A0A3Q0KGE3_SCHMA Loading...

Eukaryotic translation initiation factor 3 subunit B

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. RNA-binding component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession A0A3Q0KGE3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 671 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	41.1	Very low	52.6	Low	236 Å²	236	130.7 Å²	130.7	100%	1.163	76%	0.761	S	S	*	*				0	131.1	0	-64.6	-151.3	-152.3	0	0	107.6
2	P	47.5	Very low	53.5	Low	124 Å²	124	131.9 Å²	131.9	81%	0.805	75%	0.754	S	S	*	*			trans	-69.8	131.8	176.3	-2.8	19.7	0	0	0	109	F4	P2-F4 PolarHBondContact O-N 2.99Å
3	S	46.7	Very low	54.2	Low	108 Å²	108	133.5 Å²	133.5	76%	0.755	75%	0.751	S	S	*	*			trans	-65.1	124.5	173.7	51.5	0	0	0	0	110.3	A5	S3-A5 PolarHBondContact O-N 2.94Å
4	F	50.7	Low	54.8	Low	204 Å²	204	131.5 Å²	131.5	90%	0.895	74%	0.736	S	S	*	*			trans	-66.3	96.7	164.5	-81.1	-97	0	0	0	108.6	P2	P2-F4 PolarHBondContact O-N 2.99Å
5	A	50.2	Low	55.6	Low	91 Å²	91	127.1 Å²	127.1	75%	0.752	71%	0.709	S	S	*	*			trans	-126.2	120.3	166.6	0	0	0	0	0	106.7	S3	S3-A5 PolarHBondContact O-N 2.94Å
6	G	51.7	Low	56.4	Low	73 Å²	73	123.6 Å²	123.6	75%	0.753	69%	0.694	S	S	*	*			trans	126.1	24.3	169.3	0	0	0	0	0	117.7
7	L	51.6	Low	57.3	Low	145 Å²	145	123.6 Å²	123.6	76%	0.759	69%	0.692	S	S	*	*			trans	-99.9	87.8	162.2	-74.9	167.8	0	0	0	108.3	V9	L7-V9 VanDerWaalsContact C-N 3.28Å; L7-V9 HydrophobicContact CB-CG2 4.06Å; L7-V9 PolarHBondContact O-N 2.88Å; L7-V9 VanDerWaalsContact O-N 3.13Å
8	D	58.6	Low	57.7	Low	174 Å²	174	123.1 Å²	123.1	93%	0.93	69%	0.686	S	S	*	*			trans	-71.5	90.5	159	-76.8	-29.8	0	0	0	106.5
9	V	59.5	Low	57.9	Low	58 Å²	58	120.8 Å²	120.8	35%	0.352	67%	0.672	S	S	.	*			trans	-90.3	124.6	171.5	-175.8	0	0	0	0	106.5	L7 E13 I14	L7-V9 VanDerWaalsContact C-N 3.28Å; L7-V9 HydrophobicContact CB-CG2 4.06Å; L7-V9 PolarHBondContact O-N 2.88Å; L7-V9 VanDerWaalsContact O-N 3.13Å; V9-E13 HydrophobicContact CG1-CB 3.84Å; V9-I14 HydrophobicContact CB-CD1 3.94Å; V9-I14 HydrophobicContact CB-CG1 4.08Å; V9-I14 HydrophobicContact CG1-CD1 4Å; V9-I14 HydrophobicContact CG1-CG1 3.55Å
10	D	60.9	Low	58.2	Low	109 Å²	109	123.6 Å²	123.6	58%	0.583	68%	0.679	S	S	*	*			trans	-58.9	136.4	179.1	-152.9	-20.5	0	0	0	109.5	E12 E13	D10-E12 PolarHBondContact O-N 2.83Å; D10-E13 PolarHBondContact O-N 3.38Å
11	D	60.1	Low	58.5	Low	116 Å²	116	125.4 Å²	125.4	62%	0.62	68%	0.683	S	S	*	*	H	α-helix	trans	-58.2	-22.7	-179.1	-78.8	-27.8	0	0	0	111.4	E13 I14 I15	D11-E13 VanDerWaalsContact C-N 3.31Å; D11-E13 PolarHBondContact O-N 3.45Å; D11-I14 PolarHBondContact O-N 3.38Å; D11-I15 PolarHBondContact O-N 2.92Å
12	E	63.1	Low	59.3	Low	145 Å²	145	121.4 Å²	121.4	68%	0.678	66%	0.659	S	S	*	*	H	α-helix	trans	-64.9	-26.8	172	-65.9	-167.4	165.2	0	0	113.8	D10	D10-E12 PolarHBondContact O-N 2.83Å
13	E	63.1	Low	59.6	Low	153 Å²	153	120.8 Å²	120.8	72%	0.715	66%	0.655	S	S	*	*	H	α-helix	trans	-87.2	-26.6	175.6	-81.3	-168	158.6	0	0	113.2	V9 D10 D11	V9-E13 HydrophobicContact CG1-CB 3.84Å; D10-E13 PolarHBondContact O-N 3.38Å; D11-E13 VanDerWaalsContact C-N 3.31Å; D11-E13 PolarHBondContact O-N 3.45Å
14	I	62.8	Low	59.9	Low	105 Å²	105	125.1 Å²	125.1	54%	0.538	66%	0.66	S	S	.	*	H	α-helix	trans	-84.5	-25.7	-172.7	-52.5	177.8	0	0	0	111.9	V9 D11	V9-I14 HydrophobicContact CB-CD1 3.94Å; V9-I14 HydrophobicContact CB-CG1 4.08Å; V9-I14 HydrophobicContact CG1-CD1 4Å; V9-I14 HydrophobicContact CG1-CG1 3.55Å; D11-I14 PolarHBondContact O-N 3.38Å
15	I	66.9	Low	60.2	Low	65 Å²	65	122 Å²	122	33%	0.333	66%	0.658	S	S	.	*			trans	-138.7	51.6	-167.3	-26.1	178.8	0	0	0	115.2	D11 D17 I18 L19	D11-I15 PolarHBondContact O-N 2.92Å; I15-D17 PolarHBondContact O-N 3.08Å; I15-I18 HydrophobicContact CG2-CB 3.49Å; I15-I18 VanDerWaalsContact CG2-CB 3.49Å; I15-I18 HydrophobicContact CG2-CD1 3.48Å; I15-I18 VanDerWaalsContact CG2-CD1 3.48Å; I15-I18 HydrophobicContact CG2-CG1 3.39Å; I15-I18 PolarHBondContact O-N 3.1Å; I15-L19 PolarHBondContact O-N 3.25Å
16	P	68.3	Low	60.4	Low	72 Å²	72	124.4 Å²	124.4	47%	0.468	65%	0.654	S	S	.	*	H	α-helix	trans	-57.9	-36.8	177.8	22.7	-31.6	0	0	0	112.7	I18 L19 E20	P16-I18 VanDerWaalsContact C-N 3.34Å; P16-I18 PolarHBondContact O-N 3.49Å; P16-L19 PolarHBondContact O-N 2.78Å; P16-E20 PolarHBondContact O-N 2.81Å; P16-E20 VanDerWaalsContact O-N 3.1Å
17	D	71	Confident	60.9	Low	124 Å²	124	126.7 Å²	126.7	66%	0.663	65%	0.648	S	S	*	*	H	α-helix	trans	-68.1	-28.3	-176.1	-55	-11.4	0	0	0	113.7	I15	I15-D17 PolarHBondContact O-N 3.08Å
18	I	64.4	Low	61.5	Low	114 Å²	114	123.9 Å²	123.9	59%	0.585	63%	0.631	S	S	*	*	H	α-helix	trans	-88.2	-31.3	177.9	-59	-172.9	0	0	0	110.7	I15 P16 Q21 K22	I15-I18 HydrophobicContact CG2-CB 3.49Å; I15-I18 VanDerWaalsContact CG2-CB 3.49Å; I15-I18 HydrophobicContact CG2-CD1 3.48Å; I15-I18 VanDerWaalsContact CG2-CD1 3.48Å; I15-I18 HydrophobicContact CG2-CG1 3.39Å; I15-I18 PolarHBondContact O-N 3.1Å; P16-I18 VanDerWaalsContact C-N 3.34Å; P16-I18 PolarHBondContact O-N 3.49Å; I18-Q21 PolarHBondContact O-N 3.35Å; I18-K22 PolarHBondContact O-N 2.8Å
19	L	62.4	Low	62	Low	79 Å²	79	117.5 Å²	117.5	41%	0.414	60%	0.597	S	S	.	*	H	α-helix	trans	-67.9	-33.4	174.7	-83.2	159	0	0	0	112.2	I15 P16 Q21 K22	I15-L19 PolarHBondContact O-N 3.25Å; P16-L19 PolarHBondContact O-N 2.78Å; L19-Q21 VanDerWaalsContact C-N 3.25Å; L19-Q21 PolarHBondContact O-N 3.32Å; L19-K22 HydrophobicContact CD2-CD 4.44Å; L19-K22 WeakPolarHBondContact O-CB 3.34Å; L19-K22 PolarHBondContact O-N 3.41Å
20	E	64	Low	62.8	Low	177 Å²	177	116.3 Å²	116.3	83%	0.827	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-26.1	171.2	-94.3	-168.6	162.2	0	0	113.4	P16	P16-E20 PolarHBondContact O-N 2.81Å; P16-E20 VanDerWaalsContact O-N 3.1Å
21	Q	64.2	Low	64	Low	161 Å²	161	112.1 Å²	112.1	75%	0.752	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-6.1	177	-66.5	-174.5	12.2	0	0	113.7	I18 L19 P23	I18-Q21 PolarHBondContact O-N 3.35Å; L19-Q21 VanDerWaalsContact C-N 3.25Å; L19-Q21 PolarHBondContact O-N 3.32Å; Q21-P23 WeakPolarHBondContact O-CD 3.49Å
22	K	57.1	Low	65.4	Low	152 Å²	152	107.1 Å²	107.1	66%	0.661	55%	0.55	S	S	*	.	S	Bend	trans	-67.2	120.1	179.2	-146.4	176.2	-170.5	177.2	0	108.3	I18 L19 K24	I18-K22 PolarHBondContact O-N 2.8Å; L19-K22 HydrophobicContact CD2-CD 4.44Å; L19-K22 WeakPolarHBondContact O-CB 3.34Å; L19-K22 PolarHBondContact O-N 3.41Å; K22-K24 PolarHBondContact O-N 3.22Å
23	P	53.4	Low	66.8	Low	112 Å²	112	100.3 Å²	100.3	73%	0.727	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-58.1	127.8	-179.8	21	-30	0	0	0	109.3	Q21 V25	Q21-P23 WeakPolarHBondContact O-CD 3.49Å; P23-V25 PolarHBondContact O-N 3.44Å
24	K	54.5	Low	68.1	Low	198 Å²	198	93.9 Å²	93.9	86%	0.861	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-57.4	122.9	168.9	-90.2	179.6	175.3	174.6	0	107.4	K22 E26	K22-K24 PolarHBondContact O-N 3.22Å; K24-E26 PolarHBondContact O-N 3.24Å
25	V	56.1	Low	69.5	Low	140 Å²	140	88.9 Å²	88.9	85%	0.848	46%	0.463	S	S	*	.			trans	-60	105.3	169.1	-177.8	0	0	0	0	105.9	P23 D27	P23-V25 PolarHBondContact O-N 3.44Å; V25-D27 PolarHBondContact O-N 3.43Å; V25-D27 VanDerWaalsContact O-N 3.09Å
26	E	55.1	Low	70.7	Confident	141 Å²	141	89.3 Å²	89.3	66%	0.659	47%	0.465	S	S	*	.			trans	-63.5	114.4	173.6	-80.9	-167.9	162.5	0	0	107.4	K24 H28	K24-E26 PolarHBondContact O-N 3.24Å; E26-H28 WeakPolarHBondContact CB-NE2 3.25Å; E26-H28 PolarHBondContact O-CD2 2.88Å; E26-H28 PolarHBondContact O-N 3.24Å; E26-H28 IonicContact OE2-CE1 3.9Å; E26-H28 PolarHBondContact OE2-CE1 3.1Å; E26-H28 IonicContact OE2-NE2 3.45Å
27	D	61.6	Low	71.6	Confident	120 Å²	120	86.9 Å²	86.9	64%	0.642	45%	0.453	S	S	*	.			trans	-72.2	83.5	179.5	-171.6	-1.5	0	0	0	109.3	V25 L29	V25-D27 PolarHBondContact O-N 3.43Å; V25-D27 VanDerWaalsContact O-N 3.09Å; D27-L29 PolarHBondContact O-N 2.95Å; D27-L29 WeakPolarHBondContact OD1-CB 3.35Å; D27-L29 WeakPolarHBondContact OD1-CD1 3.24Å; D27-L29 VanDerWaalsContact OD1-CG 3.28Å; D27-L29 WeakPolarHBondContact OD1-CG 3.34Å; D27-L29 PolarHBondContact OD1-N 3.47Å
28	H	64.2	Low	72.5	Confident	86 Å²	86	81.2 Å²	81.2	40%	0.398	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-78	4.5	176.2	-60	-60.5	0	0	0	112.7	E26 G30 S31 T32 T83	E26-H28 WeakPolarHBondContact CB-NE2 3.25Å; E26-H28 PolarHBondContact O-CD2 2.88Å; E26-H28 PolarHBondContact O-N 3.24Å; E26-H28 IonicContact OE2-CE1 3.9Å; E26-H28 PolarHBondContact OE2-CE1 3.1Å; E26-H28 IonicContact OE2-NE2 3.45Å; H28-G30 PolarHBondContact O-N 3.33Å; H28-G30 VanDerWaalsContact O-N 3.11Å; H28-S31 PolarHBondContact O-N 2.81Å; H28-T32 PolarHBondContact O-N 2.71Å; H28-T32 PolarHBondContact O-OG1 3.42Å; H28-T83 HydrophobicContact CB-CG2 4.39Å
29	L	69.4	Low	73.6	Confident	40 Å²	40	76.6 Å²	76.6	21%	0.209	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-56.2	-34.1	-177.4	-77.7	157.5	0	0	0	112.7	D27 L113 S114 E117	D27-L29 PolarHBondContact O-N 2.95Å; D27-L29 WeakPolarHBondContact OD1-CB 3.35Å; D27-L29 WeakPolarHBondContact OD1-CD1 3.24Å; D27-L29 VanDerWaalsContact OD1-CG 3.28Å; D27-L29 WeakPolarHBondContact OD1-CG 3.34Å; D27-L29 PolarHBondContact OD1-N 3.47Å; L29-L113 HydrophobicContact CD2-CB 4.36Å; L29-L113 HydrophobicContact CD2-CD2 3.83Å; L29-L113 HydrophobicContact CD2-CG 3.73Å; L29-S114 WeakPolarHBondContact O-CB 3.3Å; L29-S114 PolarHBondContact O-N 3.28Å; L29-S114 VanDerWaalsContact O-N 3.11Å; L29-E117 VanDerWaalsContact CD1-OE2 3.24Å; L29-E117 WeakPolarHBondContact CD1-OE2 3.25Å; L29-E117 HydrophobicContact CD2-CG 4.01Å; L29-E117 WeakPolarHBondContact CD2-OE1 3.31Å; L29-E117 WeakPolarHBondContact CD2-OE2 3.44Å
30	G	76.5	Confident	74.8	Confident	34 Å²	34	76.8 Å²	76.8	35%	0.351	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-81.8	-10.5	176.6	0	0	0	0	0	115.3	H28 G87	H28-G30 PolarHBondContact O-N 3.33Å; H28-G30 VanDerWaalsContact O-N 3.11Å; G30-G87 VanDerWaalsContact O-CA 3.26Å; G30-G87 WeakPolarHBondContact O-CA 3.17Å
31	S	86	Confident	75.9	Confident	21 Å²	21	69.4 Å²	69.4	15%	0.147	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-14.5	-177	-60	0	0	0	0	113.2	H28 Y84 G87 A90	H28-S31 PolarHBondContact O-N 2.81Å; S31-Y84 WeakPolarHBondContact CB-O 3.36Å; S31-Y84 PolarHBondContact O-N 3.43Å; S31-G87 PolarHBondContact OG-N 3.27Å; S31-A90 WeakPolarHBondContact O-CB 3.11Å
32	T	89.4	Confident	76.9	Confident	11 Å²	11	63 Å²	63	7%	0.067	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131.1	178	-54.6	0	0	0	0	111.6	H28 F81 I82 T83 L113	H28-T32 PolarHBondContact O-N 2.71Å; H28-T32 PolarHBondContact O-OG1 3.42Å; T32-F81 HydrophobicContact CG2-CB 4.29Å; T32-F81 HydrophobicContact CG2-CD1 4.49Å; T32-I82 WeakPolarHBondContact CA-O 3.49Å; T32-T83 PolarHBondContact OG1-OG1 3.41Å; T32-L113 HydrophobicContact CG2-CB 4.38Å; T32-L113 HydrophobicContact CG2-CD2 4.11Å; T32-L113 PolarHBondContact O-N 2.66Å
33	V	91.5	Very high	78.2	Confident	1 Å²	1	60 Å²	60	1%	0.006	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.6	179.4	-177.7	0	0	0	0	109.1	V35 F81 I82 Y84 A90 V94 V110 T111 L112	V33-V35 HydrophobicContact CG1-CG2 4.22Å; V33-F81 WeakPolarHBondContact O-CA 3.45Å; V33-I82 PolarHBondContact N-O 2.94Å; V33-I82 PolarHBondContact O-N 3.41Å; V33-Y84 HydrophobicContact CG2-CD2 4.1Å; V33-Y84 HydrophobicContact CG2-CE2 4.01Å; V33-A90 HydrophobicContact CG2-CB 3.57Å; V33-V94 HydrophobicContact CG1-CG2 4.14Å; V33-V110 HydrophobicContact CG1-CG1 3.16Å; V33-T111 CarbonylContact C-O 3.58Å; V33-T111 WeakPolarHBondContact CA-O 3.32Å; V33-T111 WeakPolarHBondContact CG1-O 3.32Å; V33-L112 HydrophobicContact CG2-CD2 4.3Å
34	I	91.8	Very high	79.8	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.097	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125	168.5	-49	177.7	0	0	0	107.4	F81 V110 T111 L113 F116	I34-F81 HydrophobicContact CB-CE1 4.49Å; I34-F81 HydrophobicContact CD1-CE1 4.04Å; I34-F81 HydrophobicContact CG1-CD1 3.85Å; I34-F81 HydrophobicContact CG1-CE1 3.69Å; I34-F81 HydrophobicContact CG2-CE1 4.29Å; I34-V110 WeakPolarHBondContact O-CA 3.37Å; I34-T111 PolarHBondContact N-O 2.82Å; I34-T111 PolarHBondContact O-N 3.06Å; I34-L113 HydrophobicContact CD1-CD1 3.69Å; I34-L113 HydrophobicContact CG1-CB 4.43Å; I34-L113 HydrophobicContact CG1-CD1 4.05Å; I34-F116 HydrophobicContact CD1-CB 3.98Å; I34-F116 HydrophobicContact CD1-CG 4.26Å
35	V	92.1	Very high	81.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	103.8	173.2	178.7	0	0	0	0	107.4	V33 F57 Y79 I80 I82 F108 V110	V33-V35 HydrophobicContact CG1-CG2 4.22Å; V35-F57 HydrophobicContact CB-CZ 4.1Å; V35-F57 HydrophobicContact CG1-CE2 3.95Å; V35-F57 HydrophobicContact CG1-CZ 3.57Å; V35-F57 HydrophobicContact CG2-CE1 3.68Å; V35-F57 HydrophobicContact CG2-CE2 3.99Å; V35-F57 HydrophobicContact CG2-CZ 3.38Å; V35-Y79 CarbonylContact O-C 3.49Å; V35-Y79 VanDerWaalsContact O-CA 3.23Å; V35-Y79 WeakPolarHBondContact O-CA 3.43Å; V35-I80 HydrophobicContact CB-CD1 4.09Å; V35-I80 HydrophobicContact CB-CG1 3.57Å; V35-I80 HydrophobicContact CG1-CD1 4.41Å; V35-I80 HydrophobicContact CG1-CG1 4.23Å; V35-I80 HydrophobicContact CG2-CD1 4.35Å; V35-I80 HydrophobicContact CG2-CG1 4.14Å; V35-I80 PolarHBondContact N-O 2.9Å; V35-I80 PolarHBondContact O-N 3.49Å; V35-I82 HydrophobicContact CG2-CD1 4.36Å; V35-F108 HydrophobicContact CG1-CB 4.26Å; V35-F108 HydrophobicContact CG1-CD1 3.8Å; V35-F108 HydrophobicContact CG1-CE1 4.38Å; V35-F108 HydrophobicContact CG1-CG 4.14Å; V35-V110 HydrophobicContact CG1-CG2 4.18Å; V35-V110 HydrophobicContact CG2-CG1 4.14Å; V35-V110 HydrophobicContact CG2-CG2 4.24Å
36	D	90.8	Very high	82.8	Confident	73 Å²	73	52.1 Å²	52.1	39%	0.39	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	162.6	172.8	-169.4	20.4	0	0	0	110.8	F108 Q109	D36-F108 WeakPolarHBondContact O-CA 3.44Å; D36-Q109 HydrophobicContact CB-CB 4.29Å; D36-Q109 PolarHBondContact N-O 3.17Å; D36-Q109 PolarHBondContact O-N 3.01Å
37	G	88.2	Confident	84.4	Confident	21 Å²	21	51.1 Å²	51.1	22%	0.216	30%	0.303	C	S	.	.			trans	81.8	23.2	-177.5	0	0	0	0	0	114.2	G78 H106	G37-G78 PolarHBondContact N-O 3.32Å; G37-H106 WeakPolarHBondContact O-CB 3.3Å
38	C	89	Confident	85.7	Confident	5 Å²	5	52 Å²	52	3%	0.034	31%	0.307	C	S	.	.			trans	-79.1	150	170.9	-64.7	0	0	0	0	111.3	L53 G78	C38-L53 HydrophobicContact CB-CD1 4.21Å; C38-G78 WeakPolarHBondContact CA-O 3.45Å; C38-G78 WeakPolarHBondContact CB-O 3.23Å; C38-G78 PolarHBondContact N-O 2.78Å; C38-G78 VanDerWaalsContact O-CA 3.32Å; C38-G78 WeakPolarHBondContact O-CA 3.29Å
39	P	87.8	Confident	86.9	Confident	17 Å²	17	48.8 Å²	48.8	11%	0.11	29%	0.293	C	S	.	.			trans	-60.9	138.3	176.9	-22.2	31.7	0	0	0	113.7	V41 L49 T76 L102 H106	P39-V41 HydrophobicContact CB-CG1 4.28Å; P39-L49 HydrophobicContact CB-CD1 4.5Å; P39-L49 HydrophobicContact CB-CD2 4.42Å; P39-L49 HydrophobicContact CG-CD1 4.11Å; P39-L49 WeakPolarHBondContact O-CD2 3.32Å; P39-T76 PolarHBondContact O-OG1 2.81Å; P39-L102 HydrophobicContact CG-CD2 3.62Å; P39-H106 HydrophobicContact CG-CB 4.48Å
40	V	88.4	Confident	87.8	Confident	83 Å²	83	49.4 Å²	49.4	50%	0.503	29%	0.294	S	S	.	.			trans	-80.3	114.5	169.5	177.9	0	0	0	0	108.8	Q75 T76	V40-Q75 HydrophobicContact CG1-CB 4.15Å; V40-T76 WeakPolarHBondContact CA-OG1 3.39Å; V40-T76 WeakPolarHBondContact CG1-O 3.33Å; V40-T76 WeakPolarHBondContact CG2-O 3.45Å
41	V	87	Confident	88.5	Confident	22 Å²	22	55.7 Å²	55.7	13%	0.133	31%	0.312	C	S	.	.			trans	-128.1	142.4	-178.1	-62.2	0	0	0	0	111.3	P39 K45 L49 Q75 T76	P39-V41 HydrophobicContact CB-CG1 4.28Å; V41-K45 HydrophobicContact CB-CB 4.09Å; V41-K45 HydrophobicContact CG1-CB 4.41Å; V41-L49 HydrophobicContact CB-CD2 4.41Å; V41-L49 HydrophobicContact CG1-CD2 4.02Å; V41-L49 HydrophobicContact CG2-CB 4.08Å; V41-L49 HydrophobicContact CG2-CD2 3.5Å; V41-L49 VanDerWaalsContact CG2-CD2 3.5Å; V41-L49 HydrophobicContact CG2-CG 4.43Å; V41-Q75 WeakPolarHBondContact O-CA 3.41Å; V41-T76 HydrophobicContact CG2-CG2 3.91Å; V41-T76 PolarHBondContact N-OG1 3.39Å; V41-T76 PolarHBondContact O-N 2.99Å; V41-T76 VanDerWaalsContact O-N 3.09Å
42	G	86.1	Confident	88.8	Confident	27 Å²	27	59.9 Å²	59.9	28%	0.278	33%	0.327	S	S	.	.			trans	-75	173.3	170.6	0	0	0	0	0	113.3	A44 K45 F46	G42-A44 VanDerWaalsContact C-N 3.27Å; G42-A44 PolarHBondContact O-N 2.92Å; G42-A44 VanDerWaalsContact O-N 3.11Å; G42-K45 PolarHBondContact O-N 3.4Å; G42-F46 PolarHBondContact O-N 3.38Å
43	P	84.4	Confident	88.8	Confident	89 Å²	89	59.3 Å²	59.3	58%	0.578	32%	0.324	S	S	*	.	H	α-helix	trans	-59.4	-31.9	-168.8	20.6	-32.8	0	0	0	114.1	K45 F46	P43-K45 VanDerWaalsContact C-N 3.28Å; P43-K45 PolarHBondContact O-N 3.39Å; P43-F46 PolarHBondContact O-N 3.3Å
44	A	85.5	Confident	88.8	Confident	105 Å²	105	60.7 Å²	60.7	87%	0.868	33%	0.331	S	S	*	.	H	α-helix	trans	-65.1	-28.1	179.2	0	0	0	0	0	113.9	G42	G42-A44 VanDerWaalsContact C-N 3.27Å; G42-A44 PolarHBondContact O-N 2.92Å; G42-A44 VanDerWaalsContact O-N 3.11Å
45	K	86.8	Confident	88.8	Confident	147 Å²	147	64.4 Å²	64.4	64%	0.639	35%	0.351	S	S	*	.	H	α-helix	trans	-105.9	-5.7	-179	-68.5	-176.2	-178.9	179.3	0	113.1	V41 G42 P43 E47 L48 L49	V41-K45 HydrophobicContact CB-CB 4.09Å; V41-K45 HydrophobicContact CG1-CB 4.41Å; G42-K45 PolarHBondContact O-N 3.4Å; P43-K45 VanDerWaalsContact C-N 3.28Å; P43-K45 PolarHBondContact O-N 3.39Å; K45-E47 PolarHBondContact O-N 2.89Å; K45-L48 PolarHBondContact O-N 2.74Å; K45-L49 PolarHBondContact O-N 3.46Å; K45-L49 VanDerWaalsContact O-N 3.1Å
46	F	87.7	Confident	88.7	Confident	32 Å²	32	66.9 Å²	66.9	14%	0.14	36%	0.362	C	S	.	.	H	α-helix	trans	-58.1	-50.5	-174.7	177.3	-111.7	0	0	0	112.9	G42 P43 L48 L49 K50 F68 L70 T76	G42-F46 PolarHBondContact O-N 3.38Å; P43-F46 PolarHBondContact O-N 3.3Å; F46-L48 VanDerWaalsContact C-N 3.28Å; F46-L48 PolarHBondContact O-N 2.88Å; F46-L49 PolarHBondContact O-N 2.94Å; F46-K50 HydrophobicContact CE1-CD 4.31Å; F46-K50 HydrophobicContact CZ-CD 4.47Å; F46-K50 WeakPolarHBondContact O-CB 3.3Å; F46-K50 PolarHBondContact O-N 3.31Å; F46-F68 HydrophobicContact CE2-CB 3.7Å; F46-F68 HydrophobicContact CE2-CD1 4.16Å; F46-F68 HydrophobicContact CE2-CG 4.11Å; F46-F68 HydrophobicContact CZ-CB 3.75Å; F46-F68 HydrophobicContact CZ-CG 4.2Å; F46-L70 HydrophobicContact CD2-CD2 4.16Å; F46-L70 HydrophobicContact CE2-CD2 3.91Å; F46-L70 HydrophobicContact CZ-CD2 4.39Å; F46-T76 HydrophobicContact CD2-CG2 3.35Å; F46-T76 HydrophobicContact CE2-CG2 3.53Å
47	E	88.3	Confident	88.8	Confident	120 Å²	120	63.4 Å²	63.4	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-62.9	-34	-179.2	-75.8	-59.3	147.7	0	0	113	K45 K51	K45-E47 PolarHBondContact O-N 2.89Å; E47-K51 WeakPolarHBondContact O-CB 3.45Å; E47-K51 PolarHBondContact O-N 3.13Å; E47-K51 VanDerWaalsContact O-N 3.07Å
48	L	89.4	Confident	88.9	Confident	138 Å²	138	65 Å²	65	72%	0.723	35%	0.351	S	S	*	.	H	α-helix	trans	-68.9	-43.8	176.9	-162.9	79	0	0	0	111.3	K45 F46 F52	K45-L48 PolarHBondContact O-N 2.74Å; F46-L48 VanDerWaalsContact C-N 3.28Å; F46-L48 PolarHBondContact O-N 2.88Å; L48-F52 WeakPolarHBondContact O-CB 3.36Å; L48-F52 PolarHBondContact O-N 3.49Å; L48-F52 VanDerWaalsContact O-N 3.09Å
49	L	87.9	Confident	88.9	Confident	19 Å²	19	72.3 Å²	72.3	10%	0.099	38%	0.382	C	S	.	.	H	α-helix	trans	-65.1	-44.9	177.1	-178.2	66.7	0	0	0	111.2	P39 V41 K45 F46 K51 F52 L53	P39-L49 HydrophobicContact CB-CD1 4.5Å; P39-L49 HydrophobicContact CB-CD2 4.42Å; P39-L49 HydrophobicContact CG-CD1 4.11Å; P39-L49 WeakPolarHBondContact O-CD2 3.32Å; V41-L49 HydrophobicContact CB-CD2 4.41Å; V41-L49 HydrophobicContact CG1-CD2 4.02Å; V41-L49 HydrophobicContact CG2-CB 4.08Å; V41-L49 HydrophobicContact CG2-CD2 3.5Å; V41-L49 VanDerWaalsContact CG2-CD2 3.5Å; V41-L49 HydrophobicContact CG2-CG 4.43Å; K45-L49 PolarHBondContact O-N 3.46Å; K45-L49 VanDerWaalsContact O-N 3.1Å; F46-L49 PolarHBondContact O-N 2.94Å; L49-K51 PolarHBondContact O-N 2.87Å; L49-F52 PolarHBondContact O-N 2.86Å; L49-L53 HydrophobicContact CD1-CD1 3.82Å; L49-L53 HydrophobicContact CD1-CG 4.02Å; L49-L53 HydrophobicContact CD2-CD1 4.27Å; L49-L53 HydrophobicContact CG-CD1 3.76Å; L49-L53 HydrophobicContact CG-CG 4.29Å; L49-L53 WeakPolarHBondContact O-CG 3.18Å; L49-L53 PolarHBondContact O-N 3.4Å
50	K	90.2	Very high	88.9	Confident	54 Å²	54	72.9 Å²	72.9	24%	0.235	38%	0.384	C	S	.	.	H	α-helix	trans	-55.7	-51.5	177.6	-177.5	-176.8	-173.9	-173.9	0	111.2	F46 F52 L53 L54 H66 F68	F46-K50 HydrophobicContact CE1-CD 4.31Å; F46-K50 HydrophobicContact CZ-CD 4.47Å; F46-K50 WeakPolarHBondContact O-CB 3.3Å; F46-K50 PolarHBondContact O-N 3.31Å; K50-F52 VanDerWaalsContact C-N 3.34Å; K50-F52 PolarHBondContact O-N 3.38Å; K50-L53 PolarHBondContact O-N 3.13Å; K50-L54 HydrophobicContact CG-CD1 3.92Å; K50-L54 WeakPolarHBondContact O-CB 3.39Å; K50-L54 VanDerWaalsContact O-CG 3.31Å; K50-L54 WeakPolarHBondContact O-CG 3.37Å; K50-L54 PolarHBondContact O-N 3.14Å; K50-H66 VanDerWaalsContact CE-NE2 3.33Å; K50-H66 WeakPolarHBondContact CE-NE2 3.31Å; K50-F68 HydrophobicContact CB-CE1 4.37Å; K50-F68 HydrophobicContact CB-CZ 4.25Å; K50-F68 HydrophobicContact CG-CD2 4.28Å; K50-F68 HydrophobicContact CG-CE1 4.42Å; K50-F68 HydrophobicContact CG-CE2 3.79Å; K50-F68 HydrophobicContact CG-CZ 3.87Å
51	K	90.9	Very high	88.8	Confident	165 Å²	165	69.5 Å²	69.5	72%	0.717	37%	0.366	S	S	*	.	H	α-helix	trans	-61	-42.5	178.3	-172	176.2	-180	177.7	0	112	E47 L49 D55	E47-K51 WeakPolarHBondContact O-CB 3.45Å; E47-K51 PolarHBondContact O-N 3.13Å; E47-K51 VanDerWaalsContact O-N 3.07Å; L49-K51 PolarHBondContact O-N 2.87Å; K51-D55 VanDerWaalsContact O-CB 3.31Å; K51-D55 WeakPolarHBondContact O-CB 3.19Å; K51-D55 PolarHBondContact O-N 2.93Å
52	F	91.4	Very high	88.8	Confident	109 Å²	109	72 Å²	72	48%	0.478	38%	0.382	S	S	.	.	H	α-helix	trans	-66.2	-43.7	-179.6	177.1	-111.4	0	0	0	113.3	L48 L49 K50 K56 L102	L48-F52 WeakPolarHBondContact O-CB 3.36Å; L48-F52 PolarHBondContact O-N 3.49Å; L48-F52 VanDerWaalsContact O-N 3.09Å; L49-F52 PolarHBondContact O-N 2.86Å; K50-F52 VanDerWaalsContact C-N 3.34Å; K50-F52 PolarHBondContact O-N 3.38Å; F52-K56 PolarHBondContact O-N 2.84Å; F52-K56 VanDerWaalsContact O-N 3.17Å; F52-L102 HydrophobicContact CD1-CD1 4.46Å; F52-L102 HydrophobicContact CE1-CD1 3.43Å; F52-L102 VanDerWaalsContact CE1-CD1 3.43Å; F52-L102 HydrophobicContact CE1-CD2 4.45Å; F52-L102 HydrophobicContact CE1-CG 4.26Å; F52-L102 HydrophobicContact CZ-CD1 4.02Å
53	L	89.9	Confident	89	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-68.6	-45.2	179.2	-69.3	175.1	0	0	0	111.2	C38 L49 K50 D55 K56 F57 F68 I80 L102 F108	C38-L53 HydrophobicContact CB-CD1 4.21Å; L49-L53 HydrophobicContact CD1-CD1 3.82Å; L49-L53 HydrophobicContact CD1-CG 4.02Å; L49-L53 HydrophobicContact CD2-CD1 4.27Å; L49-L53 HydrophobicContact CG-CD1 3.76Å; L49-L53 HydrophobicContact CG-CG 4.29Å; L49-L53 WeakPolarHBondContact O-CG 3.18Å; L49-L53 PolarHBondContact O-N 3.4Å; K50-L53 PolarHBondContact O-N 3.13Å; L53-D55 VanDerWaalsContact C-N 3.34Å; L53-D55 PolarHBondContact O-N 3.4Å; L53-K56 PolarHBondContact O-N 3.24Å; L53-K56 VanDerWaalsContact O-N 3.11Å; L53-F57 VanDerWaalsContact O-CD2 3.31Å; L53-F57 WeakPolarHBondContact O-CD2 3.25Å; L53-F57 PolarHBondContact O-N 2.85Å; L53-F68 HydrophobicContact CD1-CE1 4.05Å; L53-I80 HydrophobicContact CB-CD1 4.36Å; L53-I80 HydrophobicContact CD1-CD1 4.26Å; L53-L102 HydrophobicContact CD2-CD2 4.47Å; L53-F108 HydrophobicContact CD2-CE1 3.83Å; L53-F108 HydrophobicContact CD2-CZ 3.46Å; L53-F108 VanDerWaalsContact CD2-CZ 3.46Å
54	L	91.9	Very high	89.2	Confident	30 Å²	30	73.1 Å²	73.1	16%	0.157	38%	0.381	C	S	.	.	H	α-helix	trans	-63.3	-37.8	177.4	-67.2	173.8	0	0	0	112.5	K50 K56 F57 S58 I63 H66 F68	K50-L54 HydrophobicContact CG-CD1 3.92Å; K50-L54 WeakPolarHBondContact O-CB 3.39Å; K50-L54 VanDerWaalsContact O-CG 3.31Å; K50-L54 WeakPolarHBondContact O-CG 3.37Å; K50-L54 PolarHBondContact O-N 3.14Å; L54-K56 VanDerWaalsContact C-N 3.28Å; L54-K56 PolarHBondContact O-N 2.85Å; L54-F57 PolarHBondContact O-N 2.78Å; L54-S58 WeakPolarHBondContact O-CB 3.26Å; L54-S58 PolarHBondContact O-N 3.4Å; L54-S58 PolarHBondContact O-OG 3.46Å; L54-I63 HydrophobicContact CD2-CD1 3.84Å; L54-H66 HydrophobicContact CD2-CB 3.7Å; L54-F68 HydrophobicContact CD1-CE2 4.44Å; L54-F68 HydrophobicContact CD2-CE2 4.35Å; L54-F68 HydrophobicContact CD2-CZ 4.47Å; L54-F68 HydrophobicContact CG-CE2 4.36Å; L54-F68 HydrophobicContact CG-CZ 4.26Å
55	D	91.4	Very high	89.4	Confident	96 Å²	96	72.6 Å²	72.6	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-65.8	-31.3	174.5	-168.3	60	0	0	0	112.4	K51 L53 S58 K59	K51-D55 VanDerWaalsContact O-CB 3.31Å; K51-D55 WeakPolarHBondContact O-CB 3.19Å; K51-D55 PolarHBondContact O-N 2.93Å; L53-D55 VanDerWaalsContact C-N 3.34Å; L53-D55 PolarHBondContact O-N 3.4Å; D55-S58 WeakPolarHBondContact CA-OG 3.24Å; D55-S58 PolarHBondContact O-OG 3.18Å; D55-K59 WeakPolarHBondContact O-CE 3.41Å
56	K	90.5	Very high	89.6	Confident	52 Å²	52	68.6 Å²	68.6	23%	0.226	35%	0.346	C	S	.	.	H	α-helix	trans	-74.4	-41.2	176.8	-155.9	176.7	-179.3	-176.9	0	112.2	F52 L53 L54 M97 F108	F52-K56 PolarHBondContact O-N 2.84Å; F52-K56 VanDerWaalsContact O-N 3.17Å; L53-K56 PolarHBondContact O-N 3.24Å; L53-K56 VanDerWaalsContact O-N 3.11Å; L54-K56 VanDerWaalsContact C-N 3.28Å; L54-K56 PolarHBondContact O-N 2.85Å; K56-M97 HydrophobicContact CB-CE 4.39Å; K56-M97 HydrophobicContact CD-CE 3.82Å; K56-M97 HydrophobicContact CG-CE 3.7Å; K56-F108 HydrophobicContact CD-CE2 4.12Å
57	F	91.2	Very high	89.7	Confident	1 Å²	1	72.7 Å²	72.7	0%	0.004	37%	0.366	C	S	.	.	H	α-helix	trans	-82.1	-30.6	-178.4	-79.6	-78.4	0	0	0	113.7	V35 L53 L54 K59 I60 I63 I80 I82 Y84 M97 V110	V35-F57 HydrophobicContact CB-CZ 4.1Å; V35-F57 HydrophobicContact CG1-CE2 3.95Å; V35-F57 HydrophobicContact CG1-CZ 3.57Å; V35-F57 HydrophobicContact CG2-CE1 3.68Å; V35-F57 HydrophobicContact CG2-CE2 3.99Å; V35-F57 HydrophobicContact CG2-CZ 3.38Å; L53-F57 VanDerWaalsContact O-CD2 3.31Å; L53-F57 WeakPolarHBondContact O-CD2 3.25Å; L53-F57 PolarHBondContact O-N 2.85Å; L54-F57 PolarHBondContact O-N 2.78Å; F57-K59 PolarHBondContact O-N 3.07Å; F57-K59 VanDerWaalsContact O-N 3.12Å; F57-I60 HydrophobicContact CD1-CD1 4.13Å; F57-I60 PolarHBondContact O-N 3.12Å; F57-I63 HydrophobicContact CB-CD1 4.08Å; F57-I80 HydrophobicContact CE2-CD1 4.35Å; F57-I82 HydrophobicContact CB-CD1 3.57Å; F57-I82 HydrophobicContact CD1-CD1 3.94Å; F57-I82 HydrophobicContact CD2-CD1 3.48Å; F57-I82 VanDerWaalsContact CD2-CD1 3.48Å; F57-I82 HydrophobicContact CE2-CD1 4.15Å; F57-I82 HydrophobicContact CG-CD1 3.38Å; F57-Y84 WeakPolarHBondContact CD1-OH 3.26Å; F57-Y84 PolarHBondContact O-OH 3.46Å; F57-M97 HydrophobicContact CD1-CE 4.04Å; F57-M97 HydrophobicContact CD1-CG 4.17Å; F57-M97 HydrophobicContact CD2-CE 4.28Å; F57-M97 HydrophobicContact CE1-CB 3.76Å; F57-M97 HydrophobicContact CE1-CE 3.73Å; F57-M97 HydrophobicContact CE1-CG 3.74Å; F57-M97 HydrophobicContact CE2-CE 3.96Å; F57-M97 HydrophobicContact CG-CE 4.31Å; F57-M97 HydrophobicContact CZ-CB 4.23Å; F57-M97 HydrophobicContact CZ-CE 3.67Å; F57-M97 HydrophobicContact CZ-CG 4.41Å; F57-V110 HydrophobicContact CZ-CG2 4.44Å
58	S	91	Very high	89.9	Confident	53 Å²	53	68 Å²	68	37%	0.371	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.7	176.1	56.6	0	0	0	0	114	L54 D55 I60 G61	L54-S58 WeakPolarHBondContact O-CB 3.26Å; L54-S58 PolarHBondContact O-N 3.4Å; L54-S58 PolarHBondContact O-OG 3.46Å; D55-S58 WeakPolarHBondContact CA-OG 3.24Å; D55-S58 PolarHBondContact O-OG 3.18Å; S58-I60 PolarHBondContact O-N 2.85Å; S58-G61 WeakPolarHBondContact CA-O 3.48Å; S58-G61 PolarHBondContact O-N 2.86Å
59	K	89.4	Confident	89.9	Confident	159 Å²	159	62.2 Å²	62.2	69%	0.691	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.3	173.1	-68.6	176.2	-172.9	177.8	0	113.7	D55 F57	D55-K59 WeakPolarHBondContact O-CE 3.41Å; F57-K59 PolarHBondContact O-N 3.07Å; F57-K59 VanDerWaalsContact O-N 3.12Å
60	I	87.7	Confident	89.9	Confident	30 Å²	30	64.9 Å²	64.9	15%	0.154	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-35.2	-179.5	-62.4	147.7	0	0	0	110.8	F57 S58 Q92 A93 M97	F57-I60 HydrophobicContact CD1-CD1 4.13Å; F57-I60 PolarHBondContact O-N 3.12Å; S58-I60 PolarHBondContact O-N 2.85Å; I60-Q92 HydrophobicContact CG2-CB 4.14Å; I60-Q92 HydrophobicContact CG2-CG 4.11Å; I60-A93 HydrophobicContact CD1-CB 3.94Å; I60-A93 HydrophobicContact CG2-CB 4.01Å; I60-M97 HydrophobicContact CD1-CG 3.44Å; I60-M97 VanDerWaalsContact CD1-CG 3.44Å; I60-M97 HydrophobicContact CD1-SD 4.26Å
61	G	85.8	Confident	89.6	Confident	12 Å²	12	64.6 Å²	64.6	12%	0.124	33%	0.33	C	S	.	.	S	Bend	trans	-178.6	167.9	179.2	0	0	0	0	0	112.2	S58 I63 Y84	S58-G61 WeakPolarHBondContact CA-O 3.48Å; S58-G61 PolarHBondContact O-N 2.86Å; G61-I63 PolarHBondContact O-N 3.45Å; G61-Y84 WeakPolarHBondContact O-CE1 3.43Å
62	P	88.3	Confident	89.3	Confident	73 Å²	73	65 Å²	65	47%	0.474	34%	0.34	S	S	.	.			trans	-64	126.8	177.3	26.6	-32.5	0	0	0	110.6	E85	P62-E85 HydrophobicContact CG-CB 4.04Å; P62-E85 VanDerWaalsContact CG-OE2 3.22Å; P62-E85 WeakPolarHBondContact CG-OE2 3.21Å; P62-E85 PolarHBondContact O-N 2.84Å
63	I	89.5	Confident	88.8	Confident	41 Å²	41	66.7 Å²	66.7	21%	0.21	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.5	176.1	-60	174.2	0	0	0	107.5	L54 F57 G61 D65 H66 I82 Y84	L54-I63 HydrophobicContact CD2-CD1 3.84Å; F57-I63 HydrophobicContact CB-CD1 4.08Å; G61-I63 PolarHBondContact O-N 3.45Å; I63-D65 WeakPolarHBondContact CG2-O 3.12Å; I63-H66 HydrophobicContact CG2-CB 4.43Å; I63-I82 HydrophobicContact CB-CG2 4.38Å; I63-I82 HydrophobicContact CD1-CG2 3.91Å; I63-I82 HydrophobicContact CG1-CG2 3.8Å; I63-I82 HydrophobicContact CG2-CG2 3.8Å; I63-Y84 HydrophobicContact CG1-CD1 4.45Å; I63-Y84 HydrophobicContact CG1-CE1 4.09Å
64	V	89	Confident	88.4	Confident	100 Å²	100	73.5 Å²	73.5	61%	0.606	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	-42.6	178	176.1	0	0	0	0	110.5	T83 E85	V64-T83 PolarHBondContact N-O 3.48Å; V64-E85 HydrophobicContact CG2-CB 3.78Å; V64-E85 HydrophobicContact CG2-CG 4.33Å
65	D	89.5	Confident	88.1	Confident	94 Å²	94	75.2 Å²	75.2	50%	0.503	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	153.9	-179.1	-167.6	22.5	0	0	0	111.2	I63 T83	I63-D65 WeakPolarHBondContact CG2-O 3.12Å; D65-T83 PolarHBondContact N-O 3.44Å; D65-T83 PolarHBondContact O-N 2.92Å
66	H	90.4	Very high	87.9	Confident	62 Å²	62	71 Å²	71	29%	0.287	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	136.5	176.1	57.6	-96.2	0	0	0	111.1	K50 L54 I63 F68 F81	K50-H66 VanDerWaalsContact CE-NE2 3.33Å; K50-H66 WeakPolarHBondContact CE-NE2 3.31Å; L54-H66 HydrophobicContact CD2-CB 3.7Å; I63-H66 HydrophobicContact CG2-CB 4.43Å; H66-F68 HydrophobicContact CB-CE2 4.13Å; H66-F68 AromaticContact CD2-CD2 3.92Å; H66-F68 AromaticContact CD2-CE2 3.64Å; H66-F81 CarbonylContact C-O 3.39Å; H66-F81 VanDerWaalsContact CA-O 3.27Å; H66-F81 WeakPolarHBondContact CA-O 3.49Å
67	E	91	Very high	87.8	Confident	118 Å²	118	73.4 Å²	73.4	55%	0.551	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	131.3	176.2	-166.6	176.6	176.6	0	0	110.1	P69 F81	E67-P69 WeakPolarHBondContact O-CD 3.41Å; E67-F81 HydrophobicContact CB-CB 4.28Å; E67-F81 HydrophobicContact CB-CD2 4.31Å; E67-F81 PolarHBondContact N-O 3.05Å; E67-F81 PolarHBondContact O-N 3.34Å
68	F	91.5	Very high	87.7	Confident	21 Å²	21	73.7 Å²	73.7	9%	0.092	38%	0.378	C	S	.	.			trans	-116.7	93.4	177.2	-71.8	-106.9	0	0	0	108.6	F46 K50 L53 L54 H66 L70 I80	F46-F68 HydrophobicContact CE2-CB 3.7Å; F46-F68 HydrophobicContact CE2-CD1 4.16Å; F46-F68 HydrophobicContact CE2-CG 4.11Å; F46-F68 HydrophobicContact CZ-CB 3.75Å; F46-F68 HydrophobicContact CZ-CG 4.2Å; K50-F68 HydrophobicContact CB-CE1 4.37Å; K50-F68 HydrophobicContact CB-CZ 4.25Å; K50-F68 HydrophobicContact CG-CD2 4.28Å; K50-F68 HydrophobicContact CG-CE1 4.42Å; K50-F68 HydrophobicContact CG-CE2 3.79Å; K50-F68 HydrophobicContact CG-CZ 3.87Å; L53-F68 HydrophobicContact CD1-CE1 4.05Å; L54-F68 HydrophobicContact CD1-CE2 4.44Å; L54-F68 HydrophobicContact CD2-CE2 4.35Å; L54-F68 HydrophobicContact CD2-CZ 4.47Å; L54-F68 HydrophobicContact CG-CE2 4.36Å; L54-F68 HydrophobicContact CG-CZ 4.26Å; H66-F68 HydrophobicContact CB-CE2 4.13Å; H66-F68 AromaticContact CD2-CD2 3.92Å; H66-F68 AromaticContact CD2-CE2 3.64Å; F68-L70 PolarHBondContact O-N 3.17Å; F68-I80 HydrophobicContact CD1-CB 4.34Å; F68-I80 HydrophobicContact CD1-CG2 3.35Å; F68-I80 HydrophobicContact CE1-CB 4.32Å; F68-I80 HydrophobicContact CE1-CD1 4.46Å; F68-I80 HydrophobicContact CE1-CG2 3.47Å; F68-I80 VanDerWaalsContact CE1-CG2 3.47Å; F68-I80 HydrophobicContact CG-CG2 4.03Å; F68-I80 HydrophobicContact CZ-CD1 4.42Å; F68-I80 HydrophobicContact CZ-CG2 4.2Å
69	P	88.8	Confident	87.7	Confident	18 Å²	18	74.8 Å²	74.8	12%	0.117	37%	0.374	C	S	.	.			trans	-59.7	127.9	-179.6	-28.7	38.8	0	0	0	112.1	E67 K77 Y79 F81	E67-P69 WeakPolarHBondContact O-CD 3.41Å; P69-K77 HydrophobicContact CB-CB 4.4Å; P69-K77 HydrophobicContact CB-CD 4.04Å; P69-K77 HydrophobicContact CB-CG 4.47Å; P69-K77 PolarHBondContact O-N 2.84Å; P69-Y79 HydrophobicContact CB-CE2 3.86Å; P69-Y79 WeakPolarHBondContact CD-O 3.22Å; P69-Y79 HydrophobicContact CG-CD2 4Å; P69-Y79 HydrophobicContact CG-CE2 3.51Å; P69-F81 HydrophobicContact CG-CD2 3.99Å; P69-F81 HydrophobicContact CG-CE2 3.74Å
70	L	88	Confident	87.8	Confident	74 Å²	74	67.4 Å²	67.4	39%	0.387	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-104.9	147.3	177.1	-60.2	173.2	0	0	0	110.5	F46 F68 Q75 T76 K77	F46-L70 HydrophobicContact CD2-CD2 4.16Å; F46-L70 HydrophobicContact CE2-CD2 3.91Å; F46-L70 HydrophobicContact CZ-CD2 4.39Å; F68-L70 PolarHBondContact O-N 3.17Å; L70-Q75 CarbonylContact C-O 3.5Å; L70-Q75 VanDerWaalsContact CA-O 3.25Å; L70-Q75 WeakPolarHBondContact CA-O 3.32Å; L70-T76 HydrophobicContact CD2-CG2 3.9Å; L70-K77 WeakPolarHBondContact O-CE 3.38Å
71	D	84.8	Confident	88.1	Confident	48 Å²	48	68.4 Å²	68.4	26%	0.257	35%	0.346	S	S	.	.			trans	-81.4	180	170.8	73	10.7	0	0	0	112.3	E73 K74 Q75 K77	D71-E73 PolarHBondContact O-N 2.84Å; D71-E73 VanDerWaalsContact OD1-C 3.26Å; D71-E73 VanDerWaalsContact OD1-CA 3.31Å; D71-E73 WeakPolarHBondContact OD1-CA 3.37Å; D71-E73 PolarHBondContact OD1-N 3.44Å; D71-K74 PolarHBondContact O-N 3.41Å; D71-K74 VanDerWaalsContact O-N 3.08Å; D71-K74 PolarHBondContact OD1-N 2.7Å; D71-Q75 PolarHBondContact N-O 3.15Å; D71-Q75 PolarHBondContact OD1-N 3.08Å; D71-Q75 WeakPolarHBondContact OD2-CB 3.24Å; D71-K77 HydrophobicContact CB-CG 4.2Å
72	N	83.9	Confident	88.4	Confident	174 Å²	174	67.9 Å²	67.9	93%	0.93	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.4	-179.9	-64.9	-15.3	0	0	0	113
73	E	81.7	Confident	88.5	Confident	144 Å²	144	65.3 Å²	65.3	67%	0.673	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	7.9	177.4	-61.7	-172.3	177.7	0	0	112.8	D71 Q75	D71-E73 PolarHBondContact O-N 2.84Å; D71-E73 VanDerWaalsContact OD1-C 3.26Å; D71-E73 VanDerWaalsContact OD1-CA 3.31Å; D71-E73 WeakPolarHBondContact OD1-CA 3.37Å; D71-E73 PolarHBondContact OD1-N 3.44Å; E73-Q75 VanDerWaalsContact C-N 3.29Å; E73-Q75 HydrophobicContact CB-CG 4.22Å; E73-Q75 PolarHBondContact O-N 3.33Å; E73-Q75 PolarHBondContact OE2-NE2 3.43Å
74	K	82	Confident	88.6	Confident	143 Å²	143	63.5 Å²	63.5	62%	0.622	31%	0.313	S	S	*	.	S	Bend	trans	61.8	29.4	-174.5	-54.7	-177.2	177.9	-178.5	0	114	D71	D71-K74 PolarHBondContact O-N 3.41Å; D71-K74 VanDerWaalsContact O-N 3.08Å; D71-K74 PolarHBondContact OD1-N 2.7Å
75	Q	85	Confident	88.5	Confident	66 Å²	66	65.2 Å²	65.2	31%	0.308	32%	0.315	S	S	.	.			trans	-94.6	153	168	-45.3	-169.8	6.7	0	0	110.8	V40 V41 L70 D71 E73	V40-Q75 HydrophobicContact CG1-CB 4.15Å; V41-Q75 WeakPolarHBondContact O-CA 3.41Å; L70-Q75 CarbonylContact C-O 3.5Å; L70-Q75 VanDerWaalsContact CA-O 3.25Å; L70-Q75 WeakPolarHBondContact CA-O 3.32Å; D71-Q75 PolarHBondContact N-O 3.15Å; D71-Q75 PolarHBondContact OD1-N 3.08Å; D71-Q75 WeakPolarHBondContact OD2-CB 3.24Å; E73-Q75 VanDerWaalsContact C-N 3.29Å; E73-Q75 HydrophobicContact CB-CG 4.22Å; E73-Q75 PolarHBondContact O-N 3.33Å; E73-Q75 PolarHBondContact OE2-NE2 3.43Å
76	T	87.8	Confident	88.2	Confident	7 Å²	7	64 Å²	64	4%	0.043	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-72.4	133	178.1	51.9	0	0	0	0	112	P39 V40 V41 F46 L70 G78	P39-T76 PolarHBondContact O-OG1 2.81Å; V40-T76 WeakPolarHBondContact CA-OG1 3.39Å; V40-T76 WeakPolarHBondContact CG1-O 3.33Å; V40-T76 WeakPolarHBondContact CG2-O 3.45Å; V41-T76 HydrophobicContact CG2-CG2 3.91Å; V41-T76 PolarHBondContact N-OG1 3.39Å; V41-T76 PolarHBondContact O-N 2.99Å; V41-T76 VanDerWaalsContact O-N 3.09Å; F46-T76 HydrophobicContact CD2-CG2 3.35Å; F46-T76 HydrophobicContact CE2-CG2 3.53Å; L70-T76 HydrophobicContact CD2-CG2 3.9Å; T76-G78 PolarHBondContact O-N 2.85Å
77	K	87.4	Confident	87.9	Confident	103 Å²	103	62.3 Å²	62.3	45%	0.448	31%	0.308	S	S	.	.			trans	-72.2	1.5	-176.9	-69.6	-176.4	172.8	165.7	0	115.7	P69 L70 D71 Y79	P69-K77 HydrophobicContact CB-CB 4.4Å; P69-K77 HydrophobicContact CB-CD 4.04Å; P69-K77 HydrophobicContact CB-CG 4.47Å; P69-K77 PolarHBondContact O-N 2.84Å; L70-K77 WeakPolarHBondContact O-CE 3.38Å; D71-K77 HydrophobicContact CB-CG 4.2Å; K77-Y79 HydrophobicContact CB-CD1 4.04Å; K77-Y79 HydrophobicContact CB-CE1 3.49Å; K77-Y79 VanDerWaalsContact CB-CE1 3.49Å; K77-Y79 HydrophobicContact CD-CE1 4.22Å; K77-Y79 WeakPolarHBondContact CD-OH 3.25Å
78	G	88.6	Confident	87.7	Confident	8 Å²	8	65.2 Å²	65.2	8%	0.082	32%	0.318	C	S	.	.	S	Bend	trans	89	-2.2	176.7	0	0	0	0	0	115.7	G37 C38 T76	G37-G78 PolarHBondContact N-O 3.32Å; C38-G78 WeakPolarHBondContact CA-O 3.45Å; C38-G78 WeakPolarHBondContact CB-O 3.23Å; C38-G78 PolarHBondContact N-O 2.78Å; C38-G78 VanDerWaalsContact O-CA 3.32Å; C38-G78 WeakPolarHBondContact O-CA 3.29Å; T76-G78 PolarHBondContact O-N 2.85Å
79	Y	91.4	Very high	87.5	Confident	76 Å²	76	64.5 Å²	64.5	30%	0.298	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	157.2	171.9	57.5	-86.6	0	0	0	110.9	V35 P69 K77 F81	V35-Y79 CarbonylContact O-C 3.49Å; V35-Y79 VanDerWaalsContact O-CA 3.23Å; V35-Y79 WeakPolarHBondContact O-CA 3.43Å; P69-Y79 HydrophobicContact CB-CE2 3.86Å; P69-Y79 WeakPolarHBondContact CD-O 3.22Å; P69-Y79 HydrophobicContact CG-CD2 4Å; P69-Y79 HydrophobicContact CG-CE2 3.51Å; K77-Y79 HydrophobicContact CB-CD1 4.04Å; K77-Y79 HydrophobicContact CB-CE1 3.49Å; K77-Y79 VanDerWaalsContact CB-CE1 3.49Å; K77-Y79 HydrophobicContact CD-CE1 4.22Å; K77-Y79 WeakPolarHBondContact CD-OH 3.25Å; Y79-F81 AromaticContact CD2-CE2 3.93Å; Y79-F81 HydrophobicContact CD2-CE2 3.93Å; Y79-F81 HydrophobicContact CD2-CZ 4.09Å; Y79-F81 AromaticContact CE2-CE2 3.77Å; Y79-F81 HydrophobicContact CE2-CE2 3.77Å; Y79-F81 AromaticContact CE2-CZ 4Å; Y79-F81 HydrophobicContact CE2-CZ 4Å
80	I	92.3	Very high	87.5	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	151.7	178.4	65.1	171.1	0	0	0	110.3	V35 L53 F57 F68 I82	V35-I80 HydrophobicContact CB-CD1 4.09Å; V35-I80 HydrophobicContact CB-CG1 3.57Å; V35-I80 HydrophobicContact CG1-CD1 4.41Å; V35-I80 HydrophobicContact CG1-CG1 4.23Å; V35-I80 HydrophobicContact CG2-CD1 4.35Å; V35-I80 HydrophobicContact CG2-CG1 4.14Å; V35-I80 PolarHBondContact N-O 2.9Å; V35-I80 PolarHBondContact O-N 3.49Å; L53-I80 HydrophobicContact CB-CD1 4.36Å; L53-I80 HydrophobicContact CD1-CD1 4.26Å; F57-I80 HydrophobicContact CE2-CD1 4.35Å; F68-I80 HydrophobicContact CD1-CB 4.34Å; F68-I80 HydrophobicContact CD1-CG2 3.35Å; F68-I80 HydrophobicContact CE1-CB 4.32Å; F68-I80 HydrophobicContact CE1-CD1 4.46Å; F68-I80 HydrophobicContact CE1-CG2 3.47Å; F68-I80 VanDerWaalsContact CE1-CG2 3.47Å; F68-I80 HydrophobicContact CG-CG2 4.03Å; F68-I80 HydrophobicContact CZ-CD1 4.42Å; F68-I80 HydrophobicContact CZ-CG2 4.2Å; I80-I82 HydrophobicContact CD1-CD1 3.69Å; I80-I82 HydrophobicContact CD1-CG1 3.98Å; I80-I82 HydrophobicContact CG1-CD1 4.49Å; I80-I82 HydrophobicContact CG1-CG1 4.36Å
