WeakPolarHBondContact O-CG2 3.34Å
28	S	94.8	Very high	95	Very high	47 Å²	47	51.7 Å²	51.7	33%	0.329	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-66.2	-22.4	175.8	63.6	0	0	0	0	113.8	D26 I30 E31	D26-S28 PolarHBondContact O-N 3.35Å; D26-S28 PolarHBondContact OD1-N 3.32Å; D26-S28 PolarHBondContact OD1-OG 2.85Å; D26-S28 PolarHBondContact OD2-OG 2.82Å; S28-I30 PolarHBondContact O-N 3.18Å; S28-E31 WeakPolarHBondContact O-CB 3.49Å; S28-E31 WeakPolarHBondContact O-CG 3.16Å; S28-E31 PolarHBondContact O-N 3.31Å
29	E	95.5	Very high	94.9	Very high	46 Å²	46	53.3 Å²	53.3	22%	0.215	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-59.8	-24.2	179.4	-71	-73.6	161	0	0	112.6	V25 D26 M27 E31 H32 H52 V55 F57	V25-E29 HydrophobicContact CG1-CB 4.11Å; V25-E29 HydrophobicContact CG1-CG 4.1Å; D26-E29 HydrophobicContact CB-CG 4.31Å; D26-E29 WeakPolarHBondContact O-CB 3.24Å; D26-E29 PolarHBondContact O-N 3.31Å; M27-E29 VanDerWaalsContact C-N 3.26Å; M27-E29 PolarHBondContact O-N 2.51Å; E29-E31 PolarHBondContact O-N 3.11Å; E29-H32 PolarHBondContact O-N 2.85Å; E29-H52 IonicContact OE2-CE1 2.83Å; E29-H52 IonicContact OE2-CG 3.7Å; E29-H52 IonicContact OE2-ND1 3.96Å; E29-H52 PolarHBondContact OE2-ND1 2.8Å; E29-V55 HydrophobicContact CG-CG2 4.16Å; E29-F57 HydrophobicContact CB-CZ 4.33Å; E29-F57 WeakPolarHBondContact O-CE1 3.42Å; E29-F57 WeakPolarHBondContact O-CZ 3.41Å
30	I	96.5	Very high	94.8	Very high	11 Å²	11	52.7 Å²	52.7	6%	0.056	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-61.9	-24.4	177.7	-161.5	59.8	0	0	0	113	Y7 L9 V15 M27 S28 H32 F33 F57 V68	Y7-I30 HydrophobicContact CD1-CB 4.09Å; Y7-I30 HydrophobicContact CD1-CD1 4.21Å; Y7-I30 HydrophobicContact CD1-CG1 3.78Å; Y7-I30 HydrophobicContact CD1-CG2 4.3Å; Y7-I30 HydrophobicContact CD2-CD1 3.84Å; Y7-I30 HydrophobicContact CD2-CG1 4.32Å; Y7-I30 HydrophobicContact CE1-CB 3.9Å; Y7-I30 HydrophobicContact CE1-CG1 4.11Å; Y7-I30 HydrophobicContact CE1-CG2 4.09Å; Y7-I30 HydrophobicContact CE2-CD1 4.28Å; Y7-I30 HydrophobicContact CG-CD1 3.83Å; Y7-I30 HydrophobicContact CG-CG1 3.9Å; L9-I30 HydrophobicContact CD1-CD1 4.16Å; L9-I30 HydrophobicContact CD1-CG1 4.27Å; L9-I30 HydrophobicContact CD2-CD1 4.41Å; L9-I30 HydrophobicContact CD2-CG1 3.93Å; V15-I30 HydrophobicContact CG2-CG1 4.3Å; V15-I30 HydrophobicContact CG2-CG2 3.78Å; M27-I30 WeakPolarHBondContact O-CG2 3.34Å; S28-I30 PolarHBondContact O-N 3.18Å; I30-H32 PolarHBondContact O-N 2.88Å; I30-F33 HydrophobicContact CD1-CB 4.15Å; I30-F33 VanDerWaalsContact O-CB 3.23Å; I30-F33 WeakPolarHBondContact O-CB 3.19Å; I30-F33 PolarHBondContact O-N 2.79Å; I30-F33 VanDerWaalsContact O-N 3.1Å; I30-F57 HydrophobicContact CD1-CD1 4.41Å; I30-F57 HydrophobicContact CD1-CE1 4.48Å; I30-V68 HydrophobicContact CD1-CB 4.12Å; I30-V68 HydrophobicContact CD1-CG1 3.89Å; I30-V68 HydrophobicContact CD1-CG2 4.5Å
31	E	95.2	Very high	94.6	Very high	152 Å²	152	55.9 Å²	55.9	71%	0.71	29%	0.293	S	S	*	.	H	α-helix	trans	-64.1	-26.3	179.5	-64.4	179.8	178.2	0	0	112.5	S28 E29 F33	S28-E31 WeakPolarHBondContact O-CB 3.49Å; S28-E31 WeakPolarHBondContact O-CG 3.16Å; S28-E31 PolarHBondContact O-N 3.31Å; E29-E31 PolarHBondContact O-N 3.11Å; E31-F33 VanDerWaalsContact C-N 3.34Å
32	H	96	Very high	94.5	Very high	75 Å²	75	62.3 Å²	62.3	35%	0.347	32%	0.324	S	S	.	.	H	α-helix	trans	-80.4	-16	178.1	-58.5	84.6	0	0	0	113	E29 I30 M34 L36 H52	E29-H32 PolarHBondContact O-N 2.85Å; I30-H32 PolarHBondContact O-N 2.88Å; H32-M34 PolarHBondContact O-N 2.82Å; H32-L36 HydrophobicContact CB-CD1 4.29Å; H32-L36 WeakPolarHBondContact O-CB 3.2Å; H32-L36 VanDerWaalsContact O-CG 3.27Å; H32-L36 WeakPolarHBondContact O-CG 3.38Å; H32-L36 PolarHBondContact O-N 2.97Å; H32-L36 VanDerWaalsContact O-N 3.1Å; H32-H52 AromaticContact CD2-CE1 3.54Å; H32-H52 AromaticContact CD2-NE2 3.53Å; H32-H52 AromaticContact CE1-CE1 3.81Å; H32-H52 AromaticContact CG-CE1 3.73Å; H32-H52 AromaticContact CG-ND1 3.92Å; H32-H52 AromaticContact CG-NE2 3.98Å; H32-H52 AromaticContact ND1-CE1 3.88Å; H32-H52 AromaticContact NE2-CE1 3.6Å; H32-H52 AromaticContact NE2-NE2 3.91Å
33	F	96.8	Very high	94.6	Very high	1 Å²	1	66.4 Å²	66.4	0%	0.004	35%	0.345	C	S	.	.	H	α-helix	trans	-59.7	-48.6	-172.3	170	-103.1	0	0	0	112.5	L9 I30 E31 L36 L37 L50 F57 W59 Y66 V68	L9-F33 HydrophobicContact CD1-CD1 3.49Å; L9-F33 VanDerWaalsContact CD1-CD1 3.49Å; L9-F33 HydrophobicContact CD1-CE1 3.85Å; L9-F33 HydrophobicContact CD1-CG 4.41Å; I30-F33 HydrophobicContact CD1-CB 4.15Å; I30-F33 VanDerWaalsContact O-CB 3.23Å; I30-F33 WeakPolarHBondContact O-CB 3.19Å; I30-F33 PolarHBondContact O-N 2.79Å; I30-F33 VanDerWaalsContact O-N 3.1Å; E31-F33 VanDerWaalsContact C-N 3.34Å; F33-L36 PolarHBondContact O-N 3.03Å; F33-L37 HydrophobicContact CE1-CD2 4.24Å; F33-L37 HydrophobicContact CZ-CD2 4.25Å; F33-L37 WeakPolarHBondContact O-CB 3.24Å; F33-L37 PolarHBondContact O-N 2.9Å; F33-L50 HydrophobicContact CD2-CD1 3.92Å; F33-L50 HydrophobicContact CE2-CD1 3.74Å; F33-F57 HydrophobicContact CB-CD1 4.21Å; F33-F57 HydrophobicContact CB-CE1 4.35Å; F33-F57 HydrophobicContact CD2-CB 3.85Å; F33-F57 HydrophobicContact CD2-CD1 4.13Å; F33-F57 HydrophobicContact CD2-CG 4.05Å; F33-F57 HydrophobicContact CE2-CB 4.26Å; F33-W59 HydrophobicContact CE2-CB 3.76Å; F33-W59 AromaticContact CE2-CD1 3.63Å; F33-W59 HydrophobicContact CE2-CD2 4.25Å; F33-W59 AromaticContact CE2-CG 3.58Å; F33-W59 HydrophobicContact CE2-CG 3.58Å; F33-W59 HydrophobicContact CZ-CB 3.76Å; F33-W59 AromaticContact CZ-CD2 3.92Å; F33-W59 HydrophobicContact CZ-CD2 3.92Å; F33-W59 HydrophobicContact CZ-CE3 4.39Å; F33-W59 AromaticContact CZ-CG 3.62Å; F33-W59 HydrophobicContact CZ-CG 3.62Å; F33-Y66 HydrophobicContact CE1-CG 4.3Å; F33-V68 HydrophobicContact CD1-CG2 4.11Å; F33-V68 HydrophobicContact CD2-CG1 4.13Å; F33-V68 HydrophobicContact CD2-CG2 4.37Å; F33-V68 HydrophobicContact CE1-CG2 3.74Å; F33-V68 HydrophobicContact CE2-CG1 4.2Å; F33-V68 HydrophobicContact CE2-CG2 4.02Å; F33-V68 HydrophobicContact CG-CG2 4.41Å; F33-V68 HydrophobicContact CZ-CG2 3.69Å
34	M	95.8	Very high	94.6	Very high	38 Å²	38	67.1 Å²	67.1	19%	0.187	35%	0.352	C	S	.	.	H	α-helix	trans	-69.1	-40.6	-173.6	-165.3	65.7	-171.2	0	0	111.8	L11 H32 L37 M38 Y66	L11-M34 WeakPolarHBondContact O-CE 3.11Å; H32-M34 PolarHBondContact O-N 2.82Å; M34-L37 WeakPolarHBondContact O-CB 3.46Å; M34-L37 PolarHBondContact O-N 3.12Å; M34-L37 HydrophobicContact SD-CD2 4.04Å; M34-M38 HydrophobicContact CE-CG 4.42Å; M34-M38 HydrophobicContact CE-SD 4.49Å; M34-M38 HydrophobicContact CG-SD 4.46Å; M34-M38 WeakPolarHBondContact O-CG 3.48Å; M34-M38 PolarHBondContact O-N 2.75Å; M34-Y66 HydrophobicContact SD-CE2 4.36Å
35	T	94.9	Very high	94.7	Very high	83 Å²	83	68 Å²	68	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-60.2	-48.5	174.9	-48.4	0	0	0	0	110.8	L37 M38 D39	T35-L37 VanDerWaalsContact C-N 3.28Å; T35-L37 PolarHBondContact O-N 3.42Å; T35-M38 PolarHBondContact O-N 3.08Å; T35-D39 PolarHBondContact O-N 2.68Å
36	L	95.3	Very high	94.7	Very high	35 Å²	35	71.8 Å²	71.8	18%	0.183	38%	0.379	C	S	.	.	H	α-helix	trans	-62.7	-35.2	177.6	-70.6	170.2	0	0	0	112.9	H32 F33 K40 L50 H52 F57	H32-L36 HydrophobicContact CB-CD1 4.29Å; H32-L36 WeakPolarHBondContact O-CB 3.2Å; H32-L36 VanDerWaalsContact O-CG 3.27Å; H32-L36 WeakPolarHBondContact O-CG 3.38Å; H32-L36 PolarHBondContact O-N 2.97Å; H32-L36 VanDerWaalsContact O-N 3.1Å; F33-L36 PolarHBondContact O-N 3.03Å; L36-K40 WeakPolarHBondContact O-CB 3.43Å; L36-K40 WeakPolarHBondContact O-CG 3.27Å; L36-K40 PolarHBondContact O-N 2.87Å; L36-K40 VanDerWaalsContact O-N 3.08Å; L36-L50 HydrophobicContact CB-CD1 4.23Å; L36-H52 HydrophobicContact CD1-CB 3.82Å; L36-F57 HydrophobicContact CD1-CE2 4.34Å
37	L	95.5	Very high	94.6	Very high	3 Å²	3	68.9 Å²	68.9	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-64.4	-47.5	176.8	-177.2	69.9	0	0	0	110.6	F33 M34 T35 K40 E41 L46 L50 W59 Y66	F33-L37 HydrophobicContact CE1-CD2 4.24Å; F33-L37 HydrophobicContact CZ-CD2 4.25Å; F33-L37 WeakPolarHBondContact O-CB 3.24Å; F33-L37 PolarHBondContact O-N 2.9Å; M34-L37 WeakPolarHBondContact O-CB 3.46Å; M34-L37 PolarHBondContact O-N 3.12Å; M34-L37 HydrophobicContact SD-CD2 4.04Å; T35-L37 VanDerWaalsContact C-N 3.28Å; T35-L37 PolarHBondContact O-N 3.42Å; L37-K40 PolarHBondContact O-N 2.81Å; L37-E41 WeakPolarHBondContact O-CB 3.43Å; L37-E41 PolarHBondContact O-N 3.37Å; L37-L46 HydrophobicContact CD1-CD1 3.52Å; L37-L50 HydrophobicContact CB-CD1 3.92Å; L37-L50 HydrophobicContact CD1-CD1 4.05Å; L37-W59 HydrophobicContact CD1-CD2 4.39Å; L37-W59 HydrophobicContact CD1-CH2 3.69Å; L37-W59 HydrophobicContact CD1-CZ2 3.24Å; L37-W59 HydrophobicContact CD1-CZ3 4.43Å; L37-Y66 HydrophobicContact CD2-CE1 3.91Å
38	M	94.3	Very high	94.7	Very high	90 Å²	90	69.9 Å²	69.9	44%	0.443	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-47.8	178.2	-68.7	177.6	67.8	0	0	111.5	M34 T35 K40 E41 E42	M34-M38 HydrophobicContact CE-CG 4.42Å; M34-M38 HydrophobicContact CE-SD 4.49Å; M34-M38 HydrophobicContact CG-SD 4.46Å; M34-M38 WeakPolarHBondContact O-CG 3.48Å; M34-M38 PolarHBondContact O-N 2.75Å; T35-M38 PolarHBondContact O-N 3.08Å; M38-K40 VanDerWaalsContact C-N 3.27Å; M38-K40 PolarHBondContact O-N 2.81Å; M38-E41 PolarHBondContact O-N 3.15Å; M38-E41 VanDerWaalsContact O-N 3.12Å; M38-E42 WeakPolarHBondContact O-CG 3.43Å; M38-E42 PolarHBondContact O-N 2.87Å
39	D	94.6	Very high	94.8	Very high	73 Å²	73	70.5 Å²	70.5	39%	0.39	38%	0.377	S	S	.	.	H	α-helix	trans	-56.3	-43.8	177.4	-66.7	-15.6	0	0	0	111	T35 E43	T35-D39 PolarHBondContact O-N 2.68Å; D39-E43 WeakPolarHBondContact O-CB 3.27Å; D39-E43 VanDerWaalsContact O-CG 3.25Å; D39-E43 WeakPolarHBondContact O-CG 3.35Å; D39-E43 PolarHBondContact O-N 3.47Å
40	K	93.6	Very high	94.9	Very high	72 Å²	72	68.7 Å²	68.7	31%	0.313	37%	0.368	S	S	.	.	H	α-helix	trans	-72.6	-30.4	179.8	-69.6	-70.3	161.7	-148.6	0	113.6	L36 L37 M38 E43 G44 T45 L46 L50	L36-K40 WeakPolarHBondContact O-CB 3.43Å; L36-K40 WeakPolarHBondContact O-CG 3.27Å; L36-K40 PolarHBondContact O-N 2.87Å; L36-K40 VanDerWaalsContact O-N 3.08Å; L37-K40 PolarHBondContact O-N 2.81Å; M38-K40 VanDerWaalsContact C-N 3.27Å; M38-K40 PolarHBondContact O-N 2.81Å; K40-E43 IonicContact NZ-OE2 2.75Å; K40-E43 PolarHBondContact NZ-OE2 2.91Å; K40-G44 PolarHBondContact O-N 3.24Å; K40-T45 WeakPolarHBondContact CD-OG1 3.15Å; K40-T45 CarbonylContact O-C 3.58Å; K40-T45 PolarHBondContact O-N 2.89Å; K40-L46 PolarHBondContact O-N 3Å; K40-L46 VanDerWaalsContact O-N 3.14Å; K40-L50 HydrophobicContact CB-CD2 4.42Å; K40-L50 HydrophobicContact CG-CD2 4.11Å
41	E	93.4	Very high	94.8	Very high	124 Å²	124	70.7 Å²	70.7	58%	0.579	39%	0.386	S	S	*	.	H	α-helix	trans	-69.1	-45.5	173.6	-172.7	168.9	-148.4	0	0	110.9	L37 M38 E43 G44	L37-E41 WeakPolarHBondContact O-CB 3.43Å; L37-E41 PolarHBondContact O-N 3.37Å; M38-E41 PolarHBondContact O-N 3.15Å; M38-E41 VanDerWaalsContact O-N 3.12Å; E41-E43 PolarHBondContact O-N 2.84Å; E41-G44 PolarHBondContact O-N 2.9Å
42	E	93.5	Very high	94.9	Very high	159 Å²	159	66.4 Å²	66.4	74%	0.743	37%	0.366	S	S	*	.	H	α-helix	trans	-64.2	-38.7	176.5	-70.6	-177.9	-173.8	0	0	112.5	M38 G44	M38-E42 WeakPolarHBondContact O-CG 3.43Å; M38-E42 PolarHBondContact O-N 2.87Å; E42-G44 PolarHBondContact O-N 2.86Å
43	E	93.6	Very high	94.7	Very high	120 Å²	120	66.1 Å²	66.1	56%	0.561	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-9.8	173.1	-72.8	176.6	175.2	0	0	113.5	D39 K40 E41 T45	D39-E43 WeakPolarHBondContact O-CB 3.27Å; D39-E43 VanDerWaalsContact O-CG 3.25Å; D39-E43 WeakPolarHBondContact O-CG 3.35Å; D39-E43 PolarHBondContact O-N 3.47Å; K40-E43 IonicContact NZ-OE2 2.75Å; K40-E43 PolarHBondContact NZ-OE2 2.91Å; E41-E43 PolarHBondContact O-N 2.84Å; E43-T45 HydrophobicContact CB-CG2 4.47Å; E43-T45 PolarHBondContact O-N 2.84Å; E43-T45 PolarHBondContact OE2-OG1 2.78Å
44	G	91.9	Very high	94.6	Very high	66 Å²	66	68.2 Å²	68.2	68%	0.68	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	20.3	-174	0	0	0	0	0	114	K40 E41 E42	K40-G44 PolarHBondContact O-N 3.24Å; E41-G44 PolarHBondContact O-N 2.9Å; E42-G44 PolarHBondContact O-N 2.86Å
45	T	93.6	Very high	94.6	Very high	73 Å²	73	66.9 Å²	66.9	45%	0.448	40%	0.399	S	S	.	.			trans	-110.7	27.8	-179.6	61.9	0	0	0	0	112.7	K40 E43 S47	K40-T45 WeakPolarHBondContact CD-OG1 3.15Å; K40-T45 CarbonylContact O-C 3.58Å; K40-T45 PolarHBondContact O-N 2.89Å; E43-T45 HydrophobicContact CB-CG2 4.47Å; E43-T45 PolarHBondContact O-N 2.84Å; E43-T45 PolarHBondContact OE2-OG1 2.78Å; T45-S47 PolarHBondContact O-N 3.35Å
46	L	93.8	Very high	94.7	Very high	84 Å²	84	67.8 Å²	67.8	44%	0.44	39%	0.393	S	S	.	.			trans	-52.3	129.7	-179.9	-172.9	65.5	0	0	0	111.6	L37 K40 W59	L37-L46 HydrophobicContact CD1-CD1 3.52Å; K40-L46 PolarHBondContact O-N 3Å; K40-L46 VanDerWaalsContact O-N 3.14Å; L46-W59 HydrophobicContact CD1-CH2 4.38Å; L46-W59 HydrophobicContact CD1-CZ2 3.84Å; L46-W59 HydrophobicContact CG-CZ2 4.35Å
47	S	94.4	Very high	94.8	Very high	43 Å²	43	66.1 Å²	66.1	30%	0.301	39%	0.385	S	S	.	.			trans	-136	141	-178	171.2	0	0	0	0	110.1	T45 I49 W59	T45-S47 PolarHBondContact O-N 3.35Å; S47-I49 WeakPolarHBondContact CB-O 3.46Å; S47-I49 PolarHBondContact O-N 2.99Å; S47-I49 PolarHBondContact OG-N 2.88Å; S47-I49 VanDerWaalsContact OG-N 3.14Å; S47-I49 PolarHBondContact OG-O 3.27Å; S47-W59 PolarHBondContact O-NE1 3.47Å
48	P	95.8	Very high	95	Very high	72 Å²	72	66.1 Å²	66.1	47%	0.468	39%	0.385	S	S	.	.	S	Bend	trans	-60.9	-10.7	170.7	-22.4	33.8	0	0	0	114	W59 F81	P48-W59 PolarHBondContact O-N 2.95Å; P48-F81 HydrophobicContact CB-CE1 4.09Å; P48-F81 HydrophobicContact CB-CZ 3.63Å
49	I	97	Very high	95.1	Very high	61 Å²	61	63.2 Å²	63.2	31%	0.313	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	113.4	177.9	-49.8	177.1	0	0	0	108.6	S47 R56 F57 M58 V77 F81	S47-I49 WeakPolarHBondContact CB-O 3.46Å; S47-I49 PolarHBondContact O-N 2.99Å; S47-I49 PolarHBondContact OG-N 2.88Å; S47-I49 VanDerWaalsContact OG-N 3.14Å; S47-I49 PolarHBondContact OG-O 3.27Å; I49-R56 HydrophobicContact CG2-CB 4.43Å; I49-F57 CarbonylContact C-O 3.57Å; I49-F57 VanDerWaalsContact CA-O 3.29Å; I49-F57 WeakPolarHBondContact CA-O 3.33Å; I49-M58 HydrophobicContact CG1-CG 4.19Å; I49-M58 HydrophobicContact CG2-CG 4.36Å; I49-V77 HydrophobicContact CD1-CG1 3.67Å; I49-V77 HydrophobicContact CD1-CG2 4.15Å; I49-F81 HydrophobicContact CD1-CE2 4.36Å; I49-F81 HydrophobicContact CG1-CE2 4.15Å; I49-F81 HydrophobicContact CG1-CZ 4.16Å
50	L	96.6	Very high	95.3	Very high	8 Å²	8	60.1 Å²	60.1	4%	0.042	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	163.8	173.6	-52.6	179.9	0	0	0	110.5	F33 L36 L37 K40 R56 F57	F33-L50 HydrophobicContact CD2-CD1 3.92Å; F33-L50 HydrophobicContact CE2-CD1 3.74Å; L36-L50 HydrophobicContact CB-CD1 4.23Å; L37-L50 HydrophobicContact CB-CD1 3.92Å; L37-L50 HydrophobicContact CD1-CD1 4.05Å; K40-L50 HydrophobicContact CB-CD2 4.42Å; K40-L50 HydrophobicContact CG-CD2 4.11Å; L50-R56 WeakPolarHBondContact O-CA 3.23Å; L50-F57 HydrophobicContact CB-CB 4.22Å; L50-F57 HydrophobicContact CB-CD2 4.28Å; L50-F57 PolarHBondContact N-O 2.92Å; L50-F57 PolarHBondContact O-N 2.92Å
51	A	95.8	Very high	95.4	Very high	52 Å²	52	62.4 Å²	62.4	43%	0.43	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	131.5	-177.6	0	0	0	0	0	111.5	V55	A51-V55 WeakPolarHBondContact CA-O 3.36Å
52	H	95.9	Very high	95.5	Very high	63 Å²	63	58.7 Å²	58.7	29%	0.292	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	105.6	167.4	-173.3	-119.8	0	0	0	107.9	E29 H32 L36 G54 V55 F57	E29-H52 IonicContact OE2-CE1 2.83Å; E29-H52 IonicContact OE2-CG 3.7Å; E29-H52 IonicContact OE2-ND1 3.96Å; E29-H52 PolarHBondContact OE2-ND1 2.8Å; H32-H52 AromaticContact CD2-CE1 3.54Å; H32-H52 AromaticContact CD2-NE2 3.53Å; H32-H52 AromaticContact CE1-CE1 3.81Å; H32-H52 AromaticContact CG-CE1 3.73Å; H32-H52 AromaticContact CG-ND1 3.92Å; H32-H52 AromaticContact CG-NE2 3.98Å; H32-H52 AromaticContact ND1-CE1 3.88Å; H32-H52 AromaticContact NE2-CE1 3.6Å; H32-H52 AromaticContact NE2-NE2 3.91Å; L36-H52 HydrophobicContact CD1-CB 3.82Å; H52-G54 PolarHBondContact O-N 3.48Å; H52-G54 VanDerWaalsContact O-N 3.07Å; H52-V55 PolarHBondContact N-O 2.81Å; H52-V55 VanDerWaalsContact N-O 3.09Å; H52-V55 PolarHBondContact O-N 2.81Å; H52-F57 HydrophobicContact CB-CE2 3.62Å; H52-F57 HydrophobicContact CB-CZ 4.16Å
53	G	93.4	Very high	95.5	Very high	69 Å²	69	55.5 Å²	55.5	71%	0.711	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	-116	-171.7	0	0	0	0	0	112.8	R56	G53-R56 PolarHBondContact O-NH1 2.79Å
54	G	93.8	Very high	95.5	Very high	45 Å²	45	51.6 Å²	51.6	46%	0.464	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-6.7	178.2	0	0	0	0	0	115.4	H52	H52-G54 PolarHBondContact O-N 3.48Å; H52-G54 VanDerWaalsContact O-N 3.07Å
55	V	96.7	Very high	95.8	Very high	10 Å²	10	48.5 Å²	48.5	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	142.1	-178.6	-176	0	0	0	0	109.7	V25 E29 A51 H52 F57	V25-V55 HydrophobicContact CG1-CG1 3.8Å; V25-V55 HydrophobicContact CG1-CG2 4.06Å; V25-V55 HydrophobicContact CG2-CG1 4.43Å; E29-V55 HydrophobicContact CG-CG2 4.16Å; A51-V55 WeakPolarHBondContact CA-O 3.36Å; H52-V55 PolarHBondContact N-O 2.81Å; H52-V55 VanDerWaalsContact N-O 3.09Å; H52-V55 PolarHBondContact O-N 2.81Å; V55-F57 HydrophobicContact CB-CE2 4.46Å; V55-F57 HydrophobicContact CG1-CE1 4.3Å; V55-F57 HydrophobicContact CG1-CE2 4.12Å; V55-F57 HydrophobicContact CG1-CZ 3.93Å
56	R	96.9	Very high	96	Very high	102 Å²	102	45.8 Å²	45.8	39%	0.385	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135	173.5	-60.5	-64.2	176.3	-94.4	3.5	109.3	I49 L50 G53 M58 T70 S71	I49-R56 HydrophobicContact CG2-CB 4.43Å; L50-R56 WeakPolarHBondContact O-CA 3.23Å; G53-R56 PolarHBondContact O-NH1 2.79Å; R56-M58 HydrophobicContact CB-SD 3.94Å; R56-T70 CarbonylContact O-C 3.57Å; R56-T70 VanDerWaalsContact O-CA 3.32Å; R56-T70 WeakPolarHBondContact O-CA 3.5Å; R56-S71 PolarHBondContact N-O 3.29Å; R56-S71 PolarHBondContact O-N 3.3Å
57	F	97.6	Very high	96.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	107.3	176.5	-53.8	-94.5	0	0	0	108.4	E29 I30 F33 L36 I49 L50 H52 V55 V68 T70	E29-F57 HydrophobicContact CB-CZ 4.33Å; E29-F57 WeakPolarHBondContact O-CE1 3.42Å; E29-F57 WeakPolarHBondContact O-CZ 3.41Å; I30-F57 HydrophobicContact CD1-CD1 4.41Å; I30-F57 HydrophobicContact CD1-CE1 4.48Å; F33-F57 HydrophobicContact CB-CD1 4.21Å; F33-F57 HydrophobicContact CB-CE1 4.35Å; F33-F57 HydrophobicContact CD2-CB 3.85Å; F33-F57 HydrophobicContact CD2-CD1 4.13Å; F33-F57 HydrophobicContact CD2-CG 4.05Å; F33-F57 HydrophobicContact CE2-CB 4.26Å; L36-F57 HydrophobicContact CD1-CE2 4.34Å; I49-F57 CarbonylContact C-O 3.57Å; I49-F57 VanDerWaalsContact CA-O 3.29Å; I49-F57 WeakPolarHBondContact CA-O 3.33Å; L50-F57 HydrophobicContact CB-CB 4.22Å; L50-F57 HydrophobicContact CB-CD2 4.28Å; L50-F57 PolarHBondContact N-O 2.92Å; L50-F57 PolarHBondContact O-N 2.92Å; H52-F57 HydrophobicContact CB-CE2 3.62Å; H52-F57 HydrophobicContact CB-CZ 4.16Å; V55-F57 HydrophobicContact CB-CE2 4.46Å; V55-F57 HydrophobicContact CG1-CE1 4.3Å; V55-F57 HydrophobicContact CG1-CE2 4.12Å; V55-F57 HydrophobicContact CG1-CZ 3.93Å; F57-V68 HydrophobicContact CB-CG1 4.03Å; F57-V68 HydrophobicContact CD1-CG1 4.07Å; F57-T70 HydrophobicContact CD1-CG2 3.57Å; F57-T70 HydrophobicContact CE1-CG2 3.76Å
58	M	97.9	Very high	96.3	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.8	173.1	-65.4	83.8	80.6	0	0	107.9	I49 R56 A69 A75 V80 F81	I49-M58 HydrophobicContact CG1-CG 4.19Å; I49-M58 HydrophobicContact CG2-CG 4.36Å; R56-M58 HydrophobicContact CB-SD 3.94Å; M58-A69 PolarHBondContact N-O 2.83Å; M58-A69 PolarHBondContact O-N 3.14Å; M58-A75 HydrophobicContact CE-CB 3.9Å; M58-V80 HydrophobicContact CB-CG1 3.9Å; M58-V80 HydrophobicContact CE-CB 4.19Å; M58-V80 HydrophobicContact CE-CG1 3.95Å; M58-V80 HydrophobicContact CE-CG2 3.82Å; M58-V80 HydrophobicContact CG-CG1 4.45Å; M58-F81 HydrophobicContact CB-CE2 4.38Å; M58-F81 HydrophobicContact CB-CZ 4.07Å; M58-F81 HydrophobicContact CG-CE2 4.46Å
59	W	97.9	Very high	96.4	Very high	29 Å²	29	36.5 Å²	36.5	11%	0.11	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.1	-168.9	69.3	-83.3	0	0	0	113.4	F33 L37 L46 S47 P48 K61 Y66 L67 V68 F81	F33-W59 HydrophobicContact CE2-CB 3.76Å; F33-W59 AromaticContact CE2-CD1 3.63Å; F33-W59 HydrophobicContact CE2-CD2 4.25Å; F33-W59 AromaticContact CE2-CG 3.58Å; F33-W59 HydrophobicContact CE2-CG 3.58Å; F33-W59 HydrophobicContact CZ-CB 3.76Å; F33-W59 AromaticContact CZ-CD2 3.92Å; F33-W59 HydrophobicContact CZ-CD2 3.92Å; F33-W59 HydrophobicContact CZ-CE3 4.39Å; F33-W59 AromaticContact CZ-CG 3.62Å; F33-W59 HydrophobicContact CZ-CG 3.62Å; L37-W59 HydrophobicContact CD1-CD2 4.39Å; L37-W59 HydrophobicContact CD1-CH2 3.69Å; L37-W59 HydrophobicContact CD1-CZ2 3.24Å; L37-W59 HydrophobicContact CD1-CZ3 4.43Å; L46-W59 HydrophobicContact CD1-CH2 4.38Å; L46-W59 HydrophobicContact CD1-CZ2 3.84Å; L46-W59 HydrophobicContact CG-CZ2 4.35Å; S47-W59 PolarHBondContact O-NE1 3.47Å; P48-W59 PolarHBondContact O-N 2.95Å; W59-K61 HydrophobicContact CZ3-CB 4.08Å; W59-Y66 AromaticContact CE3-CD1 3.68Å; W59-Y66 HydrophobicContact CE3-CD1 3.68Å; W59-Y66 AromaticContact CE3-CE1 3.94Å; W59-Y66 HydrophobicContact CE3-CE1 3.94Å; W59-Y66 HydrophobicContact CH2-CE1 4.48Å; W59-Y66 AromaticContact CZ3-CD1 3.84Å; W59-Y66 HydrophobicContact CZ3-CD1 3.84Å; W59-Y66 AromaticContact CZ3-CE1 3.61Å; W59-Y66 HydrophobicContact CZ3-CE1 3.61Å; W59-L67 CarbonylContact C-O 3.53Å; W59-L67 VanDerWaalsContact CA-O 3.22Å; W59-L67 WeakPolarHBondContact CA-O 3.11Å; W59-V68 HydrophobicContact CB-CB 4.43Å; W59-V68 HydrophobicContact CB-CG1 4.36Å; W59-V68 HydrophobicContact CB-CG2 3.96Å; W59-F81 WeakPolarHBondContact O-CE1 3.39Å
60	I	97.8	Very high	96.5	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.041	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	152.7	169.4	62.2	177.4	0	0	0	109.5	Y66 L67 F81 L84 Y85 I88	I60-Y66 WeakPolarHBondContact O-CA 3.41Å; I60-L67 HydrophobicContact CG1-CB 3.91Å; I60-L67 PolarHBondContact N-O 2.86Å; I60-L67 PolarHBondContact O-N 3.02Å; I60-F81 HydrophobicContact CG2-CD1 3.64Å; I60-F81 HydrophobicContact CG2-CE1 3.77Å; I60-L84 HydrophobicContact CD1-CB 3.53Å; I60-L84 HydrophobicContact CG1-CB 4.06Å; I60-L84 HydrophobicContact CG1-CD1 4.32Å; I60-Y85 HydrophobicContact CD1-CD1 3.93Å; I60-Y85 HydrophobicContact CD1-CD2 4.46Å; I60-Y85 HydrophobicContact CD1-CE1 4.01Å; I60-Y85 HydrophobicContact CD1-CG 4.15Å; I60-Y85 HydrophobicContact CG2-CE2 4.11Å; I60-I88 HydrophobicContact CD1-CD1 3.32Å; I60-I88 HydrophobicContact CD1-CG1 4.38Å; I60-I88 HydrophobicContact CG1-CD1 4.16Å
61	K	96.4	Very high	96.5	Very high	120 Å²	120	33.3 Å²	33.3	52%	0.522	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.5	174.1	-174.8	176.5	-177	173	0	109.7	W59 L65 Y66	W59-K61 HydrophobicContact CZ3-CB 4.08Å; K61-L65 WeakPolarHBondContact CA-O 3.31Å; K61-Y66 HydrophobicContact CB-CD1 4.02Å; K61-Y66 HydrophobicContact CB-CE1 3.9Å; K61-Y66 HydrophobicContact CD-CE1 3.83Å; K61-Y66 HydrophobicContact CG-CD1 4.23Å; K61-Y66 HydrophobicContact CG-CE1 3.89Å
62	H	95.4	Very high	96.4	Very high	46 Å²	46	37.1 Å²	37.1	21%	0.213	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	116.8	175	-178.9	-94	0	0	0	109	N64 L65 L67 I88	H62-N64 PolarHBondContact O-N 2.86Å; H62-L65 PolarHBondContact N-O 3.32Å; H62-L65 WeakPolarHBondContact O-CA 3.33Å; H62-L65 WeakPolarHBondContact O-CB 3.39Å; H62-L65 PolarHBondContact O-N 2.82Å; H62-L67 HydrophobicContact CB-CD1 4.35Å; H62-I88 HydrophobicContact CB-CD1 3.64Å; H62-I88 HydrophobicContact CB-CG1 4.28Å
63	N	93.8	Very high	96.2	Very high	92 Å²	92	38.2 Å²	38.2	49%	0.492	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	-120.3	-172.5	-61	-16.5	0	0	0	111.7	L98	N63-L98 PolarHBondContact ND2-O 2.95Å
64	N	94.1	Very high	96.2	Very high	38 Å²	38	42.7 Å²	42.7	20%	0.203	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	17.1	176.8	57.7	-11.8	0	0	0	113.6	L11 H62 E99 E100	L11-N64 HydrophobicContact CD1-CB 3.98Å; L11-N64 HydrophobicContact CG-CB 4Å; L11-N64 PolarHBondContact N-O 2.91Å; H62-N64 PolarHBondContact O-N 2.86Å; N64-E99 WeakPolarHBondContact OD1-CA 3.42Å; N64-E100 PolarHBondContact OD1-N 3.18Å
65	L	96.6	Very high	96.2	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	145.5	-176.9	-56.2	176.4	0	0	0	112.3	V8 L9 L16 K61 H62 L67 L98 E100 I103	V8-L65 HydrophobicContact CG1-CB 4.3Å; V8-L65 HydrophobicContact CG1-CD1 4.16Å; V8-L65 HydrophobicContact CG1-CD2 4.14Å; V8-L65 HydrophobicContact CG1-CG 4.45Å; L9-L65 CarbonylContact O-C 3.58Å; L9-L65 VanDerWaalsContact O-CA 3.3Å; L9-L65 WeakPolarHBondContact O-CA 3.48Å; L16-L65 HydrophobicContact CD1-CD2 3.45Å; L16-L65 VanDerWaalsContact CD1-CD2 3.45Å; K61-L65 WeakPolarHBondContact CA-O 3.31Å; H62-L65 PolarHBondContact N-O 3.32Å; H62-L65 WeakPolarHBondContact O-CA 3.33Å; H62-L65 WeakPolarHBondContact O-CB 3.39Å; H62-L65 PolarHBondContact O-N 2.82Å; L65-L67 HydrophobicContact CB-CD1 4.37Å; L65-L98 HydrophobicContact CD1-CD1 4.08Å; L65-L98 HydrophobicContact CD1-CG 3.85Å; L65-E100 HydrophobicContact CD2-CB 4.3Å; L65-I103 HydrophobicContact CD1-CD1 4.5Å; L65-I103 HydrophobicContact CD1-CG1 4.07Å; L65-I103 HydrophobicContact CD2-CG1 4.5Å
66	Y	97.8	Very high	96.1	Very high	17 Å²	17	43 Å²	43	7%	0.067	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	126.6	161.2	-66.8	-77.8	0	0	0	109.6	V8 L9 D10 L11 F33 M34 L37 W59 I60 K61	V8-Y66 CarbonylContact C-O 3.56Å; V8-Y66 WeakPolarHBondContact CA-O 3.41Å; L9-Y66 PolarHBondContact N-O 2.89Å; L9-Y66 PolarHBondContact O-N 2.83Å; D10-Y66 WeakPolarHBondContact O-CD2 3.32Å; L11-Y66 HydrophobicContact CD2-CE2 4.15Å; F33-Y66 HydrophobicContact CE1-CG 4.3Å; M34-Y66 HydrophobicContact SD-CE2 4.36Å; L37-Y66 HydrophobicContact CD2-CE1 3.91Å; W59-Y66 AromaticContact CE3-CD1 3.68Å; W59-Y66 HydrophobicContact CE3-CD1 3.68Å; W59-Y66 AromaticContact CE3-CE1 3.94Å; W59-Y66 HydrophobicContact CE3-CE1 3.94Å; W59-Y66 HydrophobicContact CH2-CE1 4.48Å; W59-Y66 AromaticContact CZ3-CD1 3.84Å; W59-Y66 HydrophobicContact CZ3-CD1 3.84Å; W59-Y66 AromaticContact CZ3-CE1 3.61Å; W59-Y66 HydrophobicContact CZ3-CE1 3.61Å; I60-Y66 WeakPolarHBondContact O-CA 3.41Å; K61-Y66 HydrophobicContact CB-CD1 4.02Å; K61-Y66 HydrophobicContact CB-CE1 3.9Å; K61-Y66 HydrophobicContact CD-CE1 3.83Å; K61-Y66 HydrophobicContact CG-CD1 4.23Å; K61-Y66 HydrophobicContact CG-CE1 3.89Å
67	L	97.9	Very high	96	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.4	167.3	-73	78.7	0	0	0	107.8	Y7 V8 W59 I60 H62 L65 L84 I87 I88	Y7-L67 WeakPolarHBondContact O-CA 3.32Å; V8-L67 HydrophobicContact CG2-CG 4.42Å; W59-L67 CarbonylContact C-O 3.53Å; W59-L67 VanDerWaalsContact CA-O 3.22Å; W59-L67 WeakPolarHBondContact CA-O 3.11Å; I60-L67 HydrophobicContact CG1-CB 3.91Å; I60-L67 PolarHBondContact N-O 2.86Å; I60-L67 PolarHBondContact O-N 3.02Å; H62-L67 HydrophobicContact CB-CD1 4.35Å; L65-L67 HydrophobicContact CB-CD1 4.37Å; L67-L84 HydrophobicContact CB-CD2 4.23Å; L67-I87 HydrophobicContact CD2-CB 4.24Å; L67-I87 HydrophobicContact CD2-CG2 3.86Å; L67-I88 HydrophobicContact CD1-CD1 4.15Å; L67-I88 HydrophobicContact CD1-CG1 4Å; L67-I88 HydrophobicContact CD2-CD1 4.26Å; L67-I88 HydrophobicContact CD2-CG1 3.66Å; L67-I88 HydrophobicContact CG-CG1 4.49Å
68	V	98.1	Very high	95.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.6	-174.2	-172.4	0	0	0	0	109.2	V6 Y7 L9 I30 F33 F57 W59	V6-V68 CarbonylContact C-O 3.56Å; V6-V68 WeakPolarHBondContact CA-O 3.47Å; Y7-V68 WeakPolarHBondContact CD2-O 3.39Å; Y7-V68 PolarHBondContact N-O 2.9Å; Y7-V68 PolarHBondContact O-N 2.86Å; L9-V68 HydrophobicContact CD1-CG2 3.82Å; L9-V68 HydrophobicContact CG-CG2 4.24Å; I30-V68 HydrophobicContact CD1-CB 4.12Å; I30-V68 HydrophobicContact CD1-CG1 3.89Å; I30-V68 HydrophobicContact CD1-CG2 4.5Å; F33-V68 HydrophobicContact CD1-CG2 4.11Å; F33-V68 HydrophobicContact CD2-CG1 4.13Å; F33-V68 HydrophobicContact CD2-CG2 4.37Å; F33-V68 HydrophobicContact CE1-CG2 3.74Å; F33-V68 HydrophobicContact CE2-CG1 4.2Å; F33-V68 HydrophobicContact CE2-CG2 4.02Å; F33-V68 HydrophobicContact CG-CG2 4.41Å; F33-V68 HydrophobicContact CZ-CG2 3.69Å; F57-V68 HydrophobicContact CB-CG1 4.03Å; F57-V68 HydrophobicContact CD1-CG1 4.07Å; W59-V68 HydrophobicContact CB-CB 4.43Å; W59-V68 HydrophobicContact CB-CG1 4.36Å; W59-V68 HydrophobicContact CB-CG2 3.96Å
69	A	97.9	Very high	95.8	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127.8	169.8	0	0	0	0	0	109.9	A3 A5 V6 M58 V80 L84	A3-A69 HydrophobicContact CB-CB 4.1Å; A5-A69 CarbonylContact O-C 3.55Å; A5-A69 WeakPolarHBondContact O-CA 3.36Å; V6-A69 HydrophobicContact CG2-CB 4.25Å; M58-A69 PolarHBondContact N-O 2.83Å; M58-A69 PolarHBondContact O-N 3.14Å; A69-V80 HydrophobicContact CB-CG1 3.42Å; A69-V80 VanDerWaalsContact CB-CG1 3.42Å; A69-L84 HydrophobicContact CB-CD1 4.32Å; A69-L84 HydrophobicContact CB-CD2 4.2Å
70	T	97.4	Very high	95.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.8	178.2	60.2	0	0	0	0	111.6	S4 A5 Y7 R56 F57	S4-T70 WeakPolarHBondContact CB-O 3.41Å; S4-T70 PolarHBondContact N-O 3.21Å; A5-T70 PolarHBondContact O-N 2.9Å; Y7-T70 HydrophobicContact CD2-CG2 4.21Å; Y7-T70 HydrophobicContact CE2-CG2 3.58Å; R56-T70 CarbonylContact O-C 3.57Å; R56-T70 VanDerWaalsContact O-CA 3.32Å; R56-T70 WeakPolarHBondContact O-CA 3.5Å; F57-T70 HydrophobicContact CD1-CG2 3.57Å; F57-T70 HydrophobicContact CE1-CG2 3.76Å
71	S	96.6	Very high	95.7	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	144.6	171.1	-160.4	0	0	0	0	111.5	S2 R56	S2-S71 PolarHBondContact O-OG 2.99Å; S2-S71 VanDerWaalsContact O-OG 3.08Å; R56-S71 PolarHBondContact N-O 3.29Å; R56-S71 PolarHBondContact O-N 3.3Å
72	K	94.8	Very high	95.7	Very high	133 Å²	133	45.9 Å²	45.9	58%	0.578	25%	0.25	S	S	*	.	S	Bend	trans	-98.2	-16.2	175.2	-164.2	173.2	-177.9	172.9	0	113.1	V25	V25-K72 HydrophobicContact CG2-CB 4Å
73	K	91.9	Very high	95.7	Very high	86 Å²	86	44 Å²	44	37%	0.374	24%	0.242	S	C	.	.	S	Bend	trans	-101.7	172.3	-174.7	-65.8	174.9	179.8	148.5	0	110	M1 D24 A75	M1-K73 HydrophobicContact CE-CD 3.9Å; M1-K73 HydrophobicContact SD-CD 3.72Å; D24-K73 IonicContact OD1-NZ 3.35Å; D24-K73 IonicContact OD2-NZ 2.7Å; D24-K73 PolarHBondContact OD2-NZ 3.32Å; K73-A75 VanDerWaalsContact C-N 3.26Å; K73-A75 PolarHBondContact O-N 3.07Å
74	N	92.8	Very high	95.9	Very high	163 Å²	163	39.7 Å²	39.7	87%	0.872	22%	0.218	S	C	*	.			trans	-68.8	86.9	168.6	-172.4	11.6	0	0	0	109.7
75	A	93.3	Very high	96	Very high	10 Å²	10	44.7 Å²	44.7	8%	0.083	24%	0.235	C	C	.	.			trans	-77.6	149.8	-176.6	0	0	0	0	0	111.7	M1 S2 M58 K73 V77	M1-A75 CarbonylContact O-C 3.52Å; M1-A75 VanDerWaalsContact O-CA 3.25Å; M1-A75 WeakPolarHBondContact O-CA 3.32Å; S2-A75 VanDerWaalsContact O-CB 3.25Å; S2-A75 WeakPolarHBondContact O-CB 3.23Å; M58-A75 HydrophobicContact CE-CB 3.9Å; K73-A75 VanDerWaalsContact C-N 3.26Å; K73-A75 PolarHBondContact O-N 3.07Å; A75-V77 PolarHBondContact O-N 2.78Å
76	S	95.2	Very high	96	Very high	50 Å²	50	46.6 Å²	46.6	35%	0.35	24%	0.244	S	C	.	.			trans	-70.1	95.6	166.5	-176.2	0	0	0	0	109.3	M1 S78 L79 V80	M1-S76 PolarHBondContact O-N 3.41Å; S76-S78 VanDerWaalsContact C-N 3.34Å; S76-S78 PolarHBondContact O-N 2.76Å; S76-L79 PolarHBondContact O-N 2.84Å; S76-V80 WeakPolarHBondContact O-CG2 3.42Å; S76-V80 PolarHBondContact O-N 3.43Å; S76-V80 VanDerWaalsContact O-N 3.15Å
77	V	95.5	Very high	95.9	Very high	56 Å²	56	45.9 Å²	45.9	34%	0.339	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-42.5	-174.4	174	0	0	0	0	111.8	I49 A75 L79 V80 F81	I49-V77 HydrophobicContact CD1-CG1 3.67Å; I49-V77 HydrophobicContact CD1-CG2 4.15Å; A75-V77 PolarHBondContact O-N 2.78Å; V77-L79 PolarHBondContact O-N 3.07Å; V77-V80 PolarHBondContact O-N 2.58Å; V77-F81 HydrophobicContact CG1-CD2 3.55Å; V77-F81 HydrophobicContact CG1-CE2 3.42Å; V77-F81 VanDerWaalsContact CG1-CE2 3.42Å; V77-F81 VanDerWaalsContact O-CD2 3.28Å; V77-F81 WeakPolarHBondContact O-CD2 3.42Å; V77-F81 PolarHBondContact O-N 3.32Å
