A0A060YJS6_ONCMY Loading...

Tyrosyl-DNA phosphodiesterase 2

AlphaFold DB , UniProt , Accession A0A060YJS6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene tdp2b, Length 381 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50	Low	60.1	Low	216 Å²	216	101.2 Å²	101.2	100%	1.064	57%	0.567	S	S	*	*				0	-31.7	0	-68.9	-177.1	-172.3	0	0	113.6	N3	M1-N3 PolarHBondContact O-N 3.47Å
2	S	55.7	Low	61.8	Low	84 Å²	84	102.7 Å²	102.7	59%	0.587	57%	0.566	S	S	*	*	H	α-helix	trans	-68.8	-29.5	-178	170.6	0	0	0	0	116.4
3	N	51.4	Low	63.2	Low	136 Å²	136	105.2 Å²	105.2	73%	0.727	57%	0.571	S	S	*	*	H	α-helix	trans	-80.5	-22.1	-179.2	-81.2	-8.3	0	0	0	114.3	M1 S7	M1-N3 PolarHBondContact O-N 3.47Å; N3-S7 PolarHBondContact O-N 3.45Å
4	I	54.5	Low	64.8	Low	121 Å²	121	103.8 Å²	103.8	62%	0.621	57%	0.568	S	S	*	*	H	α-helix	trans	-78.7	-40.7	-179.2	-62.9	169.8	0	0	0	110.3	K6 S7 V8	I4-K6 VanDerWaalsContact C-N 3.34Å; I4-K6 PolarHBondContact O-N 3.4Å; I4-S7 PolarHBondContact O-N 3.26Å; I4-S7 PolarHBondContact O-OG 2.71Å; I4-V8 VanDerWaalsContact O-CG2 3.28Å; I4-V8 WeakPolarHBondContact O-CG2 3.21Å; I4-V8 PolarHBondContact O-N 2.76Å; I4-V8 VanDerWaalsContact O-N 3.16Å
5	S	56.8	Low	66.6	Low	85 Å²	85	104.2 Å²	104.2	59%	0.594	56%	0.558	S	S	*	*	H	α-helix	trans	-64.4	-36.5	178.2	146.9	0	0	0	0	112.8	S9	S5-S9 PolarHBondContact O-N 3.41Å
6	K	56.1	Low	68.1	Low	138 Å²	138	102.6 Å²	102.6	60%	0.6	55%	0.553	S	S	*	*	H	α-helix	trans	-73.4	-33.6	176.7	-78.6	-176.4	174	-177.6	0	113.3	I4 S9 T10	I4-K6 VanDerWaalsContact C-N 3.34Å; I4-K6 PolarHBondContact O-N 3.4Å; K6-S9 PolarHBondContact O-OG 2.67Å; K6-T10 WeakPolarHBondContact O-CG2 3.12Å; K6-T10 PolarHBondContact O-N 3.11Å; K6-T10 PolarHBondContact O-OG1 3.24Å; K6-T10 VanDerWaalsContact O-OG1 3.1Å
7	S	57.7	Low	69.5	Low	55 Å²	55	98.8 Å²	98.8	39%	0.385	54%	0.543	S	S	.	.	H	α-helix	trans	-73.3	-32.6	178.2	81.9	0	0	0	0	112.1	N3 I4 T10 L11	N3-S7 PolarHBondContact O-N 3.45Å; I4-S7 PolarHBondContact O-N 3.26Å; I4-S7 PolarHBondContact O-OG 2.71Å; S7-T10 WeakPolarHBondContact CA-OG1 3.27Å; S7-T10 PolarHBondContact O-OG1 3.17Å; S7-L11 WeakPolarHBondContact O-CB 3.42Å; S7-L11 WeakPolarHBondContact O-CD1 3.18Å; S7-L11 VanDerWaalsContact O-CG 3.29Å; S7-L11 WeakPolarHBondContact O-CG 3.23Å; S7-L11 PolarHBondContact O-N 3.04Å; S7-L11 VanDerWaalsContact O-N 3.14Å
8	V	62.1	Low	70.8	Confident	67 Å²	67	95.4 Å²	95.4	41%	0.406	52%	0.524	S	S	.	.	H	α-helix	trans	-68.1	-43.9	176.2	174	0	0	0	0	110.8	I4 T10 L11 E12	I4-V8 VanDerWaalsContact O-CG2 3.28Å; I4-V8 WeakPolarHBondContact O-CG2 3.21Å; I4-V8 PolarHBondContact O-N 2.76Å; I4-V8 VanDerWaalsContact O-N 3.16Å; V8-T10 PolarHBondContact O-N 2.75Å; V8-L11 PolarHBondContact O-N 3.34Å; V8-E12 WeakPolarHBondContact O-CG 3.33Å; V8-E12 PolarHBondContact O-N 3.46Å
9	S	64.2	Low	72	Confident	48 Å²	48	90.8 Å²	90.8	34%	0.336	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-40.4	177.8	66.9	0	0	0	0	112.6	S5 K6 L11 E12 E13	S5-S9 PolarHBondContact O-N 3.41Å; K6-S9 PolarHBondContact O-OG 2.67Å; S9-L11 VanDerWaalsContact C-N 3.33Å; S9-L11 PolarHBondContact O-N 2.66Å; S9-E12 PolarHBondContact O-N 2.98Å; S9-E13 WeakPolarHBondContact O-CG 3.47Å; S9-E13 PolarHBondContact O-N 2.98Å
10	T	74.6	Confident	73.1	Confident	71 Å²	71	91.2 Å²	91.2	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-67.7	-32.8	177	49.2	0	0	0	0	113	K6 S7 V8 T14	K6-T10 WeakPolarHBondContact O-CG2 3.12Å; K6-T10 PolarHBondContact O-N 3.11Å; K6-T10 PolarHBondContact O-OG1 3.24Å; K6-T10 VanDerWaalsContact O-OG1 3.1Å; S7-T10 WeakPolarHBondContact CA-OG1 3.27Å; S7-T10 PolarHBondContact O-OG1 3.17Å; V8-T10 PolarHBondContact O-N 2.75Å; T10-T14 WeakPolarHBondContact O-CB 3.23Å; T10-T14 PolarHBondContact O-N 3.5Å; T10-T14 VanDerWaalsContact O-N 3.1Å; T10-T14 PolarHBondContact O-OG1 2.96Å
11	L	78.6	Confident	74.1	Confident	92 Å²	92	91.9 Å²	91.9	48%	0.482	50%	0.5	S	S	.	.	H	α-helix	trans	-71.8	-40.1	176.1	-80.1	164.3	0	0	0	111.4	S7 V8 S9 T14 R15	S7-L11 WeakPolarHBondContact O-CB 3.42Å; S7-L11 WeakPolarHBondContact O-CD1 3.18Å; S7-L11 VanDerWaalsContact O-CG 3.29Å; S7-L11 WeakPolarHBondContact O-CG 3.23Å; S7-L11 PolarHBondContact O-N 3.04Å; S7-L11 VanDerWaalsContact O-N 3.14Å; V8-L11 PolarHBondContact O-N 3.34Å; S9-L11 VanDerWaalsContact C-N 3.33Å; S9-L11 PolarHBondContact O-N 2.66Å; L11-T14 PolarHBondContact O-N 3.07Å; L11-R15 WeakPolarHBondContact O-CB 3.39Å; L11-R15 WeakPolarHBondContact O-CG 3.13Å; L11-R15 PolarHBondContact O-N 2.66Å
12	E	79.5	Confident	76.3	Confident	119 Å²	119	81.6 Å²	81.6	56%	0.556	45%	0.45	S	S	*	.	H	α-helix	trans	-64	-46.2	175.6	-73.8	175.1	170.6	0	0	111.5	V8 S9 T14 R15 T16	V8-E12 WeakPolarHBondContact O-CG 3.33Å; V8-E12 PolarHBondContact O-N 3.46Å; S9-E12 PolarHBondContact O-N 2.98Å; E12-T14 VanDerWaalsContact C-N 3.33Å; E12-T14 PolarHBondContact O-N 3.28Å; E12-R15 PolarHBondContact O-N 3.42Å; E12-T16 PolarHBondContact O-N 3.34Å; E12-T16 PolarHBondContact O-OG1 3.25Å; E12-T16 VanDerWaalsContact O-OG1 3.09Å
13	E	80.2	Confident	78.2	Confident	136 Å²	136	79.5 Å²	79.5	64%	0.636	43%	0.433	S	S	*	.	H	α-helix	trans	-59.9	-42	175.8	-72.6	169	178.4	0	0	112.2	S9 T16 G17	S9-E13 WeakPolarHBondContact O-CG 3.47Å; S9-E13 PolarHBondContact O-N 2.98Å; E13-T16 PolarHBondContact O-N 3.11Å; E13-G17 PolarHBondContact O-N 3.46Å
14	T	86.2	Confident	80.2	Confident	85 Å²	85	78 Å²	78	52%	0.521	43%	0.434	S	S	.	.	H	α-helix	trans	-63.6	-43.1	176.9	-56.7	0	0	0	0	111.2	T10 L11 E12 G17 L18	T10-T14 WeakPolarHBondContact O-CB 3.23Å; T10-T14 PolarHBondContact O-N 3.5Å; T10-T14 VanDerWaalsContact O-N 3.1Å; T10-T14 PolarHBondContact O-OG1 2.96Å; L11-T14 PolarHBondContact O-N 3.07Å; E12-T14 VanDerWaalsContact C-N 3.33Å; E12-T14 PolarHBondContact O-N 3.28Å; T14-G17 PolarHBondContact O-N 3.02Å; T14-L18 WeakPolarHBondContact O-CG 3.42Å; T14-L18 PolarHBondContact O-N 2.99Å
15	R	90.9	Very high	82.1	Confident	110 Å²	110	76 Å²	76	42%	0.415	43%	0.427	S	S	.	.	H	α-helix	trans	-66.8	-40.8	179.3	-77.6	-179.8	165.1	166.9	-1.9	112.4	L11 E12 G17 L18 C19 W42	L11-R15 WeakPolarHBondContact O-CB 3.39Å; L11-R15 WeakPolarHBondContact O-CG 3.13Å; L11-R15 PolarHBondContact O-N 2.66Å; E12-R15 PolarHBondContact O-N 3.42Å; R15-G17 VanDerWaalsContact C-N 3.34Å; R15-L18 PolarHBondContact O-N 3.39Å; R15-C19 PolarHBondContact O-N 2.83Å; R15-C19 PolarHBondContact O-SG 2.87Å; R15-W42 HydrophobicContact CB-CE3 3.92Å; R15-W42 HydrophobicContact CB-CH2 3.51Å; R15-W42 HydrophobicContact CB-CZ2 4.23Å; R15-W42 HydrophobicContact CB-CZ3 3.34Å; R15-W42 VanDerWaalsContact CD-CZ2 3.46Å; R15-W42 HydrophobicContact CG-CD2 3.77Å; R15-W42 HydrophobicContact CG-CE3 3.53Å; R15-W42 HydrophobicContact CG-CH2 3.61Å; R15-W42 HydrophobicContact CG-CZ2 3.86Å; R15-W42 HydrophobicContact CG-CZ3 3.45Å; R15-W42 VanDerWaalsContact CG-CZ3 3.45Å; R15-W42 VanDerWaalsContact NE-CE2 3.25Å; R15-W42 WeakPolarHBondContact O-CZ3 3.44Å
16	T	90.9	Very high	83.7	Confident	79 Å²	79	73.1 Å²	73.1	49%	0.485	41%	0.406	S	S	.	.	H	α-helix	trans	-61.3	-44	173.4	-59	0	0	0	0	111.2	E12 E13 L18 C19 D20	E12-T16 PolarHBondContact O-N 3.34Å; E12-T16 PolarHBondContact O-OG1 3.25Å; E12-T16 VanDerWaalsContact O-OG1 3.09Å; E13-T16 PolarHBondContact O-N 3.11Å; T16-L18 VanDerWaalsContact C-N 3.34Å; T16-L18 PolarHBondContact O-N 3.02Å; T16-C19 WeakPolarHBondContact O-CB 3.42Å; T16-C19 PolarHBondContact O-N 2.9Å; T16-C19 VanDerWaalsContact O-N 3.14Å; T16-D20 PolarHBondContact O-N 3.5Å
17	G	91.5	Very high	85.4	Confident	37 Å²	37	69.9 Å²	69.9	38%	0.381	41%	0.411	S	S	.	.	H	α-helix	trans	-59.6	-40.9	175.8	0	0	0	0	0	113.6	E13 T14 R15 D20 E21	E13-G17 PolarHBondContact O-N 3.46Å; T14-G17 PolarHBondContact O-N 3.02Å; R15-G17 VanDerWaalsContact C-N 3.34Å; G17-D20 PolarHBondContact O-N 3.38Å; G17-E21 PolarHBondContact O-N 3.49Å
18	L	93.1	Very high	87	Confident	39 Å²	39	68.4 Å²	68.4	20%	0.204	40%	0.401	C	S	.	.	H	α-helix	trans	-65	-39.9	174.2	-70	170.5	0	0	0	112.1	T14 R15 T16 D20 E21 F22 L37 W42 M44	T14-L18 WeakPolarHBondContact O-CG 3.42Å; T14-L18 PolarHBondContact O-N 2.99Å; R15-L18 PolarHBondContact O-N 3.39Å; T16-L18 VanDerWaalsContact C-N 3.34Å; T16-L18 PolarHBondContact O-N 3.02Å; L18-D20 VanDerWaalsContact C-N 3.34Å; L18-D20 PolarHBondContact O-N 2.93Å; L18-E21 PolarHBondContact O-N 3.41Å; L18-F22 WeakPolarHBondContact O-CB 3.32Å; L18-F22 PolarHBondContact O-N 2.91Å; L18-L37 HydrophobicContact CB-CD1 3.97Å; L18-L37 HydrophobicContact CB-CD2 4.47Å; L18-W42 HydrophobicContact CB-CE3 4.49Å; L18-W42 HydrophobicContact CD1-CB 4.39Å; L18-W42 HydrophobicContact CD1-CE3 4.09Å; L18-M44 HydrophobicContact CB-CE 4.21Å; L18-M44 HydrophobicContact CD2-CE 3.8Å; L18-M44 WeakPolarHBondContact O-CE 3.42Å
19	C	94.1	Very high	88.5	Confident	8 Å²	8	69.6 Å²	69.6	5%	0.054	41%	0.405	C	S	.	.	H	α-helix	trans	-62.4	-42	175.1	-71	0	0	0	0	111.8	R15 T16 F22 V23 A33 L37	R15-C19 PolarHBondContact O-N 2.83Å; R15-C19 PolarHBondContact O-SG 2.87Å; T16-C19 WeakPolarHBondContact O-CB 3.42Å; T16-C19 PolarHBondContact O-N 2.9Å; T16-C19 VanDerWaalsContact O-N 3.14Å; C19-F22 PolarHBondContact O-N 2.92Å; C19-V23 WeakPolarHBondContact O-CB 3.27Å; C19-V23 VanDerWaalsContact O-CG2 3.28Å; C19-V23 WeakPolarHBondContact O-CG2 3.47Å; C19-V23 PolarHBondContact O-N 2.95Å; C19-A33 HydrophobicContact CB-CB 4.24Å; C19-L37 HydrophobicContact CB-CD1 4.46Å
20	D	94.5	Very high	89.8	Confident	97 Å²	97	70.5 Å²	70.5	52%	0.519	41%	0.411	S	S	.	.	H	α-helix	trans	-65.7	-42.4	179.5	-68.7	-21.6	0	0	0	111.8	T16 G17 L18 V23 S24	T16-D20 PolarHBondContact O-N 3.5Å; G17-D20 PolarHBondContact O-N 3.38Å; L18-D20 VanDerWaalsContact C-N 3.34Å; L18-D20 PolarHBondContact O-N 2.93Å; D20-V23 PolarHBondContact O-N 3.02Å; D20-S24 WeakPolarHBondContact O-CB 3.1Å; D20-S24 PolarHBondContact O-N 3.19Å
21	E	94.1	Very high	90.6	Very high	106 Å²	106	70.4 Å²	70.4	50%	0.495	42%	0.418	S	S	.	.	H	α-helix	trans	-62.9	-45.9	174.8	179.9	178.5	-176.8	0	0	111.3	G17 L18 V23 S24 V25 M44	G17-E21 PolarHBondContact O-N 3.49Å; L18-E21 PolarHBondContact O-N 3.41Å; E21-V23 PolarHBondContact O-N 3.25Å; E21-S24 WeakPolarHBondContact O-CB 3.33Å; E21-S24 PolarHBondContact O-N 3.04Å; E21-S24 VanDerWaalsContact O-N 3.16Å; E21-V25 WeakPolarHBondContact O-CG2 3.44Å; E21-V25 PolarHBondContact O-N 2.76Å; E21-V25 VanDerWaalsContact O-N 3.08Å; E21-M44 HydrophobicContact CB-CE 3.73Å; E21-M44 HydrophobicContact CG-CE 3.73Å
22	F	95.5	Very high	91.1	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-58.4	-49.4	177	-175.2	-76.8	0	0	0	111	L18 C19 S24 V25 T26 A33 Y36 L37 M44 A47 L48 F51	L18-F22 WeakPolarHBondContact O-CB 3.32Å; L18-F22 PolarHBondContact O-N 2.91Å; C19-F22 PolarHBondContact O-N 2.92Å; F22-S24 VanDerWaalsContact C-N 3.27Å; F22-S24 PolarHBondContact O-N 3.1Å; F22-V25 PolarHBondContact O-N 2.88Å; F22-V25 VanDerWaalsContact O-N 3.07Å; F22-T26 HydrophobicContact CD1-CG2 3.81Å; F22-T26 HydrophobicContact CE1-CG2 3.52Å; F22-T26 HydrophobicContact CE2-CG2 4.34Å; F22-T26 HydrophobicContact CG-CG2 4.36Å; F22-T26 HydrophobicContact CZ-CG2 3.83Å; F22-T26 WeakPolarHBondContact O-CG2 3.48Å; F22-T26 PolarHBondContact O-N 3.28Å; F22-T26 PolarHBondContact O-OG1 3.45Å; F22-A33 HydrophobicContact CB-CB 4.03Å; F22-A33 HydrophobicContact CD1-CB 3.41Å; F22-A33 VanDerWaalsContact CD1-CB 3.41Å; F22-A33 HydrophobicContact CE1-CB 4.07Å; F22-A33 HydrophobicContact CG-CB 3.93Å; F22-Y36 HydrophobicContact CZ-CD2 4.33Å; F22-Y36 HydrophobicContact CZ-CG 4.17Å; F22-L37 HydrophobicContact CB-CD1 4.19Å; F22-L37 HydrophobicContact CD2-CD2 4.5Å; F22-L37 HydrophobicContact CD2-CG 4.28Å; F22-M44 HydrophobicContact CB-CE 4.16Å; F22-M44 HydrophobicContact CB-SD 3.98Å; F22-M44 HydrophobicContact CD2-SD 3.98Å; F22-M44 HydrophobicContact CG-SD 4.47Å; F22-A47 HydrophobicContact CD2-CB 4.21Å; F22-A47 HydrophobicContact CE2-CB 3.82Å; F22-L48 HydrophobicContact CD2-CD2 3.64Å; F22-L48 HydrophobicContact CD2-CG 4.04Å; F22-L48 HydrophobicContact CE2-CD2 3.76Å; F22-L48 HydrophobicContact CE2-CG 4.17Å; F22-L48 HydrophobicContact CG-CD2 4.2Å; F22-L48 HydrophobicContact CZ-CD2 4.39Å; F22-F51 HydrophobicContact CE1-CD2 4.17Å; F22-F51 HydrophobicContact CE1-CG 4.3Å; F22-F51 HydrophobicContact CE2-CB 4.32Å; F22-F51 HydrophobicContact CZ-CB 3.66Å; F22-F51 AromaticContact CZ-CD2 3.97Å; F22-F51 HydrophobicContact CZ-CD2 3.97Å; F22-F51 AromaticContact CZ-CG 3.82Å; F22-F51 HydrophobicContact CZ-CG 3.82Å
23	V	95.3	Very high	91.7	Very high	41 Å²	41	62.6 Å²	62.6	25%	0.248	38%	0.382	C	S	.	.	H	α-helix	trans	-57	-41	176.3	162.9	0	0	0	0	111.4	C19 D20 E21 V25 G27 S28 A33	C19-V23 WeakPolarHBondContact O-CB 3.27Å; C19-V23 VanDerWaalsContact O-CG2 3.28Å; C19-V23 WeakPolarHBondContact O-CG2 3.47Å; C19-V23 PolarHBondContact O-N 2.95Å; D20-V23 PolarHBondContact O-N 3.02Å; E21-V23 PolarHBondContact O-N 3.25Å; V23-V25 VanDerWaalsContact C-N 3.28Å; V23-V25 PolarHBondContact O-N 3.46Å; V23-G27 VanDerWaalsContact O-CA 3.28Å; V23-G27 WeakPolarHBondContact O-CA 3.38Å; V23-G27 PolarHBondContact O-N 3.14Å; V23-S28 VanDerWaalsContact CG1-O 3.27Å; V23-S28 WeakPolarHBondContact CG1-O 3.39Å; V23-A33 HydrophobicContact CG2-CB 3.82Å
24	S	94.9	Very high	92.3	Very high	105 Å²	105	61.4 Å²	61.4	73%	0.734	38%	0.377	S	S	*	.	H	α-helix	trans	-65.1	-31.3	178	-174.5	0	0	0	0	113.1	D20 E21 F22	D20-S24 WeakPolarHBondContact O-CB 3.1Å; D20-S24 PolarHBondContact O-N 3.19Å; E21-S24 WeakPolarHBondContact O-CB 3.33Å; E21-S24 PolarHBondContact O-N 3.04Å; E21-S24 VanDerWaalsContact O-N 3.16Å; F22-S24 VanDerWaalsContact C-N 3.27Å; F22-S24 PolarHBondContact O-N 3.1Å
25	V	92.9	Very high	92.7	Very high	78 Å²	78	60.2 Å²	60.2	47%	0.473	37%	0.371	S	S	.	.	H	α-helix	trans	-83.4	-42.5	180	174.9	0	0	0	0	111.4	E21 F22 V23 L48 F52	E21-V25 WeakPolarHBondContact O-CG2 3.44Å; E21-V25 PolarHBondContact O-N 2.76Å; E21-V25 VanDerWaalsContact O-N 3.08Å; F22-V25 PolarHBondContact O-N 2.88Å; F22-V25 VanDerWaalsContact O-N 3.07Å; V23-V25 VanDerWaalsContact C-N 3.28Å; V23-V25 PolarHBondContact O-N 3.46Å; V25-L48 HydrophobicContact CB-CD2 4.09Å; V25-L48 HydrophobicContact CG1-CD1 4.12Å; V25-L48 HydrophobicContact CG1-CD2 3.8Å; V25-F52 HydrophobicContact CG1-CE2 4.42Å; V25-F52 HydrophobicContact CG1-CZ 4.42Å
26	T	91.3	Very high	92.8	Very high	25 Å²	25	57.3 Å²	57.3	15%	0.153	36%	0.36	C	S	.	.	H	α-helix	trans	-91.5	-21.5	-172.8	62.5	0	0	0	0	113.8	F22 S28 L48 F51 F52	F22-T26 HydrophobicContact CD1-CG2 3.81Å; F22-T26 HydrophobicContact CE1-CG2 3.52Å; F22-T26 HydrophobicContact CE2-CG2 4.34Å; F22-T26 HydrophobicContact CG-CG2 4.36Å; F22-T26 HydrophobicContact CZ-CG2 3.83Å; F22-T26 WeakPolarHBondContact O-CG2 3.48Å; F22-T26 PolarHBondContact O-N 3.28Å; F22-T26 PolarHBondContact O-OG1 3.45Å; T26-S28 PolarHBondContact O-N 2.69Å; T26-S28 WeakPolarHBondContact OG1-CB 3.41Å; T26-S28 PolarHBondContact OG1-N 3.1Å; T26-S28 VanDerWaalsContact OG1-N 3.13Å; T26-S28 PolarHBondContact OG1-OG 2.8Å; T26-L48 HydrophobicContact CG2-CD2 3.42Å; T26-L48 VanDerWaalsContact CG2-CD2 3.42Å; T26-F51 VanDerWaalsContact CB-CE1 3.47Å; T26-F51 HydrophobicContact CG2-CD1 3.47Å; T26-F51 VanDerWaalsContact CG2-CD1 3.47Å; T26-F51 HydrophobicContact CG2-CE1 3.62Å; T26-F51 HydrophobicContact CG2-CG 4.04Å; T26-F51 HydrophobicContact CG2-CZ 4.28Å; T26-F52 HydrophobicContact CG2-CE2 4.38Å; T26-F52 HydrophobicContact CG2-CZ 4.1Å
27	G	90.8	Very high	92.9	Very high	70 Å²	70	53.5 Å²	53.5	72%	0.722	34%	0.337	S	S	*	.			trans	67.9	13.7	-168.5	0	0	0	0	0	113.8	V23	V23-G27 VanDerWaalsContact O-CA 3.28Å; V23-G27 WeakPolarHBondContact O-CA 3.38Å; V23-G27 PolarHBondContact O-N 3.14Å
28	S	91.3	Very high	92.9	Very high	23 Å²	23	54.3 Å²	54.3	16%	0.161	34%	0.34	C	S	.	.			trans	-79.1	178.2	178.2	74.8	0	0	0	0	112.3	V23 T26	V23-S28 VanDerWaalsContact CG1-O 3.27Å; V23-S28 WeakPolarHBondContact CG1-O 3.39Å; T26-S28 PolarHBondContact O-N 2.69Å; T26-S28 WeakPolarHBondContact OG1-CB 3.41Å; T26-S28 PolarHBondContact OG1-N 3.1Å; T26-S28 VanDerWaalsContact OG1-N 3.13Å; T26-S28 PolarHBondContact OG1-OG 2.8Å
29	D	93.6	Very high	92.8	Very high	93 Å²	93	58.8 Å²	58.8	50%	0.497	36%	0.36	S	S	.	.			trans	-86.1	166.7	168.9	68.7	64.6	0	0	0	112.6	A31 V32 A33	D29-A31 VanDerWaalsContact C-N 3.29Å; D29-A31 PolarHBondContact O-N 3.45Å; D29-A31 WeakPolarHBondContact OD1-CA 3.13Å; D29-A31 WeakPolarHBondContact OD1-CB 3.46Å; D29-A31 PolarHBondContact OD1-N 3.31Å; D29-V32 PolarHBondContact O-N 3.14Å; D29-V32 PolarHBondContact OD1-N 3.4Å; D29-A33 PolarHBondContact O-N 3.47Å
30	S	91.3	Very high	92.8	Very high	66 Å²	66	59.4 Å²	59.4	46%	0.462	36%	0.363	S	S	.	.	H	α-helix	trans	-65.4	-29	-177.2	-172.3	0	0	0	0	113.2	A33 Q34	S30-A33 PolarHBondContact O-N 3.04Å; S30-Q34 WeakPolarHBondContact O-CB 3.35Å; S30-Q34 PolarHBondContact O-N 3.09Å
31	A	91.3	Very high	92.7	Very high	70 Å²	70	60.3 Å²	60.3	58%	0.579	37%	0.367	S	S	*	.	H	α-helix	trans	-72.8	-39.7	178	0	0	0	0	0	111.1	D29 Q34 C35	D29-A31 VanDerWaalsContact C-N 3.29Å; D29-A31 PolarHBondContact O-N 3.45Å; D29-A31 WeakPolarHBondContact OD1-CA 3.13Å; D29-A31 WeakPolarHBondContact OD1-CB 3.46Å; D29-A31 PolarHBondContact OD1-N 3.31Å; A31-Q34 PolarHBondContact O-N 3.13Å; A31-C35 PolarHBondContact O-N 2.87Å; A31-C35 VanDerWaalsContact O-N 3.11Å
32	V	90.8	Very high	92.6	Very high	47 Å²	47	57.7 Å²	57.7	29%	0.285	35%	0.353	S	S	.	.	H	α-helix	trans	-61.5	-47.8	171.5	174.3	0	0	0	0	110.6	D29 Q34 C35 Y36 F51	D29-V32 PolarHBondContact O-N 3.14Å; D29-V32 PolarHBondContact OD1-N 3.4Å; V32-Q34 VanDerWaalsContact C-N 3.33Å; V32-Q34 PolarHBondContact O-N 2.92Å; V32-C35 WeakPolarHBondContact O-CB 3.4Å; V32-C35 PolarHBondContact O-N 3Å; V32-Y36 HydrophobicContact CG1-CD2 3.78Å; V32-Y36 HydrophobicContact CG1-CE2 3.86Å; V32-Y36 WeakPolarHBondContact O-CD2 3.44Å; V32-Y36 PolarHBondContact O-N 2.85Å; V32-Y36 VanDerWaalsContact O-N 3.11Å; V32-F51 HydrophobicContact CG1-CD2 4.13Å; V32-F51 HydrophobicContact CG1-CE2 3.89Å
33	A	92.2	Very high	92.5	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-57.3	-45.6	177.7	0	0	0	0	0	112.3	C19 F22 V23 D29 S30 C35 Y36 L37	C19-A33 HydrophobicContact CB-CB 4.24Å; F22-A33 HydrophobicContact CB-CB 4.03Å; F22-A33 HydrophobicContact CD1-CB 3.41Å; F22-A33 VanDerWaalsContact CD1-CB 3.41Å; F22-A33 HydrophobicContact CE1-CB 4.07Å; F22-A33 HydrophobicContact CG-CB 3.93Å; V23-A33 HydrophobicContact CG2-CB 3.82Å; D29-A33 PolarHBondContact O-N 3.47Å; S30-A33 PolarHBondContact O-N 3.04Å; A33-C35 VanDerWaalsContact C-N 3.32Å; A33-C35 PolarHBondContact O-N 2.98Å; A33-Y36 PolarHBondContact O-N 3.48Å; A33-L37 WeakPolarHBondContact O-CB 3.32Å; A33-L37 WeakPolarHBondContact O-CD1 3.42Å; A33-L37 WeakPolarHBondContact O-CG 3.23Å; A33-L37 PolarHBondContact O-N 2.88Å
34	Q	92.7	Very high	92.4	Very high	111 Å²	111	62 Å²	62	52%	0.519	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-38.6	178.5	-172.3	174.1	12.8	0	0	112.4	S30 A31 V32 A38 W42	S30-Q34 WeakPolarHBondContact O-CB 3.35Å; S30-Q34 PolarHBondContact O-N 3.09Å; A31-Q34 PolarHBondContact O-N 3.13Å; V32-Q34 VanDerWaalsContact C-N 3.33Å; V32-Q34 PolarHBondContact O-N 2.92Å; Q34-A38 WeakPolarHBondContact O-CB 3.47Å; Q34-A38 PolarHBondContact O-N 3.38Å; Q34-W42 HydrophobicContact CG-CH2 4.34Å
35	C	93.7	Very high	92.1	Very high	60 Å²	60	64.6 Å²	64.6	41%	0.405	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-54.1	177.9	-162.4	0	0	0	0	111.2	A31 V32 A33 L37 A38 E39	A31-C35 PolarHBondContact O-N 2.87Å; A31-C35 VanDerWaalsContact O-N 3.11Å; V32-C35 WeakPolarHBondContact O-CB 3.4Å; V32-C35 PolarHBondContact O-N 3Å; A33-C35 VanDerWaalsContact C-N 3.32Å; A33-C35 PolarHBondContact O-N 2.98Å; C35-L37 PolarHBondContact O-N 2.96Å; C35-A38 PolarHBondContact O-N 3.08Å; C35-E39 WeakPolarHBondContact O-CB 3.48Å; C35-E39 WeakPolarHBondContact O-CG 3.33Å; C35-E39 PolarHBondContact O-N 2.9Å
36	Y	92.7	Very high	91.9	Very high	48 Å²	48	66.4 Å²	66.4	19%	0.188	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-40.9	-178.4	-83.8	-80.7	0	0	0	112.6	F22 V32 A33 N40 F51 A54	F22-Y36 HydrophobicContact CZ-CD2 4.33Å; F22-Y36 HydrophobicContact CZ-CG 4.17Å; V32-Y36 HydrophobicContact CG1-CD2 3.78Å; V32-Y36 HydrophobicContact CG1-CE2 3.86Å; V32-Y36 WeakPolarHBondContact O-CD2 3.44Å; V32-Y36 PolarHBondContact O-N 2.85Å; V32-Y36 VanDerWaalsContact O-N 3.11Å; A33-Y36 PolarHBondContact O-N 3.48Å; Y36-N40 WeakPolarHBondContact O-CB 3.49Å; Y36-N40 PolarHBondContact O-N 3.32Å; Y36-N40 PolarHBondContact O-ND2 2.91Å; Y36-F51 HydrophobicContact CD1-CB 4.05Å; Y36-F51 HydrophobicContact CD2-CB 4.39Å; Y36-F51 AromaticContact CD2-CD2 3.89Å; Y36-F51 HydrophobicContact CD2-CD2 3.89Å; Y36-F51 HydrophobicContact CE1-CB 4.07Å; Y36-F51 HydrophobicContact CE2-CB 4.42Å; Y36-F51 AromaticContact CE2-CD2 3.62Å; Y36-F51 HydrophobicContact CE2-CD2 3.62Å; Y36-F51 HydrophobicContact CE2-CE2 4.44Å; Y36-F51 HydrophobicContact CG-CB 4.21Å; Y36-A54 WeakPolarHBondContact OH-CB 3.38Å
37	L	92.6	Very high	91.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-65.2	-42.6	175.3	-74.3	163.9	0	0	0	111.2	L18 C19 F22 A33 C35 E39 N40 D41 W42 M44 A47	L18-L37 HydrophobicContact CB-CD1 3.97Å; L18-L37 HydrophobicContact CB-CD2 4.47Å; C19-L37 HydrophobicContact CB-CD1 4.46Å; F22-L37 HydrophobicContact CB-CD1 4.19Å; F22-L37 HydrophobicContact CD2-CD2 4.5Å; F22-L37 HydrophobicContact CD2-CG 4.28Å; A33-L37 WeakPolarHBondContact O-CB 3.32Å; A33-L37 WeakPolarHBondContact O-CD1 3.42Å; A33-L37 WeakPolarHBondContact O-CG 3.23Å; A33-L37 PolarHBondContact O-N 2.88Å; C35-L37 PolarHBondContact O-N 2.96Å; L37-E39 PolarHBondContact O-N 3.03Å; L37-N40 CarbonylContact O-C 3.57Å; L37-N40 PolarHBondContact O-N 3.36Å; L37-D41 PolarHBondContact O-N 3.03Å; L37-W42 HydrophobicContact CB-CD2 4.18Å; L37-W42 HydrophobicContact CB-CE3 3.79Å; L37-W42 HydrophobicContact CB-CZ3 4.07Å; L37-W42 HydrophobicContact CD1-CE3 4.29Å; L37-W42 HydrophobicContact CD1-CZ3 4.19Å; L37-W42 HydrophobicContact CG-CE3 4.49Å; L37-W42 VanDerWaalsContact O-CA 3.25Å; L37-W42 WeakPolarHBondContact O-CA 3.43Å; L37-W42 PolarHBondContact O-N 2.84Å; L37-M44 HydrophobicContact CD2-SD 4.43Å; L37-A47 HydrophobicContact CD2-CB 3.77Å; L37-A47 HydrophobicContact CG-CB 4.15Å
38	A	92.6	Very high	91.9	Very high	53 Å²	53	63.2 Å²	63.2	44%	0.438	34%	0.335	S	S	.	.	H	α-helix	trans	-66	-38.4	179.3	0	0	0	0	0	113.1	Q34 C35 N40	Q34-A38 WeakPolarHBondContact O-CB 3.47Å; Q34-A38 PolarHBondContact O-N 3.38Å; C35-A38 PolarHBondContact O-N 3.08Å; A38-N40 VanDerWaalsContact C-N 3.26Å; A38-N40 PolarHBondContact O-N 3.03Å
39	E	91.3	Very high	91.7	Very high	133 Å²	133	67.3 Å²	67.3	62%	0.621	36%	0.355	S	S	*	.	H	α-helix	trans	-71.8	-19.6	177.6	-72	176	173.6	0	0	113.3	C35 L37	C35-E39 WeakPolarHBondContact O-CB 3.48Å; C35-E39 WeakPolarHBondContact O-CG 3.33Å; C35-E39 PolarHBondContact O-N 2.9Å; L37-E39 PolarHBondContact O-N 3.03Å
40	N	93.6	Very high	91.4	Very high	22 Å²	22	65 Å²	65	12%	0.118	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	35.5	-177.8	-69.5	-85.3	0	0	0	112.5	Y36 L37 A38 W42 E43 R46 A47	Y36-N40 WeakPolarHBondContact O-CB 3.49Å; Y36-N40 PolarHBondContact O-N 3.32Å; Y36-N40 PolarHBondContact O-ND2 2.91Å; L37-N40 CarbonylContact O-C 3.57Å; L37-N40 PolarHBondContact O-N 3.36Å; A38-N40 VanDerWaalsContact C-N 3.26Å; A38-N40 PolarHBondContact O-N 3.03Å; N40-W42 PolarHBondContact O-N 3.07Å; N40-E43 PolarHBondContact O-N 3.38Å; N40-R46 HydrophobicContact CB-CB 3.96Å; N40-A47 HydrophobicContact CB-CB 4.11Å
41	D	93.4	Very high	91.3	Very high	115 Å²	115	63.9 Å²	63.9	62%	0.615	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	24.8	175	-58.2	-53.2	0	0	0	114.7	L37 E43 R46	L37-D41 PolarHBondContact O-N 3.03Å; D41-E43 PolarHBondContact O-N 3.44Å; D41-R46 IonicContact OD2-NH1 3.69Å; D41-R46 PolarHBondContact OD2-NH1 3.28Å
42	W	91.6	Very high	91.2	Very high	51 Å²	51	64.7 Å²	64.7	19%	0.193	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	21.9	-173.2	-62.4	77.5	0	0	0	114.5	R15 L18 Q34 L37 N40 M44	R15-W42 HydrophobicContact CB-CE3 3.92Å; R15-W42 HydrophobicContact CB-CH2 3.51Å; R15-W42 HydrophobicContact CB-CZ2 4.23Å; R15-W42 HydrophobicContact CB-CZ3 3.34Å; R15-W42 VanDerWaalsContact CD-CZ2 3.46Å; R15-W42 HydrophobicContact CG-CD2 3.77Å; R15-W42 HydrophobicContact CG-CE3 3.53Å; R15-W42 HydrophobicContact CG-CH2 3.61Å; R15-W42 HydrophobicContact CG-CZ2 3.86Å; R15-W42 HydrophobicContact CG-CZ3 3.45Å; R15-W42 VanDerWaalsContact CG-CZ3 3.45Å; R15-W42 VanDerWaalsContact NE-CE2 3.25Å; R15-W42 WeakPolarHBondContact O-CZ3 3.44Å; L18-W42 HydrophobicContact CB-CE3 4.49Å; L18-W42 HydrophobicContact CD1-CB 4.39Å; L18-W42 HydrophobicContact CD1-CE3 4.09Å; Q34-W42 HydrophobicContact CG-CH2 4.34Å; L37-W42 HydrophobicContact CB-CD2 4.18Å; L37-W42 HydrophobicContact CB-CE3 3.79Å; L37-W42 HydrophobicContact CB-CZ3 4.07Å; L37-W42 HydrophobicContact CD1-CE3 4.29Å; L37-W42 HydrophobicContact CD1-CZ3 4.19Å; L37-W42 HydrophobicContact CG-CE3 4.49Å; L37-W42 VanDerWaalsContact O-CA 3.25Å; L37-W42 WeakPolarHBondContact O-CA 3.43Å; L37-W42 PolarHBondContact O-N 2.84Å; N40-W42 PolarHBondContact O-N 3.07Å; W42-M44 PolarHBondContact O-N 2.85Å
43	E	92.8	Very high	91	Very high	104 Å²	104	63.4 Å²	63.4	49%	0.486	31%	0.314	S	S	.	.			trans	-84.9	109	171.6	-68	-172.8	-178.1	0	0	110.4	N40 D41 E45 R46 A47	N40-E43 PolarHBondContact O-N 3.38Å; D41-E43 PolarHBondContact O-N 3.44Å; E43-E45 PolarHBondContact O-N 2.99Å; E43-R46 HydrophobicContact CB-CB 4.18Å; E43-R46 HydrophobicContact CB-CG 4.33Å; E43-R46 PolarHBondContact O-N 2.83Å; E43-R46 WeakPolarHBondContact OE2-CD 3.31Å; E43-R46 IonicContact OE2-NH1 2.76Å; E43-A47 WeakPolarHBondContact O-CB 3.25Å; E43-A47 PolarHBondContact O-N 2.93Å
44	M	92.4	Very high	90.5	Very high	28 Å²	28	65.4 Å²	65.4	14%	0.138	33%	0.331	C	S	.	.	H	α-helix	trans	-51.7	-49.8	-175.2	179.8	63.3	74	0	0	113	L18 E21 F22 L37 W42 R46 A47 L48	L18-M44 HydrophobicContact CB-CE 4.21Å; L18-M44 HydrophobicContact CD2-CE 3.8Å; L18-M44 WeakPolarHBondContact O-CE 3.42Å; E21-M44 HydrophobicContact CB-CE 3.73Å; E21-M44 HydrophobicContact CG-CE 3.73Å; F22-M44 HydrophobicContact CB-CE 4.16Å; F22-M44 HydrophobicContact CB-SD 3.98Å; F22-M44 HydrophobicContact CD2-SD 3.98Å; F22-M44 HydrophobicContact CG-SD 4.47Å; L37-M44 HydrophobicContact CD2-SD 4.43Å; W42-M44 PolarHBondContact O-N 2.85Å; M44-R46 PolarHBondContact O-N 3.16Å; M44-A47 PolarHBondContact O-N 3.35Å; M44-L48 HydrophobicContact CG-CD1 3.85Å; M44-L48 HydrophobicContact CG-CG 4.33Å; M44-L48 WeakPolarHBondContact O-CB 3.4Å; M44-L48 WeakPolarHBondContact O-CG 3.32Å; M44-L48 PolarHBondContact O-N 2.88Å; M44-L48 HydrophobicContact SD-CD1 3.88Å; M44-L48 HydrophobicContact SD-CD2 4.48Å; M44-L48 HydrophobicContact SD-CG 3.93Å
45	E	89.2	Confident	90.1	Very high	159 Å²	159	64.7 Å²	64.7	74%	0.743	33%	0.33	S	S	*	.	H	α-helix	trans	-62.9	-41.6	-178.3	-68.6	-174.8	173.8	0	0	112.3	E43 N49	E43-E45 PolarHBondContact O-N 2.99Å; E45-N49 VanDerWaalsContact O-CB 3.26Å; E45-N49 WeakPolarHBondContact O-CB 3.39Å; E45-N49 PolarHBondContact O-N 3.35Å; E45-N49 PolarHBondContact O-ND2 3.43Å; E45-N49 VanDerWaalsContact O-ND2 3.08Å
46	R	88.5	Confident	89.5	Confident	117 Å²	117	63 Å²	63	44%	0.442	32%	0.317	S	S	.	.	H	α-helix	trans	-66.5	-42.2	177.1	-72.4	177.2	76.6	-164.1	-3.2	111.2	N40 D41 E43 M44 N49 S50	N40-R46 HydrophobicContact CB-CB 3.96Å; D41-R46 IonicContact OD2-NH1 3.69Å; D41-R46 PolarHBondContact OD2-NH1 3.28Å; E43-R46 HydrophobicContact CB-CB 4.18Å; E43-R46 HydrophobicContact CB-CG 4.33Å; E43-R46 PolarHBondContact O-N 2.83Å; E43-R46 WeakPolarHBondContact OE2-CD 3.31Å; E43-R46 IonicContact OE2-NH1 2.76Å; M44-R46 PolarHBondContact O-N 3.16Å; R46-N49 PolarHBondContact O-N 3.36Å; R46-S50 WeakPolarHBondContact O-CB 3.42Å; R46-S50 PolarHBondContact O-N 2.91Å
47	A	90.7	Very high	89.1	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-47.6	176.6	0	0	0	0	0	111.9	F22 L37 N40 E43 M44 S50 F51	F22-A47 HydrophobicContact CD2-CB 4.21Å; F22-A47 HydrophobicContact CE2-CB 3.82Å; L37-A47 HydrophobicContact CD2-CB 3.77Å; L37-A47 HydrophobicContact CG-CB 4.15Å; N40-A47 HydrophobicContact CB-CB 4.11Å; E43-A47 WeakPolarHBondContact O-CB 3.25Å; E43-A47 PolarHBondContact O-N 2.93Å; M44-A47 PolarHBondContact O-N 3.35Å; A47-S50 PolarHBondContact O-N 3.3Å; A47-F51 WeakPolarHBondContact O-CB 3.26Å; A47-F51 PolarHBondContact O-N 3.44Å
