A0A077Z0S2_TRITR Loading...

Acetylcholine receptor subunit alpha type

AlphaFold DB , UniProt , Accession A0A077Z0S2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 461 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	61.6	Low	75.1	Confident	190 Å²	190	137.2 Å²	137.2	94%	0.936	65%	0.648	S	S	*	*				0	-46	0	-152.7	169	137.8	0	0	113.7	L3 I4	M1-L3 PolarHBondContact O-N 3.42Å; M1-I4 PolarHBondContact O-N 3.16Å
2	R	67.4	Low	75.5	Confident	230 Å²	230	133.4 Å²	133.4	87%	0.868	63%	0.634	S	S	*	*	H	α-helix	trans	-60.6	-35.7	178.9	-73.4	-176.7	171.2	179	-2.9	115.5	F6	R2-F6 PolarHBondContact O-N 2.86Å
3	L	70.5	Confident	75.6	Confident	145 Å²	145	132.7 Å²	132.7	76%	0.759	63%	0.627	S	S	*	*	H	α-helix	trans	-66.8	-38.1	-179.9	-141.7	93.9	0	0	0	112.7	M1 F6 V7	M1-L3 PolarHBondContact O-N 3.42Å; L3-F6 PolarHBondContact O-N 3.02Å; L3-V7 WeakPolarHBondContact O-CG2 3.48Å; L3-V7 PolarHBondContact O-N 3.11Å
4	I	74.4	Confident	75.5	Confident	123 Å²	123	129.9 Å²	129.9	63%	0.631	62%	0.616	S	S	*	*	H	α-helix	trans	-67.6	-41.6	-178.3	-62	170.7	0	0	0	110.4	M1 F6 V7 Y8	M1-I4 PolarHBondContact O-N 3.16Å; I4-F6 VanDerWaalsContact C-N 3.32Å; I4-F6 PolarHBondContact O-N 3.2Å; I4-V7 PolarHBondContact O-N 2.77Å; I4-Y8 WeakPolarHBondContact O-CB 3.28Å; I4-Y8 PolarHBondContact O-N 3.13Å
5	I	75.5	Confident	75.4	Confident	86 Å²	86	126.6 Å²	126.6	44%	0.441	61%	0.612	S	S	.	*	H	α-helix	trans	-62.7	-41.3	176.4	-63.6	169.9	0	0	0	110.5	Y8 F9	I5-Y8 PolarHBondContact O-N 2.85Å; I5-F9 HydrophobicContact CG2-CD2 3.79Å; I5-F9 HydrophobicContact CG2-CE2 4.01Å; I5-F9 WeakPolarHBondContact O-CD2 2.93Å; I5-F9 PolarHBondContact O-N 3.37Å
6	F	77.3	Confident	75	Confident	145 Å²	145	124.6 Å²	124.6	64%	0.636	60%	0.604	S	S	*	*	H	α-helix	trans	-66.7	-38.1	179	-140.3	-88.7	0	0	0	112.6	R2 L3 I4 K10	R2-F6 PolarHBondContact O-N 2.86Å; L3-F6 PolarHBondContact O-N 3.02Å; I4-F6 VanDerWaalsContact C-N 3.32Å; I4-F6 PolarHBondContact O-N 3.2Å; F6-K10 WeakPolarHBondContact O-CB 3.31Å; F6-K10 PolarHBondContact O-N 3.01Å
7	V	80.4	Confident	74.3	Confident	95 Å²	95	127.5 Å²	127.5	58%	0.576	61%	0.607	S	S	*	*	H	α-helix	trans	-66.1	-42.2	173.5	173.4	0	0	0	0	110.7	L3 I4 K10 A11	L3-V7 WeakPolarHBondContact O-CG2 3.48Å; L3-V7 PolarHBondContact O-N 3.11Å; I4-V7 PolarHBondContact O-N 2.77Å; V7-K10 PolarHBondContact O-N 3.36Å; V7-A11 WeakPolarHBondContact O-CB 2.75Å; V7-A11 PolarHBondContact O-N 2.99Å
8	Y	81.3	Confident	73.6	Confident	172 Å²	172	128 Å²	128	68%	0.675	61%	0.609	S	S	*	*	H	α-helix	trans	-64.5	-43.3	177.8	-134.5	-89.8	0	0	0	112	I4 I5 A11 L12	I4-Y8 WeakPolarHBondContact O-CB 3.28Å; I4-Y8 PolarHBondContact O-N 3.13Å; I5-Y8 PolarHBondContact O-N 2.85Å; Y8-A11 PolarHBondContact O-N 2.9Å; Y8-L12 VanDerWaalsContact O-CB 3.3Å; Y8-L12 WeakPolarHBondContact O-CB 2.93Å; Y8-L12 PolarHBondContact O-N 3.11Å
9	F	80.1	Confident	72.9	Confident	142 Å²	142	125.7 Å²	125.7	62%	0.623	61%	0.614	S	S	*	*	H	α-helix	trans	-65.3	-40.4	175.3	-95.4	-82.6	0	0	0	112.3	I5 L12 F13	I5-F9 HydrophobicContact CG2-CD2 3.79Å; I5-F9 HydrophobicContact CG2-CE2 4.01Å; I5-F9 WeakPolarHBondContact O-CD2 2.93Å; I5-F9 PolarHBondContact O-N 3.37Å; F9-L12 PolarHBondContact O-N 3.14Å; F9-F13 VanDerWaalsContact O-CB 3.24Å; F9-F13 WeakPolarHBondContact O-CB 3.46Å; F9-F13 PolarHBondContact O-N 3.11Å
10	K	79.2	Confident	72.4	Confident	132 Å²	132	126.4 Å²	126.4	57%	0.574	62%	0.62	S	S	*	*	H	α-helix	trans	-63.9	-43.9	173.4	-82.4	-163.8	175.4	-169.5	0	111.9	F6 V7 F13 I14	F6-K10 WeakPolarHBondContact O-CB 3.31Å; F6-K10 PolarHBondContact O-N 3.01Å; V7-K10 PolarHBondContact O-N 3.36Å; K10-F13 PolarHBondContact O-N 3.14Å; K10-I14 WeakPolarHBondContact O-CB 3.05Å; K10-I14 WeakPolarHBondContact O-CD1 3.15Å; K10-I14 WeakPolarHBondContact O-CG1 3.43Å; K10-I14 PolarHBondContact O-N 2.99Å
11	A	78.9	Confident	71.9	Confident	49 Å²	49	123.2 Å²	123.2	41%	0.405	61%	0.613	S	S	.	*	H	α-helix	trans	-62.8	-44.2	177	0	0	0	0	0	111.4	V7 Y8 F13 I14 C15	V7-A11 WeakPolarHBondContact O-CB 2.75Å; V7-A11 PolarHBondContact O-N 2.99Å; Y8-A11 PolarHBondContact O-N 2.9Å; A11-F13 VanDerWaalsContact C-N 3.34Å; A11-F13 PolarHBondContact O-N 3.43Å; A11-I14 PolarHBondContact O-N 2.92Å; A11-C15 PolarHBondContact O-N 3.01Å
12	L	79.7	Confident	72.4	Confident	92 Å²	92	119 Å²	119	48%	0.482	60%	0.595	S	S	.	*	H	α-helix	trans	-62.4	-42.1	175.7	-158.7	97.6	0	0	0	111.2	Y8 F9 I14 C15 L16	Y8-L12 VanDerWaalsContact O-CB 3.3Å; Y8-L12 WeakPolarHBondContact O-CB 2.93Å; Y8-L12 PolarHBondContact O-N 3.11Å; F9-L12 PolarHBondContact O-N 3.14Å; L12-I14 VanDerWaalsContact C-N 3.35Å; L12-C15 PolarHBondContact O-N 3.39Å; L12-L16 HydrophobicContact CD2-CD1 3.91Å; L12-L16 HydrophobicContact CG-CD1 4.13Å; L12-L16 WeakPolarHBondContact O-CB 3.33Å; L12-L16 PolarHBondContact O-N 2.93Å
13	F	76.6	Confident	73.3	Confident	124 Å²	124	113 Å²	113	54%	0.544	58%	0.579	S	S	.	*	H	α-helix	trans	-67.4	-34.8	177.5	-159	-98.4	0	0	0	112.2	F9 K10 A11 R17	F9-F13 VanDerWaalsContact O-CB 3.24Å; F9-F13 WeakPolarHBondContact O-CB 3.46Å; F9-F13 PolarHBondContact O-N 3.11Å; K10-F13 PolarHBondContact O-N 3.14Å; A11-F13 VanDerWaalsContact C-N 3.34Å; A11-F13 PolarHBondContact O-N 3.43Å; F13-R17 HydrophobicContact CD1-CG 4.45Å; F13-R17 HydrophobicContact CE1-CG 4.41Å; F13-R17 VanDerWaalsContact CE1-NE 3.33Å; F13-R17 WeakPolarHBondContact O-CB 3.22Å; F13-R17 WeakPolarHBondContact O-CG 3.47Å; F13-R17 PolarHBondContact O-N 3.41Å
14	I	74.6	Confident	74.2	Confident	93 Å²	93	109.5 Å²	109.5	48%	0.477	56%	0.559	S	S	.	*	H	α-helix	trans	-68.6	-44.9	172.9	-68.5	162.5	0	0	0	110.5	K10 A11 L12 R17 Q18	K10-I14 WeakPolarHBondContact O-CB 3.05Å; K10-I14 WeakPolarHBondContact O-CD1 3.15Å; K10-I14 WeakPolarHBondContact O-CG1 3.43Å; K10-I14 PolarHBondContact O-N 2.99Å; A11-I14 PolarHBondContact O-N 2.92Å; L12-I14 VanDerWaalsContact C-N 3.35Å; I14-R17 PolarHBondContact O-N 3.29Å; I14-Q18 WeakPolarHBondContact O-CG 3.25Å; I14-Q18 PolarHBondContact O-N 3.39Å
15	C	74	Confident	74.9	Confident	81 Å²	81	108.1 Å²	108.1	55%	0.547	55%	0.549	S	S	.	.	H	α-helix	trans	-63.4	-40.8	175.3	-78.9	0	0	0	0	112.2	A11 L12 R17 Q18 A19	A11-C15 PolarHBondContact O-N 3.01Å; L12-C15 PolarHBondContact O-N 3.39Å; C15-R17 VanDerWaalsContact C-N 3.34Å; C15-Q18 PolarHBondContact O-N 3.15Å; C15-A19 WeakPolarHBondContact O-CB 3.36Å; C15-A19 PolarHBondContact O-N 3.15Å
16	L	68.6	Low	75.6	Confident	95 Å²	95	112.8 Å²	112.8	50%	0.497	56%	0.561	S	S	.	*	H	α-helix	trans	-62	-41.5	173.2	-93	148	0	0	0	111.4	L12 A19 L20	L12-L16 HydrophobicContact CD2-CD1 3.91Å; L12-L16 HydrophobicContact CG-CD1 4.13Å; L12-L16 WeakPolarHBondContact O-CB 3.33Å; L12-L16 PolarHBondContact O-N 2.93Å; L16-A19 PolarHBondContact O-N 3.46Å; L16-L20 WeakPolarHBondContact O-CD1 3.3Å; L16-L20 PolarHBondContact O-N 2.88Å
17	R	62.6	Low	76.2	Confident	174 Å²	174	110.2 Å²	110.2	66%	0.657	55%	0.551	S	S	*	*	H	α-helix	trans	-66.6	-35.4	174.7	-82	-170	173.6	-155.4	-0.9	113.3	F13 I14 C15 L20 A21	F13-R17 HydrophobicContact CD1-CG 4.45Å; F13-R17 HydrophobicContact CE1-CG 4.41Å; F13-R17 VanDerWaalsContact CE1-NE 3.33Å; F13-R17 WeakPolarHBondContact O-CB 3.22Å; F13-R17 WeakPolarHBondContact O-CG 3.47Å; F13-R17 PolarHBondContact O-N 3.41Å; I14-R17 PolarHBondContact O-N 3.29Å; C15-R17 VanDerWaalsContact C-N 3.34Å; R17-L20 PolarHBondContact O-N 3.08Å; R17-A21 PolarHBondContact O-N 3.39Å
18	Q	61.5	Low	76.9	Confident	136 Å²	136	105.7 Å²	105.7	64%	0.636	52%	0.524	S	S	*	.	H	α-helix	trans	-72.5	-32.8	174	-74	178.8	-8.6	0	0	112.2	I14 C15 L20 A21	I14-Q18 WeakPolarHBondContact O-CG 3.25Å; I14-Q18 PolarHBondContact O-N 3.39Å; C15-Q18 PolarHBondContact O-N 3.15Å; Q18-L20 PolarHBondContact O-N 3.16Å; Q18-A21 VanDerWaalsContact O-CB 3.28Å; Q18-A21 WeakPolarHBondContact O-CB 3.27Å; Q18-A21 PolarHBondContact O-N 3.41Å
19	A	61.3	Low	77.4	Confident	85 Å²	85	99.1 Å²	99.1	70%	0.702	50%	0.503	S	S	*	.	H	α-helix	trans	-70.8	-21.1	172.8	0	0	0	0	0	113	C15 L16	C15-A19 WeakPolarHBondContact O-CB 3.36Å; C15-A19 PolarHBondContact O-N 3.15Å; L16-A19 PolarHBondContact O-N 3.46Å
20	L	61.9	Low	78	Confident	139 Å²	139	96.2 Å²	96.2	73%	0.728	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	0.5	171.6	-82.4	156.2	0	0	0	113.3	L16 R17 Q18 D22	L16-L20 WeakPolarHBondContact O-CD1 3.3Å; L16-L20 PolarHBondContact O-N 2.88Å; R17-L20 PolarHBondContact O-N 3.08Å; Q18-L20 PolarHBondContact O-N 3.16Å; L20-D22 PolarHBondContact O-N 3.46Å
21	A	63.4	Low	78.7	Confident	59 Å²	59	93 Å²	93	49%	0.488	48%	0.483	S	S	.	.	S	Bend	trans	-69.4	118.6	174.6	0	0	0	0	0	109.1	R17 Q18 I23	R17-A21 PolarHBondContact O-N 3.39Å; Q18-A21 VanDerWaalsContact O-CB 3.28Å; Q18-A21 WeakPolarHBondContact O-CB 3.27Å; Q18-A21 PolarHBondContact O-N 3.41Å; A21-I23 PolarHBondContact O-N 3.24Å
22	D	71	Confident	79.4	Confident	103 Å²	103	91.7 Å²	91.7	55%	0.551	47%	0.469	S	S	*	.			trans	-73.2	110.8	-178.1	-165.4	-11	0	0	0	110.3	L20 H24	L20-D22 PolarHBondContact O-N 3.46Å; D22-H24 VanDerWaalsContact OD1-CB 3.26Å; D22-H24 WeakPolarHBondContact OD1-CB 3.3Å; D22-H24 IonicContact OD1-CD2 3.02Å; D22-H24 PolarHBondContact OD1-CD2 2.87Å; D22-H24 IonicContact OD1-CG 3.39Å; D22-H24 PolarHBondContact OD1-N 3.44Å
23	I	85.9	Confident	80.1	Confident	102 Å²	102	89.3 Å²	89.3	52%	0.523	46%	0.457	S	S	.	.			trans	-91.5	-12.7	-179.1	-62.8	163.3	0	0	0	110.3	A21 E25 R26 Q27	A21-I23 PolarHBondContact O-N 3.24Å; I23-E25 PolarHBondContact O-N 3.47Å; I23-R26 PolarHBondContact O-N 2.92Å; I23-Q27 HydrophobicContact CG2-CG 3.84Å; I23-Q27 PolarHBondContact O-N 3.15Å
24	H	89.2	Confident	80.9	Confident	73 Å²	73	92 Å²	92	34%	0.338	46%	0.463	S	S	.	.	H	α-helix	trans	-65.9	-38.9	-168.5	-62.3	-58.4	0	0	0	112.5	D22 R26 Q27 L28 L96	D22-H24 VanDerWaalsContact OD1-CB 3.26Å; D22-H24 WeakPolarHBondContact OD1-CB 3.3Å; D22-H24 IonicContact OD1-CD2 3.02Å; D22-H24 PolarHBondContact OD1-CD2 2.87Å; D22-H24 IonicContact OD1-CG 3.39Å; D22-H24 PolarHBondContact OD1-N 3.44Å; H24-R26 PolarHBondContact O-N 2.95Å; H24-Q27 PolarHBondContact O-N 2.9Å; H24-L28 VanDerWaalsContact O-CB 3.29Å; H24-L28 WeakPolarHBondContact O-CB 2.94Å; H24-L28 PolarHBondContact O-N 3.03Å; H24-L96 HydrophobicContact CB-CD1 3.93Å
25	E	89.6	Confident	81.7	Confident	93 Å²	93	91.4 Å²	91.4	44%	0.435	48%	0.48	S	S	.	.	H	α-helix	trans	-65.7	-39.9	179.9	-171.5	176.5	-177.5	0	0	111.8	I23 S29 L96 I99	I23-E25 PolarHBondContact O-N 3.47Å; E25-S29 WeakPolarHBondContact O-CB 3.22Å; E25-S29 PolarHBondContact O-N 3.4Å; E25-L96 VanDerWaalsContact CA-CD1 3.48Å; E25-L96 HydrophobicContact CB-CD1 3.87Å; E25-I99 HydrophobicContact CG-CG2 4.28Å
26	R	89.6	Confident	82.7	Confident	184 Å²	184	89.1 Å²	89.1	69%	0.694	46%	0.46	S	S	*	.	H	α-helix	trans	-66.2	-46.3	175.6	-179.9	179.2	174.4	177.1	0.6	111.3	I23 H24 S29 D30	I23-R26 PolarHBondContact O-N 2.92Å; H24-R26 PolarHBondContact O-N 2.95Å; R26-S29 PolarHBondContact O-N 3.38Å; R26-D30 IonicContact NE-OD2 3.81Å; R26-D30 WeakPolarHBondContact O-CB 3.34Å; R26-D30 PolarHBondContact O-N 3.45Å
27	Q	91.8	Very high	83.9	Confident	91 Å²	91	88.6 Å²	88.6	43%	0.425	46%	0.458	S	S	.	.	H	α-helix	trans	-58.8	-48.1	177.5	-78	172.8	-24.8	0	0	111.2	I23 H24 S29 D30 D31 Y93	I23-Q27 HydrophobicContact CG2-CG 3.84Å; I23-Q27 PolarHBondContact O-N 3.15Å; H24-Q27 PolarHBondContact O-N 2.9Å; Q27-S29 PolarHBondContact O-N 3.23Å; Q27-D30 PolarHBondContact O-N 3.2Å; Q27-D31 WeakPolarHBondContact O-CB 3.33Å; Q27-D31 VanDerWaalsContact O-CG 3.28Å; Q27-D31 PolarHBondContact O-N 2.88Å; Q27-Y93 HydrophobicContact CB-CE1 4.48Å
28	L	93.7	Very high	85.4	Confident	0 Å²	0	84 Å²	84	0%	0	45%	0.446	C	S	.	.	H	α-helix	trans	-58.6	-47.3	177.4	179	59	0	0	0	111.5	H24 D30 D31 L32 W88 Y93 L96 I99	H24-L28 VanDerWaalsContact O-CB 3.29Å; H24-L28 WeakPolarHBondContact O-CB 2.94Å; H24-L28 PolarHBondContact O-N 3.03Å; L28-D30 VanDerWaalsContact C-N 3.35Å; L28-D30 PolarHBondContact O-N 2.94Å; L28-D31 PolarHBondContact O-N 3.38Å; L28-L32 HydrophobicContact CD1-CD1 3.69Å; L28-L32 HydrophobicContact CD1-CD2 4.39Å; L28-L32 HydrophobicContact CD1-CG 3.8Å; L28-L32 HydrophobicContact CG-CD1 3.87Å; L28-L32 HydrophobicContact CG-CG 4.34Å; L28-L32 WeakPolarHBondContact O-CB 3.42Å; L28-L32 VanDerWaalsContact O-CG 3.3Å; L28-L32 WeakPolarHBondContact O-CG 3.29Å; L28-L32 PolarHBondContact O-N 2.92Å; L28-W88 HydrophobicContact CD1-CB 3.79Å; L28-W88 HydrophobicContact CD1-CD2 3.84Å; L28-W88 HydrophobicContact CD1-CE3 4.34Å; L28-W88 HydrophobicContact CD1-CG 3.58Å; L28-W88 HydrophobicContact CD2-CD2 3.94Å; L28-W88 HydrophobicContact CD2-CG 4.18Å; L28-W88 HydrophobicContact CD2-CZ2 3.94Å; L28-W88 HydrophobicContact CG-CD2 4.46Å; L28-Y93 HydrophobicContact CB-CD1 3.58Å; L28-Y93 HydrophobicContact CB-CE1 3.89Å; L28-Y93 HydrophobicContact CB-CG 4.05Å; L28-Y93 HydrophobicContact CD1-CD1 4.02Å; L28-Y93 HydrophobicContact CD1-CD2 3.78Å; L28-Y93 HydrophobicContact CD1-CE1 3.99Å; L28-Y93 HydrophobicContact CD1-CE2 3.76Å; L28-Y93 HydrophobicContact CD1-CG 3.9Å; L28-Y93 HydrophobicContact CD2-CG 4.47Å; L28-Y93 HydrophobicContact CG-CD1 4.31Å; L28-Y93 HydrophobicContact CG-CG 4.36Å; L28-L96 HydrophobicContact CD2-CB 4.29Å; L28-L96 HydrophobicContact CD2-CD1 4.19Å; L28-I99 HydrophobicContact CD2-CD1 4.38Å; L28-I99 HydrophobicContact CD2-CG2 3.6Å; L28-I99 HydrophobicContact CG-CD1 4.35Å; L28-I99 HydrophobicContact CG-CG2 4.45Å
29	S	91.8	Very high	86.8	Confident	34 Å²	34	84.6 Å²	84.6	24%	0.238	45%	0.452	C	S	.	.	H	α-helix	trans	-62.9	-40.2	178.2	-176.9	0	0	0	0	112.5	E25 R26 Q27 L33	E25-S29 WeakPolarHBondContact O-CB 3.22Å; E25-S29 PolarHBondContact O-N 3.4Å; R26-S29 PolarHBondContact O-N 3.38Å; Q27-S29 PolarHBondContact O-N 3.23Å; S29-L33 WeakPolarHBondContact O-CB 3.46Å; S29-L33 VanDerWaalsContact O-CG 3.24Å; S29-L33 WeakPolarHBondContact O-CG 3.33Å; S29-L33 PolarHBondContact O-N 3.29Å
30	D	92.7	Very high	88.3	Confident	81 Å²	81	85 Å²	85	43%	0.433	44%	0.44	S	S	.	.	H	α-helix	trans	-71	-33.2	179.5	-75.4	-20.7	0	0	0	111.6	R26 Q27 L28 R34	R26-D30 IonicContact NE-OD2 3.81Å; R26-D30 WeakPolarHBondContact O-CB 3.34Å; R26-D30 PolarHBondContact O-N 3.45Å; Q27-D30 PolarHBondContact O-N 3.2Å; L28-D30 VanDerWaalsContact C-N 3.35Å; L28-D30 PolarHBondContact O-N 2.94Å; D30-R34 WeakPolarHBondContact O-CB 3.48Å; D30-R34 PolarHBondContact O-N 2.71Å
31	D	94	Very high	89.8	Confident	66 Å²	66	79.8 Å²	79.8	35%	0.353	41%	0.41	S	S	.	.	H	α-helix	trans	-75.6	-45.6	178.4	-72.5	-18.3	0	0	0	112	Q27 L28 L33 R34 Y93	Q27-D31 WeakPolarHBondContact O-CB 3.33Å; Q27-D31 VanDerWaalsContact O-CG 3.28Å; Q27-D31 PolarHBondContact O-N 2.88Å; L28-D31 PolarHBondContact O-N 3.38Å; D31-L33 VanDerWaalsContact C-N 3.33Å; D31-L33 PolarHBondContact O-N 2.89Å; D31-R34 PolarHBondContact O-N 3.4Å; D31-R34 IonicContact OD1-CZ 3.78Å; D31-R34 IonicContact OD1-NH1 3.99Å; D31-R34 IonicContact OD1-NH2 3.22Å; D31-R34 PolarHBondContact OD1-NH2 3.37Å; D31-Y93 PolarHBondContact OD2-OH 3.37Å
32	L	93.6	Very high	91.4	Very high	21 Å²	21	77.4 Å²	77.4	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-64.1	-37	178.8	-72.5	176.5	0	0	0	112.8	L28 R34 L86 W88 I99	L28-L32 HydrophobicContact CD1-CD1 3.69Å; L28-L32 HydrophobicContact CD1-CD2 4.39Å; L28-L32 HydrophobicContact CD1-CG 3.8Å; L28-L32 HydrophobicContact CG-CD1 3.87Å; L28-L32 HydrophobicContact CG-CG 4.34Å; L28-L32 WeakPolarHBondContact O-CB 3.42Å; L28-L32 VanDerWaalsContact O-CG 3.3Å; L28-L32 WeakPolarHBondContact O-CG 3.29Å; L28-L32 PolarHBondContact O-N 2.92Å; L32-R34 VanDerWaalsContact C-N 3.35Å; L32-L86 HydrophobicContact CB-CD2 4.06Å; L32-L86 HydrophobicContact CD2-CD2 4.49Å; L32-W88 HydrophobicContact CD1-CE3 3.82Å; L32-W88 HydrophobicContact CD1-CZ3 4Å; L32-W88 HydrophobicContact CD2-CE3 4.35Å; L32-I99 HydrophobicContact CD1-CD1 3.47Å; L32-I99 VanDerWaalsContact CD1-CD1 3.47Å
33	L	93.9	Very high	92.4	Very high	42 Å²	42	73.4 Å²	73.4	22%	0.22	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-7.7	-178.5	-62.4	177.2	0	0	0	112.9	S29 D31 G35 Y36 I101 K105 I106	S29-L33 WeakPolarHBondContact O-CB 3.46Å; S29-L33 VanDerWaalsContact O-CG 3.24Å; S29-L33 WeakPolarHBondContact O-CG 3.33Å; S29-L33 PolarHBondContact O-N 3.29Å; D31-L33 VanDerWaalsContact C-N 3.33Å; D31-L33 PolarHBondContact O-N 2.89Å; L33-G35 PolarHBondContact O-N 2.9Å; L33-Y36 PolarHBondContact O-N 2.9Å; L33-I101 HydrophobicContact CD2-CD1 4.44Å; L33-K105 HydrophobicContact CD1-CD 3.99Å; L33-K105 HydrophobicContact CD2-CB 4.44Å; L33-I106 HydrophobicContact CD2-CG2 4.04Å
34	R	93.9	Very high	92.6	Very high	180 Å²	180	73.9 Å²	73.9	68%	0.679	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	103.6	179.8	-171	178.2	-60.8	158.6	14.9	110.4	D30 D31 L32 Y36	D30-R34 WeakPolarHBondContact O-CB 3.48Å; D30-R34 PolarHBondContact O-N 2.71Å; D31-R34 PolarHBondContact O-N 3.4Å; D31-R34 IonicContact OD1-CZ 3.78Å; D31-R34 IonicContact OD1-NH1 3.99Å; D31-R34 IonicContact OD1-NH2 3.22Å; D31-R34 PolarHBondContact OD1-NH2 3.37Å; L32-R34 VanDerWaalsContact C-N 3.35Å; R34-Y36 VanDerWaalsContact C-N 3.34Å
35	G	91.5	Very high	92.7	Very high	81 Å²	81	73.9 Å²	73.9	84%	0.835	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	5.9	178.7	0	0	0	0	0	114.3	L33 N37	L33-G35 PolarHBondContact O-N 2.9Å; G35-N37 PolarHBondContact O-N 3.31Å
36	Y	95.1	Very high	92.8	Very high	32 Å²	32	73.6 Å²	73.6	13%	0.125	38%	0.383	C	S	.	.			trans	-67	125.6	173.6	-174.5	-83.3	0	0	0	110.5	L33 R34 I38 D83 N85 L86 I106 W107	L33-Y36 PolarHBondContact O-N 2.9Å; R34-Y36 VanDerWaalsContact C-N 3.34Å; Y36-I38 HydrophobicContact CD1-CG1 4.29Å; Y36-I38 HydrophobicContact CE1-CG1 4.42Å; Y36-D83 WeakPolarHBondContact CE2-OD2 3.48Å; Y36-D83 PolarHBondContact OH-OD2 2.87Å; Y36-N85 HydrophobicContact CD2-CB 3.89Å; Y36-N85 HydrophobicContact CE2-CB 3.83Å; Y36-L86 HydrophobicContact CD2-CD2 3.99Å; Y36-L86 HydrophobicContact CD2-CG 4.3Å; Y36-L86 HydrophobicContact CE2-CD1 4.03Å; Y36-L86 HydrophobicContact CE2-CD2 4.02Å; Y36-L86 HydrophobicContact CE2-CG 3.83Å; Y36-I106 HydrophobicContact CE1-CB 4.16Å; Y36-I106 HydrophobicContact CE1-CG2 4.41Å; Y36-W107 WeakPolarHBondContact OH-CB 3.38Å; Y36-W107 PolarHBondContact OH-N 2.94Å
37	N	93.9	Very high	92.9	Very high	84 Å²	84	69.4 Å²	69.4	45%	0.449	38%	0.381	S	S	.	.			trans	-98.5	110.8	178.5	-174.6	-2.7	0	0	0	111.2	G35 L39 E40	G35-N37 PolarHBondContact O-N 3.31Å; N37-L39 PolarHBondContact O-N 2.94Å; N37-L39 PolarHBondContact OD1-N 2.95Å; N37-L39 VanDerWaalsContact OD1-N 3.14Å; N37-E40 HydrophobicContact CB-CB 4.15Å; N37-E40 PolarHBondContact O-N 3.21Å; N37-E40 VanDerWaalsContact O-N 3.16Å
38	I	93.6	Very high	93	Very high	77 Å²	77	70 Å²	70	40%	0.395	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-24.6	-176.7	-58.4	159.6	0	0	0	112.9	Y36 E104 K105	Y36-I38 HydrophobicContact CD1-CG1 4.29Å; Y36-I38 HydrophobicContact CE1-CG1 4.42Å; I38-E104 WeakPolarHBondContact CD1-O 3.48Å; I38-K105 WeakPolarHBondContact CG1-O 3.48Å
39	L	92.5	Very high	93	Very high	149 Å²	149	71.3 Å²	71.3	78%	0.78	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.4	-178.1	-59.4	179.1	0	0	0	113.2	N37	N37-L39 PolarHBondContact O-N 2.94Å; N37-L39 PolarHBondContact OD1-N 2.95Å; N37-L39 VanDerWaalsContact OD1-N 3.14Å
40	E	92.1	Very high	93.2	Very high	93 Å²	93	70 Å²	70	44%	0.435	38%	0.384	S	S	.	.	S	Bend	trans	-87.3	128.8	-179.7	-174.6	172.5	-168.5	0	0	110.5	N37 W107	N37-E40 HydrophobicContact CB-CB 4.15Å; N37-E40 PolarHBondContact O-N 3.21Å; N37-E40 VanDerWaalsContact O-N 3.16Å; E40-W107 VanDerWaalsContact O-CD1 3.27Å
41	R	94.3	Very high	93.3	Very high	30 Å²	30	70.6 Å²	70.6	11%	0.113	39%	0.387	C	S	.	.			trans	-65.7	137.6	172.7	-71.2	-174.3	-61	122.6	14.6	109.2	V43 C46 K48 V50 W107 Y172 K176	R41-V43 HydrophobicContact CB-CG2 4.45Å; R41-V43 PolarHBondContact O-N 2.99Å; R41-C46 PolarHBondContact NH2-O 3.06Å; R41-K48 PolarHBondContact NH1-O 3.42Å; R41-V50 HydrophobicContact CB-CG2 4.13Å; R41-W107 HydrophobicContact CG-CZ2 4.12Å; R41-Y172 HydrophobicContact CG-CE1 3.87Å; R41-K176 VanDerWaalsContact NH1-CA 3.34Å; R41-K176 PolarHBondContact NH1-O 3.48Å; R41-K176 VanDerWaalsContact NH2-CD 3.33Å
42	P	95.1	Very high	93.4	Very high	9 Å²	9	67.4 Å²	67.4	6%	0.058	37%	0.371	C	S	.	.	S	Bend	trans	-78.9	68.3	-175.3	34.1	-40.1	0	0	0	112.4	V50 D83 W107	P42-V50 HydrophobicContact CG-CG1 4.37Å; P42-V50 HydrophobicContact CG-CG2 4.15Å; P42-D83 HydrophobicContact CB-CB 3.76Å; P42-D83 VanDerWaalsContact CB-OD1 3.26Å; P42-D83 WeakPolarHBondContact CB-OD1 3.47Å; P42-D83 HydrophobicContact CG-CB 4.36Å; P42-W107 VanDerWaalsContact CD-CE3 3.42Å; P42-W107 HydrophobicContact CG-CD2 4.11Å; P42-W107 HydrophobicContact CG-CE3 3.62Å; P42-W107 HydrophobicContact CG-CZ3 3.95Å
43	V	93.6	Very high	93.5	Very high	19 Å²	19	68.8 Å²	68.8	12%	0.115	38%	0.38	C	S	.	.			trans	-123	137.9	177.1	-65.5	0	0	0	0	111	R41 N45 V50 Y84	R41-V43 HydrophobicContact CB-CG2 4.45Å; R41-V43 PolarHBondContact O-N 2.99Å; V43-N45 WeakPolarHBondContact CG2-O 3.34Å; V43-N45 PolarHBondContact O-N 3.34Å; V43-V50 HydrophobicContact CG1-CG2 3.47Å; V43-V50 VanDerWaalsContact CG1-CG2 3.47Å; V43-Y84 VanDerWaalsContact O-CE1 3.23Å; V43-Y84 WeakPolarHBondContact O-CE1 3.5Å
44	D	88.8	Confident	93.5	Very high	112 Å²	112	66.8 Å²	66.8	60%	0.599	37%	0.369	S	S	*	.	S	Bend	trans	-64.4	-32.8	172.4	64.4	-25.9	0	0	0	111.9	K48	D44-K48 VanDerWaalsContact CG-NZ 3.31Å; D44-K48 WeakPolarHBondContact OD1-CD 3.28Å; D44-K48 IonicContact OD1-NZ 2.98Å; D44-K48 PolarHBondContact OD1-NZ 2.99Å; D44-K48 IonicContact OD2-NZ 2.77Å; D44-K48 PolarHBondContact OD2-NZ 3.06Å
45	N	92.3	Very high	93.6	Very high	74 Å²	74	59.4 Å²	59.4	40%	0.396	34%	0.342	S	S	.	.	S	Bend	trans	-130.3	127.2	-179.2	-175.2	-21.1	0	0	0	110.4	V43 S47 K48	V43-N45 WeakPolarHBondContact CG2-O 3.34Å; V43-N45 PolarHBondContact O-N 3.34Å; N45-S47 PolarHBondContact O-N 2.95Å; N45-S47 WeakPolarHBondContact OD1-CB 3.4Å; N45-S47 PolarHBondContact OD1-N 3.46Å; N45-K48 HydrophobicContact CB-CD 4.4Å; N45-K48 HydrophobicContact CB-CG 4.31Å; N45-K48 PolarHBondContact O-N 3.17Å
46	C	90.4	Very high	93.7	Very high	87 Å²	87	55.5 Å²	55.5	59%	0.588	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.4	-177.4	68.4	0	0	0	0	114.4	R41 K176	R41-C46 PolarHBondContact NH2-O 3.06Å; C46-K176 PolarHBondContact O-NZ 2.9Å
47	S	91.7	Very high	93.7	Very high	95 Å²	95	54.8 Å²	54.8	66%	0.664	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.8	175.4	-61.6	0	0	0	0	114	N45	N45-S47 PolarHBondContact O-N 2.95Å; N45-S47 WeakPolarHBondContact OD1-CB 3.4Å; N45-S47 PolarHBondContact OD1-N 3.46Å
48	K	94.2	Very high	93.8	Very high	103 Å²	103	50.8 Å²	50.8	45%	0.448	28%	0.279	S	S	.	.	S	Bend	trans	-88.1	152.1	178.7	-64	-178	-168.8	162.2	0	111.9	R41 D44 N45	R41-K48 PolarHBondContact NH1-O 3.42Å; D44-K48 VanDerWaalsContact CG-NZ 3.31Å; D44-K48 WeakPolarHBondContact OD1-CD 3.28Å; D44-K48 IonicContact OD1-NZ 2.98Å; D44-K48 PolarHBondContact OD1-NZ 2.99Å; D44-K48 IonicContact OD2-NZ 2.77Å; D44-K48 PolarHBondContact OD2-NZ 3.06Å; N45-K48 HydrophobicContact CB-CD 4.4Å; N45-K48 HydrophobicContact CB-CG 4.31Å; N45-K48 PolarHBondContact O-N 3.17Å
49	A	94.6	Very high	93.8	Very high	29 Å²	29	49.3 Å²	49.3	24%	0.24	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-84.5	150.9	168.2	0	0	0	0	0	110.1	N175 K176 N178	A49-N175 WeakPolarHBondContact CB-O 3.34Å; A49-K176 WeakPolarHBondContact CA-O 3.2Å; A49-N178 HydrophobicContact CB-CB 4Å
50	V	95.5	Very high	93.9	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.036	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.3	164.2	-177.7	0	0	0	0	107.2	R41 P42 V43 V52 W81 W107 K176 N178	R41-V50 HydrophobicContact CB-CG2 4.13Å; P42-V50 HydrophobicContact CG-CG1 4.37Å; P42-V50 HydrophobicContact CG-CG2 4.15Å; V43-V50 HydrophobicContact CG1-CG2 3.47Å; V43-V50 VanDerWaalsContact CG1-CG2 3.47Å; V50-V52 HydrophobicContact CG1-CG2 4Å; V50-V52 PolarHBondContact O-N 3.44Å; V50-W81 HydrophobicContact CG1-CB 4.25Å; V50-W107 HydrophobicContact CB-CH2 4.3Å; V50-W107 HydrophobicContact CG1-CH2 4.03Å; V50-W107 HydrophobicContact CG1-CZ3 4.08Å; V50-W107 HydrophobicContact CG2-CH2 4.32Å; V50-K176 PolarHBondContact N-O 3.42Å; V50-N178 PolarHBondContact O-N 3.47Å
51	D	95.3	Very high	94.1	Very high	93 Å²	93	41.3 Å²	41.3	50%	0.497	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	114	172.3	-69.6	-34.3	0	0	0	109.1	N178	D51-N178 WeakPolarHBondContact CA-O 3.41Å; D51-N178 VanDerWaalsContact OD1-CB 3.31Å; D51-N178 WeakPolarHBondContact OD1-CB 3.46Å; D51-N178 PolarHBondContact OD1-ND2 2.89Å
52	V	96	Very high	94.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	114.1	177.5	-179.1	0	0	0	0	107.7	V50 F79 W81 P109 L177 N178 L179 V180	V50-V52 HydrophobicContact CG1-CG2 4Å; V50-V52 PolarHBondContact O-N 3.44Å; V52-F79 HydrophobicContact CG1-CD1 4.16Å; V52-W81 HydrophobicContact CG2-CB 4.25Å; V52-P109 HydrophobicContact CG1-CB 4.35Å; V52-P109 HydrophobicContact CG1-CG 4.04Å; V52-P109 HydrophobicContact CG2-CB 4.03Å; V52-P109 HydrophobicContact CG2-CG 4.36Å; V52-L177 HydrophobicContact CB-CD2 4.49Å; V52-L177 HydrophobicContact CG2-CD1 4.3Å; V52-L177 HydrophobicContact CG2-CD2 4.25Å; V52-L177 HydrophobicContact CG2-CG 4.05Å; V52-N178 PolarHBondContact N-O 2.88Å; V52-L179 HydrophobicContact CB-CD1 4.19Å; V52-L179 HydrophobicContact CG1-CD1 4.09Å; V52-V180 PolarHBondContact O-N 2.91Å
53	T	95.5	Very high	94	Very high	49 Å²	49	45.9 Å²	45.9	30%	0.301	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.9	172.9	-54.4	0	0	0	0	109.3	F79 S80 V180	T53-F79 WeakPolarHBondContact O-CA 3.35Å; T53-S80 PolarHBondContact N-O 3.01Å; T53-S80 PolarHBondContact O-N 2.93Å; T53-V180 CarbonylContact C-O 3.56Å; T53-V180 VanDerWaalsContact CA-O 3.27Å; T53-V180 WeakPolarHBondContact CA-O 3.5Å
54	L	94.9	Very high	94.1	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.9	175.9	178.5	60	0	0	0	110.2	L77 F79 V111 F167 L179 V180 S182 F224	L54-L77 HydrophobicContact CD1-CD2 4.18Å; L54-F79 HydrophobicContact CD1-CD1 3.89Å; L54-F79 HydrophobicContact CD1-CE1 3.61Å; L54-F79 HydrophobicContact CD1-CZ 4.04Å; L54-V111 HydrophobicContact CD2-CG1 4.26Å; L54-F167 HydrophobicContact CD2-CB 3.7Å; L54-F167 HydrophobicContact CD2-CD1 4.49Å; L54-F167 HydrophobicContact CD2-CD2 4.28Å; L54-F167 HydrophobicContact CD2-CG 3.91Å; L54-L179 HydrophobicContact CB-CD1 3.92Å; L54-L179 HydrophobicContact CD2-CD1 4.41Å; L54-L179 HydrophobicContact CD2-CD2 4.34Å; L54-V180 PolarHBondContact N-O 3.21Å; L54-S182 PolarHBondContact O-N 3.32Å; L54-F224 HydrophobicContact CD2-CE2 3.67Å; L54-F224 HydrophobicContact CD2-CZ 4.16Å; L54-F224 HydrophobicContact CG-CE2 3.94Å; L54-F224 HydrophobicContact CG-CZ 3.89Å
55	E	94.1	Very high	94.2	Very high	25 Å²	25	42.2 Å²	42.2	12%	0.117	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.9	174.1	178.4	171.1	-140.5	0	0	108.6	K78	E55-K78 HydrophobicContact CB-CB 4.17Å; E55-K78 PolarHBondContact N-O 2.89Å; E55-K78 PolarHBondContact O-N 2.89Å; E55-K78 WeakPolarHBondContact OE2-CD 3.25Å; E55-K78 WeakPolarHBondContact OE2-CE 3.2Å; E55-K78 IonicContact OE2-NZ 2.7Å; E55-K78 PolarHBondContact OE2-NZ 3.12Å
56	L	94.4	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.9	177.9	-77.8	179.6	0	0	0	110.2	V75 L77 L165 F167 G185 W186 D187 F224	L56-V75 HydrophobicContact CD2-CB 4.38Å; L56-V75 HydrophobicContact CD2-CG2 4.19Å; L56-L77 HydrophobicContact CD2-CD2 3.31Å; L56-L77 HydrophobicContact CD2-CG 3.91Å; L56-L165 HydrophobicContact CD1-CD1 4.09Å; L56-F167 HydrophobicContact CD1-CD2 4.34Å; L56-F167 HydrophobicContact CD1-CE2 3.77Å; L56-F167 HydrophobicContact CD2-CE2 4.18Å; L56-F167 HydrophobicContact CD2-CZ 4.39Å; L56-F167 HydrophobicContact CG-CE2 4.47Å; L56-G185 PolarHBondContact N-O 2.91Å; L56-W186 HydrophobicContact CB-CD2 4.31Å; L56-W186 HydrophobicContact CB-CE3 3.6Å; L56-W186 HydrophobicContact CB-CZ3 3.72Å; L56-W186 HydrophobicContact CD1-CE3 4.36Å; L56-W186 HydrophobicContact CD1-CH2 3.89Å; L56-W186 HydrophobicContact CD1-CZ2 4.38Å; L56-W186 HydrophobicContact CD1-CZ3 3.86Å; L56-W186 HydrophobicContact CG-CZ3 4.43Å; L56-W186 CarbonylContact O-C 3.53Å; L56-W186 WeakPolarHBondContact O-CA 3.35Å; L56-D187 PolarHBondContact O-N 3.46Å; L56-F224 HydrophobicContact CB-CD1 4.03Å; L56-F224 HydrophobicContact CB-CE1 4.07Å; L56-F224 HydrophobicContact CD1-CB 3.44Å; L56-F224 VanDerWaalsContact CD1-CB 3.44Å; L56-F224 HydrophobicContact CD1-CD1 3.51Å; L56-F224 HydrophobicContact CD1-CD2 3.47Å; L56-F224 VanDerWaalsContact CD1-CD2 3.47Å; L56-F224 HydrophobicContact CD1-CE1 4.03Å; L56-F224 HydrophobicContact CD1-CE2 3.98Å; L56-F224 HydrophobicContact CD1-CG 3.19Å; L56-F224 HydrophobicContact CD1-CZ 4.24Å; L56-F224 HydrophobicContact CG-CD1 3.91Å; L56-F224 HydrophobicContact CG-CD2 4.15Å; L56-F224 HydrophobicContact CG-CE1 3.94Å; L56-F224 HydrophobicContact CG-CE2 4.16Å; L56-F224 HydrophobicContact CG-CG 4.02Å; L56-F224 HydrophobicContact CG-CZ 4.07Å
57	I	94.9	Very high	94	Very high	17 Å²	17	42.7 Å²	42.7	9%	0.087	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	115	171.8	-45.5	177.9	0	0	0	107.5	F59 V75 W76 D187	I57-F59 HydrophobicContact CG2-CD2 4.41Å; I57-F59 HydrophobicContact CG2-CE2 4.26Å; I57-V75 CarbonylContact O-C 3.58Å; I57-V75 WeakPolarHBondContact O-CA 3.49Å; I57-W76 HydrophobicContact CB-CB 4.13Å; I57-W76 HydrophobicContact CD1-CB 4.29Å; I57-W76 HydrophobicContact CD1-CE3 4.11Å; I57-W76 HydrophobicContact CG1-CB 4.41Å; I57-W76 PolarHBondContact N-O 3.49Å; I57-W76 PolarHBondContact O-N 3.1Å; I57-D187 WeakPolarHBondContact CA-O 3.42Å; I57-D187 HydrophobicContact CB-CB 4.27Å; I57-D187 HydrophobicContact CG1-CB 3.96Å; I57-D187 HydrophobicContact CG2-CB 4.16Å
58	L	95.8	Very high	93.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	111.9	179.3	-177.7	66.1	0	0	0	109.8	I61 T73 V75 W186 D187 L188 Y191 L199 L226	L58-I61 HydrophobicContact CD2-CG1 4.45Å; L58-T73 HydrophobicContact CD1-CG2 4.34Å; L58-V75 HydrophobicContact CD1-CG1 3.84Å; L58-W186 HydrophobicContact CB-CE3 3.96Å; L58-W186 HydrophobicContact CB-CZ3 3.91Å; L58-W186 HydrophobicContact CD1-CZ3 4.27Å; L58-W186 HydrophobicContact CG-CZ3 4.5Å; L58-D187 PolarHBondContact N-O 3.36Å; L58-L188 HydrophobicContact CB-CD2 3.83Å; L58-L188 HydrophobicContact CD2-CD2 3.93Å; L58-Y191 HydrophobicContact CD2-CD2 3.62Å; L58-Y191 HydrophobicContact CD2-CE2 3.76Å; L58-Y191 HydrophobicContact CD2-CG 4.47Å; L58-Y191 HydrophobicContact CG-CD2 3.79Å; L58-Y191 HydrophobicContact CG-CE2 4.22Å; L58-Y191 WeakPolarHBondContact O-CA 3.32Å; L58-L199 HydrophobicContact CD2-CD2 4.14Å; L58-L226 HydrophobicContact CD1-CD1 4.4Å; L58-L226 HydrophobicContact CD2-CD1 4.15Å; L58-L226 HydrophobicContact CD2-CD2 3.91Å
59	F	94.2	Very high	93.8	Very high	46 Å²	46	38.5 Å²	38.5	20%	0.202	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-49.3	174	-98.6	-98.1	0	0	0	111.8	I57 N74 W76 E190 L192	I57-F59 HydrophobicContact CG2-CD2 4.41Å; I57-F59 HydrophobicContact CG2-CE2 4.26Å; F59-N74 HydrophobicContact CB-CB 4.36Å; F59-N74 WeakPolarHBondContact CB-O 3.45Å; F59-N74 PolarHBondContact N-O 3.42Å; F59-W76 AromaticContact CD2-CD1 3.97Å; F59-W76 HydrophobicContact CD2-CD2 4.09Å; F59-W76 AromaticContact CD2-CE2 3.85Å; F59-W76 HydrophobicContact CD2-CG 4.21Å; F59-W76 HydrophobicContact CD2-CZ2 4.35Å; F59-W76 AromaticContact CD2-NE1 3.73Å; F59-W76 HydrophobicContact CE1-CZ2 4.2Å; F59-W76 AromaticContact CE2-CD2 3.42Å; F59-W76 HydrophobicContact CE2-CD2 3.42Å; F59-W76 VanDerWaalsContact CE2-CD2 3.42Å; F59-W76 AromaticContact CE2-CE2 3.18Å; F59-W76 AromaticContact CE2-CE3 3.77Å; F59-W76 HydrophobicContact CE2-CE3 3.77Å; F59-W76 HydrophobicContact CE2-CG 4Å; F59-W76 AromaticContact CE2-CH2 3.73Å; F59-W76 HydrophobicContact CE2-CH2 3.73Å; F59-W76 AromaticContact CE2-CZ2 3.39Å; F59-W76 HydrophobicContact CE2-CZ2 3.39Å; F59-W76 AromaticContact CE2-CZ3 3.9Å; F59-W76 HydrophobicContact CE2-CZ3 3.9Å; F59-W76 AromaticContact CE2-NE1 3.57Å; F59-W76 HydrophobicContact CZ-CD2 4.21Å; F59-W76 AromaticContact CZ-CE2 3.64Å; F59-W76 HydrophobicContact CZ-CE3 4.38Å; F59-W76 AromaticContact CZ-CH2 3.5Å; F59-W76 HydrophobicContact CZ-CH2 3.5Å; F59-W76 AromaticContact CZ-CZ2 3.28Å; F59-W76 HydrophobicContact CZ-CZ2 3.28Å; F59-W76 HydrophobicContact CZ-CZ3 4.05Å; F59-E190 HydrophobicContact CD1-CB 4.45Å; F59-E190 HydrophobicContact CD2-CB 4.49Å; F59-E190 HydrophobicContact CE1-CB 4.1Å; F59-E190 HydrophobicContact CE2-CB 4.11Å; F59-E190 HydrophobicContact CE2-CG 4.45Å; F59-E190 HydrophobicContact CZ-CB 3.91Å; F59-E190 HydrophobicContact CZ-CG 4.1Å; F59-L192 PolarHBondContact O-N 2.83Å
60	Q	94.9	Very high	93.7	Very high	71 Å²	71	37.6 Å²	37.6	33%	0.332	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	151.7	178.2	57.2	177.9	-7.1	0	0	111.6	V62 N74 L192	Q60-V62 HydrophobicContact CG-CG2 4.02Å; Q60-N74 HydrophobicContact CG-CB 3.74Å; Q60-N74 PolarHBondContact N-O 2.83Å; Q60-N74 PolarHBondContact O-N 2.98Å; Q60-L192 HydrophobicContact CB-CB 4.44Å
61	I	96	Very high	93.7	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.015	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.1	161.8	-59.9	167	0	0	0	106	L58 V64 Y191 N194 L226 I228	L58-I61 HydrophobicContact CD2-CG1 4.45Å; I61-V64 HydrophobicContact CG2-CG2 3.9Å; I61-Y191 HydrophobicContact CD1-CE2 4.42Å; I61-Y191 HydrophobicContact CG1-CE2 4.26Å; I61-N194 PolarHBondContact O-ND2 2.84Å; I61-L226 HydrophobicContact CD1-CD1 4.36Å; I61-L226 HydrophobicContact CG1-CD1 4.29Å; I61-I228 HydrophobicContact CD1-CG2 3.76Å