78	S	95.4	Very high	95.8	Very high	83 Å²	83	46.5 Å²	46.5	58%	0.58	24%	0.244	S	C	*	.	H	α-helix	trans	-60.8	-43.9	178.2	53.7	0	0	0	0	111.9	S76 V80 F81 S82	S76-S78 VanDerWaalsContact C-N 3.34Å; S76-S78 PolarHBondContact O-N 2.76Å; S78-V80 VanDerWaalsContact C-N 3.32Å; S78-V80 PolarHBondContact O-N 3.38Å; S78-F81 PolarHBondContact O-N 2.86Å; S78-S82 WeakPolarHBondContact O-CB 3.43Å; S78-S82 PolarHBondContact O-N 3.02Å; S78-S82 PolarHBondContact O-OG 3.42Å; S78-S82 VanDerWaalsContact O-OG 3.12Å
79	L	95.8	Very high	95.6	Very high	63 Å²	63	50.6 Å²	50.6	33%	0.33	26%	0.264	S	S	.	.	H	α-helix	trans	-60.9	-41.9	176.7	178.9	61.5	0	0	0	111.6	S2 S76 V77 F83 P123	S2-L79 WeakPolarHBondContact OG-CD2 3.45Å; S76-L79 PolarHBondContact O-N 2.84Å; V77-L79 PolarHBondContact O-N 3.07Å; L79-F83 VanDerWaalsContact O-CB 3.22Å; L79-F83 WeakPolarHBondContact O-CB 3.38Å; L79-F83 PolarHBondContact O-N 2.99Å; L79-P123 HydrophobicContact CD1-CG 4Å; L79-P123 HydrophobicContact CG-CG 4.43Å
80	V	96.6	Very high	95.4	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-49.9	178.3	173.6	0	0	0	0	110.8	M58 A69 S76 V77 S78 F83 L84	M58-V80 HydrophobicContact CB-CG1 3.9Å; M58-V80 HydrophobicContact CE-CB 4.19Å; M58-V80 HydrophobicContact CE-CG1 3.95Å; M58-V80 HydrophobicContact CE-CG2 3.82Å; M58-V80 HydrophobicContact CG-CG1 4.45Å; A69-V80 HydrophobicContact CB-CG1 3.42Å; A69-V80 VanDerWaalsContact CB-CG1 3.42Å; S76-V80 WeakPolarHBondContact O-CG2 3.42Å; S76-V80 PolarHBondContact O-N 3.43Å; S76-V80 VanDerWaalsContact O-N 3.15Å; V77-V80 PolarHBondContact O-N 2.58Å; S78-V80 VanDerWaalsContact C-N 3.32Å; S78-V80 PolarHBondContact O-N 3.38Å; V80-F83 WeakPolarHBondContact O-CB 3.39Å; V80-F83 PolarHBondContact O-N 3.49Å; V80-L84 HydrophobicContact CG1-CD1 4.25Å; V80-L84 HydrophobicContact CG1-CG 4.34Å; V80-L84 WeakPolarHBondContact O-CG 3.42Å; V80-L84 PolarHBondContact O-N 2.95Å
81	F	97.2	Very high	95.3	Very high	39 Å²	39	50.6 Å²	50.6	17%	0.171	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-44.5	178.8	-78.4	-66.7	0	0	0	112.7	P48 I49 M58 W59 I60 V77 S78 F83 L84 Y85	P48-F81 HydrophobicContact CB-CE1 4.09Å; P48-F81 HydrophobicContact CB-CZ 3.63Å; I49-F81 HydrophobicContact CD1-CE2 4.36Å; I49-F81 HydrophobicContact CG1-CE2 4.15Å; I49-F81 HydrophobicContact CG1-CZ 4.16Å; M58-F81 HydrophobicContact CB-CE2 4.38Å; M58-F81 HydrophobicContact CB-CZ 4.07Å; M58-F81 HydrophobicContact CG-CE2 4.46Å; W59-F81 WeakPolarHBondContact O-CE1 3.39Å; I60-F81 HydrophobicContact CG2-CD1 3.64Å; I60-F81 HydrophobicContact CG2-CE1 3.77Å; V77-F81 HydrophobicContact CG1-CD2 3.55Å; V77-F81 HydrophobicContact CG1-CE2 3.42Å; V77-F81 VanDerWaalsContact CG1-CE2 3.42Å; V77-F81 VanDerWaalsContact O-CD2 3.28Å; V77-F81 WeakPolarHBondContact O-CD2 3.42Å; V77-F81 PolarHBondContact O-N 3.32Å; S78-F81 PolarHBondContact O-N 2.86Å; F81-F83 PolarHBondContact O-N 3.3Å; F81-L84 PolarHBondContact O-N 3.27Å; F81-Y85 WeakPolarHBondContact O-CD2 3.44Å; F81-Y85 PolarHBondContact O-N 2.8Å
82	S	95.7	Very high	95.2	Very high	81 Å²	81	52.1 Å²	52.1	57%	0.566	27%	0.274	S	S	*	.	H	α-helix	trans	-57.3	-39.6	174.6	-67.5	0	0	0	0	111.6	S78 K86	S78-S82 WeakPolarHBondContact O-CB 3.43Å; S78-S82 PolarHBondContact O-N 3.02Å; S78-S82 PolarHBondContact O-OG 3.42Å; S78-S82 VanDerWaalsContact O-OG 3.12Å; S82-K86 VanDerWaalsContact O-CB 3.29Å; S82-K86 WeakPolarHBondContact O-CB 3.39Å; S82-K86 PolarHBondContact O-N 3.42Å
83	F	96.3	Very high	95	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.035	26%	0.263	C	S	.	.	H	α-helix	trans	-68.9	-41.4	175.8	-179.1	-108.6	0	0	0	113	V6 L79 V80 F81 Y85 K86 I87 L117 M118 P123 T126	V6-F83 HydrophobicContact CG2-CE1 4.47Å; L79-F83 VanDerWaalsContact O-CB 3.22Å; L79-F83 WeakPolarHBondContact O-CB 3.38Å; L79-F83 PolarHBondContact O-N 2.99Å; V80-F83 WeakPolarHBondContact O-CB 3.39Å; V80-F83 PolarHBondContact O-N 3.49Å; F81-F83 PolarHBondContact O-N 3.3Å; F83-Y85 PolarHBondContact O-N 2.88Å; F83-K86 CarbonylContact O-C 3.47Å; F83-K86 WeakPolarHBondContact O-CA 3.35Å; F83-K86 WeakPolarHBondContact O-CB 3.17Å; F83-K86 PolarHBondContact O-N 3.16Å; F83-K86 VanDerWaalsContact O-N 3.08Å; F83-I87 HydrophobicContact CD1-CD1 3.7Å; F83-I87 HydrophobicContact CD1-CG1 4.3Å; F83-I87 HydrophobicContact CE1-CD1 3.17Å; F83-I87 HydrophobicContact CE1-CG1 3.87Å; F83-I87 HydrophobicContact CE2-CD1 4.44Å; F83-I87 HydrophobicContact CE2-CG1 4.26Å; F83-I87 HydrophobicContact CZ-CD1 3.6Å; F83-I87 HydrophobicContact CZ-CG1 3.83Å; F83-I87 PolarHBondContact O-N 3.09Å; F83-L117 HydrophobicContact CE2-CB 4.03Å; F83-L117 HydrophobicContact CZ-CB 3.99Å; F83-M118 HydrophobicContact CD1-CE 3.3Å; F83-M118 HydrophobicContact CD1-SD 4.48Å; F83-M118 HydrophobicContact CD2-CE 4.12Å; F83-M118 HydrophobicContact CE1-CB 4.22Å; F83-M118 HydrophobicContact CE1-CE 3.2Å; F83-M118 HydrophobicContact CE1-SD 3.89Å; F83-M118 HydrophobicContact CE2-CB 4.16Å; F83-M118 HydrophobicContact CE2-CE 4.06Å; F83-M118 HydrophobicContact CG-CE 3.76Å; F83-M118 HydrophobicContact CZ-CB 3.6Å; F83-M118 HydrophobicContact CZ-CE 3.62Å; F83-M118 HydrophobicContact CZ-CG 4.46Å; F83-M118 HydrophobicContact CZ-SD 4.25Å; F83-P123 HydrophobicContact CB-CG 4.12Å; F83-P123 HydrophobicContact CD2-CB 3.7Å; F83-P123 HydrophobicContact CD2-CG 3.56Å; F83-P123 HydrophobicContact CE2-CB 4Å; F83-P123 HydrophobicContact CE2-CG 4.15Å; F83-P123 HydrophobicContact CG-CG 3.93Å; F83-T126 HydrophobicContact CD2-CG2 4.47Å; F83-T126 HydrophobicContact CE2-CG2 4.31Å
84	L	97.1	Very high	95	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-43.8	177.1	-67.8	-179.6	0	0	0	111.7	V6 I60 L67 A69 V80 F81 K86 I87 I88	V6-L84 HydrophobicContact CG1-CD2 4.15Å; I60-L84 HydrophobicContact CD1-CB 3.53Å; I60-L84 HydrophobicContact CG1-CB 4.06Å; I60-L84 HydrophobicContact CG1-CD1 4.32Å; L67-L84 HydrophobicContact CB-CD2 4.23Å; A69-L84 HydrophobicContact CB-CD1 4.32Å; A69-L84 HydrophobicContact CB-CD2 4.2Å; V80-L84 HydrophobicContact CG1-CD1 4.25Å; V80-L84 HydrophobicContact CG1-CG 4.34Å; V80-L84 WeakPolarHBondContact O-CG 3.42Å; V80-L84 PolarHBondContact O-N 2.95Å; F81-L84 PolarHBondContact O-N 3.27Å; L84-K86 VanDerWaalsContact C-N 3.28Å; L84-K86 PolarHBondContact O-N 3.16Å; L84-I87 HydrophobicContact CD2-CD1 4.48Å; L84-I87 PolarHBondContact O-N 2.63Å; L84-I88 PolarHBondContact O-N 2.91Å; L84-I88 VanDerWaalsContact O-N 3.15Å
85	Y	96.6	Very high	94.9	Very high	143 Å²	143	39.5 Å²	39.5	56%	0.561	21%	0.212	S	C	*	.	H	α-helix	trans	-64.5	-34.6	172.5	-75.8	-66.9	0	0	0	112.2	I60 F81 F83 I88 Q89	I60-Y85 HydrophobicContact CD1-CD1 3.93Å; I60-Y85 HydrophobicContact CD1-CD2 4.46Å; I60-Y85 HydrophobicContact CD1-CE1 4.01Å; I60-Y85 HydrophobicContact CD1-CG 4.15Å; I60-Y85 HydrophobicContact CG2-CE2 4.11Å; F81-Y85 WeakPolarHBondContact O-CD2 3.44Å; F81-Y85 PolarHBondContact O-N 2.8Å; F83-Y85 PolarHBondContact O-N 2.88Å; Y85-I88 HydrophobicContact CD1-CD1 4.43Å; Y85-I88 PolarHBondContact O-N 2.89Å; Y85-Q89 PolarHBondContact O-N 2.8Å
86	K	95.6	Very high	94.7	Very high	41 Å²	41	48 Å²	48	18%	0.178	25%	0.247	C	C	.	.	H	α-helix	trans	-68.5	-37.4	176.1	-169.4	65.1	-178	178.5	0	112.3	S82 F83 L84 Q89 V90 T126	S82-K86 VanDerWaalsContact O-CB 3.29Å; S82-K86 WeakPolarHBondContact O-CB 3.39Å; S82-K86 PolarHBondContact O-N 3.42Å; F83-K86 CarbonylContact O-C 3.47Å; F83-K86 WeakPolarHBondContact O-CA 3.35Å; F83-K86 WeakPolarHBondContact O-CB 3.17Å; F83-K86 PolarHBondContact O-N 3.16Å; F83-K86 VanDerWaalsContact O-N 3.08Å; L84-K86 VanDerWaalsContact C-N 3.28Å; L84-K86 PolarHBondContact O-N 3.16Å; K86-Q89 WeakPolarHBondContact O-CB 3.4Å; K86-Q89 PolarHBondContact O-N 3.3Å; K86-V90 WeakPolarHBondContact O-CG2 3.25Å; K86-V90 PolarHBondContact O-N 2.9Å; K86-T126 WeakPolarHBondContact CE-O 3.39Å; K86-T126 WeakPolarHBondContact CE-OG1 3.21Å; K86-T126 HydrophobicContact CG-CG2 4.18Å; K86-T126 PolarHBondContact NZ-O 2.9Å
87	I	95.6	Very high	94.4	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-58.7	-49	171.4	-73.9	168.4	0	0	0	110	V6 L67 F83 L84 Q89 V90 F91 L117	V6-I87 HydrophobicContact CG1-CD1 4.15Å; L67-I87 HydrophobicContact CD2-CB 4.24Å; L67-I87 HydrophobicContact CD2-CG2 3.86Å; F83-I87 HydrophobicContact CD1-CD1 3.7Å; F83-I87 HydrophobicContact CD1-CG1 4.3Å; F83-I87 HydrophobicContact CE1-CD1 3.17Å; F83-I87 HydrophobicContact CE1-CG1 3.87Å; F83-I87 HydrophobicContact CE2-CD1 4.44Å; F83-I87 HydrophobicContact CE2-CG1 4.26Å; F83-I87 HydrophobicContact CZ-CD1 3.6Å; F83-I87 HydrophobicContact CZ-CG1 3.83Å; F83-I87 PolarHBondContact O-N 3.09Å; L84-I87 HydrophobicContact CD2-CD1 4.48Å; L84-I87 PolarHBondContact O-N 2.63Å; I87-Q89 VanDerWaalsContact C-N 3.29Å; I87-Q89 PolarHBondContact O-N 3.21Å; I87-V90 PolarHBondContact O-N 2.77Å; I87-F91 HydrophobicContact CG2-CD1 4.34Å; I87-F91 HydrophobicContact CG2-CD2 3.63Å; I87-F91 HydrophobicContact CG2-CE1 4.11Å; I87-F91 HydrophobicContact CG2-CE2 3.38Å; I87-F91 HydrophobicContact CG2-CG 4.11Å; I87-F91 HydrophobicContact CG2-CZ 3.64Å; I87-F91 WeakPolarHBondContact O-CB 3.42Å; I87-F91 WeakPolarHBondContact O-CG 3.24Å; I87-F91 PolarHBondContact O-N 2.7Å; I87-L117 HydrophobicContact CG1-CD1 4.24Å
88	I	95.9	Very high	94.3	Very high	14 Å²	14	49.5 Å²	49.5	7%	0.072	25%	0.245	C	C	.	.	H	α-helix	trans	-55.4	-49	176.7	-68.3	168	0	0	0	109.8	I60 H62 L67 L84 Y85 V90 F91 S92 L98	I60-I88 HydrophobicContact CD1-CD1 3.32Å; I60-I88 HydrophobicContact CD1-CG1 4.38Å; I60-I88 HydrophobicContact CG1-CD1 4.16Å; H62-I88 HydrophobicContact CB-CD1 3.64Å; H62-I88 HydrophobicContact CB-CG1 4.28Å; L67-I88 HydrophobicContact CD1-CD1 4.15Å; L67-I88 HydrophobicContact CD1-CG1 4Å; L67-I88 HydrophobicContact CD2-CD1 4.26Å; L67-I88 HydrophobicContact CD2-CG1 3.66Å; L67-I88 HydrophobicContact CG-CG1 4.49Å; L84-I88 PolarHBondContact O-N 2.91Å; L84-I88 VanDerWaalsContact O-N 3.15Å; Y85-I88 HydrophobicContact CD1-CD1 4.43Å; Y85-I88 PolarHBondContact O-N 2.89Å; I88-V90 PolarHBondContact O-N 3.39Å; I88-F91 PolarHBondContact O-N 3.37Å; I88-S92 WeakPolarHBondContact O-CB 3.46Å; I88-S92 PolarHBondContact O-N 2.87Å; I88-S92 PolarHBondContact O-OG 3.29Å; I88-S92 VanDerWaalsContact O-OG 3.07Å; I88-L98 HydrophobicContact CB-CD2 4.23Å; I88-L98 HydrophobicContact CG1-CD2 4.14Å; I88-L98 HydrophobicContact CG2-CD2 4.06Å
89	Q	94.5	Very high	94.3	Very high	87 Å²	87	49 Å²	49	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-57.6	-50.1	178.8	-173.9	-171.1	-7.8	0	0	111.8	Y85 K86 I87 F91 S92 E93	Y85-Q89 PolarHBondContact O-N 2.8Å; K86-Q89 WeakPolarHBondContact O-CB 3.4Å; K86-Q89 PolarHBondContact O-N 3.3Å; I87-Q89 VanDerWaalsContact C-N 3.29Å; I87-Q89 PolarHBondContact O-N 3.21Å; Q89-F91 PolarHBondContact O-N 3.34Å; Q89-S92 PolarHBondContact O-N 2.95Å; Q89-E93 WeakPolarHBondContact CG-OE1 3.47Å; Q89-E93 PolarHBondContact NE2-OE1 3.01Å; Q89-E93 WeakPolarHBondContact O-CG 3.44Å; Q89-E93 PolarHBondContact O-N 3.39Å
90	V	94.8	Very high	94.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-47.4	-180	172.6	0	0	0	0	110.4	K86 I87 I88 S92 E93 Y94 L113 L117 T126 L131	K86-V90 WeakPolarHBondContact O-CG2 3.25Å; K86-V90 PolarHBondContact O-N 2.9Å; I87-V90 PolarHBondContact O-N 2.77Å; I88-V90 PolarHBondContact O-N 3.39Å; V90-S92 PolarHBondContact O-N 3.14Å; V90-E93 PolarHBondContact O-N 3.13Å; V90-E93 VanDerWaalsContact O-N 3.17Å; V90-Y94 HydrophobicContact CG1-CD2 4.01Å; V90-Y94 HydrophobicContact CG1-CE2 4.04Å; V90-Y94 WeakPolarHBondContact O-CD2 3.28Å; V90-Y94 PolarHBondContact O-N 3.26Å; V90-L113 HydrophobicContact CG1-CD2 4.24Å; V90-L117 HydrophobicContact CG1-CD1 4.47Å; V90-L117 HydrophobicContact CG1-CD2 4.47Å; V90-L117 HydrophobicContact CG2-CD2 4.14Å; V90-T126 VanDerWaalsContact CG2-O 3.31Å; V90-T126 WeakPolarHBondContact CG2-O 3.39Å; V90-L131 HydrophobicContact CG1-CD1 4.11Å
91	F	94.7	Very high	94	Very high	1 Å²	1	54.6 Å²	54.6	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-41.2	179	-70.6	-2.7	0	0	0	112.3	I87 I88 Q89 E93 Y94 F95 L98 I103 I110 L113 M114 L117	I87-F91 HydrophobicContact CG2-CD1 4.34Å; I87-F91 HydrophobicContact CG2-CD2 3.63Å; I87-F91 HydrophobicContact CG2-CE1 4.11Å; I87-F91 HydrophobicContact CG2-CE2 3.38Å; I87-F91 HydrophobicContact CG2-CG 4.11Å; I87-F91 HydrophobicContact CG2-CZ 3.64Å; I87-F91 WeakPolarHBondContact O-CB 3.42Å; I87-F91 WeakPolarHBondContact O-CG 3.24Å; I87-F91 PolarHBondContact O-N 2.7Å; I88-F91 PolarHBondContact O-N 3.37Å; Q89-F91 PolarHBondContact O-N 3.34Å; F91-E93 VanDerWaalsContact C-N 3.29Å; F91-E93 PolarHBondContact O-N 3.08Å; F91-Y94 PolarHBondContact O-N 2.81Å; F91-F95 HydrophobicContact CB-CD2 3.98Å; F91-F95 HydrophobicContact CB-CE2 3.98Å; F91-F95 HydrophobicContact CD1-CE2 4.18Å; F91-F95 HydrophobicContact CG-CE2 4.07Å; F91-F95 WeakPolarHBondContact O-CB 3.38Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 WeakPolarHBondContact O-CG 3.22Å; F91-F95 PolarHBondContact O-N 2.84Å; F91-L98 HydrophobicContact CB-CD1 3.79Å; F91-L98 HydrophobicContact CB-CD2 3.91Å; F91-L98 HydrophobicContact CB-CG 4.36Å; F91-L98 HydrophobicContact CD2-CD1 3.98Å; F91-L98 HydrophobicContact CD2-CD2 4.27Å; F91-L98 HydrophobicContact CG-CD1 4.37Å; F91-I103 HydrophobicContact CD2-CD1 4.37Å; F91-I103 HydrophobicContact CE2-CD1 4.46Å; F91-I110 HydrophobicContact CE2-CG2 4.21Å; F91-I110 HydrophobicContact CZ-CG2 3.8Å; F91-L113 HydrophobicContact CD1-CD1 4Å; F91-L113 HydrophobicContact CE1-CB 4.01Å; F91-L113 HydrophobicContact CE1-CD1 3.91Å; F91-M114 HydrophobicContact CZ-CG 4.1Å; F91-L117 HydrophobicContact CE1-CD1 4.35Å
92	S	93.1	Very high	93.7	Very high	34 Å²	34	53.7 Å²	53.7	24%	0.238	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-35.1	174	-67.9	0	0	0	0	112.3	I88 Q89 V90 K96	I88-S92 WeakPolarHBondContact O-CB 3.46Å; I88-S92 PolarHBondContact O-N 2.87Å; I88-S92 PolarHBondContact O-OG 3.29Å; I88-S92 VanDerWaalsContact O-OG 3.07Å; Q89-S92 PolarHBondContact O-N 2.95Å; V90-S92 PolarHBondContact O-N 3.14Å; S92-K96 CarbonylContact O-C 3.57Å; S92-K96 WeakPolarHBondContact O-CA 3.26Å; S92-K96 PolarHBondContact O-N 3.06Å
93	E	91.2	Very high	93.6	Very high	75 Å²	75	50 Å²	50	35%	0.35	23%	0.23	S	C	.	.	H	α-helix	trans	-72.7	-27.5	175.9	-71.9	-178.1	-147.5	0	0	113.1	Q89 V90 F91 S128	Q89-E93 WeakPolarHBondContact CG-OE1 3.47Å; Q89-E93 PolarHBondContact NE2-OE1 3.01Å; Q89-E93 WeakPolarHBondContact O-CG 3.44Å; Q89-E93 PolarHBondContact O-N 3.39Å; V90-E93 PolarHBondContact O-N 3.13Å; V90-E93 VanDerWaalsContact O-N 3.17Å; F91-E93 VanDerWaalsContact C-N 3.29Å; F91-E93 PolarHBondContact O-N 3.08Å; E93-S128 VanDerWaalsContact CD-OG 3.32Å; E93-S128 VanDerWaalsContact OE2-CB 3.25Å; E93-S128 WeakPolarHBondContact OE2-CB 3.48Å; E93-S128 PolarHBondContact OE2-OG 2.86Å
94	Y	91.6	Very high	93.5	Very high	16 Å²	16	55.4 Å²	55.4	6%	0.063	25%	0.25	C	S	.	.	H	α-helix	trans	-81.5	-43.2	173.9	-89.3	-101	0	0	0	113	V90 F91 I109 L113 L131 Q132 I135 Q137	V90-Y94 HydrophobicContact CG1-CD2 4.01Å; V90-Y94 HydrophobicContact CG1-CE2 4.04Å; V90-Y94 WeakPolarHBondContact O-CD2 3.28Å; V90-Y94 PolarHBondContact O-N 3.26Å; F91-Y94 PolarHBondContact O-N 2.81Å; Y94-I109 HydrophobicContact CD1-CD1 3.7Å; Y94-I109 HydrophobicContact CE1-CD1 3.75Å; Y94-L113 HydrophobicContact CD1-CD1 4.31Å; Y94-L113 HydrophobicContact CD2-CD1 4.31Å; Y94-L113 HydrophobicContact CD2-CD2 4.45Å; Y94-L113 HydrophobicContact CE1-CD1 4.47Å; Y94-L113 HydrophobicContact CE1-CD2 4.29Å; Y94-L113 HydrophobicContact CE2-CD1 4.45Å; Y94-L113 HydrophobicContact CE2-CD2 3.82Å; Y94-L113 HydrophobicContact CG-CD1 4.21Å; Y94-L131 HydrophobicContact CE2-CB 4.39Å; Y94-L131 VanDerWaalsContact OH-CB 3.28Å; Y94-L131 WeakPolarHBondContact OH-CB 3.25Å; Y94-L131 PolarHBondContact OH-O 3.03Å; Y94-Q132 HydrophobicContact CD2-CG 4.41Å; Y94-Q132 HydrophobicContact CE1-CG 3.86Å; Y94-Q132 HydrophobicContact CE2-CG 3.72Å; Y94-Q132 VanDerWaalsContact CZ-CG 3.42Å; Y94-Q132 WeakPolarHBondContact OH-CA 3.39Å; Y94-Q132 WeakPolarHBondContact OH-CG 3.46Å; Y94-Q132 PolarHBondContact OH-N 3.33Å; Y94-I135 WeakPolarHBondContact CE1-O 3.3Å; Y94-I135 PolarHBondContact OH-O 2.9Å; Y94-Q137 HydrophobicContact CD1-CG 4.45Å; Y94-Q137 PolarHBondContact O-NE2 2.82Å
95	F	90.9	Very high	93.2	Very high	26 Å²	26	60.7 Å²	60.7	11%	0.114	28%	0.279	C	S	.	.	H	α-helix	trans	-106.6	-5.2	-169.4	-48.9	-51.7	0	0	0	114.1	F91 E97 N106 I109 I110 L113	F91-F95 HydrophobicContact CB-CD2 3.98Å; F91-F95 HydrophobicContact CB-CE2 3.98Å; F91-F95 HydrophobicContact CD1-CE2 4.18Å; F91-F95 HydrophobicContact CG-CE2 4.07Å; F91-F95 WeakPolarHBondContact O-CB 3.38Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 WeakPolarHBondContact O-CG 3.22Å; F91-F95 PolarHBondContact O-N 2.84Å; F95-E97 PolarHBondContact O-N 2.91Å; F95-N106 HydrophobicContact CD1-CB 4.11Å; F95-N106 HydrophobicContact CE1-CB 3.49Å; F95-N106 VanDerWaalsContact CE1-CB 3.49Å; F95-N106 HydrophobicContact CZ-CB 3.83Å; F95-I109 HydrophobicContact CE1-CG2 3.82Å; F95-I109 HydrophobicContact CZ-CG2 3.9Å; F95-I110 HydrophobicContact CE2-CD1 4.05Å; F95-I110 HydrophobicContact CE2-CG1 3.79Å; F95-I110 HydrophobicContact CZ-CD1 4.15Å; F95-I110 HydrophobicContact CZ-CG1 3.65Å; F95-L113 HydrophobicContact CZ-CD1 4.38Å
96	K	89	Confident	93	Very high	188 Å²	188	56.2 Å²	56.2	82%	0.817	27%	0.265	S	S	*	.	S	Bend	trans	68.2	-57.7	-171.1	-52.1	170.2	-176.9	169	0	112.9	S92	S92-K96 CarbonylContact O-C 3.57Å; S92-K96 WeakPolarHBondContact O-CA 3.26Å; S92-K96 PolarHBondContact O-N 3.06Å
97	E	90.1	Very high	92.8	Very high	136 Å²	136	59.8 Å²	59.8	64%	0.636	28%	0.28	S	S	*	.	S	Bend	trans	-113.6	132.9	175.7	-68.3	-179	172.6	0	0	109.4	F95 S102	F95-E97 PolarHBondContact O-N 2.91Å; E97-S102 WeakPolarHBondContact O-CB 3.48Å; E97-S102 PolarHBondContact O-OG 3.33Å
98	L	93.3	Very high	92.6	Very high	2 Å²	2	63.6 Å²	63.6	1%	0.01	30%	0.303	C	S	.	.			trans	-108.9	98.8	-179.2	179.8	60.7	0	0	0	109.4	N63 L65 I88 F91 I103	N63-L98 PolarHBondContact ND2-O 2.95Å; L65-L98 HydrophobicContact CD1-CD1 4.08Å; L65-L98 HydrophobicContact CD1-CG 3.85Å; I88-L98 HydrophobicContact CB-CD2 4.23Å; I88-L98 HydrophobicContact CG1-CD2 4.14Å; I88-L98 HydrophobicContact CG2-CD2 4.06Å; F91-L98 HydrophobicContact CB-CD1 3.79Å; F91-L98 HydrophobicContact CB-CD2 3.91Å; F91-L98 HydrophobicContact CB-CG 4.36Å; F91-L98 HydrophobicContact CD2-CD1 3.98Å; F91-L98 HydrophobicContact CD2-CD2 4.27Å; F91-L98 HydrophobicContact CG-CD1 4.37Å; L98-I103 HydrophobicContact CD1-CD1 3.69Å; L98-I103 HydrophobicContact CD1-CG1 4.39Å
99	E	94.6	Very high	92.4	Very high	73 Å²	73	63.5 Å²	63.5	34%	0.341	30%	0.303	S	S	.	.	S	Bend	trans	-137.9	176.6	-179.9	-57.5	-167.5	171.2	0	0	110.9	N64 E101 S102 I103	N64-E99 WeakPolarHBondContact OD1-CA 3.42Å; E99-E101 VanDerWaalsContact C-N 3.28Å; E99-E101 PolarHBondContact O-N 3.12Å; E99-S102 PolarHBondContact N-OG 3.23Å; E99-S102 WeakPolarHBondContact O-CB 3.16Å; E99-S102 PolarHBondContact O-N 2.94Å; E99-I103 PolarHBondContact O-N 3Å
100	E	93.7	Very high	92.4	Very high	48 Å²	48	59.4 Å²	59.4	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-53.6	-40.9	178.4	-176.5	178.6	150.8	0	0	113.6	L16 N64 L65 I103 R104	L16-E100 HydrophobicContact CD1-CB 4.26Å; L16-E100 HydrophobicContact CD1-CG 3.88Å; L16-E100 HydrophobicContact CD2-CG 3.96Å; N64-E100 PolarHBondContact OD1-N 3.18Å; L65-E100 HydrophobicContact CD2-CB 4.3Å; E100-I103 PolarHBondContact O-N 3.45Å; E100-R104 PolarHBondContact O-N 3.1Å; E100-R104 IonicContact OE1-CZ 3.4Å; E100-R104 IonicContact OE1-NE 3.16Å; E100-R104 IonicContact OE1-NH1 3.43Å; E100-R104 PolarHBondContact OE1-NH1 3.31Å; E100-R104 IonicContact OE1-NH2 3.49Å; E100-R104 PolarHBondContact OE1-NH2 2.74Å
101	E	91.9	Very high	92.4	Very high	133 Å²	133	64 Å²	64	62%	0.621	30%	0.302	S	S	*	.	H	α-helix	trans	-64.6	-46.1	177.3	-173.1	171.2	-159.2	0	0	111.2	E99 I103 R104 D105	E99-E101 VanDerWaalsContact C-N 3.28Å; E99-E101 PolarHBondContact O-N 3.12Å; E101-I103 PolarHBondContact O-N 2.79Å; E101-R104 PolarHBondContact O-N 2.95Å; E101-D105 PolarHBondContact O-N 2.7Å
102	S	92.6	Very high	92.3	Very high	20 Å²	20	68.5 Å²	68.5	14%	0.14	32%	0.323	C	S	.	.	H	α-helix	trans	-54.6	-39.6	176.2	-44.4	0	0	0	0	112	E97 E99 N106	E97-S102 WeakPolarHBondContact O-CB 3.48Å; E97-S102 PolarHBondContact O-OG 3.33Å; E99-S102 PolarHBondContact N-OG 3.23Å; E99-S102 WeakPolarHBondContact O-CB 3.16Å; E99-S102 PolarHBondContact O-N 2.94Å; S102-N106 VanDerWaalsContact O-CB 3.3Å; S102-N106 WeakPolarHBondContact O-CB 3.35Å; S102-N106 PolarHBondContact O-N 2.69Å; S102-N106 PolarHBondContact O-ND2 2.79Å
103	I	93.5	Very high	92.4	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-69	-43.4	178.4	-59.1	-62.5	0	0	0	111.9	V8 L16 V17 L65 F91 L98 E99 E100 E101 F107 I110	V8-I103 HydrophobicContact CG1-CD1 4.31Å; V8-I103 HydrophobicContact CG1-CG1 4.24Å; L16-I103 HydrophobicContact CB-CG2 3.75Å; L16-I103 HydrophobicContact CD1-CB 4.42Å; L16-I103 HydrophobicContact CD1-CG2 4.47Å; V17-I103 HydrophobicContact CB-CG2 4.21Å; V17-I103 HydrophobicContact CG1-CG2 3.86Å; L65-I103 HydrophobicContact CD1-CD1 4.5Å; L65-I103 HydrophobicContact CD1-CG1 4.07Å; L65-I103 HydrophobicContact CD2-CG1 4.5Å; F91-I103 HydrophobicContact CD2-CD1 4.37Å; F91-I103 HydrophobicContact CE2-CD1 4.46Å; L98-I103 HydrophobicContact CD1-CD1 3.69Å; L98-I103 HydrophobicContact CD1-CG1 4.39Å; E99-I103 PolarHBondContact O-N 3Å; E100-I103 PolarHBondContact O-N 3.45Å; E101-I103 PolarHBondContact O-N 2.79Å; I103-F107 PolarHBondContact O-N 3.29Å; I103-I110 HydrophobicContact CB-CD1 4.27Å; I103-I110 HydrophobicContact CD1-CD1 3.69Å; I103-I110 HydrophobicContact CG2-CD1 4.18Å
104	R	92.4	Very high	92.6	Very high	121 Å²	121	63.4 Å²	63.4	46%	0.457	30%	0.295	S	S	.	.	H	α-helix	trans	-68.3	-42.8	-177.3	-74.6	-177.3	174.8	148.8	10.9	112.4	E100 E101 N106	E100-R104 PolarHBondContact O-N 3.1Å; E100-R104 IonicContact OE1-CZ 3.4Å; E100-R104 IonicContact OE1-NE 3.16Å; E100-R104 IonicContact OE1-NH1 3.43Å; E100-R104 PolarHBondContact OE1-NH1 3.31Å; E100-R104 IonicContact OE1-NH2 3.49Å; E100-R104 PolarHBondContact OE1-NH2 2.74Å; E101-R104 PolarHBondContact O-N 2.95Å; R104-N106 VanDerWaalsContact C-N 3.32Å; R104-N106 PolarHBondContact O-N 3.2Å
105	D	92.1	Very high	92.6	Very high	112 Å²	112	66.5 Å²	66.5	60%	0.599	31%	0.313	S	S	*	.	H	α-helix	trans	-76	-24.7	-175.2	-68.7	-10.9	0	0	0	112.4	E101	E101-D105 PolarHBondContact O-N 2.7Å
106	N	92.3	Very high	92.7	Very high	49 Å²	49	68.8 Å²	68.8	26%	0.262	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	26.1	-173.7	-58.6	-80.4	0	0	0	113.3	F95 S102 R104 V108 I109 I110	F95-N106 HydrophobicContact CD1-CB 4.11Å; F95-N106 HydrophobicContact CE1-CB 3.49Å; F95-N106 VanDerWaalsContact CE1-CB 3.49Å; F95-N106 HydrophobicContact CZ-CB 3.83Å; S102-N106 VanDerWaalsContact O-CB 3.3Å; S102-N106 WeakPolarHBondContact O-CB 3.35Å; S102-N106 PolarHBondContact O-N 2.69Å; S102-N106 PolarHBondContact O-ND2 2.79Å; R104-N106 VanDerWaalsContact C-N 3.32Å; R104-N106 PolarHBondContact O-N 3.2Å; N106-V108 VanDerWaalsContact C-N 3.26Å; N106-V108 PolarHBondContact O-N 2.82Å; N106-V108 VanDerWaalsContact O-N 3.16Å; N106-I109 HydrophobicContact CB-CG2 3.68Å; N106-I109 WeakPolarHBondContact O-CG2 3.28Å; N106-I109 PolarHBondContact O-N 2.83Å; N106-I110 HydrophobicContact CB-CD1 4.19Å; N106-I110 HydrophobicContact CB-CG1 4.48Å; N106-I110 WeakPolarHBondContact O-CD1 3.19Å; N106-I110 VanDerWaalsContact O-CG1 3.27Å; N106-I110 WeakPolarHBondContact O-CG1 3.37Å; N106-I110 PolarHBondContact O-N 3.33Å
107	F	91.5	Very high	93	Very high	116 Å²	116	59.9 Å²	59.9	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-57	-35.9	-172.7	73.9	-86.4	0	0	0	113.8	I103 I110 Y111	I103-F107 PolarHBondContact O-N 3.29Å; F107-I110 PolarHBondContact O-N 3.39Å; F107-Y111 HydrophobicContact CD2-CD2 4.37Å; F107-Y111 HydrophobicContact CD2-CE2 4.42Å; F107-Y111 WeakPolarHBondContact O-CD2 3.4Å; F107-Y111 PolarHBondContact O-N 2.96Å
108	V	91.3	Very high	93.2	Very high	81 Å²	81	53.5 Å²	53.5	49%	0.491	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-56.4	-179.7	179.6	0	0	0	0	110.8	N106 I110 Y111 E112	N106-V108 VanDerWaalsContact C-N 3.26Å; N106-V108 PolarHBondContact O-N 2.82Å; N106-V108 VanDerWaalsContact O-N 3.16Å; V108-I110 VanDerWaalsContact C-N 3.26Å; V108-I110 PolarHBondContact O-N 3.48Å; V108-Y111 PolarHBondContact O-N 3.14Å; V108-Y111 VanDerWaalsContact O-N 3.16Å; V108-E112 PolarHBondContact O-N 2.92Å; V108-E112 VanDerWaalsContact O-N 3.14Å
109	I	91.8	Very high	93.3	Very high	13 Å²	13	58.4 Å²	58.4	7%	0.067	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-31	-179.8	-173.6	169.3	0	0	0	111.8	Y94 F95 N106 E112 L113 I135 Q137	Y94-I109 HydrophobicContact CD1-CD1 3.7Å; Y94-I109 HydrophobicContact CE1-CD1 3.75Å; F95-I109 HydrophobicContact CE1-CG2 3.82Å; F95-I109 HydrophobicContact CZ-CG2 3.9Å; N106-I109 HydrophobicContact CB-CG2 3.68Å; N106-I109 WeakPolarHBondContact O-CG2 3.28Å; N106-I109 PolarHBondContact O-N 2.83Å; I109-E112 PolarHBondContact O-N 3.05Å; I109-L113 HydrophobicContact CG1-CD1 4.12Å; I109-L113 HydrophobicContact CG1-CG 4.25Å; I109-L113 WeakPolarHBondContact O-CB 3.25Å; I109-L113 WeakPolarHBondContact O-CG 3.18Å; I109-L113 PolarHBondContact O-N 2.91Å; I109-I135 HydrophobicContact CD1-CG2 4.29Å; I109-I135 HydrophobicContact CG1-CG2 3.87Å; I109-Q137 HydrophobicContact CD1-CB 4.37Å; I109-Q137 HydrophobicContact CD1-CG 3.39Å
110	I	94.7	Very high	93.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-42	174.5	-70.3	166.8	0	0	0	111	V17 F91 F95 I103 N106 F107 V108 L113 M114	V17-I110 HydrophobicContact CG1-CG2 4.07Å; V17-I110 HydrophobicContact CG2-CG2 4.09Å; F91-I110 HydrophobicContact CE2-CG2 4.21Å; F91-I110 HydrophobicContact CZ-CG2 3.8Å; F95-I110 HydrophobicContact CE2-CD1 4.05Å; F95-I110 HydrophobicContact CE2-CG1 3.79Å; F95-I110 HydrophobicContact CZ-CD1 4.15Å; F95-I110 HydrophobicContact CZ-CG1 3.65Å; I103-I110 HydrophobicContact CB-CD1 4.27Å; I103-I110 HydrophobicContact CD1-CD1 3.69Å; I103-I110 HydrophobicContact CG2-CD1 4.18Å; N106-I110 HydrophobicContact CB-CD1 4.19Å; N106-I110 HydrophobicContact CB-CG1 4.48Å; N106-I110 WeakPolarHBondContact O-CD1 3.19Å; N106-I110 VanDerWaalsContact O-CG1 3.27Å; N106-I110 WeakPolarHBondContact O-CG1 3.37Å; N106-I110 PolarHBondContact O-N 3.33Å; F107-I110 PolarHBondContact O-N 3.39Å; V108-I110 VanDerWaalsContact C-N 3.26Å; V108-I110 PolarHBondContact O-N 3.48Å; I110-L113 PolarHBondContact O-N 3.02Å; I110-M114 HydrophobicContact CG2-CG 4.27Å; I110-M114 HydrophobicContact CG2-SD 4.08Å; I110-M114 WeakPolarHBondContact O-CB 3.35Å; I110-M114 VanDerWaalsContact O-CG 3.24Å; I110-M114 WeakPolarHBondContact O-CG 3.5Å; I110-M114 PolarHBondContact O-N 2.71Å
111	Y	94.1	Very high	93.1	Very high	98 Å²	98	57.3 Å²	57.3	38%	0.384	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-42.4	175	-83.4	-65.9	0	0	0	112.1	V17 C18 F107 V108 M114 D115	V17-Y111 HydrophobicContact CG2-CD1 4.34Å; V17-Y111 HydrophobicContact CG2-CE1 3.82Å; V17-Y111 HydrophobicContact CG2-CE2 4.04Å; C18-Y111 WeakPolarHBondContact O-CE1 3.35Å; F107-Y111 HydrophobicContact CD2-CD2 4.37Å; F107-Y111 HydrophobicContact CD2-CE2 4.42Å; F107-Y111 WeakPolarHBondContact O-CD2 3.4Å; F107-Y111 PolarHBondContact O-N 2.96Å; V108-Y111 PolarHBondContact O-N 3.14Å; V108-Y111 VanDerWaalsContact O-N 3.16Å; Y111-M114 PolarHBondContact O-N 2.91Å; Y111-D115 WeakPolarHBondContact O-CB 3.37Å; Y111-D115 PolarHBondContact O-N 2.72Å
112	E	93.3	Very high	93.2	Very high	95 Å²	95	55.9 Å²	55.9	44%	0.444	27%	0.265	S	S	.	.	H	α-helix	trans	-60.9	-47.1	174.9	-67.9	177.3	179.5	0	0	111.4	V108 I109 M114 D115 E116 I135	V108-E112 PolarHBondContact O-N 2.92Å; V108-E112 VanDerWaalsContact O-N 3.14Å; I109-E112 PolarHBondContact O-N 3.05Å; E112-M114 PolarHBondContact O-N 3.22Å; E112-D115 PolarHBondContact O-N 2.79Å; E112-E116 PolarHBondContact O-N 3.4Å; E112-I135 HydrophobicContact CB-CG2 4.16Å
113	L	94.7	Very high	93.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-47	176	-73.6	169.6	0	0	0	111.5	V90 F91 Y94 F95 I109 I110 D115 E116 L117 L131 I135	V90-L113 HydrophobicContact CG1-CD2 4.24Å; F91-L113 HydrophobicContact CD1-CD1 4Å; F91-L113 HydrophobicContact CE1-CB 4.01Å; F91-L113 HydrophobicContact CE1-CD1 3.91Å; Y94-L113 HydrophobicContact CD1-CD1 4.31Å; Y94-L113 HydrophobicContact CD2-CD1 4.31Å; Y94-L113 HydrophobicContact CD2-CD2 4.45Å; Y94-L113 HydrophobicContact CE1-CD1 4.47Å; Y94-L113 HydrophobicContact CE1-CD2 4.29Å; Y94-L113 HydrophobicContact CE2-CD1 4.45Å; Y94-L113 HydrophobicContact CE2-CD2 3.82Å; Y94-L113 HydrophobicContact CG-CD1 4.21Å; F95-L113 HydrophobicContact CZ-CD1 4.38Å; I109-L113 HydrophobicContact CG1-CD1 4.12Å; I109-L113 HydrophobicContact CG1-CG 4.25Å; I109-L113 WeakPolarHBondContact O-CB 3.25Å; I109-L113 WeakPolarHBondContact O-CG 3.18Å; I109-L113 PolarHBondContact O-N 2.91Å; I110-L113 PolarHBondContact O-N 3.02Å; L113-D115 PolarHBondContact O-N 2.96Å; L113-E116 PolarHBondContact O-N 3.45Å; L113-L117 HydrophobicContact CB-CD1 4.22Å; L113-L117 WeakPolarHBondContact O-CB 3.47Å; L113-L117 VanDerWaalsContact O-CD1 3.32Å; L113-L117 WeakPolarHBondContact O-CD1 3.26Å; L113-L117 WeakPolarHBondContact O-CG 3.38Å; L113-L117 PolarHBondContact O-N 3.26Å; L113-L131 HydrophobicContact CD2-CD1 4.19Å; L113-I135 HydrophobicContact CD2-CD1 3.98Å; L113-I135 HydrophobicContact CD2-CG2 4.07Å; L113-I135 HydrophobicContact CG-CG2 4.2Å
114	M	94.7	Very high	93.2	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-31.2	-179.9	-74	-173.7	84.3	0	0	112.4	V6 V17 R19 Y21 F91 I110 Y111 E112	V6-M114 HydrophobicContact CB-CE 3.91Å; V6-M114 HydrophobicContact CG1-CE 3.88Å; V17-M114 HydrophobicContact CG1-SD 4.41Å; V17-M114 HydrophobicContact CG2-SD 4.12Å; R19-M114 HydrophobicContact CB-CB 4.27Å; R19-M114 HydrophobicContact CB-CE 3.46Å; R19-M114 VanDerWaalsContact CB-CE 3.46Å; R19-M114 HydrophobicContact CB-SD 4.07Å; R19-M114 HydrophobicContact CG-CB 4.29Å; Y21-M114 VanDerWaalsContact CE1-O 3.32Å; Y21-M114 WeakPolarHBondContact CE1-O 3.23Å; Y21-M114 PolarHBondContact OH-O 2.77Å; F91-M114 HydrophobicContact CZ-CG 4.1Å; I110-M114 HydrophobicContact CG2-CG 4.27Å; I110-M114 HydrophobicContact CG2-SD 4.08Å; I110-M114 WeakPolarHBondContact O-CB 3.35Å; I110-M114 VanDerWaalsContact O-CG 3.24Å; I110-M114 WeakPolarHBondContact O-CG 3.5Å; I110-M114 PolarHBondContact O-N 2.71Å; Y111-M114 PolarHBondContact O-N 2.91Å; E112-M114 PolarHBondContact O-N 3.22Å
115	D	93.2	Very high	93.1	Very high	81 Å²	81	57.3 Å²	57.3	43%	0.433	28%	0.28	S	S	.	.	H	α-helix	trans	-71.7	-42.2	175.5	-154.5	50.3	0	0	0	112	R19 Y111 E112 L113	R19-D115 IonicContact CZ-OD1 2.85Å; R19-D115 IonicContact NE-OD1 3.66Å; R19-D115 PolarHBondContact NE-OD1 3.23Å; R19-D115 IonicContact NH2-OD1 2.93Å; R19-D115 PolarHBondContact NH2-OD1 3.1Å; Y111-D115 WeakPolarHBondContact O-CB 3.37Å; Y111-D115 PolarHBondContact O-N 2.72Å; E112-D115 PolarHBondContact O-N 2.79Å; L113-D115 PolarHBondContact O-N 2.96Å
116	E	93.1	Very high	93.1	Very high	74 Å²	74	53.5 Å²	53.5	35%	0.346	26%	0.26	S	S	.	.	H	α-helix	trans	-78	-29.6	-179.2	-75.4	-72.8	155.4	0	0	113.5	E112 L113 M118 L131 Y134 I135	E112-E116 PolarHBondContact O-N 3.4Å; L113-E116 PolarHBondContact O-N 3.45Å; E116-M118 PolarHBondContact O-N 3.16Å; E116-L131 HydrophobicContact CB-CD2 4.37Å; E116-Y134 HydrophobicContact CG-CE2 4.17Å; E116-Y134 PolarHBondContact OE2-OH 2.92Å; E116-I135 HydrophobicContact CB-CD1 3.7Å; E116-I135 HydrophobicContact CG-CD1 3.66Å