81	F	93	Very high	87.4	Confident	51 Å²	51	62.4 Å²	62.4	22%	0.224	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130.3	170.5	-58.8	-82.2	0	0	0	109.2	T32 V33 I34 H66 E67 P69 Y79 L113	T32-F81 HydrophobicContact CG2-CB 4.29Å; T32-F81 HydrophobicContact CG2-CD1 4.49Å; V33-F81 WeakPolarHBondContact O-CA 3.45Å; I34-F81 HydrophobicContact CB-CE1 4.49Å; I34-F81 HydrophobicContact CD1-CE1 4.04Å; I34-F81 HydrophobicContact CG1-CD1 3.85Å; I34-F81 HydrophobicContact CG1-CE1 3.69Å; I34-F81 HydrophobicContact CG2-CE1 4.29Å; H66-F81 CarbonylContact C-O 3.39Å; H66-F81 VanDerWaalsContact CA-O 3.27Å; H66-F81 WeakPolarHBondContact CA-O 3.49Å; E67-F81 HydrophobicContact CB-CB 4.28Å; E67-F81 HydrophobicContact CB-CD2 4.31Å; E67-F81 PolarHBondContact N-O 3.05Å; E67-F81 PolarHBondContact O-N 3.34Å; P69-F81 HydrophobicContact CG-CD2 3.99Å; P69-F81 HydrophobicContact CG-CE2 3.74Å; Y79-F81 AromaticContact CD2-CE2 3.93Å; Y79-F81 HydrophobicContact CD2-CE2 3.93Å; Y79-F81 HydrophobicContact CD2-CZ 4.09Å; Y79-F81 AromaticContact CE2-CE2 3.77Å; Y79-F81 HydrophobicContact CE2-CE2 3.77Å; Y79-F81 AromaticContact CE2-CZ 4Å; Y79-F81 HydrophobicContact CE2-CZ 4Å; F81-L113 HydrophobicContact CE1-CD1 4.26Å
82	I	92	Very high	87.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	118.3	176.1	-58.6	-178.9	0	0	0	108.1	T32 V33 V35 F57 I63 I80 Y84	T32-I82 WeakPolarHBondContact CA-O 3.49Å; V33-I82 PolarHBondContact N-O 2.94Å; V33-I82 PolarHBondContact O-N 3.41Å; V35-I82 HydrophobicContact CG2-CD1 4.36Å; F57-I82 HydrophobicContact CB-CD1 3.57Å; F57-I82 HydrophobicContact CD1-CD1 3.94Å; F57-I82 HydrophobicContact CD2-CD1 3.48Å; F57-I82 VanDerWaalsContact CD2-CD1 3.48Å; F57-I82 HydrophobicContact CE2-CD1 4.15Å; F57-I82 HydrophobicContact CG-CD1 3.38Å; I63-I82 HydrophobicContact CB-CG2 4.38Å; I63-I82 HydrophobicContact CD1-CG2 3.91Å; I63-I82 HydrophobicContact CG1-CG2 3.8Å; I63-I82 HydrophobicContact CG2-CG2 3.8Å; I80-I82 HydrophobicContact CD1-CD1 3.69Å; I80-I82 HydrophobicContact CD1-CG1 3.98Å; I80-I82 HydrophobicContact CG1-CD1 4.49Å; I80-I82 HydrophobicContact CG1-CG1 4.36Å; I82-Y84 HydrophobicContact CG2-CD2 4.28Å; I82-Y84 HydrophobicContact CG2-CE2 3.85Å
83	T	92.1	Very high	87.8	Confident	19 Å²	19	57 Å²	57	12%	0.117	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.4	175.5	-56.7	0	0	0	0	109.2	H28 T32 V64 D65	H28-T83 HydrophobicContact CB-CG2 4.39Å; T32-T83 PolarHBondContact OG1-OG1 3.41Å; V64-T83 PolarHBondContact N-O 3.48Å; D65-T83 PolarHBondContact N-O 3.44Å; D65-T83 PolarHBondContact O-N 2.92Å
84	Y	91.4	Very high	88.2	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.012	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	159.9	173.2	-70.6	-83.9	0	0	0	111.1	S31 V33 F57 G61 I63 I82 N86 A89 A90 A93	S31-Y84 WeakPolarHBondContact CB-O 3.36Å; S31-Y84 PolarHBondContact O-N 3.43Å; V33-Y84 HydrophobicContact CG2-CD2 4.1Å; V33-Y84 HydrophobicContact CG2-CE2 4.01Å; F57-Y84 WeakPolarHBondContact CD1-OH 3.26Å; F57-Y84 PolarHBondContact O-OH 3.46Å; G61-Y84 WeakPolarHBondContact O-CE1 3.43Å; I63-Y84 HydrophobicContact CG1-CD1 4.45Å; I63-Y84 HydrophobicContact CG1-CE1 4.09Å; I82-Y84 HydrophobicContact CG2-CD2 4.28Å; I82-Y84 HydrophobicContact CG2-CE2 3.85Å; Y84-N86 PolarHBondContact O-N 2.84Å; Y84-A89 HydrophobicContact CD1-CB 3.93Å; Y84-A89 HydrophobicContact CG-CB 3.98Å; Y84-A90 HydrophobicContact CD2-CB 4.04Å; Y84-A93 HydrophobicContact CE2-CB 3.71Å
85	E	85.7	Confident	88.5	Confident	136 Å²	136	55.1 Å²	55.1	64%	0.636	26%	0.262	S	S	*	.	S	Bend	trans	-63.1	-28.3	175	-169.4	179.1	-167.1	0	0	112.8	P62 V64	P62-E85 HydrophobicContact CG-CB 4.04Å; P62-E85 VanDerWaalsContact CG-OE2 3.22Å; P62-E85 WeakPolarHBondContact CG-OE2 3.21Å; P62-E85 PolarHBondContact O-N 2.84Å; V64-E85 HydrophobicContact CG2-CB 3.78Å; V64-E85 HydrophobicContact CG2-CG 4.33Å
86	N	84.2	Confident	88.7	Confident	70 Å²	70	55.8 Å²	55.8	37%	0.374	27%	0.27	S	S	.	.	S	Bend	trans	-138.5	149	-179.9	70.3	55.8	0	0	0	112.8	Y84 K88 A89 A90	Y84-N86 PolarHBondContact O-N 2.84Å; N86-K88 PolarHBondContact O-N 3.47Å; N86-K88 WeakPolarHBondContact OD1-CB 3.45Å; N86-K88 PolarHBondContact OD1-N 3.44Å; N86-A89 PolarHBondContact O-N 2.83Å; N86-A89 WeakPolarHBondContact OD1-CB 3.31Å; N86-A89 PolarHBondContact OD1-N 2.94Å; N86-A90 PolarHBondContact O-N 3.25Å
87	G	84.4	Confident	88.7	Confident	26 Å²	26	56.1 Å²	56.1	27%	0.268	27%	0.271	S	S	.	.	H	α-helix	trans	-67.2	-17.7	178.7	0	0	0	0	0	114.7	G30 S31 S91	G30-G87 VanDerWaalsContact O-CA 3.26Å; G30-G87 WeakPolarHBondContact O-CA 3.17Å; S31-G87 PolarHBondContact OG-N 3.27Å; G87-S91 WeakPolarHBondContact O-CB 3.06Å; G87-S91 PolarHBondContact O-N 3.4Å; G87-S91 PolarHBondContact O-OG 2.94Å
88	K	85.8	Confident	88.8	Confident	179 Å²	179	54 Å²	54	78%	0.778	27%	0.265	S	S	*	.	H	α-helix	trans	-69.2	-42	173.5	-73.4	-175.6	-179.8	176.7	0	111.4	N86 S91 Q92	N86-K88 PolarHBondContact O-N 3.47Å; N86-K88 WeakPolarHBondContact OD1-CB 3.45Å; N86-K88 PolarHBondContact OD1-N 3.44Å; K88-S91 PolarHBondContact O-N 3.44Å; K88-Q92 VanDerWaalsContact O-CB 3.31Å; K88-Q92 WeakPolarHBondContact O-CB 3.39Å; K88-Q92 PolarHBondContact O-N 2.86Å
89	A	87.8	Confident	88.8	Confident	6 Å²	6	58.9 Å²	58.9	5%	0.05	29%	0.289	C	S	.	.	H	α-helix	trans	-66.8	-41.6	176.8	0	0	0	0	0	110.1	Y84 N86 Q92 A93	Y84-A89 HydrophobicContact CD1-CB 3.93Å; Y84-A89 HydrophobicContact CG-CB 3.98Å; N86-A89 PolarHBondContact O-N 2.83Å; N86-A89 WeakPolarHBondContact OD1-CB 3.31Å; N86-A89 PolarHBondContact OD1-N 2.94Å; A89-Q92 PolarHBondContact O-N 2.99Å; A89-A93 WeakPolarHBondContact O-CB 3.5Å; A89-A93 PolarHBondContact O-N 3.46Å
90	A	88.2	Confident	88.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59	-47.7	172.1	0	0	0	0	0	112.2	S31 V33 Y84 N86 Q92 A93 V94 L112	S31-A90 WeakPolarHBondContact O-CB 3.11Å; V33-A90 HydrophobicContact CG2-CB 3.57Å; Y84-A90 HydrophobicContact CD2-CB 4.04Å; N86-A90 PolarHBondContact O-N 3.25Å; A90-Q92 VanDerWaalsContact C-N 3.33Å; A90-Q92 PolarHBondContact O-N 2.94Å; A90-A93 WeakPolarHBondContact O-CB 3.44Å; A90-A93 PolarHBondContact O-N 3.33Å; A90-V94 PolarHBondContact O-N 3.35Å; A90-L112 HydrophobicContact CB-CD2 3.7Å
91	S	86.4	Confident	88.4	Confident	48 Å²	48	61.1 Å²	61.1	34%	0.336	31%	0.312	S	S	.	.	H	α-helix	trans	-63.6	-37.2	176.3	-64.2	0	0	0	0	112.8	G87 K88 R95	G87-S91 WeakPolarHBondContact O-CB 3.06Å; G87-S91 PolarHBondContact O-N 3.4Å; G87-S91 PolarHBondContact O-OG 2.94Å; K88-S91 PolarHBondContact O-N 3.44Å; S91-R95 WeakPolarHBondContact O-CG 3.44Å; S91-R95 PolarHBondContact O-N 2.58Å; S91-R95 VanDerWaalsContact O-N 3.15Å
92	Q	88.3	Confident	88.1	Confident	109 Å²	109	60.5 Å²	60.5	51%	0.509	31%	0.311	S	S	.	.	H	α-helix	trans	-69.3	-38.7	175.5	-172.4	172.7	-13.3	0	0	111	I60 K88 A89 A90 V94 R95 T96	I60-Q92 HydrophobicContact CG2-CB 4.14Å; I60-Q92 HydrophobicContact CG2-CG 4.11Å; K88-Q92 VanDerWaalsContact O-CB 3.31Å; K88-Q92 WeakPolarHBondContact O-CB 3.39Å; K88-Q92 PolarHBondContact O-N 2.86Å; A89-Q92 PolarHBondContact O-N 2.99Å; A90-Q92 VanDerWaalsContact C-N 3.33Å; A90-Q92 PolarHBondContact O-N 2.94Å; Q92-V94 PolarHBondContact O-N 3.19Å; Q92-R95 PolarHBondContact O-N 2.67Å; Q92-R95 VanDerWaalsContact O-N 3.15Å; Q92-T96 WeakPolarHBondContact O-CB 3.45Å; Q92-T96 PolarHBondContact O-N 3.17Å; Q92-T96 PolarHBondContact O-OG1 3.22Å; Q92-T96 VanDerWaalsContact O-OG1 3.1Å
93	A	89.2	Confident	87.8	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.7	-44.5	176	0	0	0	0	0	111.6	I60 Y84 A89 A90 R95 T96 M97	I60-A93 HydrophobicContact CD1-CB 3.94Å; I60-A93 HydrophobicContact CG2-CB 4.01Å; Y84-A93 HydrophobicContact CE2-CB 3.71Å; A89-A93 WeakPolarHBondContact O-CB 3.5Å; A89-A93 PolarHBondContact O-N 3.46Å; A90-A93 WeakPolarHBondContact O-CB 3.44Å; A90-A93 PolarHBondContact O-N 3.33Å; A93-R95 VanDerWaalsContact C-N 3.34Å; A93-R95 PolarHBondContact O-N 2.64Å; A93-T96 PolarHBondContact O-N 3.35Å; A93-M97 VanDerWaalsContact O-CB 3.28Å; A93-M97 WeakPolarHBondContact O-CB 3.18Å; A93-M97 PolarHBondContact O-N 3.27Å
94	V	90	Very high	87.4	Confident	27 Å²	27	72.9 Å²	72.9	16%	0.164	37%	0.367	C	S	.	.	H	α-helix	trans	-57.2	-47.1	171.6	170.6	0	0	0	0	111.2	V33 A90 Q92 T96 N98 V110 L112	V33-V94 HydrophobicContact CG1-CG2 4.14Å; A90-V94 PolarHBondContact O-N 3.35Å; Q92-V94 PolarHBondContact O-N 3.19Å; V94-T96 PolarHBondContact O-N 3.33Å; V94-N98 WeakPolarHBondContact O-CB 3.31Å; V94-N98 PolarHBondContact O-N 2.84Å; V94-V110 HydrophobicContact CB-CG1 4.47Å; V94-V110 WeakPolarHBondContact CG1-O 3.48Å; V94-V110 HydrophobicContact CG2-CG1 4Å; V94-L112 HydrophobicContact CG2-CG 4Å
95	R	87.7	Confident	87.1	Confident	220 Å²	220	79.4 Å²	79.4	83%	0.83	40%	0.402	S	S	*	.	H	α-helix	trans	-66.4	-36.2	-178.1	-73.3	177.6	-178.9	-172.8	1.3	113.6	S91 Q92 A93	S91-R95 WeakPolarHBondContact O-CG 3.44Å; S91-R95 PolarHBondContact O-N 2.58Å; S91-R95 VanDerWaalsContact O-N 3.15Å; Q92-R95 PolarHBondContact O-N 2.67Å; Q92-R95 VanDerWaalsContact O-N 3.15Å; A93-R95 VanDerWaalsContact C-N 3.34Å; A93-R95 PolarHBondContact O-N 2.64Å
96	T	89.1	Confident	87.2	Confident	80 Å²	80	75.3 Å²	75.3	49%	0.491	38%	0.383	S	S	.	.	H	α-helix	trans	-91.7	-34.4	-172.6	-55.3	0	0	0	0	112.9	Q92 A93 V94 V100	Q92-T96 WeakPolarHBondContact O-CB 3.45Å; Q92-T96 PolarHBondContact O-N 3.17Å; Q92-T96 PolarHBondContact O-OG1 3.22Å; Q92-T96 VanDerWaalsContact O-OG1 3.1Å; A93-T96 PolarHBondContact O-N 3.35Å; V94-T96 PolarHBondContact O-N 3.33Å; T96-V100 WeakPolarHBondContact O-CG2 3.27Å
97	M	88.7	Confident	87.4	Confident	13 Å²	13	74.9 Å²	74.9	6%	0.064	38%	0.383	C	S	.	.	H	α-helix	trans	-102.8	-14.7	-171.9	-64	-70.6	-83.6	0	0	114.1	K56 F57 I60 A93 N99 V100 F108 V110	K56-M97 HydrophobicContact CB-CE 4.39Å; K56-M97 HydrophobicContact CD-CE 3.82Å; K56-M97 HydrophobicContact CG-CE 3.7Å; F57-M97 HydrophobicContact CD1-CE 4.04Å; F57-M97 HydrophobicContact CD1-CG 4.17Å; F57-M97 HydrophobicContact CD2-CE 4.28Å; F57-M97 HydrophobicContact CE1-CB 3.76Å; F57-M97 HydrophobicContact CE1-CE 3.73Å; F57-M97 HydrophobicContact CE1-CG 3.74Å; F57-M97 HydrophobicContact CE2-CE 3.96Å; F57-M97 HydrophobicContact CG-CE 4.31Å; F57-M97 HydrophobicContact CZ-CB 4.23Å; F57-M97 HydrophobicContact CZ-CE 3.67Å; F57-M97 HydrophobicContact CZ-CG 4.41Å; I60-M97 HydrophobicContact CD1-CG 3.44Å; I60-M97 VanDerWaalsContact CD1-CG 3.44Å; I60-M97 HydrophobicContact CD1-SD 4.26Å; A93-M97 VanDerWaalsContact O-CB 3.28Å; A93-M97 WeakPolarHBondContact O-CB 3.18Å; A93-M97 PolarHBondContact O-N 3.27Å; M97-N99 PolarHBondContact O-N 3.38Å; M97-V100 WeakPolarHBondContact O-CB 3.35Å; M97-V100 WeakPolarHBondContact O-CG2 3.28Å; M97-V100 PolarHBondContact O-N 2.85Å; M97-F108 HydrophobicContact CE-CD2 4.35Å; M97-F108 HydrophobicContact CE-CE2 4.27Å; M97-V110 HydrophobicContact CB-CG2 3.89Å
98	N	89.4	Confident	87.8	Confident	60 Å²	60	73.7 Å²	73.7	32%	0.321	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	133.4	176.7	-168.1	26.5	0	0	0	111	V94 V100 Q109 V110	V94-N98 WeakPolarHBondContact O-CB 3.31Å; V94-N98 PolarHBondContact O-N 2.84Å; N98-V100 VanDerWaalsContact C-N 3.26Å; N98-V100 PolarHBondContact O-N 2.98Å; N98-Q109 WeakPolarHBondContact OD1-CA 3.49Å; N98-V110 HydrophobicContact CB-CB 4.06Å; N98-V110 PolarHBondContact OD1-N 3.28Å; N98-V110 VanDerWaalsContact OD1-N 3.07Å
99	N	87.8	Confident	88	Confident	109 Å²	109	70.3 Å²	70.3	58%	0.583	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	20.2	-172.8	-58.8	-54.2	0	0	0	115.6	M97 P101 F108	M97-N99 PolarHBondContact O-N 3.38Å; N99-P101 WeakPolarHBondContact O-CD 3.27Å; N99-F108 WeakPolarHBondContact CA-O 3.42Å; N99-F108 PolarHBondContact N-O 3.01Å
100	V	88.8	Confident	88.1	Confident	42 Å²	42	70 Å²	70	26%	0.255	36%	0.355	S	S	.	.			trans	-81.8	120.4	173	175.5	0	0	0	0	109.6	T96 M97 N98 F108	T96-V100 WeakPolarHBondContact O-CG2 3.27Å; M97-V100 WeakPolarHBondContact O-CB 3.35Å; M97-V100 WeakPolarHBondContact O-CG2 3.28Å; M97-V100 PolarHBondContact O-N 2.85Å; N98-V100 VanDerWaalsContact C-N 3.26Å; N98-V100 PolarHBondContact O-N 2.98Å; V100-F108 HydrophobicContact CB-CD2 4.43Å; V100-F108 PolarHBondContact O-N 3.15Å
101	P	87.5	Confident	88.2	Confident	85 Å²	85	73 Å²	73	55%	0.552	37%	0.373	S	S	*	.	B	Isolated β-bridge	trans	-69	133.1	175.7	27.8	-33	0	0	0	110.7	N99	N99-P101 WeakPolarHBondContact O-CD 3.27Å
102	L	86.2	Confident	88.3	Confident	38 Å²	38	71.7 Å²	71.7	20%	0.199	36%	0.362	C	S	.	.	S	Bend	trans	-88.1	-47.6	170.5	-169.4	67.1	0	0	0	110.7	P39 F52 L53 H106 F108	P39-L102 HydrophobicContact CG-CD2 3.62Å; F52-L102 HydrophobicContact CD1-CD1 4.46Å; F52-L102 HydrophobicContact CE1-CD1 3.43Å; F52-L102 VanDerWaalsContact CE1-CD1 3.43Å; F52-L102 HydrophobicContact CE1-CD2 4.45Å; F52-L102 HydrophobicContact CE1-CG 4.26Å; F52-L102 HydrophobicContact CZ-CD1 4.02Å; L53-L102 HydrophobicContact CD2-CD2 4.47Å; L102-H106 HydrophobicContact CB-CB 4.18Å; L102-H106 WeakPolarHBondContact CB-O 3.04Å; L102-H106 PolarHBondContact N-O 3.34Å; L102-F108 HydrophobicContact CB-CE1 4.19Å; L102-F108 HydrophobicContact CB-CE2 4.29Å; L102-F108 HydrophobicContact CB-CZ 3.9Å; L102-F108 HydrophobicContact CD1-CE1 4.34Å; L102-F108 HydrophobicContact CD1-CE2 3.79Å; L102-F108 HydrophobicContact CD1-CZ 3.39Å; L102-F108 HydrophobicContact CD2-CE1 4Å; L102-F108 HydrophobicContact CD2-CZ 3.83Å; L102-F108 HydrophobicContact CG-CE1 4.41Å; L102-F108 HydrophobicContact CG-CZ 3.9Å
103	D	84.4	Confident	88.2	Confident	74 Å²	74	68.4 Å²	68.4	40%	0.396	35%	0.348	S	S	.	.	S	Bend	trans	-146.1	-166.4	173.3	65.5	33.7	0	0	0	109.5	N105 H106	D103-N105 VanDerWaalsContact C-N 3.25Å; D103-N105 PolarHBondContact O-N 3.1Å; D103-N105 WeakPolarHBondContact OD1-CA 3.49Å; D103-N105 PolarHBondContact OD1-N 3.44Å; D103-H106 PolarHBondContact N-O 3.39Å; D103-H106 WeakPolarHBondContact OD1-CB 3.37Å; D103-H106 IonicContact OD1-CG 3.91Å; D103-H106 PolarHBondContact OD1-N 3.08Å; D103-H106 IonicContact OD1-ND1 2.75Å; D103-H106 PolarHBondContact OD1-ND1 2.8Å; D103-H106 IonicContact OD2-CE1 3.81Å; D103-H106 IonicContact OD2-CG 3.5Å; D103-H106 IonicContact OD2-ND1 2.93Å; D103-H106 PolarHBondContact OD2-ND1 3.44Å
104	K	84.5	Confident	87.9	Confident	205 Å²	205	70.3 Å²	70.3	89%	0.891	36%	0.362	S	S	*	.	S	Bend	trans	-66.2	-24.5	-179.2	-71.4	-175.5	177.5	-179.8	0	114.1
105	N	86.1	Confident	87.4	Confident	141 Å²	141	71.1 Å²	71.1	75%	0.754	37%	0.365	S	S	*	.	S	Bend	trans	-109.1	-20.8	-173	-64.7	-7	0	0	0	112.6	D103	D103-N105 VanDerWaalsContact C-N 3.25Å; D103-N105 PolarHBondContact O-N 3.1Å; D103-N105 WeakPolarHBondContact OD1-CA 3.49Å; D103-N105 PolarHBondContact OD1-N 3.44Å
106	H	86.3	Confident	86.9	Confident	50 Å²	50	66.2 Å²	66.2	23%	0.231	35%	0.35	C	S	.	.			trans	-117.7	114.3	-172.9	-57.6	104.1	0	0	0	110.2	G37 P39 L102 D103	G37-H106 WeakPolarHBondContact O-CB 3.3Å; P39-H106 HydrophobicContact CG-CB 4.48Å; L102-H106 HydrophobicContact CB-CB 4.18Å; L102-H106 WeakPolarHBondContact CB-O 3.04Å; L102-H106 PolarHBondContact N-O 3.34Å; D103-H106 PolarHBondContact N-O 3.39Å; D103-H106 WeakPolarHBondContact OD1-CB 3.37Å; D103-H106 IonicContact OD1-CG 3.91Å; D103-H106 PolarHBondContact OD1-N 3.08Å; D103-H106 IonicContact OD1-ND1 2.75Å; D103-H106 PolarHBondContact OD1-ND1 2.8Å; D103-H106 IonicContact OD2-CE1 3.81Å; D103-H106 IonicContact OD2-CG 3.5Å; D103-H106 IonicContact OD2-ND1 2.93Å; D103-H106 PolarHBondContact OD2-ND1 3.44Å
107	T	89.3	Confident	86.3	Confident	61 Å²	61	66.5 Å²	66.5	37%	0.374	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-120.5	127	172.6	-60.9	0	0	0	0	108.3	Q109	T107-Q109 PolarHBondContact O-N 3.27Å
108	F	91.5	Very high	85.6	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.372	C	S	.	.			trans	-68.2	130.4	-177	-63.2	-43.9	0	0	0	111.5	V35 D36 L53 K56 M97 N99 V100 L102 V110	V35-F108 HydrophobicContact CG1-CB 4.26Å; V35-F108 HydrophobicContact CG1-CD1 3.8Å; V35-F108 HydrophobicContact CG1-CE1 4.38Å; V35-F108 HydrophobicContact CG1-CG 4.14Å; D36-F108 WeakPolarHBondContact O-CA 3.44Å; L53-F108 HydrophobicContact CD2-CE1 3.83Å; L53-F108 HydrophobicContact CD2-CZ 3.46Å; L53-F108 VanDerWaalsContact CD2-CZ 3.46Å; K56-F108 HydrophobicContact CD-CE2 4.12Å; M97-F108 HydrophobicContact CE-CD2 4.35Å; M97-F108 HydrophobicContact CE-CE2 4.27Å; N99-F108 WeakPolarHBondContact CA-O 3.42Å; N99-F108 PolarHBondContact N-O 3.01Å; V100-F108 HydrophobicContact CB-CD2 4.43Å; V100-F108 PolarHBondContact O-N 3.15Å; L102-F108 HydrophobicContact CB-CE1 4.19Å; L102-F108 HydrophobicContact CB-CE2 4.29Å; L102-F108 HydrophobicContact CB-CZ 3.9Å; L102-F108 HydrophobicContact CD1-CE1 4.34Å; L102-F108 HydrophobicContact CD1-CE2 3.79Å; L102-F108 HydrophobicContact CD1-CZ 3.39Å; L102-F108 HydrophobicContact CD2-CE1 4Å; L102-F108 HydrophobicContact CD2-CZ 3.83Å; L102-F108 HydrophobicContact CG-CE1 4.41Å; L102-F108 HydrophobicContact CG-CZ 3.9Å; F108-V110 HydrophobicContact CB-CG2 3.95Å
109	Q	90	Very high	85	Confident	108 Å²	108	75.8 Å²	75.8	51%	0.505	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.6	166.2	-64.9	-173.1	8.7	0	0	107.8	D36 N98 T107	D36-Q109 HydrophobicContact CB-CB 4.29Å; D36-Q109 PolarHBondContact N-O 3.17Å; D36-Q109 PolarHBondContact O-N 3.01Å; N98-Q109 WeakPolarHBondContact OD1-CA 3.49Å; T107-Q109 PolarHBondContact O-N 3.27Å
110	V	91.2	Very high	84.6	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118.7	-169	-171.8	0	0	0	0	108.8	V33 I34 V35 F57 V94 M97 N98 F108	V33-V110 HydrophobicContact CG1-CG1 3.16Å; I34-V110 WeakPolarHBondContact O-CA 3.37Å; V35-V110 HydrophobicContact CG1-CG2 4.18Å; V35-V110 HydrophobicContact CG2-CG1 4.14Å; V35-V110 HydrophobicContact CG2-CG2 4.24Å; F57-V110 HydrophobicContact CZ-CG2 4.44Å; V94-V110 HydrophobicContact CB-CG1 4.47Å; V94-V110 WeakPolarHBondContact CG1-O 3.48Å; V94-V110 HydrophobicContact CG2-CG1 4Å; M97-V110 HydrophobicContact CB-CG2 3.89Å; N98-V110 HydrophobicContact CB-CB 4.06Å; N98-V110 PolarHBondContact OD1-N 3.28Å; N98-V110 VanDerWaalsContact OD1-N 3.07Å; F108-V110 HydrophobicContact CB-CG2 3.95Å
111	T	89.4	Confident	84.1	Confident	62 Å²	62	78.4 Å²	78.4	38%	0.38	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.4	-177.5	37.8	0	0	0	0	111.1	V33 I34	V33-T111 CarbonylContact C-O 3.58Å; V33-T111 WeakPolarHBondContact CA-O 3.32Å; V33-T111 WeakPolarHBondContact CG1-O 3.32Å; I34-T111 PolarHBondContact N-O 2.82Å; I34-T111 PolarHBondContact O-N 3.06Å
112	L	89.2	Confident	83.5	Confident	21 Å²	21	79 Å²	79	11%	0.11	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	142.5	172	-77.8	154.4	0	0	0	109.9	V33 A90 V94 S114 D115 F116	V33-L112 HydrophobicContact CG2-CD2 4.3Å; A90-L112 HydrophobicContact CB-CD2 3.7Å; V94-L112 HydrophobicContact CG2-CG 4Å; L112-S114 PolarHBondContact O-N 3.19Å; L112-D115 HydrophobicContact CB-CB 4.33Å; L112-D115 WeakPolarHBondContact O-CB 3.49Å; L112-D115 PolarHBondContact O-N 3.09Å; L112-F116 PolarHBondContact O-N 3.19Å
113	L	86.3	Confident	83.1	Confident	41 Å²	41	82 Å²	82	22%	0.215	43%	0.426	C	S	.	.	H	α-helix	trans	-60.2	-37.4	175	-174.1	64	0	0	0	111.2	L29 T32 I34 F81 D115 F116 E117	L29-L113 HydrophobicContact CD2-CB 4.36Å; L29-L113 HydrophobicContact CD2-CD2 3.83Å; L29-L113 HydrophobicContact CD2-CG 3.73Å; T32-L113 HydrophobicContact CG2-CB 4.38Å; T32-L113 HydrophobicContact CG2-CD2 4.11Å; T32-L113 PolarHBondContact O-N 2.66Å; I34-L113 HydrophobicContact CD1-CD1 3.69Å; I34-L113 HydrophobicContact CG1-CB 4.43Å; I34-L113 HydrophobicContact CG1-CD1 4.05Å; F81-L113 HydrophobicContact CE1-CD1 4.26Å; L113-D115 PolarHBondContact O-N 3.18Å; L113-F116 WeakPolarHBondContact O-CB 3.42Å; L113-F116 PolarHBondContact O-N 3.44Å; L113-F116 VanDerWaalsContact O-N 3.07Å; L113-E117 PolarHBondContact O-N 3.39Å; L113-E117 VanDerWaalsContact O-N 3.1Å
114	S	82.3	Confident	82.9	Confident	40 Å²	40	85.7 Å²	85.7	28%	0.28	45%	0.451	S	S	.	.	H	α-helix	trans	-58.2	-33.3	172	64.5	0	0	0	0	113.8	L29 L112 R118	L29-S114 WeakPolarHBondContact O-CB 3.3Å; L29-S114 PolarHBondContact O-N 3.28Å; L29-S114 VanDerWaalsContact O-N 3.11Å; L112-S114 PolarHBondContact O-N 3.19Å; S114-R118 WeakPolarHBondContact O-CB 3.43Å; S114-R118 PolarHBondContact O-N 3.17Å
115	D	79.9	Confident	82.7	Confident	43 Å²	43	83.6 Å²	83.6	23%	0.23	45%	0.445	C	S	.	.	H	α-helix	trans	-72.2	-35.4	176.9	-75.3	-31.7	0	0	0	110.9	L112 L113 R118 V119	L112-D115 HydrophobicContact CB-CB 4.33Å; L112-D115 WeakPolarHBondContact O-CB 3.49Å; L112-D115 PolarHBondContact O-N 3.09Å; L113-D115 PolarHBondContact O-N 3.18Å; D115-R118 PolarHBondContact O-N 3.42Å; D115-R118 IonicContact OD1-CZ 3.55Å; D115-R118 IonicContact OD1-NH1 3.53Å; D115-R118 PolarHBondContact OD1-NH1 2.96Å; D115-R118 IonicContact OD1-NH2 2.85Å; D115-R118 PolarHBondContact OD1-NH2 2.79Å; D115-V119 WeakPolarHBondContact O-CG2 3.4Å; D115-V119 PolarHBondContact O-N 2.78Å
116	F	77.6	Confident	82.5	Confident	118 Å²	118	86.8 Å²	86.8	52%	0.518	45%	0.446	S	S	.	.	H	α-helix	trans	-62.9	-49.8	174.6	178.2	-95.7	0	0	0	111	I34 L112 L113 R118 V119 T120	I34-F116 HydrophobicContact CD1-CB 3.98Å; I34-F116 HydrophobicContact CD1-CG 4.26Å; L112-F116 PolarHBondContact O-N 3.19Å; L113-F116 WeakPolarHBondContact O-CB 3.42Å; L113-F116 PolarHBondContact O-N 3.44Å; L113-F116 VanDerWaalsContact O-N 3.07Å; F116-R118 VanDerWaalsContact C-N 3.31Å; F116-R118 PolarHBondContact O-N 2.74Å; F116-V119 PolarHBondContact O-N 3.16Å; F116-V119 VanDerWaalsContact O-N 3.14Å; F116-T120 WeakPolarHBondContact O-CB 3.49Å; F116-T120 PolarHBondContact O-N 3.03Å; F116-T120 PolarHBondContact O-OG1 3.39Å
117	E	76.5	Confident	82.3	Confident	86 Å²	86	89.8 Å²	89.8	40%	0.402	47%	0.468	S	S	.	.	H	α-helix	trans	-59.9	-41.6	175.8	-73.9	-165.2	164.3	0	0	112.1	L29 L113 V119 T120 N121	L29-E117 VanDerWaalsContact CD1-OE2 3.24Å; L29-E117 WeakPolarHBondContact CD1-OE2 3.25Å; L29-E117 HydrophobicContact CD2-CG 4.01Å; L29-E117 WeakPolarHBondContact CD2-OE1 3.31Å; L29-E117 WeakPolarHBondContact CD2-OE2 3.44Å; L113-E117 PolarHBondContact O-N 3.39Å; L113-E117 VanDerWaalsContact O-N 3.1Å; E117-V119 VanDerWaalsContact C-N 3.29Å; E117-V119 PolarHBondContact O-N 3.47Å; E117-T120 PolarHBondContact O-N 2.88Å; E117-N121 VanDerWaalsContact O-CB 3.26Å; E117-N121 WeakPolarHBondContact O-CB 3.34Å; E117-N121 PolarHBondContact O-N 3.27Å
118	R	73.7	Confident	82	Confident	166 Å²	166	90.5 Å²	90.5	63%	0.626	47%	0.473	S	S	*	.	H	α-helix	trans	-61	-37.8	176.6	-171.8	-177.5	66.7	-149.5	-11.5	112.4	S114 D115 F116 V122	S114-R118 WeakPolarHBondContact O-CB 3.43Å; S114-R118 PolarHBondContact O-N 3.17Å; D115-R118 PolarHBondContact O-N 3.42Å; D115-R118 IonicContact OD1-CZ 3.55Å; D115-R118 IonicContact OD1-NH1 3.53Å; D115-R118 PolarHBondContact OD1-NH1 2.96Å; D115-R118 IonicContact OD1-NH2 2.85Å; D115-R118 PolarHBondContact OD1-NH2 2.79Å; F116-R118 VanDerWaalsContact C-N 3.31Å; F116-R118 PolarHBondContact O-N 2.74Å; R118-V122 VanDerWaalsContact O-CG2 3.29Å; R118-V122 WeakPolarHBondContact O-CG2 3.34Å
119	V	75.4	Confident	81.5	Confident	102 Å²	102	95.2 Å²	95.2	62%	0.618	50%	0.504	S	S	*	.	H	α-helix	trans	-76.2	-30.8	178.4	174.3	0	0	0	0	111.5	D115 F116 E117 V122	D115-V119 WeakPolarHBondContact O-CG2 3.4Å; D115-V119 PolarHBondContact O-N 2.78Å; F116-V119 PolarHBondContact O-N 3.16Å; F116-V119 VanDerWaalsContact O-N 3.14Å; E117-V119 VanDerWaalsContact C-N 3.29Å; E117-V119 PolarHBondContact O-N 3.47Å; V119-V122 WeakPolarHBondContact O-CG2 3.3Å
120	T	80.3	Confident	81.1	Confident	85 Å²	85	96 Å²	96	52%	0.521	52%	0.519	S	S	.	.	H	α-helix	trans	-78.7	-34.8	178.9	-40	0	0	0	0	111.5	F116 E117 V122	F116-T120 WeakPolarHBondContact O-CB 3.49Å; F116-T120 PolarHBondContact O-N 3.03Å; F116-T120 PolarHBondContact O-OG1 3.39Å; E117-T120 PolarHBondContact O-N 2.88Å; T120-V122 VanDerWaalsContact C-N 3.3Å; T120-V122 PolarHBondContact O-N 2.8Å
121	N	78	Confident	80.7	Confident	121 Å²	121	105.8 Å²	105.8	65%	0.647	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	27	179.1	-67.1	-24.3	0	0	0	113.3	E117 P123	E117-N121 VanDerWaalsContact O-CB 3.26Å; E117-N121 WeakPolarHBondContact O-CB 3.34Å; E117-N121 PolarHBondContact O-N 3.27Å; N121-P123 WeakPolarHBondContact O-CD 3.04Å
122	V	74.7	Confident	80.2	Confident	97 Å²	97	111.8 Å²	111.8	59%	0.588	59%	0.585	S	S	*	*			trans	-71.7	123.5	173.5	179.1	0	0	0	0	108.7	R118 V119 T120 T124	R118-V122 VanDerWaalsContact O-CG2 3.29Å; R118-V122 WeakPolarHBondContact O-CG2 3.34Å; V119-V122 WeakPolarHBondContact O-CG2 3.3Å; T120-V122 VanDerWaalsContact C-N 3.3Å; T120-V122 PolarHBondContact O-N 2.8Å; V122-T124 PolarHBondContact O-N 3.11Å
123	P	77.9	Confident	79.8	Confident	101 Å²	101	119.2 Å²	119.2	66%	0.656	62%	0.619	S	S	*	*			trans	-55.7	133.2	175.3	-23.4	33	0	0	0	111	N121 E125	N121-P123 WeakPolarHBondContact O-CD 3.04Å; P123-E125 VanDerWaalsContact C-N 3.26Å; P123-E125 PolarHBondContact O-N 3.2Å
124	T	80.7	Confident	79.5	Confident	152 Å²	152	126.4 Å²	126.4	93%	0.933	65%	0.645	S	S	*	*	S	Bend	trans	-66.5	-27.4	177.8	28.8	0	0	0	0	112.8	V122	V122-T124 PolarHBondContact O-N 3.11Å
125	E	81.4	Confident	79.4	Confident	160 Å²	160	132.7 Å²	132.7	75%	0.748	67%	0.667	S	S	*	*	S	Bend	trans	-96.1	117.3	173.9	-69.7	-170.6	166.4	0	0	111.3	P123 V127	P123-E125 VanDerWaalsContact C-N 3.26Å; P123-E125 PolarHBondContact O-N 3.2Å; E125-V127 PolarHBondContact O-N 2.97Å
126	W	81.3	Confident	79.5	Confident	208 Å²	208	136 Å²	136	79%	0.788	69%	0.685	S	S	*	*			trans	-74.8	115.2	170.8	-179.4	82.7	0	0	0	110.1	P128	W126-P128 HydrophobicContact CE3-CB 4.45Å; W126-P128 HydrophobicContact CH2-CB 3.51Å; W126-P128 HydrophobicContact CH2-CG 4.44Å; W126-P128 HydrophobicContact CZ2-CB 4.23Å; W126-P128 HydrophobicContact CZ3-CB 3.63Å; W126-P128 HydrophobicContact CZ3-CG 4.08Å
127	V	82.7	Confident	79.6	Confident	114 Å²	114	133.3 Å²	133.3	69%	0.691	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-96.6	122.1	171.2	-176.6	0	0	0	0	108.4	E125	E125-V127 PolarHBondContact O-N 2.97Å
128	P	81.4	Confident	80	Confident	75 Å²	75	131 Å²	131	49%	0.487	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-57.9	138	174.5	21.6	-30.3	0	0	0	109.5	W126	W126-P128 HydrophobicContact CE3-CB 4.45Å; W126-P128 HydrophobicContact CH2-CB 3.51Å; W126-P128 HydrophobicContact CH2-CG 4.44Å; W126-P128 HydrophobicContact CZ2-CB 4.23Å; W126-P128 HydrophobicContact CZ3-CB 3.63Å; W126-P128 HydrophobicContact CZ3-CG 4.08Å
129	P	80.8	Confident	80.6	Confident	100 Å²	100	127 Å²	127	65%	0.649	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-55.6	142.1	174.6	23.8	-32.6	0	0	0	109.2	K131	P129-K131 PolarHBondContact O-N 3.43Å
130	P	83.3	Confident	81.3	Confident	125 Å²	125	123.8 Å²	123.8	81%	0.812	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-55	135.9	179	23.1	-32.8	0	0	0	109.1	Q132	P130-Q132 PolarHBondContact O-N 2.89Å; P130-Q132 VanDerWaalsContact O-N 3.15Å
131	K	81.9	Confident	81.7	Confident	205 Å²	205	124.3 Å²	124.3	89%	0.891	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-57.3	124.5	174.2	-70.7	-179.3	-179.2	174.7	0	107.4	P129 E133	P129-K131 PolarHBondContact O-N 3.43Å; K131-E133 PolarHBondContact O-N 2.89Å
132	Q	78.8	Confident	82.3	Confident	188 Å²	188	119.5 Å²	119.5	88%	0.879	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-53.6	135	172.7	-100.4	179.3	-13.7	0	0	109.3	P130 Y134	P130-Q132 PolarHBondContact O-N 2.89Å; P130-Q132 VanDerWaalsContact O-N 3.15Å; Q132-Y134 PolarHBondContact O-N 3.17Å
133	E	81.1	Confident	83	Confident	176 Å²	176	115.1 Å²	115.1	82%	0.822	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-55.9	129.1	173.6	-68.9	-176.3	167.1	0	0	109.5	K131 K135	K131-E133 PolarHBondContact O-N 2.89Å; E133-K135 PolarHBondContact O-N 2.8Å; E133-K135 VanDerWaalsContact O-N 3.12Å
134	Y	80.6	Confident	83.6	Confident	192 Å²	192	112.9 Å²	112.9	75%	0.753	57%	0.571	S	S	*	*			trans	-66	113.7	176.7	175.7	-99.1	0	0	0	108.9	Q132 D136	Q132-Y134 PolarHBondContact O-N 3.17Å; Y134-D136 HydrophobicContact CD1-CB 4.47Å; Y134-D136 HydrophobicContact CE1-CB 3.81Å
135	K	79.4	Confident	84	Confident	172 Å²	172	111.7 Å²	111.7	75%	0.748	56%	0.559	S	S	*	*			trans	-87.5	112.8	169.3	-66.3	-175.9	-179.1	-178.6	0	108.1	E133 L137	E133-K135 PolarHBondContact O-N 2.8Å; E133-K135 VanDerWaalsContact O-N 3.12Å; K135-L137 PolarHBondContact O-N 2.8Å; K135-L137 VanDerWaalsContact O-N 3.15Å
136	D	82.4	Confident	84.3	Confident	113 Å²	113	105.7 Å²	105.7	60%	0.604	53%	0.532	S	S	*	.			trans	-67.7	112.7	172.8	-172.2	17.1	0	0	0	109.6	Y134 G138	Y134-D136 HydrophobicContact CD1-CB 4.47Å; Y134-D136 HydrophobicContact CE1-CB 3.81Å; D136-G138 PolarHBondContact OD1-N 3.23Å
137	L	79.9	Confident	84.4	Confident	61 Å²	61	103.9 Å²	103.9	32%	0.319	53%	0.532	S	S	.	.			trans	-86	3.1	176.6	-62.2	174	0	0	0	111.9	K135 L140 I215	K135-L137 PolarHBondContact O-N 2.8Å; K135-L137 VanDerWaalsContact O-N 3.15Å; L137-L140 HydrophobicContact CB-CD2 4.23Å; L137-I215 HydrophobicContact CD1-CG1 4.36Å; L137-I215 HydrophobicContact CD1-CG2 3.99Å
138	G	83.5	Confident	84.3	Confident	39 Å²	39	102.6 Å²	102.6	40%	0.402	52%	0.517	S	S	.	.			trans	69.1	-169.5	-172.4	0	0	0	0	0	112.5	D136 L140	D136-G138 PolarHBondContact OD1-N 3.23Å; G138-L140 PolarHBondContact O-N 2.7Å; G138-L140 VanDerWaalsContact O-N 3.1Å
139	N	87.9	Confident	84.4	Confident	80 Å²	80	102.3 Å²	102.3	43%	0.428	52%	0.516	S	S	.	.			trans	-78.2	99.8	-178.8	-174.3	0.5	0	0	0	111.3	K141 S142 L145	N139-K141 PolarHBondContact O-N 2.76Å; N139-K141 VanDerWaalsContact O-N 3.13Å; N139-K141 WeakPolarHBondContact OD1-CA 3.38Å; N139-K141 PolarHBondContact OD1-N 3.05Å; N139-S142 WeakPolarHBondContact O-CB 3.44Å; N139-S142 PolarHBondContact O-N 2.93Å; N139-S142 VanDerWaalsContact O-N 3.09Å; N139-S142 PolarHBondContact O-OG 3.33Å; N139-S142 PolarHBondContact OD1-N 2.81Å; N139-L145 WeakPolarHBondContact ND2-CD1 3.46Å
140	L	88.6	Confident	84.8	Confident	36 Å²	36	100.9 Å²	100.9	19%	0.188	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-20.5	175.8	-59.4	-179	0	0	0	113.7	L137 G138 T194 Y195 I215	L137-L140 HydrophobicContact CB-CD2 4.23Å; G138-L140 PolarHBondContact O-N 2.7Å; G138-L140 VanDerWaalsContact O-N 3.1Å; L140-T194 HydrophobicContact CB-CG2 3.77Å; L140-T194 HydrophobicContact CD1-CG2 4.08Å; L140-Y195 HydrophobicContact CD1-CE1 4.09Å; L140-I215 HydrophobicContact CD2-CD1 3.51Å
141	K	89.3	Confident	85.2	Confident	95 Å²	95	95 Å²	95	41%	0.413	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	15.3	-179.8	-65.5	-177.8	-176.7	176.9	0	112.5	N139 W143 L144	N139-K141 PolarHBondContact O-N 2.76Å; N139-K141 VanDerWaalsContact O-N 3.13Å; N139-K141 WeakPolarHBondContact OD1-CA 3.38Å; N139-K141 PolarHBondContact OD1-N 3.05Å; K141-W143 PolarHBondContact O-N 3.23Å; K141-W143 VanDerWaalsContact O-N 3.09Å; K141-L144 HydrophobicContact CB-CD1 4.22Å; K141-L144 HydrophobicContact CD-CD1 4.47Å; K141-L144 HydrophobicContact CG-CD1 4.5Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 2.87Å
142	S	89.9	Confident	85.8	Confident	21 Å²	21	85.6 Å²	85.6	15%	0.147	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-51.2	-37.3	-177.5	57.6	0	0	0	0	113	N139 L144 L145	N139-S142 WeakPolarHBondContact O-CB 3.44Å; N139-S142 PolarHBondContact O-N 2.93Å; N139-S142 VanDerWaalsContact O-N 3.09Å; N139-S142 PolarHBondContact O-OG 3.33Å; N139-S142 PolarHBondContact OD1-N 2.81Å; S142-L144 PolarHBondContact O-N 3.23Å; S142-L145 WeakPolarHBondContact O-CB 3.31Å; S142-L145 PolarHBondContact O-N 2.99Å
143	W	90.5	Very high	86.6	Confident	5 Å²	5	76.6 Å²	76.6	2%	0.019	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-63.6	-25.4	-177.9	71.1	-83.5	0	0	0	114.1	K141 L145 N146 W167 R563 P564 R565	K141-W143 PolarHBondContact O-N 3.23Å; K141-W143 VanDerWaalsContact O-N 3.09Å; W143-L145 PolarHBondContact O-N 3.13Å; W143-N146 WeakPolarHBondContact O-CB 3.38Å; W143-N146 PolarHBondContact O-N 2.94Å; W143-W167 HydrophobicContact CB-CH2 3.85Å; W143-R563 VanDerWaalsContact CD1-NH1 3.27Å; W143-R563 VanDerWaalsContact CG-NH1 3.34Å; W143-P564 WeakPolarHBondContact CZ2-O 3.33Å; W143-R565 HydrophobicContact CH2-CB 3.67Å; W143-R565 HydrophobicContact CH2-CG 3.39Å; W143-R565 HydrophobicContact CZ3-CB 4.44Å; W143-R565 HydrophobicContact CZ3-CG 3.69Å
144	L	90	Very high	87.4	Confident	53 Å²	53	68.2 Å²	68.2	28%	0.277	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-69.4	-21.4	174.2	-74.9	171.1	0	0	0	112.8	K141 S142 N146 P566	K141-L144 HydrophobicContact CB-CD1 4.22Å; K141-L144 HydrophobicContact CD-CD1 4.47Å; K141-L144 HydrophobicContact CG-CD1 4.5Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 2.87Å; S142-L144 PolarHBondContact O-N 3.23Å; L144-N146 VanDerWaalsContact C-N 3.25Å; L144-P566 HydrophobicContact CD1-CG 3.7Å; L144-P566 HydrophobicContact CD2-CG 4.47Å
145	L	89.4	Confident	88.1	Confident	127 Å²	127	59.1 Å²	59.1	67%	0.665	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-87.6	9.3	179.6	-55.9	176.8	0	0	0	112.5	N139 S142 W143 E147	N139-L145 WeakPolarHBondContact ND2-CD1 3.46Å; S142-L145 WeakPolarHBondContact O-CB 3.31Å; S142-L145 PolarHBondContact O-N 2.99Å; W143-L145 PolarHBondContact O-N 3.13Å; L145-E147 PolarHBondContact O-N 3.05Å; L145-E147 VanDerWaalsContact O-N 3.14Å
146	N	86.6	Confident	88.9	Confident	34 Å²	34	50.9 Å²	50.9	18%	0.182	27%	0.266	C	S	.	.			trans	-59.5	119	175.8	-172.9	-86.5	0	0	0	110	W143 L144 F148 C149 R150 W167	W143-N146 WeakPolarHBondContact O-CB 3.38Å; W143-N146 PolarHBondContact O-N 2.94Å; L144-N146 VanDerWaalsContact C-N 3.25Å; N146-F148 PolarHBondContact O-N 3.1Å; N146-F148 VanDerWaalsContact O-N 3.12Å; N146-F148 PolarHBondContact OD1-N 3.43Å; N146-F148 VanDerWaalsContact OD1-N 3.16Å; N146-C149 PolarHBondContact O-N 3.46Å; N146-C149 PolarHBondContact OD1-N 3.12Å; N146-R150 PolarHBondContact OD1-N 2.71Å; N146-W167 HydrophobicContact CB-CH2 3.78Å; N146-W167 HydrophobicContact CB-CZ3 3.7Å; N146-W167 WeakPolarHBondContact ND2-CH2 3.38Å; N146-W167 WeakPolarHBondContact ND2-CZ3 3.31Å
147	E	83.5	Confident	89.4	Confident	171 Å²	171	46.6 Å²	46.6	80%	0.799	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-34	-175.1	-62.7	-179.5	166.8	0	0	112.6	L145 C149	L145-E147 PolarHBondContact O-N 3.05Å; L145-E147 VanDerWaalsContact O-N 3.14Å; E147-C149 VanDerWaalsContact C-N 3.34Å
148	F	81.7	Confident	90	Very high	87 Å²	87	46.1 Å²	46.1	38%	0.382	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	7.3	-178.5	-55.1	-62.3	0	0	0	113.7	N146 R150 L596	N146-F148 PolarHBondContact O-N 3.1Å; N146-F148 VanDerWaalsContact O-N 3.12Å; N146-F148 PolarHBondContact OD1-N 3.43Å; N146-F148 VanDerWaalsContact OD1-N 3.16Å; F148-R150 HydrophobicContact CB-CG 3.87Å; F148-R150 PolarHBondContact O-N 3.22Å; F148-R150 VanDerWaalsContact O-N 3.12Å; F148-L596 HydrophobicContact CD1-CD1 3.45Å; F148-L596 VanDerWaalsContact CD1-CD1 3.45Å; F148-L596 HydrophobicContact CD1-CD2 4.32Å; F148-L596 HydrophobicContact CD1-CG 4.46Å; F148-L596 HydrophobicContact CE1-CD1 3.55Å; F148-L596 HydrophobicContact CE1-CD2 3.66Å; F148-L596 HydrophobicContact CE1-CG 4.11Å; F148-L596 HydrophobicContact CG-CD1 4.29Å; F148-L596 HydrophobicContact CZ-CD1 4.46Å; F148-L596 HydrophobicContact CZ-CD2 3.84Å
149	C	83.7	Confident	90.3	Very high	68 Å²	68	47.9 Å²	47.9	46%	0.459	24%	0.24	S	C	.	.			trans	50.2	38.6	-176.9	-64.7	0	0	0	0	112.8	N146 E147 R522	N146-C149 PolarHBondContact O-N 3.46Å; N146-C149 PolarHBondContact OD1-N 3.12Å; E147-C149 VanDerWaalsContact C-N 3.34Å; C149-R522 PolarHBondContact O-NH2 3.36Å
150	R	88.2	Confident	90.3	Very high	70 Å²	70	44.5 Å²	44.5	26%	0.264	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-78.6	145	177.6	-67.9	172.6	-174.2	-178	3.1	110.4	N146 F148 W167 H168	N146-R150 PolarHBondContact OD1-N 2.71Å; F148-R150 HydrophobicContact CB-CG 3.87Å; F148-R150 PolarHBondContact O-N 3.22Å; F148-R150 VanDerWaalsContact O-N 3.12Å; R150-W167 HydrophobicContact CB-CE3 3.93Å; R150-W167 HydrophobicContact CB-CZ3 4.42Å; R150-W167 WeakPolarHBondContact O-CZ3 3.46Å; R150-H168 WeakPolarHBondContact CG-O 3.25Å
151	D	92.6	Very high	90.5	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.011	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-95.8	152.1	175.7	-62.4	-73.6	0	0	0	110.3	H168 T520 R522 W562 R565	D151-H168 WeakPolarHBondContact O-CB 3.1Å; D151-H168 PolarHBondContact O-N 2.97Å; D151-T520 WeakPolarHBondContact OD2-CG2 3.49Å; D151-R522 IonicContact OD2-NH2 2.9Å; D151-R522 PolarHBondContact OD2-NH2 3.17Å; D151-W562 HydrophobicContact CB-CE3 4.41Å; D151-W562 HydrophobicContact CB-CZ3 4.35Å; D151-R565 WeakPolarHBondContact OD1-CD 3.44Å
152	Q	94.5	Very high	90.7	Very high	7 Å²	7	44.5 Å²	44.5	3%	0.033	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	153	176	-71.1	-174.7	-30.8	0	0	110.9	V165 Y166 W167 R563	Q152-V165 HydrophobicContact CB-CG1 4.26Å; Q152-Y166 CarbonylContact C-O 3.58Å; Q152-Y166 WeakPolarHBondContact CA-O 3.41Å; Q152-W167 HydrophobicContact CG-CD2 3.64Å; Q152-W167 HydrophobicContact CG-CE3 3.42Å; Q152-W167 VanDerWaalsContact CG-CE3 3.42Å; Q152-W167 HydrophobicContact CG-CG 4.33Å; Q152-W167 HydrophobicContact CG-CH2 4.01Å; Q152-W167 HydrophobicContact CG-CZ2 4.2Å; Q152-W167 HydrophobicContact CG-CZ3 3.61Å; Q152-R563 HydrophobicContact CB-CB 3.95Å; Q152-R563 VanDerWaalsContact O-CB 3.24Å; Q152-R563 WeakPolarHBondContact O-CB 3.21Å; Q152-R563 PolarHBondContact O-N 3.31Å; Q152-R563 VanDerWaalsContact OE1-CD 3.3Å
153	F	95.8	Very high	91	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	152.3	167.4	62.1	-90.6	0	0	0	110.2	V165 Y166 H168 P173 F541 M552 F560 T561 W562	F153-V165 WeakPolarHBondContact O-CA 3.29Å; F153-Y166 HydrophobicContact CD2-CD2 4.21Å; F153-Y166 HydrophobicContact CE1-CG 4.49Å; F153-Y166 AromaticContact CE2-CD2 3.5Å; F153-Y166 HydrophobicContact CE2-CD2 3.5Å; F153-Y166 HydrophobicContact CE2-CE2 4.4Å; F153-Y166 AromaticContact CE2-CG 3.82Å; F153-Y166 HydrophobicContact CE2-CG 3.82Å; F153-Y166 AromaticContact CZ-CD2 3.93Å; F153-Y166 HydrophobicContact CZ-CD2 3.93Å; F153-Y166 AromaticContact CZ-CG 3.74Å; F153-Y166 HydrophobicContact CZ-CG 3.74Å; F153-Y166 PolarHBondContact N-O 3.27Å; F153-Y166 PolarHBondContact O-N 3.27Å; F153-H168 HydrophobicContact CD1-CB 4.2Å; F153-H168 HydrophobicContact CE1-CB 4.16Å; F153-P173 HydrophobicContact CE1-CB 4.11Å; F153-P173 HydrophobicContact CZ-CB 3.87Å; F153-P173 HydrophobicContact CZ-CG 4.42Å; F153-F541 HydrophobicContact CD1-CE1 4.32Å; F153-F541 HydrophobicContact CD1-CZ 4.32Å; F153-F541 HydrophobicContact CE1-CE1 4.04Å; F153-F541 AromaticContact CE1-CZ 3.73Å; F153-F541 HydrophobicContact CE1-CZ 3.73Å; F153-F541 HydrophobicContact CE2-CZ 4.15Å; F153-F541 HydrophobicContact CZ-CE1 4.38Å; F153-F541 HydrophobicContact CZ-CE2 4.4Å; F153-F541 AromaticContact CZ-CZ 3.61Å; F153-F541 HydrophobicContact CZ-CZ 3.61Å; F153-M552 HydrophobicContact CE2-CE 3.98Å; F153-M552 HydrophobicContact CZ-CE 4.25Å; F153-F560 HydrophobicContact CB-CE2 3.78Å; F153-F560 HydrophobicContact CB-CZ 4.03Å; F153-F560 HydrophobicContact CD1-CE2 4.49Å; F153-F560 AromaticContact CD2-CD2 3.95Å; F153-F560 HydrophobicContact CD2-CD2 3.95Å; F153-F560 AromaticContact CD2-CE2 3.43Å; F153-F560 HydrophobicContact CD2-CE2 3.43Å; F153-F560 VanDerWaalsContact CD2-CE2 3.43Å; F153-F560 HydrophobicContact CD2-CZ 4.43Å; F153-F560 HydrophobicContact CE2-CE2 4.08Å; F153-F560 AromaticContact CG-CE2 3.66Å; F153-F560 HydrophobicContact CG-CE2 3.66Å; F153-F560 HydrophobicContact CG-CZ 4.25Å; F153-T561 CarbonylContact C-O 3.59Å; F153-T561 WeakPolarHBondContact CA-O 3.49Å; F153-W562 HydrophobicContact CB-CD2 4.18Å; F153-W562 HydrophobicContact CB-CE3 3.71Å; F153-W562 HydrophobicContact CB-CZ3 4.03Å; F153-W562 HydrophobicContact CD1-CE3 4.25Å; F153-W562 HydrophobicContact CD1-CH2 4.06Å; F153-W562 AromaticContact CD1-CZ3 3.67Å; F153-W562 HydrophobicContact CD1-CZ3 3.67Å; F153-W562 HydrophobicContact CG-CE3 4.44Å; F153-W562 HydrophobicContact CG-CZ3 4.28Å
154	A	96.4	Very high	91.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	141.3	172.1	0	0	0	0	0	109.4	S164 V165 W189 L196 F560 T561	A154-S164 CarbonylContact C-O 3.56Å; A154-S164 WeakPolarHBondContact CA-O 3.4Å; A154-V165 HydrophobicContact CB-CG2 4.25Å; A154-W189 HydrophobicContact CB-CZ2 3.88Å; A154-L196 HydrophobicContact CB-CD1 4.26Å; A154-F560 WeakPolarHBondContact O-CA 3.38Å; A154-T561 HydrophobicContact CB-CG2 4.14Å; A154-T561 PolarHBondContact N-O 3.47Å; A154-T561 PolarHBondContact O-N 2.76Å