62	V	94.3	Very high	93.7	Very high	59 Å²	59	35.8 Å²	35.8	36%	0.358	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-49.8	-173.8	177.4	0	0	0	0	110.3	Q60 Q72 N74	Q60-V62 HydrophobicContact CG-CG2 4.02Å; V62-Q72 HydrophobicContact CB-CB 4.2Å; V62-Q72 HydrophobicContact CB-CG 4.05Å; V62-Q72 HydrophobicContact CG1-CG 4.33Å; V62-Q72 PolarHBondContact N-O 3.44Å; V62-N74 HydrophobicContact CG2-CB 4.11Å
63	N	93.8	Very high	93.7	Very high	75 Å²	75	35.8 Å²	35.8	40%	0.401	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	147.5	-179.5	-169.5	25	0	0	0	110.5	Q72	N63-Q72 HydrophobicContact CB-CB 4.39Å; N63-Q72 PolarHBondContact N-O 2.91Å; N63-Q72 PolarHBondContact O-N 2.72Å
64	V	94.2	Very high	93.6	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	105.8	166.9	-179.3	0	0	0	0	105.3	I61 M71 L151 W197 I228	I61-V64 HydrophobicContact CG2-CG2 3.9Å; V64-M71 HydrophobicContact CG2-CG 4.16Å; V64-L151 HydrophobicContact CG1-CD1 3.98Å; V64-L151 HydrophobicContact CG1-CD2 4.07Å; V64-W197 HydrophobicContact CB-CZ2 3.95Å; V64-W197 HydrophobicContact CG1-CZ2 3.97Å; V64-W197 HydrophobicContact CG2-CZ2 4.44Å; V64-I228 HydrophobicContact CG2-CD1 3.83Å
65	D	92.4	Very high	93.6	Very high	52 Å²	52	35.2 Å²	35.2	28%	0.278	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	107.9	-179.3	178.3	-5.4	0	0	0	109.2	K67 S68 Q69 T70	D65-K67 VanDerWaalsContact C-N 3.31Å; D65-K67 PolarHBondContact O-N 3.38Å; D65-K67 WeakPolarHBondContact OD1-CB 3.25Å; D65-K67 PolarHBondContact OD1-N 3.31Å; D65-S68 VanDerWaalsContact CB-OG 3.29Å; D65-S68 WeakPolarHBondContact CB-OG 3.43Å; D65-S68 PolarHBondContact OD1-N 2.86Å; D65-S68 VanDerWaalsContact OD1-N 3.09Å; D65-S68 VanDerWaalsContact OD2-CB 3.23Å; D65-S68 WeakPolarHBondContact OD2-CB 3.26Å; D65-S68 PolarHBondContact OD2-OG 3Å; D65-Q69 WeakPolarHBondContact O-CA 3.34Å; D65-Q69 PolarHBondContact O-N 3.06Å; D65-T70 PolarHBondContact N-O 3.42Å; D65-T70 PolarHBondContact O-N 3.19Å; D65-T70 VanDerWaalsContact O-N 3.11Å
66	E	89.8	Confident	93.6	Very high	29 Å²	29	38.6 Å²	38.6	14%	0.136	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-36.5	-179	-61.3	83.5	174.2	0	0	112.2	Q69 L151 R230 P286	E66-Q69 PolarHBondContact O-N 3.33Å; E66-L151 HydrophobicContact CB-CD1 4.21Å; E66-L151 HydrophobicContact CG-CD1 4.1Å; E66-R230 IonicContact OE1-CZ 3.29Å; E66-R230 IonicContact OE1-NH1 3.8Å; E66-R230 PolarHBondContact OE1-NH1 3.46Å; E66-R230 IonicContact OE1-NH2 2.81Å; E66-R230 PolarHBondContact OE1-NH2 2.78Å; E66-P286 VanDerWaalsContact O-CB 3.26Å; E66-P286 WeakPolarHBondContact O-CB 3.48Å; E66-P286 WeakPolarHBondContact O-CD 3.24Å; E66-P286 WeakPolarHBondContact O-CG 3.43Å
67	K	87.2	Confident	93.6	Very high	142 Å²	142	38.6 Å²	38.6	62%	0.617	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-42.2	-174.9	-176	-178.6	179	180	0	111.3	D65	D65-K67 VanDerWaalsContact C-N 3.31Å; D65-K67 PolarHBondContact O-N 3.38Å; D65-K67 WeakPolarHBondContact OD1-CB 3.25Å; D65-K67 PolarHBondContact OD1-N 3.31Å
68	S	89.6	Confident	93.5	Very high	56 Å²	56	41.1 Å²	41.1	39%	0.392	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-8.8	176.9	70	0	0	0	0	113.6	D65 T70	D65-S68 VanDerWaalsContact CB-OG 3.29Å; D65-S68 WeakPolarHBondContact CB-OG 3.43Å; D65-S68 PolarHBondContact OD1-N 2.86Å; D65-S68 VanDerWaalsContact OD1-N 3.09Å; D65-S68 VanDerWaalsContact OD2-CB 3.23Å; D65-S68 WeakPolarHBondContact OD2-CB 3.26Å; D65-S68 PolarHBondContact OD2-OG 3Å; S68-T70 VanDerWaalsContact C-N 3.34Å; S68-T70 PolarHBondContact OG-OG1 2.85Å
69	Q	91.9	Very high	93.5	Very high	54 Å²	54	41.2 Å²	41.2	25%	0.252	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	45.7	-175.2	-58.8	-169.5	-56.2	0	0	112.1	D65 E66 C149 P286	D65-Q69 WeakPolarHBondContact O-CA 3.34Å; D65-Q69 PolarHBondContact O-N 3.06Å; E66-Q69 PolarHBondContact O-N 3.33Å; Q69-C149 CarbonylContact C-O 3.46Å; Q69-C149 WeakPolarHBondContact CB-O 3.49Å; Q69-C149 PolarHBondContact O-N 3.41Å; Q69-C149 VanDerWaalsContact O-O 3.13Å; Q69-P286 HydrophobicContact CG-CB 4.36Å
70	T	93.8	Very high	93.5	Very high	10 Å²	10	40.2 Å²	40.2	6%	0.061	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.4	-179.7	66.6	0	0	0	0	112.6	D65 S68 V117 S147	D65-T70 PolarHBondContact N-O 3.42Å; D65-T70 PolarHBondContact O-N 3.19Å; D65-T70 VanDerWaalsContact O-N 3.11Å; S68-T70 VanDerWaalsContact C-N 3.34Å; S68-T70 PolarHBondContact OG-OG1 2.85Å; T70-V117 HydrophobicContact CG2-CB 4.18Å; T70-V117 HydrophobicContact CG2-CG1 3.96Å; T70-V117 HydrophobicContact CG2-CG2 4.07Å; T70-S147 CarbonylContact C-O 3.57Å; T70-S147 WeakPolarHBondContact CA-O 3.36Å
71	M	95.4	Very high	93.6	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126	173.3	177.7	-177	72.1	0	0	109.3	V64 T73 Q146 S147 C149 C163 L165 L226	V64-M71 HydrophobicContact CG2-CG 4.16Å; M71-T73 HydrophobicContact CE-CG2 3.77Å; M71-T73 HydrophobicContact CG-CG2 3.97Å; M71-T73 HydrophobicContact SD-CG2 3.96Å; M71-Q146 WeakPolarHBondContact O-CA 3.49Å; M71-S147 PolarHBondContact N-O 3.22Å; M71-S147 PolarHBondContact O-N 2.96Å; M71-S147 PolarHBondContact O-OG 2.59Å; M71-C149 HydrophobicContact CB-CB 4.33Å; M71-C163 HydrophobicContact CB-CB 4.48Å; M71-C163 HydrophobicContact CE-CB 3.72Å; M71-C163 HydrophobicContact SD-CB 3.41Å; M71-C163 WeakPolarHBondContact SD-CB 3.5Å; M71-L165 HydrophobicContact CE-CD2 4.01Å; M71-L165 HydrophobicContact CE-CG 4.25Å; M71-L226 HydrophobicContact CE-CD1 4.15Å; M71-L226 HydrophobicContact SD-CD1 4.12Å
72	Q	94.9	Very high	93.6	Very high	62 Å²	62	42.9 Å²	42.9	29%	0.29	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.8	175.3	-167.1	177.6	18.9	0	0	110.3	V62 N63 I144 L145	V62-Q72 HydrophobicContact CB-CB 4.2Å; V62-Q72 HydrophobicContact CB-CG 4.05Å; V62-Q72 HydrophobicContact CG1-CG 4.33Å; V62-Q72 PolarHBondContact N-O 3.44Å; N63-Q72 HydrophobicContact CB-CB 4.39Å; N63-Q72 PolarHBondContact N-O 2.91Å; N63-Q72 PolarHBondContact O-N 2.72Å; Q72-I144 HydrophobicContact CG-CG2 3.75Å; Q72-I144 VanDerWaalsContact NE2-CG2 3.27Å; Q72-L145 CarbonylContact C-O 3.36Å; Q72-L145 VanDerWaalsContact CA-O 3.29Å; Q72-L145 WeakPolarHBondContact CA-O 3.4Å
73	T	95.2	Very high	93.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.4	-179.5	52.3	0	0	0	0	110.8	L58 M71 I144 L145 L226	L58-T73 HydrophobicContact CD1-CG2 4.34Å; M71-T73 HydrophobicContact CE-CG2 3.77Å; M71-T73 HydrophobicContact CG-CG2 3.97Å; M71-T73 HydrophobicContact SD-CG2 3.96Å; T73-I144 WeakPolarHBondContact O-CA 3.36Å; T73-L145 PolarHBondContact N-O 2.9Å; T73-L145 PolarHBondContact O-N 3.44Å; T73-L226 HydrophobicContact CG2-CD1 4.19Å
74	N	94.6	Very high	93.6	Very high	36 Å²	36	41.3 Å²	41.3	19%	0.193	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	113.4	168.2	-176.7	14.4	0	0	0	107.8	F59 Q60 V62	F59-N74 HydrophobicContact CB-CB 4.36Å; F59-N74 WeakPolarHBondContact CB-O 3.45Å; F59-N74 PolarHBondContact N-O 3.42Å; Q60-N74 HydrophobicContact CG-CB 3.74Å; Q60-N74 PolarHBondContact N-O 2.83Å; Q60-N74 PolarHBondContact O-N 2.98Å; V62-N74 HydrophobicContact CG2-CB 4.11Å
75	V	94.9	Very high	93.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	152.8	-174.6	-59.1	0	0	0	0	111.2	L56 I57 L58 A143 L145 W186	L56-V75 HydrophobicContact CD2-CB 4.38Å; L56-V75 HydrophobicContact CD2-CG2 4.19Å; I57-V75 CarbonylContact O-C 3.58Å; I57-V75 WeakPolarHBondContact O-CA 3.49Å; L58-V75 HydrophobicContact CD1-CG1 3.84Å; V75-A143 PolarHBondContact N-O 3.21Å; V75-A143 PolarHBondContact O-N 3.39Å; V75-A143 VanDerWaalsContact O-O 3.09Å; V75-L145 HydrophobicContact CG2-CD1 3.38Å; V75-L145 HydrophobicContact CG2-CG 3.86Å; V75-W186 HydrophobicContact CG1-CZ3 4.4Å
76	W	94.1	Very high	93.6	Very high	97 Å²	97	41.8 Å²	41.8	37%	0.367	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.3	163.4	-59.9	-2.7	0	0	0	109.1	I57 F59 I140 P142	I57-W76 HydrophobicContact CB-CB 4.13Å; I57-W76 HydrophobicContact CD1-CB 4.29Å; I57-W76 HydrophobicContact CD1-CE3 4.11Å; I57-W76 HydrophobicContact CG1-CB 4.41Å; I57-W76 PolarHBondContact N-O 3.49Å; I57-W76 PolarHBondContact O-N 3.1Å; F59-W76 AromaticContact CD2-CD1 3.97Å; F59-W76 HydrophobicContact CD2-CD2 4.09Å; F59-W76 AromaticContact CD2-CE2 3.85Å; F59-W76 HydrophobicContact CD2-CG 4.21Å; F59-W76 HydrophobicContact CD2-CZ2 4.35Å; F59-W76 AromaticContact CD2-NE1 3.73Å; F59-W76 HydrophobicContact CE1-CZ2 4.2Å; F59-W76 AromaticContact CE2-CD2 3.42Å; F59-W76 HydrophobicContact CE2-CD2 3.42Å; F59-W76 VanDerWaalsContact CE2-CD2 3.42Å; F59-W76 AromaticContact CE2-CE2 3.18Å; F59-W76 AromaticContact CE2-CE3 3.77Å; F59-W76 HydrophobicContact CE2-CE3 3.77Å; F59-W76 HydrophobicContact CE2-CG 4Å; F59-W76 AromaticContact CE2-CH2 3.73Å; F59-W76 HydrophobicContact CE2-CH2 3.73Å; F59-W76 AromaticContact CE2-CZ2 3.39Å; F59-W76 HydrophobicContact CE2-CZ2 3.39Å; F59-W76 AromaticContact CE2-CZ3 3.9Å; F59-W76 HydrophobicContact CE2-CZ3 3.9Å; F59-W76 AromaticContact CE2-NE1 3.57Å; F59-W76 HydrophobicContact CZ-CD2 4.21Å; F59-W76 AromaticContact CZ-CE2 3.64Å; F59-W76 HydrophobicContact CZ-CE3 4.38Å; F59-W76 AromaticContact CZ-CH2 3.5Å; F59-W76 HydrophobicContact CZ-CH2 3.5Å; F59-W76 AromaticContact CZ-CZ2 3.28Å; F59-W76 HydrophobicContact CZ-CZ2 3.28Å; F59-W76 HydrophobicContact CZ-CZ3 4.05Å; W76-I140 HydrophobicContact CB-CG2 3.92Å; W76-I140 HydrophobicContact CE3-CG2 4.3Å; W76-P142 VanDerWaalsContact CD1-CB 3.44Å; W76-P142 HydrophobicContact CG-CB 4.3Å
77	L	93.1	Very high	93.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	106.7	-179.3	-69.4	146.3	0	0	0	108.5	L54 L56 F79 Y124 I140 P141 A143 F167	L54-L77 HydrophobicContact CD1-CD2 4.18Å; L56-L77 HydrophobicContact CD2-CD2 3.31Å; L56-L77 HydrophobicContact CD2-CG 3.91Å; L77-F79 HydrophobicContact CB-CD2 4.24Å; L77-F79 HydrophobicContact CB-CE2 3.56Å; L77-F79 HydrophobicContact CB-CZ 4.06Å; L77-F79 HydrophobicContact CD2-CZ 4.31Å; L77-F79 HydrophobicContact CG-CE2 4.49Å; L77-Y124 HydrophobicContact CD1-CD1 3.51Å; L77-Y124 HydrophobicContact CD1-CE1 3.13Å; L77-Y124 HydrophobicContact CD1-CG 4.41Å; L77-I140 WeakPolarHBondContact O-CA 3.41Å; L77-P141 HydrophobicContact CB-CG 4.27Å; L77-P141 PolarHBondContact N-O 2.86Å; L77-P141 WeakPolarHBondContact O-CD 3.5Å; L77-A143 HydrophobicContact CD1-CB 3.87Å; L77-F167 HydrophobicContact CD2-CD1 4.37Å; L77-F167 HydrophobicContact CD2-CE1 3.6Å; L77-F167 HydrophobicContact CD2-CE2 4.23Å; L77-F167 HydrophobicContact CD2-CZ 3.51Å
78	K	94	Very high	94.2	Very high	70 Å²	70	41.3 Å²	41.3	30%	0.304	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	105.1	178	176	171	165.3	-150.3	0	109.6	E55 I140	E55-K78 HydrophobicContact CB-CB 4.17Å; E55-K78 PolarHBondContact N-O 2.89Å; E55-K78 PolarHBondContact O-N 2.89Å; E55-K78 WeakPolarHBondContact OE2-CD 3.25Å; E55-K78 WeakPolarHBondContact OE2-CE 3.2Å; E55-K78 IonicContact OE2-NZ 2.7Å; E55-K78 PolarHBondContact OE2-NZ 3.12Å; K78-I140 HydrophobicContact CB-CG1 4.14Å; K78-I140 HydrophobicContact CB-CG2 4.46Å; K78-I140 HydrophobicContact CD-CD1 4.06Å; K78-I140 HydrophobicContact CD-CG1 4.47Å; K78-I140 HydrophobicContact CG-CD1 4.13Å; K78-I140 HydrophobicContact CG-CG1 3.99Å
79	F	94.8	Very high	94.5	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.2	171	-59.6	-82.2	0	0	0	109.7	V52 T53 L54 L77 W81 P109 V111 S138 W139 P141	V52-F79 HydrophobicContact CG1-CD1 4.16Å; T53-F79 WeakPolarHBondContact O-CA 3.35Å; L54-F79 HydrophobicContact CD1-CD1 3.89Å; L54-F79 HydrophobicContact CD1-CE1 3.61Å; L54-F79 HydrophobicContact CD1-CZ 4.04Å; L77-F79 HydrophobicContact CB-CD2 4.24Å; L77-F79 HydrophobicContact CB-CE2 3.56Å; L77-F79 HydrophobicContact CB-CZ 4.06Å; L77-F79 HydrophobicContact CD2-CZ 4.31Å; L77-F79 HydrophobicContact CG-CE2 4.49Å; F79-W81 HydrophobicContact CB-CE3 4.13Å; F79-W81 HydrophobicContact CB-CZ3 3.84Å; F79-P109 HydrophobicContact CD1-CG 4.35Å; F79-V111 HydrophobicContact CE1-CB 3.71Å; F79-V111 HydrophobicContact CE1-CG1 3.92Å; F79-V111 HydrophobicContact CE1-CG2 4.19Å; F79-V111 HydrophobicContact CZ-CB 4.3Å; F79-V111 HydrophobicContact CZ-CG1 4.45Å; F79-S138 WeakPolarHBondContact O-CA 3.49Å; F79-W139 HydrophobicContact CB-CB 4.38Å; F79-W139 HydrophobicContact CD2-CD2 4.28Å; F79-W139 AromaticContact CD2-CE3 3.59Å; F79-W139 HydrophobicContact CD2-CE3 3.59Å; F79-W139 HydrophobicContact CD2-CZ3 4.07Å; F79-W139 HydrophobicContact CE2-CE3 4.09Å; F79-W139 HydrophobicContact CE2-CZ3 4.1Å; F79-W139 HydrophobicContact CG-CE3 4.21Å; F79-W139 PolarHBondContact N-O 2.68Å; F79-W139 PolarHBondContact O-N 2.97Å; F79-P141 HydrophobicContact CD2-CG 4.4Å; F79-P141 HydrophobicContact CE2-CG 4.14Å
80	S	95.5	Very high	94.6	Very high	25 Å²	25	38.9 Å²	38.9	18%	0.175	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125	171.8	-176.5	0	0	0	0	110.4	T53 Q136 I137	T53-S80 PolarHBondContact N-O 3.01Å; T53-S80 PolarHBondContact O-N 2.93Å; S80-Q136 PolarHBondContact OG-NE2 3.11Å; S80-I137 VanDerWaalsContact CA-O 3.29Å; S80-I137 WeakPolarHBondContact CA-O 3.44Å
81	W	95.9	Very high	94.5	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	174.5	174.8	71.1	98.8	0	0	0	110.2	V50 V52 F79 W107 V129 I137 W139	V50-W81 HydrophobicContact CG1-CB 4.25Å; V52-W81 HydrophobicContact CG2-CB 4.25Å; F79-W81 HydrophobicContact CB-CE3 4.13Å; F79-W81 HydrophobicContact CB-CZ3 3.84Å; W81-W107 AromaticContact CD1-CZ3 3.91Å; W81-W107 HydrophobicContact CG-CZ3 4.34Å; W81-W107 WeakPolarHBondContact CZ2-O 3.33Å; W81-W107 AromaticContact NE1-CE3 3.73Å; W81-W107 AromaticContact NE1-CZ3 3.84Å; W81-V129 HydrophobicContact CH2-CG1 4.33Å; W81-I137 HydrophobicContact CD2-CB 4.04Å; W81-I137 HydrophobicContact CD2-CG2 4.13Å; W81-I137 HydrophobicContact CE3-CB 4.41Å; W81-I137 HydrophobicContact CE3-CG2 4.2Å; W81-I137 HydrophobicContact CH2-CB 4.44Å; W81-I137 HydrophobicContact CH2-CG2 3.5Å; W81-I137 VanDerWaalsContact CH2-CG2 3.5Å; W81-I137 HydrophobicContact CZ2-CB 4.08Å; W81-I137 HydrophobicContact CZ2-CD1 4.19Å; W81-I137 HydrophobicContact CZ2-CG2 3.4Å; W81-I137 VanDerWaalsContact CZ2-CG2 3.4Å; W81-I137 HydrophobicContact CZ3-CG2 3.9Å; W81-I137 PolarHBondContact N-O 3.41Å; W81-I137 PolarHBondContact O-N 3.38Å; W81-W139 HydrophobicContact CH2-CB 4.03Å; W81-W139 HydrophobicContact CZ3-CB 3.86Å
82	Q	95.9	Very high	94.3	Very high	127 Å²	127	53.4 Å²	53.4	59%	0.593	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	141.3	175.4	-67.7	-175.3	-0.6	0	0	111	S135	Q82-S135 CarbonylContact C-O 3.48Å; Q82-S135 VanDerWaalsContact CA-O 3.26Å; Q82-S135 WeakPolarHBondContact CA-O 3.28Å
83	D	95.8	Very high	94.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	107.7	173.9	-169.8	-20.6	0	0	0	112.4	Y36 P42 N85 L86 S135 I137	Y36-D83 WeakPolarHBondContact CE2-OD2 3.48Å; Y36-D83 PolarHBondContact OH-OD2 2.87Å; P42-D83 HydrophobicContact CB-CB 3.76Å; P42-D83 VanDerWaalsContact CB-OD1 3.26Å; P42-D83 WeakPolarHBondContact CB-OD1 3.47Å; P42-D83 HydrophobicContact CG-CB 4.36Å; D83-N85 PolarHBondContact O-N 3.29Å; D83-N85 VanDerWaalsContact O-N 3.17Å; D83-N85 WeakPolarHBondContact OD1-CB 3.31Å; D83-N85 PolarHBondContact OD1-N 3.39Å; D83-L86 HydrophobicContact CB-CB 4.28Å; D83-L86 HydrophobicContact CB-CD1 4.25Å; D83-L86 HydrophobicContact CB-CG 4.37Å; D83-L86 PolarHBondContact O-N 3Å; D83-S135 PolarHBondContact N-O 3.14Å; D83-S135 WeakPolarHBondContact O-CB 3.22Å; D83-I137 HydrophobicContact CB-CD1 3.49Å; D83-I137 VanDerWaalsContact CB-CD1 3.49Å; D83-I137 HydrophobicContact CB-CG1 4.36Å
84	Y	92.8	Very high	93.9	Very high	101 Å²	101	54.6 Å²	54.6	40%	0.396	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	-23.1	-175.9	80	-86.3	0	0	0	113.6	V43 L86	V43-Y84 VanDerWaalsContact O-CE1 3.23Å; V43-Y84 WeakPolarHBondContact O-CE1 3.5Å; Y84-L86 VanDerWaalsContact C-N 3.31Å
85	N	92.7	Very high	93.7	Very high	64 Å²	64	55.1 Å²	55.1	34%	0.342	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-21.7	176.7	-68.8	-50.9	0	0	0	112.1	Y36 D83 K87	Y36-N85 HydrophobicContact CD2-CB 3.89Å; Y36-N85 HydrophobicContact CE2-CB 3.83Å; D83-N85 PolarHBondContact O-N 3.29Å; D83-N85 VanDerWaalsContact O-N 3.17Å; D83-N85 WeakPolarHBondContact OD1-CB 3.31Å; D83-N85 PolarHBondContact OD1-N 3.39Å; N85-K87 PolarHBondContact O-N 2.77Å
86	L	94.3	Very high	93.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	57	-175.1	-62.2	177.5	0	0	0	111.3	L32 Y36 D83 Y84 I106 V131 I137	L32-L86 HydrophobicContact CB-CD2 4.06Å; L32-L86 HydrophobicContact CD2-CD2 4.49Å; Y36-L86 HydrophobicContact CD2-CD2 3.99Å; Y36-L86 HydrophobicContact CD2-CG 4.3Å; Y36-L86 HydrophobicContact CE2-CD1 4.03Å; Y36-L86 HydrophobicContact CE2-CD2 4.02Å; Y36-L86 HydrophobicContact CE2-CG 3.83Å; D83-L86 HydrophobicContact CB-CB 4.28Å; D83-L86 HydrophobicContact CB-CD1 4.25Å; D83-L86 HydrophobicContact CB-CG 4.37Å; D83-L86 PolarHBondContact O-N 3Å; Y84-L86 VanDerWaalsContact C-N 3.31Å; L86-I106 HydrophobicContact CD1-CB 4.3Å; L86-I106 HydrophobicContact CD1-CG2 3.87Å; L86-V131 HydrophobicContact CB-CG1 3.87Å; L86-V131 HydrophobicContact CD1-CG1 4.42Å; L86-V131 HydrophobicContact CD1-CG2 4.5Å; L86-I137 HydrophobicContact CD1-CD1 3.68Å
87	K	94.1	Very high	93.6	Very high	142 Å²	142	55.4 Å²	55.4	62%	0.617	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.7	-179.9	-174.6	-178.1	177	179.3	0	110.4	N85 H133	N85-K87 PolarHBondContact O-N 2.77Å; K87-H133 WeakPolarHBondContact CG-O 3.39Å
88	W	94.8	Very high	93.7	Very high	18 Å²	18	57 Å²	57	7%	0.068	30%	0.301	C	S	.	.			trans	-146.1	164.5	174.9	68.2	98.7	0	0	0	111.3	L28 L32 Y93 L96 I99 V131 H133	L28-W88 HydrophobicContact CD1-CB 3.79Å; L28-W88 HydrophobicContact CD1-CD2 3.84Å; L28-W88 HydrophobicContact CD1-CE3 4.34Å; L28-W88 HydrophobicContact CD1-CG 3.58Å; L28-W88 HydrophobicContact CD2-CD2 3.94Å; L28-W88 HydrophobicContact CD2-CG 4.18Å; L28-W88 HydrophobicContact CD2-CZ2 3.94Å; L28-W88 HydrophobicContact CG-CD2 4.46Å; L32-W88 HydrophobicContact CD1-CE3 3.82Å; L32-W88 HydrophobicContact CD1-CZ3 4Å; L32-W88 HydrophobicContact CD2-CE3 4.35Å; W88-Y93 HydrophobicContact CB-CD2 4.16Å; W88-Y93 HydrophobicContact CB-CE2 4.07Å; W88-Y93 AromaticContact CD1-CD2 3.9Å; W88-Y93 HydrophobicContact CG-CD2 4.32Å; W88-L96 PolarHBondContact NE1-O 3.24Å; W88-I99 HydrophobicContact CH2-CD1 4.46Å; W88-I99 HydrophobicContact CH2-CG1 4.05Å; W88-V131 HydrophobicContact CH2-CG1 4.3Å; W88-V131 WeakPolarHBondContact CH2-O 3.21Å; W88-V131 HydrophobicContact CZ3-CG1 3.88Å; W88-H133 HydrophobicContact CD2-CB 3.93Å; W88-H133 VanDerWaalsContact CE2-CB 3.47Å; W88-H133 HydrophobicContact CE3-CB 4.44Å; W88-H133 HydrophobicContact CG-CB 4.41Å; W88-H133 HydrophobicContact CH2-CB 4.23Å; W88-H133 VanDerWaalsContact CH2-N 3.28Å; W88-H133 HydrophobicContact CZ2-CB 3.66Å; W88-H133 PolarHBondContact N-O 2.91Å
89	S	95.5	Very high	93.7	Very high	32 Å²	32	53.9 Å²	53.9	22%	0.224	29%	0.288	C	S	.	.			trans	-90.1	122.5	167.4	-172.1	0	0	0	0	109.5	E91 E92	S89-E91 PolarHBondContact O-N 3.43Å; S89-E91 VanDerWaalsContact O-N 3.1Å; S89-E91 PolarHBondContact OG-OE2 3.16Å; S89-E92 PolarHBondContact O-N 3.05Å; S89-E92 VanDerWaalsContact O-N 3.1Å
90	P	94	Very high	93.7	Very high	27 Å²	27	59.9 Å²	59.9	18%	0.175	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-54.3	-29.9	175.7	-28	36.2	0	0	0	113.2	E92 Y93 G95 L96 H133	P90-E92 PolarHBondContact O-N 3.37Å; P90-Y93 CarbonylContact O-C 3.57Å; P90-Y93 PolarHBondContact O-N 3.36Å; P90-G95 VanDerWaalsContact O-CA 3.26Å; P90-G95 WeakPolarHBondContact O-CA 3.48Å; P90-G95 PolarHBondContact O-N 3.37Å; P90-L96 WeakPolarHBondContact CB-O 3.45Å; P90-H133 HydrophobicContact CG-CB 3.84Å
91	E	92.7	Very high	93.7	Very high	175 Å²	175	58.8 Å²	58.8	82%	0.818	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-61.8	-30.3	-179.6	-62.9	149.1	-179.4	0	0	112.9	S89	S89-E91 PolarHBondContact O-N 3.43Å; S89-E91 VanDerWaalsContact O-N 3.1Å; S89-E91 PolarHBondContact OG-OE2 3.16Å
92	E	91.5	Very high	93.6	Very high	140 Å²	140	60.5 Å²	60.5	65%	0.654	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-82.2	-22	-178.9	-66.3	176.9	-175	0	0	112.6	S89 P90	S89-E92 PolarHBondContact O-N 3.05Å; S89-E92 VanDerWaalsContact O-N 3.1Å; P90-E92 PolarHBondContact O-N 3.37Å
93	Y	92.5	Very high	93.4	Very high	35 Å²	35	54.6 Å²	54.6	14%	0.137	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	43.4	-171.3	-64.8	-83.7	0	0	0	112.2	Q27 L28 D31 W88 P90 G95 L96	Q27-Y93 HydrophobicContact CB-CE1 4.48Å; L28-Y93 HydrophobicContact CB-CD1 3.58Å; L28-Y93 HydrophobicContact CB-CE1 3.89Å; L28-Y93 HydrophobicContact CB-CG 4.05Å; L28-Y93 HydrophobicContact CD1-CD1 4.02Å; L28-Y93 HydrophobicContact CD1-CD2 3.78Å; L28-Y93 HydrophobicContact CD1-CE1 3.99Å; L28-Y93 HydrophobicContact CD1-CE2 3.76Å; L28-Y93 HydrophobicContact CD1-CG 3.9Å; L28-Y93 HydrophobicContact CD2-CG 4.47Å; L28-Y93 HydrophobicContact CG-CD1 4.31Å; L28-Y93 HydrophobicContact CG-CG 4.36Å; D31-Y93 PolarHBondContact OD2-OH 3.37Å; W88-Y93 HydrophobicContact CB-CD2 4.16Å; W88-Y93 HydrophobicContact CB-CE2 4.07Å; W88-Y93 AromaticContact CD1-CD2 3.9Å; W88-Y93 HydrophobicContact CG-CD2 4.32Å; P90-Y93 CarbonylContact O-C 3.57Å; P90-Y93 PolarHBondContact O-N 3.36Å; Y93-G95 VanDerWaalsContact C-N 3.28Å; Y93-G95 PolarHBondContact O-N 3.04Å; Y93-L96 WeakPolarHBondContact O-CB 2.8Å; Y93-L96 WeakPolarHBondContact O-CD1 3.41Å; Y93-L96 VanDerWaalsContact O-CG 3.26Å; Y93-L96 WeakPolarHBondContact O-CG 3.4Å; Y93-L96 PolarHBondContact O-N 2.8Å
94	G	87.3	Confident	93.2	Very high	52 Å²	52	59.9 Å²	59.9	54%	0.536	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	19.7	171.2	0	0	0	0	0	115.4
95	G	91.5	Very high	93.3	Very high	47 Å²	47	60.1 Å²	60.1	49%	0.485	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	12.4	-178	0	0	0	0	0	114.5	P90 Y93 T97	P90-G95 VanDerWaalsContact O-CA 3.26Å; P90-G95 WeakPolarHBondContact O-CA 3.48Å; P90-G95 PolarHBondContact O-N 3.37Å; Y93-G95 VanDerWaalsContact C-N 3.28Å; Y93-G95 PolarHBondContact O-N 3.04Å; G95-T97 PolarHBondContact O-N 3.32Å
96	L	92.1	Very high	93.4	Very high	33 Å²	33	57.1 Å²	57.1	17%	0.173	30%	0.299	C	S	.	.			trans	-63.7	118.9	177.8	-73.1	170.1	0	0	0	111.5	H24 E25 L28 W88 P90 Y93	H24-L96 HydrophobicContact CB-CD1 3.93Å; E25-L96 VanDerWaalsContact CA-CD1 3.48Å; E25-L96 HydrophobicContact CB-CD1 3.87Å; L28-L96 HydrophobicContact CD2-CB 4.29Å; L28-L96 HydrophobicContact CD2-CD1 4.19Å; W88-L96 PolarHBondContact NE1-O 3.24Å; P90-L96 WeakPolarHBondContact CB-O 3.45Å; Y93-L96 WeakPolarHBondContact O-CB 2.8Å; Y93-L96 WeakPolarHBondContact O-CD1 3.41Å; Y93-L96 VanDerWaalsContact O-CG 3.26Å; Y93-L96 WeakPolarHBondContact O-CG 3.4Å; Y93-L96 PolarHBondContact O-N 2.8Å
97	T	94.5	Very high	93.4	Very high	70 Å²	70	57.4 Å²	57.4	43%	0.429	30%	0.3	S	S	.	.			trans	-94.2	-24.6	178.8	46.5	0	0	0	0	113.6	G95 H133	G95-T97 PolarHBondContact O-N 3.32Å; T97-H133 PolarHBondContact O-CD2 3.22Å; T97-H133 PolarHBondContact O-N 2.89Å
98	D	95.1	Very high	93.4	Very high	34 Å²	34	54.6 Å²	54.6	18%	0.182	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	150.5	-173.8	56.4	-74.6	0	0	0	111.6	R100 I130 V131 Y132	D98-R100 IonicContact OD2-CZ 2.94Å; D98-R100 IonicContact OD2-NH1 2.77Å; D98-R100 PolarHBondContact OD2-NH1 3.24Å; D98-R100 IonicContact OD2-NH2 2.74Å; D98-R100 PolarHBondContact OD2-NH2 3.43Å; D98-I130 HydrophobicContact CB-CG2 4.31Å; D98-V131 CarbonylContact C-O 3.55Å; D98-V131 WeakPolarHBondContact CA-O 3.45Å; D98-Y132 HydrophobicContact CB-CD1 3.85Å; D98-Y132 HydrophobicContact CB-CE1 4.12Å
99	I	94.6	Very high	93.4	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	159.2	178.4	61.5	174.4	0	0	0	110.8	E25 L28 L32 W88 I101 V131	E25-I99 HydrophobicContact CG-CG2 4.28Å; L28-I99 HydrophobicContact CD2-CD1 4.38Å; L28-I99 HydrophobicContact CD2-CG2 3.6Å; L28-I99 HydrophobicContact CG-CD1 4.35Å; L28-I99 HydrophobicContact CG-CG2 4.45Å; L32-I99 HydrophobicContact CD1-CD1 3.47Å; L32-I99 VanDerWaalsContact CD1-CD1 3.47Å; W88-I99 HydrophobicContact CH2-CD1 4.46Å; W88-I99 HydrophobicContact CH2-CG1 4.05Å; I99-I101 HydrophobicContact CD1-CD1 3.6Å; I99-I101 HydrophobicContact CD1-CG1 4.02Å; I99-I101 HydrophobicContact CG1-CD1 4.18Å; I99-I101 HydrophobicContact CG1-CG1 4.27Å; I99-V131 HydrophobicContact CG1-CB 4.09Å; I99-V131 PolarHBondContact N-O 3.49Å; I99-V131 PolarHBondContact O-N 3.19Å
100	R	95.2	Very high	93.2	Very high	127 Å²	127	54.4 Å²	54.4	48%	0.479	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	118.2	178.1	-71.8	83.9	-175.8	152.6	12.5	110.2	D98 N128 V129	D98-R100 IonicContact OD2-CZ 2.94Å; D98-R100 IonicContact OD2-NH1 2.77Å; D98-R100 PolarHBondContact OD2-NH1 3.24Å; D98-R100 IonicContact OD2-NH2 2.74Å; D98-R100 PolarHBondContact OD2-NH2 3.43Å; R100-N128 HydrophobicContact CB-CB 4.19Å; R100-V129 CarbonylContact C-O 3.56Å; R100-V129 WeakPolarHBondContact CA-O 3.46Å
101	I	94	Very high	93.1	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.015	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.4	179.9	-62.4	172.1	0	0	0	109.6	L33 I99 K105 I106 V129 V131	L33-I101 HydrophobicContact CD2-CD1 4.44Å; I99-I101 HydrophobicContact CD1-CD1 3.6Å; I99-I101 HydrophobicContact CD1-CG1 4.02Å; I99-I101 HydrophobicContact CG1-CD1 4.18Å; I99-I101 HydrophobicContact CG1-CG1 4.27Å; I101-K105 HydrophobicContact CG2-CB 3.89Å; I101-I106 HydrophobicContact CD1-CG2 4.45Å; I101-I106 HydrophobicContact CG2-CG2 3.82Å; I101-V129 PolarHBondContact N-O 2.95Å; I101-V129 WeakPolarHBondContact O-CB 3.3Å; I101-V129 PolarHBondContact O-N 3.3Å; I101-V131 HydrophobicContact CD1-CG2 4.12Å
102	P	94.2	Very high	93.1	Very high	40 Å²	40	46.3 Å²	46.3	26%	0.26	25%	0.246	S	C	.	.			trans	-57.5	138.5	172.1	-25.8	34.6	0	0	0	112.3	E104 K105	P102-E104 WeakPolarHBondContact CB-OE2 3.38Å; P102-E104 PolarHBondContact O-N 2.93Å; P102-K105 PolarHBondContact O-N 3.34Å
103	P	92.5	Very high	93.2	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.019	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.9	-174.4	25.8	-33.7	0	0	0	114	K105 K108 S127 V129 W139	P103-K105 VanDerWaalsContact C-N 3.33Å; P103-K108 HydrophobicContact CB-CD 4.24Å; P103-S127 WeakPolarHBondContact CD-O 3.43Å; P103-S127 WeakPolarHBondContact CG-O 3.44Å; P103-V129 HydrophobicContact CB-CG2 3.77Å; P103-W139 HydrophobicContact CB-CZ2 4.19Å
104	E	92.2	Very high	93.3	Very high	110 Å²	110	40.9 Å²	40.9	51%	0.514	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.6	176.2	-56.7	73.7	-156.9	0	0	113.3	I38 P102	I38-E104 WeakPolarHBondContact CD1-O 3.48Å; P102-E104 WeakPolarHBondContact CB-OE2 3.38Å; P102-E104 PolarHBondContact O-N 2.93Å
105	K	93.7	Very high	93.6	Very high	106 Å²	106	39.9 Å²	39.9	46%	0.461	20%	0.203	S	C	.	.	S	Bend	trans	-95.9	-10.2	-175.8	-66.6	-169	179.1	-177	0	114.3	L33 I38 I101 P102 P103	L33-K105 HydrophobicContact CD1-CD 3.99Å; L33-K105 HydrophobicContact CD2-CB 4.44Å; I38-K105 WeakPolarHBondContact CG1-O 3.48Å; I101-K105 HydrophobicContact CG2-CB 3.89Å; P102-K105 PolarHBondContact O-N 3.34Å; P103-K105 VanDerWaalsContact C-N 3.33Å
106	I	94.7	Very high	93.7	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.185	C	C	.	.	S	Bend	trans	-130.6	162	-178	61.3	172.4	0	0	0	110.2	L33 Y36 L86 I101 K108 V129 V131 I137	L33-I106 HydrophobicContact CD2-CG2 4.04Å; Y36-I106 HydrophobicContact CE1-CB 4.16Å; Y36-I106 HydrophobicContact CE1-CG2 4.41Å; L86-I106 HydrophobicContact CD1-CB 4.3Å; L86-I106 HydrophobicContact CD1-CG2 3.87Å; I101-I106 HydrophobicContact CD1-CG2 4.45Å; I101-I106 HydrophobicContact CG2-CG2 3.82Å; I106-K108 PolarHBondContact O-N 3.45Å; I106-V129 HydrophobicContact CD1-CB 3.95Å; I106-V129 HydrophobicContact CD1-CG1 3.82Å; I106-V129 HydrophobicContact CD1-CG2 4.08Å; I106-V131 HydrophobicContact CD1-CG2 4.36Å; I106-I137 HydrophobicContact CD1-CD1 4.42Å
107	W	95.6	Very high	93.6	Very high	7 Å²	7	40.4 Å²	40.4	3%	0.027	20%	0.197	C	C	.	.			trans	-63.1	136.3	173.2	-179.4	92.3	0	0	0	109.4	Y36 E40 R41 P42 V50 W81 P109 Y172 L177	Y36-W107 WeakPolarHBondContact OH-CB 3.38Å; Y36-W107 PolarHBondContact OH-N 2.94Å; E40-W107 VanDerWaalsContact O-CD1 3.27Å; R41-W107 HydrophobicContact CG-CZ2 4.12Å; P42-W107 VanDerWaalsContact CD-CE3 3.42Å; P42-W107 HydrophobicContact CG-CD2 4.11Å; P42-W107 HydrophobicContact CG-CE3 3.62Å; P42-W107 HydrophobicContact CG-CZ3 3.95Å; V50-W107 HydrophobicContact CB-CH2 4.3Å; V50-W107 HydrophobicContact CG1-CH2 4.03Å; V50-W107 HydrophobicContact CG1-CZ3 4.08Å; V50-W107 HydrophobicContact CG2-CH2 4.32Å; W81-W107 AromaticContact CD1-CZ3 3.91Å; W81-W107 HydrophobicContact CG-CZ3 4.34Å; W81-W107 WeakPolarHBondContact CZ2-O 3.33Å; W81-W107 AromaticContact NE1-CE3 3.73Å; W81-W107 AromaticContact NE1-CZ3 3.84Å; W107-P109 HydrophobicContact CH2-CB 3.87Å; W107-P109 HydrophobicContact CZ3-CB 4.23Å; W107-Y172 HydrophobicContact CZ2-CE2 4.19Å; W107-L177 HydrophobicContact CH2-CD1 4.27Å; W107-L177 HydrophobicContact CZ2-CD1 4.47Å
108	K	93.4	Very high	93.1	Very high	83 Å²	83	39 Å²	39	36%	0.361	19%	0.187	S	C	.	.			trans	-133.3	146.6	174	68.4	-177.3	179.6	-174.7	0	109.9	P103 I106 W139	P103-K108 HydrophobicContact CB-CD 4.24Å; I106-K108 PolarHBondContact O-N 3.45Å; K108-W139 HydrophobicContact CD-CH2 4.08Å; K108-W139 HydrophobicContact CD-CZ3 4.27Å
109	P	94.3	Very high	92.3	Very high	9 Å²	9	42.1 Å²	42.1	6%	0.058	21%	0.212	C	C	.	.			trans	-70.2	145	179	31	-36.2	0	0	0	111.2	V52 F79 W107 V111 L177	V52-P109 HydrophobicContact CG1-CB 4.35Å; V52-P109 HydrophobicContact CG1-CG 4.04Å; V52-P109 HydrophobicContact CG2-CB 4.03Å; V52-P109 HydrophobicContact CG2-CG 4.36Å; F79-P109 HydrophobicContact CD1-CG 4.35Å; W107-P109 HydrophobicContact CH2-CB 3.87Å; W107-P109 HydrophobicContact CZ3-CB 4.23Å; P109-V111 HydrophobicContact CB-CG2 4.14Å; P109-V111 PolarHBondContact O-N 2.9Å; P109-V111 VanDerWaalsContact O-N 3.16Å; P109-L177 HydrophobicContact CB-CD1 3.81Å
110	D	91.8	Very high	91.5	Very high	37 Å²	37	46.9 Å²	46.9	20%	0.198	24%	0.237	C	C	.	.			trans	-88.7	45	179.8	67.2	-28.7	0	0	0	112.1	I112 S169 W170 T171 Y172	D110-I112 PolarHBondContact O-N 3.15Å; D110-S169 PolarHBondContact OD1-OG 3.35Å; D110-W170 PolarHBondContact O-N 3.48Å; D110-W170 PolarHBondContact OD2-N 3.47Å; D110-T171 WeakPolarHBondContact OD2-CB 3.23Å; D110-T171 PolarHBondContact OD2-N 3.24Å; D110-T171 PolarHBondContact OD2-OG1 3.45Å; D110-Y172 VanDerWaalsContact OD1-CD2 3.27Å; D110-Y172 WeakPolarHBondContact OD1-CD2 3.2Å
111	V	92.8	Very high	90.3	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	118.6	179.5	179.3	0	0	0	0	109.9	L54 F79 P109 Y124 F167 G168 L179	L54-V111 HydrophobicContact CD2-CG1 4.26Å; F79-V111 HydrophobicContact CE1-CB 3.71Å; F79-V111 HydrophobicContact CE1-CG1 3.92Å; F79-V111 HydrophobicContact CE1-CG2 4.19Å; F79-V111 HydrophobicContact CZ-CB 4.3Å; F79-V111 HydrophobicContact CZ-CG1 4.45Å; P109-V111 HydrophobicContact CB-CG2 4.14Å; P109-V111 PolarHBondContact O-N 2.9Å; P109-V111 VanDerWaalsContact O-N 3.16Å; V111-Y124 PolarHBondContact O-OH 2.86Å; V111-F167 HydrophobicContact CG1-CB 3.98Å; V111-F167 HydrophobicContact CG1-CD1 4.09Å; V111-F167 HydrophobicContact CG1-CG 4.47Å; V111-G168 WeakPolarHBondContact CA-O 3.29Å; V111-L179 HydrophobicContact CG1-CD2 4.28Å; V111-L179 HydrophobicContact CG2-CD1 3.93Å
112	I	92.3	Very high	89.1	Confident	28 Å²	28	53.6 Å²	53.6	14%	0.144	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	162.3	-178.9	67	165.4	0	0	0	111.2	D110 Y114 F167 G168 W170	D110-I112 PolarHBondContact O-N 3.15Å; I112-Y114 HydrophobicContact CD1-CD1 4.29Å; I112-Y114 HydrophobicContact CD1-CE1 4.48Å; I112-Y114 HydrophobicContact CG1-CD1 3.93Å; I112-Y114 HydrophobicContact CG1-CE1 4Å; I112-F167 WeakPolarHBondContact O-CA 3.39Å; I112-G168 PolarHBondContact N-O 3.45Å; I112-G168 PolarHBondContact O-N 3.36Å; I112-G168 VanDerWaalsContact O-N 3.12Å; I112-W170 HydrophobicContact CD1-CB 4.04Å; I112-W170 HydrophobicContact CD1-CD2 3.78Å; I112-W170 HydrophobicContact CD1-CE3 3.43Å; I112-W170 VanDerWaalsContact CD1-CE3 3.43Å; I112-W170 HydrophobicContact CD1-CG 4.07Å; I112-W170 HydrophobicContact CD1-CZ3 4.08Å; I112-W170 HydrophobicContact CG1-CB 4.28Å; I112-W170 HydrophobicContact CG1-CE3 4.28Å
113	L	94	Very high	87.9	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	112.5	171.2	-179.1	67.7	0	0	0	109.8	N115 N116 L145 L165 F167	L113-N115 VanDerWaalsContact CD1-OD1 3.24Å; L113-N115 WeakPolarHBondContact CD1-OD1 3.18Å; L113-N116 HydrophobicContact CB-CB 4.28Å; L113-N116 HydrophobicContact CD2-CB 4Å; L113-N116 HydrophobicContact CG-CB 4.15Å; L113-N116 WeakPolarHBondContact O-CB 3.28Å; L113-L145 HydrophobicContact CD2-CB 4.24Å; L113-L145 HydrophobicContact CD2-CD2 4.5Å; L113-L165 HydrophobicContact CD1-CB 3.89Å; L113-L165 HydrophobicContact CD1-CD2 4.18Å; L113-L165 HydrophobicContact CD2-CD2 4.39Å; L113-F167 HydrophobicContact CB-CD1 4.38Å; L113-F167 HydrophobicContact CB-CE1 3.97Å; L113-F167 HydrophobicContact CB-CZ 4.4Å; L113-F167 HydrophobicContact CD1-CD2 4.46Å; L113-F167 HydrophobicContact CD1-CE1 4.38Å; L113-F167 HydrophobicContact CD1-CE2 4.16Å; L113-F167 HydrophobicContact CD1-CZ 4.12Å
114	Y	92.7	Very high	87.4	Confident	56 Å²	56	55.1 Å²	55.1	22%	0.22	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-36.1	-177.6	-69.6	-11.7	0	0	0	113.4	I112 N116 K166 S169 W170 D221	I112-Y114 HydrophobicContact CD1-CD1 4.29Å; I112-Y114 HydrophobicContact CD1-CE1 4.48Å; I112-Y114 HydrophobicContact CG1-CD1 3.93Å; I112-Y114 HydrophobicContact CG1-CE1 4Å; Y114-N116 VanDerWaalsContact C-N 3.29Å; Y114-N116 PolarHBondContact O-N 2.9Å; Y114-K166 HydrophobicContact CD2-CD 3.82Å; Y114-K166 HydrophobicContact CD2-CG 4.01Å; Y114-K166 PolarHBondContact N-O 3.23Å; Y114-S169 PolarHBondContact OH-O 3.28Å; Y114-W170 HydrophobicContact CD1-CE3 4.21Å; Y114-W170 HydrophobicContact CD1-CZ3 4.31Å; Y114-W170 AromaticContact CE1-CE3 3.9Å; Y114-W170 HydrophobicContact CE1-CE3 3.9Å; Y114-W170 HydrophobicContact CE1-CZ3 4.35Å; Y114-D221 HydrophobicContact CE2-CB 4.4Å