117	L	94.7	Very high	93	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-70.5	-31.1	-179.1	-77.6	167.1	0	0	0	112.7	F83 I87 V90 F91 L113 P123 Q124 T125 T126 L131	F83-L117 HydrophobicContact CE2-CB 4.03Å; F83-L117 HydrophobicContact CZ-CB 3.99Å; I87-L117 HydrophobicContact CG1-CD1 4.24Å; V90-L117 HydrophobicContact CG1-CD1 4.47Å; V90-L117 HydrophobicContact CG1-CD2 4.47Å; V90-L117 HydrophobicContact CG2-CD2 4.14Å; F91-L117 HydrophobicContact CE1-CD1 4.35Å; L113-L117 HydrophobicContact CB-CD1 4.22Å; L113-L117 WeakPolarHBondContact O-CB 3.47Å; L113-L117 VanDerWaalsContact O-CD1 3.32Å; L113-L117 WeakPolarHBondContact O-CD1 3.26Å; L113-L117 WeakPolarHBondContact O-CG 3.38Å; L113-L117 PolarHBondContact O-N 3.26Å; L117-P123 CarbonylContact O-C 3.51Å; L117-P123 VanDerWaalsContact O-CA 3.31Å; L117-P123 WeakPolarHBondContact O-CA 3.35Å; L117-Q124 PolarHBondContact O-N 2.85Å; L117-T125 WeakPolarHBondContact CD2-O 3.36Å; L117-T126 HydrophobicContact CD2-CG2 3.94Å; L117-L131 HydrophobicContact CD2-CD1 3.9Å; L117-L131 HydrophobicContact CG-CD1 4.46Å
118	M	94.8	Very high	93	Very high	2 Å²	2	47 Å²	47	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	132.4	-173.4	173.6	175.6	-75.5	0	0	111.5	A3 Y21 F83 E116 G121 Y122 P123	A3-M118 HydrophobicContact CB-CE 4.44Å; A3-M118 HydrophobicContact CB-SD 4.21Å; Y21-M118 HydrophobicContact CD1-CB 4.33Å; Y21-M118 HydrophobicContact CD1-CG 3.93Å; Y21-M118 VanDerWaalsContact CD1-O 3.32Å; Y21-M118 WeakPolarHBondContact CD1-O 3.43Å; Y21-M118 HydrophobicContact CD1-SD 4.38Å; Y21-M118 HydrophobicContact CD2-CG 4.29Å; Y21-M118 HydrophobicContact CD2-SD 3.65Å; Y21-M118 HydrophobicContact CE1-CB 3.77Å; Y21-M118 HydrophobicContact CE1-CG 3.86Å; Y21-M118 WeakPolarHBondContact CE1-O 3.47Å; Y21-M118 HydrophobicContact CE1-SD 4.35Å; Y21-M118 HydrophobicContact CE2-CB 4.46Å; Y21-M118 HydrophobicContact CE2-CG 4.2Å; Y21-M118 HydrophobicContact CE2-SD 3.6Å; Y21-M118 VanDerWaalsContact CE2-SD 3.6Å; Y21-M118 HydrophobicContact CG-CG 4.14Å; Y21-M118 HydrophobicContact CG-SD 4.04Å; F83-M118 HydrophobicContact CD1-CE 3.3Å; F83-M118 HydrophobicContact CD1-SD 4.48Å; F83-M118 HydrophobicContact CD2-CE 4.12Å; F83-M118 HydrophobicContact CE1-CB 4.22Å; F83-M118 HydrophobicContact CE1-CE 3.2Å; F83-M118 HydrophobicContact CE1-SD 3.89Å; F83-M118 HydrophobicContact CE2-CB 4.16Å; F83-M118 HydrophobicContact CE2-CE 4.06Å; F83-M118 HydrophobicContact CG-CE 3.76Å; F83-M118 HydrophobicContact CZ-CB 3.6Å; F83-M118 HydrophobicContact CZ-CE 3.62Å; F83-M118 HydrophobicContact CZ-CG 4.46Å; F83-M118 HydrophobicContact CZ-SD 4.25Å; E116-M118 PolarHBondContact O-N 3.16Å; M118-G121 VanDerWaalsContact SD-CA 3.56Å; M118-Y122 WeakPolarHBondContact CA-O 3.47Å; M118-P123 HydrophobicContact CE-CG 3.84Å
119	D	94	Very high	92.8	Very high	106 Å²	106	46.6 Å²	46.6	57%	0.567	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.8	171	-174.8	12.9	0	0	0	109.9	G121 Y122 Q124	D119-G121 PolarHBondContact O-N 2.98Å; D119-Y122 PolarHBondContact N-O 2.96Å; D119-Y122 WeakPolarHBondContact O-CB 3.34Å; D119-Y122 PolarHBondContact O-N 3Å; D119-Q124 HydrophobicContact CB-CG 4.02Å
120	F	93.5	Very high	92.6	Very high	97 Å²	97	46.2 Å²	46.2	43%	0.425	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	31.7	179.2	-162.4	-112.7	0	0	0	115.2	Y21 R22 Y122	Y21-F120 WeakPolarHBondContact O-CD2 3.24Å; R22-F120 HydrophobicContact CB-CD2 4.4Å; R22-F120 HydrophobicContact CB-CE2 4.14Å; R22-F120 HydrophobicContact CG-CD2 3.88Å; R22-F120 HydrophobicContact CG-CE2 3.98Å; R22-F120 HydrophobicContact CG-CG 4.29Å; R22-F120 HydrophobicContact CG-CZ 4.48Å; F120-Y122 HydrophobicContact CB-CD2 4.48Å; F120-Y122 HydrophobicContact CD1-CD2 4.48Å; F120-Y122 HydrophobicContact CD1-CE2 4Å
121	G	90.7	Very high	92.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	5.4	-178.2	0	0	0	0	0	115	S2 A3 M118 D119	S2-G121 WeakPolarHBondContact CB-O 3.42Å; S2-G121 PolarHBondContact OG-O 2.84Å; A3-G121 VanDerWaalsContact O-CA 3.27Å; A3-G121 WeakPolarHBondContact O-CA 3.44Å; M118-G121 VanDerWaalsContact SD-CA 3.56Å; D119-G121 PolarHBondContact O-N 2.98Å
122	Y	93.7	Very high	92.1	Very high	103 Å²	103	45.4 Å²	45.4	40%	0.404	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.3	176.1	-59.7	-72.8	0	0	0	110	M118 D119 F120 Q124	M118-Y122 WeakPolarHBondContact CA-O 3.47Å; D119-Y122 PolarHBondContact N-O 2.96Å; D119-Y122 WeakPolarHBondContact O-CB 3.34Å; D119-Y122 PolarHBondContact O-N 3Å; F120-Y122 HydrophobicContact CB-CD2 4.48Å; F120-Y122 HydrophobicContact CD1-CD2 4.48Å; F120-Y122 HydrophobicContact CD1-CE2 4Å; Y122-Q124 PolarHBondContact O-N 3.27Å; Y122-Q124 PolarHBondContact O-NE2 2.94Å
123	P	94.6	Very high	91.7	Very high	38 Å²	38	45 Å²	45	25%	0.247	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	133.1	173.4	-25.1	35.7	0	0	0	111.4	L79 F83 L117 M118 T126	L79-P123 HydrophobicContact CD1-CG 4Å; L79-P123 HydrophobicContact CG-CG 4.43Å; F83-P123 HydrophobicContact CB-CG 4.12Å; F83-P123 HydrophobicContact CD2-CB 3.7Å; F83-P123 HydrophobicContact CD2-CG 3.56Å; F83-P123 HydrophobicContact CE2-CB 4Å; F83-P123 HydrophobicContact CE2-CG 4.15Å; F83-P123 HydrophobicContact CG-CG 3.93Å; L117-P123 CarbonylContact O-C 3.51Å; L117-P123 VanDerWaalsContact O-CA 3.31Å; L117-P123 WeakPolarHBondContact O-CA 3.35Å; M118-P123 HydrophobicContact CE-CG 3.84Å; P123-T126 HydrophobicContact CB-CG2 4.33Å
124	Q	91.7	Very high	91.3	Very high	111 Å²	111	46.2 Å²	46.2	52%	0.519	22%	0.224	S	C	.	.			trans	-108.6	-106.4	179.3	-56.5	-57.3	-49.4	0	0	109.4	L117 D119 Y122 T126	L117-Q124 PolarHBondContact O-N 2.85Å; D119-Q124 HydrophobicContact CB-CG 4.02Å; Y122-Q124 PolarHBondContact O-N 3.27Å; Y122-Q124 PolarHBondContact O-NE2 2.94Å; Q124-T126 PolarHBondContact O-N 2.88Å
125	T	90.6	Very high	90.9	Very high	25 Å²	25	46.5 Å²	46.5	15%	0.153	23%	0.225	C	C	.	.			trans	-87.4	111.1	-178.3	-52.8	0	0	0	0	109.6	L117 L131 V153	L117-T125 WeakPolarHBondContact CD2-O 3.36Å; T125-L131 HydrophobicContact CG2-CD2 3.59Å; T125-L131 HydrophobicContact CG2-CG 4.09Å; T125-V153 HydrophobicContact CG2-CG2 4.48Å; T125-V153 WeakPolarHBondContact OG1-CG1 3.44Å
126	T	92.1	Very high	90.3	Very high	32 Å²	32	45 Å²	45	20%	0.196	22%	0.219	C	C	.	.			trans	-115.5	1.4	-178.9	64	0	0	0	0	114.1	F83 K86 V90 L117 P123 Q124 S128	F83-T126 HydrophobicContact CD2-CG2 4.47Å; F83-T126 HydrophobicContact CE2-CG2 4.31Å; K86-T126 WeakPolarHBondContact CE-O 3.39Å; K86-T126 WeakPolarHBondContact CE-OG1 3.21Å; K86-T126 HydrophobicContact CG-CG2 4.18Å; K86-T126 PolarHBondContact NZ-O 2.9Å; V90-T126 VanDerWaalsContact CG2-O 3.31Å; V90-T126 WeakPolarHBondContact CG2-O 3.39Å; L117-T126 HydrophobicContact CD2-CG2 3.94Å; P123-T126 HydrophobicContact CB-CG2 4.33Å; Q124-T126 PolarHBondContact O-N 2.88Å; T126-S128 PolarHBondContact O-N 3.27Å
127	D	90.8	Very high	89.3	Confident	24 Å²	24	46.7 Å²	46.7	13%	0.128	23%	0.227	C	C	.	.			trans	-82.7	97.4	177.6	-72.4	-47.8	0	0	0	110.3	K129 I130 L131 Q240	D127-K129 VanDerWaalsContact C-N 3.29Å; D127-K129 PolarHBondContact O-N 2.79Å; D127-I130 HydrophobicContact CB-CB 4.37Å; D127-I130 HydrophobicContact CB-CG1 4.07Å; D127-I130 WeakPolarHBondContact O-CA 3.38Å; D127-I130 WeakPolarHBondContact O-CB 3.41Å; D127-I130 PolarHBondContact O-N 2.48Å; D127-L131 WeakPolarHBondContact O-CG 3.34Å; D127-L131 PolarHBondContact O-N 2.85Å; D127-Q240 PolarHBondContact OD1-NE2 3.21Å; D127-Q240 PolarHBondContact OD2-NE2 3.11Å
128	S	90.4	Very high	87.9	Confident	6 Å²	6	54.5 Å²	54.5	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-42	-47.3	176.9	47	0	0	0	0	114.3	E93 T126 I130 L131 Q132	E93-S128 VanDerWaalsContact CD-OG 3.32Å; E93-S128 VanDerWaalsContact OE2-CB 3.25Å; E93-S128 WeakPolarHBondContact OE2-CB 3.48Å; E93-S128 PolarHBondContact OE2-OG 2.86Å; T126-S128 PolarHBondContact O-N 3.27Å; S128-I130 PolarHBondContact O-N 3.07Å; S128-L131 WeakPolarHBondContact O-CB 3.49Å; S128-L131 PolarHBondContact O-N 3.09Å; S128-Q132 WeakPolarHBondContact O-CB 3.48Å; S128-Q132 VanDerWaalsContact O-CG 3.25Å; S128-Q132 WeakPolarHBondContact O-CG 3.37Å; S128-Q132 PolarHBondContact O-N 3.49Å
129	K	87.9	Confident	85.6	Confident	72 Å²	72	58.3 Å²	58.3	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-29.5	-179.6	-68.2	179.8	-175.7	162.5	0	113.2	D127 D259 E261	D127-K129 VanDerWaalsContact C-N 3.29Å; D127-K129 PolarHBondContact O-N 2.79Å; K129-D259 WeakPolarHBondContact CD-O 3.4Å; K129-D259 WeakPolarHBondContact CE-O 3.39Å; K129-D259 PolarHBondContact NZ-O 2.98Å; K129-E261 PolarHBondContact NZ-O 3.08Å
130	I	88.5	Confident	83.4	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-83.6	-40.2	175.5	-55.2	-52.4	0	0	0	110.2	D127 S128 Q132 E133 Y134 T152 V153 S158	D127-I130 HydrophobicContact CB-CB 4.37Å; D127-I130 HydrophobicContact CB-CG1 4.07Å; D127-I130 WeakPolarHBondContact O-CA 3.38Å; D127-I130 WeakPolarHBondContact O-CB 3.41Å; D127-I130 PolarHBondContact O-N 2.48Å; S128-I130 PolarHBondContact O-N 3.07Å; I130-Q132 PolarHBondContact O-N 2.81Å; I130-E133 WeakPolarHBondContact O-CB 3.45Å; I130-E133 PolarHBondContact O-N 2.91Å; I130-E133 VanDerWaalsContact O-N 3.1Å; I130-Y134 WeakPolarHBondContact O-CD1 3.34Å; I130-T152 HydrophobicContact CD1-CG2 3.73Å; I130-T152 HydrophobicContact CG1-CG2 4.19Å; I130-T152 HydrophobicContact CG2-CG2 4.43Å; I130-V153 HydrophobicContact CG2-CG2 3.82Å; I130-S158 WeakPolarHBondContact CG1-O 3.31Å
131	L	88.9	Confident	80.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-56.9	-38.5	173.5	-66.5	174	0	0	0	111.3	V90 Y94 L113 E116 L117 T125 D127 S128 E133 Y134 I135	V90-L131 HydrophobicContact CG1-CD1 4.11Å; Y94-L131 HydrophobicContact CE2-CB 4.39Å; Y94-L131 VanDerWaalsContact OH-CB 3.28Å; Y94-L131 WeakPolarHBondContact OH-CB 3.25Å; Y94-L131 PolarHBondContact OH-O 3.03Å; L113-L131 HydrophobicContact CD2-CD1 4.19Å; E116-L131 HydrophobicContact CB-CD2 4.37Å; L117-L131 HydrophobicContact CD2-CD1 3.9Å; L117-L131 HydrophobicContact CG-CD1 4.46Å; T125-L131 HydrophobicContact CG2-CD2 3.59Å; T125-L131 HydrophobicContact CG2-CG 4.09Å; D127-L131 WeakPolarHBondContact O-CG 3.34Å; D127-L131 PolarHBondContact O-N 2.85Å; S128-L131 WeakPolarHBondContact O-CB 3.49Å; S128-L131 PolarHBondContact O-N 3.09Å; L131-E133 PolarHBondContact O-N 2.79Å; L131-E133 VanDerWaalsContact O-N 3.11Å; L131-Y134 HydrophobicContact CD2-CE1 4.17Å; L131-Y134 VanDerWaalsContact CD2-OH 3.3Å; L131-Y134 WeakPolarHBondContact CD2-OH 3.27Å; L131-Y134 PolarHBondContact O-N 2.81Å; L131-Y134 VanDerWaalsContact O-N 3.14Å; L131-I135 HydrophobicContact CB-CD1 4.39Å; L131-I135 HydrophobicContact CD2-CD1 3.95Å; L131-I135 WeakPolarHBondContact O-CB 3.38Å; L131-I135 PolarHBondContact O-N 3.43Å
132	Q	88.8	Confident	78.6	Confident	80 Å²	80	72 Å²	72	37%	0.374	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.7	179.4	-77.8	173.1	-5.4	0	0	113.9	Y94 S128 I130 Y134	Y94-Q132 HydrophobicContact CD2-CG 4.41Å; Y94-Q132 HydrophobicContact CE1-CG 3.86Å; Y94-Q132 HydrophobicContact CE2-CG 3.72Å; Y94-Q132 VanDerWaalsContact CZ-CG 3.42Å; Y94-Q132 WeakPolarHBondContact OH-CA 3.39Å; Y94-Q132 WeakPolarHBondContact OH-CG 3.46Å; Y94-Q132 PolarHBondContact OH-N 3.33Å; S128-Q132 WeakPolarHBondContact O-CB 3.48Å; S128-Q132 VanDerWaalsContact O-CG 3.25Å; S128-Q132 WeakPolarHBondContact O-CG 3.37Å; S128-Q132 PolarHBondContact O-N 3.49Å; I130-Q132 PolarHBondContact O-N 2.81Å; Q132-Y134 VanDerWaalsContact C-N 3.34Å
133	E	85.5	Confident	76.2	Confident	86 Å²	86	74.3 Å²	74.3	40%	0.402	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-23.9	176.5	-62.9	-175.5	-174.6	0	0	112.8	I130 L131 P150 S161	I130-E133 WeakPolarHBondContact O-CB 3.45Å; I130-E133 PolarHBondContact O-N 2.91Å; I130-E133 VanDerWaalsContact O-N 3.1Å; L131-E133 PolarHBondContact O-N 2.79Å; L131-E133 VanDerWaalsContact O-N 3.11Å; E133-P150 HydrophobicContact CB-CG 3.75Å; E133-P150 HydrophobicContact CG-CG 4.47Å; E133-P150 VanDerWaalsContact OE2-CB 3.29Å; E133-P150 WeakPolarHBondContact OE2-CB 3.13Å; E133-P150 WeakPolarHBondContact OE2-CG 3.49Å; E133-S161 VanDerWaalsContact CD-OG 3.31Å; E133-S161 WeakPolarHBondContact OE1-CB 3.35Å; E133-S161 PolarHBondContact OE1-OG 3.4Å; E133-S161 PolarHBondContact OE2-OG 2.99Å
134	Y	84.4	Confident	73.9	Confident	26 Å²	26	78 Å²	78	10%	0.102	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.3	-14.7	-175.2	69.5	-86.6	0	0	0	115.1	E116 I130 L131 Q132 P150 V153	E116-Y134 HydrophobicContact CG-CE2 4.17Å; E116-Y134 PolarHBondContact OE2-OH 2.92Å; I130-Y134 WeakPolarHBondContact O-CD1 3.34Å; L131-Y134 HydrophobicContact CD2-CE1 4.17Å; L131-Y134 VanDerWaalsContact CD2-OH 3.3Å; L131-Y134 WeakPolarHBondContact CD2-OH 3.27Å; L131-Y134 PolarHBondContact O-N 2.81Å; L131-Y134 VanDerWaalsContact O-N 3.14Å; Q132-Y134 VanDerWaalsContact C-N 3.34Å; Y134-P150 HydrophobicContact CD1-CG 3.99Å; Y134-V153 HydrophobicContact CE1-CG2 4.07Å
135	I	86.4	Confident	71.9	Confident	7 Å²	7	76.1 Å²	76.1	4%	0.036	42%	0.418	C	S	.	.	S	Bend	trans	-110.2	94.1	169.4	-52.9	174	0	0	0	107.1	Y94 I109 E112 L113 E116 L131	Y94-I135 WeakPolarHBondContact CE1-O 3.3Å; Y94-I135 PolarHBondContact OH-O 2.9Å; I109-I135 HydrophobicContact CD1-CG2 4.29Å; I109-I135 HydrophobicContact CG1-CG2 3.87Å; E112-I135 HydrophobicContact CB-CG2 4.16Å; L113-I135 HydrophobicContact CD2-CD1 3.98Å; L113-I135 HydrophobicContact CD2-CG2 4.07Å; L113-I135 HydrophobicContact CG-CG2 4.2Å; E116-I135 HydrophobicContact CB-CD1 3.7Å; E116-I135 HydrophobicContact CG-CD1 3.66Å; L131-I135 HydrophobicContact CB-CD1 4.39Å; L131-I135 HydrophobicContact CD2-CD1 3.95Å; L131-I135 WeakPolarHBondContact O-CB 3.38Å; L131-I135 PolarHBondContact O-N 3.43Å
136	T	81.5	Confident	70.4	Confident	49 Å²	49	79.4 Å²	79.4	30%	0.301	45%	0.448	S	S	.	.			trans	-108.6	146.2	-172	57.6	0	0	0	0	112.1	E138 H140	T136-E138 PolarHBondContact OG1-O 2.89Å; T136-H140 PolarHBondContact OG1-CD2 3.03Å
137	Q	71.9	Confident	69.2	Low	111 Å²	111	80.7 Å²	80.7	52%	0.519	46%	0.457	S	S	.	.	S	Bend	trans	-77.2	-23.5	173.8	-70.3	173.9	-7.2	0	0	112.5	Y94 I109	Y94-Q137 HydrophobicContact CD1-CG 4.45Å; Y94-Q137 PolarHBondContact O-NE2 2.82Å; I109-Q137 HydrophobicContact CD1-CB 4.37Å; I109-Q137 HydrophobicContact CD1-CG 3.39Å
138	E	64.9	Low	68.4	Low	165 Å²	165	90.5 Å²	90.5	77%	0.771	49%	0.492	S	S	*	.	S	Bend	trans	-84.1	118.1	179	-67.4	-171.4	171.4	0	0	110.1	T136 H140	T136-E138 PolarHBondContact OG1-O 2.89Å; E138-H140 PolarHBondContact O-N 2.89Å
139	G	47.6	Very low	67.8	Low	81 Å²	81	94.4 Å²	94.4	84%	0.835	52%	0.517	S	S	*	.			trans	-60.5	108.4	176.2	0	0	0	0	0	111.1	K141	G139-K141 PolarHBondContact O-N 2.86Å
140	H	46.1	Very low	67.4	Low	124 Å²	124	92 Å²	92	57%	0.574	51%	0.509	S	S	*	.			trans	-63.9	124.8	169	-76.4	-84.4	0	0	0	109.1	T136 E138 L142	T136-H140 PolarHBondContact OG1-CD2 3.03Å; E138-H140 PolarHBondContact O-N 2.89Å; H140-L142 PolarHBondContact O-N 3.1Å
141	K	41.1	Very low	67.1	Low	187 Å²	187	94.8 Å²	94.8	81%	0.813	53%	0.533	S	S	*	.			trans	-54	131.1	159.2	-81.9	-179.1	176	177.7	0	107.6	G139 D143	G139-K141 PolarHBondContact O-N 2.86Å; K141-D143 PolarHBondContact O-N 2.69Å
142	L	44.3	Very low	66.7	Low	179 Å²	179	95.2 Å²	95.2	94%	0.937	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	29.1	-176.9	-86.7	152.4	0	0	0	116.8	H140	H140-L142 PolarHBondContact O-N 3.1Å
143	D	43.2	Very low	66.1	Low	152 Å²	152	93.4 Å²	93.4	81%	0.813	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-8.1	-176.4	-90.5	-26.1	0	0	0	115.1	K141	K141-D143 PolarHBondContact O-N 2.69Å
144	T	44.5	Very low	65.8	Low	115 Å²	115	95.1 Å²	95.1	71%	0.706	55%	0.546	S	S	*	.	S	Bend	trans	-140.8	128.9	164.6	47.8	0	0	0	0	108.2
145	G	51.3	Low	65.7	Low	72 Å²	72	97.4 Å²	97.4	74%	0.742	56%	0.56	S	S	*	*			trans	-49.9	163.1	-177.5	0	0	0	0	0	113.7
146	A	58	Low	65.5	Low	94 Å²	94	101.9 Å²	101.9	78%	0.777	60%	0.598	S	S	*	*	S	Bend	trans	-41.4	131.7	-176.6	0	0	0	0	0	111.5	R148	A146-R148 PolarHBondContact O-N 3.24Å
147	P	67.7	Low	65.9	Low	59 Å²	59	101.1 Å²	101.1	38%	0.383	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-53.4	130.1	-177.7	20.7	-31	0	0	0	109.4
148	R	74.5	Confident	66.7	Low	231 Å²	231	97.5 Å²	97.5	87%	0.872	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-63.7	140.1	177.1	-69.3	-177.2	-178.6	-178.9	0.3	108.6	A146	A146-R148 PolarHBondContact O-N 3.24Å
149	P	77.3	Confident	68	Low	88 Å²	88	91.3 Å²	91.3	57%	0.571	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-51.7	132.9	175.1	-28.2	35	0	0	0	111.1
150	P	79.4	Confident	70.2	Confident	21 Å²	21	87.7 Å²	87.7	14%	0.136	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-57.7	144.2	177.1	-23.5	31.8	0	0	0	111.3	E133 Y134 T152 V153	E133-P150 HydrophobicContact CB-CG 3.75Å; E133-P150 HydrophobicContact CG-CG 4.47Å; E133-P150 VanDerWaalsContact OE2-CB 3.29Å; E133-P150 WeakPolarHBondContact OE2-CB 3.13Å; E133-P150 WeakPolarHBondContact OE2-CG 3.49Å; Y134-P150 HydrophobicContact CD1-CG 3.99Å; P150-T152 PolarHBondContact O-N 3.22Å; P150-V153 WeakPolarHBondContact O-CB 3.39Å; P150-V153 PolarHBondContact O-N 2.9Å
151	A	81.6	Confident	72.2	Confident	64 Å²	64	82.2 Å²	82.2	53%	0.529	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-58.2	-23.1	173.2	0	0	0	0	0	112.2	V153 T154 N155	A151-V153 PolarHBondContact O-N 3.06Å; A151-T154 PolarHBondContact O-N 2.9Å; A151-T154 VanDerWaalsContact O-N 3.12Å; A151-T154 PolarHBondContact O-OG1 2.9Å; A151-N155 WeakPolarHBondContact O-CB 3.38Å; A151-N155 PolarHBondContact O-N 2.86Å; A151-N155 PolarHBondContact O-ND2 3.25Å
152	T	80.3	Confident	74.5	Confident	8 Å²	8	80.3 Å²	80.3	5%	0.049	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-54.5	-34.5	173	-43.5	0	0	0	0	112.3	I130 P150 T154 N155 V157 S158 S161	I130-T152 HydrophobicContact CD1-CG2 3.73Å; I130-T152 HydrophobicContact CG1-CG2 4.19Å; I130-T152 HydrophobicContact CG2-CG2 4.43Å; P150-T152 PolarHBondContact O-N 3.22Å; T152-T154 VanDerWaalsContact C-N 3.27Å; T152-T154 PolarHBondContact O-N 2.96Å; T152-N155 PolarHBondContact O-N 3.19Å; T152-V157 WeakPolarHBondContact CG2-O 3.2Å; T152-S158 WeakPolarHBondContact O-CA 3.27Å; T152-S161 WeakPolarHBondContact OG1-CA 3.48Å; T152-S161 PolarHBondContact OG1-OG 3.47Å
153	V	76.3	Confident	76.5	Confident	43 Å²	43	74.6 Å²	74.6	26%	0.261	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-63.1	-33.6	179.7	177.9	0	0	0	0	112	T125 I130 Y134 P150 A151	T125-V153 HydrophobicContact CG2-CG2 4.48Å; T125-V153 WeakPolarHBondContact OG1-CG1 3.44Å; I130-V153 HydrophobicContact CG2-CG2 3.82Å; Y134-V153 HydrophobicContact CE1-CG2 4.07Å; P150-V153 WeakPolarHBondContact O-CB 3.39Å; P150-V153 PolarHBondContact O-N 2.9Å; A151-V153 PolarHBondContact O-N 3.06Å
154	T	80.3	Confident	78.9	Confident	121 Å²	121	69 Å²	69	74%	0.742	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-7.6	-178	57.7	0	0	0	0	113.6	A151 T152	A151-T154 PolarHBondContact O-N 2.9Å; A151-T154 VanDerWaalsContact O-N 3.12Å; A151-T154 PolarHBondContact O-OG1 2.9Å; T152-T154 VanDerWaalsContact C-N 3.27Å; T152-T154 PolarHBondContact O-N 2.96Å
155	N	82	Confident	81.2	Confident	75 Å²	75	72.2 Å²	72.2	40%	0.401	44%	0.439	S	S	.	.	S	Bend	trans	-78.5	154.7	-179.9	-83.3	-20.3	0	0	0	112.3	A151 T152 V157	A151-N155 WeakPolarHBondContact O-CB 3.38Å; A151-N155 PolarHBondContact O-N 2.86Å; A151-N155 PolarHBondContact O-ND2 3.25Å; T152-N155 PolarHBondContact O-N 3.19Å; N155-V157 PolarHBondContact O-N 2.84Å
156	A	81.3	Confident	83.3	Confident	100 Å²	100	72.4 Å²	72.4	83%	0.826	42%	0.418	S	S	*	.	S	Bend	trans	-63.2	-20.4	172.3	0	0	0	0	0	113.3
157	V	89.6	Confident	84.9	Confident	34 Å²	34	80.3 Å²	80.3	21%	0.206	43%	0.428	C	S	.	.			trans	-104.6	93.2	170	-179.6	0	0	0	0	107	T152 N155 W159 R160 M207 I256	T152-V157 WeakPolarHBondContact CG2-O 3.2Å; N155-V157 PolarHBondContact O-N 2.84Å; V157-W159 HydrophobicContact CG1-CD2 4.34Å; V157-W159 HydrophobicContact CG1-CZ2 4.02Å; V157-W159 HydrophobicContact CG2-CZ2 4.46Å; V157-R160 HydrophobicContact CG1-CB 4.28Å; V157-M207 HydrophobicContact CB-CE 4.41Å; V157-M207 HydrophobicContact CG1-CE 3.84Å; V157-I256 HydrophobicContact CG1-CG2 4.39Å; V157-I256 HydrophobicContact CG2-CD1 4.12Å
158	S	89.8	Confident	86.1	Confident	35 Å²	35	84.7 Å²	84.7	25%	0.245	44%	0.441	C	S	.	.			trans	-92.2	0.8	-172.6	63.6	0	0	0	0	114.6	I130 T152	I130-S158 WeakPolarHBondContact CG1-O 3.31Å; T152-S158 WeakPolarHBondContact O-CA 3.27Å
159	W	91.4	Very high	87.1	Confident	35 Å²	35	74.8 Å²	74.8	13%	0.133	41%	0.405	C	S	.	.	S	Bend	trans	-119.4	3.6	-170.5	56.2	76	0	0	0	113.9	V157 Q240 C241 I256 P258	V157-W159 HydrophobicContact CG1-CD2 4.34Å; V157-W159 HydrophobicContact CG1-CZ2 4.02Å; V157-W159 HydrophobicContact CG2-CZ2 4.46Å; W159-Q240 HydrophobicContact CD2-CG 4.28Å; W159-Q240 HydrophobicContact CE3-CB 4.49Å; W159-Q240 HydrophobicContact CE3-CG 3.69Å; W159-Q240 HydrophobicContact CZ3-CB 4.4Å; W159-Q240 HydrophobicContact CZ3-CG 4.09Å; W159-C241 HydrophobicContact CD2-CB 4.1Å; W159-C241 VanDerWaalsContact CE2-CB 3.44Å; W159-C241 HydrophobicContact CG-CB 4.44Å; W159-C241 HydrophobicContact CZ2-CB 3.72Å; W159-I256 PolarHBondContact NE1-O 3.01Å; W159-P258 HydrophobicContact CB-CG 4.11Å; W159-P258 HydrophobicContact CG-CG 4.07Å; W159-P258 WeakPolarHBondContact O-CA 3.41Å
160	R	93.2	Very high	88	Confident	4 Å²	4	72.9 Å²	72.9	2%	0.015	39%	0.389	C	S	.	.			trans	-149	120.1	179.3	-171.8	-173.5	-175.2	69.3	9.7	110.9	V157 I164 L204 G206 M207 P257 D259	V157-R160 HydrophobicContact CG1-CB 4.28Å; R160-I164 HydrophobicContact CG-CD1 4.02Å; R160-L204 PolarHBondContact NH2-O 3.45Å; R160-G206 PolarHBondContact NE-O 3.04Å; R160-G206 PolarHBondContact NH2-O 2.87Å; R160-M207 HydrophobicContact CB-CE 4.24Å; R160-M207 HydrophobicContact CB-SD 4.28Å; R160-M207 WeakPolarHBondContact CD-SD 3.04Å; R160-M207 HydrophobicContact CG-CE 4.31Å; R160-M207 HydrophobicContact CG-SD 3.71Å; R160-P257 WeakPolarHBondContact CD-O 3.4Å; R160-P257 PolarHBondContact NH1-O 3.46Å; R160-D259 IonicContact CZ-OD1 2.81Å; R160-D259 IonicContact NH1-OD1 3.72Å; R160-D259 PolarHBondContact NH1-OD1 3.24Å; R160-D259 VanDerWaalsContact NH1-OD1 3.1Å; R160-D259 IonicContact NH2-OD1 3.81Å
161	S	88.9	Confident	88.9	Confident	10 Å²	10	71.9 Å²	71.9	7%	0.07	38%	0.382	C	S	.	.			trans	-80.1	150.6	175.9	-61.7	0	0	0	0	112.7	E133 T152 I164	E133-S161 VanDerWaalsContact CD-OG 3.31Å; E133-S161 WeakPolarHBondContact OE1-CB 3.35Å; E133-S161 PolarHBondContact OE1-OG 3.4Å; E133-S161 PolarHBondContact OE2-OG 2.99Å; T152-S161 WeakPolarHBondContact OG1-CA 3.48Å; T152-S161 PolarHBondContact OG1-OG 3.47Å; S161-I164 VanDerWaalsContact O-CD1 3.31Å; S161-I164 WeakPolarHBondContact O-CD1 3.29Å; S161-I164 WeakPolarHBondContact O-CG1 3.38Å
162	E	88.6	Confident	89.7	Confident	147 Å²	147	71.7 Å²	71.7	69%	0.687	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	158.8	175.1	-62.2	-170.6	171.5	0	0	111.5	I164 M207	E162-I164 VanDerWaalsContact C-N 3.34Å; E162-I164 PolarHBondContact O-N 3.18Å; E162-M207 HydrophobicContact CG-CG 4.18Å; E162-M207 HydrophobicContact CG-SD 4.35Å
163	G	88.1	Confident	90.5	Very high	59 Å²	59	71.4 Å²	71.4	61%	0.608	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-0.8	173.1	0	0	0	0	0	116.1	K165	G163-K165 PolarHBondContact O-N 2.61Å
164	I	92.3	Very high	91.5	Very high	35 Å²	35	70.3 Å²	70.3	18%	0.179	36%	0.36	C	S	.	.			trans	-55.9	130.3	173.4	-60.9	173.7	0	0	0	110	R160 S161 E162 Y166 L204 S205 G206 D259	R160-I164 HydrophobicContact CG-CD1 4.02Å; S161-I164 VanDerWaalsContact O-CD1 3.31Å; S161-I164 WeakPolarHBondContact O-CD1 3.29Å; S161-I164 WeakPolarHBondContact O-CG1 3.38Å; E162-I164 VanDerWaalsContact C-N 3.34Å; E162-I164 PolarHBondContact O-N 3.18Å; I164-Y166 HydrophobicContact CG2-CD2 3.9Å; I164-Y166 HydrophobicContact CG2-CE2 3.44Å; I164-Y166 VanDerWaalsContact CG2-CE2 3.44Å; I164-L204 WeakPolarHBondContact CG2-O 3.4Å; I164-S205 CarbonylContact O-C 3.48Å; I164-S205 VanDerWaalsContact O-CA 3.25Å; I164-S205 WeakPolarHBondContact O-CA 3.33Å; I164-G206 PolarHBondContact O-N 2.89Å; I164-D259 HydrophobicContact CD1-CB 3.75Å
165	K	93.9	Very high	92.3	Very high	182 Å²	182	64.5 Å²	64.5	79%	0.791	33%	0.325	S	S	*	.			trans	-137.2	129.7	-178.7	-76.6	176.4	-176.4	174.7	0	110.9	G163	G163-K165 PolarHBondContact O-N 2.61Å
166	Y	94	Very high	93.1	Very high	76 Å²	76	62.1 Å²	62.1	30%	0.298	31%	0.312	S	S	.	.			trans	-118.4	143.8	173.4	-73.3	-84.1	0	0	0	110.4	I164 K168 F203 L204 S205 D259	I164-Y166 HydrophobicContact CG2-CD2 3.9Å; I164-Y166 HydrophobicContact CG2-CE2 3.44Å; I164-Y166 VanDerWaalsContact CG2-CE2 3.44Å; Y166-K168 VanDerWaalsContact C-N 3.27Å; Y166-K168 WeakPolarHBondContact CB-O 3.23Å; Y166-F203 HydrophobicContact CD1-CB 4.01Å; Y166-F203 HydrophobicContact CD1-CD1 4.44Å; Y166-F203 HydrophobicContact CD2-CB 4.4Å; Y166-F203 HydrophobicContact CE1-CB 3.99Å; Y166-F203 AromaticContact CE1-CD1 3.68Å; Y166-F203 HydrophobicContact CE1-CD1 3.68Å; Y166-F203 HydrophobicContact CE1-CG 4.31Å; Y166-F203 HydrophobicContact CE2-CB 4.36Å; Y166-F203 HydrophobicContact CG-CB 4.21Å; Y166-F203 AromaticContact CZ-CD1 3.85Å; Y166-L204 WeakPolarHBondContact CD2-O 3.45Å; Y166-S205 PolarHBondContact N-OG 2.58Å; Y166-S205 PolarHBondContact O-OG 3.01Å; Y166-D259 WeakPolarHBondContact CE2-OD1 3.48Å; Y166-D259 PolarHBondContact OH-OD2 3.27Å
167	R	92.5	Very high	93.8	Very high	260 Å²	260	57.3 Å²	57.3	98%	0.981	27%	0.272	S	S	*	.	S	Bend	trans	-66.5	-33.4	172.1	-68.7	-176.8	179.8	-180	-0.3	111.8
168	K	93.8	Very high	94.1	Very high	150 Å²	150	56.9 Å²	56.9	65%	0.652	27%	0.271	S	S	*	.	S	Bend	trans	-128	126.7	176.5	-69	-174.2	176.3	-176.1	0	108.6	Y166 E170	Y166-K168 VanDerWaalsContact C-N 3.27Å; Y166-K168 WeakPolarHBondContact CB-O 3.23Å; K168-E170 HydrophobicContact CB-CG 4.43Å
169	N	95.6	Very high	94.4	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.128	26%	0.26	C	S	.	.			trans	-93.7	108.9	179.3	-63	-69.9	0	0	0	109.3	F203 L204 S205 Y403 A405 L406	N169-F203 CarbonylContact C-O 3.59Å; N169-F203 VanDerWaalsContact CA-O 3.25Å; N169-F203 WeakPolarHBondContact CA-O 3.37Å; N169-L204 HydrophobicContact CB-CD2 3.82Å; N169-S205 WeakPolarHBondContact OD1-CB 3.47Å; N169-S205 PolarHBondContact OD1-N 2.84Å; N169-S205 PolarHBondContact OD1-OG 2.98Å; N169-Y403 HydrophobicContact CB-CD2 3.76Å; N169-Y403 HydrophobicContact CB-CE2 3.69Å; N169-A405 HydrophobicContact CB-CB 3.86Å; N169-A405 VanDerWaalsContact O-CA 3.28Å; N169-A405 WeakPolarHBondContact O-CA 3.45Å; N169-L406 PolarHBondContact O-N 2.81Å; N169-L406 VanDerWaalsContact O-N 3.1Å
170	E	96	Very high	94.6	Very high	48 Å²	48	54.7 Å²	54.7	22%	0.224	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	144.8	-173.7	-63.8	-178	159.7	0	0	110.3	K168 F172 F203	K168-E170 HydrophobicContact CB-CG 4.43Å; E170-F172 HydrophobicContact CB-CE2 3.88Å; E170-F172 HydrophobicContact CB-CZ 4.15Å; E170-F203 PolarHBondContact N-O 3.22Å; E170-F203 CarbonylContact O-C 3.55Å; E170-F203 WeakPolarHBondContact O-CA 3.25Å; E170-F203 PolarHBondContact O-N 2.76Å
171	V	97.4	Very high	94.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	126.7	175.7	-175.4	0	0	0	0	108.6	L173 M200 V202 L204 L395 I397 L406 P407 W408	V171-L173 HydrophobicContact CG1-CD1 3.78Å; V171-M200 HydrophobicContact CG1-CE 3.41Å; V171-M200 VanDerWaalsContact CG1-CE 3.41Å; V171-V202 HydrophobicContact CG1-CG2 4.16Å; V171-L204 HydrophobicContact CG2-CD1 3.68Å; V171-L204 HydrophobicContact CG2-CD2 3.75Å; V171-L204 HydrophobicContact CG2-CG 3.75Å; V171-L395 HydrophobicContact CB-CD2 4.13Å; V171-L395 HydrophobicContact CG1-CD2 3.81Å; V171-L395 HydrophobicContact CG2-CD2 4.41Å; V171-I397 HydrophobicContact CG2-CD1 3.98Å; V171-L406 PolarHBondContact N-O 3.41Å; V171-P407 CarbonylContact O-C 3.56Å; V171-P407 WeakPolarHBondContact O-CA 3.39Å; V171-W408 PolarHBondContact O-N 2.86Å
172	F	97.7	Very high	94.9	Very high	59 Å²	59	56 Å²	56	26%	0.259	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.8	174.8	-54	-91.6	0	0	0	109.7	E170 M200 R201 F203 W408	E170-F172 HydrophobicContact CB-CE2 3.88Å; E170-F172 HydrophobicContact CB-CZ 4.15Å; F172-M200 CarbonylContact O-C 3.55Å; F172-M200 VanDerWaalsContact O-CA 3.3Å; F172-M200 WeakPolarHBondContact O-CA 3.46Å; F172-R201 HydrophobicContact CB-CB 4.2Å; F172-R201 HydrophobicContact CD2-CB 4.34Å; F172-R201 PolarHBondContact N-O 3.12Å; F172-R201 PolarHBondContact O-N 3.43Å; F172-F203 HydrophobicContact CD2-CD2 4.02Å; F172-F203 AromaticContact CD2-CE2 3.9Å; F172-F203 HydrophobicContact CD2-CE2 3.9Å; F172-F203 AromaticContact CE2-CD2 3.83Å; F172-F203 HydrophobicContact CE2-CD2 3.83Å; F172-F203 AromaticContact CE2-CE2 3.89Å; F172-F203 HydrophobicContact CE2-CE2 3.89Å; F172-W408 CarbonylContact C-O 3.51Å; F172-W408 HydrophobicContact CD1-CB 3.64Å; F172-W408 AromaticContact CD1-CD1 3.78Å; F172-W408 AromaticContact CD1-CG 3.86Å; F172-W408 HydrophobicContact CD1-CG 3.86Å; F172-W408 HydrophobicContact CE1-CB 4.1Å; F172-W408 AromaticContact CE1-CD1 3.43Å; F172-W408 VanDerWaalsContact CE1-CD1 3.43Å; F172-W408 AromaticContact CE1-CG 3.79Å; F172-W408 HydrophobicContact CE1-CG 3.79Å; F172-W408 HydrophobicContact CG-CB 4.45Å; F172-W408 AromaticContact CZ-CD1 4Å
173	L	97.6	Very high	95.2	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.4	177.3	-68.5	88.1	0	0	0	109.3	V171 I198 M200 L212 V392 L395 W408 V409 R410	V171-L173 HydrophobicContact CG1-CD1 3.78Å; L173-I198 HydrophobicContact CD2-CG2 4.43Å; L173-M200 HydrophobicContact CD1-CE 4.22Å; L173-M200 HydrophobicContact CD2-CE 4.23Å; L173-M200 HydrophobicContact CG-CE 4.03Å; L173-M200 HydrophobicContact CG-CG 4.31Å; L173-L212 HydrophobicContact CD2-CD1 3.97Å; L173-V392 HydrophobicContact CD2-CG1 4.47Å; L173-L395 HydrophobicContact CD1-CD2 4Å; L173-W408 WeakPolarHBondContact CD1-O 3.46Å; L173-W408 PolarHBondContact N-O 2.74Å; L173-V409 HydrophobicContact CB-CB 4.21Å; L173-V409 HydrophobicContact CB-CG2 4.07Å; L173-V409 CarbonylContact O-C 3.58Å; L173-V409 VanDerWaalsContact O-CA 3.29Å; L173-V409 WeakPolarHBondContact O-CA 3.27Å; L173-R410 PolarHBondContact O-N 2.78Å
174	D	97.6	Very high	95.4	Very high	19 Å²	19	47.2 Å²	47.2	10%	0.102	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	106.2	173.2	-71.4	-7.4	0	0	0	108	I176 I198 K199 R410	D174-I176 HydrophobicContact CB-CD1 4.27Å; D174-I176 HydrophobicContact CB-CG1 4.19Å; D174-I198 WeakPolarHBondContact O-CA 3.3Å; D174-K199 HydrophobicContact CB-CB 4.3Å; D174-K199 PolarHBondContact N-O 2.87Å; D174-K199 PolarHBondContact O-N 3.01Å; D174-R410 WeakPolarHBondContact OD1-CD 3.48Å; D174-R410 WeakPolarHBondContact OD1-CG 3.49Å; D174-R410 IonicContact OD1-CZ 2.77Å; D174-R410 IonicContact OD1-NE 3.39Å; D174-R410 PolarHBondContact OD1-NE 3.35Å; D174-R410 IonicContact OD1-NH2 2.9Å; D174-R410 IonicContact OD2-CZ 2.66Å; D174-R410 IonicContact OD2-NE 3.49Å; D174-R410 PolarHBondContact OD2-NE 2.76Å; D174-R410 IonicContact OD2-NH2 3.42Å; D174-R410 PolarHBondContact OD2-NH2 2.89Å
175	V	97.8	Very high	95.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	101.5	173.7	179.1	0	0	0	0	106.9	I198 I390 V392 V409 R410 Y411 I412	V175-I198 HydrophobicContact CG2-CD1 4.48Å; V175-I198 HydrophobicContact CG2-CG1 4.31Å; V175-I390 HydrophobicContact CG1-CG2 3.83Å; V175-V392 HydrophobicContact CG2-CG2 3.88Å; V175-V409 HydrophobicContact CG2-CG2 4.07Å; V175-R410 PolarHBondContact N-O 3.38Å; V175-Y411 HydrophobicContact CB-CD1 3.57Å; V175-Y411 HydrophobicContact CB-CE1 3.91Å; V175-Y411 HydrophobicContact CB-CG 4.47Å; V175-Y411 HydrophobicContact CG1-CD1 3.76Å; V175-Y411 HydrophobicContact CG1-CE1 4.08Å; V175-Y411 HydrophobicContact CG2-CD1 4.02Å; V175-Y411 HydrophobicContact CG2-CE1 3.83Å; V175-Y411 CarbonylContact O-C 3.52Å; V175-Y411 WeakPolarHBondContact O-CA 3.31Å; V175-I412 PolarHBondContact O-N 3.18Å
176	I	97.9	Very high	95	Very high	24 Å²	24	44.9 Å²	44.9	12%	0.123	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.6	-175	-53.9	173.7	0	0	0	108.4	D174 G196 S197 K199 I412 Q414	D174-I176 HydrophobicContact CB-CD1 4.27Å; D174-I176 HydrophobicContact CB-CG1 4.19Å; I176-G196 CarbonylContact O-C 3.51Å; I176-G196 VanDerWaalsContact O-CA 3.25Å; I176-G196 WeakPolarHBondContact O-CA 3.36Å; I176-S197 PolarHBondContact N-O 3.33Å; I176-S197 PolarHBondContact O-N 3.39Å; I176-K199 HydrophobicContact CD1-CD 4.12Å; I176-I412 CarbonylContact C-O 3.6Å; I176-I412 VanDerWaalsContact CA-O 3.31Å; I176-I412 WeakPolarHBondContact CA-O 3.39Å; I176-Q414 HydrophobicContact CG2-CG 4.14Å