48	L	91.3	Very high	88.6	Confident	28 Å²	28	65.1 Å²	65.1	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-62.8	-44.3	177.5	-74.1	174	0	0	0	111.3	F22 V25 T26 M44 S50 F51 F52	F22-L48 HydrophobicContact CD2-CD2 3.64Å; F22-L48 HydrophobicContact CD2-CG 4.04Å; F22-L48 HydrophobicContact CE2-CD2 3.76Å; F22-L48 HydrophobicContact CE2-CG 4.17Å; F22-L48 HydrophobicContact CG-CD2 4.2Å; F22-L48 HydrophobicContact CZ-CD2 4.39Å; V25-L48 HydrophobicContact CB-CD2 4.09Å; V25-L48 HydrophobicContact CG1-CD1 4.12Å; V25-L48 HydrophobicContact CG1-CD2 3.8Å; T26-L48 HydrophobicContact CG2-CD2 3.42Å; T26-L48 VanDerWaalsContact CG2-CD2 3.42Å; M44-L48 HydrophobicContact CG-CD1 3.85Å; M44-L48 HydrophobicContact CG-CG 4.33Å; M44-L48 WeakPolarHBondContact O-CB 3.4Å; M44-L48 WeakPolarHBondContact O-CG 3.32Å; M44-L48 PolarHBondContact O-N 2.88Å; M44-L48 HydrophobicContact SD-CD1 3.88Å; M44-L48 HydrophobicContact SD-CD2 4.48Å; M44-L48 HydrophobicContact SD-CG 3.93Å; L48-S50 VanDerWaalsContact C-N 3.34Å; L48-S50 PolarHBondContact O-N 3.38Å; L48-F51 PolarHBondContact O-N 2.93Å; L48-F52 HydrophobicContact CB-CE2 4.45Å; L48-F52 HydrophobicContact CD2-CE2 4.21Å; L48-F52 WeakPolarHBondContact O-CD2 3.47Å; L48-F52 PolarHBondContact O-N 2.98Å
49	N	87.3	Confident	88.4	Confident	109 Å²	109	64 Å²	64	58%	0.583	32%	0.323	S	S	*	.	H	α-helix	trans	-57.8	-49.2	174.9	-75.6	-28.5	0	0	0	110.6	E45 R46 F51 F52 E53	E45-N49 VanDerWaalsContact O-CB 3.26Å; E45-N49 WeakPolarHBondContact O-CB 3.39Å; E45-N49 PolarHBondContact O-N 3.35Å; E45-N49 PolarHBondContact O-ND2 3.43Å; E45-N49 VanDerWaalsContact O-ND2 3.08Å; R46-N49 PolarHBondContact O-N 3.36Å; N49-F51 VanDerWaalsContact C-N 3.3Å; N49-F51 PolarHBondContact O-N 3.01Å; N49-F52 PolarHBondContact O-N 3.07Å; N49-E53 WeakPolarHBondContact O-CB 3.35Å; N49-E53 PolarHBondContact O-N 3.11Å
50	S	87.3	Confident	88.2	Confident	43 Å²	43	59.4 Å²	59.4	30%	0.301	30%	0.302	S	S	.	.	H	α-helix	trans	-60.2	-37.5	177.5	-170.5	0	0	0	0	113	R46 A47 L48 E53 A54	R46-S50 WeakPolarHBondContact O-CB 3.42Å; R46-S50 PolarHBondContact O-N 2.91Å; A47-S50 PolarHBondContact O-N 3.3Å; L48-S50 VanDerWaalsContact C-N 3.34Å; L48-S50 PolarHBondContact O-N 3.38Å; S50-E53 WeakPolarHBondContact O-CB 3.45Å; S50-A54 PolarHBondContact O-N 2.88Å; S50-A54 VanDerWaalsContact O-N 3.16Å
51	F	90.3	Very high	87.5	Confident	43 Å²	43	63.1 Å²	63.1	19%	0.189	33%	0.325	C	S	.	.	H	α-helix	trans	-68.1	-51.9	179.2	173.1	-92.2	0	0	0	112.6	F22 T26 V32 Y36 A47 L48 N49 E53 A54	F22-F51 HydrophobicContact CE1-CD2 4.17Å; F22-F51 HydrophobicContact CE1-CG 4.3Å; F22-F51 HydrophobicContact CE2-CB 4.32Å; F22-F51 HydrophobicContact CZ-CB 3.66Å; F22-F51 AromaticContact CZ-CD2 3.97Å; F22-F51 HydrophobicContact CZ-CD2 3.97Å; F22-F51 AromaticContact CZ-CG 3.82Å; F22-F51 HydrophobicContact CZ-CG 3.82Å; T26-F51 VanDerWaalsContact CB-CE1 3.47Å; T26-F51 HydrophobicContact CG2-CD1 3.47Å; T26-F51 VanDerWaalsContact CG2-CD1 3.47Å; T26-F51 HydrophobicContact CG2-CE1 3.62Å; T26-F51 HydrophobicContact CG2-CG 4.04Å; T26-F51 HydrophobicContact CG2-CZ 4.28Å; V32-F51 HydrophobicContact CG1-CD2 4.13Å; V32-F51 HydrophobicContact CG1-CE2 3.89Å; Y36-F51 HydrophobicContact CD1-CB 4.05Å; Y36-F51 HydrophobicContact CD2-CB 4.39Å; Y36-F51 AromaticContact CD2-CD2 3.89Å; Y36-F51 HydrophobicContact CD2-CD2 3.89Å; Y36-F51 HydrophobicContact CE1-CB 4.07Å; Y36-F51 HydrophobicContact CE2-CB 4.42Å; Y36-F51 AromaticContact CE2-CD2 3.62Å; Y36-F51 HydrophobicContact CE2-CD2 3.62Å; Y36-F51 HydrophobicContact CE2-CE2 4.44Å; Y36-F51 HydrophobicContact CG-CB 4.21Å; A47-F51 WeakPolarHBondContact O-CB 3.26Å; A47-F51 PolarHBondContact O-N 3.44Å; L48-F51 PolarHBondContact O-N 2.93Å; N49-F51 VanDerWaalsContact C-N 3.3Å; N49-F51 PolarHBondContact O-N 3.01Å; F51-E53 PolarHBondContact O-N 2.84Å; F51-A54 PolarHBondContact O-N 3.23Å
52	F	88.4	Confident	86	Confident	88 Å²	88	64.2 Å²	64.2	39%	0.386	34%	0.336	S	S	.	.	H	α-helix	trans	-66.4	-32.2	177.8	-68.9	-61.5	0	0	0	111	V25 T26 L48 N49 A54 D55 M56	V25-F52 HydrophobicContact CG1-CE2 4.42Å; V25-F52 HydrophobicContact CG1-CZ 4.42Å; T26-F52 HydrophobicContact CG2-CE2 4.38Å; T26-F52 HydrophobicContact CG2-CZ 4.1Å; L48-F52 HydrophobicContact CB-CE2 4.45Å; L48-F52 HydrophobicContact CD2-CE2 4.21Å; L48-F52 WeakPolarHBondContact O-CD2 3.47Å; L48-F52 PolarHBondContact O-N 2.98Å; N49-F52 PolarHBondContact O-N 3.07Å; F52-A54 VanDerWaalsContact C-N 3.34Å; F52-A54 PolarHBondContact O-N 3.46Å; F52-D55 PolarHBondContact O-N 3.48Å; F52-M56 HydrophobicContact CB-CE 4.29Å; F52-M56 VanDerWaalsContact O-CE 3.31Å; F52-M56 WeakPolarHBondContact O-CE 3.31Å; F52-M56 WeakPolarHBondContact O-CG 3.45Å; F52-M56 PolarHBondContact O-N 3.17Å; F52-M56 VanDerWaalsContact O-N 3.1Å
53	E	85.8	Confident	83.8	Confident	20 Å²	20	70.4 Å²	70.4	9%	0.093	37%	0.367	C	S	.	.	H	α-helix	trans	-56.8	-46.7	173.6	-164.2	63.2	-144.6	0	0	112.6	N49 S50 F51 D55 M56 E57 R153 Y179 R183	N49-E53 WeakPolarHBondContact O-CB 3.35Å; N49-E53 PolarHBondContact O-N 3.11Å; S50-E53 WeakPolarHBondContact O-CB 3.45Å; F51-E53 PolarHBondContact O-N 2.84Å; E53-D55 VanDerWaalsContact C-N 3.31Å; E53-D55 PolarHBondContact O-N 3.31Å; E53-M56 CarbonylContact O-C 3.58Å; E53-M56 WeakPolarHBondContact O-CA 3.5Å; E53-M56 WeakPolarHBondContact O-CB 3.28Å; E53-M56 PolarHBondContact O-N 3.44Å; E53-E57 HydrophobicContact CG-CG 4.29Å; E53-E57 WeakPolarHBondContact O-CG 3.4Å; E53-E57 PolarHBondContact O-N 2.82Å; E53-R153 VanDerWaalsContact CG-CZ 3.47Å; E53-R153 IonicContact OE1-CZ 3.61Å; E53-R153 IonicContact OE1-NE 3.37Å; E53-R153 PolarHBondContact OE1-NE 2.86Å; E53-R153 IonicContact OE1-NH2 3.25Å; E53-R153 PolarHBondContact OE1-NH2 2.78Å; E53-R153 IonicContact OE2-NE 2.86Å; E53-Y179 PolarHBondContact OE1-OH 3.47Å; E53-R183 IonicContact OE1-CZ 3.7Å; E53-R183 IonicContact OE1-NH2 3.53Å; E53-R183 PolarHBondContact OE1-NH2 2.85Å; E53-R183 IonicContact OE2-CZ 3.73Å; E53-R183 IonicContact OE2-NH1 3.91Å; E53-R183 PolarHBondContact OE2-NH1 3.29Å; E53-R183 IonicContact OE2-NH2 3.32Å; E53-R183 PolarHBondContact OE2-NH2 2.99Å
54	A	82.7	Confident	81.3	Confident	41 Å²	41	73.4 Å²	73.4	34%	0.339	39%	0.386	S	S	.	.	H	α-helix	trans	-59.8	-40.6	-179.2	0	0	0	0	0	112	Y36 S50 F51 F52 M56 E57 A58	Y36-A54 WeakPolarHBondContact OH-CB 3.38Å; S50-A54 PolarHBondContact O-N 2.88Å; S50-A54 VanDerWaalsContact O-N 3.16Å; F51-A54 PolarHBondContact O-N 3.23Å; F52-A54 VanDerWaalsContact C-N 3.34Å; F52-A54 PolarHBondContact O-N 3.46Å; A54-M56 VanDerWaalsContact C-N 3.33Å; A54-M56 PolarHBondContact O-N 2.92Å; A54-E57 PolarHBondContact O-N 3.08Å; A54-A58 WeakPolarHBondContact O-CB 2.86Å; A54-A58 PolarHBondContact O-N 2.99Å
55	D	83.1	Confident	78.3	Confident	96 Å²	96	76.2 Å²	76.2	51%	0.513	41%	0.409	S	S	.	.	H	α-helix	trans	-65.1	-36.8	173.6	178.5	77.4	0	0	0	112.6	F52 E53 K182	F52-D55 PolarHBondContact O-N 3.48Å; E53-D55 VanDerWaalsContact C-N 3.31Å; E53-D55 PolarHBondContact O-N 3.31Å; D55-K182 PolarHBondContact O-NZ 2.95Å; D55-K182 VanDerWaalsContact O-NZ 3.12Å; D55-K182 IonicContact OD2-NZ 3.35Å; D55-K182 PolarHBondContact OD2-NZ 2.95Å
56	M	82.4	Confident	75.8	Confident	24 Å²	24	74.8 Å²	74.8	12%	0.118	41%	0.413	C	S	.	.	H	α-helix	trans	-69.9	-40.9	177.6	-69.2	-177.2	-68.5	0	0	111.2	F52 E53 A54 A58 V59 Y179 K182 R183	F52-M56 HydrophobicContact CB-CE 4.29Å; F52-M56 VanDerWaalsContact O-CE 3.31Å; F52-M56 WeakPolarHBondContact O-CE 3.31Å; F52-M56 WeakPolarHBondContact O-CG 3.45Å; F52-M56 PolarHBondContact O-N 3.17Å; F52-M56 VanDerWaalsContact O-N 3.1Å; E53-M56 CarbonylContact O-C 3.58Å; E53-M56 WeakPolarHBondContact O-CA 3.5Å; E53-M56 WeakPolarHBondContact O-CB 3.28Å; E53-M56 PolarHBondContact O-N 3.44Å; A54-M56 VanDerWaalsContact C-N 3.33Å; A54-M56 PolarHBondContact O-N 2.92Å; M56-A58 VanDerWaalsContact C-N 3.34Å; M56-V59 WeakPolarHBondContact O-CG1 3.32Å; M56-V59 WeakPolarHBondContact O-CG2 3.32Å; M56-Y179 HydrophobicContact CB-CD2 4.19Å; M56-Y179 HydrophobicContact CB-CE2 3.9Å; M56-Y179 WeakPolarHBondContact O-CD2 3.31Å; M56-K182 HydrophobicContact CG-CB 4.46Å; M56-K182 HydrophobicContact CG-CD 4.09Å; M56-R183 VanDerWaalsContact CE-NE 3.29Å; M56-R183 WeakPolarHBondContact SD-CD 3.48Å; M56-R183 HydrophobicContact SD-CG 4.04Å; M56-R183 PolarHBondContact SD-NE 2.8Å
57	E	83	Confident	73	Confident	49 Å²	49	79.1 Å²	79.1	23%	0.229	44%	0.435	C	S	.	.	H	α-helix	trans	-76.2	-20.4	178.4	-68.7	-165	148.2	0	0	114	E53 A54 V59 F60 E150 R153	E53-E57 HydrophobicContact CG-CG 4.29Å; E53-E57 WeakPolarHBondContact O-CG 3.4Å; E53-E57 PolarHBondContact O-N 2.82Å; A54-E57 PolarHBondContact O-N 3.08Å; E57-V59 PolarHBondContact O-N 2.65Å; E57-F60 WeakPolarHBondContact O-CB 3.43Å; E57-F60 PolarHBondContact O-N 2.89Å; E57-E150 PolarHBondContact OE1-N 2.91Å; E57-R153 IonicContact OE1-CZ 2.51Å; E57-R153 IonicContact OE1-NE 3.81Å; E57-R153 IonicContact OE1-NH2 3.54Å; E57-R153 PolarHBondContact OE1-NH2 3.46Å; E57-R153 IonicContact OE2-NH2 2.69Å; E57-R153 PolarHBondContact OE2-NH2 3.42Å
58	A	83.8	Confident	70.1	Confident	44 Å²	44	88.2 Å²	88.2	36%	0.364	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-57	-21.8	173.9	0	0	0	0	0	112.8	A54 M56 F60 T61	A54-A58 WeakPolarHBondContact O-CB 2.86Å; A54-A58 PolarHBondContact O-N 2.99Å; M56-A58 VanDerWaalsContact C-N 3.34Å; A58-F60 PolarHBondContact O-N 2.88Å; A58-T61 WeakPolarHBondContact CA-OG1 3.19Å; A58-T61 PolarHBondContact O-N 2.83Å; A58-T61 VanDerWaalsContact O-N 3.1Å; A58-T61 PolarHBondContact O-OG1 2.77Å
59	V	86.6	Confident	67.3	Low	29 Å²	29	94.5 Å²	94.5	18%	0.176	51%	0.509	C	S	.	.	G	3₁₀ helix	trans	-63	-23.1	172.9	-53.1	0	0	0	0	112.8	M56 E57 Y179 K182	M56-V59 WeakPolarHBondContact O-CG1 3.32Å; M56-V59 WeakPolarHBondContact O-CG2 3.32Å; E57-V59 PolarHBondContact O-N 2.65Å; V59-Y179 HydrophobicContact CG2-CD2 4.34Å; V59-K182 HydrophobicContact CG1-CD 4.46Å
60	F	87.5	Confident	64.5	Low	37 Å²	37	97.2 Å²	97.2	16%	0.162	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-94.2	-12.8	176.3	-57.9	-68.3	0	0	0	113.1	E57 A58 V62 L148 G149 A152 P175 Y176 Y179	E57-F60 WeakPolarHBondContact O-CB 3.43Å; E57-F60 PolarHBondContact O-N 2.89Å; A58-F60 PolarHBondContact O-N 2.88Å; F60-V62 PolarHBondContact O-N 3.18Å; F60-L148 HydrophobicContact CD1-CB 4.5Å; F60-L148 HydrophobicContact CD1-CD2 3.63Å; F60-L148 HydrophobicContact CD1-CG 3.9Å; F60-L148 HydrophobicContact CE1-CD2 3.79Å; F60-L148 HydrophobicContact CE1-CG 3.85Å; F60-G149 VanDerWaalsContact CD2-CA 3.48Å; F60-A152 HydrophobicContact CE2-CB 4.06Å; F60-A152 HydrophobicContact CZ-CB 3.72Å; F60-P175 HydrophobicContact CD1-CB 3.72Å; F60-P175 HydrophobicContact CE1-CB 3.98Å; F60-Y176 HydrophobicContact CE1-CG 4.46Å; F60-Y179 HydrophobicContact CD2-CD2 4.45Å; F60-Y179 HydrophobicContact CE2-CD1 4.28Å; F60-Y179 AromaticContact CE2-CD2 3.49Å; F60-Y179 HydrophobicContact CE2-CD2 3.49Å; F60-Y179 VanDerWaalsContact CE2-CD2 3.49Å; F60-Y179 HydrophobicContact CE2-CE2 4.18Å; F60-Y179 AromaticContact CE2-CG 3.54Å; F60-Y179 HydrophobicContact CE2-CG 3.54Å; F60-Y179 VanDerWaalsContact CZ-CB 3.41Å; F60-Y179 HydrophobicContact CZ-CD1 4.23Å; F60-Y179 HydrophobicContact CZ-CD2 4.12Å; F60-Y179 AromaticContact CZ-CG 3.67Å; F60-Y179 HydrophobicContact CZ-CG 3.67Å
61	T	78.9	Confident	61.7	Low	100 Å²	100	100 Å²	100	61%	0.613	54%	0.541	S	S	*	.	S	Bend	trans	-84.5	105.4	173.4	60.4	0	0	0	0	108.6	A58 E63	A58-T61 WeakPolarHBondContact CA-OG1 3.19Å; A58-T61 PolarHBondContact O-N 2.83Å; A58-T61 VanDerWaalsContact O-N 3.1Å; A58-T61 PolarHBondContact O-OG1 2.77Å; T61-E63 PolarHBondContact O-N 2.76Å
62	V	63.4	Low	58.9	Low	138 Å²	138	103.4 Å²	103.4	84%	0.836	57%	0.567	S	S	*	*			trans	-64.1	126.4	175.7	-135.5	0	0	0	0	108.9	F60 D64	F60-V62 PolarHBondContact O-N 3.18Å; V62-D64 PolarHBondContact O-N 2.77Å
63	E	44.3	Very low	56.1	Low	182 Å²	182	105.1 Å²	105.1	85%	0.85	59%	0.587	S	S	*	*			trans	-59.2	101.3	163.7	-76.3	-172.6	157.1	0	0	108.8	T61 S65	T61-E63 PolarHBondContact O-N 2.76Å; E63-S65 PolarHBondContact O-N 3.37Å
64	D	39.5	Very low	53.3	Low	167 Å²	167	114.2 Å²	114.2	89%	0.893	63%	0.626	S	S	*	*			trans	-76.1	79.9	172.8	-144.1	8.8	0	0	0	108.3	V62	V62-D64 PolarHBondContact O-N 2.77Å
65	S	30	Very low	50.7	Low	87 Å²	87	118.7 Å²	118.7	61%	0.608	65%	0.65	S	S	*	*			trans	-99.2	134	168.2	-79	0	0	0	0	110.4	E63 K67	E63-S65 PolarHBondContact O-N 3.37Å; S65-K67 PolarHBondContact O-N 3.32Å
66	P	36.9	Very low	48	Very low	128 Å²	128	123.6 Å²	123.6	83%	0.831	67%	0.666	S	S	*	*			trans	-77.9	114.1	-156.3	30.5	-34.1	0	0	0	111.4
67	K	30.5	Very low	45.4	Very low	208 Å²	208	134.4 Å²	134.4	90%	0.904	71%	0.706	S	S	*	*			trans	-100.7	105.7	161.8	-74.7	-175	-178.1	172.9	0	109.9	S65	S65-K67 PolarHBondContact O-N 3.32Å
68	K	29.6	Very low	42.7	Very low	191 Å²	191	143.6 Å²	143.6	83%	0.83	74%	0.738	S	S	*	*			trans	-1.2	119.8	156.4	-86	175.2	168.9	175.6	0	116.5	I70	K68-I70 PolarHBondContact O-N 2.64Å
69	D	32.6	Very low	40	Very low	161 Å²	161	151 Å²	151	86%	0.861	76%	0.762	S	S	*	*			trans	18.5	95.1	140.1	-66.9	-41.2	0	0	0	117.3
70	I	28.8	Very low	37.2	Very low	165 Å²	165	157.9 Å²	157.9	85%	0.846	80%	0.797	S	S	*	*			trans	-139.5	108.6	140.7	-53.3	-179.7	0	0	0	107.9	K68	K68-I70 PolarHBondContact O-N 2.64Å
71	S	28.3	Very low	34.4	Very low	103 Å²	103	163.2 Å²	163.2	72%	0.72	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-59.2	139.5	177.6	51.1	0	0	0	0	113.1
72	P	30.9	Very low	32.1	Very low	114 Å²	114	168 Å²	168	74%	0.74	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-80.1	146.1	173.8	30.8	-32.7	0	0	0	112.2
73	P	28.7	Very low	30.5	Very low	124 Å²	124	167.4 Å²	167.4	81%	0.805	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-73.8	132.3	178.5	28.2	-31.1	0	0	0	111.9	V75	P73-V75 PolarHBondContact O-N 3.03Å
74	K	28.1	Very low	30	Very low	210 Å²	210	168.2 Å²	168.2	91%	0.913	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-64.8	117.2	176.5	-69.2	174.9	177.2	174.2	0	111.2
75	V	28.7	Very low	29.5	Very low	136 Å²	136	163.3 Å²	163.3	82%	0.824	83%	0.831	S	S	*	*			trans	-107.4	121.3	161.9	-177.4	0	0	0	0	109.3	P73 R77	P73-V75 PolarHBondContact O-N 3.03Å; V75-R77 PolarHBondContact O-N 3.39Å
76	K	26.1	Very low	29.6	Very low	198 Å²	198	169 Å²	169	86%	0.861	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-65	120.5	-177.7	-72.4	174.8	175.3	175.3	0	111	R78	K76-R78 PolarHBondContact O-N 3.09Å
77	R	27.6	Very low	29.6	Very low	251 Å²	251	169.9 Å²	169.9	95%	0.947	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-64.6	121.2	163.9	-74.8	177.6	171.7	165.3	-2.9	109.5	V75	V75-R77 PolarHBondContact O-N 3.39Å
78	R	26.1	Very low	29.9	Very low	243 Å²	243	166.8 Å²	166.8	92%	0.917	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-95.9	122.5	159.4	-82.8	-176.1	168.9	-179.9	-2.7	108.2	K76	K76-R78 PolarHBondContact O-N 3.09Å
79	K	27.6	Very low	30.4	Very low	200 Å²	200	163 Å²	163	87%	0.87	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-62.4	136.4	164.4	-85.8	178.6	170.8	-179.5	0	108.5
80	L	28.1	Very low	30.6	Very low	173 Å²	173	161.5 Å²	161.5	91%	0.906	82%	0.821	S	S	*	*			trans	-134.8	132.4	158.8	-150.2	75	0	0	0	109
81	D	27.9	Very low	31	Very low	148 Å²	148	158.7 Å²	158.7	79%	0.791	81%	0.808	S	S	*	*			trans	-70.7	158.3	-169.5	-70.8	-52.9	0	0	0	114.2
82	K	30.2	Very low	31.7	Very low	202 Å²	202	159 Å²	159	88%	0.878	80%	0.801	S	S	*	*			trans	-59.6	151.1	173.7	-69.8	179	175.3	-179.9	0	111.9
83	P	30.3	Very low	32.4	Very low	124 Å²	124	156.1 Å²	156.1	81%	0.805	78%	0.782	S	S	*	*			trans	-120	133.8	132.3	7.8	12.4	0	0	0	111.4
84	Q	34	Very low	32.6	Very low	199 Å²	199	156.3 Å²	156.3	93%	0.93	78%	0.781	S	S	*	*			trans	-68.8	125.8	161.4	-78	167.6	-52.9	0	0	108.8
85	G	28.6	Very low	32.8	Very low	65 Å²	65	155.4 Å²	155.4	67%	0.67	78%	0.78	S	S	*	*			trans	-156	137.4	172.1	0	0	0	0	0	109.6
86	K	31.4	Very low	33.2	Very low	207 Å²	207	157.8 Å²	157.8	90%	0.9	78%	0.782	S	S	*	*			trans	-50.6	137.4	-175.7	-78.1	172.7	170.7	178	0	112.3	D88	K86-D88 PolarHBondContact O-N 2.89Å
87	I	38.2	Very low	33.6	Very low	146 Å²	146	153.7 Å²	153.7	75%	0.749	78%	0.775	S	S	*	*			trans	-84.2	108.3	179.5	-61.6	166.3	0	0	0	107.9
88	D	35.7	Very low	33.5	Very low	143 Å²	143	146.6 Å²	146.6	77%	0.765	77%	0.77	S	S	*	*			trans	-97.2	131.5	164.5	-77.8	-27.5	0	0	0	109.3	K86 I90	K86-D88 PolarHBondContact O-N 2.89Å; D88-I90 PolarHBondContact O-N 3.2Å
89	C	39.8	Very low	33.5	Very low	111 Å²	111	141.4 Å²	141.4	75%	0.75	77%	0.77	S	S	*	*			trans	-64.6	123.7	177	-64.5	0	0	0	0	110.3	D91	C89-D91 PolarHBondContact O-N 3.43Å
90	I	38.6	Very low	33.4	Very low	129 Å²	129	137.3 Å²	137.3	66%	0.662	77%	0.767	S	S	*	*			trans	-88	91.9	169.2	-59.5	171.3	0	0	0	107.3	D88 L92	D88-I90 PolarHBondContact O-N 3.2Å; I90-L92 HydrophobicContact CG2-CD2 3.45Å; I90-L92 VanDerWaalsContact CG2-CD2 3.45Å; I90-L92 HydrophobicContact CG2-CG 3.76Å
91	D	37	Very low	33.5	Very low	106 Å²	106	134.8 Å²	134.8	57%	0.567	76%	0.763	S	S	*	*			trans	-79.9	112.5	161.1	-172	-15	0	0	0	107.9	C89 T93	C89-D91 PolarHBondContact O-N 3.43Å; D91-T93 PolarHBondContact O-N 3.34Å; D91-T93 PolarHBondContact OD1-N 3.01Å; D91-T93 PolarHBondContact OD1-OG1 3.34Å
92	L	42.1	Very low	33.4	Very low	110 Å²	110	133 Å²	133	58%	0.576	76%	0.763	S	S	*	*			trans	-87	20.2	179.2	-67	177	0	0	0	112.7	I90	I90-L92 HydrophobicContact CG2-CD2 3.45Å; I90-L92 VanDerWaalsContact CG2-CD2 3.45Å; I90-L92 HydrophobicContact CG2-CG 3.76Å
93	T	45	Very low	33.3	Very low	54 Å²	54	129.3 Å²	129.3	33%	0.331	76%	0.762	S	S	.	*	S	Bend	trans	-130.1	54.8	-174.8	60.7	0	0	0	0	114.8	D91	D91-T93 PolarHBondContact O-N 3.34Å; D91-T93 PolarHBondContact OD1-N 3.01Å; D91-T93 PolarHBondContact OD1-OG1 3.34Å
94	T	33.1	Very low	33	Very low	127 Å²	127	129.2 Å²	129.2	78%	0.779	76%	0.764	S	S	*	*			trans	-173.8	117.1	151.5	34.4	0	0	0	0	112.2
95	E	33.8	Very low	32.6	Very low	192 Å²	192	124.6 Å²	124.6	90%	0.897	76%	0.76	S	S	*	*			trans	-141.5	110.4	152.6	-80.3	-81.2	159.4	0	0	104.3
96	E	35.6	Very low	32.4	Very low	186 Å²	186	131.4 Å²	131.4	87%	0.869	77%	0.771	S	S	*	*			trans	-171.9	150.7	151	-88	-106.3	163.1	0	0	109.1
97	P	35	Very low	32.2	Very low	111 Å²	111	126.9 Å²	126.9	72%	0.721	77%	0.766	S	S	*	*			trans	-95.1	151.6	-138.8	34.5	-34	0	0	0	115.1
98	A	25.4	Very low	31.5	Very low	102 Å²	102	125 Å²	125	84%	0.843	76%	0.761	S	S	*	*			trans	-70.5	137.4	172.9	0	0	0	0	0	112.5
99	C	25.2	Very low	31	Very low	135 Å²	135	125.4 Å²	125.4	91%	0.912	76%	0.764	S	S	*	*			trans	-121.9	130.7	149.5	-98.6	0	0	0	0	109.5
100	S	27.1	Very low	30.5	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	76%	0.758	S	S	*	*			trans	-67.2	144.5	-174.4	51.8	0	0	0	0	114.4
101	S	29	Very low	30	Very low	120 Å²	120	124.1 Å²	124.1	84%	0.839	77%	0.767	S	S	*	*				-174	146.8	113.3	44.3	0	0	0	0	111.8
102	S	26.3	Very low	29.6	Very low	111 Å²	111	128 Å²	128	78%	0.776	78%	0.779	S	S	*	*			trans	-76.1	148.4	-172.8	42.1	0	0	0	0	113.6
103	S	27.4	Very low	28.9	Very low	123 Å²	123	128.5 Å²	128.5	86%	0.86	79%	0.791	S	S	*	*				-171.8	139.3	125.7	38	0	0	0	0	111.4
104	S	24.2	Very low	28.2	Very low	123 Å²	123	132.3 Å²	132.3	86%	0.86	82%	0.815	S	S	*	*			trans	-85.4	145.3	-173	-33.5	0	0	0	0	111.1
105	A	27	Very low	28.1	Very low	102 Å²	102	134.8 Å²	134.8	84%	0.843	82%	0.817	S	S	*	*			trans	-170.3	132.8	137.7	0	0	0	0	0	112.6
106	K	24.4	Very low	28	Very low	207 Å²	207	131.7 Å²	131.7	90%	0.9	81%	0.814	S	S	*	*			trans	-37.6	145.8	162.9	-71.7	161.2	167.5	172.5	0	113.9
107	S	25.6	Very low	27.6	Very low	112 Å²	112	132.1 Å²	132.1	78%	0.783	81%	0.813	S	S	*	*				-172.7	149.4	109	-153.1	0	0	0	0	113.7
108	T	23.4	Very low	27.4	Very low	106 Å²	106	131.4 Å²	131.4	65%	0.65	82%	0.816	S	S	*	*			trans	-53.8	146.3	172	48.9	0	0	0	0	115.4
109	N	26.5	Very low	27.5	Very low	153 Å²	153	134.8 Å²	134.8	82%	0.818	82%	0.815	S	S	*	*				159.1	150.6	99.3	-103.9	-17.8	0	0	0	114.7
110	S	28.9	Very low	27.8	Very low	91 Å²	91	134.3 Å²	134.3	64%	0.636	81%	0.807	S	S	*	*			trans	77.2	90.8	140.5	-175.4	0	0	0	0	119.3
111	S	28.6	Very low	27.9	Very low	121 Å²	121	138 Å²	138	85%	0.846	81%	0.809	S	S	*	*			trans	-51.5	124.7	144	29.5	0	0	0	0	112.6
112	K	28.3	Very low	28.2	Very low	188 Å²	188	138.6 Å²	138.6	82%	0.817	81%	0.808	S	S	*	*			trans	-141.2	111	155.4	-104.3	-177.1	-179.6	179.5	0	109.5
113	S	27.1	Very low	28.5	Very low	120 Å²	120	138.1 Å²	138.1	84%	0.839	80%	0.804	S	S	*	*			trans	-64.6	129.2	166.5	33.3	0	0	0	0	110.3
114	V	30	Very low	29.2	Very low	135 Å²	135	136.4 Å²	136.4	82%	0.818	81%	0.806	S	S	*	*			trans	-136.9	114.7	164.1	-177.4	0	0	0	0	107.3
115	E	30.8	Very low	29.7	Very low	179 Å²	179	134.5 Å²	134.5	84%	0.836	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.5	143.9	170.3	-60.9	175.6	165.3	0	0	110.5
116	P	32.4	Very low	30.2	Very low	127 Å²	127	138.9 Å²	138.9	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-100	117.1	162.7	29.1	-16.6	0	0	0	110.7	A118	P116-A118 PolarHBondContact O-N 3.06Å
117	K	27.8	Very low	30.7	Very low	194 Å²	194	138.1 Å²	138.1	84%	0.843	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.9	119.6	160.7	-85.4	-178.5	172	-177.4	0	108.9
118	A	29.3	Very low	31.4	Very low	96 Å²	96	141.3 Å²	141.3	79%	0.793	80%	0.798	S	S	*	*			trans	-78.6	115.2	167.3	0	0	0	0	0	109.4	P116	P116-A118 PolarHBondContact O-N 3.06Å
119	E	27.9	Very low	32.8	Very low	174 Å²	174	140.3 Å²	140.3	81%	0.813	79%	0.788	S	S	*	*			trans	-105.3	112.6	161.3	-81.5	-176.6	179.1	0	0	108.5	K121	E119-K121 PolarHBondContact O-N 3.4Å
120	V	31.5	Very low	34.4	Very low	125 Å²	125	134 Å²	134	76%	0.758	76%	0.76	S	S	*	*			trans	-70.3	115.4	174.7	174.3	0	0	0	0	108.4
121	K	28.7	Very low	36.8	Very low	191 Å²	191	131 Å²	131	83%	0.83	74%	0.743	S	S	*	*			trans	-109.3	100.2	161	-81.9	-170.5	177.8	179.8	0	109.4	E119 S123	E119-K121 PolarHBondContact O-N 3.4Å; K121-S123 PolarHBondContact O-N 2.86Å
122	T	35.4	Very low	39.9	Very low	133 Å²	133	128.5 Å²	128.5	82%	0.816	72%	0.717	S	S	*	*			trans	-75.3	109.3	164.8	-25.5	0	0	0	0	107.9
123	S	33.4	Very low	43.2	Very low	101 Å²	101	119.6 Å²	119.6	71%	0.706	68%	0.678	S	S	*	*			trans	-145.2	118.6	162.1	59.8	0	0	0	0	108.6	K121	K121-S123 PolarHBondContact O-N 2.86Å
124	G	42.3	Very low	46.5	Very low	86 Å²	86	114.4 Å²	114.4	89%	0.887	64%	0.642	S	S	*	*			trans	-48.8	134.5	-170.8	0	0	0	0	0	114.3
125	S	35	Very low	49.8	Very low	83 Å²	83	108.1 Å²	108.1	58%	0.58	60%	0.604	S	S	*	*			trans	-124.3	42.8	-179.5	63	0	0	0	0	111.2	E127	S125-E127 PolarHBondContact O-N 3.24Å
126	E	37	Very low	53.1	Low	195 Å²	195	99.6 Å²	99.6	91%	0.911	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-14.4	173.2	-69	-170.7	163	0	0	112.4
127	E	35.4	Very low	56.2	Low	191 Å²	191	93.5 Å²	93.5	89%	0.893	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-6	-178.7	-68.5	-171.1	161.5	0	0	115.4	S125	S125-E127 PolarHBondContact O-N 3.24Å
128	Q	40	Very low	59.6	Low	179 Å²	179	84.3 Å²	84.3	84%	0.836	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-15.3	179	-71.7	-165.5	32.3	0	0	114.9
129	D	52.8	Low	62.9	Low	84 Å²	84	79.7 Å²	79.7	45%	0.449	45%	0.447	S	S	.	.	S	Bend	trans	-97.6	11.3	-178.4	-166.1	40.4	0	0	0	114	G131	D129-G131 PolarHBondContact O-N 2.9Å
130	G	60.4	Low	66.3	Low	22 Å²	22	71.4 Å²	71.4	23%	0.227	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-46.4	178.3	0	0	0	0	0	111	K132 R207 R235	G130-K132 PolarHBondContact O-N 3.29Å; G130-R207 PolarHBondContact O-NH2 3.14Å; G130-R235 PolarHBondContact O-NE 2.8Å; G130-R235 PolarHBondContact O-NH2 2.87Å
131	G	78.3	Confident	69.5	Low	27 Å²	27	65.7 Å²	65.7	28%	0.278	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25	-164.9	0	0	0	0	0	117.9	D129 R235	D129-G131 PolarHBondContact O-N 2.9Å; G131-R235 VanDerWaalsContact CA-CZ 3.43Å
132	K	93.8	Very high	72.8	Confident	68 Å²	68	56.6 Å²	56.6	30%	0.296	33%	0.333	S	S	.	.			trans	-86.9	141.8	-167.6	-62.2	-173.9	-176.5	-173.2	0	111.6	G130 R207 F234 D353 F379 I380	G130-K132 PolarHBondContact O-N 3.29Å; K132-R207 PolarHBondContact O-NH2 3.07Å; K132-F234 WeakPolarHBondContact O-CZ 3.29Å; K132-D353 WeakPolarHBondContact CE-OD2 3.32Å; K132-D353 IonicContact NZ-OD2 3.86Å; K132-D353 PolarHBondContact NZ-OD2 2.99Å; K132-F379 CarbonylContact C-O 3.51Å; K132-F379 VanDerWaalsContact CA-O 3.23Å; K132-F379 WeakPolarHBondContact CA-O 3.46Å; K132-I380 HydrophobicContact CD-CG1 4.29Å; K132-I380 HydrophobicContact CG-CG1 4.12Å
133	L	97	Very high	75.7	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	131.9	165.7	-178.5	72.4	0	0	0	108.2	D165 V166 F234 L239 L277 M350 S378 F379	L133-D165 HydrophobicContact CD1-CB 3.7Å; L133-V166 HydrophobicContact CD1-CG2 4.4Å; L133-F234 HydrophobicContact CB-CD1 4.25Å; L133-F234 HydrophobicContact CB-CE1 3.84Å; L133-F234 HydrophobicContact CB-CZ 4.25Å; L133-F234 HydrophobicContact CD1-CB 4.39Å; L133-F234 HydrophobicContact CD1-CD1 3.9Å; L133-F234 HydrophobicContact CD1-CD2 3.86Å; L133-F234 HydrophobicContact CD1-CE1 4.07Å; L133-F234 HydrophobicContact CD1-CE2 4.06Å; L133-F234 HydrophobicContact CD1-CG 3.79Å; L133-F234 HydrophobicContact CD1-CZ 4.17Å; L133-L239 HydrophobicContact CD2-CD1 4.05Å; L133-L239 HydrophobicContact CD2-CD2 4.43Å; L133-L277 HydrophobicContact CD2-CD1 3.48Å; L133-L277 VanDerWaalsContact CD2-CD1 3.48Å; L133-M350 HydrophobicContact CB-CE 4.01Å; L133-M350 HydrophobicContact CD2-CE 3.82Å; L133-M350 HydrophobicContact CD2-SD 4.43Å; L133-S378 CarbonylContact O-C 3.52Å; L133-S378 WeakPolarHBondContact O-CA 3.46Å; L133-F379 HydrophobicContact CB-CB 4.4Å; L133-F379 PolarHBondContact N-O 3.41Å; L133-F379 WeakPolarHBondContact O-CD2 3.44Å; L133-F379 PolarHBondContact O-N 3.45Å
134	S	98.3	Very high	78.8	Confident	12 Å²	12	51 Å²	51	8%	0.084	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	143.9	178.3	54.5	0	0	0	0	112.3	P164 D165 V166 C377	S134-P164 WeakPolarHBondContact OG-CA 3.19Å; S134-D165 PolarHBondContact N-OD2 2.84Å; S134-D165 WeakPolarHBondContact O-CB 3.34Å; S134-D165 PolarHBondContact O-N 2.86Å; S134-D165 VanDerWaalsContact O-N 3.11Å; S134-D165 PolarHBondContact OG-N 2.86Å; S134-D165 PolarHBondContact OG-OD2 3.48Å; S134-V166 PolarHBondContact O-N 2.86Å; S134-V166 VanDerWaalsContact O-N 3.07Å; S134-C377 WeakPolarHBondContact CA-O 3.29Å
135	L	98.8	Very high	81.2	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.7	-176.8	176.5	72.7	0	0	0	110.1	V166 F168 V337 Y376 C377 F379	L135-V166 CarbonylContact C-O 3.58Å; L135-V166 VanDerWaalsContact CA-O 3.31Å; L135-V166 WeakPolarHBondContact CA-O 3.25Å; L135-V166 HydrophobicContact CD1-CB 3.72Å; L135-V166 HydrophobicContact CD1-CG1 3.6Å; L135-F168 HydrophobicContact CD1-CD1 4.21Å; L135-F168 HydrophobicContact CD1-CD2 3.64Å; L135-F168 HydrophobicContact CD1-CE1 4.04Å; L135-F168 HydrophobicContact CD1-CE2 3.44Å; L135-F168 VanDerWaalsContact CD1-CE2 3.44Å; L135-F168 HydrophobicContact CD1-CG 4.01Å; L135-F168 HydrophobicContact CD1-CZ 3.65Å; L135-F168 HydrophobicContact CD2-CD2 4.12Å; L135-F168 HydrophobicContact CD2-CE2 3.78Å; L135-F168 HydrophobicContact CG-CD2 4.36Å; L135-F168 HydrophobicContact CG-CE2 4.23Å; L135-V337 HydrophobicContact CD2-CG1 3.77Å; L135-V337 HydrophobicContact CD2-CG2 4.14Å; L135-Y376 CarbonylContact O-C 3.51Å; L135-Y376 WeakPolarHBondContact O-CA 3.32Å; L135-C377 HydrophobicContact CB-CB 4.42Å; L135-C377 PolarHBondContact N-O 2.95Å; L135-C377 PolarHBondContact O-N 3.23Å; L135-F379 HydrophobicContact CB-CE2 4.12Å
136	I	98.9	Very high	84.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.4	158.1	-71.5	-176.8	0	0	0	109.5	W138 L159 Y162 P164 V166 V167 F168 I375 Y376	I136-W138 HydrophobicContact CG2-CB 4.39Å; I136-W138 HydrophobicContact CG2-CE3 4.41Å; I136-L159 HydrophobicContact CD1-CD2 4.39Å; I136-Y162 HydrophobicContact CD1-CG 4.42Å; I136-P164 HydrophobicContact CB-CB 4.42Å; I136-P164 HydrophobicContact CB-CG 4.26Å; I136-P164 HydrophobicContact CD1-CB 4.36Å; I136-P164 HydrophobicContact CD1-CG 3.88Å; I136-P164 HydrophobicContact CG1-CB 4Å; I136-P164 HydrophobicContact CG1-CG 3.96Å; I136-V166 PolarHBondContact N-O 2.99Å; I136-V167 HydrophobicContact CB-CG1 4.24Å; I136-V167 HydrophobicContact CG2-CG1 4.22Å; I136-V167 CarbonylContact O-C 3.54Å; I136-V167 VanDerWaalsContact O-CA 3.27Å; I136-V167 WeakPolarHBondContact O-CA 3.49Å; I136-F168 PolarHBondContact O-N 3.14Å; I136-I375 CarbonylContact C-O 3.47Å; I136-I375 VanDerWaalsContact CA-O 3.24Å; I136-I375 WeakPolarHBondContact CA-O 3.12Å; I136-Y376 HydrophobicContact CD1-CD2 4.3Å; I136-Y376 HydrophobicContact CG1-CD2 3.82Å
137	S	98.9	Very high	86.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.6	166.7	-175.9	0	0	0	0	110	F168 G280 G374 I375	S137-F168 CarbonylContact C-O 3.58Å; S137-F168 VanDerWaalsContact CA-O 3.29Å; S137-F168 WeakPolarHBondContact CA-O 3.26Å; S137-G280 WeakPolarHBondContact OG-CA 3.1Å; S137-G280 PolarHBondContact OG-N 3.49Å; S137-G374 WeakPolarHBondContact O-CA 3.38Å; S137-I375 PolarHBondContact N-O 2.58Å; S137-I375 PolarHBondContact O-N 3.15Å