115	N	94.4	Very high	87.1	Confident	31 Å²	31	56.2 Å²	56.2	17%	0.166	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	32.8	-179.6	64.9	-46.3	0	0	0	112.8	L113 S147 S148 C164 K166	L113-N115 VanDerWaalsContact CD1-OD1 3.24Å; L113-N115 WeakPolarHBondContact CD1-OD1 3.18Å; N115-S147 CarbonylContact O-C 3.23Å; N115-S147 VanDerWaalsContact O-CA 3.3Å; N115-S147 WeakPolarHBondContact O-CA 3.44Å; N115-S148 PolarHBondContact ND2-O 3Å; N115-S148 VanDerWaalsContact ND2-O 3.11Å; N115-S148 PolarHBondContact O-N 3.11Å; N115-C164 PolarHBondContact ND2-O 3.04Å; N115-K166 PolarHBondContact OD1-N 3.09Å
116	N	93.4	Very high	86.6	Confident	19 Å²	19	55.3 Å²	55.3	10%	0.102	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-71	135.7	174.8	-170.3	47.2	0	0	0	111.1	L113 Y114 D118 N120 F121 Q146	L113-N116 HydrophobicContact CB-CB 4.28Å; L113-N116 HydrophobicContact CD2-CB 4Å; L113-N116 HydrophobicContact CG-CB 4.15Å; L113-N116 WeakPolarHBondContact O-CB 3.28Å; Y114-N116 VanDerWaalsContact C-N 3.29Å; Y114-N116 PolarHBondContact O-N 2.9Å; N116-D118 PolarHBondContact ND2-O 3.26Å; N116-N120 PolarHBondContact ND2-O 3.45Å; N116-F121 HydrophobicContact CB-CD1 4.09Å; N116-F121 HydrophobicContact CB-CE1 4.13Å; N116-Q146 PolarHBondContact OD1-O 3.48Å; N116-Q146 VanDerWaalsContact OD1-O 3.09Å
117	V	90.6	Very high	86.5	Confident	71 Å²	71	56.2 Å²	56.2	43%	0.43	29%	0.292	S	S	.	.			trans	-106	-18.5	175.8	-179.1	0	0	0	0	111.3	T70 Q146	T70-V117 HydrophobicContact CG2-CB 4.18Å; T70-V117 HydrophobicContact CG2-CG1 3.96Å; T70-V117 HydrophobicContact CG2-CG2 4.07Å; V117-Q146 HydrophobicContact CB-CG 4.44Å; V117-Q146 PolarHBondContact N-O 2.98Å
118	D	83.2	Confident	86.5	Confident	42 Å²	42	60.2 Å²	60.2	23%	0.225	31%	0.314	C	S	.	.	S	Bend	trans	-65.6	141.1	175.8	-167.4	-2	0	0	0	111.1	N116 N120 S123 Q146	N116-D118 PolarHBondContact ND2-O 3.26Å; D118-N120 PolarHBondContact O-N 2.96Å; D118-N120 PolarHBondContact OD1-N 3.43Å; D118-S123 PolarHBondContact OD2-OG 3.49Å; D118-Q146 HydrophobicContact CB-CB 4.25Å
119	S	78.3	Confident	86.6	Confident	99 Å²	99	56.2 Å²	56.2	69%	0.692	30%	0.297	S	S	*	.	S	Bend	trans	-54.6	-32.4	172	58.2	0	0	0	0	113
120	N	77.9	Confident	86.7	Confident	103 Å²	103	58 Å²	58	55%	0.551	31%	0.305	S	S	*	.			trans	-90.9	105.8	175.2	-68.2	-33.8	0	0	0	109.6	N116 D118 Q122 S123	N116-N120 PolarHBondContact ND2-O 3.45Å; D118-N120 PolarHBondContact O-N 2.96Å; D118-N120 PolarHBondContact OD1-N 3.43Å; N120-Q122 PolarHBondContact O-N 3.22Å; N120-S123 PolarHBondContact O-OG 3.31Å
121	F	70.1	Confident	87	Confident	123 Å²	123	56.2 Å²	56.2	54%	0.539	30%	0.296	S	S	.	.	S	Bend	trans	-73.7	-13.2	175.7	-75.4	-89.6	0	0	0	113.6	N116	N116-F121 HydrophobicContact CB-CD1 4.09Å; N116-F121 HydrophobicContact CB-CE1 4.13Å
122	Q	68.7	Low	87.2	Confident	149 Å²	149	60.1 Å²	60.1	70%	0.696	31%	0.311	S	S	*	.			trans	-118.7	71	176.4	-70.8	-174.9	-14.7	0	0	110.5	N120 Y124	N120-Q122 PolarHBondContact O-N 3.22Å; Q122-Y124 PolarHBondContact O-N 2.98Å
123	S	68.5	Low	87.4	Confident	32 Å²	32	62 Å²	62	22%	0.224	32%	0.319	C	S	.	.			trans	-82.1	20.3	-180	-54.8	0	0	0	0	114.1	D118 N120	D118-S123 PolarHBondContact OD2-OG 3.49Å; N120-S123 PolarHBondContact O-OG 3.31Å
124	Y	82.7	Confident	87.4	Confident	42 Å²	42	65.2 Å²	65.2	17%	0.165	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-82.1	134.4	-178.3	-54	-22.7	0	0	0	110.4	L77 V111 Q122 W139 P141 A143 L145	L77-Y124 HydrophobicContact CD1-CD1 3.51Å; L77-Y124 HydrophobicContact CD1-CE1 3.13Å; L77-Y124 HydrophobicContact CD1-CG 4.41Å; V111-Y124 PolarHBondContact O-OH 2.86Å; Q122-Y124 PolarHBondContact O-N 2.98Å; Y124-W139 HydrophobicContact CD2-CH2 4.2Å; Y124-P141 HydrophobicContact CG-CG 4.5Å; Y124-A143 HydrophobicContact CD1-CB 3.73Å; Y124-A143 HydrophobicContact CE1-CB 4.3Å; Y124-L145 HydrophobicContact CE1-CD2 4.38Å
125	F	85.2	Confident	87.5	Confident	134 Å²	134	63.4 Å²	63.4	59%	0.588	33%	0.331	S	S	*	.			trans	-67.7	136.6	166.1	-175.5	-94.7	0	0	0	109.7	S127 P142	F125-S127 VanDerWaalsContact C-N 3.27Å; F125-S127 PolarHBondContact O-N 2.93Å; F125-P142 HydrophobicContact CB-CG 3.69Å; F125-P142 HydrophobicContact CD1-CG 4.42Å; F125-P142 HydrophobicContact CG-CG 4.3Å; F125-P142 PolarHBondContact N-O 3.23Å
126	P	84.7	Confident	87.6	Confident	86 Å²	86	65.3 Å²	65.3	56%	0.558	34%	0.339	S	S	*	.			trans	-74.5	76.3	-178	31.4	-36.2	0	0	0	111.4
127	S	92.3	Very high	87.8	Confident	21 Å²	21	64.4 Å²	64.4	15%	0.147	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-80.4	146.4	174	67.6	0	0	0	0	111.3	P103 F125 W139 P141	P103-S127 WeakPolarHBondContact CD-O 3.43Å; P103-S127 WeakPolarHBondContact CG-O 3.44Å; F125-S127 VanDerWaalsContact C-N 3.27Å; F125-S127 PolarHBondContact O-N 2.93Å; S127-W139 PolarHBondContact O-NE1 3.02Å; S127-W139 PolarHBondContact OG-NE1 2.84Å; S127-P141 WeakPolarHBondContact OG-CA 3.45Å
128	N	94.9	Very high	88	Confident	90 Å²	90	61.7 Å²	61.7	48%	0.481	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-63.7	150.7	170.3	-69.8	-19.5	0	0	0	111.1	R100	R100-N128 HydrophobicContact CB-CB 4.19Å
129	V	96.1	Very high	88.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	139.3	174.6	-176.2	0	0	0	0	109	W81 R100 I101 P103 I106 V131 I137 W139	W81-V129 HydrophobicContact CH2-CG1 4.33Å; R100-V129 CarbonylContact C-O 3.56Å; R100-V129 WeakPolarHBondContact CA-O 3.46Å; I101-V129 PolarHBondContact N-O 2.95Å; I101-V129 WeakPolarHBondContact O-CB 3.3Å; I101-V129 PolarHBondContact O-N 3.3Å; P103-V129 HydrophobicContact CB-CG2 3.77Å; I106-V129 HydrophobicContact CD1-CB 3.95Å; I106-V129 HydrophobicContact CD1-CG1 3.82Å; I106-V129 HydrophobicContact CD1-CG2 4.08Å; V129-V131 HydrophobicContact CG1-CG2 4.38Å; V129-I137 HydrophobicContact CG1-CG2 3.15Å; V129-W139 HydrophobicContact CG1-CB 4.12Å; V129-W139 HydrophobicContact CG2-CB 4.08Å; V129-W139 HydrophobicContact CG2-CD2 4.41Å; V129-W139 HydrophobicContact CG2-CG 3.77Å
130	I	96.9	Very high	89.4	Confident	45 Å²	45	58.2 Å²	58.2	23%	0.231	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120.8	173.2	-55.4	173.6	0	0	0	107.7	D98 Y132 I137 S138	D98-I130 HydrophobicContact CB-CG2 4.31Å; I130-Y132 HydrophobicContact CG2-CD2 4.35Å; I130-Y132 HydrophobicContact CG2-CE1 4.38Å; I130-Y132 HydrophobicContact CG2-CE2 3.83Å; I130-I137 WeakPolarHBondContact O-CA 3.25Å; I130-S138 PolarHBondContact N-O 3.45Å; I130-S138 PolarHBondContact O-N 3.48Å
131	V	96.9	Very high	90.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.1	176.2	-176.4	0	0	0	0	107.5	L86 W88 D98 I99 I101 I106 V129 I137	L86-V131 HydrophobicContact CB-CG1 3.87Å; L86-V131 HydrophobicContact CD1-CG1 4.42Å; L86-V131 HydrophobicContact CD1-CG2 4.5Å; W88-V131 HydrophobicContact CH2-CG1 4.3Å; W88-V131 WeakPolarHBondContact CH2-O 3.21Å; W88-V131 HydrophobicContact CZ3-CG1 3.88Å; D98-V131 CarbonylContact C-O 3.55Å; D98-V131 WeakPolarHBondContact CA-O 3.45Å; I99-V131 HydrophobicContact CG1-CB 4.09Å; I99-V131 PolarHBondContact N-O 3.49Å; I99-V131 PolarHBondContact O-N 3.19Å; I101-V131 HydrophobicContact CD1-CG2 4.12Å; I106-V131 HydrophobicContact CD1-CG2 4.36Å; V129-V131 HydrophobicContact CG1-CG2 4.38Å; V131-I137 HydrophobicContact CG1-CG1 4.22Å; V131-I137 HydrophobicContact CG2-CD1 4.36Å; V131-I137 HydrophobicContact CG2-CG1 4.25Å
132	Y	97.4	Very high	91.4	Very high	86 Å²	86	49.4 Å²	49.4	34%	0.337	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	152.5	177.2	-66.6	-85.5	0	0	0	111.1	D98 I130 N134 S135 Q136	D98-Y132 HydrophobicContact CB-CD1 3.85Å; D98-Y132 HydrophobicContact CB-CE1 4.12Å; I130-Y132 HydrophobicContact CG2-CD2 4.35Å; I130-Y132 HydrophobicContact CG2-CE1 4.38Å; I130-Y132 HydrophobicContact CG2-CE2 3.83Å; Y132-N134 VanDerWaalsContact CB-OD1 3.23Å; Y132-N134 WeakPolarHBondContact CB-OD1 3.42Å; Y132-N134 PolarHBondContact O-N 3.09Å; Y132-S135 PolarHBondContact O-N 3.38Å; Y132-S135 VanDerWaalsContact O-N 3.11Å; Y132-Q136 WeakPolarHBondContact CB-O 3.32Å; Y132-Q136 HydrophobicContact CD2-CB 4.33Å; Y132-Q136 HydrophobicContact CD2-CG 4.49Å; Y132-Q136 WeakPolarHBondContact CD2-O 3.42Å; Y132-Q136 PolarHBondContact N-O 3.16Å
133	H	96.2	Very high	92.5	Very high	67 Å²	67	42.4 Å²	42.4	31%	0.31	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.6	-177.3	75.5	90.8	0	0	0	114.1	K87 W88 P90 T97 S135	K87-H133 WeakPolarHBondContact CG-O 3.39Å; W88-H133 HydrophobicContact CD2-CB 3.93Å; W88-H133 VanDerWaalsContact CE2-CB 3.47Å; W88-H133 HydrophobicContact CE3-CB 4.44Å; W88-H133 HydrophobicContact CG-CB 4.41Å; W88-H133 HydrophobicContact CH2-CB 4.23Å; W88-H133 VanDerWaalsContact CH2-N 3.28Å; W88-H133 HydrophobicContact CZ2-CB 3.66Å; W88-H133 PolarHBondContact N-O 2.91Å; P90-H133 HydrophobicContact CG-CB 3.84Å; T97-H133 PolarHBondContact O-CD2 3.22Å; T97-H133 PolarHBondContact O-N 2.89Å; H133-S135 VanDerWaalsContact C-N 3.27Å; H133-S135 PolarHBondContact O-N 3.09Å
134	N	95.3	Very high	93.7	Very high	74 Å²	74	45.1 Å²	45.1	40%	0.396	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	18.2	-179.3	71.1	-13	0	0	0	113.7	Y132 Q136	Y132-N134 VanDerWaalsContact CB-OD1 3.23Å; Y132-N134 WeakPolarHBondContact CB-OD1 3.42Å; Y132-N134 PolarHBondContact O-N 3.09Å; N134-Q136 PolarHBondContact O-N 3.06Å; N134-Q136 WeakPolarHBondContact OD1-CB 3.29Å; N134-Q136 PolarHBondContact OD1-N 3.34Å
135	S	93.7	Very high	94.3	Very high	17 Å²	17	43.3 Å²	43.3	12%	0.119	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	69.4	1.6	-173.4	67.2	0	0	0	0	116.4	Q82 D83 Y132 H133	Q82-S135 CarbonylContact C-O 3.48Å; Q82-S135 VanDerWaalsContact CA-O 3.26Å; Q82-S135 WeakPolarHBondContact CA-O 3.28Å; D83-S135 PolarHBondContact N-O 3.14Å; D83-S135 WeakPolarHBondContact O-CB 3.22Å; Y132-S135 PolarHBondContact O-N 3.38Å; Y132-S135 VanDerWaalsContact O-N 3.11Å; H133-S135 VanDerWaalsContact C-N 3.27Å; H133-S135 PolarHBondContact O-N 3.09Å
136	Q	96.5	Very high	94.7	Very high	72 Å²	72	39.7 Å²	39.7	34%	0.336	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	134.4	175.8	-172.6	173.7	-2.9	0	0	110.5	S80 Y132 N134	S80-Q136 PolarHBondContact OG-NE2 3.11Å; Y132-Q136 WeakPolarHBondContact CB-O 3.32Å; Y132-Q136 HydrophobicContact CD2-CB 4.33Å; Y132-Q136 HydrophobicContact CD2-CG 4.49Å; Y132-Q136 WeakPolarHBondContact CD2-O 3.42Å; Y132-Q136 PolarHBondContact N-O 3.16Å; N134-Q136 PolarHBondContact O-N 3.06Å; N134-Q136 WeakPolarHBondContact OD1-CB 3.29Å; N134-Q136 PolarHBondContact OD1-N 3.34Å
137	I	97.1	Very high	95.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.2	177.7	-60.8	-172.8	0	0	0	108.9	S80 W81 D83 L86 I106 V129 I130 V131	S80-I137 VanDerWaalsContact CA-O 3.29Å; S80-I137 WeakPolarHBondContact CA-O 3.44Å; W81-I137 HydrophobicContact CD2-CB 4.04Å; W81-I137 HydrophobicContact CD2-CG2 4.13Å; W81-I137 HydrophobicContact CE3-CB 4.41Å; W81-I137 HydrophobicContact CE3-CG2 4.2Å; W81-I137 HydrophobicContact CH2-CB 4.44Å; W81-I137 HydrophobicContact CH2-CG2 3.5Å; W81-I137 VanDerWaalsContact CH2-CG2 3.5Å; W81-I137 HydrophobicContact CZ2-CB 4.08Å; W81-I137 HydrophobicContact CZ2-CD1 4.19Å; W81-I137 HydrophobicContact CZ2-CG2 3.4Å; W81-I137 VanDerWaalsContact CZ2-CG2 3.4Å; W81-I137 HydrophobicContact CZ3-CG2 3.9Å; W81-I137 PolarHBondContact N-O 3.41Å; W81-I137 PolarHBondContact O-N 3.38Å; D83-I137 HydrophobicContact CB-CD1 3.49Å; D83-I137 VanDerWaalsContact CB-CD1 3.49Å; D83-I137 HydrophobicContact CB-CG1 4.36Å; L86-I137 HydrophobicContact CD1-CD1 3.68Å; I106-I137 HydrophobicContact CD1-CD1 4.42Å; V129-I137 HydrophobicContact CG1-CG2 3.15Å; I130-I137 WeakPolarHBondContact O-CA 3.25Å; V131-I137 HydrophobicContact CG1-CG1 4.22Å; V131-I137 HydrophobicContact CG2-CD1 4.36Å; V131-I137 HydrophobicContact CG2-CG1 4.25Å
138	S	96.3	Very high	95.3	Very high	13 Å²	13	37.3 Å²	37.3	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.7	174.1	-172	0	0	0	0	110.4	F79 I130	F79-S138 WeakPolarHBondContact O-CA 3.49Å; I130-S138 PolarHBondContact N-O 3.45Å; I130-S138 PolarHBondContact O-N 3.48Å
139	W	95.8	Very high	95.3	Very high	10 Å²	10	33.4 Å²	33.4	4%	0.038	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.8	177.4	-176.7	39.7	0	0	0	109.6	F79 W81 P103 K108 Y124 S127 V129 P141	F79-W139 HydrophobicContact CB-CB 4.38Å; F79-W139 HydrophobicContact CD2-CD2 4.28Å; F79-W139 AromaticContact CD2-CE3 3.59Å; F79-W139 HydrophobicContact CD2-CE3 3.59Å; F79-W139 HydrophobicContact CD2-CZ3 4.07Å; F79-W139 HydrophobicContact CE2-CE3 4.09Å; F79-W139 HydrophobicContact CE2-CZ3 4.1Å; F79-W139 HydrophobicContact CG-CE3 4.21Å; F79-W139 PolarHBondContact N-O 2.68Å; F79-W139 PolarHBondContact O-N 2.97Å; W81-W139 HydrophobicContact CH2-CB 4.03Å; W81-W139 HydrophobicContact CZ3-CB 3.86Å; P103-W139 HydrophobicContact CB-CZ2 4.19Å; K108-W139 HydrophobicContact CD-CH2 4.08Å; K108-W139 HydrophobicContact CD-CZ3 4.27Å; Y124-W139 HydrophobicContact CD2-CH2 4.2Å; S127-W139 PolarHBondContact O-NE1 3.02Å; S127-W139 PolarHBondContact OG-NE1 2.84Å; V129-W139 HydrophobicContact CG1-CB 4.12Å; V129-W139 HydrophobicContact CG2-CB 4.08Å; V129-W139 HydrophobicContact CG2-CD2 4.41Å; V129-W139 HydrophobicContact CG2-CG 3.77Å; W139-P141 VanDerWaalsContact C-CD 3.46Å; W139-P141 HydrophobicContact CD2-CG 4.06Å; W139-P141 HydrophobicContact CE3-CG 4.46Å; W139-P141 HydrophobicContact CH2-CG 4.26Å; W139-P141 HydrophobicContact CZ2-CB 4.22Å; W139-P141 HydrophobicContact CZ2-CG 3.86Å
140	I	94.6	Very high	95.1	Very high	59 Å²	59	39.8 Å²	39.8	30%	0.303	20%	0.201	S	C	.	.			trans	-127.4	70.5	-173.9	-47.2	178.9	0	0	0	110.6	W76 L77 K78	W76-I140 HydrophobicContact CB-CG2 3.92Å; W76-I140 HydrophobicContact CE3-CG2 4.3Å; L77-I140 WeakPolarHBondContact O-CA 3.41Å; K78-I140 HydrophobicContact CB-CG1 4.14Å; K78-I140 HydrophobicContact CB-CG2 4.46Å; K78-I140 HydrophobicContact CD-CD1 4.06Å; K78-I140 HydrophobicContact CD-CG1 4.47Å; K78-I140 HydrophobicContact CG-CD1 4.13Å; K78-I140 HydrophobicContact CG-CG1 3.99Å
141	P	95	Very high	94.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.			trans	-73.2	131.5	173.3	27.4	-35.3	0	0	0	111.6	L77 F79 Y124 S127 W139	L77-P141 HydrophobicContact CB-CG 4.27Å; L77-P141 PolarHBondContact N-O 2.86Å; L77-P141 WeakPolarHBondContact O-CD 3.5Å; F79-P141 HydrophobicContact CD2-CG 4.4Å; F79-P141 HydrophobicContact CE2-CG 4.14Å; Y124-P141 HydrophobicContact CG-CG 4.5Å; S127-P141 WeakPolarHBondContact OG-CA 3.45Å; W139-P141 VanDerWaalsContact C-CD 3.46Å; W139-P141 HydrophobicContact CD2-CG 4.06Å; W139-P141 HydrophobicContact CE3-CG 4.46Å; W139-P141 HydrophobicContact CH2-CG 4.26Å; W139-P141 HydrophobicContact CZ2-CB 4.22Å; W139-P141 HydrophobicContact CZ2-CG 3.86Å
142	P	94.7	Very high	94.5	Very high	40 Å²	40	42 Å²	42	26%	0.26	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	145.3	165.9	30.7	-33	0	0	0	110.5	W76 F125	W76-P142 VanDerWaalsContact CD1-CB 3.44Å; W76-P142 HydrophobicContact CG-CB 4.3Å; F125-P142 HydrophobicContact CB-CG 3.69Å; F125-P142 HydrophobicContact CD1-CG 4.42Å; F125-P142 HydrophobicContact CG-CG 4.3Å; F125-P142 PolarHBondContact N-O 3.23Å
143	A	93	Very high	94.1	Very high	3 Å²	3	38.2 Å²	38.2	3%	0.025	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	142	-178.6	0	0	0	0	0	111.7	V75 L77 Y124 L145	V75-A143 PolarHBondContact N-O 3.21Å; V75-A143 PolarHBondContact O-N 3.39Å; V75-A143 VanDerWaalsContact O-O 3.09Å; L77-A143 HydrophobicContact CD1-CB 3.87Å; Y124-A143 HydrophobicContact CD1-CB 3.73Å; Y124-A143 HydrophobicContact CE1-CB 4.3Å; A143-L145 HydrophobicContact CB-CD2 3.84Å; A143-L145 HydrophobicContact CB-CG 4.13Å
144	I	93.1	Very high	93.8	Very high	88 Å²	88	37.1 Å²	37.1	45%	0.451	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.3	162.9	-61.3	176.3	0	0	0	106.4	Q72 T73	Q72-I144 HydrophobicContact CG-CG2 3.75Å; Q72-I144 VanDerWaalsContact NE2-CG2 3.27Å; T73-I144 WeakPolarHBondContact O-CA 3.36Å
145	L	93.9	Very high	93.5	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132	-175.8	-59.2	179.4	0	0	0	110.2	Q72 T73 V75 L113 Y124 A143 L165 F167	Q72-L145 CarbonylContact C-O 3.36Å; Q72-L145 VanDerWaalsContact CA-O 3.29Å; Q72-L145 WeakPolarHBondContact CA-O 3.4Å; T73-L145 PolarHBondContact N-O 2.9Å; T73-L145 PolarHBondContact O-N 3.44Å; V75-L145 HydrophobicContact CG2-CD1 3.38Å; V75-L145 HydrophobicContact CG2-CG 3.86Å; L113-L145 HydrophobicContact CD2-CB 4.24Å; L113-L145 HydrophobicContact CD2-CD2 4.5Å; Y124-L145 HydrophobicContact CE1-CD2 4.38Å; A143-L145 HydrophobicContact CB-CD2 3.84Å; A143-L145 HydrophobicContact CB-CG 4.13Å; L145-L165 HydrophobicContact CD1-CD1 4.32Å; L145-F167 HydrophobicContact CD1-CE1 4.45Å; L145-F167 HydrophobicContact CD1-CE2 4.4Å; L145-F167 HydrophobicContact CD1-CZ 3.58Å
146	Q	94.1	Very high	93.2	Very high	59 Å²	59	37.7 Å²	37.7	28%	0.276	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	99.6	174	-171.6	177.8	-10.5	0	0	109.3	M71 N116 V117 D118	M71-Q146 WeakPolarHBondContact O-CA 3.49Å; N116-Q146 PolarHBondContact OD1-O 3.48Å; N116-Q146 VanDerWaalsContact OD1-O 3.09Å; V117-Q146 HydrophobicContact CB-CG 4.44Å; V117-Q146 PolarHBondContact N-O 2.98Å; D118-Q146 HydrophobicContact CB-CB 4.25Å
147	S	94.7	Very high	92.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	147.8	-178.9	59.9	0	0	0	0	112.4	T70 M71 N115 L165	T70-S147 CarbonylContact C-O 3.57Å; T70-S147 WeakPolarHBondContact CA-O 3.36Å; M71-S147 PolarHBondContact N-O 3.22Å; M71-S147 PolarHBondContact O-N 2.96Å; M71-S147 PolarHBondContact O-OG 2.59Å; N115-S147 CarbonylContact O-C 3.23Å; N115-S147 VanDerWaalsContact O-CA 3.3Å; N115-S147 WeakPolarHBondContact O-CA 3.44Å; S147-L165 VanDerWaalsContact CB-CD2 3.43Å; S147-L165 WeakPolarHBondContact OG-CD2 3.37Å
148	S	94.8	Very high	92.5	Very high	57 Å²	57	35.4 Å²	35.4	40%	0.399	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	131.1	165.7	64.5	0	0	0	0	110	N115	N115-S148 PolarHBondContact ND2-O 3Å; N115-S148 VanDerWaalsContact ND2-O 3.11Å; N115-S148 PolarHBondContact O-N 3.11Å
149	C	94.6	Very high	92.2	Very high	7 Å²	7	34.9 Å²	34.9	5%	0.047	18%	0.177	C	C	.	.			trans	-134.5	118.6	176.5	179.1	0	0	0	0	109.1	Q69 M71 L151 C163	Q69-C149 CarbonylContact C-O 3.46Å; Q69-C149 WeakPolarHBondContact CB-O 3.49Å; Q69-C149 PolarHBondContact O-N 3.41Å; Q69-C149 VanDerWaalsContact O-O 3.13Å; M71-C149 HydrophobicContact CB-CB 4.33Å; C149-L151 PolarHBondContact O-N 3.11Å; C149-C163 HydrophobicContact CB-CB 3.74Å; C149-C163 WeakPolarHBondContact CB-SG 3.42Å; C149-C163 WeakPolarHBondContact SG-CA 3.49Å; C149-C163 WeakPolarHBondContact SG-CB 3.39Å; C149-C163 CovalentContact SG-SG 2.03Å; C149-C163 PolarHBondContact SG-SG 3.09Å
150	K	92	Very high	92.1	Very high	134 Å²	134	37.9 Å²	37.9	58%	0.583	19%	0.194	S	C	*	.			trans	-78.4	108.1	175.4	-176.1	179.4	179.5	170.6	0	108.8	E290	K150-E290 WeakPolarHBondContact CE-OE2 3.47Å; K150-E290 IonicContact NZ-OE1 3.22Å; K150-E290 PolarHBondContact NZ-OE1 2.97Å; K150-E290 IonicContact NZ-OE2 2.66Å; K150-E290 PolarHBondContact NZ-OE2 3.35Å
151	L	91.5	Very high	92.1	Very high	10 Å²	10	35.5 Å²	35.5	5%	0.052	18%	0.182	C	C	.	.			trans	-91.3	140	-177.5	-60.1	163.8	0	0	0	111.2	V64 E66 C149 Q161	V64-L151 HydrophobicContact CG1-CD1 3.98Å; V64-L151 HydrophobicContact CG1-CD2 4.07Å; E66-L151 HydrophobicContact CB-CD1 4.21Å; E66-L151 HydrophobicContact CG-CD1 4.1Å; C149-L151 PolarHBondContact O-N 3.11Å; L151-Q161 VanDerWaalsContact CA-OE1 3.3Å; L151-Q161 HydrophobicContact CD2-CB 3.91Å; L151-Q161 HydrophobicContact CD2-CG 3.78Å
152	D	90.3	Very high	92.2	Very high	83 Å²	83	40.8 Å²	40.8	44%	0.444	21%	0.206	S	C	.	.			trans	-97.7	106.5	173.8	-176.8	-1.9	0	0	0	110.5	T154 Q161	D152-T154 VanDerWaalsContact OD1-CB 3.25Å; D152-T154 WeakPolarHBondContact OD1-CB 3.39Å; D152-T154 PolarHBondContact OD1-N 3.37Å; D152-T154 PolarHBondContact OD1-OG1 3.49Å; D152-Q161 PolarHBondContact O-NE2 3.31Å
153	I	89.7	Confident	92.3	Very high	6 Å²	6	39 Å²	39	3%	0.031	19%	0.194	C	C	.	.			trans	-90.6	4.5	-176.4	64	169.6	0	0	0	113.9	W155 F156 T285 P286 P293	I153-W155 PolarHBondContact O-N 3.22Å; I153-F156 WeakPolarHBondContact O-CB 3.3Å; I153-F156 PolarHBondContact O-N 3.11Å; I153-F156 VanDerWaalsContact O-N 3.15Å; I153-T285 HydrophobicContact CD1-CG2 4.42Å; I153-P286 HydrophobicContact CD1-CG 4.16Å; I153-P286 HydrophobicContact CG2-CG 4.12Å; I153-P293 HydrophobicContact CD1-CG 4.48Å; I153-P293 WeakPolarHBondContact O-CA 3.35Å; I153-P293 WeakPolarHBondContact O-CB 3.45Å
154	T	89.2	Confident	92.4	Very high	44 Å²	44	40.1 Å²	40.1	27%	0.27	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-44.3	-174.8	-57.6	0	0	0	0	111.9	D152 A291 L294	D152-T154 VanDerWaalsContact OD1-CB 3.25Å; D152-T154 WeakPolarHBondContact OD1-CB 3.39Å; D152-T154 PolarHBondContact OD1-N 3.37Å; D152-T154 PolarHBondContact OD1-OG1 3.49Å; T154-A291 VanDerWaalsContact OG1-CB 3.29Å; T154-A291 WeakPolarHBondContact OG1-CB 3.39Å; T154-L294 WeakPolarHBondContact O-CB 3.26Å; T154-L294 PolarHBondContact O-N 2.87Å
155	W	88.7	Confident	92.5	Very high	96 Å²	96	36 Å²	36	36%	0.364	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	9.3	-174.5	-60.2	112	0	0	0	114.6	I153 F158 L294 S455 P457	I153-W155 PolarHBondContact O-N 3.22Å; W155-F158 CarbonylContact O-C 3.55Å; W155-F158 WeakPolarHBondContact O-CA 2.88Å; W155-F158 PolarHBondContact O-N 3.01Å; W155-L294 HydrophobicContact CE3-CD2 4.04Å; W155-L294 HydrophobicContact CZ3-CD2 4.14Å; W155-S455 WeakPolarHBondContact CH2-O 3.35Å; W155-S455 WeakPolarHBondContact CZ3-O 3.45Å; W155-P457 HydrophobicContact CB-CG 4.07Å; W155-P457 HydrophobicContact CD2-CG 4.06Å; W155-P457 VanDerWaalsContact CE3-CD 3.48Å; W155-P457 HydrophobicContact CE3-CG 4.41Å; W155-P457 HydrophobicContact CG-CG 3.9Å
156	F	88.2	Confident	92.6	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.026	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	131.5	-178.1	-179.7	-86.4	0	0	0	112	I153 Y235 P293 I295	I153-F156 WeakPolarHBondContact O-CB 3.3Å; I153-F156 PolarHBondContact O-N 3.11Å; I153-F156 VanDerWaalsContact O-N 3.15Å; F156-Y235 HydrophobicContact CE1-CD1 4.28Å; F156-Y235 HydrophobicContact CE1-CE1 4.36Å; F156-Y235 HydrophobicContact CE2-CE1 4.26Å; F156-Y235 AromaticContact CZ-CD1 3.87Å; F156-Y235 HydrophobicContact CZ-CD1 3.87Å; F156-Y235 AromaticContact CZ-CE1 3.53Å; F156-Y235 HydrophobicContact CZ-CE1 3.53Å; F156-P293 HydrophobicContact CB-CB 4.21Å; F156-I295 HydrophobicContact CD1-CG2 3.74Å; F156-I295 HydrophobicContact CE1-CG2 4.29Å
157	P	89.2	Confident	92.6	Very high	5 Å²	5	35 Å²	35	3%	0.032	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.9	12.6	5.5	38.8	-38.9	0	0	0	115.1	D159 T232 Y235 I240	P157-D159 VanDerWaalsContact C-N 3.26Å; P157-D159 PolarHBondContact O-N 3.29Å; P157-T232 VanDerWaalsContact O-CG2 3.23Å; P157-T232 WeakPolarHBondContact O-CG2 3.1Å; P157-Y235 HydrophobicContact CB-CD1 4.36Å; P157-Y235 HydrophobicContact CB-CD2 3.89Å; P157-Y235 HydrophobicContact CB-CG 3.73Å; P157-Y235 HydrophobicContact CG-CG 4.3Å; P157-I240 HydrophobicContact CG-CD1 4.41Å
158	F	89.1	Confident	92.6	Very high	19 Å²	19	35 Å²	35	8%	0.083	18%	0.175	C	C	.	.	S	Bend	trans	-96.4	38	-179.3	-53.4	-86.9	0	0	0	111.6	W155 T232 I240 S456 P457 L459	W155-F158 CarbonylContact O-C 3.55Å; W155-F158 WeakPolarHBondContact O-CA 2.88Å; W155-F158 PolarHBondContact O-N 3.01Å; F158-T232 HydrophobicContact CD1-CG2 3.34Å; F158-T232 HydrophobicContact CE1-CG2 3.64Å; F158-T232 HydrophobicContact CG-CG2 4.05Å; F158-I240 HydrophobicContact CE2-CD1 3.89Å; F158-I240 HydrophobicContact CZ-CD1 3.71Å; F158-S456 VanDerWaalsContact CB-OG 3.27Å; F158-S456 WeakPolarHBondContact CB-OG 3.47Å; F158-S456 WeakPolarHBondContact CD2-OG 3.37Å; F158-S456 WeakPolarHBondContact CG-OG 3.23Å; F158-P457 WeakPolarHBondContact CB-O 3.5Å; F158-L459 HydrophobicContact CD1-CD1 4.42Å; F158-L459 HydrophobicContact CE1-CD1 3.48Å; F158-L459 VanDerWaalsContact CE1-CD1 3.48Å; F158-L459 HydrophobicContact CE2-CD1 4.17Å; F158-L459 HydrophobicContact CZ-CD1 3.32Å
159	D	91.1	Very high	92.6	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	16%	0.157	C	C	.	.			trans	-92	142.5	-173.2	54.1	-50.3	0	0	0	112.6	P157 Q161 R230	P157-D159 VanDerWaalsContact C-N 3.26Å; P157-D159 PolarHBondContact O-N 3.29Å; D159-Q161 PolarHBondContact OD2-NE2 3.22Å; D159-R230 PolarHBondContact O-N 2.69Å; D159-R230 IonicContact OD1-CZ 2.89Å; D159-R230 IonicContact OD1-NE 2.8Å; D159-R230 PolarHBondContact OD1-NE 2.87Å; D159-R230 IonicContact OD2-CZ 3.54Å; D159-R230 IonicContact OD2-NE 3.94Å; D159-R230 PolarHBondContact OD2-NE 3.31Å; D159-R230 IonicContact OD2-NH2 3.21Å; D159-R230 PolarHBondContact OD2-NH2 2.95Å
160	D	93.2	Very high	92.4	Very high	73 Å²	73	40.2 Å²	40.2	39%	0.39	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.8	164.8	-69.9	-54	0	0	0	107.3	R229 H458	D160-R229 VanDerWaalsContact OD1-CB 3.32Å; D160-R229 WeakPolarHBondContact OD1-CB 3.32Å; D160-R229 WeakPolarHBondContact OD1-CG 3.39Å; D160-R229 IonicContact OD1-CZ 3.84Å; D160-R229 IonicContact OD1-NE 3.47Å; D160-R229 PolarHBondContact OD1-NE 2.9Å; D160-R229 IonicContact OD1-NH2 2.99Å; D160-R229 PolarHBondContact OD1-NH2 3.39Å; D160-R229 IonicContact OD2-NE 3.77Å; D160-R229 IonicContact OD2-NH2 2.74Å; D160-H458 IonicContact OD2-CD2 3.92Å; D160-H458 IonicContact OD2-CE1 2.76Å; D160-H458 IonicContact OD2-NE2 3.83Å; D160-H458 PolarHBondContact OD2-NE2 3.04Å
161	Q	95.1	Very high	92.4	Very high	9 Å²	9	38.1 Å²	38.1	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	145.2	-177.9	-57	-63.7	-16.9	0	0	110.6	L151 D152 D159 W197 N227 I228	L151-Q161 VanDerWaalsContact CA-OE1 3.3Å; L151-Q161 HydrophobicContact CD2-CB 3.91Å; L151-Q161 HydrophobicContact CD2-CG 3.78Å; D152-Q161 PolarHBondContact O-NE2 3.31Å; D159-Q161 PolarHBondContact OD2-NE2 3.22Å; Q161-W197 HydrophobicContact CB-CZ3 4.4Å; Q161-W197 HydrophobicContact CG-CH2 3.85Å; Q161-W197 HydrophobicContact CG-CZ3 3.84Å; Q161-N227 CarbonylContact O-C 3.6Å; Q161-N227 WeakPolarHBondContact O-CA 3.46Å; Q161-I228 HydrophobicContact CB-CD1 4.32Å; Q161-I228 HydrophobicContact CB-CG1 3.79Å; Q161-I228 PolarHBondContact N-O 3.45Å; Q161-I228 PolarHBondContact O-N 3.25Å
162	Q	95.5	Very high	92.5	Very high	111 Å²	111	40.4 Å²	40.4	52%	0.519	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	110.6	173.4	176.5	170.2	72.1	0	0	109.7	N227	Q162-N227 WeakPolarHBondContact CG-OD1 3.2Å; Q162-N227 PolarHBondContact NE2-OD1 3.46Å
163	C	96.9	Very high	92.6	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.5	178.4	-66	0	0	0	0	110.8	M71 C149 C225 L226	M71-C163 HydrophobicContact CB-CB 4.48Å; M71-C163 HydrophobicContact CE-CB 3.72Å; M71-C163 HydrophobicContact SD-CB 3.41Å; M71-C163 WeakPolarHBondContact SD-CB 3.5Å; C149-C163 HydrophobicContact CB-CB 3.74Å; C149-C163 WeakPolarHBondContact CB-SG 3.42Å; C149-C163 WeakPolarHBondContact SG-CA 3.49Å; C149-C163 WeakPolarHBondContact SG-CB 3.39Å; C149-C163 CovalentContact SG-SG 2.03Å; C149-C163 PolarHBondContact SG-SG 3.09Å; C163-C225 CarbonylContact O-C 3.53Å; C163-C225 WeakPolarHBondContact O-CA 3.44Å; C163-L226 PolarHBondContact N-O 2.85Å; C163-L226 PolarHBondContact O-N 3.14Å
164	C	96.2	Very high	92.7	Very high	28 Å²	28	37.6 Å²	37.6	19%	0.189	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.2	-176.4	-57.3	0	0	0	0	112.5	N115 F224 C225	N115-C164 PolarHBondContact ND2-O 3.04Å; C164-F224 CarbonylContact C-O 3.57Å; C164-F224 WeakPolarHBondContact CA-O 3.38Å; C164-C225 HydrophobicContact CB-CB 4.11Å; C164-C225 WeakPolarHBondContact CB-SG 3.4Å; C164-C225 WeakPolarHBondContact SG-CB 3.43Å; C164-C225 CovalentContact SG-SG 2.05Å; C164-C225 PolarHBondContact SG-SG 3.35Å
165	L	95.2	Very high	92.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.5	168.7	-57.3	173.8	0	0	0	108.7	L56 M71 L113 L145 S147 F167 W186 R223 F224	L56-L165 HydrophobicContact CD1-CD1 4.09Å; M71-L165 HydrophobicContact CE-CD2 4.01Å; M71-L165 HydrophobicContact CE-CG 4.25Å; L113-L165 HydrophobicContact CD1-CB 3.89Å; L113-L165 HydrophobicContact CD1-CD2 4.18Å; L113-L165 HydrophobicContact CD2-CD2 4.39Å; L145-L165 HydrophobicContact CD1-CD1 4.32Å; S147-L165 VanDerWaalsContact CB-CD2 3.43Å; S147-L165 WeakPolarHBondContact OG-CD2 3.37Å; L165-F167 HydrophobicContact CB-CD2 4.25Å; L165-F167 HydrophobicContact CB-CE2 3.75Å; L165-F167 HydrophobicContact CD1-CE2 4.36Å; L165-W186 HydrophobicContact CD1-CH2 3.88Å; L165-R223 WeakPolarHBondContact O-CA 3.13Å; L165-F224 HydrophobicContact CB-CB 4.39Å; L165-F224 PolarHBondContact N-O 2.63Å; L165-F224 PolarHBondContact O-N 3.13Å
166	K	95	Very high	93.2	Very high	42 Å²	42	38.9 Å²	38.9	18%	0.183	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	102.5	-177.8	-173.5	178.9	-174.8	-170.6	0	110.9	Y114 N115 Y211 D221 R223	Y114-K166 HydrophobicContact CD2-CD 3.82Å; Y114-K166 HydrophobicContact CD2-CG 4.01Å; Y114-K166 PolarHBondContact N-O 3.23Å; N115-K166 PolarHBondContact OD1-N 3.09Å; K166-Y211 PolarHBondContact NZ-OH 2.84Å; K166-D221 WeakPolarHBondContact CE-OD1 3.39Å; K166-D221 WeakPolarHBondContact CE-OD2 3.48Å; K166-D221 HydrophobicContact CG-CB 4.22Å; K166-D221 IonicContact NZ-OD1 3.46Å; K166-D221 PolarHBondContact NZ-OD1 2.76Å; K166-R223 HydrophobicContact CB-CG 4.25Å; K166-R223 HydrophobicContact CG-CG 4.03Å
167	F	95	Very high	93.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139.7	176.7	-72.8	-82	0	0	0	112.1	L54 L56 L77 V111 I112 L113 L145 L165 D221 V222 F224	L54-F167 HydrophobicContact CD2-CB 3.7Å; L54-F167 HydrophobicContact CD2-CD1 4.49Å; L54-F167 HydrophobicContact CD2-CD2 4.28Å; L54-F167 HydrophobicContact CD2-CG 3.91Å; L56-F167 HydrophobicContact CD1-CD2 4.34Å; L56-F167 HydrophobicContact CD1-CE2 3.77Å; L56-F167 HydrophobicContact CD2-CE2 4.18Å; L56-F167 HydrophobicContact CD2-CZ 4.39Å; L56-F167 HydrophobicContact CG-CE2 4.47Å; L77-F167 HydrophobicContact CD2-CD1 4.37Å; L77-F167 HydrophobicContact CD2-CE1 3.6Å; L77-F167 HydrophobicContact CD2-CE2 4.23Å; L77-F167 HydrophobicContact CD2-CZ 3.51Å; V111-F167 HydrophobicContact CG1-CB 3.98Å; V111-F167 HydrophobicContact CG1-CD1 4.09Å; V111-F167 HydrophobicContact CG1-CG 4.47Å; I112-F167 WeakPolarHBondContact O-CA 3.39Å; L113-F167 HydrophobicContact CB-CD1 4.38Å; L113-F167 HydrophobicContact CB-CE1 3.97Å; L113-F167 HydrophobicContact CB-CZ 4.4Å; L113-F167 HydrophobicContact CD1-CD2 4.46Å; L113-F167 HydrophobicContact CD1-CE1 4.38Å; L113-F167 HydrophobicContact CD1-CE2 4.16Å; L113-F167 HydrophobicContact CD1-CZ 4.12Å; L145-F167 HydrophobicContact CD1-CE1 4.45Å; L145-F167 HydrophobicContact CD1-CE2 4.4Å; L145-F167 HydrophobicContact CD1-CZ 3.58Å; L165-F167 HydrophobicContact CB-CD2 4.25Å; L165-F167 HydrophobicContact CB-CE2 3.75Å; L165-F167 HydrophobicContact CD1-CE2 4.36Å; F167-D221 CarbonylContact O-C 3.6Å; F167-D221 WeakPolarHBondContact O-CA 3.1Å; F167-D221 WeakPolarHBondContact O-CB 3.47Å; F167-V222 PolarHBondContact N-O 2.73Å; F167-V222 PolarHBondContact O-N 2.99Å; F167-F224 AromaticContact CD2-CD2 3.86Å; F167-F224 HydrophobicContact CD2-CD2 3.86Å; F167-F224 HydrophobicContact CD2-CE2 4.18Å; F167-F224 HydrophobicContact CE2-CD2 4.45Å
168	G	94.4	Very high	93.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	161.6	174.4	0	0	0	0	0	111.7	V111 I112	V111-G168 WeakPolarHBondContact CA-O 3.29Å; I112-G168 PolarHBondContact N-O 3.45Å; I112-G168 PolarHBondContact O-N 3.36Å; I112-G168 VanDerWaalsContact O-N 3.12Å
169	S	94.5	Very high	94.1	Very high	4 Å²	4	39.3 Å²	39.3	3%	0.028	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	137.4	169.9	153.3	0	0	0	0	109.9	D110 Y114 Y172	D110-S169 PolarHBondContact OD1-OG 3.35Å; Y114-S169 PolarHBondContact OH-O 3.28Å; S169-Y172 WeakPolarHBondContact CB-O 3.32Å; S169-Y172 WeakPolarHBondContact OG-CA 3.39Å; S169-Y172 VanDerWaalsContact OG-CB 3.32Å; S169-Y172 WeakPolarHBondContact OG-CB 3.44Å; S169-Y172 PolarHBondContact OG-N 3.16Å; S169-Y172 PolarHBondContact OG-O 3.4Å
170	W	90.8	Very high	94.2	Very high	171 Å²	171	41.4 Å²	41.4	65%	0.648	21%	0.205	S	C	*	.	S	Bend	trans	-82.2	-39.8	-179.9	-171.5	-112.1	0	0	0	112.7	D110 I112 Y114	D110-W170 PolarHBondContact O-N 3.48Å; D110-W170 PolarHBondContact OD2-N 3.47Å; I112-W170 HydrophobicContact CD1-CB 4.04Å; I112-W170 HydrophobicContact CD1-CD2 3.78Å; I112-W170 HydrophobicContact CD1-CE3 3.43Å; I112-W170 VanDerWaalsContact CD1-CE3 3.43Å; I112-W170 HydrophobicContact CD1-CG 4.07Å; I112-W170 HydrophobicContact CD1-CZ3 4.08Å; I112-W170 HydrophobicContact CG1-CB 4.28Å; I112-W170 HydrophobicContact CG1-CE3 4.28Å; Y114-W170 HydrophobicContact CD1-CE3 4.21Å; Y114-W170 HydrophobicContact CD1-CZ3 4.31Å; Y114-W170 AromaticContact CE1-CE3 3.9Å; Y114-W170 HydrophobicContact CE1-CE3 3.9Å; Y114-W170 HydrophobicContact CE1-CZ3 4.35Å
171	T	91.7	Very high	94	Very high	90 Å²	90	40.3 Å²	40.3	55%	0.552	20%	0.199	S	C	*	.	S	Bend	trans	-110.6	-33	-170.9	64.7	0	0	0	0	113.5	D110	D110-T171 WeakPolarHBondContact OD2-CB 3.23Å; D110-T171 PolarHBondContact OD2-N 3.24Å; D110-T171 PolarHBondContact OD2-OG1 3.45Å
172	Y	92.9	Very high	93.4	Very high	57 Å²	57	41.2 Å²	41.2	22%	0.224	21%	0.207	C	C	.	.			trans	-87.4	134.1	179.9	-58.7	-68.8	0	0	0	111.6	R41 W107 D110 S169 K176 L177	R41-Y172 HydrophobicContact CG-CE1 3.87Å; W107-Y172 HydrophobicContact CZ2-CE2 4.19Å; D110-Y172 VanDerWaalsContact OD1-CD2 3.27Å; D110-Y172 WeakPolarHBondContact OD1-CD2 3.2Å; S169-Y172 WeakPolarHBondContact CB-O 3.32Å; S169-Y172 WeakPolarHBondContact OG-CA 3.39Å; S169-Y172 VanDerWaalsContact OG-CB 3.32Å; S169-Y172 WeakPolarHBondContact OG-CB 3.44Å; S169-Y172 PolarHBondContact OG-N 3.16Å; S169-Y172 PolarHBondContact OG-O 3.4Å; Y172-K176 HydrophobicContact CD1-CB 3.93Å; Y172-K176 HydrophobicContact CG-CB 4.35Å; Y172-L177 HydrophobicContact CD2-CB 4.3Å; Y172-L177 HydrophobicContact CD2-CD1 3.92Å; Y172-L177 HydrophobicContact CG-CB 4.17Å