177	E	96.6	Very high	94.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.3	173.7	-75.5	-175.8	-171.4	0	0	110.2	I194 Y267 T387 S388 I390 I412 T413 Q414	E177-I194 HydrophobicContact CB-CG2 3.89Å; E177-I194 HydrophobicContact CG-CG2 3.83Å; E177-Y267 VanDerWaalsContact CG-OH 3.27Å; E177-Y267 WeakPolarHBondContact CG-OH 3.39Å; E177-Y267 PolarHBondContact OE1-OH 3.05Å; E177-T387 WeakPolarHBondContact OE2-CA 3.22Å; E177-T387 WeakPolarHBondContact OE2-CB 3.31Å; E177-T387 PolarHBondContact OE2-N 3.12Å; E177-S388 WeakPolarHBondContact OE1-CB 3.48Å; E177-S388 PolarHBondContact OE1-N 3.33Å; E177-S388 PolarHBondContact OE1-OG 3.05Å; E177-S388 PolarHBondContact OE2-N 2.85Å; E177-I390 VanDerWaalsContact OE1-CG2 3.31Å; E177-I390 WeakPolarHBondContact OE1-CG2 3.44Å; E177-I412 PolarHBondContact N-O 3.37Å; E177-T413 HydrophobicContact CB-CG2 4.42Å; E177-T413 CarbonylContact O-C 3.54Å; E177-T413 WeakPolarHBondContact O-CA 3.2Å; E177-Q414 PolarHBondContact O-N 3.3Å
178	S	96.5	Very high	94.6	Very high	25 Å²	25	35.4 Å²	35.4	18%	0.175	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119	170.6	-54.4	0	0	0	0	108.7	V195 Q414	S178-V195 PolarHBondContact N-O 2.91Å; S178-V195 PolarHBondContact O-N 2.82Å; S178-Q414 WeakPolarHBondContact CA-O 3.37Å; S178-Q414 PolarHBondContact OG-NE2 2.99Å
179	V	95.6	Very high	94.5	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.024	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.2	-179.6	-176.5	0	0	0	0	109.1	L276 F380 T413 Q414 G416 Y418	V179-L276 HydrophobicContact CG2-CD1 3.95Å; V179-F380 HydrophobicContact CB-CZ 4.41Å; V179-T413 HydrophobicContact CG2-CG2 3.72Å; V179-Q414 PolarHBondContact N-O 3.39Å; V179-G416 PolarHBondContact O-N 3.46Å; V179-Y418 HydrophobicContact CG1-CD2 4.34Å; V179-Y418 HydrophobicContact CG1-CE2 4.22Å
180	N	95.2	Very high	94.3	Very high	20 Å²	20	35 Å²	35	11%	0.107	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.3	170.6	-65	-18.1	0	0	0	108.5	S192 E193 G416 D417	N180-S192 WeakPolarHBondContact O-CA 3.42Å; N180-E193 HydrophobicContact CB-CG 3.59Å; N180-E193 PolarHBondContact N-O 2.79Å; N180-E193 PolarHBondContact ND2-OE1 2.89Å; N180-E193 PolarHBondContact O-N 3.29Å; N180-E193 VanDerWaalsContact O-N 3.13Å; N180-G416 VanDerWaalsContact OD1-CA 3.25Å; N180-G416 WeakPolarHBondContact OD1-CA 3.25Å; N180-D417 CarbonylContact C-O 3.57Å; N180-D417 WeakPolarHBondContact CA-O 3.42Å; N180-D417 PolarHBondContact OD1-N 3.19Å
181	L	94.6	Very high	94.1	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	130.5	179.7	-176.6	73.1	0	0	0	109.6	V183 V189 R191 P275 D417 Y418 Q419	L181-V183 HydrophobicContact CD1-CG2 4.24Å; L181-V183 HydrophobicContact CD2-CG2 3.71Å; L181-V183 HydrophobicContact CG-CG2 3.81Å; L181-V189 HydrophobicContact CD1-CG1 3.71Å; L181-V189 HydrophobicContact CD1-CG2 4.33Å; L181-R191 CarbonylContact C-O 3.58Å; L181-R191 WeakPolarHBondContact CA-O 3.23Å; L181-P275 HydrophobicContact CD1-CB 4.43Å; L181-P275 HydrophobicContact CD1-CG 3.84Å; L181-P275 HydrophobicContact CD2-CB 3.64Å; L181-P275 HydrophobicContact CD2-CG 3.77Å; L181-P275 HydrophobicContact CG-CG 4.48Å; L181-D417 PolarHBondContact N-O 3.27Å; L181-Y418 HydrophobicContact CB-CD2 3.63Å; L181-Y418 HydrophobicContact CB-CE2 3.73Å; L181-Y418 HydrophobicContact CB-CG 4.1Å; L181-Y418 HydrophobicContact CD2-CD1 4.29Å; L181-Y418 HydrophobicContact CD2-CD2 4.23Å; L181-Y418 HydrophobicContact CD2-CE1 3.71Å; L181-Y418 HydrophobicContact CD2-CE2 3.63Å; L181-Y418 HydrophobicContact CG-CE2 4.32Å; L181-Q419 PolarHBondContact O-N 3.45Å; L181-Q419 VanDerWaalsContact O-O 3.08Å
182	L	94.6	Very high	93.9	Very high	38 Å²	38	40.2 Å²	40.2	20%	0.199	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	116.5	167.8	-177.3	62.8	0	0	0	109.5	L190 R191 Q419 R421	L182-L190 HydrophobicContact CB-CB 4.5Å; L182-L190 HydrophobicContact CD2-CB 4.28Å; L182-L190 HydrophobicContact CD2-CD1 4.18Å; L182-L190 HydrophobicContact CG-CB 4.27Å; L182-L190 HydrophobicContact CG-CD1 4.26Å; L182-L190 PolarHBondContact O-N 2.84Å; L182-R191 HydrophobicContact CB-CB 4.06Å; L182-R191 PolarHBondContact N-O 2.82Å; L182-R191 PolarHBondContact O-N 3.44Å; L182-Q419 WeakPolarHBondContact CA-O 3.36Å; L182-Q419 HydrophobicContact CD1-CB 4.27Å; L182-R421 HydrophobicContact CD1-CG 4.28Å
183	V	94.1	Very high	93.7	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.5	175.2	-171	0	0	0	0	109.4	L181 V189 W278 Q419 L420 R421	L181-V183 HydrophobicContact CD1-CG2 4.24Å; L181-V183 HydrophobicContact CD2-CG2 3.71Å; L181-V183 HydrophobicContact CG-CG2 3.81Å; V183-V189 HydrophobicContact CG2-CG2 4.48Å; V183-W278 HydrophobicContact CG1-CH2 3.57Å; V183-W278 HydrophobicContact CG1-CZ3 3.91Å; V183-W278 HydrophobicContact CG2-CH2 4.34Å; V183-W278 HydrophobicContact CG2-CZ3 3.8Å; V183-Q419 PolarHBondContact N-O 3.35Å; V183-L420 HydrophobicContact CB-CB 4.19Å; V183-L420 HydrophobicContact CB-CD2 4.11Å; V183-L420 HydrophobicContact CB-CG 4.04Å; V183-L420 HydrophobicContact CG2-CD2 3.82Å; V183-L420 HydrophobicContact CG2-CG 3.87Å; V183-R421 WeakPolarHBondContact O-CB 3.39Å; V183-R421 WeakPolarHBondContact O-CG 3.36Å; V183-R421 PolarHBondContact O-N 3.24Å
184	S	93.4	Very high	93.6	Very high	18 Å²	18	37.7 Å²	37.7	13%	0.126	21%	0.21	C	C	.	.			trans	-70.5	162.4	172.2	62.9	0	0	0	0	112	N186 G187 N188	S184-N186 PolarHBondContact O-N 2.83Å; S184-N186 VanDerWaalsContact O-N 3.08Å; S184-G187 PolarHBondContact O-N 3.17Å; S184-N188 PolarHBondContact N-O 3.45Å; S184-N188 WeakPolarHBondContact OG-CB 3.5Å; S184-N188 PolarHBondContact OG-N 2.89Å; S184-N188 PolarHBondContact OG-O 3.38Å
185	A	88.9	Confident	93.6	Very high	36 Å²	36	39.3 Å²	39.3	30%	0.298	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-19	175.3	0	0	0	0	0	113.9	G187 R421 T422 Q423	A185-G187 VanDerWaalsContact C-N 3.33Å; A185-R421 WeakPolarHBondContact CA-O 3.4Å; A185-T422 WeakPolarHBondContact CB-O 3.26Å; A185-Q423 HydrophobicContact CB-CG 3.94Å; A185-Q423 WeakPolarHBondContact O-CG 3.29Å; A185-Q423 PolarHBondContact O-NE2 2.71Å
186	N	88.1	Confident	93.5	Very high	133 Å²	133	39.3 Å²	39.3	71%	0.711	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.1	175.3	-63.8	-14.2	0	0	0	113	S184	S184-N186 PolarHBondContact O-N 2.83Å; S184-N186 VanDerWaalsContact O-N 3.08Å
187	G	86.1	Confident	93.5	Very high	31 Å²	31	39 Å²	39	32%	0.32	22%	0.22	S	C	.	.	S	Bend	trans	84.7	8.1	-177.1	0	0	0	0	0	114.9	S184 A185 W278	S184-G187 PolarHBondContact O-N 3.17Å; A185-G187 VanDerWaalsContact C-N 3.33Å; G187-W278 VanDerWaalsContact O-CH2 3.27Å; G187-W278 WeakPolarHBondContact O-CH2 3.36Å
188	N	91.1	Very high	93.6	Very high	106 Å²	106	39 Å²	39	57%	0.567	22%	0.22	S	C	*	.			trans	-83.6	134.3	173	-63.7	-27.9	0	0	0	110.7	S184 L190	S184-N188 PolarHBondContact N-O 3.45Å; S184-N188 WeakPolarHBondContact OG-CB 3.5Å; S184-N188 PolarHBondContact OG-N 2.89Å; S184-N188 PolarHBondContact OG-O 3.38Å; N188-L190 PolarHBondContact O-N 2.95Å
189	V	91.8	Very high	93.6	Very high	68 Å²	68	41.7 Å²	41.7	41%	0.412	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	115.9	172.5	-179.7	0	0	0	0	108.9	L181 V183 P275 W278	L181-V189 HydrophobicContact CD1-CG1 3.71Å; L181-V189 HydrophobicContact CD1-CG2 4.33Å; V183-V189 HydrophobicContact CG2-CG2 4.48Å; V189-P275 HydrophobicContact CG2-CG 4.06Å; V189-W278 HydrophobicContact CG2-CZ3 4.42Å
190	L	92.6	Very high	93.7	Very high	98 Å²	98	41.5 Å²	41.5	51%	0.513	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-40.5	179.7	-61.5	-180	0	0	0	112	L182 N188	L182-L190 HydrophobicContact CB-CB 4.5Å; L182-L190 HydrophobicContact CD2-CB 4.28Å; L182-L190 HydrophobicContact CD2-CD1 4.18Å; L182-L190 HydrophobicContact CG-CB 4.27Å; L182-L190 HydrophobicContact CG-CD1 4.26Å; L182-L190 PolarHBondContact O-N 2.84Å; N188-L190 PolarHBondContact O-N 2.95Å
191	R	91.9	Very high	93.8	Very high	139 Å²	139	45.7 Å²	45.7	53%	0.525	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	133	178	-173.8	177.3	177.5	-175	-1.2	108.9	L181 L182 E193	L181-R191 CarbonylContact C-O 3.58Å; L181-R191 WeakPolarHBondContact CA-O 3.23Å; L182-R191 HydrophobicContact CB-CB 4.06Å; L182-R191 PolarHBondContact N-O 2.82Å; L182-R191 PolarHBondContact O-N 3.44Å; R191-E193 IonicContact CZ-OE1 2.66Å; R191-E193 IonicContact CZ-OE2 3.99Å; R191-E193 IonicContact NE-OE1 2.61Å; R191-E193 IonicContact NE-OE2 2.92Å; R191-E193 PolarHBondContact NE-OE2 2.8Å; R191-E193 IonicContact NH2-OE1 3.42Å; R191-E193 PolarHBondContact NH2-OE1 3.41Å; R191-E193 IonicContact NH2-OE2 3.44Å; R191-E193 PolarHBondContact NH2-OE2 3.28Å
192	S	92.6	Very high	93.9	Very high	17 Å²	17	45.6 Å²	45.6	12%	0.119	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	113.3	168.5	-165	0	0	0	0	109.7	N180 T271	N180-S192 WeakPolarHBondContact O-CA 3.42Å; S192-T271 PolarHBondContact O-N 3.42Å; S192-T271 WeakPolarHBondContact OG-CG2 3.48Å
193	E	93.9	Very high	94	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.047	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	154.8	179	65.7	178.4	-168.7	0	0	109.2	N180 R191 R268 L269	N180-E193 HydrophobicContact CB-CG 3.59Å; N180-E193 PolarHBondContact N-O 2.79Å; N180-E193 PolarHBondContact ND2-OE1 2.89Å; N180-E193 PolarHBondContact O-N 3.29Å; N180-E193 VanDerWaalsContact O-N 3.13Å; R191-E193 IonicContact CZ-OE1 2.66Å; R191-E193 IonicContact CZ-OE2 3.99Å; R191-E193 IonicContact NE-OE1 2.61Å; R191-E193 IonicContact NE-OE2 2.92Å; R191-E193 PolarHBondContact NE-OE2 2.8Å; R191-E193 IonicContact NH2-OE1 3.42Å; R191-E193 PolarHBondContact NH2-OE1 3.41Å; R191-E193 IonicContact NH2-OE2 3.44Å; R191-E193 PolarHBondContact NH2-OE2 3.28Å; E193-R268 IonicContact OE2-NH1 3.76Å; E193-L269 WeakPolarHBondContact CA-O 3.42Å
194	I	95.4	Very high	94.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.9	174.4	-59.8	167.7	0	0	0	106.3	E177 R268 L269 T271 T387	E177-I194 HydrophobicContact CB-CG2 3.89Å; E177-I194 HydrophobicContact CG-CG2 3.83Å; I194-R268 WeakPolarHBondContact O-CA 3.48Å; I194-L269 HydrophobicContact CB-CD2 3.98Å; I194-L269 HydrophobicContact CB-CG 4.14Å; I194-L269 HydrophobicContact CD1-CD1 4.41Å; I194-L269 HydrophobicContact CD1-CG 4.49Å; I194-L269 HydrophobicContact CG2-CD2 4.18Å; I194-L269 PolarHBondContact N-O 3.5Å; I194-L269 PolarHBondContact O-N 2.86Å; I194-T271 HydrophobicContact CD1-CG2 4.07Å; I194-T271 HydrophobicContact CG1-CG2 3.97Å; I194-T387 HydrophobicContact CD1-CG2 3.72Å
195	V	96.8	Very high	94.2	Very high	52 Å²	52	46.1 Å²	46.1	32%	0.315	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	105.2	169.2	-178.6	0	0	0	0	106.7	S178 R268	S178-V195 PolarHBondContact N-O 2.91Å; S178-V195 PolarHBondContact O-N 2.82Å; V195-R268 HydrophobicContact CG2-CG 4.34Å
196	G	96.8	Very high	94.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	150.8	177.4	0	0	0	0	0	112.4	I176 S266 Y267	I176-G196 CarbonylContact O-C 3.51Å; I176-G196 VanDerWaalsContact O-CA 3.25Å; I176-G196 WeakPolarHBondContact O-CA 3.36Å; G196-S266 CarbonylContact O-C 3.57Å; G196-S266 VanDerWaalsContact O-CA 3.23Å; G196-S266 WeakPolarHBondContact O-CA 3.46Å; G196-Y267 VanDerWaalsContact CA-CZ 3.44Å; G196-Y267 PolarHBondContact N-O 3.5Å; G196-Y267 PolarHBondContact O-N 2.85Å
197	S	97.6	Very high	94.7	Very high	18 Å²	18	41.5 Å²	41.5	13%	0.126	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.5	175.8	177.7	0	0	0	0	108.8	I176 E263 M265	I176-S197 PolarHBondContact N-O 3.33Å; I176-S197 PolarHBondContact O-N 3.39Å; S197-E263 VanDerWaalsContact CB-OE1 3.32Å; S197-E263 WeakPolarHBondContact CB-OE1 3.16Å; S197-E263 WeakPolarHBondContact OG-CG 3.41Å; S197-E263 PolarHBondContact OG-OE1 2.82Å; S197-M265 WeakPolarHBondContact CA-O 3.25Å
198	I	97.8	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	102.5	170.9	-56	-173.2	0	0	0	107.3	L173 D174 V175 M200 L212 L214 L264 M265 Y267	L173-I198 HydrophobicContact CD2-CG2 4.43Å; D174-I198 WeakPolarHBondContact O-CA 3.3Å; V175-I198 HydrophobicContact CG2-CD1 4.48Å; V175-I198 HydrophobicContact CG2-CG1 4.31Å; I198-M200 HydrophobicContact CG2-CG 4.47Å; I198-L212 HydrophobicContact CD1-CD2 4.23Å; I198-L214 HydrophobicContact CD1-CD1 4.36Å; I198-L214 HydrophobicContact CD1-CD2 4.23Å; I198-L264 PolarHBondContact O-N 3.37Å; I198-M265 HydrophobicContact CB-CG 3.86Å; I198-M265 HydrophobicContact CD1-CE 4.38Å; I198-M265 HydrophobicContact CD1-CG 3.88Å; I198-M265 HydrophobicContact CD1-SD 3.75Å; I198-M265 HydrophobicContact CG1-CG 3.91Å; I198-M265 HydrophobicContact CG1-SD 4.42Å; I198-M265 PolarHBondContact N-O 3.36Å; I198-Y267 HydrophobicContact CG1-CE1 4.04Å
199	K	97.6	Very high	95.4	Very high	81 Å²	81	36.6 Å²	36.6	35%	0.352	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	136.8	172.8	-62.4	-173	178.5	-172.6	0	109.6	D174 I176 E263	D174-K199 HydrophobicContact CB-CB 4.3Å; D174-K199 PolarHBondContact N-O 2.87Å; D174-K199 PolarHBondContact O-N 3.01Å; I176-K199 HydrophobicContact CD1-CD 4.12Å; K199-E263 HydrophobicContact CG-CB 4.48Å
200	M	97.6	Very high	95.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.3	179.6	-63.2	-167.3	68.1	0	0	110.3	V171 F172 L173 I198 V202 L210 F255 E261 F262 L264 L395	V171-M200 HydrophobicContact CG1-CE 3.41Å; V171-M200 VanDerWaalsContact CG1-CE 3.41Å; F172-M200 CarbonylContact O-C 3.55Å; F172-M200 VanDerWaalsContact O-CA 3.3Å; F172-M200 WeakPolarHBondContact O-CA 3.46Å; L173-M200 HydrophobicContact CD1-CE 4.22Å; L173-M200 HydrophobicContact CD2-CE 4.23Å; L173-M200 HydrophobicContact CG-CE 4.03Å; L173-M200 HydrophobicContact CG-CG 4.31Å; I198-M200 HydrophobicContact CG2-CG 4.47Å; M200-V202 HydrophobicContact CB-CG2 4.05Å; M200-V202 HydrophobicContact CE-CG2 4.08Å; M200-L210 HydrophobicContact CE-CD2 3.92Å; M200-F255 HydrophobicContact CE-CE2 4.31Å; M200-F255 HydrophobicContact CE-CZ 4.1Å; M200-F255 HydrophobicContact SD-CE2 3.82Å; M200-F255 HydrophobicContact SD-CZ 3.63Å; M200-E261 CarbonylContact O-C 3.52Å; M200-E261 VanDerWaalsContact O-CA 3.29Å; M200-E261 WeakPolarHBondContact O-CA 3.25Å; M200-F262 HydrophobicContact CB-CD1 4.32Å; M200-F262 HydrophobicContact CB-CE1 3.81Å; M200-F262 HydrophobicContact CB-CZ 4Å; M200-F262 HydrophobicContact CG-CZ 4.42Å; M200-F262 PolarHBondContact N-O 2.86Å; M200-F262 PolarHBondContact O-N 2.94Å; M200-F262 HydrophobicContact SD-CZ 4.07Å; M200-L264 HydrophobicContact CG-CB 4.02Å; M200-L264 HydrophobicContact SD-CB 3.91Å; M200-L264 HydrophobicContact SD-CD1 4.47Å; M200-L264 HydrophobicContact SD-CD2 3.61Å; M200-L264 HydrophobicContact SD-CG 4.19Å; M200-L395 HydrophobicContact CE-CD1 4.49Å; M200-L395 HydrophobicContact CE-CD2 4.36Å
201	R	97.3	Very high	95.8	Very high	109 Å²	109	32.7 Å²	32.7	41%	0.411	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	108.4	165.5	-58.8	172.9	61.7	-166.6	0.4	107.8	F172 F203 G260 E261	F172-R201 HydrophobicContact CB-CB 4.2Å; F172-R201 HydrophobicContact CD2-CB 4.34Å; F172-R201 PolarHBondContact N-O 3.12Å; F172-R201 PolarHBondContact O-N 3.43Å; R201-F203 HydrophobicContact CB-CE2 4.03Å; R201-F203 HydrophobicContact CB-CZ 4.41Å; R201-G260 WeakPolarHBondContact CA-O 3.47Å; R201-E261 HydrophobicContact CG-CB 4.07Å; R201-E261 HydrophobicContact CG-CG 3.98Å
202	V	96.9	Very high	96	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.5	-169.9	-179.2	0	0	0	0	109.7	V171 M200 L204 P257 G260 F262	V171-V202 HydrophobicContact CG1-CG2 4.16Å; M200-V202 HydrophobicContact CB-CG2 4.05Å; M200-V202 HydrophobicContact CE-CG2 4.08Å; V202-L204 HydrophobicContact CG1-CB 3.92Å; V202-L204 HydrophobicContact CG1-CD1 3.68Å; V202-L204 HydrophobicContact CG1-CG 3.6Å; V202-P257 HydrophobicContact CB-CB 4.28Å; V202-P257 HydrophobicContact CG1-CB 3.99Å; V202-P257 HydrophobicContact CG1-CG 3.73Å; V202-P257 HydrophobicContact CG2-CB 3.83Å; V202-P257 HydrophobicContact CG2-CG 4.36Å; V202-G260 PolarHBondContact N-O 2.87Å; V202-G260 PolarHBondContact O-N 3.37Å; V202-F262 HydrophobicContact CG2-CE1 3.68Å; V202-F262 HydrophobicContact CG2-CZ 4.46Å
203	F	96.6	Very high	96	Very high	53 Å²	53	25.5 Å²	25.5	23%	0.232	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	76.5	174.2	-55.4	-72.2	0	0	0	107.8	Y166 N169 E170 F172 R201	Y166-F203 HydrophobicContact CD1-CB 4.01Å; Y166-F203 HydrophobicContact CD1-CD1 4.44Å; Y166-F203 HydrophobicContact CD2-CB 4.4Å; Y166-F203 HydrophobicContact CE1-CB 3.99Å; Y166-F203 AromaticContact CE1-CD1 3.68Å; Y166-F203 HydrophobicContact CE1-CD1 3.68Å; Y166-F203 HydrophobicContact CE1-CG 4.31Å; Y166-F203 HydrophobicContact CE2-CB 4.36Å; Y166-F203 HydrophobicContact CG-CB 4.21Å; Y166-F203 AromaticContact CZ-CD1 3.85Å; N169-F203 CarbonylContact C-O 3.59Å; N169-F203 VanDerWaalsContact CA-O 3.25Å; N169-F203 WeakPolarHBondContact CA-O 3.37Å; E170-F203 PolarHBondContact N-O 3.22Å; E170-F203 CarbonylContact O-C 3.55Å; E170-F203 WeakPolarHBondContact O-CA 3.25Å; E170-F203 PolarHBondContact O-N 2.76Å; F172-F203 HydrophobicContact CD2-CD2 4.02Å; F172-F203 AromaticContact CD2-CE2 3.9Å; F172-F203 HydrophobicContact CD2-CE2 3.9Å; F172-F203 AromaticContact CE2-CD2 3.83Å; F172-F203 HydrophobicContact CE2-CD2 3.83Å; F172-F203 AromaticContact CE2-CE2 3.89Å; F172-F203 HydrophobicContact CE2-CE2 3.89Å; R201-F203 HydrophobicContact CB-CE2 4.03Å; R201-F203 HydrophobicContact CB-CZ 4.41Å
204	L	96	Very high	95.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.			trans	-123.8	142	-173.9	-68.8	-176.9	0	0	0	111	R160 I164 Y166 N169 V171 V202 P208 L210 I397 Y403 A405	R160-L204 PolarHBondContact NH2-O 3.45Å; I164-L204 WeakPolarHBondContact CG2-O 3.4Å; Y166-L204 WeakPolarHBondContact CD2-O 3.45Å; N169-L204 HydrophobicContact CB-CD2 3.82Å; V171-L204 HydrophobicContact CG2-CD1 3.68Å; V171-L204 HydrophobicContact CG2-CD2 3.75Å; V171-L204 HydrophobicContact CG2-CG 3.75Å; V202-L204 HydrophobicContact CG1-CB 3.92Å; V202-L204 HydrophobicContact CG1-CD1 3.68Å; V202-L204 HydrophobicContact CG1-CG 3.6Å; L204-P208 HydrophobicContact CB-CG 3.88Å; L204-P208 HydrophobicContact CD1-CB 4.16Å; L204-P208 HydrophobicContact CD1-CG 3.61Å; L204-P208 HydrophobicContact CG-CG 4.42Å; L204-L210 HydrophobicContact CD1-CD1 3.72Å; L204-L210 HydrophobicContact CD1-CD2 4.38Å; L204-I397 HydrophobicContact CD1-CG2 4.23Å; L204-Y403 HydrophobicContact CD2-CE2 4.03Å; L204-A405 HydrophobicContact CD2-CB 3.77Å
205	S	95.2	Very high	95.8	Very high	18 Å²	18	25.4 Å²	25.4	13%	0.126	12%	0.123	C	C	.	.	S	Bend	trans	-82.9	147.3	175.5	-52.1	0	0	0	0	111	I164 Y166 N169 Y403	I164-S205 CarbonylContact O-C 3.48Å; I164-S205 VanDerWaalsContact O-CA 3.25Å; I164-S205 WeakPolarHBondContact O-CA 3.33Å; Y166-S205 PolarHBondContact N-OG 2.58Å; Y166-S205 PolarHBondContact O-OG 3.01Å; N169-S205 WeakPolarHBondContact OD1-CB 3.47Å; N169-S205 PolarHBondContact OD1-N 2.84Å; N169-S205 PolarHBondContact OD1-OG 2.98Å; S205-Y403 WeakPolarHBondContact O-CE1 3.41Å; S205-Y403 PolarHBondContact O-OH 3.34Å
206	G	93.6	Very high	95.4	Very high	20 Å²	20	23.3 Å²	23.3	21%	0.206	11%	0.11	C	C	.	.	S	Bend	trans	76.1	-146.2	175.9	0	0	0	0	0	114	R160 I164 P208	R160-G206 PolarHBondContact NE-O 3.04Å; R160-G206 PolarHBondContact NH2-O 2.87Å; I164-G206 PolarHBondContact O-N 2.89Å; G206-P208 VanDerWaalsContact C-CD 3.43Å; G206-P208 WeakPolarHBondContact O-CD 3.4Å
207	M	94.3	Very high	94.9	Very high	51 Å²	51	25.9 Å²	25.9	25%	0.251	12%	0.121	S	C	.	.			trans	-124.6	68.1	-175.2	-67.9	-63.6	-76	0	0	110.1	V157 R160 E162 I256 E399	V157-M207 HydrophobicContact CB-CE 4.41Å; V157-M207 HydrophobicContact CG1-CE 3.84Å; R160-M207 HydrophobicContact CB-CE 4.24Å; R160-M207 HydrophobicContact CB-SD 4.28Å; R160-M207 WeakPolarHBondContact CD-SD 3.04Å; R160-M207 HydrophobicContact CG-CE 4.31Å; R160-M207 HydrophobicContact CG-SD 3.71Å; E162-M207 HydrophobicContact CG-CG 4.18Å; E162-M207 HydrophobicContact CG-SD 4.35Å; M207-I256 HydrophobicContact CE-CG2 4.22Å; M207-E399 PolarHBondContact N-OE2 2.88Å
208	P	95.7	Very high	94.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.132	C	C	.	.			trans	-75.9	137.8	-169.2	30.3	-36.7	0	0	0	111.3	L204 G206 L210 P257 I397 I398 E399	L204-P208 HydrophobicContact CB-CG 3.88Å; L204-P208 HydrophobicContact CD1-CB 4.16Å; L204-P208 HydrophobicContact CD1-CG 3.61Å; L204-P208 HydrophobicContact CG-CG 4.42Å; G206-P208 VanDerWaalsContact C-CD 3.43Å; G206-P208 WeakPolarHBondContact O-CD 3.4Å; P208-L210 HydrophobicContact CB-CD1 3.82Å; P208-L210 HydrophobicContact CG-CD1 4.03Å; P208-P257 HydrophobicContact CG-CG 4.35Å; P208-P257 WeakPolarHBondContact O-CD 3.11Å; P208-I397 HydrophobicContact CB-CG2 4.25Å; P208-I398 CarbonylContact C-O 3.58Å; P208-I398 WeakPolarHBondContact CA-O 3.25Å; P208-E399 WeakPolarHBondContact CA-OE2 3.45Å; P208-E399 HydrophobicContact CB-CB 4.28Å; P208-E399 WeakPolarHBondContact CD-OE2 3.37Å
209	E	95.7	Very high	93.5	Very high	34 Å²	34	29.4 Å²	29.4	16%	0.159	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	114.7	166.1	-174.6	177.7	130.5	0	0	108.8	R211 R243 R246 S254 I398	E209-R211 IonicContact OE1-CZ 2.79Å; E209-R211 IonicContact OE1-NE 3.52Å; E209-R211 PolarHBondContact OE1-NE 3.31Å; E209-R211 VanDerWaalsContact OE1-NE 3.16Å; E209-R211 IonicContact OE1-NH2 3.69Å; E209-R211 PolarHBondContact OE1-NH2 2.92Å; E209-R243 IonicContact OE1-NH1 2.61Å; E209-R243 IonicContact OE2-CZ 2.81Å; E209-R243 IonicContact OE2-NH1 2.91Å; E209-R243 PolarHBondContact OE2-NH1 2.8Å; E209-R243 IonicContact OE2-NH2 3.83Å; E209-R246 IonicContact OE1-NH1 2.84Å; E209-R246 PolarHBondContact OE1-NH1 2.94Å; E209-R246 IonicContact OE2-NH1 3.29Å; E209-S254 PolarHBondContact OE1-OG 2.84Å; E209-I398 HydrophobicContact CB-CB 4.33Å; E209-I398 PolarHBondContact N-O 2.79Å; E209-I398 WeakPolarHBondContact O-CB 3.45Å; E209-I398 PolarHBondContact O-N 3.01Å
210	L	96.5	Very high	92.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	144.3	174.8	-89.4	60.2	0	0	0	110.5	M200 L204 P208 S254 F255 P257 L395 K396 I397	M200-L210 HydrophobicContact CE-CD2 3.92Å; L204-L210 HydrophobicContact CD1-CD1 3.72Å; L204-L210 HydrophobicContact CD1-CD2 4.38Å; P208-L210 HydrophobicContact CB-CD1 3.82Å; P208-L210 HydrophobicContact CG-CD1 4.03Å; L210-S254 WeakPolarHBondContact O-CA 3.33Å; L210-F255 HydrophobicContact CB-CD1 4.35Å; L210-F255 HydrophobicContact CB-CD2 4.14Å; L210-F255 HydrophobicContact CB-CE1 3.96Å; L210-F255 HydrophobicContact CB-CE2 3.73Å; L210-F255 HydrophobicContact CB-CG 4.43Å; L210-F255 HydrophobicContact CB-CZ 3.62Å; L210-F255 HydrophobicContact CD2-CE2 3.81Å; L210-F255 HydrophobicContact CD2-CZ 3.93Å; L210-F255 HydrophobicContact CG-CE2 4.42Å; L210-F255 HydrophobicContact CG-CZ 4.43Å; L210-F255 PolarHBondContact N-O 2.89Å; L210-F255 PolarHBondContact O-N 2.9Å; L210-P257 HydrophobicContact CD1-CG 3.98Å; L210-P257 HydrophobicContact CD2-CB 4.47Å; L210-P257 HydrophobicContact CD2-CG 3.96Å; L210-P257 HydrophobicContact CG-CG 4.48Å; L210-L395 HydrophobicContact CB-CD1 4.41Å; L210-L395 HydrophobicContact CD2-CD1 4.15Å; L210-L395 HydrophobicContact CD2-CD2 4.1Å; L210-L395 HydrophobicContact CD2-CG 4.44Å; L210-L395 HydrophobicContact CG-CD1 4.34Å; L210-K396 CarbonylContact C-O 3.53Å; L210-K396 VanDerWaalsContact CA-O 3.3Å; L210-K396 WeakPolarHBondContact CA-O 3.36Å; L210-I397 HydrophobicContact CD1-CG1 4.24Å; L210-I397 HydrophobicContact CD1-CG2 4.17Å; L210-I397 HydrophobicContact CG-CG1 4.2Å
211	R	95.8	Very high	92.3	Very high	85 Å²	85	31 Å²	31	32%	0.321	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	117.1	169.2	-54.5	-175.4	-174.6	175	6.1	110.6	E209 T252 I253 L395 K396 I398	E209-R211 IonicContact OE1-CZ 2.79Å; E209-R211 IonicContact OE1-NE 3.52Å; E209-R211 PolarHBondContact OE1-NE 3.31Å; E209-R211 VanDerWaalsContact OE1-NE 3.16Å; E209-R211 IonicContact OE1-NH2 3.69Å; E209-R211 PolarHBondContact OE1-NH2 2.92Å; R211-T252 HydrophobicContact CB-CG2 4.49Å; R211-I253 CarbonylContact C-O 3.5Å; R211-I253 VanDerWaalsContact CA-O 3.28Å; R211-I253 WeakPolarHBondContact CA-O 3.48Å; R211-L395 WeakPolarHBondContact O-CA 3.28Å; R211-K396 HydrophobicContact CB-CB 4.24Å; R211-K396 PolarHBondContact N-O 3.48Å; R211-K396 PolarHBondContact O-N 3.18Å; R211-I398 HydrophobicContact CG-CD1 4.48Å
212	L	95.6	Very high	91.5	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.1	178.8	179.6	66.9	0	0	0	109.9	L173 I198 L214 I253 F255 L264 V392 L395	L173-L212 HydrophobicContact CD2-CD1 3.97Å; I198-L212 HydrophobicContact CD1-CD2 4.23Å; L212-L214 HydrophobicContact CD1-CD2 4.46Å; L212-L214 HydrophobicContact CD2-CD2 4.25Å; L212-L214 HydrophobicContact CD2-CG 4.45Å; L212-L214 HydrophobicContact CG-CD2 4.25Å; L212-L214 HydrophobicContact CG-CG 4.39Å; L212-I253 HydrophobicContact CB-CB 4.11Å; L212-I253 HydrophobicContact CB-CG2 4.22Å; L212-I253 HydrophobicContact CD2-CD1 4.19Å; L212-I253 HydrophobicContact CG-CD1 4.49Å; L212-I253 PolarHBondContact N-O 3.25Å; L212-F255 HydrophobicContact CB-CE1 4.11Å; L212-L264 HydrophobicContact CD2-CD2 3.64Å; L212-V392 HydrophobicContact CD1-CG1 3.63Å; L212-V392 HydrophobicContact CD1-CG2 4.38Å; L212-L395 HydrophobicContact CB-CD1 4.15Å; L212-L395 HydrophobicContact CD1-CD1 4.07Å
213	G	92.8	Very high	90.8	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.6	173.5	0	0	0	0	0	111.1	R393 Y394	G213-R393 WeakPolarHBondContact O-CB 3.38Å; G213-R393 PolarHBondContact O-N 2.82Å; G213-Y394 PolarHBondContact N-O 2.95Å; G213-Y394 PolarHBondContact O-N 2.92Å
214	L	93.7	Very high	90	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.042	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	169	174.6	-59.5	175.6	0	0	0	110.6	I198 L212 D216 I253 M265 I390 Q391 V392 R393	I198-L214 HydrophobicContact CD1-CD1 4.36Å; I198-L214 HydrophobicContact CD1-CD2 4.23Å; L212-L214 HydrophobicContact CD1-CD2 4.46Å; L212-L214 HydrophobicContact CD2-CD2 4.25Å; L212-L214 HydrophobicContact CD2-CG 4.45Å; L212-L214 HydrophobicContact CG-CD2 4.25Å; L212-L214 HydrophobicContact CG-CG 4.39Å; L214-D216 PolarHBondContact O-N 3.18Å; L214-I253 HydrophobicContact CD1-CD1 3.81Å; L214-I253 HydrophobicContact CG-CD1 4.28Å; L214-M265 HydrophobicContact CD1-CE 4.06Å; L214-M265 HydrophobicContact CD1-SD 4.05Å; L214-I390 HydrophobicContact CD1-CD1 4.24Å; L214-I390 HydrophobicContact CD2-CD1 4.49Å; L214-I390 HydrophobicContact CD2-CG1 4.43Å; L214-Q391 WeakPolarHBondContact CA-O 3.33Å; L214-V392 HydrophobicContact CD2-CG2 4Å; L214-R393 WeakPolarHBondContact O-CD 3.45Å
215	N	92	Very high	89.1	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.23	C	C	.	.			trans	-83.2	46.8	167.5	64.4	-32.5	0	0	0	112.1	K217 F220 K229 S230 V231 G389 I390 Q391 R393	N215-K217 PolarHBondContact O-N 2.85Å; N215-F220 HydrophobicContact CB-CE1 4.3Å; N215-F220 HydrophobicContact CB-CE2 4.18Å; N215-F220 HydrophobicContact CB-CZ 3.77Å; N215-K229 PolarHBondContact ND2-O 2.88Å; N215-S230 CarbonylContact O-C 3.54Å; N215-S230 WeakPolarHBondContact O-CA 3.37Å; N215-S230 WeakPolarHBondContact O-CB 3.44Å; N215-V231 PolarHBondContact O-N 2.96Å; N215-G389 PolarHBondContact ND2-O 2.81Å; N215-G389 VanDerWaalsContact ND2-O 3.08Å; N215-I390 WeakPolarHBondContact OD1-CA 3.49Å; N215-Q391 PolarHBondContact N-O 2.98Å; N215-Q391 PolarHBondContact OD1-N 3.24Å; N215-Q391 PolarHBondContact OD1-O 3.33Å; N215-R393 HydrophobicContact CB-CG 4.47Å
216	D	88.3	Confident	88	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.043	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-62.2	129.7	177.7	-178.5	6.8	0	0	0	110.7	L214 V218 L219 F220 R251	L214-D216 PolarHBondContact O-N 3.18Å; D216-V218 VanDerWaalsContact C-N 3.34Å; D216-V218 PolarHBondContact O-N 2.79Å; D216-V218 PolarHBondContact OD1-N 2.88Å; D216-L219 HydrophobicContact CB-CB 4Å; D216-L219 PolarHBondContact O-N 3.4Å; D216-F220 WeakPolarHBondContact O-CB 3.47Å; D216-F220 WeakPolarHBondContact O-CD1 3.32Å; D216-F220 PolarHBondContact O-N 3.34Å; D216-R251 IonicContact OD1-NH2 3.57Å; D216-R251 IonicContact OD2-CZ 3.62Å; D216-R251 VanDerWaalsContact OD2-CZ 3.29Å; D216-R251 IonicContact OD2-NE 2.7Å; D216-R251 PolarHBondContact OD2-NE 2.8Å; D216-R251 IonicContact OD2-NH2 3.86Å; D216-R251 PolarHBondContact OD2-NH2 2.76Å
217	K	87	Confident	87.2	Confident	54 Å²	54	53 Å²	53	24%	0.235	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-45	179.2	-177.7	-178.7	173.8	-163.3	0	111.6	N215 L219 F220 E221 V231 E232	N215-K217 PolarHBondContact O-N 2.85Å; K217-L219 PolarHBondContact O-N 3.06Å; K217-F220 PolarHBondContact O-N 2.98Å; K217-F220 VanDerWaalsContact O-N 3.12Å; K217-E221 WeakPolarHBondContact CE-OE1 3.29Å; K217-E221 HydrophobicContact CG-CG 4.48Å; K217-E221 WeakPolarHBondContact CG-OE1 3.44Å; K217-E221 WeakPolarHBondContact O-CG 3.21Å; K217-E221 PolarHBondContact O-N 2.73Å; K217-V231 WeakPolarHBondContact CB-O 3.43Å; K217-V231 PolarHBondContact N-O 3.36Å; K217-E232 HydrophobicContact CB-CB 4.38Å; K217-E232 HydrophobicContact CD-CB 3.8Å; K217-E232 HydrophobicContact CD-CG 3.99Å; K217-E232 IonicContact NZ-OE1 3.61Å; K217-E232 PolarHBondContact NZ-OE1 3.07Å; K217-E232 IonicContact NZ-OE2 3.22Å; K217-E232 PolarHBondContact NZ-OE2 3.19Å
218	V	84.6	Confident	86.5	Confident	58 Å²	58	52.9 Å²	52.9	35%	0.352	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-45	-178.4	-177.9	0	0	0	0	110.6	D216 F220 E221 N222 R251	D216-V218 VanDerWaalsContact C-N 3.34Å; D216-V218 PolarHBondContact O-N 2.79Å; D216-V218 PolarHBondContact OD1-N 2.88Å; V218-F220 VanDerWaalsContact C-N 3.3Å; V218-F220 PolarHBondContact O-N 3.38Å; V218-E221 PolarHBondContact O-N 2.8Å; V218-N222 VanDerWaalsContact O-CG 3.31Å; V218-N222 PolarHBondContact O-N 2.88Å; V218-R251 HydrophobicContact CB-CG 4.48Å; V218-R251 HydrophobicContact CG1-CG 4.12Å
219	L	82	Confident	85.9	Confident	33 Å²	33	59 Å²	59	17%	0.173	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-40.5	175.2	179.3	67.5	0	0	0	111.8	D216 K217 T223 D250 R251	D216-L219 HydrophobicContact CB-CB 4Å; D216-L219 PolarHBondContact O-N 3.4Å; K217-L219 PolarHBondContact O-N 3.06Å; L219-T223 WeakPolarHBondContact O-CB 3.32Å; L219-T223 PolarHBondContact O-N 3.07Å; L219-T223 VanDerWaalsContact O-N 3.11Å; L219-T223 PolarHBondContact O-OG1 3.15Å; L219-D250 WeakPolarHBondContact CD1-O 3.37Å; L219-R251 HydrophobicContact CB-CB 4.12Å; L219-R251 HydrophobicContact CD1-CB 4.2Å
220	F	84.3	Confident	85.5	Confident	9 Å²	9	59.1 Å²	59.1	4%	0.039	32%	0.317	C	S	.	.	H	α-helix	trans	-72	-37.9	-178	-84.7	31.6	0	0	0	112.3	N215 D216 K217 V218 T223 G224 R225 S228	N215-F220 HydrophobicContact CB-CE1 4.3Å; N215-F220 HydrophobicContact CB-CE2 4.18Å; N215-F220 HydrophobicContact CB-CZ 3.77Å; D216-F220 WeakPolarHBondContact O-CB 3.47Å; D216-F220 WeakPolarHBondContact O-CD1 3.32Å; D216-F220 PolarHBondContact O-N 3.34Å; K217-F220 PolarHBondContact O-N 2.98Å; K217-F220 VanDerWaalsContact O-N 3.12Å; V218-F220 VanDerWaalsContact C-N 3.3Å; V218-F220 PolarHBondContact O-N 3.38Å; F220-T223 CarbonylContact O-C 3.54Å; F220-T223 PolarHBondContact O-N 2.71Å; F220-G224 PolarHBondContact O-N 3.28Å; F220-R225 HydrophobicContact CB-CB 4.27Å; F220-R225 HydrophobicContact CD2-CB 4.23Å; F220-R225 HydrophobicContact CG-CB 4.26Å; F220-R225 WeakPolarHBondContact O-CA 3.35Å; F220-R225 PolarHBondContact O-N 3.29Å; F220-S228 WeakPolarHBondContact CD2-OG 3.37Å; F220-S228 WeakPolarHBondContact CE2-OG 3.49Å
221	E	83.8	Confident	85.2	Confident	107 Å²	107	59.2 Å²	59.2	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-47.4	173.1	-73.7	174.6	179.9	0	0	110.6	K217 V218 T223 G224	K217-E221 WeakPolarHBondContact CE-OE1 3.29Å; K217-E221 HydrophobicContact CG-CG 4.48Å; K217-E221 WeakPolarHBondContact CG-OE1 3.44Å; K217-E221 WeakPolarHBondContact O-CG 3.21Å; K217-E221 PolarHBondContact O-N 2.73Å; V218-E221 PolarHBondContact O-N 2.8Å; E221-T223 PolarHBondContact O-N 3.36Å; E221-G224 PolarHBondContact O-N 2.82Å; E221-G224 VanDerWaalsContact O-N 3.08Å