138	W	98.9	Very high	89.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	121.2	-174.6	-152.5	-15.9	0	0	0	112.9	I136 V140 L155 Y158 F168 L169 Q170 V358 G359 T369 H372 G374	I136-W138 HydrophobicContact CG2-CB 4.39Å; I136-W138 HydrophobicContact CG2-CE3 4.41Å; W138-V140 HydrophobicContact CB-CG1 4.29Å; W138-V140 HydrophobicContact CG-CG1 4.32Å; W138-V140 PolarHBondContact O-N 3.5Å; W138-L155 HydrophobicContact CD2-CD1 4.26Å; W138-L155 HydrophobicContact CE3-CD1 3.47Å; W138-L155 VanDerWaalsContact CE3-CD1 3.47Å; W138-L155 HydrophobicContact CZ3-CD1 3.85Å; W138-Y158 AromaticContact CH2-CD2 3.65Å; W138-Y158 HydrophobicContact CH2-CD2 3.65Å; W138-Y158 AromaticContact CH2-CE2 3.97Å; W138-Y158 HydrophobicContact CH2-CE2 3.97Å; W138-Y158 HydrophobicContact CH2-CG 4.2Å; W138-Y158 AromaticContact CZ3-CD2 3.73Å; W138-Y158 HydrophobicContact CZ3-CD2 3.73Å; W138-Y158 HydrophobicContact CZ3-CE2 4.48Å; W138-Y158 AromaticContact CZ3-CG 3.91Å; W138-Y158 HydrophobicContact CZ3-CG 3.91Å; W138-F168 PolarHBondContact N-O 3.3Å; W138-L169 HydrophobicContact CB-CD2 4.16Å; W138-L169 WeakPolarHBondContact O-CA 3.45Å; W138-Q170 PolarHBondContact O-N 2.93Å; W138-Q170 PolarHBondContact O-OE1 3.4Å; W138-V358 HydrophobicContact CE3-CG2 4.04Å; W138-V358 HydrophobicContact CH2-CG2 4.23Å; W138-V358 HydrophobicContact CZ3-CG2 3.81Å; W138-G359 VanDerWaalsContact CH2-CA 3.45Å; W138-T369 HydrophobicContact CH2-CG2 3.69Å; W138-T369 HydrophobicContact CZ2-CG2 3.64Å; W138-T369 HydrophobicContact CZ3-CG2 4.31Å; W138-H372 PolarHBondContact NE1-O 3.21Å; W138-G374 VanDerWaalsContact CD2-CA 3.5Å; W138-G374 VanDerWaalsContact CE2-N 3.33Å; W138-G374 VanDerWaalsContact CG-CA 3.46Å
139	N	98.9	Very high	92.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	116.5	159.7	-176.8	-22	0	0	0	108.8	D141 Q170 E171 D281 S370 H372	N139-D141 PolarHBondContact OD1-N 3.34Å; N139-D141 VanDerWaalsContact OD1-N 3.08Å; N139-Q170 HydrophobicContact CB-CB 4.06Å; N139-E171 PolarHBondContact ND2-OE1 2.95Å; N139-E171 WeakPolarHBondContact OD1-CB 3.15Å; N139-E171 VanDerWaalsContact OD1-CG 3.23Å; N139-E171 WeakPolarHBondContact OD1-CG 3.43Å; N139-E171 PolarHBondContact OD1-OE1 3.46Å; N139-D281 HydrophobicContact CB-CB 4.17Å; N139-D281 PolarHBondContact ND2-OD2 3.46Å; N139-S370 VanDerWaalsContact O-CB 3.26Å; N139-S370 WeakPolarHBondContact O-CB 3.49Å; N139-S370 PolarHBondContact O-OG 2.73Å; N139-H372 HydrophobicContact CB-CB 4.15Å
140	V	98.7	Very high	94.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.158	C	C	.	.			trans	-95.9	1.4	-170.5	-59.9	0	0	0	0	113.8	W138 G142 R151 L155 L169 Q170 L172 Y176	W138-V140 HydrophobicContact CB-CG1 4.29Å; W138-V140 HydrophobicContact CG-CG1 4.32Å; W138-V140 PolarHBondContact O-N 3.5Å; V140-G142 VanDerWaalsContact C-N 3.26Å; V140-G142 PolarHBondContact O-N 3.07Å; V140-R151 PolarHBondContact O-NH2 3.22Å; V140-L155 HydrophobicContact CG1-CD1 4.35Å; V140-L155 HydrophobicContact CG1-CD2 3.82Å; V140-L169 HydrophobicContact CG1-CD2 3.82Å; V140-Q170 WeakPolarHBondContact CG2-O 3.32Å; V140-Q170 PolarHBondContact N-O 2.95Å; V140-L172 HydrophobicContact CG2-CD2 3.84Å; V140-Y176 HydrophobicContact CB-CE2 4.12Å; V140-Y176 HydrophobicContact CG2-CD2 4.25Å; V140-Y176 HydrophobicContact CG2-CE2 3.75Å
141	D	98.4	Very high	96.4	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.021	15%	0.147	C	C	.	.			trans	49.3	46.3	178	-176.3	32.5	0	0	0	112	N139 L143 D144 R151 K324 S370 D371	N139-D141 PolarHBondContact OD1-N 3.34Å; N139-D141 VanDerWaalsContact OD1-N 3.08Å; D141-L143 PolarHBondContact O-N 2.9Å; D141-L143 VanDerWaalsContact O-N 3.12Å; D141-D144 PolarHBondContact O-N 3.16Å; D141-D144 VanDerWaalsContact OD2-CB 3.27Å; D141-D144 WeakPolarHBondContact OD2-CB 3.47Å; D141-R151 PolarHBondContact O-NH2 2.93Å; D141-R151 IonicContact OD2-NH2 2.8Å; D141-K324 IonicContact OD1-NZ 4Å; D141-K324 PolarHBondContact OD1-NZ 2.9Å; D141-K324 IonicContact OD2-NZ 2.77Å; D141-K324 PolarHBondContact OD2-NZ 3.12Å; D141-S370 WeakPolarHBondContact CB-OG 3.09Å; D141-D371 VanDerWaalsContact CB-OD1 3.32Å; D141-D371 WeakPolarHBondContact CB-OD1 3.2Å
142	G	97.9	Very high	97.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-11.4	178.7	0	0	0	0	0	113.1	V140 D144 E171 I173	V140-G142 VanDerWaalsContact C-N 3.26Å; V140-G142 PolarHBondContact O-N 3.07Å; G142-D144 VanDerWaalsContact C-N 3.35Å; G142-E171 WeakPolarHBondContact CA-O 3.36Å; G142-E171 PolarHBondContact N-O 3.08Å; G142-I173 WeakPolarHBondContact O-CD1 3.31Å
143	L	97.1	Very high	97.5	Very high	90 Å²	90	24.7 Å²	24.7	47%	0.471	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-27.4	171	-65.8	-179.3	0	0	0	112.9	D141 T145 I173 Y197	D141-L143 PolarHBondContact O-N 2.9Å; D141-L143 VanDerWaalsContact O-N 3.12Å; L143-T145 PolarHBondContact O-N 2.77Å; L143-I173 HydrophobicContact CD2-CG2 4.36Å; L143-Y197 HydrophobicContact CD1-CD1 4.03Å; L143-Y197 HydrophobicContact CD1-CE1 4.24Å; L143-Y197 HydrophobicContact CD1-CG 4.16Å; L143-Y197 HydrophobicContact CD2-CD1 3.87Å; L143-Y197 HydrophobicContact CD2-CG 3.99Å; L143-Y197 HydrophobicContact CG-CD1 4.41Å; L143-Y197 HydrophobicContact CG-CG 4.3Å
144	D	97	Very high	97.5	Very high	26 Å²	26	25 Å²	25	14%	0.139	14%	0.137	C	C	.	.			trans	-82.4	105.2	168.8	-178.8	8.5	0	0	0	109.6	D141 G142 V146 R151 R367	D141-D144 PolarHBondContact O-N 3.16Å; D141-D144 VanDerWaalsContact OD2-CB 3.27Å; D141-D144 WeakPolarHBondContact OD2-CB 3.47Å; G142-D144 VanDerWaalsContact C-N 3.35Å; D144-V146 VanDerWaalsContact C-N 3.27Å; D144-V146 PolarHBondContact O-N 3.31Å; D144-V146 WeakPolarHBondContact OD1-CB 3.18Å; D144-V146 WeakPolarHBondContact OD1-CG2 3.46Å; D144-V146 PolarHBondContact OD1-N 2.83Å; D144-R151 PolarHBondContact O-NH1 3.42Å; D144-R151 IonicContact OD2-NH1 3.49Å; D144-R367 IonicContact OD2-CZ 2.88Å; D144-R367 VanDerWaalsContact OD2-CZ 3.3Å; D144-R367 IonicContact OD2-NH1 3.59Å; D144-R367 IonicContact OD2-NH2 2.68Å; D144-R367 PolarHBondContact OD2-NH2 3.4Å
145	T	94.4	Very high	97.5	Very high	103 Å²	103	24.4 Å²	24.4	63%	0.632	13%	0.133	S	C	*	.			trans	-81.3	-5.4	-178	57.7	0	0	0	0	113.5	L143 N147 L148	L143-T145 PolarHBondContact O-N 2.77Å; T145-N147 PolarHBondContact O-N 2.96Å; T145-L148 PolarHBondContact O-N 3.33Å
146	V	95.6	Very high	97.5	Very high	70 Å²	70	25.2 Å²	25.2	42%	0.424	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	122.7	178.8	-178.8	0	0	0	0	109.9	D144 L148 R151	D144-V146 VanDerWaalsContact C-N 3.27Å; D144-V146 PolarHBondContact O-N 3.31Å; D144-V146 WeakPolarHBondContact OD1-CB 3.18Å; D144-V146 WeakPolarHBondContact OD1-CG2 3.46Å; D144-V146 PolarHBondContact OD1-N 2.83Å; V146-L148 PolarHBondContact O-N 3.25Å; V146-R151 PolarHBondContact O-NH1 3.25Å
147	N	96.3	Very high	97.4	Very high	70 Å²	70	28.6 Å²	28.6	37%	0.374	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	32.4	-176.3	-56.9	104.2	0	0	0	113.6	T145 G149 E150 R151 C365	T145-N147 PolarHBondContact O-N 2.96Å; N147-G149 PolarHBondContact O-N 3.4Å; N147-E150 PolarHBondContact O-N 2.84Å; N147-R151 WeakPolarHBondContact O-CB 3.36Å; N147-R151 WeakPolarHBondContact O-CG 3.43Å; N147-R151 PolarHBondContact O-N 2.84Å; N147-C365 HydrophobicContact CB-CB 4.15Å
148	L	96.8	Very high	97.4	Very high	11 Å²	11	29.9 Å²	29.9	6%	0.058	17%	0.167	C	C	.	.	H	α-helix	trans	-61.2	-39.6	-172.2	-174	60.3	0	0	0	113.6	F60 T145 V146 R151 A152 I173 Y176	F60-L148 HydrophobicContact CD1-CB 4.5Å; F60-L148 HydrophobicContact CD1-CD2 3.63Å; F60-L148 HydrophobicContact CD1-CG 3.9Å; F60-L148 HydrophobicContact CE1-CD2 3.79Å; F60-L148 HydrophobicContact CE1-CG 3.85Å; T145-L148 PolarHBondContact O-N 3.33Å; V146-L148 PolarHBondContact O-N 3.25Å; L148-R151 PolarHBondContact O-N 2.86Å; L148-A152 VanDerWaalsContact O-CB 3.32Å; L148-A152 WeakPolarHBondContact O-CB 3.28Å; L148-A152 PolarHBondContact O-N 3.47Å; L148-I173 HydrophobicContact CD2-CD1 3.88Å; L148-Y176 HydrophobicContact CD1-CD2 3.73Å; L148-Y176 HydrophobicContact CD1-CE2 3.65Å; L148-Y176 HydrophobicContact CG-CD2 4.4Å
149	G	95.6	Very high	97.3	Very high	10 Å²	10	30.2 Å²	30.2	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-52	177	0	0	0	0	0	112.4	F60 N147 R151 A152 R153	F60-G149 VanDerWaalsContact CD2-CA 3.48Å; N147-G149 PolarHBondContact O-N 3.4Å; G149-R151 VanDerWaalsContact C-N 3.33Å; G149-R151 PolarHBondContact O-N 2.91Å; G149-A152 PolarHBondContact O-N 3.18Å; G149-R153 PolarHBondContact O-N 3.46Å
150	E	96.6	Very high	97.2	Very high	42 Å²	42	33.7 Å²	33.7	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-63.3	-38.5	177.8	-165	-174.3	135.6	0	0	112.2	E57 N147 R153 G154 L363 D364 C365	E57-E150 PolarHBondContact OE1-N 2.91Å; N147-E150 PolarHBondContact O-N 2.84Å; E150-R153 WeakPolarHBondContact O-CB 3.43Å; E150-R153 PolarHBondContact O-N 3.14Å; E150-G154 PolarHBondContact O-N 3.35Å; E150-L363 HydrophobicContact CG-CB 4.49Å; E150-L363 HydrophobicContact CG-CD1 4.49Å; E150-L363 VanDerWaalsContact OE1-CB 3.24Å; E150-L363 WeakPolarHBondContact OE1-CB 3.47Å; E150-D364 PolarHBondContact OE1-N 3.11Å; E150-C365 VanDerWaalsContact CD-SG 3.55Å; E150-C365 WeakPolarHBondContact OE1-CB 3.37Å; E150-C365 PolarHBondContact OE1-N 2.87Å; E150-C365 PolarHBondContact OE1-SG 2.69Å; E150-C365 VanDerWaalsContact OE2-CB 3.26Å; E150-C365 WeakPolarHBondContact OE2-CB 3.33Å
151	R	98.3	Very high	97.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-41.5	174.4	-75	171.4	54.4	-145	-8.8	112.5	V140 D141 D144 V146 N147 L148 G149 R153 G154 L155 L363 T369	V140-R151 PolarHBondContact O-NH2 3.22Å; D141-R151 PolarHBondContact O-NH2 2.93Å; D141-R151 IonicContact OD2-NH2 2.8Å; D144-R151 PolarHBondContact O-NH1 3.42Å; D144-R151 IonicContact OD2-NH1 3.49Å; V146-R151 PolarHBondContact O-NH1 3.25Å; N147-R151 WeakPolarHBondContact O-CB 3.36Å; N147-R151 WeakPolarHBondContact O-CG 3.43Å; N147-R151 PolarHBondContact O-N 2.84Å; L148-R151 PolarHBondContact O-N 2.86Å; G149-R151 VanDerWaalsContact C-N 3.33Å; G149-R151 PolarHBondContact O-N 2.91Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R151-G154 PolarHBondContact O-N 2.93Å; R151-L155 PolarHBondContact O-N 3.28Å; R151-L363 HydrophobicContact CB-CD1 4.33Å; R151-L363 HydrophobicContact CG-CD1 3.86Å; R151-T369 PolarHBondContact NE-O 3.28Å; R151-T369 PolarHBondContact NH2-O 2.99Å
152	A	98.1	Very high	97	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-37.7	174.2	0	0	0	0	0	111.9	F60 L148 G149 L155 C156 Y176 Y179	F60-A152 HydrophobicContact CE2-CB 4.06Å; F60-A152 HydrophobicContact CZ-CB 3.72Å; L148-A152 VanDerWaalsContact O-CB 3.32Å; L148-A152 WeakPolarHBondContact O-CB 3.28Å; L148-A152 PolarHBondContact O-N 3.47Å; G149-A152 PolarHBondContact O-N 3.18Å; A152-L155 WeakPolarHBondContact O-CB 3.17Å; A152-L155 PolarHBondContact O-N 3.3Å; A152-C156 PolarHBondContact O-N 3.48Å; A152-C156 VanDerWaalsContact O-N 3.08Å; A152-Y176 WeakPolarHBondContact CA-OH 3.38Å; A152-Y176 HydrophobicContact CB-CD1 4.12Å; A152-Y176 HydrophobicContact CB-CE1 3.54Å; A152-Y176 HydrophobicContact CB-CE2 4.21Å; A152-Y179 VanDerWaalsContact C-CE1 3.47Å; A152-Y179 HydrophobicContact CB-CD1 3.55Å; A152-Y179 HydrophobicContact CB-CE1 3.58Å; A152-Y179 HydrophobicContact CB-CG 4.26Å
153	R	96.7	Very high	97	Very high	78 Å²	78	46.1 Å²	46.1	29%	0.294	26%	0.261	S	S	.	.	H	α-helix	trans	-60	-45.5	169.4	-166.8	-170.1	-53.2	158.6	3.7	111.8	E53 E57 G149 E150 R151 L155 C156 S157 Y179	E53-R153 VanDerWaalsContact CG-CZ 3.47Å; E53-R153 IonicContact OE1-CZ 3.61Å; E53-R153 IonicContact OE1-NE 3.37Å; E53-R153 PolarHBondContact OE1-NE 2.86Å; E53-R153 IonicContact OE1-NH2 3.25Å; E53-R153 PolarHBondContact OE1-NH2 2.78Å; E53-R153 IonicContact OE2-NE 2.86Å; E57-R153 IonicContact OE1-CZ 2.51Å; E57-R153 IonicContact OE1-NE 3.81Å; E57-R153 IonicContact OE1-NH2 3.54Å; E57-R153 PolarHBondContact OE1-NH2 3.46Å; E57-R153 IonicContact OE2-NH2 2.69Å; E57-R153 PolarHBondContact OE2-NH2 3.42Å; G149-R153 PolarHBondContact O-N 3.46Å; E150-R153 WeakPolarHBondContact O-CB 3.43Å; E150-R153 PolarHBondContact O-N 3.14Å; R151-R153 VanDerWaalsContact C-N 3.32Å; R153-L155 VanDerWaalsContact C-N 3.33Å; R153-L155 PolarHBondContact O-N 2.99Å; R153-C156 WeakPolarHBondContact O-CA 3.35Å; R153-C156 WeakPolarHBondContact O-CB 3.38Å; R153-C156 PolarHBondContact O-N 2.9Å; R153-S157 PolarHBondContact O-N 3.09Å; R153-S157 PolarHBondContact O-OG 3.33Å; R153-Y179 VanDerWaalsContact CA-OH 3.25Å; R153-Y179 WeakPolarHBondContact CA-OH 3.26Å; R153-Y179 WeakPolarHBondContact CB-OH 3.38Å
154	G	97.9	Very high	97	Very high	6 Å²	6	41.9 Å²	41.9	6%	0.062	24%	0.238	C	C	.	.	H	α-helix	trans	-52.8	-48.3	174.2	0	0	0	0	0	112.2	E150 R151 C156 S157 Y158	E150-G154 PolarHBondContact O-N 3.35Å; R151-G154 PolarHBondContact O-N 2.93Å; G154-C156 PolarHBondContact O-N 3.02Å; G154-S157 WeakPolarHBondContact O-CB 3.48Å; G154-S157 PolarHBondContact O-N 3.24Å; G154-Y158 WeakPolarHBondContact O-CD2 3.45Å; G154-Y158 PolarHBondContact O-N 3.46Å
155	L	98.5	Very high	97.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-56.3	-49.2	173.1	174.6	65.9	0	0	0	111.8	W138 V140 R151 A152 R153 S157 Y158 L159 L169 Y176 L180 T369	W138-L155 HydrophobicContact CD2-CD1 4.26Å; W138-L155 HydrophobicContact CE3-CD1 3.47Å; W138-L155 VanDerWaalsContact CE3-CD1 3.47Å; W138-L155 HydrophobicContact CZ3-CD1 3.85Å; V140-L155 HydrophobicContact CG1-CD1 4.35Å; V140-L155 HydrophobicContact CG1-CD2 3.82Å; R151-L155 PolarHBondContact O-N 3.28Å; A152-L155 WeakPolarHBondContact O-CB 3.17Å; A152-L155 PolarHBondContact O-N 3.3Å; R153-L155 VanDerWaalsContact C-N 3.33Å; R153-L155 PolarHBondContact O-N 2.99Å; L155-S157 VanDerWaalsContact C-N 3.27Å; L155-S157 PolarHBondContact O-N 2.93Å; L155-Y158 WeakPolarHBondContact O-CB 3.28Å; L155-Y158 PolarHBondContact O-N 3.38Å; L155-Y158 VanDerWaalsContact O-N 3.09Å; L155-L159 HydrophobicContact CD1-CG 4.46Å; L155-L159 HydrophobicContact CG-CD1 4.4Å; L155-L159 HydrophobicContact CG-CG 4.46Å; L155-L159 WeakPolarHBondContact O-CG 3.48Å; L155-L159 PolarHBondContact O-N 2.98Å; L155-L169 HydrophobicContact CD1-CD2 4.26Å; L155-L169 HydrophobicContact CD2-CD1 4.03Å; L155-L169 HydrophobicContact CD2-CD2 4.21Å; L155-Y176 HydrophobicContact CD2-CE1 3.82Å; L155-L180 HydrophobicContact CD2-CD2 4.16Å; L155-T369 HydrophobicContact CB-CG2 4.02Å
156	C	98.1	Very high	97.3	Very high	19 Å²	19	35.9 Å²	35.9	13%	0.128	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-35	179.2	-71.3	0	0	0	0	113	A152 R153 G154 Y158 L159 A160 R183	A152-C156 PolarHBondContact O-N 3.48Å; A152-C156 VanDerWaalsContact O-N 3.08Å; R153-C156 WeakPolarHBondContact O-CA 3.35Å; R153-C156 WeakPolarHBondContact O-CB 3.38Å; R153-C156 PolarHBondContact O-N 2.9Å; G154-C156 PolarHBondContact O-N 3.02Å; C156-Y158 VanDerWaalsContact C-N 3.34Å; C156-Y158 PolarHBondContact O-N 3.05Å; C156-L159 PolarHBondContact O-N 2.92Å; C156-A160 WeakPolarHBondContact O-CB 3.47Å; C156-A160 PolarHBondContact O-N 2.75Å; C156-R183 VanDerWaalsContact SG-CB 3.59Å
157	S	97.1	Very high	97.5	Very high	72 Å²	72	32.5 Å²	32.5	50%	0.503	18%	0.182	S	C	.	.	H	α-helix	trans	-60.6	-41.7	173.4	-61.2	0	0	0	0	111.9	R153 G154 L155 A160 L161	R153-S157 PolarHBondContact O-N 3.09Å; R153-S157 PolarHBondContact O-OG 3.33Å; G154-S157 WeakPolarHBondContact O-CB 3.48Å; G154-S157 PolarHBondContact O-N 3.24Å; L155-S157 VanDerWaalsContact C-N 3.27Å; L155-S157 PolarHBondContact O-N 2.93Å; S157-A160 PolarHBondContact O-N 3.45Å; S157-L161 WeakPolarHBondContact O-CB 3.31Å; S157-L161 PolarHBondContact O-N 2.96Å
158	Y	98.2	Very high	97.6	Very high	27 Å²	27	29.2 Å²	29.2	11%	0.106	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-39.9	173.5	-75.2	-76.9	0	0	0	112.6	W138 G154 L155 C156 A160 L161 Y162 V358 G359 E361	W138-Y158 AromaticContact CH2-CD2 3.65Å; W138-Y158 HydrophobicContact CH2-CD2 3.65Å; W138-Y158 AromaticContact CH2-CE2 3.97Å; W138-Y158 HydrophobicContact CH2-CE2 3.97Å; W138-Y158 HydrophobicContact CH2-CG 4.2Å; W138-Y158 AromaticContact CZ3-CD2 3.73Å; W138-Y158 HydrophobicContact CZ3-CD2 3.73Å; W138-Y158 HydrophobicContact CZ3-CE2 4.48Å; W138-Y158 AromaticContact CZ3-CG 3.91Å; W138-Y158 HydrophobicContact CZ3-CG 3.91Å; G154-Y158 WeakPolarHBondContact O-CD2 3.45Å; G154-Y158 PolarHBondContact O-N 3.46Å; L155-Y158 WeakPolarHBondContact O-CB 3.28Å; L155-Y158 PolarHBondContact O-N 3.38Å; L155-Y158 VanDerWaalsContact O-N 3.09Å; C156-Y158 VanDerWaalsContact C-N 3.34Å; C156-Y158 PolarHBondContact O-N 3.05Å; Y158-A160 VanDerWaalsContact C-N 3.3Å; Y158-A160 PolarHBondContact O-N 3.23Å; Y158-L161 PolarHBondContact O-N 3.5Å; Y158-Y162 HydrophobicContact CD1-CD2 4.11Å; Y158-Y162 AromaticContact CD1-CE2 3.74Å; Y158-Y162 HydrophobicContact CD1-CE2 3.74Å; Y158-Y162 HydrophobicContact CE1-CE2 4.32Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.28Å; Y158-Y162 PolarHBondContact O-N 3.29Å; Y158-V358 HydrophobicContact CD1-CB 3.86Å; Y158-V358 HydrophobicContact CD1-CG1 4.41Å; Y158-V358 HydrophobicContact CE1-CB 4.04Å; Y158-G359 VanDerWaalsContact CZ-CA 3.44Å; Y158-G359 VanDerWaalsContact CZ-N 3.33Å; Y158-G359 WeakPolarHBondContact OH-CA 3.32Å; Y158-G359 PolarHBondContact OH-N 2.77Å; Y158-E361 PolarHBondContact OH-OE2 2.79Å
159	L	98.1	Very high	97.7	Very high	7 Å²	7	28.7 Å²	28.7	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-37.8	175.8	-61.8	-175.5	0	0	0	111.8	I136 L155 C156 T163 P164 V167 A184 M202	I136-L159 HydrophobicContact CD1-CD2 4.39Å; L155-L159 HydrophobicContact CD1-CG 4.46Å; L155-L159 HydrophobicContact CG-CD1 4.4Å; L155-L159 HydrophobicContact CG-CG 4.46Å; L155-L159 WeakPolarHBondContact O-CG 3.48Å; L155-L159 PolarHBondContact O-N 2.98Å; C156-L159 PolarHBondContact O-N 2.92Å; L159-T163 WeakPolarHBondContact O-CA 3.36Å; L159-T163 PolarHBondContact O-N 3.31Å; L159-P164 HydrophobicContact CD2-CG 4.04Å; L159-V167 HydrophobicContact CD2-CG1 4.02Å; L159-V167 HydrophobicContact CD2-CG2 3.76Å; L159-A184 HydrophobicContact CD1-CB 4.47Å; L159-M202 HydrophobicContact CD1-CE 3.94Å; L159-M202 HydrophobicContact CD1-SD 4.19Å
160	A	96.4	Very high	97.9	Very high	73 Å²	73	28.2 Å²	28.2	60%	0.603	16%	0.157	S	C	*	.	H	α-helix	trans	-70.8	-37.7	175.4	0	0	0	0	0	112.4	C156 S157 Y158 T163	C156-A160 WeakPolarHBondContact O-CB 3.47Å; C156-A160 PolarHBondContact O-N 2.75Å; S157-A160 PolarHBondContact O-N 3.45Å; Y158-A160 VanDerWaalsContact C-N 3.3Å; Y158-A160 PolarHBondContact O-N 3.23Å; A160-T163 WeakPolarHBondContact O-CG2 3.45Å
161	L	96.3	Very high	98	Very high	125 Å²	125	27.2 Å²	27.2	65%	0.654	15%	0.152	S	C	*	.	H	α-helix	trans	-70.5	-49.3	-179.7	177.6	60.4	0	0	0	112.4	S157 Y158	S157-L161 WeakPolarHBondContact O-CB 3.31Å; S157-L161 PolarHBondContact O-N 2.96Å; Y158-L161 PolarHBondContact O-N 3.5Å
162	Y	96.8	Very high	98	Very high	78 Å²	78	27.3 Å²	27.3	31%	0.306	15%	0.152	S	C	.	.	H	α-helix	trans	-89.8	-22.9	-175.3	-72.6	-92	0	0	0	112.7	I136 Y158 P164 V358 Y376	I136-Y162 HydrophobicContact CD1-CG 4.42Å; Y158-Y162 HydrophobicContact CD1-CD2 4.11Å; Y158-Y162 AromaticContact CD1-CE2 3.74Å; Y158-Y162 HydrophobicContact CD1-CE2 3.74Å; Y158-Y162 HydrophobicContact CE1-CE2 4.32Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.28Å; Y158-Y162 PolarHBondContact O-N 3.29Å; Y162-P164 VanDerWaalsContact C-CD 3.49Å; Y162-P164 VanDerWaalsContact C-N 3.31Å; Y162-V358 HydrophobicContact CD2-CG1 4.42Å; Y162-V358 HydrophobicContact CE1-CG1 4.24Å; Y162-V358 HydrophobicContact CE2-CG1 3.78Å; Y162-Y376 HydrophobicContact CD1-CD1 4.23Å; Y162-Y376 AromaticContact CD1-CD2 3.58Å; Y162-Y376 HydrophobicContact CD1-CD2 3.58Å; Y162-Y376 HydrophobicContact CD1-CE1 4.33Å; Y162-Y376 AromaticContact CD1-CE2 3.68Å; Y162-Y376 HydrophobicContact CD1-CE2 3.68Å; Y162-Y376 AromaticContact CD1-CG 3.87Å; Y162-Y376 HydrophobicContact CD1-CG 3.87Å; Y162-Y376 HydrophobicContact CE1-CD1 4.28Å; Y162-Y376 HydrophobicContact CE1-CD2 4.3Å; Y162-Y376 HydrophobicContact CE1-CG 4.13Å; Y162-Y376 HydrophobicContact CG-CD2 4.11Å; Y162-Y376 HydrophobicContact CG-CE2 4.29Å
163	T	97	Very high	98	Very high	62 Å²	62	28.6 Å²	28.6	38%	0.38	16%	0.159	S	C	.	.			trans	45	46.6	-176.6	75.8	0	0	0	0	114.4	L159 A160 Y187 K204	L159-T163 WeakPolarHBondContact O-CA 3.36Å; L159-T163 PolarHBondContact O-N 3.31Å; A160-T163 WeakPolarHBondContact O-CG2 3.45Å; T163-Y187 VanDerWaalsContact C-OH 3.27Å; T163-K204 WeakPolarHBondContact O-CD 3.35Å; T163-K204 PolarHBondContact O-NZ 3.06Å; T163-K204 PolarHBondContact OG1-NZ 2.85Å
164	P	98.1	Very high	98	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.16	C	C	.	.			trans	-58.8	149.8	-171.5	29	-39.4	0	0	0	112.5	S134 I136 L159 Y162 V167 Y187	S134-P164 WeakPolarHBondContact OG-CA 3.19Å; I136-P164 HydrophobicContact CB-CB 4.42Å; I136-P164 HydrophobicContact CB-CG 4.26Å; I136-P164 HydrophobicContact CD1-CB 4.36Å; I136-P164 HydrophobicContact CD1-CG 3.88Å; I136-P164 HydrophobicContact CG1-CB 4Å; I136-P164 HydrophobicContact CG1-CG 3.96Å; L159-P164 HydrophobicContact CD2-CG 4.04Å; Y162-P164 VanDerWaalsContact C-CD 3.49Å; Y162-P164 VanDerWaalsContact C-N 3.31Å; P164-V167 HydrophobicContact CB-CG2 4.36Å; P164-V167 HydrophobicContact CG-CG2 3.55Å; P164-Y187 VanDerWaalsContact CD-OH 3.32Å; P164-Y187 WeakPolarHBondContact CD-OH 3.5Å; P164-Y187 WeakPolarHBondContact O-CE1 3.37Å; P164-Y187 VanDerWaalsContact O-CZ 3.32Å; P164-Y187 PolarHBondContact O-OH 2.93Å
165	D	98.6	Very high	97.9	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.011	17%	0.17	C	C	.	.	S	Bend	trans	-70.7	-38.3	177.6	-66.4	-57.6	0	0	0	112	L133 S134 K204 R207 V208	L133-D165 HydrophobicContact CD1-CB 3.7Å; S134-D165 PolarHBondContact N-OD2 2.84Å; S134-D165 WeakPolarHBondContact O-CB 3.34Å; S134-D165 PolarHBondContact O-N 2.86Å; S134-D165 VanDerWaalsContact O-N 3.11Å; S134-D165 PolarHBondContact OG-N 2.86Å; S134-D165 PolarHBondContact OG-OD2 3.48Å; D165-K204 PolarHBondContact O-N 3.2Å; D165-R207 WeakPolarHBondContact OD1-CB 3.28Å; D165-R207 WeakPolarHBondContact OD1-CD 3.15Å; D165-R207 IonicContact OD1-CZ 2.67Å; D165-R207 IonicContact OD1-NE 3.92Å; D165-R207 PolarHBondContact OD1-NE 2.79Å; D165-R207 IonicContact OD1-NH2 3.34Å; D165-R207 IonicContact OD2-CZ 3.54Å; D165-R207 IonicContact OD2-NE 2.66Å; D165-R207 IonicContact OD2-NH2 3.75Å; D165-R207 PolarHBondContact OD2-NH2 2.76Å; D165-V208 HydrophobicContact CB-CG2 3.87Å
166	V	98.8	Very high	97.8	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	139.5	-179.6	-176.5	0	0	0	0	109.2	L133 S134 L135 I136 F168 M202 L203 V208 V241	L133-V166 HydrophobicContact CD1-CG2 4.4Å; S134-V166 PolarHBondContact O-N 2.86Å; S134-V166 VanDerWaalsContact O-N 3.07Å; L135-V166 CarbonylContact C-O 3.58Å; L135-V166 VanDerWaalsContact CA-O 3.31Å; L135-V166 WeakPolarHBondContact CA-O 3.25Å; L135-V166 HydrophobicContact CD1-CB 3.72Å; L135-V166 HydrophobicContact CD1-CG1 3.6Å; I136-V166 PolarHBondContact N-O 2.99Å; V166-F168 HydrophobicContact CG1-CD1 3.92Å; V166-F168 HydrophobicContact CG1-CE1 3.31Å; V166-F168 HydrophobicContact CG1-CZ 3.83Å; V166-M202 CarbonylContact C-O 3.57Å; V166-M202 WeakPolarHBondContact CA-O 3.06Å; V166-L203 HydrophobicContact CG1-CD2 4.28Å; V166-L203 HydrophobicContact CG2-CD2 4.13Å; V166-V208 HydrophobicContact CG2-CG2 4.39Å; V166-V241 HydrophobicContact CG1-CB 4.46Å; V166-V241 HydrophobicContact CG1-CG1 4.32Å; V166-V241 HydrophobicContact CG2-CG1 4.36Å
167	V	98.9	Very high	97.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.2	173.4	-167.6	0	0	0	0	109.6	I136 L159 P164 L169 Y187 L201 M202	I136-V167 HydrophobicContact CB-CG1 4.24Å; I136-V167 HydrophobicContact CG2-CG1 4.22Å; I136-V167 CarbonylContact O-C 3.54Å; I136-V167 VanDerWaalsContact O-CA 3.27Å; I136-V167 WeakPolarHBondContact O-CA 3.49Å; L159-V167 HydrophobicContact CD2-CG1 4.02Å; L159-V167 HydrophobicContact CD2-CG2 3.76Å; P164-V167 HydrophobicContact CB-CG2 4.36Å; P164-V167 HydrophobicContact CG-CG2 3.55Å; V167-L169 HydrophobicContact CG1-CD2 3.64Å; V167-L169 HydrophobicContact CG1-CG 3.88Å; V167-Y187 HydrophobicContact CG2-CD1 4.5Å; V167-Y187 HydrophobicContact CG2-CE1 4.02Å; V167-L201 CarbonylContact O-C 3.57Å; V167-L201 WeakPolarHBondContact O-CA 3.32Å; V167-M202 HydrophobicContact CB-CB 3.88Å; V167-M202 HydrophobicContact CB-CG 4.18Å; V167-M202 HydrophobicContact CB-SD 4.19Å; V167-M202 HydrophobicContact CG1-SD 4.29Å; V167-M202 HydrophobicContact CG2-CB 4.18Å; V167-M202 PolarHBondContact N-O 2.88Å; V167-M202 PolarHBondContact O-N 3.47Å
168	F	98.9	Very high	97.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119	171.3	-59.9	-25.6	0	0	0	109.1	L135 I136 S137 W138 V166 L201 V241 M242 T243 G279	L135-F168 HydrophobicContact CD1-CD1 4.21Å; L135-F168 HydrophobicContact CD1-CD2 3.64Å; L135-F168 HydrophobicContact CD1-CE1 4.04Å; L135-F168 HydrophobicContact CD1-CE2 3.44Å; L135-F168 VanDerWaalsContact CD1-CE2 3.44Å; L135-F168 HydrophobicContact CD1-CG 4.01Å; L135-F168 HydrophobicContact CD1-CZ 3.65Å; L135-F168 HydrophobicContact CD2-CD2 4.12Å; L135-F168 HydrophobicContact CD2-CE2 3.78Å; L135-F168 HydrophobicContact CG-CD2 4.36Å; L135-F168 HydrophobicContact CG-CE2 4.23Å; I136-F168 PolarHBondContact O-N 3.14Å; S137-F168 CarbonylContact C-O 3.58Å; S137-F168 VanDerWaalsContact CA-O 3.29Å; S137-F168 WeakPolarHBondContact CA-O 3.26Å; W138-F168 PolarHBondContact N-O 3.3Å; V166-F168 HydrophobicContact CG1-CD1 3.92Å; V166-F168 HydrophobicContact CG1-CE1 3.31Å; V166-F168 HydrophobicContact CG1-CZ 3.83Å; F168-L201 HydrophobicContact CD1-CD1 4.35Å; F168-L201 HydrophobicContact CD1-CG 4.06Å; F168-L201 HydrophobicContact CE1-CD1 4.01Å; F168-L201 HydrophobicContact CE1-CG 4.05Å; F168-V241 HydrophobicContact CE1-CB 3.99Å; F168-V241 HydrophobicContact CZ-CB 3.9Å; F168-V241 HydrophobicContact CZ-CG1 4.38Å; F168-M242 WeakPolarHBondContact CE2-O 3.28Å; F168-T243 HydrophobicContact CD1-CG2 4.26Å; F168-G279 WeakPolarHBondContact CD2-O 3.48Å
169	L	98.9	Very high	97.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.5	177.8	-59.3	-178.5	0	0	0	110.3	W138 V140 L155 V167 L172 L180 T199 G200 M202	W138-L169 HydrophobicContact CB-CD2 4.16Å; W138-L169 WeakPolarHBondContact O-CA 3.45Å; V140-L169 HydrophobicContact CG1-CD2 3.82Å; L155-L169 HydrophobicContact CD1-CD2 4.26Å; L155-L169 HydrophobicContact CD2-CD1 4.03Å; L155-L169 HydrophobicContact CD2-CD2 4.21Å; V167-L169 HydrophobicContact CG1-CD2 3.64Å; V167-L169 HydrophobicContact CG1-CG 3.88Å; L169-L172 HydrophobicContact CB-CD1 3.89Å; L169-L172 HydrophobicContact CB-CD2 4.24Å; L169-L172 HydrophobicContact CB-CG 3.97Å; L169-L172 HydrophobicContact CD1-CD1 4.22Å; L169-L172 HydrophobicContact CD1-CD2 4.02Å; L169-L180 HydrophobicContact CD1-CD1 3.71Å; L169-T199 CarbonylContact O-C 3.58Å; L169-T199 WeakPolarHBondContact O-CA 3.49Å; L169-T199 WeakPolarHBondContact O-CB 3.41Å; L169-G200 PolarHBondContact N-O 3.44Å; L169-G200 PolarHBondContact O-N 3.48Å; L169-M202 HydrophobicContact CD1-CG 4.49Å; L169-M202 HydrophobicContact CD1-SD 3.62Å; L169-M202 HydrophobicContact CG-SD 4.4Å
170	Q	98.9	Very high	97.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	155.3	171.7	-56.3	78.8	43.6	0	0	109.8	W138 N139 V140 L172 T199 T243 H245 G280 D281	W138-Q170 PolarHBondContact O-N 2.93Å; W138-Q170 PolarHBondContact O-OE1 3.4Å; N139-Q170 HydrophobicContact CB-CB 4.06Å; V140-Q170 WeakPolarHBondContact CG2-O 3.32Å; V140-Q170 PolarHBondContact N-O 2.95Å; Q170-L172 VanDerWaalsContact C-N 3.32Å; Q170-L172 PolarHBondContact O-N 2.69Å; Q170-T199 HydrophobicContact CB-CG2 4.5Å; Q170-T199 HydrophobicContact CG-CG2 4.07Å; Q170-T243 PolarHBondContact NE2-OG1 2.51Å; Q170-H245 HydrophobicContact CB-CB 4.01Å; Q170-H245 HydrophobicContact CG-CB 3.89Å; Q170-G280 VanDerWaalsContact NE2-CA 3.34Å; Q170-D281 HydrophobicContact CG-CB 4.26Å
171	E	98.7	Very high	97.6	Very high	21 Å²	21	29 Å²	29	10%	0.098	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	60.1	36.8	-176.1	-57.8	-168.9	-158.5	0	0	114.5	N139 G142 Y197 F198 H245	N139-E171 PolarHBondContact ND2-OE1 2.95Å; N139-E171 WeakPolarHBondContact OD1-CB 3.15Å; N139-E171 VanDerWaalsContact OD1-CG 3.23Å; N139-E171 WeakPolarHBondContact OD1-CG 3.43Å; N139-E171 PolarHBondContact OD1-OE1 3.46Å; G142-E171 WeakPolarHBondContact CA-O 3.36Å; G142-E171 PolarHBondContact N-O 3.08Å; E171-Y197 HydrophobicContact CG-CD2 4.16Å; E171-Y197 HydrophobicContact CG-CE2 4.45Å; E171-F198 PolarHBondContact N-O 3.37Å; E171-H245 IonicContact OE1-CE1 2.73Å; E171-H245 PolarHBondContact OE1-CE1 3.07Å
172	L	98.6	Very high	97.5	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	146.4	165.5	-69.2	177	0	0	0	110.4	V140 L169 Q170 Y176 V177 L180 Y197 F198	V140-L172 HydrophobicContact CG2-CD2 3.84Å; L169-L172 HydrophobicContact CB-CD1 3.89Å; L169-L172 HydrophobicContact CB-CD2 4.24Å; L169-L172 HydrophobicContact CB-CG 3.97Å; L169-L172 HydrophobicContact CD1-CD1 4.22Å; L169-L172 HydrophobicContact CD1-CD2 4.02Å; Q170-L172 VanDerWaalsContact C-N 3.32Å; Q170-L172 PolarHBondContact O-N 2.69Å; L172-Y176 HydrophobicContact CD2-CD1 3.89Å; L172-Y176 HydrophobicContact CD2-CE1 4.41Å; L172-Y176 HydrophobicContact CD2-CG 4Å; L172-V177 HydrophobicContact CB-CG2 4.18Å; L172-V177 HydrophobicContact CD1-CG2 4.15Å; L172-L180 HydrophobicContact CD2-CD1 3.89Å; L172-Y197 CarbonylContact O-C 3.54Å; L172-Y197 WeakPolarHBondContact O-CA 3.25Å; L172-Y197 WeakPolarHBondContact O-CB 3.37Å; L172-F198 HydrophobicContact CB-CD2 4.18Å; L172-F198 HydrophobicContact CB-CE2 4.1Å; L172-F198 PolarHBondContact N-O 3.25Å; L172-F198 PolarHBondContact O-N 3.08Å