173	N	93.1	Very high	92.5	Very high	20 Å²	20	45.1 Å²	45.1	11%	0.107	23%	0.225	C	C	.	.			trans	-76.5	169.1	164.9	67.1	21.7	0	0	0	111.2	N175 K176 L177 E217 Y219	N173-N175 PolarHBondContact O-N 2.88Å; N173-N175 VanDerWaalsContact O-N 3.11Å; N173-N175 PolarHBondContact OD1-N 2.99Å; N173-K176 PolarHBondContact O-N 3.29Å; N173-K176 WeakPolarHBondContact OD1-CG 3.47Å; N173-K176 PolarHBondContact OD1-N 2.89Å; N173-L177 PolarHBondContact O-N 3.32Å; N173-E217 HydrophobicContact CB-CB 4Å; N173-Y219 HydrophobicContact CB-CE2 4.38Å
174	G	92.9	Very high	91.2	Very high	11 Å²	11	51.5 Å²	51.5	11%	0.113	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.4	-179.3	0	0	0	0	0	115	K176 L177 P218	G174-K176 VanDerWaalsContact C-N 3.31Å; G174-L177 WeakPolarHBondContact CA-O 3.13Å; G174-P218 WeakPolarHBondContact CA-O 3.4Å; G174-P218 PolarHBondContact N-O 3.26Å
175	N	92.5	Very high	90.3	Very high	91 Å²	91	50.1 Å²	50.1	49%	0.487	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-15.3	174.4	-62.8	-28.3	0	0	0	112.4	A49 N173	A49-N175 WeakPolarHBondContact CB-O 3.34Å; N173-N175 PolarHBondContact O-N 2.88Å; N173-N175 VanDerWaalsContact O-N 3.11Å; N173-N175 PolarHBondContact OD1-N 2.99Å
176	K	94	Very high	89.9	Confident	76 Å²	76	50.7 Å²	50.7	33%	0.33	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-36.8	-178.5	-63.4	-69	174	-174.1	0	112.1	R41 C46 A49 V50 Y172 N173 G174	R41-K176 VanDerWaalsContact NH1-CA 3.34Å; R41-K176 PolarHBondContact NH1-O 3.48Å; R41-K176 VanDerWaalsContact NH2-CD 3.33Å; C46-K176 PolarHBondContact O-NZ 2.9Å; A49-K176 WeakPolarHBondContact CA-O 3.2Å; V50-K176 PolarHBondContact N-O 3.42Å; Y172-K176 HydrophobicContact CD1-CB 3.93Å; Y172-K176 HydrophobicContact CG-CB 4.35Å; N173-K176 PolarHBondContact O-N 3.29Å; N173-K176 WeakPolarHBondContact OD1-CG 3.47Å; N173-K176 PolarHBondContact OD1-N 2.89Å; G174-K176 VanDerWaalsContact C-N 3.31Å
177	L	95.5	Very high	89.7	Confident	3 Å²	3	51 Å²	51	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	116.4	174.6	-173.2	158.4	0	0	0	108.3	V52 W107 P109 Y172 N173 G174 L179	V52-L177 HydrophobicContact CB-CD2 4.49Å; V52-L177 HydrophobicContact CG2-CD1 4.3Å; V52-L177 HydrophobicContact CG2-CD2 4.25Å; V52-L177 HydrophobicContact CG2-CG 4.05Å; W107-L177 HydrophobicContact CH2-CD1 4.27Å; W107-L177 HydrophobicContact CZ2-CD1 4.47Å; P109-L177 HydrophobicContact CB-CD1 3.81Å; Y172-L177 HydrophobicContact CD2-CB 4.3Å; Y172-L177 HydrophobicContact CD2-CD1 3.92Å; Y172-L177 HydrophobicContact CG-CB 4.17Å; N173-L177 PolarHBondContact O-N 3.32Å; G174-L177 WeakPolarHBondContact CA-O 3.13Å; L177-L179 HydrophobicContact CD2-CB 4.27Å
178	N	95.3	Very high	89.6	Confident	35 Å²	35	54.2 Å²	54.2	19%	0.187	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	107.3	178.1	176.5	34.3	0	0	0	109.1	A49 V50 D51 V52 R206	A49-N178 HydrophobicContact CB-CB 4Å; V50-N178 PolarHBondContact O-N 3.47Å; D51-N178 WeakPolarHBondContact CA-O 3.41Å; D51-N178 VanDerWaalsContact OD1-CB 3.31Å; D51-N178 WeakPolarHBondContact OD1-CB 3.46Å; D51-N178 PolarHBondContact OD1-ND2 2.89Å; V52-N178 PolarHBondContact N-O 2.88Å; N178-R206 PolarHBondContact OD1-NH2 3.28Å
179	L	95.2	Very high	89.5	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.4	177.6	-166.4	64.6	0	0	0	109.4	V52 L54 V111 L177 R206 V220 V222	V52-L179 HydrophobicContact CB-CD1 4.19Å; V52-L179 HydrophobicContact CG1-CD1 4.09Å; L54-L179 HydrophobicContact CB-CD1 3.92Å; L54-L179 HydrophobicContact CD2-CD1 4.41Å; L54-L179 HydrophobicContact CD2-CD2 4.34Å; V111-L179 HydrophobicContact CG1-CD2 4.28Å; V111-L179 HydrophobicContact CG2-CD1 3.93Å; L177-L179 HydrophobicContact CD2-CB 4.27Å; L179-R206 PolarHBondContact O-NE 3.03Å; L179-V220 HydrophobicContact CB-CG1 4.11Å; L179-V220 WeakPolarHBondContact O-CG1 3.44Å; L179-V222 HydrophobicContact CB-CG2 4.33Å; L179-V222 HydrophobicContact CD2-CB 4.14Å; L179-V222 HydrophobicContact CD2-CG2 3.75Å; L179-V222 HydrophobicContact CG-CG2 3.75Å
180	V	92.7	Very high	89.3	Confident	47 Å²	47	63.8 Å²	63.8	29%	0.285	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.3	-178.1	-176.5	0	0	0	0	108.4	V52 T53 L54	V52-V180 PolarHBondContact O-N 2.91Å; T53-V180 CarbonylContact C-O 3.56Å; T53-V180 VanDerWaalsContact CA-O 3.27Å; T53-V180 WeakPolarHBondContact CA-O 3.5Å; L54-V180 PolarHBondContact N-O 3.21Å
181	N	88.9	Confident	89.5	Confident	50 Å²	50	57.7 Å²	57.7	27%	0.267	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	147.4	173	60.5	-72	0	0	0	110.7	V204 V222	N181-V204 HydrophobicContact CB-CG1 3.86Å; N181-V222 HydrophobicContact CB-CG1 3.99Å
182	S	83.9	Confident	89.7	Confident	28 Å²	28	58.9 Å²	58.9	20%	0.196	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	156.5	166.8	-175.2	0	0	0	0	110.8	L54 N184 G185	L54-S182 PolarHBondContact O-N 3.32Å; S182-N184 PolarHBondContact O-N 3.24Å; S182-G185 WeakPolarHBondContact O-CA 3.47Å; S182-G185 PolarHBondContact O-N 2.65Å
183	E	75.9	Confident	89.7	Confident	193 Å²	193	63 Å²	63	90%	0.902	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.5	-39.2	-176.9	-71.7	-174.2	166	0	0	112.6
184	N	70.3	Confident	89.6	Confident	134 Å²	134	63.5 Å²	63.5	72%	0.717	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	-15.3	176.4	-64.9	-25.6	0	0	0	113	S182 W186	S182-N184 PolarHBondContact O-N 3.24Å; N184-W186 PolarHBondContact O-N 2.91Å
185	G	76.3	Confident	89.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66.6	-68.2	-178.1	0	0	0	0	0	113.5	L56 S182 F224	L56-G185 PolarHBondContact N-O 2.91Å; S182-G185 WeakPolarHBondContact O-CA 3.47Å; S182-G185 PolarHBondContact O-N 2.65Å; G185-F224 WeakPolarHBondContact O-CE1 3.31Å
186	W	87.4	Confident	89.5	Confident	12 Å²	12	65 Å²	65	5%	0.045	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	138.7	172.1	-68.5	98.5	0	0	0	111.5	L56 L58 V75 L165 N184 L188 A202 V204 F224 C225 L226	L56-W186 HydrophobicContact CB-CD2 4.31Å; L56-W186 HydrophobicContact CB-CE3 3.6Å; L56-W186 HydrophobicContact CB-CZ3 3.72Å; L56-W186 HydrophobicContact CD1-CE3 4.36Å; L56-W186 HydrophobicContact CD1-CH2 3.89Å; L56-W186 HydrophobicContact CD1-CZ2 4.38Å; L56-W186 HydrophobicContact CD1-CZ3 3.86Å; L56-W186 HydrophobicContact CG-CZ3 4.43Å; L56-W186 CarbonylContact O-C 3.53Å; L56-W186 WeakPolarHBondContact O-CA 3.35Å; L58-W186 HydrophobicContact CB-CE3 3.96Å; L58-W186 HydrophobicContact CB-CZ3 3.91Å; L58-W186 HydrophobicContact CD1-CZ3 4.27Å; L58-W186 HydrophobicContact CG-CZ3 4.5Å; V75-W186 HydrophobicContact CG1-CZ3 4.4Å; L165-W186 HydrophobicContact CD1-CH2 3.88Å; N184-W186 PolarHBondContact O-N 2.91Å; W186-L188 HydrophobicContact CB-CD2 4.16Å; W186-L188 HydrophobicContact CB-CG 4.25Å; W186-A202 HydrophobicContact CB-CB 4.47Å; W186-A202 HydrophobicContact CG-CB 4Å; W186-V204 HydrophobicContact CG-CG2 4.28Å; W186-F224 HydrophobicContact CD2-CD1 4.18Å; W186-F224 HydrophobicContact CG-CD1 4.4Å; W186-F224 HydrophobicContact CH2-CB 4.06Å; W186-F224 HydrophobicContact CZ2-CB 3.4Å; W186-F224 HydrophobicContact CZ2-CG 4.42Å; W186-C225 PolarHBondContact NE1-O 3.4Å; W186-L226 HydrophobicContact CD2-CD2 4.31Å; W186-L226 HydrophobicContact CH2-CD1 4.08Å; W186-L226 HydrophobicContact CH2-CD2 3.74Å; W186-L226 HydrophobicContact CH2-CG 3.9Å; W186-L226 HydrophobicContact CZ2-CD1 4.32Å; W186-L226 HydrophobicContact CZ2-CD2 3.4Å; W186-L226 VanDerWaalsContact CZ2-CD2 3.4Å; W186-L226 HydrophobicContact CZ2-CG 3.63Å; W186-L226 HydrophobicContact CZ3-CD2 4.31Å
187	D	91.1	Very high	89.6	Confident	47 Å²	47	61.5 Å²	61.5	25%	0.251	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114.3	160.1	-174.5	-4.1	0	0	0	108.5	L56 I57 L58 S189	L56-D187 PolarHBondContact O-N 3.46Å; I57-D187 WeakPolarHBondContact CA-O 3.42Å; I57-D187 HydrophobicContact CB-CB 4.27Å; I57-D187 HydrophobicContact CG1-CB 3.96Å; I57-D187 HydrophobicContact CG2-CB 4.16Å; L58-D187 PolarHBondContact N-O 3.36Å; D187-S189 WeakPolarHBondContact OD1-CB 3.42Å; D187-S189 PolarHBondContact OD1-N 3.28Å; D187-S189 PolarHBondContact OD1-OG 2.89Å; D187-S189 PolarHBondContact OD2-OG 3.47Å
188	L	92.5	Very high	89.5	Confident	69 Å²	69	64.5 Å²	64.5	36%	0.361	35%	0.351	S	S	.	.			trans	-105.5	10.6	-179.4	-57.2	178.3	0	0	0	112	L58 W186 E190 Y191 L199 A202	L58-L188 HydrophobicContact CB-CD2 3.83Å; L58-L188 HydrophobicContact CD2-CD2 3.93Å; W186-L188 HydrophobicContact CB-CD2 4.16Å; W186-L188 HydrophobicContact CB-CG 4.25Å; L188-E190 VanDerWaalsContact C-N 3.28Å; L188-E190 PolarHBondContact O-N 3.41Å; L188-Y191 WeakPolarHBondContact O-CB 3.38Å; L188-Y191 PolarHBondContact O-N 3.22Å; L188-L199 HydrophobicContact CD1-CD2 3.96Å; L188-L199 HydrophobicContact CD2-CD2 4Å; L188-A202 HydrophobicContact CD1-CB 4.21Å
189	S	91.5	Very high	89.5	Confident	87 Å²	87	64.3 Å²	64.3	61%	0.608	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-34.8	-175.9	55.7	0	0	0	0	113.6	D187	D187-S189 WeakPolarHBondContact OD1-CB 3.42Å; D187-S189 PolarHBondContact OD1-N 3.28Å; D187-S189 PolarHBondContact OD1-OG 2.89Å; D187-S189 PolarHBondContact OD2-OG 3.47Å
190	E	91.8	Very high	89.4	Confident	117 Å²	117	67.5 Å²	67.5	55%	0.547	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	12.5	179.8	-63	-67.8	162.5	0	0	112.9	F59 L188 L192	F59-E190 HydrophobicContact CD1-CB 4.45Å; F59-E190 HydrophobicContact CD2-CB 4.49Å; F59-E190 HydrophobicContact CE1-CB 4.1Å; F59-E190 HydrophobicContact CE2-CB 4.11Å; F59-E190 HydrophobicContact CE2-CG 4.45Å; F59-E190 HydrophobicContact CZ-CB 3.91Å; F59-E190 HydrophobicContact CZ-CG 4.1Å; L188-E190 VanDerWaalsContact C-N 3.28Å; L188-E190 PolarHBondContact O-N 3.41Å; E190-L192 PolarHBondContact O-N 3.18Å
191	Y	94.6	Very high	89.5	Confident	43 Å²	43	69.5 Å²	69.5	17%	0.169	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-69.6	117.8	-176	176.5	-115.3	0	0	0	111.8	L58 I61 L188 E193 L199	L58-Y191 HydrophobicContact CD2-CD2 3.62Å; L58-Y191 HydrophobicContact CD2-CE2 3.76Å; L58-Y191 HydrophobicContact CD2-CG 4.47Å; L58-Y191 HydrophobicContact CG-CD2 3.79Å; L58-Y191 HydrophobicContact CG-CE2 4.22Å; L58-Y191 WeakPolarHBondContact O-CA 3.32Å; I61-Y191 HydrophobicContact CD1-CE2 4.42Å; I61-Y191 HydrophobicContact CG1-CE2 4.26Å; L188-Y191 WeakPolarHBondContact O-CB 3.38Å; L188-Y191 PolarHBondContact O-N 3.22Å; Y191-E193 HydrophobicContact CE1-CG 4.44Å; Y191-L199 HydrophobicContact CD1-CD2 4.31Å; Y191-L199 HydrophobicContact CE1-CB 4.01Å; Y191-L199 HydrophobicContact CE1-CD2 4.11Å
192	L	94.8	Very high	89.7	Confident	115 Å²	115	68 Å²	68	60%	0.602	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-82.5	119	168.9	-176.3	66.5	0	0	0	110	F59 Q60 E190 N194	F59-L192 PolarHBondContact O-N 2.83Å; Q60-L192 HydrophobicContact CB-CB 4.44Å; E190-L192 PolarHBondContact O-N 3.18Å; L192-N194 PolarHBondContact O-N 3.41Å
193	E	92.9	Very high	90.2	Very high	145 Å²	145	68.3 Å²	68.3	68%	0.678	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-57.5	133.4	177.9	-68.6	-170.9	-170.4	0	0	112.2	Y191 R231	Y191-E193 HydrophobicContact CE1-CG 4.44Å; E193-R231 IonicContact OE2-NH2 2.73Å
194	N	91.9	Very high	91.1	Very high	30 Å²	30	60.8 Å²	60.8	16%	0.16	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-85.2	140.2	178.1	-173.6	-65	0	0	0	111.1	I61 L192 E196 W197 R231	I61-N194 PolarHBondContact O-ND2 2.84Å; L192-N194 PolarHBondContact O-N 3.41Å; N194-E196 VanDerWaalsContact C-N 3.26Å; N194-E196 PolarHBondContact O-N 3.24Å; N194-E196 WeakPolarHBondContact OD1-CA 3.37Å; N194-E196 WeakPolarHBondContact OD1-CB 3.32Å; N194-E196 PolarHBondContact OD1-N 3.01Å; N194-W197 HydrophobicContact CB-CB 4.34Å; N194-W197 PolarHBondContact OD1-N 3.39Å; N194-W197 VanDerWaalsContact OD1-N 3.08Å; N194-R231 PolarHBondContact O-NE 2.88Å
195	G	91.6	Very high	92.2	Very high	74 Å²	74	57.5 Å²	57.5	76%	0.763	32%	0.323	S	S	*	.	S	Bend	trans	-72.2	-14.9	-178.5	0	0	0	0	0	114.9	R231	G195-R231 WeakPolarHBondContact O-CD 3.39Å
196	E	91.8	Very high	93.1	Very high	59 Å²	59	62.1 Å²	62.1	28%	0.276	34%	0.341	S	S	.	.	S	Bend	trans	-112.3	-37.3	179.8	-176.5	177	-178.8	0	0	112.2	N194 R230 R231 Y235	N194-E196 VanDerWaalsContact C-N 3.26Å; N194-E196 PolarHBondContact O-N 3.24Å; N194-E196 WeakPolarHBondContact OD1-CA 3.37Å; N194-E196 WeakPolarHBondContact OD1-CB 3.32Å; N194-E196 PolarHBondContact OD1-N 3.01Å; E196-R230 IonicContact OE1-NH1 2.7Å; E196-R230 PolarHBondContact OE1-NH1 2.97Å; E196-R231 WeakPolarHBondContact O-CB 3.5Å; E196-R231 WeakPolarHBondContact O-CG 3.39Å; E196-R231 PolarHBondContact O-N 3.27Å; E196-Y235 PolarHBondContact OE1-OH 2.95Å
197	W	94.8	Very high	93.4	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.008	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.5	-174	-63.5	98.1	0	0	0	111.9	V64 Q161 N194 I228 R230	V64-W197 HydrophobicContact CB-CZ2 3.95Å; V64-W197 HydrophobicContact CG1-CZ2 3.97Å; V64-W197 HydrophobicContact CG2-CZ2 4.44Å; Q161-W197 HydrophobicContact CB-CZ3 4.4Å; Q161-W197 HydrophobicContact CG-CH2 3.85Å; Q161-W197 HydrophobicContact CG-CZ3 3.84Å; N194-W197 HydrophobicContact CB-CB 4.34Å; N194-W197 PolarHBondContact OD1-N 3.39Å; N194-W197 VanDerWaalsContact OD1-N 3.08Å; W197-I228 HydrophobicContact CB-CB 4.43Å; W197-I228 HydrophobicContact CD2-CD1 3.82Å; W197-I228 HydrophobicContact CD2-CG1 4.28Å; W197-I228 HydrophobicContact CE3-CB 3.96Å; W197-I228 HydrophobicContact CE3-CD1 3.66Å; W197-I228 HydrophobicContact CE3-CG1 3.64Å; W197-I228 HydrophobicContact CG-CD1 4.28Å; W197-I228 HydrophobicContact CH2-CD1 4.47Å; W197-I228 HydrophobicContact CZ3-CD1 4.01Å; W197-I228 HydrophobicContact CZ3-CG1 3.94Å; W197-R230 HydrophobicContact CE3-CB 4.18Å; W197-R230 HydrophobicContact CH2-CB 4.33Å; W197-R230 VanDerWaalsContact CZ2-CZ 3.43Å; W197-R230 VanDerWaalsContact CZ2-NH2 3.35Å; W197-R230 HydrophobicContact CZ3-CB 3.85Å
198	L	94.9	Very high	93.5	Very high	67 Å²	67	64.5 Å²	64.5	35%	0.351	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.1	169.9	178.7	68.4	0	0	0	109	T200 I228 R229	L198-T200 PolarHBondContact O-N 3.44Å; L198-I228 CarbonylContact O-C 3.56Å; L198-I228 WeakPolarHBondContact O-CA 3.49Å; L198-R229 HydrophobicContact CB-CB 4.38Å; L198-R229 PolarHBondContact N-O 3.05Å; L198-R229 PolarHBondContact O-N 3.18Å
199	L	95.2	Very high	93.4	Very high	31 Å²	31	64.8 Å²	64.8	16%	0.162	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	116	171.7	-177.2	63.9	0	0	0	109.4	L58 L188 Y191 L226 I228	L58-L199 HydrophobicContact CD2-CD2 4.14Å; L188-L199 HydrophobicContact CD1-CD2 3.96Å; L188-L199 HydrophobicContact CD2-CD2 4Å; Y191-L199 HydrophobicContact CD1-CD2 4.31Å; Y191-L199 HydrophobicContact CE1-CB 4.01Å; Y191-L199 HydrophobicContact CE1-CD2 4.11Å; L199-L226 HydrophobicContact CD1-CB 4.13Å; L199-L226 HydrophobicContact CD1-CD2 3.86Å; L199-I228 HydrophobicContact CD1-CG2 4.03Å
200	T	93.1	Very high	93.5	Very high	67 Å²	67	66.2 Å²	66.2	41%	0.411	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-40.2	-177.2	58.1	0	0	0	0	112.6	L198 N227 R229	L198-T200 PolarHBondContact O-N 3.44Å; T200-N227 PolarHBondContact N-O 2.97Å; T200-N227 WeakPolarHBondContact OG1-CB 3.48Å; T200-N227 PolarHBondContact OG1-O 2.98Å; T200-R229 HydrophobicContact CG2-CB 3.89Å
201	D	93.3	Very high	93.4	Very high	90 Å²	90	64.3 Å²	64.3	48%	0.481	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	156	-178.4	-175	24.5	0	0	0	109.4	N227	D201-N227 HydrophobicContact CB-CB 4.15Å; D201-N227 PolarHBondContact N-O 3.3Å; D201-N227 WeakPolarHBondContact O-CB 3.41Å; D201-N227 PolarHBondContact O-N 3.02Å
202	A	94.8	Very high	93.2	Very high	17 Å²	17	69.2 Å²	69.2	14%	0.14	38%	0.38	C	S	.	.			trans	-138.9	72.8	-177.7	0	0	0	0	0	110.9	W186 L188 C225 L226	W186-A202 HydrophobicContact CB-CB 4.47Å; W186-A202 HydrophobicContact CG-CB 4Å; L188-A202 HydrophobicContact CD1-CB 4.21Å; A202-C225 CarbonylContact C-O 3.55Å; A202-C225 VanDerWaalsContact CA-O 3.23Å; A202-C225 WeakPolarHBondContact CA-O 3.5Å; A202-L226 HydrophobicContact CB-CD2 4.03Å
203	P	94.6	Very high	93.1	Very high	36 Å²	36	68.8 Å²	68.8	23%	0.234	39%	0.386	C	S	.	.			trans	-76.2	148.4	-177.6	28.1	-31.6	0	0	0	112.4	C225	P203-C225 WeakPolarHBondContact CD-O 3.42Å; P203-C225 HydrophobicContact CG-CB 4.06Å; P203-C225 PolarHBondContact O-N 3.39Å
204	V	94.5	Very high	92.9	Very high	35 Å²	35	63.4 Å²	63.4	21%	0.212	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129	173.4	-176.9	0	0	0	0	110.1	N181 W186 V222 R223 F224	N181-V204 HydrophobicContact CB-CG1 3.86Å; W186-V204 HydrophobicContact CG-CG2 4.28Å; V204-V222 HydrophobicContact CG1-CG1 3.56Å; V204-R223 CarbonylContact C-O 3.49Å; V204-R223 WeakPolarHBondContact CA-O 3.38Å; V204-F224 HydrophobicContact CB-CD1 4.33Å; V204-F224 HydrophobicContact CG1-CD1 3.92Å; V204-F224 HydrophobicContact CG1-CE1 3.85Å; V204-F224 HydrophobicContact CG1-CG 4.34Å; V204-F224 HydrophobicContact CG1-CZ 4.25Å; V204-F224 HydrophobicContact CG2-CD1 3.44Å; V204-F224 VanDerWaalsContact CG2-CD1 3.44Å; V204-F224 HydrophobicContact CG2-CE1 3.84Å; V204-F224 HydrophobicContact CG2-CG 4.27Å
205	I	93.5	Very high	92.7	Very high	65 Å²	65	66.1 Å²	66.1	33%	0.333	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	114	-174.9	-52.7	171.3	0	0	0	108.9	N207 R223	I205-N207 WeakPolarHBondContact CG2-OD1 3.34Å; I205-R223 HydrophobicContact CB-CB 4.44Å; I205-R223 PolarHBondContact N-O 3.47Å; I205-R223 PolarHBondContact O-N 2.62Å
206	R	94.2	Very high	92.7	Very high	96 Å²	96	69.7 Å²	69.7	36%	0.362	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.5	169.7	-176.6	176.7	176.7	-79.9	0.4	109.9	N178 L179 V220 V222	N178-R206 PolarHBondContact OD1-NH2 3.28Å; L179-R206 PolarHBondContact O-NE 3.03Å; R206-V220 HydrophobicContact CG-CG1 4.21Å; R206-V222 HydrophobicContact CB-CG2 4.45Å; R206-V222 HydrophobicContact CG-CG2 4.23Å
207	N	94	Very high	92.7	Very high	26 Å²	26	70.2 Å²	70.2	14%	0.139	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	148.5	175.5	-57.7	-39.1	0	0	0	110.9	I205 Q209 V220 D221 R223	I205-N207 WeakPolarHBondContact CG2-OD1 3.34Å; N207-Q209 HydrophobicContact CB-CG 4.34Å; N207-V220 WeakPolarHBondContact O-CA 3.21Å; N207-D221 PolarHBondContact N-O 3.43Å; N207-D221 PolarHBondContact ND2-OD2 3.38Å; N207-D221 PolarHBondContact O-N 3.37Å; N207-R223 VanDerWaalsContact ND2-CZ 3.33Å; N207-R223 PolarHBondContact ND2-NE 3.43Å; N207-R223 PolarHBondContact ND2-NH2 3.29Å; N207-R223 PolarHBondContact OD1-NH2 3.35Å
208	V	94.2	Very high	92.7	Very high	83 Å²	83	71.5 Å²	71.5	50%	0.503	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	114.3	166.1	-174.9	0	0	0	0	106.9	P218 V220	V208-P218 HydrophobicContact CG1-CB 3.64Å; V208-V220 HydrophobicContact CG2-CG2 4.29Å
209	Q	90.4	Very high	92.6	Very high	75 Å²	75	70 Å²	70	35%	0.35	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142	-177	-61.3	-162.9	-8.2	0	0	111.1	N207 Y211 Y219	N207-Q209 HydrophobicContact CB-CG 4.34Å; Q209-Y211 HydrophobicContact CB-CE2 4.47Å; Q209-Y219 PolarHBondContact N-O 3.12Å; Q209-Y219 PolarHBondContact O-N 3.04Å
210	L	92.7	Very high	92.6	Very high	117 Å²	117	69.1 Å²	69.1	61%	0.613	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	115.6	169.1	-72.9	166.5	0	0	0	107.4	P215 P218	L210-P215 VanDerWaalsContact CD2-O 3.3Å; L210-P215 WeakPolarHBondContact CD2-O 3.41Å; L210-P218 HydrophobicContact CD2-CB 4.41Å
211	Y	89.1	Confident	92.7	Very high	77 Å²	77	66 Å²	66	30%	0.302	36%	0.361	S	S	.	.			trans	-85.1	151.1	179.6	-72.2	-74.5	0	0	0	111.3	K166 Q209 C213 C214 Y219	K166-Y211 PolarHBondContact NZ-OH 2.84Å; Q209-Y211 HydrophobicContact CB-CE2 4.47Å; Y211-C213 PolarHBondContact O-N 2.91Å; Y211-C214 CarbonylContact O-C 3.59Å; Y211-C214 VanDerWaalsContact O-C 3.23Å; Y211-C214 PolarHBondContact O-N 3.18Å; Y211-Y219 AromaticContact CD2-CD2 3.74Å; Y211-Y219 HydrophobicContact CD2-CD2 3.74Å; Y211-Y219 AromaticContact CD2-CG 3.87Å; Y211-Y219 HydrophobicContact CD2-CG 3.87Å; Y211-Y219 HydrophobicContact CE2-CD2 4.33Å; Y211-Y219 AromaticContact CE2-CG 3.98Å; Y211-Y219 HydrophobicContact CE2-CG 3.98Å
212	T	91.6	Very high	92.8	Very high	147 Å²	147	61.7 Å²	61.7	90%	0.902	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-29	-179.7	-44.4	0	0	0	0	113	C214	T212-C214 VanDerWaalsContact C-N 3.35Å
213	C	91.2	Very high	92.8	Very high	106 Å²	106	64.8 Å²	64.8	72%	0.716	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-29.8	175.2	53.2	0	0	0	0	113.3	Y211	Y211-C213 PolarHBondContact O-N 2.91Å
214	C	89.7	Confident	92.9	Very high	32 Å²	32	63.1 Å²	63.1	22%	0.216	34%	0.336	C	S	.	.			trans	-138.7	74.4	-170.9	-62	0	0	0	0	110.9	Y211 T212 N216 E217 Y219	Y211-C214 CarbonylContact O-C 3.59Å; Y211-C214 VanDerWaalsContact O-C 3.23Å; Y211-C214 PolarHBondContact O-N 3.18Å; T212-C214 VanDerWaalsContact C-N 3.35Å; C214-N216 PolarHBondContact O-N 3.43Å; C214-E217 HydrophobicContact CB-CB 3.97Å; C214-E217 HydrophobicContact CB-CG 4.24Å; C214-E217 WeakPolarHBondContact CB-OE2 3.35Å; C214-E217 PolarHBondContact O-N 3.38Å; C214-E217 PolarHBondContact SG-OE2 3.23Å; C214-Y219 HydrophobicContact CB-CE2 4.07Å
215	P	88.1	Confident	93	Very high	86 Å²	86	61.5 Å²	61.5	56%	0.558	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-19	-173.4	26.8	-35.5	0	0	0	114.4	L210	L210-P215 VanDerWaalsContact CD2-O 3.3Å; L210-P215 WeakPolarHBondContact CD2-O 3.41Å
216	N	90.8	Very high	93.1	Very high	149 Å²	149	58.4 Å²	58.4	80%	0.797	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	2.1	-179.5	-63.7	-24.3	0	0	0	113.2	C214	C214-N216 PolarHBondContact O-N 3.43Å
217	E	92.2	Very high	93.1	Very high	71 Å²	71	55.4 Å²	55.4	33%	0.332	30%	0.301	S	S	.	.			trans	-121.3	107.2	-174.2	-58.5	-177.6	159.6	0	0	109.5	N173 C214 Y219	N173-E217 HydrophobicContact CB-CB 4Å; C214-E217 HydrophobicContact CB-CB 3.97Å; C214-E217 HydrophobicContact CB-CG 4.24Å; C214-E217 WeakPolarHBondContact CB-OE2 3.35Å; C214-E217 PolarHBondContact O-N 3.38Å; C214-E217 PolarHBondContact SG-OE2 3.23Å; E217-Y219 HydrophobicContact CB-CE2 3.9Å; E217-Y219 VanDerWaalsContact O-CD2 3.3Å; E217-Y219 WeakPolarHBondContact O-CD2 3.1Å; E217-Y219 PolarHBondContact O-N 3.43Å; E217-Y219 PolarHBondContact OE2-OH 3.15Å
218	P	94.1	Very high	93.2	Very high	28 Å²	28	54.2 Å²	54.2	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	131.5	174.6	28.5	-32	0	0	0	109.4	G174 V208 L210	G174-P218 WeakPolarHBondContact CA-O 3.4Å; G174-P218 PolarHBondContact N-O 3.26Å; V208-P218 HydrophobicContact CG1-CB 3.64Å; L210-P218 HydrophobicContact CD2-CB 4.41Å
219	Y	94.4	Very high	93.2	Very high	37 Å²	37	54.2 Å²	54.2	15%	0.145	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.3	169.7	-75.3	-99.6	0	0	0	108.7	N173 Q209 Y211 C214 E217	N173-Y219 HydrophobicContact CB-CE2 4.38Å; Q209-Y219 PolarHBondContact N-O 3.12Å; Q209-Y219 PolarHBondContact O-N 3.04Å; Y211-Y219 AromaticContact CD2-CD2 3.74Å; Y211-Y219 HydrophobicContact CD2-CD2 3.74Å; Y211-Y219 AromaticContact CD2-CG 3.87Å; Y211-Y219 HydrophobicContact CD2-CG 3.87Å; Y211-Y219 HydrophobicContact CE2-CD2 4.33Å; Y211-Y219 AromaticContact CE2-CG 3.98Å; Y211-Y219 HydrophobicContact CE2-CG 3.98Å; C214-Y219 HydrophobicContact CB-CE2 4.07Å; E217-Y219 HydrophobicContact CB-CE2 3.9Å; E217-Y219 VanDerWaalsContact O-CD2 3.3Å; E217-Y219 WeakPolarHBondContact O-CD2 3.1Å; E217-Y219 PolarHBondContact O-N 3.43Å; E217-Y219 PolarHBondContact OE2-OH 3.15Å
220	V	94.9	Very high	93.4	Very high	11 Å²	11	51 Å²	51	7%	0.067	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126	-178.1	-175.4	0	0	0	0	108.8	L179 R206 N207 V208	L179-V220 HydrophobicContact CB-CG1 4.11Å; L179-V220 WeakPolarHBondContact O-CG1 3.44Å; R206-V220 HydrophobicContact CG-CG1 4.21Å; N207-V220 WeakPolarHBondContact O-CA 3.21Å; V208-V220 HydrophobicContact CG2-CG2 4.29Å
221	D	94.8	Very high	93.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	146.5	171.1	68.5	-105	0	0	0	110.9	Y114 K166 F167 N207	Y114-D221 HydrophobicContact CE2-CB 4.4Å; K166-D221 WeakPolarHBondContact CE-OD1 3.39Å; K166-D221 WeakPolarHBondContact CE-OD2 3.48Å; K166-D221 HydrophobicContact CG-CB 4.22Å; K166-D221 IonicContact NZ-OD1 3.46Å; K166-D221 PolarHBondContact NZ-OD1 2.76Å; F167-D221 CarbonylContact O-C 3.6Å; F167-D221 WeakPolarHBondContact O-CA 3.1Å; F167-D221 WeakPolarHBondContact O-CB 3.47Å; N207-D221 PolarHBondContact N-O 3.43Å; N207-D221 PolarHBondContact ND2-OD2 3.38Å; N207-D221 PolarHBondContact O-N 3.37Å
222	V	95.1	Very high	93.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	119	173.3	-177.4	0	0	0	0	107.7	F167 L179 N181 V204 R206 F224	F167-V222 PolarHBondContact N-O 2.73Å; F167-V222 PolarHBondContact O-N 2.99Å; L179-V222 HydrophobicContact CB-CG2 4.33Å; L179-V222 HydrophobicContact CD2-CB 4.14Å; L179-V222 HydrophobicContact CD2-CG2 3.75Å; L179-V222 HydrophobicContact CG-CG2 3.75Å; N181-V222 HydrophobicContact CB-CG1 3.99Å; V204-V222 HydrophobicContact CG1-CG1 3.56Å; R206-V222 HydrophobicContact CB-CG2 4.45Å; R206-V222 HydrophobicContact CG-CG2 4.23Å; V222-F224 HydrophobicContact CB-CE2 3.98Å; V222-F224 HydrophobicContact CG1-CD2 3.89Å; V222-F224 HydrophobicContact CG1-CE2 3.35Å; V222-F224 HydrophobicContact CG1-CZ 3.71Å
223	R	95.3	Very high	93.3	Very high	83 Å²	83	47.9 Å²	47.9	31%	0.313	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121.2	176.1	-67.5	-174.3	-65.1	177.5	-10.7	109.7	L165 K166 V204 I205 N207	L165-R223 WeakPolarHBondContact O-CA 3.13Å; K166-R223 HydrophobicContact CB-CG 4.25Å; K166-R223 HydrophobicContact CG-CG 4.03Å; V204-R223 CarbonylContact C-O 3.49Å; V204-R223 WeakPolarHBondContact CA-O 3.38Å; I205-R223 HydrophobicContact CB-CB 4.44Å; I205-R223 PolarHBondContact N-O 3.47Å; I205-R223 PolarHBondContact O-N 2.62Å; N207-R223 VanDerWaalsContact ND2-CZ 3.33Å; N207-R223 PolarHBondContact ND2-NE 3.43Å; N207-R223 PolarHBondContact ND2-NH2 3.29Å; N207-R223 PolarHBondContact OD1-NH2 3.35Å
224	F	95.8	Very high	93.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	107.6	173.4	-68.9	-96.1	0	0	0	108.2	L54 L56 C164 L165 F167 G185 W186 V204 V222	L54-F224 HydrophobicContact CD2-CE2 3.67Å; L54-F224 HydrophobicContact CD2-CZ 4.16Å; L54-F224 HydrophobicContact CG-CE2 3.94Å; L54-F224 HydrophobicContact CG-CZ 3.89Å; L56-F224 HydrophobicContact CB-CD1 4.03Å; L56-F224 HydrophobicContact CB-CE1 4.07Å; L56-F224 HydrophobicContact CD1-CB 3.44Å; L56-F224 VanDerWaalsContact CD1-CB 3.44Å; L56-F224 HydrophobicContact CD1-CD1 3.51Å; L56-F224 HydrophobicContact CD1-CD2 3.47Å; L56-F224 VanDerWaalsContact CD1-CD2 3.47Å; L56-F224 HydrophobicContact CD1-CE1 4.03Å; L56-F224 HydrophobicContact CD1-CE2 3.98Å; L56-F224 HydrophobicContact CD1-CG 3.19Å; L56-F224 HydrophobicContact CD1-CZ 4.24Å; L56-F224 HydrophobicContact CG-CD1 3.91Å; L56-F224 HydrophobicContact CG-CD2 4.15Å; L56-F224 HydrophobicContact CG-CE1 3.94Å; L56-F224 HydrophobicContact CG-CE2 4.16Å; L56-F224 HydrophobicContact CG-CG 4.02Å; L56-F224 HydrophobicContact CG-CZ 4.07Å; C164-F224 CarbonylContact C-O 3.57Å; C164-F224 WeakPolarHBondContact CA-O 3.38Å; L165-F224 HydrophobicContact CB-CB 4.39Å; L165-F224 PolarHBondContact N-O 2.63Å; L165-F224 PolarHBondContact O-N 3.13Å; F167-F224 AromaticContact CD2-CD2 3.86Å; F167-F224 HydrophobicContact CD2-CD2 3.86Å; F167-F224 HydrophobicContact CD2-CE2 4.18Å; F167-F224 HydrophobicContact CE2-CD2 4.45Å; G185-F224 WeakPolarHBondContact O-CE1 3.31Å; W186-F224 HydrophobicContact CD2-CD1 4.18Å; W186-F224 HydrophobicContact CG-CD1 4.4Å; W186-F224 HydrophobicContact CH2-CB 4.06Å; W186-F224 HydrophobicContact CZ2-CB 3.4Å; W186-F224 HydrophobicContact CZ2-CG 4.42Å; V204-F224 HydrophobicContact CB-CD1 4.33Å; V204-F224 HydrophobicContact CG1-CD1 3.92Å; V204-F224 HydrophobicContact CG1-CE1 3.85Å; V204-F224 HydrophobicContact CG1-CG 4.34Å; V204-F224 HydrophobicContact CG1-CZ 4.25Å; V204-F224 HydrophobicContact CG2-CD1 3.44Å; V204-F224 VanDerWaalsContact CG2-CD1 3.44Å; V204-F224 HydrophobicContact CG2-CE1 3.84Å; V204-F224 HydrophobicContact CG2-CG 4.27Å; V222-F224 HydrophobicContact CB-CE2 3.98Å; V222-F224 HydrophobicContact CG1-CD2 3.89Å; V222-F224 HydrophobicContact CG1-CE2 3.35Å; V222-F224 HydrophobicContact CG1-CZ 3.71Å
225	C	95.9	Very high	93.2	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.007	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	143.2	-175.1	-61.1	0	0	0	0	110.8	C163 C164 W186 A202 P203	C163-C225 CarbonylContact O-C 3.53Å; C163-C225 WeakPolarHBondContact O-CA 3.44Å; C164-C225 HydrophobicContact CB-CB 4.11Å; C164-C225 WeakPolarHBondContact CB-SG 3.4Å; C164-C225 WeakPolarHBondContact SG-CB 3.43Å; C164-C225 CovalentContact SG-SG 2.05Å; C164-C225 PolarHBondContact SG-SG 3.35Å; W186-C225 PolarHBondContact NE1-O 3.4Å; A202-C225 CarbonylContact C-O 3.55Å; A202-C225 VanDerWaalsContact CA-O 3.23Å; A202-C225 WeakPolarHBondContact CA-O 3.5Å; P203-C225 WeakPolarHBondContact CD-O 3.42Å; P203-C225 HydrophobicContact CG-CB 4.06Å; P203-C225 PolarHBondContact O-N 3.39Å
226	L	96	Very high	93.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	119.4	173.1	-61.5	175.8	0	0	0	107.9	L58 I61 M71 T73 C163 W186 L199 A202 I228	L58-L226 HydrophobicContact CD1-CD1 4.4Å; L58-L226 HydrophobicContact CD2-CD1 4.15Å; L58-L226 HydrophobicContact CD2-CD2 3.91Å; I61-L226 HydrophobicContact CD1-CD1 4.36Å; I61-L226 HydrophobicContact CG1-CD1 4.29Å; M71-L226 HydrophobicContact CE-CD1 4.15Å; M71-L226 HydrophobicContact SD-CD1 4.12Å; T73-L226 HydrophobicContact CG2-CD1 4.19Å; C163-L226 PolarHBondContact N-O 2.85Å; C163-L226 PolarHBondContact O-N 3.14Å; W186-L226 HydrophobicContact CD2-CD2 4.31Å; W186-L226 HydrophobicContact CH2-CD1 4.08Å; W186-L226 HydrophobicContact CH2-CD2 3.74Å; W186-L226 HydrophobicContact CH2-CG 3.9Å; W186-L226 HydrophobicContact CZ2-CD1 4.32Å; W186-L226 HydrophobicContact CZ2-CD2 3.4Å; W186-L226 VanDerWaalsContact CZ2-CD2 3.4Å; W186-L226 HydrophobicContact CZ2-CG 3.63Å; W186-L226 HydrophobicContact CZ3-CD2 4.31Å; L199-L226 HydrophobicContact CD1-CB 4.13Å; L199-L226 HydrophobicContact CD1-CD2 3.86Å; A202-L226 HydrophobicContact CB-CD2 4.03Å; L226-I228 HydrophobicContact CB-CG2 4.2Å
227	N	95.8	Very high	93	Very high	33 Å²	33	45.2 Å²	45.2	18%	0.176	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	108.4	172	-63.1	-14.8	0	0	0	107.8	Q161 Q162 T200 D201	Q161-N227 CarbonylContact O-C 3.6Å; Q161-N227 WeakPolarHBondContact O-CA 3.46Å; Q162-N227 WeakPolarHBondContact CG-OD1 3.2Å; Q162-N227 PolarHBondContact NE2-OD1 3.46Å; T200-N227 PolarHBondContact N-O 2.97Å; T200-N227 WeakPolarHBondContact OG1-CB 3.48Å; T200-N227 PolarHBondContact OG1-O 2.98Å; D201-N227 HydrophobicContact CB-CB 4.15Å; D201-N227 PolarHBondContact N-O 3.3Å; D201-N227 WeakPolarHBondContact O-CB 3.41Å; D201-N227 PolarHBondContact O-N 3.02Å
228	I	95.6	Very high	92.9	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.2	-173.4	62.6	-179.9	0	0	0	110.4	I61 V64 Q161 W197 L198 L199 L226	I61-I228 HydrophobicContact CD1-CG2 3.76Å; V64-I228 HydrophobicContact CG2-CD1 3.83Å; Q161-I228 HydrophobicContact CB-CD1 4.32Å; Q161-I228 HydrophobicContact CB-CG1 3.79Å; Q161-I228 PolarHBondContact N-O 3.45Å; Q161-I228 PolarHBondContact O-N 3.25Å; W197-I228 HydrophobicContact CB-CB 4.43Å; W197-I228 HydrophobicContact CD2-CD1 3.82Å; W197-I228 HydrophobicContact CD2-CG1 4.28Å; W197-I228 HydrophobicContact CE3-CB 3.96Å; W197-I228 HydrophobicContact CE3-CD1 3.66Å; W197-I228 HydrophobicContact CE3-CG1 3.64Å; W197-I228 HydrophobicContact CG-CD1 4.28Å; W197-I228 HydrophobicContact CH2-CD1 4.47Å; W197-I228 HydrophobicContact CZ3-CD1 4.01Å; W197-I228 HydrophobicContact CZ3-CG1 3.94Å; L198-I228 CarbonylContact O-C 3.56Å; L198-I228 WeakPolarHBondContact O-CA 3.49Å; L199-I228 HydrophobicContact CD1-CG2 4.03Å; L226-I228 HydrophobicContact CB-CG2 4.2Å
229	R	94.6	Very high	92.5	Very high	84 Å²	84	44.5 Å²	44.5	32%	0.317	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.6	176.3	176.6	174.7	-65	159.7	5.5	110.2	D160 L198 T200 H458	D160-R229 VanDerWaalsContact OD1-CB 3.32Å; D160-R229 WeakPolarHBondContact OD1-CB 3.32Å; D160-R229 WeakPolarHBondContact OD1-CG 3.39Å; D160-R229 IonicContact OD1-CZ 3.84Å; D160-R229 IonicContact OD1-NE 3.47Å; D160-R229 PolarHBondContact OD1-NE 2.9Å; D160-R229 IonicContact OD1-NH2 2.99Å; D160-R229 PolarHBondContact OD1-NH2 3.39Å; D160-R229 IonicContact OD2-NE 3.77Å; D160-R229 IonicContact OD2-NH2 2.74Å; L198-R229 HydrophobicContact CB-CB 4.38Å; L198-R229 PolarHBondContact N-O 3.05Å; L198-R229 PolarHBondContact O-N 3.18Å; T200-R229 HydrophobicContact CG2-CB 3.89Å; R229-H458 PolarHBondContact NH2-CE1 3.29Å; R229-H458 VanDerWaalsContact NH2-CE1 3.34Å
230	R	93.6	Very high	92	Very high	7 Å²	7	43.9 Å²	43.9	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	137.9	177.5	-166.6	-179.6	-58.5	-89.5	3.8	112.2	E66 D159 E196 W197 Y235	E66-R230 IonicContact OE1-CZ 3.29Å; E66-R230 IonicContact OE1-NH1 3.8Å; E66-R230 PolarHBondContact OE1-NH1 3.46Å; E66-R230 IonicContact OE1-NH2 2.81Å; E66-R230 PolarHBondContact OE1-NH2 2.78Å; D159-R230 PolarHBondContact O-N 2.69Å; D159-R230 IonicContact OD1-CZ 2.89Å; D159-R230 IonicContact OD1-NE 2.8Å; D159-R230 PolarHBondContact OD1-NE 2.87Å; D159-R230 IonicContact OD2-CZ 3.54Å; D159-R230 IonicContact OD2-NE 3.94Å; D159-R230 PolarHBondContact OD2-NE 3.31Å; D159-R230 IonicContact OD2-NH2 3.21Å; D159-R230 PolarHBondContact OD2-NH2 2.95Å; E196-R230 IonicContact OE1-NH1 2.7Å; E196-R230 PolarHBondContact OE1-NH1 2.97Å; W197-R230 HydrophobicContact CE3-CB 4.18Å; W197-R230 HydrophobicContact CH2-CB 4.33Å; W197-R230 VanDerWaalsContact CZ2-CZ 3.43Å; W197-R230 VanDerWaalsContact CZ2-NH2 3.35Å; W197-R230 HydrophobicContact CZ3-CB 3.85Å; R230-Y235 HydrophobicContact CG-CE2 4.13Å; R230-Y235 PolarHBondContact NH1-OH 3.48Å