222	N	82.3	Confident	85	Confident	118 Å²	118	60.6 Å²	60.6	63%	0.631	33%	0.328	S	S	*	.	H	α-helix	trans	-61.2	-29.3	176.9	-70.6	-6.2	0	0	0	113.5	V218	V218-N222 VanDerWaalsContact O-CG 3.31Å; V218-N222 PolarHBondContact O-N 2.88Å
223	T	81.1	Confident	84.7	Confident	82 Å²	82	61.5 Å²	61.5	50%	0.503	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	7.1	-180	-41.7	0	0	0	0	112.9	L219 F220 E221 R225	L219-T223 WeakPolarHBondContact O-CB 3.32Å; L219-T223 PolarHBondContact O-N 3.07Å; L219-T223 VanDerWaalsContact O-N 3.11Å; L219-T223 PolarHBondContact O-OG1 3.15Å; F220-T223 CarbonylContact O-C 3.54Å; F220-T223 PolarHBondContact O-N 2.71Å; E221-T223 PolarHBondContact O-N 3.36Å; T223-R225 VanDerWaalsContact C-N 3.31Å; T223-R225 PolarHBondContact O-N 3.19Å
224	G	79.8	Confident	84.7	Confident	72 Å²	72	66 Å²	66	74%	0.742	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	19.8	-179.7	0	0	0	0	0	115.1	F220 E221	F220-G224 PolarHBondContact O-N 3.28Å; E221-G224 PolarHBondContact O-N 2.82Å; E221-G224 VanDerWaalsContact O-N 3.08Å
225	R	77.1	Confident	84.6	Confident	123 Å²	123	68.9 Å²	68.9	46%	0.464	37%	0.369	S	S	.	.			trans	-105.8	19.1	-179.2	-66.1	-173.3	-179.9	168.1	-0.9	114.1	F220 T223 K227 S228 R393	F220-R225 HydrophobicContact CB-CB 4.27Å; F220-R225 HydrophobicContact CD2-CB 4.23Å; F220-R225 HydrophobicContact CG-CB 4.26Å; F220-R225 WeakPolarHBondContact O-CA 3.35Å; F220-R225 PolarHBondContact O-N 3.29Å; T223-R225 VanDerWaalsContact C-N 3.31Å; T223-R225 PolarHBondContact O-N 3.19Å; R225-K227 PolarHBondContact O-N 3.17Å; R225-S228 PolarHBondContact O-N 3.3Å; R225-S228 PolarHBondContact O-OG 2.7Å; R225-R393 VanDerWaalsContact NH1-NH2 3.15Å
226	G	72.6	Confident	84.7	Confident	46 Å²	46	70.1 Å²	70.1	47%	0.474	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-17.3	-174.9	0	0	0	0	0	116.3	S228	G226-S228 VanDerWaalsContact C-N 3.32Å
227	K	75.9	Confident	85.1	Confident	219 Å²	219	76 Å²	76	95%	0.952	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.6	174.7	-64.8	-172.8	179.9	-178.9	0	114.2	R225	R225-K227 PolarHBondContact O-N 3.17Å
228	S	80.9	Confident	85.6	Confident	50 Å²	50	75.4 Å²	75.4	35%	0.35	40%	0.399	S	S	.	.	S	Bend	trans	-88.1	155	-179.9	62.3	0	0	0	0	111.3	F220 R225 G226 S230	F220-S228 WeakPolarHBondContact CD2-OG 3.37Å; F220-S228 WeakPolarHBondContact CE2-OG 3.49Å; R225-S228 PolarHBondContact O-N 3.3Å; R225-S228 PolarHBondContact O-OG 2.7Å; G226-S228 VanDerWaalsContact C-N 3.32Å; S228-S230 PolarHBondContact O-N 3.35Å
229	K	82.9	Confident	86.1	Confident	129 Å²	129	75 Å²	75	56%	0.561	39%	0.393	S	S	*	.			trans	-60.4	110	-178	-172.7	-173	179.4	-167.7	0	110.6	N215	N215-K229 PolarHBondContact ND2-O 2.88Å
230	S	87.6	Confident	86.7	Confident	35 Å²	35	78 Å²	78	25%	0.245	41%	0.406	C	S	.	.			trans	-114.9	166.2	175.7	56.6	0	0	0	0	111.6	N215 S228	N215-S230 CarbonylContact O-C 3.54Å; N215-S230 WeakPolarHBondContact O-CA 3.37Å; N215-S230 WeakPolarHBondContact O-CB 3.44Å; S228-S230 PolarHBondContact O-N 3.35Å
231	V	90.1	Very high	87.2	Confident	3 Å²	3	77.8 Å²	77.8	2%	0.018	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-113.8	133.4	170.3	64.8	0	0	0	0	108.8	N215 K217 L233 L269 I390	N215-V231 PolarHBondContact O-N 2.96Å; K217-V231 WeakPolarHBondContact CB-O 3.43Å; K217-V231 PolarHBondContact N-O 3.36Å; V231-L233 HydrophobicContact CG1-CD2 4.03Å; V231-L233 HydrophobicContact CG1-CG 4.32Å; V231-L233 HydrophobicContact CG2-CD2 3.88Å; V231-L269 HydrophobicContact CG2-CD1 4.1Å; V231-I390 HydrophobicContact CG1-CB 4.2Å; V231-I390 HydrophobicContact CG1-CD1 4.5Å; V231-I390 HydrophobicContact CG1-CG1 4.04Å
232	E	90.3	Very high	87.9	Confident	113 Å²	113	73 Å²	73	53%	0.528	38%	0.384	S	S	.	.			trans	-95.6	112.8	173.8	-173.1	159.8	-146.2	0	0	108.1	K217 L269	K217-E232 HydrophobicContact CB-CB 4.38Å; K217-E232 HydrophobicContact CD-CB 3.8Å; K217-E232 HydrophobicContact CD-CG 3.99Å; K217-E232 IonicContact NZ-OE1 3.61Å; K217-E232 PolarHBondContact NZ-OE1 3.07Å; K217-E232 IonicContact NZ-OE2 3.22Å; K217-E232 PolarHBondContact NZ-OE2 3.19Å; E232-L269 WeakPolarHBondContact O-CB 3.47Å
233	L	90.6	Very high	88.4	Confident	22 Å²	22	71.6 Å²	71.6	12%	0.115	37%	0.37	C	S	.	.			trans	-94.4	117.8	179.2	-54.3	176.2	0	0	0	107.5	V231 V236 Y267	V231-L233 HydrophobicContact CG1-CD2 4.03Å; V231-L233 HydrophobicContact CG1-CG 4.32Å; V231-L233 HydrophobicContact CG2-CD2 3.88Å; L233-V236 HydrophobicContact CB-CG2 3.7Å; L233-V236 HydrophobicContact CD1-CG2 3.76Å; L233-V236 HydrophobicContact CG-CG2 4.33Å; L233-Y267 HydrophobicContact CD2-CD2 3.67Å; L233-Y267 HydrophobicContact CD2-CE2 4.39Å; L233-Y267 HydrophobicContact CD2-CG 4.05Å
234	E	91.3	Very high	89	Confident	95 Å²	95	72.7 Å²	72.7	44%	0.444	37%	0.372	S	S	.	.	S	Bend	trans	-73.9	-44.7	179	-69.9	-173.8	177.4	0	0	111.6	R268 N270	E234-R268 WeakPolarHBondContact CB-O 3.34Å; E234-R268 PolarHBondContact N-O 2.96Å; E234-R268 IonicContact OE2-CZ 2.68Å; E234-R268 IonicContact OE2-NH1 3.59Å; E234-R268 PolarHBondContact OE2-NH1 3.21Å; E234-R268 IonicContact OE2-NH2 3.32Å; E234-R268 PolarHBondContact OE2-NH2 2.83Å; E234-N270 VanDerWaalsContact CD-ND2 3.32Å; E234-N270 VanDerWaalsContact OE1-CB 3.26Å; E234-N270 WeakPolarHBondContact OE1-CB 3.43Å; E234-N270 PolarHBondContact OE1-N 3.33Å; E234-N270 PolarHBondContact OE1-ND2 3.37Å; E234-N270 PolarHBondContact OE2-ND2 2.86Å
235	D	92.3	Very high	89.6	Confident	70 Å²	70	73.4 Å²	73.4	37%	0.374	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.8	178.9	-173.2	23.4	0	0	0	109.3	Y267 R268	D235-Y267 CarbonylContact O-C 3.54Å; D235-Y267 VanDerWaalsContact O-CA 3.27Å; D235-Y267 WeakPolarHBondContact O-CA 3.22Å; D235-R268 HydrophobicContact CB-CB 4.39Å; D235-R268 PolarHBondContact N-O 3.41Å; D235-R268 PolarHBondContact O-N 3.17Å
236	V	94.5	Very high	90.2	Very high	27 Å²	27	71.9 Å²	71.9	16%	0.164	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	124.3	178.1	-174.3	0	0	0	0	108.9	L233 F238 M265 S266	L233-V236 HydrophobicContact CB-CG2 3.7Å; L233-V236 HydrophobicContact CD1-CG2 3.76Å; L233-V236 HydrophobicContact CG-CG2 4.33Å; V236-F238 HydrophobicContact CB-CE2 4.18Å; V236-F238 HydrophobicContact CB-CZ 4.3Å; V236-F238 HydrophobicContact CG1-CD1 4.29Å; V236-F238 HydrophobicContact CG1-CD2 4.11Å; V236-F238 HydrophobicContact CG1-CE1 3.75Å; V236-F238 HydrophobicContact CG1-CE2 3.54Å; V236-F238 HydrophobicContact CG1-CG 4.47Å; V236-F238 HydrophobicContact CG1-CZ 3.35Å; V236-M265 HydrophobicContact CG1-CB 4.47Å; V236-M265 HydrophobicContact CG1-CE 3.54Å; V236-S266 CarbonylContact C-O 3.54Å; V236-S266 WeakPolarHBondContact CA-O 3.09Å
237	K	96	Very high	91.1	Very high	132 Å²	132	70.5 Å²	70.5	57%	0.574	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.1	173.6	-56.7	-176.2	-179.8	-169.4	0	108.6	M265 S266	K237-M265 CarbonylContact O-C 3.57Å; K237-M265 WeakPolarHBondContact O-CA 3.46Å; K237-M265 WeakPolarHBondContact O-CB 3.1Å; K237-S266 PolarHBondContact N-O 3.18Å; K237-S266 PolarHBondContact O-N 3.38Å
238	F	96.8	Very high	91.8	Very high	41 Å²	41	67.1 Å²	67.1	18%	0.18	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.6	-178.1	-68	-73.9	0	0	0	111.6	V236 V242 L244 F247 I253 M265	V236-F238 HydrophobicContact CB-CE2 4.18Å; V236-F238 HydrophobicContact CB-CZ 4.3Å; V236-F238 HydrophobicContact CG1-CD1 4.29Å; V236-F238 HydrophobicContact CG1-CD2 4.11Å; V236-F238 HydrophobicContact CG1-CE1 3.75Å; V236-F238 HydrophobicContact CG1-CE2 3.54Å; V236-F238 HydrophobicContact CG1-CG 4.47Å; V236-F238 HydrophobicContact CG1-CZ 3.35Å; F238-V242 HydrophobicContact CB-CB 3.8Å; F238-V242 HydrophobicContact CB-CG1 4.22Å; F238-V242 HydrophobicContact CB-CG2 3.89Å; F238-V242 HydrophobicContact CD1-CB 4.13Å; F238-V242 HydrophobicContact CD1-CG1 3.88Å; F238-V242 HydrophobicContact CD1-CG2 3.81Å; F238-V242 HydrophobicContact CD2-CG1 4.45Å; F238-V242 HydrophobicContact CE1-CG1 4.34Å; F238-V242 HydrophobicContact CG-CB 4.06Å; F238-V242 HydrophobicContact CG-CG1 3.93Å; F238-V242 HydrophobicContact CG-CG2 4.14Å; F238-L244 HydrophobicContact CB-CD2 4.12Å; F238-L244 HydrophobicContact CD2-CD2 3.61Å; F238-L244 HydrophobicContact CE2-CD2 4.46Å; F238-L244 HydrophobicContact CG-CD2 4.21Å; F238-F247 AromaticContact CE2-CD1 3.64Å; F238-F247 HydrophobicContact CE2-CD1 3.64Å; F238-F247 HydrophobicContact CE2-CD2 4.12Å; F238-F247 AromaticContact CE2-CE1 3.58Å; F238-F247 HydrophobicContact CE2-CE1 3.58Å; F238-F247 HydrophobicContact CE2-CE2 4.09Å; F238-F247 AromaticContact CE2-CG 3.89Å; F238-F247 HydrophobicContact CE2-CG 3.89Å; F238-F247 AromaticContact CE2-CZ 3.8Å; F238-F247 HydrophobicContact CE2-CZ 3.8Å; F238-F247 HydrophobicContact CZ-CD1 4.12Å; F238-F247 AromaticContact CZ-CD2 3.76Å; F238-F247 HydrophobicContact CZ-CD2 3.76Å; F238-F247 AromaticContact CZ-CE1 3.93Å; F238-F247 HydrophobicContact CZ-CE1 3.93Å; F238-F247 AromaticContact CZ-CE2 3.58Å; F238-F247 HydrophobicContact CZ-CE2 3.58Å; F238-F247 HydrophobicContact CZ-CG 4.01Å; F238-F247 AromaticContact CZ-CZ 3.64Å; F238-F247 HydrophobicContact CZ-CZ 3.64Å; F238-I253 HydrophobicContact CE1-CD1 3.97Å; F238-I253 HydrophobicContact CE1-CG1 3.88Å; F238-I253 HydrophobicContact CE1-CG2 4.05Å; F238-I253 HydrophobicContact CZ-CD1 4.34Å; F238-I253 HydrophobicContact CZ-CG1 4.09Å; F238-M265 HydrophobicContact CD1-CB 3.68Å; F238-M265 HydrophobicContact CD1-SD 4.5Å; F238-M265 HydrophobicContact CE1-CB 3.95Å; F238-M265 HydrophobicContact CE1-CE 4.41Å; F238-M265 HydrophobicContact CE1-SD 3.85Å
239	H	96.1	Very high	92.1	Very high	48 Å²	48	71.3 Å²	71.3	22%	0.222	35%	0.347	C	S	.	.			trans	-62.7	152.9	162.8	-167.5	-93	0	0	0	110.8	C241 V242 E263 L264	H239-C241 PolarHBondContact ND1-N 2.76Å; H239-C241 PolarHBondContact ND1-SG 3.08Å; H239-C241 PolarHBondContact O-N 2.86Å; H239-V242 PolarHBondContact O-N 2.96Å; H239-E263 WeakPolarHBondContact CB-O 3.45Å; H239-E263 PolarHBondContact CD2-O 3.47Å; H239-L264 WeakPolarHBondContact CB-O 3.46Å; H239-L264 PolarHBondContact N-O 3.06Å
240	Q	94.2	Very high	92.1	Very high	97 Å²	97	69 Å²	69	45%	0.453	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-20.1	178	60.6	173.8	-3	0	0	114.3	D127 W159 V242	D127-Q240 PolarHBondContact OD1-NE2 3.21Å; D127-Q240 PolarHBondContact OD2-NE2 3.11Å; W159-Q240 HydrophobicContact CD2-CG 4.28Å; W159-Q240 HydrophobicContact CE3-CB 4.49Å; W159-Q240 HydrophobicContact CE3-CG 3.69Å; W159-Q240 HydrophobicContact CZ3-CB 4.4Å; W159-Q240 HydrophobicContact CZ3-CG 4.09Å; Q240-V242 VanDerWaalsContact C-N 3.26Å; Q240-V242 PolarHBondContact O-N 2.88Å
241	C	95.5	Very high	92.1	Very high	4 Å²	4	69.8 Å²	69.8	3%	0.027	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.4	-179.3	67.4	0	0	0	0	114.4	W159 H239 F255 I256	W159-C241 HydrophobicContact CD2-CB 4.1Å; W159-C241 VanDerWaalsContact CE2-CB 3.44Å; W159-C241 HydrophobicContact CG-CB 4.44Å; W159-C241 HydrophobicContact CZ2-CB 3.72Å; H239-C241 PolarHBondContact ND1-N 2.76Å; H239-C241 PolarHBondContact ND1-SG 3.08Å; H239-C241 PolarHBondContact O-N 2.86Å; C241-F255 HydrophobicContact CB-CB 4.3Å; C241-F255 WeakPolarHBondContact O-CA 3.41Å; C241-F255 WeakPolarHBondContact O-CB 3.44Å; C241-I256 VanDerWaalsContact CB-O 3.28Å; C241-I256 WeakPolarHBondContact CB-O 3.1Å
242	V	97	Very high	91.9	Very high	8 Å²	8	70.9 Å²	70.9	5%	0.048	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-84.3	130	-179	-177.5	0	0	0	0	110.8	F238 H239 Q240 L244 I253 F255 L264	F238-V242 HydrophobicContact CB-CB 3.8Å; F238-V242 HydrophobicContact CB-CG1 4.22Å; F238-V242 HydrophobicContact CB-CG2 3.89Å; F238-V242 HydrophobicContact CD1-CB 4.13Å; F238-V242 HydrophobicContact CD1-CG1 3.88Å; F238-V242 HydrophobicContact CD1-CG2 3.81Å; F238-V242 HydrophobicContact CD2-CG1 4.45Å; F238-V242 HydrophobicContact CE1-CG1 4.34Å; F238-V242 HydrophobicContact CG-CB 4.06Å; F238-V242 HydrophobicContact CG-CG1 3.93Å; F238-V242 HydrophobicContact CG-CG2 4.14Å; H239-V242 PolarHBondContact O-N 2.96Å; Q240-V242 VanDerWaalsContact C-N 3.26Å; Q240-V242 PolarHBondContact O-N 2.88Å; V242-L244 PolarHBondContact O-N 2.93Å; V242-I253 HydrophobicContact CG1-CG2 4.12Å; V242-I253 HydrophobicContact CG2-CG2 4.33Å; V242-F255 HydrophobicContact CG2-CB 4.06Å; V242-F255 HydrophobicContact CG2-CG 4.45Å; V242-L264 HydrophobicContact CG2-CD1 3.66Å
243	R	94.7	Very high	92.2	Very high	87 Å²	87	65.8 Å²	65.8	33%	0.328	32%	0.322	S	S	.	.			trans	-76.7	89.1	175.7	-63.7	-178.5	177.3	156.6	0.9	110.2	E209 S245 R246 F247 S254	E209-R243 IonicContact OE1-NH1 2.61Å; E209-R243 IonicContact OE2-CZ 2.81Å; E209-R243 IonicContact OE2-NH1 2.91Å; E209-R243 PolarHBondContact OE2-NH1 2.8Å; E209-R243 IonicContact OE2-NH2 3.83Å; R243-S245 PolarHBondContact O-N 3.15Å; R243-R246 HydrophobicContact CB-CB 4.35Å; R243-R246 HydrophobicContact CB-CG 4.27Å; R243-R246 VanDerWaalsContact NH1-CZ 3.33Å; R243-R246 VanDerWaalsContact NH1-NH1 3.12Å; R243-R246 PolarHBondContact O-N 3.45Å; R243-F247 PolarHBondContact O-N 3.39Å; R243-S254 PolarHBondContact N-O 3.14Å
244	L	93.1	Very high	92.5	Very high	106 Å²	106	64.8 Å²	64.8	56%	0.555	32%	0.316	S	S	*	.	H	α-helix	trans	-54.6	-37.4	-178.2	-63.3	179	0	0	0	113.1	F238 V242 R246 F247 E248	F238-L244 HydrophobicContact CB-CD2 4.12Å; F238-L244 HydrophobicContact CD2-CD2 3.61Å; F238-L244 HydrophobicContact CE2-CD2 4.46Å; F238-L244 HydrophobicContact CG-CD2 4.21Å; V242-L244 PolarHBondContact O-N 2.93Å; L244-R246 VanDerWaalsContact C-N 3.27Å; L244-R246 PolarHBondContact O-N 3.08Å; L244-F247 PolarHBondContact O-N 3.31Å; L244-F247 VanDerWaalsContact O-N 3.16Å; L244-E248 PolarHBondContact O-N 2.86Å
245	S	91.6	Very high	92.8	Very high	87 Å²	87	60.2 Å²	60.2	61%	0.608	30%	0.295	S	S	*	.	H	α-helix	trans	-61.7	-31.4	177.1	57.5	0	0	0	0	113.6	R243 N249	R243-S245 PolarHBondContact O-N 3.15Å; S245-N249 PolarHBondContact O-ND2 2.99Å
246	R	90.3	Very high	93	Very high	90 Å²	90	57.9 Å²	57.9	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-74.5	-44.5	173.5	-70.8	-171.6	174.4	177.8	-3	110.8	E209 R243 L244 E248 N249 D250 S254	E209-R246 IonicContact OE1-NH1 2.84Å; E209-R246 PolarHBondContact OE1-NH1 2.94Å; E209-R246 IonicContact OE2-NH1 3.29Å; R243-R246 HydrophobicContact CB-CB 4.35Å; R243-R246 HydrophobicContact CB-CG 4.27Å; R243-R246 VanDerWaalsContact NH1-CZ 3.33Å; R243-R246 VanDerWaalsContact NH1-NH1 3.12Å; R243-R246 PolarHBondContact O-N 3.45Å; L244-R246 VanDerWaalsContact C-N 3.27Å; L244-R246 PolarHBondContact O-N 3.08Å; R246-E248 VanDerWaalsContact C-N 3.3Å; R246-E248 PolarHBondContact O-N 2.81Å; R246-N249 PolarHBondContact O-N 3.08Å; R246-N249 VanDerWaalsContact O-N 3.17Å; R246-D250 PolarHBondContact O-N 3.29Å; R246-D250 VanDerWaalsContact O-N 3.11Å; R246-S254 PolarHBondContact NH1-OG 2.85Å
247	F	91.8	Very high	93.1	Very high	17 Å²	17	56.6 Å²	56.6	8%	0.075	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-40.2	178.5	-178.6	-101.5	0	0	0	112.6	F238 R243 L244 N249 R251 I253	F238-F247 AromaticContact CE2-CD1 3.64Å; F238-F247 HydrophobicContact CE2-CD1 3.64Å; F238-F247 HydrophobicContact CE2-CD2 4.12Å; F238-F247 AromaticContact CE2-CE1 3.58Å; F238-F247 HydrophobicContact CE2-CE1 3.58Å; F238-F247 HydrophobicContact CE2-CE2 4.09Å; F238-F247 AromaticContact CE2-CG 3.89Å; F238-F247 HydrophobicContact CE2-CG 3.89Å; F238-F247 AromaticContact CE2-CZ 3.8Å; F238-F247 HydrophobicContact CE2-CZ 3.8Å; F238-F247 HydrophobicContact CZ-CD1 4.12Å; F238-F247 AromaticContact CZ-CD2 3.76Å; F238-F247 HydrophobicContact CZ-CD2 3.76Å; F238-F247 AromaticContact CZ-CE1 3.93Å; F238-F247 HydrophobicContact CZ-CE1 3.93Å; F238-F247 AromaticContact CZ-CE2 3.58Å; F238-F247 HydrophobicContact CZ-CE2 3.58Å; F238-F247 HydrophobicContact CZ-CG 4.01Å; F238-F247 AromaticContact CZ-CZ 3.64Å; F238-F247 HydrophobicContact CZ-CZ 3.64Å; R243-F247 PolarHBondContact O-N 3.39Å; L244-F247 PolarHBondContact O-N 3.31Å; L244-F247 VanDerWaalsContact O-N 3.16Å; F247-N249 VanDerWaalsContact C-N 3.32Å; F247-N249 PolarHBondContact O-N 3.19Å; F247-R251 VanDerWaalsContact CZ-NH1 3.34Å; F247-R251 WeakPolarHBondContact O-CA 3.22Å; F247-R251 PolarHBondContact O-N 2.77Å; F247-I253 HydrophobicContact CD2-CG1 3.84Å; F247-I253 HydrophobicContact CE2-CG1 3.98Å
248	E	90	Very high	93.1	Very high	148 Å²	148	50.7 Å²	50.7	69%	0.692	25%	0.249	S	C	*	.	H	α-helix	trans	-62.9	-37.9	177.5	-165.3	62.7	-155.8	0	0	112.4	L244 R246	L244-E248 PolarHBondContact O-N 2.86Å; R246-E248 VanDerWaalsContact C-N 3.3Å; R246-E248 PolarHBondContact O-N 2.81Å
249	N	87.8	Confident	93	Very high	138 Å²	138	50.2 Å²	50.2	74%	0.738	25%	0.249	S	C	*	.	H	α-helix	trans	-77.1	-49.4	-175.6	-73.3	-35.9	0	0	0	113.3	S245 R246 F247	S245-N249 PolarHBondContact O-ND2 2.99Å; R246-N249 PolarHBondContact O-N 3.08Å; R246-N249 VanDerWaalsContact O-N 3.17Å; F247-N249 VanDerWaalsContact C-N 3.32Å; F247-N249 PolarHBondContact O-N 3.19Å
250	D	83	Confident	92.9	Very high	81 Å²	81	48.5 Å²	48.5	43%	0.433	25%	0.245	S	C	.	.	H	α-helix	trans	-131.4	9.3	-169.6	71.5	3.7	0	0	0	113.8	L219 R246 T252	L219-D250 WeakPolarHBondContact CD1-O 3.37Å; R246-D250 PolarHBondContact O-N 3.29Å; R246-D250 VanDerWaalsContact O-N 3.11Å; D250-T252 PolarHBondContact O-N 3.45Å; D250-T252 WeakPolarHBondContact OD1-CA 3.15Å; D250-T252 WeakPolarHBondContact OD1-CB 3.34Å; D250-T252 PolarHBondContact OD1-N 2.88Å; D250-T252 PolarHBondContact OD1-OG1 3.48Å; D250-T252 PolarHBondContact OD2-OG1 2.81Å; D250-T252 VanDerWaalsContact OD2-OG1 3.14Å
251	R	86.4	Confident	92.9	Very high	52 Å²	52	49.3 Å²	49.3	20%	0.196	25%	0.248	C	C	.	.			trans	59.2	20.5	-176.7	-54.1	-68	-68.9	-169.2	-6.4	113.5	D216 V218 L219 F247	D216-R251 IonicContact OD1-NH2 3.57Å; D216-R251 IonicContact OD2-CZ 3.62Å; D216-R251 VanDerWaalsContact OD2-CZ 3.29Å; D216-R251 IonicContact OD2-NE 2.7Å; D216-R251 PolarHBondContact OD2-NE 2.8Å; D216-R251 IonicContact OD2-NH2 3.86Å; D216-R251 PolarHBondContact OD2-NH2 2.76Å; V218-R251 HydrophobicContact CB-CG 4.48Å; V218-R251 HydrophobicContact CG1-CG 4.12Å; L219-R251 HydrophobicContact CB-CB 4.12Å; L219-R251 HydrophobicContact CD1-CB 4.2Å; F247-R251 VanDerWaalsContact CZ-NH1 3.34Å; F247-R251 WeakPolarHBondContact O-CA 3.22Å; F247-R251 PolarHBondContact O-N 2.77Å
252	T	87.6	Confident	92.9	Very high	26 Å²	26	50 Å²	50	16%	0.16	25%	0.251	C	S	.	.			trans	-83.6	119.9	175.3	-58.2	0	0	0	0	111.3	R211 D250 S254	R211-T252 HydrophobicContact CB-CG2 4.49Å; D250-T252 PolarHBondContact O-N 3.45Å; D250-T252 WeakPolarHBondContact OD1-CA 3.15Å; D250-T252 WeakPolarHBondContact OD1-CB 3.34Å; D250-T252 PolarHBondContact OD1-N 2.88Å; D250-T252 PolarHBondContact OD1-OG1 3.48Å; D250-T252 PolarHBondContact OD2-OG1 2.81Å; D250-T252 VanDerWaalsContact OD2-OG1 3.14Å; T252-S254 PolarHBondContact O-N 3.29Å
253	I	95.5	Very high	92.9	Very high	6 Å²	6	53.6 Å²	53.6	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	99	172.7	-55.8	167.3	0	0	0	108.2	R211 L212 L214 F238 V242 F247 F255 L264 M265	R211-I253 CarbonylContact C-O 3.5Å; R211-I253 VanDerWaalsContact CA-O 3.28Å; R211-I253 WeakPolarHBondContact CA-O 3.48Å; L212-I253 HydrophobicContact CB-CB 4.11Å; L212-I253 HydrophobicContact CB-CG2 4.22Å; L212-I253 HydrophobicContact CD2-CD1 4.19Å; L212-I253 HydrophobicContact CG-CD1 4.49Å; L212-I253 PolarHBondContact N-O 3.25Å; L214-I253 HydrophobicContact CD1-CD1 3.81Å; L214-I253 HydrophobicContact CG-CD1 4.28Å; F238-I253 HydrophobicContact CE1-CD1 3.97Å; F238-I253 HydrophobicContact CE1-CG1 3.88Å; F238-I253 HydrophobicContact CE1-CG2 4.05Å; F238-I253 HydrophobicContact CZ-CD1 4.34Å; F238-I253 HydrophobicContact CZ-CG1 4.09Å; V242-I253 HydrophobicContact CG1-CG2 4.12Å; V242-I253 HydrophobicContact CG2-CG2 4.33Å; F247-I253 HydrophobicContact CD2-CG1 3.84Å; F247-I253 HydrophobicContact CE2-CG1 3.98Å; I253-F255 HydrophobicContact CG2-CD1 3.97Å; I253-F255 HydrophobicContact CG2-CE1 4.08Å; I253-L264 HydrophobicContact CG2-CD2 4.42Å; I253-M265 HydrophobicContact CD1-SD 3.78Å
254	S	96.8	Very high	93	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.3	-178.6	178.1	0	0	0	0	110.6	E209 L210 R243 R246 T252	E209-S254 PolarHBondContact OE1-OG 2.84Å; L210-S254 WeakPolarHBondContact O-CA 3.33Å; R243-S254 PolarHBondContact N-O 3.14Å; R246-S254 PolarHBondContact NH1-OG 2.85Å; T252-S254 PolarHBondContact O-N 3.29Å
255	F	97.4	Very high	93.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	159.8	-173.2	58.6	-79.8	0	0	0	112.8	M200 L210 L212 C241 V242 I253 P257 F262 L264 L395	M200-F255 HydrophobicContact CE-CE2 4.31Å; M200-F255 HydrophobicContact CE-CZ 4.1Å; M200-F255 HydrophobicContact SD-CE2 3.82Å; M200-F255 HydrophobicContact SD-CZ 3.63Å; L210-F255 HydrophobicContact CB-CD1 4.35Å; L210-F255 HydrophobicContact CB-CD2 4.14Å; L210-F255 HydrophobicContact CB-CE1 3.96Å; L210-F255 HydrophobicContact CB-CE2 3.73Å; L210-F255 HydrophobicContact CB-CG 4.43Å; L210-F255 HydrophobicContact CB-CZ 3.62Å; L210-F255 HydrophobicContact CD2-CE2 3.81Å; L210-F255 HydrophobicContact CD2-CZ 3.93Å; L210-F255 HydrophobicContact CG-CE2 4.42Å; L210-F255 HydrophobicContact CG-CZ 4.43Å; L210-F255 PolarHBondContact N-O 2.89Å; L210-F255 PolarHBondContact O-N 2.9Å; L212-F255 HydrophobicContact CB-CE1 4.11Å; C241-F255 HydrophobicContact CB-CB 4.3Å; C241-F255 WeakPolarHBondContact O-CA 3.41Å; C241-F255 WeakPolarHBondContact O-CB 3.44Å; V242-F255 HydrophobicContact CG2-CB 4.06Å; V242-F255 HydrophobicContact CG2-CG 4.45Å; I253-F255 HydrophobicContact CG2-CD1 3.97Å; I253-F255 HydrophobicContact CG2-CE1 4.08Å; F255-P257 HydrophobicContact CD2-CB 4.08Å; F255-P257 HydrophobicContact CE2-CB 3.97Å; F255-F262 HydrophobicContact CE2-CZ 4.25Å; F255-L264 HydrophobicContact CD1-CD1 3.87Å; F255-L264 HydrophobicContact CD1-CD2 4.46Å; F255-L264 HydrophobicContact CD2-CD1 3.75Å; F255-L264 HydrophobicContact CE1-CD1 3.83Å; F255-L264 HydrophobicContact CE1-CD2 3.7Å; F255-L264 HydrophobicContact CE1-CG 4.43Å; F255-L264 HydrophobicContact CE2-CD1 3.7Å; F255-L264 HydrophobicContact CE2-CD2 4.35Å; F255-L264 HydrophobicContact CG-CD1 3.84Å; F255-L264 HydrophobicContact CZ-CD1 3.75Å; F255-L264 HydrophobicContact CZ-CD2 3.63Å; F255-L264 HydrophobicContact CZ-CG 4.33Å; F255-L395 HydrophobicContact CZ-CD1 4.5Å
256	I	97.1	Very high	93.5	Very high	21 Å²	21	42 Å²	42	11%	0.108	21%	0.208	C	C	.	.			trans	-104.7	112.1	164.5	-64.4	170.8	0	0	0	106.2	V157 W159 M207 C241	V157-I256 HydrophobicContact CG1-CG2 4.39Å; V157-I256 HydrophobicContact CG2-CD1 4.12Å; W159-I256 PolarHBondContact NE1-O 3.01Å; M207-I256 HydrophobicContact CE-CG2 4.22Å; C241-I256 VanDerWaalsContact CB-O 3.28Å; C241-I256 WeakPolarHBondContact CB-O 3.1Å
257	P	96.7	Very high	93.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-71.5	138.7	-171.5	28	-35.1	0	0	0	112.8	R160 V202 P208 L210 F255 F262	R160-P257 WeakPolarHBondContact CD-O 3.4Å; R160-P257 PolarHBondContact NH1-O 3.46Å; V202-P257 HydrophobicContact CB-CB 4.28Å; V202-P257 HydrophobicContact CG1-CB 3.99Å; V202-P257 HydrophobicContact CG1-CG 3.73Å; V202-P257 HydrophobicContact CG2-CB 3.83Å; V202-P257 HydrophobicContact CG2-CG 4.36Å; P208-P257 HydrophobicContact CG-CG 4.35Å; P208-P257 WeakPolarHBondContact O-CD 3.11Å; L210-P257 HydrophobicContact CD1-CG 3.98Å; L210-P257 HydrophobicContact CD2-CB 4.47Å; L210-P257 HydrophobicContact CD2-CG 3.96Å; L210-P257 HydrophobicContact CG-CG 4.48Å; F255-P257 HydrophobicContact CD2-CB 4.08Å; F255-P257 HydrophobicContact CE2-CB 3.97Å; P257-F262 HydrophobicContact CB-CE1 3.78Å; P257-F262 HydrophobicContact CB-CZ 3.76Å
258	P	95.5	Very high	93.9	Very high	7 Å²	7	40.9 Å²	40.9	5%	0.045	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-51.4	152.9	157.8	-20.6	30.2	0	0	0	111.1	W159 F262	W159-P258 HydrophobicContact CB-CG 4.11Å; W159-P258 HydrophobicContact CG-CG 4.07Å; W159-P258 WeakPolarHBondContact O-CA 3.41Å; P258-F262 HydrophobicContact CB-CD1 4.12Å; P258-F262 HydrophobicContact CB-CG 4.28Å; P258-F262 HydrophobicContact CG-CB 4.5Å; P258-F262 HydrophobicContact CG-CD1 4.18Å; P258-F262 HydrophobicContact CG-CD2 4.09Å; P258-F262 HydrophobicContact CG-CE1 4.45Å; P258-F262 HydrophobicContact CG-CE2 4.38Å; P258-F262 HydrophobicContact CG-CG 4Å
259	D	94.4	Very high	94.1	Very high	31 Å²	31	34.5 Å²	34.5	17%	0.166	17%	0.174	C	C	.	.	S	Bend	trans	-78.6	143.9	178	-156.1	59.9	0	0	0	112	K129 R160 I164 Y166	K129-D259 WeakPolarHBondContact CD-O 3.4Å; K129-D259 WeakPolarHBondContact CE-O 3.39Å; K129-D259 PolarHBondContact NZ-O 2.98Å; R160-D259 IonicContact CZ-OD1 2.81Å; R160-D259 IonicContact NH1-OD1 3.72Å; R160-D259 PolarHBondContact NH1-OD1 3.24Å; R160-D259 VanDerWaalsContact NH1-OD1 3.1Å; R160-D259 IonicContact NH2-OD1 3.81Å; I164-D259 HydrophobicContact CD1-CB 3.75Å; Y166-D259 WeakPolarHBondContact CE2-OD1 3.48Å; Y166-D259 PolarHBondContact OH-OD2 3.27Å
260	G	94.1	Very high	94.2	Very high	13 Å²	13	31.4 Å²	31.4	13%	0.134	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.7	-144.5	-178	0	0	0	0	0	113.7	R201 V202	R201-G260 WeakPolarHBondContact CA-O 3.47Å; V202-G260 PolarHBondContact N-O 2.87Å; V202-G260 PolarHBondContact O-N 3.37Å
261	E	94.8	Very high	94	Very high	113 Å²	113	28.4 Å²	28.4	53%	0.528	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.2	-175.6	-171.5	168.7	171.6	0	0	112.8	K129 M200 R201	K129-E261 PolarHBondContact NZ-O 3.08Å; M200-E261 CarbonylContact O-C 3.52Å; M200-E261 VanDerWaalsContact O-CA 3.29Å; M200-E261 WeakPolarHBondContact O-CA 3.25Å; R201-E261 HydrophobicContact CG-CB 4.07Å; R201-E261 HydrophobicContact CG-CG 3.98Å
262	F	95.9	Very high	93.3	Very high	20 Å²	20	35.1 Å²	35.1	9%	0.088	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	159.6	170.3	72.1	-77.7	0	0	0	111.2	M200 V202 F255 P257 P258 L264	M200-F262 HydrophobicContact CB-CD1 4.32Å; M200-F262 HydrophobicContact CB-CE1 3.81Å; M200-F262 HydrophobicContact CB-CZ 4Å; M200-F262 HydrophobicContact CG-CZ 4.42Å; M200-F262 PolarHBondContact N-O 2.86Å; M200-F262 PolarHBondContact O-N 2.94Å; M200-F262 HydrophobicContact SD-CZ 4.07Å; V202-F262 HydrophobicContact CG2-CE1 3.68Å; V202-F262 HydrophobicContact CG2-CZ 4.46Å; F255-F262 HydrophobicContact CE2-CZ 4.25Å; P257-F262 HydrophobicContact CB-CE1 3.78Å; P257-F262 HydrophobicContact CB-CZ 3.76Å; P258-F262 HydrophobicContact CB-CD1 4.12Å; P258-F262 HydrophobicContact CB-CG 4.28Å; P258-F262 HydrophobicContact CG-CB 4.5Å; P258-F262 HydrophobicContact CG-CD1 4.18Å; P258-F262 HydrophobicContact CG-CD2 4.09Å; P258-F262 HydrophobicContact CG-CE1 4.45Å; P258-F262 HydrophobicContact CG-CE2 4.38Å; P258-F262 HydrophobicContact CG-CG 4Å; F262-L264 HydrophobicContact CE2-CB 3.92Å; F262-L264 HydrophobicContact CE2-CD1 3.97Å; F262-L264 HydrophobicContact CZ-CD1 4.43Å
263	E	96.8	Very high	92.6	Very high	82 Å²	82	37.9 Å²	37.9	38%	0.383	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	118.2	169.3	-180	170.9	-167.5	0	0	110	S197 K199 H239 S266	S197-E263 VanDerWaalsContact CB-OE1 3.32Å; S197-E263 WeakPolarHBondContact CB-OE1 3.16Å; S197-E263 WeakPolarHBondContact OG-CG 3.41Å; S197-E263 PolarHBondContact OG-OE1 2.82Å; K199-E263 HydrophobicContact CG-CB 4.48Å; H239-E263 WeakPolarHBondContact CB-O 3.45Å; H239-E263 PolarHBondContact CD2-O 3.47Å; E263-S266 WeakPolarHBondContact OE1-CB 3.48Å
264	L	97.3	Very high	92.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-45.6	179.2	173.9	67.9	0	0	0	111.6	I198 M200 L212 H239 V242 I253 F255 F262	I198-L264 PolarHBondContact O-N 3.37Å; M200-L264 HydrophobicContact CG-CB 4.02Å; M200-L264 HydrophobicContact SD-CB 3.91Å; M200-L264 HydrophobicContact SD-CD1 4.47Å; M200-L264 HydrophobicContact SD-CD2 3.61Å; M200-L264 HydrophobicContact SD-CG 4.19Å; L212-L264 HydrophobicContact CD2-CD2 3.64Å; H239-L264 WeakPolarHBondContact CB-O 3.46Å; H239-L264 PolarHBondContact N-O 3.06Å; V242-L264 HydrophobicContact CG2-CD1 3.66Å; I253-L264 HydrophobicContact CG2-CD2 4.42Å; F255-L264 HydrophobicContact CD1-CD1 3.87Å; F255-L264 HydrophobicContact CD1-CD2 4.46Å; F255-L264 HydrophobicContact CD2-CD1 3.75Å; F255-L264 HydrophobicContact CE1-CD1 3.83Å; F255-L264 HydrophobicContact CE1-CD2 3.7Å; F255-L264 HydrophobicContact CE1-CG 4.43Å; F255-L264 HydrophobicContact CE2-CD1 3.7Å; F255-L264 HydrophobicContact CE2-CD2 4.35Å; F255-L264 HydrophobicContact CG-CD1 3.84Å; F255-L264 HydrophobicContact CZ-CD1 3.75Å; F255-L264 HydrophobicContact CZ-CD2 3.63Å; F255-L264 HydrophobicContact CZ-CG 4.33Å; F262-L264 HydrophobicContact CE2-CB 3.92Å; F262-L264 HydrophobicContact CE2-CD1 3.97Å; F262-L264 HydrophobicContact CZ-CD1 4.43Å
265	M	96.9	Very high	91.8	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	147.9	-177.7	60.1	178.3	-79.9	0	0	111.5	S197 I198 L214 V236 K237 F238 I253 Y267	S197-M265 WeakPolarHBondContact CA-O 3.25Å; I198-M265 HydrophobicContact CB-CG 3.86Å; I198-M265 HydrophobicContact CD1-CE 4.38Å; I198-M265 HydrophobicContact CD1-CG 3.88Å; I198-M265 HydrophobicContact CD1-SD 3.75Å; I198-M265 HydrophobicContact CG1-CG 3.91Å; I198-M265 HydrophobicContact CG1-SD 4.42Å; I198-M265 PolarHBondContact N-O 3.36Å; L214-M265 HydrophobicContact CD1-CE 4.06Å; L214-M265 HydrophobicContact CD1-SD 4.05Å; V236-M265 HydrophobicContact CG1-CB 4.47Å; V236-M265 HydrophobicContact CG1-CE 3.54Å; K237-M265 CarbonylContact O-C 3.57Å; K237-M265 WeakPolarHBondContact O-CA 3.46Å; K237-M265 WeakPolarHBondContact O-CB 3.1Å; F238-M265 HydrophobicContact CD1-CB 3.68Å; F238-M265 HydrophobicContact CD1-SD 4.5Å; F238-M265 HydrophobicContact CE1-CB 3.95Å; F238-M265 HydrophobicContact CE1-CE 4.41Å; F238-M265 HydrophobicContact CE1-SD 3.85Å; I253-M265 HydrophobicContact CD1-SD 3.78Å; M265-Y267 HydrophobicContact CE-CD1 3.88Å; M265-Y267 HydrophobicContact CE-CG 4.35Å
266	S	97.3	Very high	91.7	Very high	36 Å²	36	45.8 Å²	45.8	25%	0.252	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	145.9	161	46.9	0	0	0	0	109.5	G196 V236 K237 E263	G196-S266 CarbonylContact O-C 3.57Å; G196-S266 VanDerWaalsContact O-CA 3.23Å; G196-S266 WeakPolarHBondContact O-CA 3.46Å; V236-S266 CarbonylContact C-O 3.54Å; V236-S266 WeakPolarHBondContact CA-O 3.09Å; K237-S266 PolarHBondContact N-O 3.18Å; K237-S266 PolarHBondContact O-N 3.38Å; E263-S266 WeakPolarHBondContact OE1-CB 3.48Å
267	Y	95.9	Very high	91.7	Very high	3 Å²	3	44.8 Å²	44.8	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	148.6	178.4	60.2	-86.9	0	0	0	110.1	E177 G196 I198 L233 D235 M265 L269 I390	E177-Y267 VanDerWaalsContact CG-OH 3.27Å; E177-Y267 WeakPolarHBondContact CG-OH 3.39Å; E177-Y267 PolarHBondContact OE1-OH 3.05Å; G196-Y267 VanDerWaalsContact CA-CZ 3.44Å; G196-Y267 PolarHBondContact N-O 3.5Å; G196-Y267 PolarHBondContact O-N 2.85Å; I198-Y267 HydrophobicContact CG1-CE1 4.04Å; L233-Y267 HydrophobicContact CD2-CD2 3.67Å; L233-Y267 HydrophobicContact CD2-CE2 4.39Å; L233-Y267 HydrophobicContact CD2-CG 4.05Å; D235-Y267 CarbonylContact O-C 3.54Å; D235-Y267 VanDerWaalsContact O-CA 3.27Å; D235-Y267 WeakPolarHBondContact O-CA 3.22Å; M265-Y267 HydrophobicContact CE-CD1 3.88Å; M265-Y267 HydrophobicContact CE-CG 4.35Å; Y267-L269 HydrophobicContact CD2-CD2 3.76Å; Y267-L269 HydrophobicContact CE2-CD2 3.83Å; Y267-I390 HydrophobicContact CD1-CD1 4.34Å; Y267-I390 HydrophobicContact CD2-CD1 4.49Å; Y267-I390 HydrophobicContact CE1-CD1 3.81Å; Y267-I390 HydrophobicContact CE2-CD1 3.96Å
268	R	95.5	Very high	91.6	Very high	79 Å²	79	46.6 Å²	46.6	30%	0.298	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.5	176.7	-165.8	178.9	67.7	75.7	18.7	109.1	E193 I194 V195 E234 D235	E193-R268 IonicContact OE2-NH1 3.76Å; I194-R268 WeakPolarHBondContact O-CA 3.48Å; V195-R268 HydrophobicContact CG2-CG 4.34Å; E234-R268 WeakPolarHBondContact CB-O 3.34Å; E234-R268 PolarHBondContact N-O 2.96Å; E234-R268 IonicContact OE2-CZ 2.68Å; E234-R268 IonicContact OE2-NH1 3.59Å; E234-R268 PolarHBondContact OE2-NH1 3.21Å; E234-R268 IonicContact OE2-NH2 3.32Å; E234-R268 PolarHBondContact OE2-NH2 2.83Å; D235-R268 HydrophobicContact CB-CB 4.39Å; D235-R268 PolarHBondContact N-O 3.41Å; D235-R268 PolarHBondContact O-N 3.17Å