155	V	95.9	Very high	91.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142.7	175.5	92.5	0	0	0	0	110.6	Y157 S164 Y166 I539 L554 I557 T559 F560	V155-Y157 HydrophobicContact CG1-CD1 3.66Å; V155-Y157 HydrophobicContact CG1-CE1 4.17Å; V155-S164 PolarHBondContact N-O 2.86Å; V155-S164 PolarHBondContact O-N 2.83Å; V155-Y166 HydrophobicContact CG1-CD2 4.37Å; V155-Y166 HydrophobicContact CG1-CE2 3.79Å; V155-I539 HydrophobicContact CG2-CD1 3.55Å; V155-L554 HydrophobicContact CG1-CD1 3.92Å; V155-L554 HydrophobicContact CG2-CD1 4.4Å; V155-I557 HydrophobicContact CG2-CG2 4.25Å; V155-T559 CarbonylContact C-O 3.54Å; V155-T559 VanDerWaalsContact CA-O 3.31Å; V155-T559 WeakPolarHBondContact CA-O 3.36Å; V155-T559 WeakPolarHBondContact CG2-O 3.32Å; V155-F560 HydrophobicContact CG2-CB 4.28Å; V155-F560 HydrophobicContact CG2-CD2 4.22Å
156	V	96	Very high	91.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.8	169.7	179.4	0	0	0	0	107.7	T162 T183 M187 R558 T559	V156-T162 WeakPolarHBondContact CA-O 3.04Å; V156-T183 HydrophobicContact CG1-CG2 4.16Å; V156-T183 HydrophobicContact CG2-CG2 3.76Å; V156-M187 HydrophobicContact CG2-CB 4.05Å; V156-M187 HydrophobicContact CG2-CG 3.42Å; V156-M187 VanDerWaalsContact CG2-CG 3.42Å; V156-M187 HydrophobicContact CG2-SD 3.55Å; V156-M187 VanDerWaalsContact CG2-SD 3.55Å; V156-R558 HydrophobicContact CB-CB 4.35Å; V156-R558 HydrophobicContact CG1-CB 4.18Å; V156-R558 PolarHBondContact O-N 2.96Å; V156-T559 WeakPolarHBondContact CB-OG1 3.29Å; V156-T559 VanDerWaalsContact CG2-OG1 3.24Å; V156-T559 WeakPolarHBondContact CG2-OG1 3.39Å; V156-T559 PolarHBondContact N-O 3.11Å
157	Y	93.9	Very high	92.2	Very high	22 Å²	22	36.1 Å²	36.1	9%	0.086	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	-175.1	-174.9	70.6	-76.1	0	0	0	110.9	V155 D159 G160 E161 T162 S164 E178 L554	V155-Y157 HydrophobicContact CG1-CD1 3.66Å; V155-Y157 HydrophobicContact CG1-CE1 4.17Å; Y157-D159 VanDerWaalsContact C-N 3.28Å; Y157-D159 PolarHBondContact O-N 2.91Å; Y157-G160 PolarHBondContact O-N 3.11Å; Y157-E161 PolarHBondContact O-N 2.97Å; Y157-T162 HydrophobicContact CD1-CG2 4.41Å; Y157-T162 HydrophobicContact CE1-CG2 3.61Å; Y157-T162 HydrophobicContact CE2-CG2 4.45Å; Y157-T162 PolarHBondContact N-O 2.9Å; Y157-T162 PolarHBondContact O-N 2.92Å; Y157-S164 WeakPolarHBondContact CE1-OG 3.3Å; Y157-E178 PolarHBondContact OH-OE2 3.15Å; Y157-L554 HydrophobicContact CD1-CD1 4.25Å; Y157-L554 HydrophobicContact CD2-CB 4.17Å; Y157-L554 HydrophobicContact CD2-CD1 4.41Å; Y157-L554 HydrophobicContact CD2-CD2 4Å; Y157-L554 HydrophobicContact CD2-CG 4.44Å; Y157-L554 HydrophobicContact CE2-CD2 4.01Å; Y157-L554 HydrophobicContact CG-CB 4.31Å; Y157-L554 HydrophobicContact CG-CD1 4.05Å; Y157-L554 HydrophobicContact CG-CD2 4.46Å
158	N	92.8	Very high	92.6	Very high	51 Å²	51	28.2 Å²	28.2	27%	0.273	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	52.9	46.7	-169.1	-64.4	-26.4	0	0	0	111.6	G160 E161 T162 R555	N158-G160 PolarHBondContact O-N 2.83Å; N158-G160 VanDerWaalsContact O-N 3.09Å; N158-E161 HydrophobicContact CB-CB 4.09Å; N158-E161 WeakPolarHBondContact O-CB 3.41Å; N158-E161 VanDerWaalsContact O-CG 3.3Å; N158-E161 WeakPolarHBondContact O-CG 3.38Å; N158-E161 PolarHBondContact O-N 3.32Å; N158-T162 PolarHBondContact ND2-OG1 3.22Å; N158-R555 WeakPolarHBondContact CA-O 3.29Å; N158-R555 PolarHBondContact N-O 3.22Å
159	D	88.3	Confident	92.8	Very high	76 Å²	76	25 Å²	25	41%	0.406	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	53.8	34.8	-179.6	-61.9	-47.7	0	0	0	113.3	Y157 G556 R558	Y157-D159 VanDerWaalsContact C-N 3.28Å; Y157-D159 PolarHBondContact O-N 2.91Å; D159-G556 PolarHBondContact N-O 2.8Å; D159-G556 VanDerWaalsContact OD1-CA 3.28Å; D159-G556 WeakPolarHBondContact OD1-CA 3.24Å; D159-R558 VanDerWaalsContact C-CZ 3.48Å; D159-R558 PolarHBondContact O-NE 2.77Å; D159-R558 VanDerWaalsContact O-NE 3.11Å; D159-R558 PolarHBondContact O-NH2 3.17Å
160	G	88.7	Confident	92.5	Very high	9 Å²	9	24.2 Å²	24.2	9%	0.093	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	95.2	-1.6	177	0	0	0	0	0	115	Y157 N158	Y157-G160 PolarHBondContact O-N 3.11Å; N158-G160 PolarHBondContact O-N 2.83Å; N158-G160 VanDerWaalsContact O-N 3.09Å
161	E	92.1	Very high	92.1	Very high	112 Å²	112	24.9 Å²	24.9	52%	0.523	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-26.8	179.4	-65.4	179.9	173.1	0	0	113	Y157 N158 A180 H181	Y157-E161 PolarHBondContact O-N 2.97Å; N158-E161 HydrophobicContact CB-CB 4.09Å; N158-E161 WeakPolarHBondContact O-CB 3.41Å; N158-E161 VanDerWaalsContact O-CG 3.3Å; N158-E161 WeakPolarHBondContact O-CG 3.38Å; N158-E161 PolarHBondContact O-N 3.32Å; E161-A180 CarbonylContact O-C 3.41Å; E161-A180 WeakPolarHBondContact O-CA 3.36Å; E161-H181 PolarHBondContact O-N 2.89Å
162	T	94.8	Very high	91.5	Very high	19 Å²	19	30.5 Å²	30.5	12%	0.117	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123.3	-175.3	-44.1	0	0	0	0	110.9	V156 Y157 N158 E178	V156-T162 WeakPolarHBondContact CA-O 3.04Å; Y157-T162 HydrophobicContact CD1-CG2 4.41Å; Y157-T162 HydrophobicContact CE1-CG2 3.61Å; Y157-T162 HydrophobicContact CE2-CG2 4.45Å; Y157-T162 PolarHBondContact N-O 2.9Å; Y157-T162 PolarHBondContact O-N 2.92Å; N158-T162 PolarHBondContact ND2-OG1 3.22Å; T162-E178 HydrophobicContact CG2-CG 3.76Å
163	G	95.8	Very high	91.2	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.5	167.4	0	0	0	0	0	109.4	R179	G163-R179 PolarHBondContact N-O 3.02Å; G163-R179 VanDerWaalsContact N-O 3.11Å; G163-R179 PolarHBondContact O-N 2.83Å
164	S	96.1	Very high	90.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	142.9	-178.7	-54.8	0	0	0	0	111.6	A154 V155 Y157 E177 E178	A154-S164 CarbonylContact C-O 3.56Å; A154-S164 WeakPolarHBondContact CA-O 3.4Å; V155-S164 PolarHBondContact N-O 2.86Å; V155-S164 PolarHBondContact O-N 2.83Å; Y157-S164 WeakPolarHBondContact CE1-OG 3.3Å; S164-E177 CarbonylContact C-O 3.54Å; S164-E177 WeakPolarHBondContact CA-O 3.44Å; S164-E178 WeakPolarHBondContact OG-CB 3.33Å; S164-E178 WeakPolarHBondContact OG-CG 3.27Å; S164-E178 PolarHBondContact OG-OE2 2.95Å
165	V	96.2	Very high	90.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.3	169.7	180	0	0	0	0	107.9	Q152 F153 A154 A176 E177 W182 W189 L196 F212	Q152-V165 HydrophobicContact CB-CG1 4.26Å; F153-V165 WeakPolarHBondContact O-CA 3.29Å; A154-V165 HydrophobicContact CB-CG2 4.25Å; V165-A176 HydrophobicContact CB-CB 4.39Å; V165-A176 HydrophobicContact CG1-CB 4.14Å; V165-A176 WeakPolarHBondContact O-CA 3.35Å; V165-A176 VanDerWaalsContact O-CB 3.31Å; V165-A176 WeakPolarHBondContact O-CB 3.42Å; V165-A176 PolarHBondContact O-N 2.91Å; V165-E177 PolarHBondContact N-O 3.5Å; V165-E177 PolarHBondContact O-N 2.86Å; V165-E177 VanDerWaalsContact O-N 3.17Å; V165-W182 HydrophobicContact CG2-CH2 3.91Å; V165-W182 HydrophobicContact CG2-CZ3 3.92Å; V165-W189 HydrophobicContact CG1-CH2 4.33Å; V165-W189 HydrophobicContact CG1-CZ2 4.19Å; V165-W189 HydrophobicContact CG2-CH2 4.32Å; V165-W189 HydrophobicContact CG2-CZ2 4.2Å; V165-L196 HydrophobicContact CG2-CD2 3.89Å; V165-F212 HydrophobicContact CB-CE2 4.11Å; V165-F212 HydrophobicContact CB-CZ 4.2Å; V165-F212 HydrophobicContact CG1-CE2 3.99Å; V165-F212 HydrophobicContact CG1-CZ 3.81Å; V165-F212 HydrophobicContact CG2-CE1 4.3Å; V165-F212 HydrophobicContact CG2-CE2 4.18Å; V165-F212 HydrophobicContact CG2-CZ 3.98Å
166	Y	95	Very high	90.6	Very high	17 Å²	17	39.7 Å²	39.7	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	149.6	-179.1	-67.2	-92.8	0	0	0	110.8	Q152 F153 V155 P173 V174 V175	Q152-Y166 CarbonylContact C-O 3.58Å; Q152-Y166 WeakPolarHBondContact CA-O 3.41Å; F153-Y166 HydrophobicContact CD2-CD2 4.21Å; F153-Y166 HydrophobicContact CE1-CG 4.49Å; F153-Y166 AromaticContact CE2-CD2 3.5Å; F153-Y166 HydrophobicContact CE2-CD2 3.5Å; F153-Y166 HydrophobicContact CE2-CE2 4.4Å; F153-Y166 AromaticContact CE2-CG 3.82Å; F153-Y166 HydrophobicContact CE2-CG 3.82Å; F153-Y166 AromaticContact CZ-CD2 3.93Å; F153-Y166 HydrophobicContact CZ-CD2 3.93Å; F153-Y166 AromaticContact CZ-CG 3.74Å; F153-Y166 HydrophobicContact CZ-CG 3.74Å; F153-Y166 PolarHBondContact N-O 3.27Å; F153-Y166 PolarHBondContact O-N 3.27Å; V155-Y166 HydrophobicContact CG1-CD2 4.37Å; V155-Y166 HydrophobicContact CG1-CE2 3.79Å; Y166-P173 HydrophobicContact CD1-CB 3.92Å; Y166-P173 HydrophobicContact CD1-CG 4.25Å; Y166-P173 HydrophobicContact CG-CB 4.28Å; Y166-V174 CarbonylContact C-O 3.54Å; Y166-V174 WeakPolarHBondContact CA-O 3.24Å; Y166-V175 HydrophobicContact CD1-CB 4.43Å; Y166-V175 HydrophobicContact CD1-CG2 3.92Å; Y166-V175 HydrophobicContact CE1-CB 4.36Å; Y166-V175 HydrophobicContact CE1-CG2 3.44Å; Y166-V175 VanDerWaalsContact CE1-CG2 3.44Å
167	W	93.5	Very high	90.5	Very high	47 Å²	47	41.9 Å²	41.9	18%	0.178	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.3	159.7	-68.1	100.9	0	0	0	109.5	W143 N146 R150 Q152 P173 V174	W143-W167 HydrophobicContact CB-CH2 3.85Å; N146-W167 HydrophobicContact CB-CH2 3.78Å; N146-W167 HydrophobicContact CB-CZ3 3.7Å; N146-W167 WeakPolarHBondContact ND2-CH2 3.38Å; N146-W167 WeakPolarHBondContact ND2-CZ3 3.31Å; R150-W167 HydrophobicContact CB-CE3 3.93Å; R150-W167 HydrophobicContact CB-CZ3 4.42Å; R150-W167 WeakPolarHBondContact O-CZ3 3.46Å; Q152-W167 HydrophobicContact CG-CD2 3.64Å; Q152-W167 HydrophobicContact CG-CE3 3.42Å; Q152-W167 VanDerWaalsContact CG-CE3 3.42Å; Q152-W167 HydrophobicContact CG-CG 4.33Å; Q152-W167 HydrophobicContact CG-CH2 4.01Å; Q152-W167 HydrophobicContact CG-CZ2 4.2Å; Q152-W167 HydrophobicContact CG-CZ3 3.61Å; W167-P173 CarbonylContact O-C 3.56Å; W167-P173 VanDerWaalsContact O-CA 3.31Å; W167-P173 WeakPolarHBondContact O-CA 3.36Å; W167-V174 HydrophobicContact CB-CB 4.25Å; W167-V174 PolarHBondContact N-O 2.92Å; W167-V174 PolarHBondContact O-N 3.33Å
168	H	92.4	Very high	90.6	Very high	5 Å²	5	45.2 Å²	45.2	2%	0.023	25%	0.249	C	C	.	.			trans	-73.4	134.3	174	179.5	61.1	0	0	0	111.1	R150 D151 F153 Y523 F541 Y550 W562	R150-H168 WeakPolarHBondContact CG-O 3.25Å; D151-H168 WeakPolarHBondContact O-CB 3.1Å; D151-H168 PolarHBondContact O-N 2.97Å; F153-H168 HydrophobicContact CD1-CB 4.2Å; F153-H168 HydrophobicContact CE1-CB 4.16Å; H168-Y523 AromaticContact CD2-CD2 3.55Å; H168-Y523 AromaticContact CD2-CE2 3.82Å; H168-Y523 AromaticContact CD2-CG 3.8Å; H168-Y523 AromaticContact NE2-CD1 3.42Å; H168-Y523 WeakPolarHBondContact NE2-CD1 3.43Å; H168-Y523 AromaticContact NE2-CD2 3.52Å; H168-Y523 AromaticContact NE2-CE1 3.75Å; H168-Y523 AromaticContact NE2-CE2 3.84Å; H168-Y523 AromaticContact NE2-CG 3.28Å; H168-Y523 VanDerWaalsContact NE2-CG 3.28Å; H168-Y523 AromaticContact NE2-CZ 3.93Å; H168-F541 AromaticContact CE1-CD1 3.57Å; H168-F541 AromaticContact CE1-CG 3.88Å; H168-F541 AromaticContact ND1-CD1 3.64Å; H168-F541 AromaticContact ND1-CE1 3.89Å; H168-Y550 AromaticContact CE1-CE1 3.64Å; H168-Y550 AromaticContact CE1-CZ 3.95Å; H168-Y550 PolarHBondContact CE1-OH 2.83Å; H168-Y550 AromaticContact ND1-CE1 3.93Å; H168-Y550 AromaticContact ND1-CZ 3.82Å; H168-Y550 PolarHBondContact ND1-OH 2.82Å; H168-W562 HydrophobicContact CB-CH2 3.81Å; H168-W562 HydrophobicContact CB-CZ3 3.7Å; H168-W562 AromaticContact CD2-CH2 3.99Å; H168-W562 AromaticContact CG-CH2 3.67Å
169	T	86.2	Confident	90.6	Very high	20 Å²	20	45.8 Å²	45.8	12%	0.123	25%	0.248	C	C	.	.			trans	-134.1	161.3	169.9	90.4	0	0	0	0	108.8	V171 E172 V174 Y550	T169-V171 PolarHBondContact O-N 3.39Å; T169-V171 PolarHBondContact OG1-N 2.9Å; T169-E172 WeakPolarHBondContact CG2-O 3.4Å; T169-E172 PolarHBondContact OG1-N 2.83Å; T169-E172 VanDerWaalsContact OG1-N 3.17Å; T169-E172 PolarHBondContact OG1-O 2.85Å; T169-V174 HydrophobicContact CG2-CG2 3.96Å; T169-Y550 WeakPolarHBondContact O-CE1 3.42Å
170	A	78	Confident	90.9	Very high	51 Å²	51	46 Å²	46	42%	0.421	26%	0.26	S	S	.	.	S	Bend	trans	-69.9	-11.6	-178.7	0	0	0	0	0	114.5
171	V	79.4	Confident	91	Very high	84 Å²	84	51.5 Å²	51.5	51%	0.509	28%	0.283	S	S	.	.	S	Bend	trans	-110.1	-61.4	-175.7	-176.5	0	0	0	0	110.8	T169 Y550	T169-V171 PolarHBondContact O-N 3.39Å; T169-V171 PolarHBondContact OG1-N 2.9Å; V171-Y550 WeakPolarHBondContact O-CB 3.17Å; V171-Y550 WeakPolarHBondContact O-CD1 3.43Å
172	E	80.3	Confident	91.1	Very high	120 Å²	120	46.5 Å²	46.5	56%	0.561	26%	0.259	S	S	*	.	S	Bend	trans	-149.5	136.7	-178	-169	176.2	-172.5	0	0	109.4	T169	T169-E172 WeakPolarHBondContact CG2-O 3.4Å; T169-E172 PolarHBondContact OG1-N 2.83Å; T169-E172 VanDerWaalsContact OG1-N 3.17Å; T169-E172 PolarHBondContact OG1-O 2.85Å
173	P	88.1	Confident	91.1	Very high	19 Å²	19	45.8 Å²	45.8	12%	0.123	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-68.4	143.3	-179	28.3	-31.7	0	0	0	110.3	F153 Y166 W167 Y550 M552	F153-P173 HydrophobicContact CE1-CB 4.11Å; F153-P173 HydrophobicContact CZ-CB 3.87Å; F153-P173 HydrophobicContact CZ-CG 4.42Å; Y166-P173 HydrophobicContact CD1-CB 3.92Å; Y166-P173 HydrophobicContact CD1-CG 4.25Å; Y166-P173 HydrophobicContact CG-CB 4.28Å; W167-P173 CarbonylContact O-C 3.56Å; W167-P173 VanDerWaalsContact O-CA 3.31Å; W167-P173 WeakPolarHBondContact O-CA 3.36Å; P173-Y550 VanDerWaalsContact CD-CE2 3.47Å; P173-Y550 HydrophobicContact CG-CE2 4.08Å; P173-M552 HydrophobicContact CG-SD 3.72Å
174	V	90.1	Very high	90.8	Very high	73 Å²	73	49.4 Å²	49.4	44%	0.442	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.6	177.4	177.7	0	0	0	0	108.5	Y166 W167 T169 A176	Y166-V174 CarbonylContact C-O 3.54Å; Y166-V174 WeakPolarHBondContact CA-O 3.24Å; W167-V174 HydrophobicContact CB-CB 4.25Å; W167-V174 PolarHBondContact N-O 2.92Å; W167-V174 PolarHBondContact O-N 3.33Å; T169-V174 HydrophobicContact CG2-CG2 3.96Å; V174-A176 PolarHBondContact O-N 2.91Å
175	V	93.1	Very high	90.5	Very high	75 Å²	75	50 Å²	50	46%	0.455	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	122.2	176.7	-178.9	0	0	0	0	109.1	Y166 E178	Y166-V175 HydrophobicContact CD1-CB 4.43Å; Y166-V175 HydrophobicContact CD1-CG2 3.92Å; Y166-V175 HydrophobicContact CE1-CB 4.36Å; Y166-V175 HydrophobicContact CE1-CG2 3.44Å; Y166-V175 VanDerWaalsContact CE1-CG2 3.44Å; V175-E178 HydrophobicContact CG1-CB 3.91Å
176	A	92.7	Very high	90.2	Very high	32 Å²	32	52.2 Å²	52.2	26%	0.264	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-48.7	170.7	0	0	0	0	0	110.3	V165 V174	V165-A176 HydrophobicContact CB-CB 4.39Å; V165-A176 HydrophobicContact CG1-CB 4.14Å; V165-A176 WeakPolarHBondContact O-CA 3.35Å; V165-A176 VanDerWaalsContact O-CB 3.31Å; V165-A176 WeakPolarHBondContact O-CB 3.42Å; V165-A176 PolarHBondContact O-N 2.91Å; V174-A176 PolarHBondContact O-N 2.91Å
177	E	94.1	Very high	90.2	Very high	46 Å²	46	51.7 Å²	51.7	22%	0.215	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	135.4	178.5	-169.2	83.7	-174.4	0	0	108.3	S164 V165 R179 W182 F212	S164-E177 CarbonylContact C-O 3.54Å; S164-E177 WeakPolarHBondContact CA-O 3.44Å; V165-E177 PolarHBondContact N-O 3.5Å; V165-E177 PolarHBondContact O-N 2.86Å; V165-E177 VanDerWaalsContact O-N 3.17Å; E177-R179 HydrophobicContact CG-CG 4.33Å; E177-R179 IonicContact OE1-CZ 3.93Å; E177-R179 IonicContact OE1-NE 2.89Å; E177-R179 PolarHBondContact OE1-NE 3.02Å; E177-R179 IonicContact OE1-NH2 2.7Å; E177-R179 PolarHBondContact OE1-NH2 3.42Å; E177-W182 HydrophobicContact CB-CH2 4.34Å; E177-W182 HydrophobicContact CB-CZ3 4.33Å; E177-W182 HydrophobicContact CG-CH2 4.08Å; E177-W182 HydrophobicContact CG-CZ3 4.15Å; E177-F212 HydrophobicContact CB-CD2 3.79Å; E177-F212 HydrophobicContact CB-CE2 4.32Å; E177-F212 HydrophobicContact CG-CD2 4.21Å
178	E	94.4	Very high	90.2	Very high	93 Å²	93	55 Å²	55	44%	0.435	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	132.6	174.4	172.1	160.7	106	0	0	109.2	Y157 T162 S164 V175	Y157-E178 PolarHBondContact OH-OE2 3.15Å; T162-E178 HydrophobicContact CG2-CG 3.76Å; S164-E178 WeakPolarHBondContact OG-CB 3.33Å; S164-E178 WeakPolarHBondContact OG-CG 3.27Å; S164-E178 PolarHBondContact OG-OE2 2.95Å; V175-E178 HydrophobicContact CG1-CB 3.91Å
179	R	94.5	Very high	90.4	Very high	63 Å²	63	55.2 Å²	55.2	24%	0.238	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	132.2	-178	-64.9	-178	-176	168.4	2.2	110.8	G163 E177 W182 W207 K211 F212	G163-R179 PolarHBondContact N-O 3.02Å; G163-R179 VanDerWaalsContact N-O 3.11Å; G163-R179 PolarHBondContact O-N 2.83Å; E177-R179 HydrophobicContact CG-CG 4.33Å; E177-R179 IonicContact OE1-CZ 3.93Å; E177-R179 IonicContact OE1-NE 2.89Å; E177-R179 PolarHBondContact OE1-NE 3.02Å; E177-R179 IonicContact OE1-NH2 2.7Å; E177-R179 PolarHBondContact OE1-NH2 3.42Å; R179-W182 HydrophobicContact CB-CB 3.87Å; R179-W182 HydrophobicContact CB-CD2 3.97Å; R179-W182 HydrophobicContact CB-CE3 3.95Å; R179-W182 HydrophobicContact CB-CG 3.93Å; R179-W182 HydrophobicContact CG-CD2 4.26Å; R179-W182 HydrophobicContact CG-CE3 4.19Å; R179-W207 VanDerWaalsContact NH1-CE3 3.31Å; R179-K211 PolarHBondContact NH2-O 2.85Å; R179-F212 PolarHBondContact NH1-O 3.13Å; R179-F212 PolarHBondContact NH2-O 2.86Å
180	A	93.7	Very high	90.9	Very high	79 Å²	79	54.2 Å²	54.2	65%	0.653	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	136.9	168.6	0	0	0	0	0	110.2	E161 W182	E161-A180 CarbonylContact O-C 3.41Å; E161-A180 WeakPolarHBondContact O-CA 3.36Å; A180-W182 PolarHBondContact O-N 2.9Å
181	H	91.3	Very high	91.6	Very high	126 Å²	126	54.6 Å²	54.6	58%	0.583	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	41.1	-179.4	-54.5	-68.3	0	0	0	113.7	E161 T183	E161-H181 PolarHBondContact O-N 2.89Å; H181-T183 PolarHBondContact O-N 3.01Å
182	W	94.2	Very high	92.3	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.027	28%	0.28	C	S	.	.	S	Bend	trans	-67	-25.7	179.5	-160.3	-3	0	0	0	112.5	V165 E177 R179 A180 M187 L196 T198 H200 W207 F212	V165-W182 HydrophobicContact CG2-CH2 3.91Å; V165-W182 HydrophobicContact CG2-CZ3 3.92Å; E177-W182 HydrophobicContact CB-CH2 4.34Å; E177-W182 HydrophobicContact CB-CZ3 4.33Å; E177-W182 HydrophobicContact CG-CH2 4.08Å; E177-W182 HydrophobicContact CG-CZ3 4.15Å; R179-W182 HydrophobicContact CB-CB 3.87Å; R179-W182 HydrophobicContact CB-CD2 3.97Å; R179-W182 HydrophobicContact CB-CE3 3.95Å; R179-W182 HydrophobicContact CB-CG 3.93Å; R179-W182 HydrophobicContact CG-CD2 4.26Å; R179-W182 HydrophobicContact CG-CE3 4.19Å; A180-W182 PolarHBondContact O-N 2.9Å; W182-M187 HydrophobicContact CB-CE 4.12Å; W182-M187 HydrophobicContact CD2-CE 3.28Å; W182-M187 HydrophobicContact CE3-CE 3.42Å; W182-M187 VanDerWaalsContact CE3-CE 3.42Å; W182-M187 HydrophobicContact CG-CE 3.65Å; W182-M187 HydrophobicContact CH2-CE 4.26Å; W182-M187 HydrophobicContact CZ2-CE 4.15Å; W182-M187 HydrophobicContact CZ3-CE 3.93Å; W182-L196 HydrophobicContact CH2-CD2 3.84Å; W182-L196 HydrophobicContact CZ2-CD2 3.93Å; W182-L196 HydrophobicContact CZ3-CD2 4.49Å; W182-T198 HydrophobicContact CG-CG2 4.4Å; W182-T198 WeakPolarHBondContact O-CB 3.46Å; W182-H200 PolarHBondContact O-CE1 2.62Å; W182-H200 PolarHBondContact O-NE2 3.15Å; W182-W207 AromaticContact CD1-CE2 3.78Å; W182-W207 AromaticContact CD1-CZ2 3.68Å; W182-W207 AromaticContact CD1-NE1 3.97Å; W182-W207 HydrophobicContact CZ2-CB 4.43Å; W182-W207 HydrophobicContact CZ2-CD2 4.45Å; W182-W207 HydrophobicContact CZ2-CG 4.25Å; W182-W207 AromaticContact NE1-CD1 3.76Å; W182-W207 AromaticContact NE1-CD2 3.45Å; W182-W207 AromaticContact NE1-CE2 3.14Å; W182-W207 AromaticContact NE1-CG 3.82Å; W182-W207 AromaticContact NE1-CH2 3.99Å; W182-W207 AromaticContact NE1-CZ2 3.45Å; W182-W207 AromaticContact NE1-NE1 3.38Å; W182-F212 HydrophobicContact CH2-CB 3.87Å; W182-F212 HydrophobicContact CH2-CD1 4.12Å; W182-F212 HydrophobicContact CH2-CD2 4.24Å; W182-F212 AromaticContact CH2-CG 3.8Å; W182-F212 HydrophobicContact CH2-CG 3.8Å; W182-F212 HydrophobicContact CZ2-CB 3.73Å; W182-F212 HydrophobicContact CZ2-CD1 4.27Å; W182-F212 HydrophobicContact CZ2-CG 4.07Å
183	T	93.5	Very high	92.9	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.018	25%	0.253	C	S	.	.			trans	-140.8	149.8	174.1	-174.3	0	0	0	0	109.3	V156 H181 G185 W186 M187 M199	V156-T183 HydrophobicContact CG1-CG2 4.16Å; V156-T183 HydrophobicContact CG2-CG2 3.76Å; H181-T183 PolarHBondContact O-N 3.01Å; T183-G185 VanDerWaalsContact C-N 3.29Å; T183-G185 WeakPolarHBondContact CG2-O 3.5Å; T183-G185 PolarHBondContact OG1-N 2.99Å; T183-W186 PolarHBondContact OG1-O 3.27Å; T183-M187 HydrophobicContact CG2-CG 3.57Å; T183-M187 HydrophobicContact CG2-SD 4.31Å; T183-M199 PolarHBondContact OG1-N 3.12Å; T183-M199 PolarHBondContact OG1-O 3.14Å; T183-M199 VanDerWaalsContact OG1-O 3.08Å
184	D	90.1	Very high	93.2	Very high	77 Å²	77	47.8 Å²	47.8	41%	0.412	25%	0.251	S	S	.	.	S	Bend	trans	-83.8	-11.4	171.8	-61.2	-17	0	0	0	111	M199 H200 S201	D184-M199 HydrophobicContact CB-SD 4.27Å; D184-M199 PolarHBondContact N-O 2.89Å; D184-H200 IonicContact OD1-ND1 2.99Å; D184-H200 VanDerWaalsContact OD2-CA 3.27Å; D184-H200 WeakPolarHBondContact OD2-CA 3.32Å; D184-H200 IonicContact OD2-ND1 2.96Å; D184-S201 PolarHBondContact OD2-N 2.69Å
185	G	89.2	Confident	93.4	Very high	12 Å²	12	45.4 Å²	45.4	12%	0.124	23%	0.234	C	C	.	.	S	Bend	trans	-151.8	-97.6	179	0	0	0	0	0	113.4	T183	T183-G185 VanDerWaalsContact C-N 3.29Å; T183-G185 WeakPolarHBondContact CG2-O 3.5Å; T183-G185 PolarHBondContact OG1-N 2.99Å
186	W	91.3	Very high	93.6	Very high	47 Å²	47	41.8 Å²	41.8	18%	0.178	21%	0.212	C	C	.	.			trans	-97.3	157.4	-175.4	52.7	-103.1	0	0	0	112.4	T183 R188 A197 M199 K224 I226 T559	T183-W186 PolarHBondContact OG1-O 3.27Å; W186-R188 HydrophobicContact CE3-CB 3.72Å; W186-R188 HydrophobicContact CZ3-CB 3.75Å; W186-A197 HydrophobicContact CZ3-CB 4.13Å; W186-M199 HydrophobicContact CD2-CB 4.03Å; W186-M199 HydrophobicContact CE3-CB 4.45Å; W186-M199 HydrophobicContact CG-CB 4.46Å; W186-M199 HydrophobicContact CH2-CB 4.22Å; W186-M199 HydrophobicContact CZ2-CB 3.87Å; W186-M199 HydrophobicContact CZ2-CG 4.2Å; W186-M199 PolarHBondContact O-N 3.32Å; W186-K224 PolarHBondContact NE1-O 2.99Å; W186-I226 HydrophobicContact CH2-CB 4.01Å; W186-I226 HydrophobicContact CH2-CD1 3.47Å; W186-I226 VanDerWaalsContact CH2-CD1 3.47Å; W186-I226 HydrophobicContact CH2-CG1 3.38Å; W186-I226 HydrophobicContact CH2-CG2 3.54Å; W186-I226 HydrophobicContact CZ2-CB 4.49Å; W186-I226 HydrophobicContact CZ2-CG1 4.12Å; W186-I226 HydrophobicContact CZ2-CG2 3.9Å; W186-I226 HydrophobicContact CZ3-CD1 3.63Å; W186-I226 HydrophobicContact CZ3-CG1 3.85Å; W186-T559 HydrophobicContact CB-CG2 3.95Å
187	M	94.5	Very high	93.8	Very high	6 Å²	6	40.3 Å²	40.3	3%	0.03	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.3	164.3	-61	-177.8	101.4	0	0	108.4	V156 W182 T183 L196 A197 T198	V156-M187 HydrophobicContact CG2-CB 4.05Å; V156-M187 HydrophobicContact CG2-CG 3.42Å; V156-M187 VanDerWaalsContact CG2-CG 3.42Å; V156-M187 HydrophobicContact CG2-SD 3.55Å; V156-M187 VanDerWaalsContact CG2-SD 3.55Å; W182-M187 HydrophobicContact CB-CE 4.12Å; W182-M187 HydrophobicContact CD2-CE 3.28Å; W182-M187 HydrophobicContact CE3-CE 3.42Å; W182-M187 VanDerWaalsContact CE3-CE 3.42Å; W182-M187 HydrophobicContact CG-CE 3.65Å; W182-M187 HydrophobicContact CH2-CE 4.26Å; W182-M187 HydrophobicContact CZ2-CE 4.15Å; W182-M187 HydrophobicContact CZ3-CE 3.93Å; T183-M187 HydrophobicContact CG2-CG 3.57Å; T183-M187 HydrophobicContact CG2-SD 4.31Å; M187-L196 HydrophobicContact CB-CD1 4.21Å; M187-L196 HydrophobicContact CE-CD2 3.69Å; M187-L196 HydrophobicContact CE-CG 4.33Å; M187-A197 WeakPolarHBondContact CA-O 3.47Å; M187-T198 HydrophobicContact CE-CG2 3.45Å; M187-T198 VanDerWaalsContact CE-CG2 3.45Å; M187-T198 HydrophobicContact CG-CG2 4.16Å
188	R	94.3	Very high	93.9	Very high	116 Å²	116	38.1 Å²	38.1	44%	0.438	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130.9	-178.1	-168.8	172.9	-174.7	169.2	5.4	111.1	W186 A197 I226	W186-R188 HydrophobicContact CE3-CB 3.72Å; W186-R188 HydrophobicContact CZ3-CB 3.75Å; R188-A197 PolarHBondContact N-O 2.86Å; R188-A197 WeakPolarHBondContact O-CB 3.37Å; R188-A197 PolarHBondContact O-N 2.85Å; R188-I226 PolarHBondContact NH1-O 2.93Å
189	W	96.2	Very high	93.8	Very high	10 Å²	10	35.4 Å²	35.4	4%	0.038	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	147.5	171.7	-66.2	108.7	0	0	0	111.4	A154 V165 L196 F212 T561 R563 P564	A154-W189 HydrophobicContact CB-CZ2 3.88Å; V165-W189 HydrophobicContact CG1-CH2 4.33Å; V165-W189 HydrophobicContact CG1-CZ2 4.19Å; V165-W189 HydrophobicContact CG2-CH2 4.32Å; V165-W189 HydrophobicContact CG2-CZ2 4.2Å; W189-L196 HydrophobicContact CD2-CD1 3.73Å; W189-L196 HydrophobicContact CE3-CB 3.89Å; W189-L196 HydrophobicContact CE3-CD1 3.91Å; W189-L196 HydrophobicContact CE3-CG 4.47Å; W189-L196 HydrophobicContact CG-CD1 4.25Å; W189-L196 HydrophobicContact CH2-CB 4.19Å; W189-L196 HydrophobicContact CH2-CD1 4.25Å; W189-L196 HydrophobicContact CH2-CD2 4.24Å; W189-L196 HydrophobicContact CH2-CG 4.48Å; W189-L196 HydrophobicContact CZ2-CD1 4.08Å; W189-L196 HydrophobicContact CZ2-CD2 4.46Å; W189-L196 HydrophobicContact CZ3-CB 3.69Å; W189-L196 HydrophobicContact CZ3-CD1 4.18Å; W189-L196 HydrophobicContact CZ3-CG 4.36Å; W189-F212 AromaticContact CH2-CE1 3.47Å; W189-F212 HydrophobicContact CH2-CE1 3.47Å; W189-F212 VanDerWaalsContact CH2-CE1 3.47Å; W189-F212 AromaticContact CH2-CZ 3.7Å; W189-F212 HydrophobicContact CH2-CZ 3.7Å; W189-F212 AromaticContact CZ3-CE1 3.79Å; W189-F212 HydrophobicContact CZ3-CE1 3.79Å; W189-F212 HydrophobicContact CZ3-CZ 4.36Å; W189-T561 VanDerWaalsContact CD1-CG2 3.44Å; W189-T561 PolarHBondContact NE1-O 2.84Å; W189-R563 HydrophobicContact CD2-CB 4.06Å; W189-R563 HydrophobicContact CD2-CG 3.86Å; W189-R563 HydrophobicContact CE3-CB 4.5Å; W189-R563 HydrophobicContact CE3-CG 3.82Å; W189-R563 HydrophobicContact CG-CB 4.49Å; W189-R563 HydrophobicContact CH2-CB 4.37Å; W189-R563 HydrophobicContact CH2-CG 4.01Å; W189-R563 HydrophobicContact CZ2-CB 3.92Å; W189-R563 HydrophobicContact CZ2-CG 4.04Å; W189-R563 HydrophobicContact CZ3-CG 3.89Å; W189-P564 HydrophobicContact CB-CG 4.09Å
190	S	95.6	Very high	93.8	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.			trans	-67.9	156.8	163.8	63.3	0	0	0	0	110.7	R192 G193 T194 Y195 E232	S190-R192 PolarHBondContact O-N 3.12Å; S190-G193 WeakPolarHBondContact O-CA 3.47Å; S190-G193 PolarHBondContact O-N 3.19Å; S190-T194 PolarHBondContact OG-N 2.88Å; S190-Y195 PolarHBondContact N-O 3.12Å; S190-Y195 PolarHBondContact OG-N 3.29Å; S190-Y195 PolarHBondContact OG-O 3.14Å; S190-E232 WeakPolarHBondContact CB-OE1 3.17Å; S190-E232 PolarHBondContact OG-OE1 2.96Å
191	P	93.2	Very high	93.6	Very high	59 Å²	59	33.7 Å²	33.7	38%	0.383	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-26.6	-172.5	-31.1	35.4	0	0	0	115.7	F228 P564	P191-F228 HydrophobicContact CG-CB 3.72Å; P191-P564 VanDerWaalsContact O-CB 3.24Å; P191-P564 WeakPolarHBondContact O-CB 3.49Å
192	R	93.3	Very high	93.6	Very high	68 Å²	68	32.9 Å²	32.9	26%	0.257	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	6.4	178.2	-46.3	177.2	67.6	173.4	6.2	112.6	S190 T194 E232 P566	S190-R192 PolarHBondContact O-N 3.12Å; R192-T194 PolarHBondContact O-N 3.37Å; R192-E232 VanDerWaalsContact CA-OE1 3.3Å; R192-E232 WeakPolarHBondContact CA-OE1 3.45Å; R192-E232 VanDerWaalsContact CB-CD 3.49Å; R192-E232 HydrophobicContact CB-CG 4.33Å; R192-E232 WeakPolarHBondContact CB-OE1 3.3Å; R192-E232 HydrophobicContact CG-CG 3.99Å; R192-E232 PolarHBondContact N-OE1 3.2Å; R192-P566 HydrophobicContact CB-CB 4.16Å; R192-P566 WeakPolarHBondContact O-CD 3.42Å
193	G	93.7	Very high	93.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	S	Bend	trans	69.1	11.2	-179.3	0	0	0	0	0	114.6	S190 E232 R563	S190-G193 WeakPolarHBondContact O-CA 3.47Å; S190-G193 PolarHBondContact O-N 3.19Å; G193-E232 PolarHBondContact N-OE1 3.37Å; G193-R563 PolarHBondContact O-NE 3.45Å; G193-R563 PolarHBondContact O-NH2 3.47Å
194	T	94.2	Very high	93.6	Very high	12 Å²	12	32.5 Å²	32.5	7%	0.074	16%	0.164	C	C	.	.	S	Bend	trans	-67	-39.6	179.4	-50.9	0	0	0	0	111.6	L140 S190 R192 E232	L140-T194 HydrophobicContact CB-CG2 3.77Å; L140-T194 HydrophobicContact CD1-CG2 4.08Å; S190-T194 PolarHBondContact OG-N 2.88Å; R192-T194 PolarHBondContact O-N 3.37Å; T194-E232 WeakPolarHBondContact CB-OE2 3.31Å; T194-E232 PolarHBondContact N-OE1 2.93Å; T194-E232 PolarHBondContact OG1-OE2 3.16Å
195	Y	95.2	Very high	93.8	Very high	22 Å²	22	29.7 Å²	29.7	9%	0.086	15%	0.149	C	C	.	.			trans	-119	144.9	-175.9	-52.8	-57.4	0	0	0	111.6	L140 S190 W207 I215 E232 V257	L140-Y195 HydrophobicContact CD1-CE1 4.09Å; S190-Y195 PolarHBondContact N-O 3.12Å; S190-Y195 PolarHBondContact OG-N 3.29Å; S190-Y195 PolarHBondContact OG-O 3.14Å; Y195-W207 CarbonylContact C-O 3.54Å; Y195-W207 WeakPolarHBondContact CA-O 3.43Å; Y195-I215 HydrophobicContact CD1-CD1 3.58Å; Y195-I215 HydrophobicContact CE1-CD1 3.49Å; Y195-I215 VanDerWaalsContact CE1-CD1 3.49Å; Y195-I215 HydrophobicContact CE1-CG2 4.27Å; Y195-E232 HydrophobicContact CE2-CB 4.33Å; Y195-V257 HydrophobicContact CD2-CG1 4.01Å; Y195-V257 HydrophobicContact CE2-CG1 3.54Å
196	L	96.3	Very high	94.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.3	165.1	-176.5	61.7	0	0	0	107.9	A154 V165 W182 M187 W189 W207 F212	A154-L196 HydrophobicContact CB-CD1 4.26Å; V165-L196 HydrophobicContact CG2-CD2 3.89Å; W182-L196 HydrophobicContact CH2-CD2 3.84Å; W182-L196 HydrophobicContact CZ2-CD2 3.93Å; W182-L196 HydrophobicContact CZ3-CD2 4.49Å; M187-L196 HydrophobicContact CB-CD1 4.21Å; M187-L196 HydrophobicContact CE-CD2 3.69Å; M187-L196 HydrophobicContact CE-CG 4.33Å; W189-L196 HydrophobicContact CD2-CD1 3.73Å; W189-L196 HydrophobicContact CE3-CB 3.89Å; W189-L196 HydrophobicContact CE3-CD1 3.91Å; W189-L196 HydrophobicContact CE3-CG 4.47Å; W189-L196 HydrophobicContact CG-CD1 4.25Å; W189-L196 HydrophobicContact CH2-CB 4.19Å; W189-L196 HydrophobicContact CH2-CD1 4.25Å; W189-L196 HydrophobicContact CH2-CD2 4.24Å; W189-L196 HydrophobicContact CH2-CG 4.48Å; W189-L196 HydrophobicContact CZ2-CD1 4.08Å; W189-L196 HydrophobicContact CZ2-CD2 4.46Å; W189-L196 HydrophobicContact CZ3-CB 3.69Å; W189-L196 HydrophobicContact CZ3-CD1 4.18Å; W189-L196 HydrophobicContact CZ3-CG 4.36Å; L196-W207 HydrophobicContact CB-CB 4.41Å; L196-W207 PolarHBondContact N-O 3.46Å; L196-W207 VanDerWaalsContact O-CD1 3.31Å; L196-W207 PolarHBondContact O-N 3.32Å; L196-F212 HydrophobicContact CB-CD1 4.38Å; L196-F212 HydrophobicContact CB-CE1 4.34Å; L196-F212 HydrophobicContact CD2-CD1 4.24Å; L196-F212 HydrophobicContact CD2-CE1 4.24Å
197	A	96.6	Very high	94.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.1	175.9	0	0	0	0	0	110.7	W186 M187 R188 V204 I205 L206 I226 F228	W186-A197 HydrophobicContact CZ3-CB 4.13Å; M187-A197 WeakPolarHBondContact CA-O 3.47Å; R188-A197 PolarHBondContact N-O 2.86Å; R188-A197 WeakPolarHBondContact O-CB 3.37Å; R188-A197 PolarHBondContact O-N 2.85Å; A197-V204 HydrophobicContact CB-CG1 4.12Å; A197-I205 WeakPolarHBondContact CA-O 3.36Å; A197-L206 HydrophobicContact CB-CD2 3.53Å; A197-I226 HydrophobicContact CB-CD1 3.31Å; A197-F228 HydrophobicContact CB-CE2 4.14Å; A197-F228 HydrophobicContact CB-CZ 4.08Å
198	T	95.8	Very high	94.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.2	171.5	61.6	0	0	0	0	110.5	W182 M187 H200 V204 I205 W207	W182-T198 HydrophobicContact CG-CG2 4.4Å; W182-T198 WeakPolarHBondContact O-CB 3.46Å; M187-T198 HydrophobicContact CE-CG2 3.45Å; M187-T198 VanDerWaalsContact CE-CG2 3.45Å; M187-T198 HydrophobicContact CG-CG2 4.16Å; T198-H200 PolarHBondContact OG1-CD2 3.48Å; T198-H200 PolarHBondContact OG1-NE2 3.14Å; T198-V204 WeakPolarHBondContact O-CA 3.35Å; T198-I205 PolarHBondContact N-O 2.83Å; T198-I205 PolarHBondContact O-N 3.18Å; T198-W207 VanDerWaalsContact CG2-NE1 3.33Å; T198-W207 PolarHBondContact OG1-NE1 3.36Å
199	M	93.8	Very high	94	Very high	36 Å²	36	22.2 Å²	22.2	18%	0.177	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	132.1	178.2	-177.1	-89.1	-84	0	0	109.7	T183 D184 W186	T183-M199 PolarHBondContact OG1-N 3.12Å; T183-M199 PolarHBondContact OG1-O 3.14Å; T183-M199 VanDerWaalsContact OG1-O 3.08Å; D184-M199 HydrophobicContact CB-SD 4.27Å; D184-M199 PolarHBondContact N-O 2.89Å; W186-M199 HydrophobicContact CD2-CB 4.03Å; W186-M199 HydrophobicContact CE3-CB 4.45Å; W186-M199 HydrophobicContact CG-CB 4.46Å; W186-M199 HydrophobicContact CH2-CB 4.22Å; W186-M199 HydrophobicContact CZ2-CB 3.87Å; W186-M199 HydrophobicContact CZ2-CG 4.2Å; W186-M199 PolarHBondContact O-N 3.32Å
200	H	93.6	Very high	93.6	Very high	34 Å²	34	29 Å²	29	16%	0.157	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.8	173	-59.5	-81.2	0	0	0	109.9	W182 D184 T198 L202 G203	W182-H200 PolarHBondContact O-CE1 2.62Å; W182-H200 PolarHBondContact O-NE2 3.15Å; D184-H200 IonicContact OD1-ND1 2.99Å; D184-H200 VanDerWaalsContact OD2-CA 3.27Å; D184-H200 WeakPolarHBondContact OD2-CA 3.32Å; D184-H200 IonicContact OD2-ND1 2.96Å; T198-H200 PolarHBondContact OG1-CD2 3.48Å; T198-H200 PolarHBondContact OG1-NE2 3.14Å; H200-L202 PolarHBondContact O-N 3.24Å; H200-L202 VanDerWaalsContact O-N 3.12Å; H200-G203 CarbonylContact C-O 3.54Å; H200-G203 WeakPolarHBondContact CA-O 3.46Å; H200-G203 WeakPolarHBondContact CB-O 3.29Å; H200-G203 PolarHBondContact N-O 2.98Å; H200-G203 PolarHBondContact O-N 2.72Å
201	S	90.2	Very high	93.3	Very high	72 Å²	72	35.7 Å²	35.7	50%	0.503	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-38	176.5	53.6	0	0	0	0	113.9	D184 S221 R222	D184-S201 PolarHBondContact OD2-N 2.69Å; S201-S221 WeakPolarHBondContact O-CA 3.29Å; S201-R222 PolarHBondContact O-N 3.43Å
202	L	91.2	Very high	93.2	Very high	110 Å²	110	32.9 Å²	32.9	58%	0.576	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.6	-179.1	-61.3	177.1	0	0	0	114.7	H200 H220	H200-L202 PolarHBondContact O-N 3.24Å; H200-L202 VanDerWaalsContact O-N 3.12Å; L202-H220 PolarHBondContact O-N 2.86Å
203	G	92.1	Very high	93.2	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.4	-170.6	-172.6	0	0	0	0	0	115.3	H200 F218 H220	H200-G203 CarbonylContact C-O 3.54Å; H200-G203 WeakPolarHBondContact CA-O 3.46Å; H200-G203 WeakPolarHBondContact CB-O 3.29Å; H200-G203 PolarHBondContact N-O 2.98Å; H200-G203 PolarHBondContact O-N 2.72Å; G203-F218 VanDerWaalsContact CA-O 3.25Å; G203-F218 WeakPolarHBondContact CA-O 3.47Å; G203-H220 WeakPolarHBondContact CA-O 3.5Å; G203-H220 PolarHBondContact N-O 2.85Å
204	V	95	Very high	93.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.7	176.7	179.5	0	0	0	0	108.9	A197 T198 L206 F218 V223 I226 M235 T237	A197-V204 HydrophobicContact CB-CG1 4.12Å; T198-V204 WeakPolarHBondContact O-CA 3.35Å; V204-L206 HydrophobicContact CG1-CD2 4.41Å; V204-F218 HydrophobicContact CB-CB 4.36Å; V204-F218 PolarHBondContact N-O 3.12Å; V204-F218 PolarHBondContact O-N 2.81Å; V204-V223 HydrophobicContact CG2-CB 4.09Å; V204-V223 HydrophobicContact CG2-CG1 3.82Å; V204-V223 HydrophobicContact CG2-CG2 4.23Å; V204-I226 HydrophobicContact CG1-CG2 4.4Å; V204-I226 HydrophobicContact CG2-CG2 3.81Å; V204-M235 HydrophobicContact CB-CE 4.5Å; V204-M235 HydrophobicContact CG1-CE 4.37Å; V204-M235 HydrophobicContact CG1-SD 4.24Å; V204-T237 HydrophobicContact CG2-CG2 4.2Å
205	I	95.6	Very high	93	Very high	17 Å²	17	43.2 Å²	43.2	9%	0.087	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	133	174.6	-61	179.2	0	0	0	108.6	A197 T198 W207 R214 R217	A197-I205 WeakPolarHBondContact CA-O 3.36Å; T198-I205 PolarHBondContact N-O 2.83Å; T198-I205 PolarHBondContact O-N 3.18Å; I205-W207 HydrophobicContact CB-CZ2 4.37Å; I205-W207 HydrophobicContact CD1-CZ2 4.47Å; I205-W207 HydrophobicContact CG2-CD2 4.08Å; I205-W207 VanDerWaalsContact CG2-CE2 3.48Å; I205-W207 HydrophobicContact CG2-CH2 4.46Å; I205-W207 HydrophobicContact CG2-CZ2 3.71Å; I205-R214 HydrophobicContact CG2-CG 3.32Å; I205-R217 HydrophobicContact CG1-CG 4.28Å
206	L	96.1	Very high	92.8	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.8	172.4	-60.7	-174.6	0	0	0	110.4	A197 V204 I215 G216 F218 F228 M235 V257	A197-L206 HydrophobicContact CB-CD2 3.53Å; V204-L206 HydrophobicContact CG1-CD2 4.41Å; L206-I215 PolarHBondContact O-N 2.77Å; L206-G216 PolarHBondContact N-O 2.85Å; L206-G216 PolarHBondContact O-N 3.17Å; L206-F218 HydrophobicContact CB-CE2 4.13Å; L206-F218 HydrophobicContact CD1-CD2 4.28Å; L206-F218 HydrophobicContact CD1-CE2 3.33Å; L206-F218 HydrophobicContact CD1-CZ 3.65Å; L206-F218 HydrophobicContact CG-CD2 4Å; L206-F218 HydrophobicContact CG-CE2 3.39Å; L206-F218 HydrophobicContact CG-CZ 4.23Å; L206-F228 HydrophobicContact CD1-CE1 4.19Å; L206-F228 HydrophobicContact CD1-CZ 4.48Å; L206-F228 HydrophobicContact CD2-CE1 4.15Å; L206-F228 HydrophobicContact CD2-CZ 3.62Å; L206-M235 HydrophobicContact CD2-SD 4.29Å; L206-V257 HydrophobicContact CD1-CG1 3.72Å
207	W	94.9	Very high	92.6	Very high	20 Å²	20	48.7 Å²	48.7	8%	0.076	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.1	178.3	-49.6	86.6	0	0	0	109.5	R179 W182 Y195 L196 T198 I205 F212 Q213 R214	R179-W207 VanDerWaalsContact NH1-CE3 3.31Å; W182-W207 AromaticContact CD1-CE2 3.78Å; W182-W207 AromaticContact CD1-CZ2 3.68Å; W182-W207 AromaticContact CD1-NE1 3.97Å; W182-W207 HydrophobicContact CZ2-CB 4.43Å; W182-W207 HydrophobicContact CZ2-CD2 4.45Å; W182-W207 HydrophobicContact CZ2-CG 4.25Å; W182-W207 AromaticContact NE1-CD1 3.76Å; W182-W207 AromaticContact NE1-CD2 3.45Å; W182-W207 AromaticContact NE1-CE2 3.14Å; W182-W207 AromaticContact NE1-CG 3.82Å; W182-W207 AromaticContact NE1-CH2 3.99Å; W182-W207 AromaticContact NE1-CZ2 3.45Å; W182-W207 AromaticContact NE1-NE1 3.38Å; Y195-W207 CarbonylContact C-O 3.54Å; Y195-W207 WeakPolarHBondContact CA-O 3.43Å; L196-W207 HydrophobicContact CB-CB 4.41Å; L196-W207 PolarHBondContact N-O 3.46Å; L196-W207 VanDerWaalsContact O-CD1 3.31Å; L196-W207 PolarHBondContact O-N 3.32Å; T198-W207 VanDerWaalsContact CG2-NE1 3.33Å; T198-W207 PolarHBondContact OG1-NE1 3.36Å; I205-W207 HydrophobicContact CB-CZ2 4.37Å; I205-W207 HydrophobicContact CD1-CZ2 4.47Å; I205-W207 HydrophobicContact CG2-CD2 4.08Å; I205-W207 VanDerWaalsContact CG2-CE2 3.48Å; I205-W207 HydrophobicContact CG2-CH2 4.46Å; I205-W207 HydrophobicContact CG2-CZ2 3.71Å; W207-F212 HydrophobicContact CB-CB 4.35Å; W207-F212 HydrophobicContact CB-CD1 4.4Å; W207-F212 VanDerWaalsContact CE3-O 3.23Å; W207-Q213 VanDerWaalsContact CA-O 3.3Å; W207-Q213 WeakPolarHBondContact CA-O 3.36Å; W207-R214 HydrophobicContact CD2-CG 4.43Å; W207-R214 HydrophobicContact CE3-CB 3.94Å; W207-R214 HydrophobicContact CE3-CG 4.02Å; W207-R214 HydrophobicContact CH2-CG 4.14Å; W207-R214 HydrophobicContact CZ2-CG 4.48Å; W207-R214 HydrophobicContact CZ3-CB 3.81Å; W207-R214 HydrophobicContact CZ3-CG 3.88Å
208	G	93.2	Very high	92.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	-173.5	173.7	0	0	0	0	0	112.7	F212 Q213	G208-F212 CarbonylContact O-C 3.59Å; G208-F212 VanDerWaalsContact O-CA 3.31Å; G208-F212 WeakPolarHBondContact O-CA 3.48Å; G208-Q213 PolarHBondContact N-O 2.81Å; G208-Q213 PolarHBondContact O-N 3.46Å
209	G	89.4	Confident	92.3	Very high	3 Å²	3	52.6 Å²	52.6	3%	0.031	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-176.2	-168.6	0	0	0	0	0	112.6
210	E	87.4	Confident	92.1	Very high	151 Å²	151	51.7 Å²	51.7	71%	0.706	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-41.8	-176	-172.1	179.2	173.3	0	0	113
211	K	88.6	Confident	91.8	Very high	141 Å²	141	53.3 Å²	53.3	61%	0.613	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	16.7	179.9	-59.4	-174.5	178.9	-178.3	0	113.5	R179 Q213	R179-K211 PolarHBondContact NH2-O 2.85Å; K211-Q213 PolarHBondContact O-N 3.33Å
212	F	91.6	Very high	91.6	Very high	1 Å²	1	56.9 Å²	56.9	0%	0.004	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.1	58.2	-175.3	-67.4	-84.4	0	0	0	112.9	V165 E177 R179 W182 W189 L196 W207 G208	V165-F212 HydrophobicContact CB-CE2 4.11Å; V165-F212 HydrophobicContact CB-CZ 4.2Å; V165-F212 HydrophobicContact CG1-CE2 3.99Å; V165-F212 HydrophobicContact CG1-CZ 3.81Å; V165-F212 HydrophobicContact CG2-CE1 4.3Å; V165-F212 HydrophobicContact CG2-CE2 4.18Å; V165-F212 HydrophobicContact CG2-CZ 3.98Å; E177-F212 HydrophobicContact CB-CD2 3.79Å; E177-F212 HydrophobicContact CB-CE2 4.32Å; E177-F212 HydrophobicContact CG-CD2 4.21Å; R179-F212 PolarHBondContact NH1-O 3.13Å; R179-F212 PolarHBondContact NH2-O 2.86Å; W182-F212 HydrophobicContact CH2-CB 3.87Å; W182-F212 HydrophobicContact CH2-CD1 4.12Å; W182-F212 HydrophobicContact CH2-CD2 4.24Å; W182-F212 AromaticContact CH2-CG 3.8Å; W182-F212 HydrophobicContact CH2-CG 3.8Å; W182-F212 HydrophobicContact CZ2-CB 3.73Å; W182-F212 HydrophobicContact CZ2-CD1 4.27Å; W182-F212 HydrophobicContact CZ2-CG 4.07Å; W189-F212 AromaticContact CH2-CE1 3.47Å; W189-F212 HydrophobicContact CH2-CE1 3.47Å; W189-F212 VanDerWaalsContact CH2-CE1 3.47Å; W189-F212 AromaticContact CH2-CZ 3.7Å; W189-F212 HydrophobicContact CH2-CZ 3.7Å; W189-F212 AromaticContact CZ3-CE1 3.79Å; W189-F212 HydrophobicContact CZ3-CE1 3.79Å; W189-F212 HydrophobicContact CZ3-CZ 4.36Å; L196-F212 HydrophobicContact CB-CD1 4.38Å; L196-F212 HydrophobicContact CB-CE1 4.34Å; L196-F212 HydrophobicContact CD2-CD1 4.24Å; L196-F212 HydrophobicContact CD2-CE1 4.24Å; W207-F212 HydrophobicContact CB-CB 4.35Å; W207-F212 HydrophobicContact CB-CD1 4.4Å; W207-F212 VanDerWaalsContact CE3-O 3.23Å; G208-F212 CarbonylContact O-C 3.59Å; G208-F212 VanDerWaalsContact O-CA 3.31Å; G208-F212 WeakPolarHBondContact O-CA 3.48Å