231	R	92.8	Very high	91.7	Very high	99 Å²	99	47.1 Å²	47.1	37%	0.374	22%	0.219	S	C	.	.			trans	-80.6	115.4	168.9	-65.6	178.4	-176.5	-86.7	8	109.1	E193 N194 G195 E196	E193-R231 IonicContact OE2-NH2 2.73Å; N194-R231 PolarHBondContact O-NE 2.88Å; G195-R231 WeakPolarHBondContact O-CD 3.39Å; E196-R231 WeakPolarHBondContact O-CB 3.5Å; E196-R231 WeakPolarHBondContact O-CG 3.39Å; E196-R231 PolarHBondContact O-N 3.27Å
232	T	89.8	Confident	91.4	Very high	50 Å²	50	48.7 Å²	48.7	31%	0.307	23%	0.229	S	C	.	.			trans	-84.4	-12.9	-166.7	53.8	0	0	0	0	114.7	P157 F158 Y234 Y235 G236	P157-T232 VanDerWaalsContact O-CG2 3.23Å; P157-T232 WeakPolarHBondContact O-CG2 3.1Å; F158-T232 HydrophobicContact CD1-CG2 3.34Å; F158-T232 HydrophobicContact CE1-CG2 3.64Å; F158-T232 HydrophobicContact CG-CG2 4.05Å; T232-Y234 PolarHBondContact O-N 3.42Å; T232-Y235 PolarHBondContact O-N 2.89Å; T232-G236 PolarHBondContact O-N 2.97Å
233	L	88.8	Confident	90.9	Very high	127 Å²	127	48.7 Å²	48.7	67%	0.665	23%	0.229	S	C	*	.	H	α-helix	trans	-57	-45.1	-170.3	-168	72.6	0	0	0	113.2	Y235 G236 F237	L233-Y235 PolarHBondContact O-N 3.46Å; L233-G236 PolarHBondContact O-N 3.08Å; L233-F237 HydrophobicContact CD1-CD2 4.16Å; L233-F237 HydrophobicContact CD1-CE2 3.72Å; L233-F237 HydrophobicContact CG-CD2 4.12Å; L233-F237 HydrophobicContact CG-CE2 4.06Å; L233-F237 WeakPolarHBondContact O-CD2 3.39Å; L233-F237 PolarHBondContact O-N 3.45Å; L233-F237 VanDerWaalsContact O-N 3.11Å
234	Y	90.2	Very high	90.4	Very high	141 Å²	141	46.9 Å²	46.9	55%	0.553	23%	0.227	S	C	*	.	H	α-helix	trans	-60.9	-45.7	180	174.9	-97.1	0	0	0	112	T232 G236 N238	T232-Y234 PolarHBondContact O-N 3.42Å; Y234-G236 VanDerWaalsContact C-N 3.35Å; Y234-N238 VanDerWaalsContact CD2-ND2 3.26Å; Y234-N238 WeakPolarHBondContact CD2-ND2 3.24Å; Y234-N238 WeakPolarHBondContact CE2-ND2 3.25Å; Y234-N238 WeakPolarHBondContact O-CB 3.27Å; Y234-N238 PolarHBondContact O-N 3.49Å; Y234-N238 PolarHBondContact O-ND2 3.06Å; Y234-N238 VanDerWaalsContact O-ND2 3.12Å
235	Y	88.5	Confident	90.2	Very high	26 Å²	26	51.4 Å²	51.4	10%	0.102	25%	0.25	C	S	.	.	H	α-helix	trans	-71.2	-32.1	177.9	-58.9	-83.2	0	0	0	111.9	F156 P157 E196 R230 T232 L233 M239 I240	F156-Y235 HydrophobicContact CE1-CD1 4.28Å; F156-Y235 HydrophobicContact CE1-CE1 4.36Å; F156-Y235 HydrophobicContact CE2-CE1 4.26Å; F156-Y235 AromaticContact CZ-CD1 3.87Å; F156-Y235 HydrophobicContact CZ-CD1 3.87Å; F156-Y235 AromaticContact CZ-CE1 3.53Å; F156-Y235 HydrophobicContact CZ-CE1 3.53Å; P157-Y235 HydrophobicContact CB-CD1 4.36Å; P157-Y235 HydrophobicContact CB-CD2 3.89Å; P157-Y235 HydrophobicContact CB-CG 3.73Å; P157-Y235 HydrophobicContact CG-CG 4.3Å; E196-Y235 PolarHBondContact OE1-OH 2.95Å; R230-Y235 HydrophobicContact CG-CE2 4.13Å; R230-Y235 PolarHBondContact NH1-OH 3.48Å; T232-Y235 PolarHBondContact O-N 2.89Å; L233-Y235 PolarHBondContact O-N 3.46Å; Y235-M239 HydrophobicContact CD1-SD 3.95Å; Y235-M239 WeakPolarHBondContact O-CA 3.34Å; Y235-M239 WeakPolarHBondContact O-CB 3.3Å; Y235-M239 PolarHBondContact O-N 2.67Å; Y235-I240 PolarHBondContact O-N 2.7Å
236	G	87	Confident	89.9	Confident	18 Å²	18	52.6 Å²	52.6	19%	0.186	26%	0.256	C	S	.	.	I	π-helix	trans	-54.6	-55.9	171.4	0	0	0	0	0	112.2	T232 L233 Y234 I240 I241	T232-G236 PolarHBondContact O-N 2.97Å; L233-G236 PolarHBondContact O-N 3.08Å; Y234-G236 VanDerWaalsContact C-N 3.35Å; G236-I240 WeakPolarHBondContact O-CB 3.24Å; G236-I240 PolarHBondContact O-N 2.86Å; G236-I241 WeakPolarHBondContact O-CG1 3.3Å; G236-I241 PolarHBondContact O-N 3.03Å
237	F	88.7	Confident	89.4	Confident	131 Å²	131	52.8 Å²	52.8	58%	0.575	26%	0.258	S	S	*	.	I	π-helix	trans	-72.1	-40.5	-178.4	-80.6	-76.4	0	0	0	114	L233 I241 P242	L233-F237 HydrophobicContact CD1-CD2 4.16Å; L233-F237 HydrophobicContact CD1-CE2 3.72Å; L233-F237 HydrophobicContact CG-CD2 4.12Å; L233-F237 HydrophobicContact CG-CE2 4.06Å; L233-F237 WeakPolarHBondContact O-CD2 3.39Å; L233-F237 PolarHBondContact O-N 3.45Å; L233-F237 VanDerWaalsContact O-N 3.11Å; F237-I241 HydrophobicContact CD1-CD1 3.76Å; F237-I241 HydrophobicContact CE1-CD1 4.06Å; F237-I241 HydrophobicContact CG-CD1 4.41Å; F237-P242 VanDerWaalsContact O-CD 3.31Å; F237-P242 WeakPolarHBondContact O-CD 3.46Å
238	N	88.4	Confident	88.9	Confident	77 Å²	77	55.2 Å²	55.2	41%	0.412	27%	0.271	S	S	.	.	I	π-helix	trans	-92.2	-20.8	-171	-67.2	-49.8	0	0	0	114.4	Y234	Y234-N238 VanDerWaalsContact CD2-ND2 3.26Å; Y234-N238 WeakPolarHBondContact CD2-ND2 3.24Å; Y234-N238 WeakPolarHBondContact CE2-ND2 3.25Å; Y234-N238 WeakPolarHBondContact O-CB 3.27Å; Y234-N238 PolarHBondContact O-N 3.49Å; Y234-N238 PolarHBondContact O-ND2 3.06Å; Y234-N238 VanDerWaalsContact O-ND2 3.12Å
239	M	85.7	Confident	88.7	Confident	8 Å²	8	59 Å²	59	4%	0.039	29%	0.289	C	S	.	.	I	π-helix	trans	-121.6	-50.9	-178.4	-70	-177.2	149.2	0	0	112.8	Y235 S243 M280 V281 M284	Y235-M239 HydrophobicContact CD1-SD 3.95Å; Y235-M239 WeakPolarHBondContact O-CA 3.34Å; Y235-M239 WeakPolarHBondContact O-CB 3.3Å; Y235-M239 PolarHBondContact O-N 2.67Å; M239-S243 VanDerWaalsContact O-CB 3.26Å; M239-S243 WeakPolarHBondContact O-CB 3.23Å; M239-S243 PolarHBondContact O-N 2.89Å; M239-M280 HydrophobicContact CE-CE 4.02Å; M239-M280 HydrophobicContact CE-CG 3.85Å; M239-M280 HydrophobicContact CE-SD 3.93Å; M239-V281 HydrophobicContact CE-CG2 4.11Å; M239-M284 HydrophobicContact CE-CG 4.37Å
240	I	85.2	Confident	88.4	Confident	23 Å²	23	55 Å²	55	12%	0.118	27%	0.274	C	S	.	.	I	π-helix	trans	-69.5	-52	-172.7	-63.7	176.2	0	0	0	111.3	P157 F158 Y235 G236 S243 V244 F453	P157-I240 HydrophobicContact CG-CD1 4.41Å; F158-I240 HydrophobicContact CE2-CD1 3.89Å; F158-I240 HydrophobicContact CZ-CD1 3.71Å; Y235-I240 PolarHBondContact O-N 2.7Å; G236-I240 WeakPolarHBondContact O-CB 3.24Å; G236-I240 PolarHBondContact O-N 2.86Å; I240-S243 PolarHBondContact O-N 3.25Å; I240-V244 HydrophobicContact CG2-CG2 4.47Å; I240-V244 WeakPolarHBondContact O-CG2 3.44Å; I240-V244 PolarHBondContact O-N 3.47Å; I240-F453 HydrophobicContact CG2-CE1 3.59Å; I240-F453 HydrophobicContact CG2-CZ 3.64Å
241	I	87.4	Confident	88.3	Confident	80 Å²	80	55.8 Å²	55.8	41%	0.41	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-51.2	-178.4	-68.5	174.9	0	0	0	111.8	G236 F237 S243 V244 L245	G236-I241 WeakPolarHBondContact O-CG1 3.3Å; G236-I241 PolarHBondContact O-N 3.03Å; F237-I241 HydrophobicContact CD1-CD1 3.76Å; F237-I241 HydrophobicContact CE1-CD1 4.06Å; F237-I241 HydrophobicContact CG-CD1 4.41Å; I241-S243 VanDerWaalsContact C-N 3.26Å; I241-S243 PolarHBondContact O-N 3.43Å; I241-V244 PolarHBondContact O-N 3.46Å; I241-L245 HydrophobicContact CG2-CD1 3.98Å; I241-L245 HydrophobicContact CG2-CG 4.44Å; I241-L245 WeakPolarHBondContact O-CG 3.15Å; I241-L245 PolarHBondContact O-N 2.94Å
242	P	89.6	Confident	88.1	Confident	33 Å²	33	54.9 Å²	54.9	21%	0.214	28%	0.281	C	S	.	.	H	α-helix	trans	-57.6	-38.3	176.2	-27.5	36.5	0	0	0	113.2	F237 L245 I246 F277	F237-P242 VanDerWaalsContact O-CD 3.31Å; F237-P242 WeakPolarHBondContact O-CD 3.46Å; P242-L245 PolarHBondContact O-N 3.37Å; P242-I246 VanDerWaalsContact O-CG1 3.23Å; P242-I246 WeakPolarHBondContact O-CG1 3.31Å; P242-I246 PolarHBondContact O-N 3.06Å; P242-F277 HydrophobicContact CB-CE1 4.09Å; P242-F277 HydrophobicContact CB-CZ 3.79Å
243	S	85.3	Confident	88.1	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.007	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-44.6	-180	-164.8	0	0	0	0	112.6	M239 I240 I241 L245 I246 S247 F298 F299	M239-S243 VanDerWaalsContact O-CB 3.26Å; M239-S243 WeakPolarHBondContact O-CB 3.23Å; M239-S243 PolarHBondContact O-N 2.89Å; I240-S243 PolarHBondContact O-N 3.25Å; I241-S243 VanDerWaalsContact C-N 3.26Å; I241-S243 PolarHBondContact O-N 3.43Å; S243-L245 VanDerWaalsContact C-N 3.32Å; S243-L245 PolarHBondContact O-N 3.42Å; S243-I246 PolarHBondContact O-N 3.32Å; S243-S247 PolarHBondContact O-N 3.46Å; S243-S247 PolarHBondContact O-OG 3.4Å; S243-F298 WeakPolarHBondContact OG-CD1 3.43Å; S243-F298 WeakPolarHBondContact OG-CE1 3.05Å; S243-F299 VanDerWaalsContact CB-CZ 3.47Å; S243-F299 WeakPolarHBondContact OG-CE1 3.4Å; S243-F299 WeakPolarHBondContact OG-CZ 3.45Å
244	V	84.7	Confident	88.2	Confident	44 Å²	44	46.9 Å²	46.9	27%	0.267	24%	0.236	S	C	.	.	H	α-helix	trans	-61.7	-41.5	174.8	173.9	0	0	0	0	111	I240 I241 S247 L248 F453	I240-V244 HydrophobicContact CG2-CG2 4.47Å; I240-V244 WeakPolarHBondContact O-CG2 3.44Å; I240-V244 PolarHBondContact O-N 3.47Å; I241-V244 PolarHBondContact O-N 3.46Å; V244-S247 PolarHBondContact O-N 3.25Å; V244-L248 HydrophobicContact CG1-CD1 4.23Å; V244-L248 WeakPolarHBondContact O-CG 3.39Å; V244-L248 PolarHBondContact O-N 3.32Å; V244-F453 HydrophobicContact CG2-CE2 3.91Å; V244-F453 HydrophobicContact CG2-CZ 3.76Å
245	L	90.1	Very high	88.2	Confident	95 Å²	95	44.9 Å²	44.9	50%	0.497	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-44.1	176.2	-69.7	173.4	0	0	0	111.7	I241 P242 S243 L248 M249	I241-L245 HydrophobicContact CG2-CD1 3.98Å; I241-L245 HydrophobicContact CG2-CG 4.44Å; I241-L245 WeakPolarHBondContact O-CG 3.15Å; I241-L245 PolarHBondContact O-N 2.94Å; P242-L245 PolarHBondContact O-N 3.37Å; S243-L245 VanDerWaalsContact C-N 3.32Å; S243-L245 PolarHBondContact O-N 3.42Å; L245-L248 PolarHBondContact O-N 2.96Å; L245-M249 VanDerWaalsContact O-CG 3.32Å; L245-M249 WeakPolarHBondContact O-CG 3.17Å; L245-M249 PolarHBondContact O-N 2.99Å
246	I	89.3	Confident	88.4	Confident	26 Å²	26	46 Å²	46	13%	0.133	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-44.1	176.8	-70.5	166.9	0	0	0	110.9	P242 S243 L248 M249 T250 I270 V274 F277	P242-I246 VanDerWaalsContact O-CG1 3.23Å; P242-I246 WeakPolarHBondContact O-CG1 3.31Å; P242-I246 PolarHBondContact O-N 3.06Å; S243-I246 PolarHBondContact O-N 3.32Å; I246-L248 VanDerWaalsContact C-N 3.29Å; I246-L248 PolarHBondContact O-N 2.99Å; I246-M249 WeakPolarHBondContact O-CB 3.04Å; I246-M249 PolarHBondContact O-N 3.25Å; I246-M249 VanDerWaalsContact O-N 3.12Å; I246-T250 PolarHBondContact O-N 3.27Å; I246-I270 HydrophobicContact CG2-CG2 3.84Å; I246-V274 HydrophobicContact CG2-CG2 3.52Å; I246-F277 HydrophobicContact CD1-CD2 3.54Å; I246-F277 HydrophobicContact CD1-CE2 3.39Å; I246-F277 HydrophobicContact CD1-CZ 4.38Å
247	S	85.6	Confident	88.6	Confident	5 Å²	5	49 Å²	49	4%	0.035	26%	0.258	C	S	.	.	H	α-helix	trans	-59.3	-39.8	174.4	-63.2	0	0	0	0	111.8	S243 V244 T250 N302	S243-S247 PolarHBondContact O-N 3.46Å; S243-S247 PolarHBondContact O-OG 3.4Å; V244-S247 PolarHBondContact O-N 3.25Å; S247-T250 PolarHBondContact O-N 3.3Å; S247-T250 PolarHBondContact O-OG1 3.04Å; S247-N302 VanDerWaalsContact OG-CG 3.26Å; S247-N302 PolarHBondContact OG-ND2 3.32Å; S247-N302 VanDerWaalsContact OG-ND2 3.07Å; S247-N302 PolarHBondContact OG-OD1 3.29Å; S247-N302 VanDerWaalsContact OG-OD1 3.13Å
248	L	87.1	Confident	88.7	Confident	84 Å²	84	43.3 Å²	43.3	44%	0.44	23%	0.234	S	C	.	.	H	α-helix	trans	-68.3	-34	175.1	-68.9	171.4	0	0	0	112.8	V244 L245 I246 T250 L251	V244-L248 HydrophobicContact CG1-CD1 4.23Å; V244-L248 WeakPolarHBondContact O-CG 3.39Å; V244-L248 PolarHBondContact O-N 3.32Å; L245-L248 PolarHBondContact O-N 2.96Å; I246-L248 VanDerWaalsContact C-N 3.29Å; I246-L248 PolarHBondContact O-N 2.99Å; L248-T250 VanDerWaalsContact C-N 3.28Å; L248-T250 PolarHBondContact O-N 3.22Å; L248-L251 WeakPolarHBondContact O-CB 3.31Å; L248-L251 PolarHBondContact O-N 3.01Å; L248-L251 VanDerWaalsContact O-N 3.15Å
249	M	90.6	Very high	88.8	Confident	80 Å²	80	46 Å²	46	39%	0.394	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-31.5	176.7	-68.7	-61.6	95.5	0	0	112.8	L245 I246 L251 L252 I270	L245-M249 VanDerWaalsContact O-CG 3.32Å; L245-M249 WeakPolarHBondContact O-CG 3.17Å; L245-M249 PolarHBondContact O-N 2.99Å; I246-M249 WeakPolarHBondContact O-CB 3.04Å; I246-M249 PolarHBondContact O-N 3.25Å; I246-M249 VanDerWaalsContact O-N 3.12Å; M249-L251 PolarHBondContact O-N 3.43Å; M249-L252 HydrophobicContact CE-CD1 3.36Å; M249-L252 HydrophobicContact CE-CG 4.18Å; M249-L252 WeakPolarHBondContact O-CB 3.39Å; M249-L252 PolarHBondContact O-N 3.35Å; M249-L252 HydrophobicContact SD-CD1 3.65Å; M249-I270 HydrophobicContact CB-CD1 3.78Å; M249-I270 HydrophobicContact CB-CG1 4.29Å
250	T	88.3	Confident	89	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-59.5	-30.6	175	67.5	0	0	0	0	112.6	I246 S247 L248 L252 G253 I270 V306 I445	I246-T250 PolarHBondContact O-N 3.27Å; S247-T250 PolarHBondContact O-N 3.3Å; S247-T250 PolarHBondContact O-OG1 3.04Å; L248-T250 VanDerWaalsContact C-N 3.28Å; L248-T250 PolarHBondContact O-N 3.22Å; T250-L252 VanDerWaalsContact C-N 3.33Å; T250-G253 PolarHBondContact O-N 3.16Å; T250-I270 HydrophobicContact CG2-CG2 3.61Å; T250-V306 HydrophobicContact CG2-CB 4.45Å; T250-V306 HydrophobicContact CG2-CG2 3.44Å; T250-V306 VanDerWaalsContact CG2-CG2 3.44Å; T250-I445 WeakPolarHBondContact OG1-CD1 3.32Å
251	L	90.5	Very high	89.3	Confident	22 Å²	22	49.9 Å²	49.9	12%	0.115	28%	0.283	C	S	.	.	H	α-helix	trans	-72.2	-31.9	178.1	-62	-177.8	0	0	0	111.5	L248 M249 G253 F254 L255 F438 F441 S442 I445	L248-L251 WeakPolarHBondContact O-CB 3.31Å; L248-L251 PolarHBondContact O-N 3.01Å; L248-L251 VanDerWaalsContact O-N 3.15Å; M249-L251 PolarHBondContact O-N 3.43Å; L251-G253 VanDerWaalsContact C-N 3.25Å; L251-G253 PolarHBondContact O-N 3.46Å; L251-F254 PolarHBondContact O-N 2.96Å; L251-L255 WeakPolarHBondContact O-CD1 3.43Å; L251-F438 HydrophobicContact CB-CE2 4.09Å; L251-F441 HydrophobicContact CD2-CB 4.28Å; L251-S442 WeakPolarHBondContact CD2-OG 3.33Å; L251-I445 HydrophobicContact CD2-CD1 3.66Å; L251-I445 HydrophobicContact CG-CD1 4Å
252	L	89.5	Confident	89.5	Confident	80 Å²	80	51 Å²	51	42%	0.419	29%	0.286	S	S	.	.	H	α-helix	trans	-65.8	-27.8	177.3	-63.1	-174.6	0	0	0	112.4	M249 T250 F254 L255 L256	M249-L252 HydrophobicContact CE-CD1 3.36Å; M249-L252 HydrophobicContact CE-CG 4.18Å; M249-L252 WeakPolarHBondContact O-CB 3.39Å; M249-L252 PolarHBondContact O-N 3.35Å; M249-L252 HydrophobicContact SD-CD1 3.65Å; T250-L252 VanDerWaalsContact C-N 3.33Å; L252-F254 VanDerWaalsContact C-N 3.27Å; L252-F254 PolarHBondContact O-N 2.89Å; L252-L255 PolarHBondContact O-N 3.43Å; L252-L256 PolarHBondContact O-N 3.37Å; L252-L256 VanDerWaalsContact O-N 3.09Å
253	G	89.5	Confident	89.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-36.9	173.8	0	0	0	0	0	113.2	T250 L251 L256 K263 E267	T250-G253 PolarHBondContact O-N 3.16Å; L251-G253 VanDerWaalsContact C-N 3.25Å; L251-G253 PolarHBondContact O-N 3.46Å; G253-L256 PolarHBondContact O-N 3.13Å; G253-K263 VanDerWaalsContact O-CE 3.3Å; G253-K263 WeakPolarHBondContact O-CE 3.32Å; G253-K263 PolarHBondContact O-NZ 3.38Å; G253-E267 WeakPolarHBondContact CA-OE1 3.43Å
254	F	91.5	Very high	90	Very high	9 Å²	9	52.1 Å²	52.1	4%	0.039	29%	0.29	C	S	.	.	H	α-helix	trans	-77.9	-16.8	174.9	-61.7	-74.8	0	0	0	114	L251 L252 S309 N313 D434 C437 F438 F441	L251-F254 PolarHBondContact O-N 2.96Å; L252-F254 VanDerWaalsContact C-N 3.27Å; L252-F254 PolarHBondContact O-N 2.89Å; F254-S309 WeakPolarHBondContact CE2-OG 3.37Å; F254-S309 WeakPolarHBondContact CZ-OG 3.41Å; F254-N313 WeakPolarHBondContact CE1-OD1 3.32Å; F254-D434 WeakPolarHBondContact CD1-OD1 3.42Å; F254-C437 HydrophobicContact CD1-CB 3.8Å; F254-C437 HydrophobicContact CE1-CB 3.46Å; F254-C437 VanDerWaalsContact CE1-CB 3.46Å; F254-C437 HydrophobicContact CZ-CB 4.1Å; F254-F438 HydrophobicContact CB-CB 3.71Å; F254-F438 HydrophobicContact CB-CD2 3.99Å; F254-F438 HydrophobicContact CB-CG 4.3Å; F254-F438 HydrophobicContact CG-CB 4.25Å; F254-F441 HydrophobicContact CD2-CD2 4.44Å; F254-F441 HydrophobicContact CE1-CD2 4.07Å; F254-F441 HydrophobicContact CE1-CE2 4.2Å; F254-F441 HydrophobicContact CE2-CB 4.06Å; F254-F441 AromaticContact CE2-CD2 3.42Å; F254-F441 HydrophobicContact CE2-CD2 3.42Å; F254-F441 VanDerWaalsContact CE2-CD2 3.42Å; F254-F441 HydrophobicContact CE2-CE2 4.12Å; F254-F441 AromaticContact CE2-CG 3.92Å; F254-F441 HydrophobicContact CE2-CG 3.92Å; F254-F441 AromaticContact CZ-CD2 3.19Å; F254-F441 HydrophobicContact CZ-CD2 3.19Å; F254-F441 AromaticContact CZ-CE2 3.45Å; F254-F441 HydrophobicContact CZ-CE2 3.45Å; F254-F441 VanDerWaalsContact CZ-CE2 3.45Å; F254-F441 HydrophobicContact CZ-CG 4.11Å; F254-F441 HydrophobicContact CZ-CZ 4.48Å
255	L	90.4	Very high	90.4	Very high	100 Å²	100	53.4 Å²	53.4	52%	0.524	30%	0.298	S	S	.	.	H	α-helix	trans	-82	-26.4	171.7	-82.8	84.5	0	0	0	112.2	L251 L252 F438	L251-L255 WeakPolarHBondContact O-CD1 3.43Å; L252-L255 PolarHBondContact O-N 3.43Å; L255-F438 HydrophobicContact CD1-CD2 3.62Å; L255-F438 HydrophobicContact CD1-CE2 3.21Å; L255-F438 HydrophobicContact CD1-CZ 3.89Å
256	L	92	Very high	90.5	Very high	49 Å²	49	51.5 Å²	51.5	26%	0.257	29%	0.288	S	S	.	.	S	Bend	trans	-70.5	125	-176.1	-164.9	74.3	0	0	0	110.8	L252 G253 E262 K263	L252-L256 PolarHBondContact O-N 3.37Å; L252-L256 VanDerWaalsContact O-N 3.09Å; G253-L256 PolarHBondContact O-N 3.13Å; L256-E262 HydrophobicContact CD2-CB 4.1Å; L256-K263 HydrophobicContact CD2-CB 4.17Å; L256-K263 PolarHBondContact O-NZ 2.93Å
257	P	90.8	Very high	90.6	Very high	80 Å²	80	50.3 Å²	50.3	52%	0.519	28%	0.282	S	S	.	.			trans	-65.8	140.2	178.5	27.3	-34.1	0	0	0	110.9	E259 S260	P257-E259 PolarHBondContact O-N 3.07Å; P257-E259 VanDerWaalsContact O-N 3.14Å; P257-S260 WeakPolarHBondContact O-CB 3.36Å; P257-S260 PolarHBondContact O-N 3.42Å; P257-S260 VanDerWaalsContact O-N 3.09Å
258	V	91.6	Very high	91	Very high	12 Å²	12	54 Å²	54	7%	0.073	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-57.7	-29.9	-178	171.7	0	0	0	0	113	S260 G261 K263 V316 L317 H320 Y321	V258-S260 PolarHBondContact O-N 2.8Å; V258-G261 PolarHBondContact O-N 2.96Å; V258-K263 HydrophobicContact CG2-CD 4.13Å; V258-V316 HydrophobicContact CG2-CG1 4.04Å; V258-L317 HydrophobicContact CG1-CD2 3.46Å; V258-L317 VanDerWaalsContact CG1-CD2 3.46Å; V258-L317 HydrophobicContact CG1-CG 4.46Å; V258-H320 HydrophobicContact CG1-CB 4.01Å; V258-Y321 HydrophobicContact CG1-CE2 4.15Å
259	E	89.6	Confident	91.3	Very high	135 Å²	135	53.3 Å²	53.3	63%	0.631	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-67.8	-15.9	-178.9	-60	-174.4	161.2	0	0	113.3	P257 G261 K427	P257-E259 PolarHBondContact O-N 3.07Å; P257-E259 VanDerWaalsContact O-N 3.14Å; E259-G261 VanDerWaalsContact C-N 3.27Å; E259-G261 PolarHBondContact O-N 3.42Å; E259-K427 IonicContact OE1-NZ 2.68Å; E259-K427 PolarHBondContact OE1-NZ 3.47Å
260	S	90.5	Very high	91.4	Very high	60 Å²	60	49.9 Å²	49.9	42%	0.42	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-69.8	-20.7	176.5	-174	0	0	0	0	113.6	P257 V258 E262	P257-S260 WeakPolarHBondContact O-CB 3.36Å; P257-S260 PolarHBondContact O-N 3.42Å; P257-S260 VanDerWaalsContact O-N 3.09Å; V258-S260 PolarHBondContact O-N 2.8Å; S260-E262 PolarHBondContact O-N 3.21Å
261	G	90.8	Very high	91.6	Very high	52 Å²	52	51.9 Å²	51.9	54%	0.536	29%	0.293	S	S	.	.	S	Bend	trans	73.3	-19.9	-174.6	0	0	0	0	0	115.8	V258 E259 K263	V258-G261 PolarHBondContact O-N 2.96Å; E259-G261 VanDerWaalsContact C-N 3.27Å; E259-G261 PolarHBondContact O-N 3.42Å; G261-K263 PolarHBondContact O-N 3.13Å
262	E	92.2	Very high	91.7	Very high	104 Å²	104	56 Å²	56	49%	0.486	32%	0.315	S	S	.	.			trans	-87.6	-0.7	-173.3	-64.2	-54	139.2	0	0	115.2	L256 S260 L264 T265 L266	L256-E262 HydrophobicContact CD2-CB 4.1Å; S260-E262 PolarHBondContact O-N 3.21Å; E262-L264 PolarHBondContact O-N 3.49Å; E262-T265 PolarHBondContact O-N 2.85Å; E262-T265 PolarHBondContact OE2-OG1 2.92Å; E262-L266 PolarHBondContact O-N 3.31Å
263	K	92	Very high	91.9	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.009	31%	0.311	C	S	.	.	H	α-helix	trans	-61.3	-44.7	-173	-170.8	176.2	178.3	107.2	0	113.2	G253 L256 V258 G261 E267 N313 D434	G253-K263 VanDerWaalsContact O-CE 3.3Å; G253-K263 WeakPolarHBondContact O-CE 3.32Å; G253-K263 PolarHBondContact O-NZ 3.38Å; L256-K263 HydrophobicContact CD2-CB 4.17Å; L256-K263 PolarHBondContact O-NZ 2.93Å; V258-K263 HydrophobicContact CG2-CD 4.13Å; G261-K263 PolarHBondContact O-N 3.13Å; K263-E267 WeakPolarHBondContact O-CG 3.42Å; K263-E267 PolarHBondContact O-N 3.49Å; K263-N313 WeakPolarHBondContact CE-OD1 3.33Å; K263-D434 IonicContact NZ-OD1 2.8Å; K263-D434 PolarHBondContact NZ-OD1 3.36Å; K263-D434 IonicContact NZ-OD2 2.77Å; K263-D434 PolarHBondContact NZ-OD2 3.41Å
264	L	92.5	Very high	92	Very high	55 Å²	55	54.6 Å²	54.6	29%	0.288	31%	0.312	S	S	.	.	H	α-helix	trans	-73	-37.1	177.1	-72.7	176.8	0	0	0	112.5	E262 L266 E267 I268 N313 V314 L317	E262-L264 PolarHBondContact O-N 3.49Å; L264-L266 VanDerWaalsContact C-N 3.33Å; L264-L266 PolarHBondContact O-N 3.2Å; L264-E267 PolarHBondContact O-N 3.32Å; L264-I268 VanDerWaalsContact O-CG1 3.31Å; L264-I268 WeakPolarHBondContact O-CG1 3.4Å; L264-I268 PolarHBondContact O-N 3.43Å; L264-N313 HydrophobicContact CD2-CB 4.22Å; L264-V314 HydrophobicContact CD2-CG2 3.75Å; L264-L317 HydrophobicContact CD1-CD1 3.45Å; L264-L317 VanDerWaalsContact CD1-CD1 3.45Å; L264-L317 HydrophobicContact CD2-CD1 3.69Å; L264-L317 HydrophobicContact CG-CD1 3.33Å
265	T	93.3	Very high	92	Very high	71 Å²	71	56.5 Å²	56.5	44%	0.436	33%	0.325	S	S	.	.	H	α-helix	trans	-57.6	-48.7	177.9	-50.4	0	0	0	0	110.1	E262 E267 I268 T269	E262-T265 PolarHBondContact O-N 2.85Å; E262-T265 PolarHBondContact OE2-OG1 2.92Å; T265-E267 PolarHBondContact O-N 3.46Å; T265-I268 PolarHBondContact O-N 3.42Å; T265-T269 VanDerWaalsContact O-CG2 3.25Å; T265-T269 WeakPolarHBondContact O-CG2 3.4Å; T265-T269 PolarHBondContact O-N 3.02Å; T265-T269 PolarHBondContact O-OG1 2.65Å
266	L	92.8	Very high	92	Very high	55 Å²	55	56.5 Å²	56.5	29%	0.288	33%	0.329	S	S	.	.	H	α-helix	trans	-55.5	-52.7	176.6	-179.6	63.8	0	0	0	111.6	E262 L264 I268 T269 I270	E262-L266 PolarHBondContact O-N 3.31Å; L264-L266 VanDerWaalsContact C-N 3.33Å; L264-L266 PolarHBondContact O-N 3.2Å; L266-I268 PolarHBondContact O-N 3.42Å; L266-T269 PolarHBondContact O-N 3.43Å; L266-T269 PolarHBondContact O-OG1 3.12Å; L266-I270 HydrophobicContact CD1-CD1 4.12Å; L266-I270 HydrophobicContact CG-CD1 3.99Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.43Å; L266-I270 PolarHBondContact O-N 3.05Å
267	E	92	Very high	91.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-39.8	-177.3	-70.8	-68.4	133.9	0	0	113.7	G253 K263 L264 T265 I270 L271 S309 V310 N313	G253-E267 WeakPolarHBondContact CA-OE1 3.43Å; K263-E267 WeakPolarHBondContact O-CG 3.42Å; K263-E267 PolarHBondContact O-N 3.49Å; L264-E267 PolarHBondContact O-N 3.32Å; T265-E267 PolarHBondContact O-N 3.46Å; E267-I270 PolarHBondContact O-N 2.78Å; E267-L271 PolarHBondContact O-N 3.09Å; E267-S309 WeakPolarHBondContact OE2-CB 3.41Å; E267-S309 PolarHBondContact OE2-OG 2.8Å; E267-V310 HydrophobicContact CB-CG2 3.95Å; E267-N313 WeakPolarHBondContact CG-ND2 3.31Å
268	I	93.2	Very high	91.8	Very high	84 Å²	84	54.8 Å²	54.8	43%	0.431	31%	0.313	S	S	.	.	H	α-helix	trans	-67	-39.8	177.1	-66.8	168.9	0	0	0	110.6	L264 T265 L266 I270 L271 L272	L264-I268 VanDerWaalsContact O-CG1 3.31Å; L264-I268 WeakPolarHBondContact O-CG1 3.4Å; L264-I268 PolarHBondContact O-N 3.43Å; T265-I268 PolarHBondContact O-N 3.42Å; L266-I268 PolarHBondContact O-N 3.42Å; I268-I270 VanDerWaalsContact C-N 3.32Å; I268-I270 PolarHBondContact O-N 3.13Å; I268-L271 WeakPolarHBondContact O-CB 3.28Å; I268-L271 PolarHBondContact O-N 3.42Å; I268-L272 HydrophobicContact CG2-CD1 4.39Å; I268-L272 WeakPolarHBondContact O-CG 3.46Å; I268-L272 PolarHBondContact O-N 3.26Å
269	T	93.9	Very high	91.7	Very high	68 Å²	68	58.1 Å²	58.1	42%	0.417	33%	0.334	S	S	.	.	H	α-helix	trans	-65.4	-36.1	177.2	59.8	0	0	0	0	112.5	T265 L266 S273	T265-T269 VanDerWaalsContact O-CG2 3.25Å; T265-T269 WeakPolarHBondContact O-CG2 3.4Å; T265-T269 PolarHBondContact O-N 3.02Å; T265-T269 PolarHBondContact O-OG1 2.65Å; L266-T269 PolarHBondContact O-N 3.43Å; L266-T269 PolarHBondContact O-OG1 3.12Å; T269-S273 WeakPolarHBondContact O-CB 3.5Å; T269-S273 PolarHBondContact O-N 3.36Å; T269-S273 PolarHBondContact O-OG 3.29Å
270	I	92.8	Very high	91.7	Very high	9 Å²	9	54.6 Å²	54.6	5%	0.046	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-45.2	173.4	-67.2	168.5	0	0	0	110.1	I246 M249 T250 L266 E267 I268 L272 S273 V274 V306	I246-I270 HydrophobicContact CG2-CG2 3.84Å; M249-I270 HydrophobicContact CB-CD1 3.78Å; M249-I270 HydrophobicContact CB-CG1 4.29Å; T250-I270 HydrophobicContact CG2-CG2 3.61Å; L266-I270 HydrophobicContact CD1-CD1 4.12Å; L266-I270 HydrophobicContact CG-CD1 3.99Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.43Å; L266-I270 PolarHBondContact O-N 3.05Å; E267-I270 PolarHBondContact O-N 2.78Å; I268-I270 VanDerWaalsContact C-N 3.32Å; I268-I270 PolarHBondContact O-N 3.13Å; I270-L272 PolarHBondContact O-N 2.92Å; I270-S273 WeakPolarHBondContact O-CB 3.49Å; I270-S273 PolarHBondContact O-N 3.26Å; I270-S273 VanDerWaalsContact O-N 3.13Å; I270-V274 WeakPolarHBondContact O-CG2 3.46Å; I270-V274 PolarHBondContact O-N 3.01Å; I270-V306 HydrophobicContact CG2-CG1 4.06Å; I270-V306 HydrophobicContact CG2-CG2 4.21Å
271	L	92.4	Very high	91.6	Very high	43 Å²	43	52 Å²	52	23%	0.225	30%	0.3	C	S	.	.	H	α-helix	trans	-57.9	-47.3	177.5	-178	63.3	0	0	0	111.8	E267 I268 S273 V274 C275 M303 V306	E267-L271 PolarHBondContact O-N 3.09Å; I268-L271 WeakPolarHBondContact O-CB 3.28Å; I268-L271 PolarHBondContact O-N 3.42Å; L271-S273 VanDerWaalsContact C-N 3.3Å; L271-S273 PolarHBondContact O-N 2.85Å; L271-V274 PolarHBondContact O-N 3.02Å; L271-C275 PolarHBondContact O-N 3.43Å; L271-C275 PolarHBondContact O-SG 3.01Å; L271-C275 VanDerWaalsContact O-SG 3.34Å; L271-M303 HydrophobicContact CD1-CG 4.38Å; L271-V306 HydrophobicContact CB-CG1 3.83Å; L271-V306 HydrophobicContact CD1-CB 4.31Å; L271-V306 HydrophobicContact CD1-CG1 4.02Å
272	L	93.5	Very high	91.4	Very high	109 Å²	109	51.8 Å²	51.8	57%	0.571	30%	0.298	S	S	*	.	H	α-helix	trans	-60.5	-41.3	175.9	-70.8	173.2	0	0	0	111.7	I268 I270 C275 V276	I268-L272 HydrophobicContact CG2-CD1 4.39Å; I268-L272 WeakPolarHBondContact O-CG 3.46Å; I268-L272 PolarHBondContact O-N 3.26Å; I270-L272 PolarHBondContact O-N 2.92Å; L272-C275 PolarHBondContact O-N 3.11Å; L272-V276 WeakPolarHBondContact O-CG2 3.42Å; L272-V276 PolarHBondContact O-N 3.29Å
273	S	92.5	Very high	91.2	Very high	48 Å²	48	53 Å²	53	34%	0.336	30%	0.304	S	S	.	.	H	α-helix	trans	-61.2	-46	177.2	-57.8	0	0	0	0	111.3	T269 I270 L271 C275 V276 F277	T269-S273 WeakPolarHBondContact O-CB 3.5Å; T269-S273 PolarHBondContact O-N 3.36Å; T269-S273 PolarHBondContact O-OG 3.29Å; I270-S273 WeakPolarHBondContact O-CB 3.49Å; I270-S273 PolarHBondContact O-N 3.26Å; I270-S273 VanDerWaalsContact O-N 3.13Å; L271-S273 VanDerWaalsContact C-N 3.3Å; L271-S273 PolarHBondContact O-N 2.85Å; S273-C275 VanDerWaalsContact C-N 3.32Å; S273-C275 PolarHBondContact O-N 3.49Å; S273-V276 PolarHBondContact O-N 3.34Å; S273-F277 VanDerWaalsContact O-CD2 3.28Å; S273-F277 WeakPolarHBondContact O-CD2 2.97Å; S273-F277 PolarHBondContact O-N 3.19Å; S273-F277 VanDerWaalsContact O-N 3.07Å
274	V	91.1	Very high	90.8	Very high	2 Å²	2	57 Å²	57	1%	0.012	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-41.9	175.5	174.3	0	0	0	0	111.4	I246 I270 L271 V276 F277 L278 F299 M303 V306	I246-V274 HydrophobicContact CG2-CG2 3.52Å; I270-V274 WeakPolarHBondContact O-CG2 3.46Å; I270-V274 PolarHBondContact O-N 3.01Å; L271-V274 PolarHBondContact O-N 3.02Å; V274-V276 PolarHBondContact O-N 3.05Å; V274-F277 PolarHBondContact O-N 2.93Å; V274-L278 WeakPolarHBondContact O-CB 3.04Å; V274-L278 PolarHBondContact O-N 3.05Å; V274-F299 HydrophobicContact CG1-CD1 4.4Å; V274-M303 HydrophobicContact CG1-CB 4Å; V274-V306 HydrophobicContact CG2-CG2 4.24Å
275	C	91.2	Very high	90.5	Very high	49 Å²	49	55.1 Å²	55.1	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-63.4	-38.5	176.8	-67.3	0	0	0	0	113	L271 L272 S273 T279	L271-C275 PolarHBondContact O-N 3.43Å; L271-C275 PolarHBondContact O-SG 3.01Å; L271-C275 VanDerWaalsContact O-SG 3.34Å; L272-C275 PolarHBondContact O-N 3.11Å; S273-C275 VanDerWaalsContact C-N 3.32Å; S273-C275 PolarHBondContact O-N 3.49Å; C275-T279 PolarHBondContact O-N 3.21Å; C275-T279 PolarHBondContact O-OG1 2.91Å
276	V	92	Very high	90.2	Very high	100 Å²	100	52.1 Å²	52.1	61%	0.606	30%	0.296	S	S	*	.	H	α-helix	trans	-65.8	-46.1	176.9	171.7	0	0	0	0	110.8	L272 S273 V274 L278 T279 M280	L272-V276 WeakPolarHBondContact O-CG2 3.42Å; L272-V276 PolarHBondContact O-N 3.29Å; S273-V276 PolarHBondContact O-N 3.34Å; V274-V276 PolarHBondContact O-N 3.05Å; V276-L278 PolarHBondContact O-N 3.41Å; V276-T279 WeakPolarHBondContact O-CB 3.26Å; V276-T279 PolarHBondContact O-N 2.87Å; V276-M280 PolarHBondContact O-N 3.44Å
277	F	89.5	Confident	89.7	Confident	48 Å²	48	55.5 Å²	55.5	21%	0.211	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-39.1	177.2	-82.2	-75.5	0	0	0	112.6	P242 I246 S273 V274 T279 M280 V281 F299	P242-F277 HydrophobicContact CB-CE1 4.09Å; P242-F277 HydrophobicContact CB-CZ 3.79Å; I246-F277 HydrophobicContact CD1-CD2 3.54Å; I246-F277 HydrophobicContact CD1-CE2 3.39Å; I246-F277 HydrophobicContact CD1-CZ 4.38Å; S273-F277 VanDerWaalsContact O-CD2 3.28Å; S273-F277 WeakPolarHBondContact O-CD2 2.97Å; S273-F277 PolarHBondContact O-N 3.19Å; S273-F277 VanDerWaalsContact O-N 3.07Å; V274-F277 PolarHBondContact O-N 2.93Å; F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 3.31Å; F277-M280 WeakPolarHBondContact O-CB 3.35Å; F277-M280 PolarHBondContact O-N 2.83Å; F277-V281 WeakPolarHBondContact O-CG2 3.15Å; F277-V281 PolarHBondContact O-N 3.36Å; F277-F299 HydrophobicContact CB-CD1 4.13Å; F277-F299 HydrophobicContact CB-CE1 3.43Å; F277-F299 VanDerWaalsContact CB-CE1 3.43Å; F277-F299 HydrophobicContact CB-CE2 4.49Å; F277-F299 HydrophobicContact CB-CZ 3.65Å; F277-F299 HydrophobicContact CD1-CZ 4.39Å; F277-F299 HydrophobicContact CG-CE1 4.13Å; F277-F299 HydrophobicContact CG-CZ 4.2Å
278	L	88.6	Confident	89.2	Confident	44 Å²	44	57.7 Å²	57.7	23%	0.23	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-39	173.7	-178.5	61.4	0	0	0	111.6	V274 V276 V281 G282 F299 M303	V274-L278 WeakPolarHBondContact O-CB 3.04Å; V274-L278 PolarHBondContact O-N 3.05Å; V276-L278 PolarHBondContact O-N 3.41Å; L278-V281 PolarHBondContact O-N 3.44Å; L278-G282 PolarHBondContact O-N 3.27Å; L278-F299 HydrophobicContact CB-CB 4.34Å; L278-F299 HydrophobicContact CD1-CB 3.89Å; L278-M303 HydrophobicContact CD2-SD 4.24Å
279	T	90.5	Very high	88.7	Confident	82 Å²	82	59.7 Å²	59.7	50%	0.503	36%	0.359	S	S	.	.	H	α-helix	trans	-64.2	-40.7	174.9	-56.4	0	0	0	0	111.5	C275 V276 F277 G282 Q283	C275-T279 PolarHBondContact O-N 3.21Å; C275-T279 PolarHBondContact O-OG1 2.91Å; V276-T279 WeakPolarHBondContact O-CB 3.26Å; V276-T279 PolarHBondContact O-N 2.87Å; F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 3.31Å; T279-G282 PolarHBondContact O-N 3.06Å; T279-Q283 WeakPolarHBondContact O-CG 3.48Å; T279-Q283 PolarHBondContact O-N 3.27Å; T279-Q283 VanDerWaalsContact O-N 3.08Å
280	M	89.1	Confident	88.1	Confident	62 Å²	62	62.9 Å²	62.9	31%	0.305	37%	0.369	S	S	.	.	H	α-helix	trans	-61	-43.7	175.5	-173.3	-175.9	-177.2	0	0	111.7	M239 V276 F277 Q283 M284	M239-M280 HydrophobicContact CE-CE 4.02Å; M239-M280 HydrophobicContact CE-CG 3.85Å; M239-M280 HydrophobicContact CE-SD 3.93Å; V276-M280 PolarHBondContact O-N 3.44Å; F277-M280 WeakPolarHBondContact O-CB 3.35Å; F277-M280 PolarHBondContact O-N 2.83Å; M280-Q283 PolarHBondContact O-N 2.71Å; M280-M284 HydrophobicContact CE-CE 4.31Å; M280-M284 WeakPolarHBondContact O-CG 3.39Å; M280-M284 PolarHBondContact O-N 3.28Å
281	V	87.2	Confident	87.6	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.024	38%	0.377	C	S	.	.	H	α-helix	trans	-61	-45.9	174.9	173.2	0	0	0	0	110.8	M239 F277 L278 Q283 M284 T285 I295 F299	M239-V281 HydrophobicContact CE-CG2 4.11Å; F277-V281 WeakPolarHBondContact O-CG2 3.15Å; F277-V281 PolarHBondContact O-N 3.36Å; L278-V281 PolarHBondContact O-N 3.44Å; V281-Q283 PolarHBondContact O-N 2.96Å; V281-M284 PolarHBondContact O-N 3.45Å; V281-M284 VanDerWaalsContact O-N 3.08Å; V281-T285 HydrophobicContact CG1-CG2 4.46Å; V281-T285 PolarHBondContact O-N 3.09Å; V281-T285 VanDerWaalsContact O-N 3.17Å; V281-T285 PolarHBondContact O-OG1 3.28Å; V281-I295 HydrophobicContact CG1-CG2 3.97Å; V281-I295 HydrophobicContact CG2-CG1 4.45Å; V281-I295 HydrophobicContact CG2-CG2 4.49Å; V281-F299 HydrophobicContact CG2-CD2 3.94Å; V281-F299 HydrophobicContact CG2-CE2 3.84Å
282	G	87	Confident	87.2	Confident	49 Å²	49	66.1 Å²	66.1	51%	0.505	39%	0.393	S	S	.	.	H	α-helix	trans	-64.3	-20.4	178.9	0	0	0	0	0	114.8	L278 T279	L278-G282 PolarHBondContact O-N 3.27Å; T279-G282 PolarHBondContact O-N 3.06Å
283	Q	88.4	Confident	87	Confident	130 Å²	130	61.4 Å²	61.4	61%	0.607	37%	0.37	S	S	*	.	H	α-helix	trans	-81.9	-24.9	174.1	-73.9	177.6	-8.4	0	0	113.4	T279 M280 V281	T279-Q283 WeakPolarHBondContact O-CG 3.48Å; T279-Q283 PolarHBondContact O-N 3.27Å; T279-Q283 VanDerWaalsContact O-N 3.08Å; M280-Q283 PolarHBondContact O-N 2.71Å; V281-Q283 PolarHBondContact O-N 2.96Å
284	M	84.2	Confident	86.7	Confident	84 Å²	84	60.4 Å²	60.4	41%	0.414	36%	0.36	S	S	.	.	H	α-helix	trans	-89.8	-28	-178.6	-61.8	-65.1	-177.6	0	0	112.5	M239 M280 V281	M239-M284 HydrophobicContact CE-CG 4.37Å; M280-M284 HydrophobicContact CE-CE 4.31Å; M280-M284 WeakPolarHBondContact O-CG 3.39Å; M280-M284 PolarHBondContact O-N 3.28Å; V281-M284 PolarHBondContact O-N 3.45Å; V281-M284 VanDerWaalsContact O-N 3.08Å