173	I	97.9	Very high	97.3	Very high	27 Å²	27	27.3 Å²	27.3	14%	0.138	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	162.1	167.6	60	165.8	0	0	0	108.9	G142 L143 L148 P175 Y176 V177	G142-I173 WeakPolarHBondContact O-CD1 3.31Å; L143-I173 HydrophobicContact CD2-CG2 4.36Å; L148-I173 HydrophobicContact CD2-CD1 3.88Å; I173-P175 HydrophobicContact CD1-CB 4.47Å; I173-P175 HydrophobicContact CD1-CG 4.24Å; I173-Y176 WeakPolarHBondContact O-CA 3.37Å; I173-Y176 VanDerWaalsContact O-CB 3.25Å; I173-Y176 WeakPolarHBondContact O-CB 3.38Å; I173-Y176 PolarHBondContact O-N 2.87Å; I173-V177 PolarHBondContact O-N 3.43Å
174	E	96.3	Very high	97.2	Very high	69 Å²	69	24.7 Å²	24.7	32%	0.322	12%	0.115	S	C	.	.	H	α-helix	trans	-51.6	-48.6	-176.1	177.9	61.2	-155.7	0	0	113.8	Y176 V177 Q178	E174-Y176 VanDerWaalsContact C-N 3.26Å; E174-Y176 PolarHBondContact O-N 2.82Å; E174-V177 PolarHBondContact O-N 3.25Å; E174-V177 VanDerWaalsContact O-N 3.11Å; E174-Q178 WeakPolarHBondContact O-CG 3.24Å; E174-Q178 PolarHBondContact O-N 2.94Å; E174-Q178 PolarHBondContact OE1-NE2 3.13Å
175	P	96.3	Very high	97.1	Very high	42 Å²	42	29.2 Å²	29.2	27%	0.273	14%	0.142	S	C	.	.	H	α-helix	trans	-55.9	-38.4	174.4	-29.6	37.3	0	0	0	114.2	F60 I173 Q178 Y179	F60-P175 HydrophobicContact CD1-CB 3.72Å; F60-P175 HydrophobicContact CE1-CB 3.98Å; I173-P175 HydrophobicContact CD1-CB 4.47Å; I173-P175 HydrophobicContact CD1-CG 4.24Å; P175-Q178 PolarHBondContact O-N 2.85Å; P175-Y179 PolarHBondContact O-N 2.97Å
176	Y	97.6	Very high	97	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-42.7	178.7	-148.6	-48.7	0	0	0	110.4	F60 V140 L148 A152 L155 L172 I173 E174 Q178 Y179 L180	F60-Y176 HydrophobicContact CE1-CG 4.46Å; V140-Y176 HydrophobicContact CB-CE2 4.12Å; V140-Y176 HydrophobicContact CG2-CD2 4.25Å; V140-Y176 HydrophobicContact CG2-CE2 3.75Å; L148-Y176 HydrophobicContact CD1-CD2 3.73Å; L148-Y176 HydrophobicContact CD1-CE2 3.65Å; L148-Y176 HydrophobicContact CG-CD2 4.4Å; A152-Y176 WeakPolarHBondContact CA-OH 3.38Å; A152-Y176 HydrophobicContact CB-CD1 4.12Å; A152-Y176 HydrophobicContact CB-CE1 3.54Å; A152-Y176 HydrophobicContact CB-CE2 4.21Å; L155-Y176 HydrophobicContact CD2-CE1 3.82Å; L172-Y176 HydrophobicContact CD2-CD1 3.89Å; L172-Y176 HydrophobicContact CD2-CE1 4.41Å; L172-Y176 HydrophobicContact CD2-CG 4Å; I173-Y176 WeakPolarHBondContact O-CA 3.37Å; I173-Y176 VanDerWaalsContact O-CB 3.25Å; I173-Y176 WeakPolarHBondContact O-CB 3.38Å; I173-Y176 PolarHBondContact O-N 2.87Å; E174-Y176 VanDerWaalsContact C-N 3.26Å; E174-Y176 PolarHBondContact O-N 2.82Å; Y176-Q178 VanDerWaalsContact C-N 3.35Å; Y176-Q178 PolarHBondContact O-N 2.85Å; Y176-Y179 WeakPolarHBondContact O-CB 3.38Å; Y176-Y179 PolarHBondContact O-N 3.46Å; Y176-L180 HydrophobicContact CD1-CD1 3.95Å; Y176-L180 HydrophobicContact CD1-CG 4Å; Y176-L180 HydrophobicContact CE1-CD1 4.28Å; Y176-L180 HydrophobicContact CE1-CD2 4.43Å; Y176-L180 HydrophobicContact CE1-CG 4.28Å; Y176-L180 WeakPolarHBondContact O-CG 3.42Å; Y176-L180 PolarHBondContact O-N 3.49Å
177	V	97.1	Very high	97	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.8	-41.3	176.4	177	0	0	0	0	111.4	L172 I173 E174 Y179 L180 K181 E191 F198	L172-V177 HydrophobicContact CB-CG2 4.18Å; L172-V177 HydrophobicContact CD1-CG2 4.15Å; I173-V177 PolarHBondContact O-N 3.43Å; E174-V177 PolarHBondContact O-N 3.25Å; E174-V177 VanDerWaalsContact O-N 3.11Å; V177-Y179 VanDerWaalsContact C-N 3.33Å; V177-Y179 PolarHBondContact O-N 2.97Å; V177-L180 PolarHBondContact O-N 3.23Å; V177-K181 HydrophobicContact CG1-CD 4.1Å; V177-K181 HydrophobicContact CG1-CG 4.37Å; V177-K181 WeakPolarHBondContact O-CG 3.45Å; V177-K181 PolarHBondContact O-N 2.88Å; V177-E191 HydrophobicContact CG1-CG 4.17Å; V177-E191 WeakPolarHBondContact CG1-OE1 3.17Å; V177-F198 HydrophobicContact CG2-CE2 3.62Å; V177-F198 HydrophobicContact CG2-CZ 3.71Å
178	Q	96.2	Very high	97	Very high	79 Å²	79	35.1 Å²	35.1	37%	0.369	18%	0.18	S	C	.	.	H	α-helix	trans	-61.2	-43.8	176.4	-68.7	178.3	2.4	0	0	111.5	E174 P175 Y176 L180 K181 K182	E174-Q178 WeakPolarHBondContact O-CG 3.24Å; E174-Q178 PolarHBondContact O-N 2.94Å; E174-Q178 PolarHBondContact OE1-NE2 3.13Å; P175-Q178 PolarHBondContact O-N 2.85Å; Y176-Q178 VanDerWaalsContact C-N 3.35Å; Y176-Q178 PolarHBondContact O-N 2.85Å; Q178-L180 PolarHBondContact O-N 2.91Å; Q178-K181 PolarHBondContact O-N 3.39Å; Q178-K182 PolarHBondContact O-N 2.78Å; Q178-K182 VanDerWaalsContact O-N 3.16Å
179	Y	96.8	Very high	97	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-57.8	-48.1	172.3	-177.3	-98.8	0	0	0	112	E53 M56 V59 F60 A152 R153 P175 Y176 V177 K181 K182 R183	E53-Y179 PolarHBondContact OE1-OH 3.47Å; M56-Y179 HydrophobicContact CB-CD2 4.19Å; M56-Y179 HydrophobicContact CB-CE2 3.9Å; M56-Y179 WeakPolarHBondContact O-CD2 3.31Å; V59-Y179 HydrophobicContact CG2-CD2 4.34Å; F60-Y179 HydrophobicContact CD2-CD2 4.45Å; F60-Y179 HydrophobicContact CE2-CD1 4.28Å; F60-Y179 AromaticContact CE2-CD2 3.49Å; F60-Y179 HydrophobicContact CE2-CD2 3.49Å; F60-Y179 VanDerWaalsContact CE2-CD2 3.49Å; F60-Y179 HydrophobicContact CE2-CE2 4.18Å; F60-Y179 AromaticContact CE2-CG 3.54Å; F60-Y179 HydrophobicContact CE2-CG 3.54Å; F60-Y179 VanDerWaalsContact CZ-CB 3.41Å; F60-Y179 HydrophobicContact CZ-CD1 4.23Å; F60-Y179 HydrophobicContact CZ-CD2 4.12Å; F60-Y179 AromaticContact CZ-CG 3.67Å; F60-Y179 HydrophobicContact CZ-CG 3.67Å; A152-Y179 VanDerWaalsContact C-CE1 3.47Å; A152-Y179 HydrophobicContact CB-CD1 3.55Å; A152-Y179 HydrophobicContact CB-CE1 3.58Å; A152-Y179 HydrophobicContact CB-CG 4.26Å; R153-Y179 VanDerWaalsContact CA-OH 3.25Å; R153-Y179 WeakPolarHBondContact CA-OH 3.26Å; R153-Y179 WeakPolarHBondContact CB-OH 3.38Å; P175-Y179 PolarHBondContact O-N 2.97Å; Y176-Y179 WeakPolarHBondContact O-CB 3.38Å; Y176-Y179 PolarHBondContact O-N 3.46Å; V177-Y179 VanDerWaalsContact C-N 3.33Å; V177-Y179 PolarHBondContact O-N 2.97Å; Y179-K181 VanDerWaalsContact C-N 3.34Å; Y179-K181 PolarHBondContact O-N 3.39Å; Y179-K182 PolarHBondContact O-N 3.41Å; Y179-K182 VanDerWaalsContact O-N 3.14Å; Y179-R183 HydrophobicContact CD1-CG 4.12Å; Y179-R183 HydrophobicContact CD2-CG 4.34Å; Y179-R183 HydrophobicContact CE1-CB 4.39Å; Y179-R183 HydrophobicContact CE1-CG 3.7Å; Y179-R183 HydrophobicContact CE2-CG 3.93Å; Y179-R183 HydrophobicContact CG-CG 4.43Å; Y179-R183 WeakPolarHBondContact O-CB 3.48Å; Y179-R183 WeakPolarHBondContact O-CG 3.46Å; Y179-R183 PolarHBondContact O-N 3.26Å; Y179-R183 PolarHBondContact OH-NE 2.99Å; Y179-R183 VanDerWaalsContact OH-NE 3.12Å; Y179-R183 PolarHBondContact OH-NH2 2.83Å
180	L	97.5	Very high	97	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-37.6	178.1	-70.2	173	0	0	0	112.6	L155 L169 L172 Y176 V177 Q178 K182 R183 A184 I189 M202	L155-L180 HydrophobicContact CD2-CD2 4.16Å; L169-L180 HydrophobicContact CD1-CD1 3.71Å; L172-L180 HydrophobicContact CD2-CD1 3.89Å; Y176-L180 HydrophobicContact CD1-CD1 3.95Å; Y176-L180 HydrophobicContact CD1-CG 4Å; Y176-L180 HydrophobicContact CE1-CD1 4.28Å; Y176-L180 HydrophobicContact CE1-CD2 4.43Å; Y176-L180 HydrophobicContact CE1-CG 4.28Å; Y176-L180 WeakPolarHBondContact O-CG 3.42Å; Y176-L180 PolarHBondContact O-N 3.49Å; V177-L180 PolarHBondContact O-N 3.23Å; Q178-L180 PolarHBondContact O-N 2.91Å; L180-K182 VanDerWaalsContact C-N 3.27Å; L180-K182 PolarHBondContact O-N 3.36Å; L180-R183 PolarHBondContact O-N 3.41Å; L180-A184 WeakPolarHBondContact O-CA 3.29Å; L180-A184 WeakPolarHBondContact O-CB 3.27Å; L180-A184 PolarHBondContact O-N 3.15Å; L180-I189 HydrophobicContact CB-CD1 3.82Å; L180-M202 HydrophobicContact CD1-SD 4.39Å
181	K	95.9	Very high	97	Very high	100 Å²	100	40.2 Å²	40.2	44%	0.435	21%	0.205	S	C	.	.	H	α-helix	trans	-62.5	-34.8	175.3	-75.7	171.2	179.3	162.5	0	111.8	V177 Q178 Y179 I189 E191	V177-K181 HydrophobicContact CG1-CD 4.1Å; V177-K181 HydrophobicContact CG1-CG 4.37Å; V177-K181 WeakPolarHBondContact O-CG 3.45Å; V177-K181 PolarHBondContact O-N 2.88Å; Q178-K181 PolarHBondContact O-N 3.39Å; Y179-K181 VanDerWaalsContact C-N 3.34Å; Y179-K181 PolarHBondContact O-N 3.39Å; K181-I189 HydrophobicContact CG-CD1 3.99Å; K181-E191 WeakPolarHBondContact CE-OE1 3.5Å; K181-E191 IonicContact NZ-OE1 2.73Å; K181-E191 PolarHBondContact NZ-OE1 3.17Å
182	K	93.5	Very high	96.9	Very high	88 Å²	88	39.3 Å²	39.3	38%	0.383	20%	0.201	S	C	.	.	H	α-helix	trans	-74.4	-37.7	174.1	-67.9	-172.3	178	-169.2	0	112.5	D55 M56 V59 Q178 Y179 L180 V185	D55-K182 PolarHBondContact O-NZ 2.95Å; D55-K182 VanDerWaalsContact O-NZ 3.12Å; D55-K182 IonicContact OD2-NZ 3.35Å; D55-K182 PolarHBondContact OD2-NZ 2.95Å; M56-K182 HydrophobicContact CG-CB 4.46Å; M56-K182 HydrophobicContact CG-CD 4.09Å; V59-K182 HydrophobicContact CG1-CD 4.46Å; Q178-K182 PolarHBondContact O-N 2.78Å; Q178-K182 VanDerWaalsContact O-N 3.16Å; Y179-K182 PolarHBondContact O-N 3.41Å; Y179-K182 VanDerWaalsContact O-N 3.14Å; L180-K182 VanDerWaalsContact C-N 3.27Å; L180-K182 PolarHBondContact O-N 3.36Å; K182-V185 VanDerWaalsContact O-CG1 3.31Å; K182-V185 WeakPolarHBondContact O-CG1 3.33Å
183	R	93.1	Very high	96.8	Very high	80 Å²	80	40.1 Å²	40.1	30%	0.302	21%	0.21	S	C	.	.	H	α-helix	trans	-94.3	-46.4	-170.4	-73	-65	-150.5	155	29.9	115.8	E53 M56 C156 Y179 L180 V185	E53-R183 IonicContact OE1-CZ 3.7Å; E53-R183 IonicContact OE1-NH2 3.53Å; E53-R183 PolarHBondContact OE1-NH2 2.85Å; E53-R183 IonicContact OE2-CZ 3.73Å; E53-R183 IonicContact OE2-NH1 3.91Å; E53-R183 PolarHBondContact OE2-NH1 3.29Å; E53-R183 IonicContact OE2-NH2 3.32Å; E53-R183 PolarHBondContact OE2-NH2 2.99Å; M56-R183 VanDerWaalsContact CE-NE 3.29Å; M56-R183 WeakPolarHBondContact SD-CD 3.48Å; M56-R183 HydrophobicContact SD-CG 4.04Å; M56-R183 PolarHBondContact SD-NE 2.8Å; C156-R183 VanDerWaalsContact SG-CB 3.59Å; Y179-R183 HydrophobicContact CD1-CG 4.12Å; Y179-R183 HydrophobicContact CD2-CG 4.34Å; Y179-R183 HydrophobicContact CE1-CB 4.39Å; Y179-R183 HydrophobicContact CE1-CG 3.7Å; Y179-R183 HydrophobicContact CE2-CG 3.93Å; Y179-R183 HydrophobicContact CG-CG 4.43Å; Y179-R183 WeakPolarHBondContact O-CB 3.48Å; Y179-R183 WeakPolarHBondContact O-CG 3.46Å; Y179-R183 PolarHBondContact O-N 3.26Å; Y179-R183 PolarHBondContact OH-NE 2.99Å; Y179-R183 VanDerWaalsContact OH-NE 3.12Å; Y179-R183 PolarHBondContact OH-NH2 2.83Å; L180-R183 PolarHBondContact O-N 3.41Å; R183-V185 VanDerWaalsContact C-N 3.26Å; R183-V185 PolarHBondContact O-N 3.5Å
184	A	95	Very high	96.3	Very high	7 Å²	7	47.6 Å²	47.6	6%	0.058	24%	0.241	C	C	.	.			trans	-94.8	48.2	-174.7	0	0	0	0	0	110.7	L159 L180 S186 Y187 M202	L159-A184 HydrophobicContact CD1-CB 4.47Å; L180-A184 WeakPolarHBondContact O-CA 3.29Å; L180-A184 WeakPolarHBondContact O-CB 3.27Å; L180-A184 PolarHBondContact O-N 3.15Å; A184-S186 PolarHBondContact O-N 3.06Å; A184-Y187 HydrophobicContact CB-CD2 4.06Å; A184-Y187 WeakPolarHBondContact O-CB 3.38Å; A184-Y187 PolarHBondContact O-N 3.34Å; A184-M202 HydrophobicContact CB-CE 3.42Å; A184-M202 VanDerWaalsContact CB-CE 3.42Å
185	V	96.1	Very high	95.9	Very high	95 Å²	95	52.3 Å²	52.3	58%	0.576	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.2	-172.6	-62.7	0	0	0	0	114	K182 R183 Y187 K205	K182-V185 VanDerWaalsContact O-CG1 3.31Å; K182-V185 WeakPolarHBondContact O-CG1 3.33Å; R183-V185 VanDerWaalsContact C-N 3.26Å; R183-V185 PolarHBondContact O-N 3.5Å; V185-Y187 PolarHBondContact O-N 3.39Å; V185-K205 PolarHBondContact O-NZ 2.95Å
186	S	97	Very high	95.8	Very high	63 Å²	63	52.7 Å²	52.7	44%	0.441	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-5.9	174	57.2	0	0	0	0	113.8	A184 K205	A184-S186 PolarHBondContact O-N 3.06Å; S186-K205 WeakPolarHBondContact O-CB 3.49Å; S186-K205 WeakPolarHBondContact O-CG 3.41Å; S186-K205 PolarHBondContact O-N 2.73Å
187	Y	98.8	Very high	95.8	Very high	12 Å²	12	54.2 Å²	54.2	5%	0.047	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.6	-178.9	-68.6	-94.2	0	0	0	112.3	T163 P164 V167 A184 V185 M202 L203 K204 K205	T163-Y187 VanDerWaalsContact C-OH 3.27Å; P164-Y187 VanDerWaalsContact CD-OH 3.32Å; P164-Y187 WeakPolarHBondContact CD-OH 3.5Å; P164-Y187 WeakPolarHBondContact O-CE1 3.37Å; P164-Y187 VanDerWaalsContact O-CZ 3.32Å; P164-Y187 PolarHBondContact O-OH 2.93Å; V167-Y187 HydrophobicContact CG2-CD1 4.5Å; V167-Y187 HydrophobicContact CG2-CE1 4.02Å; A184-Y187 HydrophobicContact CB-CD2 4.06Å; A184-Y187 WeakPolarHBondContact O-CB 3.38Å; A184-Y187 PolarHBondContact O-N 3.34Å; V185-Y187 PolarHBondContact O-N 3.39Å; Y187-M202 HydrophobicContact CD1-CB 3.85Å; Y187-M202 HydrophobicContact CD1-CE 4.5Å; Y187-M202 HydrophobicContact CD2-CE 4.24Å; Y187-M202 HydrophobicContact CG-CB 4.21Å; Y187-M202 HydrophobicContact CG-CE 3.94Å; Y187-L203 CarbonylContact C-O 3.56Å; Y187-L203 VanDerWaalsContact CA-O 3.28Å; Y187-L203 WeakPolarHBondContact CA-O 3.48Å; Y187-K204 HydrophobicContact CD1-CB 4.21Å; Y187-K204 HydrophobicContact CE1-CB 3.76Å; Y187-K204 HydrophobicContact CE1-CG 4.36Å; Y187-K205 VanDerWaalsContact O-CE 3.28Å; Y187-K205 WeakPolarHBondContact O-CE 3.45Å
188	T	98.6	Very high	95.9	Very high	53 Å²	53	54.7 Å²	54.7	33%	0.325	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	126.3	160.9	-63.1	0	0	0	0	107.7	M202 L203 K205	T188-M202 CarbonylContact O-C 3.6Å; T188-M202 VanDerWaalsContact O-CA 3.29Å; T188-M202 WeakPolarHBondContact O-CA 3.41Å; T188-L203 PolarHBondContact N-O 3.01Å; T188-L203 PolarHBondContact O-N 2.63Å; T188-K205 WeakPolarHBondContact OG1-CG 3.33Å
189	I	98.6	Very high	96	Very high	35 Å²	35	51.3 Å²	51.3	18%	0.179	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.2	-178	-55.7	177.5	0	0	0	109.1	L180 K181 M202	L180-I189 HydrophobicContact CB-CD1 3.82Å; K181-I189 HydrophobicContact CG-CD1 3.99Å; I189-M202 HydrophobicContact CD1-CE 4.24Å; I189-M202 HydrophobicContact CG1-CE 4.21Å; I189-M202 HydrophobicContact CG1-CG 4.2Å
190	I	98.7	Very high	96.1	Very high	17 Å²	17	51.3 Å²	51.3	9%	0.087	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.9	174.7	-48.9	176.3	0	0	0	107.3	G200 L201 L203 L210 L228 A230	I190-G200 WeakPolarHBondContact O-CA 3.28Å; I190-L201 HydrophobicContact CB-CB 4.34Å; I190-L201 HydrophobicContact CD1-CD2 4.11Å; I190-L201 PolarHBondContact N-O 3.23Å; I190-L201 PolarHBondContact O-N 3.4Å; I190-L203 HydrophobicContact CD1-CD1 4.06Å; I190-L210 HydrophobicContact CD1-CD1 3.61Å; I190-L210 HydrophobicContact CD1-CD2 3.71Å; I190-L210 HydrophobicContact CD1-CG 4.29Å; I190-L210 HydrophobicContact CG1-CD2 4.26Å; I190-L228 HydrophobicContact CG2-CD1 3.94Å; I190-A230 HydrophobicContact CD1-CB 3.89Å
191	E	98.5	Very high	96.2	Very high	55 Å²	55	51.3 Å²	51.3	26%	0.257	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132	-177.5	-63.6	164.3	-148.3	0	0	110.3	V177 K181 G193 F198	V177-E191 HydrophobicContact CG1-CG 4.17Å; V177-E191 WeakPolarHBondContact CG1-OE1 3.17Å; K181-E191 WeakPolarHBondContact CE-OE1 3.5Å; K181-E191 IonicContact NZ-OE1 2.73Å; K181-E191 PolarHBondContact NZ-OE1 3.17Å; E191-G193 VanDerWaalsContact C-N 3.29Å; E191-F198 HydrophobicContact CB-CD2 4.46Å; E191-F198 HydrophobicContact CB-CE2 4.06Å; E191-F198 HydrophobicContact CG-CE2 4.1Å
192	G	98	Very high	96.3	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.01	25%	0.247	C	C	.	.	S	Bend	trans	-85.7	3.9	176.6	0	0	0	0	0	113.8	T199 N226	G192-T199 WeakPolarHBondContact CA-O 3.37Å; G192-T199 PolarHBondContact N-O 3.13Å; G192-N226 PolarHBondContact O-ND2 3.16Å
193	G	94.8	Very high	96.6	Very high	20 Å²	20	42.5 Å²	42.5	21%	0.206	23%	0.229	C	C	.	.			trans	-171.3	174.8	-179.4	0	0	0	0	0	111	E191	E191-G193 VanDerWaalsContact C-N 3.29Å
194	K	87.3	Confident	96.8	Very high	183 Å²	183	40.2 Å²	40.2	80%	0.796	22%	0.222	S	C	*	.	S	Bend	trans	-125.1	-19.3	-179.7	-63.3	-174.8	-179.8	-177.6	0	114
195	E	87.9	Confident	97	Very high	169 Å²	169	45.8 Å²	45.8	79%	0.79	25%	0.245	S	C	*	.	S	Bend	trans	-132.7	154.4	-175.1	-67.2	-176	-173.2	0	0	109.7	Y197	E195-Y197 PolarHBondContact O-N 2.85Å
196	G	94.7	Very high	97	Very high	50 Å²	50	46 Å²	46	52%	0.515	25%	0.251	S	S	.	.	S	Bend	trans	64	-129.2	-178	0	0	0	0	0	111.6
197	Y	98.1	Very high	97	Very high	32 Å²	32	46.5 Å²	46.5	13%	0.125	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	151.5	173.1	72.9	-81.8	0	0	0	110.8	L143 E171 L172 E195 M223 M224 R225 H245	L143-Y197 HydrophobicContact CD1-CD1 4.03Å; L143-Y197 HydrophobicContact CD1-CE1 4.24Å; L143-Y197 HydrophobicContact CD1-CG 4.16Å; L143-Y197 HydrophobicContact CD2-CD1 3.87Å; L143-Y197 HydrophobicContact CD2-CG 3.99Å; L143-Y197 HydrophobicContact CG-CD1 4.41Å; L143-Y197 HydrophobicContact CG-CG 4.3Å; E171-Y197 HydrophobicContact CG-CD2 4.16Å; E171-Y197 HydrophobicContact CG-CE2 4.45Å; L172-Y197 CarbonylContact O-C 3.54Å; L172-Y197 WeakPolarHBondContact O-CA 3.25Å; L172-Y197 WeakPolarHBondContact O-CB 3.37Å; E195-Y197 PolarHBondContact O-N 2.85Å; Y197-M223 WeakPolarHBondContact OH-CB 3.35Å; Y197-M223 PolarHBondContact OH-O 3.3Å; Y197-M224 HydrophobicContact CD1-CE 3.74Å; Y197-M224 HydrophobicContact CE1-CE 3.62Å; Y197-R225 PolarHBondContact OH-NE 3.03Å; Y197-R225 PolarHBondContact OH-NH2 2.83Å; Y197-H245 AromaticContact CE2-ND1 3.94Å
198	F	98.7	Very high	96.9	Very high	10 Å²	10	46.2 Å²	46.2	4%	0.044	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	175.1	-174.3	48.3	-94.5	0	0	0	111.9	E171 L172 V177 E191	E171-F198 PolarHBondContact N-O 3.37Å; L172-F198 HydrophobicContact CB-CD2 4.18Å; L172-F198 HydrophobicContact CB-CE2 4.1Å; L172-F198 PolarHBondContact N-O 3.25Å; L172-F198 PolarHBondContact O-N 3.08Å; V177-F198 HydrophobicContact CG2-CE2 3.62Å; V177-F198 HydrophobicContact CG2-CZ 3.71Å; E191-F198 HydrophobicContact CB-CD2 4.46Å; E191-F198 HydrophobicContact CB-CE2 4.06Å; E191-F198 HydrophobicContact CG-CE2 4.1Å
199	T	98.9	Very high	96.9	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.049	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	154.2	172.9	55.3	0	0	0	0	110.7	L169 Q170 G192 H245	L169-T199 CarbonylContact O-C 3.58Å; L169-T199 WeakPolarHBondContact O-CA 3.49Å; L169-T199 WeakPolarHBondContact O-CB 3.41Å; Q170-T199 HydrophobicContact CB-CG2 4.5Å; Q170-T199 HydrophobicContact CG-CG2 4.07Å; G192-T199 WeakPolarHBondContact CA-O 3.37Å; G192-T199 PolarHBondContact N-O 3.13Å; T199-H245 HydrophobicContact CG2-CB 4.03Å
200	G	98.8	Very high	96.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	149.4	172.4	0	0	0	0	0	111.2	L169 I190	L169-G200 PolarHBondContact N-O 3.44Å; L169-G200 PolarHBondContact O-N 3.48Å; I190-G200 WeakPolarHBondContact O-CA 3.28Å
201	L	98.8	Very high	96.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.2	174.9	-171.2	164.4	0	0	0	108.6	V167 F168 I190 L203 L228 A230 V241 T243	V167-L201 CarbonylContact O-C 3.57Å; V167-L201 WeakPolarHBondContact O-CA 3.32Å; F168-L201 HydrophobicContact CD1-CD1 4.35Å; F168-L201 HydrophobicContact CD1-CG 4.06Å; F168-L201 HydrophobicContact CE1-CD1 4.01Å; F168-L201 HydrophobicContact CE1-CG 4.05Å; I190-L201 HydrophobicContact CB-CB 4.34Å; I190-L201 HydrophobicContact CD1-CD2 4.11Å; I190-L201 PolarHBondContact N-O 3.23Å; I190-L201 PolarHBondContact O-N 3.4Å; L201-L203 HydrophobicContact CD2-CD1 4.1Å; L201-L203 HydrophobicContact CD2-CD2 3.36Å; L201-L203 HydrophobicContact CD2-CG 3.48Å; L201-L203 VanDerWaalsContact CD2-CG 3.48Å; L201-L228 HydrophobicContact CB-CD2 3.62Å; L201-L228 HydrophobicContact CB-CG 4.36Å; L201-A230 HydrophobicContact CD1-CB 3.9Å; L201-A230 HydrophobicContact CD2-CB 4.45Å; L201-V241 HydrophobicContact CD1-CB 4.48Å; L201-V241 HydrophobicContact CD1-CG2 3.88Å; L201-V241 HydrophobicContact CD2-CG2 4.45Å; L201-T243 HydrophobicContact CB-CG2 4.32Å
202	M	98.9	Very high	96.9	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.5	-179.8	-43.6	172.5	57.6	0	0	110.3	L159 V166 V167 L169 L180 A184 Y187 T188 I189	L159-M202 HydrophobicContact CD1-CE 3.94Å; L159-M202 HydrophobicContact CD1-SD 4.19Å; V166-M202 CarbonylContact C-O 3.57Å; V166-M202 WeakPolarHBondContact CA-O 3.06Å; V167-M202 HydrophobicContact CB-CB 3.88Å; V167-M202 HydrophobicContact CB-CG 4.18Å; V167-M202 HydrophobicContact CB-SD 4.19Å; V167-M202 HydrophobicContact CG1-SD 4.29Å; V167-M202 HydrophobicContact CG2-CB 4.18Å; V167-M202 PolarHBondContact N-O 2.88Å; V167-M202 PolarHBondContact O-N 3.47Å; L169-M202 HydrophobicContact CD1-CG 4.49Å; L169-M202 HydrophobicContact CD1-SD 3.62Å; L169-M202 HydrophobicContact CG-SD 4.4Å; L180-M202 HydrophobicContact CD1-SD 4.39Å; A184-M202 HydrophobicContact CB-CE 3.42Å; A184-M202 VanDerWaalsContact CB-CE 3.42Å; Y187-M202 HydrophobicContact CD1-CB 3.85Å; Y187-M202 HydrophobicContact CD1-CE 4.5Å; Y187-M202 HydrophobicContact CD2-CE 4.24Å; Y187-M202 HydrophobicContact CG-CB 4.21Å; Y187-M202 HydrophobicContact CG-CE 3.94Å; T188-M202 CarbonylContact O-C 3.6Å; T188-M202 VanDerWaalsContact O-CA 3.29Å; T188-M202 WeakPolarHBondContact O-CA 3.41Å; I189-M202 HydrophobicContact CD1-CE 4.24Å; I189-M202 HydrophobicContact CG1-CE 4.21Å; I189-M202 HydrophobicContact CG1-CG 4.2Å
203	L	98.9	Very high	96.9	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.8	-177.4	-61.3	177.9	0	0	0	110.5	V166 Y187 T188 I190 L201 K205 V208 L210 V232	V166-L203 HydrophobicContact CG1-CD2 4.28Å; V166-L203 HydrophobicContact CG2-CD2 4.13Å; Y187-L203 CarbonylContact C-O 3.56Å; Y187-L203 VanDerWaalsContact CA-O 3.28Å; Y187-L203 WeakPolarHBondContact CA-O 3.48Å; T188-L203 PolarHBondContact N-O 3.01Å; T188-L203 PolarHBondContact O-N 2.63Å; I190-L203 HydrophobicContact CD1-CD1 4.06Å; L201-L203 HydrophobicContact CD2-CD1 4.1Å; L201-L203 HydrophobicContact CD2-CD2 3.36Å; L201-L203 HydrophobicContact CD2-CG 3.48Å; L201-L203 VanDerWaalsContact CD2-CG 3.48Å; L203-K205 PolarHBondContact O-N 3.09Å; L203-K205 VanDerWaalsContact O-N 3.13Å; L203-V208 HydrophobicContact CB-CB 4.38Å; L203-V208 HydrophobicContact CB-CG1 4.4Å; L203-V208 HydrophobicContact CD1-CG1 4.47Å; L203-V208 HydrophobicContact CD2-CG1 3.87Å; L203-V208 HydrophobicContact CG-CG1 4.48Å; L203-L210 HydrophobicContact CD1-CB 3.95Å; L203-L210 HydrophobicContact CD1-CD1 3.97Å; L203-L210 HydrophobicContact CD1-CG 4.46Å; L203-V232 HydrophobicContact CD1-CG1 3.6Å; L203-V232 HydrophobicContact CD2-CG1 4.11Å
204	K	98.5	Very high	97	Very high	33 Å²	33	62 Å²	62	14%	0.143	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	111.4	179.5	-169.6	173.5	-173.9	178.1	0	110	T163 D165 Y187 S206 R207 V208	T163-K204 WeakPolarHBondContact O-CD 3.35Å; T163-K204 PolarHBondContact O-NZ 3.06Å; T163-K204 PolarHBondContact OG1-NZ 2.85Å; D165-K204 PolarHBondContact O-N 3.2Å; Y187-K204 HydrophobicContact CD1-CB 4.21Å; Y187-K204 HydrophobicContact CE1-CB 3.76Å; Y187-K204 HydrophobicContact CE1-CG 4.36Å; K204-S206 PolarHBondContact O-N 3.02Å; K204-S206 VanDerWaalsContact O-N 3.09Å; K204-R207 PolarHBondContact O-N 2.87Å; K204-V208 PolarHBondContact O-N 2.98Å
205	K	98	Very high	97.6	Very high	124 Å²	124	56.8 Å²	56.8	54%	0.539	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-34.8	-170.6	-72.5	172	177.6	165.9	0	113.8	V185 S186 Y187 T188 L203 R207	V185-K205 PolarHBondContact O-NZ 2.95Å; S186-K205 WeakPolarHBondContact O-CB 3.49Å; S186-K205 WeakPolarHBondContact O-CG 3.41Å; S186-K205 PolarHBondContact O-N 2.73Å; Y187-K205 VanDerWaalsContact O-CE 3.28Å; Y187-K205 WeakPolarHBondContact O-CE 3.45Å; T188-K205 WeakPolarHBondContact OG1-CG 3.33Å; L203-K205 PolarHBondContact O-N 3.09Å; L203-K205 VanDerWaalsContact O-N 3.13Å; K205-R207 VanDerWaalsContact C-N 3.31Å; K205-R207 PolarHBondContact O-N 3.26Å
206	S	96.3	Very high	98.1	Very high	100 Å²	100	50.9 Å²	50.9	70%	0.699	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-14.8	-178	55.3	0	0	0	0	114.3	K204	K204-S206 PolarHBondContact O-N 3.02Å; K204-S206 VanDerWaalsContact O-N 3.09Å
207	R	96.4	Very high	98.2	Very high	72 Å²	72	52.9 Å²	52.9	27%	0.272	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128	-28.3	-171.2	-71.5	-179	56.3	127.2	-5.4	114.2	G130 K132 D165 K204 K205 F234	G130-R207 PolarHBondContact O-NH2 3.14Å; K132-R207 PolarHBondContact O-NH2 3.07Å; D165-R207 WeakPolarHBondContact OD1-CB 3.28Å; D165-R207 WeakPolarHBondContact OD1-CD 3.15Å; D165-R207 IonicContact OD1-CZ 2.67Å; D165-R207 IonicContact OD1-NE 3.92Å; D165-R207 PolarHBondContact OD1-NE 2.79Å; D165-R207 IonicContact OD1-NH2 3.34Å; D165-R207 IonicContact OD2-CZ 3.54Å; D165-R207 IonicContact OD2-NE 2.66Å; D165-R207 IonicContact OD2-NH2 3.75Å; D165-R207 PolarHBondContact OD2-NH2 2.76Å; K204-R207 PolarHBondContact O-N 2.87Å; K205-R207 VanDerWaalsContact C-N 3.31Å; K205-R207 PolarHBondContact O-N 3.26Å; R207-F234 HydrophobicContact CB-CD2 4.5Å; R207-F234 HydrophobicContact CB-CE2 4.3Å; R207-F234 WeakPolarHBondContact O-CD2 3.45Å
208	V	98.2	Very high	98.2	Very high	6 Å²	6	51.7 Å²	51.7	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.3	-175.5	-172.1	0	0	0	0	110.7	D165 V166 L203 K204 V232 T233 F234	D165-V208 HydrophobicContact CB-CG2 3.87Å; V166-V208 HydrophobicContact CG2-CG2 4.39Å; L203-V208 HydrophobicContact CB-CB 4.38Å; L203-V208 HydrophobicContact CB-CG1 4.4Å; L203-V208 HydrophobicContact CD1-CG1 4.47Å; L203-V208 HydrophobicContact CD2-CG1 3.87Å; L203-V208 HydrophobicContact CG-CG1 4.48Å; K204-V208 PolarHBondContact O-N 2.98Å; V208-V232 HydrophobicContact CG1-CB 3.62Å; V208-V232 HydrophobicContact CG1-CG1 4.08Å; V208-V232 HydrophobicContact CG1-CG2 3.69Å; V208-T233 WeakPolarHBondContact CA-O 3.28Å; V208-F234 HydrophobicContact CG2-CD2 4.08Å
209	K	98.2	Very high	98.2	Very high	141 Å²	141	57.1 Å²	57.1	61%	0.613	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.7	178.3	-178.7	-175.8	179.1	-176.4	0	110.1	V232 T233	K209-V232 CarbonylContact O-C 3.51Å; K209-V232 WeakPolarHBondContact O-CA 2.97Å; K209-V232 WeakPolarHBondContact O-CB 3.27Å; K209-T233 WeakPolarHBondContact CB-OG1 3.31Å; K209-T233 PolarHBondContact N-O 2.63Å; K209-T233 PolarHBondContact O-N 3.28Å
210	L	98.6	Very high	98.1	Very high	61 Å²	61	60.2 Å²	60.2	32%	0.319	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.7	172.2	-178.1	61.3	0	0	0	110.6	I190 L203 N212 A230 V232	I190-L210 HydrophobicContact CD1-CD1 3.61Å; I190-L210 HydrophobicContact CD1-CD2 3.71Å; I190-L210 HydrophobicContact CD1-CG 4.29Å; I190-L210 HydrophobicContact CG1-CD2 4.26Å; L203-L210 HydrophobicContact CD1-CB 3.95Å; L203-L210 HydrophobicContact CD1-CD1 3.97Å; L203-L210 HydrophobicContact CD1-CG 4.46Å; L210-N212 VanDerWaalsContact CD1-O 3.28Å; L210-N212 WeakPolarHBondContact CD1-O 3.44Å; L210-A230 HydrophobicContact CD1-CB 3.84Å; L210-V232 HydrophobicContact CD1-CG1 4.21Å
211	L	98.1	Very high	98.1	Very high	81 Å²	81	61.8 Å²	61.8	42%	0.424	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-53.1	170.3	-59.2	-179.6	0	0	0	110.9	Q231 T233 E238	L211-Q231 WeakPolarHBondContact CA-O 3.42Å; L211-Q231 HydrophobicContact CB-CB 4.24Å; L211-Q231 WeakPolarHBondContact CB-O 3.24Å; L211-Q231 PolarHBondContact N-O 2.95Å; L211-T233 HydrophobicContact CD1-CG2 3.77Å; L211-T233 HydrophobicContact CD2-CG2 3.99Å; L211-T233 HydrophobicContact CG-CG2 4.03Å; L211-E238 HydrophobicContact CD1-CG 4.44Å
212	N	98.1	Very high	98	Very high	89 Å²	89	69 Å²	69	48%	0.476	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	165.6	174.9	66	46.6	0	0	0	110.8	L210 A230 Q231	L210-N212 VanDerWaalsContact CD1-O 3.28Å; L210-N212 WeakPolarHBondContact CD1-O 3.44Å; N212-A230 CarbonylContact O-C 3.59Å; N212-A230 WeakPolarHBondContact O-CA 3.09Å; N212-Q231 PolarHBondContact N-O 2.88Å; N212-Q231 PolarHBondContact O-N 3.28Å; N212-Q231 VanDerWaalsContact OD1-CB 3.32Å; N212-Q231 WeakPolarHBondContact OD1-CB 3.19Å; N212-Q231 WeakPolarHBondContact OD1-CG 3.45Å
213	S	98.4	Very high	98	Very high	62 Å²	62	71 Å²	71	43%	0.434	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.5	172.9	59	0	0	0	0	111.1	V229	S213-V229 CarbonylContact C-O 3.6Å; S213-V229 WeakPolarHBondContact CA-O 3.3Å
214	D	98.1	Very high	97.9	Very high	80 Å²	80	76 Å²	76	43%	0.428	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	152.7	-177.8	-171.3	22.8	0	0	0	110.5	V229	D214-V229 PolarHBondContact N-O 3.32Å; D214-V229 PolarHBondContact O-N 3.02Å
215	I	98.6	Very high	97.9	Very high	72 Å²	72	75.1 Å²	75.1	37%	0.369	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	116.8	176.6	-62.2	173.7	0	0	0	108	N226 L228	I215-N226 HydrophobicContact CG2-CB 3.84Å; I215-L228 HydrophobicContact CG1-CD1 3.86Å