213	Q	92.1	Very high	91.4	Very high	103 Å²	103	51.8 Å²	51.8	48%	0.481	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	154.7	175.3	-67.4	-173.8	3.6	0	0	110.3	W207 G208 K211 I215	W207-Q213 VanDerWaalsContact CA-O 3.3Å; W207-Q213 WeakPolarHBondContact CA-O 3.36Å; G208-Q213 PolarHBondContact N-O 2.81Å; G208-Q213 PolarHBondContact O-N 3.46Å; K211-Q213 PolarHBondContact O-N 3.33Å; Q213-I215 PolarHBondContact O-N 2.92Å
214	R	92.6	Very high	91	Very high	160 Å²	160	58 Å²	58	60%	0.604	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	116.9	-178.4	-148.2	-175.9	-62.8	169.9	2.9	109.3	I205 W207	I205-R214 HydrophobicContact CG2-CG 3.32Å; W207-R214 HydrophobicContact CD2-CG 4.43Å; W207-R214 HydrophobicContact CE3-CB 3.94Å; W207-R214 HydrophobicContact CE3-CG 4.02Å; W207-R214 HydrophobicContact CH2-CG 4.14Å; W207-R214 HydrophobicContact CZ2-CG 4.48Å; W207-R214 HydrophobicContact CZ3-CB 3.81Å; W207-R214 HydrophobicContact CZ3-CG 3.88Å
215	I	91.7	Very high	90.6	Very high	34 Å²	34	59.2 Å²	59.2	17%	0.174	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-45	-177.4	-65.4	179.8	0	0	0	110.6	L137 L140 Y195 L206 Q213	L137-I215 HydrophobicContact CD1-CG1 4.36Å; L137-I215 HydrophobicContact CD1-CG2 3.99Å; L140-I215 HydrophobicContact CD2-CD1 3.51Å; Y195-I215 HydrophobicContact CD1-CD1 3.58Å; Y195-I215 HydrophobicContact CE1-CD1 3.49Å; Y195-I215 VanDerWaalsContact CE1-CD1 3.49Å; Y195-I215 HydrophobicContact CE1-CG2 4.27Å; L206-I215 PolarHBondContact O-N 2.77Å; Q213-I215 PolarHBondContact O-N 2.92Å
216	G	90.6	Very high	90.5	Very high	9 Å²	9	58.4 Å²	58.4	9%	0.093	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	151.7	-174.4	0	0	0	0	0	112.4	L206 C260	L206-G216 PolarHBondContact N-O 2.85Å; L206-G216 PolarHBondContact O-N 3.17Å; G216-C260 VanDerWaalsContact CA-SG 3.53Å
217	R	93.2	Very high	90.2	Very high	127 Å²	127	59.9 Å²	59.9	48%	0.479	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.5	172.5	-179.2	178.1	177.3	-178.2	-0.2	108.8	I205 P219	I205-R217 HydrophobicContact CG1-CG 4.28Å; R217-P219 WeakPolarHBondContact O-CD 3.3Å
218	F	94.8	Very high	90.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	95.2	-178.1	-60.1	-91.1	0	0	0	107.6	G203 V204 L206 H220 M235 W255 C260	G203-F218 VanDerWaalsContact CA-O 3.25Å; G203-F218 WeakPolarHBondContact CA-O 3.47Å; V204-F218 HydrophobicContact CB-CB 4.36Å; V204-F218 PolarHBondContact N-O 3.12Å; V204-F218 PolarHBondContact O-N 2.81Å; L206-F218 HydrophobicContact CB-CE2 4.13Å; L206-F218 HydrophobicContact CD1-CD2 4.28Å; L206-F218 HydrophobicContact CD1-CE2 3.33Å; L206-F218 HydrophobicContact CD1-CZ 3.65Å; L206-F218 HydrophobicContact CG-CD2 4Å; L206-F218 HydrophobicContact CG-CE2 3.39Å; L206-F218 HydrophobicContact CG-CZ 4.23Å; F218-H220 PolarHBondContact O-N 2.91Å; F218-M235 HydrophobicContact CB-CE 3.82Å; F218-M235 HydrophobicContact CD1-CE 3.56Å; F218-M235 HydrophobicContact CD2-CE 3.61Å; F218-M235 HydrophobicContact CE1-CE 4Å; F218-M235 HydrophobicContact CE2-CE 4.11Å; F218-M235 HydrophobicContact CG-CE 3.33Å; F218-M235 HydrophobicContact CZ-CE 4.26Å; F218-W255 HydrophobicContact CB-CD2 4.21Å; F218-W255 HydrophobicContact CB-CE3 4.42Å; F218-W255 HydrophobicContact CD1-CB 3.61Å; F218-W255 AromaticContact CD1-CD2 3.63Å; F218-W255 HydrophobicContact CD1-CD2 3.63Å; F218-W255 AromaticContact CD1-CE3 3.69Å; F218-W255 HydrophobicContact CD1-CE3 3.69Å; F218-W255 AromaticContact CD1-CG 3.6Å; F218-W255 HydrophobicContact CD1-CG 3.6Å; F218-W255 HydrophobicContact CE1-CB 3.76Å; F218-W255 HydrophobicContact CE1-CG 4.26Å; F218-W255 HydrophobicContact CG-CD2 4.4Å; F218-W255 HydrophobicContact CG-CG 4.48Å; F218-C260 HydrophobicContact CE1-CB 4.44Å; F218-C260 HydrophobicContact CZ-CB 4.4Å
219	P	91.7	Very high	90.3	Very high	83 Å²	83	59.7 Å²	59.7	54%	0.539	28%	0.276	S	S	.	.			trans	-72.5	99.8	-174.1	29.2	-33.6	0	0	0	110.4	R217 W255	R217-P219 WeakPolarHBondContact O-CD 3.3Å; P219-W255 HydrophobicContact CG-CH2 4.16Å; P219-W255 HydrophobicContact CG-CZ3 4.46Å; P219-W255 WeakPolarHBondContact O-CH2 3.48Å
220	H	88.2	Confident	90.4	Very high	16 Å²	16	61.8 Å²	61.8	7%	0.074	29%	0.29	C	S	.	.			trans	-146	107.6	174	-170.1	-172.7	0	0	0	108.5	L202 G203 F218 V223 T237 S239 I253 W255	L202-H220 PolarHBondContact O-N 2.86Å; G203-H220 WeakPolarHBondContact CA-O 3.5Å; G203-H220 PolarHBondContact N-O 2.85Å; F218-H220 PolarHBondContact O-N 2.91Å; H220-V223 HydrophobicContact CB-CG2 3.58Å; H220-V223 WeakPolarHBondContact ND1-CG2 3.49Å; H220-V223 VanDerWaalsContact O-CG2 3.26Å; H220-V223 WeakPolarHBondContact O-CG2 3.13Å; H220-T237 WeakPolarHBondContact ND1-CB 3.38Å; H220-T237 PolarHBondContact ND1-OG1 3.08Å; H220-S239 PolarHBondContact CE1-OG 2.83Å; H220-S239 VanDerWaalsContact CE1-OG 3.27Å; H220-S239 VanDerWaalsContact NE2-CB 3.3Å; H220-S239 WeakPolarHBondContact NE2-CB 3.33Å; H220-S239 PolarHBondContact NE2-OG 3.46Å; H220-I253 HydrophobicContact CB-CD1 4.42Å; H220-W255 HydrophobicContact CB-CZ2 4.05Å
221	S	88.4	Confident	90.7	Very high	68 Å²	68	58.1 Å²	58.1	48%	0.476	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	142.8	-175.4	56.7	0	0	0	0	112	S201 V223 S239	S201-S221 WeakPolarHBondContact O-CA 3.29Å; S221-V223 VanDerWaalsContact C-N 3.32Å; S221-V223 PolarHBondContact O-N 3.2Å; S221-S239 WeakPolarHBondContact O-CB 3.33Å
222	R	84.8	Confident	90.9	Very high	147 Å²	147	52 Å²	52	56%	0.555	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	36	173	-55.8	-174.3	-69.5	-176.1	-0.9	114.7	S201 K224 P240	S201-R222 PolarHBondContact O-N 3.43Å; R222-K224 PolarHBondContact O-N 2.71Å; R222-P240 WeakPolarHBondContact O-CD 3.2Å
223	V	87.1	Confident	91	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.024	27%	0.265	C	S	.	.			trans	-61.1	124.2	174.1	171.5	0	0	0	0	110.1	V204 H220 S221 T225 I226 T237 L238	V204-V223 HydrophobicContact CG2-CB 4.09Å; V204-V223 HydrophobicContact CG2-CG1 3.82Å; V204-V223 HydrophobicContact CG2-CG2 4.23Å; H220-V223 HydrophobicContact CB-CG2 3.58Å; H220-V223 WeakPolarHBondContact ND1-CG2 3.49Å; H220-V223 VanDerWaalsContact O-CG2 3.26Å; H220-V223 WeakPolarHBondContact O-CG2 3.13Å; S221-V223 VanDerWaalsContact C-N 3.32Å; S221-V223 PolarHBondContact O-N 3.2Å; V223-T225 WeakPolarHBondContact CG1-O 3.48Å; V223-I226 HydrophobicContact CG1-CG2 3.9Å; V223-T237 HydrophobicContact CG2-CG2 4.44Å; V223-L238 WeakPolarHBondContact CA-O 3.37Å
224	K	84.5	Confident	91.1	Very high	132 Å²	132	51.6 Å²	51.6	57%	0.574	25%	0.246	S	C	*	.			trans	-86	-42.9	175.2	-81.5	-177.4	172.3	174.8	0	111.5	W186 R222 L238 P240	W186-K224 PolarHBondContact NE1-O 2.99Å; R222-K224 PolarHBondContact O-N 2.71Å; K224-L238 PolarHBondContact N-O 3.24Å; K224-P240 HydrophobicContact CD-CG 3.66Å; K224-P240 HydrophobicContact CG-CG 4.01Å
225	T	87.3	Confident	91.2	Very high	26 Å²	26	44 Å²	44	16%	0.16	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157.3	-173.4	-176.3	0	0	0	0	111.2	V223 L238 H273	V223-T225 WeakPolarHBondContact CG1-O 3.48Å; T225-L238 HydrophobicContact CG2-CB 3.76Å; T225-L238 HydrophobicContact CG2-CD1 3.71Å; T225-L238 HydrophobicContact CG2-CG 4.31Å; T225-L238 PolarHBondContact O-N 2.85Å; T225-H273 WeakPolarHBondContact CG2-CE1 3.27Å; T225-H273 WeakPolarHBondContact CG2-ND1 3.38Å; T225-H273 PolarHBondContact OG1-CE1 2.96Å; T225-H273 VanDerWaalsContact OG1-CE1 3.29Å; T225-H273 PolarHBondContact OG1-NE2 3.07Å
226	I	91.8	Very high	91.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	154.2	175.7	65.4	170.3	0	0	0	110.6	W186 R188 A197 V204 V223 F228 M235 I236 T237	W186-I226 HydrophobicContact CH2-CB 4.01Å; W186-I226 HydrophobicContact CH2-CD1 3.47Å; W186-I226 VanDerWaalsContact CH2-CD1 3.47Å; W186-I226 HydrophobicContact CH2-CG1 3.38Å; W186-I226 HydrophobicContact CH2-CG2 3.54Å; W186-I226 HydrophobicContact CZ2-CB 4.49Å; W186-I226 HydrophobicContact CZ2-CG1 4.12Å; W186-I226 HydrophobicContact CZ2-CG2 3.9Å; W186-I226 HydrophobicContact CZ3-CD1 3.63Å; W186-I226 HydrophobicContact CZ3-CG1 3.85Å; R188-I226 PolarHBondContact NH1-O 2.93Å; A197-I226 HydrophobicContact CB-CD1 3.31Å; V204-I226 HydrophobicContact CG1-CG2 4.4Å; V204-I226 HydrophobicContact CG2-CG2 3.81Å; V223-I226 HydrophobicContact CG1-CG2 3.9Å; I226-F228 HydrophobicContact CD1-CD2 4.2Å; I226-F228 HydrophobicContact CD1-CE2 3.49Å; I226-F228 VanDerWaalsContact CD1-CE2 3.49Å; I226-F228 HydrophobicContact CD1-CZ 4.04Å; I226-F228 HydrophobicContact CG1-CE2 4.48Å; I226-M235 HydrophobicContact CB-CG 4.41Å; I226-M235 HydrophobicContact CB-SD 4.38Å; I226-M235 HydrophobicContact CD1-SD 4.24Å; I226-M235 HydrophobicContact CG2-SD 4.33Å; I226-I236 CarbonylContact C-O 3.58Å; I226-I236 VanDerWaalsContact CA-O 3.26Å; I226-I236 WeakPolarHBondContact CA-O 3.37Å; I226-T237 HydrophobicContact CG2-CG2 4.02Å
227	E	91.3	Very high	91.2	Very high	32 Å²	32	42 Å²	42	15%	0.15	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	120.2	173.6	-171.6	177.9	161.6	0	0	109.6	M235 I236 P274 F276	E227-M235 CarbonylContact O-C 3.59Å; E227-M235 WeakPolarHBondContact O-CA 3.47Å; E227-I236 HydrophobicContact CB-CB 4.48Å; E227-I236 PolarHBondContact N-O 2.89Å; E227-I236 PolarHBondContact O-N 2.89Å; E227-P274 WeakPolarHBondContact OE2-CB 3.42Å; E227-F276 VanDerWaalsContact CD-O 3.23Å
228	F	94.3	Very high	90.9	Very high	16 Å²	16	36.2 Å²	36.2	7%	0.07	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	148.9	173.8	-74.2	-78.7	0	0	0	110.5	P191 A197 L206 I226 M235 V257	P191-F228 HydrophobicContact CG-CB 3.72Å; A197-F228 HydrophobicContact CB-CE2 4.14Å; A197-F228 HydrophobicContact CB-CZ 4.08Å; L206-F228 HydrophobicContact CD1-CE1 4.19Å; L206-F228 HydrophobicContact CD1-CZ 4.48Å; L206-F228 HydrophobicContact CD2-CE1 4.15Å; L206-F228 HydrophobicContact CD2-CZ 3.62Å; I226-F228 HydrophobicContact CD1-CD2 4.2Å; I226-F228 HydrophobicContact CD1-CE2 3.49Å; I226-F228 VanDerWaalsContact CD1-CE2 3.49Å; I226-F228 HydrophobicContact CD1-CZ 4.04Å; I226-F228 HydrophobicContact CG1-CE2 4.48Å; F228-M235 HydrophobicContact CD1-CB 3.96Å; F228-M235 HydrophobicContact CD1-CG 4.12Å; F228-M235 HydrophobicContact CE1-CB 4.03Å; F228-M235 HydrophobicContact CE1-CG 4.01Å; F228-M235 HydrophobicContact CE1-SD 3.85Å; F228-M235 HydrophobicContact CZ-CG 4.45Å; F228-M235 HydrophobicContact CZ-SD 3.92Å; F228-V257 HydrophobicContact CD1-CG2 4.4Å; F228-V257 HydrophobicContact CE1-CG2 4.34Å
229	S	94.3	Very high	90.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.			trans	-68.6	146.6	163.7	70.3	0	0	0	0	110.4	L231 E232 Q233 F234 D282	S229-L231 VanDerWaalsContact C-N 3.25Å; S229-L231 PolarHBondContact O-N 3.11Å; S229-L231 VanDerWaalsContact O-N 3.16Å; S229-E232 PolarHBondContact O-N 2.73Å; S229-Q233 PolarHBondContact OG-N 3.45Å; S229-Q233 VanDerWaalsContact OG-N 3.1Å; S229-F234 PolarHBondContact N-O 2.94Å; S229-F234 PolarHBondContact OG-N 2.84Å; S229-F234 PolarHBondContact OG-O 2.96Å; S229-D282 VanDerWaalsContact CB-OD1 3.3Å; S229-D282 WeakPolarHBondContact CB-OD1 3.45Å; S229-D282 WeakPolarHBondContact CB-OD2 3.38Å; S229-D282 PolarHBondContact OG-OD2 3.49Å
230	P	92.5	Very high	89.6	Confident	48 Å²	48	34.1 Å²	34.1	31%	0.312	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-36.7	-178	-31.9	34.9	0	0	0	115.6	W278 D282	P230-W278 HydrophobicContact CG-CB 4.33Å; P230-D282 WeakPolarHBondContact CD-OD1 3.22Å; P230-D282 VanDerWaalsContact N-OD1 3.11Å
231	L	92.7	Very high	88.7	Confident	74 Å²	74	33.6 Å²	33.6	39%	0.387	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	9.1	178.4	-51.4	177.3	0	0	0	114	S229 Q233 D282	S229-L231 VanDerWaalsContact C-N 3.25Å; S229-L231 PolarHBondContact O-N 3.11Å; S229-L231 VanDerWaalsContact O-N 3.16Å; L231-Q233 VanDerWaalsContact C-N 3.25Å; L231-Q233 HydrophobicContact CB-CG 4.37Å; L231-Q233 PolarHBondContact O-N 3.06Å; L231-D282 WeakPolarHBondContact CA-OD2 3.49Å; L231-D282 VanDerWaalsContact CB-OD2 3.24Å; L231-D282 WeakPolarHBondContact CB-OD2 3.24Å; L231-D282 PolarHBondContact N-OD1 2.81Å; L231-D282 PolarHBondContact N-OD2 3.47Å; L231-D282 VanDerWaalsContact N-OD2 3.17Å
232	E	93.2	Very high	87.5	Confident	12 Å²	12	34 Å²	34	6%	0.056	17%	0.169	C	C	.	.	S	Bend	trans	62.1	26	177.7	-52.2	175.5	147.5	0	0	114.1	S190 R192 G193 T194 Y195 S229	S190-E232 WeakPolarHBondContact CB-OE1 3.17Å; S190-E232 PolarHBondContact OG-OE1 2.96Å; R192-E232 VanDerWaalsContact CA-OE1 3.3Å; R192-E232 WeakPolarHBondContact CA-OE1 3.45Å; R192-E232 VanDerWaalsContact CB-CD 3.49Å; R192-E232 HydrophobicContact CB-CG 4.33Å; R192-E232 WeakPolarHBondContact CB-OE1 3.3Å; R192-E232 HydrophobicContact CG-CG 3.99Å; R192-E232 PolarHBondContact N-OE1 3.2Å; G193-E232 PolarHBondContact N-OE1 3.37Å; T194-E232 WeakPolarHBondContact CB-OE2 3.31Å; T194-E232 PolarHBondContact N-OE1 2.93Å; T194-E232 PolarHBondContact OG1-OE2 3.16Å; Y195-E232 HydrophobicContact CE2-CB 4.33Å; S229-E232 PolarHBondContact O-N 2.73Å
233	Q	93.6	Very high	86.3	Confident	76 Å²	76	32.6 Å²	32.6	36%	0.355	17%	0.172	S	C	.	.	S	Bend	trans	-80.8	-36.1	175.8	-61.8	-167.6	-22.4	0	0	112.6	S229 L231 V257 D282	S229-Q233 PolarHBondContact OG-N 3.45Å; S229-Q233 VanDerWaalsContact OG-N 3.1Å; L231-Q233 VanDerWaalsContact C-N 3.25Å; L231-Q233 HydrophobicContact CB-CG 4.37Å; L231-Q233 PolarHBondContact O-N 3.06Å; Q233-V257 PolarHBondContact O-N 2.94Å; Q233-D282 HydrophobicContact CB-CB 4.46Å; Q233-D282 WeakPolarHBondContact CB-OD2 3.24Å; Q233-D282 WeakPolarHBondContact CG-OD2 3.32Å; Q233-D282 PolarHBondContact N-OD2 3.36Å
234	F	94.5	Very high	85	Confident	20 Å²	20	36.1 Å²	36.1	9%	0.088	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	155.3	-174.9	-53.4	-69	0	0	0	111.4	S229 W255 W278 D282 A298 F301	S229-F234 PolarHBondContact N-O 2.94Å; S229-F234 PolarHBondContact OG-N 2.84Å; S229-F234 PolarHBondContact OG-O 2.96Å; F234-W255 VanDerWaalsContact CA-O 3.23Å; F234-W255 WeakPolarHBondContact CA-O 3.39Å; F234-W278 HydrophobicContact CB-CH2 3.37Å; F234-W278 HydrophobicContact CB-CZ2 3.56Å; F234-W278 HydrophobicContact CB-CZ3 4.1Å; F234-W278 HydrophobicContact CD2-CE3 4.45Å; F234-W278 AromaticContact CD2-CH2 3.66Å; F234-W278 HydrophobicContact CD2-CH2 3.66Å; F234-W278 AromaticContact CD2-CZ3 3.57Å; F234-W278 HydrophobicContact CD2-CZ3 3.57Å; F234-W278 HydrophobicContact CE2-CZ3 4.36Å; F234-W278 AromaticContact CG-CH2 3.65Å; F234-W278 HydrophobicContact CG-CH2 3.65Å; F234-W278 HydrophobicContact CG-CZ2 4.34Å; F234-W278 HydrophobicContact CG-CZ3 4.08Å; F234-D282 HydrophobicContact CD2-CB 4.31Å; F234-D282 HydrophobicContact CE2-CB 4.36Å; F234-A298 HydrophobicContact CD2-CB 4.4Å; F234-A298 HydrophobicContact CE2-CB 3.75Å; F234-A298 HydrophobicContact CZ-CB 4.21Å; F234-F301 HydrophobicContact CD1-CE1 4.23Å; F234-F301 AromaticContact CD1-CZ 3.95Å; F234-F301 HydrophobicContact CD1-CZ 3.95Å; F234-F301 HydrophobicContact CE1-CE1 4.21Å; F234-F301 AromaticContact CE1-CZ 3.56Å; F234-F301 HydrophobicContact CE1-CZ 3.56Å; F234-F301 HydrophobicContact CZ-CZ 4.15Å
235	M	94.2	Very high	83.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134	172.9	180	-177.4	63.8	0	0	108.5	V204 L206 F218 I226 E227 F228 T237 W255 V257	V204-M235 HydrophobicContact CB-CE 4.5Å; V204-M235 HydrophobicContact CG1-CE 4.37Å; V204-M235 HydrophobicContact CG1-SD 4.24Å; L206-M235 HydrophobicContact CD2-SD 4.29Å; F218-M235 HydrophobicContact CB-CE 3.82Å; F218-M235 HydrophobicContact CD1-CE 3.56Å; F218-M235 HydrophobicContact CD2-CE 3.61Å; F218-M235 HydrophobicContact CE1-CE 4Å; F218-M235 HydrophobicContact CE2-CE 4.11Å; F218-M235 HydrophobicContact CG-CE 3.33Å; F218-M235 HydrophobicContact CZ-CE 4.26Å; I226-M235 HydrophobicContact CB-CG 4.41Å; I226-M235 HydrophobicContact CB-SD 4.38Å; I226-M235 HydrophobicContact CD1-SD 4.24Å; I226-M235 HydrophobicContact CG2-SD 4.33Å; E227-M235 CarbonylContact O-C 3.59Å; E227-M235 WeakPolarHBondContact O-CA 3.47Å; F228-M235 HydrophobicContact CD1-CB 3.96Å; F228-M235 HydrophobicContact CD1-CG 4.12Å; F228-M235 HydrophobicContact CE1-CB 4.03Å; F228-M235 HydrophobicContact CE1-CG 4.01Å; F228-M235 HydrophobicContact CE1-SD 3.85Å; F228-M235 HydrophobicContact CZ-CG 4.45Å; F228-M235 HydrophobicContact CZ-SD 3.92Å; M235-T237 HydrophobicContact CE-CG2 3.8Å; M235-T237 HydrophobicContact SD-CG2 4.42Å; M235-W255 HydrophobicContact CE-CB 4.46Å; M235-W255 HydrophobicContact CE-CG 4.32Å; M235-W255 PolarHBondContact N-O 3.1Å; M235-W255 WeakPolarHBondContact O-CB 3.18Å; M235-W255 PolarHBondContact O-N 3.32Å; M235-V257 HydrophobicContact CB-CG2 3.73Å
236	I	92.2	Very high	82.3	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.9	171	-54.1	-176.5	0	0	0	107.5	I226 E227 A252 I253 V254 F276 W278	I226-I236 CarbonylContact C-O 3.58Å; I226-I236 VanDerWaalsContact CA-O 3.26Å; I226-I236 WeakPolarHBondContact CA-O 3.37Å; E227-I236 HydrophobicContact CB-CB 4.48Å; E227-I236 PolarHBondContact N-O 2.89Å; E227-I236 PolarHBondContact O-N 2.89Å; I236-A252 HydrophobicContact CG2-CB 4.18Å; I236-I253 WeakPolarHBondContact CA-O 3.36Å; I236-V254 HydrophobicContact CD1-CG2 4.38Å; I236-V254 HydrophobicContact CG1-CG1 4.4Å; I236-V254 HydrophobicContact CG1-CG2 4.15Å; I236-F276 HydrophobicContact CD1-CB 3.46Å; I236-F276 VanDerWaalsContact CD1-CB 3.46Å; I236-F276 HydrophobicContact CD1-CD2 4.17Å; I236-F276 HydrophobicContact CD1-CG 3.84Å; I236-F276 HydrophobicContact CG2-CD2 4.18Å; I236-W278 HydrophobicContact CD1-CZ2 3.62Å; I236-W278 HydrophobicContact CG1-CZ2 3.62Å
237	T	91.4	Very high	80.6	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.7	172.8	56.7	0	0	0	0	109	V204 H220 V223 I226 M235 A252 I253 W255	V204-T237 HydrophobicContact CG2-CG2 4.2Å; H220-T237 WeakPolarHBondContact ND1-CB 3.38Å; H220-T237 PolarHBondContact ND1-OG1 3.08Å; V223-T237 HydrophobicContact CG2-CG2 4.44Å; I226-T237 HydrophobicContact CG2-CG2 4.02Å; M235-T237 HydrophobicContact CE-CG2 3.8Å; M235-T237 HydrophobicContact SD-CG2 4.42Å; T237-A252 WeakPolarHBondContact O-CA 3.46Å; T237-I253 PolarHBondContact N-O 3.36Å; T237-I253 PolarHBondContact O-N 3.31Å; T237-I253 PolarHBondContact OG1-O 2.77Å; T237-W255 VanDerWaalsContact CG2-NE1 3.34Å; T237-W255 PolarHBondContact OG1-NE1 3.09Å
238	L	87.2	Confident	79	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.1	178	-70	162.6	0	0	0	109.7	V223 K224 T225 A250 D251 A252 I270 H273	V223-L238 WeakPolarHBondContact CA-O 3.37Å; K224-L238 PolarHBondContact N-O 3.24Å; T225-L238 HydrophobicContact CG2-CB 3.76Å; T225-L238 HydrophobicContact CG2-CD1 3.71Å; T225-L238 HydrophobicContact CG2-CG 4.31Å; T225-L238 PolarHBondContact O-N 2.85Å; L238-A250 HydrophobicContact CB-CB 4.48Å; L238-A250 HydrophobicContact CD2-CB 4.36Å; L238-D251 WeakPolarHBondContact CA-O 3.35Å; L238-A252 HydrophobicContact CD2-CB 3.5Å; L238-I270 HydrophobicContact CD2-CD1 3.39Å; L238-H273 WeakPolarHBondContact CD1-ND1 3.26Å
239	S	83.1	Confident	77.3	Confident	5 Å²	5	53.2 Å²	53.2	4%	0.035	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	148.3	174.8	75.1	0	0	0	0	110.3	H220 S221 S241 A250 D251	H220-S239 PolarHBondContact CE1-OG 2.83Å; H220-S239 VanDerWaalsContact CE1-OG 3.27Å; H220-S239 VanDerWaalsContact NE2-CB 3.3Å; H220-S239 WeakPolarHBondContact NE2-CB 3.33Å; H220-S239 PolarHBondContact NE2-OG 3.46Å; S221-S239 WeakPolarHBondContact O-CB 3.33Å; S239-S241 PolarHBondContact O-N 2.86Å; S239-A250 CarbonylContact O-C 3.43Å; S239-A250 VanDerWaalsContact O-C 3.3Å; S239-A250 WeakPolarHBondContact O-CA 3.41Å; S239-A250 WeakPolarHBondContact O-CB 3.42Å; S239-D251 PolarHBondContact N-O 3.11Å; S239-D251 PolarHBondContact O-N 3.01Å
240	P	75.1	Confident	75.9	Confident	34 Å²	34	53.9 Å²	53.9	22%	0.221	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	130.1	171.7	-22.2	34.6	0	0	0	110.9	R222 K224	R222-P240 WeakPolarHBondContact O-CD 3.2Å; K224-P240 HydrophobicContact CD-CG 3.66Å; K224-P240 HydrophobicContact CG-CG 4.01Å
241	S	68.5	Low	75.3	Confident	5 Å²	5	52.7 Å²	52.7	4%	0.035	28%	0.284	C	S	.	.			trans	-66.3	126.7	-177.4	-169.1	0	0	0	0	110	S239 N243 F244 R249 D251	S239-S241 PolarHBondContact O-N 2.86Å; S241-N243 PolarHBondContact O-N 2.8Å; S241-F244 PolarHBondContact O-N 2.88Å; S241-R249 WeakPolarHBondContact CB-O 3.4Å; S241-R249 PolarHBondContact N-O 2.9Å; S241-D251 WeakPolarHBondContact CB-OD1 3.39Å; S241-D251 PolarHBondContact OG-OD1 2.77Å; S241-D251 PolarHBondContact OG-OD2 2.79Å
242	P	63.5	Low	75	Confident	76 Å²	76	49.2 Å²	49.2	49%	0.494	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.7	176.9	27.8	-32.9	0	0	0	112.3	F244 D251	P242-F244 PolarHBondContact O-N 2.84Å; P242-D251 VanDerWaalsContact CD-OD2 3.31Å; P242-D251 WeakPolarHBondContact CD-OD2 3.27Å
243	N	60.6	Low	74.9	Confident	117 Å²	117	49.5 Å²	49.5	63%	0.626	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-20.4	-179.1	-66.2	-25.4	0	0	0	112.8	S241	S241-N243 PolarHBondContact O-N 2.8Å
244	F	60.3	Low	74.8	Confident	78 Å²	78	45.9 Å²	45.9	34%	0.342	25%	0.25	S	C	.	.			trans	-131.8	70.3	-178.4	-61.4	-74.7	0	0	0	110	S241 P242 T246 D247 R249 P269	S241-F244 PolarHBondContact O-N 2.88Å; P242-F244 PolarHBondContact O-N 2.84Å; F244-T246 PolarHBondContact O-N 2.5Å; F244-D247 HydrophobicContact CB-CB 3.7Å; F244-D247 HydrophobicContact CG-CB 4.49Å; F244-D247 PolarHBondContact O-N 2.78Å; F244-D247 VanDerWaalsContact O-N 3.16Å; F244-R249 HydrophobicContact CB-CB 4.37Å; F244-R249 HydrophobicContact CB-CG 4.5Å; F244-P269 HydrophobicContact CE2-CG 4.36Å
245	P	57.3	Low	74.8	Confident	117 Å²	117	45.4 Å²	45.4	76%	0.76	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-25	-173.1	20.6	-27	0	0	0	113.9
246	T	57.7	Low	74.7	Confident	136 Å²	136	45.8 Å²	45.8	83%	0.834	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-13	177.9	49.2	0	0	0	0	113.7	F244	F244-T246 PolarHBondContact O-N 2.5Å
247	D	55.6	Low	74.8	Confident	71 Å²	71	45.8 Å²	45.8	38%	0.38	25%	0.25	S	C	.	.	S	Bend	trans	-110.2	128.5	-171.4	-126.4	-2.4	0	0	0	106.1	F244 R249	F244-D247 HydrophobicContact CB-CB 3.7Å; F244-D247 HydrophobicContact CG-CB 4.49Å; F244-D247 PolarHBondContact O-N 2.78Å; F244-D247 VanDerWaalsContact O-N 3.16Å; D247-R249 HydrophobicContact CB-CG 3.83Å; D247-R249 PolarHBondContact O-N 2.84Å; D247-R249 IonicContact OD2-CZ 3.99Å; D247-R249 IonicContact OD2-NE 3.92Å; D247-R249 PolarHBondContact OD2-NE 3.44Å; D247-R249 IonicContact OD2-NH1 3.94Å; D247-R249 IonicContact OD2-NH2 3.59Å; D247-R249 PolarHBondContact OD2-NH2 3.34Å
248	E	58	Low	74.6	Confident	169 Å²	169	53.1 Å²	53.1	79%	0.79	28%	0.281	S	S	*	.			trans	-66.1	15.4	-171.5	-61.9	-169.1	145	0	0	115.4
249	R	59	Low	74.6	Confident	72 Å²	72	60.7 Å²	60.7	27%	0.272	31%	0.31	S	S	.	.			trans	-64.8	133	-174.2	-58.4	179.3	164.4	-176.3	16	110.5	S241 F244 D247 P269	S241-R249 WeakPolarHBondContact CB-O 3.4Å; S241-R249 PolarHBondContact N-O 2.9Å; F244-R249 HydrophobicContact CB-CB 4.37Å; F244-R249 HydrophobicContact CB-CG 4.5Å; D247-R249 HydrophobicContact CB-CG 3.83Å; D247-R249 PolarHBondContact O-N 2.84Å; D247-R249 IonicContact OD2-CZ 3.99Å; D247-R249 IonicContact OD2-NE 3.92Å; D247-R249 PolarHBondContact OD2-NE 3.44Å; D247-R249 IonicContact OD2-NH1 3.94Å; D247-R249 IonicContact OD2-NH2 3.59Å; D247-R249 PolarHBondContact OD2-NH2 3.34Å; R249-P269 HydrophobicContact CB-CB 3.77Å; R249-P269 HydrophobicContact CB-CG 4.25Å; R249-P269 VanDerWaalsContact CD-CG 3.48Å; R249-P269 HydrophobicContact CG-CB 3.61Å; R249-P269 HydrophobicContact CG-CG 4.12Å
250	A	64.8	Low	74.9	Confident	14 Å²	14	62.4 Å²	62.4	12%	0.116	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.5	178.9	0	0	0	0	0	114.1	L238 S239 I270	L238-A250 HydrophobicContact CB-CB 4.48Å; L238-A250 HydrophobicContact CD2-CB 4.36Å; S239-A250 CarbonylContact O-C 3.43Å; S239-A250 VanDerWaalsContact O-C 3.3Å; S239-A250 WeakPolarHBondContact O-CA 3.41Å; S239-A250 WeakPolarHBondContact O-CB 3.42Å; A250-I270 HydrophobicContact CB-CB 4.32Å
251	D	79.1	Confident	75.6	Confident	24 Å²	24	63.7 Å²	63.7	13%	0.128	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	136.9	165.2	-65.2	-25.7	0	0	0	109.3	L238 S239 S241 P242	L238-D251 WeakPolarHBondContact CA-O 3.35Å; S239-D251 PolarHBondContact N-O 3.11Å; S239-D251 PolarHBondContact O-N 3.01Å; S241-D251 WeakPolarHBondContact CB-OD1 3.39Å; S241-D251 PolarHBondContact OG-OD1 2.77Å; S241-D251 PolarHBondContact OG-OD2 2.79Å; P242-D251 VanDerWaalsContact CD-OD2 3.31Å; P242-D251 WeakPolarHBondContact CD-OD2 3.27Å
252	A	86.6	Confident	76.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.5	178.1	0	0	0	0	0	111.5	I236 T237 L238 F266 I270 F276	I236-A252 HydrophobicContact CG2-CB 4.18Å; T237-A252 WeakPolarHBondContact O-CA 3.46Å; L238-A252 HydrophobicContact CD2-CB 3.5Å; A252-F266 HydrophobicContact CB-CB 4.17Å; A252-F266 HydrophobicContact CB-CD2 4.43Å; A252-F266 PolarHBondContact N-O 3.45Å; A252-F266 PolarHBondContact O-N 3.15Å; A252-I270 HydrophobicContact CB-CD1 3.77Å; A252-F276 HydrophobicContact CB-CD2 4.28Å; A252-F276 HydrophobicContact CB-CE2 3.52Å; A252-F276 HydrophobicContact CB-CZ 4.33Å
253	I	89.9	Confident	77.9	Confident	18 Å²	18	67.5 Å²	67.5	9%	0.092	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.2	172.8	-51.8	-179.2	0	0	0	108.7	H220 I236 T237 W255 R264 E265	H220-I253 HydrophobicContact CB-CD1 4.42Å; I236-I253 WeakPolarHBondContact CA-O 3.36Å; T237-I253 PolarHBondContact N-O 3.36Å; T237-I253 PolarHBondContact O-N 3.31Å; T237-I253 PolarHBondContact OG1-O 2.77Å; I253-W255 HydrophobicContact CB-CZ2 3.92Å; I253-W255 HydrophobicContact CD1-CZ2 3.93Å; I253-W255 HydrophobicContact CG2-CD2 3.98Å; I253-W255 HydrophobicContact CG2-CG 4.46Å; I253-W255 HydrophobicContact CG2-CH2 4.15Å; I253-W255 HydrophobicContact CG2-CZ2 3.46Å; I253-W255 VanDerWaalsContact CG2-CZ2 3.46Å; I253-W255 VanDerWaalsContact O-CD1 3.28Å; I253-W255 PolarHBondContact O-NE1 3.13Å; I253-R264 WeakPolarHBondContact CA-O 3.39Å; I253-E265 HydrophobicContact CD1-CG 4.41Å; I253-E265 HydrophobicContact CG1-CG 4.09Å; I253-E265 HydrophobicContact CG2-CG 4.05Å
254	V	92.3	Very high	79.1	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.8	174	-170.8	0	0	0	0	108.9	I236 R263 R264 F266 W278 F285 F301	I236-V254 HydrophobicContact CD1-CG2 4.38Å; I236-V254 HydrophobicContact CG1-CG1 4.4Å; I236-V254 HydrophobicContact CG1-CG2 4.15Å; V254-R263 PolarHBondContact O-N 3.26Å; V254-R264 HydrophobicContact CB-CB 4.18Å; V254-R264 HydrophobicContact CG2-CB 4.23Å; V254-R264 PolarHBondContact N-O 3.1Å; V254-R264 PolarHBondContact O-N 3.33Å; V254-F266 HydrophobicContact CG2-CD2 4.16Å; V254-F266 HydrophobicContact CG2-CE2 3.67Å; V254-W278 HydrophobicContact CG1-CH2 4.08Å; V254-W278 HydrophobicContact CG1-CZ2 4.14Å; V254-F285 HydrophobicContact CG2-CZ 4.5Å; V254-F301 HydrophobicContact CB-CE1 4.45Å; V254-F301 HydrophobicContact CG1-CD1 4.07Å; V254-F301 HydrophobicContact CG1-CE1 3.63Å
255	W	93.9	Very high	80.3	Confident	11 Å²	11	68.9 Å²	68.9	4%	0.042	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	140.8	-176.6	-55.2	90.6	0	0	0	110.8	F218 P219 H220 F234 M235 T237 I253 V261	F218-W255 HydrophobicContact CB-CD2 4.21Å; F218-W255 HydrophobicContact CB-CE3 4.42Å; F218-W255 HydrophobicContact CD1-CB 3.61Å; F218-W255 AromaticContact CD1-CD2 3.63Å; F218-W255 HydrophobicContact CD1-CD2 3.63Å; F218-W255 AromaticContact CD1-CE3 3.69Å; F218-W255 HydrophobicContact CD1-CE3 3.69Å; F218-W255 AromaticContact CD1-CG 3.6Å; F218-W255 HydrophobicContact CD1-CG 3.6Å; F218-W255 HydrophobicContact CE1-CB 3.76Å; F218-W255 HydrophobicContact CE1-CG 4.26Å; F218-W255 HydrophobicContact CG-CD2 4.4Å; F218-W255 HydrophobicContact CG-CG 4.48Å; P219-W255 HydrophobicContact CG-CH2 4.16Å; P219-W255 HydrophobicContact CG-CZ3 4.46Å; P219-W255 WeakPolarHBondContact O-CH2 3.48Å; H220-W255 HydrophobicContact CB-CZ2 4.05Å; F234-W255 VanDerWaalsContact CA-O 3.23Å; F234-W255 WeakPolarHBondContact CA-O 3.39Å; M235-W255 HydrophobicContact CE-CB 4.46Å; M235-W255 HydrophobicContact CE-CG 4.32Å; M235-W255 PolarHBondContact N-O 3.1Å; M235-W255 WeakPolarHBondContact O-CB 3.18Å; M235-W255 PolarHBondContact O-N 3.32Å; T237-W255 VanDerWaalsContact CG2-NE1 3.34Å; T237-W255 PolarHBondContact OG1-NE1 3.09Å; I253-W255 HydrophobicContact CB-CZ2 3.92Å; I253-W255 HydrophobicContact CD1-CZ2 3.93Å; I253-W255 HydrophobicContact CG2-CD2 3.98Å; I253-W255 HydrophobicContact CG2-CG 4.46Å; I253-W255 HydrophobicContact CG2-CH2 4.15Å; I253-W255 HydrophobicContact CG2-CZ2 3.46Å; I253-W255 VanDerWaalsContact CG2-CZ2 3.46Å; I253-W255 VanDerWaalsContact O-CD1 3.28Å; I253-W255 PolarHBondContact O-NE1 3.13Å; W255-V261 WeakPolarHBondContact CA-O 3.47Å
256	D	93.6	Very high	81.5	Confident	8 Å²	8	64 Å²	64	4%	0.043	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112.3	164.6	-176.7	-36.1	0	0	0	107.9	K258 R259 C260 V261 R263	D256-K258 VanDerWaalsContact C-N 3.35Å; D256-K258 PolarHBondContact O-N 3.4Å; D256-K258 PolarHBondContact OD1-N 3.44Å; D256-R259 HydrophobicContact CB-CB 4.22Å; D256-R259 PolarHBondContact OD1-N 2.81Å; D256-R259 VanDerWaalsContact OD1-N 3.07Å; D256-R259 WeakPolarHBondContact OD2-CD 3.46Å; D256-R259 IonicContact OD2-CZ 3.03Å; D256-R259 IonicContact OD2-NE 3.22Å; D256-R259 IonicContact OD2-NH1 2.68Å; D256-R259 PolarHBondContact OD2-NH1 3.09Å; D256-C260 WeakPolarHBondContact O-CA 3.49Å; D256-C260 PolarHBondContact O-N 3.23Å; D256-V261 HydrophobicContact CB-CG2 4Å; D256-V261 PolarHBondContact N-O 3.26Å; D256-R263 HydrophobicContact CB-CG 3.93Å; D256-R263 IonicContact OD2-CZ 2.76Å; D256-R263 IonicContact OD2-NE 3.3Å; D256-R263 PolarHBondContact OD2-NE 3.28Å; D256-R263 IonicContact OD2-NH2 3.57Å; D256-R263 PolarHBondContact OD2-NH2 3.02Å; D256-R263 VanDerWaalsContact OD2-NH2 3.07Å
257	V	92.9	Very high	82	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-39.3	-171.9	172.1	0	0	0	0	111.3	Y195 L206 F228 Q233 M235	Y195-V257 HydrophobicContact CD2-CG1 4.01Å; Y195-V257 HydrophobicContact CE2-CG1 3.54Å; L206-V257 HydrophobicContact CD1-CG1 3.72Å; F228-V257 HydrophobicContact CD1-CG2 4.4Å; F228-V257 HydrophobicContact CE1-CG2 4.34Å; Q233-V257 PolarHBondContact O-N 2.94Å; M235-V257 HydrophobicContact CB-CG2 3.73Å
258	K	87.9	Confident	82.3	Confident	153 Å²	153	61.3 Å²	61.3	67%	0.665	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-40.3	-177.7	-66.7	-177.1	-179.4	178.9	0	111.8	D256	D256-K258 VanDerWaalsContact C-N 3.35Å; D256-K258 PolarHBondContact O-N 3.4Å; D256-K258 PolarHBondContact OD1-N 3.44Å
259	R	86.6	Confident	82.3	Confident	166 Å²	166	55 Å²	55	63%	0.626	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-14.2	-178.2	-64.8	-175	179.8	105.3	-8.6	113.6	D256 V261	D256-R259 HydrophobicContact CB-CB 4.22Å; D256-R259 PolarHBondContact OD1-N 2.81Å; D256-R259 VanDerWaalsContact OD1-N 3.07Å; D256-R259 WeakPolarHBondContact OD2-CD 3.46Å; D256-R259 IonicContact OD2-CZ 3.03Å; D256-R259 IonicContact OD2-NE 3.22Å; D256-R259 IonicContact OD2-NH1 2.68Å; D256-R259 PolarHBondContact OD2-NH1 3.09Å; R259-V261 VanDerWaalsContact C-N 3.27Å; R259-V261 HydrophobicContact CB-CG1 4.46Å; R259-V261 HydrophobicContact CB-CG2 3.8Å; R259-V261 PolarHBondContact O-N 3.31Å
260	C	89.2	Confident	82.6	Confident	41 Å²	41	52.3 Å²	52.3	28%	0.277	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	37	-174.8	-58.5	0	0	0	0	113.6	G216 F218 D256	G216-C260 VanDerWaalsContact CA-SG 3.53Å; F218-C260 HydrophobicContact CE1-CB 4.44Å; F218-C260 HydrophobicContact CZ-CB 4.4Å; D256-C260 WeakPolarHBondContact O-CA 3.49Å; D256-C260 PolarHBondContact O-N 3.23Å
261	V	90.3	Very high	82.4	Confident	61 Å²	61	57.6 Å²	57.6	37%	0.37	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	145.9	-179	-63.3	0	0	0	0	111.7	W255 D256 R259	W255-V261 WeakPolarHBondContact CA-O 3.47Å; D256-V261 HydrophobicContact CB-CG2 4Å; D256-V261 PolarHBondContact N-O 3.26Å; R259-V261 VanDerWaalsContact C-N 3.27Å; R259-V261 HydrophobicContact CB-CG1 4.46Å; R259-V261 HydrophobicContact CB-CG2 3.8Å; R259-V261 PolarHBondContact O-N 3.31Å
262	S	90.5	Very high	81.6	Confident	56 Å²	56	60.9 Å²	60.9	39%	0.392	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	136.2	169	59.7	0	0	0	0	109.3
263	R	89.6	Confident	80.3	Confident	104 Å²	104	65.2 Å²	65.2	39%	0.392	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	-35.5	-180	-70.5	-63.6	-165.2	174.9	2	112.2	V254 D256 F301	V254-R263 PolarHBondContact O-N 3.26Å; D256-R263 HydrophobicContact CB-CG 3.93Å; D256-R263 IonicContact OD2-CZ 2.76Å; D256-R263 IonicContact OD2-NE 3.3Å; D256-R263 PolarHBondContact OD2-NE 3.28Å; D256-R263 IonicContact OD2-NH2 3.57Å; D256-R263 PolarHBondContact OD2-NH2 3.02Å; D256-R263 VanDerWaalsContact OD2-NH2 3.07Å; R263-F301 HydrophobicContact CB-CD1 4.07Å; R263-F301 HydrophobicContact CB-CD2 3.75Å; R263-F301 HydrophobicContact CB-CE1 3.79Å; R263-F301 HydrophobicContact CB-CE2 3.45Å; R263-F301 VanDerWaalsContact CB-CE2 3.45Å; R263-F301 HydrophobicContact CB-CG 4.06Å; R263-F301 HydrophobicContact CB-CZ 3.46Å; R263-F301 VanDerWaalsContact CB-CZ 3.46Å; R263-F301 HydrophobicContact CG-CD2 4.33Å; R263-F301 HydrophobicContact CG-CE1 4.31Å; R263-F301 HydrophobicContact CG-CE2 3.57Å; R263-F301 HydrophobicContact CG-CZ 3.55Å
264	R	86.7	Confident	79	Confident	108 Å²	108	67.1 Å²	67.1	41%	0.408	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	137	-177.9	-164.2	70.6	-173.6	-179.5	3	110.4	I253 V254 F266 F301	I253-R264 WeakPolarHBondContact CA-O 3.39Å; V254-R264 HydrophobicContact CB-CB 4.18Å; V254-R264 HydrophobicContact CG2-CB 4.23Å; V254-R264 PolarHBondContact N-O 3.1Å; V254-R264 PolarHBondContact O-N 3.33Å; R264-F266 HydrophobicContact CB-CE2 4.27Å; R264-F266 HydrophobicContact CG-CD2 4.3Å; R264-F266 HydrophobicContact CG-CE1 4.3Å; R264-F266 HydrophobicContact CG-CE2 3.72Å; R264-F266 HydrophobicContact CG-CZ 3.72Å; R264-F301 HydrophobicContact CB-CB 3.93Å; R264-F301 HydrophobicContact CB-CD1 4.21Å; R264-F301 HydrophobicContact CB-CG 4.25Å; R264-F301 HydrophobicContact CG-CB 4.17Å
265	E	85.8	Confident	78.3	Confident	117 Å²	117	67.3 Å²	67.3	55%	0.547	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.2	173.3	-61.8	177.7	-170.1	0	0	108.4	I253	I253-E265 HydrophobicContact CD1-CG 4.41Å; I253-E265 HydrophobicContact CG1-CG 4.09Å; I253-E265 HydrophobicContact CG2-CG 4.05Å
266	F	82.4	Confident	78	Confident	15 Å²	15	66.8 Å²	66.8	7%	0.066	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	99.1	177	-65	-81.8	0	0	0	108.3	A252 V254 R264 V268 F276 F285 Y296	A252-F266 HydrophobicContact CB-CB 4.17Å; A252-F266 HydrophobicContact CB-CD2 4.43Å; A252-F266 PolarHBondContact N-O 3.45Å; A252-F266 PolarHBondContact O-N 3.15Å; V254-F266 HydrophobicContact CG2-CD2 4.16Å; V254-F266 HydrophobicContact CG2-CE2 3.67Å; R264-F266 HydrophobicContact CB-CE2 4.27Å; R264-F266 HydrophobicContact CG-CD2 4.3Å; R264-F266 HydrophobicContact CG-CE1 4.3Å; R264-F266 HydrophobicContact CG-CE2 3.72Å; R264-F266 HydrophobicContact CG-CZ 3.72Å; F266-V268 PolarHBondContact O-N 3.01Å; F266-F276 HydrophobicContact CB-CZ 4.25Å; F266-F276 HydrophobicContact CD1-CZ 4.22Å; F266-F276 HydrophobicContact CD2-CE1 4.17Å; F266-F276 HydrophobicContact CD2-CE2 4.3Å; F266-F276 AromaticContact CD2-CZ 3.63Å; F266-F276 HydrophobicContact CD2-CZ 3.63Å; F266-F276 HydrophobicContact CE1-CE1 4.42Å; F266-F276 HydrophobicContact CE1-CZ 4.49Å; F266-F276 AromaticContact CE2-CE1 3.97Å; F266-F276 HydrophobicContact CE2-CE1 3.97Å; F266-F276 AromaticContact CE2-CZ 3.92Å; F266-F276 HydrophobicContact CE2-CZ 3.92Å; F266-F276 HydrophobicContact CG-CE1 4.47Å; F266-F276 AromaticContact CG-CZ 3.79Å; F266-F276 HydrophobicContact CG-CZ 3.79Å; F266-F276 HydrophobicContact CZ-CE1 4.11Å; F266-F276 HydrophobicContact CZ-CZ 4.34Å; F266-F285 AromaticContact CE2-CE2 3.83Å; F266-F285 HydrophobicContact CE2-CE2 3.83Å; F266-F285 HydrophobicContact CE2-CZ 4.19Å; F266-F285 AromaticContact CZ-CE2 3.7Å; F266-F285 HydrophobicContact CZ-CE2 3.7Å; F266-F285 AromaticContact CZ-CZ 3.98Å; F266-F285 HydrophobicContact CZ-CZ 3.98Å; F266-Y296 HydrophobicContact CE1-CD1 4.42Å; F266-Y296 AromaticContact CE1-CE1 3.78Å; F266-Y296 HydrophobicContact CE1-CE1 3.78Å; F266-Y296 HydrophobicContact CE1-CE2 4.11Å; F266-Y296 AromaticContact CE1-CZ 3.6Å; F266-Y296 HydrophobicContact CZ-CD1 4.27Å; F266-Y296 HydrophobicContact CZ-CD2 4.39Å; F266-Y296 HydrophobicContact CZ-CE1 4.08Å; F266-Y296 HydrophobicContact CZ-CE2 4.19Å; F266-Y296 HydrophobicContact CZ-CG 4.44Å
267	S	68.1	Low	77.9	Confident	79 Å²	79	68.4 Å²	68.4	55%	0.552	34%	0.34	S	S	*	.			trans	-84.4	19.7	178.7	-41.7	0	0	0	0	113.6
268	V	61.6	Low	77.9	Confident	70 Å²	70	69.1 Å²	69.1	42%	0.424	34%	0.342	S	S	.	.	S	Bend	trans	-103.3	133.5	-174.3	177.3	0	0	0	0	108.2	F266 R289	F266-V268 PolarHBondContact O-N 3.01Å; V268-R289 VanDerWaalsContact CG1-NH1 3.34Å; V268-R289 PolarHBondContact O-NH2 3.34Å
269	P	58	Low	78.2	Confident	38 Å²	38	61.8 Å²	61.8	25%	0.247	31%	0.311	C	S	.	.			trans	-45.9	136.6	-178.7	-31.8	39.1	0	0	0	113.9	F244 R249	F244-P269 HydrophobicContact CE2-CG 4.36Å; R249-P269 HydrophobicContact CB-CB 3.77Å; R249-P269 HydrophobicContact CB-CG 4.25Å; R249-P269 VanDerWaalsContact CD-CG 3.48Å; R249-P269 HydrophobicContact CG-CB 3.61Å; R249-P269 HydrophobicContact CG-CG 4.12Å
270	I	64.1	Low	78.5	Confident	14 Å²	14	54.7 Å²	54.7	7%	0.072	29%	0.286	C	S	.	.			trans	-122.6	114.5	175.6	-72.2	169.2	0	0	0	106.6	L238 A250 A252 F272 A275 F276	L238-I270 HydrophobicContact CD2-CD1 3.39Å; A250-I270 HydrophobicContact CB-CB 4.32Å; A252-I270 HydrophobicContact CB-CD1 3.77Å; I270-F272 WeakPolarHBondContact CG2-O 3.47Å; I270-A275 HydrophobicContact CB-CB 4.26Å; I270-A275 HydrophobicContact CD1-CB 3.94Å; I270-A275 HydrophobicContact CG1-CB 4.07Å; I270-A275 HydrophobicContact CG2-CB 3.23Å; I270-F276 HydrophobicContact CD1-CD2 4.42Å; I270-F276 HydrophobicContact CD1-CE2 3.66Å; I270-F276 HydrophobicContact CD1-CZ 4.47Å
271	D	62.1	Low	78.6	Confident	126 Å²	126	57.7 Å²	57.7	67%	0.674	29%	0.294	S	S	*	.			trans	-90.2	-18.1	-176	-56.2	-32	0	0	0	112.7
272	F	61.2	Low	78.7	Confident	93 Å²	93	54.9 Å²	54.9	41%	0.408	28%	0.277	S	S	.	.	S	Bend	trans	-137.5	149.3	-175.8	60.2	-90.4	0	0	0	112.2	I270 A275 L288	I270-F272 WeakPolarHBondContact CG2-O 3.47Å; F272-A275 WeakPolarHBondContact O-CB 3.2Å; F272-L288 HydrophobicContact CZ-CB 4.08Å; F272-L288 VanDerWaalsContact CZ-O 3.23Å; F272-L288 WeakPolarHBondContact CZ-O 3.42Å
273	H	59.7	Low	78.8	Confident	91 Å²	91	56.5 Å²	56.5	42%	0.421	28%	0.278	S	S	.	.	S	Bend	trans	-122.2	135.5	175.4	-178.7	69.2	0	0	0	109.9	T225 L238	T225-H273 WeakPolarHBondContact CG2-CE1 3.27Å; T225-H273 WeakPolarHBondContact CG2-ND1 3.38Å; T225-H273 PolarHBondContact OG1-CE1 2.96Å; T225-H273 VanDerWaalsContact OG1-CE1 3.29Å; T225-H273 PolarHBondContact OG1-NE2 3.07Å; L238-H273 WeakPolarHBondContact CD1-ND1 3.26Å
274	P	63.2	Low	79	Confident	57 Å²	57	52.8 Å²	52.8	37%	0.37	26%	0.264	S	S	.	.	S	Bend	cis	-74.4	129.3	-2.4	30.3	-33.5	0	0	0	112.7	E227	E227-P274 WeakPolarHBondContact OE2-CB 3.42Å
275	A	77.2	Confident	79.3	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.033	25%	0.245	C	C	.	.			trans	-85.2	-34.9	-177.2	0	0	0	0	0	112.7	I270 F272 C287	I270-A275 HydrophobicContact CB-CB 4.26Å; I270-A275 HydrophobicContact CD1-CB 3.94Å; I270-A275 HydrophobicContact CG1-CB 4.07Å; I270-A275 HydrophobicContact CG2-CB 3.23Å; F272-A275 WeakPolarHBondContact O-CB 3.2Å; A275-C287 WeakPolarHBondContact O-CA 3.26Å; A275-C287 WeakPolarHBondContact O-CB 3.35Å