285	T	85.5	Confident	86.4	Confident	17 Å²	17	61.1 Å²	61.1	10%	0.104	36%	0.364	C	S	.	.	S	Bend	trans	-93.2	149.6	-179	57.7	0	0	0	0	112.3	I153 V281 P293	I153-T285 HydrophobicContact CD1-CG2 4.42Å; V281-T285 HydrophobicContact CG1-CG2 4.46Å; V281-T285 PolarHBondContact O-N 3.09Å; V281-T285 VanDerWaalsContact O-N 3.17Å; V281-T285 PolarHBondContact O-OG1 3.28Å; T285-P293 HydrophobicContact CG2-CG 4.16Å
286	P	86.9	Confident	86.2	Confident	7 Å²	7	59 Å²	59	5%	0.045	35%	0.35	C	S	.	.			trans	-59.8	148.9	172.4	23.1	-30.8	0	0	0	111.4	E66 Q69 I153 T288	E66-P286 VanDerWaalsContact O-CB 3.26Å; E66-P286 WeakPolarHBondContact O-CB 3.48Å; E66-P286 WeakPolarHBondContact O-CD 3.24Å; E66-P286 WeakPolarHBondContact O-CG 3.43Å; Q69-P286 HydrophobicContact CG-CB 4.36Å; I153-P286 HydrophobicContact CD1-CG 4.16Å; I153-P286 HydrophobicContact CG2-CG 4.12Å; P286-T288 HydrophobicContact CB-CG2 4.05Å; P286-T288 PolarHBondContact O-N 3.46Å
287	S	83.5	Confident	86	Confident	126 Å²	126	57.1 Å²	57.1	88%	0.881	34%	0.339	S	S	*	.	S	Bend	trans	-77.7	49.1	175.2	60.1	0	0	0	0	111.6
288	T	80.3	Confident	85.8	Confident	46 Å²	46	54.9 Å²	54.9	28%	0.282	33%	0.329	S	S	.	.			trans	-105.6	138.1	-179.1	52.8	0	0	0	0	110.7	P286	P286-T288 HydrophobicContact CB-CG2 4.05Å; P286-T288 PolarHBondContact O-N 3.46Å
289	S	82.4	Confident	85.8	Confident	126 Å²	126	52.9 Å²	52.9	88%	0.881	32%	0.318	S	S	*	.	S	Bend	trans	-94.1	9.5	178.3	-53.1	0	0	0	0	114
290	E	82.4	Confident	85.8	Confident	136 Å²	136	51.3 Å²	51.3	64%	0.636	31%	0.31	S	S	*	.	S	Bend	trans	-70.7	-41	-177.4	-67.4	-167.5	155.9	0	0	112.4	K150	K150-E290 WeakPolarHBondContact CE-OE2 3.47Å; K150-E290 IonicContact NZ-OE1 3.22Å; K150-E290 PolarHBondContact NZ-OE1 2.97Å; K150-E290 IonicContact NZ-OE2 2.66Å; K150-E290 PolarHBondContact NZ-OE2 3.35Å
291	A	81.2	Confident	85.7	Confident	25 Å²	25	50.6 Å²	50.6	21%	0.207	31%	0.311	C	S	.	.			trans	-143.6	140.4	175.9	0	0	0	0	0	109.6	T154	T154-A291 VanDerWaalsContact OG1-CB 3.29Å; T154-A291 WeakPolarHBondContact OG1-CB 3.39Å
292	V	84.6	Confident	85.8	Confident	94 Å²	94	50.6 Å²	50.6	57%	0.57	31%	0.311	S	S	*	.			trans	-95.2	128.8	171.9	-178.2	0	0	0	0	107.4	V297	V292-V297 HydrophobicContact CB-CG2 4.27Å; V292-V297 HydrophobicContact CG1-CG2 3.78Å
293	P	88.7	Confident	85.9	Confident	11 Å²	11	51.2 Å²	51.2	7%	0.071	30%	0.301	C	S	.	.			trans	-64.2	142.2	-177.7	29	-37.7	0	0	0	110.9	I153 F156 T285 I295 G296 V297	I153-P293 HydrophobicContact CD1-CG 4.48Å; I153-P293 WeakPolarHBondContact O-CA 3.35Å; I153-P293 WeakPolarHBondContact O-CB 3.45Å; F156-P293 HydrophobicContact CB-CB 4.21Å; T285-P293 HydrophobicContact CG2-CG 4.16Å; P293-I295 HydrophobicContact CB-CG2 4.2Å; P293-I295 PolarHBondContact O-N 2.98Å; P293-G296 WeakPolarHBondContact O-CA 3.5Å; P293-G296 PolarHBondContact O-N 3.48Å; P293-V297 PolarHBondContact O-N 3.2Å
294	L	85.9	Confident	86.1	Confident	27 Å²	27	50.4 Å²	50.4	14%	0.141	30%	0.3	C	S	.	.	H	α-helix	trans	-52.3	-41.2	179.2	-178.2	67.1	0	0	0	112.3	T154 W155 G296 V297 F298 I452	T154-L294 WeakPolarHBondContact O-CB 3.26Å; T154-L294 PolarHBondContact O-N 2.87Å; W155-L294 HydrophobicContact CE3-CD2 4.04Å; W155-L294 HydrophobicContact CZ3-CD2 4.14Å; L294-G296 VanDerWaalsContact C-N 3.32Å; L294-G296 PolarHBondContact O-N 3.34Å; L294-V297 PolarHBondContact O-N 3.12Å; L294-F298 PolarHBondContact O-N 3.48Å; L294-I452 HydrophobicContact CD1-CG1 4.35Å; L294-I452 HydrophobicContact CD1-CG2 4.1Å; L294-I452 HydrophobicContact CD2-CG2 4.16Å; L294-I452 HydrophobicContact CG-CG2 3.9Å
295	I	84.7	Confident	86.4	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.082	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-35.1	175.3	-168.9	61.9	0	0	0	112.5	F156 V281 P293 F298 F299	F156-I295 HydrophobicContact CD1-CG2 3.74Å; F156-I295 HydrophobicContact CE1-CG2 4.29Å; V281-I295 HydrophobicContact CG1-CG2 3.97Å; V281-I295 HydrophobicContact CG2-CG1 4.45Å; V281-I295 HydrophobicContact CG2-CG2 4.49Å; P293-I295 HydrophobicContact CB-CG2 4.2Å; P293-I295 PolarHBondContact O-N 2.98Å; I295-F298 HydrophobicContact CD1-CD1 4.08Å; I295-F298 WeakPolarHBondContact O-CB 3.37Å; I295-F298 PolarHBondContact O-N 3.18Å; I295-F299 HydrophobicContact CD1-CD2 4.19Å; I295-F299 HydrophobicContact CD1-CE2 3.82Å; I295-F299 HydrophobicContact CG1-CD2 3.94Å; I295-F299 HydrophobicContact CG1-CE2 3.73Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.48Å; I295-F299 PolarHBondContact O-N 3.4Å
296	G	87	Confident	86.7	Confident	5 Å²	5	46.5 Å²	46.5	5%	0.052	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-41.9	174.6	0	0	0	0	0	111.4	P293 L294 F298 F299 C300	P293-G296 WeakPolarHBondContact O-CA 3.5Å; P293-G296 PolarHBondContact O-N 3.48Å; L294-G296 VanDerWaalsContact C-N 3.32Å; L294-G296 PolarHBondContact O-N 3.34Å; G296-F298 VanDerWaalsContact C-N 3.31Å; G296-F298 PolarHBondContact O-N 3.03Å; G296-F299 PolarHBondContact O-N 3.25Å; G296-C300 WeakPolarHBondContact O-CB 2.97Å; G296-C300 PolarHBondContact O-N 3.01Å; G296-C300 PolarHBondContact O-SG 2.95Å
297	V	87.9	Confident	87	Confident	60 Å²	60	48.5 Å²	48.5	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-60.2	-42.4	172.8	179.7	0	0	0	0	110.8	V292 P293 L294 C300 C301	V292-V297 HydrophobicContact CB-CG2 4.27Å; V292-V297 HydrophobicContact CG1-CG2 3.78Å; P293-V297 PolarHBondContact O-N 3.2Å; L294-V297 PolarHBondContact O-N 3.12Å; V297-C300 PolarHBondContact O-N 3.19Å; V297-C301 WeakPolarHBondContact O-CB 3.39Å; V297-C301 PolarHBondContact O-N 3.42Å; V297-C301 PolarHBondContact O-SG 2.86Å; V297-C301 VanDerWaalsContact O-SG 3.35Å
298	F	87.1	Confident	87.5	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.009	27%	0.269	C	S	.	.	H	α-helix	trans	-57.7	-51.6	175.6	-177.9	-129.3	0	0	0	112.6	S243 L294 I295 G296 C300 C301 N302 I452	S243-F298 WeakPolarHBondContact OG-CD1 3.43Å; S243-F298 WeakPolarHBondContact OG-CE1 3.05Å; L294-F298 PolarHBondContact O-N 3.48Å; I295-F298 HydrophobicContact CD1-CD1 4.08Å; I295-F298 WeakPolarHBondContact O-CB 3.37Å; I295-F298 PolarHBondContact O-N 3.18Å; G296-F298 VanDerWaalsContact C-N 3.31Å; G296-F298 PolarHBondContact O-N 3.03Å; F298-C300 VanDerWaalsContact C-N 3.32Å; F298-C300 PolarHBondContact O-N 3.42Å; F298-C301 PolarHBondContact O-N 3.07Å; F298-N302 VanDerWaalsContact CE1-ND2 3.31Å; F298-N302 WeakPolarHBondContact CE1-ND2 3.26Å; F298-N302 VanDerWaalsContact CE2-ND2 3.32Å; F298-N302 WeakPolarHBondContact CE2-ND2 2.91Å; F298-N302 WeakPolarHBondContact CZ-ND2 2.96Å; F298-N302 WeakPolarHBondContact O-CB 3.12Å; F298-N302 PolarHBondContact O-N 3.02Å; F298-N302 PolarHBondContact O-ND2 2.74Å; F298-I452 HydrophobicContact CB-CD1 3.75Å; F298-I452 HydrophobicContact CB-CG2 4.31Å; F298-I452 HydrophobicContact CD2-CD1 3.43Å; F298-I452 VanDerWaalsContact CD2-CD1 3.43Å; F298-I452 HydrophobicContact CE2-CD1 4.42Å; F298-I452 HydrophobicContact CG-CD1 4Å
299	F	88.4	Confident	88.1	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-64.1	-36.9	178.9	-80.7	-69	0	0	0	112.3	S243 V274 F277 L278 V281 I295 G296 N302 M303	S243-F299 VanDerWaalsContact CB-CZ 3.47Å; S243-F299 WeakPolarHBondContact OG-CE1 3.4Å; S243-F299 WeakPolarHBondContact OG-CZ 3.45Å; V274-F299 HydrophobicContact CG1-CD1 4.4Å; F277-F299 HydrophobicContact CB-CD1 4.13Å; F277-F299 HydrophobicContact CB-CE1 3.43Å; F277-F299 VanDerWaalsContact CB-CE1 3.43Å; F277-F299 HydrophobicContact CB-CE2 4.49Å; F277-F299 HydrophobicContact CB-CZ 3.65Å; F277-F299 HydrophobicContact CD1-CZ 4.39Å; F277-F299 HydrophobicContact CG-CE1 4.13Å; F277-F299 HydrophobicContact CG-CZ 4.2Å; L278-F299 HydrophobicContact CB-CB 4.34Å; L278-F299 HydrophobicContact CD1-CB 3.89Å; V281-F299 HydrophobicContact CG2-CD2 3.94Å; V281-F299 HydrophobicContact CG2-CE2 3.84Å; I295-F299 HydrophobicContact CD1-CD2 4.19Å; I295-F299 HydrophobicContact CD1-CE2 3.82Å; I295-F299 HydrophobicContact CG1-CD2 3.94Å; I295-F299 HydrophobicContact CG1-CE2 3.73Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.48Å; I295-F299 PolarHBondContact O-N 3.4Å; G296-F299 PolarHBondContact O-N 3.25Å; F299-N302 PolarHBondContact O-N 2.76Å; F299-M303 WeakPolarHBondContact O-CB 3.27Å; F299-M303 PolarHBondContact O-N 3.43Å
300	C	88.7	Confident	88.6	Confident	49 Å²	49	37.5 Å²	37.5	33%	0.331	22%	0.221	S	C	.	.	H	α-helix	trans	-63.7	-45.2	173.5	-74.5	0	0	0	0	112.1	G296 V297 F298 M303 I304	G296-C300 WeakPolarHBondContact O-CB 2.97Å; G296-C300 PolarHBondContact O-N 3.01Å; G296-C300 PolarHBondContact O-SG 2.95Å; V297-C300 PolarHBondContact O-N 3.19Å; F298-C300 VanDerWaalsContact C-N 3.32Å; F298-C300 PolarHBondContact O-N 3.42Å; C300-M303 WeakPolarHBondContact O-CB 3.37Å; C300-M303 PolarHBondContact O-N 2.77Å; C300-I304 WeakPolarHBondContact O-CG1 3.41Å; C300-I304 PolarHBondContact O-N 2.84Å
301	C	89	Confident	89.2	Confident	48 Å²	48	35.2 Å²	35.2	32%	0.324	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-45.7	174.4	-72.6	0	0	0	0	111.4	V297 F298 M303 I304 V305	V297-C301 WeakPolarHBondContact O-CB 3.39Å; V297-C301 PolarHBondContact O-N 3.42Å; V297-C301 PolarHBondContact O-SG 2.86Å; V297-C301 VanDerWaalsContact O-SG 3.35Å; F298-C301 PolarHBondContact O-N 3.07Å; C301-M303 VanDerWaalsContact C-N 3.32Å; C301-M303 PolarHBondContact O-N 3.15Å; C301-I304 PolarHBondContact O-N 3.19Å; C301-V305 WeakPolarHBondContact O-CG2 3.33Å; C301-V305 PolarHBondContact O-N 2.95Å
302	N	87.6	Confident	89.7	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-60.1	-42.3	175.5	-74.5	-26.6	0	0	0	111.4	S247 F298 F299 I304 V305 V306	S247-N302 VanDerWaalsContact OG-CG 3.26Å; S247-N302 PolarHBondContact OG-ND2 3.32Å; S247-N302 VanDerWaalsContact OG-ND2 3.07Å; S247-N302 PolarHBondContact OG-OD1 3.29Å; S247-N302 VanDerWaalsContact OG-OD1 3.13Å; F298-N302 VanDerWaalsContact CE1-ND2 3.31Å; F298-N302 WeakPolarHBondContact CE1-ND2 3.26Å; F298-N302 VanDerWaalsContact CE2-ND2 3.32Å; F298-N302 WeakPolarHBondContact CE2-ND2 2.91Å; F298-N302 WeakPolarHBondContact CZ-ND2 2.96Å; F298-N302 WeakPolarHBondContact O-CB 3.12Å; F298-N302 PolarHBondContact O-N 3.02Å; F298-N302 PolarHBondContact O-ND2 2.74Å; F299-N302 PolarHBondContact O-N 2.76Å; N302-I304 VanDerWaalsContact C-N 3.34Å; N302-I304 PolarHBondContact O-N 3.44Å; N302-V305 PolarHBondContact O-N 3.29Å; N302-V306 WeakPolarHBondContact O-CB 3.34Å; N302-V306 WeakPolarHBondContact O-CG2 3.42Å; N302-V306 PolarHBondContact O-N 2.89Å
303	M	90.3	Very high	90.1	Very high	61 Å²	61	30.7 Å²	30.7	30%	0.3	19%	0.187	S	C	.	.	H	α-helix	trans	-60.3	-42.6	177.5	-173.5	179.9	72.1	0	0	112	L271 V274 L278 F299 C300 C301 S307	L271-M303 HydrophobicContact CD1-CG 4.38Å; V274-M303 HydrophobicContact CG1-CB 4Å; L278-M303 HydrophobicContact CD2-SD 4.24Å; F299-M303 WeakPolarHBondContact O-CB 3.27Å; F299-M303 PolarHBondContact O-N 3.43Å; C300-M303 WeakPolarHBondContact O-CB 3.37Å; C300-M303 PolarHBondContact O-N 2.77Å; C301-M303 VanDerWaalsContact C-N 3.32Å; C301-M303 PolarHBondContact O-N 3.15Å; M303-S307 VanDerWaalsContact O-CB 3.26Å; M303-S307 WeakPolarHBondContact O-CB 3.42Å; M303-S307 PolarHBondContact O-N 3.04Å; M303-S307 PolarHBondContact O-OG 2.98Å
304	I	92	Very high	90.4	Very high	114 Å²	114	33.7 Å²	33.7	59%	0.585	21%	0.206	S	C	*	.	H	α-helix	trans	-64	-45.6	175.6	-65.9	166.9	0	0	0	110.4	C300 C301 N302 S307 A308	C300-I304 WeakPolarHBondContact O-CG1 3.41Å; C300-I304 PolarHBondContact O-N 2.84Å; C301-I304 PolarHBondContact O-N 3.19Å; N302-I304 VanDerWaalsContact C-N 3.34Å; N302-I304 PolarHBondContact O-N 3.44Å; I304-S307 PolarHBondContact O-N 3.3Å; I304-A308 WeakPolarHBondContact O-CB 3.43Å; I304-A308 PolarHBondContact O-N 3.4Å
305	V	91.2	Very high	90.8	Very high	16 Å²	16	37.3 Å²	37.3	10%	0.097	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-48.5	178.8	167.1	0	0	0	0	111.6	C301 N302 S307 A308 S309 F441 V444 I445	C301-V305 WeakPolarHBondContact O-CG2 3.33Å; C301-V305 PolarHBondContact O-N 2.95Å; N302-V305 PolarHBondContact O-N 3.29Å; V305-S307 VanDerWaalsContact C-N 3.35Å; V305-S307 PolarHBondContact O-N 2.81Å; V305-A308 PolarHBondContact O-N 3.26Å; V305-S309 WeakPolarHBondContact O-CB 3.23Å; V305-S309 PolarHBondContact O-N 3.08Å; V305-F441 HydrophobicContact CG1-CD1 3.9Å; V305-F441 HydrophobicContact CG1-CE1 4.39Å; V305-V444 HydrophobicContact CG2-CG1 3.71Å; V305-I445 HydrophobicContact CG1-CD1 4.03Å; V305-I445 HydrophobicContact CG1-CG1 3.93Å
306	V	91.5	Very high	91.2	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-41.7	178.2	-179.5	0	0	0	0	110.4	T250 I270 L271 V274 N302 A308 S309 V310	T250-V306 HydrophobicContact CG2-CB 4.45Å; T250-V306 HydrophobicContact CG2-CG2 3.44Å; T250-V306 VanDerWaalsContact CG2-CG2 3.44Å; I270-V306 HydrophobicContact CG2-CG1 4.06Å; I270-V306 HydrophobicContact CG2-CG2 4.21Å; L271-V306 HydrophobicContact CB-CG1 3.83Å; L271-V306 HydrophobicContact CD1-CB 4.31Å; L271-V306 HydrophobicContact CD1-CG1 4.02Å; V274-V306 HydrophobicContact CG2-CG2 4.24Å; N302-V306 WeakPolarHBondContact O-CB 3.34Å; N302-V306 WeakPolarHBondContact O-CG2 3.42Å; N302-V306 PolarHBondContact O-N 2.89Å; V306-A308 PolarHBondContact O-N 3.37Å; V306-S309 VanDerWaalsContact O-CB 3.31Å; V306-S309 WeakPolarHBondContact O-CB 3.23Å; V306-S309 PolarHBondContact O-N 2.81Å; V306-S309 VanDerWaalsContact O-N 3.16Å; V306-V310 HydrophobicContact CG1-CG2 4.45Å; V306-V310 WeakPolarHBondContact O-CG2 3.36Å; V306-V310 PolarHBondContact O-N 3.22Å
307	S	92.9	Very high	91.6	Very high	49 Å²	49	37.7 Å²	37.7	34%	0.343	23%	0.225	S	C	.	.	H	α-helix	trans	-62.4	-43.3	176.8	-59.8	0	0	0	0	111.8	M303 I304 V305 S309 V310 V311	M303-S307 VanDerWaalsContact O-CB 3.26Å; M303-S307 WeakPolarHBondContact O-CB 3.42Å; M303-S307 PolarHBondContact O-N 3.04Å; M303-S307 PolarHBondContact O-OG 2.98Å; I304-S307 PolarHBondContact O-N 3.3Å; V305-S307 VanDerWaalsContact C-N 3.35Å; V305-S307 PolarHBondContact O-N 2.81Å; S307-S309 VanDerWaalsContact C-N 3.31Å; S307-S309 PolarHBondContact O-N 3.28Å; S307-V310 PolarHBondContact O-N 2.7Å; S307-V311 WeakPolarHBondContact O-CG2 3.5Å; S307-V311 PolarHBondContact O-N 3.36Å; S307-V311 VanDerWaalsContact O-N 3.13Å
308	A	93.5	Very high	91.8	Very high	41 Å²	41	39 Å²	39	34%	0.339	23%	0.231	S	C	.	.	H	α-helix	trans	-66.1	-34.1	174.7	0	0	0	0	0	112.3	I304 V305 V306 S312 F441	I304-A308 WeakPolarHBondContact O-CB 3.43Å; I304-A308 PolarHBondContact O-N 3.4Å; V305-A308 PolarHBondContact O-N 3.26Å; V306-A308 PolarHBondContact O-N 3.37Å; A308-S312 WeakPolarHBondContact O-CB 3.46Å; A308-S312 PolarHBondContact O-N 2.94Å; A308-S312 PolarHBondContact O-OG 3.17Å; A308-F441 HydrophobicContact CB-CE1 3.91Å; A308-F441 HydrophobicContact CB-CZ 3.95Å
309	S	93	Very high	92.1	Very high	1 Å²	1	40 Å²	40	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-48	172.8	174.9	0	0	0	0	111.4	F254 E267 V305 V306 S307 V311 S312 N313	F254-S309 WeakPolarHBondContact CE2-OG 3.37Å; F254-S309 WeakPolarHBondContact CZ-OG 3.41Å; E267-S309 WeakPolarHBondContact OE2-CB 3.41Å; E267-S309 PolarHBondContact OE2-OG 2.8Å; V305-S309 WeakPolarHBondContact O-CB 3.23Å; V305-S309 PolarHBondContact O-N 3.08Å; V306-S309 VanDerWaalsContact O-CB 3.31Å; V306-S309 WeakPolarHBondContact O-CB 3.23Å; V306-S309 PolarHBondContact O-N 2.81Å; V306-S309 VanDerWaalsContact O-N 3.16Å; S307-S309 VanDerWaalsContact C-N 3.31Å; S307-S309 PolarHBondContact O-N 3.28Å; S309-V311 PolarHBondContact O-N 3Å; S309-S312 WeakPolarHBondContact O-CB 3.39Å; S309-S312 PolarHBondContact O-N 2.78Å; S309-S312 VanDerWaalsContact O-N 3.14Å; S309-N313 WeakPolarHBondContact O-CB 3.32Å; S309-N313 PolarHBondContact O-N 3.28Å; S309-N313 PolarHBondContact O-ND2 2.77Å; S309-N313 VanDerWaalsContact O-ND2 3.13Å; S309-N313 PolarHBondContact OG-ND2 3.48Å
310	V	93.4	Very high	92.3	Very high	25 Å²	25	41 Å²	41	15%	0.152	24%	0.24	C	C	.	.	H	α-helix	trans	-57.2	-48.2	176.7	-178.7	0	0	0	0	110.7	E267 V306 S307 S312 N313 V314	E267-V310 HydrophobicContact CB-CG2 3.95Å; V306-V310 HydrophobicContact CG1-CG2 4.45Å; V306-V310 WeakPolarHBondContact O-CG2 3.36Å; V306-V310 PolarHBondContact O-N 3.22Å; S307-V310 PolarHBondContact O-N 2.7Å; V310-S312 VanDerWaalsContact C-N 3.34Å; V310-S312 PolarHBondContact O-N 3.46Å; V310-N313 PolarHBondContact O-N 2.85Å; V310-V314 WeakPolarHBondContact O-CG2 3.34Å; V310-V314 PolarHBondContact O-N 2.81Å
311	V	94.5	Very high	92.4	Very high	89 Å²	89	46.1 Å²	46.1	54%	0.539	25%	0.254	S	S	.	.	H	α-helix	trans	-60.3	-44	177.3	174.4	0	0	0	0	111.2	S307 S309 N313 V314 L315	S307-V311 WeakPolarHBondContact O-CG2 3.5Å; S307-V311 PolarHBondContact O-N 3.36Å; S307-V311 VanDerWaalsContact O-N 3.13Å; S309-V311 PolarHBondContact O-N 3Å; V311-N313 VanDerWaalsContact C-N 3.34Å; V311-N313 PolarHBondContact O-N 3.33Å; V311-V314 PolarHBondContact O-N 2.76Å; V311-L315 HydrophobicContact CG1-CD1 4.44Å; V311-L315 WeakPolarHBondContact O-CG 3.41Å; V311-L315 PolarHBondContact O-N 2.79Å
312	S	93	Very high	92.6	Very high	23 Å²	23	46.9 Å²	46.9	16%	0.161	25%	0.25	C	C	.	.	H	α-helix	trans	-61.9	-41.6	177.7	-59.2	0	0	0	0	111.8	A308 S309 V310 L315 V316	A308-S312 WeakPolarHBondContact O-CB 3.46Å; A308-S312 PolarHBondContact O-N 2.94Å; A308-S312 PolarHBondContact O-OG 3.17Å; S309-S312 WeakPolarHBondContact O-CB 3.39Å; S309-S312 PolarHBondContact O-N 2.78Å; S309-S312 VanDerWaalsContact O-N 3.14Å; V310-S312 VanDerWaalsContact C-N 3.34Å; V310-S312 PolarHBondContact O-N 3.46Å; S312-L315 WeakPolarHBondContact O-CB 3.48Å; S312-L315 PolarHBondContact O-N 3.24Å; S312-V316 WeakPolarHBondContact O-CG2 3.39Å; S312-V316 PolarHBondContact O-N 3.17Å
313	N	92.9	Very high	92.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.5	-38.1	177.4	-75.9	-43.2	0	0	0	112.4	F254 K263 L264 E267 S309 V310 V311 L315 V316 L317	F254-N313 WeakPolarHBondContact CE1-OD1 3.32Å; K263-N313 WeakPolarHBondContact CE-OD1 3.33Å; L264-N313 HydrophobicContact CD2-CB 4.22Å; E267-N313 WeakPolarHBondContact CG-ND2 3.31Å; S309-N313 WeakPolarHBondContact O-CB 3.32Å; S309-N313 PolarHBondContact O-N 3.28Å; S309-N313 PolarHBondContact O-ND2 2.77Å; S309-N313 VanDerWaalsContact O-ND2 3.13Å; S309-N313 PolarHBondContact OG-ND2 3.48Å; V310-N313 PolarHBondContact O-N 2.85Å; V311-N313 VanDerWaalsContact C-N 3.34Å; V311-N313 PolarHBondContact O-N 3.33Å; N313-L315 VanDerWaalsContact C-N 3.31Å; N313-L315 PolarHBondContact O-N 2.82Å; N313-V316 PolarHBondContact O-N 2.62Å; N313-L317 WeakPolarHBondContact O-CB 3.36Å; N313-L317 WeakPolarHBondContact O-CD1 3.43Å; N313-L317 WeakPolarHBondContact O-CG 3.43Å; N313-L317 PolarHBondContact O-N 3Å
314	V	94.4	Very high	92.3	Very high	75 Å²	75	45.9 Å²	45.9	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-39.7	171.5	173.7	0	0	0	0	111.2	L264 V310 V311 L317 N318	L264-V314 HydrophobicContact CD2-CG2 3.75Å; V310-V314 WeakPolarHBondContact O-CG2 3.34Å; V310-V314 PolarHBondContact O-N 2.81Å; V311-V314 PolarHBondContact O-N 2.76Å; V314-L317 PolarHBondContact O-N 3.24Å; V314-N318 WeakPolarHBondContact O-CB 3.4Å; V314-N318 PolarHBondContact O-N 3.08Å
315	L	94.1	Very high	92	Very high	103 Å²	103	46.4 Å²	46.4	54%	0.539	25%	0.253	S	S	.	.	H	α-helix	trans	-66	-43.1	175.4	-67.1	172.8	0	0	0	112.1	V311 S312 N313 L317 N318 L319	V311-L315 HydrophobicContact CG1-CD1 4.44Å; V311-L315 WeakPolarHBondContact O-CG 3.41Å; V311-L315 PolarHBondContact O-N 2.79Å; S312-L315 WeakPolarHBondContact O-CB 3.48Å; S312-L315 PolarHBondContact O-N 3.24Å; N313-L315 VanDerWaalsContact C-N 3.31Å; N313-L315 PolarHBondContact O-N 2.82Å; L315-L317 VanDerWaalsContact C-N 3.32Å; L315-L317 PolarHBondContact O-N 2.87Å; L315-N318 PolarHBondContact O-N 3.21Å; L315-L319 VanDerWaalsContact O-CG 3.32Å; L315-L319 WeakPolarHBondContact O-CG 3.41Å; L315-L319 PolarHBondContact O-N 3.33Å
316	V	93.7	Very high	91.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-43.8	174.7	170.2	0	0	0	0	110.7	V258 S312 N313 L319 H320 A430 I433 D434	V258-V316 HydrophobicContact CG2-CG1 4.04Å; S312-V316 WeakPolarHBondContact O-CG2 3.39Å; S312-V316 PolarHBondContact O-N 3.17Å; N313-V316 PolarHBondContact O-N 2.62Å; V316-L319 PolarHBondContact O-N 2.85Å; V316-H320 WeakPolarHBondContact O-CB 3.29Å; V316-H320 PolarHBondContact O-N 2.87Å; V316-A430 HydrophobicContact CG1-CB 4.21Å; V316-I433 HydrophobicContact CG2-CB 4.35Å; V316-I433 HydrophobicContact CG2-CG2 3.74Å; V316-D434 HydrophobicContact CG1-CB 4.09Å; V316-D434 HydrophobicContact CG2-CB 4.31Å
317	L	93.9	Very high	91.9	Very high	29 Å²	29	54.2 Å²	54.2	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-44.4	175.8	-78.9	158.3	0	0	0	112.2	V258 L264 N313 V314 L315 L319 H320 Y321	V258-L317 HydrophobicContact CG1-CD2 3.46Å; V258-L317 VanDerWaalsContact CG1-CD2 3.46Å; V258-L317 HydrophobicContact CG1-CG 4.46Å; L264-L317 HydrophobicContact CD1-CD1 3.45Å; L264-L317 VanDerWaalsContact CD1-CD1 3.45Å; L264-L317 HydrophobicContact CD2-CD1 3.69Å; L264-L317 HydrophobicContact CG-CD1 3.33Å; N313-L317 WeakPolarHBondContact O-CB 3.36Å; N313-L317 WeakPolarHBondContact O-CD1 3.43Å; N313-L317 WeakPolarHBondContact O-CG 3.43Å; N313-L317 PolarHBondContact O-N 3Å; V314-L317 PolarHBondContact O-N 3.24Å; L315-L317 VanDerWaalsContact C-N 3.32Å; L315-L317 PolarHBondContact O-N 2.87Å; L317-L319 PolarHBondContact O-N 3.42Å; L317-H320 PolarHBondContact O-N 3.08Å; L317-Y321 HydrophobicContact CD2-CD2 4.44Å; L317-Y321 HydrophobicContact CD2-CE2 3.93Å; L317-Y321 WeakPolarHBondContact O-CD2 3.25Å; L317-Y321 PolarHBondContact O-N 2.83Å; L317-Y321 VanDerWaalsContact O-N 3.16Å
318	N	93.4	Very high	91.6	Very high	88 Å²	88	63 Å²	63	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-58.3	-40.3	175.4	-177.5	-93	0	0	0	111.4	V314 L315 R322	V314-N318 WeakPolarHBondContact O-CB 3.4Å; V314-N318 PolarHBondContact O-N 3.08Å; L315-N318 PolarHBondContact O-N 3.21Å; N318-R322 WeakPolarHBondContact O-CG 3.33Å; N318-R322 PolarHBondContact OD1-NE 3Å; N318-R322 PolarHBondContact OD1-NH2 3.18Å
319	L	92.1	Very high	91.4	Very high	22 Å²	22	62.4 Å²	62.4	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-71.6	-40	178.4	-71.2	163.9	0	0	0	112.7	L315 V316 L317 Y321 R322 W426 A430 I433	L315-L319 VanDerWaalsContact O-CG 3.32Å; L315-L319 WeakPolarHBondContact O-CG 3.41Å; L315-L319 PolarHBondContact O-N 3.33Å; V316-L319 PolarHBondContact O-N 2.85Å; L317-L319 PolarHBondContact O-N 3.42Å; L319-Y321 PolarHBondContact O-N 2.83Å; L319-R322 PolarHBondContact O-N 2.88Å; L319-W426 HydrophobicContact CD2-CE3 4.05Å; L319-W426 HydrophobicContact CD2-CZ3 3.57Å; L319-A430 HydrophobicContact CB-CB 4.16Å; L319-I433 HydrophobicContact CD1-CD1 3.3Å
320	H	92.6	Very high	91.2	Very high	22 Å²	22	64 Å²	64	10%	0.102	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-39.7	-179.8	179.9	-88.3	0	0	0	112.5	V258 V316 L317 A430	V258-H320 HydrophobicContact CG1-CB 4.01Å; V316-H320 WeakPolarHBondContact O-CB 3.29Å; V316-H320 PolarHBondContact O-N 2.87Å; L317-H320 PolarHBondContact O-N 3.08Å; H320-A430 HydrophobicContact CB-CB 3.87Å
321	Y	92	Very high	91.1	Very high	157 Å²	157	68.7 Å²	68.7	62%	0.616	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	12.2	-177.8	-71	-69.1	0	0	0	114.5	V258 L317 L319 S323	V258-Y321 HydrophobicContact CG1-CE2 4.15Å; L317-Y321 HydrophobicContact CD2-CD2 4.44Å; L317-Y321 HydrophobicContact CD2-CE2 3.93Å; L317-Y321 WeakPolarHBondContact O-CD2 3.25Å; L317-Y321 PolarHBondContact O-N 2.83Å; L317-Y321 VanDerWaalsContact O-N 3.16Å; L319-Y321 PolarHBondContact O-N 2.83Å; Y321-S323 PolarHBondContact O-N 2.74Å
322	R	91.9	Very high	90.9	Very high	63 Å²	63	73.7 Å²	73.7	24%	0.238	37%	0.368	C	S	.	.			trans	-70	121	173	-82	171.5	-168.1	-165.8	0.9	111.2	N318 L319 H327 W426	N318-R322 WeakPolarHBondContact O-CG 3.33Å; N318-R322 PolarHBondContact OD1-NE 3Å; N318-R322 PolarHBondContact OD1-NH2 3.18Å; L319-R322 PolarHBondContact O-N 2.88Å; R322-H327 HydrophobicContact CB-CB 4.42Å; R322-H327 HydrophobicContact CG-CB 4.22Å; R322-W426 HydrophobicContact CB-CD2 3.79Å; R322-W426 HydrophobicContact CB-CE3 4.23Å; R322-W426 HydrophobicContact CB-CG 3.95Å; R322-W426 VanDerWaalsContact NH1-CH2 3.31Å
323	S	86.6	Confident	90.8	Very high	30 Å²	30	73.7 Å²	73.7	21%	0.21	37%	0.369	C	S	.	.			trans	-89.6	145.5	171.6	-172.3	0	0	0	0	111.2	Y321 D325 T326 H327	Y321-S323 PolarHBondContact O-N 2.74Å; S323-D325 PolarHBondContact O-N 3.4Å; S323-D325 VanDerWaalsContact O-N 3.11Å; S323-D325 PolarHBondContact OG-OD2 2.59Å; S323-D325 VanDerWaalsContact OG-OD2 3.06Å; S323-T326 PolarHBondContact O-N 3.43Å; S323-T326 PolarHBondContact O-OG1 2.88Å; S323-H327 PolarHBondContact O-N 3.34Å; S323-H327 VanDerWaalsContact O-N 3.11Å
324	P	85.2	Confident	90.6	Very high	15 Å²	15	77.7 Å²	77.7	10%	0.097	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-25.7	171.9	21.6	-35.3	0	0	0	114.4	T326 D419 L422 R423	P324-T326 VanDerWaalsContact C-N 3.27Å; P324-T326 PolarHBondContact O-N 2.62Å; P324-D419 HydrophobicContact CG-CB 3.89Å; P324-L422 HydrophobicContact CB-CB 3.95Å; P324-L422 HydrophobicContact CB-CD1 3.71Å; P324-L422 HydrophobicContact CB-CG 4.5Å; P324-L422 HydrophobicContact CG-CB 4.31Å; P324-R423 HydrophobicContact CG-CG 4.41Å
325	D	86.6	Confident	90.4	Very high	125 Å²	125	81.4 Å²	81.4	67%	0.668	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.4	176.7	-56.2	-57.5	0	0	0	113.3	S323	S323-D325 PolarHBondContact O-N 3.4Å; S323-D325 VanDerWaalsContact O-N 3.11Å; S323-D325 PolarHBondContact OG-OD2 2.59Å; S323-D325 VanDerWaalsContact OG-OD2 3.06Å
326	T	89.9	Confident	90.3	Very high	95 Å²	95	78 Å²	78	58%	0.583	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-36.2	-173.7	60.3	0	0	0	0	112.7	S323 P324	S323-T326 PolarHBondContact O-N 3.43Å; S323-T326 PolarHBondContact O-OG1 2.88Å; P324-T326 VanDerWaalsContact C-N 3.27Å; P324-T326 PolarHBondContact O-N 2.62Å
327	H	90.7	Very high	90.1	Very high	86 Å²	86	79.2 Å²	79.2	40%	0.398	39%	0.386	S	S	.	.			trans	-140.1	127.7	-172.6	-64.9	80.3	0	0	0	111.4	R322 S323 W426	R322-H327 HydrophobicContact CB-CB 4.42Å; R322-H327 HydrophobicContact CG-CB 4.22Å; S323-H327 PolarHBondContact O-N 3.34Å; S323-H327 VanDerWaalsContact O-N 3.11Å; H327-W426 HydrophobicContact CB-CZ2 4Å; H327-W426 PolarHBondContact O-NE1 3.03Å
328	R	86.1	Confident	89.9	Confident	233 Å²	233	79 Å²	79	88%	0.879	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-100.3	132.6	168	-66.1	-173.4	176.9	-167.2	-2	110	G330	R328-G330 PolarHBondContact O-N 2.97Å
329	M	88.7	Confident	89.5	Confident	30 Å²	30	77.9 Å²	77.9	15%	0.148	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-72.1	116.4	178.6	-166	-175.5	-157.6	0	0	109.8	A333 K334 L337 L338 W426 A429	M329-A333 HydrophobicContact CE-CB 4.43Å; M329-A333 HydrophobicContact CG-CB 4.03Å; M329-K334 HydrophobicContact CG-CB 4.2Å; M329-K334 HydrophobicContact SD-CB 3.82Å; M329-K334 HydrophobicContact SD-CG 4.02Å; M329-L337 HydrophobicContact CE-CB 3.62Å; M329-L337 HydrophobicContact CE-CD1 3.6Å; M329-L337 HydrophobicContact CE-CG 4.13Å; M329-L338 HydrophobicContact CE-CD2 4.24Å; M329-L338 HydrophobicContact CE-CG 4.03Å; M329-L338 HydrophobicContact SD-CD1 4.15Å; M329-L338 HydrophobicContact SD-CG 4.26Å; M329-W426 HydrophobicContact CB-CH2 4.29Å; M329-W426 HydrophobicContact CB-CZ2 3.9Å; M329-W426 HydrophobicContact CG-CH2 4.32Å; M329-W426 HydrophobicContact CG-CZ2 4.41Å; M329-A429 HydrophobicContact CE-CB 3.98Å
330	G	89.7	Confident	89.3	Confident	35 Å²	35	84.5 Å²	84.5	36%	0.361	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-60	152.9	177.5	0	0	0	0	0	112.3	R328 W332 A333 K334	R328-G330 PolarHBondContact O-N 2.97Å; G330-W332 PolarHBondContact O-N 3Å; G330-A333 PolarHBondContact O-N 2.97Å; G330-A333 VanDerWaalsContact O-N 3.09Å; G330-K334 PolarHBondContact O-N 3.01Å
331	P	90.3	Very high	89.3	Confident	122 Å²	122	84.1 Å²	84.1	79%	0.792	41%	0.406	S	S	*	.	H	α-helix	trans	-60.3	-34.9	-175.3	23.2	-33.6	0	0	0	112.7	K335	P331-K335 WeakPolarHBondContact O-CB 3.37Å; P331-K335 PolarHBondContact O-N 2.8Å; P331-K335 VanDerWaalsContact O-N 3.09Å
332	W	91.5	Very high	89.1	Confident	194 Å²	194	76.9 Å²	76.9	74%	0.735	38%	0.378	S	S	*	.	H	α-helix	trans	-67.3	-47.7	174.7	-179.4	86.7	0	0	0	112	G330 K334 K335 V336	G330-W332 PolarHBondContact O-N 3Å; W332-K334 VanDerWaalsContact C-N 3.3Å; W332-K334 PolarHBondContact O-N 2.87Å; W332-K335 PolarHBondContact O-N 2.84Å; W332-K335 VanDerWaalsContact O-N 3.16Å; W332-V336 HydrophobicContact CD2-CG2 4.05Å; W332-V336 HydrophobicContact CE3-CG2 4.47Å; W332-V336 HydrophobicContact CH2-CG2 4.25Å; W332-V336 HydrophobicContact CZ2-CG2 3.8Å; W332-V336 WeakPolarHBondContact O-CG2 3.41Å; W332-V336 PolarHBondContact O-N 2.94Å
333	A	90.7	Very high	88.9	Confident	24 Å²	24	81.9 Å²	81.9	20%	0.198	40%	0.401	C	S	.	.	H	α-helix	trans	-59.7	-43	177.5	0	0	0	0	0	110.9	M329 G330 K335 V336 L337	M329-A333 HydrophobicContact CE-CB 4.43Å; M329-A333 HydrophobicContact CG-CB 4.03Å; G330-A333 PolarHBondContact O-N 2.97Å; G330-A333 VanDerWaalsContact O-N 3.09Å; A333-K335 PolarHBondContact O-N 3.11Å; A333-V336 PolarHBondContact O-N 3.47Å; A333-L337 HydrophobicContact CB-CD1 4.43Å; A333-L337 VanDerWaalsContact O-CB 3.29Å; A333-L337 WeakPolarHBondContact O-CB 3.44Å; A333-L337 WeakPolarHBondContact O-CG 3.23Å; A333-L337 PolarHBondContact O-N 3.09Å
334	K	89.2	Confident	89.1	Confident	83 Å²	83	85.6 Å²	85.6	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-58.2	-46	175.6	-166.6	168.3	-179.7	143.2	0	111.7	M329 G330 W332 L338 E425	M329-K334 HydrophobicContact CG-CB 4.2Å; M329-K334 HydrophobicContact SD-CB 3.82Å; M329-K334 HydrophobicContact SD-CG 4.02Å; G330-K334 PolarHBondContact O-N 3.01Å; W332-K334 VanDerWaalsContact C-N 3.3Å; W332-K334 PolarHBondContact O-N 2.87Å; K334-L338 HydrophobicContact CD-CD1 4.34Å; K334-L338 HydrophobicContact CG-CD1 3.62Å; K334-L338 HydrophobicContact CG-CG 4.23Å; K334-L338 VanDerWaalsContact O-CB 3.23Å; K334-L338 WeakPolarHBondContact O-CB 3.4Å; K334-L338 PolarHBondContact O-N 2.95Å; K334-E425 IonicContact NZ-OE1 2.73Å; K334-E425 PolarHBondContact NZ-OE1 3.1Å; K334-E425 IonicContact NZ-OE2 3.37Å; K334-E425 PolarHBondContact NZ-OE2 3.03Å
335	K	89.7	Confident	89.3	Confident	153 Å²	153	86 Å²	86	67%	0.665	42%	0.42	S	S	*	.	I	π-helix	trans	-64.6	-41.3	177.8	-170.2	175.2	-178.3	177.7	0	112.6	P331 W332 A333 C339 W340	P331-K335 WeakPolarHBondContact O-CB 3.37Å; P331-K335 PolarHBondContact O-N 2.8Å; P331-K335 VanDerWaalsContact O-N 3.09Å; W332-K335 PolarHBondContact O-N 2.84Å; W332-K335 VanDerWaalsContact O-N 3.16Å; A333-K335 PolarHBondContact O-N 3.11Å; K335-C339 VanDerWaalsContact O-CB 3.28Å; K335-C339 WeakPolarHBondContact O-CB 3.46Å; K335-C339 PolarHBondContact O-N 3.47Å; K335-W340 PolarHBondContact O-N 2.83Å
336	V	91.8	Very high	89.3	Confident	33 Å²	33	91.3 Å²	91.3	20%	0.2	43%	0.431	C	S	.	.	I	π-helix	trans	-73	-53.8	-179.1	174	0	0	0	0	111.3	W332 A333 W340 L341	W332-V336 HydrophobicContact CD2-CG2 4.05Å; W332-V336 HydrophobicContact CE3-CG2 4.47Å; W332-V336 HydrophobicContact CH2-CG2 4.25Å; W332-V336 HydrophobicContact CZ2-CG2 3.8Å; W332-V336 WeakPolarHBondContact O-CG2 3.41Å; W332-V336 PolarHBondContact O-N 2.94Å; A333-V336 PolarHBondContact O-N 3.47Å; V336-W340 PolarHBondContact O-N 2.03Å; V336-L341 HydrophobicContact CG1-CD1 3.96Å; V336-L341 HydrophobicContact CG1-CG 4.26Å; V336-L341 WeakPolarHBondContact O-CB 3.23Å; V336-L341 PolarHBondContact O-N 3.27Å
337	L	90.6	Very high	89	Confident	24 Å²	24	89 Å²	89	13%	0.126	41%	0.413	C	S	.	.	I	π-helix	trans	-77.7	-33.9	-171.7	-61.9	174.1	0	0	0	113.2	M329 A333 L341 P342 A429 I433	M329-L337 HydrophobicContact CE-CB 3.62Å; M329-L337 HydrophobicContact CE-CD1 3.6Å; M329-L337 HydrophobicContact CE-CG 4.13Å; A333-L337 HydrophobicContact CB-CD1 4.43Å; A333-L337 VanDerWaalsContact O-CB 3.29Å; A333-L337 WeakPolarHBondContact O-CB 3.44Å; A333-L337 WeakPolarHBondContact O-CG 3.23Å; A333-L337 PolarHBondContact O-N 3.09Å; L337-L341 HydrophobicContact CD2-CD1 3.83Å; L337-P342 VanDerWaalsContact O-CD 3.28Å; L337-P342 WeakPolarHBondContact O-CD 3.35Å; L337-P342 WeakPolarHBondContact O-CG 3.19Å; L337-A429 HydrophobicContact CB-CB 4.04Å; L337-A429 HydrophobicContact CD1-CB 4.12Å; L337-I433 HydrophobicContact CD1-CD1 4.39Å; L337-I433 HydrophobicContact CD2-CD1 3.61Å; L337-I433 HydrophobicContact CD2-CG1 3.78Å
338	L	88	Confident	88.5	Confident	25 Å²	25	93.3 Å²	93.3	13%	0.131	43%	0.431	C	S	.	.	I	π-helix	trans	-98.8	-21.5	-177.8	-51.9	-173.5	0	0	0	114.1	M329 K334 P342 E425 F428 A429	M329-L338 HydrophobicContact CE-CD2 4.24Å; M329-L338 HydrophobicContact CE-CG 4.03Å; M329-L338 HydrophobicContact SD-CD1 4.15Å; M329-L338 HydrophobicContact SD-CG 4.26Å; K334-L338 HydrophobicContact CD-CD1 4.34Å; K334-L338 HydrophobicContact CG-CD1 3.62Å; K334-L338 HydrophobicContact CG-CG 4.23Å; K334-L338 VanDerWaalsContact O-CB 3.23Å; K334-L338 WeakPolarHBondContact O-CB 3.4Å; K334-L338 PolarHBondContact O-N 2.95Å; L338-P342 WeakPolarHBondContact O-CG 2.78Å; L338-E425 HydrophobicContact CD1-CB 4.11Å; L338-E425 HydrophobicContact CD1-CG 4Å; L338-F428 HydrophobicContact CD2-CD1 3.67Å; L338-F428 HydrophobicContact CD2-CE1 4.38Å; L338-A429 HydrophobicContact CD2-CB 4.2Å
339	C	85.9	Confident	87.7	Confident	64 Å²	64	86.8 Å²	86.8	43%	0.432	42%	0.419	S	S	.	.	I	π-helix	trans	-116.5	-49.6	-175.6	-60	0	0	0	0	113.7	K335 K343	K335-C339 VanDerWaalsContact O-CB 3.28Å; K335-C339 WeakPolarHBondContact O-CB 3.46Å; K335-C339 PolarHBondContact O-N 3.47Å; C339-K343 VanDerWaalsContact O-CD 3.29Å; C339-K343 WeakPolarHBondContact O-CD 3.29Å; C339-K343 WeakPolarHBondContact O-CG 3.38Å