269	L	93.7	Very high	91.6	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.079	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	149	168	66.2	145.8	0	0	0	110.2	E193 I194 V231 E232 Y267	E193-L269 WeakPolarHBondContact CA-O 3.42Å; I194-L269 HydrophobicContact CB-CD2 3.98Å; I194-L269 HydrophobicContact CB-CG 4.14Å; I194-L269 HydrophobicContact CD1-CD1 4.41Å; I194-L269 HydrophobicContact CD1-CG 4.49Å; I194-L269 HydrophobicContact CG2-CD2 4.18Å; I194-L269 PolarHBondContact N-O 3.5Å; I194-L269 PolarHBondContact O-N 2.86Å; V231-L269 HydrophobicContact CG2-CD1 4.1Å; E232-L269 WeakPolarHBondContact O-CB 3.47Å; Y267-L269 HydrophobicContact CD2-CD2 3.76Å; Y267-L269 HydrophobicContact CE2-CD2 3.83Å
270	N	89.6	Confident	91.6	Very high	73 Å²	73	48.7 Å²	48.7	39%	0.39	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	144.9	168.3	-71	-37.1	0	0	0	110.1	E234	E234-N270 VanDerWaalsContact CD-ND2 3.32Å; E234-N270 VanDerWaalsContact OE1-CB 3.26Å; E234-N270 WeakPolarHBondContact OE1-CB 3.43Å; E234-N270 PolarHBondContact OE1-N 3.33Å; E234-N270 PolarHBondContact OE1-ND2 3.37Å; E234-N270 PolarHBondContact OE2-ND2 2.86Å
271	T	79.4	Confident	91.5	Very high	17 Å²	17	49.9 Å²	49.9	10%	0.104	24%	0.244	C	C	.	.			trans	-119.9	129	176.9	-170.3	0	0	0	0	110.5	S192 I194 V273	S192-T271 PolarHBondContact O-N 3.42Å; S192-T271 WeakPolarHBondContact OG-CG2 3.48Å; I194-T271 HydrophobicContact CD1-CG2 4.07Å; I194-T271 HydrophobicContact CG1-CG2 3.97Å; T271-V273 VanDerWaalsContact C-N 3.27Å; T271-V273 WeakPolarHBondContact OG1-CB 3.48Å; T271-V273 VanDerWaalsContact OG1-CG2 3.28Å; T271-V273 WeakPolarHBondContact OG1-CG2 3.29Å; T271-V273 PolarHBondContact OG1-N 3.17Å
272	H	71	Confident	91.4	Very high	194 Å²	194	48.4 Å²	48.4	90%	0.898	24%	0.243	S	C	*	.			trans	-92.6	10.4	169.6	-59.4	-66.5	0	0	0	111.8
273	V	73.5	Confident	91.2	Very high	83 Å²	83	50.2 Å²	50.2	50%	0.503	25%	0.252	S	S	.	.	S	Bend	trans	-78.4	147.3	-178.4	-174	0	0	0	0	109.6	T271	T271-V273 VanDerWaalsContact C-N 3.27Å; T271-V273 WeakPolarHBondContact OG1-CB 3.48Å; T271-V273 VanDerWaalsContact OG1-CG2 3.28Å; T271-V273 WeakPolarHBondContact OG1-CG2 3.29Å; T271-V273 PolarHBondContact OG1-N 3.17Å
274	K	85.2	Confident	91	Very high	153 Å²	153	50.9 Å²	50.9	67%	0.665	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-58	143.4	174.3	-62	-175.4	178.2	-178.4	0	110.8	L276 Q300	K274-L276 PolarHBondContact O-N 3.37Å; K274-Q300 VanDerWaalsContact CB-OE1 3.31Å
275	P	90.7	Very high	90.7	Very high	13 Å²	13	57.1 Å²	57.1	8%	0.084	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-51.6	133.7	176.8	-32.3	40.5	0	0	0	113.1	L181 V189 I277 W278 Q300 Y418	L181-P275 HydrophobicContact CD1-CB 4.43Å; L181-P275 HydrophobicContact CD1-CG 3.84Å; L181-P275 HydrophobicContact CD2-CB 3.64Å; L181-P275 HydrophobicContact CD2-CG 3.77Å; L181-P275 HydrophobicContact CG-CG 4.48Å; V189-P275 HydrophobicContact CG2-CG 4.06Å; P275-I277 VanDerWaalsContact C-N 3.34Å; P275-I277 PolarHBondContact O-N 2.91Å; P275-W278 HydrophobicContact CB-CE3 3.97Å; P275-W278 HydrophobicContact CG-CE3 3.74Å; P275-W278 HydrophobicContact CG-CZ3 3.91Å; P275-Q300 WeakPolarHBondContact O-CB 2.97Å; P275-Q300 PolarHBondContact O-OE1 3.2Å; P275-Y418 WeakPolarHBondContact CB-OH 3.49Å
276	L	94.5	Very high	90.4	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.037	30%	0.3	C	S	.	.	S	Bend	trans	-61.1	-42	-177	-62.8	174.8	0	0	0	112.3	V179 K274 S299 Q300 F301 F380 I382 F385 T387 T413	V179-L276 HydrophobicContact CG2-CD1 3.95Å; K274-L276 PolarHBondContact O-N 3.37Å; L276-S299 CarbonylContact O-C 3.6Å; L276-Q300 PolarHBondContact O-N 2.84Å; L276-F301 HydrophobicContact CB-CD1 4.08Å; L276-F301 HydrophobicContact CD2-CB 4.04Å; L276-F301 VanDerWaalsContact O-CD1 3.24Å; L276-F301 WeakPolarHBondContact O-CD1 3.45Å; L276-F380 HydrophobicContact CD1-CE2 3.83Å; L276-F380 HydrophobicContact CD1-CZ 4Å; L276-I382 HydrophobicContact CD1-CD1 4.11Å; L276-F385 HydrophobicContact CD2-CE1 3.9Å; L276-F385 HydrophobicContact CD2-CZ 4.31Å; L276-T387 HydrophobicContact CD2-CG2 4.29Å; L276-T413 HydrophobicContact CD1-CG2 3.69Å
277	I	96.3	Very high	89.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	106.8	175.2	-60.3	179.5	0	0	0	108	P275 I279 K298 F301 A307 V310 F348 V378 F380 Y418	P275-I277 VanDerWaalsContact C-N 3.34Å; P275-I277 PolarHBondContact O-N 2.91Å; I277-I279 HydrophobicContact CG2-CD1 3.81Å; I277-K298 WeakPolarHBondContact CA-O 3.48Å; I277-F301 HydrophobicContact CG1-CE1 4.05Å; I277-A307 HydrophobicContact CD1-CB 4.17Å; I277-V310 HydrophobicContact CD1-CG1 3.92Å; I277-V310 HydrophobicContact CD1-CG2 4.01Å; I277-F348 HydrophobicContact CG2-CE1 4.28Å; I277-V378 HydrophobicContact CD1-CG1 4.48Å; I277-V378 HydrophobicContact CG2-CG1 4.39Å; I277-F380 HydrophobicContact CD1-CB 3.7Å; I277-F380 HydrophobicContact CD1-CD1 3.97Å; I277-F380 HydrophobicContact CD1-CD2 4.46Å; I277-F380 HydrophobicContact CD1-CG 3.79Å; I277-Y418 VanDerWaalsContact C-OH 3.28Å; I277-Y418 PolarHBondContact N-OH 3.12Å; I277-Y418 WeakPolarHBondContact O-CE1 3.3Å; I277-Y418 PolarHBondContact O-OH 3.06Å
278	W	95.9	Very high	89.4	Confident	37 Å²	37	67 Å²	67	14%	0.14	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.6	179.1	-177.1	-104.6	0	0	0	110.3	V183 G187 V189 P275 E280 A297 K298 Q300	V183-W278 HydrophobicContact CG1-CH2 3.57Å; V183-W278 HydrophobicContact CG1-CZ3 3.91Å; V183-W278 HydrophobicContact CG2-CH2 4.34Å; V183-W278 HydrophobicContact CG2-CZ3 3.8Å; G187-W278 VanDerWaalsContact O-CH2 3.27Å; G187-W278 WeakPolarHBondContact O-CH2 3.36Å; V189-W278 HydrophobicContact CG2-CZ3 4.42Å; P275-W278 HydrophobicContact CB-CE3 3.97Å; P275-W278 HydrophobicContact CG-CE3 3.74Å; P275-W278 HydrophobicContact CG-CZ3 3.91Å; W278-E280 VanDerWaalsContact NE1-CG 3.26Å; W278-E280 PolarHBondContact NE1-OE1 2.79Å; W278-E280 VanDerWaalsContact NE1-OE1 3.12Å; W278-A297 WeakPolarHBondContact O-CA 3.33Å; W278-K298 HydrophobicContact CB-CB 4.24Å; W278-K298 PolarHBondContact N-O 2.89Å; W278-K298 PolarHBondContact O-N 3.11Å; W278-Q300 HydrophobicContact CB-CG 4.34Å
279	I	95.8	Very high	89.2	Confident	9 Å²	9	66.5 Å²	66.5	5%	0.046	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.1	177.2	-50.9	-59.1	0	0	0	108.8	I277 I295 A297 I312 I376 V378 L420	I277-I279 HydrophobicContact CG2-CD1 3.81Å; I279-I295 HydrophobicContact CG2-CG2 3.64Å; I279-A297 HydrophobicContact CD1-CB 3.57Å; I279-I312 HydrophobicContact CD1-CD1 3.73Å; I279-I312 HydrophobicContact CD1-CG1 4.11Å; I279-I312 HydrophobicContact CD1-CG2 4.3Å; I279-I312 HydrophobicContact CG1-CG2 4.49Å; I279-I376 HydrophobicContact CG2-CD1 4.37Å; I279-I376 HydrophobicContact CG2-CG2 4.39Å; I279-V378 HydrophobicContact CD1-CG2 4.25Å; I279-V378 HydrophobicContact CG1-CG2 3.73Å; I279-L420 HydrophobicContact CB-CD1 4.43Å; I279-L420 HydrophobicContact CB-CD2 4.05Å; I279-L420 HydrophobicContact CG1-CD1 4.24Å
280	E	93.8	Very high	89.2	Confident	74 Å²	74	70.1 Å²	70.1	35%	0.346	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120	168.2	-70	166.8	-175.1	0	0	107.4	W278 I295 K296 K298	W278-E280 VanDerWaalsContact NE1-CG 3.26Å; W278-E280 PolarHBondContact NE1-OE1 2.79Å; W278-E280 VanDerWaalsContact NE1-OE1 3.12Å; E280-I295 CarbonylContact O-C 3.58Å; E280-I295 WeakPolarHBondContact O-CA 3.43Å; E280-K296 HydrophobicContact CB-CB 4.3Å; E280-K296 PolarHBondContact N-O 2.64Å; E280-K296 PolarHBondContact O-N 2.88Å; E280-K296 WeakPolarHBondContact OE2-CE 3.37Å; E280-K298 IonicContact OE1-NZ 3.03Å; E280-K298 PolarHBondContact OE1-NZ 3.37Å; E280-K298 IonicContact OE2-NZ 3.64Å; E280-K298 PolarHBondContact OE2-NZ 2.85Å
281	S	92.3	Very high	89.4	Confident	38 Å²	38	66.9 Å²	66.9	27%	0.266	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.5	176.8	60.5	0	0	0	0	110.1
282	V	92.6	Very high	90.1	Very high	82 Å²	82	66.7 Å²	66.7	50%	0.497	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.9	167.9	-178.4	0	0	0	0	107.4	E284 M294	V282-E284 HydrophobicContact CG1-CG 4.48Å; V282-M294 HydrophobicContact CB-CB 4.48Å; V282-M294 PolarHBondContact N-O 3.18Å; V282-M294 PolarHBondContact O-N 3.4Å
283	I	92	Very high	91.3	Very high	57 Å²	57	57.9 Å²	57.9	29%	0.292	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.3	-178.2	-54.3	176.8	0	0	0	107.7	I291 Y293 T422	I283-I291 HydrophobicContact CG2-CD1 3.78Å; I283-I291 HydrophobicContact CG2-CG1 3.95Å; I283-Y293 HydrophobicContact CD1-CD1 4.23Å; I283-Y293 HydrophobicContact CD1-CE1 3.79Å; I283-Y293 HydrophobicContact CG1-CD1 3.81Å; I283-Y293 HydrophobicContact CG1-CE1 3.83Å; I283-Y293 HydrophobicContact CG2-CD1 4.42Å; I283-Y293 HydrophobicContact CG2-CE1 4.07Å; I283-T422 HydrophobicContact CD1-CG2 4.45Å
284	E	93	Very high	92.4	Very high	96 Å²	96	58.2 Å²	58.2	45%	0.449	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	97.2	175.6	-68.3	178.7	-169.4	0	0	108.3	V282 E292	V282-E284 HydrophobicContact CG1-CG 4.48Å; E284-E292 HydrophobicContact CB-CB 4.37Å; E284-E292 PolarHBondContact N-O 3.37Å; E284-E292 PolarHBondContact O-N 3.21Å
285	K	90.4	Very high	92.9	Very high	131 Å²	131	50.9 Å²	50.9	57%	0.57	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	119.2	177.2	-173.4	176	-179.5	175.3	0	109.9	I291 L362	K285-I291 HydrophobicContact CB-CD1 4.19Å; K285-I291 HydrophobicContact CB-CG1 4.24Å; K285-I291 HydrophobicContact CD-CD1 4.45Å; K285-I291 HydrophobicContact CG-CD1 4.24Å; K285-I291 HydrophobicContact CG-CG1 4.49Å; K285-L362 HydrophobicContact CD-CD1 4.46Å; K285-L362 HydrophobicContact CG-CD1 4.04Å
286	H	90.7	Very high	93.2	Very high	80 Å²	80	52.8 Å²	52.8	37%	0.37	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	103.8	167.5	-62.4	-89.4	0	0	0	108.3	H288 S289 R290	H286-H288 PolarHBondContact O-N 3.27Å; H286-S289 PolarHBondContact O-N 3.29Å; H286-S289 VanDerWaalsContact O-N 3.16Å; H286-R290 CarbonylContact C-O 3.48Å; H286-R290 WeakPolarHBondContact CA-O 3.46Å; H286-R290 HydrophobicContact CB-CG 3.99Å; H286-R290 WeakPolarHBondContact CB-O 3.22Å; H286-R290 PolarHBondContact N-O 3Å; H286-R290 PolarHBondContact O-N 3.16Å; H286-R290 VanDerWaalsContact O-N 3.11Å; H286-R290 VanDerWaalsContact O-O 3.05Å
287	S	85.8	Confident	93.3	Very high	75 Å²	75	52.5 Å²	52.5	52%	0.524	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	139	179.9	-57.4	0	0	0	0	111.5	S289	S287-S289 PolarHBondContact O-N 2.99Å
288	H	86.4	Confident	93.3	Very high	94 Å²	94	54.7 Å²	54.7	44%	0.435	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	18.9	179.8	-46.8	-80.6	0	0	0	115.9	H286 P363 S364 E366	H286-H288 PolarHBondContact O-N 3.27Å; H288-P363 WeakPolarHBondContact CA-O 3.22Å; H288-S364 PolarHBondContact ND1-O 3.02Å; H288-E366 VanDerWaalsContact CE1-CG 3.42Å; H288-E366 WeakPolarHBondContact CE1-CG 3.45Å; H288-E366 IonicContact CE1-OE1 2.76Å; H288-E366 IonicContact NE2-OE1 3.94Å; H288-E366 PolarHBondContact NE2-OE1 3.32Å
289	S	91.8	Very high	93.3	Very high	69 Å²	69	53.1 Å²	53.1	48%	0.483	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	-65.6	-176.1	-178.9	0	0	0	0	113.3	H286 S287 L362	H286-S289 PolarHBondContact O-N 3.29Å; H286-S289 VanDerWaalsContact O-N 3.16Å; S287-S289 PolarHBondContact O-N 2.99Å; S289-L362 PolarHBondContact O-N 3.2Å
290	R	92.2	Very high	93.3	Very high	91 Å²	91	56.5 Å²	56.5	34%	0.343	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	160.5	-170.8	59.8	176.5	-179.8	171.2	8.3	112.3	H286 E292 H359 F360	H286-R290 CarbonylContact C-O 3.48Å; H286-R290 WeakPolarHBondContact CA-O 3.46Å; H286-R290 HydrophobicContact CB-CG 3.99Å; H286-R290 WeakPolarHBondContact CB-O 3.22Å; H286-R290 PolarHBondContact N-O 3Å; H286-R290 PolarHBondContact O-N 3.16Å; H286-R290 VanDerWaalsContact O-N 3.11Å; H286-R290 VanDerWaalsContact O-O 3.05Å; R290-E292 IonicContact CZ-OE1 2.83Å; R290-E292 VanDerWaalsContact CZ-OE1 3.22Å; R290-E292 IonicContact NE-OE1 3.68Å; R290-E292 IonicContact NH1-OE1 2.71Å; R290-E292 PolarHBondContact NH1-OE1 3.03Å; R290-E292 IonicContact NH2-OE1 3.78Å; R290-H359 WeakPolarHBondContact CD-NE2 3.38Å; R290-F360 CarbonylContact C-O 3.51Å; R290-F360 WeakPolarHBondContact CA-O 3.34Å; R290-F360 WeakPolarHBondContact CB-O 3.49Å
291	I	93.8	Very high	93.3	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.026	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	131.8	170.5	-172.3	166.8	0	0	0	109.7	I283 K285 Y293 P317 F360 L362	I283-I291 HydrophobicContact CG2-CD1 3.78Å; I283-I291 HydrophobicContact CG2-CG1 3.95Å; K285-I291 HydrophobicContact CB-CD1 4.19Å; K285-I291 HydrophobicContact CB-CG1 4.24Å; K285-I291 HydrophobicContact CD-CD1 4.45Å; K285-I291 HydrophobicContact CG-CD1 4.24Å; K285-I291 HydrophobicContact CG-CG1 4.49Å; I291-Y293 HydrophobicContact CB-CE2 4.44Å; I291-Y293 HydrophobicContact CD1-CE2 3.87Å; I291-Y293 WeakPolarHBondContact CD1-OH 3.29Å; I291-Y293 HydrophobicContact CG1-CD2 4.37Å; I291-Y293 HydrophobicContact CG1-CE2 3.72Å; I291-Y293 HydrophobicContact CG2-CE2 3.98Å; I291-P317 HydrophobicContact CD1-CG 4.05Å; I291-F360 HydrophobicContact CG2-CB 3.66Å; I291-F360 HydrophobicContact CG2-CG 4.47Å; I291-F360 PolarHBondContact N-O 3.35Å; I291-F360 PolarHBondContact O-N 3.13Å; I291-L362 HydrophobicContact CB-CD1 4.06Å; I291-L362 HydrophobicContact CB-CG 4.33Å; I291-L362 HydrophobicContact CG2-CD1 4.38Å; I291-L362 HydrophobicContact CG2-CD2 4.16Å; I291-L362 HydrophobicContact CG2-CG 4.15Å
292	E	95.3	Very high	93.4	Very high	13 Å²	13	57.3 Å²	57.3	6%	0.061	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.8	178.4	-60.4	-167	-170.7	0	0	110.3	E284 R290 R357 A358 H359	E284-E292 HydrophobicContact CB-CB 4.37Å; E284-E292 PolarHBondContact N-O 3.37Å; E284-E292 PolarHBondContact O-N 3.21Å; R290-E292 IonicContact CZ-OE1 2.83Å; R290-E292 VanDerWaalsContact CZ-OE1 3.22Å; R290-E292 IonicContact NE-OE1 3.68Å; R290-E292 IonicContact NH1-OE1 2.71Å; R290-E292 PolarHBondContact NH1-OE1 3.03Å; R290-E292 IonicContact NH2-OE1 3.78Å; E292-R357 IonicContact OE1-NH2 3.28Å; E292-R357 IonicContact OE2-CZ 3.63Å; E292-R357 IonicContact OE2-NE 2.73Å; E292-R357 PolarHBondContact OE2-NE 2.86Å; E292-R357 IonicContact OE2-NH2 3.41Å; E292-R357 PolarHBondContact OE2-NH2 3.19Å; E292-A358 CarbonylContact C-O 3.59Å; E292-A358 WeakPolarHBondContact CA-O 3.14Å; E292-H359 HydrophobicContact CG-CB 4.47Å; E292-H359 IonicContact OE1-CD2 3.41Å; E292-H359 PolarHBondContact OE1-CD2 2.91Å
293	Y	95.6	Very high	93.5	Very high	9 Å²	9	63.6 Å²	63.6	4%	0.035	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.7	175.1	-65.5	-98.7	0	0	0	108.8	I283 I291 I295 I314 P315 V316 P317 R357 A358 F360	I283-Y293 HydrophobicContact CD1-CD1 4.23Å; I283-Y293 HydrophobicContact CD1-CE1 3.79Å; I283-Y293 HydrophobicContact CG1-CD1 3.81Å; I283-Y293 HydrophobicContact CG1-CE1 3.83Å; I283-Y293 HydrophobicContact CG2-CD1 4.42Å; I283-Y293 HydrophobicContact CG2-CE1 4.07Å; I291-Y293 HydrophobicContact CB-CE2 4.44Å; I291-Y293 HydrophobicContact CD1-CE2 3.87Å; I291-Y293 WeakPolarHBondContact CD1-OH 3.29Å; I291-Y293 HydrophobicContact CG1-CD2 4.37Å; I291-Y293 HydrophobicContact CG1-CE2 3.72Å; I291-Y293 HydrophobicContact CG2-CE2 3.98Å; Y293-I295 HydrophobicContact CD1-CD1 4.49Å; Y293-I314 HydrophobicContact CD1-CG2 4.09Å; Y293-I314 HydrophobicContact CE1-CG2 4.14Å; Y293-P315 PolarHBondContact OH-O 3.46Å; Y293-V316 HydrophobicContact CE2-CG1 3.97Å; Y293-P317 WeakPolarHBondContact OH-CD 3.37Å; Y293-R357 CarbonylContact O-C 3.59Å; Y293-R357 VanDerWaalsContact O-CA 3.24Å; Y293-R357 WeakPolarHBondContact O-CA 3.47Å; Y293-A358 HydrophobicContact CD2-CB 4.41Å; Y293-A358 PolarHBondContact N-O 2.75Å; Y293-A358 PolarHBondContact O-N 2.92Å; Y293-F360 HydrophobicContact CD2-CD2 4.32Å; Y293-F360 HydrophobicContact CE2-CD2 4.28Å
294	M	95.7	Very high	93.6	Very high	89 Å²	89	70.5 Å²	70.5	44%	0.438	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	109.8	168	-169.9	176.6	-57.4	0	0	108.8	V282	V282-M294 HydrophobicContact CB-CB 4.48Å; V282-M294 PolarHBondContact N-O 3.18Å; V282-M294 PolarHBondContact O-N 3.4Å
295	I	96.1	Very high	93.7	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.7	-171.2	-50.5	-169.5	0	0	0	109.6	I279 E280 Y293 I314 W343 L355 M356	I279-I295 HydrophobicContact CG2-CG2 3.64Å; E280-I295 CarbonylContact O-C 3.58Å; E280-I295 WeakPolarHBondContact O-CA 3.43Å; Y293-I295 HydrophobicContact CD1-CD1 4.49Å; I295-I314 HydrophobicContact CD1-CB 4.11Å; I295-I314 HydrophobicContact CD1-CD1 3.38Å; I295-I314 HydrophobicContact CD1-CG1 3.49Å; I295-I314 VanDerWaalsContact CD1-CG1 3.49Å; I295-I314 HydrophobicContact CD1-CG2 3.72Å; I295-W343 HydrophobicContact CG2-CZ3 4.43Å; I295-L355 CarbonylContact O-C 3.6Å; I295-L355 WeakPolarHBondContact O-CA 3.4Å; I295-M356 HydrophobicContact CB-CE 4.06Å; I295-M356 HydrophobicContact CD1-CE 3.51Å; I295-M356 HydrophobicContact CG1-CE 3.93Å; I295-M356 PolarHBondContact N-O 3.27Å; I295-M356 PolarHBondContact O-N 2.81Å
296	K	96.6	Very high	94.1	Very high	53 Å²	53	62.3 Å²	62.3	23%	0.23	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.2	-178.3	172.4	164.3	145.9	151.1	0	109	E280 K298 E353 Y354 L355	E280-K296 HydrophobicContact CB-CB 4.3Å; E280-K296 PolarHBondContact N-O 2.64Å; E280-K296 PolarHBondContact O-N 2.88Å; E280-K296 WeakPolarHBondContact OE2-CE 3.37Å; K296-K298 VanDerWaalsContact CE-NZ 3.25Å; K296-K298 HydrophobicContact CG-CG 4.44Å; K296-E353 HydrophobicContact CD-CG 4.18Å; K296-E353 VanDerWaalsContact CD-OE1 3.24Å; K296-E353 WeakPolarHBondContact CD-OE1 3.36Å; K296-E353 WeakPolarHBondContact CE-OE1 3.49Å; K296-E353 WeakPolarHBondContact CE-OE2 3.12Å; K296-E353 HydrophobicContact CG-CG 3.86Å; K296-E353 IonicContact NZ-OE1 3.22Å; K296-E353 PolarHBondContact NZ-OE1 3.23Å; K296-E353 IonicContact NZ-OE2 3.51Å; K296-E353 PolarHBondContact NZ-OE2 2.92Å; K296-Y354 WeakPolarHBondContact CA-O 3.32Å; K296-L355 HydrophobicContact CB-CG 4.4Å; K296-L355 HydrophobicContact CD-CD2 4.39Å; K296-L355 HydrophobicContact CD-CG 4.45Å; K296-L355 HydrophobicContact CG-CG 4.4Å
297	A	97.3	Very high	94.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.8	178.1	0	0	0	0	0	109.6	W278 I279 I312 W343 F348 E353 Y354	W278-A297 WeakPolarHBondContact O-CA 3.33Å; I279-A297 HydrophobicContact CD1-CB 3.57Å; A297-I312 HydrophobicContact CB-CD1 3.79Å; A297-W343 HydrophobicContact CB-CH2 3.88Å; A297-W343 HydrophobicContact CB-CZ3 3.6Å; A297-F348 HydrophobicContact CB-CE1 3.89Å; A297-F348 HydrophobicContact CB-CZ 4.1Å; A297-E353 VanDerWaalsContact O-CA 3.32Å; A297-E353 WeakPolarHBondContact O-CA 3.48Å; A297-Y354 PolarHBondContact N-O 2.66Å; A297-Y354 PolarHBondContact O-N 3.22Å
298	K	96.8	Very high	94.9	Very high	47 Å²	47	57.4 Å²	57.4	20%	0.204	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.9	-179.1	-74.5	160.5	153.4	154.9	0	109.7	I277 W278 E280 K296 E353	I277-K298 WeakPolarHBondContact CA-O 3.48Å; W278-K298 HydrophobicContact CB-CB 4.24Å; W278-K298 PolarHBondContact N-O 2.89Å; W278-K298 PolarHBondContact O-N 3.11Å; E280-K298 IonicContact OE1-NZ 3.03Å; E280-K298 PolarHBondContact OE1-NZ 3.37Å; E280-K298 IonicContact OE2-NZ 3.64Å; E280-K298 PolarHBondContact OE2-NZ 2.85Å; K296-K298 VanDerWaalsContact CE-NZ 3.25Å; K296-K298 HydrophobicContact CG-CG 4.44Å; K298-E353 WeakPolarHBondContact CE-OE2 3.08Å; K298-E353 HydrophobicContact CG-CB 4.23Å; K298-E353 HydrophobicContact CG-CG 3.76Å
299	S	96.7	Very high	95.4	Very high	4 Å²	4	57.9 Å²	57.9	3%	0.028	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.1	173.3	58.2	0	0	0	0	110.8	L276 F348 P349 G350 G351 K352	L276-S299 CarbonylContact O-C 3.6Å; S299-F348 WeakPolarHBondContact OG-CE2 3.3Å; S299-P349 PolarHBondContact OG-O 2.99Å; S299-G350 WeakPolarHBondContact OG-CA 3.24Å; S299-G351 VanDerWaalsContact O-CA 3.23Å; S299-G351 WeakPolarHBondContact O-CA 3.21Å; S299-G351 PolarHBondContact O-N 3.19Å; S299-G351 PolarHBondContact OG-N 2.99Å; S299-G351 VanDerWaalsContact OG-N 3.09Å; S299-K352 PolarHBondContact N-O 3.28Å; S299-K352 PolarHBondContact OG-N 3.4Å; S299-K352 PolarHBondContact OG-O 3.18Å; S299-K352 VanDerWaalsContact OG-O 3.14Å
300	Q	94.8	Very high	95.7	Very high	79 Å²	79	54.6 Å²	54.6	37%	0.369	24%	0.241	S	C	.	.			trans	-105.7	30	-174.6	-52.9	-173.5	-18.4	0	0	113.4	K274 P275 L276 W278	K274-Q300 VanDerWaalsContact CB-OE1 3.31Å; P275-Q300 WeakPolarHBondContact O-CB 2.97Å; P275-Q300 PolarHBondContact O-OE1 3.2Å; L276-Q300 PolarHBondContact O-N 2.84Å; W278-Q300 HydrophobicContact CB-CG 4.34Å
301	F	94.3	Very high	96	Very high	16 Å²	16	52.9 Å²	52.9	7%	0.07	24%	0.237	C	C	.	.	S	Bend	trans	-111.4	177.6	172.6	52.6	-93.4	0	0	0	112	L276 I277 R303 S305 A307 F348 G350 I382 F385	L276-F301 HydrophobicContact CB-CD1 4.08Å; L276-F301 HydrophobicContact CD2-CB 4.04Å; L276-F301 VanDerWaalsContact O-CD1 3.24Å; L276-F301 WeakPolarHBondContact O-CD1 3.45Å; I277-F301 HydrophobicContact CG1-CE1 4.05Å; F301-R303 PolarHBondContact O-N 2.87Å; F301-S305 WeakPolarHBondContact CE2-O 3.38Å; F301-A307 HydrophobicContact CE1-CB 4.24Å; F301-A307 HydrophobicContact CZ-CB 3.74Å; F301-F348 WeakPolarHBondContact CZ-O 3.28Å; F301-G350 VanDerWaalsContact CE2-N 3.31Å; F301-I382 HydrophobicContact CD1-CD1 3.79Å; F301-I382 HydrophobicContact CD2-CD1 4.3Å; F301-I382 HydrophobicContact CE1-CD1 3.78Å; F301-I382 HydrophobicContact CE2-CD1 4.27Å; F301-I382 HydrophobicContact CG-CD1 4.06Å; F301-I382 HydrophobicContact CZ-CD1 4.04Å; F301-F385 HydrophobicContact CB-CE2 4.49Å; F301-F385 HydrophobicContact CB-CZ 4.14Å
302	K	93.8	Very high	96.2	Very high	113 Å²	113	52.7 Å²	52.7	49%	0.491	24%	0.235	S	C	.	.			trans	-58.6	134.6	-174.9	-64.4	-178.7	178.9	174.8	0	111.1	R304 S305 F385	K302-R304 HydrophobicContact CB-CG 4.15Å; K302-R304 PolarHBondContact O-N 3.4Å; K302-S305 WeakPolarHBondContact O-CB 3.47Å; K302-S305 PolarHBondContact O-N 2.93Å; K302-F385 HydrophobicContact CD-CE2 4.48Å; K302-F385 HydrophobicContact CG-CE2 4.47Å
303	R	94	Very high	96.3	Very high	214 Å²	214	52.8 Å²	52.8	81%	0.808	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-25	-179.7	-62.2	-174.6	176.6	-178.9	-0.7	115.3	F301 S305 G350	F301-R303 PolarHBondContact O-N 2.87Å; R303-S305 VanDerWaalsContact C-N 3.29Å; R303-G350 WeakPolarHBondContact CA-O 3.37Å; R303-G350 WeakPolarHBondContact CG-O 3.35Å
304	R	94.6	Very high	96.3	Very high	202 Å²	202	52.4 Å²	52.4	76%	0.762	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.9	176.9	70.4	-174.8	-176.8	-168	6.5	113.8	K302	K302-R304 HydrophobicContact CB-CG 4.15Å; K302-R304 PolarHBondContact O-N 3.4Å
305	S	96.2	Very high	96.3	Very high	14 Å²	14	49.3 Å²	49.3	10%	0.098	22%	0.221	C	C	.	.			trans	-99.9	152.6	177.5	-62.2	0	0	0	0	108.7	F301 K302 R303 G350 F385	F301-S305 WeakPolarHBondContact CE2-O 3.38Å; K302-S305 WeakPolarHBondContact O-CB 3.47Å; K302-S305 PolarHBondContact O-N 2.93Å; R303-S305 VanDerWaalsContact C-N 3.29Å; S305-G350 PolarHBondContact O-N 2.9Å; S305-F385 WeakPolarHBondContact OG-CD2 3.18Å
306	T	97.3	Very high	96.2	Very high	41 Å²	41	49.7 Å²	49.7	25%	0.252	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	130.1	-177.4	-60.2	0	0	0	0	108.1	S347	T306-S347 VanDerWaalsContact CG2-OG 3.24Å; T306-S347 WeakPolarHBondContact CG2-OG 3.43Å
307	A	97.5	Very high	95.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	128	167.8	0	0	0	0	0	109	I277 F301 V310 F348 F380 E381 I382	I277-A307 HydrophobicContact CD1-CB 4.17Å; F301-A307 HydrophobicContact CE1-CB 4.24Å; F301-A307 HydrophobicContact CZ-CB 3.74Å; A307-V310 HydrophobicContact CB-CG2 3.57Å; A307-F348 HydrophobicContact CB-CB 4.3Å; A307-F348 PolarHBondContact N-O 2.77Å; A307-F348 PolarHBondContact O-N 3.46Å; A307-F380 HydrophobicContact CB-CB 4.48Å; A307-E381 CarbonylContact C-O 3.58Å; A307-E381 WeakPolarHBondContact CA-O 3.42Å; A307-I382 HydrophobicContact CB-CD1 4.32Å; A307-I382 HydrophobicContact CB-CG1 3.81Å
308	N	97.2	Very high	95.6	Very high	52 Å²	52	52.2 Å²	52.2	28%	0.278	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	148.6	179.4	-63.2	-28.1	0	0	0	109.7	V310 K346 E381	N308-V310 PolarHBondContact O-N 2.67Å; N308-V310 VanDerWaalsContact O-N 3.16Å; N308-K346 WeakPolarHBondContact CA-O 3.37Å; N308-E381 PolarHBondContact N-O 2.56Å; N308-E381 PolarHBondContact O-N 3.31Å
309	N	96.2	Very high	95.2	Very high	105 Å²	105	52.5 Å²	52.5	56%	0.561	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	46.9	48.2	171.7	-55.8	-29.4	0	0	0	112.6	E311 K346	N309-E311 PolarHBondContact O-N 2.46Å; N309-K346 PolarHBondContact N-O 2.97Å
310	V	97.8	Very high	95	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.8	179.9	-177.9	0	0	0	0	108.7	I277 A307 N308 I312 S344 I345 F348 V378 K379 F380	I277-V310 HydrophobicContact CD1-CG1 3.92Å; I277-V310 HydrophobicContact CD1-CG2 4.01Å; A307-V310 HydrophobicContact CB-CG2 3.57Å; N308-V310 PolarHBondContact O-N 2.67Å; N308-V310 VanDerWaalsContact O-N 3.16Å; V310-I312 HydrophobicContact CG1-CG1 4.18Å; V310-S344 CarbonylContact O-C 3.49Å; V310-S344 WeakPolarHBondContact O-CA 3.4Å; V310-I345 HydrophobicContact CB-CB 4.32Å; V310-I345 PolarHBondContact N-O 3.21Å; V310-I345 PolarHBondContact O-N 2.88Å; V310-F348 HydrophobicContact CG1-CD1 4.44Å; V310-F348 HydrophobicContact CG2-CB 3.97Å; V310-F348 HydrophobicContact CG2-CD1 4.27Å; V310-V378 HydrophobicContact CG1-CG1 3.93Å; V310-K379 CarbonylContact C-O 3.59Å; V310-K379 VanDerWaalsContact CA-O 3.22Å; V310-K379 WeakPolarHBondContact CA-O 3.49Å; V310-F380 HydrophobicContact CG1-CB 4.37Å; V310-F380 HydrophobicContact CG2-CB 3.91Å
311	E	97.9	Very high	94.9	Very high	55 Å²	55	52.3 Å²	52.3	26%	0.257	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119.2	174	-57.6	-169.9	140.4	0	0	108.9	N309 H313 K333 V342 V378 K379	N309-E311 PolarHBondContact O-N 2.46Å; E311-H313 IonicContact OE2-NE2 3.69Å; E311-K333 IonicContact OE1-NZ 3.44Å; E311-V342 HydrophobicContact CB-CG1 3.9Å; E311-V342 HydrophobicContact CG-CG1 4.39Å; E311-V378 CarbonylContact O-C 3.6Å; E311-V378 WeakPolarHBondContact O-CA 3.47Å; E311-K379 HydrophobicContact CB-CB 4.22Å; E311-K379 PolarHBondContact N-O 2.85Å; E311-K379 PolarHBondContact O-N 3.03Å
312	I	97.9	Very high	94.8	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	110.5	176.9	-58.1	159.9	0	0	0	107	I279 A297 V310 I314 V342 W343 I345 I376 V378	I279-I312 HydrophobicContact CD1-CD1 3.73Å; I279-I312 HydrophobicContact CD1-CG1 4.11Å; I279-I312 HydrophobicContact CD1-CG2 4.3Å; I279-I312 HydrophobicContact CG1-CG2 4.49Å; A297-I312 HydrophobicContact CB-CD1 3.79Å; V310-I312 HydrophobicContact CG1-CG1 4.18Å; I312-I314 HydrophobicContact CB-CD1 4.44Å; I312-I314 HydrophobicContact CG2-CD1 3.74Å; I312-I314 HydrophobicContact CG2-CG1 3.91Å; I312-V342 WeakPolarHBondContact O-CA 3.38Å; I312-W343 HydrophobicContact CB-CB 4.32Å; I312-W343 HydrophobicContact CD1-CD2 4.11Å; I312-W343 HydrophobicContact CD1-CE3 3.41Å; I312-W343 VanDerWaalsContact CD1-CE3 3.41Å; I312-W343 HydrophobicContact CD1-CZ3 3.74Å; I312-W343 PolarHBondContact N-O 2.73Å; I312-W343 PolarHBondContact O-N 2.92Å; I312-I345 HydrophobicContact CD1-CD1 4.26Å; I312-I376 HydrophobicContact CG2-CG2 3.97Å; I312-V378 HydrophobicContact CG1-CG1 3.98Å; I312-V378 HydrophobicContact CG1-CG2 4.3Å; I312-V378 HydrophobicContact CG2-CG2 4.33Å
313	H	97.5	Very high	94.9	Very high	15 Å²	15	51.9 Å²	51.9	7%	0.069	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.4	179.7	-68.7	-98.1	0	0	0	109.1	E311 E340 I376 S377 K379	E311-H313 IonicContact OE2-NE2 3.69Å; H313-E340 WeakPolarHBondContact CB-OE2 3.08Å; H313-E340 IonicContact CE1-OE1 2.75Å; H313-E340 IonicContact CG-OE1 3.46Å; H313-E340 IonicContact CG-OE2 2.86Å; H313-E340 IonicContact ND1-OE1 3.65Å; H313-E340 PolarHBondContact ND1-OE1 3.36Å; H313-E340 IonicContact ND1-OE2 3.29Å; H313-E340 PolarHBondContact ND1-OE2 2.82Å; H313-I376 VanDerWaalsContact O-CA 3.32Å; H313-I376 WeakPolarHBondContact O-CA 3.3Å; H313-I376 WeakPolarHBondContact O-CG2 3.31Å; H313-S377 WeakPolarHBondContact CB-OG 3.27Å; H313-S377 PolarHBondContact N-O 2.68Å; H313-S377 PolarHBondContact O-N 3.18Å; H313-K379 WeakPolarHBondContact NE2-CE 3.48Å
314	I	96.3	Very high	95	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116.7	-177.9	-57.1	123.1	0	0	0	108.7	Y293 I295 I312 E340 I341 M356 I376	Y293-I314 HydrophobicContact CD1-CG2 4.09Å; Y293-I314 HydrophobicContact CE1-CG2 4.14Å; I295-I314 HydrophobicContact CD1-CB 4.11Å; I295-I314 HydrophobicContact CD1-CD1 3.38Å; I295-I314 HydrophobicContact CD1-CG1 3.49Å; I295-I314 VanDerWaalsContact CD1-CG1 3.49Å; I295-I314 HydrophobicContact CD1-CG2 3.72Å; I312-I314 HydrophobicContact CB-CD1 4.44Å; I312-I314 HydrophobicContact CG2-CD1 3.74Å; I312-I314 HydrophobicContact CG2-CG1 3.91Å; I314-E340 CarbonylContact O-C 3.6Å; I314-E340 VanDerWaalsContact O-CA 3.31Å; I314-E340 WeakPolarHBondContact O-CA 2.85Å; I314-E340 WeakPolarHBondContact O-CB 3.37Å; I314-I341 HydrophobicContact CB-CD1 4.29Å; I314-I341 HydrophobicContact CB-CG1 3.74Å; I314-I341 HydrophobicContact CD1-CD1 4.19Å; I314-I341 HydrophobicContact CD1-CG1 4.01Å; I314-I341 HydrophobicContact CG2-CG1 4.39Å; I314-I341 PolarHBondContact N-O 2.88Å; I314-I341 PolarHBondContact O-N 3.16Å; I314-M356 HydrophobicContact CD1-CE 3.75Å; I314-I376 HydrophobicContact CB-CG1 4.36Å; I314-I376 HydrophobicContact CG1-CD1 4.32Å; I314-I376 HydrophobicContact CG1-CG1 4.09Å; I314-I376 HydrophobicContact CG1-CG2 4.27Å; I314-I376 HydrophobicContact CG2-CD1 4.37Å; I314-I376 HydrophobicContact CG2-CG1 4.15Å
315	P	95.3	Very high	95.1	Very high	25 Å²	25	42.1 Å²	42.1	16%	0.162	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	136.8	175.6	-25.1	36.4	0	0	0	111.9	Y293 P374	Y293-P315 PolarHBondContact OH-O 3.46Å; P315-P374 HydrophobicContact CB-CB 4.25Å; P315-P374 HydrophobicContact CB-CG 4.13Å; P315-P374 HydrophobicContact CG-CB 3.7Å; P315-P374 HydrophobicContact CG-CG 4.13Å; P315-P374 WeakPolarHBondContact CG-O 3.28Å
316	V	93.6	Very high	95.1	Very high	8 Å²	8	49.3 Å²	49.3	5%	0.048	26%	0.26	C	S	.	.			trans	-124.9	156.3	173.6	-60.2	0	0	0	0	109.4	Y293 S339 I341 F360	Y293-V316 HydrophobicContact CE2-CG1 3.97Å; V316-S339 PolarHBondContact N-O 3.16Å; V316-I341 HydrophobicContact CG1-CD1 4.4Å; V316-I341 HydrophobicContact CG1-CG1 4.16Å; V316-I341 HydrophobicContact CG1-CG2 3.96Å; V316-F360 HydrophobicContact CG1-CE2 3.94Å; V316-F360 HydrophobicContact CG1-CZ 4.17Å
317	P	91.4	Very high	95.1	Very high	15 Å²	15	49.7 Å²	49.7	10%	0.097	26%	0.262	C	S	.	.			trans	-56.3	144.1	176.9	-26.1	36.1	0	0	0	111.8	I291 Y293 D319 A320 L362 E371	I291-P317 HydrophobicContact CD1-CG 4.05Å; Y293-P317 WeakPolarHBondContact OH-CD 3.37Å; P317-D319 WeakPolarHBondContact CB-OD1 3.32Å; P317-D319 PolarHBondContact O-N 2.89Å; P317-A320 HydrophobicContact CB-CB 4.21Å; P317-A320 WeakPolarHBondContact O-CB 3.37Å; P317-A320 PolarHBondContact O-N 2.88Å; P317-L362 HydrophobicContact CB-CD2 4.12Å; P317-L362 HydrophobicContact CG-CD2 4.11Å; P317-E371 WeakPolarHBondContact CA-OE2 3.46Å
318	T	89.7	Confident	95	Very high	90 Å²	90	53.8 Å²	53.8	55%	0.552	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-27.3	-179.1	68.8	0	0	0	0	112	A320 S339 E371	T318-A320 VanDerWaalsContact C-N 3.34Å; T318-S339 WeakPolarHBondContact CG2-OG 3.39Å; T318-E371 WeakPolarHBondContact CB-OE1 3.42Å; T318-E371 HydrophobicContact CG2-CG 4.44Å; T318-E371 WeakPolarHBondContact CG2-OE1 3.37Å; T318-E371 PolarHBondContact N-OE1 2.84Å; T318-E371 VanDerWaalsContact N-OE1 3.11Å; T318-E371 PolarHBondContact N-OE2 2.81Å; T318-E371 PolarHBondContact OG1-OE1 3.32Å
319	D	89.6	Confident	94.9	Very high	54 Å²	54	53.9 Å²	53.9	29%	0.289	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	1.8	-179.5	70.4	-17.2	0	0	0	113.4	P317 P363	P317-D319 WeakPolarHBondContact CB-OD1 3.32Å; P317-D319 PolarHBondContact O-N 2.89Å; D319-P363 HydrophobicContact CB-CG 3.82Å; D319-P363 WeakPolarHBondContact O-CD 3.38Å; D319-P363 WeakPolarHBondContact O-CG 3.3Å; D319-P363 WeakPolarHBondContact OD2-CD 3Å