276	F	87.2	Confident	79.6	Confident	1 Å²	1	42 Å²	42	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	140.7	174.6	-66.1	-81.8	0	0	0	107	E227 I236 A252 F266 I270 F285 A286 C287 Y296	E227-F276 VanDerWaalsContact CD-O 3.23Å; I236-F276 HydrophobicContact CD1-CB 3.46Å; I236-F276 VanDerWaalsContact CD1-CB 3.46Å; I236-F276 HydrophobicContact CD1-CD2 4.17Å; I236-F276 HydrophobicContact CD1-CG 3.84Å; I236-F276 HydrophobicContact CG2-CD2 4.18Å; A252-F276 HydrophobicContact CB-CD2 4.28Å; A252-F276 HydrophobicContact CB-CE2 3.52Å; A252-F276 HydrophobicContact CB-CZ 4.33Å; F266-F276 HydrophobicContact CB-CZ 4.25Å; F266-F276 HydrophobicContact CD1-CZ 4.22Å; F266-F276 HydrophobicContact CD2-CE1 4.17Å; F266-F276 HydrophobicContact CD2-CE2 4.3Å; F266-F276 AromaticContact CD2-CZ 3.63Å; F266-F276 HydrophobicContact CD2-CZ 3.63Å; F266-F276 HydrophobicContact CE1-CE1 4.42Å; F266-F276 HydrophobicContact CE1-CZ 4.49Å; F266-F276 AromaticContact CE2-CE1 3.97Å; F266-F276 HydrophobicContact CE2-CE1 3.97Å; F266-F276 AromaticContact CE2-CZ 3.92Å; F266-F276 HydrophobicContact CE2-CZ 3.92Å; F266-F276 HydrophobicContact CG-CE1 4.47Å; F266-F276 AromaticContact CG-CZ 3.79Å; F266-F276 HydrophobicContact CG-CZ 3.79Å; F266-F276 HydrophobicContact CZ-CE1 4.11Å; F266-F276 HydrophobicContact CZ-CZ 4.34Å; I270-F276 HydrophobicContact CD1-CD2 4.42Å; I270-F276 HydrophobicContact CD1-CE2 3.66Å; I270-F276 HydrophobicContact CD1-CZ 4.47Å; F276-F285 AromaticContact CD1-CD2 3.75Å; F276-F285 HydrophobicContact CD1-CD2 3.75Å; F276-F285 HydrophobicContact CD1-CE2 4.06Å; F276-F285 HydrophobicContact CE1-CD2 4.32Å; F276-F285 HydrophobicContact CE1-CE2 4.17Å; F276-A286 CarbonylContact C-O 3.57Å; F276-A286 VanDerWaalsContact CA-O 3.26Å; F276-A286 WeakPolarHBondContact CA-O 3.49Å; F276-C287 HydrophobicContact CD1-CB 3.62Å; F276-C287 HydrophobicContact CE1-CB 3.66Å; F276-C287 HydrophobicContact CG-CB 4.34Å; F276-C287 HydrophobicContact CZ-CB 4.39Å; F276-Y296 HydrophobicContact CE1-CE2 4.39Å
277	K	91.1	Very high	80	Confident	41 Å²	41	41.4 Å²	41.4	18%	0.178	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.5	171.7	-57.4	-178.6	-175.3	176.9	0	107.6	F285 A286 D315 F316 W318	K277-F285 WeakPolarHBondContact O-CA 3.25Å; K277-A286 PolarHBondContact N-O 3.44Å; K277-A286 PolarHBondContact O-N 3.2Å; K277-D315 IonicContact NZ-OD1 3.11Å; K277-D315 PolarHBondContact NZ-OD1 2.94Å; K277-D315 VanDerWaalsContact NZ-OD1 3.16Å; K277-F316 HydrophobicContact CB-CE2 3.89Å; K277-F316 HydrophobicContact CB-CZ 4.1Å; K277-F316 HydrophobicContact CD-CD2 4.38Å; K277-F316 HydrophobicContact CD-CE1 4.42Å; K277-F316 HydrophobicContact CD-CE2 3.88Å; K277-F316 HydrophobicContact CD-CZ 3.9Å; K277-F316 HydrophobicContact CG-CE2 4.09Å; K277-F316 HydrophobicContact CG-CZ 3.93Å; K277-F316 PolarHBondContact NZ-O 3.44Å; K277-W318 PolarHBondContact O-NE1 3.44Å
278	W	93.6	Very high	81	Confident	16 Å²	16	38.3 Å²	38.3	6%	0.061	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	146.9	-179.6	-71.3	94.2	0	0	0	112.1	P230 F234 I236 V254 F285 A298 W318	P230-W278 HydrophobicContact CG-CB 4.33Å; F234-W278 HydrophobicContact CB-CH2 3.37Å; F234-W278 HydrophobicContact CB-CZ2 3.56Å; F234-W278 HydrophobicContact CB-CZ3 4.1Å; F234-W278 HydrophobicContact CD2-CE3 4.45Å; F234-W278 AromaticContact CD2-CH2 3.66Å; F234-W278 HydrophobicContact CD2-CH2 3.66Å; F234-W278 AromaticContact CD2-CZ3 3.57Å; F234-W278 HydrophobicContact CD2-CZ3 3.57Å; F234-W278 HydrophobicContact CE2-CZ3 4.36Å; F234-W278 AromaticContact CG-CH2 3.65Å; F234-W278 HydrophobicContact CG-CH2 3.65Å; F234-W278 HydrophobicContact CG-CZ2 4.34Å; F234-W278 HydrophobicContact CG-CZ3 4.08Å; I236-W278 HydrophobicContact CD1-CZ2 3.62Å; I236-W278 HydrophobicContact CG1-CZ2 3.62Å; V254-W278 HydrophobicContact CG1-CH2 4.08Å; V254-W278 HydrophobicContact CG1-CZ2 4.14Å; W278-F285 HydrophobicContact CD2-CB 3.88Å; W278-F285 HydrophobicContact CE3-CB 3.67Å; W278-F285 HydrophobicContact CE3-CD1 4.36Å; W278-F285 HydrophobicContact CE3-CG 4.38Å; W278-F285 HydrophobicContact CG-CB 4.47Å; W278-F285 HydrophobicContact CH2-CB 4.28Å; W278-F285 AromaticContact CH2-CD1 3.84Å; W278-F285 HydrophobicContact CH2-CD1 3.84Å; W278-F285 HydrophobicContact CH2-CE1 4.45Å; W278-F285 HydrophobicContact CH2-CG 4.17Å; W278-F285 HydrophobicContact CZ2-CB 4.49Å; W278-F285 HydrophobicContact CZ3-CB 3.89Å; W278-F285 AromaticContact CZ3-CD1 3.7Å; W278-F285 HydrophobicContact CZ3-CD1 3.7Å; W278-F285 HydrophobicContact CZ3-CG 4.09Å; W278-A298 HydrophobicContact CZ3-CB 4.18Å; W278-W318 VanDerWaalsContact O-CD1 3.25Å
279	S	94.5	Very high	82	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.			trans	-71.3	154.7	165.7	87.8	0	0	0	0	109.9	K281 D282 E283 Y284 N323	S279-K281 PolarHBondContact O-N 2.83Å; S279-K281 VanDerWaalsContact O-N 3.09Å; S279-D282 PolarHBondContact O-N 3.01Å; S279-D282 VanDerWaalsContact O-N 3.13Å; S279-E283 PolarHBondContact OG-N 3.13Å; S279-Y284 WeakPolarHBondContact CB-O 3.18Å; S279-Y284 PolarHBondContact N-O 3.47Å; S279-Y284 PolarHBondContact OG-N 3.25Å; S279-Y284 VanDerWaalsContact OG-N 3.15Å; S279-Y284 PolarHBondContact OG-O 2.95Å; S279-N323 WeakPolarHBondContact CB-OD1 3.47Å; S279-N323 PolarHBondContact OG-OD1 3.02Å
280	P	92.5	Very high	83.3	Confident	16 Å²	16	43.5 Å²	43.5	10%	0.104	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.3	-171.3	26.4	-36.4	0	0	0	114.5	S319 P320 D322	P280-S319 WeakPolarHBondContact CD-O 3.46Å; P280-S319 WeakPolarHBondContact CG-O 3.08Å; P280-P320 VanDerWaalsContact CB-C 3.47Å; P280-P320 WeakPolarHBondContact CB-O 3.41Å; P280-D322 WeakPolarHBondContact CG-O 3.37Å
281	K	91.6	Very high	84.3	Confident	105 Å²	105	43.5 Å²	43.5	46%	0.457	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	9.9	-179.4	-62.2	179.7	-176.6	173.9	0	113.7	S279 E283	S279-K281 PolarHBondContact O-N 2.83Å; S279-K281 VanDerWaalsContact O-N 3.09Å; K281-E283 HydrophobicContact CB-CG 4.03Å; K281-E283 PolarHBondContact O-N 3Å; K281-E283 VanDerWaalsContact O-N 3.15Å
282	D	92.3	Very high	85.7	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.011	19%	0.194	C	C	.	.	S	Bend	trans	59.3	17	-175.4	-62.3	7.2	0	0	0	114.3	S229 P230 L231 Q233 F234 S279 A298	S229-D282 VanDerWaalsContact CB-OD1 3.3Å; S229-D282 WeakPolarHBondContact CB-OD1 3.45Å; S229-D282 WeakPolarHBondContact CB-OD2 3.38Å; S229-D282 PolarHBondContact OG-OD2 3.49Å; P230-D282 WeakPolarHBondContact CD-OD1 3.22Å; P230-D282 VanDerWaalsContact N-OD1 3.11Å; L231-D282 WeakPolarHBondContact CA-OD2 3.49Å; L231-D282 VanDerWaalsContact CB-OD2 3.24Å; L231-D282 WeakPolarHBondContact CB-OD2 3.24Å; L231-D282 PolarHBondContact N-OD1 2.81Å; L231-D282 PolarHBondContact N-OD2 3.47Å; L231-D282 VanDerWaalsContact N-OD2 3.17Å; Q233-D282 HydrophobicContact CB-CB 4.46Å; Q233-D282 WeakPolarHBondContact CB-OD2 3.24Å; Q233-D282 WeakPolarHBondContact CG-OD2 3.32Å; Q233-D282 PolarHBondContact N-OD2 3.36Å; F234-D282 HydrophobicContact CD2-CB 4.31Å; F234-D282 HydrophobicContact CE2-CB 4.36Å; S279-D282 PolarHBondContact O-N 3.01Å; S279-D282 VanDerWaalsContact O-N 3.13Å; D282-A298 WeakPolarHBondContact O-CB 3.08Å
283	E	93	Very high	87.2	Confident	89 Å²	89	34.7 Å²	34.7	42%	0.416	18%	0.175	S	C	.	.	S	Bend	trans	-83	-30.7	-177.3	-67.5	179	139.1	0	0	112.6	S279 K281 A298 N323	S279-E283 PolarHBondContact OG-N 3.13Å; K281-E283 HydrophobicContact CB-CG 4.03Å; K281-E283 PolarHBondContact O-N 3Å; K281-E283 VanDerWaalsContact O-N 3.15Å; E283-A298 VanDerWaalsContact O-CB 3.29Å; E283-A298 WeakPolarHBondContact O-CB 3.48Å; E283-A298 PolarHBondContact O-N 3.29Å; E283-N323 PolarHBondContact OE2-ND2 3.2Å
284	Y	93.8	Very high	88.7	Confident	26 Å²	26	30.7 Å²	30.7	10%	0.102	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	156.4	-177.9	-49.9	-76.5	0	0	0	110.9	S279 I295 Y296 C297 L304 V344	S279-Y284 WeakPolarHBondContact CB-O 3.18Å; S279-Y284 PolarHBondContact N-O 3.47Å; S279-Y284 PolarHBondContact OG-N 3.25Å; S279-Y284 VanDerWaalsContact OG-N 3.15Å; S279-Y284 PolarHBondContact OG-O 2.95Å; Y284-I295 HydrophobicContact CD1-CG2 4.48Å; Y284-Y296 VanDerWaalsContact CA-O 3.26Å; Y284-Y296 WeakPolarHBondContact CA-O 3.25Å; Y284-C297 HydrophobicContact CD1-CB 4.42Å; Y284-C297 HydrophobicContact CE1-CB 4.49Å; Y284-L304 HydrophobicContact CE1-CD1 4.05Å; Y284-V344 HydrophobicContact CD1-CG1 4.29Å; Y284-V344 HydrophobicContact CD2-CG1 3.9Å; Y284-V344 HydrophobicContact CE1-CG1 4.38Å; Y284-V344 HydrophobicContact CE2-CG1 3.99Å; Y284-V344 HydrophobicContact CG-CG1 4.06Å
285	F	93	Very high	90.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	146.6	166	63.2	-82.2	0	0	0	109	V254 F266 F276 K277 W278 Y296 F301	V254-F285 HydrophobicContact CG2-CZ 4.5Å; F266-F285 AromaticContact CE2-CE2 3.83Å; F266-F285 HydrophobicContact CE2-CE2 3.83Å; F266-F285 HydrophobicContact CE2-CZ 4.19Å; F266-F285 AromaticContact CZ-CE2 3.7Å; F266-F285 HydrophobicContact CZ-CE2 3.7Å; F266-F285 AromaticContact CZ-CZ 3.98Å; F266-F285 HydrophobicContact CZ-CZ 3.98Å; F276-F285 AromaticContact CD1-CD2 3.75Å; F276-F285 HydrophobicContact CD1-CD2 3.75Å; F276-F285 HydrophobicContact CD1-CE2 4.06Å; F276-F285 HydrophobicContact CE1-CD2 4.32Å; F276-F285 HydrophobicContact CE1-CE2 4.17Å; K277-F285 WeakPolarHBondContact O-CA 3.25Å; W278-F285 HydrophobicContact CD2-CB 3.88Å; W278-F285 HydrophobicContact CE3-CB 3.67Å; W278-F285 HydrophobicContact CE3-CD1 4.36Å; W278-F285 HydrophobicContact CE3-CG 4.38Å; W278-F285 HydrophobicContact CG-CB 4.47Å; W278-F285 HydrophobicContact CH2-CB 4.28Å; W278-F285 AromaticContact CH2-CD1 3.84Å; W278-F285 HydrophobicContact CH2-CD1 3.84Å; W278-F285 HydrophobicContact CH2-CE1 4.45Å; W278-F285 HydrophobicContact CH2-CG 4.17Å; W278-F285 HydrophobicContact CZ2-CB 4.49Å; W278-F285 HydrophobicContact CZ3-CB 3.89Å; W278-F285 AromaticContact CZ3-CD1 3.7Å; W278-F285 HydrophobicContact CZ3-CD1 3.7Å; W278-F285 HydrophobicContact CZ3-CG 4.09Å; F285-Y296 AromaticContact CD2-CD2 3.87Å; F285-Y296 HydrophobicContact CD2-CD2 3.87Å; F285-Y296 HydrophobicContact CD2-CG 4.28Å; F285-Y296 HydrophobicContact CE1-CG 4.31Å; F285-Y296 AromaticContact CE2-CD2 3.48Å; F285-Y296 HydrophobicContact CE2-CD2 3.48Å; F285-Y296 VanDerWaalsContact CE2-CD2 3.48Å; F285-Y296 HydrophobicContact CE2-CE2 4.33Å; F285-Y296 AromaticContact CE2-CG 3.63Å; F285-Y296 HydrophobicContact CE2-CG 3.63Å; F285-Y296 HydrophobicContact CZ-CD1 4.4Å; F285-Y296 HydrophobicContact CZ-CD2 4.02Å; F285-Y296 AromaticContact CZ-CG 3.65Å; F285-Y296 HydrophobicContact CZ-CG 3.65Å; F285-Y296 PolarHBondContact N-O 3.06Å; F285-Y296 PolarHBondContact O-N 2.86Å; F285-F301 AromaticContact CE1-CD1 3.95Å; F285-F301 HydrophobicContact CE1-CD1 3.95Å; F285-F301 HydrophobicContact CZ-CD1 4.25Å
286	A	92.4	Very high	90.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.3	-176.1	0	0	0	0	0	111.4	F276 K277 I293 S294 I295 F316 W318	F276-A286 CarbonylContact C-O 3.57Å; F276-A286 VanDerWaalsContact CA-O 3.26Å; F276-A286 WeakPolarHBondContact CA-O 3.49Å; K277-A286 PolarHBondContact N-O 3.44Å; K277-A286 PolarHBondContact O-N 3.2Å; A286-I293 HydrophobicContact CB-CG2 3.97Å; A286-S294 VanDerWaalsContact CA-O 3.26Å; A286-S294 WeakPolarHBondContact CA-O 3.4Å; A286-I295 HydrophobicContact CB-CG1 4.08Å; A286-F316 HydrophobicContact CB-CE2 3.76Å; A286-F316 HydrophobicContact CB-CZ 4.17Å; A286-F316 WeakPolarHBondContact O-CZ 3.26Å; A286-W318 HydrophobicContact CB-CZ2 3.85Å
287	C	90.1	Very high	91.2	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.014	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	151.4	168.2	66.1	0	0	0	0	110.9	A275 F276 I293 S294	A275-C287 WeakPolarHBondContact O-CA 3.26Å; A275-C287 WeakPolarHBondContact O-CB 3.35Å; F276-C287 HydrophobicContact CD1-CB 3.62Å; F276-C287 HydrophobicContact CE1-CB 3.66Å; F276-C287 HydrophobicContact CG-CB 4.34Å; F276-C287 HydrophobicContact CZ-CB 4.39Å; C287-I293 CarbonylContact O-C 3.52Å; C287-I293 WeakPolarHBondContact O-CA 3.1Å; C287-S294 PolarHBondContact N-O 3.35Å; C287-S294 PolarHBondContact O-N 2.8Å
288	L	88.4	Confident	91.1	Very high	14 Å²	14	28.5 Å²	28.5	7%	0.073	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.4	173	174.6	66.6	0	0	0	108.8	F272 I293 I313 R314 F316	F272-L288 HydrophobicContact CZ-CB 4.08Å; F272-L288 VanDerWaalsContact CZ-O 3.23Å; F272-L288 WeakPolarHBondContact CZ-O 3.42Å; L288-I293 HydrophobicContact CD1-CG1 3.92Å; L288-I313 HydrophobicContact CD1-CB 3.86Å; L288-I313 HydrophobicContact CD1-CG2 3.85Å; L288-I313 HydrophobicContact CD2-CG2 4.45Å; L288-R314 VanDerWaalsContact CD2-O 3.25Å; L288-R314 WeakPolarHBondContact CD2-O 3.48Å; L288-F316 HydrophobicContact CB-CD1 3.64Å; L288-F316 HydrophobicContact CB-CE1 3.5Å; L288-F316 VanDerWaalsContact CB-CE1 3.5Å; L288-F316 HydrophobicContact CD2-CD1 4.38Å
289	R	83.7	Confident	90.9	Very high	50 Å²	50	32.5 Å²	32.5	19%	0.189	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	131.6	176.9	-66.7	-176.8	176.3	176.9	-9.1	109.5	V268 G291 V292	V268-R289 VanDerWaalsContact CG1-NH1 3.34Å; V268-R289 PolarHBondContact O-NH2 3.34Å; R289-G291 PolarHBondContact O-N 3.21Å; R289-G291 VanDerWaalsContact O-N 3.09Å; R289-V292 PolarHBondContact N-O 2.98Å; R289-V292 WeakPolarHBondContact O-CA 3.41Å; R289-V292 PolarHBondContact O-N 2.91Å; R289-V292 VanDerWaalsContact O-O 3.09Å
290	D	83.7	Confident	90.7	Very high	167 Å²	167	36.5 Å²	36.5	89%	0.893	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	37	178.2	-52	-42.7	0	0	0	113.5	V292	D290-V292 VanDerWaalsContact C-N 3.31Å; D290-V292 PolarHBondContact O-N 2.84Å
291	G	87.1	Confident	90.4	Very high	13 Å²	13	36.4 Å²	36.4	13%	0.134	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	15.6	-177.8	0	0	0	0	0	115.5	R289 G311 N312 I313	R289-G291 PolarHBondContact O-N 3.21Å; R289-G291 VanDerWaalsContact O-N 3.09Å; G291-G311 CarbonylContact O-C 3.54Å; G291-G311 WeakPolarHBondContact O-CA 3.3Å; G291-N312 PolarHBondContact O-N 2.98Å; G291-I313 VanDerWaalsContact CA-O 3.31Å; G291-I313 WeakPolarHBondContact CA-O 3.4Å; G291-I313 WeakPolarHBondContact O-CB 3.43Å; G291-I313 PolarHBondContact O-N 3.49Å
292	V	91	Very high	90.4	Very high	35 Å²	35	39.8 Å²	39.8	21%	0.212	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.7	-178.9	-178.8	0	0	0	0	110	R289 D290 K308 L309	R289-V292 PolarHBondContact N-O 2.98Å; R289-V292 WeakPolarHBondContact O-CA 3.41Å; R289-V292 PolarHBondContact O-N 2.91Å; R289-V292 VanDerWaalsContact O-O 3.09Å; D290-V292 VanDerWaalsContact C-N 3.31Å; D290-V292 PolarHBondContact O-N 2.84Å; V292-K308 HydrophobicContact CG1-CB 3.42Å; V292-K308 VanDerWaalsContact CG1-CB 3.42Å; V292-K308 HydrophobicContact CG1-CD 3.84Å; V292-K308 HydrophobicContact CG1-CG 4.24Å; V292-L309 WeakPolarHBondContact CG1-O 3.38Å
293	I	92.2	Very high	90.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	129.4	176.4	-59.9	172.7	0	0	0	109.7	A286 C287 L288 I295 L309 I313 F316 L325 Y327	A286-I293 HydrophobicContact CB-CG2 3.97Å; C287-I293 CarbonylContact O-C 3.52Å; C287-I293 WeakPolarHBondContact O-CA 3.1Å; L288-I293 HydrophobicContact CD1-CG1 3.92Å; I293-I295 HydrophobicContact CG2-CG1 3.97Å; I293-L309 HydrophobicContact CB-CB 4.23Å; I293-L309 HydrophobicContact CD1-CD2 4.32Å; I293-L309 PolarHBondContact N-O 3.06Å; I293-L309 PolarHBondContact O-N 2.96Å; I293-I313 HydrophobicContact CB-CD1 4.41Å; I293-I313 HydrophobicContact CD1-CD1 3.68Å; I293-I313 HydrophobicContact CD1-CG2 4.05Å; I293-I313 HydrophobicContact CG1-CD1 3.69Å; I293-I313 HydrophobicContact CG1-CG2 4.19Å; I293-F316 HydrophobicContact CD1-CB 3.46Å; I293-F316 VanDerWaalsContact CD1-CB 3.46Å; I293-F316 HydrophobicContact CD1-CD1 4.26Å; I293-F316 HydrophobicContact CD1-CD2 4.45Å; I293-F316 HydrophobicContact CD1-CG 3.81Å; I293-F316 HydrophobicContact CG1-CB 4.36Å; I293-F316 HydrophobicContact CG1-CD1 4.28Å; I293-F316 HydrophobicContact CG1-CG 4.3Å; I293-L325 HydrophobicContact CD1-CD2 4Å; I293-L325 HydrophobicContact CG2-CD2 4.31Å; I293-Y327 HydrophobicContact CD1-CD1 4.45Å; I293-Y327 HydrophobicContact CD1-CG 4.17Å
294	S	91.9	Very high	90.2	Very high	6 Å²	6	38.3 Å²	38.3	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.1	172.1	-61.6	0	0	0	0	109.6	A286 C287	A286-S294 VanDerWaalsContact CA-O 3.26Å; A286-S294 WeakPolarHBondContact CA-O 3.4Å; C287-S294 PolarHBondContact N-O 3.35Å; C287-S294 PolarHBondContact O-N 2.8Å
295	I	93.2	Very high	89.9	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.7	179.8	-52.7	176.1	0	0	0	108.9	Y284 A286 I293 L303 L304 W318 L325 M342 V344	Y284-I295 HydrophobicContact CD1-CG2 4.48Å; A286-I295 HydrophobicContact CB-CG1 4.08Å; I293-I295 HydrophobicContact CG2-CG1 3.97Å; I295-L303 WeakPolarHBondContact O-CD1 3.3Å; I295-L304 HydrophobicContact CB-CB 4.34Å; I295-L304 HydrophobicContact CB-CD2 4.49Å; I295-L304 HydrophobicContact CG2-CB 4.35Å; I295-L304 HydrophobicContact CG2-CD2 4.07Å; I295-L304 WeakPolarHBondContact O-CB 3.38Å; I295-L304 PolarHBondContact O-N 2.96Å; I295-W318 HydrophobicContact CG2-CH2 4.32Å; I295-W318 HydrophobicContact CG2-CZ2 4.34Å; I295-L325 HydrophobicContact CD1-CD2 4.12Å; I295-M342 HydrophobicContact CD1-CE 4.02Å; I295-V344 HydrophobicContact CD1-CG2 4.01Å; I295-V344 HydrophobicContact CG2-CG1 4.36Å
296	Y	93.1	Very high	89.6	Confident	27 Å²	27	50.8 Å²	50.8	11%	0.106	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143.6	179.4	-59.9	-88.3	0	0	0	110.4	F266 F276 Y284 F285 R302 L303	F266-Y296 HydrophobicContact CE1-CD1 4.42Å; F266-Y296 AromaticContact CE1-CE1 3.78Å; F266-Y296 HydrophobicContact CE1-CE1 3.78Å; F266-Y296 HydrophobicContact CE1-CE2 4.11Å; F266-Y296 AromaticContact CE1-CZ 3.6Å; F266-Y296 HydrophobicContact CZ-CD1 4.27Å; F266-Y296 HydrophobicContact CZ-CD2 4.39Å; F266-Y296 HydrophobicContact CZ-CE1 4.08Å; F266-Y296 HydrophobicContact CZ-CE2 4.19Å; F266-Y296 HydrophobicContact CZ-CG 4.44Å; F276-Y296 HydrophobicContact CE1-CE2 4.39Å; Y284-Y296 VanDerWaalsContact CA-O 3.26Å; Y284-Y296 WeakPolarHBondContact CA-O 3.25Å; F285-Y296 AromaticContact CD2-CD2 3.87Å; F285-Y296 HydrophobicContact CD2-CD2 3.87Å; F285-Y296 HydrophobicContact CD2-CG 4.28Å; F285-Y296 HydrophobicContact CE1-CG 4.31Å; F285-Y296 AromaticContact CE2-CD2 3.48Å; F285-Y296 HydrophobicContact CE2-CD2 3.48Å; F285-Y296 VanDerWaalsContact CE2-CD2 3.48Å; F285-Y296 HydrophobicContact CE2-CE2 4.33Å; F285-Y296 AromaticContact CE2-CG 3.63Å; F285-Y296 HydrophobicContact CE2-CG 3.63Å; F285-Y296 HydrophobicContact CZ-CD1 4.4Å; F285-Y296 HydrophobicContact CZ-CD2 4.02Å; F285-Y296 AromaticContact CZ-CG 3.65Å; F285-Y296 HydrophobicContact CZ-CG 3.65Å; F285-Y296 PolarHBondContact N-O 3.06Å; F285-Y296 PolarHBondContact O-N 2.86Å; Y296-R302 CarbonylContact C-O 3.6Å; Y296-R302 VanDerWaalsContact CA-O 3.3Å; Y296-R302 WeakPolarHBondContact CA-O 3.29Å; Y296-L303 HydrophobicContact CE1-CB 4.45Å; Y296-L303 HydrophobicContact CE1-CD1 4.38Å
297	C	92.8	Very high	89.4	Confident	23 Å²	23	57.4 Å²	57.4	16%	0.155	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.7	173	-173.3	0	0	0	0	109.9	Y284 S299 N300 F301 R302	Y284-C297 HydrophobicContact CD1-CB 4.42Å; Y284-C297 HydrophobicContact CE1-CB 4.49Å; C297-S299 PolarHBondContact O-N 3.01Å; C297-S299 PolarHBondContact SG-OG 2.91Å; C297-N300 PolarHBondContact O-N 3.35Å; C297-N300 PolarHBondContact O-OD1 2.99Å; C297-F301 WeakPolarHBondContact O-CA 3.21Å; C297-F301 PolarHBondContact O-N 2.81Å; C297-R302 PolarHBondContact N-O 3.39Å
298	A	90.3	Very high	89.4	Confident	5 Å²	5	64 Å²	64	4%	0.041	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-19.4	-177.1	0	0	0	0	0	113.6	F234 W278 D282 E283 F301	F234-A298 HydrophobicContact CD2-CB 4.4Å; F234-A298 HydrophobicContact CE2-CB 3.75Å; F234-A298 HydrophobicContact CZ-CB 4.21Å; W278-A298 HydrophobicContact CZ3-CB 4.18Å; D282-A298 WeakPolarHBondContact O-CB 3.08Å; E283-A298 VanDerWaalsContact O-CB 3.29Å; E283-A298 WeakPolarHBondContact O-CB 3.48Å; E283-A298 PolarHBondContact O-N 3.29Å; A298-F301 VanDerWaalsContact O-CE2 3.23Å; A298-F301 WeakPolarHBondContact O-CE2 3.18Å; A298-F301 VanDerWaalsContact O-CZ 3.24Å; A298-F301 WeakPolarHBondContact O-CZ 3.11Å
299	S	89.5	Confident	89.4	Confident	100 Å²	100	64.3 Å²	64.3	70%	0.699	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-36.2	178.4	65.5	0	0	0	0	113.1	C297	C297-S299 PolarHBondContact O-N 3.01Å; C297-S299 PolarHBondContact SG-OG 2.91Å
300	N	88.5	Confident	89.2	Confident	84 Å²	84	64.5 Å²	64.5	45%	0.449	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-4.5	-174.5	64	25.1	0	0	0	113.9	C297 R302	C297-N300 PolarHBondContact O-N 3.35Å; C297-N300 PolarHBondContact O-OD1 2.99Å; N300-R302 PolarHBondContact O-N 2.9Å; N300-R302 WeakPolarHBondContact OD1-CB 3.39Å; N300-R302 PolarHBondContact OD1-N 2.89Å
301	F	88	Confident	89.2	Confident	14 Å²	14	58.7 Å²	58.7	6%	0.061	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	28	-177.5	-54.9	-89.6	0	0	0	114.1	F234 V254 R263 R264 F285 C297 A298	F234-F301 HydrophobicContact CD1-CE1 4.23Å; F234-F301 AromaticContact CD1-CZ 3.95Å; F234-F301 HydrophobicContact CD1-CZ 3.95Å; F234-F301 HydrophobicContact CE1-CE1 4.21Å; F234-F301 AromaticContact CE1-CZ 3.56Å; F234-F301 HydrophobicContact CE1-CZ 3.56Å; F234-F301 HydrophobicContact CZ-CZ 4.15Å; V254-F301 HydrophobicContact CB-CE1 4.45Å; V254-F301 HydrophobicContact CG1-CD1 4.07Å; V254-F301 HydrophobicContact CG1-CE1 3.63Å; R263-F301 HydrophobicContact CB-CD1 4.07Å; R263-F301 HydrophobicContact CB-CD2 3.75Å; R263-F301 HydrophobicContact CB-CE1 3.79Å; R263-F301 HydrophobicContact CB-CE2 3.45Å; R263-F301 VanDerWaalsContact CB-CE2 3.45Å; R263-F301 HydrophobicContact CB-CG 4.06Å; R263-F301 HydrophobicContact CB-CZ 3.46Å; R263-F301 VanDerWaalsContact CB-CZ 3.46Å; R263-F301 HydrophobicContact CG-CD2 4.33Å; R263-F301 HydrophobicContact CG-CE1 4.31Å; R263-F301 HydrophobicContact CG-CE2 3.57Å; R263-F301 HydrophobicContact CG-CZ 3.55Å; R264-F301 HydrophobicContact CB-CB 3.93Å; R264-F301 HydrophobicContact CB-CD1 4.21Å; R264-F301 HydrophobicContact CB-CG 4.25Å; R264-F301 HydrophobicContact CG-CB 4.17Å; F285-F301 AromaticContact CE1-CD1 3.95Å; F285-F301 HydrophobicContact CE1-CD1 3.95Å; F285-F301 HydrophobicContact CZ-CD1 4.25Å; C297-F301 WeakPolarHBondContact O-CA 3.21Å; C297-F301 PolarHBondContact O-N 2.81Å; A298-F301 VanDerWaalsContact O-CE2 3.23Å; A298-F301 WeakPolarHBondContact O-CE2 3.18Å; A298-F301 VanDerWaalsContact O-CZ 3.24Å; A298-F301 WeakPolarHBondContact O-CZ 3.11Å
302	R	90.1	Very high	89.3	Confident	176 Å²	176	61.9 Å²	61.9	66%	0.664	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	158.7	176.5	-64.7	-179.9	-179.9	-175.2	-1.6	110.7	Y296 C297 N300 L304	Y296-R302 CarbonylContact C-O 3.6Å; Y296-R302 VanDerWaalsContact CA-O 3.3Å; Y296-R302 WeakPolarHBondContact CA-O 3.29Å; C297-R302 PolarHBondContact N-O 3.39Å; N300-R302 PolarHBondContact O-N 2.9Å; N300-R302 WeakPolarHBondContact OD1-CB 3.39Å; N300-R302 PolarHBondContact OD1-N 2.89Å; R302-L304 PolarHBondContact O-N 3.24Å
303	L	90.6	Very high	89.4	Confident	43 Å²	43	60.4 Å²	60.4	23%	0.225	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	127.4	176	-173.2	71.6	0	0	0	109.9	I295 Y296 D305 K306 K308	I295-L303 WeakPolarHBondContact O-CD1 3.3Å; Y296-L303 HydrophobicContact CE1-CB 4.45Å; Y296-L303 HydrophobicContact CE1-CD1 4.38Å; L303-D305 PolarHBondContact O-N 3.04Å; L303-K306 VanDerWaalsContact CD2-C 3.49Å; L303-K306 PolarHBondContact O-N 2.99Å; L303-K306 VanDerWaalsContact O-N 3.16Å; L303-K308 HydrophobicContact CD2-CG 4.04Å
304	L	90.1	Very high	89.2	Confident	17 Å²	17	68 Å²	68	9%	0.089	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-56.1	126.9	176.6	-173	66.5	0	0	0	109.1	Y284 I295 R302 K306 K307 V344 P345 R347	Y284-L304 HydrophobicContact CE1-CD1 4.05Å; I295-L304 HydrophobicContact CB-CB 4.34Å; I295-L304 HydrophobicContact CB-CD2 4.49Å; I295-L304 HydrophobicContact CG2-CB 4.35Å; I295-L304 HydrophobicContact CG2-CD2 4.07Å; I295-L304 WeakPolarHBondContact O-CB 3.38Å; I295-L304 PolarHBondContact O-N 2.96Å; R302-L304 PolarHBondContact O-N 3.24Å; L304-K306 PolarHBondContact O-N 3.4Å; L304-K307 PolarHBondContact O-N 2.8Å; L304-V344 HydrophobicContact CD2-CG1 3.8Å; L304-P345 HydrophobicContact CD1-CB 4.4Å; L304-P345 HydrophobicContact CD2-CB 4.28Å; L304-R347 VanDerWaalsContact C-NH2 3.27Å; L304-R347 PolarHBondContact O-NH2 3.4Å
305	D	87.4	Confident	89.2	Confident	96 Å²	96	70.2 Å²	70.2	51%	0.513	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	48.6	16.4	-176.5	-41.3	-48.5	0	0	0	116.2	L303 K307 R347	L303-D305 PolarHBondContact O-N 3.04Å; D305-K307 PolarHBondContact O-N 3Å; D305-K307 VanDerWaalsContact O-N 3.08Å; D305-R347 IonicContact OD2-CZ 3.72Å; D305-R347 IonicContact OD2-NE 2.73Å; D305-R347 PolarHBondContact OD2-NE 2.82Å; D305-R347 IonicContact OD2-NH2 3.46Å; D305-R347 PolarHBondContact OD2-NH2 3.35Å
306	K	87.1	Confident	89.2	Confident	192 Å²	192	70.2 Å²	70.2	84%	0.835	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	53.9	19.9	-168.7	-53.7	177.2	-178.6	176	0	114	L303 L304	L303-K306 VanDerWaalsContact CD2-C 3.49Å; L303-K306 PolarHBondContact O-N 2.99Å; L303-K306 VanDerWaalsContact O-N 3.16Å; L304-K306 PolarHBondContact O-N 3.4Å
307	K	88.8	Confident	89.3	Confident	140 Å²	140	70.2 Å²	70.2	61%	0.609	36%	0.363	S	S	*	.			trans	-116.6	130.2	-177.1	-72.9	178.1	-176.5	179.6	0	110.9	L304 D305 R347	L304-K307 PolarHBondContact O-N 2.8Å; D305-K307 PolarHBondContact O-N 3Å; D305-K307 VanDerWaalsContact O-N 3.08Å; K307-R347 PolarHBondContact O-NH1 2.85Å; K307-R347 PolarHBondContact O-NH2 3.4Å
308	K	90.1	Very high	89.4	Confident	139 Å²	139	69.8 Å²	69.8	60%	0.604	36%	0.358	S	S	*	.			trans	-84.6	161	169.5	-53.9	-177.7	179.1	177.9	0	110.5	V292 L303	V292-K308 HydrophobicContact CG1-CB 3.42Å; V292-K308 VanDerWaalsContact CG1-CB 3.42Å; V292-K308 HydrophobicContact CG1-CD 3.84Å; V292-K308 HydrophobicContact CG1-CG 4.24Å; L303-K308 HydrophobicContact CD2-CG 4.04Å
309	L	88.8	Confident	89.7	Confident	22 Å²	22	69.6 Å²	69.6	12%	0.115	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-109.8	128.8	-177	-175.4	76	0	0	0	111.5	V292 I293 I313 L325 Y327 M342	V292-L309 WeakPolarHBondContact CG1-O 3.38Å; I293-L309 HydrophobicContact CB-CB 4.23Å; I293-L309 HydrophobicContact CD1-CD2 4.32Å; I293-L309 PolarHBondContact N-O 3.06Å; I293-L309 PolarHBondContact O-N 2.96Å; L309-I313 WeakPolarHBondContact O-CD1 3.38Å; L309-L325 HydrophobicContact CD2-CD2 3.95Å; L309-Y327 HydrophobicContact CD2-CD1 4.06Å; L309-Y327 HydrophobicContact CD2-CE1 3.65Å; L309-M342 HydrophobicContact CD1-CE 4.23Å; L309-M342 HydrophobicContact CD1-SD 3.56Å; L309-M342 VanDerWaalsContact CD1-SD 3.56Å; L309-M342 HydrophobicContact CD2-CE 3.42Å; L309-M342 VanDerWaalsContact CD2-CE 3.42Å; L309-M342 HydrophobicContact CD2-SD 3.74Å; L309-M342 HydrophobicContact CG-CE 4.45Å; L309-M342 HydrophobicContact CG-SD 4.32Å
310	G	79.1	Confident	89.9	Confident	54 Å²	54	67.7 Å²	67.7	56%	0.557	34%	0.342	S	S	*	.			trans	77.9	-165.9	166.7	0	0	0	0	0	116.4
311	G	83.9	Confident	90	Very high	45 Å²	45	65.4 Å²	65.4	46%	0.464	33%	0.332	S	S	.	.	S	Bend	trans	-163.3	136.2	173.8	0	0	0	0	0	108.9	G291 I313	G291-G311 CarbonylContact O-C 3.54Å; G291-G311 WeakPolarHBondContact O-CA 3.3Å; G311-I313 VanDerWaalsContact C-N 3.32Å; G311-I313 PolarHBondContact O-N 3.21Å
312	N	89.5	Confident	90.3	Very high	79 Å²	79	66.9 Å²	66.9	42%	0.422	34%	0.34	S	S	.	.	S	Bend	trans	61.1	28.8	-175.3	-162	28.4	0	0	0	115.5	G291 P330	G291-N312 PolarHBondContact O-N 2.98Å; N312-P330 WeakPolarHBondContact O-CD 3.33Å
313	I	91.5	Very high	90.5	Very high	5 Å²	5	59.5 Å²	59.5	3%	0.026	31%	0.314	C	S	.	.			trans	-65.9	136.8	172.5	-63.6	171.2	0	0	0	109.9	L288 G291 I293 L309 G311 Y327 V329	L288-I313 HydrophobicContact CD1-CB 3.86Å; L288-I313 HydrophobicContact CD1-CG2 3.85Å; L288-I313 HydrophobicContact CD2-CG2 4.45Å; G291-I313 VanDerWaalsContact CA-O 3.31Å; G291-I313 WeakPolarHBondContact CA-O 3.4Å; G291-I313 WeakPolarHBondContact O-CB 3.43Å; G291-I313 PolarHBondContact O-N 3.49Å; I293-I313 HydrophobicContact CB-CD1 4.41Å; I293-I313 HydrophobicContact CD1-CD1 3.68Å; I293-I313 HydrophobicContact CD1-CG2 4.05Å; I293-I313 HydrophobicContact CG1-CD1 3.69Å; I293-I313 HydrophobicContact CG1-CG2 4.19Å; L309-I313 WeakPolarHBondContact O-CD1 3.38Å; G311-I313 VanDerWaalsContact C-N 3.32Å; G311-I313 PolarHBondContact O-N 3.21Å; I313-Y327 HydrophobicContact CD1-CD2 3.85Å; I313-Y327 HydrophobicContact CD1-CE2 4.2Å; I313-Y327 HydrophobicContact CD1-CG 4.36Å; I313-Y327 HydrophobicContact CG1-CD2 4.05Å; I313-V329 HydrophobicContact CG1-CG2 4.03Å
314	R	89.6	Confident	90.7	Very high	158 Å²	158	58.2 Å²	58.2	60%	0.596	31%	0.307	S	S	*	.			trans	-98.4	-40.4	-178.9	-75.1	-74.6	178.6	174.2	0.6	113.9	L288 W328 P330	L288-R314 VanDerWaalsContact CD2-O 3.25Å; L288-R314 WeakPolarHBondContact CD2-O 3.48Å; R314-W328 HydrophobicContact CB-CD2 4.03Å; R314-W328 VanDerWaalsContact CB-CE2 3.45Å; R314-W328 HydrophobicContact CB-CE3 4.35Å; R314-W328 HydrophobicContact CB-CH2 3.66Å; R314-W328 HydrophobicContact CB-CZ2 3.25Å; R314-W328 HydrophobicContact CB-CZ3 4.21Å; R314-W328 HydrophobicContact CG-CH2 3.76Å; R314-W328 HydrophobicContact CG-CZ2 3.89Å; R314-W328 HydrophobicContact CG-CZ3 4.18Å; R314-W328 PolarHBondContact N-O 2.99Å; R314-W328 VanDerWaalsContact N-O 3.14Å; R314-P330 HydrophobicContact CG-CB 4.19Å; R314-P330 HydrophobicContact CG-CG 3.64Å
315	D	91.6	Very high	90.9	Very high	54 Å²	54	57.4 Å²	57.4	29%	0.289	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	162.6	174.3	-170.7	24.6	0	0	0	110.6	K277 Y327 W328	K277-D315 IonicContact NZ-OD1 3.11Å; K277-D315 PolarHBondContact NZ-OD1 2.94Å; K277-D315 VanDerWaalsContact NZ-OD1 3.16Å; D315-Y327 WeakPolarHBondContact O-CA 3.46Å; D315-W328 PolarHBondContact O-N 2.65Å
316	F	93.7	Very high	91.3	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	153.3	177.4	77.7	-80.4	0	0	0	111.4	K277 A286 L288 I293 L325 A326	K277-F316 HydrophobicContact CB-CE2 3.89Å; K277-F316 HydrophobicContact CB-CZ 4.1Å; K277-F316 HydrophobicContact CD-CD2 4.38Å; K277-F316 HydrophobicContact CD-CE1 4.42Å; K277-F316 HydrophobicContact CD-CE2 3.88Å; K277-F316 HydrophobicContact CD-CZ 3.9Å; K277-F316 HydrophobicContact CG-CE2 4.09Å; K277-F316 HydrophobicContact CG-CZ 3.93Å; K277-F316 PolarHBondContact NZ-O 3.44Å; A286-F316 HydrophobicContact CB-CE2 3.76Å; A286-F316 HydrophobicContact CB-CZ 4.17Å; A286-F316 WeakPolarHBondContact O-CZ 3.26Å; L288-F316 HydrophobicContact CB-CD1 3.64Å; L288-F316 HydrophobicContact CB-CE1 3.5Å; L288-F316 VanDerWaalsContact CB-CE1 3.5Å; L288-F316 HydrophobicContact CD2-CD1 4.38Å; I293-F316 HydrophobicContact CD1-CB 3.46Å; I293-F316 VanDerWaalsContact CD1-CB 3.46Å; I293-F316 HydrophobicContact CD1-CD1 4.26Å; I293-F316 HydrophobicContact CD1-CD2 4.45Å; I293-F316 HydrophobicContact CD1-CG 3.81Å; I293-F316 HydrophobicContact CG1-CB 4.36Å; I293-F316 HydrophobicContact CG1-CD1 4.28Å; I293-F316 HydrophobicContact CG1-CG 4.3Å; F316-L325 HydrophobicContact CD2-CD1 3.68Å; F316-L325 HydrophobicContact CE2-CD1 4.33Å; F316-A326 CarbonylContact C-O 3.56Å; F316-A326 WeakPolarHBondContact CA-O 3.36Å; F316-A326 WeakPolarHBondContact CB-O 3.42Å
317	S	94.5	Very high	91.7	Very high	28 Å²	28	44 Å²	44	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	144	172.6	-173.3	0	0	0	0	111.2	A326 W365	S317-A326 PolarHBondContact N-O 3.16Å; S317-A326 PolarHBondContact O-N 2.86Å; S317-W365 PolarHBondContact OG-NE1 2.49Å
318	W	95.2	Very high	92	Very high	13 Å²	13	38.3 Å²	38.3	5%	0.049	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	147.8	170.5	-68.5	103.2	0	0	0	111.1	K277 W278 A286 I295 L325 V344 W365	K277-W318 PolarHBondContact O-NE1 3.44Å; W278-W318 VanDerWaalsContact O-CD1 3.25Å; A286-W318 HydrophobicContact CB-CZ2 3.85Å; I295-W318 HydrophobicContact CG2-CH2 4.32Å; I295-W318 HydrophobicContact CG2-CZ2 4.34Å; W318-L325 HydrophobicContact CD2-CD1 3.55Å; W318-L325 HydrophobicContact CE3-CB 4.28Å; W318-L325 HydrophobicContact CE3-CD1 3.84Å; W318-L325 HydrophobicContact CG-CD1 4.06Å; W318-L325 HydrophobicContact CH2-CD1 4.14Å; W318-L325 HydrophobicContact CZ2-CD1 3.87Å; W318-L325 HydrophobicContact CZ3-CB 4.2Å; W318-L325 HydrophobicContact CZ3-CD1 4.12Å; W318-V344 HydrophobicContact CH2-CB 4.06Å; W318-V344 HydrophobicContact CH2-CG1 4.1Å; W318-V344 HydrophobicContact CH2-CG2 3.79Å; W318-V344 HydrophobicContact CZ3-CB 3.99Å; W318-V344 HydrophobicContact CZ3-CG1 4.48Å; W318-V344 HydrophobicContact CZ3-CG2 3.8Å; W318-W365 PolarHBondContact O-NE1 2.77Å
319	S	95.8	Very high	92.2	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.007	19%	0.192	C	C	.	.			trans	-63.3	136.5	162.3	168.8	0	0	0	0	109.3	P280 S321 D322 I324	P280-S319 WeakPolarHBondContact CD-O 3.46Å; P280-S319 WeakPolarHBondContact CG-O 3.08Å; S319-S321 PolarHBondContact O-N 2.88Å; S319-S321 PolarHBondContact OG-N 3.23Å; S319-D322 WeakPolarHBondContact CB-O 3.4Å; S319-D322 PolarHBondContact OG-N 2.84Å; S319-I324 PolarHBondContact N-O 2.79Å
320	P	93.3	Very high	92.4	Very high	61 Å²	61	32.5 Å²	32.5	40%	0.396	19%	0.192	S	C	.	.	S	Bend	trans	-67	-13.1	179.2	-27.2	37.7	0	0	0	115.8	P280 W365 H366 E367	P280-P320 VanDerWaalsContact CB-C 3.47Å; P280-P320 WeakPolarHBondContact CB-O 3.41Å; P320-W365 HydrophobicContact CG-CB 3.85Å; P320-W365 HydrophobicContact CG-CG 4.45Å; P320-H366 WeakPolarHBondContact CG-O 3.44Å; P320-E367 VanDerWaalsContact CB-O 3.27Å; P320-E367 WeakPolarHBondContact CB-O 3.31Å
321	S	91.9	Very high	92.8	Very high	36 Å²	36	34.5 Å²	34.5	25%	0.252	19%	0.187	S	C	.	.	S	Bend	trans	-123.5	-37.1	-176.3	53.2	0	0	0	0	113.9	S319 Q368 R405	S319-S321 PolarHBondContact O-N 2.88Å; S319-S321 PolarHBondContact OG-N 3.23Å; S321-Q368 VanDerWaalsContact CB-O 3.3Å; S321-Q368 WeakPolarHBondContact CB-O 3.31Å; S321-Q368 PolarHBondContact OG-O 3.42Å; S321-R405 PolarHBondContact OG-NH2 3.01Å; S321-R405 VanDerWaalsContact OG-NH2 3.1Å
322	D	93	Very high	92.9	Very high	44 Å²	44	34.9 Å²	34.9	24%	0.235	18%	0.183	C	C	.	.	S	Bend	trans	-111.6	155.2	-176.2	-60.9	-55.6	0	0	0	111.7	P280 S319 I324 R405	P280-D322 WeakPolarHBondContact CG-O 3.37Å; S319-D322 WeakPolarHBondContact CB-O 3.4Å; S319-D322 PolarHBondContact OG-N 2.84Å; D322-I324 HydrophobicContact CB-CD1 3.9Å; D322-I324 HydrophobicContact CB-CG1 3.97Å; D322-I324 PolarHBondContact O-N 3.09Å; D322-R405 IonicContact OD2-CZ 2.69Å; D322-R405 VanDerWaalsContact OD2-CZ 3.3Å; D322-R405 IonicContact OD2-NH1 3.48Å; D322-R405 PolarHBondContact OD2-NH1 3.16Å; D322-R405 IonicContact OD2-NH2 3.34Å; D322-R405 PolarHBondContact OD2-NH2 3.22Å
323	N	94	Very high	92.4	Very high	22 Å²	22	39.1 Å²	39.1	12%	0.118	21%	0.205	C	C	.	.	S	Bend	trans	-76.2	53.2	174.4	-69.4	-32.4	0	0	0	111.3	S279 E283 V344	S279-N323 WeakPolarHBondContact CB-OD1 3.47Å; S279-N323 PolarHBondContact OG-OD1 3.02Å; E283-N323 PolarHBondContact OE2-ND2 3.2Å; N323-V344 VanDerWaalsContact CB-O 3.3Å; N323-V344 WeakPolarHBondContact CB-O 3.31Å; N323-V344 PolarHBondContact O-N 3.24Å
324	I	95.3	Very high	92	Very high	15 Å²	15	46.4 Å²	46.4	8%	0.077	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.9	176.5	-61	170.9	0	0	0	107.9	S319 D322 L341 M342 L350 W365 L404	S319-I324 PolarHBondContact N-O 2.79Å; D322-I324 HydrophobicContact CB-CD1 3.9Å; D322-I324 HydrophobicContact CB-CG1 3.97Å; D322-I324 PolarHBondContact O-N 3.09Å; I324-L341 HydrophobicContact CG2-CB 4.3Å; I324-L341 HydrophobicContact CG2-CD2 4.3Å; I324-M342 CarbonylContact C-O 3.57Å; I324-M342 WeakPolarHBondContact CA-O 3.46Å; I324-L350 HydrophobicContact CD1-CD1 3.91Å; I324-L350 HydrophobicContact CG1-CD1 4Å; I324-L350 HydrophobicContact CG2-CD1 4.24Å; I324-W365 HydrophobicContact CG2-CH2 4.33Å; I324-L404 HydrophobicContact CD1-CD2 3.9Å
325	L	95	Very high	92	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	119.9	176.4	-166.6	75.8	0	0	0	109.1	I293 I295 L309 F316 W318 Y327 M342 V344	I293-L325 HydrophobicContact CD1-CD2 4Å; I293-L325 HydrophobicContact CG2-CD2 4.31Å; I295-L325 HydrophobicContact CD1-CD2 4.12Å; L309-L325 HydrophobicContact CD2-CD2 3.95Å; F316-L325 HydrophobicContact CD2-CD1 3.68Å; F316-L325 HydrophobicContact CE2-CD1 4.33Å; W318-L325 HydrophobicContact CD2-CD1 3.55Å; W318-L325 HydrophobicContact CE3-CB 4.28Å; W318-L325 HydrophobicContact CE3-CD1 3.84Å; W318-L325 HydrophobicContact CG-CD1 4.06Å; W318-L325 HydrophobicContact CH2-CD1 4.14Å; W318-L325 HydrophobicContact CZ2-CD1 3.87Å; W318-L325 HydrophobicContact CZ3-CB 4.2Å; W318-L325 HydrophobicContact CZ3-CD1 4.12Å; L325-Y327 HydrophobicContact CD2-CD1 4.29Å; L325-M342 HydrophobicContact CB-CE 4.18Å; L325-M342 HydrophobicContact CD2-CE 3.79Å; L325-M342 PolarHBondContact N-O 3.07Å; L325-M342 PolarHBondContact O-N 3.05Å; L325-V344 HydrophobicContact CB-CG2 4.36Å
326	A	96.1	Very high	92.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	135.1	164.8	0	0	0	0	0	109.5	F316 S317 V340 L341 L363 W365 L372	F316-A326 CarbonylContact C-O 3.56Å; F316-A326 WeakPolarHBondContact CA-O 3.36Å; F316-A326 WeakPolarHBondContact CB-O 3.42Å; S317-A326 PolarHBondContact N-O 3.16Å; S317-A326 PolarHBondContact O-N 2.86Å; A326-V340 VanDerWaalsContact CA-O 3.32Å; A326-V340 WeakPolarHBondContact CA-O 3.42Å; A326-L341 HydrophobicContact CB-CD2 3.65Å; A326-L363 HydrophobicContact CB-CD1 4Å; A326-W365 HydrophobicContact CB-CH2 4.47Å; A326-W365 HydrophobicContact CB-CZ2 3.51Å; A326-L372 HydrophobicContact CB-CD2 3.93Å
327	Y	95.3	Very high	92.1	Very high	7 Å²	7	41.2 Å²	41.2	3%	0.027	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	160.9	169.4	63.2	-88.7	0	0	0	110.6	I293 L309 I313 D315 L325 V329 V340 M342	I293-Y327 HydrophobicContact CD1-CD1 4.45Å; I293-Y327 HydrophobicContact CD1-CG 4.17Å; L309-Y327 HydrophobicContact CD2-CD1 4.06Å; L309-Y327 HydrophobicContact CD2-CE1 3.65Å; I313-Y327 HydrophobicContact CD1-CD2 3.85Å; I313-Y327 HydrophobicContact CD1-CE2 4.2Å; I313-Y327 HydrophobicContact CD1-CG 4.36Å; I313-Y327 HydrophobicContact CG1-CD2 4.05Å; D315-Y327 WeakPolarHBondContact O-CA 3.46Å; L325-Y327 HydrophobicContact CD2-CD1 4.29Å; Y327-V329 HydrophobicContact CD2-CG2 4.37Å; Y327-V329 HydrophobicContact CE2-CG2 4.38Å; Y327-V340 HydrophobicContact CD1-CB 4.29Å; Y327-V340 HydrophobicContact CD2-CB 4.29Å; Y327-V340 HydrophobicContact CD2-CG2 4.44Å; Y327-V340 HydrophobicContact CE1-CB 3.81Å; Y327-V340 HydrophobicContact CE1-CG1 3.81Å; Y327-V340 HydrophobicContact CE2-CB 3.81Å; Y327-V340 HydrophobicContact CE2-CG1 4.37Å; Y327-V340 HydrophobicContact CE2-CG2 3.78Å; Y327-V340 PolarHBondContact N-O 3.21Å; Y327-V340 PolarHBondContact O-N 3.24Å; Y327-V340 WeakPolarHBondContact OH-CG1 3.45Å; Y327-M342 HydrophobicContact CE1-CB 4.06Å
328	W	95	Very high	92	Very high	20 Å²	20	43.6 Å²	43.6	8%	0.076	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.8	176.9	76.7	-86.3	0	0	0	112.8	R314 D315 P330 R338 V339 I361	R314-W328 HydrophobicContact CB-CD2 4.03Å; R314-W328 VanDerWaalsContact CB-CE2 3.45Å; R314-W328 HydrophobicContact CB-CE3 4.35Å; R314-W328 HydrophobicContact CB-CH2 3.66Å; R314-W328 HydrophobicContact CB-CZ2 3.25Å; R314-W328 HydrophobicContact CB-CZ3 4.21Å; R314-W328 HydrophobicContact CG-CH2 3.76Å; R314-W328 HydrophobicContact CG-CZ2 3.89Å; R314-W328 HydrophobicContact CG-CZ3 4.18Å; R314-W328 PolarHBondContact N-O 2.99Å; R314-W328 VanDerWaalsContact N-O 3.14Å; D315-W328 PolarHBondContact O-N 2.65Å; W328-P330 HydrophobicContact CE3-CB 4.38Å; W328-P330 HydrophobicContact CH2-CB 4.26Å; W328-P330 HydrophobicContact CZ3-CB 3.61Å; W328-P330 HydrophobicContact CZ3-CG 4.46Å; W328-R338 CarbonylContact C-O 3.58Å; W328-R338 VanDerWaalsContact CA-O 3.24Å; W328-R338 WeakPolarHBondContact CA-O 3.37Å; W328-V339 HydrophobicContact CB-CG2 3.99Å; W328-I361 HydrophobicContact CB-CD1 4.18Å; W328-I361 HydrophobicContact CB-CG2 4.49Å; W328-I361 HydrophobicContact CD2-CB 3.77Å; W328-I361 HydrophobicContact CD2-CD1 4.06Å; W328-I361 HydrophobicContact CD2-CG1 4.14Å; W328-I361 HydrophobicContact CE3-CB 4.18Å; W328-I361 HydrophobicContact CE3-CD1 3.8Å; W328-I361 HydrophobicContact CE3-CG1 4.04Å; W328-I361 HydrophobicContact CG-CB 3.95Å; W328-I361 HydrophobicContact CG-CD1 4.25Å; W328-I361 HydrophobicContact CG-CG2 4.19Å; W328-I361 HydrophobicContact CZ2-CB 4.32Å; W328-I361 HydrophobicContact CZ3-CD1 4.44Å; W328-I361 HydrophobicContact CZ3-CG1 4.34Å; W328-I361 PolarHBondContact NE1-O 2.85Å