340	W	88.8	Confident	86.8	Confident	161 Å²	161	88.1 Å²	88.1	61%	0.61	43%	0.426	S	S	*	.	I	π-helix	trans	-81.3	-53.6	-172	-174	77.1	0	0	0	112.7	K335 V336 K343 L344	K335-W340 PolarHBondContact O-N 2.83Å; V336-W340 PolarHBondContact O-N 2.03Å; W340-K343 PolarHBondContact O-N 2.93Å; W340-L344 HydrophobicContact CH2-CD2 4.07Å; W340-L344 HydrophobicContact CZ3-CD2 4.28Å; W340-L344 PolarHBondContact O-N 2.91Å
341	L	90.6	Very high	85.5	Confident	15 Å²	15	94.4 Å²	94.4	8%	0.079	45%	0.446	C	S	.	.	H	α-helix	trans	-62.5	-43.3	179.4	-76.5	168.7	0	0	0	113.7	V336 L337 K343 L344 L345 V432 L436	V336-L341 HydrophobicContact CG1-CD1 3.96Å; V336-L341 HydrophobicContact CG1-CG 4.26Å; V336-L341 WeakPolarHBondContact O-CB 3.23Å; V336-L341 PolarHBondContact O-N 3.27Å; L337-L341 HydrophobicContact CD2-CD1 3.83Å; L341-K343 VanDerWaalsContact C-N 3.3Å; L341-K343 PolarHBondContact O-N 3.26Å; L341-L344 HydrophobicContact CD2-CD2 4.41Å; L341-L344 WeakPolarHBondContact O-CB 3.42Å; L341-L344 PolarHBondContact O-N 2.8Å; L341-L344 VanDerWaalsContact O-N 3.16Å; L341-L345 WeakPolarHBondContact O-CB 3.41Å; L341-L345 VanDerWaalsContact O-CG 3.25Å; L341-L345 WeakPolarHBondContact O-CG 3.35Å; L341-L345 PolarHBondContact O-N 2.8Å; L341-V432 HydrophobicContact CB-CG1 3.5Å; L341-V432 HydrophobicContact CD1-CG1 4.23Å; L341-V432 HydrophobicContact CG-CG1 4.5Å; L341-L436 HydrophobicContact CD1-CD2 4.44Å; L341-L436 HydrophobicContact CD2-CD1 4.35Å; L341-L436 HydrophobicContact CD2-CD2 4.02Å
342	P	89.2	Confident	83.9	Confident	4 Å²	4	93 Å²	93	3%	0.026	43%	0.425	C	S	.	.	H	α-helix	trans	-62.6	-37.7	178.5	-25	36.4	0	0	0	112.6	L337 L338 L345 R346 M347 F428 V432	L337-P342 VanDerWaalsContact O-CD 3.28Å; L337-P342 WeakPolarHBondContact O-CD 3.35Å; L337-P342 WeakPolarHBondContact O-CG 3.19Å; L338-P342 WeakPolarHBondContact O-CG 2.78Å; P342-L345 CarbonylContact O-C 3.56Å; P342-L345 PolarHBondContact O-N 3.22Å; P342-R346 PolarHBondContact O-N 2.75Å; P342-M347 HydrophobicContact CB-CB 4.24Å; P342-M347 PolarHBondContact O-N 2.77Å; P342-F428 HydrophobicContact CB-CE1 4.2Å; P342-F428 HydrophobicContact CB-CZ 4.13Å; P342-F428 HydrophobicContact CG-CE1 3.69Å; P342-F428 HydrophobicContact CG-CZ 4.12Å; P342-V432 HydrophobicContact CB-CG2 4.43Å; P342-V432 HydrophobicContact CG-CG1 4.11Å; P342-V432 HydrophobicContact CG-CG2 3.71Å
343	K	87.4	Confident	81.9	Confident	168 Å²	168	87.4 Å²	87.4	73%	0.73	42%	0.415	S	S	*	.	H	α-helix	trans	-64.7	-42.5	174.2	-73.9	179.6	-174.1	-175.6	0	111.6	C339 W340 L341 L345 R346	C339-K343 VanDerWaalsContact O-CD 3.29Å; C339-K343 WeakPolarHBondContact O-CD 3.29Å; C339-K343 WeakPolarHBondContact O-CG 3.38Å; W340-K343 PolarHBondContact O-N 2.93Å; L341-K343 VanDerWaalsContact C-N 3.3Å; L341-K343 PolarHBondContact O-N 3.26Å; K343-L345 VanDerWaalsContact C-N 3.35Å; K343-R346 PolarHBondContact O-N 2.05Å
344	L	90.1	Very high	79.6	Confident	108 Å²	108	91.3 Å²	91.3	57%	0.565	43%	0.433	S	S	*	.	H	α-helix	trans	-62.1	-42.9	175.5	-176.9	66.8	0	0	0	111.5	W340 L341 R346	W340-L344 HydrophobicContact CH2-CD2 4.07Å; W340-L344 HydrophobicContact CZ3-CD2 4.28Å; W340-L344 PolarHBondContact O-N 2.91Å; L341-L344 HydrophobicContact CD2-CD2 4.41Å; L341-L344 WeakPolarHBondContact O-CB 3.42Å; L341-L344 PolarHBondContact O-N 2.8Å; L341-L344 VanDerWaalsContact O-N 3.16Å; L344-R346 VanDerWaalsContact C-N 3.29Å; L344-R346 PolarHBondContact O-N 2.85Å
345	L	89.5	Confident	77.8	Confident	25 Å²	25	94.1 Å²	94.1	13%	0.131	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	1.1	-178.7	-62.5	172	0	0	0	114	L341 P342 K343 M347 V432 R435 L436 I439	L341-L345 WeakPolarHBondContact O-CB 3.41Å; L341-L345 VanDerWaalsContact O-CG 3.25Å; L341-L345 WeakPolarHBondContact O-CG 3.35Å; L341-L345 PolarHBondContact O-N 2.8Å; P342-L345 CarbonylContact O-C 3.56Å; P342-L345 PolarHBondContact O-N 3.22Å; K343-L345 VanDerWaalsContact C-N 3.35Å; L345-M347 HydrophobicContact CB-CG 4.05Å; L345-M347 HydrophobicContact CB-SD 4.27Å; L345-M347 HydrophobicContact CD1-SD 4.22Å; L345-M347 PolarHBondContact O-N 3.05Å; L345-V432 HydrophobicContact CD1-CG1 4.02Å; L345-V432 WeakPolarHBondContact CD1-O 3.26Å; L345-R435 HydrophobicContact CD1-CB 4.24Å; L345-R435 HydrophobicContact CD1-CG 4.26Å; L345-L436 HydrophobicContact CD1-CB 4.19Å; L345-L436 HydrophobicContact CD2-CD1 4.27Å; L345-I439 HydrophobicContact CD2-CD1 3.46Å; L345-I439 VanDerWaalsContact CD2-CD1 3.46Å
346	R	86.2	Confident	75.9	Confident	236 Å²	236	89.8 Å²	89.8	89%	0.891	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	34.8	-174.7	-58.9	-177.6	176.7	178.5	-0.8	114	P342 K343 L344	P342-R346 PolarHBondContact O-N 2.75Å; K343-R346 PolarHBondContact O-N 2.05Å; L344-R346 VanDerWaalsContact C-N 3.29Å; L344-R346 PolarHBondContact O-N 2.85Å
347	M	85.4	Confident	73.9	Confident	45 Å²	45	93 Å²	93	22%	0.222	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-82.1	144.2	173.4	-65	178.8	111.7	0	0	110.1	P342 L345 M431 V432 R435	P342-M347 HydrophobicContact CB-CB 4.24Å; P342-M347 PolarHBondContact O-N 2.77Å; L345-M347 HydrophobicContact CB-CG 4.05Å; L345-M347 HydrophobicContact CB-SD 4.27Å; L345-M347 HydrophobicContact CD1-SD 4.22Å; L345-M347 PolarHBondContact O-N 3.05Å; M347-M431 HydrophobicContact CE-CG 4Å; M347-M431 HydrophobicContact CE-SD 4.34Å; M347-V432 HydrophobicContact SD-CG2 4Å; M347-R435 HydrophobicContact CE-CB 3.65Å; M347-R435 HydrophobicContact CE-CG 3.81Å; M347-R435 HydrophobicContact SD-CB 3.98Å; M347-R435 HydrophobicContact SD-CG 4.02Å
348	K	79.3	Confident	72	Confident	178 Å²	178	97.1 Å²	97.1	77%	0.774	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-64.1	130.7	172.5	-70.8	-175.3	178.3	-177.4	0	108.9
349	P	69.9	Low	70.3	Confident	96 Å²	96	101.1 Å²	101.1	62%	0.623	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-63.5	150	175	26.2	-31.8	0	0	0	110.1	E351	P349-E351 PolarHBondContact O-N 3.31Å
350	L	68.6	Low	68.7	Low	58 Å²	58	104.8 Å²	104.8	30%	0.304	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-59.5	118.5	170.5	-82.3	156.9	0	0	0	110.3	W352 F428	L350-W352 VanDerWaalsContact C-N 3.3Å; L350-W352 HydrophobicContact CB-CG 4.42Å; L350-W352 HydrophobicContact CD2-CZ2 3.86Å; L350-W352 VanDerWaalsContact CD2-NE1 3.26Å; L350-W352 PolarHBondContact O-N 2.93Å; L350-F428 HydrophobicContact CD1-CB 3.28Å; L350-F428 HydrophobicContact CD1-CD1 3.54Å; L350-F428 HydrophobicContact CD1-CD2 3.85Å; L350-F428 HydrophobicContact CD1-CE1 4.24Å; L350-F428 HydrophobicContact CD1-CG 3.28Å; L350-F428 HydrophobicContact CD2-CB 4.18Å; L350-F428 HydrophobicContact CD2-CD2 4.03Å; L350-F428 HydrophobicContact CD2-CG 4.23Å; L350-F428 HydrophobicContact CG-CB 3.9Å; L350-F428 HydrophobicContact CG-CD1 4.05Å; L350-F428 HydrophobicContact CG-CD2 3.54Å; L350-F428 HydrophobicContact CG-CE1 4.41Å; L350-F428 HydrophobicContact CG-CE2 3.97Å; L350-F428 HydrophobicContact CG-CG 3.57Å; L350-F428 HydrophobicContact CG-CZ 4.38Å
351	E	63.5	Low	67	Low	167 Å²	167	107.1 Å²	107.1	78%	0.78	50%	0.497	S	S	*	.			trans	-79.4	70.4	176.9	-68.4	-180	176.3	0	0	111.1	P349	P349-E351 PolarHBondContact O-N 3.31Å
352	W	56.6	Low	65.3	Low	93 Å²	93	113.9 Å²	113.9	35%	0.352	53%	0.528	S	S	.	.			trans	-89.4	-11.1	177.1	-69	113.1	0	0	0	115	L350 Q421 S424	L350-W352 VanDerWaalsContact C-N 3.3Å; L350-W352 HydrophobicContact CB-CG 4.42Å; L350-W352 HydrophobicContact CD2-CZ2 3.86Å; L350-W352 VanDerWaalsContact CD2-NE1 3.26Å; L350-W352 PolarHBondContact O-N 2.93Å; W352-Q421 HydrophobicContact CD2-CG 4.27Å; W352-Q421 HydrophobicContact CE3-CG 4.34Å; W352-S424 WeakPolarHBondContact CH2-OG 3.37Å; W352-S424 WeakPolarHBondContact CZ2-OG 3.37Å; W352-S424 PolarHBondContact NE1-OG 3.06Å
353	S	48.6	Very low	63.8	Low	75 Å²	75	120 Å²	120	52%	0.524	56%	0.56	S	S	.	*	S	Bend	trans	-91.9	-25.7	-169	70.3	0	0	0	0	115.5
354	N	43.7	Very low	61.9	Low	107 Å²	107	118.5 Å²	118.5	57%	0.572	56%	0.559	S	S	*	*	H	α-helix	trans	-86.2	-37.5	-168.4	-71.1	-2	0	0	0	113.6	E358	N354-E358 WeakPolarHBondContact O-CB 3.41Å; N354-E358 WeakPolarHBondContact O-CG 3.07Å; N354-E358 PolarHBondContact O-N 2.9Å
355	H	49.6	Very low	59.8	Low	142 Å²	142	118.9 Å²	118.9	66%	0.657	57%	0.568	S	S	*	*	H	α-helix	trans	-72.6	-35.5	-176.4	-89.2	-66.5	0	0	0	114.4	E359	H355-E359 WeakPolarHBondContact O-CB 3.02Å; H355-E359 PolarHBondContact O-N 3.35Å
356	R	49.6	Very low	57.5	Low	62 Å²	62	124.9 Å²	124.9	23%	0.234	60%	0.6	C	S	.	*	H	α-helix	trans	-78.1	-30.9	-178.6	-98.3	-174.3	-75.4	-133.5	-11.1	114	K360 S417	R356-K360 WeakPolarHBondContact O-CB 3.45Å; R356-K360 VanDerWaalsContact O-CG 3.25Å; R356-K360 WeakPolarHBondContact O-CG 3.48Å; R356-K360 PolarHBondContact O-N 2.86Å; R356-S417 PolarHBondContact NH1-O 2.97Å
357	D	50.5	Low	55.2	Low	100 Å²	100	123.1 Å²	123.1	54%	0.535	60%	0.599	S	S	.	*	H	α-helix	trans	-75.6	-29.4	175	-74.5	-23.1	0	0	0	111.5	R361	D357-R361 WeakPolarHBondContact O-CB 3.1Å; D357-R361 WeakPolarHBondContact O-CG 3.37Å; D357-R361 PolarHBondContact O-N 2.73Å
358	E	50.3	Low	53	Low	110 Å²	110	127.2 Å²	127.2	51%	0.514	63%	0.626	S	S	.	*	H	α-helix	trans	-74.6	-45	171.1	-75.2	-178.4	161.3	0	0	112.4	N354 R361 Q362	N354-E358 WeakPolarHBondContact O-CB 3.41Å; N354-E358 WeakPolarHBondContact O-CG 3.07Å; N354-E358 PolarHBondContact O-N 2.9Å; E358-R361 PolarHBondContact O-N 2.88Å; E358-Q362 VanDerWaalsContact O-CG 3.3Å; E358-Q362 WeakPolarHBondContact O-CG 3.37Å; E358-Q362 PolarHBondContact O-N 2.95Å
359	E	52.9	Low	50.8	Low	110 Å²	110	126.4 Å²	126.4	51%	0.514	63%	0.625	S	S	.	*	H	α-helix	trans	-66.6	-40.8	176.2	-84.2	-173.7	142.2	0	0	112.6	H355 R361 Q362 L363	H355-E359 WeakPolarHBondContact O-CB 3.02Å; H355-E359 PolarHBondContact O-N 3.35Å; E359-R361 VanDerWaalsContact C-N 3.26Å; E359-R361 PolarHBondContact O-N 2.89Å; E359-Q362 PolarHBondContact O-N 3.21Å; E359-Q362 VanDerWaalsContact O-N 3.15Å; E359-L363 HydrophobicContact CB-CD1 4.49Å; E359-L363 WeakPolarHBondContact O-CB 3.32Å; E359-L363 WeakPolarHBondContact O-CG 3.11Å; E359-L363 PolarHBondContact O-N 2.87Å
360	K	53.1	Low	49.1	Very low	140 Å²	140	128 Å²	128	61%	0.609	63%	0.633	S	S	*	*	H	α-helix	trans	-63.6	-32.9	173.8	-77.6	179.2	178.1	178.4	0	111.9	R356 L364	R356-K360 WeakPolarHBondContact O-CB 3.45Å; R356-K360 VanDerWaalsContact O-CG 3.25Å; R356-K360 WeakPolarHBondContact O-CG 3.48Å; R356-K360 PolarHBondContact O-N 2.86Å; K360-L364 WeakPolarHBondContact O-CD1 3.39Å
361	R	52.4	Low	47.5	Very low	210 Å²	210	132.9 Å²	132.9	79%	0.792	66%	0.655	S	S	*	*	H	α-helix	trans	-71.3	-32.6	172.7	-82.4	178.4	-168.7	-163.6	4.9	112.9	D357 E358 E359	D357-R361 WeakPolarHBondContact O-CB 3.1Å; D357-R361 WeakPolarHBondContact O-CG 3.37Å; D357-R361 PolarHBondContact O-N 2.73Å; E358-R361 PolarHBondContact O-N 2.88Å; E359-R361 VanDerWaalsContact C-N 3.26Å; E359-R361 PolarHBondContact O-N 2.89Å
362	Q	54.3	Low	46.1	Very low	158 Å²	158	134.2 Å²	134.2	74%	0.738	66%	0.661	S	S	*	*	H	α-helix	trans	-81.7	-26.9	179.1	-70.5	178.7	10.8	0	0	113.3	E358 E359	E358-Q362 VanDerWaalsContact O-CG 3.3Å; E358-Q362 WeakPolarHBondContact O-CG 3.37Å; E358-Q362 PolarHBondContact O-N 2.95Å; E359-Q362 PolarHBondContact O-N 3.21Å; E359-Q362 VanDerWaalsContact O-N 3.15Å
363	L	57.3	Low	45.1	Very low	133 Å²	133	135.8 Å²	135.8	70%	0.696	68%	0.681	S	S	*	*	S	Bend	trans	-91.2	2.9	-179	-72.9	163.2	0	0	0	114.8	E359 P365	E359-L363 HydrophobicContact CB-CD1 4.49Å; E359-L363 WeakPolarHBondContact O-CB 3.32Å; E359-L363 WeakPolarHBondContact O-CG 3.11Å; E359-L363 PolarHBondContact O-N 2.87Å; L363-P365 VanDerWaalsContact C-CD 3.46Å; L363-P365 WeakPolarHBondContact O-CD 3.41Å
364	L	49.1	Very low	44.5	Very low	135 Å²	135	137.6 Å²	137.6	71%	0.707	69%	0.691	S	S	*	*			trans	-93.9	87.8	169.8	-83.3	158.2	0	0	0	109.4	K360 N366	K360-L364 WeakPolarHBondContact O-CD1 3.39Å; L364-N366 PolarHBondContact O-N 3.27Å
365	P	45.3	Very low	44.3	Very low	117 Å²	117	142.2 Å²	142.2	76%	0.76	71%	0.709	S	S	*	*			trans	-64.3	132.3	166.8	28	-31.6	0	0	0	108.1	L363 K367	L363-P365 VanDerWaalsContact C-CD 3.46Å; L363-P365 WeakPolarHBondContact O-CD 3.41Å; P365-K367 PolarHBondContact O-N 2.96Å
366	N	40.7	Very low	43.8	Very low	151 Å²	151	147 Å²	147	81%	0.807	72%	0.721	S	S	*	*			trans	-24.9	128.7	177.1	-77.5	-33	0	0	0	113.4	L364 V368	L364-N366 PolarHBondContact O-N 3.27Å; N366-V368 PolarHBondContact O-N 2.9Å
367	K	38	Very low	43.4	Very low	198 Å²	198	148.7 Å²	148.7	86%	0.861	75%	0.748	S	S	*	*			trans	-21.4	103.5	162.3	-89.5	174.4	168.5	176.2	0	110.4	P365 Q369	P365-K367 PolarHBondContact O-N 2.96Å; K367-Q369 PolarHBondContact O-N 2.98Å
368	V	39	Very low	43.5	Very low	131 Å²	131	151.9 Å²	151.9	79%	0.794	77%	0.765	S	S	*	*			trans	-64.6	98.9	160.8	175.6	0	0	0	0	104.4	N366 T370	N366-V368 PolarHBondContact O-N 2.9Å; V368-T370 PolarHBondContact O-N 3.11Å
369	Q	33.4	Very low	43.6	Very low	161 Å²	161	152 Å²	152	75%	0.752	78%	0.775	S	S	*	*			trans	-58.4	105.6	165	-77.4	172.8	-32.3	0	0	105.8	K367 E371	K367-Q369 PolarHBondContact O-N 2.98Å; Q369-E371 PolarHBondContact O-N 2.83Å
370	T	34.7	Very low	43.3	Very low	130 Å²	130	154 Å²	154	80%	0.798	79%	0.794	S	S	*	*			trans	-66.9	87.3	166.1	-39.2	0	0	0	0	106.5	V368 Q372	V368-T370 PolarHBondContact O-N 3.11Å; T370-Q372 PolarHBondContact O-N 2.91Å
371	E	34.8	Very low	43.2	Very low	161 Å²	161	155.1 Å²	155.1	75%	0.752	80%	0.8	S	S	*	*			trans	-60.2	117.6	168.6	-79.1	-174.5	154.8	0	0	108.3	Q369 T373	Q369-E371 PolarHBondContact O-N 2.83Å; E371-T373 PolarHBondContact O-N 2.82Å
372	Q	33.9	Very low	43.2	Very low	195 Å²	195	148.9 Å²	148.9	91%	0.911	79%	0.788	S	S	*	*			trans	-65.8	97.4	170	-70.2	175	-23.5	0	0	108.4	T370	T370-Q372 PolarHBondContact O-N 2.91Å
373	T	36.1	Very low	43.3	Very low	126 Å²	126	147.2 Å²	147.2	77%	0.773	79%	0.794	S	S	*	*			trans	-79.1	126.1	169.9	-33.1	0	0	0	0	109.2	E371	E371-T373 PolarHBondContact O-N 2.82Å
374	P	35.3	Very low	43.2	Very low	112 Å²	112	148 Å²	148	73%	0.727	79%	0.794	S	S	*	*			trans	-70.4	141	-178.5	-8.7	23.4	0	0	0	111	R376	P374-R376 PolarHBondContact O-N 2.81Å; P374-R376 VanDerWaalsContact O-N 3.11Å
375	Q	39.9	Very low	43.5	Very low	205 Å²	205	142.6 Å²	142.6	96%	0.958	77%	0.766	S	S	*	*			trans	-52.8	114.1	172.5	-70.5	172	-20.8	0	0	110.4
376	R	39.4	Very low	44.1	Very low	243 Å²	243	143.6 Å²	143.6	92%	0.917	76%	0.764	S	S	*	*			trans	-113.8	129	168.4	-143.5	172.9	-171.1	171.4	1.9	108.4	P374	P374-R376 PolarHBondContact O-N 2.81Å; P374-R376 VanDerWaalsContact O-N 3.11Å
377	A	41.1	Very low	45.1	Very low	97 Å²	97	139.4 Å²	139.4	80%	0.802	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-53.5	139.4	-170.5	0	0	0	0	0	113.7
378	L	51.6	Low	46.3	Very low	167 Å²	167	133.6 Å²	133.6	87%	0.874	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-61.9	137.2	174.8	-80.9	93.6	0	0	0	111.4
379	P	54	Low	47.6	Very low	112 Å²	112	130.1 Å²	130.1	73%	0.727	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-81.5	147.8	153.3	20.7	-6.2	0	0	0	110.3	F381	P379-F381 PolarHBondContact O-N 2.97Å
380	T	45	Very low	49.4	Very low	151 Å²	151	128.8 Å²	128.8	93%	0.926	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-59	124.1	176.8	37.8	0	0	0	0	111.8
381	F	51.3	Low	51.4	Low	164 Å²	164	129.8 Å²	129.8	72%	0.719	70%	0.702	S	S	*	*			trans	-109.8	144.6	-174.7	-147.9	-146.3	0	0	0	110.1	P379 D385	P379-F381 PolarHBondContact O-N 2.97Å; F381-D385 HydrophobicContact CD1-CB 3.05Å; F381-D385 WeakPolarHBondContact CD1-OD1 3.32Å; F381-D385 WeakPolarHBondContact CD2-OD1 3.35Å; F381-D385 HydrophobicContact CE1-CB 3.12Å; F381-D385 WeakPolarHBondContact CE1-OD1 3.34Å; F381-D385 WeakPolarHBondContact CE1-OD2 3.35Å; F381-D385 VanDerWaalsContact CE2-CG 3.41Å; F381-D385 VanDerWaalsContact CE2-OD1 3.31Å; F381-D385 WeakPolarHBondContact CE2-OD1 3.3Å; F381-D385 VanDerWaalsContact CE2-OD2 3.28Å; F381-D385 WeakPolarHBondContact CE2-OD2 3.4Å; F381-D385 HydrophobicContact CG-CB 3.8Å; F381-D385 WeakPolarHBondContact CG-OD1 3.37Å; F381-D385 HydrophobicContact CZ-CB 3.91Å; F381-D385 WeakPolarHBondContact CZ-OD1 3.2Å; F381-D385 WeakPolarHBondContact CZ-OD2 3.29Å
382	S	54	Low	53.5	Low	79 Å²	79	127 Å²	127	55%	0.552	69%	0.692	S	S	*	*			trans	-93.5	172.6	-163	69.1	0	0	0	0	112.6	H384 D385	S382-H384 PolarHBondContact O-N 3.48Å; S382-D385 WeakPolarHBondContact CA-OD1 3.38Å; S382-D385 PolarHBondContact N-OD1 2.84Å; S382-D385 VanDerWaalsContact O-CB 3.22Å; S382-D385 WeakPolarHBondContact O-CB 3.43Å; S382-D385 VanDerWaalsContact O-CG 3.27Å; S382-D385 PolarHBondContact O-N 3.06Å; S382-D385 VanDerWaalsContact O-N 3.13Å; S382-D385 PolarHBondContact OG-OD1 3.09Å
383	S	55.6	Low	55.7	Low	124 Å²	124	126.2 Å²	126.2	87%	0.867	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-12.6	-174.4	47.1	0	0	0	0	115.9	D385	S383-D385 PolarHBondContact O-N 2.85Å
384	H	55.3	Low	57.9	Low	148 Å²	148	124.5 Å²	124.5	69%	0.685	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-9.5	176.7	-146.5	-63.5	0	0	0	113.6	S382	S382-H384 PolarHBondContact O-N 3.48Å
385	D	55.8	Low	60.2	Low	22 Å²	22	123.9 Å²	123.9	12%	0.118	65%	0.654	C	S	.	*	H	α-helix	trans	-91.6	-11.7	-168.2	-61.6	131.5	0	0	0	113.9	F381 S382 S383 C389	F381-D385 HydrophobicContact CD1-CB 3.05Å; F381-D385 WeakPolarHBondContact CD1-OD1 3.32Å; F381-D385 WeakPolarHBondContact CD2-OD1 3.35Å; F381-D385 HydrophobicContact CE1-CB 3.12Å; F381-D385 WeakPolarHBondContact CE1-OD1 3.34Å; F381-D385 WeakPolarHBondContact CE1-OD2 3.35Å; F381-D385 VanDerWaalsContact CE2-CG 3.41Å; F381-D385 VanDerWaalsContact CE2-OD1 3.31Å; F381-D385 WeakPolarHBondContact CE2-OD1 3.3Å; F381-D385 VanDerWaalsContact CE2-OD2 3.28Å; F381-D385 WeakPolarHBondContact CE2-OD2 3.4Å; F381-D385 HydrophobicContact CG-CB 3.8Å; F381-D385 WeakPolarHBondContact CG-OD1 3.37Å; F381-D385 HydrophobicContact CZ-CB 3.91Å; F381-D385 WeakPolarHBondContact CZ-OD1 3.2Å; F381-D385 WeakPolarHBondContact CZ-OD2 3.29Å; S382-D385 WeakPolarHBondContact CA-OD1 3.38Å; S382-D385 PolarHBondContact N-OD1 2.84Å; S382-D385 VanDerWaalsContact O-CB 3.22Å; S382-D385 WeakPolarHBondContact O-CB 3.43Å; S382-D385 VanDerWaalsContact O-CG 3.27Å; S382-D385 PolarHBondContact O-N 3.06Å; S382-D385 VanDerWaalsContact O-N 3.13Å; S382-D385 PolarHBondContact OG-OD1 3.09Å; S383-D385 PolarHBondContact O-N 2.85Å; D385-C389 WeakPolarHBondContact O-CB 3.36Å; D385-C389 PolarHBondContact O-N 2.84Å; D385-C389 PolarHBondContact O-SG 3.01Å
386	L	57.1	Low	62.5	Low	138 Å²	138	123.9 Å²	123.9	72%	0.723	65%	0.645	S	S	*	*	H	α-helix	trans	-71.1	-36.7	177.7	-143.2	79.5	0	0	0	112.1	C389 Q390	L386-C389 PolarHBondContact O-N 3.43Å; L386-Q390 PolarHBondContact O-N 2.84Å; L386-Q390 VanDerWaalsContact O-N 3.14Å
387	A	60.9	Low	64.8	Low	64 Å²	64	118.3 Å²	118.3	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-69.1	-43.3	177.6	0	0	0	0	0	111.5	C389 Q390 E391	A387-C389 VanDerWaalsContact C-N 3.3Å; A387-C389 PolarHBondContact O-N 2.89Å; A387-Q390 PolarHBondContact O-N 2.93Å; A387-Q390 VanDerWaalsContact O-N 3.11Å; A387-E391 PolarHBondContact O-N 3.41Å; A387-E391 VanDerWaalsContact O-N 3.11Å
388	V	64.5	Low	67	Low	76 Å²	76	118 Å²	118	46%	0.461	61%	0.611	S	S	.	*	H	α-helix	trans	-63.4	-37.8	174.6	-179.1	0	0	0	0	110.8	Q390 L392	V388-Q390 VanDerWaalsContact C-N 3.29Å; V388-Q390 PolarHBondContact O-N 2.87Å; V388-L392 HydrophobicContact CG1-CD1 3.87Å; V388-L392 HydrophobicContact CG1-CG 4.43Å; V388-L392 WeakPolarHBondContact O-CB 3.48Å; V388-L392 WeakPolarHBondContact O-CD1 3.24Å; V388-L392 VanDerWaalsContact O-CG 3.27Å; V388-L392 WeakPolarHBondContact O-CG 3.38Å; V388-L392 PolarHBondContact O-N 2.86Å
389	C	64.9	Low	68.8	Low	58 Å²	58	114 Å²	114	39%	0.392	59%	0.593	S	S	.	*	H	α-helix	trans	-63.9	-30.8	173.9	-77.4	0	0	0	0	113.5	D385 L386 A387 R393	D385-C389 WeakPolarHBondContact O-CB 3.36Å; D385-C389 PolarHBondContact O-N 2.84Å; D385-C389 PolarHBondContact O-SG 3.01Å; L386-C389 PolarHBondContact O-N 3.43Å; A387-C389 VanDerWaalsContact C-N 3.3Å; A387-C389 PolarHBondContact O-N 2.89Å; C389-R393 VanDerWaalsContact O-CG 3.3Å; C389-R393 WeakPolarHBondContact O-CG 3.27Å; C389-R393 PolarHBondContact O-N 2.85Å; C389-R393 VanDerWaalsContact O-N 3.15Å
390	Q	72.9	Confident	70.4	Confident	133 Å²	133	111 Å²	111	62%	0.621	58%	0.579	S	S	*	*	H	α-helix	trans	-77.8	-44.6	179.5	-167.8	163.3	-20.6	0	0	111.8	L386 A387 V388 L392 R393 E394	L386-Q390 PolarHBondContact O-N 2.84Å; L386-Q390 VanDerWaalsContact O-N 3.14Å; A387-Q390 PolarHBondContact O-N 2.93Å; A387-Q390 VanDerWaalsContact O-N 3.11Å; V388-Q390 VanDerWaalsContact C-N 3.29Å; V388-Q390 PolarHBondContact O-N 2.87Å; Q390-L392 VanDerWaalsContact C-N 3.34Å; Q390-L392 PolarHBondContact O-N 2.85Å; Q390-R393 PolarHBondContact O-N 2.82Å; Q390-R393 VanDerWaalsContact O-N 3.16Å; Q390-E394 PolarHBondContact O-N 2.84Å; Q390-E394 VanDerWaalsContact O-N 3.08Å
391	E	76.8	Confident	72.5	Confident	151 Å²	151	110.8 Å²	110.8	71%	0.706	57%	0.565	S	S	*	*	H	α-helix	trans	-55.9	-46.4	170.6	-75.7	-86.2	142.8	0	0	111.5	A387 R393 E394 L395	A387-E391 PolarHBondContact O-N 3.41Å; A387-E391 VanDerWaalsContact O-N 3.11Å; E391-R393 VanDerWaalsContact C-N 3.33Å; E391-R393 PolarHBondContact O-N 3.37Å; E391-E394 PolarHBondContact O-N 2.7Å; E391-L395 WeakPolarHBondContact O-CB 3.13Å; E391-L395 PolarHBondContact O-N 2.86Å
392	L	78	Confident	74.4	Confident	103 Å²	103	107.9 Å²	107.9	54%	0.539	56%	0.556	S	S	.	*	H	α-helix	trans	-64	-33.8	176.9	-77.2	167.4	0	0	0	113.1	V388 Q390 R396	V388-L392 HydrophobicContact CG1-CD1 3.87Å; V388-L392 HydrophobicContact CG1-CG 4.43Å; V388-L392 WeakPolarHBondContact O-CB 3.48Å; V388-L392 WeakPolarHBondContact O-CD1 3.24Å; V388-L392 VanDerWaalsContact O-CG 3.27Å; V388-L392 WeakPolarHBondContact O-CG 3.38Å; V388-L392 PolarHBondContact O-N 2.86Å; Q390-L392 VanDerWaalsContact C-N 3.34Å; Q390-L392 PolarHBondContact O-N 2.85Å; L392-R396 VanDerWaalsContact O-CB 3.25Å; L392-R396 WeakPolarHBondContact O-CB 3.4Å; L392-R396 PolarHBondContact O-N 3.05Å
393	R	79.6	Confident	76.2	Confident	177 Å²	177	108 Å²	108	67%	0.668	55%	0.55	S	S	*	.	H	α-helix	trans	-67.8	-43.4	175.1	-81.6	176.4	-170.7	173	4.6	111.5	C389 Q390 E391 R396 K397	C389-R393 VanDerWaalsContact O-CG 3.3Å; C389-R393 WeakPolarHBondContact O-CG 3.27Å; C389-R393 PolarHBondContact O-N 2.85Å; C389-R393 VanDerWaalsContact O-N 3.15Å; Q390-R393 PolarHBondContact O-N 2.82Å; Q390-R393 VanDerWaalsContact O-N 3.16Å; E391-R393 VanDerWaalsContact C-N 3.33Å; E391-R393 PolarHBondContact O-N 3.37Å; R393-R396 PolarHBondContact O-N 3.23Å; R393-K397 WeakPolarHBondContact O-CG 3.21Å; R393-K397 PolarHBondContact O-N 2.7Å
394	E	82.8	Confident	77.9	Confident	90 Å²	90	106.1 Å²	106.1	42%	0.421	53%	0.534	S	S	.	.	H	α-helix	trans	-66.7	-42.6	176.2	-68.5	-52.5	129	0	0	111.5	Q390 E391 R396 K397 I398	Q390-E394 PolarHBondContact O-N 2.84Å; Q390-E394 VanDerWaalsContact O-N 3.08Å; E391-E394 PolarHBondContact O-N 2.7Å; E394-R396 VanDerWaalsContact C-N 3.33Å; E394-R396 PolarHBondContact O-N 3.32Å; E394-K397 WeakPolarHBondContact O-CB 3.18Å; E394-K397 PolarHBondContact O-N 2.81Å; E394-K397 VanDerWaalsContact O-N 3.15Å; E394-K397 IonicContact OE1-NZ 2.71Å; E394-K397 PolarHBondContact OE1-NZ 3.25Å; E394-K397 IonicContact OE2-NZ 3.9Å; E394-I398 WeakPolarHBondContact O-CG1 3.42Å; E394-I398 PolarHBondContact O-N 3.28Å
395	L	84.7	Confident	79.5	Confident	100 Å²	100	103 Å²	103	52%	0.524	52%	0.522	S	S	.	.	H	α-helix	trans	-59.9	-42.7	173.8	-168	71.4	0	0	0	111.7	E391 K397 I398 V399	E391-L395 WeakPolarHBondContact O-CB 3.13Å; E391-L395 PolarHBondContact O-N 2.86Å; L395-K397 VanDerWaalsContact C-N 3.34Å; L395-K397 PolarHBondContact O-N 3.19Å; L395-I398 PolarHBondContact O-N 2.95Å; L395-V399 WeakPolarHBondContact O-CB 3.46Å; L395-V399 VanDerWaalsContact O-CG2 3.29Å; L395-V399 WeakPolarHBondContact O-CG2 3.43Å; L395-V399 PolarHBondContact O-N 3.38Å
396	R	86.6	Confident	81.1	Confident	204 Å²	204	105.8 Å²	105.8	77%	0.77	54%	0.54	S	S	*	.	H	α-helix	trans	-62.8	-38.3	176.1	-172.8	176	178.7	168.5	0.2	112.2	L392 R393 E394 A400	L392-R396 VanDerWaalsContact O-CB 3.25Å; L392-R396 WeakPolarHBondContact O-CB 3.4Å; L392-R396 PolarHBondContact O-N 3.05Å; R393-R396 PolarHBondContact O-N 3.23Å; E394-R396 VanDerWaalsContact C-N 3.33Å; E394-R396 PolarHBondContact O-N 3.32Å; R396-A400 VanDerWaalsContact O-CB 3.28Å; R396-A400 WeakPolarHBondContact O-CB 3.33Å; R396-A400 PolarHBondContact O-N 3Å
397	K	87.4	Confident	82.7	Confident	127 Å²	127	106 Å²	106	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-65.2	-43.5	173.7	-71.9	172.9	-174.3	170.5	0	111.5	R393 E394 L395 A400 K401	R393-K397 WeakPolarHBondContact O-CG 3.21Å; R393-K397 PolarHBondContact O-N 2.7Å; E394-K397 WeakPolarHBondContact O-CB 3.18Å; E394-K397 PolarHBondContact O-N 2.81Å; E394-K397 VanDerWaalsContact O-N 3.15Å; E394-K397 IonicContact OE1-NZ 2.71Å; E394-K397 PolarHBondContact OE1-NZ 3.25Å; E394-K397 IonicContact OE2-NZ 3.9Å; L395-K397 VanDerWaalsContact C-N 3.34Å; L395-K397 PolarHBondContact O-N 3.19Å; K397-A400 PolarHBondContact O-N 3.18Å; K397-K401 WeakPolarHBondContact O-CB 3.44Å; K397-K401 PolarHBondContact O-N 3.12Å
398	I	87.6	Confident	84.2	Confident	91 Å²	91	109.5 Å²	109.5	47%	0.467	54%	0.535	S	S	.	.	H	α-helix	trans	-62.3	-48.4	177.6	-67.6	165.1	0	0	0	110.6	E394 L395 A400 K401 L402	E394-I398 WeakPolarHBondContact O-CG1 3.42Å; E394-I398 PolarHBondContact O-N 3.28Å; L395-I398 PolarHBondContact O-N 2.95Å; I398-A400 PolarHBondContact O-N 3.44Å; I398-K401 PolarHBondContact O-N 3.43Å; I398-L402 HydrophobicContact CG2-CD1 3.83Å; I398-L402 PolarHBondContact O-N 2.65Å
399	V	89.6	Confident	85.4	Confident	81 Å²	81	110.5 Å²	110.5	49%	0.491	54%	0.536	S	S	.	.	H	α-helix	trans	-61.5	-43	177.2	172.2	0	0	0	0	111.2	L395 K401 L402 L403	L395-V399 WeakPolarHBondContact O-CB 3.46Å; L395-V399 VanDerWaalsContact O-CG2 3.29Å; L395-V399 WeakPolarHBondContact O-CG2 3.43Å; L395-V399 PolarHBondContact O-N 3.38Å; V399-K401 VanDerWaalsContact C-N 3.34Å; V399-K401 PolarHBondContact O-N 2.98Å; V399-L402 PolarHBondContact O-N 2.85Å; V399-L403 WeakPolarHBondContact O-CB 3.2Å; V399-L403 PolarHBondContact O-N 2.95Å
400	A	88.7	Confident	86.6	Confident	51 Å²	51	116.4 Å²	116.4	42%	0.421	55%	0.55	S	S	.	*	H	α-helix	trans	-62	-40.6	175.7	0	0	0	0	0	112.2	R396 K397 I398 L403 T404	R396-A400 VanDerWaalsContact O-CB 3.28Å; R396-A400 WeakPolarHBondContact O-CB 3.33Å; R396-A400 PolarHBondContact O-N 3Å; K397-A400 PolarHBondContact O-N 3.18Å; I398-A400 PolarHBondContact O-N 3.44Å; A400-L403 PolarHBondContact O-N 3.01Å; A400-T404 PolarHBondContact O-N 2.81Å; A400-T404 PolarHBondContact O-OG1 2.97Å; A400-T404 VanDerWaalsContact O-OG1 3.06Å
401	K	89.5	Confident	87.4	Confident	146 Å²	146	115.3 Å²	115.3	64%	0.635	55%	0.549	S	S	*	.	H	α-helix	trans	-66.9	-42.1	176.7	-169	174.1	-177.9	178.5	0	112.2	K397 I398 V399 L403 T404 N405	K397-K401 WeakPolarHBondContact O-CB 3.44Å; K397-K401 PolarHBondContact O-N 3.12Å; I398-K401 PolarHBondContact O-N 3.43Å; V399-K401 VanDerWaalsContact C-N 3.34Å; V399-K401 PolarHBondContact O-N 2.98Å; K401-L403 VanDerWaalsContact C-N 3.34Å; K401-T404 PolarHBondContact O-N 3.45Å; K401-N405 PolarHBondContact O-N 2.95Å
402	L	90.5	Very high	88	Confident	102 Å²	102	110.9 Å²	110.9	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-61.5	-41.6	173.5	-79.5	160.1	0	0	0	111.8	I398 V399 N405 T406	I398-L402 HydrophobicContact CG2-CD1 3.83Å; I398-L402 PolarHBondContact O-N 2.65Å; V399-L402 PolarHBondContact O-N 2.85Å; L402-N405 PolarHBondContact O-N 2.8Å; L402-T406 WeakPolarHBondContact O-CB 3.42Å; L402-T406 WeakPolarHBondContact O-CG2 3.41Å; L402-T406 PolarHBondContact O-N 3.49Å; L402-T406 PolarHBondContact O-OG1 2.82Å
403	L	91.3	Very high	88.6	Confident	81 Å²	81	111.1 Å²	111.1	42%	0.424	53%	0.533	S	S	.	.	H	α-helix	trans	-64.7	-39.5	176.5	-166	111	0	0	0	111.8	V399 A400 K401 T406 R407	V399-L403 WeakPolarHBondContact O-CB 3.2Å; V399-L403 PolarHBondContact O-N 2.95Å; A400-L403 PolarHBondContact O-N 3.01Å; K401-L403 VanDerWaalsContact C-N 3.34Å; L403-T406 WeakPolarHBondContact CA-OG1 3.49Å; L403-T406 PolarHBondContact O-OG1 2.66Å; L403-R407 WeakPolarHBondContact O-CB 3.44Å; L403-R407 VanDerWaalsContact O-CG 3.26Å; L403-R407 WeakPolarHBondContact O-CG 3.29Å; L403-R407 PolarHBondContact O-N 3.26Å
404	T	90.9	Very high	89	Confident	86 Å²	86	104 Å²	104	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-66.6	-43.5	174.2	-58.1	0	0	0	0	111.8	A400 K401 R407 F408	A400-T404 PolarHBondContact O-N 2.81Å; A400-T404 PolarHBondContact O-OG1 2.97Å; A400-T404 VanDerWaalsContact O-OG1 3.06Å; K401-T404 PolarHBondContact O-N 3.45Å; T404-R407 PolarHBondContact O-N 2.83Å; T404-F408 PolarHBondContact O-N 3.27Å
405	N	89.6	Confident	89.2	Confident	81 Å²	81	105.5 Å²	105.5	43%	0.433	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-41.8	177.6	-73.7	-5.5	0	0	0	112.2	K401 L402 F408 I409	K401-N405 PolarHBondContact O-N 2.95Å; L402-N405 PolarHBondContact O-N 2.8Å; N405-F408 PolarHBondContact O-N 2.94Å; N405-I409 WeakPolarHBondContact O-CB 3.36Å; N405-I409 VanDerWaalsContact O-CG1 3.24Å; N405-I409 WeakPolarHBondContact O-CG1 3.44Å; N405-I409 PolarHBondContact O-N 2.96Å
406	T	90.1	Very high	89.4	Confident	82 Å²	82	104.6 Å²	104.6	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-67	-35.8	177	48.1	0	0	0	0	112.4	L402 L403 R410	L402-T406 WeakPolarHBondContact O-CB 3.42Å; L402-T406 WeakPolarHBondContact O-CG2 3.41Å; L402-T406 PolarHBondContact O-N 3.49Å; L402-T406 PolarHBondContact O-OG1 2.82Å; L403-T406 WeakPolarHBondContact CA-OG1 3.49Å; L403-T406 PolarHBondContact O-OG1 2.66Å; T406-R410 WeakPolarHBondContact O-CB 3.18Å; T406-R410 PolarHBondContact O-N 3.2Å
407	R	90.8	Very high	89.5	Confident	142 Å²	142	97 Å²	97	54%	0.536	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-47.7	170.2	-74.5	173.3	-179.4	-178.9	-2.4	111.6	L403 T404 I409 R410 D411	L403-R407 WeakPolarHBondContact O-CB 3.44Å; L403-R407 VanDerWaalsContact O-CG 3.26Å; L403-R407 WeakPolarHBondContact O-CG 3.29Å; L403-R407 PolarHBondContact O-N 3.26Å; T404-R407 PolarHBondContact O-N 2.83Å; R407-I409 PolarHBondContact O-N 2.82Å; R407-R410 WeakPolarHBondContact O-CB 3.3Å; R407-R410 PolarHBondContact O-N 3.11Å; R407-D411 VanDerWaalsContact O-CG 3.28Å; R407-D411 PolarHBondContact O-N 2.86Å
408	F	91	Very high	89.5	Confident	138 Å²	138	96.8 Å²	96.8	61%	0.605	50%	0.495	S	S	*	.	H	α-helix	trans	-59.1	-45.5	176.8	179	-98.6	0	0	0	112.2	T404 N405 R410 D411 V412	T404-F408 PolarHBondContact O-N 3.27Å; N405-F408 PolarHBondContact O-N 2.94Å; F408-R410 VanDerWaalsContact C-N 3.34Å; F408-R410 PolarHBondContact O-N 3.01Å; F408-D411 PolarHBondContact O-N 2.87Å; F408-V412 HydrophobicContact CD1-CG2 4.19Å; F408-V412 HydrophobicContact CE1-CG2 3.76Å; F408-V412 HydrophobicContact CE2-CG2 4.14Å; F408-V412 HydrophobicContact CZ-CG2 3.73Å; F408-V412 WeakPolarHBondContact O-CG2 3.31Å; F408-V412 PolarHBondContact O-N 2.94Å
409	I	90.2	Very high	89.6	Confident	96 Å²	96	93.8 Å²	93.8	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-61	-43	175.9	-68.6	164.1	0	0	0	110.8	N405 R407 D411 V412 L413	N405-I409 WeakPolarHBondContact O-CB 3.36Å; N405-I409 VanDerWaalsContact O-CG1 3.24Å; N405-I409 WeakPolarHBondContact O-CG1 3.44Å; N405-I409 PolarHBondContact O-N 2.96Å; R407-I409 PolarHBondContact O-N 2.82Å; I409-D411 VanDerWaalsContact C-N 3.33Å; I409-D411 PolarHBondContact O-N 3.17Å; I409-V412 PolarHBondContact O-N 3.44Å; I409-L413 HydrophobicContact CG2-CD1 3.77Å; I409-L413 HydrophobicContact CG2-CG 4.23Å; I409-L413 WeakPolarHBondContact O-CB 3.26Å; I409-L413 VanDerWaalsContact O-CG 3.25Å; I409-L413 WeakPolarHBondContact O-CG 3.47Å; I409-L413 PolarHBondContact O-N 2.89Å
410	R	90.5	Very high	89.5	Confident	182 Å²	182	95.9 Å²	95.9	69%	0.687	48%	0.484	S	S	*	.	H	α-helix	trans	-59.8	-43.6	175	176	-174.2	-72.3	161.5	-4.1	111.7	T406 R407 F408 G414	T406-R410 WeakPolarHBondContact O-CB 3.18Å; T406-R410 PolarHBondContact O-N 3.2Å; R407-R410 WeakPolarHBondContact O-CB 3.3Å; R407-R410 PolarHBondContact O-N 3.11Å; F408-R410 VanDerWaalsContact C-N 3.34Å; F408-R410 PolarHBondContact O-N 3.01Å; R410-G414 PolarHBondContact O-N 3.05Å
411	D	89.1	Confident	89.5	Confident	111 Å²	111	95.9 Å²	95.9	59%	0.594	48%	0.476	S	S	*	.	H	α-helix	trans	-67.9	-40	-178.7	-65.8	-19.1	0	0	0	111.3	R407 F408 I409 G414 K415	R407-D411 VanDerWaalsContact O-CG 3.28Å; R407-D411 PolarHBondContact O-N 2.86Å; F408-D411 PolarHBondContact O-N 2.87Å; I409-D411 VanDerWaalsContact C-N 3.33Å; I409-D411 PolarHBondContact O-N 3.17Å; D411-G414 PolarHBondContact O-N 3.34Å; D411-K415 WeakPolarHBondContact O-CB 3.3Å; D411-K415 PolarHBondContact O-N 3.16Å
412	V	90	Very high	89.5	Confident	57 Å²	57	92.4 Å²	92.4	35%	0.345	46%	0.464	S	S	.	.	H	α-helix	trans	-64.2	-49.5	174	172.7	0	0	0	0	111.1	F408 I409 G414 K415 D416	F408-V412 HydrophobicContact CD1-CG2 4.19Å; F408-V412 HydrophobicContact CE1-CG2 3.76Å; F408-V412 HydrophobicContact CE2-CG2 4.14Å; F408-V412 HydrophobicContact CZ-CG2 3.73Å; F408-V412 WeakPolarHBondContact O-CG2 3.31Å; F408-V412 PolarHBondContact O-N 2.94Å; I409-V412 PolarHBondContact O-N 3.44Å; V412-G414 VanDerWaalsContact C-N 3.27Å; V412-G414 PolarHBondContact O-N 2.82Å; V412-K415 PolarHBondContact O-N 3.21Å; V412-D416 WeakPolarHBondContact O-CB 3.32Å; V412-D416 PolarHBondContact O-N 2.88Å
413	L	89.5	Confident	89.4	Confident	108 Å²	108	92.8 Å²	92.8	57%	0.565	46%	0.458	S	S	*	.	H	α-helix	trans	-61.1	-37.7	176.4	-71.5	173.5	0	0	0	112	I409 S417	I409-L413 HydrophobicContact CG2-CD1 3.77Å; I409-L413 HydrophobicContact CG2-CG 4.23Å; I409-L413 WeakPolarHBondContact O-CB 3.26Å; I409-L413 VanDerWaalsContact O-CG 3.25Å; I409-L413 WeakPolarHBondContact O-CG 3.47Å; I409-L413 PolarHBondContact O-N 2.89Å; L413-S417 WeakPolarHBondContact O-CB 3.45Å; L413-S417 PolarHBondContact O-N 3.46Å; L413-S417 PolarHBondContact O-OG 3.37Å