320	A	91.4	Very high	94.9	Very high	5 Å²	5	50.5 Å²	50.5	4%	0.041	28%	0.28	C	S	.	.			trans	-66.4	139.2	179.7	0	0	0	0	0	111.8	P317 T318 W334 F360 G361	P317-A320 HydrophobicContact CB-CB 4.21Å; P317-A320 WeakPolarHBondContact O-CB 3.37Å; P317-A320 PolarHBondContact O-N 2.88Å; T318-A320 VanDerWaalsContact C-N 3.34Å; A320-W334 VanDerWaalsContact O-CZ2 3.27Å; A320-W334 WeakPolarHBondContact O-CZ2 3.32Å; A320-F360 HydrophobicContact CB-CB 4.07Å; A320-F360 HydrophobicContact CB-CD1 3.79Å; A320-F360 HydrophobicContact CB-CG 4.12Å; A320-G361 WeakPolarHBondContact CA-O 3.28Å
321	D	92.6	Very high	94.9	Very high	73 Å²	73	54.3 Å²	54.3	39%	0.39	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	179.7	179	80.9	16.2	0	0	0	113	F360 G361	D321-F360 CarbonylContact O-C 3.59Å; D321-F360 WeakPolarHBondContact O-CA 3.4Å; D321-F360 WeakPolarHBondContact O-CD1 3.32Å; D321-G361 PolarHBondContact N-O 2.93Å; D321-G361 PolarHBondContact O-N 3.1Å; D321-G361 VanDerWaalsContact OD1-CA 3.25Å; D321-G361 WeakPolarHBondContact OD1-CA 3.45Å
322	S	94	Very high	94.9	Very high	73 Å²	73	53 Å²	53	51%	0.51	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.9	53.2	168	-51.8	0	0	0	0	114.7	K324	S322-K324 PolarHBondContact O-N 3.01Å
323	P	95.7	Very high	94.8	Very high	48 Å²	48	57.7 Å²	57.7	31%	0.312	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	132.9	-174.8	25.1	-35.1	0	0	0	112.3	F325 W334 H359 F360	P323-F325 HydrophobicContact CB-CE1 4.32Å; P323-F325 HydrophobicContact CB-CE2 3.7Å; P323-F325 HydrophobicContact CB-CZ 3.51Å; P323-W334 HydrophobicContact CG-CD2 4.18Å; P323-W334 HydrophobicContact CG-CE3 3.7Å; P323-W334 HydrophobicContact CG-CZ3 4.22Å; P323-H359 CarbonylContact C-O 3.59Å; P323-F360 HydrophobicContact CB-CD1 4.08Å; P323-F360 HydrophobicContact CB-CE1 3.56Å; P323-F360 HydrophobicContact CB-CZ 3.99Å; P323-F360 HydrophobicContact CG-CE1 4.48Å
324	K	95.9	Very high	94.8	Very high	141 Å²	141	61.3 Å²	61.3	61%	0.613	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.4	170.4	-65.3	176.4	-174.1	171.7	0	109.7	S322 A358 H359	S322-K324 PolarHBondContact O-N 3.01Å; K324-A358 CarbonylContact O-C 3.59Å; K324-A358 WeakPolarHBondContact O-CA 3.27Å; K324-H359 HydrophobicContact CB-CB 4.29Å; K324-H359 PolarHBondContact N-O 3.19Å; K324-H359 PolarHBondContact O-N 3.27Å
325	F	96.8	Very high	94.7	Very high	69 Å²	69	62.5 Å²	62.5	30%	0.303	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.7	-176.7	-53.4	-60.8	0	0	0	111.8	P323 V332 W334 I341 R357 A358 F360	P323-F325 HydrophobicContact CB-CE1 4.32Å; P323-F325 HydrophobicContact CB-CE2 3.7Å; P323-F325 HydrophobicContact CB-CZ 3.51Å; F325-V332 HydrophobicContact CB-CB 4.1Å; F325-V332 HydrophobicContact CB-CG2 4.43Å; F325-V332 HydrophobicContact CD1-CB 4.07Å; F325-V332 HydrophobicContact CD1-CG1 3.58Å; F325-V332 HydrophobicContact CD2-CB 3.99Å; F325-V332 HydrophobicContact CD2-CG1 3.91Å; F325-V332 HydrophobicContact CE1-CG1 3.61Å; F325-V332 HydrophobicContact CE2-CB 4.45Å; F325-V332 HydrophobicContact CE2-CG1 3.93Å; F325-V332 HydrophobicContact CG-CB 3.77Å; F325-V332 HydrophobicContact CG-CG1 3.74Å; F325-V332 HydrophobicContact CG-CG2 4.45Å; F325-V332 HydrophobicContact CZ-CG1 3.79Å; F325-W334 HydrophobicContact CE2-CB 4.31Å; F325-W334 HydrophobicContact CZ-CB 4.07Å; F325-I341 HydrophobicContact CE1-CD1 4.3Å; F325-I341 HydrophobicContact CE1-CG2 3.86Å; F325-I341 HydrophobicContact CZ-CG2 3.83Å; F325-R357 CarbonylContact C-O 3.57Å; F325-R357 WeakPolarHBondContact CA-O 3.12Å; F325-A358 HydrophobicContact CD1-CB 3.59Å; F325-A358 HydrophobicContact CE1-CB 3.71Å; F325-F360 AromaticContact CE1-CE2 3.87Å; F325-F360 HydrophobicContact CE1-CE2 3.87Å; F325-F360 AromaticContact CE1-CZ 3.75Å; F325-F360 HydrophobicContact CE1-CZ 3.75Å; F325-F360 HydrophobicContact CZ-CE2 4.36Å; F325-F360 AromaticContact CZ-CZ 3.76Å; F325-F360 HydrophobicContact CZ-CZ 3.76Å
326	K	96.6	Very high	94.6	Very high	165 Å²	165	64.1 Å²	64.1	72%	0.717	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	113.2	169.8	-174.2	176.4	-177.7	176.8	0	109	M356 R357	K326-M356 CarbonylContact O-C 3.58Å; K326-M356 WeakPolarHBondContact O-CA 3.03Å; K326-R357 HydrophobicContact CB-CB 4.5Å; K326-R357 PolarHBondContact N-O 2.95Å; K326-R357 PolarHBondContact O-N 3.04Å
327	T	96.3	Very high	94.5	Very high	49 Å²	49	71.2 Å²	71.2	30%	0.301	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	150.1	-179.8	55.1	0	0	0	0	110.6	G330 V332 M356	T327-G330 PolarHBondContact OG1-O 2.9Å; T327-V332 HydrophobicContact CG2-CG2 3.52Å; T327-M356 HydrophobicContact CG2-CB 4.1Å; T327-M356 HydrophobicContact CG2-CG 3.55Å
328	T	95.5	Very high	94.6	Very high	86 Å²	86	75.7 Å²	75.7	53%	0.528	41%	0.409	S	S	.	.	S	Bend	trans	-78.4	-39.3	166.5	56.6	0	0	0	0	111.4	L355	T328-L355 HydrophobicContact CG2-CB 4.05Å; T328-L355 HydrophobicContact CG2-CD1 4.49Å; T328-L355 PolarHBondContact N-O 3.5Å; T328-L355 PolarHBondContact OG1-N 3.49Å; T328-L355 PolarHBondContact OG1-O 2.82Å
329	V	95.9	Very high	94.7	Very high	54 Å²	54	72.8 Å²	72.8	33%	0.327	39%	0.393	S	S	.	.	S	Bend	trans	-147	145.7	-178.8	178.9	0	0	0	0	108.8	W343 I345 Y354	V329-W343 PolarHBondContact O-NE1 2.98Å; V329-I345 HydrophobicContact CG1-CG2 4.31Å; V329-Y354 HydrophobicContact CB-CD1 4Å; V329-Y354 HydrophobicContact CB-CD2 4.13Å; V329-Y354 HydrophobicContact CB-CE1 4.14Å; V329-Y354 HydrophobicContact CB-CE2 4.2Å; V329-Y354 HydrophobicContact CB-CG 4.01Å; V329-Y354 HydrophobicContact CG1-CD2 4.4Å; V329-Y354 HydrophobicContact CG1-CE2 4.07Å; V329-Y354 HydrophobicContact CG2-CD1 3.63Å; V329-Y354 HydrophobicContact CG2-CE1 3.54Å; V329-Y354 HydrophobicContact CG2-CE2 4.43Å; V329-Y354 HydrophobicContact CG2-CG 4.18Å
330	G	95.4	Very high	95	Very high	35 Å²	35	71.6 Å²	71.6	36%	0.361	39%	0.386	S	S	.	.	S	Bend	trans	82.6	176.7	179.9	0	0	0	0	0	113.1	T327 S344	T327-G330 PolarHBondContact OG1-O 2.9Å; G330-S344 WeakPolarHBondContact CA-O 3.5Å
331	S	96.9	Very high	95.3	Very high	80 Å²	80	71.4 Å²	71.4	56%	0.559	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	151.6	-178.9	52.8	0	0	0	0	110.4	S344	S331-S344 PolarHBondContact N-O 3.16Å; S331-S344 PolarHBondContact O-N 3.3Å
332	V	97.9	Very high	95.5	Very high	26 Å²	26	68 Å²	68	16%	0.158	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.7	174.8	179.4	0	0	0	0	108.2	F325 T327 I341 V342 W343 M356	F325-V332 HydrophobicContact CB-CB 4.1Å; F325-V332 HydrophobicContact CB-CG2 4.43Å; F325-V332 HydrophobicContact CD1-CB 4.07Å; F325-V332 HydrophobicContact CD1-CG1 3.58Å; F325-V332 HydrophobicContact CD2-CB 3.99Å; F325-V332 HydrophobicContact CD2-CG1 3.91Å; F325-V332 HydrophobicContact CE1-CG1 3.61Å; F325-V332 HydrophobicContact CE2-CB 4.45Å; F325-V332 HydrophobicContact CE2-CG1 3.93Å; F325-V332 HydrophobicContact CG-CB 3.77Å; F325-V332 HydrophobicContact CG-CG1 3.74Å; F325-V332 HydrophobicContact CG-CG2 4.45Å; F325-V332 HydrophobicContact CZ-CG1 3.79Å; T327-V332 HydrophobicContact CG2-CG2 3.52Å; V332-I341 HydrophobicContact CG1-CB 4Å; V332-I341 HydrophobicContact CG1-CD1 4.46Å; V332-I341 HydrophobicContact CG1-CG2 4.47Å; V332-V342 WeakPolarHBondContact CA-O 3.16Å; V332-W343 HydrophobicContact CG2-CB 3.98Å; V332-W343 HydrophobicContact CG2-CG 4Å; V332-M356 HydrophobicContact CG2-CG 3.68Å; V332-M356 HydrophobicContact CG2-SD 4.32Å
333	K	96.6	Very high	95.7	Very high	100 Å²	100	64.5 Å²	64.5	44%	0.435	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.8	168.8	58.9	-177.9	176.6	-175.9	0	108.6	E311 V335 I341 V342	E311-K333 IonicContact OE1-NZ 3.44Å; K333-V335 HydrophobicContact CD-CG2 4.43Å; K333-V335 HydrophobicContact CG-CG2 4.24Å; K333-I341 WeakPolarHBondContact O-CA 3.41Å; K333-V342 HydrophobicContact CD-CB 4.21Å; K333-V342 VanDerWaalsContact CE-CG1 3.49Å; K333-V342 HydrophobicContact CG-CB 3.73Å; K333-V342 HydrophobicContact CG-CG2 4.41Å; K333-V342 PolarHBondContact N-O 3.14Å; K333-V342 PolarHBondContact O-N 2.87Å
334	W	96.8	Very high	95.9	Very high	90 Å²	90	63.5 Å²	63.5	34%	0.341	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.9	168.9	-178.7	38.7	0	0	0	108.5	A320 P323 F325 P336 I341 F360	A320-W334 VanDerWaalsContact O-CZ2 3.27Å; A320-W334 WeakPolarHBondContact O-CZ2 3.32Å; P323-W334 HydrophobicContact CG-CD2 4.18Å; P323-W334 HydrophobicContact CG-CE3 3.7Å; P323-W334 HydrophobicContact CG-CZ3 4.22Å; F325-W334 HydrophobicContact CE2-CB 4.31Å; F325-W334 HydrophobicContact CZ-CB 4.07Å; W334-P336 HydrophobicContact CD2-CG 3.75Å; W334-P336 HydrophobicContact CE3-CG 3.85Å; W334-P336 HydrophobicContact CG-CG 4.4Å; W334-P336 HydrophobicContact CH2-CB 4.46Å; W334-P336 HydrophobicContact CH2-CG 3.91Å; W334-P336 HydrophobicContact CZ2-CB 4.07Å; W334-P336 HydrophobicContact CZ2-CG 3.78Å; W334-P336 HydrophobicContact CZ3-CG 3.94Å; W334-I341 HydrophobicContact CB-CG2 4.36Å; W334-I341 HydrophobicContact CG-CG2 4.45Å; W334-F360 AromaticContact CD1-CE1 3.88Å; W334-F360 HydrophobicContact CD2-CE1 4.26Å; W334-F360 HydrophobicContact CG-CE1 4.15Å; W334-F360 HydrophobicContact CG-CZ 4.43Å; W334-F360 AromaticContact NE1-CE1 3.79Å
335	V	95.9	Very high	96	Very high	27 Å²	27	56.9 Å²	56.9	16%	0.164	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	83.8	-178.7	-173.2	0	0	0	0	107.4	K333 E337 N338 S339 E340 V342	K333-V335 HydrophobicContact CD-CG2 4.43Å; K333-V335 HydrophobicContact CG-CG2 4.24Å; V335-E337 WeakPolarHBondContact CG1-OE2 3.31Å; V335-E337 PolarHBondContact O-N 2.83Å; V335-N338 HydrophobicContact CG1-CB 4.07Å; V335-N338 PolarHBondContact O-N 3.48Å; V335-S339 PolarHBondContact O-N 3.4Å; V335-E340 CarbonylContact C-O 3.54Å; V335-E340 HydrophobicContact CB-CG 4.23Å; V335-E340 PolarHBondContact N-O 3.04Å; V335-E340 PolarHBondContact O-N 3.42Å; V335-E340 VanDerWaalsContact O-N 3.15Å; V335-V342 HydrophobicContact CG2-CG2 3.99Å
336	P	92.1	Very high	95.9	Very high	58 Å²	58	61.7 Å²	61.7	38%	0.377	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-58.8	-32.7	-178.4	-20	29.6	0	0	0	113.1	W334 N338 S339	W334-P336 HydrophobicContact CD2-CG 3.75Å; W334-P336 HydrophobicContact CE3-CG 3.85Å; W334-P336 HydrophobicContact CG-CG 4.4Å; W334-P336 HydrophobicContact CH2-CB 4.46Å; W334-P336 HydrophobicContact CH2-CG 3.91Å; W334-P336 HydrophobicContact CZ2-CB 4.07Å; W334-P336 HydrophobicContact CZ2-CG 3.78Å; W334-P336 HydrophobicContact CZ3-CG 3.94Å; P336-N338 PolarHBondContact O-N 3.39Å; P336-S339 PolarHBondContact O-N 3.03Å
337	E	92.1	Very high	96	Very high	158 Å²	158	56.8 Å²	56.8	74%	0.738	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-61	-31	-177.2	-56.2	78.6	-171.8	0	0	112.3	V335	V335-E337 WeakPolarHBondContact CG1-OE2 3.31Å; V335-E337 PolarHBondContact O-N 2.83Å
338	N	92.3	Very high	96	Very high	108 Å²	108	54.5 Å²	54.5	58%	0.578	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-104.4	1.2	176.5	-68.9	-12.7	0	0	0	112.4	V335 P336 E340	V335-N338 HydrophobicContact CG1-CB 4.07Å; V335-N338 PolarHBondContact O-N 3.48Å; P336-N338 PolarHBondContact O-N 3.39Å; N338-E340 VanDerWaalsContact C-N 3.31Å; N338-E340 HydrophobicContact CB-CG 3.8Å; N338-E340 PolarHBondContact O-N 3.35Å
339	S	93.4	Very high	96.1	Very high	30 Å²	30	52 Å²	52	21%	0.21	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	48.2	-173	-58.1	0	0	0	0	112.6	V316 T318 V335 P336	V316-S339 PolarHBondContact N-O 3.16Å; T318-S339 WeakPolarHBondContact CG2-OG 3.39Å; V335-S339 PolarHBondContact O-N 3.4Å; P336-S339 PolarHBondContact O-N 3.03Å
340	E	95.5	Very high	96.2	Very high	29 Å²	29	49.6 Å²	49.6	14%	0.136	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	163.9	-179.3	70.8	178.8	-171.9	0	0	113	H313 I314 V335 N338 V342	H313-E340 WeakPolarHBondContact CB-OE2 3.08Å; H313-E340 IonicContact CE1-OE1 2.75Å; H313-E340 IonicContact CG-OE1 3.46Å; H313-E340 IonicContact CG-OE2 2.86Å; H313-E340 IonicContact ND1-OE1 3.65Å; H313-E340 PolarHBondContact ND1-OE1 3.36Å; H313-E340 IonicContact ND1-OE2 3.29Å; H313-E340 PolarHBondContact ND1-OE2 2.82Å; I314-E340 CarbonylContact O-C 3.6Å; I314-E340 VanDerWaalsContact O-CA 3.31Å; I314-E340 WeakPolarHBondContact O-CA 2.85Å; I314-E340 WeakPolarHBondContact O-CB 3.37Å; V335-E340 CarbonylContact C-O 3.54Å; V335-E340 HydrophobicContact CB-CG 4.23Å; V335-E340 PolarHBondContact N-O 3.04Å; V335-E340 PolarHBondContact O-N 3.42Å; V335-E340 VanDerWaalsContact O-N 3.15Å; N338-E340 VanDerWaalsContact C-N 3.31Å; N338-E340 HydrophobicContact CB-CG 3.8Å; N338-E340 PolarHBondContact O-N 3.35Å; E340-V342 HydrophobicContact CG-CG2 4.3Å
341	I	96.8	Very high	96.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	144.1	160.8	60	179.8	0	0	0	109.7	I314 V316 F325 V332 K333 W334 M356 A358 F360	I314-I341 HydrophobicContact CB-CD1 4.29Å; I314-I341 HydrophobicContact CB-CG1 3.74Å; I314-I341 HydrophobicContact CD1-CD1 4.19Å; I314-I341 HydrophobicContact CD1-CG1 4.01Å; I314-I341 HydrophobicContact CG2-CG1 4.39Å; I314-I341 PolarHBondContact N-O 2.88Å; I314-I341 PolarHBondContact O-N 3.16Å; V316-I341 HydrophobicContact CG1-CD1 4.4Å; V316-I341 HydrophobicContact CG1-CG1 4.16Å; V316-I341 HydrophobicContact CG1-CG2 3.96Å; F325-I341 HydrophobicContact CE1-CD1 4.3Å; F325-I341 HydrophobicContact CE1-CG2 3.86Å; F325-I341 HydrophobicContact CZ-CG2 3.83Å; V332-I341 HydrophobicContact CG1-CB 4Å; V332-I341 HydrophobicContact CG1-CD1 4.46Å; V332-I341 HydrophobicContact CG1-CG2 4.47Å; K333-I341 WeakPolarHBondContact O-CA 3.41Å; W334-I341 HydrophobicContact CB-CG2 4.36Å; W334-I341 HydrophobicContact CG-CG2 4.45Å; I341-M356 HydrophobicContact CD1-CE 3.62Å; I341-M356 HydrophobicContact CD1-SD 4.47Å; I341-A358 HydrophobicContact CD1-CB 3.94Å; I341-F360 HydrophobicContact CG2-CE2 3.97Å; I341-F360 HydrophobicContact CG2-CZ 3.45Å; I341-F360 VanDerWaalsContact CG2-CZ 3.45Å
342	V	98	Very high	96.2	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	112.5	175.9	-174	0	0	0	0	108.6	E311 I312 V332 K333 V335 E340	E311-V342 HydrophobicContact CB-CG1 3.9Å; E311-V342 HydrophobicContact CG-CG1 4.39Å; I312-V342 WeakPolarHBondContact O-CA 3.38Å; V332-V342 WeakPolarHBondContact CA-O 3.16Å; K333-V342 HydrophobicContact CD-CB 4.21Å; K333-V342 VanDerWaalsContact CE-CG1 3.49Å; K333-V342 HydrophobicContact CG-CB 3.73Å; K333-V342 HydrophobicContact CG-CG2 4.41Å; K333-V342 PolarHBondContact N-O 3.14Å; K333-V342 PolarHBondContact O-N 2.87Å; V335-V342 HydrophobicContact CG2-CG2 3.99Å; E340-V342 HydrophobicContact CG-CG2 4.3Å
343	W	98.3	Very high	96.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	110.4	172.6	179.6	26.3	0	0	0	109.7	I295 A297 I312 V329 V332 I345 M356	I295-W343 HydrophobicContact CG2-CZ3 4.43Å; A297-W343 HydrophobicContact CB-CH2 3.88Å; A297-W343 HydrophobicContact CB-CZ3 3.6Å; I312-W343 HydrophobicContact CB-CB 4.32Å; I312-W343 HydrophobicContact CD1-CD2 4.11Å; I312-W343 HydrophobicContact CD1-CE3 3.41Å; I312-W343 VanDerWaalsContact CD1-CE3 3.41Å; I312-W343 HydrophobicContact CD1-CZ3 3.74Å; I312-W343 PolarHBondContact N-O 2.73Å; I312-W343 PolarHBondContact O-N 2.92Å; V329-W343 PolarHBondContact O-NE1 2.98Å; V332-W343 HydrophobicContact CG2-CB 3.98Å; V332-W343 HydrophobicContact CG2-CG 4Å; W343-I345 HydrophobicContact CD2-CD1 4.11Å; W343-I345 HydrophobicContact CD2-CG1 4.38Å; W343-I345 HydrophobicContact CE3-CD1 4.48Å; W343-I345 HydrophobicContact CH2-CD1 3.99Å; W343-I345 HydrophobicContact CZ2-CD1 3.57Å; W343-I345 HydrophobicContact CZ2-CG1 4.22Å; W343-I345 HydrophobicContact CZ3-CD1 4.43Å; W343-M356 HydrophobicContact CD2-CB 3.78Å; W343-M356 HydrophobicContact CD2-CG 4.16Å; W343-M356 HydrophobicContact CE3-CB 3.77Å; W343-M356 HydrophobicContact CE3-CG 4.46Å; W343-M356 HydrophobicContact CG-CB 4.42Å; W343-M356 HydrophobicContact CG-CG 4.29Å; W343-M356 HydrophobicContact CH2-CB 4.02Å; W343-M356 HydrophobicContact CZ2-CB 4.02Å; W343-M356 HydrophobicContact CZ3-CB 3.89Å
344	S	98.1	Very high	96.2	Very high	27 Å²	27	51 Å²	51	19%	0.189	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125	-175	-60.7	0	0	0	0	111.6	V310 G330 S331	V310-S344 CarbonylContact O-C 3.49Å; V310-S344 WeakPolarHBondContact O-CA 3.4Å; G330-S344 WeakPolarHBondContact CA-O 3.5Å; S331-S344 PolarHBondContact N-O 3.16Å; S331-S344 PolarHBondContact O-N 3.3Å
345	I	98	Very high	96.2	Very high	1 Å²	1	50 Å²	50	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	103.5	179.6	-51.8	172.7	0	0	0	108.2	V310 I312 V329 W343 S347 F348 Y354	V310-I345 HydrophobicContact CB-CB 4.32Å; V310-I345 PolarHBondContact N-O 3.21Å; V310-I345 PolarHBondContact O-N 2.88Å; I312-I345 HydrophobicContact CD1-CD1 4.26Å; V329-I345 HydrophobicContact CG1-CG2 4.31Å; W343-I345 HydrophobicContact CD2-CD1 4.11Å; W343-I345 HydrophobicContact CD2-CG1 4.38Å; W343-I345 HydrophobicContact CE3-CD1 4.48Å; W343-I345 HydrophobicContact CH2-CD1 3.99Å; W343-I345 HydrophobicContact CZ2-CD1 3.57Å; W343-I345 HydrophobicContact CZ2-CG1 4.22Å; W343-I345 HydrophobicContact CZ3-CD1 4.43Å; I345-S347 VanDerWaalsContact C-N 3.3Å; I345-S347 PolarHBondContact O-N 2.74Å; I345-F348 HydrophobicContact CD1-CD1 4.11Å; I345-F348 HydrophobicContact CD1-CE1 4.22Å; I345-F348 HydrophobicContact CG2-CB 3.96Å; I345-F348 HydrophobicContact CG2-CG 4.33Å; I345-Y354 HydrophobicContact CD1-CD2 4.05Å; I345-Y354 HydrophobicContact CG2-CD2 4.28Å; I345-Y354 HydrophobicContact CG2-CE2 4.11Å
346	K	96.6	Very high	96.3	Very high	170 Å²	170	48.8 Å²	48.8	74%	0.739	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	-37.3	-174.8	-171.1	173	-176.4	174.2	0	113.5	N308 N309	N308-K346 WeakPolarHBondContact CA-O 3.37Å; N309-K346 PolarHBondContact N-O 2.97Å
347	S	97.1	Very high	96.5	Very high	63 Å²	63	51.7 Å²	51.7	44%	0.441	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	115.9	-179.1	177	0	0	0	0	109.7	T306 I345	T306-S347 VanDerWaalsContact CG2-OG 3.24Å; T306-S347 WeakPolarHBondContact CG2-OG 3.43Å; I345-S347 VanDerWaalsContact C-N 3.3Å; I345-S347 PolarHBondContact O-N 2.74Å
348	F	97.8	Very high	96.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	90.8	-178.1	-163.2	172.7	0	0	0	110	I277 A297 S299 F301 A307 V310 I345 K352 Y354	I277-F348 HydrophobicContact CG2-CE1 4.28Å; A297-F348 HydrophobicContact CB-CE1 3.89Å; A297-F348 HydrophobicContact CB-CZ 4.1Å; S299-F348 WeakPolarHBondContact OG-CE2 3.3Å; F301-F348 WeakPolarHBondContact CZ-O 3.28Å; A307-F348 HydrophobicContact CB-CB 4.3Å; A307-F348 PolarHBondContact N-O 2.77Å; A307-F348 PolarHBondContact O-N 3.46Å; V310-F348 HydrophobicContact CG1-CD1 4.44Å; V310-F348 HydrophobicContact CG2-CB 3.97Å; V310-F348 HydrophobicContact CG2-CD1 4.27Å; I345-F348 HydrophobicContact CD1-CD1 4.11Å; I345-F348 HydrophobicContact CD1-CE1 4.22Å; I345-F348 HydrophobicContact CG2-CB 3.96Å; I345-F348 HydrophobicContact CG2-CG 4.33Å; F348-K352 HydrophobicContact CD2-CB 4.22Å; F348-K352 HydrophobicContact CE2-CB 3.86Å; F348-Y354 AromaticContact CD2-CD2 3.75Å; F348-Y354 HydrophobicContact CD2-CD2 3.75Å; F348-Y354 AromaticContact CD2-CE2 3.39Å; F348-Y354 HydrophobicContact CD2-CE2 3.39Å; F348-Y354 HydrophobicContact CE1-CD2 4.32Å; F348-Y354 AromaticContact CE2-CD2 3.51Å; F348-Y354 HydrophobicContact CE2-CD2 3.51Å; F348-Y354 AromaticContact CE2-CE2 3.57Å; F348-Y354 HydrophobicContact CE2-CE2 3.57Å; F348-Y354 HydrophobicContact CE2-CG 4.32Å; F348-Y354 HydrophobicContact CG-CD2 4.25Å; F348-Y354 HydrophobicContact CG-CE2 4.01Å; F348-Y354 AromaticContact CZ-CD2 3.83Å; F348-Y354 HydrophobicContact CZ-CD2 3.83Å; F348-Y354 HydrophobicContact CZ-CE2 4.33Å
349	P	97.7	Very high	97	Very high	34 Å²	34	41.3 Å²	41.3	22%	0.221	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	151.3	178.6	-22	33.7	0	0	0	112.2	S299 K352	S299-P349 PolarHBondContact OG-O 2.99Å; P349-K352 HydrophobicContact CB-CG 4.09Å; P349-K352 WeakPolarHBondContact O-CB 3.25Å
350	G	96.8	Very high	97.1	Very high	4 Å²	4	39.9 Å²	39.9	4%	0.041	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	145.8	177.1	0	0	0	0	0	113.3	S299 F301 R303 S305 K352	S299-G350 WeakPolarHBondContact OG-CA 3.24Å; F301-G350 VanDerWaalsContact CE2-N 3.31Å; R303-G350 WeakPolarHBondContact CA-O 3.37Å; R303-G350 WeakPolarHBondContact CG-O 3.35Å; S305-G350 PolarHBondContact O-N 2.9Å; G350-K352 VanDerWaalsContact C-N 3.29Å; G350-K352 PolarHBondContact O-N 3.48Å
351	G	95.6	Very high	97	Very high	45 Å²	45	39 Å²	39	46%	0.464	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	20.1	-179.7	0	0	0	0	0	114.3	S299	S299-G351 VanDerWaalsContact O-CA 3.23Å; S299-G351 WeakPolarHBondContact O-CA 3.21Å; S299-G351 PolarHBondContact O-N 3.19Å; S299-G351 PolarHBondContact OG-N 2.99Å; S299-G351 VanDerWaalsContact OG-N 3.09Å
352	K	96.8	Very high	96.7	Very high	113 Å²	113	39.8 Å²	39.8	49%	0.491	21%	0.207	S	C	.	.			trans	-104.5	158.5	174.9	-70.7	-68.4	-174.1	175.5	0	110.3	S299 F348 P349 G350 Y354	S299-K352 PolarHBondContact N-O 3.28Å; S299-K352 PolarHBondContact OG-N 3.4Å; S299-K352 PolarHBondContact OG-O 3.18Å; S299-K352 VanDerWaalsContact OG-O 3.14Å; F348-K352 HydrophobicContact CD2-CB 4.22Å; F348-K352 HydrophobicContact CE2-CB 3.86Å; P349-K352 HydrophobicContact CB-CG 4.09Å; P349-K352 WeakPolarHBondContact O-CB 3.25Å; G350-K352 VanDerWaalsContact C-N 3.29Å; G350-K352 PolarHBondContact O-N 3.48Å; K352-Y354 HydrophobicContact CB-CE1 4.36Å
353	E	96.9	Very high	96.2	Very high	79 Å²	79	42 Å²	42	37%	0.369	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.9	177	-178	-176.4	122.4	0	0	108.4	K296 A297 K298	K296-E353 HydrophobicContact CD-CG 4.18Å; K296-E353 VanDerWaalsContact CD-OE1 3.24Å; K296-E353 WeakPolarHBondContact CD-OE1 3.36Å; K296-E353 WeakPolarHBondContact CE-OE1 3.49Å; K296-E353 WeakPolarHBondContact CE-OE2 3.12Å; K296-E353 HydrophobicContact CG-CG 3.86Å; K296-E353 IonicContact NZ-OE1 3.22Å; K296-E353 PolarHBondContact NZ-OE1 3.23Å; K296-E353 IonicContact NZ-OE2 3.51Å; K296-E353 PolarHBondContact NZ-OE2 2.92Å; A297-E353 VanDerWaalsContact O-CA 3.32Å; A297-E353 WeakPolarHBondContact O-CA 3.48Å; K298-E353 WeakPolarHBondContact CE-OE2 3.08Å; K298-E353 HydrophobicContact CG-CB 4.23Å; K298-E353 HydrophobicContact CG-CG 3.76Å
354	Y	97.8	Very high	95.6	Very high	32 Å²	32	46.5 Å²	46.5	13%	0.125	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	151.4	177.5	-60.3	-38.5	0	0	0	110	K296 A297 V329 I345 F348 K352	K296-Y354 WeakPolarHBondContact CA-O 3.32Å; A297-Y354 PolarHBondContact N-O 2.66Å; A297-Y354 PolarHBondContact O-N 3.22Å; V329-Y354 HydrophobicContact CB-CD1 4Å; V329-Y354 HydrophobicContact CB-CD2 4.13Å; V329-Y354 HydrophobicContact CB-CE1 4.14Å; V329-Y354 HydrophobicContact CB-CE2 4.2Å; V329-Y354 HydrophobicContact CB-CG 4.01Å; V329-Y354 HydrophobicContact CG1-CD2 4.4Å; V329-Y354 HydrophobicContact CG1-CE2 4.07Å; V329-Y354 HydrophobicContact CG2-CD1 3.63Å; V329-Y354 HydrophobicContact CG2-CE1 3.54Å; V329-Y354 HydrophobicContact CG2-CE2 4.43Å; V329-Y354 HydrophobicContact CG2-CG 4.18Å; I345-Y354 HydrophobicContact CD1-CD2 4.05Å; I345-Y354 HydrophobicContact CG2-CD2 4.28Å; I345-Y354 HydrophobicContact CG2-CE2 4.11Å; F348-Y354 AromaticContact CD2-CD2 3.75Å; F348-Y354 HydrophobicContact CD2-CD2 3.75Å; F348-Y354 AromaticContact CD2-CE2 3.39Å; F348-Y354 HydrophobicContact CD2-CE2 3.39Å; F348-Y354 HydrophobicContact CE1-CD2 4.32Å; F348-Y354 AromaticContact CE2-CD2 3.51Å; F348-Y354 HydrophobicContact CE2-CD2 3.51Å; F348-Y354 AromaticContact CE2-CE2 3.57Å; F348-Y354 HydrophobicContact CE2-CE2 3.57Å; F348-Y354 HydrophobicContact CE2-CG 4.32Å; F348-Y354 HydrophobicContact CG-CD2 4.25Å; F348-Y354 HydrophobicContact CG-CE2 4.01Å; F348-Y354 AromaticContact CZ-CD2 3.83Å; F348-Y354 HydrophobicContact CZ-CD2 3.83Å; F348-Y354 HydrophobicContact CZ-CE2 4.33Å; K352-Y354 HydrophobicContact CB-CE1 4.36Å
355	L	97.4	Very high	94.9	Very high	69 Å²	69	50.5 Å²	50.5	36%	0.361	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.9	179.6	-66.5	95.4	0	0	0	110.7	I295 K296 T328	I295-L355 CarbonylContact O-C 3.6Å; I295-L355 WeakPolarHBondContact O-CA 3.4Å; K296-L355 HydrophobicContact CB-CG 4.4Å; K296-L355 HydrophobicContact CD-CD2 4.39Å; K296-L355 HydrophobicContact CD-CG 4.45Å; K296-L355 HydrophobicContact CG-CG 4.4Å; T328-L355 HydrophobicContact CG2-CB 4.05Å; T328-L355 HydrophobicContact CG2-CD1 4.49Å; T328-L355 PolarHBondContact N-O 3.5Å; T328-L355 PolarHBondContact OG1-N 3.49Å; T328-L355 PolarHBondContact OG1-O 2.82Å
356	M	97.5	Very high	94	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.9	172.4	-176.6	-80.2	-76	0	0	108.4	I295 I314 K326 T327 V332 I341 W343 A358	I295-M356 HydrophobicContact CB-CE 4.06Å; I295-M356 HydrophobicContact CD1-CE 3.51Å; I295-M356 HydrophobicContact CG1-CE 3.93Å; I295-M356 PolarHBondContact N-O 3.27Å; I295-M356 PolarHBondContact O-N 2.81Å; I314-M356 HydrophobicContact CD1-CE 3.75Å; K326-M356 CarbonylContact O-C 3.58Å; K326-M356 WeakPolarHBondContact O-CA 3.03Å; T327-M356 HydrophobicContact CG2-CB 4.1Å; T327-M356 HydrophobicContact CG2-CG 3.55Å; V332-M356 HydrophobicContact CG2-CG 3.68Å; V332-M356 HydrophobicContact CG2-SD 4.32Å; I341-M356 HydrophobicContact CD1-CE 3.62Å; I341-M356 HydrophobicContact CD1-SD 4.47Å; W343-M356 HydrophobicContact CD2-CB 3.78Å; W343-M356 HydrophobicContact CD2-CG 4.16Å; W343-M356 HydrophobicContact CE3-CB 3.77Å; W343-M356 HydrophobicContact CE3-CG 4.46Å; W343-M356 HydrophobicContact CG-CB 4.42Å; W343-M356 HydrophobicContact CG-CG 4.29Å; W343-M356 HydrophobicContact CH2-CB 4.02Å; W343-M356 HydrophobicContact CZ2-CB 4.02Å; W343-M356 HydrophobicContact CZ3-CB 3.89Å; M356-A358 HydrophobicContact SD-CB 3.85Å
357	R	97	Very high	93.2	Very high	120 Å²	120	51.5 Å²	51.5	45%	0.453	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128	169.4	-169	176.9	-178.3	-177.7	1.7	108.9	E292 Y293 F325 K326	E292-R357 IonicContact OE1-NH2 3.28Å; E292-R357 IonicContact OE2-CZ 3.63Å; E292-R357 IonicContact OE2-NE 2.73Å; E292-R357 PolarHBondContact OE2-NE 2.86Å; E292-R357 IonicContact OE2-NH2 3.41Å; E292-R357 PolarHBondContact OE2-NH2 3.19Å; Y293-R357 CarbonylContact O-C 3.59Å; Y293-R357 VanDerWaalsContact O-CA 3.24Å; Y293-R357 WeakPolarHBondContact O-CA 3.47Å; F325-R357 CarbonylContact C-O 3.57Å; F325-R357 WeakPolarHBondContact CA-O 3.12Å; K326-R357 HydrophobicContact CB-CB 4.5Å; K326-R357 PolarHBondContact N-O 2.95Å; K326-R357 PolarHBondContact O-N 3.04Å
358	A	96.6	Very high	92.2	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	146.1	170.9	0	0	0	0	0	109.9	E292 Y293 K324 F325 I341 M356 F360	E292-A358 CarbonylContact C-O 3.59Å; E292-A358 WeakPolarHBondContact CA-O 3.14Å; Y293-A358 HydrophobicContact CD2-CB 4.41Å; Y293-A358 PolarHBondContact N-O 2.75Å; Y293-A358 PolarHBondContact O-N 2.92Å; K324-A358 CarbonylContact O-C 3.59Å; K324-A358 WeakPolarHBondContact O-CA 3.27Å; F325-A358 HydrophobicContact CD1-CB 3.59Å; F325-A358 HydrophobicContact CE1-CB 3.71Å; I341-A358 HydrophobicContact CD1-CB 3.94Å; M356-A358 HydrophobicContact SD-CB 3.85Å; A358-F360 HydrophobicContact CB-CD2 4.41Å; A358-F360 HydrophobicContact CB-CE2 3.94Å
359	H	96.4	Very high	91.3	Very high	47 Å²	47	64.7 Å²	64.7	22%	0.218	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.3	173.4	173.6	-62.9	0	0	0	108.2	R290 E292 P323 K324	R290-H359 WeakPolarHBondContact CD-NE2 3.38Å; E292-H359 HydrophobicContact CG-CB 4.47Å; E292-H359 IonicContact OE1-CD2 3.41Å; E292-H359 PolarHBondContact OE1-CD2 2.91Å; P323-H359 CarbonylContact C-O 3.59Å; K324-H359 HydrophobicContact CB-CB 4.29Å; K324-H359 PolarHBondContact N-O 3.19Å; K324-H359 PolarHBondContact O-N 3.27Å
360	F	95.6	Very high	90.3	Very high	0 Å²	0	73 Å²	73	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.5	175.4	-71.9	-94.2	0	0	0	110	R290 I291 Y293 V316 A320 D321 P323 F325 W334 I341 A358	R290-F360 CarbonylContact C-O 3.51Å; R290-F360 WeakPolarHBondContact CA-O 3.34Å; R290-F360 WeakPolarHBondContact CB-O 3.49Å; I291-F360 HydrophobicContact CG2-CB 3.66Å; I291-F360 HydrophobicContact CG2-CG 4.47Å; I291-F360 PolarHBondContact N-O 3.35Å; I291-F360 PolarHBondContact O-N 3.13Å; Y293-F360 HydrophobicContact CD2-CD2 4.32Å; Y293-F360 HydrophobicContact CE2-CD2 4.28Å; V316-F360 HydrophobicContact CG1-CE2 3.94Å; V316-F360 HydrophobicContact CG1-CZ 4.17Å; A320-F360 HydrophobicContact CB-CB 4.07Å; A320-F360 HydrophobicContact CB-CD1 3.79Å; A320-F360 HydrophobicContact CB-CG 4.12Å; D321-F360 CarbonylContact O-C 3.59Å; D321-F360 WeakPolarHBondContact O-CA 3.4Å; D321-F360 WeakPolarHBondContact O-CD1 3.32Å; P323-F360 HydrophobicContact CB-CD1 4.08Å; P323-F360 HydrophobicContact CB-CE1 3.56Å; P323-F360 HydrophobicContact CB-CZ 3.99Å; P323-F360 HydrophobicContact CG-CE1 4.48Å; F325-F360 AromaticContact CE1-CE2 3.87Å; F325-F360 HydrophobicContact CE1-CE2 3.87Å; F325-F360 AromaticContact CE1-CZ 3.75Å; F325-F360 HydrophobicContact CE1-CZ 3.75Å; F325-F360 HydrophobicContact CZ-CE2 4.36Å; F325-F360 AromaticContact CZ-CZ 3.76Å; F325-F360 HydrophobicContact CZ-CZ 3.76Å; W334-F360 AromaticContact CD1-CE1 3.88Å; W334-F360 HydrophobicContact CD2-CE1 4.26Å; W334-F360 HydrophobicContact CG-CE1 4.15Å; W334-F360 HydrophobicContact CG-CZ 4.43Å; W334-F360 AromaticContact NE1-CE1 3.79Å; I341-F360 HydrophobicContact CG2-CE2 3.97Å; I341-F360 HydrophobicContact CG2-CZ 3.45Å; I341-F360 VanDerWaalsContact CG2-CZ 3.45Å; A358-F360 HydrophobicContact CB-CD2 4.41Å; A358-F360 HydrophobicContact CB-CE2 3.94Å
361	G	93.6	Very high	89.4	Confident	11 Å²	11	76.9 Å²	76.9	11%	0.113	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	151.1	162.8	0	0	0	0	0	110.1	A320 D321	A320-G361 WeakPolarHBondContact CA-O 3.28Å; D321-G361 PolarHBondContact N-O 2.93Å; D321-G361 PolarHBondContact O-N 3.1Å; D321-G361 VanDerWaalsContact OD1-CA 3.25Å; D321-G361 WeakPolarHBondContact OD1-CA 3.45Å
362	L	91.2	Very high	88.6	Confident	17 Å²	17	77.7 Å²	77.7	9%	0.089	41%	0.411	C	S	.	.			trans	-118.7	146.4	168.6	-72.1	177	0	0	0	109.2	K285 S289 I291 P317	K285-L362 HydrophobicContact CD-CD1 4.46Å; K285-L362 HydrophobicContact CG-CD1 4.04Å; S289-L362 PolarHBondContact O-N 3.2Å; I291-L362 HydrophobicContact CB-CD1 4.06Å; I291-L362 HydrophobicContact CB-CG 4.33Å; I291-L362 HydrophobicContact CG2-CD1 4.38Å; I291-L362 HydrophobicContact CG2-CD2 4.16Å; I291-L362 HydrophobicContact CG2-CG 4.15Å; P317-L362 HydrophobicContact CB-CD2 4.12Å; P317-L362 HydrophobicContact CG-CD2 4.11Å
363	P	88.6	Confident	88	Confident	49 Å²	49	79.2 Å²	79.2	32%	0.318	42%	0.418	S	S	.	.			trans	-59.9	152.1	174.9	-20	31.8	0	0	0	111.8	H288 D319 V365	H288-P363 WeakPolarHBondContact CA-O 3.22Å; D319-P363 HydrophobicContact CB-CG 3.82Å; D319-P363 WeakPolarHBondContact O-CD 3.38Å; D319-P363 WeakPolarHBondContact O-CG 3.3Å; D319-P363 WeakPolarHBondContact OD2-CD 3Å; P363-V365 VanDerWaalsContact C-N 3.25Å; P363-V365 PolarHBondContact O-N 3.1Å
364	S	84.3	Confident	87.7	Confident	94 Å²	94	78.8 Å²	78.8	66%	0.657	42%	0.422	S	S	*	.	S	Bend	trans	-73.7	-18.4	174.5	53.3	0	0	0	0	113.1	H288	H288-S364 PolarHBondContact ND1-O 3.02Å
365	V	84.3	Confident	87.6	Confident	111 Å²	111	79 Å²	79	67%	0.673	43%	0.427	S	S	*	.	S	Bend	trans	-102	129.5	177	-176.4	0	0	0	0	108.5	P363	P363-V365 VanDerWaalsContact C-N 3.25Å; P363-V365 PolarHBondContact O-N 3.1Å
366	E	78.9	Confident	87.6	Confident	131 Å²	131	75.8 Å²	75.8	61%	0.612	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-72.9	142.3	176.3	-86.8	173.7	176.6	0	0	111.3	H288	H288-E366 VanDerWaalsContact CE1-CG 3.42Å; H288-E366 WeakPolarHBondContact CE1-CG 3.45Å; H288-E366 IonicContact CE1-OE1 2.76Å; H288-E366 IonicContact NE2-OE1 3.94Å; H288-E366 PolarHBondContact NE2-OE1 3.32Å
367	A	78.5	Confident	87.5	Confident	61 Å²	61	77.6 Å²	77.6	50%	0.504	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-66.5	143.4	168.9	0	0	0	0	0	110.8	D369	A367-D369 VanDerWaalsContact C-N 3.33Å
368	E	76.9	Confident	87.5	Confident	200 Å²	200	71.9 Å²	71.9	94%	0.935	40%	0.401	S	S	*	.	S	Bend	trans	-69.9	-32.2	-179.8	-65.6	-175	168	0	0	112.1