329	V	94.1	Very high	92.1	Very high	20 Å²	20	43.5 Å²	43.5	12%	0.121	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.9	177.7	-174.9	0	0	0	0	107.4	I313 Y327 A337 R338	I313-V329 HydrophobicContact CG1-CG2 4.03Å; Y327-V329 HydrophobicContact CD2-CG2 4.37Å; Y327-V329 HydrophobicContact CE2-CG2 4.38Å; V329-A337 CarbonylContact O-C 3.55Å; V329-A337 VanDerWaalsContact O-CA 3.23Å; V329-A337 WeakPolarHBondContact O-CA 3.3Å; V329-R338 HydrophobicContact CB-CG 3.8Å; V329-R338 HydrophobicContact CG2-CG 4.16Å; V329-R338 PolarHBondContact N-O 3.46Å; V329-R338 PolarHBondContact O-N 3.2Å
330	P	92.7	Very high	92.1	Very high	20 Å²	20	43.4 Å²	43.4	13%	0.13	24%	0.238	C	C	.	.			trans	-69.6	164.4	178.8	32.2	-35	0	0	0	111.1	N312 R314 W328	N312-P330 WeakPolarHBondContact O-CD 3.33Å; R314-P330 HydrophobicContact CG-CB 4.19Å; R314-P330 HydrophobicContact CG-CG 3.64Å; W328-P330 HydrophobicContact CE3-CB 4.38Å; W328-P330 HydrophobicContact CH2-CB 4.26Å; W328-P330 HydrophobicContact CZ3-CB 3.61Å; W328-P330 HydrophobicContact CZ3-CG 4.46Å
331	E	88.5	Confident	92.2	Very high	95 Å²	95	40.8 Å²	40.8	44%	0.444	22%	0.221	S	C	.	.			trans	-61.5	136.5	174.9	-170.1	168.9	179.1	0	0	110.7	T335 A337 S357	E331-T335 WeakPolarHBondContact CA-O 3.21Å; E331-A337 HydrophobicContact CB-CB 4.38Å; E331-S357 PolarHBondContact OE2-N 2.98Å
332	S	85.7	Confident	92.3	Very high	53 Å²	53	39.1 Å²	39.1	37%	0.371	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-122.7	166.9	172.8	84.4	0	0	0	0	109	N334 T335	S332-N334 PolarHBondContact O-N 3.27Å; S332-T335 PolarHBondContact N-O 2.6Å; S332-T335 PolarHBondContact O-N 3.42Å; S332-T335 VanDerWaalsContact O-O 3.13Å; S332-T335 PolarHBondContact OG-OG1 3.45Å
333	D	79.4	Confident	92.4	Very high	168 Å²	168	41 Å²	41	90%	0.898	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-31	-171.4	-63.1	-26.3	0	0	0	114.2
334	N	83.4	Confident	92.4	Very high	158 Å²	158	40 Å²	40	85%	0.845	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122	2.4	-178.9	-65.4	-34.7	0	0	0	114.7	S332	S332-N334 PolarHBondContact O-N 3.27Å
335	T	89	Confident	92.2	Very high	69 Å²	69	42.5 Å²	42.5	42%	0.423	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-133.4	129.7	-177.7	67.8	0	0	0	0	111.8	E331 S332	E331-T335 WeakPolarHBondContact CA-O 3.21Å; S332-T335 PolarHBondContact N-O 2.6Å; S332-T335 PolarHBondContact O-N 3.42Å; S332-T335 VanDerWaalsContact O-O 3.13Å; S332-T335 PolarHBondContact OG-OG1 3.45Å
336	P	92.6	Very high	92.1	Very high	36 Å²	36	45.5 Å²	45.5	23%	0.234	25%	0.249	C	C	.	.			trans	-62	161.6	173.6	28	-34.6	0	0	0	111.1	N354 L355 F356	P336-N354 HydrophobicContact CB-CB 4.46Å; P336-N354 HydrophobicContact CG-CB 4.08Å; P336-L355 WeakPolarHBondContact CB-O 3.45Å; P336-F356 HydrophobicContact CB-CD1 3.95Å; P336-F356 HydrophobicContact CB-CE1 3.66Å; P336-F356 HydrophobicContact CB-CZ 4.05Å; P336-F356 HydrophobicContact CG-CE1 4.26Å; P336-F356 HydrophobicContact CG-CZ 4.37Å
337	A	93.9	Very high	91.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	140.9	168.4	0	0	0	0	0	109.1	V329 E331 N354 L355 V358	V329-A337 CarbonylContact O-C 3.55Å; V329-A337 VanDerWaalsContact O-CA 3.23Å; V329-A337 WeakPolarHBondContact O-CA 3.3Å; E331-A337 HydrophobicContact CB-CB 4.38Å; A337-N354 CarbonylContact O-C 3.45Å; A337-N354 WeakPolarHBondContact O-CA 3.45Å; A337-L355 HydrophobicContact CB-CB 4.42Å; A337-L355 PolarHBondContact N-O 3.23Å; A337-L355 PolarHBondContact O-N 2.7Å; A337-V358 HydrophobicContact CB-CB 4.04Å; A337-V358 HydrophobicContact CB-CG2 3.9Å
338	R	93.8	Very high	91.7	Very high	78 Å²	78	53.5 Å²	53.5	29%	0.294	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.1	179.6	55.5	179.1	-86.4	-173.4	-0.6	111	W328 V329 V340 E349 T352 K353	W328-R338 CarbonylContact C-O 3.58Å; W328-R338 VanDerWaalsContact CA-O 3.24Å; W328-R338 WeakPolarHBondContact CA-O 3.37Å; V329-R338 HydrophobicContact CB-CG 3.8Å; V329-R338 HydrophobicContact CG2-CG 4.16Å; V329-R338 PolarHBondContact N-O 3.46Å; V329-R338 PolarHBondContact O-N 3.2Å; R338-V340 HydrophobicContact CG-CG2 4.47Å; R338-V340 VanDerWaalsContact NE-CG2 3.29Å; R338-V340 VanDerWaalsContact NH2-CG2 3.27Å; R338-E349 IonicContact CZ-OE1 3.33Å; R338-E349 IonicContact NH2-OE1 3.66Å; R338-E349 PolarHBondContact NH2-OE1 3Å; R338-E349 IonicContact NH2-OE2 2.79Å; R338-E349 PolarHBondContact NH2-OE2 3.28Å; R338-T352 HydrophobicContact CB-CG2 4.42Å; R338-K353 WeakPolarHBondContact CA-O 3.48Å
339	V	95.7	Very high	91.6	Very high	10 Å²	10	56.9 Å²	56.9	6%	0.061	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.4	168.3	-177.7	0	0	0	0	107.8	W328 T352 K353 L355 I361 L363 V374	W328-V339 HydrophobicContact CB-CG2 3.99Å; V339-T352 WeakPolarHBondContact O-CA 3.31Å; V339-K353 PolarHBondContact N-O 3.38Å; V339-K353 PolarHBondContact O-N 2.91Å; V339-L355 HydrophobicContact CG2-CD1 3.92Å; V339-I361 HydrophobicContact CG2-CD1 3.59Å; V339-I361 HydrophobicContact CG2-CG2 4.32Å; V339-L363 HydrophobicContact CG1-CD2 4.03Å; V339-V374 HydrophobicContact CG1-CG2 4.1Å; V339-V374 HydrophobicContact CG2-CG1 3.94Å
340	V	95.5	Very high	91.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.8	-172.5	-174.1	0	0	0	0	109.3	A326 Y327 R338 E349 C351 T352	A326-V340 VanDerWaalsContact CA-O 3.32Å; A326-V340 WeakPolarHBondContact CA-O 3.42Å; Y327-V340 HydrophobicContact CD1-CB 4.29Å; Y327-V340 HydrophobicContact CD2-CB 4.29Å; Y327-V340 HydrophobicContact CD2-CG2 4.44Å; Y327-V340 HydrophobicContact CE1-CB 3.81Å; Y327-V340 HydrophobicContact CE1-CG1 3.81Å; Y327-V340 HydrophobicContact CE2-CB 3.81Å; Y327-V340 HydrophobicContact CE2-CG1 4.37Å; Y327-V340 HydrophobicContact CE2-CG2 3.78Å; Y327-V340 PolarHBondContact N-O 3.21Å; Y327-V340 PolarHBondContact O-N 3.24Å; Y327-V340 WeakPolarHBondContact OH-CG1 3.45Å; R338-V340 HydrophobicContact CG-CG2 4.47Å; R338-V340 VanDerWaalsContact NE-CG2 3.29Å; R338-V340 VanDerWaalsContact NH2-CG2 3.27Å; V340-E349 HydrophobicContact CG1-CB 4.2Å; V340-E349 HydrophobicContact CG1-CG 3.76Å; V340-C351 WeakPolarHBondContact CA-O 3.48Å; V340-T352 HydrophobicContact CG2-CG2 4.19Å
341	L	95.8	Very high	91.6	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.5	164.4	-65.9	-176.4	0	0	0	108.6	I324 A326 E349 L350 C351 W365 L372 V402	I324-L341 HydrophobicContact CG2-CB 4.3Å; I324-L341 HydrophobicContact CG2-CD2 4.3Å; A326-L341 HydrophobicContact CB-CD2 3.65Å; L341-E349 CarbonylContact O-C 3.49Å; L341-L350 HydrophobicContact CB-CB 4.32Å; L341-L350 PolarHBondContact O-N 3.44Å; L341-C351 HydrophobicContact CB-CB 4.24Å; L341-C351 HydrophobicContact CD1-CB 4.16Å; L341-C351 HydrophobicContact CG-CB 4.42Å; L341-C351 PolarHBondContact N-O 3.12Å; L341-C351 PolarHBondContact O-N 3.35Å; L341-W365 HydrophobicContact CD2-CH2 3.89Å; L341-W365 HydrophobicContact CD2-CZ2 4.14Å; L341-L372 HydrophobicContact CD2-CD2 3.66Å; L341-V402 HydrophobicContact CD1-CG1 3.88Å
342	M	95.1	Very high	91.8	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.1	-177.8	-175.9	-166.9	64.8	0	0	110.6	I295 L309 I324 L325 Y327 V344 R347 Q348	I295-M342 HydrophobicContact CD1-CE 4.02Å; L309-M342 HydrophobicContact CD1-CE 4.23Å; L309-M342 HydrophobicContact CD1-SD 3.56Å; L309-M342 VanDerWaalsContact CD1-SD 3.56Å; L309-M342 HydrophobicContact CD2-CE 3.42Å; L309-M342 VanDerWaalsContact CD2-CE 3.42Å; L309-M342 HydrophobicContact CD2-SD 3.74Å; L309-M342 HydrophobicContact CG-CE 4.45Å; L309-M342 HydrophobicContact CG-SD 4.32Å; I324-M342 CarbonylContact C-O 3.57Å; I324-M342 WeakPolarHBondContact CA-O 3.46Å; L325-M342 HydrophobicContact CB-CE 4.18Å; L325-M342 HydrophobicContact CD2-CE 3.79Å; L325-M342 PolarHBondContact N-O 3.07Å; L325-M342 PolarHBondContact O-N 3.05Å; Y327-M342 HydrophobicContact CE1-CB 4.06Å; M342-V344 HydrophobicContact CE-CG2 3.74Å; M342-R347 HydrophobicContact SD-CB 4.05Å; M342-R347 HydrophobicContact SD-CG 4.45Å; M342-Q348 WeakPolarHBondContact CA-O 3.45Å
343	E	94.7	Very high	92.2	Very high	82 Å²	82	57 Å²	57	38%	0.383	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.5	173.5	-174.8	-174.2	-138.9	0	0	111.3	S346 R347 Q348 L350	E343-S346 WeakPolarHBondContact CB-OG 3.39Å; E343-S346 PolarHBondContact O-OG 3.08Å; E343-S346 PolarHBondContact OE2-OG 3.48Å; E343-R347 VanDerWaalsContact O-CA 3.23Å; E343-R347 WeakPolarHBondContact O-CA 3.48Å; E343-R347 PolarHBondContact O-N 3.07Å; E343-Q348 PolarHBondContact N-O 3.33Å; E343-L350 HydrophobicContact CB-CD1 4.04Å; E343-L350 HydrophobicContact CB-CD2 4.21Å; E343-L350 HydrophobicContact CB-CG 4.11Å
344	V	93.6	Very high	92.9	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.018	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	128.6	175.1	-179.6	0	0	0	0	108.5	Y284 I295 L304 W318 N323 L325 M342	Y284-V344 HydrophobicContact CD1-CG1 4.29Å; Y284-V344 HydrophobicContact CD2-CG1 3.9Å; Y284-V344 HydrophobicContact CE1-CG1 4.38Å; Y284-V344 HydrophobicContact CE2-CG1 3.99Å; Y284-V344 HydrophobicContact CG-CG1 4.06Å; I295-V344 HydrophobicContact CD1-CG2 4.01Å; I295-V344 HydrophobicContact CG2-CG1 4.36Å; L304-V344 HydrophobicContact CD2-CG1 3.8Å; W318-V344 HydrophobicContact CH2-CB 4.06Å; W318-V344 HydrophobicContact CH2-CG1 4.1Å; W318-V344 HydrophobicContact CH2-CG2 3.79Å; W318-V344 HydrophobicContact CZ3-CB 3.99Å; W318-V344 HydrophobicContact CZ3-CG1 4.48Å; W318-V344 HydrophobicContact CZ3-CG2 3.8Å; N323-V344 VanDerWaalsContact CB-O 3.3Å; N323-V344 WeakPolarHBondContact CB-O 3.31Å; N323-V344 PolarHBondContact O-N 3.24Å; L325-V344 HydrophobicContact CB-CG2 4.36Å; M342-V344 HydrophobicContact CE-CG2 3.74Å
345	P	91.8	Very high	93.3	Very high	67 Å²	67	45.9 Å²	45.9	44%	0.435	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	cis	-94.8	-3.8	17.5	35.9	-36.7	0	0	0	116.5	L304 R347	L304-P345 HydrophobicContact CD1-CB 4.4Å; L304-P345 HydrophobicContact CD2-CB 4.28Å; P345-R347 PolarHBondContact O-N 3.43Å; P345-R347 VanDerWaalsContact O-N 3.12Å
346	S	92.3	Very high	93.4	Very high	63 Å²	63	48.4 Å²	48.4	44%	0.441	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.7	-174	63.4	0	0	0	0	113.8	E343 Q348	E343-S346 WeakPolarHBondContact CB-OG 3.39Å; E343-S346 PolarHBondContact O-OG 3.08Å; E343-S346 PolarHBondContact OE2-OG 3.48Å; S346-Q348 PolarHBondContact O-N 3.27Å; S346-Q348 PolarHBondContact OG-N 3.18Å
347	R	91	Very high	93.2	Very high	54 Å²	54	49.7 Å²	49.7	20%	0.204	26%	0.255	C	S	.	.			trans	57.4	22	-171.4	-55.3	-179.6	-171.8	-124.2	-3.3	113.1	L304 D305 K307 M342 E343 P345	L304-R347 VanDerWaalsContact C-NH2 3.27Å; L304-R347 PolarHBondContact O-NH2 3.4Å; D305-R347 IonicContact OD2-CZ 3.72Å; D305-R347 IonicContact OD2-NE 2.73Å; D305-R347 PolarHBondContact OD2-NE 2.82Å; D305-R347 IonicContact OD2-NH2 3.46Å; D305-R347 PolarHBondContact OD2-NH2 3.35Å; K307-R347 PolarHBondContact O-NH1 2.85Å; K307-R347 PolarHBondContact O-NH2 3.4Å; M342-R347 HydrophobicContact SD-CB 4.05Å; M342-R347 HydrophobicContact SD-CG 4.45Å; E343-R347 VanDerWaalsContact O-CA 3.23Å; E343-R347 WeakPolarHBondContact O-CA 3.48Å; E343-R347 PolarHBondContact O-N 3.07Å; P345-R347 PolarHBondContact O-N 3.43Å; P345-R347 VanDerWaalsContact O-N 3.12Å
348	Q	92.8	Very high	93	Very high	121 Å²	121	50.5 Å²	50.5	57%	0.565	26%	0.26	S	S	*	.			trans	-76.8	126.3	176	-175.3	173.4	-8	0	0	109.3	M342 E343 S346 L350	M342-Q348 WeakPolarHBondContact CA-O 3.45Å; E343-Q348 PolarHBondContact N-O 3.33Å; S346-Q348 PolarHBondContact O-N 3.27Å; S346-Q348 PolarHBondContact OG-N 3.18Å; Q348-L350 PolarHBondContact O-N 2.73Å
349	E	93.2	Very high	92.7	Very high	91 Å²	91	47.5 Å²	47.5	43%	0.425	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	111.9	169.5	-62.2	-171.2	-177.8	0	0	108.6	R338 V340 L341 T352	R338-E349 IonicContact CZ-OE1 3.33Å; R338-E349 IonicContact NH2-OE1 3.66Å; R338-E349 PolarHBondContact NH2-OE1 3Å; R338-E349 IonicContact NH2-OE2 2.79Å; R338-E349 PolarHBondContact NH2-OE2 3.28Å; V340-E349 HydrophobicContact CG1-CB 4.2Å; V340-E349 HydrophobicContact CG1-CG 3.76Å; L341-E349 CarbonylContact O-C 3.49Å; E349-T352 PolarHBondContact OE2-OG1 3.46Å
350	L	92.9	Very high	92.5	Very high	41 Å²	41	52.3 Å²	52.3	22%	0.215	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-41	-178.9	-64.4	177.1	0	0	0	111.5	I324 L341 E343 Q348 Y409	I324-L350 HydrophobicContact CD1-CD1 3.91Å; I324-L350 HydrophobicContact CG1-CD1 4Å; I324-L350 HydrophobicContact CG2-CD1 4.24Å; L341-L350 HydrophobicContact CB-CB 4.32Å; L341-L350 PolarHBondContact O-N 3.44Å; E343-L350 HydrophobicContact CB-CD1 4.04Å; E343-L350 HydrophobicContact CB-CD2 4.21Å; E343-L350 HydrophobicContact CB-CG 4.11Å; Q348-L350 PolarHBondContact O-N 2.73Å; L350-Y409 HydrophobicContact CB-CD2 4.31Å; L350-Y409 HydrophobicContact CB-CE2 3.7Å; L350-Y409 HydrophobicContact CD2-CE2 4.43Å; L350-Y409 HydrophobicContact CG-CE2 4.45Å
351	C	92.4	Very high	92.4	Very high	26 Å²	26	52.5 Å²	52.5	18%	0.176	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	135.4	-179.6	-176.7	0	0	0	0	109.2	V340 L341 Y409	V340-C351 WeakPolarHBondContact CA-O 3.48Å; L341-C351 HydrophobicContact CB-CB 4.24Å; L341-C351 HydrophobicContact CD1-CB 4.16Å; L341-C351 HydrophobicContact CG-CB 4.42Å; L341-C351 PolarHBondContact N-O 3.12Å; L341-C351 PolarHBondContact O-N 3.35Å; C351-Y409 HydrophobicContact CB-CD2 4.17Å; C351-Y409 HydrophobicContact CB-CG 4.26Å
352	T	93.4	Very high	92.3	Very high	57 Å²	57	54.4 Å²	54.4	35%	0.35	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.8	175.2	-65.3	0	0	0	0	109	R338 V339 V340 E349	R338-T352 HydrophobicContact CB-CG2 4.42Å; V339-T352 WeakPolarHBondContact O-CA 3.31Å; V340-T352 HydrophobicContact CG2-CG2 4.19Å; E349-T352 PolarHBondContact OE2-OG1 3.46Å
353	K	93.4	Very high	92.3	Very high	67 Å²	67	55.1 Å²	55.1	29%	0.291	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.4	177.6	-175.6	74	172.4	-163.4	0	109.5	R338 V339 L355 E400 Q413	R338-K353 WeakPolarHBondContact CA-O 3.48Å; V339-K353 PolarHBondContact N-O 3.38Å; V339-K353 PolarHBondContact O-N 2.91Å; K353-L355 HydrophobicContact CG-CD2 4.09Å; K353-L355 HydrophobicContact CG-CG 4.35Å; K353-E400 VanDerWaalsContact CE-OE2 3.25Å; K353-E400 WeakPolarHBondContact CE-OE2 3.26Å; K353-E400 IonicContact NZ-OE2 3.94Å; K353-E400 PolarHBondContact NZ-OE2 3.45Å; K353-Q413 VanDerWaalsContact NZ-NE2 3.18Å
354	N	94	Very high	92.4	Very high	88 Å²	88	53.4 Å²	53.4	47%	0.471	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135.4	173.2	-62.9	-34.8	0	0	0	110	P336 A337	P336-N354 HydrophobicContact CB-CB 4.46Å; P336-N354 HydrophobicContact CG-CB 4.08Å; A337-N354 CarbonylContact O-C 3.45Å; A337-N354 WeakPolarHBondContact O-CA 3.45Å
355	L	92.3	Very high	92.5	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.3	-176.6	-61.1	170.7	0	0	0	109.1	P336 A337 V339 K353 V358 I361 V376 E400	P336-L355 WeakPolarHBondContact CB-O 3.45Å; A337-L355 HydrophobicContact CB-CB 4.42Å; A337-L355 PolarHBondContact N-O 3.23Å; A337-L355 PolarHBondContact O-N 2.7Å; V339-L355 HydrophobicContact CG2-CD1 3.92Å; K353-L355 HydrophobicContact CG-CD2 4.09Å; K353-L355 HydrophobicContact CG-CG 4.35Å; L355-V358 HydrophobicContact CB-CG2 3.58Å; L355-I361 HydrophobicContact CD1-CD1 3.82Å; L355-V376 HydrophobicContact CD1-CG1 4.29Å; L355-V376 HydrophobicContact CD1-CG2 3.68Å; L355-E400 HydrophobicContact CD2-CG 4.26Å
356	F	90.4	Very high	92.6	Very high	123 Å²	123	51.4 Å²	51.4	54%	0.539	27%	0.269	S	S	.	.	S	Bend	trans	-118.3	148.6	-178.4	-62	-87.3	0	0	0	110.6	P336 V358 R378	P336-F356 HydrophobicContact CB-CD1 3.95Å; P336-F356 HydrophobicContact CB-CE1 3.66Å; P336-F356 HydrophobicContact CB-CZ 4.05Å; P336-F356 HydrophobicContact CG-CE1 4.26Å; P336-F356 HydrophobicContact CG-CZ 4.37Å; F356-V358 PolarHBondContact O-N 2.88Å; F356-R378 PolarHBondContact O-NH1 3.27Å
357	S	88.2	Confident	92.6	Very high	62 Å²	62	53.7 Å²	53.7	43%	0.434	27%	0.273	S	S	.	.	S	Bend	trans	59.7	46.6	174.7	-44.7	0	0	0	0	112.4	E331 R378 C379	E331-S357 PolarHBondContact OE2-N 2.98Å; S357-R378 WeakPolarHBondContact O-CA 3.46Å; S357-C379 WeakPolarHBondContact CB-O 3.41Å; S357-C379 PolarHBondContact O-N 3.25Å
358	V	89.8	Confident	92.5	Very high	18 Å²	18	55.7 Å²	55.7	11%	0.109	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.9	-176.4	179.5	0	0	0	0	110.1	A337 L355 F356 I361 V376	A337-V358 HydrophobicContact CB-CB 4.04Å; A337-V358 HydrophobicContact CB-CG2 3.9Å; L355-V358 HydrophobicContact CB-CG2 3.58Å; F356-V358 PolarHBondContact O-N 2.88Å; V358-I361 HydrophobicContact CG1-CD1 3.93Å; V358-I361 HydrophobicContact CG1-CG1 3.52Å; V358-V376 HydrophobicContact CB-CG1 4.47Å; V358-V376 HydrophobicContact CG1-CG1 4.02Å; V358-V376 HydrophobicContact CG2-CG1 3.85Å
359	A	88.1	Confident	92.5	Very high	15 Å²	15	50 Å²	50	12%	0.124	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-48.5	170.5	0	0	0	0	0	111.3	L377 C379 Y392	A359-L377 HydrophobicContact CB-CB 4.44Å; A359-L377 HydrophobicContact CB-CD2 4.19Å; A359-L377 HydrophobicContact CB-CG 4.21Å; A359-L377 WeakPolarHBondContact CB-O 3.35Å; A359-L377 PolarHBondContact N-O 2.93Å; A359-C379 HydrophobicContact CB-CB 4.4Å; A359-Y392 HydrophobicContact CB-CD1 3.78Å; A359-Y392 HydrophobicContact CB-CD2 3.71Å; A359-Y392 HydrophobicContact CB-CE1 3.82Å; A359-Y392 HydrophobicContact CB-CE2 3.75Å; A359-Y392 HydrophobicContact CB-CG 3.72Å
360	E	91	Very high	92.5	Very high	111 Å²	111	47.6 Å²	47.6	52%	0.519	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	149.9	-175.4	-172.4	171.4	-174.1	0	0	110.9	L377	E360-L377 HydrophobicContact CB-CB 4.26Å; E360-L377 PolarHBondContact N-O 3.09Å; E360-L377 PolarHBondContact O-N 3.19Å
361	I	94	Very high	92.6	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.6	174.1	-59.1	-176	0	0	0	109.3	W328 V339 L355 V358 L363 V374 Q375	W328-I361 HydrophobicContact CB-CD1 4.18Å; W328-I361 HydrophobicContact CB-CG2 4.49Å; W328-I361 HydrophobicContact CD2-CB 3.77Å; W328-I361 HydrophobicContact CD2-CD1 4.06Å; W328-I361 HydrophobicContact CD2-CG1 4.14Å; W328-I361 HydrophobicContact CE3-CB 4.18Å; W328-I361 HydrophobicContact CE3-CD1 3.8Å; W328-I361 HydrophobicContact CE3-CG1 4.04Å; W328-I361 HydrophobicContact CG-CB 3.95Å; W328-I361 HydrophobicContact CG-CD1 4.25Å; W328-I361 HydrophobicContact CG-CG2 4.19Å; W328-I361 HydrophobicContact CZ2-CB 4.32Å; W328-I361 HydrophobicContact CZ3-CD1 4.44Å; W328-I361 HydrophobicContact CZ3-CG1 4.34Å; W328-I361 PolarHBondContact NE1-O 2.85Å; V339-I361 HydrophobicContact CG2-CD1 3.59Å; V339-I361 HydrophobicContact CG2-CG2 4.32Å; L355-I361 HydrophobicContact CD1-CD1 3.82Å; V358-I361 HydrophobicContact CG1-CD1 3.93Å; V358-I361 HydrophobicContact CG1-CG1 3.52Å; I361-L363 HydrophobicContact CG2-CD2 4Å; I361-V374 HydrophobicContact CG2-CG1 3.49Å; I361-V374 VanDerWaalsContact CG2-CG1 3.49Å; I361-Q375 WeakPolarHBondContact CA-O 3.23Å
362	S	94.2	Very high	92.7	Very high	44 Å²	44	45.1 Å²	45.1	31%	0.308	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.6	167.1	-66.9	0	0	0	0	110.4	Q375	S362-Q375 PolarHBondContact N-O 3.34Å; S362-Q375 PolarHBondContact O-N 2.83Å
363	L	95.1	Very high	92.9	Very high	17 Å²	17	42.4 Å²	42.4	9%	0.089	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	109.7	-179.4	-59.3	174.7	0	0	0	109.4	A326 V339 I361 L372 V374	A326-L363 HydrophobicContact CB-CD1 4Å; V339-L363 HydrophobicContact CG1-CD2 4.03Å; I361-L363 HydrophobicContact CG2-CD2 4Å; L363-L372 HydrophobicContact CB-CD1 4.3Å; L363-V374 HydrophobicContact CD2-CG1 4.44Å; L363-V374 HydrophobicContact CD2-CG2 4.26Å
364	L	95.5	Very high	93	Very high	46 Å²	46	39.4 Å²	39.4	24%	0.241	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	98.8	-171	-58.3	168.7	0	0	0	110.2	A373 Q375 F423 W425	L364-A373 HydrophobicContact CB-CB 4.18Å; L364-A373 WeakPolarHBondContact CB-O 3.46Å; L364-A373 PolarHBondContact N-O 2.87Å; L364-A373 PolarHBondContact O-N 2.93Å; L364-Q375 HydrophobicContact CD1-CB 4.12Å; L364-F423 HydrophobicContact CB-CD1 4.14Å; L364-F423 HydrophobicContact CB-CE1 4.24Å; L364-F423 HydrophobicContact CD1-CB 3.71Å; L364-F423 HydrophobicContact CD1-CD1 3.46Å; L364-F423 VanDerWaalsContact CD1-CD1 3.46Å; L364-F423 HydrophobicContact CD1-CD2 4.45Å; L364-F423 HydrophobicContact CD1-CE1 4.21Å; L364-F423 HydrophobicContact CD1-CG 3.62Å; L364-F423 HydrophobicContact CG-CD1 4.35Å; L364-W425 PolarHBondContact O-NE1 2.99Å
365	W	96.2	Very high	93.1	Very high	28 Å²	28	36.9 Å²	36.9	11%	0.106	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	139.1	-179.3	-73.6	101.5	0	0	0	112.4	S317 W318 P320 I324 A326 L341 L372 L404 W425	S317-W365 PolarHBondContact OG-NE1 2.49Å; W318-W365 PolarHBondContact O-NE1 2.77Å; P320-W365 HydrophobicContact CG-CB 3.85Å; P320-W365 HydrophobicContact CG-CG 4.45Å; I324-W365 HydrophobicContact CG2-CH2 4.33Å; A326-W365 HydrophobicContact CB-CH2 4.47Å; A326-W365 HydrophobicContact CB-CZ2 3.51Å; L341-W365 HydrophobicContact CD2-CH2 3.89Å; L341-W365 HydrophobicContact CD2-CZ2 4.14Å; W365-L372 HydrophobicContact CD2-CB 4.37Å; W365-L372 HydrophobicContact CD2-CD1 3.81Å; W365-L372 HydrophobicContact CE3-CB 3.88Å; W365-L372 HydrophobicContact CE3-CD1 4.2Å; W365-L372 HydrophobicContact CG-CD1 4.06Å; W365-L372 HydrophobicContact CH2-CB 4.28Å; W365-L372 HydrophobicContact CH2-CD2 4.18Å; W365-L372 HydrophobicContact CZ2-CD1 4.42Å; W365-L372 HydrophobicContact CZ2-CD2 4.16Å; W365-L372 HydrophobicContact CZ3-CB 3.81Å; W365-L404 HydrophobicContact CH2-CD1 4.42Å; W365-L404 HydrophobicContact CH2-CD2 3.84Å; W365-L404 HydrophobicContact CZ3-CD1 3.75Å; W365-L404 HydrophobicContact CZ3-CD2 3.5Å; W365-L404 HydrophobicContact CZ3-CG 4.28Å; W365-W425 VanDerWaalsContact C-CD1 3.43Å; W365-W425 VanDerWaalsContact O-CD1 3.24Å
366	H	94.9	Very high	93.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.188	C	C	.	.			trans	-66	142.1	163.5	-175.4	-100.8	0	0	0	109.8	P320 Q368 G369 F371 W425 E426 G429	P320-H366 WeakPolarHBondContact CG-O 3.44Å; H366-Q368 PolarHBondContact ND1-N 2.81Å; H366-Q368 PolarHBondContact O-N 3.05Å; H366-Q368 VanDerWaalsContact O-N 3.12Å; H366-G369 WeakPolarHBondContact O-CA 3.24Å; H366-G369 PolarHBondContact O-N 3.29Å; H366-F371 HydrophobicContact CB-CB 4.01Å; H366-F371 HydrophobicContact CB-CD2 4.18Å; H366-F371 WeakPolarHBondContact CB-O 3.37Å; H366-F371 AromaticContact CG-CD2 3.97Å; H366-F371 PolarHBondContact N-O 2.94Å; H366-W425 HydrophobicContact CB-CD2 4.17Å; H366-W425 HydrophobicContact CB-CG 4.21Å; H366-W425 AromaticContact CD2-CD2 3.96Å; H366-W425 AromaticContact CD2-CE3 3.79Å; H366-E426 PolarHBondContact NE2-O 2.82Å; H366-G429 PolarHBondContact CE1-O 3.44Å; H366-G429 PolarHBondContact NE2-O 2.89Å
367	E	91.2	Very high	93.2	Very high	111 Å²	111	33.3 Å²	33.3	52%	0.519	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-29.7	-174.1	-67.8	-166.9	-172.7	0	0	114	P320 P427	P320-E367 VanDerWaalsContact CB-O 3.27Å; P320-E367 WeakPolarHBondContact CB-O 3.31Å; E367-P427 HydrophobicContact CG-CB 4.48Å; E367-P427 WeakPolarHBondContact OE2-CB 3.15Å
368	Q	90.2	Very high	93.4	Very high	96 Å²	96	32.1 Å²	32.1	45%	0.449	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-3.7	174.8	-55.1	-56.3	-49.1	0	0	113.6	S321 H366 D370 R405	S321-Q368 VanDerWaalsContact CB-O 3.3Å; S321-Q368 WeakPolarHBondContact CB-O 3.31Å; S321-Q368 PolarHBondContact OG-O 3.42Å; H366-Q368 PolarHBondContact ND1-N 2.81Å; H366-Q368 PolarHBondContact O-N 3.05Å; H366-Q368 VanDerWaalsContact O-N 3.12Å; Q368-D370 VanDerWaalsContact C-N 3.27Å; Q368-D370 PolarHBondContact O-N 3.33Å; Q368-R405 PolarHBondContact O-NH2 2.87Å
369	G	92.1	Very high	93.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	71.7	14.8	-176	0	0	0	0	0	114.8	H366	H366-G369 WeakPolarHBondContact O-CA 3.24Å; H366-G369 PolarHBondContact O-N 3.29Å
370	D	92.7	Very high	93	Very high	42 Å²	42	34.8 Å²	34.8	23%	0.225	18%	0.183	C	C	.	.	S	Bend	trans	-73.6	-29.3	179.9	-66.9	-27.5	0	0	0	113.1	Q368 L404 R405	Q368-D370 VanDerWaalsContact C-N 3.27Å; Q368-D370 PolarHBondContact O-N 3.33Å; D370-L404 PolarHBondContact O-N 3.01Å; D370-R405 HydrophobicContact CB-CG 4.18Å; D370-R405 VanDerWaalsContact OD1-CG 3.32Å; D370-R405 WeakPolarHBondContact OD1-CG 3.38Å; D370-R405 IonicContact OD1-CZ 3.46Å; D370-R405 IonicContact OD1-NE 3.65Å; D370-R405 PolarHBondContact OD1-NE 2.83Å; D370-R405 IonicContact OD1-NH2 2.87Å
371	F	94.5	Very high	92.5	Very high	14 Å²	14	36.3 Å²	36.3	6%	0.061	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	150.3	-177.7	-48.7	-76.2	0	0	0	111.3	H366 V402 R403 W425 T430 V450	H366-F371 HydrophobicContact CB-CB 4.01Å; H366-F371 HydrophobicContact CB-CD2 4.18Å; H366-F371 WeakPolarHBondContact CB-O 3.37Å; H366-F371 AromaticContact CG-CD2 3.97Å; H366-F371 PolarHBondContact N-O 2.94Å; F371-V402 WeakPolarHBondContact CA-O 3.17Å; F371-R403 HydrophobicContact CD1-CB 4.47Å; F371-R403 HydrophobicContact CD1-CG 4.2Å; F371-R403 HydrophobicContact CE1-CG 4.25Å; F371-W425 HydrophobicContact CB-CH2 3.67Å; F371-W425 HydrophobicContact CB-CZ2 3.8Å; F371-W425 HydrophobicContact CB-CZ3 4.21Å; F371-W425 HydrophobicContact CD2-CZ3 4.25Å; F371-W425 HydrophobicContact CG-CH2 4.19Å; F371-W425 HydrophobicContact CG-CZ3 4.38Å; F371-T430 HydrophobicContact CE2-CG2 4.04Å; F371-T430 HydrophobicContact CZ-CG2 4.01Å; F371-V450 HydrophobicContact CD1-CG1 4.01Å; F371-V450 HydrophobicContact CE1-CB 4.28Å; F371-V450 HydrophobicContact CE1-CG1 3.69Å; F371-V450 HydrophobicContact CZ-CB 4.41Å; F371-V450 HydrophobicContact CZ-CG1 4.28Å
372	L	96.1	Very high	91.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	117	166.1	171.4	63.9	0	0	0	108.4	A326 L341 L363 W365 V374 I401 V402 L404	A326-L372 HydrophobicContact CB-CD2 3.93Å; L341-L372 HydrophobicContact CD2-CD2 3.66Å; L363-L372 HydrophobicContact CB-CD1 4.3Å; W365-L372 HydrophobicContact CD2-CB 4.37Å; W365-L372 HydrophobicContact CD2-CD1 3.81Å; W365-L372 HydrophobicContact CE3-CB 3.88Å; W365-L372 HydrophobicContact CE3-CD1 4.2Å; W365-L372 HydrophobicContact CG-CD1 4.06Å; W365-L372 HydrophobicContact CH2-CB 4.28Å; W365-L372 HydrophobicContact CH2-CD2 4.18Å; W365-L372 HydrophobicContact CZ2-CD1 4.42Å; W365-L372 HydrophobicContact CZ2-CD2 4.16Å; W365-L372 HydrophobicContact CZ3-CB 3.81Å; L372-V374 HydrophobicContact CD2-CG2 4.12Å; L372-V374 HydrophobicContact CG-CG2 4.07Å; L372-I401 WeakPolarHBondContact O-CA 2.99Å; L372-V402 HydrophobicContact CB-CB 4.32Å; L372-V402 PolarHBondContact N-O 2.76Å; L372-V402 PolarHBondContact O-N 2.69Å; L372-L404 HydrophobicContact CB-CD1 4.12Å
373	A	96.2	Very high	90.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	118.7	166.7	0	0	0	0	0	108.8	L364 F423 W425	L364-A373 HydrophobicContact CB-CB 4.18Å; L364-A373 WeakPolarHBondContact CB-O 3.46Å; L364-A373 PolarHBondContact N-O 2.87Å; L364-A373 PolarHBondContact O-N 2.93Å; A373-F423 HydrophobicContact CB-CE1 3.85Å; A373-F423 HydrophobicContact CB-CE2 4.02Å; A373-F423 HydrophobicContact CB-CZ 3.44Å; A373-F423 VanDerWaalsContact CB-CZ 3.44Å; A373-W425 HydrophobicContact CB-CH2 4.48Å; A373-W425 HydrophobicContact CB-CZ2 3.47Å; A373-W425 VanDerWaalsContact CB-CZ2 3.47Å
374	V	96.2	Very high	89.8	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	103.7	169.6	-177.8	0	0	0	0	106.9	V339 I361 L363 L372 V376 F399 E400	V339-V374 HydrophobicContact CG1-CG2 4.1Å; V339-V374 HydrophobicContact CG2-CG1 3.94Å; I361-V374 HydrophobicContact CG2-CG1 3.49Å; I361-V374 VanDerWaalsContact CG2-CG1 3.49Å; L363-V374 HydrophobicContact CD2-CG1 4.44Å; L363-V374 HydrophobicContact CD2-CG2 4.26Å; L372-V374 HydrophobicContact CD2-CG2 4.12Å; L372-V374 HydrophobicContact CG-CG2 4.07Å; V374-V376 HydrophobicContact CG1-CG2 3.77Å; V374-V376 PolarHBondContact O-N 2.86Å; V374-F399 WeakPolarHBondContact O-CA 3.47Å; V374-E400 HydrophobicContact CB-CB 4.15Å; V374-E400 WeakPolarHBondContact CB-O 3.48Å; V374-E400 PolarHBondContact N-O 2.85Å; V374-E400 PolarHBondContact O-N 2.98Å
375	Q	95.3	Very high	88.5	Confident	36 Å²	36	53.6 Å²	53.6	17%	0.168	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	110.7	174.4	-178	176.8	-16.3	0	0	108.6	I361 S362 L364 T397 F399	I361-Q375 WeakPolarHBondContact CA-O 3.23Å; S362-Q375 PolarHBondContact N-O 3.34Å; S362-Q375 PolarHBondContact O-N 2.83Å; L364-Q375 HydrophobicContact CD1-CB 4.12Å; Q375-T397 HydrophobicContact CG-CG2 3.71Å; Q375-F399 HydrophobicContact CB-CD1 3.93Å; Q375-F399 HydrophobicContact CB-CE1 3.62Å; Q375-F399 HydrophobicContact CG-CD1 4.15Å; Q375-F399 HydrophobicContact CG-CE1 3.52Å; Q375-F399 HydrophobicContact CG-CZ 4.14Å
376	V	94.6	Very high	86.6	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.1	-177.8	-172.4	0	0	0	0	108.8	L355 V358 V374 R378 T397 N398 E400	L355-V376 HydrophobicContact CD1-CG1 4.29Å; L355-V376 HydrophobicContact CD1-CG2 3.68Å; V358-V376 HydrophobicContact CB-CG1 4.47Å; V358-V376 HydrophobicContact CG1-CG1 4.02Å; V358-V376 HydrophobicContact CG2-CG1 3.85Å; V374-V376 HydrophobicContact CG1-CG2 3.77Å; V374-V376 PolarHBondContact O-N 2.86Å; V376-R378 HydrophobicContact CG1-CG 3.86Å; V376-R378 PolarHBondContact O-N 3.38Å; V376-T397 WeakPolarHBondContact O-CA 3.44Å; V376-N398 PolarHBondContact N-O 3.25Å; V376-N398 PolarHBondContact O-N 3.47Å; V376-E400 HydrophobicContact CG2-CG 4.25Å
377	L	92.1	Very high	85	Confident	51 Å²	51	63.8 Å²	63.8	27%	0.267	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	107.2	167	-174.2	64.9	0	0	0	108.1	A359 E360	A359-L377 HydrophobicContact CB-CB 4.44Å; A359-L377 HydrophobicContact CB-CD2 4.19Å; A359-L377 HydrophobicContact CB-CG 4.21Å; A359-L377 WeakPolarHBondContact CB-O 3.35Å; A359-L377 PolarHBondContact N-O 2.93Å; E360-L377 HydrophobicContact CB-CB 4.26Å; E360-L377 PolarHBondContact N-O 3.09Å; E360-L377 PolarHBondContact O-N 3.19Å
378	R	90.3	Very high	83.6	Confident	37 Å²	37	67.9 Å²	67.9	14%	0.14	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	153.5	177.4	-66.9	-176.1	179.5	-98.6	6.2	110.4	F356 S357 V376 T395 Y396 N398 E400	F356-R378 PolarHBondContact O-NH1 3.27Å; S357-R378 WeakPolarHBondContact O-CA 3.46Å; V376-R378 HydrophobicContact CG1-CG 3.86Å; V376-R378 PolarHBondContact O-N 3.38Å; R378-T395 WeakPolarHBondContact O-CA 3.47Å; R378-Y396 HydrophobicContact CB-CD1 4.15Å; R378-Y396 HydrophobicContact CB-CD2 4.5Å; R378-Y396 HydrophobicContact CB-CE1 3.76Å; R378-Y396 HydrophobicContact CB-CE2 4.18Å; R378-Y396 HydrophobicContact CB-CG 4.5Å; R378-Y396 WeakPolarHBondContact CD-OH 3.13Å; R378-Y396 HydrophobicContact CG-CE2 4.47Å; R378-Y396 PolarHBondContact N-O 2.92Å; R378-Y396 PolarHBondContact O-N 3.44Å; R378-N398 PolarHBondContact NE-ND2 2.83Å; R378-N398 VanDerWaalsContact NE-ND2 3.13Å; R378-E400 IonicContact NH2-OE1 3.07Å
379	C	86.1	Confident	82.3	Confident	13 Å²	13	69.3 Å²	69.3	9%	0.088	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	141.6	175.2	64.2	0	0	0	0	111.4	S357 A359 Y392 T395	S357-C379 WeakPolarHBondContact CB-O 3.41Å; S357-C379 PolarHBondContact O-N 3.25Å; A359-C379 HydrophobicContact CB-CB 4.4Å; C379-Y392 HydrophobicContact CB-CD1 3.81Å; C379-Y392 HydrophobicContact CB-CG 4.16Å; C379-Y392 VanDerWaalsContact SG-CD1 3.54Å; C379-T395 HydrophobicContact CB-CG2 4.23Å
380	A	84	Confident	81.3	Confident	75 Å²	75	71.8 Å²	71.8	62%	0.62	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	-37.1	175.8	0	0	0	0	0	112.5	V393 G394	A380-V393 PolarHBondContact N-O 3.49Å; A380-G394 PolarHBondContact N-O 3.23Å
381	K	80.1	Confident	80.5	Confident	143 Å²	143	75.1 Å²	75.1	62%	0.622	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	140.4	179.6	-65.3	-177.3	-179.2	177.9	0	111.5	V393	K381-V393 HydrophobicContact CB-CB 4.38Å; K381-V393 PolarHBondContact N-O 3.17Å; K381-V393 PolarHBondContact O-N 3.44Å
382	K	79.8	Confident	79.8	Confident	137 Å²	137	78.9 Å²	78.9	60%	0.596	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.6	170.4	-171.5	179	178	177.7	0	108.7	V390 Y392	K382-V390 HydrophobicContact CD-CG1 4.01Å; K382-V390 VanDerWaalsContact CE-CG1 3.49Å; K382-V390 HydrophobicContact CG-CG1 3.46Å; K382-V390 VanDerWaalsContact CG-CG1 3.46Å; K382-Y392 HydrophobicContact CG-CE1 4.29Å
383	K	76.4	Confident	79	Confident	131 Å²	131	81.8 Å²	81.8	57%	0.57	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	124.5	170.5	-71	-171.6	179.6	-178	0	108.7	K391 V393	K383-K391 PolarHBondContact N-O 3.15Å; K383-K391 PolarHBondContact O-N 3.21Å; K383-V393 HydrophobicContact CD-CG2 3.97Å; K383-V393 HydrophobicContact CG-CG2 4.18Å
384	L	71.2	Confident	78.2	Confident	130 Å²	130	84.1 Å²	84.1	68%	0.681	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	115.6	164.8	-87.2	137.1	0	0	0	107.3	V390	L384-V390 HydrophobicContact CD2-CG2 4.33Å
385	D	68	Low	77.5	Confident	76 Å²	76	87.2 Å²	87.2	41%	0.406	46%	0.459	S	S	.	.			trans	-77.8	153	166.4	-150.5	-12	0	0	0	108.9	E387 K388 Q389 K391	D385-E387 PolarHBondContact O-N 3.46Å; D385-K388 PolarHBondContact O-N 2.98Å; D385-Q389 PolarHBondContact N-O 3.07Å; D385-K391 HydrophobicContact CB-CD 4.38Å; D385-K391 WeakPolarHBondContact OD2-CE 3.22Å; D385-K391 IonicContact OD2-NZ 3.21Å; D385-K391 PolarHBondContact OD2-NZ 3.02Å
386	G	56.9	Low	77.2	Confident	80 Å²	80	89.6 Å²	89.6	83%	0.825	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	0.5	-169	0	0	0	0	0	116.6
387	E	60.7	Low	77.1	Confident	163 Å²	163	89.9 Å²	89.9	76%	0.762	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	29	-176.2	-63.4	-172.8	155.3	0	0	113.5	D385 Q389	D385-E387 PolarHBondContact O-N 3.46Å; E387-Q389 PolarHBondContact O-N 3.29Å; E387-Q389 VanDerWaalsContact O-N 3.12Å
388	K	62.1	Low	77.1	Confident	197 Å²	197	88.3 Å²	88.3	86%	0.857	46%	0.461	S	S	*	.	S	Bend	trans	65.2	4.7	-177.8	-56.1	178.1	177.7	176.3	0	115.2	D385	D385-K388 PolarHBondContact O-N 2.98Å
389	Q	62.7	Low	77.4	Confident	126 Å²	126	86.5 Å²	86.5	59%	0.589	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-84.2	126.9	172.8	-66.2	-169.4	3.2	0	0	110.7	D385 E387	D385-Q389 PolarHBondContact N-O 3.07Å; E387-Q389 PolarHBondContact O-N 3.29Å; E387-Q389 VanDerWaalsContact O-N 3.12Å
390	V	71.2	Confident	77.7	Confident	52 Å²	52	86 Å²	86	32%	0.315	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	116	175.6	177.7	0	0	0	0	108.5	K382 L384 Y392	K382-V390 HydrophobicContact CD-CG1 4.01Å; K382-V390 VanDerWaalsContact CE-CG1 3.49Å; K382-V390 HydrophobicContact CG-CG1 3.46Å; K382-V390 VanDerWaalsContact CG-CG1 3.46Å; L384-V390 HydrophobicContact CD2-CG2 4.33Å; V390-Y392 HydrophobicContact CG1-CD1 4.23Å; V390-Y392 HydrophobicContact CG1-CE1 3.71Å; V390-Y392 HydrophobicContact CG1-CE2 4.08Å
391	K	76.4	Confident	78.2	Confident	113 Å²	113	82.5 Å²	82.5	49%	0.491	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.9	170.2	-75.4	179.4	176.6	164.1	0	110	K383 D385	K383-K391 PolarHBondContact N-O 3.15Å; K383-K391 PolarHBondContact O-N 3.21Å; D385-K391 HydrophobicContact CB-CD 4.38Å; D385-K391 WeakPolarHBondContact OD2-CE 3.22Å; D385-K391 IonicContact OD2-NZ 3.21Å; D385-K391 PolarHBondContact OD2-NZ 3.02Å
392	Y	78.8	Confident	78.9	Confident	92 Å²	92	76.1 Å²	76.1	36%	0.361	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	132.9	175	-60	-72.7	0	0	0	110.1	A359 C379 K382 V390	A359-Y392 HydrophobicContact CB-CD1 3.78Å; A359-Y392 HydrophobicContact CB-CD2 3.71Å; A359-Y392 HydrophobicContact CB-CE1 3.82Å; A359-Y392 HydrophobicContact CB-CE2 3.75Å; A359-Y392 HydrophobicContact CB-CG 3.72Å; C379-Y392 HydrophobicContact CB-CD1 3.81Å; C379-Y392 HydrophobicContact CB-CG 4.16Å; C379-Y392 VanDerWaalsContact SG-CD1 3.54Å; K382-Y392 HydrophobicContact CG-CE1 4.29Å; V390-Y392 HydrophobicContact CG1-CD1 4.23Å; V390-Y392 HydrophobicContact CG1-CE1 3.71Å; V390-Y392 HydrophobicContact CG1-CE2 4.08Å
393	V	79.1	Confident	79.6	Confident	62 Å²	62	69.8 Å²	69.8	38%	0.376	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.1	-177.8	178	0	0	0	0	109.9	A380 K381 K383	A380-V393 PolarHBondContact N-O 3.49Å; K381-V393 HydrophobicContact CB-CB 4.38Å; K381-V393 PolarHBondContact N-O 3.17Å; K381-V393 PolarHBondContact O-N 3.44Å; K383-V393 HydrophobicContact CD-CG2 3.97Å; K383-V393 HydrophobicContact CG-CG2 4.18Å
394	G	79.4	Confident	80.3	Confident	48 Å²	48	64.1 Å²	64.1	50%	0.495	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	70.6	51.9	179.8	0	0	0	0	0	111.8	A380	A380-G394 PolarHBondContact N-O 3.23Å
395	T	83.3	Confident	81.3	Confident	69 Å²	69	63.8 Å²	63.8	42%	0.423	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	137.2	-176.9	53.4	0	0	0	0	111.9	R378 C379	R378-T395 WeakPolarHBondContact O-CA 3.47Å; C379-T395 HydrophobicContact CB-CG2 4.23Å
396	Y	87.8	Confident	82.3	Confident	87 Å²	87	63.4 Å²	63.4	34%	0.341	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	158.2	172.5	65.3	-80.5	0	0	0	109.7	R378 N398 E415	R378-Y396 HydrophobicContact CB-CD1 4.15Å; R378-Y396 HydrophobicContact CB-CD2 4.5Å; R378-Y396 HydrophobicContact CB-CE1 3.76Å; R378-Y396 HydrophobicContact CB-CE2 4.18Å; R378-Y396 HydrophobicContact CB-CG 4.5Å; R378-Y396 WeakPolarHBondContact CD-OH 3.13Å; R378-Y396 HydrophobicContact CG-CE2 4.47Å; R378-Y396 PolarHBondContact N-O 2.92Å; R378-Y396 PolarHBondContact O-N 3.44Å; Y396-N398 WeakPolarHBondContact CD2-OD1 3.36Å; Y396-N398 WeakPolarHBondContact CE2-OD1 3.45Å; Y396-E415 HydrophobicContact CD2-CG 4.33Å; Y396-E415 HydrophobicContact CE2-CG 4.44Å
397	T	92.3	Very high	83.8	Confident	6 Å²	6	69 Å²	69	4%	0.037	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.5	-173.3	-54.2	0	0	0	0	110.7	Q375 V376 F399 V416 V420	Q375-T397 HydrophobicContact CG-CG2 3.71Å; V376-T397 WeakPolarHBondContact O-CA 3.44Å; T397-F399 HydrophobicContact CG2-CE1 4.49Å; T397-F399 HydrophobicContact CG2-CE2 4.2Å; T397-F399 HydrophobicContact CG2-CZ 4.09Å; T397-V416 PolarHBondContact O-N 3.31Å; T397-V416 VanDerWaalsContact O-N 3.07Å; T397-V420 HydrophobicContact CG2-CB 4.24Å; T397-V420 HydrophobicContact CG2-CG2 4.23Å
398	N	93.4	Very high	85.1	Confident	17 Å²	17	69 Å²	69	9%	0.091	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.7	170.4	-70.7	23.9	0	0	0	109.3	V376 R378 Y396 L414	V376-N398 PolarHBondContact N-O 3.25Å; V376-N398 PolarHBondContact O-N 3.47Å; R378-N398 PolarHBondContact NE-ND2 2.83Å; R378-N398 VanDerWaalsContact NE-ND2 3.13Å; Y396-N398 WeakPolarHBondContact CD2-OD1 3.36Å; Y396-N398 WeakPolarHBondContact CE2-OD1 3.45Å; N398-L414 WeakPolarHBondContact CA-O 3.36Å
399	F	94.8	Very high	86.5	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.7	168.3	-64.9	-74.1	0	0	0	109.5	V374 Q375 T397 I401 L414 V416 V420 F423 F434	V374-F399 WeakPolarHBondContact O-CA 3.47Å; Q375-F399 HydrophobicContact CB-CD1 3.93Å; Q375-F399 HydrophobicContact CB-CE1 3.62Å; Q375-F399 HydrophobicContact CG-CD1 4.15Å; Q375-F399 HydrophobicContact CG-CE1 3.52Å; Q375-F399 HydrophobicContact CG-CZ 4.14Å; T397-F399 HydrophobicContact CG2-CE1 4.49Å; T397-F399 HydrophobicContact CG2-CE2 4.2Å; T397-F399 HydrophobicContact CG2-CZ 4.09Å; F399-I401 HydrophobicContact CB-CG1 4.41Å; F399-L414 HydrophobicContact CB-CB 4.25Å; F399-L414 HydrophobicContact CD2-CD2 4.22Å; F399-L414 PolarHBondContact N-O 3.4Å; F399-L414 PolarHBondContact O-N 3.27Å; F399-V416 HydrophobicContact CD2-CG2 3.97Å; F399-V416 HydrophobicContact CE2-CG2 3.92Å; F399-V420 HydrophobicContact CE2-CG1 4.17Å; F399-V420 HydrophobicContact CE2-CG2 4.3Å; F399-V420 HydrophobicContact CZ-CB 4.41Å; F399-V420 HydrophobicContact CZ-CG1 3.71Å; F399-F423 HydrophobicContact CD1-CD2 4.06Å; F399-F423 HydrophobicContact CD1-CE2 4.03Å; F399-F423 AromaticContact CE1-CD2 3.38Å; F399-F423 HydrophobicContact CE1-CD2 3.38Å; F399-F423 AromaticContact CE1-CE2 3.83Å; F399-F423 HydrophobicContact CE1-CE2 3.83Å; F399-F423 HydrophobicContact CE1-CG 4.2Å; F399-F423 HydrophobicContact CE2-CD2 4.49Å; F399-F423 AromaticContact CZ-CD2 3.64Å; F399-F423 HydrophobicContact CZ-CD2 3.64Å; F399-F423 HydrophobicContact CZ-CE2 4.27Å; F399-F434 HydrophobicContact CE2-CD1 4.08Å; F399-F434 AromaticContact CE2-CE1 3.93Å; F399-F434 HydrophobicContact CE2-CE1 3.93Å; F399-F434 HydrophobicContact CE2-CG 4.5Å; F399-F434 HydrophobicContact CE2-CZ 4.21Å; F399-F434 HydrophobicContact CZ-CD1 4.31Å