414	G	88	Confident	89.4	Confident	29 Å²	29	89.8 Å²	89.8	30%	0.299	44%	0.444	S	S	.	.	H	α-helix	trans	-59.9	-51.4	174.7	0	0	0	0	0	111.1	R410 D411 V412 S417 E418	R410-G414 PolarHBondContact O-N 3.05Å; D411-G414 PolarHBondContact O-N 3.34Å; V412-G414 VanDerWaalsContact C-N 3.27Å; V412-G414 PolarHBondContact O-N 2.82Å; G414-S417 PolarHBondContact O-N 2.95Å; G414-S417 PolarHBondContact O-OG 3.31Å; G414-E418 WeakPolarHBondContact O-CG 3.19Å; G414-E418 PolarHBondContact O-N 2.88Å
415	K	88.6	Confident	89.4	Confident	121 Å²	121	86.5 Å²	86.5	53%	0.526	42%	0.422	S	S	.	.	H	α-helix	trans	-62.2	-45.5	177.3	-172.7	-179.7	174.3	-172.4	0	112.5	D411 V412 S417 E418 D419	D411-K415 WeakPolarHBondContact O-CB 3.3Å; D411-K415 PolarHBondContact O-N 3.16Å; V412-K415 PolarHBondContact O-N 3.21Å; K415-S417 VanDerWaalsContact C-N 3.27Å; K415-S417 PolarHBondContact O-N 2.78Å; K415-E418 PolarHBondContact O-N 2.59Å; K415-E418 VanDerWaalsContact O-N 3.12Å; K415-D419 PolarHBondContact O-N 3Å
416	D	88.5	Confident	89.5	Confident	81 Å²	81	83.3 Å²	83.3	43%	0.433	40%	0.404	S	S	.	.	H	α-helix	trans	-59.4	-39.6	177.9	-74.3	-17.8	0	0	0	111.4	V412 D419 E420	V412-D416 WeakPolarHBondContact O-CB 3.32Å; V412-D416 PolarHBondContact O-N 2.88Å; D416-D419 PolarHBondContact O-N 3.16Å; D416-E420 VanDerWaalsContact O-CB 3.31Å; D416-E420 WeakPolarHBondContact O-CB 3.46Å; D416-E420 PolarHBondContact O-N 2.78Å
417	S	88.9	Confident	89.6	Confident	45 Å²	45	83.6 Å²	83.6	32%	0.315	40%	0.399	S	S	.	.	H	α-helix	trans	-69.5	-31.9	176.9	80.2	0	0	0	0	113.6	R356 L413 G414 K415 Q421	R356-S417 PolarHBondContact NH1-O 2.97Å; L413-S417 WeakPolarHBondContact O-CB 3.45Å; L413-S417 PolarHBondContact O-N 3.46Å; L413-S417 PolarHBondContact O-OG 3.37Å; G414-S417 PolarHBondContact O-N 2.95Å; G414-S417 PolarHBondContact O-OG 3.31Å; K415-S417 VanDerWaalsContact C-N 3.27Å; K415-S417 PolarHBondContact O-N 2.78Å; S417-Q421 WeakPolarHBondContact O-CB 3.23Å; S417-Q421 PolarHBondContact O-N 2.68Å; S417-Q421 VanDerWaalsContact O-N 3.1Å
418	E	87.5	Confident	89.6	Confident	122 Å²	122	77.9 Å²	77.9	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-71.5	-44.3	173.4	-73.2	-177.5	174.1	0	0	110.4	G414 K415 E420 Q421 L422	G414-E418 WeakPolarHBondContact O-CG 3.19Å; G414-E418 PolarHBondContact O-N 2.88Å; K415-E418 PolarHBondContact O-N 2.59Å; K415-E418 VanDerWaalsContact O-N 3.12Å; E418-E420 PolarHBondContact O-N 3.28Å; E418-Q421 WeakPolarHBondContact O-CB 3.49Å; E418-Q421 PolarHBondContact O-N 3.11Å; E418-L422 WeakPolarHBondContact O-CG 3.35Å; E418-L422 PolarHBondContact O-N 2.91Å
419	D	88.9	Confident	89.7	Confident	27 Å²	27	71.3 Å²	71.3	14%	0.144	35%	0.349	C	S	.	.	H	α-helix	trans	-66.9	-36.5	178	-72.6	-24.9	0	0	0	111.8	P324 K415 D416 L422 R423	P324-D419 HydrophobicContact CG-CB 3.89Å; K415-D419 PolarHBondContact O-N 3Å; D416-D419 PolarHBondContact O-N 3.16Å; D419-L422 PolarHBondContact O-N 2.76Å; D419-R423 WeakPolarHBondContact O-CB 3.45Å; D419-R423 VanDerWaalsContact O-CG 3.3Å; D419-R423 WeakPolarHBondContact O-CG 3.43Å; D419-R423 PolarHBondContact O-N 3.27Å; D419-R423 PolarHBondContact O-NE 3.02Å
420	E	88.4	Confident	89.8	Confident	125 Å²	125	66.8 Å²	66.8	58%	0.584	33%	0.326	S	S	*	.	H	α-helix	trans	-63.1	-43.8	170.5	-172.4	172.4	-166	0	0	112	D416 E418 L422 R423 S424	D416-E420 VanDerWaalsContact O-CB 3.31Å; D416-E420 WeakPolarHBondContact O-CB 3.46Å; D416-E420 PolarHBondContact O-N 2.78Å; E418-E420 PolarHBondContact O-N 3.28Å; E420-L422 PolarHBondContact O-N 2.88Å; E420-R423 PolarHBondContact O-N 3.46Å; E420-S424 WeakPolarHBondContact O-CB 3.13Å; E420-S424 PolarHBondContact O-N 3.24Å
421	Q	88.2	Confident	89.9	Confident	52 Å²	52	63.3 Å²	63.3	24%	0.243	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-45.5	174.5	-175.2	178.3	3.2	0	0	111.2	W352 S417 E418 R423 S424 E425	W352-Q421 HydrophobicContact CD2-CG 4.27Å; W352-Q421 HydrophobicContact CE3-CG 4.34Å; S417-Q421 WeakPolarHBondContact O-CB 3.23Å; S417-Q421 PolarHBondContact O-N 2.68Å; S417-Q421 VanDerWaalsContact O-N 3.1Å; E418-Q421 WeakPolarHBondContact O-CB 3.49Å; E418-Q421 PolarHBondContact O-N 3.11Å; Q421-R423 PolarHBondContact O-N 3.24Å; Q421-S424 WeakPolarHBondContact O-CB 3.26Å; Q421-S424 PolarHBondContact O-N 2.79Å; Q421-S424 PolarHBondContact O-OG 3.06Å; Q421-E425 WeakPolarHBondContact O-CG 3.32Å; Q421-E425 PolarHBondContact O-N 3.2Å
422	L	89.2	Confident	90.1	Very high	72 Å²	72	58 Å²	58	38%	0.377	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-39.5	178.4	-69.3	173	0	0	0	112.3	P324 E418 D419 E420 S424 E425 W426	P324-L422 HydrophobicContact CB-CB 3.95Å; P324-L422 HydrophobicContact CB-CD1 3.71Å; P324-L422 HydrophobicContact CB-CG 4.5Å; P324-L422 HydrophobicContact CG-CB 4.31Å; E418-L422 WeakPolarHBondContact O-CG 3.35Å; E418-L422 PolarHBondContact O-N 2.91Å; D419-L422 PolarHBondContact O-N 2.76Å; E420-L422 PolarHBondContact O-N 2.88Å; L422-S424 VanDerWaalsContact C-N 3.32Å; L422-S424 PolarHBondContact O-N 3.23Å; L422-E425 PolarHBondContact O-N 3.1Å; L422-W426 PolarHBondContact O-N 3.46Å
423	R	89.2	Confident	90.2	Very high	111 Å²	111	56.9 Å²	56.9	42%	0.419	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-41.5	172.8	-76.5	-179.8	-74.4	-151.4	1.9	111.6	P324 D419 E420 Q421 E425 W426 K427	P324-R423 HydrophobicContact CG-CG 4.41Å; D419-R423 WeakPolarHBondContact O-CB 3.45Å; D419-R423 VanDerWaalsContact O-CG 3.3Å; D419-R423 WeakPolarHBondContact O-CG 3.43Å; D419-R423 PolarHBondContact O-N 3.27Å; D419-R423 PolarHBondContact O-NE 3.02Å; E420-R423 PolarHBondContact O-N 3.46Å; Q421-R423 PolarHBondContact O-N 3.24Å; R423-E425 VanDerWaalsContact C-N 3.31Å; R423-E425 PolarHBondContact O-N 3.21Å; R423-W426 PolarHBondContact O-N 3.25Å; R423-K427 WeakPolarHBondContact O-CG 3.49Å; R423-K427 PolarHBondContact O-N 3.03Å
424	S	89.5	Confident	90.4	Very high	18 Å²	18	52.4 Å²	52.4	13%	0.126	26%	0.259	C	S	.	.	H	α-helix	trans	-64.7	-34.2	177.8	81.8	0	0	0	0	113.1	W352 E420 Q421 L422 K427 F428	W352-S424 WeakPolarHBondContact CH2-OG 3.37Å; W352-S424 WeakPolarHBondContact CZ2-OG 3.37Å; W352-S424 PolarHBondContact NE1-OG 3.06Å; E420-S424 WeakPolarHBondContact O-CB 3.13Å; E420-S424 PolarHBondContact O-N 3.24Å; Q421-S424 WeakPolarHBondContact O-CB 3.26Å; Q421-S424 PolarHBondContact O-N 2.79Å; Q421-S424 PolarHBondContact O-OG 3.06Å; L422-S424 VanDerWaalsContact C-N 3.32Å; L422-S424 PolarHBondContact O-N 3.23Å; S424-K427 PolarHBondContact O-N 3.3Å; S424-F428 WeakPolarHBondContact O-CB 3.35Å; S424-F428 PolarHBondContact O-N 3Å
425	E	91.2	Very high	90.6	Very high	16 Å²	16	56.4 Å²	56.4	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-43.5	173.8	-71	-174.6	173.2	0	0	110.8	K334 L338 Q421 L422 R423 F428 A429	K334-E425 IonicContact NZ-OE1 2.73Å; K334-E425 PolarHBondContact NZ-OE1 3.1Å; K334-E425 IonicContact NZ-OE2 3.37Å; K334-E425 PolarHBondContact NZ-OE2 3.03Å; L338-E425 HydrophobicContact CD1-CB 4.11Å; L338-E425 HydrophobicContact CD1-CG 4Å; Q421-E425 WeakPolarHBondContact O-CG 3.32Å; Q421-E425 PolarHBondContact O-N 3.2Å; L422-E425 PolarHBondContact O-N 3.1Å; R423-E425 VanDerWaalsContact C-N 3.31Å; R423-E425 PolarHBondContact O-N 3.21Å; E425-F428 PolarHBondContact O-N 2.97Å; E425-A429 WeakPolarHBondContact O-CB 3.27Å; E425-A429 PolarHBondContact O-N 2.77Å
426	W	92.1	Very high	90.9	Very high	14 Å²	14	52.9 Å²	52.9	5%	0.053	25%	0.252	C	S	.	.	H	α-helix	trans	-65.3	-44.1	174.8	-79	115.2	0	0	0	112.8	L319 R322 H327 M329 L422 R423 F428 A429 A430	L319-W426 HydrophobicContact CD2-CE3 4.05Å; L319-W426 HydrophobicContact CD2-CZ3 3.57Å; R322-W426 HydrophobicContact CB-CD2 3.79Å; R322-W426 HydrophobicContact CB-CE3 4.23Å; R322-W426 HydrophobicContact CB-CG 3.95Å; R322-W426 VanDerWaalsContact NH1-CH2 3.31Å; H327-W426 HydrophobicContact CB-CZ2 4Å; H327-W426 PolarHBondContact O-NE1 3.03Å; M329-W426 HydrophobicContact CB-CH2 4.29Å; M329-W426 HydrophobicContact CB-CZ2 3.9Å; M329-W426 HydrophobicContact CG-CH2 4.32Å; M329-W426 HydrophobicContact CG-CZ2 4.41Å; L422-W426 PolarHBondContact O-N 3.46Å; R423-W426 PolarHBondContact O-N 3.25Å; W426-F428 VanDerWaalsContact C-N 3.33Å; W426-F428 PolarHBondContact O-N 3.17Å; W426-A429 PolarHBondContact O-N 2.98Å; W426-A430 WeakPolarHBondContact O-CB 3.32Å; W426-A430 PolarHBondContact O-N 2.95Å
427	K	91.9	Very high	91.1	Very high	88 Å²	88	49.8 Å²	49.8	38%	0.383	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-44.3	175.5	-72.9	-168.6	173	-164.8	0	111.8	E259 R423 S424 A430 M431	E259-K427 IonicContact OE1-NZ 2.68Å; E259-K427 PolarHBondContact OE1-NZ 3.47Å; R423-K427 WeakPolarHBondContact O-CG 3.49Å; R423-K427 PolarHBondContact O-N 3.03Å; S424-K427 PolarHBondContact O-N 3.3Å; K427-A430 PolarHBondContact O-N 3.26Å; K427-M431 PolarHBondContact O-N 3.07Å
428	F	91.8	Very high	91.3	Very high	22 Å²	22	49.7 Å²	49.7	10%	0.096	23%	0.23	C	C	.	.	H	α-helix	trans	-68.1	-41.5	176.6	-176.3	-97.9	0	0	0	112.2	L338 P342 L350 S424 E425 W426 A430 M431 V432	L338-F428 HydrophobicContact CD2-CD1 3.67Å; L338-F428 HydrophobicContact CD2-CE1 4.38Å; P342-F428 HydrophobicContact CB-CE1 4.2Å; P342-F428 HydrophobicContact CB-CZ 4.13Å; P342-F428 HydrophobicContact CG-CE1 3.69Å; P342-F428 HydrophobicContact CG-CZ 4.12Å; L350-F428 HydrophobicContact CD1-CB 3.28Å; L350-F428 HydrophobicContact CD1-CD1 3.54Å; L350-F428 HydrophobicContact CD1-CD2 3.85Å; L350-F428 HydrophobicContact CD1-CE1 4.24Å; L350-F428 HydrophobicContact CD1-CG 3.28Å; L350-F428 HydrophobicContact CD2-CB 4.18Å; L350-F428 HydrophobicContact CD2-CD2 4.03Å; L350-F428 HydrophobicContact CD2-CG 4.23Å; L350-F428 HydrophobicContact CG-CB 3.9Å; L350-F428 HydrophobicContact CG-CD1 4.05Å; L350-F428 HydrophobicContact CG-CD2 3.54Å; L350-F428 HydrophobicContact CG-CE1 4.41Å; L350-F428 HydrophobicContact CG-CE2 3.97Å; L350-F428 HydrophobicContact CG-CG 3.57Å; L350-F428 HydrophobicContact CG-CZ 4.38Å; S424-F428 WeakPolarHBondContact O-CB 3.35Å; S424-F428 PolarHBondContact O-N 3Å; E425-F428 PolarHBondContact O-N 2.97Å; W426-F428 VanDerWaalsContact C-N 3.33Å; W426-F428 PolarHBondContact O-N 3.17Å; F428-A430 VanDerWaalsContact C-N 3.27Å; F428-A430 PolarHBondContact O-N 2.57Å; F428-M431 WeakPolarHBondContact O-CB 3.38Å; F428-M431 PolarHBondContact O-N 2.79Å; F428-M431 VanDerWaalsContact O-N 3.15Å; F428-V432 HydrophobicContact CD1-CG2 3.84Å; F428-V432 HydrophobicContact CE1-CG2 3.63Å; F428-V432 HydrophobicContact CG-CG2 4.43Å; F428-V432 HydrophobicContact CZ-CG2 4.03Å; F428-V432 WeakPolarHBondContact O-CG2 3.5Å; F428-V432 PolarHBondContact O-N 3.45Å
429	A	92.5	Very high	91.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.3	-40.5	174.3	0	0	0	0	0	112	M329 L337 L338 E425 W426 V432 I433	M329-A429 HydrophobicContact CE-CB 3.98Å; L337-A429 HydrophobicContact CB-CB 4.04Å; L337-A429 HydrophobicContact CD1-CB 4.12Å; L338-A429 HydrophobicContact CD2-CB 4.2Å; E425-A429 WeakPolarHBondContact O-CB 3.27Å; E425-A429 PolarHBondContact O-N 2.77Å; W426-A429 PolarHBondContact O-N 2.98Å; A429-V432 PolarHBondContact O-N 3.46Å; A429-I433 WeakPolarHBondContact O-CG1 3.45Å; A429-I433 PolarHBondContact O-N 2.9Å; A429-I433 VanDerWaalsContact O-N 3.11Å
430	A	92.8	Very high	91.8	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-46	173.6	0	0	0	0	0	111.5	V316 L319 H320 W426 K427 F428 V432 I433 D434	V316-A430 HydrophobicContact CG1-CB 4.21Å; L319-A430 HydrophobicContact CB-CB 4.16Å; H320-A430 HydrophobicContact CB-CB 3.87Å; W426-A430 WeakPolarHBondContact O-CB 3.32Å; W426-A430 PolarHBondContact O-N 2.95Å; K427-A430 PolarHBondContact O-N 3.26Å; F428-A430 VanDerWaalsContact C-N 3.27Å; F428-A430 PolarHBondContact O-N 2.57Å; A430-V432 VanDerWaalsContact C-N 3.31Å; A430-V432 PolarHBondContact O-N 3.32Å; A430-I433 PolarHBondContact O-N 2.98Å; A430-D434 WeakPolarHBondContact O-CB 3.26Å; A430-D434 PolarHBondContact O-N 3.04Å
431	M	91.9	Very high	92.1	Very high	110 Å²	110	45.2 Å²	45.2	54%	0.542	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-37	176.6	-172.3	-175	-67.3	0	0	113	M347 K427 F428 D434 R435	M347-M431 HydrophobicContact CE-CG 4Å; M347-M431 HydrophobicContact CE-SD 4.34Å; K427-M431 PolarHBondContact O-N 3.07Å; F428-M431 WeakPolarHBondContact O-CB 3.38Å; F428-M431 PolarHBondContact O-N 2.79Å; F428-M431 VanDerWaalsContact O-N 3.15Å; M431-D434 PolarHBondContact O-N 3Å; M431-R435 WeakPolarHBondContact O-CB 3.49Å; M431-R435 PolarHBondContact O-N 3.27Å
432	V	92.9	Very high	92.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.9	-42.4	177	170.9	0	0	0	0	111	L341 P342 L345 M347 F428 A429 A430 R435 L436	L341-V432 HydrophobicContact CB-CG1 3.5Å; L341-V432 HydrophobicContact CD1-CG1 4.23Å; L341-V432 HydrophobicContact CG-CG1 4.5Å; P342-V432 HydrophobicContact CB-CG2 4.43Å; P342-V432 HydrophobicContact CG-CG1 4.11Å; P342-V432 HydrophobicContact CG-CG2 3.71Å; L345-V432 HydrophobicContact CD1-CG1 4.02Å; L345-V432 WeakPolarHBondContact CD1-O 3.26Å; M347-V432 HydrophobicContact SD-CG2 4Å; F428-V432 HydrophobicContact CD1-CG2 3.84Å; F428-V432 HydrophobicContact CE1-CG2 3.63Å; F428-V432 HydrophobicContact CG-CG2 4.43Å; F428-V432 HydrophobicContact CZ-CG2 4.03Å; F428-V432 WeakPolarHBondContact O-CG2 3.5Å; F428-V432 PolarHBondContact O-N 3.45Å; A429-V432 PolarHBondContact O-N 3.46Å; A430-V432 VanDerWaalsContact C-N 3.31Å; A430-V432 PolarHBondContact O-N 3.32Å; V432-R435 PolarHBondContact O-N 3.3Å; V432-L436 WeakPolarHBondContact O-CB 3.49Å; V432-L436 PolarHBondContact O-N 2.88Å
433	I	92.8	Very high	92.5	Very high	33 Å²	33	43.5 Å²	43.5	17%	0.169	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-42.4	175.5	-70.5	164.2	0	0	0	110.6	V316 L319 L337 A429 A430 R435 L436 C437	V316-I433 HydrophobicContact CG2-CB 4.35Å; V316-I433 HydrophobicContact CG2-CG2 3.74Å; L319-I433 HydrophobicContact CD1-CD1 3.3Å; L337-I433 HydrophobicContact CD1-CD1 4.39Å; L337-I433 HydrophobicContact CD2-CD1 3.61Å; L337-I433 HydrophobicContact CD2-CG1 3.78Å; A429-I433 WeakPolarHBondContact O-CG1 3.45Å; A429-I433 PolarHBondContact O-N 2.9Å; A429-I433 VanDerWaalsContact O-N 3.11Å; A430-I433 PolarHBondContact O-N 2.98Å; I433-R435 VanDerWaalsContact C-N 3.29Å; I433-R435 PolarHBondContact O-N 3Å; I433-L436 WeakPolarHBondContact O-CB 3.41Å; I433-L436 PolarHBondContact O-N 3.26Å; I433-L436 VanDerWaalsContact O-N 3.11Å; I433-C437 WeakPolarHBondContact O-CB 3.26Å; I433-C437 PolarHBondContact O-N 3.32Å; I433-C437 PolarHBondContact O-SG 2.81Å; I433-C437 VanDerWaalsContact O-SG 3.39Å
434	D	93.8	Very high	92.6	Very high	14 Å²	14	41.1 Å²	41.1	8%	0.075	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-45.6	176.2	-157.7	24.7	0	0	0	111	F254 K263 V316 A430 M431 C437 F438	F254-D434 WeakPolarHBondContact CD1-OD1 3.42Å; K263-D434 IonicContact NZ-OD1 2.8Å; K263-D434 PolarHBondContact NZ-OD1 3.36Å; K263-D434 IonicContact NZ-OD2 2.77Å; K263-D434 PolarHBondContact NZ-OD2 3.41Å; V316-D434 HydrophobicContact CG1-CB 4.09Å; V316-D434 HydrophobicContact CG2-CB 4.31Å; A430-D434 WeakPolarHBondContact O-CB 3.26Å; A430-D434 PolarHBondContact O-N 3.04Å; M431-D434 PolarHBondContact O-N 3Å; D434-C437 PolarHBondContact O-N 2.87Å; D434-F438 WeakPolarHBondContact O-CB 3.26Å; D434-F438 PolarHBondContact O-N 2.84Å
435	R	92.5	Very high	92.6	Very high	112 Å²	112	40.5 Å²	40.5	42%	0.423	20%	0.201	S	C	.	.	H	α-helix	trans	-66.7	-37.1	175.8	-172.2	63.9	172.9	-169.8	1.5	113.1	L345 M347 M431 V432 I433 F438 I439	L345-R435 HydrophobicContact CD1-CB 4.24Å; L345-R435 HydrophobicContact CD1-CG 4.26Å; M347-R435 HydrophobicContact CE-CB 3.65Å; M347-R435 HydrophobicContact CE-CG 3.81Å; M347-R435 HydrophobicContact SD-CB 3.98Å; M347-R435 HydrophobicContact SD-CG 4.02Å; M431-R435 WeakPolarHBondContact O-CB 3.49Å; M431-R435 PolarHBondContact O-N 3.27Å; V432-R435 PolarHBondContact O-N 3.3Å; I433-R435 VanDerWaalsContact C-N 3.29Å; I433-R435 PolarHBondContact O-N 3Å; R435-F438 WeakPolarHBondContact O-CB 3.41Å; R435-I439 WeakPolarHBondContact O-CG1 3.33Å; R435-I439 PolarHBondContact O-N 3.36Å
436	L	93.6	Very high	92.6	Very high	48 Å²	48	44.6 Å²	44.6	25%	0.251	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-49	175.1	179.6	65.8	0	0	0	110.7	L341 L345 V432 I433 F438 I439 I440	L341-L436 HydrophobicContact CD1-CD2 4.44Å; L341-L436 HydrophobicContact CD2-CD1 4.35Å; L341-L436 HydrophobicContact CD2-CD2 4.02Å; L345-L436 HydrophobicContact CD1-CB 4.19Å; L345-L436 HydrophobicContact CD2-CD1 4.27Å; V432-L436 WeakPolarHBondContact O-CB 3.49Å; V432-L436 PolarHBondContact O-N 2.88Å; I433-L436 WeakPolarHBondContact O-CB 3.41Å; I433-L436 PolarHBondContact O-N 3.26Å; I433-L436 VanDerWaalsContact O-N 3.11Å; L436-F438 VanDerWaalsContact C-N 3.34Å; L436-F438 PolarHBondContact O-N 3.28Å; L436-I439 PolarHBondContact O-N 2.95Å; L436-I440 HydrophobicContact CD1-CD1 4.12Å; L436-I440 HydrophobicContact CG-CD1 3.88Å; L436-I440 WeakPolarHBondContact O-CG1 3.43Å; L436-I440 PolarHBondContact O-N 2.88Å
437	C	93.7	Very high	92.5	Very high	16 Å²	16	48.6 Å²	48.6	11%	0.108	24%	0.244	C	C	.	.	H	α-helix	trans	-57.9	-46.5	176	-71.7	0	0	0	0	110.8	F254 I433 D434 I439 I440 F441	F254-C437 HydrophobicContact CD1-CB 3.8Å; F254-C437 HydrophobicContact CE1-CB 3.46Å; F254-C437 VanDerWaalsContact CE1-CB 3.46Å; F254-C437 HydrophobicContact CZ-CB 4.1Å; I433-C437 WeakPolarHBondContact O-CB 3.26Å; I433-C437 PolarHBondContact O-N 3.32Å; I433-C437 PolarHBondContact O-SG 2.81Å; I433-C437 VanDerWaalsContact O-SG 3.39Å; D434-C437 PolarHBondContact O-N 2.87Å; C437-I439 VanDerWaalsContact C-N 3.31Å; C437-I439 PolarHBondContact O-N 3.35Å; C437-I440 PolarHBondContact O-N 3.47Å; C437-F441 HydrophobicContact CB-CD2 4.04Å; C437-F441 HydrophobicContact CB-CE2 4.08Å; C437-F441 WeakPolarHBondContact O-CB 3.46Å; C437-F441 WeakPolarHBondContact O-CD2 3.39Å; C437-F441 PolarHBondContact O-N 3.48Å
438	F	94	Very high	92.2	Very high	42 Å²	42	45.4 Å²	45.4	18%	0.184	23%	0.232	C	C	.	.	H	α-helix	trans	-50.5	-48.8	174.7	173.7	-107.3	0	0	0	112.6	L251 F254 L255 D434 R435 L436 S442	L251-F438 HydrophobicContact CB-CE2 4.09Å; F254-F438 HydrophobicContact CB-CB 3.71Å; F254-F438 HydrophobicContact CB-CD2 3.99Å; F254-F438 HydrophobicContact CB-CG 4.3Å; F254-F438 HydrophobicContact CG-CB 4.25Å; L255-F438 HydrophobicContact CD1-CD2 3.62Å; L255-F438 HydrophobicContact CD1-CE2 3.21Å; L255-F438 HydrophobicContact CD1-CZ 3.89Å; D434-F438 WeakPolarHBondContact O-CB 3.26Å; D434-F438 PolarHBondContact O-N 2.84Å; R435-F438 WeakPolarHBondContact O-CB 3.41Å; L436-F438 VanDerWaalsContact C-N 3.34Å; L436-F438 PolarHBondContact O-N 3.28Å; F438-S442 WeakPolarHBondContact O-CB 3.38Å; F438-S442 PolarHBondContact O-N 3.43Å; F438-S442 PolarHBondContact O-OG 3.05Å
439	I	93	Very high	91.9	Very high	70 Å²	70	45.1 Å²	45.1	36%	0.359	23%	0.233	S	C	.	.	H	α-helix	trans	-66.7	-46	-179.5	-65.6	176.9	0	0	0	110.8	L345 R435 L436 C437 S442 V443	L345-I439 HydrophobicContact CD2-CD1 3.46Å; L345-I439 VanDerWaalsContact CD2-CD1 3.46Å; R435-I439 WeakPolarHBondContact O-CG1 3.33Å; R435-I439 PolarHBondContact O-N 3.36Å; L436-I439 PolarHBondContact O-N 2.95Å; C437-I439 VanDerWaalsContact C-N 3.31Å; C437-I439 PolarHBondContact O-N 3.35Å; I439-S442 PolarHBondContact O-N 3.45Å; I439-V443 WeakPolarHBondContact O-CG2 3.49Å; I439-V443 PolarHBondContact O-N 3.3Å
440	I	93.8	Very high	91.6	Very high	88 Å²	88	48.9 Å²	48.9	45%	0.451	26%	0.259	S	S	.	.	H	α-helix	trans	-59.4	-52.8	179.7	-67.6	169.7	0	0	0	110	L436 C437 S442 V443 V444	L436-I440 HydrophobicContact CD1-CD1 4.12Å; L436-I440 HydrophobicContact CG-CD1 3.88Å; L436-I440 WeakPolarHBondContact O-CG1 3.43Å; L436-I440 PolarHBondContact O-N 2.88Å; C437-I440 PolarHBondContact O-N 3.47Å; I440-S442 PolarHBondContact O-N 3.4Å; I440-V443 PolarHBondContact O-N 3.34Å; I440-V444 WeakPolarHBondContact O-CG2 3.33Å; I440-V444 PolarHBondContact O-N 3.23Å
441	F	93.8	Very high	91.2	Very high	22 Å²	22	51.8 Å²	51.8	10%	0.096	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-36.5	-178.9	-73.5	-65.3	0	0	0	112.5	L251 F254 V305 A308 C437 V443 V444 I445	L251-F441 HydrophobicContact CD2-CB 4.28Å; F254-F441 HydrophobicContact CD2-CD2 4.44Å; F254-F441 HydrophobicContact CE1-CD2 4.07Å; F254-F441 HydrophobicContact CE1-CE2 4.2Å; F254-F441 HydrophobicContact CE2-CB 4.06Å; F254-F441 AromaticContact CE2-CD2 3.42Å; F254-F441 HydrophobicContact CE2-CD2 3.42Å; F254-F441 VanDerWaalsContact CE2-CD2 3.42Å; F254-F441 HydrophobicContact CE2-CE2 4.12Å; F254-F441 AromaticContact CE2-CG 3.92Å; F254-F441 HydrophobicContact CE2-CG 3.92Å; F254-F441 AromaticContact CZ-CD2 3.19Å; F254-F441 HydrophobicContact CZ-CD2 3.19Å; F254-F441 AromaticContact CZ-CE2 3.45Å; F254-F441 HydrophobicContact CZ-CE2 3.45Å; F254-F441 VanDerWaalsContact CZ-CE2 3.45Å; F254-F441 HydrophobicContact CZ-CG 4.11Å; F254-F441 HydrophobicContact CZ-CZ 4.48Å; V305-F441 HydrophobicContact CG1-CD1 3.9Å; V305-F441 HydrophobicContact CG1-CE1 4.39Å; A308-F441 HydrophobicContact CB-CE1 3.91Å; A308-F441 HydrophobicContact CB-CZ 3.95Å; C437-F441 HydrophobicContact CB-CD2 4.04Å; C437-F441 HydrophobicContact CB-CE2 4.08Å; C437-F441 WeakPolarHBondContact O-CB 3.46Å; C437-F441 WeakPolarHBondContact O-CD2 3.39Å; C437-F441 PolarHBondContact O-N 3.48Å; F441-V443 VanDerWaalsContact C-N 3.35Å; F441-V443 PolarHBondContact O-N 3.05Å; F441-V444 PolarHBondContact O-N 3.35Å; F441-I445 WeakPolarHBondContact O-CB 3.42Å; F441-I445 WeakPolarHBondContact O-CD1 3.46Å; F441-I445 VanDerWaalsContact O-CG1 3.32Å; F441-I445 WeakPolarHBondContact O-CG1 3.18Å; F441-I445 PolarHBondContact O-N 3.19Å
442	S	92.5	Very high	90.7	Very high	14 Å²	14	47.6 Å²	47.6	10%	0.098	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-46.1	172.8	-62.2	0	0	0	0	111.7	L251 F438 I439 I440 I445 I446	L251-S442 WeakPolarHBondContact CD2-OG 3.33Å; F438-S442 WeakPolarHBondContact O-CB 3.38Å; F438-S442 PolarHBondContact O-N 3.43Å; F438-S442 PolarHBondContact O-OG 3.05Å; I439-S442 PolarHBondContact O-N 3.45Å; I440-S442 PolarHBondContact O-N 3.4Å; S442-I445 PolarHBondContact O-N 3.25Å; S442-I446 WeakPolarHBondContact O-CB 3.33Å; S442-I446 WeakPolarHBondContact O-CD1 3.41Å; S442-I446 WeakPolarHBondContact O-CG1 3.36Å; S442-I446 PolarHBondContact O-N 3.4Å
443	V	92.5	Very high	89.9	Confident	75 Å²	75	50.3 Å²	50.3	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-44.5	178	170.9	0	0	0	0	110.8	I439 I440 F441 I445 I446 I447	I439-V443 WeakPolarHBondContact O-CG2 3.49Å; I439-V443 PolarHBondContact O-N 3.3Å; I440-V443 PolarHBondContact O-N 3.34Å; F441-V443 VanDerWaalsContact C-N 3.35Å; F441-V443 PolarHBondContact O-N 3.05Å; V443-I445 PolarHBondContact O-N 3.35Å; V443-I446 PolarHBondContact O-N 2.87Å; V443-I447 HydrophobicContact CG1-CD1 3.53Å; V443-I447 HydrophobicContact CG1-CG1 4.31Å; V443-I447 WeakPolarHBondContact O-CB 3.46Å; V443-I447 VanDerWaalsContact O-CG1 3.24Å; V443-I447 WeakPolarHBondContact O-CG1 3.47Å; V443-I447 PolarHBondContact O-N 3.24Å
444	V	92	Very high	89.4	Confident	61 Å²	61	52.8 Å²	52.8	37%	0.37	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-45.4	177.8	175.9	0	0	0	0	111.4	V305 I440 F441 I447 S448	V305-V444 HydrophobicContact CG2-CG1 3.71Å; I440-V444 WeakPolarHBondContact O-CG2 3.33Å; I440-V444 PolarHBondContact O-N 3.23Å; F441-V444 PolarHBondContact O-N 3.35Å; V444-I447 PolarHBondContact O-N 3.45Å; V444-S448 VanDerWaalsContact O-CB 3.3Å; V444-S448 WeakPolarHBondContact O-CB 3.3Å; V444-S448 PolarHBondContact O-N 2.9Å; V444-S448 PolarHBondContact O-OG 2.94Å; V444-S448 VanDerWaalsContact O-OG 3.06Å
445	I	90.3	Very high	88.8	Confident	4 Å²	4	55 Å²	55	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-41.6	-179.4	-73.3	162.7	0	0	0	111.7	T250 L251 V305 F441 S442 V443 S448 S449	T250-I445 WeakPolarHBondContact OG1-CD1 3.32Å; L251-I445 HydrophobicContact CD2-CD1 3.66Å; L251-I445 HydrophobicContact CG-CD1 4Å; V305-I445 HydrophobicContact CG1-CD1 4.03Å; V305-I445 HydrophobicContact CG1-CG1 3.93Å; F441-I445 WeakPolarHBondContact O-CB 3.42Å; F441-I445 WeakPolarHBondContact O-CD1 3.46Å; F441-I445 VanDerWaalsContact O-CG1 3.32Å; F441-I445 WeakPolarHBondContact O-CG1 3.18Å; F441-I445 PolarHBondContact O-N 3.19Å; S442-I445 PolarHBondContact O-N 3.25Å; V443-I445 PolarHBondContact O-N 3.35Å; I445-S448 WeakPolarHBondContact CA-OG 3.24Å; I445-S448 PolarHBondContact O-OG 3.46Å; I445-S448 VanDerWaalsContact O-OG 3.08Å; I445-S449 WeakPolarHBondContact O-CB 3.42Å; I445-S449 PolarHBondContact O-N 2.96Å; I445-S449 PolarHBondContact O-OG 3.16Å
446	I	89.9	Confident	87.9	Confident	102 Å²	102	50.1 Å²	50.1	52%	0.523	30%	0.296	S	S	.	.	H	α-helix	trans	-65.4	-48.1	177.5	-68.7	166	0	0	0	110	S442 V443 S449 C450	S442-I446 WeakPolarHBondContact O-CB 3.33Å; S442-I446 WeakPolarHBondContact O-CD1 3.41Å; S442-I446 WeakPolarHBondContact O-CG1 3.36Å; S442-I446 PolarHBondContact O-N 3.4Å; V443-I446 PolarHBondContact O-N 2.87Å; I446-S449 PolarHBondContact O-N 3.45Å; I446-C450 VanDerWaalsContact O-CB 3.27Å; I446-C450 WeakPolarHBondContact O-CB 3.29Å; I446-C450 PolarHBondContact O-N 3.18Å; I446-C450 PolarHBondContact O-SG 3.38Å
447	I	89.9	Confident	86.8	Confident	99 Å²	99	50 Å²	50	51%	0.508	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-44.9	-179.6	-68.2	171.7	0	0	0	110.8	V443 V444 S451	V443-I447 HydrophobicContact CG1-CD1 3.53Å; V443-I447 HydrophobicContact CG1-CG1 4.31Å; V443-I447 WeakPolarHBondContact O-CB 3.46Å; V443-I447 VanDerWaalsContact O-CG1 3.24Å; V443-I447 WeakPolarHBondContact O-CG1 3.47Å; V443-I447 PolarHBondContact O-N 3.24Å; V444-I447 PolarHBondContact O-N 3.45Å; I447-S451 VanDerWaalsContact O-CB 3.24Å; I447-S451 WeakPolarHBondContact O-CB 3.46Å; I447-S451 PolarHBondContact O-N 3.34Å; I447-S451 PolarHBondContact O-OG 2.92Å
448	S	86.9	Confident	85.7	Confident	20 Å²	20	52.3 Å²	52.3	14%	0.14	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-46.8	179.8	65.7	0	0	0	0	111.3	V444 I445 S451 I452	V444-S448 VanDerWaalsContact O-CB 3.3Å; V444-S448 WeakPolarHBondContact O-CB 3.3Å; V444-S448 PolarHBondContact O-N 2.9Å; V444-S448 PolarHBondContact O-OG 2.94Å; V444-S448 VanDerWaalsContact O-OG 3.06Å; I445-S448 WeakPolarHBondContact CA-OG 3.24Å; I445-S448 PolarHBondContact O-OG 3.46Å; I445-S448 VanDerWaalsContact O-OG 3.08Å; S448-S451 PolarHBondContact O-N 3.26Å; S448-I452 WeakPolarHBondContact O-CB 3.4Å; S448-I452 WeakPolarHBondContact O-CD1 3.46Å; S448-I452 VanDerWaalsContact O-CG1 3.32Å; S448-I452 WeakPolarHBondContact O-CG1 3.28Å; S448-I452 PolarHBondContact O-N 3.05Å; S448-I452 VanDerWaalsContact O-N 3.09Å
449	S	85.3	Confident	84.3	Confident	17 Å²	17	53.9 Å²	53.9	12%	0.119	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-50.9	178	-56.2	0	0	0	0	110.9	I445 I446 S451 I452 F453	I445-S449 WeakPolarHBondContact O-CB 3.42Å; I445-S449 PolarHBondContact O-N 2.96Å; I445-S449 PolarHBondContact O-OG 3.16Å; I446-S449 PolarHBondContact O-N 3.45Å; S449-S451 PolarHBondContact O-N 2.93Å; S449-I452 PolarHBondContact O-N 3.43Å; S449-F453 WeakPolarHBondContact O-CD2 3.24Å; S449-F453 PolarHBondContact O-N 2.85Å
450	C	85.7	Confident	82	Confident	79 Å²	79	57.1 Å²	57.1	53%	0.534	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-42.2	179.1	-71	0	0	0	0	112.6	I446 I452 A454	I446-C450 VanDerWaalsContact O-CB 3.27Å; I446-C450 WeakPolarHBondContact O-CB 3.29Å; I446-C450 PolarHBondContact O-N 3.18Å; I446-C450 PolarHBondContact O-SG 3.38Å; C450-I452 VanDerWaalsContact C-N 3.3Å; C450-I452 PolarHBondContact O-N 3.14Å; C450-A454 WeakPolarHBondContact O-CB 3.3Å; C450-A454 PolarHBondContact O-N 3.37Å
451	S	84.2	Confident	79.3	Confident	62 Å²	62	61.5 Å²	61.5	43%	0.434	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-39.4	179.9	-58.8	0	0	0	0	111.6	I447 S448 S449 S455	I447-S451 VanDerWaalsContact O-CB 3.24Å; I447-S451 WeakPolarHBondContact O-CB 3.46Å; I447-S451 PolarHBondContact O-N 3.34Å; I447-S451 PolarHBondContact O-OG 2.92Å; S448-S451 PolarHBondContact O-N 3.26Å; S449-S451 PolarHBondContact O-N 2.93Å; S451-S455 WeakPolarHBondContact O-CB 3.4Å; S451-S455 PolarHBondContact O-N 3.22Å; S451-S455 VanDerWaalsContact O-N 3.12Å; S451-S455 PolarHBondContact O-OG 3.35Å
452	I	81.5	Confident	78.5	Confident	22 Å²	22	63.5 Å²	63.5	11%	0.113	38%	0.384	C	S	.	.	H	α-helix	trans	-72.5	-48.1	-178.4	-73.8	163.8	0	0	0	110.7	L294 F298 S448 S449 C450 A454 S455 S456	L294-I452 HydrophobicContact CD1-CG1 4.35Å; L294-I452 HydrophobicContact CD1-CG2 4.1Å; L294-I452 HydrophobicContact CD2-CG2 4.16Å; L294-I452 HydrophobicContact CG-CG2 3.9Å; F298-I452 HydrophobicContact CB-CD1 3.75Å; F298-I452 HydrophobicContact CB-CG2 4.31Å; F298-I452 HydrophobicContact CD2-CD1 3.43Å; F298-I452 VanDerWaalsContact CD2-CD1 3.43Å; F298-I452 HydrophobicContact CE2-CD1 4.42Å; F298-I452 HydrophobicContact CG-CD1 4Å; S448-I452 WeakPolarHBondContact O-CB 3.4Å; S448-I452 WeakPolarHBondContact O-CD1 3.46Å; S448-I452 VanDerWaalsContact O-CG1 3.32Å; S448-I452 WeakPolarHBondContact O-CG1 3.28Å; S448-I452 PolarHBondContact O-N 3.05Å; S448-I452 VanDerWaalsContact O-N 3.09Å; S449-I452 PolarHBondContact O-N 3.43Å; C450-I452 VanDerWaalsContact C-N 3.3Å; C450-I452 PolarHBondContact O-N 3.14Å; I452-A454 VanDerWaalsContact C-N 3.33Å; I452-A454 PolarHBondContact O-N 3.36Å; I452-S455 PolarHBondContact O-N 2.93Å; I452-S456 PolarHBondContact O-N 3.34Å
453	F	77.2	Confident	77.8	Confident	56 Å²	56	66.1 Å²	66.1	25%	0.246	40%	0.399	C	S	.	.	H	α-helix	trans	-65.4	-35.5	177.2	-72.4	-60.4	0	0	0	112.8	I240 V244 S449 S455 S456 L459	I240-F453 HydrophobicContact CG2-CE1 3.59Å; I240-F453 HydrophobicContact CG2-CZ 3.64Å; V244-F453 HydrophobicContact CG2-CE2 3.91Å; V244-F453 HydrophobicContact CG2-CZ 3.76Å; S449-F453 WeakPolarHBondContact O-CD2 3.24Å; S449-F453 PolarHBondContact O-N 2.85Å; F453-S455 VanDerWaalsContact C-N 3.29Å; F453-S455 PolarHBondContact O-N 2.82Å; F453-S456 PolarHBondContact O-N 2.85Å; F453-L459 HydrophobicContact CB-CD2 3.66Å; F453-L459 HydrophobicContact CD1-CD1 4.49Å; F453-L459 HydrophobicContact CD1-CD2 3.84Å; F453-L459 HydrophobicContact CG-CD2 4.15Å; F453-L459 WeakPolarHBondContact O-CD2 3.37Å
454	A	82.2	Confident	77	Confident	86 Å²	86	65.6 Å²	65.6	71%	0.711	40%	0.396	S	S	*	.	H	α-helix	trans	-71	-24.9	176.5	0	0	0	0	0	113.2	C450 I452 S456	C450-A454 WeakPolarHBondContact O-CB 3.3Å; C450-A454 PolarHBondContact O-N 3.37Å; I452-A454 VanDerWaalsContact C-N 3.33Å; I452-A454 PolarHBondContact O-N 3.36Å; A454-S456 VanDerWaalsContact C-N 3.32Å
455	S	79.7	Confident	76.1	Confident	61 Å²	61	65.9 Å²	65.9	43%	0.427	40%	0.397	S	S	.	.	H	α-helix	trans	-78.2	-21.1	178.6	-58.9	0	0	0	0	112.2	W155 S451 I452 F453 P457	W155-S455 WeakPolarHBondContact CH2-O 3.35Å; W155-S455 WeakPolarHBondContact CZ3-O 3.45Å; S451-S455 WeakPolarHBondContact O-CB 3.4Å; S451-S455 PolarHBondContact O-N 3.22Å; S451-S455 VanDerWaalsContact O-N 3.12Å; S451-S455 PolarHBondContact O-OG 3.35Å; I452-S455 PolarHBondContact O-N 2.93Å; F453-S455 VanDerWaalsContact C-N 3.29Å; F453-S455 PolarHBondContact O-N 2.82Å; S455-P457 WeakPolarHBondContact O-CD 3.34Å
456	S	75.3	Confident	75.2	Confident	9 Å²	9	69.8 Å²	69.8	6%	0.063	42%	0.421	C	S	.	.	S	Bend	trans	-68.6	122.9	-177	-175.4	0	0	0	0	112	F158 I452 F453 A454	F158-S456 VanDerWaalsContact CB-OG 3.27Å; F158-S456 WeakPolarHBondContact CB-OG 3.47Å; F158-S456 WeakPolarHBondContact CD2-OG 3.37Å; F158-S456 WeakPolarHBondContact CG-OG 3.23Å; I452-S456 PolarHBondContact O-N 3.34Å; F453-S456 PolarHBondContact O-N 2.85Å; A454-S456 VanDerWaalsContact C-N 3.32Å
457	P	68.6	Low	74.2	Confident	44 Å²	44	67.6 Å²	67.6	29%	0.286	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	150.1	163.9	27.6	-31.2	0	0	0	109.3	W155 F158 S455 L459	W155-P457 HydrophobicContact CB-CG 4.07Å; W155-P457 HydrophobicContact CD2-CG 4.06Å; W155-P457 VanDerWaalsContact CE3-CD 3.48Å; W155-P457 HydrophobicContact CE3-CG 4.41Å; W155-P457 HydrophobicContact CG-CG 3.9Å; F158-P457 WeakPolarHBondContact CB-O 3.5Å; S455-P457 WeakPolarHBondContact O-CD 3.34Å; P457-L459 VanDerWaalsContact C-N 3.26Å; P457-L459 PolarHBondContact O-N 3.4Å; P457-L459 VanDerWaalsContact O-N 3.09Å
458	H	71.2	Confident	73.1	Confident	66 Å²	66	65.4 Å²	65.4	31%	0.306	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	6.3	175	-46	-60.8	0	0	0	118.3	D160 R229 T460	D160-H458 IonicContact OD2-CD2 3.92Å; D160-H458 IonicContact OD2-CE1 2.76Å; D160-H458 IonicContact OD2-NE2 3.83Å; D160-H458 PolarHBondContact OD2-NE2 3.04Å; R229-H458 PolarHBondContact NH2-CE1 3.29Å; R229-H458 VanDerWaalsContact NH2-CE1 3.34Å; H458-T460 PolarHBondContact O-N 3.41Å
459	L	64.4	Low	72.1	Confident	75 Å²	75	68.8 Å²	68.8	39%	0.393	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.7	170.2	-159	82.3	0	0	0	112.3	F158 F453 P457	F158-L459 HydrophobicContact CD1-CD1 4.42Å; F158-L459 HydrophobicContact CE1-CD1 3.48Å; F158-L459 VanDerWaalsContact CE1-CD1 3.48Å; F158-L459 HydrophobicContact CE2-CD1 4.17Å; F158-L459 HydrophobicContact CZ-CD1 3.32Å; F453-L459 HydrophobicContact CB-CD2 3.66Å; F453-L459 HydrophobicContact CD1-CD1 4.49Å; F453-L459 HydrophobicContact CD1-CD2 3.84Å; F453-L459 HydrophobicContact CG-CD2 4.15Å; F453-L459 WeakPolarHBondContact O-CD2 3.37Å; P457-L459 VanDerWaalsContact C-N 3.26Å; P457-L459 PolarHBondContact O-N 3.4Å; P457-L459 VanDerWaalsContact O-N 3.09Å
460	T	44.7	Very low	71	Confident	137 Å²	137	73.2 Å²	73.2	84%	0.84	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	20.5	-173.3	49.5	0	0	0	0	114.5	H458	H458-T460 PolarHBondContact O-N 3.41Å
461	V	37	Very low	69.6	Low	181 Å²	181	72.6 Å²	72.6	100%	1.097	45%	0.447	S	S	*	.			trans	-108	0	171.3	-173.7	0	0	0	0	110.5

Retrieved 461 of 461 residues in 296.7 ms (Link to these results)

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