216	I	98.5	Very high	97.9	Very high	46 Å²	46	70.3 Å²	70.3	24%	0.236	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	112.1	178	-56.2	174.5	0	0	0	108.5	N226 L227 V229 V262 R266	I216-N226 WeakPolarHBondContact O-CA 3.36Å; I216-N226 WeakPolarHBondContact O-CB 3.27Å; I216-L227 HydrophobicContact CB-CB 4.2Å; I216-L227 HydrophobicContact CD1-CD2 4.27Å; I216-L227 PolarHBondContact N-O 3.27Å; I216-L227 PolarHBondContact O-N 3.05Å; I216-V229 HydrophobicContact CD1-CG2 4.21Å; I216-V262 HydrophobicContact CG2-CG1 4.24Å; I216-R266 HydrophobicContact CD1-CG 4.32Å
217	S	97.8	Very high	98.1	Very high	91 Å²	91	65.6 Å²	65.6	64%	0.636	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	144.6	-179.8	-56.3	0	0	0	0	112.7	P219	S217-P219 WeakPolarHBondContact O-CD 3.44Å
218	Y	98.5	Very high	98.2	Very high	7 Å²	7	62.2 Å²	62.2	3%	0.027	34%	0.337	C	S	.	.			trans	-97.8	102.8	164.6	-58.5	-35.1	0	0	0	108.9	T220 T221 R225 N226 L227 S244 F246 Q259 V262 V263	Y218-T220 PolarHBondContact O-N 2.87Å; Y218-T220 VanDerWaalsContact O-N 3.11Å; Y218-T221 WeakPolarHBondContact O-CG2 3.42Å; Y218-T221 PolarHBondContact O-N 3.15Å; Y218-R225 VanDerWaalsContact CD2-C 3.49Å; Y218-R225 HydrophobicContact CD2-CB 3.7Å; Y218-R225 HydrophobicContact CE2-CB 4.25Å; Y218-N226 VanDerWaalsContact CE2-C 3.44Å; Y218-N226 WeakPolarHBondContact CE2-O 3.36Å; Y218-L227 HydrophobicContact CE1-CB 4.14Å; Y218-L227 WeakPolarHBondContact OH-CB 3.14Å; Y218-S244 WeakPolarHBondContact CE2-OG 3.43Å; Y218-S244 PolarHBondContact OH-OG 2.95Å; Y218-F246 HydrophobicContact CE2-CD1 4.38Å; Y218-Q259 HydrophobicContact CD1-CG 4.17Å; Y218-Q259 HydrophobicContact CD2-CB 4.17Å; Y218-Q259 HydrophobicContact CD2-CG 3.49Å; Y218-Q259 VanDerWaalsContact CD2-CG 3.49Å; Y218-Q259 HydrophobicContact CE1-CB 4.34Å; Y218-Q259 HydrophobicContact CE1-CG 4.38Å; Y218-Q259 HydrophobicContact CE2-CB 3.89Å; Y218-Q259 HydrophobicContact CE2-CG 3.74Å; Y218-Q259 HydrophobicContact CG-CG 3.72Å; Y218-V262 HydrophobicContact CD1-CG1 4.47Å; Y218-V262 HydrophobicContact CE1-CB 4.02Å; Y218-V262 HydrophobicContact CE1-CG1 3.87Å; Y218-V262 HydrophobicContact CE1-CG2 4.49Å; Y218-V263 WeakPolarHBondContact OH-CG2 3.49Å
219	P	97.1	Very high	98.2	Very high	125 Å²	125	62 Å²	62	81%	0.812	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.8	-167.6	26.4	-35.4	0	0	0	113.9	S217	S217-P219 WeakPolarHBondContact O-CD 3.44Å
220	T	98.1	Very high	98.2	Very high	73 Å²	73	55.2 Å²	55.2	45%	0.448	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	4.7	-176.7	47.1	0	0	0	0	113.6	Y218 E255	Y218-T220 PolarHBondContact O-N 2.87Å; Y218-T220 VanDerWaalsContact O-N 3.11Å; T220-E255 VanDerWaalsContact CB-OE2 3.25Å; T220-E255 WeakPolarHBondContact CB-OE2 3.37Å; T220-E255 VanDerWaalsContact OG1-CD 3.27Å; T220-E255 PolarHBondContact OG1-OE1 3.48Å; T220-E255 PolarHBondContact OG1-OE2 3.48Å
221	T	98.1	Very high	98.2	Very high	33 Å²	33	53.7 Å²	53.7	20%	0.202	30%	0.298	C	S	.	.			trans	-63	143	174.8	-173.1	0	0	0	0	111.1	Y218 M223 R225 E247 E255	Y218-T221 WeakPolarHBondContact O-CG2 3.42Å; Y218-T221 PolarHBondContact O-N 3.15Å; T221-M223 PolarHBondContact OG1-N 3.09Å; T221-M223 VanDerWaalsContact OG1-N 3.15Å; T221-R225 WeakPolarHBondContact OG1-CB 3.46Å; T221-R225 WeakPolarHBondContact OG1-CG 3.29Å; T221-R225 PolarHBondContact OG1-N 3.3Å; T221-R225 VanDerWaalsContact OG1-N 3.15Å; T221-E247 WeakPolarHBondContact CB-OE2 3.48Å; T221-E247 PolarHBondContact OG1-OE1 3.11Å; T221-E247 PolarHBondContact OG1-OE2 3.03Å; T221-E255 PolarHBondContact N-OE1 3.32Å
222	Q	97.7	Very high	98.3	Very high	150 Å²	150	49.8 Å²	49.8	70%	0.701	28%	0.278	S	S	*	.	S	Bend	trans	-107.9	3.4	171.4	-62.1	176.1	25.5	0	0	111.4	E247	Q222-E247 PolarHBondContact N-OE1 3.27Å
223	M	97.5	Very high	98.2	Very high	43 Å²	43	47 Å²	47	21%	0.212	26%	0.263	C	S	.	.	S	Bend	trans	-128.6	22.9	-171.6	-64.5	-177.4	-167.7	0	0	112.2	Y197 T221 R225 E247 Q252	Y197-M223 WeakPolarHBondContact OH-CB 3.35Å; Y197-M223 PolarHBondContact OH-O 3.3Å; T221-M223 PolarHBondContact OG1-N 3.09Å; T221-M223 VanDerWaalsContact OG1-N 3.15Å; M223-R225 VanDerWaalsContact C-N 3.28Å; M223-R225 HydrophobicContact CB-CG 4Å; M223-R225 VanDerWaalsContact CB-NE 3.26Å; M223-R225 WeakPolarHBondContact O-CD 3.21Å; M223-R225 PolarHBondContact O-N 2.86Å; M223-R225 PolarHBondContact O-NE 3.35Å; M223-R225 PolarHBondContact SD-NH2 3.43Å; M223-E247 WeakPolarHBondContact CB-OE1 3.49Å; M223-E247 HydrophobicContact CE-CG 4.41Å; M223-E247 WeakPolarHBondContact CG-OE1 3.36Å; M223-E247 PolarHBondContact N-OE1 3.16Å; M223-E247 HydrophobicContact SD-CG 4.19Å; M223-Q252 HydrophobicContact CE-CG 3.96Å
224	M	97.1	Very high	98	Very high	107 Å²	107	44.1 Å²	44.1	53%	0.527	24%	0.243	S	C	.	.			trans	61	32.4	176.8	-53.6	175.5	-68.8	0	0	113.6	Y197	Y197-M224 HydrophobicContact CD1-CE 3.74Å; Y197-M224 HydrophobicContact CE1-CE 3.62Å
225	R	98.5	Very high	97.7	Very high	14 Å²	14	46.8 Å²	46.8	5%	0.053	25%	0.248	C	C	.	.			trans	-82.2	149.6	-175.5	-51.2	-46.6	177.9	71	-1.3	112.4	Y197 Y218 T221 M223 H245 F246 E247 S248	Y197-R225 PolarHBondContact OH-NE 3.03Å; Y197-R225 PolarHBondContact OH-NH2 2.83Å; Y218-R225 VanDerWaalsContact CD2-C 3.49Å; Y218-R225 HydrophobicContact CD2-CB 3.7Å; Y218-R225 HydrophobicContact CE2-CB 4.25Å; T221-R225 WeakPolarHBondContact OG1-CB 3.46Å; T221-R225 WeakPolarHBondContact OG1-CG 3.29Å; T221-R225 PolarHBondContact OG1-N 3.3Å; T221-R225 VanDerWaalsContact OG1-N 3.15Å; M223-R225 VanDerWaalsContact C-N 3.28Å; M223-R225 HydrophobicContact CB-CG 4Å; M223-R225 VanDerWaalsContact CB-NE 3.26Å; M223-R225 WeakPolarHBondContact O-CD 3.21Å; M223-R225 PolarHBondContact O-N 2.86Å; M223-R225 PolarHBondContact O-NE 3.35Å; M223-R225 PolarHBondContact SD-NH2 3.43Å; R225-H245 WeakPolarHBondContact CB-O 3.49Å; R225-H245 WeakPolarHBondContact CD-O 3.28Å; R225-H245 WeakPolarHBondContact CG-O 3.34Å; R225-H245 PolarHBondContact NH1-CD2 3.41Å; R225-H245 PolarHBondContact NH1-NE2 3.11Å; R225-H245 PolarHBondContact NH1-O 3.19Å; R225-F246 PolarHBondContact NH1-O 3.19Å; R225-E247 WeakPolarHBondContact CG-OE2 3.35Å; R225-S248 PolarHBondContact NH1-OG 3.5Å; R225-S248 PolarHBondContact NH2-OG 3.36Å
226	N	98.8	Very high	97.1	Very high	24 Å²	24	51.1 Å²	51.1	13%	0.128	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	176.1	174.3	62	50.7	0	0	0	110.6	G192 I215 I216 Y218 S244	G192-N226 PolarHBondContact O-ND2 3.16Å; I215-N226 HydrophobicContact CG2-CB 3.84Å; I216-N226 WeakPolarHBondContact O-CA 3.36Å; I216-N226 WeakPolarHBondContact O-CB 3.27Å; Y218-N226 VanDerWaalsContact CE2-C 3.44Å; Y218-N226 WeakPolarHBondContact CE2-O 3.36Å; N226-S244 WeakPolarHBondContact O-CB 3.41Å; N226-S244 PolarHBondContact O-OG 3.36Å
227	L	98.9	Very high	96.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.3	168.2	-179.3	62.8	0	0	0	109.2	I216 Y218 V229 M242 V263 R266 F278	I216-L227 HydrophobicContact CB-CB 4.2Å; I216-L227 HydrophobicContact CD1-CD2 4.27Å; I216-L227 PolarHBondContact N-O 3.27Å; I216-L227 PolarHBondContact O-N 3.05Å; Y218-L227 HydrophobicContact CE1-CB 4.14Å; Y218-L227 WeakPolarHBondContact OH-CB 3.14Å; L227-V229 HydrophobicContact CD2-CG2 4.06Å; L227-V229 HydrophobicContact CG-CG2 3.82Å; L227-M242 HydrophobicContact CD1-CB 4.02Å; L227-M242 HydrophobicContact CD2-SD 4.35Å; L227-V263 HydrophobicContact CD1-CG2 3.8Å; L227-V263 HydrophobicContact CD2-CG2 4.05Å; L227-V263 HydrophobicContact CG-CG2 4.46Å; L227-R266 HydrophobicContact CD2-CB 4.24Å; L227-R266 HydrophobicContact CD2-CG 4.23Å; L227-F278 HydrophobicContact CD1-CD2 4.13Å; L227-F278 HydrophobicContact CD1-CE2 3.97Å
228	L	98.9	Very high	96.6	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.3	170.8	175.3	61.3	0	0	0	108.9	I190 L201 I215 M242 T243	I190-L228 HydrophobicContact CG2-CD1 3.94Å; L201-L228 HydrophobicContact CB-CD2 3.62Å; L201-L228 HydrophobicContact CB-CG 4.36Å; I215-L228 HydrophobicContact CG1-CD1 3.86Å; L228-M242 CarbonylContact O-C 3.55Å; L228-M242 VanDerWaalsContact O-CA 3.28Å; L228-M242 WeakPolarHBondContact O-CA 3.24Å; L228-T243 HydrophobicContact CB-CG2 3.93Å; L228-T243 HydrophobicContact CD2-CG2 3.99Å; L228-T243 HydrophobicContact CG-CG2 4.24Å; L228-T243 PolarHBondContact N-O 3.12Å; L228-T243 PolarHBondContact O-N 2.91Å
229	V	98.9	Very high	96.6	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.3	-177.7	-177.7	0	0	0	0	109.4	S213 D214 I216 L227 M242	S213-V229 CarbonylContact C-O 3.6Å; S213-V229 WeakPolarHBondContact CA-O 3.3Å; D214-V229 PolarHBondContact N-O 3.32Å; D214-V229 PolarHBondContact O-N 3.02Å; I216-V229 HydrophobicContact CD1-CG2 4.21Å; L227-V229 HydrophobicContact CD2-CG2 4.06Å; L227-V229 HydrophobicContact CG-CG2 3.82Å; V229-M242 HydrophobicContact CB-CG 4.32Å; V229-M242 HydrophobicContact CG1-CG 3.98Å; V229-M242 HydrophobicContact CG1-SD 4.37Å; V229-M242 HydrophobicContact CG2-CG 3.97Å; V229-M242 HydrophobicContact CG2-SD 4.06Å
230	A	98.8	Very high	96.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.8	166.8	0	0	0	0	0	111	I190 L201 L210 N212 V232 V241	I190-A230 HydrophobicContact CD1-CB 3.89Å; L201-A230 HydrophobicContact CD1-CB 3.9Å; L201-A230 HydrophobicContact CD2-CB 4.45Å; L210-A230 HydrophobicContact CD1-CB 3.84Å; N212-A230 CarbonylContact O-C 3.59Å; N212-A230 WeakPolarHBondContact O-CA 3.09Å; A230-V232 HydrophobicContact CB-CG1 4.13Å; A230-V241 HydrophobicContact CB-CG2 3.94Å; A230-V241 PolarHBondContact N-O 2.92Å; A230-V241 WeakPolarHBondContact O-CG2 3.39Å; A230-V241 PolarHBondContact O-N 2.81Å
231	Q	98.6	Very high	96.7	Very high	28 Å²	28	39.9 Å²	39.9	13%	0.131	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	127.8	165.6	-57.9	-56.7	-33.9	0	0	108.1	L211 N212 L239 C240	L211-Q231 WeakPolarHBondContact CA-O 3.42Å; L211-Q231 HydrophobicContact CB-CB 4.24Å; L211-Q231 WeakPolarHBondContact CB-O 3.24Å; L211-Q231 PolarHBondContact N-O 2.95Å; N212-Q231 PolarHBondContact N-O 2.88Å; N212-Q231 PolarHBondContact O-N 3.28Å; N212-Q231 VanDerWaalsContact OD1-CB 3.32Å; N212-Q231 WeakPolarHBondContact OD1-CB 3.19Å; N212-Q231 WeakPolarHBondContact OD1-CG 3.45Å; Q231-L239 WeakPolarHBondContact CA-O 3.17Å; Q231-L239 PolarHBondContact OE1-O 2.82Å; Q231-C240 PolarHBondContact NE2-SG 2.83Å
232	V	98.5	Very high	96.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	161.3	-174.5	-53.3	0	0	0	0	110.7	L203 V208 K209 L210 A230 L239 V241	L203-V232 HydrophobicContact CD1-CG1 3.6Å; L203-V232 HydrophobicContact CD2-CG1 4.11Å; V208-V232 HydrophobicContact CG1-CB 3.62Å; V208-V232 HydrophobicContact CG1-CG1 4.08Å; V208-V232 HydrophobicContact CG1-CG2 3.69Å; K209-V232 CarbonylContact O-C 3.51Å; K209-V232 WeakPolarHBondContact O-CA 2.97Å; K209-V232 WeakPolarHBondContact O-CB 3.27Å; L210-V232 HydrophobicContact CD1-CG1 4.21Å; A230-V232 HydrophobicContact CB-CG1 4.13Å; V232-L239 HydrophobicContact CG2-CB 3.69Å; V232-L239 HydrophobicContact CG2-CD1 4.3Å; V232-L239 PolarHBondContact N-O 2.96Å; V232-L239 PolarHBondContact O-N 3.44Å; V232-V241 HydrophobicContact CG1-CG2 3.95Å; V232-V241 HydrophobicContact CG2-CG1 4.37Å; V232-V241 HydrophobicContact CG2-CG2 4.19Å
233	T	96.9	Very high	96.8	Very high	29 Å²	29	31.1 Å²	31.1	18%	0.178	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	139.4	164.1	65.6	0	0	0	0	110.9	V208 K209 L211 Q237 E238	V208-T233 WeakPolarHBondContact CA-O 3.28Å; K209-T233 WeakPolarHBondContact CB-OG1 3.31Å; K209-T233 PolarHBondContact N-O 2.63Å; K209-T233 PolarHBondContact O-N 3.28Å; L211-T233 HydrophobicContact CD1-CG2 3.77Å; L211-T233 HydrophobicContact CD2-CG2 3.99Å; L211-T233 HydrophobicContact CG-CG2 4.03Å; T233-Q237 WeakPolarHBondContact CA-O 3.33Å; T233-E238 HydrophobicContact CG2-CG 4.27Å
234	F	95.2	Very high	96.9	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.009	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120	170.7	173.5	-107.4	0	0	0	107	K132 L133 R207 V208 D236 Q237 L239 L381	K132-F234 WeakPolarHBondContact O-CZ 3.29Å; L133-F234 HydrophobicContact CB-CD1 4.25Å; L133-F234 HydrophobicContact CB-CE1 3.84Å; L133-F234 HydrophobicContact CB-CZ 4.25Å; L133-F234 HydrophobicContact CD1-CB 4.39Å; L133-F234 HydrophobicContact CD1-CD1 3.9Å; L133-F234 HydrophobicContact CD1-CD2 3.86Å; L133-F234 HydrophobicContact CD1-CE1 4.07Å; L133-F234 HydrophobicContact CD1-CE2 4.06Å; L133-F234 HydrophobicContact CD1-CG 3.79Å; L133-F234 HydrophobicContact CD1-CZ 4.17Å; R207-F234 HydrophobicContact CB-CD2 4.5Å; R207-F234 HydrophobicContact CB-CE2 4.3Å; R207-F234 WeakPolarHBondContact O-CD2 3.45Å; V208-F234 HydrophobicContact CG2-CD2 4.08Å; F234-D236 VanDerWaalsContact C-N 3.26Å; F234-D236 PolarHBondContact O-N 3.18Å; F234-Q237 PolarHBondContact N-O 3.45Å; F234-Q237 WeakPolarHBondContact O-CB 3.49Å; F234-Q237 PolarHBondContact O-N 3.35Å; F234-L239 HydrophobicContact CB-CD1 3.45Å; F234-L239 VanDerWaalsContact CB-CD1 3.45Å; F234-L239 HydrophobicContact CD1-CD1 4.49Å; F234-L239 HydrophobicContact CG-CD1 4.32Å; F234-L381 HydrophobicContact CD1-CD1 3.83Å; F234-L381 HydrophobicContact CE1-CD1 3.59Å
235	R	90.3	Very high	97	Very high	137 Å²	137	24.2 Å²	24.2	52%	0.517	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	46.4	-176.9	-58.9	176.2	148.6	-114.6	-25.1	113	G130 G131 Q237	G130-R235 PolarHBondContact O-NE 2.8Å; G130-R235 PolarHBondContact O-NH2 2.87Å; G131-R235 VanDerWaalsContact CA-CZ 3.43Å; R235-Q237 PolarHBondContact O-N 3.12Å
236	D	87.6	Confident	97	Very high	163 Å²	163	23.5 Å²	23.5	87%	0.872	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	8.2	-178.4	-51.2	-47.4	0	0	0	115.6	F234	F234-D236 VanDerWaalsContact C-N 3.26Å; F234-D236 PolarHBondContact O-N 3.18Å
237	Q	91.1	Very high	97	Very high	20 Å²	20	22.4 Å²	22.4	9%	0.093	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.1	171.3	178.4	61.4	59.9	0	0	110.4	T233 F234 R235 N273 G347	T233-Q237 WeakPolarHBondContact CA-O 3.33Å; F234-Q237 PolarHBondContact N-O 3.45Å; F234-Q237 WeakPolarHBondContact O-CB 3.49Å; F234-Q237 PolarHBondContact O-N 3.35Å; R235-Q237 PolarHBondContact O-N 3.12Å; Q237-N273 PolarHBondContact NE2-O 3.34Å; Q237-N273 VanDerWaalsContact NE2-O 3.11Å; Q237-G347 VanDerWaalsContact OE1-N 3.09Å
238	E	94.9	Very high	96.9	Very high	83 Å²	83	23.4 Å²	23.4	39%	0.388	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	133.9	172.8	-69.5	-171.8	175.9	0	0	111.5	L211 T233 V274 T275	L211-E238 HydrophobicContact CD1-CG 4.44Å; T233-E238 HydrophobicContact CG2-CG 4.27Å; E238-V274 HydrophobicContact CB-CG2 4.07Å; E238-T275 PolarHBondContact O-N 3.33Å
239	L	97.5	Very high	96.8	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.4	179.1	-69.7	157.5	0	0	0	109.6	L133 Q231 V232 F234 T275 M350	L133-L239 HydrophobicContact CD2-CD1 4.05Å; L133-L239 HydrophobicContact CD2-CD2 4.43Å; Q231-L239 WeakPolarHBondContact CA-O 3.17Å; Q231-L239 PolarHBondContact OE1-O 2.82Å; V232-L239 HydrophobicContact CG2-CB 3.69Å; V232-L239 HydrophobicContact CG2-CD1 4.3Å; V232-L239 PolarHBondContact N-O 2.96Å; V232-L239 PolarHBondContact O-N 3.44Å; F234-L239 HydrophobicContact CB-CD1 3.45Å; F234-L239 VanDerWaalsContact CB-CD1 3.45Å; F234-L239 HydrophobicContact CD1-CD1 4.49Å; F234-L239 HydrophobicContact CG-CD1 4.32Å; L239-T275 CarbonylContact C-O 3.59Å; L239-T275 VanDerWaalsContact CA-O 3.31Å; L239-T275 WeakPolarHBondContact CA-O 3.36Å; L239-T275 HydrophobicContact CD2-CG2 3.77Å; L239-M350 HydrophobicContact CD2-CE 4.35Å; L239-M350 HydrophobicContact CD2-SD 4.33Å
240	C	98.5	Very high	96.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	108.1	166.3	177.7	0	0	0	0	108.3	Q231 V274 T275 V276 L277	Q231-C240 PolarHBondContact NE2-SG 2.83Å; C240-V274 HydrophobicContact CB-CG1 3.87Å; C240-T275 PolarHBondContact N-O 3.09Å; C240-V276 HydrophobicContact CB-CB 4.41Å; C240-V276 HydrophobicContact CB-CG1 4.14Å; C240-V276 HydrophobicContact CB-CG2 4.08Å; C240-V276 CarbonylContact O-C 3.5Å; C240-V276 VanDerWaalsContact O-CA 3.32Å; C240-V276 WeakPolarHBondContact O-CA 3.49Å; C240-L277 PolarHBondContact O-N 3.38Å
241	V	98.9	Very high	96.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	136.5	176.8	-69.9	0	0	0	0	110.1	V166 F168 L201 A230 V232 L277	V166-V241 HydrophobicContact CG1-CB 4.46Å; V166-V241 HydrophobicContact CG1-CG1 4.32Å; V166-V241 HydrophobicContact CG2-CG1 4.36Å; F168-V241 HydrophobicContact CE1-CB 3.99Å; F168-V241 HydrophobicContact CZ-CB 3.9Å; F168-V241 HydrophobicContact CZ-CG1 4.38Å; L201-V241 HydrophobicContact CD1-CB 4.48Å; L201-V241 HydrophobicContact CD1-CG2 3.88Å; L201-V241 HydrophobicContact CD2-CG2 4.45Å; A230-V241 HydrophobicContact CB-CG2 3.94Å; A230-V241 PolarHBondContact N-O 2.92Å; A230-V241 WeakPolarHBondContact O-CG2 3.39Å; A230-V241 PolarHBondContact O-N 2.81Å; V232-V241 HydrophobicContact CG1-CG2 3.95Å; V232-V241 HydrophobicContact CG2-CG1 4.37Å; V232-V241 HydrophobicContact CG2-CG2 4.19Å; V241-L277 CarbonylContact C-O 3.58Å; V241-L277 WeakPolarHBondContact CA-O 3.49Å; V241-L277 HydrophobicContact CG1-CB 4.3Å
242	M	98.9	Very high	96.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	138.4	-171.7	-54.1	-173.6	-57.3	0	0	111.6	F168 L227 L228 V229 R266 M267 V276 L277 F278 G279	F168-M242 WeakPolarHBondContact CE2-O 3.28Å; L227-M242 HydrophobicContact CD1-CB 4.02Å; L227-M242 HydrophobicContact CD2-SD 4.35Å; L228-M242 CarbonylContact O-C 3.55Å; L228-M242 VanDerWaalsContact O-CA 3.28Å; L228-M242 WeakPolarHBondContact O-CA 3.24Å; V229-M242 HydrophobicContact CB-CG 4.32Å; V229-M242 HydrophobicContact CG1-CG 3.98Å; V229-M242 HydrophobicContact CG1-SD 4.37Å; V229-M242 HydrophobicContact CG2-CG 3.97Å; V229-M242 HydrophobicContact CG2-SD 4.06Å; M242-R266 HydrophobicContact SD-CB 4.32Å; M242-R266 HydrophobicContact SD-CG 3.6Å; M242-M267 HydrophobicContact CE-CG 3.37Å; M242-M267 HydrophobicContact CE-SD 4.43Å; M242-V276 HydrophobicContact CE-CG1 3.45Å; M242-V276 VanDerWaalsContact CE-CG1 3.45Å; M242-V276 HydrophobicContact SD-CG1 4.25Å; M242-L277 PolarHBondContact N-O 3.39Å; M242-F278 HydrophobicContact CB-CB 4.42Å; M242-F278 HydrophobicContact CB-CD2 4.01Å; M242-F278 HydrophobicContact CE-CB 3.93Å; M242-F278 HydrophobicContact CE-CD2 4.5Å; M242-F278 WeakPolarHBondContact O-CA 3.38Å; M242-G279 PolarHBondContact O-N 3.17Å
243	T	98.9	Very high	96.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.9	174.8	-179.2	0	0	0	0	112	F168 Q170 L201 L228 G279	F168-T243 HydrophobicContact CD1-CG2 4.26Å; Q170-T243 PolarHBondContact NE2-OG1 2.51Å; L201-T243 HydrophobicContact CB-CG2 4.32Å; L228-T243 HydrophobicContact CB-CG2 3.93Å; L228-T243 HydrophobicContact CD2-CG2 3.99Å; L228-T243 HydrophobicContact CG-CG2 4.24Å; L228-T243 PolarHBondContact N-O 3.12Å; L228-T243 PolarHBondContact O-N 2.91Å; T243-G279 VanDerWaalsContact CA-O 3.23Å; T243-G279 WeakPolarHBondContact CA-O 3.5Å; T243-G279 WeakPolarHBondContact CB-O 3.48Å; T243-G279 PolarHBondContact OG1-O 3.24Å
244	S	98.9	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	159.9	175	-169.9	0	0	0	0	110.6	Y218 N226 F246	Y218-S244 WeakPolarHBondContact CE2-OG 3.43Å; Y218-S244 PolarHBondContact OH-OG 2.95Å; N226-S244 WeakPolarHBondContact O-CB 3.41Å; N226-S244 PolarHBondContact O-OG 3.36Å; S244-F246 WeakPolarHBondContact OG-CD1 3.22Å
245	H	98.9	Very high	96.6	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.019	24%	0.244	C	C	.	.			trans	-118.5	102	166.6	-178.3	-176	0	0	0	107.4	Q170 E171 Y197 T199 R225 S248 D281 N283	Q170-H245 HydrophobicContact CB-CB 4.01Å; Q170-H245 HydrophobicContact CG-CB 3.89Å; E171-H245 IonicContact OE1-CE1 2.73Å; E171-H245 PolarHBondContact OE1-CE1 3.07Å; Y197-H245 AromaticContact CE2-ND1 3.94Å; T199-H245 HydrophobicContact CG2-CB 4.03Å; R225-H245 WeakPolarHBondContact CB-O 3.49Å; R225-H245 WeakPolarHBondContact CD-O 3.28Å; R225-H245 WeakPolarHBondContact CG-O 3.34Å; R225-H245 PolarHBondContact NH1-CD2 3.41Å; R225-H245 PolarHBondContact NH1-NE2 3.11Å; R225-H245 PolarHBondContact NH1-O 3.19Å; H245-S248 PolarHBondContact NE2-OG 3.34Å; H245-S248 VanDerWaalsContact NE2-OG 3.12Å; H245-D281 CarbonylContact C-O 3.54Å; H245-D281 VanDerWaalsContact CA-O 3.32Å; H245-D281 WeakPolarHBondContact CA-O 3.43Å; H245-D281 IonicContact CD2-OD2 3.3Å; H245-D281 IonicContact NE2-OD2 3.73Å; H245-D281 PolarHBondContact NE2-OD2 3.08Å; H245-N283 PolarHBondContact CD2-ND2 3.19Å; H245-N283 PolarHBondContact NE2-ND2 2.87Å; H245-N283 VanDerWaalsContact NE2-ND2 3.17Å
246	F	98.9	Very high	97	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.22	C	C	.	.			trans	-76.7	154.2	-176.4	-65	-10.2	0	0	0	112.8	Y218 R225 S244 S248 R256 Q259 L260 V263 F278 D281 T282 N283 L284	Y218-F246 HydrophobicContact CE2-CD1 4.38Å; R225-F246 PolarHBondContact NH1-O 3.19Å; S244-F246 WeakPolarHBondContact OG-CD1 3.22Å; F246-S248 PolarHBondContact O-N 3.1Å; F246-R256 HydrophobicContact CB-CG 3.94Å; F246-R256 HydrophobicContact CD2-CG 4Å; F246-R256 HydrophobicContact CG-CG 4.42Å; F246-Q259 HydrophobicContact CD1-CB 3.93Å; F246-Q259 HydrophobicContact CE1-CB 4.18Å; F246-Q259 HydrophobicContact CG-CB 4.2Å; F246-L260 HydrophobicContact CE2-CB 3.83Å; F246-L260 HydrophobicContact CE2-CD1 4.08Å; F246-L260 HydrophobicContact CZ-CB 4.38Å; F246-L260 HydrophobicContact CZ-CD1 4.48Å; F246-V263 HydrophobicContact CE1-CG2 3.64Å; F246-V263 HydrophobicContact CZ-CB 4.16Å; F246-V263 HydrophobicContact CZ-CG2 3.58Å; F246-F278 HydrophobicContact CE1-CE2 4.42Å; F246-F278 AromaticContact CE1-CZ 3.97Å; F246-F278 HydrophobicContact CE1-CZ 3.97Å; F246-F278 HydrophobicContact CZ-CE1 4.38Å; F246-F278 HydrophobicContact CZ-CE2 4.43Å; F246-F278 AromaticContact CZ-CZ 3.71Å; F246-F278 HydrophobicContact CZ-CZ 3.71Å; F246-D281 PolarHBondContact N-O 3.16Å; F246-T282 VanDerWaalsContact CB-O 3.26Å; F246-T282 WeakPolarHBondContact CB-O 3.37Å; F246-T282 HydrophobicContact CD2-CG2 4.46Å; F246-T282 VanDerWaalsContact CD2-O 3.22Å; F246-T282 WeakPolarHBondContact CD2-O 3.44Å; F246-T282 HydrophobicContact CE2-CG2 4.26Å; F246-N283 PolarHBondContact O-ND2 3.44Å; F246-L284 HydrophobicContact CD2-CG 4.39Å; F246-L284 HydrophobicContact CE2-CD1 4.34Å
247	E	98.8	Very high	97.5	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.			trans	-43.3	120.5	-175.5	-144.8	74.4	-168.6	0	0	112	T221 Q222 M223 R225 Q252 E255 R256 Q259	T221-E247 WeakPolarHBondContact CB-OE2 3.48Å; T221-E247 PolarHBondContact OG1-OE1 3.11Å; T221-E247 PolarHBondContact OG1-OE2 3.03Å; Q222-E247 PolarHBondContact N-OE1 3.27Å; M223-E247 WeakPolarHBondContact CB-OE1 3.49Å; M223-E247 HydrophobicContact CE-CG 4.41Å; M223-E247 WeakPolarHBondContact CG-OE1 3.36Å; M223-E247 PolarHBondContact N-OE1 3.16Å; M223-E247 HydrophobicContact SD-CG 4.19Å; R225-E247 WeakPolarHBondContact CG-OE2 3.35Å; E247-Q252 HydrophobicContact CB-CB 3.94Å; E247-Q252 HydrophobicContact CG-CB 3.55Å; E247-Q252 HydrophobicContact CG-CG 3.83Å; E247-E255 HydrophobicContact CB-CB 4.16Å; E247-E255 HydrophobicContact CB-CG 3.81Å; E247-E255 HydrophobicContact CG-CB 4.05Å; E247-E255 HydrophobicContact CG-CG 3.66Å; E247-R256 HydrophobicContact CB-CB 4.34Å; E247-R256 PolarHBondContact O-NH1 2.76Å; E247-Q259 PolarHBondContact OE2-NE2 2.68Å
248	S	98.1	Very high	97.8	Very high	21 Å²	21	36.4 Å²	36.4	15%	0.147	20%	0.202	C	C	.	.			trans	-81.5	170.6	-172.6	-51.5	0	0	0	0	111.6	R225 H245 F246 Q252 N283	R225-S248 PolarHBondContact NH1-OG 3.5Å; R225-S248 PolarHBondContact NH2-OG 3.36Å; H245-S248 PolarHBondContact NE2-OG 3.34Å; H245-S248 VanDerWaalsContact NE2-OG 3.12Å; F246-S248 PolarHBondContact O-N 3.1Å; S248-Q252 VanDerWaalsContact O-CB 3.29Å; S248-Q252 WeakPolarHBondContact O-CB 3.32Å; S248-Q252 VanDerWaalsContact O-CG 3.26Å; S248-Q252 WeakPolarHBondContact O-CG 3.33Å; S248-N283 PolarHBondContact OG-ND2 2.66Å
249	C	95	Very high	98	Very high	83 Å²	83	32.5 Å²	32.5	56%	0.561	18%	0.184	S	C	*	.	S	Bend	trans	70.5	154.5	-179.3	-55	0	0	0	0	114.5	G251 Q252 R256	C249-G251 VanDerWaalsContact C-N 3.33Å; C249-G251 PolarHBondContact O-N 3.43Å; C249-Q252 PolarHBondContact O-N 3.47Å; C249-R256 PolarHBondContact O-NH1 2.85Å; C249-R256 VanDerWaalsContact O-NH1 3.14Å
250	K	93.3	Very high	98.1	Very high	152 Å²	152	32.4 Å²	32.4	66%	0.661	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-63.5	-37.1	-177.8	-174	177.3	179.5	178.3	0	112.6	Q252	K250-Q252 PolarHBondContact O-N 2.82Å
251	G	95.9	Very high	98.1	Very high	75 Å²	75	35.1 Å²	35.1	77%	0.773	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-68.4	-15.5	-177.1	0	0	0	0	0	115	C249	C249-G251 VanDerWaalsContact C-N 3.33Å; C249-G251 PolarHBondContact O-N 3.43Å
252	Q	98.1	Very high	98.1	Very high	50 Å²	50	37.6 Å²	37.6	23%	0.234	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-98.8	24.3	-177	-59.9	-64.3	-11.4	0	0	113.2	M223 E247 S248 C249 K250 E254 E255 R256	M223-Q252 HydrophobicContact CE-CG 3.96Å; E247-Q252 HydrophobicContact CB-CB 3.94Å; E247-Q252 HydrophobicContact CG-CB 3.55Å; E247-Q252 HydrophobicContact CG-CG 3.83Å; S248-Q252 VanDerWaalsContact O-CB 3.29Å; S248-Q252 WeakPolarHBondContact O-CB 3.32Å; S248-Q252 VanDerWaalsContact O-CG 3.26Å; S248-Q252 WeakPolarHBondContact O-CG 3.33Å; C249-Q252 PolarHBondContact O-N 3.47Å; K250-Q252 PolarHBondContact O-N 2.82Å; Q252-E254 VanDerWaalsContact C-N 3.29Å; Q252-E254 PolarHBondContact O-N 3.14Å; Q252-E255 PolarHBondContact O-N 3.5Å; Q252-R256 WeakPolarHBondContact O-CB 3.5Å; Q252-R256 PolarHBondContact O-N 3.22Å
253	A	98.2	Very high	98.1	Very high	26 Å²	26	37.6 Å²	37.6	22%	0.215	22%	0.217	C	C	.	.	H	α-helix	trans	-58	-39.3	-177.4	0	0	0	0	0	113.3	M257 E288	A253-M257 WeakPolarHBondContact O-CB 3.45Å; A253-M257 VanDerWaalsContact O-CG 3.31Å; A253-M257 WeakPolarHBondContact O-CG 3.23Å; A253-M257 PolarHBondContact O-N 2.93Å; A253-E288 VanDerWaalsContact CB-OE1 3.28Å; A253-E288 WeakPolarHBondContact CB-OE1 3.46Å
254	E	98.4	Very high	98.1	Very high	127 Å²	127	38.2 Å²	38.2	59%	0.593	22%	0.22	S	C	*	.	H	α-helix	trans	-62.9	-46.5	179.1	-167.3	-167.2	142.5	0	0	111.7	Q252 M257 K258	Q252-E254 VanDerWaalsContact C-N 3.29Å; Q252-E254 PolarHBondContact O-N 3.14Å; E254-M257 PolarHBondContact O-N 2.87Å; E254-K258 WeakPolarHBondContact O-CG 3.45Å; E254-K258 PolarHBondContact O-N 2.9Å; E254-K258 VanDerWaalsContact O-N 3.12Å; E254-K258 VanDerWaalsContact OE1-CE 3.28Å; E254-K258 WeakPolarHBondContact OE1-CE 3.34Å; E254-K258 IonicContact OE1-NZ 3.45Å; E254-K258 PolarHBondContact OE1-NZ 3.12Å
255	E	98.7	Very high	98	Very high	11 Å²	11	43.1 Å²	43.1	5%	0.051	24%	0.242	C	C	.	.	H	α-helix	trans	-65.4	-45.8	178.4	177.9	54.5	-154.9	0	0	111.3	T220 T221 E247 Q252 M257 K258 Q259	T220-E255 VanDerWaalsContact CB-OE2 3.25Å; T220-E255 WeakPolarHBondContact CB-OE2 3.37Å; T220-E255 VanDerWaalsContact OG1-CD 3.27Å; T220-E255 PolarHBondContact OG1-OE1 3.48Å; T220-E255 PolarHBondContact OG1-OE2 3.48Å; T221-E255 PolarHBondContact N-OE1 3.32Å; E247-E255 HydrophobicContact CB-CB 4.16Å; E247-E255 HydrophobicContact CB-CG 3.81Å; E247-E255 HydrophobicContact CG-CB 4.05Å; E247-E255 HydrophobicContact CG-CG 3.66Å; Q252-E255 PolarHBondContact O-N 3.5Å; E255-M257 VanDerWaalsContact C-N 3.28Å; E255-M257 PolarHBondContact O-N 2.88Å; E255-K258 WeakPolarHBondContact O-CB 3.33Å; E255-K258 PolarHBondContact O-N 3.4Å; E255-Q259 WeakPolarHBondContact O-CG 3.13Å; E255-Q259 PolarHBondContact O-N 3Å; E255-Q259 PolarHBondContact OE1-NE2 2.95Å
256	R	98.6	Very high	98	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-38.6	175.1	174.5	169.4	58.9	-99.9	4.5	112.9	F246 E247 C249 Q252 Q259 L260 T282 N283 L284 E288	F246-R256 HydrophobicContact CB-CG 3.94Å; F246-R256 HydrophobicContact CD2-CG 4Å; F246-R256 HydrophobicContact CG-CG 4.42Å; E247-R256 HydrophobicContact CB-CB 4.34Å; E247-R256 PolarHBondContact O-NH1 2.76Å; C249-R256 PolarHBondContact O-NH1 2.85Å; C249-R256 VanDerWaalsContact O-NH1 3.14Å; Q252-R256 WeakPolarHBondContact O-CB 3.5Å; Q252-R256 PolarHBondContact O-N 3.22Å; R256-Q259 PolarHBondContact O-N 2.89Å; R256-L260 WeakPolarHBondContact O-CB 3.49Å; R256-L260 PolarHBondContact O-N 2.95Å; R256-T282 WeakPolarHBondContact CD-O 3.32Å; R256-N283 WeakPolarHBondContact CD-O 3.24Å; R256-N283 PolarHBondContact NE-O 2.87Å; R256-N283 VanDerWaalsContact NE-O 3.11Å; R256-L284 HydrophobicContact CG-CD2 3.79Å; R256-L284 HydrophobicContact CG-CG 4.4Å; R256-E288 IonicContact CZ-OE1 2.75Å; R256-E288 IonicContact CZ-OE2 2.64Å; R256-E288 IonicContact NE-OE1 3.21Å; R256-E288 IonicContact NE-OE2 2.71Å; R256-E288 PolarHBondContact NE-OE2 2.97Å; R256-E288 IonicContact NH2-OE1 3.56Å; R256-E288 PolarHBondContact NH2-OE1 3.5Å; R256-E288 IonicContact NH2-OE2 3.7Å; R256-E288 PolarHBondContact NH2-OE2 3.39Å; R256-E288 VanDerWaalsContact NH2-OE2 3.12Å