400	E	93.9	Very high	87.9	Confident	3 Å²	3	58.4 Å²	58.4	1%	0.014	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	107	167.5	-52.5	-88.7	166.1	0	0	106.7	K353 L355 V374 V376 R378 V411 D412 Q413	K353-E400 VanDerWaalsContact CE-OE2 3.25Å; K353-E400 WeakPolarHBondContact CE-OE2 3.26Å; K353-E400 IonicContact NZ-OE2 3.94Å; K353-E400 PolarHBondContact NZ-OE2 3.45Å; L355-E400 HydrophobicContact CD2-CG 4.26Å; V374-E400 HydrophobicContact CB-CB 4.15Å; V374-E400 WeakPolarHBondContact CB-O 3.48Å; V374-E400 PolarHBondContact N-O 2.85Å; V374-E400 PolarHBondContact O-N 2.98Å; V376-E400 HydrophobicContact CG2-CG 4.25Å; R378-E400 IonicContact NH2-OE1 3.07Å; E400-V411 HydrophobicContact CB-CG1 3.82Å; E400-V411 WeakPolarHBondContact OE2-CG1 3.34Å; E400-D412 CarbonylContact C-O 3.56Å; E400-D412 WeakPolarHBondContact CA-O 3.38Å; E400-Q413 VanDerWaalsContact CD-NE2 3.34Å; E400-Q413 PolarHBondContact OE1-NE2 2.85Å; E400-Q413 WeakPolarHBondContact OE2-CG 3.49Å; E400-Q413 PolarHBondContact OE2-NE2 3.25Å
401	I	94.7	Very high	88.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	111.1	-175.5	-56.5	-177.6	0	0	0	108.7	L372 F399 V411 D412 W425 F432 V450 V456	L372-I401 WeakPolarHBondContact O-CA 2.99Å; F399-I401 HydrophobicContact CB-CG1 4.41Å; I401-V411 CarbonylContact O-C 3.55Å; I401-V411 WeakPolarHBondContact O-CA 3.48Å; I401-D412 HydrophobicContact CB-CB 4.34Å; I401-D412 PolarHBondContact N-O 2.98Å; I401-D412 PolarHBondContact O-N 2.94Å; I401-W425 HydrophobicContact CD1-CH2 4.46Å; I401-W425 HydrophobicContact CG2-CH2 3.95Å; I401-W425 HydrophobicContact CG2-CZ2 4.43Å; I401-F432 HydrophobicContact CD1-CD1 4.28Å; I401-F432 HydrophobicContact CD1-CE1 3.38Å; I401-F432 HydrophobicContact CD1-CE2 4.45Å; I401-F432 HydrophobicContact CD1-CZ 3.47Å; I401-F432 VanDerWaalsContact CD1-CZ 3.47Å; I401-V450 HydrophobicContact CD1-CG2 4.13Å; I401-V450 HydrophobicContact CG2-CG1 4.33Å; I401-V450 HydrophobicContact CG2-CG2 4.31Å; I401-V456 HydrophobicContact CD1-CG1 4.41Å; I401-V456 HydrophobicContact CD1-CG2 3.89Å
402	V	94.4	Very high	89.7	Confident	10 Å²	10	53.5 Å²	53.5	6%	0.061	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.7	178.7	-169	0	0	0	0	109.7	L341 F371 L372 L404 V411	L341-V402 HydrophobicContact CD1-CG1 3.88Å; F371-V402 WeakPolarHBondContact CA-O 3.17Å; L372-V402 HydrophobicContact CB-CB 4.32Å; L372-V402 PolarHBondContact N-O 2.76Å; L372-V402 PolarHBondContact O-N 2.69Å; V402-L404 HydrophobicContact CB-CD1 4.49Å; V402-L404 HydrophobicContact CG1-CD1 4.39Å; V402-V411 HydrophobicContact CG1-CG2 4.39Å; V402-V411 HydrophobicContact CG2-CG1 4.44Å; V402-V411 HydrophobicContact CG2-CG2 4.1Å
403	R	93.5	Very high	90.3	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.015	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	110.9	176.6	-53.9	-174	175.4	-134	-1.6	110.8	F371 E406 Y409 P410 D412 V450 S451 T454	F371-R403 HydrophobicContact CD1-CB 4.47Å; F371-R403 HydrophobicContact CD1-CG 4.2Å; F371-R403 HydrophobicContact CE1-CG 4.25Å; R403-E406 HydrophobicContact CB-CB 4.32Å; R403-E406 HydrophobicContact CB-CG 4.3Å; R403-E406 VanDerWaalsContact CD-CD 3.45Å; R403-E406 WeakPolarHBondContact CD-OE1 3.41Å; R403-E406 IonicContact CZ-OE1 2.8Å; R403-E406 IonicContact NE-OE1 3.5Å; R403-E406 IonicContact NH1-OE1 3.09Å; R403-E406 PolarHBondContact NH1-OE1 2.97Å; R403-E406 VanDerWaalsContact NH1-OE1 3.11Å; R403-Y409 WeakPolarHBondContact O-CA 3.25Å; R403-P410 HydrophobicContact CB-CG 4.05Å; R403-P410 HydrophobicContact CG-CG 4.39Å; R403-P410 PolarHBondContact N-O 2.96Å; R403-D412 IonicContact CZ-OD2 3.32Å; R403-D412 VanDerWaalsContact CZ-OD2 3.22Å; R403-D412 IonicContact NE-OD2 2.93Å; R403-D412 PolarHBondContact NE-OD2 3.43Å; R403-D412 IonicContact NH2-OD2 3.61Å; R403-D412 PolarHBondContact NH2-OD2 3.25Å; R403-V450 VanDerWaalsContact CZ-CG1 3.43Å; R403-S451 PolarHBondContact NH1-O 3.31Å; R403-S451 PolarHBondContact NH2-O 2.91Å; R403-T454 PolarHBondContact NH2-O 2.92Å
404	L	92.4	Very high	90.9	Very high	12 Å²	12	53.5 Å²	53.5	6%	0.063	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-21.1	-173.7	-83.1	82.6	0	0	0	114.7	I324 W365 D370 L372 V402 Y409	I324-L404 HydrophobicContact CD1-CD2 3.9Å; W365-L404 HydrophobicContact CH2-CD1 4.42Å; W365-L404 HydrophobicContact CH2-CD2 3.84Å; W365-L404 HydrophobicContact CZ3-CD1 3.75Å; W365-L404 HydrophobicContact CZ3-CD2 3.5Å; W365-L404 HydrophobicContact CZ3-CG 4.28Å; D370-L404 PolarHBondContact O-N 3.01Å; L372-L404 HydrophobicContact CB-CD1 4.12Å; V402-L404 HydrophobicContact CB-CD1 4.49Å; V402-L404 HydrophobicContact CG1-CD1 4.39Å; L404-Y409 HydrophobicContact CG-CD1 4.42Å
405	R	91	Very high	91.4	Very high	123 Å²	123	56.7 Å²	56.7	46%	0.464	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-6	-178.4	-55.3	-56.4	178.2	-150.4	-4.3	113.9	S321 D322 Q368 D370	S321-R405 PolarHBondContact OG-NH2 3.01Å; S321-R405 VanDerWaalsContact OG-NH2 3.1Å; D322-R405 IonicContact OD2-CZ 2.69Å; D322-R405 VanDerWaalsContact OD2-CZ 3.3Å; D322-R405 IonicContact OD2-NH1 3.48Å; D322-R405 PolarHBondContact OD2-NH1 3.16Å; D322-R405 IonicContact OD2-NH2 3.34Å; D322-R405 PolarHBondContact OD2-NH2 3.22Å; Q368-R405 PolarHBondContact O-NH2 2.87Å; D370-R405 HydrophobicContact CB-CG 4.18Å; D370-R405 VanDerWaalsContact OD1-CG 3.32Å; D370-R405 WeakPolarHBondContact OD1-CG 3.38Å; D370-R405 IonicContact OD1-CZ 3.46Å; D370-R405 IonicContact OD1-NE 3.65Å; D370-R405 PolarHBondContact OD1-NE 2.83Å; D370-R405 IonicContact OD1-NH2 2.87Å
406	E	89.8	Confident	91.7	Very high	67 Å²	67	53.7 Å²	53.7	31%	0.313	25%	0.252	S	S	.	.	S	Bend	trans	-99.5	149	178.6	-64.2	-175.2	-159.4	0	0	110.4	R403 Y409 P410	R403-E406 HydrophobicContact CB-CB 4.32Å; R403-E406 HydrophobicContact CB-CG 4.3Å; R403-E406 VanDerWaalsContact CD-CD 3.45Å; R403-E406 WeakPolarHBondContact CD-OE1 3.41Å; R403-E406 IonicContact CZ-OE1 2.8Å; R403-E406 IonicContact NE-OE1 3.5Å; R403-E406 IonicContact NH1-OE1 3.09Å; R403-E406 PolarHBondContact NH1-OE1 2.97Å; R403-E406 VanDerWaalsContact NH1-OE1 3.11Å; E406-Y409 PolarHBondContact O-N 3.3Å; E406-P410 HydrophobicContact CB-CG 3.82Å; E406-P410 WeakPolarHBondContact OE2-CG 3.44Å
407	K	88.5	Confident	91.4	Very high	197 Å²	197	58.3 Å²	58.3	86%	0.857	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	140.3	-179.5	-69.1	-174.4	178.5	-178.4	0	110.1	Y409	K407-Y409 PolarHBondContact O-N 3.1Å
408	L	87.7	Confident	91	Very high	165 Å²	165	58.9 Å²	58.9	86%	0.864	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	12.9	178.7	-52.3	174.7	0	0	0	115.6
409	Y	90.8	Very high	90.7	Very high	56 Å²	56	62.4 Å²	62.4	22%	0.22	30%	0.303	C	S	.	.			trans	53	60.6	173.1	-50.9	-75.4	0	0	0	113.6	L350 C351 R403 L404 E406 K407	L350-Y409 HydrophobicContact CB-CD2 4.31Å; L350-Y409 HydrophobicContact CB-CE2 3.7Å; L350-Y409 HydrophobicContact CD2-CE2 4.43Å; L350-Y409 HydrophobicContact CG-CE2 4.45Å; C351-Y409 HydrophobicContact CB-CD2 4.17Å; C351-Y409 HydrophobicContact CB-CG 4.26Å; R403-Y409 WeakPolarHBondContact O-CA 3.25Å; L404-Y409 HydrophobicContact CG-CD1 4.42Å; E406-Y409 PolarHBondContact O-N 3.3Å; K407-Y409 PolarHBondContact O-N 3.1Å
410	P	92.3	Very high	90.5	Very high	44 Å²	44	63.3 Å²	63.3	29%	0.286	31%	0.309	S	S	.	.			trans	-58.7	145.5	-179.8	25.8	-32.1	0	0	0	110.9	R403 E406	R403-P410 HydrophobicContact CB-CG 4.05Å; R403-P410 HydrophobicContact CG-CG 4.39Å; R403-P410 PolarHBondContact N-O 2.96Å; E406-P410 HydrophobicContact CB-CG 3.82Å; E406-P410 WeakPolarHBondContact OE2-CG 3.44Å
411	V	92.4	Very high	90.5	Very high	38 Å²	38	65.5 Å²	65.5	23%	0.23	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	112.1	-175.2	-174.4	0	0	0	0	109.3	E400 I401 V402	E400-V411 HydrophobicContact CB-CG1 3.82Å; E400-V411 WeakPolarHBondContact OE2-CG1 3.34Å; I401-V411 CarbonylContact O-C 3.55Å; I401-V411 WeakPolarHBondContact O-CA 3.48Å; V402-V411 HydrophobicContact CG1-CG2 4.39Å; V402-V411 HydrophobicContact CG2-CG1 4.44Å; V402-V411 HydrophobicContact CG2-CG2 4.1Å
412	D	92.7	Very high	90.4	Very high	24 Å²	24	68.3 Å²	68.3	13%	0.128	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	138.5	174.1	-64.4	-43.8	0	0	0	110.3	E400 I401 R403 V456	E400-D412 CarbonylContact C-O 3.56Å; E400-D412 WeakPolarHBondContact CA-O 3.38Å; I401-D412 HydrophobicContact CB-CB 4.34Å; I401-D412 PolarHBondContact N-O 2.98Å; I401-D412 PolarHBondContact O-N 2.94Å; R403-D412 IonicContact CZ-OD2 3.32Å; R403-D412 VanDerWaalsContact CZ-OD2 3.22Å; R403-D412 IonicContact NE-OD2 2.93Å; R403-D412 PolarHBondContact NE-OD2 3.43Å; R403-D412 IonicContact NH2-OD2 3.61Å; R403-D412 PolarHBondContact NH2-OD2 3.25Å; D412-V456 HydrophobicContact CB-CG2 3.51Å
413	Q	92.1	Very high	90.4	Very high	127 Å²	127	68.4 Å²	68.4	59%	0.593	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.7	-179.6	-57.7	-164.6	-38.1	0	0	110.4	K353 E400	K353-Q413 VanDerWaalsContact NZ-NE2 3.18Å; E400-Q413 VanDerWaalsContact CD-NE2 3.34Å; E400-Q413 PolarHBondContact OE1-NE2 2.85Å; E400-Q413 WeakPolarHBondContact OE2-CG 3.49Å; E400-Q413 PolarHBondContact OE2-NE2 3.25Å
414	L	92.5	Very high	90.5	Very high	26 Å²	26	71.6 Å²	71.6	14%	0.136	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114.3	175.3	175	67.8	0	0	0	109.5	N398 F399 V416 F432 Y448 V456	N398-L414 WeakPolarHBondContact CA-O 3.36Å; F399-L414 HydrophobicContact CB-CB 4.25Å; F399-L414 HydrophobicContact CD2-CD2 4.22Å; F399-L414 PolarHBondContact N-O 3.4Å; F399-L414 PolarHBondContact O-N 3.27Å; L414-V416 HydrophobicContact CD2-CG2 4.48Å; L414-V416 HydrophobicContact CG-CG2 4.26Å; L414-F432 HydrophobicContact CD2-CE2 4.2Å; L414-F432 HydrophobicContact CD2-CZ 3.91Å; L414-Y448 HydrophobicContact CD1-CD1 4.44Å; L414-Y448 HydrophobicContact CD1-CE1 3.91Å; L414-Y448 HydrophobicContact CD2-CD1 4.04Å; L414-Y448 HydrophobicContact CD2-CD2 4.25Å; L414-Y448 HydrophobicContact CD2-CE1 4.09Å; L414-Y448 HydrophobicContact CD2-CE2 4.26Å; L414-Y448 HydrophobicContact CD2-CG 4.16Å; L414-V456 HydrophobicContact CD2-CG1 4.31Å
415	E	90.4	Very high	90.7	Very high	116 Å²	116	71.6 Å²	71.6	54%	0.542	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.9	175	-177.7	177.3	142	0	0	110	Y396	Y396-E415 HydrophobicContact CD2-CG 4.33Å; Y396-E415 HydrophobicContact CE2-CG 4.44Å
416	V	89.6	Confident	90.9	Very high	6 Å²	6	66.3 Å²	66.3	4%	0.036	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.3	179.8	-177.4	0	0	0	0	109.8	T397 F399 L414 G418 V420 F434	T397-V416 PolarHBondContact O-N 3.31Å; T397-V416 VanDerWaalsContact O-N 3.07Å; F399-V416 HydrophobicContact CD2-CG2 3.97Å; F399-V416 HydrophobicContact CE2-CG2 3.92Å; L414-V416 HydrophobicContact CD2-CG2 4.48Å; L414-V416 HydrophobicContact CG-CG2 4.26Å; V416-G418 PolarHBondContact O-N 2.77Å; V416-V420 HydrophobicContact CB-CG2 4.02Å; V416-V420 HydrophobicContact CG1-CG2 3.67Å; V416-V420 HydrophobicContact CG2-CG2 4.47Å; V416-F434 HydrophobicContact CG1-CE2 4.05Å; V416-F434 HydrophobicContact CG1-CZ 4.33Å; V416-F434 HydrophobicContact CG2-CE2 4.22Å; V416-F434 HydrophobicContact CG2-CZ 3.74Å
417	K	80.6	Confident	91	Very high	183 Å²	183	63.3 Å²	63.3	80%	0.796	32%	0.32	S	S	*	.	S	Bend	trans	-82.4	64.1	178.1	-64	-176.2	-179.1	178.5	0	111
418	G	82.9	Confident	90.8	Very high	19 Å²	19	57.6 Å²	57.6	20%	0.196	30%	0.304	C	S	.	.	S	Bend	trans	-178.1	177.2	-179.3	0	0	0	0	0	112.9	V416	V416-G418 PolarHBondContact O-N 2.77Å
419	T	87.7	Confident	90.8	Very high	90 Å²	90	50.6 Å²	50.6	55%	0.552	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.3	168.6	54.6	0	0	0	0	108.6	Q436 S437	T419-Q436 VanDerWaalsContact O-CA 3.31Å; T419-Q436 WeakPolarHBondContact O-CA 3.47Å; T419-S437 PolarHBondContact N-O 3.33Å; T419-S437 VanDerWaalsContact N-O 3.1Å; T419-S437 PolarHBondContact O-N 2.85Å; T419-S437 WeakPolarHBondContact OG1-CB 3.38Å; T419-S437 PolarHBondContact OG1-O 3.43Å
420	V	91.9	Very high	90.9	Very high	20 Å²	20	50.1 Å²	50.1	12%	0.121	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.1	-178.8	-178.2	0	0	0	0	109.7	T397 F399 V416 F434 L435	T397-V420 HydrophobicContact CG2-CB 4.24Å; T397-V420 HydrophobicContact CG2-CG2 4.23Å; F399-V420 HydrophobicContact CE2-CG1 4.17Å; F399-V420 HydrophobicContact CE2-CG2 4.3Å; F399-V420 HydrophobicContact CZ-CB 4.41Å; F399-V420 HydrophobicContact CZ-CG1 3.71Å; V416-V420 HydrophobicContact CB-CG2 4.02Å; V416-V420 HydrophobicContact CG1-CG2 3.67Å; V416-V420 HydrophobicContact CG2-CG2 4.47Å; V420-F434 HydrophobicContact CB-CD2 4.34Å; V420-F434 HydrophobicContact CG1-CB 3.69Å; V420-F434 HydrophobicContact CG1-CD2 3.43Å; V420-F434 VanDerWaalsContact CG1-CD2 3.43Å; V420-F434 HydrophobicContact CG1-CE2 4.2Å; V420-F434 HydrophobicContact CG1-CG 3.68Å; V420-F434 HydrophobicContact CG2-CD2 4.05Å; V420-F434 HydrophobicContact CG2-CE2 4.02Å; V420-L435 CarbonylContact C-O 3.59Å; V420-L435 WeakPolarHBondContact CA-O 3.24Å
421	S	92.3	Very high	91.1	Very high	49 Å²	49	49.5 Å²	49.5	34%	0.343	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.2	174.5	55.6	0	0	0	0	110.3	F423 L435	S421-F423 PolarHBondContact O-N 3.4Å; S421-L435 PolarHBondContact N-O 2.7Å; S421-L435 WeakPolarHBondContact O-CB 3.44Å; S421-L435 PolarHBondContact O-N 2.89Å; S421-L435 WeakPolarHBondContact OG-CB 3.23Å
422	N	92.4	Very high	91.2	Very high	58 Å²	58	47.7 Å²	47.7	31%	0.31	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.7	59	175.1	-73	44.2	0	0	0	115.2	L435 N470 D471 L472	N422-L435 HydrophobicContact CB-CD1 4.19Å; N422-L435 HydrophobicContact CB-CG 4.43Å; N422-N470 PolarHBondContact ND2-O 2.86Å; N422-N470 PolarHBondContact OD1-O 3.18Å; N422-D471 WeakPolarHBondContact ND2-CB 3.3Å; N422-D471 PolarHBondContact ND2-OD1 2.86Å; N422-L472 HydrophobicContact CB-CB 4.11Å
423	F	95.4	Very high	91.4	Very high	12 Å²	12	46.5 Å²	46.5	5%	0.053	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	132.8	167.5	-179.3	-73.3	0	0	0	110.5	L364 A373 F399 S421 W425 F432 A433 F434	L364-F423 HydrophobicContact CB-CD1 4.14Å; L364-F423 HydrophobicContact CB-CE1 4.24Å; L364-F423 HydrophobicContact CD1-CB 3.71Å; L364-F423 HydrophobicContact CD1-CD1 3.46Å; L364-F423 VanDerWaalsContact CD1-CD1 3.46Å; L364-F423 HydrophobicContact CD1-CD2 4.45Å; L364-F423 HydrophobicContact CD1-CE1 4.21Å; L364-F423 HydrophobicContact CD1-CG 3.62Å; L364-F423 HydrophobicContact CG-CD1 4.35Å; A373-F423 HydrophobicContact CB-CE1 3.85Å; A373-F423 HydrophobicContact CB-CE2 4.02Å; A373-F423 HydrophobicContact CB-CZ 3.44Å; A373-F423 VanDerWaalsContact CB-CZ 3.44Å; F399-F423 HydrophobicContact CD1-CD2 4.06Å; F399-F423 HydrophobicContact CD1-CE2 4.03Å; F399-F423 AromaticContact CE1-CD2 3.38Å; F399-F423 HydrophobicContact CE1-CD2 3.38Å; F399-F423 AromaticContact CE1-CE2 3.83Å; F399-F423 HydrophobicContact CE1-CE2 3.83Å; F399-F423 HydrophobicContact CE1-CG 4.2Å; F399-F423 HydrophobicContact CE2-CD2 4.49Å; F399-F423 AromaticContact CZ-CD2 3.64Å; F399-F423 HydrophobicContact CZ-CD2 3.64Å; F399-F423 HydrophobicContact CZ-CE2 4.27Å; S421-F423 PolarHBondContact O-N 3.4Å; F423-W425 AromaticContact CE1-CD1 3.68Å; F423-W425 HydrophobicContact CE1-CD2 4Å; F423-W425 AromaticContact CE1-CE2 3.69Å; F423-W425 AromaticContact CE1-CG 3.99Å; F423-W425 HydrophobicContact CE1-CG 3.99Å; F423-W425 HydrophobicContact CE1-CZ2 4.31Å; F423-W425 AromaticContact CE1-NE1 3.49Å; F423-W425 HydrophobicContact CZ-CD2 4.21Å; F423-W425 AromaticContact CZ-CE2 3.8Å; F423-W425 HydrophobicContact CZ-CH2 4.47Å; F423-W425 AromaticContact CZ-CZ2 3.97Å; F423-W425 HydrophobicContact CZ-CZ2 3.97Å; F423-F432 AromaticContact CD2-CD2 4Å; F423-F432 HydrophobicContact CD2-CD2 4Å; F423-F432 HydrophobicContact CD2-CE2 4.48Å; F423-F432 HydrophobicContact CE1-CB 4.15Å; F423-F432 HydrophobicContact CE2-CB 4.13Å; F423-F432 AromaticContact CE2-CD2 3.14Å; F423-F432 HydrophobicContact CE2-CD2 3.14Å; F423-F432 AromaticContact CE2-CE2 3.59Å; F423-F432 HydrophobicContact CE2-CE2 3.59Å; F423-F432 AromaticContact CE2-CG 3.78Å; F423-F432 HydrophobicContact CE2-CG 3.78Å; F423-F432 HydrophobicContact CZ-CB 3.62Å; F423-F432 HydrophobicContact CZ-CD1 4.46Å; F423-F432 AromaticContact CZ-CD2 3.51Å; F423-F432 HydrophobicContact CZ-CD2 3.51Å; F423-F432 HydrophobicContact CZ-CE2 4.22Å; F423-F432 AromaticContact CZ-CG 3.62Å; F423-F432 HydrophobicContact CZ-CG 3.62Å; F423-A433 CarbonylContact C-O 3.57Å; F423-A433 WeakPolarHBondContact CA-O 3.2Å; F423-F434 HydrophobicContact CB-CB 4.25Å; F423-F434 HydrophobicContact CD2-CB 4.33Å; F423-F434 HydrophobicContact CD2-CD1 4.19Å
424	Q	95.8	Very high	91.6	Very high	71 Å²	71	40.5 Å²	40.5	33%	0.332	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	133.1	175.5	-64.9	-68.6	-12.8	0	0	111.8	F432 A433 L472 W474	Q424-F432 WeakPolarHBondContact O-CA 3.15Å; Q424-A433 PolarHBondContact N-O 3.26Å; Q424-A433 PolarHBondContact O-N 2.96Å; Q424-L472 HydrophobicContact CB-CD2 4.45Å; Q424-L472 HydrophobicContact CG-CB 4.42Å; Q424-L472 WeakPolarHBondContact CG-O 3.37Å; Q424-W474 VanDerWaalsContact CB-CD1 3.49Å; Q424-W474 PolarHBondContact O-NE1 3.37Å; Q424-W474 VanDerWaalsContact O-NE1 3.09Å
425	W	96.1	Very high	91.7	Very high	13 Å²	13	39.2 Å²	39.2	5%	0.049	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	148.1	169.8	-75.2	110.1	0	0	0	111.4	L364 W365 H366 F371 A373 I401 F423 P427 F432 V450 W474	L364-W425 PolarHBondContact O-NE1 2.99Å; W365-W425 VanDerWaalsContact C-CD1 3.43Å; W365-W425 VanDerWaalsContact O-CD1 3.24Å; H366-W425 HydrophobicContact CB-CD2 4.17Å; H366-W425 HydrophobicContact CB-CG 4.21Å; H366-W425 AromaticContact CD2-CD2 3.96Å; H366-W425 AromaticContact CD2-CE3 3.79Å; F371-W425 HydrophobicContact CB-CH2 3.67Å; F371-W425 HydrophobicContact CB-CZ2 3.8Å; F371-W425 HydrophobicContact CB-CZ3 4.21Å; F371-W425 HydrophobicContact CD2-CZ3 4.25Å; F371-W425 HydrophobicContact CG-CH2 4.19Å; F371-W425 HydrophobicContact CG-CZ3 4.38Å; A373-W425 HydrophobicContact CB-CH2 4.48Å; A373-W425 HydrophobicContact CB-CZ2 3.47Å; A373-W425 VanDerWaalsContact CB-CZ2 3.47Å; I401-W425 HydrophobicContact CD1-CH2 4.46Å; I401-W425 HydrophobicContact CG2-CH2 3.95Å; I401-W425 HydrophobicContact CG2-CZ2 4.43Å; F423-W425 AromaticContact CE1-CD1 3.68Å; F423-W425 HydrophobicContact CE1-CD2 4Å; F423-W425 AromaticContact CE1-CE2 3.69Å; F423-W425 AromaticContact CE1-CG 3.99Å; F423-W425 HydrophobicContact CE1-CG 3.99Å; F423-W425 HydrophobicContact CE1-CZ2 4.31Å; F423-W425 AromaticContact CE1-NE1 3.49Å; F423-W425 HydrophobicContact CZ-CD2 4.21Å; F423-W425 AromaticContact CZ-CE2 3.8Å; F423-W425 HydrophobicContact CZ-CH2 4.47Å; F423-W425 AromaticContact CZ-CZ2 3.97Å; F423-W425 HydrophobicContact CZ-CZ2 3.97Å; W425-P427 WeakPolarHBondContact O-CD 3.28Å; W425-F432 HydrophobicContact CD2-CB 4.11Å; W425-F432 HydrophobicContact CE3-CB 3.64Å; W425-F432 HydrophobicContact CE3-CD1 4.24Å; W425-F432 HydrophobicContact CE3-CG 4.34Å; W425-F432 AromaticContact CH2-CD1 3.95Å; W425-F432 HydrophobicContact CH2-CD1 3.95Å; W425-F432 HydrophobicContact CH2-CG 4.48Å; W425-F432 HydrophobicContact CZ3-CB 3.89Å; W425-F432 AromaticContact CZ3-CD1 3.59Å; W425-F432 HydrophobicContact CZ3-CD1 3.59Å; W425-F432 HydrophobicContact CZ3-CG 4.09Å; W425-V450 HydrophobicContact CH2-CG2 4.21Å; W425-V450 HydrophobicContact CZ3-CG2 4.11Å; W425-W474 VanDerWaalsContact O-CD1 3.24Å
426	E	95.3	Very high	91.8	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.056	19%	0.194	C	C	.	.			trans	-71.6	120.2	164.1	-178.9	173.4	-147.7	0	0	109.7	H366 C428 G429 R431 W474 G478 G479	H366-E426 PolarHBondContact NE2-O 2.82Å; E426-C428 VanDerWaalsContact C-N 3.27Å; E426-C428 PolarHBondContact O-N 3.14Å; E426-G429 PolarHBondContact O-N 3Å; E426-R431 HydrophobicContact CB-CB 4.22Å; E426-R431 VanDerWaalsContact CB-O 3.25Å; E426-R431 WeakPolarHBondContact CB-O 3.41Å; E426-R431 PolarHBondContact N-O 2.73Å; E426-R431 IonicContact OE1-CZ 3.26Å; E426-R431 IonicContact OE1-NE 3.16Å; E426-R431 IonicContact OE1-NH2 2.8Å; E426-R431 PolarHBondContact OE1-NH2 2.88Å; E426-R431 WeakPolarHBondContact OE2-CB 3.34Å; E426-R431 IonicContact OE2-CZ 2.74Å; E426-R431 IonicContact OE2-NE 3.57Å; E426-R431 PolarHBondContact OE2-NE 2.69Å; E426-R431 IonicContact OE2-NH2 3.99Å; E426-R431 PolarHBondContact OE2-NH2 2.99Å; E426-W474 HydrophobicContact CB-CD2 4.13Å; E426-W474 HydrophobicContact CB-CE3 4.04Å; E426-W474 HydrophobicContact CB-CH2 4.11Å; E426-W474 HydrophobicContact CB-CZ2 4.2Å; E426-W474 HydrophobicContact CB-CZ3 4.05Å; E426-W474 HydrophobicContact CG-CD2 4.44Å; E426-W474 HydrophobicContact CG-CE3 3.92Å; E426-W474 HydrophobicContact CG-CH2 4.46Å; E426-W474 HydrophobicContact CG-CZ3 3.94Å; E426-G478 VanDerWaalsContact OE1-CA 3.31Å; E426-G478 WeakPolarHBondContact OE1-CA 3.48Å; E426-G479 PolarHBondContact OE1-N 3.26Å
427	P	90.8	Very high	91.7	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.026	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-34.3	-170.9	-35.9	40.4	0	0	0	117.2	E367 W425 W474	E367-P427 HydrophobicContact CG-CB 4.48Å; E367-P427 WeakPolarHBondContact OE2-CB 3.15Å; W425-P427 WeakPolarHBondContact O-CD 3.28Å; P427-W474 HydrophobicContact CG-CB 4.26Å
428	C	85.2	Confident	91.8	Very high	77 Å²	77	30.4 Å²	30.4	52%	0.52	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.1	17.9	-172.9	-67.6	0	0	0	0	112.6	E426	E426-C428 VanDerWaalsContact C-N 3.27Å; E426-C428 PolarHBondContact O-N 3.14Å
429	G	88.7	Confident	91.5	Very high	18 Å²	18	36.7 Å²	36.7	19%	0.186	22%	0.219	C	C	.	.	S	Bend	trans	-126.3	-164.1	-169.6	0	0	0	0	0	113.9	H366 E426	H366-G429 PolarHBondContact CE1-O 3.44Å; H366-G429 PolarHBondContact NE2-O 2.89Å; E426-G429 PolarHBondContact O-N 3Å
430	T	92.8	Very high	90.9	Very high	45 Å²	45	36.5 Å²	36.5	28%	0.276	22%	0.221	S	C	.	.	S	Bend	trans	-114.9	1.1	172.1	49.6	0	0	0	0	111.8	F371 D449 V450	F371-T430 HydrophobicContact CE2-CG2 4.04Å; F371-T430 HydrophobicContact CZ-CG2 4.01Å; T430-D449 VanDerWaalsContact C-OD1 3.27Å; T430-D449 VanDerWaalsContact CB-OD1 3.22Å; T430-D449 WeakPolarHBondContact CB-OD1 3.26Å; T430-D449 PolarHBondContact OG1-OD1 3.32Å; T430-V450 WeakPolarHBondContact O-CB 3.12Å; T430-V450 PolarHBondContact O-N 3.23Å
431	R	94.8	Very high	90.3	Very high	31 Å²	31	37.9 Å²	37.9	12%	0.117	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	157.9	-177.7	-60.7	179.9	-67.9	-163.7	-7.9	112	E426 Y448 D449 W474 A498 N499	E426-R431 HydrophobicContact CB-CB 4.22Å; E426-R431 VanDerWaalsContact CB-O 3.25Å; E426-R431 WeakPolarHBondContact CB-O 3.41Å; E426-R431 PolarHBondContact N-O 2.73Å; E426-R431 IonicContact OE1-CZ 3.26Å; E426-R431 IonicContact OE1-NE 3.16Å; E426-R431 IonicContact OE1-NH2 2.8Å; E426-R431 PolarHBondContact OE1-NH2 2.88Å; E426-R431 WeakPolarHBondContact OE2-CB 3.34Å; E426-R431 IonicContact OE2-CZ 2.74Å; E426-R431 IonicContact OE2-NE 3.57Å; E426-R431 PolarHBondContact OE2-NE 2.69Å; E426-R431 IonicContact OE2-NH2 3.99Å; E426-R431 PolarHBondContact OE2-NH2 2.99Å; R431-Y448 CarbonylContact C-O 3.58Å; R431-Y448 WeakPolarHBondContact CA-O 3.31Å; R431-Y448 WeakPolarHBondContact CB-O 3.35Å; R431-D449 HydrophobicContact CG-CB 3.95Å; R431-W474 HydrophobicContact CB-CH2 4.26Å; R431-A498 PolarHBondContact NH1-O 2.91Å; R431-N499 PolarHBondContact NH1-OD1 2.96Å; R431-N499 PolarHBondContact NH2-OD1 2.67Å
432	F	95.9	Very high	90	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	158.5	166.8	61.4	-85.6	0	0	0	109.6	I401 L414 F423 Q424 W425 F434 I447 Y448 V450 V456	I401-F432 HydrophobicContact CD1-CD1 4.28Å; I401-F432 HydrophobicContact CD1-CE1 3.38Å; I401-F432 HydrophobicContact CD1-CE2 4.45Å; I401-F432 HydrophobicContact CD1-CZ 3.47Å; I401-F432 VanDerWaalsContact CD1-CZ 3.47Å; L414-F432 HydrophobicContact CD2-CE2 4.2Å; L414-F432 HydrophobicContact CD2-CZ 3.91Å; F423-F432 AromaticContact CD2-CD2 4Å; F423-F432 HydrophobicContact CD2-CD2 4Å; F423-F432 HydrophobicContact CD2-CE2 4.48Å; F423-F432 HydrophobicContact CE1-CB 4.15Å; F423-F432 HydrophobicContact CE2-CB 4.13Å; F423-F432 AromaticContact CE2-CD2 3.14Å; F423-F432 HydrophobicContact CE2-CD2 3.14Å; F423-F432 AromaticContact CE2-CE2 3.59Å; F423-F432 HydrophobicContact CE2-CE2 3.59Å; F423-F432 AromaticContact CE2-CG 3.78Å; F423-F432 HydrophobicContact CE2-CG 3.78Å; F423-F432 HydrophobicContact CZ-CB 3.62Å; F423-F432 HydrophobicContact CZ-CD1 4.46Å; F423-F432 AromaticContact CZ-CD2 3.51Å; F423-F432 HydrophobicContact CZ-CD2 3.51Å; F423-F432 HydrophobicContact CZ-CE2 4.22Å; F423-F432 AromaticContact CZ-CG 3.62Å; F423-F432 HydrophobicContact CZ-CG 3.62Å; Q424-F432 WeakPolarHBondContact O-CA 3.15Å; W425-F432 HydrophobicContact CD2-CB 4.11Å; W425-F432 HydrophobicContact CE3-CB 3.64Å; W425-F432 HydrophobicContact CE3-CD1 4.24Å; W425-F432 HydrophobicContact CE3-CG 4.34Å; W425-F432 AromaticContact CH2-CD1 3.95Å; W425-F432 HydrophobicContact CH2-CD1 3.95Å; W425-F432 HydrophobicContact CH2-CG 4.48Å; W425-F432 HydrophobicContact CZ3-CB 3.89Å; W425-F432 AromaticContact CZ3-CD1 3.59Å; W425-F432 HydrophobicContact CZ3-CD1 3.59Å; W425-F432 HydrophobicContact CZ3-CG 4.09Å; F432-F434 HydrophobicContact CD2-CD1 4.08Å; F432-F434 HydrophobicContact CD2-CE1 4.36Å; F432-F434 HydrophobicContact CE2-CD1 4Å; F432-F434 AromaticContact CE2-CE1 3.85Å; F432-F434 HydrophobicContact CE2-CE1 3.85Å; F432-I447 WeakPolarHBondContact O-CA 3.48Å; F432-Y448 HydrophobicContact CE2-CD2 4.05Å; F432-Y448 HydrophobicContact CE2-CG 4.12Å; F432-Y448 HydrophobicContact CZ-CD2 4.29Å; F432-Y448 AromaticContact CZ-CG 3.89Å; F432-Y448 HydrophobicContact CZ-CG 3.89Å; F432-Y448 PolarHBondContact N-O 3.03Å; F432-Y448 PolarHBondContact O-N 3.09Å; F432-V450 HydrophobicContact CD1-CG2 3.88Å; F432-V450 HydrophobicContact CE1-CG2 3.61Å; F432-V456 HydrophobicContact CE1-CG1 4.03Å; F432-V456 HydrophobicContact CZ-CG1 3.98Å
433	A	96.1	Very high	90	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150.9	177.3	0	0	0	0	0	110.8	F423 Q424 I445 A446 I447 L472 W474 I481	F423-A433 CarbonylContact C-O 3.57Å; F423-A433 WeakPolarHBondContact CA-O 3.2Å; Q424-A433 PolarHBondContact N-O 3.26Å; Q424-A433 PolarHBondContact O-N 2.96Å; A433-I445 HydrophobicContact CB-CD1 4.23Å; A433-I445 HydrophobicContact CB-CG1 4.29Å; A433-A446 VanDerWaalsContact CA-O 3.23Å; A433-A446 WeakPolarHBondContact CA-O 3.37Å; A433-I447 HydrophobicContact CB-CG1 4.09Å; A433-L472 HydrophobicContact CB-CD2 3.75Å; A433-W474 HydrophobicContact CB-CZ2 3.65Å; A433-I481 HydrophobicContact CB-CD1 3.79Å
434	F	95.7	Very high	89.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	158.1	173.3	57.1	-96.6	0	0	0	110.3	F399 V416 V420 F423 F432 Q436 A446 Y448	F399-F434 HydrophobicContact CE2-CD1 4.08Å; F399-F434 AromaticContact CE2-CE1 3.93Å; F399-F434 HydrophobicContact CE2-CE1 3.93Å; F399-F434 HydrophobicContact CE2-CG 4.5Å; F399-F434 HydrophobicContact CE2-CZ 4.21Å; F399-F434 HydrophobicContact CZ-CD1 4.31Å; V416-F434 HydrophobicContact CG1-CE2 4.05Å; V416-F434 HydrophobicContact CG1-CZ 4.33Å; V416-F434 HydrophobicContact CG2-CE2 4.22Å; V416-F434 HydrophobicContact CG2-CZ 3.74Å; V420-F434 HydrophobicContact CB-CD2 4.34Å; V420-F434 HydrophobicContact CG1-CB 3.69Å; V420-F434 HydrophobicContact CG1-CD2 3.43Å; V420-F434 VanDerWaalsContact CG1-CD2 3.43Å; V420-F434 HydrophobicContact CG1-CE2 4.2Å; V420-F434 HydrophobicContact CG1-CG 3.68Å; V420-F434 HydrophobicContact CG2-CD2 4.05Å; V420-F434 HydrophobicContact CG2-CE2 4.02Å; F423-F434 HydrophobicContact CB-CB 4.25Å; F423-F434 HydrophobicContact CD2-CB 4.33Å; F423-F434 HydrophobicContact CD2-CD1 4.19Å; F432-F434 HydrophobicContact CD2-CD1 4.08Å; F432-F434 HydrophobicContact CD2-CE1 4.36Å; F432-F434 HydrophobicContact CE2-CD1 4Å; F432-F434 AromaticContact CE2-CE1 3.85Å; F432-F434 HydrophobicContact CE2-CE1 3.85Å; F434-Q436 HydrophobicContact CD2-CB 4.14Å; F434-Q436 HydrophobicContact CE2-CB 3.95Å; F434-Q436 HydrophobicContact CE2-CG 4.45Å; F434-A446 HydrophobicContact CD2-CB 4.34Å; F434-A446 HydrophobicContact CE1-CB 4.39Å; F434-A446 HydrophobicContact CE2-CB 3.83Å; F434-A446 HydrophobicContact CZ-CB 3.86Å; F434-A446 PolarHBondContact N-O 3.26Å; F434-A446 VanDerWaalsContact N-O 3.14Å; F434-A446 PolarHBondContact O-N 2.89Å; F434-Y448 AromaticContact CE1-CD2 3.6Å; F434-Y448 HydrophobicContact CE1-CD2 3.6Å; F434-Y448 AromaticContact CE1-CE2 3.59Å; F434-Y448 HydrophobicContact CE1-CE2 3.59Å; F434-Y448 HydrophobicContact CZ-CD2 4.04Å; F434-Y448 AromaticContact CZ-CE2 3.52Å; F434-Y448 HydrophobicContact CZ-CE2 3.52Å
435	L	94.5	Very high	89.8	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	129	171	-62.6	177.2	0	0	0	108.7	V420 S421 N422 L443 I445 L464 T469 L472	V420-L435 CarbonylContact C-O 3.59Å; V420-L435 WeakPolarHBondContact CA-O 3.24Å; S421-L435 PolarHBondContact N-O 2.7Å; S421-L435 WeakPolarHBondContact O-CB 3.44Å; S421-L435 PolarHBondContact O-N 2.89Å; S421-L435 WeakPolarHBondContact OG-CB 3.23Å; N422-L435 HydrophobicContact CB-CD1 4.19Å; N422-L435 HydrophobicContact CB-CG 4.43Å; L435-L443 HydrophobicContact CB-CD1 4.31Å; L435-I445 HydrophobicContact CD2-CB 4.44Å; L435-L464 HydrophobicContact CD2-CD1 3.67Å; L435-T469 HydrophobicContact CD1-CG2 4.14Å; L435-T469 HydrophobicContact CD2-CG2 4.26Å; L435-L472 HydrophobicContact CD2-CD1 4.33Å
436	Q	92.4	Very high	89.7	Confident	23 Å²	23	35.4 Å²	35.4	11%	0.107	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136	174.1	65.8	179.1	2.1	0	0	111.2	T419 F434 S444 A446	T419-Q436 VanDerWaalsContact O-CA 3.31Å; T419-Q436 WeakPolarHBondContact O-CA 3.47Å; F434-Q436 HydrophobicContact CD2-CB 4.14Å; F434-Q436 HydrophobicContact CE2-CB 3.95Å; F434-Q436 HydrophobicContact CE2-CG 4.45Å; Q436-S444 VanDerWaalsContact CG-OG 3.24Å; Q436-S444 WeakPolarHBondContact CG-OG 3.34Å; Q436-S444 PolarHBondContact N-O 2.99Å; Q436-S444 PolarHBondContact NE2-OG 3.03Å; Q436-S444 PolarHBondContact O-N 2.94Å; Q436-A446 HydrophobicContact CG-CB 4.4Å
437	S	88.9	Confident	89.7	Confident	35 Å²	35	34.9 Å²	34.9	25%	0.245	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.8	168.6	-178.6	0	0	0	0	109.4	T419	T419-S437 PolarHBondContact N-O 3.33Å; T419-S437 VanDerWaalsContact N-O 3.1Å; T419-S437 PolarHBondContact O-N 2.85Å; T419-S437 WeakPolarHBondContact OG1-CB 3.38Å; T419-S437 PolarHBondContact OG1-O 3.43Å
438	V	82.1	Confident	89.9	Confident	62 Å²	62	35.6 Å²	35.6	38%	0.376	22%	0.22	S	C	.	.			trans	-85	159.8	172.7	-173	0	0	0	0	108.6	S440 G441 K442	V438-S440 PolarHBondContact O-N 3.23Å; V438-G441 PolarHBondContact O-N 2.81Å; V438-K442 PolarHBondContact N-O 2.76Å
439	T	76.3	Confident	90.3	Very high	151 Å²	151	33.4 Å²	33.4	93%	0.926	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-19.8	179.3	-41.2	0	0	0	0	114.1	G441	T439-G441 PolarHBondContact O-N 3.3Å
440	S	75.6	Confident	90.4	Very high	85 Å²	85	32.5 Å²	32.5	59%	0.594	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-6.6	173.5	56.7	0	0	0	0	114.5	V438 K442	V438-S440 PolarHBondContact O-N 3.23Å; S440-K442 PolarHBondContact O-N 2.91Å
441	G	79.2	Confident	90	Very high	49 Å²	49	32 Å²	32	51%	0.505	19%	0.193	S	C	.	.	S	Bend	trans	76.9	0.3	-176.6	0	0	0	0	0	114.2	V438 T439	V438-G441 PolarHBondContact O-N 2.81Å; T439-G441 PolarHBondContact O-N 3.3Å
442	K	85.6	Confident	89.1	Confident	128 Å²	128	40.4 Å²	40.4	56%	0.557	22%	0.224	S	C	*	.			trans	-75.9	130.8	173	-67.7	-172	174.5	-169.4	0	110.1	V438 S440 D463	V438-K442 PolarHBondContact N-O 2.76Å; S440-K442 PolarHBondContact O-N 2.91Å; K442-D463 IonicContact NZ-OD2 2.69Å
443	L	92.2	Very high	87.9	Confident	18 Å²	18	43.9 Å²	43.9	9%	0.094	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	125.5	174.3	-171.7	69.6	0	0	0	109.2	L435 L464 T469	L435-L443 HydrophobicContact CB-CD1 4.31Å; L443-L464 HydrophobicContact CD2-CD1 4.2Å; L443-L464 HydrophobicContact CG-CD1 4.28Å; L443-L464 PolarHBondContact O-N 2.77Å; L443-T469 HydrophobicContact CD2-CG2 4.5Å; L443-T469 VanDerWaalsContact CD2-O 3.25Å; L443-T469 WeakPolarHBondContact CD2-O 3.36Å
444	S	93.2	Very high	86.9	Confident	6 Å²	6	47.5 Å²	47.5	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	152.5	174.4	55	0	0	0	0	111.1	Q436 L462	Q436-S444 VanDerWaalsContact CG-OG 3.24Å; Q436-S444 WeakPolarHBondContact CG-OG 3.34Å; Q436-S444 PolarHBondContact N-O 2.99Å; Q436-S444 PolarHBondContact NE2-OG 3.03Å; Q436-S444 PolarHBondContact O-N 2.94Å; S444-L462 CarbonylContact C-O 3.55Å; S444-L462 WeakPolarHBondContact CA-O 3.46Å; S444-L462 WeakPolarHBondContact CB-O 3.28Å
445	I	94.5	Very high	86.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.1	165.8	-177.4	-178.5	0	0	0	107.9	A433 L435 I447 V461 L462 L464 L472 I481 I496	A433-I445 HydrophobicContact CB-CD1 4.23Å; A433-I445 HydrophobicContact CB-CG1 4.29Å; L435-I445 HydrophobicContact CD2-CB 4.44Å; I445-I447 HydrophobicContact CD1-CD1 4.45Å; I445-I447 HydrophobicContact CD1-CG1 4.32Å; I445-I447 HydrophobicContact CG1-CG1 4.31Å; I445-V461 WeakPolarHBondContact O-CA 3.22Å; I445-L462 HydrophobicContact CG2-CB 3.72Å; I445-L462 PolarHBondContact N-O 2.91Å; I445-L462 PolarHBondContact O-N 3.1Å; I445-L464 HydrophobicContact CG2-CD2 4.02Å; I445-L464 HydrophobicContact CG2-CG 4.43Å; I445-L472 HydrophobicContact CD1-CD1 3.66Å; I445-L472 HydrophobicContact CD1-CD2 4.41Å; I445-L472 HydrophobicContact CG1-CD1 4.34Å; I445-I481 HydrophobicContact CD1-CD1 3.82Å; I445-I481 HydrophobicContact CD1-CG2 4.23Å; I445-I496 HydrophobicContact CD1-CD1 3.87Å; I445-I496 HydrophobicContact CG2-CD1 4.05Å
446	A	94.3	Very high	86.1	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.9	173.8	0	0	0	0	0	109.6	A433 F434 Q436 Y448 V461	A433-A446 VanDerWaalsContact CA-O 3.23Å; A433-A446 WeakPolarHBondContact CA-O 3.37Å; F434-A446 HydrophobicContact CD2-CB 4.34Å; F434-A446 HydrophobicContact CE1-CB 4.39Å; F434-A446 HydrophobicContact CE2-CB 3.83Å; F434-A446 HydrophobicContact CZ-CB 3.86Å; F434-A446 PolarHBondContact N-O 3.26Å; F434-A446 VanDerWaalsContact N-O 3.14Å; F434-A446 PolarHBondContact O-N 2.89Å; Q436-A446 HydrophobicContact CG-CB 4.4Å; A446-Y448 HydrophobicContact CB-CD2 4.35Å; A446-Y448 HydrophobicContact CB-CE2 3.74Å; A446-V461 HydrophobicContact CB-CG2 4.1Å
447	I	95.4	Very high	86	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.9	179.6	-52.3	-177.8	0	0	0	108.3	F432 A433 I445 V459 T460 W474 I481 I496 A498	F432-I447 WeakPolarHBondContact O-CA 3.48Å; A433-I447 HydrophobicContact CB-CG1 4.09Å; I445-I447 HydrophobicContact CD1-CD1 4.45Å; I445-I447 HydrophobicContact CD1-CG1 4.32Å; I445-I447 HydrophobicContact CG1-CG1 4.31Å; I447-V459 HydrophobicContact CB-CB 4.43Å; I447-V459 HydrophobicContact CG2-CB 4.23Å; I447-V459 WeakPolarHBondContact O-CB 3.18Å; I447-V459 PolarHBondContact O-N 2.89Å; I447-T460 HydrophobicContact CB-CG2 4.04Å; I447-T460 HydrophobicContact CD1-CG2 3.76Å; I447-T460 HydrophobicContact CG1-CG2 4.03Å; I447-T460 PolarHBondContact N-O 2.54Å; I447-T460 PolarHBondContact O-N 2.8Å; I447-W474 HydrophobicContact CG2-CH2 4.44Å; I447-I481 HydrophobicContact CD1-CD1 3.74Å; I447-I481 HydrophobicContact CG1-CD1 4.25Å; I447-I496 HydrophobicContact CD1-CG2 4.4Å; I447-A498 HydrophobicContact CD1-CB 4.01Å
448	Y	94.7	Very high	86.1	Confident	20 Å²	20	65.5 Å²	65.5	8%	0.078	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	156	178.4	-73	-93.9	0	0	0	110.4	L414 R431 F432 F434 A446 V456 R457 E458	L414-Y448 HydrophobicContact CD1-CD1 4.44Å; L414-Y448 HydrophobicContact CD1-CE1 3.91Å; L414-Y448 HydrophobicContact CD2-CD1 4.04Å; L414-Y448 HydrophobicContact CD2-CD2 4.25Å; L414-Y448 HydrophobicContact CD2-CE1 4.09Å; L414-Y448 HydrophobicContact CD2-CE2 4.26Å; L414-Y448 HydrophobicContact CD2-CG 4.16Å; R431-Y448 CarbonylContact C-O 3.58Å; R431-Y448 WeakPolarHBondContact CA-O 3.31Å; R431-Y448 WeakPolarHBondContact CB-O 3.35Å; F432-Y448 HydrophobicContact CE2-CD2 4.05Å; F432-Y448 HydrophobicContact CE2-CG 4.12Å; F432-Y448 HydrophobicContact CZ-CD2 4.29Å; F432-Y448 AromaticContact CZ-CG 3.89Å; F432-Y448 HydrophobicContact CZ-CG 3.89Å; F432-Y448 PolarHBondContact N-O 3.03Å; F432-Y448 PolarHBondContact O-N 3.09Å; F434-Y448 AromaticContact CE1-CD2 3.6Å; F434-Y448 HydrophobicContact CE1-CD2 3.6Å; F434-Y448 AromaticContact CE1-CE2 3.59Å; F434-Y448 HydrophobicContact CE1-CE2 3.59Å; F434-Y448 HydrophobicContact CZ-CD2 4.04Å; F434-Y448 AromaticContact CZ-CE2 3.52Å; F434-Y448 HydrophobicContact CZ-CE2 3.52Å; A446-Y448 HydrophobicContact CB-CD2 4.35Å; A446-Y448 HydrophobicContact CB-CE2 3.74Å; Y448-V456 HydrophobicContact CD1-CG1 3.94Å; Y448-V456 HydrophobicContact CG-CG1 4.35Å; Y448-R457 CarbonylContact C-O 3.57Å; Y448-R457 VanDerWaalsContact CA-O 3.28Å; Y448-R457 WeakPolarHBondContact CA-O 3.16Å; Y448-E458 HydrophobicContact CD1-CB 4Å; Y448-E458 HydrophobicContact CD1-CG 4.46Å; Y448-E458 HydrophobicContact CE1-CB 3.54Å; Y448-E458 HydrophobicContact CE1-CG 3.85Å; Y448-E458 PolarHBondContact OH-OE2 3.09Å
449	D	94.1	Very high	86.5	Confident	30 Å²	30	65.5 Å²	65.5	16%	0.16	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.5	175.7	-170.2	23.3	0	0	0	111.3	T430 R431 S451 R457 V459	T430-D449 VanDerWaalsContact C-OD1 3.27Å; T430-D449 VanDerWaalsContact CB-OD1 3.22Å; T430-D449 WeakPolarHBondContact CB-OD1 3.26Å; T430-D449 PolarHBondContact OG1-OD1 3.32Å; R431-D449 HydrophobicContact CG-CB 3.95Å; D449-S451 PolarHBondContact OD2-OG 3.35Å; D449-R457 PolarHBondContact N-O 3.27Å; D449-R457 PolarHBondContact O-N 2.99Å; D449-V459 HydrophobicContact CB-CG2 3.58Å
450	V	91.1	Very high	87.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.325	C	S	.	.			trans	-105.3	58.8	177.3	-167.6	0	0	0	0	108.2	F371 I401 R403 W425 T430 F432 V456	F371-V450 HydrophobicContact CD1-CG1 4.01Å; F371-V450 HydrophobicContact CE1-CB 4.28Å; F371-V450 HydrophobicContact CE1-CG1 3.69Å; F371-V450 HydrophobicContact CZ-CB 4.41Å; F371-V450 HydrophobicContact CZ-CG1 4.28Å; I401-V450 HydrophobicContact CD1-CG2 4.13Å; I401-V450 HydrophobicContact CG2-CG1 4.33Å; I401-V450 HydrophobicContact CG2-CG2 4.31Å; R403-V450 VanDerWaalsContact CZ-CG1 3.43Å; W425-V450 HydrophobicContact CH2-CG2 4.21Å; W425-V450 HydrophobicContact CZ3-CG2 4.11Å; T430-V450 WeakPolarHBondContact O-CB 3.12Å; T430-V450 PolarHBondContact O-N 3.23Å; F432-V450 HydrophobicContact CD1-CG2 3.88Å; F432-V450 HydrophobicContact CE1-CG2 3.61Å; V450-V456 HydrophobicContact CG2-CG2 4.36Å
451	S	84.3	Confident	88	Confident	35 Å²	35	58 Å²	58	25%	0.245	31%	0.311	C	S	.	.			trans	-61.5	149.1	-178.9	-31.3	0	0	0	0	110.6	R403 D449 G453 T454	R403-S451 PolarHBondContact NH1-O 3.31Å; R403-S451 PolarHBondContact NH2-O 2.91Å; D449-S451 PolarHBondContact OD2-OG 3.35Å; S451-G453 PolarHBondContact O-N 2.85Å; S451-T454 PolarHBondContact O-OG1 2.93Å
452	R	74.8	Confident	88.6	Confident	206 Å²	206	57 Å²	57	78%	0.777	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	130.8	-179	-68.9	-174.3	-179.1	-172	-1.9	111	T454	R452-T454 VanDerWaalsContact C-N 3.28Å; R452-T454 PolarHBondContact O-N 2.83Å
453	G	70.9	Confident	88.9	Confident	74 Å²	74	55.4 Å²	55.4	76%	0.763	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	2.1	175.1	0	0	0	0	0	115.8	S451	S451-G453 PolarHBondContact O-N 2.85Å
454	T	75.7	Confident	88.9	Confident	75 Å²	75	55.4 Å²	55.4	46%	0.46	29%	0.292	S	S	.	.	S	Bend	trans	-123.5	152.5	173.6	58.6	0	0	0	0	110.4	R403 S451 R452	R403-T454 PolarHBondContact NH2-O 2.92Å; S451-T454 PolarHBondContact O-OG1 2.93Å; R452-T454 VanDerWaalsContact C-N 3.28Å; R452-T454 PolarHBondContact O-N 2.83Å
455	N	82.3	Confident	88.5	Confident	131 Å²	131	58 Å²	58	70%	0.701	31%	0.314	S	S	*	.			trans	-57.8	159.9	168	-64.9	-17.2	0	0	0	110.5	R457	N455-R457 PolarHBondContact O-N 3.43Å
456	V	89.7	Confident	88.1	Confident	26 Å²	26	58.2 Å²	58.2	16%	0.158	32%	0.315	C	S	.	.			trans	-53.8	125.3	175.5	-179.4	0	0	0	0	109.7	I401 D412 L414 F432 Y448 V450	I401-V456 HydrophobicContact CD1-CG1 4.41Å; I401-V456 HydrophobicContact CD1-CG2 3.89Å; D412-V456 HydrophobicContact CB-CG2 3.51Å; L414-V456 HydrophobicContact CD2-CG1 4.31Å; F432-V456 HydrophobicContact CE1-CG1 4.03Å; F432-V456 HydrophobicContact CZ-CG1 3.98Å; Y448-V456 HydrophobicContact CD1-CG1 3.94Å; Y448-V456 HydrophobicContact CG-CG1 4.35Å; V450-V456 HydrophobicContact CG2-CG2 4.36Å