369	D	78.2	Confident	87.6	Confident	140 Å²	140	76.4 Å²	76.4	75%	0.749	42%	0.421	S	S	*	.	S	Bend	trans	-98.8	136.5	-178.1	-69.5	-43	0	0	0	112.7	A367 E371	A367-D369 VanDerWaalsContact C-N 3.33Å; D369-E371 PolarHBondContact O-N 3.26Å
370	K	76.6	Confident	87.6	Confident	208 Å²	208	74.5 Å²	74.5	90%	0.904	41%	0.412	S	S	*	.			trans	-77.8	115.2	172.5	-71.9	-177.9	-179.2	174.6	0	109.8
371	E	78.4	Confident	87.7	Confident	85 Å²	85	78.3 Å²	78.3	40%	0.397	43%	0.43	S	S	.	.			trans	-63.8	146.1	170.4	-69	177.4	-169.3	0	0	111.9	P317 T318 D369	P317-E371 WeakPolarHBondContact CA-OE2 3.46Å; T318-E371 WeakPolarHBondContact CB-OE1 3.42Å; T318-E371 HydrophobicContact CG2-CG 4.44Å; T318-E371 WeakPolarHBondContact CG2-OE1 3.37Å; T318-E371 PolarHBondContact N-OE1 2.84Å; T318-E371 VanDerWaalsContact N-OE1 3.11Å; T318-E371 PolarHBondContact N-OE2 2.81Å; T318-E371 PolarHBondContact OG1-OE1 3.32Å; D369-E371 PolarHBondContact O-N 3.26Å
372	G	80.1	Confident	87.9	Confident	63 Å²	63	77.8 Å²	77.8	65%	0.649	42%	0.424	S	S	*	.			trans	-61.6	161.4	166.7	0	0	0	0	0	111	P374	G372-P374 VanDerWaalsContact O-CD 3.23Å; G372-P374 WeakPolarHBondContact O-CD 3.22Å
373	K	83.6	Confident	88.2	Confident	145 Å²	145	78.6 Å²	78.6	63%	0.63	43%	0.431	S	S	*	.			trans	-108.8	85.8	171.6	-65.7	-175.2	177.1	-171.1	0	109.3	Q423	K373-Q423 PolarHBondContact NZ-O 3.14Å; K373-Q423 PolarHBondContact NZ-OXT 2.73Å
374	P	91.2	Very high	88.5	Confident	70 Å²	70	85.3 Å²	85.3	46%	0.455	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-62.2	148.3	174.5	-12.6	25.5	0	0	0	109.8	P315 G372	P315-P374 HydrophobicContact CB-CB 4.25Å; P315-P374 HydrophobicContact CB-CG 4.13Å; P315-P374 HydrophobicContact CG-CB 3.7Å; P315-P374 HydrophobicContact CG-CG 4.13Å; P315-P374 WeakPolarHBondContact CG-O 3.28Å; G372-P374 VanDerWaalsContact O-CD 3.23Å; G372-P374 WeakPolarHBondContact O-CD 3.22Å
375	P	94.8	Very high	88.9	Confident	37 Å²	37	82 Å²	82	24%	0.24	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-71.8	155.9	173.1	30.3	-33.4	0	0	0	111	S377 Q419 L420 R421	P375-S377 PolarHBondContact O-N 3.11Å; P375-Q419 HydrophobicContact CB-CB 4.03Å; P375-Q419 HydrophobicContact CG-CB 3.95Å; P375-Q419 HydrophobicContact CG-CG 4.07Å; P375-L420 CarbonylContact C-O 3.53Å; P375-L420 WeakPolarHBondContact CA-O 3.38Å; P375-L420 WeakPolarHBondContact CB-O 3.48Å; P375-R421 HydrophobicContact CB-CG 4.3Å
376	I	96.4	Very high	89.4	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.005	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	132.8	164.6	-70.1	165.3	0	0	0	108	I279 I312 H313 I314 V378 Q419 L420 T422	I279-I376 HydrophobicContact CG2-CD1 4.37Å; I279-I376 HydrophobicContact CG2-CG2 4.39Å; I312-I376 HydrophobicContact CG2-CG2 3.97Å; H313-I376 VanDerWaalsContact O-CA 3.32Å; H313-I376 WeakPolarHBondContact O-CA 3.3Å; H313-I376 WeakPolarHBondContact O-CG2 3.31Å; I314-I376 HydrophobicContact CB-CG1 4.36Å; I314-I376 HydrophobicContact CG1-CD1 4.32Å; I314-I376 HydrophobicContact CG1-CG1 4.09Å; I314-I376 HydrophobicContact CG1-CG2 4.27Å; I314-I376 HydrophobicContact CG2-CD1 4.37Å; I314-I376 HydrophobicContact CG2-CG1 4.15Å; I376-V378 HydrophobicContact CG2-CG2 4.49Å; I376-Q419 CarbonylContact O-C 3.59Å; I376-Q419 WeakPolarHBondContact O-CA 3.49Å; I376-L420 HydrophobicContact CB-CB 4.43Å; I376-L420 PolarHBondContact N-O 3.41Å; I376-L420 PolarHBondContact O-N 3.27Å; I376-T422 HydrophobicContact CD1-CG2 3.6Å; I376-T422 HydrophobicContact CG1-CG2 3.56Å
377	S	96.9	Very high	90	Very high	39 Å²	39	73 Å²	73	27%	0.273	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	150.3	172.6	70.4	0	0	0	0	111.6	H313 P375 Y418	H313-S377 WeakPolarHBondContact CB-OG 3.27Å; H313-S377 PolarHBondContact N-O 2.68Å; H313-S377 PolarHBondContact O-N 3.18Å; P375-S377 PolarHBondContact O-N 3.11Å; S377-Y418 VanDerWaalsContact CA-O 3.28Å; S377-Y418 WeakPolarHBondContact CA-O 3.25Å
378	V	97.2	Very high	90.7	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	124.5	-178.8	-170.6	0	0	0	0	110	I277 I279 V310 E311 I312 I376 F380 N415 Y418 L420	I277-V378 HydrophobicContact CD1-CG1 4.48Å; I277-V378 HydrophobicContact CG2-CG1 4.39Å; I279-V378 HydrophobicContact CD1-CG2 4.25Å; I279-V378 HydrophobicContact CG1-CG2 3.73Å; V310-V378 HydrophobicContact CG1-CG1 3.93Å; E311-V378 CarbonylContact O-C 3.6Å; E311-V378 WeakPolarHBondContact O-CA 3.47Å; I312-V378 HydrophobicContact CG1-CG1 3.98Å; I312-V378 HydrophobicContact CG1-CG2 4.3Å; I312-V378 HydrophobicContact CG2-CG2 4.33Å; I376-V378 HydrophobicContact CG2-CG2 4.49Å; V378-F380 HydrophobicContact CG1-CD1 4.16Å; V378-N415 VanDerWaalsContact O-CB 3.23Å; V378-N415 WeakPolarHBondContact O-CB 3.44Å; V378-Y418 HydrophobicContact CB-CD1 3.72Å; V378-Y418 HydrophobicContact CB-CE1 4.16Å; V378-Y418 HydrophobicContact CG2-CD1 3.97Å; V378-Y418 HydrophobicContact CG2-CE1 4.16Å; V378-Y418 PolarHBondContact N-O 3.2Å; V378-Y418 VanDerWaalsContact N-O 3.16Å; V378-L420 HydrophobicContact CG2-CD1 4.13Å
379	K	97.8	Very high	91.4	Very high	94 Å²	94	61.4 Å²	61.4	41%	0.409	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.2	167.7	-58.9	179.1	-175.1	167.7	0	109.7	V310 E311 H313 N415	V310-K379 CarbonylContact C-O 3.59Å; V310-K379 VanDerWaalsContact CA-O 3.22Å; V310-K379 WeakPolarHBondContact CA-O 3.49Å; E311-K379 HydrophobicContact CB-CB 4.22Å; E311-K379 PolarHBondContact N-O 2.85Å; E311-K379 PolarHBondContact O-N 3.03Å; H313-K379 WeakPolarHBondContact NE2-CE 3.48Å; K379-N415 VanDerWaalsContact CA-OD1 3.26Å; K379-N415 WeakPolarHBondContact CA-OD1 3.31Å
380	F	97.2	Very high	92.1	Very high	7 Å²	7	54.8 Å²	54.8	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	157	177.1	64	-92.8	0	0	0	110.9	V179 L276 I277 A307 V310 V378 I382 T413 Q414 N415 Y418	V179-F380 HydrophobicContact CB-CZ 4.41Å; L276-F380 HydrophobicContact CD1-CE2 3.83Å; L276-F380 HydrophobicContact CD1-CZ 4Å; I277-F380 HydrophobicContact CD1-CB 3.7Å; I277-F380 HydrophobicContact CD1-CD1 3.97Å; I277-F380 HydrophobicContact CD1-CD2 4.46Å; I277-F380 HydrophobicContact CD1-CG 3.79Å; A307-F380 HydrophobicContact CB-CB 4.48Å; V310-F380 HydrophobicContact CG1-CB 4.37Å; V310-F380 HydrophobicContact CG2-CB 3.91Å; V378-F380 HydrophobicContact CG1-CD1 4.16Å; F380-I382 HydrophobicContact CD2-CD1 4.31Å; F380-I382 HydrophobicContact CD2-CG1 4.02Å; F380-I382 HydrophobicContact CE2-CD1 4.37Å; F380-I382 HydrophobicContact CE2-CG1 4.42Å; F380-T413 HydrophobicContact CE2-CG2 4.38Å; F380-Q414 VanDerWaalsContact O-CA 3.25Å; F380-Q414 WeakPolarHBondContact O-CA 3.2Å; F380-N415 HydrophobicContact CD1-CB 3.92Å; F380-N415 HydrophobicContact CE1-CB 3.72Å; F380-N415 HydrophobicContact CZ-CB 4.29Å; F380-N415 PolarHBondContact N-OD1 3.39Å; F380-N415 VanDerWaalsContact N-OD1 3.1Å; F380-N415 PolarHBondContact O-N 3.01Å; F380-N415 PolarHBondContact O-OD1 3.45Å; F380-Y418 HydrophobicContact CE1-CD1 4.47Å; F380-Y418 AromaticContact CE1-CD2 3.7Å; F380-Y418 HydrophobicContact CE1-CD2 3.7Å; F380-Y418 AromaticContact CE1-CE2 3.81Å; F380-Y418 HydrophobicContact CE1-CE2 3.81Å; F380-Y418 HydrophobicContact CE1-CG 4.03Å; F380-Y418 HydrophobicContact CZ-CD2 4.2Å; F380-Y418 HydrophobicContact CZ-CE2 4.16Å
381	E	97.4	Very high	93	Very high	80 Å²	80	49.4 Å²	49.4	37%	0.374	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	127.8	171.4	-170.1	-170.6	120.9	0	0	110.3	A307 N308 I412 T413	A307-E381 CarbonylContact C-O 3.58Å; A307-E381 WeakPolarHBondContact CA-O 3.42Å; N308-E381 PolarHBondContact N-O 2.56Å; N308-E381 PolarHBondContact O-N 3.31Å; E381-I412 HydrophobicContact CG-CG2 3.64Å; E381-T413 CarbonylContact C-O 3.56Å; E381-T413 WeakPolarHBondContact CA-O 3.06Å
382	I	97.4	Very high	93.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	103.3	176.8	-48.4	-178.8	0	0	0	108.1	L276 F301 A307 F380 F385 T413	L276-I382 HydrophobicContact CD1-CD1 4.11Å; F301-I382 HydrophobicContact CD1-CD1 3.79Å; F301-I382 HydrophobicContact CD2-CD1 4.3Å; F301-I382 HydrophobicContact CE1-CD1 3.78Å; F301-I382 HydrophobicContact CE2-CD1 4.27Å; F301-I382 HydrophobicContact CG-CD1 4.06Å; F301-I382 HydrophobicContact CZ-CD1 4.04Å; A307-I382 HydrophobicContact CB-CD1 4.32Å; A307-I382 HydrophobicContact CB-CG1 3.81Å; F380-I382 HydrophobicContact CD2-CD1 4.31Å; F380-I382 HydrophobicContact CD2-CG1 4.02Å; F380-I382 HydrophobicContact CE2-CD1 4.37Å; F380-I382 HydrophobicContact CE2-CG1 4.42Å; I382-F385 HydrophobicContact CB-CB 4.15Å; I382-F385 HydrophobicContact CG2-CB 3.51Å; I382-F385 HydrophobicContact CG2-CD1 4.3Å; I382-F385 HydrophobicContact CG2-CG 3.89Å; I382-T413 PolarHBondContact N-O 3.42Å; I382-T413 PolarHBondContact O-N 3.48Å
383	P	96.8	Very high	94.3	Very high	35 Å²	35	49.1 Å²	49.1	23%	0.227	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	155.8	177.4	32.2	-36.5	0	0	0	111.4	F385	P383-F385 PolarHBondContact O-N 3.14Å
384	Y	94.6	Very high	94.8	Very high	190 Å²	190	46.2 Å²	46.2	75%	0.745	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	33	-179.4	-47.5	-74.4	0	0	0	113.6	Y411	Y384-Y411 VanDerWaalsContact CA-O 3.25Å; Y384-Y411 WeakPolarHBondContact CA-O 3.18Å; Y384-Y411 PolarHBondContact N-O 3.1Å
385	F	94.3	Very high	95	Very high	25 Å²	25	44 Å²	44	11%	0.11	21%	0.208	C	C	.	.			trans	-133.9	142.9	-176.5	-168.7	-96.3	0	0	0	111.2	L276 F301 K302 S305 I382 P383 T413	L276-F385 HydrophobicContact CD2-CE1 3.9Å; L276-F385 HydrophobicContact CD2-CZ 4.31Å; F301-F385 HydrophobicContact CB-CE2 4.49Å; F301-F385 HydrophobicContact CB-CZ 4.14Å; K302-F385 HydrophobicContact CD-CE2 4.48Å; K302-F385 HydrophobicContact CG-CE2 4.47Å; S305-F385 WeakPolarHBondContact OG-CD2 3.18Å; I382-F385 HydrophobicContact CB-CB 4.15Å; I382-F385 HydrophobicContact CG2-CB 3.51Å; I382-F385 HydrophobicContact CG2-CD1 4.3Å; I382-F385 HydrophobicContact CG2-CG 3.89Å; P383-F385 PolarHBondContact O-N 3.14Å; F385-T413 HydrophobicContact CD1-CG2 4.47Å; F385-T413 PolarHBondContact O-OG1 3.01Å
386	T	93.6	Very high	95	Very high	29 Å²	29	47.7 Å²	47.7	18%	0.178	22%	0.22	C	C	.	.			trans	-129.7	133	167.3	53.8	0	0	0	0	108.8	G389 I390 Y411	T386-G389 WeakPolarHBondContact OG1-CA 3.28Å; T386-I390 HydrophobicContact CG2-CG2 3.87Å; T386-I390 PolarHBondContact OG1-O 2.83Å; T386-Y411 HydrophobicContact CG2-CD1 3.31Å; T386-Y411 HydrophobicContact CG2-CE1 4.17Å; T386-Y411 HydrophobicContact CG2-CG 3.86Å
387	T	92.8	Very high	94.9	Very high	22 Å²	22	49.9 Å²	49.9	14%	0.135	23%	0.231	C	C	.	.	S	Bend	trans	-80.4	-41.4	175.8	-52.3	0	0	0	0	110.2	E177 I194 L276 G389 T413	E177-T387 WeakPolarHBondContact OE2-CA 3.22Å; E177-T387 WeakPolarHBondContact OE2-CB 3.31Å; E177-T387 PolarHBondContact OE2-N 3.12Å; I194-T387 HydrophobicContact CD1-CG2 3.72Å; L276-T387 HydrophobicContact CD2-CG2 4.29Å; T387-G389 PolarHBondContact O-N 2.93Å; T387-T413 WeakPolarHBondContact OG1-CG2 3.25Å
388	S	92.4	Very high	94.8	Very high	18 Å²	18	51.7 Å²	51.7	13%	0.126	24%	0.237	C	C	.	.	S	Bend	trans	-66.5	-26.7	176.9	77.1	0	0	0	0	112.5	E177 I390	E177-S388 WeakPolarHBondContact OE1-CB 3.48Å; E177-S388 PolarHBondContact OE1-N 3.33Å; E177-S388 PolarHBondContact OE1-OG 3.05Å; E177-S388 PolarHBondContact OE2-N 2.85Å; S388-I390 VanDerWaalsContact C-N 3.32Å; S388-I390 VanDerWaalsContact OG-CB 3.31Å; S388-I390 WeakPolarHBondContact OG-CB 3.49Å; S388-I390 WeakPolarHBondContact OG-CG2 3.46Å; S388-I390 PolarHBondContact OG-N 3.18Å
389	G	91.6	Very high	94.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.01	25%	0.245	C	C	.	.			trans	77.4	15.6	-171	0	0	0	0	0	114.4	N215 T386 T387	N215-G389 PolarHBondContact ND2-O 2.81Å; N215-G389 VanDerWaalsContact ND2-O 3.08Å; T386-G389 WeakPolarHBondContact OG1-CA 3.28Å; T387-G389 PolarHBondContact O-N 2.93Å
390	I	93.9	Very high	94.1	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	27%	0.269	C	S	.	.			trans	-54.6	143.3	168.4	-166.7	166	0	0	0	110.9	V175 E177 L214 N215 V231 Y267 T386 S388	V175-I390 HydrophobicContact CG1-CG2 3.83Å; E177-I390 VanDerWaalsContact OE1-CG2 3.31Å; E177-I390 WeakPolarHBondContact OE1-CG2 3.44Å; L214-I390 HydrophobicContact CD1-CD1 4.24Å; L214-I390 HydrophobicContact CD2-CD1 4.49Å; L214-I390 HydrophobicContact CD2-CG1 4.43Å; N215-I390 WeakPolarHBondContact OD1-CA 3.49Å; V231-I390 HydrophobicContact CG1-CB 4.2Å; V231-I390 HydrophobicContact CG1-CD1 4.5Å; V231-I390 HydrophobicContact CG1-CG1 4.04Å; Y267-I390 HydrophobicContact CD1-CD1 4.34Å; Y267-I390 HydrophobicContact CD2-CD1 4.49Å; Y267-I390 HydrophobicContact CE1-CD1 3.81Å; Y267-I390 HydrophobicContact CE2-CD1 3.96Å; T386-I390 HydrophobicContact CG2-CG2 3.87Å; T386-I390 PolarHBondContact OG1-O 2.83Å; S388-I390 VanDerWaalsContact C-N 3.32Å; S388-I390 VanDerWaalsContact OG-CB 3.31Å; S388-I390 WeakPolarHBondContact OG-CB 3.49Å; S388-I390 WeakPolarHBondContact OG-CG2 3.46Å; S388-I390 PolarHBondContact OG-N 3.18Å
391	Q	94.1	Very high	93.6	Very high	94 Å²	94	62.6 Å²	62.6	44%	0.439	30%	0.296	S	S	.	.			trans	-142.2	128.3	-179.3	-66.9	-179.6	-17.1	0	0	109.9	L214 N215 R393	L214-Q391 WeakPolarHBondContact CA-O 3.33Å; N215-Q391 PolarHBondContact N-O 2.98Å; N215-Q391 PolarHBondContact OD1-N 3.24Å; N215-Q391 PolarHBondContact OD1-O 3.33Å; Q391-R393 PolarHBondContact O-N 2.88Å
392	V	94.4	Very high	93	Very high	27 Å²	27	61.8 Å²	61.8	16%	0.164	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	109.7	165.6	178.5	0	0	0	0	107.9	L173 V175 L212 L214 V409 Y411	L173-V392 HydrophobicContact CD2-CG1 4.47Å; V175-V392 HydrophobicContact CG2-CG2 3.88Å; L212-V392 HydrophobicContact CD1-CG1 3.63Å; L212-V392 HydrophobicContact CD1-CG2 4.38Å; L214-V392 HydrophobicContact CD2-CG2 4Å; V392-V409 HydrophobicContact CB-CG2 4.34Å; V392-V409 HydrophobicContact CG2-CG2 4.06Å; V392-Y411 PolarHBondContact N-OH 2.92Å
393	R	92.4	Very high	92.7	Very high	115 Å²	115	64.1 Å²	64.1	43%	0.434	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-39.7	-178	-60.7	-172.3	70	-157.9	-2.9	112.3	G213 L214 N215 R225 Q391	G213-R393 WeakPolarHBondContact O-CB 3.38Å; G213-R393 PolarHBondContact O-N 2.82Å; L214-R393 WeakPolarHBondContact O-CD 3.45Å; N215-R393 HydrophobicContact CB-CG 4.47Å; R225-R393 VanDerWaalsContact NH1-NH2 3.15Å; Q391-R393 PolarHBondContact O-N 2.88Å
394	Y	93.7	Very high	92.3	Very high	85 Å²	85	70.7 Å²	70.7	33%	0.333	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	155.2	175.8	62.3	-101.1	0	0	0	110.6	G213 K396	G213-Y394 PolarHBondContact N-O 2.95Å; G213-Y394 PolarHBondContact O-N 2.92Å; Y394-K396 HydrophobicContact CD2-CD 4.28Å; Y394-K396 HydrophobicContact CD2-CG 3.78Å; Y394-K396 HydrophobicContact CE2-CD 4.17Å; Y394-K396 HydrophobicContact CE2-CG 4.12Å
395	L	95.3	Very high	92.1	Very high	24 Å²	24	62.4 Å²	62.4	13%	0.126	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	112.1	160.6	-175.3	75.9	0	0	0	107.5	V171 L173 M200 L210 R211 L212 F255 I397 P407	V171-L395 HydrophobicContact CB-CD2 4.13Å; V171-L395 HydrophobicContact CG1-CD2 3.81Å; V171-L395 HydrophobicContact CG2-CD2 4.41Å; L173-L395 HydrophobicContact CD1-CD2 4Å; M200-L395 HydrophobicContact CE-CD1 4.49Å; M200-L395 HydrophobicContact CE-CD2 4.36Å; L210-L395 HydrophobicContact CB-CD1 4.41Å; L210-L395 HydrophobicContact CD2-CD1 4.15Å; L210-L395 HydrophobicContact CD2-CD2 4.1Å; L210-L395 HydrophobicContact CD2-CG 4.44Å; L210-L395 HydrophobicContact CG-CD1 4.34Å; R211-L395 WeakPolarHBondContact O-CA 3.28Å; L212-L395 HydrophobicContact CB-CD1 4.15Å; L212-L395 HydrophobicContact CD1-CD1 4.07Å; F255-L395 HydrophobicContact CZ-CD1 4.5Å; L395-I397 HydrophobicContact CD2-CD1 4.35Å; L395-I397 HydrophobicContact CD2-CG1 4.32Å; L395-I397 HydrophobicContact CG-CG1 4.44Å; L395-P407 HydrophobicContact CB-CB 4.31Å; L395-P407 HydrophobicContact CD2-CB 4.01Å
396	K	94.5	Very high	91.9	Very high	114 Å²	114	65.2 Å²	65.2	50%	0.496	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.3	173.5	-65.6	179.1	-178.1	-177.9	0	108.5	L210 R211 Y394	L210-K396 CarbonylContact C-O 3.53Å; L210-K396 VanDerWaalsContact CA-O 3.3Å; L210-K396 WeakPolarHBondContact CA-O 3.36Å; R211-K396 HydrophobicContact CB-CB 4.24Å; R211-K396 PolarHBondContact N-O 3.48Å; R211-K396 PolarHBondContact O-N 3.18Å; Y394-K396 HydrophobicContact CD2-CD 4.28Å; Y394-K396 HydrophobicContact CD2-CG 3.78Å; Y394-K396 HydrophobicContact CE2-CD 4.17Å; Y394-K396 HydrophobicContact CE2-CG 4.12Å
397	I	95.3	Very high	91.9	Very high	46 Å²	46	67 Å²	67	24%	0.236	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.5	177.1	-59.7	169.8	0	0	0	106.5	V171 L204 P208 L210 L395 Y403 A405	V171-I397 HydrophobicContact CG2-CD1 3.98Å; L204-I397 HydrophobicContact CD1-CG2 4.23Å; P208-I397 HydrophobicContact CB-CG2 4.25Å; L210-I397 HydrophobicContact CD1-CG1 4.24Å; L210-I397 HydrophobicContact CD1-CG2 4.17Å; L210-I397 HydrophobicContact CG-CG1 4.2Å; L395-I397 HydrophobicContact CD2-CD1 4.35Å; L395-I397 HydrophobicContact CD2-CG1 4.32Å; L395-I397 HydrophobicContact CG-CG1 4.44Å; I397-Y403 HydrophobicContact CG2-CE2 4.33Å; I397-A405 HydrophobicContact CD1-CB 3.47Å; I397-A405 VanDerWaalsContact CD1-CB 3.47Å; I397-A405 HydrophobicContact CG2-CB 4.47Å
398	I	94.3	Very high	92.1	Very high	77 Å²	77	72.6 Å²	72.6	40%	0.395	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	109.8	-177.2	-54.3	170.8	0	0	0	107.4	P208 E209 R211	P208-I398 CarbonylContact C-O 3.58Å; P208-I398 WeakPolarHBondContact CA-O 3.25Å; E209-I398 HydrophobicContact CB-CB 4.33Å; E209-I398 PolarHBondContact N-O 2.79Å; E209-I398 WeakPolarHBondContact O-CB 3.45Å; E209-I398 PolarHBondContact O-N 3.01Å; R211-I398 HydrophobicContact CG-CD1 4.48Å
399	E	92.2	Very high	92.3	Very high	36 Å²	36	74.8 Å²	74.8	17%	0.168	38%	0.376	C	S	.	.			trans	-134	143.5	177.7	179	56	-118.3	0	0	109.8	M207 P208 S401 G402 Y403	M207-E399 PolarHBondContact N-OE2 2.88Å; P208-E399 WeakPolarHBondContact CA-OE2 3.45Å; P208-E399 HydrophobicContact CB-CB 4.28Å; P208-E399 WeakPolarHBondContact CD-OE2 3.37Å; E399-S401 WeakPolarHBondContact CG-OG 3.42Å; E399-S401 PolarHBondContact O-N 2.88Å; E399-G402 PolarHBondContact O-N 2.76Å; E399-Y403 HydrophobicContact CB-CE1 4Å; E399-Y403 HydrophobicContact CG-CD1 4.1Å; E399-Y403 HydrophobicContact CG-CE1 3.5Å; E399-Y403 VanDerWaalsContact CG-CE1 3.5Å
400	K	88.6	Confident	92.5	Very high	209 Å²	209	80.3 Å²	80.3	91%	0.909	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-33.1	-175.4	-66.6	179.1	-178.2	174.1	0	112.6	G402	K400-G402 PolarHBondContact O-N 2.92Å
401	S	86.6	Confident	92.7	Very high	87 Å²	87	82.4 Å²	82.4	61%	0.608	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-11	177.8	60.2	0	0	0	0	113.7	E399 Y403	E399-S401 WeakPolarHBondContact CG-OG 3.42Å; E399-S401 PolarHBondContact O-N 2.88Å; S401-Y403 VanDerWaalsContact C-N 3.28Å; S401-Y403 PolarHBondContact O-N 2.55Å; S401-Y403 VanDerWaalsContact OG-CD1 3.26Å; S401-Y403 WeakPolarHBondContact OG-CD1 3.32Å
402	G	84.9	Confident	92.8	Very high	63 Å²	63	78.8 Å²	78.8	65%	0.649	39%	0.388	S	S	*	.			trans	65.7	22.4	173.1	0	0	0	0	0	115.3	E399 K400	E399-G402 PolarHBondContact O-N 2.76Å; K400-G402 PolarHBondContact O-N 2.92Å
403	Y	90.6	Very high	93	Very high	49 Å²	49	77.5 Å²	77.5	19%	0.192	38%	0.38	C	S	.	.			trans	-63.7	153.2	177.5	61.5	-111.9	0	0	0	112	N169 L204 S205 I397 E399 S401 A405	N169-Y403 HydrophobicContact CB-CD2 3.76Å; N169-Y403 HydrophobicContact CB-CE2 3.69Å; L204-Y403 HydrophobicContact CD2-CE2 4.03Å; S205-Y403 WeakPolarHBondContact O-CE1 3.41Å; S205-Y403 PolarHBondContact O-OH 3.34Å; I397-Y403 HydrophobicContact CG2-CE2 4.33Å; E399-Y403 HydrophobicContact CB-CE1 4Å; E399-Y403 HydrophobicContact CG-CD1 4.1Å; E399-Y403 HydrophobicContact CG-CE1 3.5Å; E399-Y403 VanDerWaalsContact CG-CE1 3.5Å; S401-Y403 VanDerWaalsContact C-N 3.28Å; S401-Y403 PolarHBondContact O-N 2.55Å; S401-Y403 VanDerWaalsContact OG-CD1 3.26Å; S401-Y403 WeakPolarHBondContact OG-CD1 3.32Å; Y403-A405 HydrophobicContact CD2-CB 4.1Å; Y403-A405 HydrophobicContact CE2-CB 3.9Å
404	Q	87.9	Confident	93.2	Very high	172 Å²	172	75.2 Å²	75.2	80%	0.804	37%	0.374	S	S	*	.			trans	-82.3	133.8	168.5	-167.7	176.4	6.5	0	0	109.8
405	A	90.9	Very high	93.3	Very high	17 Å²	17	73.2 Å²	73.2	14%	0.14	37%	0.37	C	S	.	.			trans	-125.6	150.5	174.5	0	0	0	0	0	110.7	N169 L204 I397 Y403 P407	N169-A405 HydrophobicContact CB-CB 3.86Å; N169-A405 VanDerWaalsContact O-CA 3.28Å; N169-A405 WeakPolarHBondContact O-CA 3.45Å; L204-A405 HydrophobicContact CD2-CB 3.77Å; I397-A405 HydrophobicContact CD1-CB 3.47Å; I397-A405 VanDerWaalsContact CD1-CB 3.47Å; I397-A405 HydrophobicContact CG2-CB 4.47Å; Y403-A405 HydrophobicContact CD2-CB 4.1Å; Y403-A405 HydrophobicContact CE2-CB 3.9Å; A405-P407 WeakPolarHBondContact O-CD 3.39Å
406	L	90.8	Very high	93.2	Very high	83 Å²	83	73.2 Å²	73.2	44%	0.435	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	107.6	-176.3	-63.1	174.5	0	0	0	110.4	N169 V171	N169-L406 PolarHBondContact O-N 2.81Å; N169-L406 VanDerWaalsContact O-N 3.1Å; V171-L406 PolarHBondContact N-O 3.41Å
407	P	93.6	Very high	93.2	Very high	66 Å²	66	72.9 Å²	72.9	43%	0.429	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.4	172.4	32.5	-32.3	0	0	0	111.1	V171 L395 A405	V171-P407 CarbonylContact O-C 3.56Å; V171-P407 WeakPolarHBondContact O-CA 3.39Å; L395-P407 HydrophobicContact CB-CB 4.31Å; L395-P407 HydrophobicContact CD2-CB 4.01Å; A405-P407 WeakPolarHBondContact O-CD 3.39Å
408	W	95.9	Very high	93.3	Very high	140 Å²	140	70.9 Å²	70.9	53%	0.53	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143.5	174.2	-61.4	93.4	0	0	0	109.2	V171 F172 L173	V171-W408 PolarHBondContact O-N 2.86Å; F172-W408 CarbonylContact C-O 3.51Å; F172-W408 HydrophobicContact CD1-CB 3.64Å; F172-W408 AromaticContact CD1-CD1 3.78Å; F172-W408 AromaticContact CD1-CG 3.86Å; F172-W408 HydrophobicContact CD1-CG 3.86Å; F172-W408 HydrophobicContact CE1-CB 4.1Å; F172-W408 AromaticContact CE1-CD1 3.43Å; F172-W408 VanDerWaalsContact CE1-CD1 3.43Å; F172-W408 AromaticContact CE1-CG 3.79Å; F172-W408 HydrophobicContact CE1-CG 3.79Å; F172-W408 HydrophobicContact CG-CB 4.45Å; F172-W408 AromaticContact CZ-CD1 4Å; L173-W408 WeakPolarHBondContact CD1-O 3.46Å; L173-W408 PolarHBondContact N-O 2.74Å
409	V	96.5	Very high	93.3	Very high	64 Å²	64	70.7 Å²	70.7	39%	0.388	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.5	174.3	62.1	0	0	0	0	110.2	L173 V175 V392 Y411	L173-V409 HydrophobicContact CB-CB 4.21Å; L173-V409 HydrophobicContact CB-CG2 4.07Å; L173-V409 CarbonylContact O-C 3.58Å; L173-V409 VanDerWaalsContact O-CA 3.29Å; L173-V409 WeakPolarHBondContact O-CA 3.27Å; V175-V409 HydrophobicContact CG2-CG2 4.07Å; V392-V409 HydrophobicContact CB-CG2 4.34Å; V392-V409 HydrophobicContact CG2-CG2 4.06Å; V409-Y411 HydrophobicContact CG1-CE2 4.12Å; V409-Y411 HydrophobicContact CG2-CE1 4.25Å; V409-Y411 HydrophobicContact CG2-CE2 3.89Å
410	R	96.4	Very high	93.4	Very high	117 Å²	117	69.4 Å²	69.4	44%	0.442	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154.9	164.7	62.8	175.8	178.5	167.7	5.2	110.2	L173 D174 V175	L173-R410 PolarHBondContact O-N 2.78Å; D174-R410 WeakPolarHBondContact OD1-CD 3.48Å; D174-R410 WeakPolarHBondContact OD1-CG 3.49Å; D174-R410 IonicContact OD1-CZ 2.77Å; D174-R410 IonicContact OD1-NE 3.39Å; D174-R410 PolarHBondContact OD1-NE 3.35Å; D174-R410 IonicContact OD1-NH2 2.9Å; D174-R410 IonicContact OD2-CZ 2.66Å; D174-R410 IonicContact OD2-NE 3.49Å; D174-R410 PolarHBondContact OD2-NE 2.76Å; D174-R410 IonicContact OD2-NH2 3.42Å; D174-R410 PolarHBondContact OD2-NH2 2.89Å; V175-R410 PolarHBondContact N-O 3.38Å
411	Y	97.8	Very high	93.6	Very high	46 Å²	46	66 Å²	66	18%	0.18	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.2	-178.4	-60.4	-86.5	0	0	0	108.3	V175 Y384 T386 V392 V409	V175-Y411 HydrophobicContact CB-CD1 3.57Å; V175-Y411 HydrophobicContact CB-CE1 3.91Å; V175-Y411 HydrophobicContact CB-CG 4.47Å; V175-Y411 HydrophobicContact CG1-CD1 3.76Å; V175-Y411 HydrophobicContact CG1-CE1 4.08Å; V175-Y411 HydrophobicContact CG2-CD1 4.02Å; V175-Y411 HydrophobicContact CG2-CE1 3.83Å; V175-Y411 CarbonylContact O-C 3.52Å; V175-Y411 WeakPolarHBondContact O-CA 3.31Å; Y384-Y411 VanDerWaalsContact CA-O 3.25Å; Y384-Y411 WeakPolarHBondContact CA-O 3.18Å; Y384-Y411 PolarHBondContact N-O 3.1Å; T386-Y411 HydrophobicContact CG2-CD1 3.31Å; T386-Y411 HydrophobicContact CG2-CE1 4.17Å; T386-Y411 HydrophobicContact CG2-CG 3.86Å; V392-Y411 PolarHBondContact N-OH 2.92Å; V409-Y411 HydrophobicContact CG1-CE2 4.12Å; V409-Y411 HydrophobicContact CG2-CE1 4.25Å; V409-Y411 HydrophobicContact CG2-CE2 3.89Å
412	I	97.3	Very high	93.5	Very high	18 Å²	18	63 Å²	63	9%	0.092	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	130.6	180	-56.7	174.7	0	0	0	106.8	V175 I176 E177 E381	V175-I412 PolarHBondContact O-N 3.18Å; I176-I412 CarbonylContact C-O 3.6Å; I176-I412 VanDerWaalsContact CA-O 3.31Å; I176-I412 WeakPolarHBondContact CA-O 3.39Å; E177-I412 PolarHBondContact N-O 3.37Å; E381-I412 HydrophobicContact CG-CG2 3.64Å
413	T	97.1	Very high	92.8	Very high	0 Å²	0	68 Å²	68	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.9	169.4	-60.3	0	0	0	0	108.7	E177 V179 L276 F380 E381 I382 F385 T387	E177-T413 HydrophobicContact CB-CG2 4.42Å; E177-T413 CarbonylContact O-C 3.54Å; E177-T413 WeakPolarHBondContact O-CA 3.2Å; V179-T413 HydrophobicContact CG2-CG2 3.72Å; L276-T413 HydrophobicContact CD1-CG2 3.69Å; F380-T413 HydrophobicContact CE2-CG2 4.38Å; E381-T413 CarbonylContact C-O 3.56Å; E381-T413 WeakPolarHBondContact CA-O 3.06Å; I382-T413 PolarHBondContact N-O 3.42Å; I382-T413 PolarHBondContact O-N 3.48Å; F385-T413 HydrophobicContact CD1-CG2 4.47Å; F385-T413 PolarHBondContact O-OG1 3.01Å; T387-T413 WeakPolarHBondContact OG1-CG2 3.25Å
414	Q	96.9	Very high	92.9	Very high	66 Å²	66	68.9 Å²	68.9	31%	0.308	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	173.6	179.6	64	-177.2	17	0	0	110.8	I176 E177 S178 V179 F380	I176-Q414 HydrophobicContact CG2-CG 4.14Å; E177-Q414 PolarHBondContact O-N 3.3Å; S178-Q414 WeakPolarHBondContact CA-O 3.37Å; S178-Q414 PolarHBondContact OG-NE2 2.99Å; V179-Q414 PolarHBondContact N-O 3.39Å; F380-Q414 VanDerWaalsContact O-CA 3.25Å; F380-Q414 WeakPolarHBondContact O-CA 3.2Å
415	N	95.1	Very high	93.1	Very high	44 Å²	44	63.5 Å²	63.5	24%	0.235	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	141	169.5	65.1	-77.5	0	0	0	110.7	V378 K379 F380	V378-N415 VanDerWaalsContact O-CB 3.23Å; V378-N415 WeakPolarHBondContact O-CB 3.44Å; K379-N415 VanDerWaalsContact CA-OD1 3.26Å; K379-N415 WeakPolarHBondContact CA-OD1 3.31Å; F380-N415 HydrophobicContact CD1-CB 3.92Å; F380-N415 HydrophobicContact CE1-CB 3.72Å; F380-N415 HydrophobicContact CZ-CB 4.29Å; F380-N415 PolarHBondContact N-OD1 3.39Å; F380-N415 VanDerWaalsContact N-OD1 3.1Å; F380-N415 PolarHBondContact O-N 3.01Å; F380-N415 PolarHBondContact O-OD1 3.45Å
416	G	94.5	Very high	93.2	Very high	23 Å²	23	66.1 Å²	66.1	24%	0.237	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-123.4	151.4	0	0	0	0	0	108.5	V179 N180 Y418	V179-G416 PolarHBondContact O-N 3.46Å; N180-G416 VanDerWaalsContact OD1-CA 3.25Å; N180-G416 WeakPolarHBondContact OD1-CA 3.25Å; G416-Y418 VanDerWaalsContact C-N 3.34Å; G416-Y418 PolarHBondContact O-N 3.01Å
417	D	94.5	Very high	93.4	Very high	108 Å²	108	65.1 Å²	65.1	58%	0.578	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	84	170.1	-68.6	-37.4	0	0	0	110.2	N180 L181	N180-D417 CarbonylContact C-O 3.57Å; N180-D417 WeakPolarHBondContact CA-O 3.42Å; N180-D417 PolarHBondContact OD1-N 3.19Å; L181-D417 PolarHBondContact N-O 3.27Å
418	Y	96.2	Very high	93.4	Very high	3 Å²	3	65 Å²	65	1%	0.012	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	88.9	-177.5	-158.7	-82	0	0	0	110.9	V179 L181 P275 I277 S377 V378 F380 G416 L420	V179-Y418 HydrophobicContact CG1-CD2 4.34Å; V179-Y418 HydrophobicContact CG1-CE2 4.22Å; L181-Y418 HydrophobicContact CB-CD2 3.63Å; L181-Y418 HydrophobicContact CB-CE2 3.73Å; L181-Y418 HydrophobicContact CB-CG 4.1Å; L181-Y418 HydrophobicContact CD2-CD1 4.29Å; L181-Y418 HydrophobicContact CD2-CD2 4.23Å; L181-Y418 HydrophobicContact CD2-CE1 3.71Å; L181-Y418 HydrophobicContact CD2-CE2 3.63Å; L181-Y418 HydrophobicContact CG-CE2 4.32Å; P275-Y418 WeakPolarHBondContact CB-OH 3.49Å; I277-Y418 VanDerWaalsContact C-OH 3.28Å; I277-Y418 PolarHBondContact N-OH 3.12Å; I277-Y418 WeakPolarHBondContact O-CE1 3.3Å; I277-Y418 PolarHBondContact O-OH 3.06Å; S377-Y418 VanDerWaalsContact CA-O 3.28Å; S377-Y418 WeakPolarHBondContact CA-O 3.25Å; V378-Y418 HydrophobicContact CB-CD1 3.72Å; V378-Y418 HydrophobicContact CB-CE1 4.16Å; V378-Y418 HydrophobicContact CG2-CD1 3.97Å; V378-Y418 HydrophobicContact CG2-CE1 4.16Å; V378-Y418 PolarHBondContact N-O 3.2Å; V378-Y418 VanDerWaalsContact N-O 3.16Å; F380-Y418 HydrophobicContact CE1-CD1 4.47Å; F380-Y418 AromaticContact CE1-CD2 3.7Å; F380-Y418 HydrophobicContact CE1-CD2 3.7Å; F380-Y418 AromaticContact CE1-CE2 3.81Å; F380-Y418 HydrophobicContact CE1-CE2 3.81Å; F380-Y418 HydrophobicContact CE1-CG 4.03Å; F380-Y418 HydrophobicContact CZ-CD2 4.2Å; F380-Y418 HydrophobicContact CZ-CE2 4.16Å; G416-Y418 VanDerWaalsContact C-N 3.34Å; G416-Y418 PolarHBondContact O-N 3.01Å; Y418-L420 HydrophobicContact CD1-CD1 4.03Å; Y418-L420 HydrophobicContact CE1-CD1 3.96Å
419	Q	95.4	Very high	93.2	Very high	74 Å²	74	60 Å²	60	35%	0.346	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.3	-168.6	-64.3	-178.6	0.7	0	0	112.6	L181 L182 V183 P375 I376	L181-Q419 PolarHBondContact O-N 3.45Å; L181-Q419 VanDerWaalsContact O-O 3.08Å; L182-Q419 WeakPolarHBondContact CA-O 3.36Å; L182-Q419 HydrophobicContact CD1-CB 4.27Å; V183-Q419 PolarHBondContact N-O 3.35Å; P375-Q419 HydrophobicContact CB-CB 4.03Å; P375-Q419 HydrophobicContact CG-CB 3.95Å; P375-Q419 HydrophobicContact CG-CG 4.07Å; I376-Q419 CarbonylContact O-C 3.59Å; I376-Q419 WeakPolarHBondContact O-CA 3.49Å
420	L	94.8	Very high	93	Very high	8 Å²	8	59.7 Å²	59.7	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.3	175.4	-57.6	95.3	0	0	0	108.8	V183 I279 P375 I376 V378 Y418 T422	V183-L420 HydrophobicContact CB-CB 4.19Å; V183-L420 HydrophobicContact CB-CD2 4.11Å; V183-L420 HydrophobicContact CB-CG 4.04Å; V183-L420 HydrophobicContact CG2-CD2 3.82Å; V183-L420 HydrophobicContact CG2-CG 3.87Å; I279-L420 HydrophobicContact CB-CD1 4.43Å; I279-L420 HydrophobicContact CB-CD2 4.05Å; I279-L420 HydrophobicContact CG1-CD1 4.24Å; P375-L420 CarbonylContact C-O 3.53Å; P375-L420 WeakPolarHBondContact CA-O 3.38Å; P375-L420 WeakPolarHBondContact CB-O 3.48Å; I376-L420 HydrophobicContact CB-CB 4.43Å; I376-L420 PolarHBondContact N-O 3.41Å; I376-L420 PolarHBondContact O-N 3.27Å; V378-L420 HydrophobicContact CG2-CD1 4.13Å; Y418-L420 HydrophobicContact CD1-CD1 4.03Å; Y418-L420 HydrophobicContact CE1-CD1 3.96Å; L420-T422 PolarHBondContact O-N 3.31Å
421	R	92.6	Very high	92.7	Very high	138 Å²	138	55.3 Å²	55.3	52%	0.521	27%	0.267	S	S	.	.			trans	-66.9	134.1	179.3	-67.3	-179.4	177.3	173.3	-0.2	110	L182 V183 A185 P375	L182-R421 HydrophobicContact CD1-CG 4.28Å; V183-R421 WeakPolarHBondContact O-CB 3.39Å; V183-R421 WeakPolarHBondContact O-CG 3.36Å; V183-R421 PolarHBondContact O-N 3.24Å; A185-R421 WeakPolarHBondContact CA-O 3.4Å; P375-R421 HydrophobicContact CB-CG 4.3Å
422	T	83.2	Confident	92.3	Very high	23 Å²	23	56.1 Å²	56.1	14%	0.141	28%	0.275	C	S	.	.			trans	-87.7	164.6	175.7	56.4	0	0	0	0	110.6	A185 I283 I376 L420	A185-T422 WeakPolarHBondContact CB-O 3.26Å; I283-T422 HydrophobicContact CD1-CG2 4.45Å; I376-T422 HydrophobicContact CD1-CG2 3.6Å; I376-T422 HydrophobicContact CG1-CG2 3.56Å; L420-T422 PolarHBondContact O-N 3.31Å
423	Q	69.8	Low	91.8	Very high	168 Å²	168	59.5 Å²	59.5	79%	0.785	29%	0.291	S	S	*	.			trans	-82	0	177	-72.9	-175.5	5.6	0	0	112.7	A185 K373	A185-Q423 HydrophobicContact CB-CG 3.94Å; A185-Q423 WeakPolarHBondContact O-CG 3.29Å; A185-Q423 PolarHBondContact O-NE2 2.71Å; K373-Q423 PolarHBondContact NZ-O 3.14Å; K373-Q423 PolarHBondContact NZ-OXT 2.73Å

Retrieved 423 of 423 residues in 255.5 ms (Link to these results)

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