257	M	98.8	Very high	98	Very high	40 Å²	40	45.7 Å²	45.7	20%	0.197	25%	0.251	C	S	.	.	H	α-helix	trans	-68.3	-34.3	175.4	-74.9	-174.3	-60.8	0	0	112.7	A253 E254 E255 S261 E288 K291 V292	A253-M257 WeakPolarHBondContact O-CB 3.45Å; A253-M257 VanDerWaalsContact O-CG 3.31Å; A253-M257 WeakPolarHBondContact O-CG 3.23Å; A253-M257 PolarHBondContact O-N 2.93Å; E254-M257 PolarHBondContact O-N 2.87Å; E255-M257 VanDerWaalsContact C-N 3.28Å; E255-M257 PolarHBondContact O-N 2.88Å; M257-S261 PolarHBondContact O-N 3.13Å; M257-S261 PolarHBondContact O-OG 2.81Å; M257-E288 HydrophobicContact CG-CB 3.96Å; M257-E288 HydrophobicContact CG-CG 4.42Å; M257-E288 HydrophobicContact SD-CB 4.14Å; M257-E288 HydrophobicContact SD-CG 4.34Å; M257-K291 HydrophobicContact SD-CB 3.75Å; M257-K291 HydrophobicContact SD-CD 4.08Å; M257-V292 HydrophobicContact CB-CG1 3.67Å; M257-V292 HydrophobicContact CG-CG1 3.83Å; M257-V292 HydrophobicContact SD-CG1 4.24Å
258	K	98.7	Very high	97.9	Very high	91 Å²	91	52.2 Å²	52.2	40%	0.396	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-45.1	171.5	-68	169.6	-172.9	162.6	0	110.8	E254 E255 S261 V262	E254-K258 WeakPolarHBondContact O-CG 3.45Å; E254-K258 PolarHBondContact O-N 2.9Å; E254-K258 VanDerWaalsContact O-N 3.12Å; E254-K258 VanDerWaalsContact OE1-CE 3.28Å; E254-K258 WeakPolarHBondContact OE1-CE 3.34Å; E254-K258 IonicContact OE1-NZ 3.45Å; E254-K258 PolarHBondContact OE1-NZ 3.12Å; E255-K258 WeakPolarHBondContact O-CB 3.33Å; E255-K258 PolarHBondContact O-N 3.4Å; K258-S261 WeakPolarHBondContact O-CB 3.32Å; K258-S261 PolarHBondContact O-N 3.23Å; K258-S261 VanDerWaalsContact O-N 3.16Å; K258-V262 WeakPolarHBondContact O-CG2 3.16Å; K258-V262 PolarHBondContact O-N 2.88Å
259	Q	98.8	Very high	97.8	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-63.7	-44.2	178.5	-64.1	171	-4.8	0	0	111.7	Y218 F246 E247 E255 R256 S261 V262 V263	Y218-Q259 HydrophobicContact CD1-CG 4.17Å; Y218-Q259 HydrophobicContact CD2-CB 4.17Å; Y218-Q259 HydrophobicContact CD2-CG 3.49Å; Y218-Q259 VanDerWaalsContact CD2-CG 3.49Å; Y218-Q259 HydrophobicContact CE1-CB 4.34Å; Y218-Q259 HydrophobicContact CE1-CG 4.38Å; Y218-Q259 HydrophobicContact CE2-CB 3.89Å; Y218-Q259 HydrophobicContact CE2-CG 3.74Å; Y218-Q259 HydrophobicContact CG-CG 3.72Å; F246-Q259 HydrophobicContact CD1-CB 3.93Å; F246-Q259 HydrophobicContact CE1-CB 4.18Å; F246-Q259 HydrophobicContact CG-CB 4.2Å; E247-Q259 PolarHBondContact OE2-NE2 2.68Å; E255-Q259 WeakPolarHBondContact O-CG 3.13Å; E255-Q259 PolarHBondContact O-N 3Å; E255-Q259 PolarHBondContact OE1-NE2 2.95Å; R256-Q259 PolarHBondContact O-N 2.89Å; Q259-S261 VanDerWaalsContact C-N 3.29Å; Q259-S261 PolarHBondContact O-N 2.68Å; Q259-V262 WeakPolarHBondContact O-CB 3.25Å; Q259-V262 PolarHBondContact O-N 2.99Å; Q259-V262 VanDerWaalsContact O-N 3.14Å; Q259-V263 PolarHBondContact O-N 2.77Å
260	L	98.8	Very high	97.9	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-56.6	-44.2	171.5	177.3	58.8	0	0	0	111.3	F246 R256 V262 V263 L264 L284 V289 V292 Y338	F246-L260 HydrophobicContact CE2-CB 3.83Å; F246-L260 HydrophobicContact CE2-CD1 4.08Å; F246-L260 HydrophobicContact CZ-CB 4.38Å; F246-L260 HydrophobicContact CZ-CD1 4.48Å; R256-L260 WeakPolarHBondContact O-CB 3.49Å; R256-L260 PolarHBondContact O-N 2.95Å; L260-V262 VanDerWaalsContact C-N 3.3Å; L260-V262 PolarHBondContact O-N 2.79Å; L260-V263 PolarHBondContact O-N 3.28Å; L260-V263 VanDerWaalsContact O-N 3.17Å; L260-L264 HydrophobicContact CD1-CD1 3.93Å; L260-L264 HydrophobicContact CD1-CD2 4.11Å; L260-L264 HydrophobicContact CD1-CG 3.79Å; L260-L264 HydrophobicContact CG-CD1 3.92Å; L260-L264 HydrophobicContact CG-CG 4.18Å; L260-L264 WeakPolarHBondContact O-CG 3.22Å; L260-L264 PolarHBondContact O-N 3.19Å; L260-L284 HydrophobicContact CD1-CD1 4.21Å; L260-L284 HydrophobicContact CD2-CD1 3.96Å; L260-L284 HydrophobicContact CD2-CD2 3.88Å; L260-V289 HydrophobicContact CD2-CG2 4.3Å; L260-V292 HydrophobicContact CD2-CG1 4.39Å; L260-V292 HydrophobicContact CD2-CG2 3.49Å; L260-V292 VanDerWaalsContact CD2-CG2 3.49Å; L260-V292 HydrophobicContact CG-CG2 4.12Å; L260-Y338 HydrophobicContact CD1-CE2 4.09Å
261	S	98.4	Very high	98	Very high	56 Å²	56	49.2 Å²	49.2	39%	0.392	26%	0.261	S	S	.	.	H	α-helix	trans	-60.9	-37.8	178.1	-58.3	0	0	0	0	112.4	M257 K258 Q259 K265	M257-S261 PolarHBondContact O-N 3.13Å; M257-S261 PolarHBondContact O-OG 2.81Å; K258-S261 WeakPolarHBondContact O-CB 3.32Å; K258-S261 PolarHBondContact O-N 3.23Å; K258-S261 VanDerWaalsContact O-N 3.16Å; Q259-S261 VanDerWaalsContact C-N 3.29Å; Q259-S261 PolarHBondContact O-N 2.68Å; S261-K265 WeakPolarHBondContact O-CB 3.35Å; S261-K265 PolarHBondContact O-N 2.87Å
262	V	98.7	Very high	97.9	Very high	53 Å²	53	48.8 Å²	48.8	32%	0.321	24%	0.244	S	C	.	.	H	α-helix	trans	-64.1	-46.1	174	175.1	0	0	0	0	111	I216 Y218 K258 Q259 L260 K265 R266	I216-V262 HydrophobicContact CG2-CG1 4.24Å; Y218-V262 HydrophobicContact CD1-CG1 4.47Å; Y218-V262 HydrophobicContact CE1-CB 4.02Å; Y218-V262 HydrophobicContact CE1-CG1 3.87Å; Y218-V262 HydrophobicContact CE1-CG2 4.49Å; K258-V262 WeakPolarHBondContact O-CG2 3.16Å; K258-V262 PolarHBondContact O-N 2.88Å; Q259-V262 WeakPolarHBondContact O-CB 3.25Å; Q259-V262 PolarHBondContact O-N 2.99Å; Q259-V262 VanDerWaalsContact O-N 3.14Å; L260-V262 VanDerWaalsContact C-N 3.3Å; L260-V262 PolarHBondContact O-N 2.79Å; V262-K265 PolarHBondContact O-N 2.76Å; V262-R266 WeakPolarHBondContact O-CB 2.84Å; V262-R266 PolarHBondContact O-N 2.91Å
263	V	98.9	Very high	97.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.6	-50.3	177.7	172	0	0	0	0	111.4	Y218 L227 F246 Q259 L260 K265 R266 M267 F278	Y218-V263 WeakPolarHBondContact OH-CG2 3.49Å; L227-V263 HydrophobicContact CD1-CG2 3.8Å; L227-V263 HydrophobicContact CD2-CG2 4.05Å; L227-V263 HydrophobicContact CG-CG2 4.46Å; F246-V263 HydrophobicContact CE1-CG2 3.64Å; F246-V263 HydrophobicContact CZ-CB 4.16Å; F246-V263 HydrophobicContact CZ-CG2 3.58Å; Q259-V263 PolarHBondContact O-N 2.77Å; L260-V263 PolarHBondContact O-N 3.28Å; L260-V263 VanDerWaalsContact O-N 3.17Å; V263-K265 VanDerWaalsContact C-N 3.29Å; V263-K265 PolarHBondContact O-N 3.22Å; V263-R266 PolarHBondContact O-N 2.83Å; V263-R266 VanDerWaalsContact O-N 3.12Å; V263-M267 HydrophobicContact CG1-CG 4.41Å; V263-M267 HydrophobicContact CG1-SD 4.34Å; V263-M267 WeakPolarHBondContact O-CG 3.28Å; V263-M267 PolarHBondContact O-N 3.08Å; V263-F278 HydrophobicContact CB-CE2 4.42Å; V263-F278 HydrophobicContact CG1-CB 4.26Å; V263-F278 HydrophobicContact CG1-CD1 3.96Å; V263-F278 HydrophobicContact CG1-CD2 3.48Å; V263-F278 VanDerWaalsContact CG1-CD2 3.48Å; V263-F278 HydrophobicContact CG1-CE1 4.16Å; V263-F278 HydrophobicContact CG1-CE2 3.71Å; V263-F278 HydrophobicContact CG1-CG 3.6Å; V263-F278 HydrophobicContact CG1-CZ 4.05Å; V263-F278 HydrophobicContact CG2-CD2 4.28Å; V263-F278 HydrophobicContact CG2-CE2 3.8Å; V263-F278 HydrophobicContact CG2-CZ 4.22Å
264	L	98.6	Very high	97.6	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.063	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-36.1	-179.5	-63.6	-179.2	0	0	0	111.8	L260 M267 R268 V292 L295 P296 Y338	L260-L264 HydrophobicContact CD1-CD1 3.93Å; L260-L264 HydrophobicContact CD1-CD2 4.11Å; L260-L264 HydrophobicContact CD1-CG 3.79Å; L260-L264 HydrophobicContact CG-CD1 3.92Å; L260-L264 HydrophobicContact CG-CG 4.18Å; L260-L264 WeakPolarHBondContact O-CG 3.22Å; L260-L264 PolarHBondContact O-N 3.19Å; L264-M267 HydrophobicContact CD2-SD 4.49Å; L264-R268 WeakPolarHBondContact O-CB 3.3Å; L264-R268 PolarHBondContact O-N 3.45Å; L264-V292 HydrophobicContact CD1-CG2 4.29Å; L264-L295 HydrophobicContact CD2-CD2 3.74Å; L264-P296 HydrophobicContact CB-CG 4.39Å; L264-Y338 HydrophobicContact CD2-CD2 4.46Å
265	K	98.1	Very high	97.6	Very high	104 Å²	104	42.5 Å²	42.5	45%	0.452	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-49.4	171.5	177.1	175.7	-178.1	-170.1	0	111.1	S261 V262 V263 M267 R268 E269	S261-K265 WeakPolarHBondContact O-CB 3.35Å; S261-K265 PolarHBondContact O-N 2.87Å; V262-K265 PolarHBondContact O-N 2.76Å; V263-K265 VanDerWaalsContact C-N 3.29Å; V263-K265 PolarHBondContact O-N 3.22Å; K265-M267 VanDerWaalsContact C-N 3.33Å; K265-M267 PolarHBondContact O-N 2.8Å; K265-R268 PolarHBondContact O-N 3.46Å; K265-R268 VanDerWaalsContact O-N 3.13Å; K265-E269 VanDerWaalsContact CE-CD 3.44Å; K265-E269 WeakPolarHBondContact CE-OE1 3.4Å; K265-E269 VanDerWaalsContact CE-OE2 3.3Å; K265-E269 WeakPolarHBondContact CE-OE2 3.49Å; K265-E269 VanDerWaalsContact CG-CD 3.5Å; K265-E269 HydrophobicContact CG-CG 4.4Å; K265-E269 VanDerWaalsContact CG-OE1 3.28Å; K265-E269 WeakPolarHBondContact CG-OE1 3.49Å; K265-E269 WeakPolarHBondContact O-CB 3.46Å; K265-E269 WeakPolarHBondContact O-CG 3.45Å; K265-E269 PolarHBondContact O-N 3.26Å
266	R	98.1	Very high	97.6	Very high	57 Å²	57	42 Å²	42	22%	0.215	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-40.7	178.7	-172.4	60.1	158.7	95.3	-5.9	112.2	I216 L227 M242 V262 V263 A270	I216-R266 HydrophobicContact CD1-CG 4.32Å; L227-R266 HydrophobicContact CD2-CB 4.24Å; L227-R266 HydrophobicContact CD2-CG 4.23Å; M242-R266 HydrophobicContact SD-CB 4.32Å; M242-R266 HydrophobicContact SD-CG 3.6Å; V262-R266 WeakPolarHBondContact O-CB 2.84Å; V262-R266 PolarHBondContact O-N 2.91Å; V263-R266 PolarHBondContact O-N 2.83Å; V263-R266 VanDerWaalsContact O-N 3.12Å; R266-A270 PolarHBondContact O-N 3.34Å
267	M	98.4	Very high	97.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.3	-44.6	173	-70.1	-172.5	84.4	0	0	111.2	M242 V263 L264 K265 V276 F278 V299 Y338 R340	M242-M267 HydrophobicContact CE-CG 3.37Å; M242-M267 HydrophobicContact CE-SD 4.43Å; V263-M267 HydrophobicContact CG1-CG 4.41Å; V263-M267 HydrophobicContact CG1-SD 4.34Å; V263-M267 WeakPolarHBondContact O-CG 3.28Å; V263-M267 PolarHBondContact O-N 3.08Å; L264-M267 HydrophobicContact CD2-SD 4.49Å; K265-M267 VanDerWaalsContact C-N 3.33Å; K265-M267 PolarHBondContact O-N 2.8Å; M267-V276 HydrophobicContact CB-CG1 4.46Å; M267-V276 HydrophobicContact CE-CB 4.44Å; M267-V276 HydrophobicContact CE-CG1 4.21Å; M267-V276 HydrophobicContact CG-CG1 3.95Å; M267-F278 HydrophobicContact CE-CB 4.27Å; M267-F278 HydrophobicContact SD-CB 3.95Å; M267-V299 HydrophobicContact CB-CG2 4.42Å; M267-V299 HydrophobicContact CE-CG1 3.68Å; M267-V299 HydrophobicContact CE-CG2 4.35Å; M267-V299 HydrophobicContact SD-CG1 4Å; M267-Y338 HydrophobicContact SD-CD2 4.41Å; M267-R340 HydrophobicContact CE-CB 4.11Å; M267-R340 WeakPolarHBondContact O-CD 3.44Å; M267-R340 VanDerWaalsContact O-CZ 3.22Å; M267-R340 PolarHBondContact O-NE 3.03Å; M267-R340 PolarHBondContact O-NH1 3.12Å
268	R	97	Very high	97.6	Very high	138 Å²	138	40.2 Å²	40.2	52%	0.521	20%	0.201	S	C	.	.	H	α-helix	trans	-66.9	-39	-179.8	-177.5	-177.9	61.8	-117.1	-2.7	112.9	L264 K265 R340	L264-R268 WeakPolarHBondContact O-CB 3.3Å; L264-R268 PolarHBondContact O-N 3.45Å; K265-R268 PolarHBondContact O-N 3.46Å; K265-R268 VanDerWaalsContact O-N 3.13Å; R268-R340 PolarHBondContact O-NH1 3.21Å
269	E	96.2	Very high	97.6	Very high	113 Å²	113	35.9 Å²	35.9	53%	0.528	18%	0.182	S	C	.	.	H	α-helix	trans	-83.8	-11.2	-172.6	-72	172	-178	0	0	114.3	K265	K265-E269 VanDerWaalsContact CE-CD 3.44Å; K265-E269 WeakPolarHBondContact CE-OE1 3.4Å; K265-E269 VanDerWaalsContact CE-OE2 3.3Å; K265-E269 WeakPolarHBondContact CE-OE2 3.49Å; K265-E269 VanDerWaalsContact CG-CD 3.5Å; K265-E269 HydrophobicContact CG-CG 4.4Å; K265-E269 VanDerWaalsContact CG-OE1 3.28Å; K265-E269 WeakPolarHBondContact CG-OE1 3.49Å; K265-E269 WeakPolarHBondContact O-CB 3.46Å; K265-E269 WeakPolarHBondContact O-CG 3.45Å; K265-E269 PolarHBondContact O-N 3.26Å
270	A	96.3	Very high	97.6	Very high	6 Å²	6	35.8 Å²	35.8	5%	0.05	18%	0.182	C	C	.	.	S	Bend	trans	-60.3	147.9	174.9	0	0	0	0	0	111.4	R266 V276 R340	R266-A270 PolarHBondContact O-N 3.34Å; A270-V276 HydrophobicContact CB-CG2 3.53Å; A270-R340 PolarHBondContact O-NH1 3.12Å; A270-R340 PolarHBondContact O-NH2 2.78Å
271	P	95.6	Very high	97.6	Very high	73 Å²	73	35.9 Å²	35.9	47%	0.474	18%	0.182	S	C	.	.			trans	-52.7	150.4	-177.4	-27.1	35.1	0	0	0	113.6	N273 V274 R340	P271-N273 VanDerWaalsContact C-N 3.26Å; P271-N273 VanDerWaalsContact CB-OD1 3.23Å; P271-N273 WeakPolarHBondContact CB-OD1 3.42Å; P271-N273 PolarHBondContact O-N 2.9Å; P271-V274 HydrophobicContact CB-CB 4.44Å; P271-V274 HydrophobicContact CB-CG2 3.96Å; P271-V274 HydrophobicContact CG-CG2 4.23Å; P271-V274 PolarHBondContact O-N 3.47Å; P271-V274 VanDerWaalsContact O-N 3.14Å; P271-R340 PolarHBondContact O-NH2 3.45Å
272	T	94.3	Very high	97.6	Very high	67 Å²	67	33.2 Å²	33.2	41%	0.411	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-27.1	-174.3	49.3	0	0	0	0	113.6	V274 A342 K343 E344	T272-V274 VanDerWaalsContact C-N 3.3Å; T272-A342 CarbonylContact O-C 3.58Å; T272-A342 WeakPolarHBondContact O-CA 3.09Å; T272-K343 HydrophobicContact CG2-CD 3.86Å; T272-K343 PolarHBondContact O-N 3.01Å; T272-E344 PolarHBondContact OG1-OE1 3.33Å
273	N	93.8	Very high	97.6	Very high	68 Å²	68	31.1 Å²	31.1	36%	0.364	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.1	177.6	66.9	-49.7	0	0	0	113.6	Q237 P271 E344	Q237-N273 PolarHBondContact NE2-O 3.34Å; Q237-N273 VanDerWaalsContact NE2-O 3.11Å; P271-N273 VanDerWaalsContact C-N 3.26Å; P271-N273 VanDerWaalsContact CB-OD1 3.23Å; P271-N273 WeakPolarHBondContact CB-OD1 3.42Å; P271-N273 PolarHBondContact O-N 2.9Å; N273-E344 HydrophobicContact CB-CG 4.23Å
274	V	96.4	Very high	97.6	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	15%	0.151	C	C	.	.			trans	-108.4	130.3	-177	175.8	0	0	0	0	110.6	E238 C240 P271 T272 R340	E238-V274 HydrophobicContact CB-CG2 4.07Å; C240-V274 HydrophobicContact CB-CG1 3.87Å; P271-V274 HydrophobicContact CB-CB 4.44Å; P271-V274 HydrophobicContact CB-CG2 3.96Å; P271-V274 HydrophobicContact CG-CG2 4.23Å; P271-V274 PolarHBondContact O-N 3.47Å; P271-V274 VanDerWaalsContact O-N 3.14Å; T272-V274 VanDerWaalsContact C-N 3.3Å; V274-R340 PolarHBondContact O-NH2 3.25Å
275	T	97.6	Very high	97.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	137.4	170.1	-63.7	0	0	0	0	109.6	E238 L239 C240 L339 R340 A342 G347 M350	E238-T275 PolarHBondContact O-N 3.33Å; L239-T275 CarbonylContact C-O 3.59Å; L239-T275 VanDerWaalsContact CA-O 3.31Å; L239-T275 WeakPolarHBondContact CA-O 3.36Å; L239-T275 HydrophobicContact CD2-CG2 3.77Å; C240-T275 PolarHBondContact N-O 3.09Å; T275-L339 HydrophobicContact CG2-CD1 3.72Å; T275-R340 CarbonylContact C-O 3.53Å; T275-R340 WeakPolarHBondContact CA-O 3.25Å; T275-A342 PolarHBondContact OG1-N 3.13Å; T275-G347 WeakPolarHBondContact OG1-CA 3.4Å; T275-G347 PolarHBondContact OG1-O 3.28Å; T275-M350 HydrophobicContact CG2-CB 4.38Å; T275-M350 HydrophobicContact CG2-CG 4.44Å; T275-M350 HydrophobicContact CG2-SD 3.53Å; T275-M350 VanDerWaalsContact CG2-SD 3.53Å
276	V	98.6	Very high	97.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.5	-177.7	-170.3	0	0	0	0	110	C240 M242 M267 A270 R340	C240-V276 HydrophobicContact CB-CB 4.41Å; C240-V276 HydrophobicContact CB-CG1 4.14Å; C240-V276 HydrophobicContact CB-CG2 4.08Å; C240-V276 CarbonylContact O-C 3.5Å; C240-V276 VanDerWaalsContact O-CA 3.32Å; C240-V276 WeakPolarHBondContact O-CA 3.49Å; M242-V276 HydrophobicContact CE-CG1 3.45Å; M242-V276 VanDerWaalsContact CE-CG1 3.45Å; M242-V276 HydrophobicContact SD-CG1 4.25Å; M267-V276 HydrophobicContact CB-CG1 4.46Å; M267-V276 HydrophobicContact CE-CB 4.44Å; M267-V276 HydrophobicContact CE-CG1 4.21Å; M267-V276 HydrophobicContact CG-CG1 3.95Å; A270-V276 HydrophobicContact CB-CG2 3.53Å; V276-R340 HydrophobicContact CB-CB 4.04Å; V276-R340 HydrophobicContact CG2-CB 4.46Å; V276-R340 VanDerWaalsContact CG2-CZ 3.48Å; V276-R340 PolarHBondContact N-O 3.4Å; V276-R340 PolarHBondContact O-N 3.43Å
277	L	98.6	Very high	97.3	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123.7	171.3	-79.5	168.6	0	0	0	108.9	L133 C240 V241 M242 L339 F379	L133-L277 HydrophobicContact CD2-CD1 3.48Å; L133-L277 VanDerWaalsContact CD2-CD1 3.48Å; C240-L277 PolarHBondContact O-N 3.38Å; V241-L277 CarbonylContact C-O 3.58Å; V241-L277 WeakPolarHBondContact CA-O 3.49Å; V241-L277 HydrophobicContact CG1-CB 4.3Å; M242-L277 PolarHBondContact N-O 3.39Å; L277-L339 HydrophobicContact CD2-CB 4.04Å; L277-L339 HydrophobicContact CD2-CD1 3.63Å; L277-L339 HydrophobicContact CD2-CG 4.4Å; L277-L339 HydrophobicContact CG-CD1 4.08Å; L277-F379 HydrophobicContact CD1-CD2 4.45Å; L277-F379 HydrophobicContact CD1-CE2 4.23Å; L277-F379 HydrophobicContact CD2-CD1 4.47Å; L277-F379 HydrophobicContact CD2-CE1 3.79Å; L277-F379 HydrophobicContact CD2-CE2 4.02Å; L277-F379 HydrophobicContact CD2-CZ 3.53Å
278	F	98.9	Very high	97.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.6	167.7	168.9	-96.8	0	0	0	108.8	L227 M242 F246 V263 M267 T282 V337 Y338	L227-F278 HydrophobicContact CD1-CD2 4.13Å; L227-F278 HydrophobicContact CD1-CE2 3.97Å; M242-F278 HydrophobicContact CB-CB 4.42Å; M242-F278 HydrophobicContact CB-CD2 4.01Å; M242-F278 HydrophobicContact CE-CB 3.93Å; M242-F278 HydrophobicContact CE-CD2 4.5Å; M242-F278 WeakPolarHBondContact O-CA 3.38Å; F246-F278 HydrophobicContact CE1-CE2 4.42Å; F246-F278 AromaticContact CE1-CZ 3.97Å; F246-F278 HydrophobicContact CE1-CZ 3.97Å; F246-F278 HydrophobicContact CZ-CE1 4.38Å; F246-F278 HydrophobicContact CZ-CE2 4.43Å; F246-F278 AromaticContact CZ-CZ 3.71Å; F246-F278 HydrophobicContact CZ-CZ 3.71Å; V263-F278 HydrophobicContact CB-CE2 4.42Å; V263-F278 HydrophobicContact CG1-CB 4.26Å; V263-F278 HydrophobicContact CG1-CD1 3.96Å; V263-F278 HydrophobicContact CG1-CD2 3.48Å; V263-F278 VanDerWaalsContact CG1-CD2 3.48Å; V263-F278 HydrophobicContact CG1-CE1 4.16Å; V263-F278 HydrophobicContact CG1-CE2 3.71Å; V263-F278 HydrophobicContact CG1-CG 3.6Å; V263-F278 HydrophobicContact CG1-CZ 4.05Å; V263-F278 HydrophobicContact CG2-CD2 4.28Å; V263-F278 HydrophobicContact CG2-CE2 3.8Å; V263-F278 HydrophobicContact CG2-CZ 4.22Å; M267-F278 HydrophobicContact CE-CB 4.27Å; M267-F278 HydrophobicContact SD-CB 3.95Å; F278-T282 HydrophobicContact CE1-CG2 3.87Å; F278-T282 HydrophobicContact CZ-CG2 4.26Å; F278-V337 CarbonylContact O-C 3.47Å; F278-V337 VanDerWaalsContact O-CA 3.31Å; F278-V337 WeakPolarHBondContact O-CA 3.48Å; F278-Y338 AromaticContact CD1-CD2 3.54Å; F278-Y338 HydrophobicContact CD1-CD2 3.54Å; F278-Y338 HydrophobicContact CD1-CE2 4.11Å; F278-Y338 HydrophobicContact CD1-CG 4.14Å; F278-Y338 HydrophobicContact CE1-CD2 4.07Å; F278-Y338 HydrophobicContact CE1-CE2 4.16Å; F278-Y338 PolarHBondContact N-O 3.42Å; F278-Y338 PolarHBondContact O-N 3.33Å
279	G	98.8	Very high	97.3	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	155.5	167.4	0	0	0	0	0	112.3	F168 M242 T243 R336	F168-G279 WeakPolarHBondContact CD2-O 3.48Å; M242-G279 PolarHBondContact O-N 3.17Å; T243-G279 VanDerWaalsContact CA-O 3.23Å; T243-G279 WeakPolarHBondContact CA-O 3.5Å; T243-G279 WeakPolarHBondContact CB-O 3.48Å; T243-G279 PolarHBondContact OG1-O 3.24Å; G279-R336 VanDerWaalsContact CA-O 3.22Å; G279-R336 WeakPolarHBondContact CA-O 3.4Å
280	G	98.8	Very high	97.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.2	-177.9	175.5	0	0	0	0	0	112.9	S137 Q170 T282 D335 R336	S137-G280 WeakPolarHBondContact OG-CA 3.1Å; S137-G280 PolarHBondContact OG-N 3.49Å; Q170-G280 VanDerWaalsContact NE2-CA 3.34Å; G280-T282 PolarHBondContact O-N 3.36Å; G280-T282 VanDerWaalsContact O-N 3.08Å; G280-D335 WeakPolarHBondContact O-CA 3.37Å; G280-R336 PolarHBondContact N-O 3.11Å; G280-R336 VanDerWaalsContact N-O 3.15Å; G280-R336 PolarHBondContact O-N 2.95Å; G280-R336 VanDerWaalsContact O-N 3.09Å
281	D	98.9	Very high	97.3	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	97.6	170.7	-178.2	-1.4	0	0	0	110	N139 Q170 H245 F246 N283 F334 H372	N139-D281 HydrophobicContact CB-CB 4.17Å; N139-D281 PolarHBondContact ND2-OD2 3.46Å; Q170-D281 HydrophobicContact CG-CB 4.26Å; H245-D281 CarbonylContact C-O 3.54Å; H245-D281 VanDerWaalsContact CA-O 3.32Å; H245-D281 WeakPolarHBondContact CA-O 3.43Å; H245-D281 IonicContact CD2-OD2 3.3Å; H245-D281 IonicContact NE2-OD2 3.73Å; H245-D281 PolarHBondContact NE2-OD2 3.08Å; F246-D281 PolarHBondContact N-O 3.16Å; D281-N283 VanDerWaalsContact C-N 3.34Å; D281-N283 PolarHBondContact OD1-N 3.01Å; D281-N283 PolarHBondContact OD1-ND2 3.32Å; D281-N283 VanDerWaalsContact OD1-ND2 3.15Å; D281-N283 PolarHBondContact OD2-ND2 3.15Å; D281-F334 WeakPolarHBondContact OD1-CB 3.35Å; D281-H372 IonicContact OD2-CE1 3.78Å; D281-H372 PolarHBondContact OD2-CE1 3.45Å; D281-H372 IonicContact OD2-NE2 3.48Å
282	T	98.9	Very high	97.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.177	C	C	.	.			trans	-82.4	-12.3	179.6	72.3	0	0	0	0	112.7	F246 R256 F278 G280 L284 F334 R336	F246-T282 VanDerWaalsContact CB-O 3.26Å; F246-T282 WeakPolarHBondContact CB-O 3.37Å; F246-T282 HydrophobicContact CD2-CG2 4.46Å; F246-T282 VanDerWaalsContact CD2-O 3.22Å; F246-T282 WeakPolarHBondContact CD2-O 3.44Å; F246-T282 HydrophobicContact CE2-CG2 4.26Å; R256-T282 WeakPolarHBondContact CD-O 3.32Å; F278-T282 HydrophobicContact CE1-CG2 3.87Å; F278-T282 HydrophobicContact CZ-CG2 4.26Å; G280-T282 PolarHBondContact O-N 3.36Å; G280-T282 VanDerWaalsContact O-N 3.08Å; T282-L284 HydrophobicContact CG2-CD1 4.21Å; T282-L284 WeakPolarHBondContact O-CG 3.4Å; T282-L284 PolarHBondContact O-N 2.86Å; T282-L284 WeakPolarHBondContact OG1-CB 3.32Å; T282-L284 WeakPolarHBondContact OG1-CD1 3.5Å; T282-L284 WeakPolarHBondContact OG1-CG 3.37Å; T282-L284 PolarHBondContact OG1-N 3.32Å; T282-F334 WeakPolarHBondContact CA-O 3.49Å; T282-F334 WeakPolarHBondContact CB-O 3.33Å; T282-F334 PolarHBondContact N-O 3.41Å; T282-F334 PolarHBondContact OG1-O 3.31Å; T282-R336 HydrophobicContact CG2-CB 3.91Å; T282-R336 HydrophobicContact CG2-CG 4.18Å
283	N	98.8	Very high	97.4	Very high	10 Å²	10	32.4 Å²	32.4	5%	0.053	19%	0.192	C	C	.	.			trans	50.8	12.3	-172.1	-85.1	-76	0	0	0	115.3	H245 F246 S248 R256 D281 R285 F334	H245-N283 PolarHBondContact CD2-ND2 3.19Å; H245-N283 PolarHBondContact NE2-ND2 2.87Å; H245-N283 VanDerWaalsContact NE2-ND2 3.17Å; F246-N283 PolarHBondContact O-ND2 3.44Å; S248-N283 PolarHBondContact OG-ND2 2.66Å; R256-N283 WeakPolarHBondContact CD-O 3.24Å; R256-N283 PolarHBondContact NE-O 2.87Å; R256-N283 VanDerWaalsContact NE-O 3.11Å; D281-N283 VanDerWaalsContact C-N 3.34Å; D281-N283 PolarHBondContact OD1-N 3.01Å; D281-N283 PolarHBondContact OD1-ND2 3.32Å; D281-N283 VanDerWaalsContact OD1-ND2 3.15Å; D281-N283 PolarHBondContact OD2-ND2 3.15Å; N283-R285 PolarHBondContact O-NH1 2.91Å; N283-F334 VanDerWaalsContact C-CD1 3.48Å
284	L	98.5	Very high	97.6	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.016	19%	0.186	C	C	.	.			trans	-75.5	146.7	-168.5	-76.6	167.7	0	0	0	112.2	F246 R256 L260 T282 E288 V289 R336 Y338	F246-L284 HydrophobicContact CD2-CG 4.39Å; F246-L284 HydrophobicContact CE2-CD1 4.34Å; R256-L284 HydrophobicContact CG-CD2 3.79Å; R256-L284 HydrophobicContact CG-CG 4.4Å; L260-L284 HydrophobicContact CD1-CD1 4.21Å; L260-L284 HydrophobicContact CD2-CD1 3.96Å; L260-L284 HydrophobicContact CD2-CD2 3.88Å; T282-L284 HydrophobicContact CG2-CD1 4.21Å; T282-L284 WeakPolarHBondContact O-CG 3.4Å; T282-L284 PolarHBondContact O-N 2.86Å; T282-L284 WeakPolarHBondContact OG1-CB 3.32Å; T282-L284 WeakPolarHBondContact OG1-CD1 3.5Å; T282-L284 WeakPolarHBondContact OG1-CG 3.37Å; T282-L284 PolarHBondContact OG1-N 3.32Å; L284-E288 HydrophobicContact CD2-CB 3.99Å; L284-V289 HydrophobicContact CD1-CG2 3.95Å; L284-R336 PolarHBondContact O-NH2 2.86Å; L284-Y338 WeakPolarHBondContact CD1-OH 3.45Å
285	R	97.4	Very high	97.7	Very high	60 Å²	60	32.3 Å²	32.3	23%	0.226	20%	0.196	C	C	.	.			trans	-102.2	149.3	159.5	-74.3	69.7	176.2	-178.1	4.7	108.4	N283 A287 E288	N283-R285 PolarHBondContact O-NH1 2.91Å; R285-A287 PolarHBondContact O-N 2.82Å; R285-E288 HydrophobicContact CB-CG 4.31Å; R285-E288 PolarHBondContact N-OE2 3.36Å; R285-E288 VanDerWaalsContact O-CB 3.31Å; R285-E288 WeakPolarHBondContact O-CB 3.22Å; R285-E288 PolarHBondContact O-N 3.15Å
286	D	94.8	Very high	97.6	Very high	66 Å²	66	33.6 Å²	33.6	35%	0.353	21%	0.205	S	C	.	.	H	α-helix	trans	-58.1	-38.1	-174.3	-66.5	-15	0	0	0	112.6	E288 V289 T290 R333 R336	D286-E288 PolarHBondContact O-N 2.62Å; D286-E288 VanDerWaalsContact O-N 3.16Å; D286-V289 PolarHBondContact O-N 3.24Å; D286-V289 VanDerWaalsContact O-N 3.17Å; D286-T290 PolarHBondContact O-N 3.36Å; D286-R333 IonicContact OD1-NH2 3.56Å; D286-R336 IonicContact OD1-CZ 3.12Å; D286-R336 IonicContact OD1-NH1 2.74Å; D286-R336 PolarHBondContact OD1-NH1 2.84Å; D286-R336 IonicContact OD1-NH2 2.63Å; D286-R336 PolarHBondContact OD1-NH2 3.33Å
287	A	96.8	Very high	97.4	Very high	59 Å²	59	37.6 Å²	37.6	49%	0.488	25%	0.246	S	C	.	.	H	α-helix	trans	-60.6	-24.6	175.7	0	0	0	0	0	114.1	R285 K291	R285-A287 PolarHBondContact O-N 2.82Å; A287-K291 VanDerWaalsContact O-CG 3.24Å; A287-K291 WeakPolarHBondContact O-CG 3.37Å; A287-K291 PolarHBondContact O-N 3.48Å; A287-K291 VanDerWaalsContact O-N 3.09Å
288	E	98.3	Very high	97.2	Very high	16 Å²	16	40.3 Å²	40.3	8%	0.075	28%	0.275	C	S	.	.	H	α-helix	trans	-76.7	-33.5	179.7	-64	167.8	165.8	0	0	111.5	A253 R256 M257 L284 R285 D286 T290 K291 V292	A253-E288 VanDerWaalsContact CB-OE1 3.28Å; A253-E288 WeakPolarHBondContact CB-OE1 3.46Å; R256-E288 IonicContact CZ-OE1 2.75Å; R256-E288 IonicContact CZ-OE2 2.64Å; R256-E288 IonicContact NE-OE1 3.21Å; R256-E288 IonicContact NE-OE2 2.71Å; R256-E288 PolarHBondContact NE-OE2 2.97Å; R256-E288 IonicContact NH2-OE1 3.56Å; R256-E288 PolarHBondContact NH2-OE1 3.5Å; R256-E288 IonicContact NH2-OE2 3.7Å; R256-E288 PolarHBondContact NH2-OE2 3.39Å; R256-E288 VanDerWaalsContact NH2-OE2 3.12Å; M257-E288 HydrophobicContact CG-CB 3.96Å; M257-E288 HydrophobicContact CG-CG 4.42Å; M257-E288 HydrophobicContact SD-CB 4.14Å; M257-E288 HydrophobicContact SD-CG 4.34Å; L284-E288 HydrophobicContact CD2-CB 3.99Å; R285-E288 HydrophobicContact CB-CG 4.31Å; R285-E288 PolarHBondContact N-OE2 3.36Å; R285-E288 VanDerWaalsContact O-CB 3.31Å; R285-E288 WeakPolarHBondContact O-CB 3.22Å; R285-E288 PolarHBondContact O-N 3.15Å; D286-E288 PolarHBondContact O-N 2.62Å; D286-E288 VanDerWaalsContact O-N 3.16Å; E288-T290 VanDerWaalsContact C-N 3.34Å; E288-K291 PolarHBondContact O-N 2.96Å; E288-V292 PolarHBondContact O-N 3.08Å
289	V	97.2	Very high	97.1	Very high	20 Å²	20	41.1 Å²	41.1	12%	0.121	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-43.6	172.6	-177.4	0	0	0	0	110.1	L260 L284 D286 K291 V292 G294 L295	L260-V289 HydrophobicContact CD2-CG2 4.3Å; L284-V289 HydrophobicContact CD1-CG2 3.95Å; D286-V289 PolarHBondContact O-N 3.24Å; D286-V289 VanDerWaalsContact O-N 3.17Å; V289-K291 PolarHBondContact O-N 2.8Å; V289-V292 WeakPolarHBondContact O-CG2 3.41Å; V289-V292 PolarHBondContact O-N 3.41Å; V289-G294 WeakPolarHBondContact O-CA 3.48Å; V289-G294 PolarHBondContact O-N 3.25Å; V289-L295 HydrophobicContact CG1-CD2 4.48Å
290	T	96.2	Very high	97.1	Very high	108 Å²	108	42.3 Å²	42.3	66%	0.663	29%	0.288	S	S	*	.	H	α-helix	trans	-62.8	-41.5	175.7	-51.6	0	0	0	0	111.9	D286 E288 V292 G293	D286-T290 PolarHBondContact O-N 3.36Å; E288-T290 VanDerWaalsContact C-N 3.34Å; T290-V292 VanDerWaalsContact C-N 3.28Å; T290-V292 PolarHBondContact O-N 3.36Å; T290-G293 PolarHBondContact O-N 2.88Å
291	K	97.3	Very high	97.1	Very high	155 Å²	155	42.6 Å²	42.6	67%	0.674	29%	0.289	S	S	*	.	H	α-helix	trans	-63.7	-29	-179.6	-78.4	172	-176.8	-179.3	0	114	M257 A287 E288 V289 G293	M257-K291 HydrophobicContact SD-CB 3.75Å; M257-K291 HydrophobicContact SD-CD 4.08Å; A287-K291 VanDerWaalsContact O-CG 3.24Å; A287-K291 WeakPolarHBondContact O-CG 3.37Å; A287-K291 PolarHBondContact O-N 3.48Å; A287-K291 VanDerWaalsContact O-N 3.09Å; E288-K291 PolarHBondContact O-N 2.96Å; V289-K291 PolarHBondContact O-N 2.8Å; K291-G293 VanDerWaalsContact C-N 3.25Å; K291-G293 PolarHBondContact O-N 3.08Å
292	V	95.6	Very high	97.1	Very high	40 Å²	40	42.6 Å²	42.6	24%	0.242	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	5.3	174.5	-58.5	0	0	0	0	113.5	M257 L260 L264 E288 V289 T290	M257-V292 HydrophobicContact CB-CG1 3.67Å; M257-V292 HydrophobicContact CG-CG1 3.83Å; M257-V292 HydrophobicContact SD-CG1 4.24Å; L260-V292 HydrophobicContact CD2-CG1 4.39Å; L260-V292 HydrophobicContact CD2-CG2 3.49Å; L260-V292 VanDerWaalsContact CD2-CG2 3.49Å; L260-V292 HydrophobicContact CG-CG2 4.12Å; L264-V292 HydrophobicContact CD1-CG2 4.29Å; E288-V292 PolarHBondContact O-N 3.08Å; V289-V292 WeakPolarHBondContact O-CG2 3.41Å; V289-V292 PolarHBondContact O-N 3.41Å; T290-V292 VanDerWaalsContact C-N 3.28Å; T290-V292 PolarHBondContact O-N 3.36Å
293	G	96.3	Very high	97.1	Very high	70 Å²	70	43.3 Å²	43.3	72%	0.722	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	11.6	179.6	0	0	0	0	0	114.8	T290 K291	T290-G293 PolarHBondContact O-N 2.88Å; K291-G293 VanDerWaalsContact C-N 3.25Å; K291-G293 PolarHBondContact O-N 3.08Å
294	G	96.9	Very high	97.1	Very high	23 Å²	23	46.7 Å²	46.7	24%	0.237	31%	0.307	C	S	.	.	S	Bend	trans	78.9	-173.6	-178.8	0	0	0	0	0	114	V289	V289-G294 WeakPolarHBondContact O-CA 3.48Å; V289-G294 PolarHBondContact O-N 3.25Å
295	L	97.8	Very high	97	Very high	45 Å²	45	52.4 Å²	52.4	24%	0.236	33%	0.334	C	S	.	.	S	Bend	trans	-75.5	138.4	173.9	-60.4	-178.3	0	0	0	110.1	L264 V289 V299 D301 Y338	L264-L295 HydrophobicContact CD2-CD2 3.74Å; V289-L295 HydrophobicContact CG1-CD2 4.48Å; L295-V299 HydrophobicContact CB-CB 4.43Å; L295-V299 HydrophobicContact CD1-CG1 4.49Å; L295-D301 HydrophobicContact CD1-CB 3.99Å; L295-Y338 HydrophobicContact CD1-CD1 4.43Å; L295-Y338 HydrophobicContact CD2-CD2 4.29Å; L295-Y338 HydrophobicContact CD2-CE1 4.36Å; L295-Y338 HydrophobicContact CD2-CE2 4.09Å
296	P	96.1	Very high	97.1	Very high	27 Å²	27	51 Å²	51	18%	0.175	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-67.8	154.7	178.6	27.9	-31.7	0	0	0	111	L264 G298 V299	L264-P296 HydrophobicContact CB-CG 4.39Å; P296-G298 PolarHBondContact O-N 2.96Å; P296-V299 HydrophobicContact CG-CB 4.17Å; P296-V299 HydrophobicContact CG-CG2 3.66Å; P296-V299 WeakPolarHBondContact O-CB 3.48Å; P296-V299 PolarHBondContact O-N 3.44Å
297	G	94.5	Very high	97.3	Very high	85 Å²	85	50.7 Å²	50.7	88%	0.876	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	132.1	-179.4	0	0	0	0	0	112.9	V299	G297-V299 VanDerWaalsContact C-N 3.33Å
298	G	94.2	Very high	97.3	Very high	59 Å²	59	53.5 Å²	53.5	61%	0.608	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	-2.9	-175.9	0	0	0	0	0	114.8	P296 R340 P341	P296-G298 PolarHBondContact O-N 2.96Å; G298-R340 WeakPolarHBondContact O-CA 3.38Å; G298-P341 WeakPolarHBondContact O-CD 3.46Å
299	V	97.9	Very high	97.3	Very high	16 Å²	16	56.1 Å²	56.1	10%	0.097	36%	0.357	C	S	.	.			trans	-101.3	133.5	169.2	-175.5	0	0	0	0	109.4	M267 L295 P296 G297 L339 R340	M267-V299 HydrophobicContact CB-CG2 4.42Å; M267-V299 HydrophobicContact CE-CG1 3.68Å; M267-V299 HydrophobicContact CE-CG2 4.35Å; M267-V299 HydrophobicContact SD-CG1 4Å; L295-V299 HydrophobicContact CB-CB 4.43Å; L295-V299 HydrophobicContact CD1-CG1 4.49Å; P296-V299 HydrophobicContact CG-CB 4.17Å; P296-V299 HydrophobicContact CG-CG2 3.66Å; P296-V299 WeakPolarHBondContact O-CB 3.48Å; P296-V299 PolarHBondContact O-N 3.44Å; G297-V299 VanDerWaalsContact C-N 3.33Å; V299-L339 CarbonylContact C-O 3.57Å; V299-L339 WeakPolarHBondContact CA-O 3.32Å; V299-R340 HydrophobicContact CG2-CB 3.95Å; V299-R340 HydrophobicContact CG2-CG 3.95Å
300	C	97.8	Very high	97.3	Very high	26 Å²	26	59.9 Å²	59.9	18%	0.176	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.2	174.8	65	0	0	0	0	111.4	Q305 Y338 L339	C300-Q305 HydrophobicContact CB-CB 4.42Å; C300-Y338 CarbonylContact O-C 3.56Å; C300-Y338 VanDerWaalsContact O-CA 3.26Å; C300-Y338 WeakPolarHBondContact O-CA 3.42Å; C300-L339 PolarHBondContact N-O 3.05Å; C300-L339 PolarHBondContact O-N 2.73Å
301	D	98.8	Very high	97.3	Very high	6 Å²	6	60.5 Å²	60.5	3%	0.032	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.6	162.9	-179.9	-45	0	0	0	108.3	L295 W303 E304 Q305 R333 Y338	L295-D301 HydrophobicContact CD1-CB 3.99Å; D301-W303 VanDerWaalsContact C-N 3.33Å; D301-W303 PolarHBondContact O-N 3.31Å; D301-W303 WeakPolarHBondContact OD1-CB 3.5Å; D301-W303 PolarHBondContact OD1-N 2.9Å; D301-E304 HydrophobicContact CB-CB 3.99Å; D301-E304 HydrophobicContact CB-CG 3.8Å; D301-E304 PolarHBondContact O-N 2.91Å; D301-E304 PolarHBondContact OD1-N 3.04Å; D301-Q305 WeakPolarHBondContact O-CB 3.43Å; D301-Q305 PolarHBondContact O-N 3.37Å; D301-R333 IonicContact OD1-NH1 3.78Å; D301-R333 IonicContact OD2-CZ 3.73Å; D301-R333 IonicContact OD2-NH1 3.48Å; D301-R333 PolarHBondContact OD2-NH1 3.21Å; D301-R333 IonicContact OD2-NH2 3.18Å; D301-R333 PolarHBondContact OD2-NH2 3.17Å; D301-R333 VanDerWaalsContact OD2-NH2 3.09Å; D301-Y338 HydrophobicContact CB-CD1 4.03Å; D301-Y338 HydrophobicContact CB-CE1 4.02Å
302	V	98.8	Very high	97.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.4	-41.3	-174.9	168.8	0	0	0	0	111.9	E304 Q305 L306 V337 L339 P352 M355 F379	V302-E304 VanDerWaalsContact C-N 3.34Å; V302-Q305 PolarHBondContact O-N 3Å; V302-L306 HydrophobicContact CG1-CD1 3.85Å; V302-L306 WeakPolarHBondContact O-CB 3.31Å; V302-L306 VanDerWaalsContact O-CG 3.31Å; V302-L306 WeakPolarHBondContact O-CG 3.15Å; V302-L306 PolarHBondContact O-N 2.97Å; V302-V337 HydrophobicContact CB-CB 4.15Å; V302-V337 HydrophobicContact CB-CG1 4.4Å; V302-V337 HydrophobicContact CG2-CB 4.02Å; V302-V337 HydrophobicContact CG2-CG1 3.75Å; V302-V337 WeakPolarHBondContact CG2-O 3.32Å; V302-V337 PolarHBondContact N-O 2.85Å; V302-L339 HydrophobicContact CG2-CB 4.25Å; V302-P352 HydrophobicContact CB-CG 4.48Å; V302-P352 HydrophobicContact CG1-CB 3.87Å; V302-P352 HydrophobicContact CG1-CG 4.27Å; V302-P352 HydrophobicContact CG2-CG 4.09Å; V302-M355 HydrophobicContact CG1-CB 4.49Å; V302-M355 HydrophobicContact CG1-SD 4.21Å; V302-F379 HydrophobicContact CG2-CE1 3.79Å; V302-F379 HydrophobicContact CG2-CZ 4.11Å
303	W	98.8	Very high	97.4	Very high	15 Å²	15	54 Å²	54	6%	0.057	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-40.5	178.2	174.5	76.8	0	0	0	111	D301 K308 Q309 R313 M355	D301-W303 VanDerWaalsContact C-N 3.33Å; D301-W303 PolarHBondContact O-N 3.31Å; D301-W303 WeakPolarHBondContact OD1-CB 3.5Å; D301-W303 PolarHBondContact OD1-N 2.9Å; W303-K308 HydrophobicContact CD2-CB 4.42Å; W303-K308 VanDerWaalsContact CE2-CA 3.45Å; W303-K308 HydrophobicContact CE3-CB 4.4Å; W303-K308 HydrophobicContact CE3-CG 4.07Å; W303-K308 HydrophobicContact CH2-CB 3.57Å; W303-K308 HydrophobicContact CH2-CD 4.14Å; W303-K308 HydrophobicContact CH2-CG 3.78Å; W303-K308 HydrophobicContact CZ2-CB 3.57Å; W303-K308 HydrophobicContact CZ2-CG 4.22Å; W303-K308 WeakPolarHBondContact CZ2-O 3.26Å; W303-K308 HydrophobicContact CZ3-CB 4.01Å; W303-K308 HydrophobicContact CZ3-CD 4.1Å; W303-K308 HydrophobicContact CZ3-CG 3.7Å; W303-K308 WeakPolarHBondContact O-CA 3.5Å; W303-K308 PolarHBondContact O-N 3.36Å; W303-Q309 PolarHBondContact NE1-O 2.82Å; W303-R313 HydrophobicContact CH2-CG 4.09Å; W303-R313 HydrophobicContact CZ2-CB 3.81Å; W303-R313 HydrophobicContact CZ2-CG 3.54Å; W303-M355 HydrophobicContact CB-CE 4.04Å; W303-M355 HydrophobicContact CB-SD 3.64Å; W303-M355 HydrophobicContact CG-SD 4.34Å
304	E	98.5	Very high	97.6	Very high	81 Å²	81	52 Å²	52	38%	0.379	31%	0.306	S	S	.	.	H	α-helix	trans	-67.4	-43.9	177.1	-60.9	-171.1	160.8	0	0	112.1	D301 V302 L306 G307 K308 R333	D301-E304 HydrophobicContact CB-CB 3.99Å; D301-E304 HydrophobicContact CB-CG 3.8Å; D301-E304 PolarHBondContact O-N 2.91Å; D301-E304 PolarHBondContact OD1-N 3.04Å; V302-E304 VanDerWaalsContact C-N 3.34Å; E304-L306 VanDerWaalsContact C-N 3.28Å; E304-L306 PolarHBondContact O-N 3.14Å; E304-G307 PolarHBondContact O-N 3.16Å; E304-G307 VanDerWaalsContact O-N 3.07Å; E304-K308 HydrophobicContact CB-CG 4.39Å; E304-K308 HydrophobicContact CG-CG 4.38Å; E304-R333 IonicContact OE1-NH2 3.31Å
305	Q	98.3	Very high	97.6	Very high	123 Å²	123	51 Å²	51	58%	0.575	30%	0.295	S	S	*	.	H	α-helix	trans	-62.9	-33.9	178.9	-174.1	63.8	33.1	0	0	112.2	C300 D301 V302 G307 P352	C300-Q305 HydrophobicContact CB-CB 4.42Å; D301-Q305 WeakPolarHBondContact O-CB 3.43Å; D301-Q305 PolarHBondContact O-N 3.37Å; V302-Q305 PolarHBondContact O-N 3Å; Q305-G307 PolarHBondContact O-N 3Å; Q305-P352 HydrophobicContact CB-CG 4.37Å; Q305-P352 HydrophobicContact CG-CG 4.1Å
306	L	98.4	Very high	97.7	Very high	31 Å²	31	50.2 Å²	50.2	16%	0.162	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	11.7	176	-69.5	173	0	0	0	113.8	V302 E304 Q309 P352 M355	V302-L306 HydrophobicContact CG1-CD1 3.85Å; V302-L306 WeakPolarHBondContact O-CB 3.31Å; V302-L306 VanDerWaalsContact O-CG 3.31Å; V302-L306 WeakPolarHBondContact O-CG 3.15Å; V302-L306 PolarHBondContact O-N 2.97Å; E304-L306 VanDerWaalsContact C-N 3.28Å; E304-L306 PolarHBondContact O-N 3.14Å; L306-Q309 WeakPolarHBondContact O-CG 3.46Å; L306-Q309 PolarHBondContact O-NE2 3.04Å; L306-P352 HydrophobicContact CD1-CB 4.08Å; L306-P352 HydrophobicContact CD2-CB 4Å; L306-P352 HydrophobicContact CG-CB 3.92Å; L306-M355 HydrophobicContact CD1-CB 3.49Å; L306-M355 VanDerWaalsContact CD1-CB 3.49Å
307	G	98.3	Very high	97.8	Very high	59 Å²	59	49.5 Å²	49.5	61%	0.608	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	24.4	173.7	0	0	0	0	0	114.7	E304 Q305 Q309	E304-G307 PolarHBondContact O-N 3.16Å; E304-G307 VanDerWaalsContact O-N 3.07Å; Q305-G307 PolarHBondContact O-N 3Å; G307-Q309 PolarHBondContact O-N 3.17Å
308	K	98.3	Very high	97.9	Very high	119 Å²	119	46.5 Å²	46.5	52%	0.517	25%	0.248	S	C	.	.			trans	57	46.4	172.2	-60.6	-177.8	179.8	-175.1	0	113.2	W303 E304 E310	W303-K308 HydrophobicContact CD2-CB 4.42Å; W303-K308 VanDerWaalsContact CE2-CA 3.45Å; W303-K308 HydrophobicContact CE3-CB 4.4Å; W303-K308 HydrophobicContact CE3-CG 4.07Å; W303-K308 HydrophobicContact CH2-CB 3.57Å; W303-K308 HydrophobicContact CH2-CD 4.14Å; W303-K308 HydrophobicContact CH2-CG 3.78Å; W303-K308 HydrophobicContact CZ2-CB 3.57Å; W303-K308 HydrophobicContact CZ2-CG 4.22Å; W303-K308 WeakPolarHBondContact CZ2-O 3.26Å; W303-K308 HydrophobicContact CZ3-CB 4.01Å; W303-K308 HydrophobicContact CZ3-CD 4.1Å; W303-K308 HydrophobicContact CZ3-CG 3.7Å; W303-K308 WeakPolarHBondContact O-CA 3.5Å; W303-K308 PolarHBondContact O-N 3.36Å; E304-K308 HydrophobicContact CB-CG 4.39Å; E304-K308 HydrophobicContact CG-CG 4.38Å; K308-E310 PolarHBondContact O-N 2.91Å
309	Q	97.3	Very high	98	Very high	71 Å²	71	51.5 Å²	51.5	33%	0.332	25%	0.253	S	S	.	.			trans	-62.5	123.7	-172.7	-58.7	-177.9	14	0	0	111.1	W303 L306 G307 H311 C312 R313	W303-Q309 PolarHBondContact NE1-O 2.82Å; L306-Q309 WeakPolarHBondContact O-CG 3.46Å; L306-Q309 PolarHBondContact O-NE2 3.04Å; G307-Q309 PolarHBondContact O-N 3.17Å; Q309-H311 VanDerWaalsContact C-N 3.31Å; Q309-H311 PolarHBondContact O-N 3.45Å; Q309-H311 PolarHBondContact OE1-CE1 2.64Å; Q309-C312 PolarHBondContact O-N 3.18Å; Q309-R313 PolarHBondContact O-N 2.86Å
310	E	97.6	Very high	97.9	Very high	99 Å²	99	53 Å²	53	46%	0.463	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-66.9	-32.6	-169.6	-175.6	59.8	-157.3	0	0	112.7	K308 C312 R313 Y314	K308-E310 PolarHBondContact O-N 2.91Å; E310-C312 PolarHBondContact O-N 2.94Å; E310-C312 VanDerWaalsContact O-N 3.14Å; E310-R313 WeakPolarHBondContact O-CB 3.49Å; E310-R313 PolarHBondContact O-N 3.22Å; E310-R313 WeakPolarHBondContact OE2-CD 3.26Å; E310-R313 IonicContact OE2-NH1 3.69Å; E310-R313 PolarHBondContact OE2-NH1 3.32Å; E310-Y314 WeakPolarHBondContact OE1-CE2 3.45Å
311	H	96.3	Very high	97.9	Very high	120 Å²	120	52 Å²	52	56%	0.556	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-64.6	-20.1	-177.2	76.7	-97.7	0	0	0	113.6	Q309	Q309-H311 VanDerWaalsContact C-N 3.31Å; Q309-H311 PolarHBondContact O-N 3.45Å; Q309-H311 PolarHBondContact OE1-CE1 2.64Å
312	C	97.5	Very high	97.8	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.014	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-120.6	19.1	177.7	62.1	0	0	0	0	113.5	Q309 E310 L357	Q309-C312 PolarHBondContact O-N 3.18Å; E310-C312 PolarHBondContact O-N 2.94Å; E310-C312 VanDerWaalsContact O-N 3.14Å; C312-L357 HydrophobicContact CB-CD2 4.35Å; C312-L357 HydrophobicContact CB-CG 3.91Å
313	R	98.3	Very high	97.7	Very high	56 Å²	56	55.4 Å²	55.4	21%	0.211	28%	0.284	C	S	.	.	S	Bend	trans	-71.8	-45.7	-177.5	179.1	175.3	-178.2	-176.9	-3.4	113.6	W303 Q309 E310 R333	W303-R313 HydrophobicContact CH2-CG 4.09Å; W303-R313 HydrophobicContact CZ2-CB 3.81Å; W303-R313 HydrophobicContact CZ2-CG 3.54Å; Q309-R313 PolarHBondContact O-N 2.86Å; E310-R313 WeakPolarHBondContact O-CB 3.49Å; E310-R313 PolarHBondContact O-N 3.22Å; E310-R313 WeakPolarHBondContact OE2-CD 3.26Å; E310-R313 IonicContact OE2-NH1 3.69Å; E310-R313 PolarHBondContact OE2-NH1 3.32Å; R313-R333 WeakPolarHBondContact O-CB 3.45Å; R313-R333 VanDerWaalsContact O-CD 3.3Å; R313-R333 WeakPolarHBondContact O-CD 3.47Å; R313-R333 WeakPolarHBondContact O-CG 3.4Å
314	Y	98.6	Very high	97.4	Very high	30 Å²	30	58 Å²	58	12%	0.118	30%	0.296	C	S	.	.			trans	-103.3	116.6	-172.2	-59.7	-76.4	0	0	0	110	E310 R331 L357	E310-Y314 WeakPolarHBondContact OE1-CE2 3.45Å; Y314-R331 HydrophobicContact CD1-CB 3.49Å; Y314-R331 VanDerWaalsContact CD1-CB 3.49Å; Y314-R331 HydrophobicContact CE1-CB 3.73Å; Y314-R331 VanDerWaalsContact CE2-NH1 3.27Å; Y314-R331 VanDerWaalsContact CE2-NH2 3.33Å; Y314-R331 HydrophobicContact CG-CB 3.88Å; Y314-L357 WeakPolarHBondContact O-CD1 3.48Å
315	T	98.8	Very high	96.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-99.2	-15.8	-176	66.3	0	0	0	0	111.6	C332 F334 D335 L357 H372 W373 I375	T315-C332 PolarHBondContact N-O 3.04Å; T315-F334 PolarHBondContact OG1-N 3.05Å; T315-D335 WeakPolarHBondContact CB-OD2 3.42Å; T315-D335 HydrophobicContact CG2-CB 3.89Å; T315-D335 WeakPolarHBondContact OG1-CB 3.26Å; T315-D335 PolarHBondContact OG1-N 3.11Å; T315-D335 PolarHBondContact OG1-OD2 2.94Å; T315-L357 HydrophobicContact CG2-CD2 4.03Å; T315-H372 CarbonylContact O-C 3.54Å; T315-H372 WeakPolarHBondContact O-CA 3.35Å; T315-W373 PolarHBondContact O-N 3.35Å; T315-I375 HydrophobicContact CG2-CD1 3.8Å; T315-I375 HydrophobicContact CG2-CG1 3.92Å
316	W	98.6	Very high	96.3	Very high	30 Å²	30	56.7 Å²	56.7	11%	0.114	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	115	169.2	-170.4	87.2	0	0	0	109.1	T318 R331 C332 F334 D371 H372	W316-T318 HydrophobicContact CD2-CG2 4.38Å; W316-T318 HydrophobicContact CE3-CG2 4.03Å; W316-T318 HydrophobicContact CH2-CG2 3.09Å; W316-T318 HydrophobicContact CZ2-CG2 3.46Å; W316-T318 VanDerWaalsContact CZ2-CG2 3.46Å; W316-T318 HydrophobicContact CZ3-CG2 3.42Å; W316-T318 VanDerWaalsContact CZ3-CG2 3.42Å; W316-R331 CarbonylContact O-C 3.47Å; W316-R331 WeakPolarHBondContact O-CA 3.21Å; W316-C332 PolarHBondContact N-O 3.25Å; W316-C332 VanDerWaalsContact N-O 3.08Å; W316-C332 PolarHBondContact O-N 2.75Å; W316-F334 HydrophobicContact CB-CD2 3.71Å; W316-F334 HydrophobicContact CB-CE2 4.22Å; W316-F334 HydrophobicContact CD2-CD2 4.41Å; W316-F334 HydrophobicContact CD2-CE2 4.08Å; W316-F334 AromaticContact CE3-CE2 3.97Å; W316-F334 HydrophobicContact CE3-CE2 3.97Å; W316-F334 HydrophobicContact CG-CD2 4.04Å; W316-F334 HydrophobicContact CG-CE2 4.2Å; W316-D371 PolarHBondContact NE1-OD2 2.88Å; W316-H372 AromaticContact CD1-CD2 3.49Å; W316-H372 VanDerWaalsContact CD1-CD2 3.49Å; W316-H372 AromaticContact CD1-CE1 3.88Å; W316-H372 AromaticContact CD1-CG 3.9Å; W316-H372 AromaticContact CD1-NE2 3.43Å
317	D	98	Very high	95.8	Very high	11 Å²	11	61.3 Å²	61.3	6%	0.059	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	103.4	-170.9	-173.6	-29	0	0	0	110.7	K319 A320 N321 R331	D317-K319 PolarHBondContact O-N 2.75Å; D317-K319 WeakPolarHBondContact OD1-CA 3.49Å; D317-K319 VanDerWaalsContact OD1-CB 3.24Å; D317-K319 WeakPolarHBondContact OD1-CB 3.37Å; D317-K319 PolarHBondContact OD1-N 2.9Å; D317-A320 HydrophobicContact CB-CB 4.29Å; D317-A320 PolarHBondContact O-N 3.37Å; D317-A320 PolarHBondContact OD1-N 3.42Å; D317-A320 VanDerWaalsContact OD1-N 3.13Å; D317-N321 WeakPolarHBondContact O-CA 3.02Å; D317-N321 VanDerWaalsContact O-CB 3.22Å; D317-N321 WeakPolarHBondContact O-CB 3.22Å; D317-N321 PolarHBondContact O-N 2.98Å; D317-R331 HydrophobicContact CB-CG 4.47Å; D317-R331 IonicContact OD1-NE 3.5Å; D317-R331 IonicContact OD2-CZ 3.09Å; D317-R331 IonicContact OD2-NE 3.59Å; D317-R331 PolarHBondContact OD2-NE 2.71Å; D317-R331 IonicContact OD2-NH2 3.42Å
318	T	97	Very high	95.3	Very high	23 Å²	23	64.6 Å²	64.6	14%	0.141	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-4.3	-177.6	66.9	0	0	0	0	114.2	W316 V326 Y328 V329 S330	W316-T318 HydrophobicContact CD2-CG2 4.38Å; W316-T318 HydrophobicContact CE3-CG2 4.03Å; W316-T318 HydrophobicContact CH2-CG2 3.09Å; W316-T318 HydrophobicContact CZ2-CG2 3.46Å; W316-T318 VanDerWaalsContact CZ2-CG2 3.46Å; W316-T318 HydrophobicContact CZ3-CG2 3.42Å; W316-T318 VanDerWaalsContact CZ3-CG2 3.42Å; T318-V326 HydrophobicContact CG2-CG2 3.6Å; T318-Y328 PolarHBondContact OG1-O 2.88Å; T318-V329 WeakPolarHBondContact OG1-CA 3.44Å; T318-S330 PolarHBondContact N-O 2.89Å; T318-S330 PolarHBondContact OG1-N 2.63Å; T318-S330 PolarHBondContact OG1-O 2.64Å
319	K	95.7	Very high	95.1	Very high	164 Å²	164	62.1 Å²	62.1	71%	0.713	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-39.9	170.7	-179.4	-178.4	177.4	-176.8	0	110.9	D317 V329	D317-K319 PolarHBondContact O-N 2.75Å; D317-K319 WeakPolarHBondContact OD1-CA 3.49Å; D317-K319 VanDerWaalsContact OD1-CB 3.24Å; D317-K319 WeakPolarHBondContact OD1-CB 3.37Å; D317-K319 PolarHBondContact OD1-N 2.9Å; K319-V329 HydrophobicContact CB-CG1 3.86Å; K319-V329 HydrophobicContact CB-CG2 4.3Å; K319-V329 HydrophobicContact CD-CG1 4.47Å
320	A	96.4	Very high	94.9	Very high	48 Å²	48	60.1 Å²	60.1	40%	0.397	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-34.2	-178.8	0	0	0	0	0	112.8	D317 Y368 W373	D317-A320 HydrophobicContact CB-CB 4.29Å; D317-A320 PolarHBondContact O-N 3.37Å; D317-A320 PolarHBondContact OD1-N 3.42Å; D317-A320 VanDerWaalsContact OD1-N 3.13Å; A320-Y368 PolarHBondContact O-OH 3.31Å; A320-W373 HydrophobicContact CB-CZ2 4.09Å
321	N	98.1	Very high	94.9	Very high	4 Å²	4	60.5 Å²	60.5	2%	0.021	32%	0.319	C	S	.	.			trans	-101.5	126.8	-179.6	-164.8	-51.7	0	0	0	110.8	D317 N323 Y368 S370 D371 W373	D317-N321 WeakPolarHBondContact O-CA 3.02Å; D317-N321 VanDerWaalsContact O-CB 3.22Å; D317-N321 WeakPolarHBondContact O-CB 3.22Å; D317-N321 PolarHBondContact O-N 2.98Å; N321-N323 WeakPolarHBondContact OD1-CB 3.23Å; N321-N323 PolarHBondContact OD1-N 3.16Å; N321-Y368 HydrophobicContact CB-CD2 4.4Å; N321-Y368 HydrophobicContact CB-CE2 4.49Å; N321-Y368 WeakPolarHBondContact OD1-CD2 3.44Å; N321-S370 PolarHBondContact ND2-O 2.87Å; N321-D371 WeakPolarHBondContact ND2-CA 3.45Å; N321-D371 PolarHBondContact ND2-O 2.92Å; N321-W373 HydrophobicContact CB-CH2 3.83Å; N321-W373 HydrophobicContact CB-CZ2 3.65Å; N321-W373 VanDerWaalsContact ND2-CH2 3.33Å; N321-W373 WeakPolarHBondContact ND2-CH2 3.15Å; N321-W373 VanDerWaalsContact ND2-CZ3 3.27Å; N321-W373 WeakPolarHBondContact ND2-CZ3 3.45Å
322	S	96.2	Very high	95	Very high	66 Å²	66	55.5 Å²	55.5	46%	0.462	30%	0.298	S	S	.	.			trans	-107.1	9.3	-175.6	62	0	0	0	0	113.9	K324	S322-K324 VanDerWaalsContact C-N 3.34Å
323	N	97.4	Very high	95	Very high	12 Å²	12	56.2 Å²	56.2	6%	0.064	30%	0.3	C	S	.	.	S	Bend	trans	-66.4	-36.8	-179.4	-82	21	0	0	0	112.1	N321 R367 Y368 S370 D371	N321-N323 WeakPolarHBondContact OD1-CB 3.23Å; N321-N323 PolarHBondContact OD1-N 3.16Å; N323-R367 PolarHBondContact O-NH2 3.2Å; N323-R367 WeakPolarHBondContact OD1-CB 3.36Å; N323-Y368 PolarHBondContact ND2-O 3.42Å; N323-Y368 PolarHBondContact OD1-N 3.26Å; N323-S370 PolarHBondContact ND2-O 2.84Å; N323-D371 HydrophobicContact CB-CB 3.9Å
324	K	92.8	Very high	95	Very high	70 Å²	70	54.1 Å²	54.1	30%	0.304	29%	0.293	S	S	.	.	S	Bend	trans	-98.4	121.7	170.8	-56.8	-56.9	-168.8	-157.3	0	110.1	D141 S322 V326 D371	D141-K324 IonicContact OD1-NZ 4Å; D141-K324 PolarHBondContact OD1-NZ 2.9Å; D141-K324 IonicContact OD2-NZ 2.77Å; D141-K324 PolarHBondContact OD2-NZ 3.12Å; S322-K324 VanDerWaalsContact C-N 3.34Å; K324-V326 HydrophobicContact CB-CG1 4.43Å; K324-V326 PolarHBondContact O-N 2.94Å; K324-V326 VanDerWaalsContact O-N 3.16Å; K324-D371 HydrophobicContact CD-CB 4.34Å; K324-D371 WeakPolarHBondContact CE-OD2 3.32Å; K324-D371 HydrophobicContact CG-CB 3.7Å; K324-D371 WeakPolarHBondContact CG-OD2 3.37Å
325	S	86.6	Confident	95.1	Very high	129 Å²	129	52.7 Å²	52.7	90%	0.902	29%	0.287	S	S	*	.			trans	-83.5	87.8	173.4	177.6	0	0	0	0	110.4
326	V	85.3	Confident	95.1	Very high	47 Å²	47	53 Å²	53	29%	0.285	29%	0.288	S	S	.	.			trans	-108.6	146.6	175.4	-65.8	0	0	0	0	111.9	T318 K324 Y328	T318-V326 HydrophobicContact CG2-CG2 3.6Å; K324-V326 HydrophobicContact CB-CG1 4.43Å; K324-V326 PolarHBondContact O-N 2.94Å; K324-V326 VanDerWaalsContact O-N 3.16Å; V326-Y328 HydrophobicContact CB-CD1 4.2Å; V326-Y328 HydrophobicContact CB-CE1 3.89Å; V326-Y328 HydrophobicContact CB-CE2 4.3Å; V326-Y328 HydrophobicContact CG1-CE1 4.22Å; V326-Y328 HydrophobicContact CG2-CD2 4.3Å; V326-Y328 HydrophobicContact CG2-CE2 4.15Å; V326-Y328 VanDerWaalsContact CG2-O 3.32Å; V326-Y328 WeakPolarHBondContact CG2-O 3.46Å; V326-Y328 PolarHBondContact O-N 2.74Å
327	P	88.7	Confident	95.1	Very high	127 Å²	127	51.6 Å²	51.6	83%	0.825	28%	0.283	S	S	*	.	S	Bend	trans	-80.4	10	-178.5	33.9	-36.4	0	0	0	113.7
328	Y	88.4	Confident	95.1	Very high	128 Å²	128	51.1 Å²	51.1	50%	0.502	28%	0.281	S	S	.	.	S	Bend	trans	-136	153.9	-175.3	57.4	-98	0	0	0	111.6	T318 V326	T318-Y328 PolarHBondContact OG1-O 2.88Å; V326-Y328 HydrophobicContact CB-CD1 4.2Å; V326-Y328 HydrophobicContact CB-CE1 3.89Å; V326-Y328 HydrophobicContact CB-CE2 4.3Å; V326-Y328 HydrophobicContact CG1-CE1 4.22Å; V326-Y328 HydrophobicContact CG2-CD2 4.3Å; V326-Y328 HydrophobicContact CG2-CE2 4.15Å; V326-Y328 VanDerWaalsContact CG2-O 3.32Å; V326-Y328 WeakPolarHBondContact CG2-O 3.46Å; V326-Y328 PolarHBondContact O-N 2.74Å
329	V	93.6	Very high	95.2	Very high	68 Å²	68	50.1 Å²	50.1	41%	0.412	27%	0.274	S	S	.	.			trans	-89.7	125.2	169.3	174.2	0	0	0	0	108.8	T318 K319 R331	T318-V329 WeakPolarHBondContact OG1-CA 3.44Å; K319-V329 HydrophobicContact CB-CG1 3.86Å; K319-V329 HydrophobicContact CB-CG2 4.3Å; K319-V329 HydrophobicContact CD-CG1 4.47Å; V329-R331 HydrophobicContact CG1-CG 4.31Å
330	S	94.1	Very high	95.3	Very high	29 Å²	29	43.5 Å²	43.5	20%	0.203	25%	0.245	C	C	.	.			trans	-140.8	133.9	172.8	177	0	0	0	0	109.2	T318	T318-S330 PolarHBondContact N-O 2.89Å; T318-S330 PolarHBondContact OG1-N 2.63Å; T318-S330 PolarHBondContact OG1-O 2.64Å
331	R	96.6	Very high	95.3	Very high	106 Å²	106	43 Å²	43	40%	0.4	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.1	-177.3	-51.4	176.1	68.7	-148.2	2.6	107.6	Y314 W316 D317 V329	Y314-R331 HydrophobicContact CD1-CB 3.49Å; Y314-R331 VanDerWaalsContact CD1-CB 3.49Å; Y314-R331 HydrophobicContact CE1-CB 3.73Å; Y314-R331 VanDerWaalsContact CE2-NH1 3.27Å; Y314-R331 VanDerWaalsContact CE2-NH2 3.33Å; Y314-R331 HydrophobicContact CG-CB 3.88Å; W316-R331 CarbonylContact O-C 3.47Å; W316-R331 WeakPolarHBondContact O-CA 3.21Å; D317-R331 HydrophobicContact CB-CG 4.47Å; D317-R331 IonicContact OD1-NE 3.5Å; D317-R331 IonicContact OD2-CZ 3.09Å; D317-R331 IonicContact OD2-NE 3.59Å; D317-R331 PolarHBondContact OD2-NE 2.71Å; D317-R331 IonicContact OD2-NH2 3.42Å; V329-R331 HydrophobicContact CG1-CG 4.31Å
332	C	97.7	Very high	95.2	Very high	16 Å²	16	43 Å²	43	11%	0.108	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	147.3	-173.3	-69	0	0	0	0	111.1	T315 W316 F334	T315-C332 PolarHBondContact N-O 3.04Å; W316-C332 PolarHBondContact N-O 3.25Å; W316-C332 VanDerWaalsContact N-O 3.08Å; W316-C332 PolarHBondContact O-N 2.75Å; C332-F334 HydrophobicContact CB-CD1 3.64Å; C332-F334 HydrophobicContact CB-CD2 3.78Å; C332-F334 HydrophobicContact CB-CE1 3.42Å; C332-F334 VanDerWaalsContact CB-CE1 3.42Å; C332-F334 HydrophobicContact CB-CE2 3.55Å; C332-F334 HydrophobicContact CB-CG 3.81Å; C332-F334 HydrophobicContact CB-CZ 3.37Å; C332-F334 WeakPolarHBondContact SG-CZ 3.2Å
333	R	98.5	Very high	95.1	Very high	16 Å²	16	48.1 Å²	48.1	6%	0.06	25%	0.252	C	S	.	.			trans	-99.2	69.1	169.9	-169.3	173.2	71.7	90.1	-7.6	108.8	D286 D301 E304 R313 R336	D286-R333 IonicContact OD1-NH2 3.56Å; D301-R333 IonicContact OD1-NH1 3.78Å; D301-R333 IonicContact OD2-CZ 3.73Å; D301-R333 IonicContact OD2-NH1 3.48Å; D301-R333 PolarHBondContact OD2-NH1 3.21Å; D301-R333 IonicContact OD2-NH2 3.18Å; D301-R333 PolarHBondContact OD2-NH2 3.17Å; D301-R333 VanDerWaalsContact OD2-NH2 3.09Å; E304-R333 IonicContact OE1-NH2 3.31Å; R313-R333 WeakPolarHBondContact O-CB 3.45Å; R313-R333 VanDerWaalsContact O-CD 3.3Å; R313-R333 WeakPolarHBondContact O-CD 3.47Å; R313-R333 WeakPolarHBondContact O-CG 3.4Å; R333-R336 VanDerWaalsContact NH2-NH1 3.2Å; R333-R336 PolarHBondContact O-NE 3.14Å; R333-R336 PolarHBondContact O-NH2 2.97Å
334	F	98.8	Very high	94.7	Very high	13 Å²	13	52.7 Å²	52.7	6%	0.057	27%	0.273	C	S	.	.			trans	-77.5	-41.9	-177.9	-70.8	-31.2	0	0	0	111.2	D281 T282 N283 T315 W316 C332	D281-F334 WeakPolarHBondContact OD1-CB 3.35Å; T282-F334 WeakPolarHBondContact CA-O 3.49Å; T282-F334 WeakPolarHBondContact CB-O 3.33Å; T282-F334 PolarHBondContact N-O 3.41Å; T282-F334 PolarHBondContact OG1-O 3.31Å; N283-F334 VanDerWaalsContact C-CD1 3.48Å; T315-F334 PolarHBondContact OG1-N 3.05Å; W316-F334 HydrophobicContact CB-CD2 3.71Å; W316-F334 HydrophobicContact CB-CE2 4.22Å; W316-F334 HydrophobicContact CD2-CD2 4.41Å; W316-F334 HydrophobicContact CD2-CE2 4.08Å; W316-F334 AromaticContact CE3-CE2 3.97Å; W316-F334 HydrophobicContact CE3-CE2 3.97Å; W316-F334 HydrophobicContact CG-CD2 4.04Å; W316-F334 HydrophobicContact CG-CE2 4.2Å; C332-F334 HydrophobicContact CB-CD1 3.64Å; C332-F334 HydrophobicContact CB-CD2 3.78Å; C332-F334 HydrophobicContact CB-CE1 3.42Å; C332-F334 VanDerWaalsContact CB-CE1 3.42Å; C332-F334 HydrophobicContact CB-CE2 3.55Å; C332-F334 HydrophobicContact CB-CG 3.81Å; C332-F334 HydrophobicContact CB-CZ 3.37Å; C332-F334 WeakPolarHBondContact SG-CZ 3.2Å
335	D	98.9	Very high	94.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	125.5	178.2	-49.5	-96.7	0	0	0	108.8	G280 T315 H372 I375	G280-D335 WeakPolarHBondContact O-CA 3.37Å; T315-D335 WeakPolarHBondContact CB-OD2 3.42Å; T315-D335 HydrophobicContact CG2-CB 3.89Å; T315-D335 WeakPolarHBondContact OG1-CB 3.26Å; T315-D335 PolarHBondContact OG1-N 3.11Å; T315-D335 PolarHBondContact OG1-OD2 2.94Å; D335-H372 IonicContact OD1-ND1 3.53Å; D335-H372 IonicContact OD2-CE1 3.45Å; D335-H372 IonicContact OD2-CG 2.63Å; D335-H372 IonicContact OD2-ND1 3.28Å; D335-H372 PolarHBondContact OD2-ND1 2.88Å; D335-I375 HydrophobicContact CB-CD1 3.5Å; D335-I375 VanDerWaalsContact CB-CD1 3.5Å; D335-I375 HydrophobicContact CB-CG1 4.27Å; D335-I375 WeakPolarHBondContact O-CD1 3.45Å
336	R	98.9	Very high	94.3	Very high	5 Å²	5	49.4 Å²	49.4	2%	0.019	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	152.9	-177	-54.5	-174.2	-175.7	-152.4	-1.9	110.3	G279 G280 T282 L284 D286 R333 Y338	G279-R336 VanDerWaalsContact CA-O 3.22Å; G279-R336 WeakPolarHBondContact CA-O 3.4Å; G280-R336 PolarHBondContact N-O 3.11Å; G280-R336 VanDerWaalsContact N-O 3.15Å; G280-R336 PolarHBondContact O-N 2.95Å; G280-R336 VanDerWaalsContact O-N 3.09Å; T282-R336 HydrophobicContact CG2-CB 3.91Å; T282-R336 HydrophobicContact CG2-CG 4.18Å; L284-R336 PolarHBondContact O-NH2 2.86Å; D286-R336 IonicContact OD1-CZ 3.12Å; D286-R336 IonicContact OD1-NH1 2.74Å; D286-R336 PolarHBondContact OD1-NH1 2.84Å; D286-R336 IonicContact OD1-NH2 2.63Å; D286-R336 PolarHBondContact OD1-NH2 3.33Å; R333-R336 VanDerWaalsContact NH2-NH1 3.2Å; R333-R336 PolarHBondContact O-NE 3.14Å; R333-R336 PolarHBondContact O-NH2 2.97Å; R336-Y338 HydrophobicContact CB-CE1 3.93Å; R336-Y338 VanDerWaalsContact CD-OH 3.28Å; R336-Y338 WeakPolarHBondContact CD-OH 3.45Å
337	V	98.9	Very high	94.4	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.4	174.7	-175.8	0	0	0	0	108.9	L135 F278 V302 I375 F379	L135-V337 HydrophobicContact CD2-CG1 3.77Å; L135-V337 HydrophobicContact CD2-CG2 4.14Å; F278-V337 CarbonylContact O-C 3.47Å; F278-V337 VanDerWaalsContact O-CA 3.31Å; F278-V337 WeakPolarHBondContact O-CA 3.48Å; V302-V337 HydrophobicContact CB-CB 4.15Å; V302-V337 HydrophobicContact CB-CG1 4.4Å; V302-V337 HydrophobicContact CG2-CB 4.02Å; V302-V337 HydrophobicContact CG2-CG1 3.75Å; V302-V337 WeakPolarHBondContact CG2-O 3.32Å; V302-V337 PolarHBondContact N-O 2.85Å; V337-I375 HydrophobicContact CG2-CG2 4.35Å; V337-F379 HydrophobicContact CG1-CZ 4.19Å
338	Y	98.9	Very high	94.5	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.1	177.7	-55.2	-29.4	0	0	0	110.5	L260 L264 M267 F278 L284 L295 C300 D301 R336	L260-Y338 HydrophobicContact CD1-CE2 4.09Å; L264-Y338 HydrophobicContact CD2-CD2 4.46Å; M267-Y338 HydrophobicContact SD-CD2 4.41Å; F278-Y338 AromaticContact CD1-CD2 3.54Å; F278-Y338 HydrophobicContact CD1-CD2 3.54Å; F278-Y338 HydrophobicContact CD1-CE2 4.11Å; F278-Y338 HydrophobicContact CD1-CG 4.14Å; F278-Y338 HydrophobicContact CE1-CD2 4.07Å; F278-Y338 HydrophobicContact CE1-CE2 4.16Å; F278-Y338 PolarHBondContact N-O 3.42Å; F278-Y338 PolarHBondContact O-N 3.33Å; L284-Y338 WeakPolarHBondContact CD1-OH 3.45Å; L295-Y338 HydrophobicContact CD1-CD1 4.43Å; L295-Y338 HydrophobicContact CD2-CD2 4.29Å; L295-Y338 HydrophobicContact CD2-CE1 4.36Å; L295-Y338 HydrophobicContact CD2-CE2 4.09Å; C300-Y338 CarbonylContact O-C 3.56Å; C300-Y338 VanDerWaalsContact O-CA 3.26Å; C300-Y338 WeakPolarHBondContact O-CA 3.42Å; D301-Y338 HydrophobicContact CB-CD1 4.03Å; D301-Y338 HydrophobicContact CB-CE1 4.02Å; R336-Y338 HydrophobicContact CB-CE1 3.93Å; R336-Y338 VanDerWaalsContact CD-OH 3.28Å; R336-Y338 WeakPolarHBondContact CD-OH 3.45Å
339	L	98.6	Very high	94.6	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	131.7	178.8	170.4	68	0	0	0	110.1	T275 L277 V299 C300 V302 P341 M350 P352 F379	T275-L339 HydrophobicContact CG2-CD1 3.72Å; L277-L339 HydrophobicContact CD2-CB 4.04Å; L277-L339 HydrophobicContact CD2-CD1 3.63Å; L277-L339 HydrophobicContact CD2-CG 4.4Å; L277-L339 HydrophobicContact CG-CD1 4.08Å; V299-L339 CarbonylContact C-O 3.57Å; V299-L339 WeakPolarHBondContact CA-O 3.32Å; C300-L339 PolarHBondContact N-O 3.05Å; C300-L339 PolarHBondContact O-N 2.73Å; V302-L339 HydrophobicContact CG2-CB 4.25Å; L339-P341 HydrophobicContact CD2-CG 4.25Å; L339-P341 HydrophobicContact CG-CG 4.16Å; L339-M350 HydrophobicContact CD1-CG 4.22Å; L339-M350 HydrophobicContact CD1-SD 4.02Å; L339-M350 HydrophobicContact CD2-CG 4.36Å; L339-P352 HydrophobicContact CD2-CG 3.95Å; L339-F379 HydrophobicContact CB-CE1 4.48Å; L339-F379 HydrophobicContact CD2-CD1 4.07Å; L339-F379 HydrophobicContact CD2-CE1 4.2Å
340	R	98.2	Very high	94.6	Very high	25 Å²	25	43.2 Å²	43.2	9%	0.094	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	101.6	163.3	-168	-160.8	73.8	164	8.8	109.1	M267 R268 A270 P271 V274 T275 V276 G298 V299	M267-R340 HydrophobicContact CE-CB 4.11Å; M267-R340 WeakPolarHBondContact O-CD 3.44Å; M267-R340 VanDerWaalsContact O-CZ 3.22Å; M267-R340 PolarHBondContact O-NE 3.03Å; M267-R340 PolarHBondContact O-NH1 3.12Å; R268-R340 PolarHBondContact O-NH1 3.21Å; A270-R340 PolarHBondContact O-NH1 3.12Å; A270-R340 PolarHBondContact O-NH2 2.78Å; P271-R340 PolarHBondContact O-NH2 3.45Å; V274-R340 PolarHBondContact O-NH2 3.25Å; T275-R340 CarbonylContact C-O 3.53Å; T275-R340 WeakPolarHBondContact CA-O 3.25Å; V276-R340 HydrophobicContact CB-CB 4.04Å; V276-R340 HydrophobicContact CG2-CB 4.46Å; V276-R340 VanDerWaalsContact CG2-CZ 3.48Å; V276-R340 PolarHBondContact N-O 3.4Å; V276-R340 PolarHBondContact O-N 3.43Å; G298-R340 WeakPolarHBondContact O-CA 3.38Å; V299-R340 HydrophobicContact CG2-CB 3.95Å; V299-R340 HydrophobicContact CG2-CG 3.95Å
341	P	96.7	Very high	94.7	Very high	38 Å²	38	45.3 Å²	45.3	25%	0.247	23%	0.23	C	C	.	.			trans	-59.3	153.4	174	-20.7	34.2	0	0	0	111	G298 L339 M350	G298-P341 WeakPolarHBondContact O-CD 3.46Å; L339-P341 HydrophobicContact CD2-CG 4.25Å; L339-P341 HydrophobicContact CG-CG 4.16Å; P341-M350 WeakPolarHBondContact CG-O 3.28Å
342	A	95.5	Very high	94.7	Very high	5 Å²	5	41 Å²	41	4%	0.041	22%	0.216	C	C	.	.			trans	-60.2	157.4	166.9	0	0	0	0	0	110.1	T272 T275 E344 G347 S348	T272-A342 CarbonylContact O-C 3.58Å; T272-A342 WeakPolarHBondContact O-CA 3.09Å; T275-A342 PolarHBondContact OG1-N 3.13Å; A342-E344 WeakPolarHBondContact CB-O 3.32Å; A342-G347 PolarHBondContact N-O 3.35Å; A342-S348 WeakPolarHBondContact O-CA 3.48Å; A342-S348 VanDerWaalsContact O-CB 3.27Å; A342-S348 WeakPolarHBondContact O-CB 3.44Å
343	K	93.1	Very high	94.7	Very high	172 Å²	172	43.1 Å²	43.1	75%	0.748	23%	0.226	S	C	*	.	S	Bend	trans	-81.2	-21	174.5	-65.5	-170.2	-179.9	178.9	0	112.8	T272	T272-K343 HydrophobicContact CG2-CD 3.86Å; T272-K343 PolarHBondContact O-N 3.01Å
344	E	88.9	Confident	94.6	Very high	108 Å²	108	46.2 Å²	46.2	51%	0.505	24%	0.241	S	C	.	.	S	Bend	trans	-145.2	165.4	-174.7	63.1	-164.8	149.7	0	0	111	T272 N273 A342	T272-E344 PolarHBondContact OG1-OE1 3.33Å; N273-E344 HydrophobicContact CB-CG 4.23Å; A342-E344 WeakPolarHBondContact CB-O 3.32Å
345	G	86.6	Confident	94.6	Very high	45 Å²	45	45.9 Å²	45.9	46%	0.464	24%	0.24	S	C	.	.	S	Bend	trans	73.6	-175.2	-177.3	0	0	0	0	0	114	G347 S348	G345-G347 PolarHBondContact O-N 2.89Å; G345-S348 WeakPolarHBondContact O-CB 3.4Å; G345-S348 PolarHBondContact O-N 3.37Å; G345-S348 PolarHBondContact O-OG 2.97Å
346	P	84.8	Confident	94.6	Very high	85 Å²	85	46.7 Å²	46.7	55%	0.552	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-54.4	-38.9	-180	-26.6	35.3	0	0	0	112.9	S348 R349	P346-S348 PolarHBondContact O-N 3.22Å; P346-R349 PolarHBondContact O-N 2.65Å
347	G	87.3	Confident	94.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-59.7	-17.8	178.1	0	0	0	0	0	115.5	Q237 T275 A342 G345 R349 M350	Q237-G347 VanDerWaalsContact OE1-N 3.09Å; T275-G347 WeakPolarHBondContact OG1-CA 3.4Å; T275-G347 PolarHBondContact OG1-O 3.28Å; A342-G347 PolarHBondContact N-O 3.35Å; G345-G347 PolarHBondContact O-N 2.89Å; G347-R349 PolarHBondContact O-N 3.04Å; G347-M350 WeakPolarHBondContact O-CB 3.43Å; G347-M350 PolarHBondContact O-N 3.12Å
348	S	91.5	Very high	94.5	Very high	50 Å²	50	47.4 Å²	47.4	35%	0.35	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-70.1	-17.7	177.8	66.4	0	0	0	0	114.8	A342 G345 P346	A342-S348 WeakPolarHBondContact O-CA 3.48Å; A342-S348 VanDerWaalsContact O-CB 3.27Å; A342-S348 WeakPolarHBondContact O-CB 3.44Å; G345-S348 WeakPolarHBondContact O-CB 3.4Å; G345-S348 PolarHBondContact O-N 3.37Å; G345-S348 PolarHBondContact O-OG 2.97Å; P346-S348 PolarHBondContact O-N 3.22Å
349	R	89.6	Confident	94.5	Very high	190 Å²	190	47.4 Å²	47.4	72%	0.717	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-98	-0.7	177.6	-66.7	175.7	-172.6	177.3	1.5	112.3	P346 G347 T351 L381	P346-R349 PolarHBondContact O-N 2.65Å; G347-R349 PolarHBondContact O-N 3.04Å; R349-T351 PolarHBondContact O-N 3.05Å; R349-T351 VanDerWaalsContact O-N 3.11Å; R349-L381 WeakPolarHBondContact CB-OXT 3.25Å
350	M	94.2	Very high	94.5	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	27%	0.27	C	S	.	.			trans	-60.4	118.9	178.6	-175.8	168.1	-89.4	0	0	110.1	L133 L239 T275 L339 P341 G347 F379 I380 L381	L133-M350 HydrophobicContact CB-CE 4.01Å; L133-M350 HydrophobicContact CD2-CE 3.82Å; L133-M350 HydrophobicContact CD2-SD 4.43Å; L239-M350 HydrophobicContact CD2-CE 4.35Å; L239-M350 HydrophobicContact CD2-SD 4.33Å; T275-M350 HydrophobicContact CG2-CB 4.38Å; T275-M350 HydrophobicContact CG2-CG 4.44Å; T275-M350 HydrophobicContact CG2-SD 3.53Å; T275-M350 VanDerWaalsContact CG2-SD 3.53Å; L339-M350 HydrophobicContact CD1-CG 4.22Å; L339-M350 HydrophobicContact CD1-SD 4.02Å; L339-M350 HydrophobicContact CD2-CG 4.36Å; P341-M350 WeakPolarHBondContact CG-O 3.28Å; G347-M350 WeakPolarHBondContact O-CB 3.43Å; G347-M350 PolarHBondContact O-N 3.12Å; M350-F379 HydrophobicContact CE-CB 4.21Å; M350-F379 HydrophobicContact CG-CB 4Å; M350-F379 HydrophobicContact SD-CB 4.19Å; M350-I380 CarbonylContact C-O 3.6Å; M350-I380 VanDerWaalsContact CA-O 3.23Å; M350-I380 WeakPolarHBondContact CA-O 3.4Å; M350-L381 HydrophobicContact CB-CD2 4.37Å; M350-L381 HydrophobicContact CE-CD2 3.55Å; M350-L381 HydrophobicContact CE-CG 3.76Å
351	T	95.6	Very high	94.5	Very high	72 Å²	72	55.3 Å²	55.3	44%	0.442	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	148.7	178.6	52	0	0	0	0	110.6	R349 D353 F379 I380	R349-T351 PolarHBondContact O-N 3.05Å; R349-T351 VanDerWaalsContact O-N 3.11Å; T351-D353 PolarHBondContact O-N 2.92Å; T351-F379 CarbonylContact O-C 3.51Å; T351-F379 VanDerWaalsContact O-CA 3.27Å; T351-F379 WeakPolarHBondContact O-CA 3.19Å; T351-I380 PolarHBondContact N-O 3.36Å; T351-I380 PolarHBondContact O-N 3.4Å
352	P	97.6	Very high	94.5	Very high	16 Å²	16	58.8 Å²	58.8	10%	0.104	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	135.1	172.3	-16.6	31.9	0	0	0	110.5	V302 Q305 L306 L339 F379	V302-P352 HydrophobicContact CB-CG 4.48Å; V302-P352 HydrophobicContact CG1-CB 3.87Å; V302-P352 HydrophobicContact CG1-CG 4.27Å; V302-P352 HydrophobicContact CG2-CG 4.09Å; Q305-P352 HydrophobicContact CB-CG 4.37Å; Q305-P352 HydrophobicContact CG-CG 4.1Å; L306-P352 HydrophobicContact CD1-CB 4.08Å; L306-P352 HydrophobicContact CD2-CB 4Å; L306-P352 HydrophobicContact CG-CB 3.92Å; L339-P352 HydrophobicContact CD2-CG 3.95Å; P352-F379 HydrophobicContact CB-CD1 4.25Å; P352-F379 HydrophobicContact CB-CE1 4.25Å; P352-F379 HydrophobicContact CG-CD1 4.33Å; P352-F379 HydrophobicContact CG-CE1 4.24Å
353	D	97	Very high	94.7	Very high	61 Å²	61	60.2 Å²	60.2	33%	0.326	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-47.6	179.8	177.6	50.3	0	0	0	111.4	K132 T351 S378 I380	K132-D353 WeakPolarHBondContact CE-OD2 3.32Å; K132-D353 IonicContact NZ-OD2 3.86Å; K132-D353 PolarHBondContact NZ-OD2 2.99Å; T351-D353 PolarHBondContact O-N 2.92Å; D353-S378 PolarHBondContact N-O 3.23Å; D353-S378 PolarHBondContact OD2-OG 2.93Å; D353-I380 HydrophobicContact CB-CD1 3.69Å; D353-I380 HydrophobicContact CB-CG1 3.78Å; D353-I380 WeakPolarHBondContact OD1-CD1 3.24Å
354	H	97.1	Very high	94.8	Very high	81 Å²	81	59.9 Å²	59.9	38%	0.375	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	149.1	-176.6	-174	72.9	0	0	0	111.8	C377 S378	H354-C377 CarbonylContact O-C 3.57Å; H354-C377 VanDerWaalsContact O-CA 3.26Å; H354-C377 WeakPolarHBondContact O-CA 3.26Å; H354-S378 WeakPolarHBondContact CB-OG 3.2Å; H354-S378 PolarHBondContact N-O 3.15Å; H354-S378 PolarHBondContact O-N 2.93Å
355	M	98.3	Very high	95.1	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.025	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	131.1	171.8	179.8	-178.5	176.8	0	0	110	V302 W303 L306 I375 Y376	V302-M355 HydrophobicContact CG1-CB 4.49Å; V302-M355 HydrophobicContact CG1-SD 4.21Å; W303-M355 HydrophobicContact CB-CE 4.04Å; W303-M355 HydrophobicContact CB-SD 3.64Å; W303-M355 HydrophobicContact CG-SD 4.34Å; L306-M355 HydrophobicContact CD1-CB 3.49Å; L306-M355 VanDerWaalsContact CD1-CB 3.49Å; M355-I375 HydrophobicContact CE-CB 4.42Å; M355-I375 HydrophobicContact CE-CD1 3.86Å; M355-I375 HydrophobicContact CE-CG1 4.04Å; M355-I375 HydrophobicContact CE-CG2 3.49Å; M355-I375 VanDerWaalsContact CE-CG2 3.49Å; M355-I375 HydrophobicContact CG-CG2 3.91Å; M355-I375 HydrophobicContact SD-CG2 4.35Å; M355-Y376 CarbonylContact C-O 3.48Å; M355-Y376 VanDerWaalsContact CA-O 3.25Å; M355-Y376 WeakPolarHBondContact CA-O 3.37Å
356	A	98.4	Very high	95.7	Very high	17 Å²	17	56.1 Å²	56.1	14%	0.14	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	161.5	176.5	0	0	0	0	0	111.2	Y376	A356-Y376 PolarHBondContact N-O 3.34Å; A356-Y376 PolarHBondContact O-N 2.84Å
357	L	98.8	Very high	96.3	Very high	21 Å²	21	54.2 Å²	54.2	11%	0.11	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	147.8	169.4	-62.1	177.2	0	0	0	110.5	C312 Y314 T315 L360 W373 G374 I375	C312-L357 HydrophobicContact CB-CD2 4.35Å; C312-L357 HydrophobicContact CB-CG 3.91Å; Y314-L357 WeakPolarHBondContact O-CD1 3.48Å; T315-L357 HydrophobicContact CG2-CD2 4.03Å; L357-L360 HydrophobicContact CB-CD1 4.2Å; L357-L360 HydrophobicContact CB-CD2 4.32Å; L357-L360 HydrophobicContact CB-CG 4.35Å; L357-L360 HydrophobicContact CD1-CD2 4.45Å; L357-W373 HydrophobicContact CB-CB 4.28Å; L357-W373 HydrophobicContact CD1-CB 4.25Å; L357-W373 HydrophobicContact CD1-CG 4.3Å; L357-W373 HydrophobicContact CD2-CB 4.04Å; L357-W373 HydrophobicContact CG-CB 4.41Å; L357-G374 CarbonylContact C-O 3.51Å; L357-G374 VanDerWaalsContact CA-O 3.25Å; L357-G374 WeakPolarHBondContact CA-O 3.32Å; L357-I375 HydrophobicContact CD2-CG1 4.26Å
358	V	98.6	Very high	96.8	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	158.3	173.4	-61.7	0	0	0	0	110.5	W138 Y158 Y162 G374	W138-V358 HydrophobicContact CE3-CG2 4.04Å; W138-V358 HydrophobicContact CH2-CG2 4.23Å; W138-V358 HydrophobicContact CZ3-CG2 3.81Å; Y158-V358 HydrophobicContact CD1-CB 3.86Å; Y158-V358 HydrophobicContact CD1-CG1 4.41Å; Y158-V358 HydrophobicContact CE1-CB 4.04Å; Y162-V358 HydrophobicContact CD2-CG1 4.42Å; Y162-V358 HydrophobicContact CE1-CG1 4.24Å; Y162-V358 HydrophobicContact CE2-CG1 3.78Å; V358-G374 PolarHBondContact N-O 2.86Å; V358-G374 PolarHBondContact O-N 3.4Å
359	G	98.3	Very high	97.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.269	C	S	.	.			trans	81.9	23.6	-179.5	0	0	0	0	0	114.6	W138 Y158 E361 W373	W138-G359 VanDerWaalsContact CH2-CA 3.45Å; Y158-G359 VanDerWaalsContact CZ-CA 3.44Å; Y158-G359 VanDerWaalsContact CZ-N 3.33Å; Y158-G359 WeakPolarHBondContact OH-CA 3.32Å; Y158-G359 PolarHBondContact OH-N 2.77Å; G359-E361 PolarHBondContact O-N 3.26Å; G359-W373 WeakPolarHBondContact O-CZ3 3.32Å
360	L	98.2	Very high	97.6	Very high	81 Å²	81	44.3 Å²	44.3	42%	0.424	24%	0.235	S	C	.	.			trans	-77.5	-7.6	-177.9	-65.6	171.2	0	0	0	112.7	L357 Y368 W373	L357-L360 HydrophobicContact CB-CD1 4.2Å; L357-L360 HydrophobicContact CB-CD2 4.32Å; L357-L360 HydrophobicContact CB-CG 4.35Å; L357-L360 HydrophobicContact CD1-CD2 4.45Å; L360-Y368 VanDerWaalsContact O-CE1 3.24Å; L360-Y368 WeakPolarHBondContact O-CE1 3.41Å; L360-W373 HydrophobicContact CD2-CD2 3.52Å; L360-W373 HydrophobicContact CD2-CE3 3.92Å; L360-W373 HydrophobicContact CD2-CG 3.81Å; L360-W373 HydrophobicContact CD2-CH2 4.37Å; L360-W373 HydrophobicContact CD2-CZ2 4.01Å; L360-W373 HydrophobicContact CD2-CZ3 4.34Å
361	E	97.7	Very high	97.8	Very high	112 Å²	112	44.8 Å²	44.8	52%	0.523	24%	0.238	S	C	.	.	S	Bend	trans	-96.4	139.3	-175.9	-65.4	79.8	174.1	0	0	110.9	Y158 G359 Y368	Y158-E361 PolarHBondContact OH-OE2 2.79Å; G359-E361 PolarHBondContact O-N 3.26Å; E361-Y368 WeakPolarHBondContact O-CD1 3.5Å
362	K	98.1	Very high	97.9	Very high	111 Å²	111	41.8 Å²	41.8	48%	0.483	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-73.2	141.4	170.8	-70.8	-174	168.4	-155.6	0	110.2	G366 R367 Y368	K362-G366 WeakPolarHBondContact CD-O 3.27Å; K362-G366 WeakPolarHBondContact CE-O 3.32Å; K362-G366 PolarHBondContact NZ-O 3.47Å; K362-R367 CarbonylContact C-O 3.54Å; K362-R367 WeakPolarHBondContact CA-O 3.31Å; K362-Y368 HydrophobicContact CB-CE1 4.5Å; K362-Y368 HydrophobicContact CG-CD1 3.93Å; K362-Y368 HydrophobicContact CG-CE1 3.48Å; K362-Y368 VanDerWaalsContact CG-CE1 3.48Å; K362-Y368 HydrophobicContact CG-CE2 4.21Å; K362-Y368 HydrophobicContact CG-CG 4.46Å
363	L	97.9	Very high	98	Very high	35 Å²	35	41.4 Å²	41.4	18%	0.183	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-78.7	173	167.5	-49.9	175.7	0	0	0	109.7	E150 R151 C365 G366 R367	E150-L363 HydrophobicContact CG-CB 4.49Å; E150-L363 HydrophobicContact CG-CD1 4.49Å; E150-L363 VanDerWaalsContact OE1-CB 3.24Å; E150-L363 WeakPolarHBondContact OE1-CB 3.47Å; R151-L363 HydrophobicContact CB-CD1 4.33Å; R151-L363 HydrophobicContact CG-CD1 3.86Å; L363-C365 PolarHBondContact O-N 3.1Å; L363-G366 WeakPolarHBondContact O-CA 3.43Å; L363-G366 PolarHBondContact O-N 3.43Å; L363-R367 PolarHBondContact N-O 3.38Å
364	D	96.3	Very high	98.1	Very high	165 Å²	165	38.5 Å²	38.5	88%	0.882	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.5	-176.8	-65.8	-28.1	0	0	0	112.4	E150 G366	E150-D364 PolarHBondContact OE1-N 3.11Å; D364-G366 PolarHBondContact O-N 3.35Å; D364-G366 VanDerWaalsContact O-N 3.08Å
365	C	96.1	Very high	98.2	Very high	40 Å²	40	34.7 Å²	34.7	27%	0.27	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-1.4	171.5	62	0	0	0	0	114.4	N147 E150 L363 R367	N147-C365 HydrophobicContact CB-CB 4.15Å; E150-C365 VanDerWaalsContact CD-SG 3.55Å; E150-C365 WeakPolarHBondContact OE1-CB 3.37Å; E150-C365 PolarHBondContact OE1-N 2.87Å; E150-C365 PolarHBondContact OE1-SG 2.69Å; E150-C365 VanDerWaalsContact OE2-CB 3.26Å; E150-C365 WeakPolarHBondContact OE2-CB 3.33Å; L363-C365 PolarHBondContact O-N 3.1Å; C365-R367 PolarHBondContact O-N 3.28Å
366	G	97.4	Very high	98.2	Very high	33 Å²	33	36.3 Å²	36.3	34%	0.34	19%	0.189	S	C	.	.	S	Bend	trans	77	6.9	179.4	0	0	0	0	0	114.7	K362 L363 D364	K362-G366 WeakPolarHBondContact CD-O 3.27Å; K362-G366 WeakPolarHBondContact CE-O 3.32Å; K362-G366 PolarHBondContact NZ-O 3.47Å; L363-G366 WeakPolarHBondContact O-CA 3.43Å; L363-G366 PolarHBondContact O-N 3.43Å; D364-G366 PolarHBondContact O-N 3.35Å; D364-G366 VanDerWaalsContact O-N 3.08Å
367	R	97.9	Very high	98.2	Very high	45 Å²	45	35.5 Å²	35.5	17%	0.17	18%	0.182	C	C	.	.	S	Bend	trans	-103.7	163.4	174.6	-57.8	-172	68.1	124.2	5.7	110.8	D144 N323 K362 L363 C365	D144-R367 IonicContact OD2-CZ 2.88Å; D144-R367 VanDerWaalsContact OD2-CZ 3.3Å; D144-R367 IonicContact OD2-NH1 3.59Å; D144-R367 IonicContact OD2-NH2 2.68Å; D144-R367 PolarHBondContact OD2-NH2 3.4Å; N323-R367 PolarHBondContact O-NH2 3.2Å; N323-R367 WeakPolarHBondContact OD1-CB 3.36Å; K362-R367 CarbonylContact C-O 3.54Å; K362-R367 WeakPolarHBondContact CA-O 3.31Å; L363-R367 PolarHBondContact N-O 3.38Å; C365-R367 PolarHBondContact O-N 3.28Å
368	Y	98.5	Very high	98.1	Very high	31 Å²	31	34.8 Å²	34.8	12%	0.122	18%	0.179	C	C	.	.			trans	-87.1	164.4	168.6	-59	-78.4	0	0	0	110.6	A320 N321 N323 L360 E361 K362 S370 W373	A320-Y368 PolarHBondContact O-OH 3.31Å; N321-Y368 HydrophobicContact CB-CD2 4.4Å; N321-Y368 HydrophobicContact CB-CE2 4.49Å; N321-Y368 WeakPolarHBondContact OD1-CD2 3.44Å; N323-Y368 PolarHBondContact ND2-O 3.42Å; N323-Y368 PolarHBondContact OD1-N 3.26Å; L360-Y368 VanDerWaalsContact O-CE1 3.24Å; L360-Y368 WeakPolarHBondContact O-CE1 3.41Å; E361-Y368 WeakPolarHBondContact O-CD1 3.5Å; K362-Y368 HydrophobicContact CB-CE1 4.5Å; K362-Y368 HydrophobicContact CG-CD1 3.93Å; K362-Y368 HydrophobicContact CG-CE1 3.48Å; K362-Y368 VanDerWaalsContact CG-CE1 3.48Å; K362-Y368 HydrophobicContact CG-CE2 4.21Å; K362-Y368 HydrophobicContact CG-CG 4.46Å; Y368-S370 WeakPolarHBondContact CB-O 3.44Å; Y368-S370 PolarHBondContact O-N 3.42Å; Y368-W373 AromaticContact CD1-CH2 3.51Å; Y368-W373 HydrophobicContact CD1-CH2 3.51Å; Y368-W373 AromaticContact CD1-CZ3 3.47Å; Y368-W373 HydrophobicContact CD1-CZ3 3.47Å; Y368-W373 VanDerWaalsContact CD1-CZ3 3.47Å; Y368-W373 AromaticContact CD2-CH2 3.98Å; Y368-W373 HydrophobicContact CD2-CH2 3.98Å; Y368-W373 HydrophobicContact CD2-CZ3 4.31Å; Y368-W373 AromaticContact CE1-CH2 3.57Å; Y368-W373 HydrophobicContact CE1-CH2 3.57Å; Y368-W373 HydrophobicContact CE1-CZ3 4.01Å; Y368-W373 HydrophobicContact CE2-CH2 4.01Å; Y368-W373 AromaticContact CG-CH2 3.71Å; Y368-W373 HydrophobicContact CG-CH2 3.71Å; Y368-W373 AromaticContact CG-CZ3 3.64Å; Y368-W373 HydrophobicContact CG-CZ3 3.64Å; Y368-W373 AromaticContact CZ-CH2 3.78Å
369	T	98.4	Very high	98.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-51.2	-39.9	174.5	-58.9	0	0	0	0	112.4	W138 R151 L155	W138-T369 HydrophobicContact CH2-CG2 3.69Å; W138-T369 HydrophobicContact CZ2-CG2 3.64Å; W138-T369 HydrophobicContact CZ3-CG2 4.31Å; R151-T369 PolarHBondContact NE-O 3.28Å; R151-T369 PolarHBondContact NH2-O 2.99Å; L155-T369 HydrophobicContact CB-CG2 4.02Å
370	S	98.8	Very high	97.8	Very high	1 Å²	1	38 Å²	38	1%	0.007	20%	0.195	C	C	.	.			trans	-150.7	166.8	178.5	177.4	0	0	0	0	109.6	N139 D141 N321 N323 Y368 H372	N139-S370 VanDerWaalsContact O-CB 3.26Å; N139-S370 WeakPolarHBondContact O-CB 3.49Å; N139-S370 PolarHBondContact O-OG 2.73Å; D141-S370 WeakPolarHBondContact CB-OG 3.09Å; N321-S370 PolarHBondContact ND2-O 2.87Å; N323-S370 PolarHBondContact ND2-O 2.84Å; Y368-S370 WeakPolarHBondContact CB-O 3.44Å; Y368-S370 PolarHBondContact O-N 3.42Å; S370-H372 WeakPolarHBondContact CB-O 3.45Å; S370-H372 PolarHBondContact OG-N 2.66Å; S370-H372 VanDerWaalsContact OG-N 3.15Å
371	D	98.4	Very high	97	Very high	12 Å²	12	36.7 Å²	36.7	6%	0.064	19%	0.188	C	C	.	.	S	Bend	trans	-72.4	-14.2	165.5	69.9	-43.7	0	0	0	113	D141 W316 N321 N323 K324	D141-D371 VanDerWaalsContact CB-OD1 3.32Å; D141-D371 WeakPolarHBondContact CB-OD1 3.2Å; W316-D371 PolarHBondContact NE1-OD2 2.88Å; N321-D371 WeakPolarHBondContact ND2-CA 3.45Å; N321-D371 PolarHBondContact ND2-O 2.92Å; N323-D371 HydrophobicContact CB-CB 3.9Å; K324-D371 HydrophobicContact CD-CB 4.34Å; K324-D371 WeakPolarHBondContact CE-OD2 3.32Å; K324-D371 HydrophobicContact CG-CB 3.7Å; K324-D371 WeakPolarHBondContact CG-OD2 3.37Å
372	H	98.8	Very high	97	Very high	8 Å²	8	33 Å²	33	4%	0.037	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-93.5	146.2	165.9	-70.6	-116.2	0	0	0	111.8	W138 N139 D281 T315 W316 D335 S370	W138-H372 PolarHBondContact NE1-O 3.21Å; N139-H372 HydrophobicContact CB-CB 4.15Å; D281-H372 IonicContact OD2-CE1 3.78Å; D281-H372 PolarHBondContact OD2-CE1 3.45Å; D281-H372 IonicContact OD2-NE2 3.48Å; T315-H372 CarbonylContact O-C 3.54Å; T315-H372 WeakPolarHBondContact O-CA 3.35Å; W316-H372 AromaticContact CD1-CD2 3.49Å; W316-H372 VanDerWaalsContact CD1-CD2 3.49Å; W316-H372 AromaticContact CD1-CE1 3.88Å; W316-H372 AromaticContact CD1-CG 3.9Å; W316-H372 AromaticContact CD1-NE2 3.43Å; D335-H372 IonicContact OD1-ND1 3.53Å; D335-H372 IonicContact OD2-CE1 3.45Å; D335-H372 IonicContact OD2-CG 2.63Å; D335-H372 IonicContact OD2-ND1 3.28Å; D335-H372 PolarHBondContact OD2-ND1 2.88Å; S370-H372 WeakPolarHBondContact CB-O 3.45Å; S370-H372 PolarHBondContact OG-N 2.66Å; S370-H372 VanDerWaalsContact OG-N 3.15Å
373	W	98.9	Very high	96.9	Very high	9 Å²	9	28.8 Å²	28.8	3%	0.034	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-81.9	137	161.2	-52.3	134	0	0	0	109.9	T315 A320 N321 L357 G359 L360 Y368	T315-W373 PolarHBondContact O-N 3.35Å; A320-W373 HydrophobicContact CB-CZ2 4.09Å; N321-W373 HydrophobicContact CB-CH2 3.83Å; N321-W373 HydrophobicContact CB-CZ2 3.65Å; N321-W373 VanDerWaalsContact ND2-CH2 3.33Å; N321-W373 WeakPolarHBondContact ND2-CH2 3.15Å; N321-W373 VanDerWaalsContact ND2-CZ3 3.27Å; N321-W373 WeakPolarHBondContact ND2-CZ3 3.45Å; L357-W373 HydrophobicContact CB-CB 4.28Å; L357-W373 HydrophobicContact CD1-CB 4.25Å; L357-W373 HydrophobicContact CD1-CG 4.3Å; L357-W373 HydrophobicContact CD2-CB 4.04Å; L357-W373 HydrophobicContact CG-CB 4.41Å; G359-W373 WeakPolarHBondContact O-CZ3 3.32Å; L360-W373 HydrophobicContact CD2-CD2 3.52Å; L360-W373 HydrophobicContact CD2-CE3 3.92Å; L360-W373 HydrophobicContact CD2-CG 3.81Å; L360-W373 HydrophobicContact CD2-CH2 4.37Å; L360-W373 HydrophobicContact CD2-CZ2 4.01Å; L360-W373 HydrophobicContact CD2-CZ3 4.34Å; Y368-W373 AromaticContact CD1-CH2 3.51Å; Y368-W373 HydrophobicContact CD1-CH2 3.51Å; Y368-W373 AromaticContact CD1-CZ3 3.47Å; Y368-W373 HydrophobicContact CD1-CZ3 3.47Å; Y368-W373 VanDerWaalsContact CD1-CZ3 3.47Å; Y368-W373 AromaticContact CD2-CH2 3.98Å; Y368-W373 HydrophobicContact CD2-CH2 3.98Å; Y368-W373 HydrophobicContact CD2-CZ3 4.31Å; Y368-W373 AromaticContact CE1-CH2 3.57Å; Y368-W373 HydrophobicContact CE1-CH2 3.57Å; Y368-W373 HydrophobicContact CE1-CZ3 4.01Å; Y368-W373 HydrophobicContact CE2-CH2 4.01Å; Y368-W373 AromaticContact CG-CH2 3.71Å; Y368-W373 HydrophobicContact CG-CH2 3.71Å; Y368-W373 AromaticContact CG-CZ3 3.64Å; Y368-W373 HydrophobicContact CG-CZ3 3.64Å; Y368-W373 AromaticContact CZ-CH2 3.78Å
374	G	98.8	Very high	96.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	152.7	172.5	0	0	0	0	0	110.4	S137 W138 L357 V358	S137-G374 WeakPolarHBondContact O-CA 3.38Å; W138-G374 VanDerWaalsContact CD2-CA 3.5Å; W138-G374 VanDerWaalsContact CE2-N 3.33Å; W138-G374 VanDerWaalsContact CG-CA 3.46Å; L357-G374 CarbonylContact C-O 3.51Å; L357-G374 VanDerWaalsContact CA-O 3.25Å; L357-G374 WeakPolarHBondContact CA-O 3.32Å; V358-G374 PolarHBondContact N-O 2.86Å; V358-G374 PolarHBondContact O-N 3.4Å
375	I	98.7	Very high	96.9	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.7	170.7	-62.5	168	0	0	0	108.1	I136 S137 T315 D335 V337 M355 L357 C377	I136-I375 CarbonylContact C-O 3.47Å; I136-I375 VanDerWaalsContact CA-O 3.24Å; I136-I375 WeakPolarHBondContact CA-O 3.12Å; S137-I375 PolarHBondContact N-O 2.58Å; S137-I375 PolarHBondContact O-N 3.15Å; T315-I375 HydrophobicContact CG2-CD1 3.8Å; T315-I375 HydrophobicContact CG2-CG1 3.92Å; D335-I375 HydrophobicContact CB-CD1 3.5Å; D335-I375 VanDerWaalsContact CB-CD1 3.5Å; D335-I375 HydrophobicContact CB-CG1 4.27Å; D335-I375 WeakPolarHBondContact O-CD1 3.45Å; V337-I375 HydrophobicContact CG2-CG2 4.35Å; M355-I375 HydrophobicContact CE-CB 4.42Å; M355-I375 HydrophobicContact CE-CD1 3.86Å; M355-I375 HydrophobicContact CE-CG1 4.04Å; M355-I375 HydrophobicContact CE-CG2 3.49Å; M355-I375 VanDerWaalsContact CE-CG2 3.49Å; M355-I375 HydrophobicContact CG-CG2 3.91Å; M355-I375 HydrophobicContact SD-CG2 4.35Å; L357-I375 HydrophobicContact CD2-CG1 4.26Å; I375-C377 WeakPolarHBondContact CG2-SG 3.28Å
376	Y	98.8	Very high	97	Very high	39 Å²	39	19.3 Å²	19.3	15%	0.153	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.9	163.3	174.5	-95.7	0	0	0	109.6	L135 I136 Y162 M355 A356	L135-Y376 CarbonylContact O-C 3.51Å; L135-Y376 WeakPolarHBondContact O-CA 3.32Å; I136-Y376 HydrophobicContact CD1-CD2 4.3Å; I136-Y376 HydrophobicContact CG1-CD2 3.82Å; Y162-Y376 HydrophobicContact CD1-CD1 4.23Å; Y162-Y376 AromaticContact CD1-CD2 3.58Å; Y162-Y376 HydrophobicContact CD1-CD2 3.58Å; Y162-Y376 HydrophobicContact CD1-CE1 4.33Å; Y162-Y376 AromaticContact CD1-CE2 3.68Å; Y162-Y376 HydrophobicContact CD1-CE2 3.68Å; Y162-Y376 AromaticContact CD1-CG 3.87Å; Y162-Y376 HydrophobicContact CD1-CG 3.87Å; Y162-Y376 HydrophobicContact CE1-CD1 4.28Å; Y162-Y376 HydrophobicContact CE1-CD2 4.3Å; Y162-Y376 HydrophobicContact CE1-CG 4.13Å; Y162-Y376 HydrophobicContact CG-CD2 4.11Å; Y162-Y376 HydrophobicContact CG-CE2 4.29Å; M355-Y376 CarbonylContact C-O 3.48Å; M355-Y376 VanDerWaalsContact CA-O 3.25Å; M355-Y376 WeakPolarHBondContact CA-O 3.37Å; A356-Y376 PolarHBondContact N-O 3.34Å; A356-Y376 PolarHBondContact O-N 2.84Å
377	C	98.1	Very high	96.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	149.4	173.5	-65.4	0	0	0	0	110.9	S134 L135 H354 I375 F379	S134-C377 WeakPolarHBondContact CA-O 3.29Å; L135-C377 HydrophobicContact CB-CB 4.42Å; L135-C377 PolarHBondContact N-O 2.95Å; L135-C377 PolarHBondContact O-N 3.23Å; H354-C377 CarbonylContact O-C 3.57Å; H354-C377 VanDerWaalsContact O-CA 3.26Å; H354-C377 WeakPolarHBondContact O-CA 3.26Å; I375-C377 WeakPolarHBondContact CG2-SG 3.28Å; C377-F379 HydrophobicContact CB-CE2 3.83Å; C377-F379 HydrophobicContact CB-CZ 3.91Å
378	S	97.9	Very high	96.8	Very high	6 Å²	6	16.4 Å²	16.4	4%	0.042	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.5	164.8	67.8	0	0	0	0	111.6	L133 D353 H354	L133-S378 CarbonylContact O-C 3.52Å; L133-S378 WeakPolarHBondContact O-CA 3.46Å; D353-S378 PolarHBondContact N-O 3.23Å; D353-S378 PolarHBondContact OD2-OG 2.93Å; H354-S378 WeakPolarHBondContact CB-OG 3.2Å; H354-S378 PolarHBondContact N-O 3.15Å; H354-S378 PolarHBondContact O-N 2.93Å
379	F	97.3	Very high	96.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134.5	-176.5	-53.6	-90.8	0	0	0	109.8	K132 L133 L135 L277 V302 V337 L339 M350 T351 P352 C377	K132-F379 CarbonylContact C-O 3.51Å; K132-F379 VanDerWaalsContact CA-O 3.23Å; K132-F379 WeakPolarHBondContact CA-O 3.46Å; L133-F379 HydrophobicContact CB-CB 4.4Å; L133-F379 PolarHBondContact N-O 3.41Å; L133-F379 WeakPolarHBondContact O-CD2 3.44Å; L133-F379 PolarHBondContact O-N 3.45Å; L135-F379 HydrophobicContact CB-CE2 4.12Å; L277-F379 HydrophobicContact CD1-CD2 4.45Å; L277-F379 HydrophobicContact CD1-CE2 4.23Å; L277-F379 HydrophobicContact CD2-CD1 4.47Å; L277-F379 HydrophobicContact CD2-CE1 3.79Å; L277-F379 HydrophobicContact CD2-CE2 4.02Å; L277-F379 HydrophobicContact CD2-CZ 3.53Å; V302-F379 HydrophobicContact CG2-CE1 3.79Å; V302-F379 HydrophobicContact CG2-CZ 4.11Å; V337-F379 HydrophobicContact CG1-CZ 4.19Å; L339-F379 HydrophobicContact CB-CE1 4.48Å; L339-F379 HydrophobicContact CD2-CD1 4.07Å; L339-F379 HydrophobicContact CD2-CE1 4.2Å; M350-F379 HydrophobicContact CE-CB 4.21Å; M350-F379 HydrophobicContact CG-CB 4Å; M350-F379 HydrophobicContact SD-CB 4.19Å; T351-F379 CarbonylContact O-C 3.51Å; T351-F379 VanDerWaalsContact O-CA 3.27Å; T351-F379 WeakPolarHBondContact O-CA 3.19Å; P352-F379 HydrophobicContact CB-CD1 4.25Å; P352-F379 HydrophobicContact CB-CE1 4.25Å; P352-F379 HydrophobicContact CG-CD1 4.33Å; P352-F379 HydrophobicContact CG-CE1 4.24Å; C377-F379 HydrophobicContact CB-CE2 3.83Å; C377-F379 HydrophobicContact CB-CZ 3.91Å
380	I	93.1	Very high	96.6	Very high	69 Å²	69	16.6 Å²	16.6	35%	0.354	8%	0.082	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.9	172.3	-67	162	0	0	0	108.2	K132 M350 T351 D353	K132-I380 HydrophobicContact CD-CG1 4.29Å; K132-I380 HydrophobicContact CG-CG1 4.12Å; M350-I380 CarbonylContact C-O 3.6Å; M350-I380 VanDerWaalsContact CA-O 3.23Å; M350-I380 WeakPolarHBondContact CA-O 3.4Å; T351-I380 PolarHBondContact N-O 3.36Å; T351-I380 PolarHBondContact O-N 3.4Å; D353-I380 HydrophobicContact CB-CD1 3.69Å; D353-I380 HydrophobicContact CB-CG1 3.78Å; D353-I380 WeakPolarHBondContact OD1-CD1 3.24Å
381	L	81.4	Confident	96.4	Very high	54 Å²	54	18 Å²	18	28%	0.283	9%	0.088	S	C	.	.			trans	-86.1	0	174.2	-84	165.1	0	0	0	112.7	F234 R349 M350	F234-L381 HydrophobicContact CD1-CD1 3.83Å; F234-L381 HydrophobicContact CE1-CD1 3.59Å; R349-L381 WeakPolarHBondContact CB-OXT 3.25Å; M350-L381 HydrophobicContact CB-CD2 4.37Å; M350-L381 HydrophobicContact CE-CD2 3.55Å; M350-L381 HydrophobicContact CE-CG 3.76Å

Retrieved 381 of 381 residues in 427.7 ms (Link to these results)

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