457	R	90.5	Very high	87.7	Confident	176 Å²	176	62.9 Å²	62.9	66%	0.664	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	136.6	-176.3	176	178.1	174.4	-172.7	0.4	110.6	Y448 D449 N455 V459	Y448-R457 CarbonylContact C-O 3.57Å; Y448-R457 VanDerWaalsContact CA-O 3.28Å; Y448-R457 WeakPolarHBondContact CA-O 3.16Å; D449-R457 PolarHBondContact N-O 3.27Å; D449-R457 PolarHBondContact O-N 2.99Å; N455-R457 PolarHBondContact O-N 3.43Å; R457-V459 PolarHBondContact O-N 2.91Å
458	E	91.5	Very high	87.2	Confident	103 Å²	103	68.7 Å²	68.7	48%	0.481	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	122.3	167.4	-167.3	172.2	114.3	0	0	110.1	Y448 V461	Y448-E458 HydrophobicContact CD1-CB 4Å; Y448-E458 HydrophobicContact CD1-CG 4.46Å; Y448-E458 HydrophobicContact CE1-CB 3.54Å; Y448-E458 HydrophobicContact CE1-CG 3.85Å; Y448-E458 PolarHBondContact OH-OE2 3.09Å; E458-V461 HydrophobicContact CG-CG2 4.09Å; E458-V461 WeakPolarHBondContact OE1-CG2 3.32Å
459	V	89.9	Confident	87.1	Confident	63 Å²	63	68.1 Å²	68.1	38%	0.382	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-55.6	178.2	179.8	0	0	0	0	109.5	I447 D449 R457	I447-V459 HydrophobicContact CB-CB 4.43Å; I447-V459 HydrophobicContact CG2-CB 4.23Å; I447-V459 WeakPolarHBondContact O-CB 3.18Å; I447-V459 PolarHBondContact O-N 2.89Å; D449-V459 HydrophobicContact CB-CG2 3.58Å; R457-V459 PolarHBondContact O-N 2.91Å
460	T	91.8	Very high	87	Confident	28 Å²	28	70 Å²	70	17%	0.172	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	154.2	179.3	-166.6	0	0	0	0	110.7	I447 L462	I447-T460 HydrophobicContact CB-CG2 4.04Å; I447-T460 HydrophobicContact CD1-CG2 3.76Å; I447-T460 HydrophobicContact CG1-CG2 4.03Å; I447-T460 PolarHBondContact N-O 2.54Å; I447-T460 PolarHBondContact O-N 2.8Å; T460-L462 HydrophobicContact CG2-CD1 4.35Å; T460-L462 HydrophobicContact CG2-CG 4.25Å
461	V	92.4	Very high	87.2	Confident	49 Å²	49	70.5 Å²	70.5	30%	0.297	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.2	168.9	179.7	0	0	0	0	107.1	I445 A446 E458	I445-V461 WeakPolarHBondContact O-CA 3.22Å; A446-V461 HydrophobicContact CB-CG2 4.1Å; E458-V461 HydrophobicContact CG-CG2 4.09Å; E458-V461 WeakPolarHBondContact OE1-CG2 3.32Å
462	L	92.5	Very high	87.7	Confident	29 Å²	29	68.9 Å²	68.9	15%	0.152	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.9	-177.2	-59.7	171.3	0	0	0	110.1	S444 I445 T460 L464 I496 G501 I503	S444-L462 CarbonylContact C-O 3.55Å; S444-L462 WeakPolarHBondContact CA-O 3.46Å; S444-L462 WeakPolarHBondContact CB-O 3.28Å; I445-L462 HydrophobicContact CG2-CB 3.72Å; I445-L462 PolarHBondContact N-O 2.91Å; I445-L462 PolarHBondContact O-N 3.1Å; T460-L462 HydrophobicContact CG2-CD1 4.35Å; T460-L462 HydrophobicContact CG2-CG 4.25Å; L462-L464 PolarHBondContact O-N 2.91Å; L462-I496 HydrophobicContact CD1-CG2 3.73Å; L462-G501 WeakPolarHBondContact CD2-O 3.14Å; L462-I503 HydrophobicContact CD1-CG1 4.46Å
463	D	91.9	Very high	88.7	Confident	95 Å²	95	63.4 Å²	63.4	51%	0.508	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	126.3	171.9	-77.4	-9.8	0	0	0	109.3	K442	K442-D463 IonicContact NZ-OD2 2.69Å
464	L	91.1	Very high	89.8	Confident	18 Å²	18	60.6 Å²	60.6	9%	0.094	31%	0.313	C	S	.	.			trans	-86.2	147.2	177.1	-63.6	177.5	0	0	0	110.1	L435 L443 I445 L462 T469 A483 E494 I496	L435-L464 HydrophobicContact CD2-CD1 3.67Å; L443-L464 HydrophobicContact CD2-CD1 4.2Å; L443-L464 HydrophobicContact CG-CD1 4.28Å; L443-L464 PolarHBondContact O-N 2.77Å; I445-L464 HydrophobicContact CG2-CD2 4.02Å; I445-L464 HydrophobicContact CG2-CG 4.43Å; L462-L464 PolarHBondContact O-N 2.91Å; L464-T469 HydrophobicContact CD1-CG2 3.87Å; L464-A483 HydrophobicContact CD1-CB 4.19Å; L464-A483 HydrophobicContact CD2-CB 4.07Å; L464-E494 WeakPolarHBondContact CB-OE2 3.3Å; L464-I496 HydrophobicContact CD2-CD1 4.15Å
465	A	86	Confident	90.7	Very high	60 Å²	60	57.2 Å²	57.2	50%	0.496	29%	0.292	S	S	.	.	S	Bend	trans	-73.3	-35.2	-178	0	0	0	0	0	112.4	E494	A465-E494 WeakPolarHBondContact CB-OE1 3.27Å; A465-E494 PolarHBondContact N-OE1 3.45Å; A465-E494 PolarHBondContact N-OE2 3.36Å
466	S	85.3	Confident	91.2	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.028	27%	0.27	C	S	.	.			trans	-97.6	122.5	-179.8	-175.3	0	0	0	0	111.1	R468 T469	S466-R468 PolarHBondContact O-N 3.07Å; S466-R468 PolarHBondContact OG-N 3.19Å; S466-T469 PolarHBondContact O-N 3.33Å; S466-T469 PolarHBondContact O-OG1 3.16Å
467	P	85	Confident	91.2	Very high	98 Å²	98	57.9 Å²	57.9	64%	0.636	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-5.9	171.1	31.7	-35.3	0	0	0	112.4
468	R	86.7	Confident	91.2	Very high	122 Å²	122	50 Å²	50	46%	0.46	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	4.8	-179.2	-64	-169.2	-84.3	-166.4	-4.9	113.6	S466 N470 D490	S466-R468 PolarHBondContact O-N 3.07Å; S466-R468 PolarHBondContact OG-N 3.19Å; R468-N470 PolarHBondContact O-N 3.46Å; R468-D490 IonicContact CZ-OD1 3.73Å; R468-D490 IonicContact CZ-OD2 2.94Å; R468-D490 IonicContact NE-OD2 3.19Å; R468-D490 IonicContact NH2-OD1 2.69Å; R468-D490 PolarHBondContact NH2-OD1 3.38Å; R468-D490 IonicContact NH2-OD2 3.88Å; R468-D490 PolarHBondContact NH2-OD2 2.75Å
469	T	91.4	Very high	91.2	Very high	9 Å²	9	45.5 Å²	45.5	6%	0.055	25%	0.245	C	C	.	.			trans	-62.6	128.4	175	-58.4	0	0	0	0	109.9	L435 L443 L464 S466 A483 A484	L435-T469 HydrophobicContact CD1-CG2 4.14Å; L435-T469 HydrophobicContact CD2-CG2 4.26Å; L443-T469 HydrophobicContact CD2-CG2 4.5Å; L443-T469 VanDerWaalsContact CD2-O 3.25Å; L443-T469 WeakPolarHBondContact CD2-O 3.36Å; L464-T469 HydrophobicContact CD1-CG2 3.87Å; S466-T469 PolarHBondContact O-N 3.33Å; S466-T469 PolarHBondContact O-OG1 3.16Å; T469-A483 HydrophobicContact CG2-CB 3.91Å; T469-A484 WeakPolarHBondContact CG2-O 3.42Å
470	N	93.1	Very high	91.5	Very high	69 Å²	69	43.9 Å²	43.9	37%	0.369	23%	0.234	S	C	.	.			trans	-137.5	-11.3	-178.6	60.9	14.8	0	0	0	112.9	N422 R468 A484 L486	N422-N470 PolarHBondContact ND2-O 2.86Å; N422-N470 PolarHBondContact OD1-O 3.18Å; R468-N470 PolarHBondContact O-N 3.46Å; N470-A484 PolarHBondContact N-O 2.79Å; N470-A484 PolarHBondContact OD1-O 3.17Å; N470-L486 PolarHBondContact ND2-O 2.85Å; N470-L486 WeakPolarHBondContact OD1-CB 3.45Å; N470-L486 PolarHBondContact OD1-N 3.24Å
471	D	94.4	Very high	91.6	Very high	11 Å²	11	42.6 Å²	42.6	6%	0.059	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	130.8	177.1	-177.7	105.3	0	0	0	113.3	N422 R473 A483 A484 L486	N422-D471 WeakPolarHBondContact ND2-CB 3.3Å; N422-D471 PolarHBondContact ND2-OD1 2.86Å; D471-R473 IonicContact OD1-CZ 2.62Å; D471-R473 IonicContact OD1-NE 3.32Å; D471-R473 PolarHBondContact OD1-NE 3.27Å; D471-R473 IonicContact OD1-NH2 3.98Å; D471-R473 WeakPolarHBondContact OD2-CG 3.48Å; D471-R473 IonicContact OD2-NE 3.15Å; D471-R473 PolarHBondContact OD2-NE 3.34Å; D471-R473 IonicContact OD2-NH2 3.8Å; D471-A483 WeakPolarHBondContact O-CA 3.43Å; D471-A484 WeakPolarHBondContact CA-O 3.33Å; D471-A484 PolarHBondContact N-O 3.27Å; D471-A484 PolarHBondContact O-N 3.37Å; D471-L486 HydrophobicContact CB-CD1 3.71Å; D471-L486 HydrophobicContact CB-CG 3.99Å
472	L	94.7	Very high	91.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	123.2	164.8	-165.2	74	0	0	0	110.5	N422 Q424 A433 L435 I445 I481 A483	N422-L472 HydrophobicContact CB-CB 4.11Å; Q424-L472 HydrophobicContact CB-CD2 4.45Å; Q424-L472 HydrophobicContact CG-CB 4.42Å; Q424-L472 WeakPolarHBondContact CG-O 3.37Å; A433-L472 HydrophobicContact CB-CD2 3.75Å; L435-L472 HydrophobicContact CD2-CD1 4.33Å; I445-L472 HydrophobicContact CD1-CD1 3.66Å; I445-L472 HydrophobicContact CD1-CD2 4.41Å; I445-L472 HydrophobicContact CG1-CD1 4.34Å; L472-I481 HydrophobicContact CD1-CG2 3.38Å; L472-I481 HydrophobicContact CD2-CG2 4.39Å; L472-I481 HydrophobicContact CG-CG2 3.7Å; L472-A483 HydrophobicContact CD1-CB 4.11Å
473	R	94.9	Very high	91.9	Very high	91 Å²	91	38.9 Å²	38.9	34%	0.343	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	115.5	-176.8	-60.9	-64.2	176.1	135.9	13.2	112.4	D471 V482 W517	D471-R473 IonicContact OD1-CZ 2.62Å; D471-R473 IonicContact OD1-NE 3.32Å; D471-R473 PolarHBondContact OD1-NE 3.27Å; D471-R473 IonicContact OD1-NH2 3.98Å; D471-R473 WeakPolarHBondContact OD2-CG 3.48Å; D471-R473 IonicContact OD2-NE 3.15Å; D471-R473 PolarHBondContact OD2-NE 3.34Å; D471-R473 IonicContact OD2-NH2 3.8Å; R473-V482 PolarHBondContact N-O 2.84Å; R473-V482 PolarHBondContact O-N 2.98Å; R473-W517 PolarHBondContact O-NE1 3.27Å
474	W	95.5	Very high	92	Very high	16 Å²	16	34.4 Å²	34.4	6%	0.061	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	144.3	169.6	-73.1	90.8	0	0	0	111.4	Q424 W425 E426 P427 R431 A433 I447 I481 A498 W517	Q424-W474 VanDerWaalsContact CB-CD1 3.49Å; Q424-W474 PolarHBondContact O-NE1 3.37Å; Q424-W474 VanDerWaalsContact O-NE1 3.09Å; W425-W474 VanDerWaalsContact O-CD1 3.24Å; E426-W474 HydrophobicContact CB-CD2 4.13Å; E426-W474 HydrophobicContact CB-CE3 4.04Å; E426-W474 HydrophobicContact CB-CH2 4.11Å; E426-W474 HydrophobicContact CB-CZ2 4.2Å; E426-W474 HydrophobicContact CB-CZ3 4.05Å; E426-W474 HydrophobicContact CG-CD2 4.44Å; E426-W474 HydrophobicContact CG-CE3 3.92Å; E426-W474 HydrophobicContact CG-CH2 4.46Å; E426-W474 HydrophobicContact CG-CZ3 3.94Å; P427-W474 HydrophobicContact CG-CB 4.26Å; R431-W474 HydrophobicContact CB-CH2 4.26Å; A433-W474 HydrophobicContact CB-CZ2 3.65Å; I447-W474 HydrophobicContact CG2-CH2 4.44Å; W474-I481 HydrophobicContact CD2-CD1 4Å; W474-I481 HydrophobicContact CD2-CG1 3.56Å; W474-I481 HydrophobicContact CE3-CD1 4.05Å; W474-I481 HydrophobicContact CE3-CG1 3.43Å; W474-I481 VanDerWaalsContact CE3-CG1 3.43Å; W474-I481 HydrophobicContact CG-CG1 4.32Å; W474-I481 HydrophobicContact CH2-CD1 3.4Å; W474-I481 HydrophobicContact CH2-CG1 3.74Å; W474-I481 HydrophobicContact CZ2-CD1 3.32Å; W474-I481 HydrophobicContact CZ2-CG1 3.85Å; W474-I481 HydrophobicContact CZ3-CD1 3.76Å; W474-I481 HydrophobicContact CZ3-CG1 3.51Å; W474-A498 HydrophobicContact CH2-CB 3.7Å; W474-A498 HydrophobicContact CZ3-CB 3.67Å; W474-W517 VanDerWaalsContact C-NE1 3.34Å; W474-W517 PolarHBondContact O-NE1 2.99Å
475	S	95	Very high	92.1	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.021	18%	0.177	C	C	.	.			trans	-57.7	142.6	163.3	175.4	0	0	0	0	109.8	K477 G478 I480 G521	S475-K477 PolarHBondContact O-N 2.96Å; S475-G478 PolarHBondContact O-N 2.9Å; S475-I480 PolarHBondContact N-O 2.69Å; S475-G521 WeakPolarHBondContact OG-CA 3.4Å; S475-G521 PolarHBondContact OG-O 2.99Å
476	S	92.1	Very high	92.4	Very high	32 Å²	32	31.6 Å²	31.6	22%	0.224	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.9	-178.9	65.7	0	0	0	0	114	D518 P519 G521	S476-D518 PolarHBondContact OG-O 3.35Å; S476-P519 PolarHBondContact OG-O 3.2Å; S476-G521 VanDerWaalsContact OG-CA 3.32Å; S476-G521 WeakPolarHBondContact OG-CA 3.28Å; S476-G521 PolarHBondContact OG-N 3.3Å
477	K	88.9	Confident	92.6	Very high	140 Å²	140	39 Å²	39	61%	0.609	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-1.3	173.8	-63.7	-58.8	-177.3	-166	0	114	S475 T520	S475-K477 PolarHBondContact O-N 2.96Å; K477-T520 WeakPolarHBondContact CG-O 3.46Å
478	G	91.7	Very high	92.7	Very high	10 Å²	10	34.9 Å²	34.9	10%	0.103	16%	0.159	C	C	.	.	S	Bend	trans	78	-169.1	-173.9	0	0	0	0	0	113.4	E426 S475 I480	E426-G478 VanDerWaalsContact OE1-CA 3.31Å; E426-G478 WeakPolarHBondContact OE1-CA 3.48Å; S475-G478 PolarHBondContact O-N 2.9Å; G478-I480 PolarHBondContact O-N 3.39Å
479	G	92	Very high	92.6	Very high	8 Å²	8	32.1 Å²	32.1	8%	0.082	16%	0.162	C	C	.	.	S	Bend	trans	77.2	-33.6	178.1	0	0	0	0	0	115.4	E426 A498	E426-G479 PolarHBondContact OE1-N 3.26Å; G479-A498 WeakPolarHBondContact O-CB 3.23Å; G479-A498 PolarHBondContact O-N 3.12Å
480	I	94.6	Very high	92.3	Very high	30 Å²	30	35 Å²	35	15%	0.154	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.6	-176.8	-58.6	169.6	0	0	0	109.9	S475 G478 I496 W517 C544	S475-I480 PolarHBondContact N-O 2.69Å; G478-I480 PolarHBondContact O-N 3.39Å; I480-I496 WeakPolarHBondContact CA-O 3.47Å; I480-W517 HydrophobicContact CB-CH2 4.42Å; I480-W517 HydrophobicContact CG2-CH2 3.89Å; I480-W517 HydrophobicContact CG2-CZ2 4.05Å; I480-C544 HydrophobicContact CD1-CB 3.71Å
481	I	95.2	Very high	92	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.9	176.7	-46.9	173.6	0	0	0	108.6	A433 I445 I447 L472 W474 I496 A498	A433-I481 HydrophobicContact CB-CD1 3.79Å; I445-I481 HydrophobicContact CD1-CD1 3.82Å; I445-I481 HydrophobicContact CD1-CG2 4.23Å; I447-I481 HydrophobicContact CD1-CD1 3.74Å; I447-I481 HydrophobicContact CG1-CD1 4.25Å; L472-I481 HydrophobicContact CD1-CG2 3.38Å; L472-I481 HydrophobicContact CD2-CG2 4.39Å; L472-I481 HydrophobicContact CG-CG2 3.7Å; W474-I481 HydrophobicContact CD2-CD1 4Å; W474-I481 HydrophobicContact CD2-CG1 3.56Å; W474-I481 HydrophobicContact CE3-CD1 4.05Å; W474-I481 HydrophobicContact CE3-CG1 3.43Å; W474-I481 VanDerWaalsContact CE3-CG1 3.43Å; W474-I481 HydrophobicContact CG-CG1 4.32Å; W474-I481 HydrophobicContact CH2-CD1 3.4Å; W474-I481 HydrophobicContact CH2-CG1 3.74Å; W474-I481 HydrophobicContact CZ2-CD1 3.32Å; W474-I481 HydrophobicContact CZ2-CG1 3.85Å; W474-I481 HydrophobicContact CZ3-CD1 3.76Å; W474-I481 HydrophobicContact CZ3-CG1 3.51Å; I481-I496 HydrophobicContact CB-CB 4.41Å; I481-I496 PolarHBondContact N-O 2.78Å; I481-I496 PolarHBondContact O-N 3.3Å; I481-A498 HydrophobicContact CD1-CB 4.38Å
482	V	95.4	Very high	91.9	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.2	163.3	-179.8	0	0	0	0	109.2	R473 L493 E494 F495 W517 I524	R473-V482 PolarHBondContact N-O 2.84Å; R473-V482 PolarHBondContact O-N 2.98Å; V482-L493 HydrophobicContact CG1-CB 4.39Å; V482-L493 HydrophobicContact CG1-CD2 4.48Å; V482-E494 WeakPolarHBondContact CA-O 3.13Å; V482-F495 HydrophobicContact CG2-CD1 3.5Å; V482-F495 HydrophobicContact CG2-CE1 3.52Å; V482-F495 HydrophobicContact CG2-CG 4.11Å; V482-F495 HydrophobicContact CG2-CZ 4.14Å; V482-W517 HydrophobicContact CG2-CH2 4.37Å; V482-W517 HydrophobicContact CG2-CZ2 3.64Å; V482-I524 HydrophobicContact CB-CD1 3.86Å; V482-I524 HydrophobicContact CG1-CD1 4.16Å; V482-I524 HydrophobicContact CG2-CD1 3.46Å; V482-I524 VanDerWaalsContact CG2-CD1 3.46Å
483	A	95.3	Very high	91.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	129.5	167.2	0	0	0	0	0	108.3	L464 T469 D471 L472 L493 E494 I496	L464-A483 HydrophobicContact CD1-CB 4.19Å; L464-A483 HydrophobicContact CD2-CB 4.07Å; T469-A483 HydrophobicContact CG2-CB 3.91Å; D471-A483 WeakPolarHBondContact O-CA 3.43Å; L472-A483 HydrophobicContact CD1-CB 4.11Å; A483-L493 WeakPolarHBondContact O-CA 3.24Å; A483-E494 PolarHBondContact N-O 2.85Å; A483-E494 PolarHBondContact O-N 2.97Å; A483-I496 HydrophobicContact CB-CD1 3.9Å
484	A	94.3	Very high	91.8	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	145.5	-175.4	0	0	0	0	0	114.1	T469 N470 D471 L486 L493 I515	T469-A484 WeakPolarHBondContact CG2-O 3.42Å; N470-A484 PolarHBondContact N-O 2.79Å; N470-A484 PolarHBondContact OD1-O 3.17Å; D471-A484 WeakPolarHBondContact CA-O 3.33Å; D471-A484 PolarHBondContact N-O 3.27Å; D471-A484 PolarHBondContact O-N 3.37Å; A484-L486 HydrophobicContact CB-CD2 4.23Å; A484-L486 PolarHBondContact O-N 3.37Å; A484-L493 HydrophobicContact CB-CD2 3.48Å; A484-L493 VanDerWaalsContact CB-CD2 3.48Å; A484-I515 HydrophobicContact CB-CD1 3.09Å
485	G	92.4	Very high	91.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.			trans	-90.9	82.4	166.9	0	0	0	0	0	111.7	S488 I492	G485-S488 WeakPolarHBondContact O-CB 3.22Å; G485-S488 PolarHBondContact O-OG 2.77Å; G485-I492 PolarHBondContact N-O 2.87Å; G485-I492 VanDerWaalsContact N-O 3.17Å
486	L	92.4	Very high	91.8	Very high	18 Å²	18	27.6 Å²	27.6	9%	0.094	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	143.2	177.3	-58.3	-173.2	0	0	0	111.2	N470 D471 A484 S488 V512 I515	N470-L486 PolarHBondContact ND2-O 2.85Å; N470-L486 WeakPolarHBondContact OD1-CB 3.45Å; N470-L486 PolarHBondContact OD1-N 3.24Å; D471-L486 HydrophobicContact CB-CD1 3.71Å; D471-L486 HydrophobicContact CB-CG 3.99Å; A484-L486 HydrophobicContact CB-CD2 4.23Å; A484-L486 PolarHBondContact O-N 3.37Å; L486-S488 PolarHBondContact O-N 3.42Å; L486-S488 VanDerWaalsContact O-N 3.14Å; L486-V512 WeakPolarHBondContact CA-O 3.47Å; L486-V512 HydrophobicContact CD2-CG1 4.13Å; L486-V512 HydrophobicContact CD2-CG2 4.17Å; L486-I515 HydrophobicContact CD2-CD1 3.55Å; L486-I515 HydrophobicContact CD2-CG1 3.68Å
487	R	89.6	Confident	92	Very high	159 Å²	159	26.3 Å²	26.3	60%	0.6	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	21.3	178.1	-49	174.2	-166.4	170	4.1	113.2	V512 Y532	R487-V512 PolarHBondContact N-O 3.38Å; R487-Y532 HydrophobicContact CG-CD1 4.44Å; R487-Y532 VanDerWaalsContact CZ-CE1 3.46Å; R487-Y532 PolarHBondContact NH2-OH 3.22Å
488	S	86.7	Confident	92.1	Very high	13 Å²	13	19.7 Å²	19.7	9%	0.091	11%	0.108	C	C	.	.			trans	-95.8	153.4	172.3	73.7	0	0	0	0	110.4	G485 L486 G491 T511	G485-S488 WeakPolarHBondContact O-CB 3.22Å; G485-S488 PolarHBondContact O-OG 2.77Å; L486-S488 PolarHBondContact O-N 3.42Å; L486-S488 VanDerWaalsContact O-N 3.14Å; S488-G491 PolarHBondContact OG-N 2.89Å; S488-G491 VanDerWaalsContact OG-N 3.12Å; S488-T511 VanDerWaalsContact O-CA 3.29Å; S488-T511 WeakPolarHBondContact O-CA 3.5Å; S488-T511 PolarHBondContact O-N 2.83Å; S488-T511 VanDerWaalsContact O-N 3.1Å
489	A	86.1	Confident	92.1	Very high	64 Å²	64	24.5 Å²	24.5	53%	0.529	13%	0.131	S	C	.	.	S	Bend	trans	-62	-45.4	178.5	0	0	0	0	0	111.6	P510 T511	A489-P510 VanDerWaalsContact O-CA 3.3Å; A489-P510 WeakPolarHBondContact O-CA 3.46Å; A489-P510 WeakPolarHBondContact O-CB 3.35Å; A489-T511 PolarHBondContact O-N 3.09Å
490	D	85	Confident	92	Very high	69 Å²	69	29.2 Å²	29.2	37%	0.369	15%	0.154	S	C	.	.	S	Bend	trans	-74	-35.7	-175.7	-43.8	-6	0	0	0	112.3	R468 I492	R468-D490 IonicContact CZ-OD1 3.73Å; R468-D490 IonicContact CZ-OD2 2.94Å; R468-D490 IonicContact NE-OD2 3.19Å; R468-D490 IonicContact NH2-OD1 2.69Å; R468-D490 PolarHBondContact NH2-OD1 3.38Å; R468-D490 IonicContact NH2-OD2 3.88Å; R468-D490 PolarHBondContact NH2-OD2 2.75Å; D490-I492 HydrophobicContact CB-CD1 4.2Å; D490-I492 HydrophobicContact CB-CG1 4.01Å; D490-I492 PolarHBondContact O-N 2.68Å
491	G	85.5	Confident	91.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.			trans	58.2	42.2	176.2	0	0	0	0	0	114.4	S488 H509	S488-G491 PolarHBondContact OG-N 2.89Å; S488-G491 VanDerWaalsContact OG-N 3.12Å; G491-H509 WeakPolarHBondContact CA-O 3.15Å; G491-H509 PolarHBondContact O-N 3.11Å
492	I	92.2	Very high	91.7	Very high	33 Å²	33	34.5 Å²	34.5	17%	0.169	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.8	-179.6	-59.7	168.8	0	0	0	110.1	G485 D490 E494	G485-I492 PolarHBondContact N-O 2.87Å; G485-I492 VanDerWaalsContact N-O 3.17Å; D490-I492 HydrophobicContact CB-CD1 4.2Å; D490-I492 HydrophobicContact CB-CG1 4.01Å; D490-I492 PolarHBondContact O-N 2.68Å; I492-E494 HydrophobicContact CG2-CG 4.1Å
493	L	94.3	Very high	91.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.3	176.4	-53.8	174.6	0	0	0	108.5	V482 A483 A484 F495 K506 G507 H509 I515 T526 W542	V482-L493 HydrophobicContact CG1-CB 4.39Å; V482-L493 HydrophobicContact CG1-CD2 4.48Å; A483-L493 WeakPolarHBondContact O-CA 3.24Å; A484-L493 HydrophobicContact CB-CD2 3.48Å; A484-L493 VanDerWaalsContact CB-CD2 3.48Å; L493-F495 HydrophobicContact CB-CE2 4.07Å; L493-K506 CarbonylContact O-C 3.54Å; L493-K506 WeakPolarHBondContact O-CA 3.29Å; L493-G507 PolarHBondContact N-O 3.11Å; L493-G507 PolarHBondContact O-N 2.86Å; L493-H509 HydrophobicContact CD1-CB 4.32Å; L493-I515 HydrophobicContact CD2-CD1 3.5Å; L493-T526 HydrophobicContact CD1-CG2 3.73Å; L493-T526 HydrophobicContact CD2-CG2 4.49Å; L493-W542 HydrophobicContact CD1-CH2 4.36Å; L493-W542 HydrophobicContact CD1-CZ2 3.76Å
494	E	94.7	Very high	91.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	116.9	175.7	-60.9	-170.4	99.1	0	0	109.3	L464 A465 V482 A483 I492 I503 K506	L464-E494 WeakPolarHBondContact CB-OE2 3.3Å; A465-E494 WeakPolarHBondContact CB-OE1 3.27Å; A465-E494 PolarHBondContact N-OE1 3.45Å; A465-E494 PolarHBondContact N-OE2 3.36Å; V482-E494 WeakPolarHBondContact CA-O 3.13Å; A483-E494 PolarHBondContact N-O 2.85Å; A483-E494 PolarHBondContact O-N 2.97Å; I492-E494 HydrophobicContact CG2-CG 4.1Å; E494-I503 HydrophobicContact CB-CG2 4.4Å; E494-K506 HydrophobicContact CG-CG 4.3Å; E494-K506 WeakPolarHBondContact OE1-CE 3.39Å; E494-K506 IonicContact OE1-NZ 3.62Å; E494-K506 PolarHBondContact OE1-NZ 2.97Å
495	F	95.6	Very high	91.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.1	179	-69.7	-103	0	0	0	108.8	V482 L493 I503 L504 A505 I524 W542 G546	V482-F495 HydrophobicContact CG2-CD1 3.5Å; V482-F495 HydrophobicContact CG2-CE1 3.52Å; V482-F495 HydrophobicContact CG2-CG 4.11Å; V482-F495 HydrophobicContact CG2-CZ 4.14Å; L493-F495 HydrophobicContact CB-CE2 4.07Å; F495-I503 CarbonylContact O-C 3.51Å; F495-I503 WeakPolarHBondContact O-CA 3.04Å; F495-L504 HydrophobicContact CB-CB 4.49Å; F495-L504 PolarHBondContact O-N 2.87Å; F495-A505 HydrophobicContact CB-CB 4.38Å; F495-A505 PolarHBondContact N-O 3.31Å; F495-I524 HydrophobicContact CE1-CG2 3.79Å; F495-I524 HydrophobicContact CZ-CG2 3.93Å; F495-W542 HydrophobicContact CE2-CE3 4.45Å; F495-W542 HydrophobicContact CZ-CB 4.04Å; F495-W542 HydrophobicContact CZ-CD2 4.38Å; F495-W542 HydrophobicContact CZ-CE3 4.46Å; F495-W542 HydrophobicContact CZ-CG 4.21Å; F495-G546 VanDerWaalsContact CD2-CA 3.47Å
496	I	95.1	Very high	91.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.1	-170.8	-62.7	148.3	0	0	0	109.4	I445 I447 L462 L464 I480 I481 A483 Q502 I503	I445-I496 HydrophobicContact CD1-CD1 3.87Å; I445-I496 HydrophobicContact CG2-CD1 4.05Å; I447-I496 HydrophobicContact CD1-CG2 4.4Å; L462-I496 HydrophobicContact CD1-CG2 3.73Å; L464-I496 HydrophobicContact CD2-CD1 4.15Å; I480-I496 WeakPolarHBondContact CA-O 3.47Å; I481-I496 HydrophobicContact CB-CB 4.41Å; I481-I496 PolarHBondContact N-O 2.78Å; I481-I496 PolarHBondContact O-N 3.3Å; A483-I496 HydrophobicContact CB-CD1 3.9Å; I496-Q502 WeakPolarHBondContact CA-O 3.47Å; I496-I503 HydrophobicContact CG1-CG1 4.09Å
497	S	94.9	Very high	91.5	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	112.5	166.7	179.3	0	0	0	0	108.6	N499 D500 G501 Q502	S497-N499 PolarHBondContact O-N 2.95Å; S497-N499 PolarHBondContact OG-N 2.94Å; S497-D500 WeakPolarHBondContact CB-OD2 3.24Å; S497-D500 PolarHBondContact OG-N 2.92Å; S497-D500 PolarHBondContact OG-OD2 2.8Å; S497-G501 VanDerWaalsContact O-CA 3.31Å; S497-G501 WeakPolarHBondContact O-CA 3.39Å; S497-G501 PolarHBondContact O-N 2.9Å; S497-Q502 PolarHBondContact N-O 2.96Å; S497-Q502 PolarHBondContact O-N 2.56Å
498	A	92.3	Very high	91.6	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.008	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-21.2	173.7	0	0	0	0	0	112.1	R431 I447 W474 G479 I481	R431-A498 PolarHBondContact NH1-O 2.91Å; I447-A498 HydrophobicContact CD1-CB 4.01Å; W474-A498 HydrophobicContact CH2-CB 3.7Å; W474-A498 HydrophobicContact CZ3-CB 3.67Å; G479-A498 WeakPolarHBondContact O-CB 3.23Å; G479-A498 PolarHBondContact O-N 3.12Å; I481-A498 HydrophobicContact CD1-CB 4.38Å
499	N	90.3	Very high	91.9	Very high	110 Å²	110	45.7 Å²	45.7	59%	0.588	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-44.7	178.4	-65	-17.6	0	0	0	111.5	R431 S497	R431-N499 PolarHBondContact NH1-OD1 2.96Å; R431-N499 PolarHBondContact NH2-OD1 2.67Å; S497-N499 PolarHBondContact O-N 2.95Å; S497-N499 PolarHBondContact OG-N 2.94Å
500	D	89.9	Confident	92.1	Very high	107 Å²	107	45.9 Å²	45.9	57%	0.572	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-15.3	-179.5	-50	-56.6	0	0	0	111.8	S497	S497-D500 WeakPolarHBondContact CB-OD2 3.24Å; S497-D500 PolarHBondContact OG-N 2.92Å; S497-D500 PolarHBondContact OG-OD2 2.8Å
501	G	90.7	Very high	92.4	Very high	15 Å²	15	44.6 Å²	44.6	16%	0.155	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	41.1	-176.3	0	0	0	0	0	112.2	L462 S497	L462-G501 WeakPolarHBondContact CD2-O 3.14Å; S497-G501 VanDerWaalsContact O-CA 3.31Å; S497-G501 WeakPolarHBondContact O-CA 3.39Å; S497-G501 PolarHBondContact O-N 2.9Å
502	Q	93	Very high	92.8	Very high	126 Å²	126	44.6 Å²	44.6	59%	0.589	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140	151.8	-173.9	-67.5	177.6	15.6	0	0	112	I496 S497 L504	I496-Q502 WeakPolarHBondContact CA-O 3.47Å; S497-Q502 PolarHBondContact N-O 2.96Å; S497-Q502 PolarHBondContact O-N 2.56Å; Q502-L504 PolarHBondContact O-N 3.22Å
503	I	93.1	Very high	92.9	Very high	56 Å²	56	43.2 Å²	43.2	29%	0.287	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	116	169.9	-58.3	170.9	0	0	0	107.7	L462 E494 F495 I496 K506	L462-I503 HydrophobicContact CD1-CG1 4.46Å; E494-I503 HydrophobicContact CB-CG2 4.4Å; F495-I503 CarbonylContact O-C 3.51Å; F495-I503 WeakPolarHBondContact O-CA 3.04Å; I496-I503 HydrophobicContact CG1-CG1 4.09Å; I503-K506 HydrophobicContact CG2-CG 4.4Å
504	L	92.9	Very high	92.9	Very high	74 Å²	74	45.4 Å²	45.4	39%	0.387	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-44	-178.9	-64.6	177.6	0	0	0	112.3	F495 Q502	F495-L504 HydrophobicContact CB-CB 4.49Å; F495-L504 PolarHBondContact O-N 2.87Å; Q502-L504 PolarHBondContact O-N 3.22Å
505	A	93.7	Very high	92.9	Very high	26 Å²	26	45.4 Å²	45.4	22%	0.215	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	159.1	-174.1	0	0	0	0	0	111.5	F495 V545	F495-A505 HydrophobicContact CB-CB 4.38Å; F495-A505 PolarHBondContact N-O 3.31Å; A505-V545 WeakPolarHBondContact CB-O 3.26Å
506	K	93.4	Very high	92.9	Very high	127 Å²	127	47.7 Å²	47.7	55%	0.552	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.1	171.5	-58.8	-172.2	-179.5	-169.8	0	108.8	L493 E494 I503	L493-K506 CarbonylContact O-C 3.54Å; L493-K506 WeakPolarHBondContact O-CA 3.29Å; E494-K506 HydrophobicContact CG-CG 4.3Å; E494-K506 WeakPolarHBondContact OE1-CE 3.39Å; E494-K506 IonicContact OE1-NZ 3.62Å; E494-K506 PolarHBondContact OE1-NZ 2.97Å; I503-K506 HydrophobicContact CG2-CG 4.4Å
507	G	92.5	Very high	92.9	Very high	6 Å²	6	49 Å²	49	6%	0.062	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	155.3	174	0	0	0	0	0	110.2	L493	L493-G507 PolarHBondContact N-O 3.11Å; L493-G507 PolarHBondContact O-N 2.86Å
508	E	92.3	Very high	92.9	Very high	135 Å²	135	48.8 Å²	48.8	63%	0.631	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.4	176.8	-67.2	176.5	-169.9	0	0	108.7	W540	E508-W540 WeakPolarHBondContact O-CZ3 3.36Å
509	H	92.4	Very high	92.9	Very high	4 Å²	4	50 Å²	50	2%	0.019	26%	0.264	C	S	.	.			trans	-136.7	91.5	171.3	-174.2	-166.3	0	0	0	109.1	G491 L493 T511 V512 T526 V528 W540 W542	G491-H509 WeakPolarHBondContact CA-O 3.15Å; G491-H509 PolarHBondContact O-N 3.11Å; L493-H509 HydrophobicContact CD1-CB 4.32Å; H509-T511 PolarHBondContact O-N 3.13Å; H509-V512 HydrophobicContact CB-CB 4.32Å; H509-V512 WeakPolarHBondContact O-CB 3.25Å; H509-V512 PolarHBondContact O-N 3.24Å; H509-T526 PolarHBondContact CE1-O 3.31Å; H509-T526 WeakPolarHBondContact ND1-CB 3.47Å; H509-T526 PolarHBondContact ND1-OG1 2.97Å; H509-V528 WeakPolarHBondContact NE2-CG2 3.36Å; H509-W540 HydrophobicContact CB-CE3 4.3Å; H509-W540 HydrophobicContact CB-CZ3 4.43Å; H509-W540 AromaticContact CD2-CD1 3.99Å; H509-W540 AromaticContact CD2-CD2 3.66Å; H509-W540 AromaticContact CD2-CE2 3.4Å; H509-W540 VanDerWaalsContact CD2-CE2 3.4Å; H509-W540 AromaticContact CD2-CZ2 3.7Å; H509-W540 AromaticContact CD2-NE1 3.65Å; H509-W540 AromaticContact CE1-CD1 3.67Å; H509-W540 AromaticContact CE1-CG 3.81Å; H509-W540 AromaticContact CG-CD2 3.96Å; H509-W540 AromaticContact NE2-CD1 3.38Å; H509-W540 AromaticContact NE2-CD2 3.88Å; H509-W540 AromaticContact NE2-CE2 3.57Å; H509-W540 AromaticContact NE2-CG 3.76Å; H509-W540 AromaticContact NE2-NE1 3.27Å; H509-W540 PolarHBondContact NE2-NE1 2.79Å; H509-W542 HydrophobicContact CB-CZ2 4.18Å
510	P	91.2	Very high	92.9	Very high	67 Å²	67	45.8 Å²	45.8	44%	0.435	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	137	-175.1	-29.3	36.3	0	0	0	112.5	A489 V512	A489-P510 VanDerWaalsContact O-CA 3.3Å; A489-P510 WeakPolarHBondContact O-CA 3.46Å; A489-P510 WeakPolarHBondContact O-CB 3.35Å; P510-V512 PolarHBondContact O-N 2.74Å; P510-V512 VanDerWaalsContact O-N 3.15Å
511	T	91.2	Very high	93	Very high	42 Å²	42	41 Å²	41	26%	0.258	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	19.1	177.2	69.9	0	0	0	0	116	S488 A489 H509 S513	S488-T511 VanDerWaalsContact O-CA 3.29Å; S488-T511 WeakPolarHBondContact O-CA 3.5Å; S488-T511 PolarHBondContact O-N 2.83Å; S488-T511 VanDerWaalsContact O-N 3.1Å; A489-T511 PolarHBondContact O-N 3.09Å; H509-T511 PolarHBondContact O-N 3.13Å; T511-S513 PolarHBondContact O-N 3.49Å
512	V	94.1	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.228	C	C	.	.			trans	-48.4	126.2	175.9	60.7	0	0	0	0	111.4	L486 R487 H509 P510 I515 T526	L486-V512 WeakPolarHBondContact CA-O 3.47Å; L486-V512 HydrophobicContact CD2-CG1 4.13Å; L486-V512 HydrophobicContact CD2-CG2 4.17Å; R487-V512 PolarHBondContact N-O 3.38Å; H509-V512 HydrophobicContact CB-CB 4.32Å; H509-V512 WeakPolarHBondContact O-CB 3.25Å; H509-V512 PolarHBondContact O-N 3.24Å; P510-V512 PolarHBondContact O-N 2.74Å; P510-V512 VanDerWaalsContact O-N 3.15Å; V512-I515 HydrophobicContact CG2-CD1 4.39Å; V512-I515 HydrophobicContact CG2-CG1 3.94Å; V512-T526 HydrophobicContact CG2-CG2 4.47Å
513	S	93.7	Very high	93.1	Very high	5 Å²	5	41.2 Å²	41.2	4%	0.035	21%	0.209	C	C	.	.			trans	-100.1	-33.3	-174	63.9	0	0	0	0	113.7	T511 T527 S529	T511-S513 PolarHBondContact O-N 3.49Å; S513-T527 PolarHBondContact N-O 3.42Å; S513-T527 PolarHBondContact OG-O 3.28Å; S513-S529 PolarHBondContact OG-N 3.29Å
514	D	94	Very high	93.2	Very high	46 Å²	46	38.6 Å²	38.6	25%	0.246	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	152.5	-179.1	-174.5	38	0	0	0	111.2	Q516 T527	D514-Q516 PolarHBondContact OD2-NE2 2.97Å; D514-T527 PolarHBondContact N-O 3.07Å; D514-T527 PolarHBondContact O-N 3.42Å; D514-T527 PolarHBondContact O-OG1 3.43Å
515	I	95	Very high	93.3	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	126.9	-176.9	-64	176	0	0	0	108.9	A484 L486 L493 V512 I524 A525 T526	A484-I515 HydrophobicContact CB-CD1 3.09Å; L486-I515 HydrophobicContact CD2-CD1 3.55Å; L486-I515 HydrophobicContact CD2-CG1 3.68Å; L493-I515 HydrophobicContact CD2-CD1 3.5Å; V512-I515 HydrophobicContact CG2-CD1 4.39Å; V512-I515 HydrophobicContact CG2-CG1 3.94Å; I515-I524 HydrophobicContact CG2-CD1 3.33Å; I515-I524 HydrophobicContact CG2-CG1 3.63Å; I515-A525 WeakPolarHBondContact CA-O 3.16Å; I515-T526 HydrophobicContact CD1-CG2 4.3Å; I515-T526 HydrophobicContact CG1-CG2 3.82Å; I515-T526 HydrophobicContact CG2-CG2 4.34Å
516	Q	95.2	Very high	93.5	Very high	47 Å²	47	33.8 Å²	33.8	22%	0.22	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.9	178.4	-60.5	-179.3	24.6	0	0	111.3	D514 A525 F560 W562	D514-Q516 PolarHBondContact OD2-NE2 2.97Å; Q516-A525 PolarHBondContact N-O 3.19Å; Q516-A525 PolarHBondContact O-N 2.88Å; Q516-F560 HydrophobicContact CB-CE1 4.27Å; Q516-F560 PolarHBondContact NE2-O 2.93Å; Q516-W562 PolarHBondContact O-NE1 3.44Å; Q516-W562 VanDerWaalsContact O-NE1 3.11Å
517	W	95.7	Very high	93.6	Very high	29 Å²	29	28 Å²	28	11%	0.11	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	143.4	167.1	-76.7	101.3	0	0	0	110.6	R473 W474 I480 V482 G521 Y523 I524 C544	R473-W517 PolarHBondContact O-NE1 3.27Å; W474-W517 VanDerWaalsContact C-NE1 3.34Å; W474-W517 PolarHBondContact O-NE1 2.99Å; I480-W517 HydrophobicContact CB-CH2 4.42Å; I480-W517 HydrophobicContact CG2-CH2 3.89Å; I480-W517 HydrophobicContact CG2-CZ2 4.05Å; V482-W517 HydrophobicContact CG2-CH2 4.37Å; V482-W517 HydrophobicContact CG2-CZ2 3.64Å; W517-G521 WeakPolarHBondContact CZ3-O 3.5Å; W517-Y523 VanDerWaalsContact CE3-O 3.29Å; W517-I524 HydrophobicContact CD2-CB 4.19Å; W517-I524 HydrophobicContact CD2-CD1 4.16Å; W517-I524 HydrophobicContact CD2-CG1 4.26Å; W517-I524 HydrophobicContact CE3-CB 4.02Å; W517-I524 HydrophobicContact CZ2-CD1 4.2Å; W517-I524 HydrophobicContact CZ3-CB 4.23Å; W517-C544 HydrophobicContact CH2-CB 4.09Å; W517-C544 HydrophobicContact CZ3-CB 3.94Å
518	D	94.6	Very high	93.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.14	C	C	.	.			trans	-67.3	156.5	166.6	88.9	-67.4	0	0	0	109.9	S476 T520 G521 R522 Y523 W562	S476-D518 PolarHBondContact OG-O 3.35Å; D518-T520 PolarHBondContact O-N 2.82Å; D518-T520 VanDerWaalsContact O-N 3.09Å; D518-T520 WeakPolarHBondContact OD2-CA 3.46Å; D518-T520 VanDerWaalsContact OD2-CB 3.26Å; D518-T520 WeakPolarHBondContact OD2-CB 3.36Å; D518-T520 PolarHBondContact OD2-N 3.15Å; D518-T520 PolarHBondContact OD2-OG1 3.37Å; D518-G521 PolarHBondContact O-N 2.69Å; D518-G521 WeakPolarHBondContact OD1-CA 3.23Å; D518-G521 PolarHBondContact OD1-N 3.26Å; D518-R522 PolarHBondContact OD1-N 2.78Å; D518-Y523 PolarHBondContact N-O 3.06Å; D518-Y523 PolarHBondContact OD1-N 2.81Å; D518-W562 HydrophobicContact CB-CD2 3.99Å; D518-W562 HydrophobicContact CB-CE3 4.21Å; D518-W562 HydrophobicContact CB-CG 4.47Å; D518-W562 HydrophobicContact CB-CH2 4.35Å; D518-W562 HydrophobicContact CB-CZ2 4.09Å; D518-W562 HydrophobicContact CB-CZ3 4.4Å
519	P	92.6	Very high	93.8	Very high	28 Å²	28	21.9 Å²	21.9	18%	0.182	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.5	-178	-22.7	32.6	0	0	0	114.5	S476 W562 R563 R565	S476-P519 PolarHBondContact OG-O 3.2Å; P519-W562 HydrophobicContact CG-CB 4.48Å; P519-R563 WeakPolarHBondContact CG-O 3.29Å; P519-R565 HydrophobicContact CB-CB 4.26Å; P519-R565 HydrophobicContact CB-CG 3.53Å; P519-R565 HydrophobicContact CG-CG 4.01Å
520	T	90.1	Very high	93.8	Very high	21 Å²	21	22.6 Å²	22.6	13%	0.129	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.3	177.5	74.3	0	0	0	0	113.5	D151 K477 D518 R522	D151-T520 WeakPolarHBondContact OD2-CG2 3.49Å; K477-T520 WeakPolarHBondContact CG-O 3.46Å; D518-T520 PolarHBondContact O-N 2.82Å; D518-T520 VanDerWaalsContact O-N 3.09Å; D518-T520 WeakPolarHBondContact OD2-CA 3.46Å; D518-T520 VanDerWaalsContact OD2-CB 3.26Å; D518-T520 WeakPolarHBondContact OD2-CB 3.36Å; D518-T520 PolarHBondContact OD2-N 3.15Å; D518-T520 PolarHBondContact OD2-OG1 3.37Å; T520-R522 VanDerWaalsContact C-N 3.28Å; T520-R522 PolarHBondContact OG1-NE 3.35Å; T520-R522 PolarHBondContact OG1-NH2 3.34Å
521	G	91.7	Very high	93.7	Very high	7 Å²	7	26.1 Å²	26.1	7%	0.072	13%	0.127	C	C	.	.	S	Bend	trans	77.6	12.8	177	0	0	0	0	0	114	S475 S476 W517 D518	S475-G521 WeakPolarHBondContact OG-CA 3.4Å; S475-G521 PolarHBondContact OG-O 2.99Å; S476-G521 VanDerWaalsContact OG-CA 3.32Å; S476-G521 WeakPolarHBondContact OG-CA 3.28Å; S476-G521 PolarHBondContact OG-N 3.3Å; W517-G521 WeakPolarHBondContact CZ3-O 3.5Å; D518-G521 PolarHBondContact O-N 2.69Å; D518-G521 WeakPolarHBondContact OD1-CA 3.23Å; D518-G521 PolarHBondContact OD1-N 3.26Å
522	R	91.1	Very high	93.6	Very high	96 Å²	96	30.2 Å²	30.2	36%	0.362	14%	0.139	S	C	.	.	S	Bend	trans	-89.4	-28.9	-179.8	-69.2	-176.4	-67.4	175.7	-0.5	112.4	C149 D151 D518 T520 N543 C544	C149-R522 PolarHBondContact O-NH2 3.36Å; D151-R522 IonicContact OD2-NH2 2.9Å; D151-R522 PolarHBondContact OD2-NH2 3.17Å; D518-R522 PolarHBondContact OD1-N 2.78Å; T520-R522 VanDerWaalsContact C-N 3.28Å; T520-R522 PolarHBondContact OG1-NE 3.35Å; T520-R522 PolarHBondContact OG1-NH2 3.34Å; R522-N543 CarbonylContact O-C 3.3Å; R522-N543 WeakPolarHBondContact O-CA 3.26Å; R522-C544 PolarHBondContact O-N 3.12Å
523	Y	94.5	Very high	93.3	Very high	49 Å²	49	33.5 Å²	33.5	19%	0.192	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	148.4	-171.1	-56.5	-71.6	0	0	0	110.9	H168 W517 D518 W542 L549	H168-Y523 AromaticContact CD2-CD2 3.55Å; H168-Y523 AromaticContact CD2-CE2 3.82Å; H168-Y523 AromaticContact CD2-CG 3.8Å; H168-Y523 AromaticContact NE2-CD1 3.42Å; H168-Y523 WeakPolarHBondContact NE2-CD1 3.43Å; H168-Y523 AromaticContact NE2-CD2 3.52Å; H168-Y523 AromaticContact NE2-CE1 3.75Å; H168-Y523 AromaticContact NE2-CE2 3.84Å; H168-Y523 AromaticContact NE2-CG 3.28Å; H168-Y523 VanDerWaalsContact NE2-CG 3.28Å; H168-Y523 AromaticContact NE2-CZ 3.93Å; W517-Y523 VanDerWaalsContact CE3-O 3.29Å; D518-Y523 PolarHBondContact N-O 3.06Å; D518-Y523 PolarHBondContact OD1-N 2.81Å; Y523-W542 CarbonylContact C-O 3.59Å; Y523-W542 VanDerWaalsContact CA-O 3.27Å; Y523-W542 WeakPolarHBondContact CA-O 3.16Å; Y523-L549 HydrophobicContact CD1-CD1 3.5Å; Y523-L549 VanDerWaalsContact CD1-CD1 3.5Å; Y523-L549 HydrophobicContact CE1-CD1 3.45Å; Y523-L549 VanDerWaalsContact CE1-CD1 3.45Å
524	I	95.5	Very high	93	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.6	174.5	-169.1	170.1	0	0	0	108.7	V482 F495 I515 W517 F541 W542	V482-I524 HydrophobicContact CB-CD1 3.86Å; V482-I524 HydrophobicContact CG1-CD1 4.16Å; V482-I524 HydrophobicContact CG2-CD1 3.46Å; V482-I524 VanDerWaalsContact CG2-CD1 3.46Å; F495-I524 HydrophobicContact CE1-CG2 3.79Å; F495-I524 HydrophobicContact CZ-CG2 3.93Å; I515-I524 HydrophobicContact CG2-CD1 3.33Å; I515-I524 HydrophobicContact CG2-CG1 3.63Å; W517-I524 HydrophobicContact CD2-CB 4.19Å; W517-I524 HydrophobicContact CD2-CD1 4.16Å; W517-I524 HydrophobicContact CD2-CG1 4.26Å; W517-I524 HydrophobicContact CE3-CB 4.02Å; W517-I524 HydrophobicContact CZ2-CD1 4.2Å; W517-I524 HydrophobicContact CZ3-CB 4.23Å; I524-F541 WeakPolarHBondContact O-CA 3.47Å; I524-W542 HydrophobicContact CG2-CB 3.5Å; I524-W542 VanDerWaalsContact CG2-CB 3.5Å; I524-W542 HydrophobicContact CG2-CG 3.95Å; I524-W542 PolarHBondContact N-O 2.86Å; I524-W542 PolarHBondContact O-N 2.88Å
525	A	95.7	Very high	92.6	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.9	173.7	0	0	0	0	0	108.8	I515 Q516 I539 W540 F541 F560 W562	I515-A525 WeakPolarHBondContact CA-O 3.16Å; Q516-A525 PolarHBondContact N-O 3.19Å; Q516-A525 PolarHBondContact O-N 2.88Å; A525-I539 HydrophobicContact CB-CG2 4.25Å; A525-W540 WeakPolarHBondContact CA-O 3.35Å; A525-F541 HydrophobicContact CB-CD1 4.03Å; A525-F541 HydrophobicContact CB-CE1 3.92Å; A525-F560 HydrophobicContact CB-CD1 4.41Å; A525-F560 HydrophobicContact CB-CE1 3.42Å; A525-F560 VanDerWaalsContact CB-CE1 3.42Å; A525-F560 HydrophobicContact CB-CE2 4.21Å; A525-F560 HydrophobicContact CB-CZ 3.28Å; A525-W562 HydrophobicContact CB-CZ2 3.79Å
526	T	96.2	Very high	92.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.4	173.8	59.6	0	0	0	0	108.6	L493 H509 V512 I515 I539 W540 W542	L493-T526 HydrophobicContact CD1-CG2 3.73Å; L493-T526 HydrophobicContact CD2-CG2 4.49Å; H509-T526 PolarHBondContact CE1-O 3.31Å; H509-T526 WeakPolarHBondContact ND1-CB 3.47Å; H509-T526 PolarHBondContact ND1-OG1 2.97Å; V512-T526 HydrophobicContact CG2-CG2 4.47Å; I515-T526 HydrophobicContact CD1-CG2 4.3Å; I515-T526 HydrophobicContact CG1-CG2 3.82Å; I515-T526 HydrophobicContact CG2-CG2 4.34Å; T526-I539 WeakPolarHBondContact O-CA 3.44Å; T526-W540 PolarHBondContact N-O 2.86Å; T526-W540 PolarHBondContact O-N 2.92Å; T526-W540 WeakPolarHBondContact OG1-CB 3.26Å; T526-W540 PolarHBondContact OG1-O 2.8Å; T526-W542 PolarHBondContact OG1-NE1 2.93Å
527	T	95.7	Very high	92.3	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.4	-168.5	63	0	0	0	0	111.8	S513 D514 I539 F560	S513-T527 PolarHBondContact N-O 3.42Å; S513-T527 PolarHBondContact OG-O 3.28Å; D514-T527 PolarHBondContact N-O 3.07Å; D514-T527 PolarHBondContact O-N 3.42Å; D514-T527 PolarHBondContact O-OG1 3.43Å; T527-I539 HydrophobicContact CG2-CB 4.46Å; T527-I539 HydrophobicContact CG2-CD1 4.18Å; T527-I539 HydrophobicContact CG2-CG1 4.07Å; T527-I539 HydrophobicContact CG2-CG2 3.96Å; T527-F560 HydrophobicContact CG2-CB 3.72Å; T527-F560 HydrophobicContact CG2-CD1 3.72Å; T527-F560 HydrophobicContact CG2-CD2 4.31Å; T527-F560 HydrophobicContact CG2-CE1 4.45Å; T527-F560 HydrophobicContact CG2-CG 3.64Å
528	V	95.5	Very high	92.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	23%	0.23	C	C	.	.			trans	-109.5	100.4	169.3	179.8	0	0	0	0	108.3	H509 Q533 N537 A538	H509-V528 WeakPolarHBondContact NE2-CG2 3.36Å; V528-Q533 HydrophobicContact CG1-CB 3.88Å; V528-Q533 HydrophobicContact CG1-CG 4.19Å; V528-N537 WeakPolarHBondContact O-CA 3.4Å; V528-N537 PolarHBondContact O-ND2 2.9Å; V528-A538 PolarHBondContact N-O 2.85Å
529	S	93.4	Very high	92.2	Very high	10 Å²	10	48.4 Å²	48.4	7%	0.07	23%	0.23	C	C	.	.			trans	-81.3	145.1	-179.2	175.9	0	0	0	0	112.6	S513 F531 Y532 Q533 I557	S513-S529 PolarHBondContact OG-N 3.29Å; S529-F531 PolarHBondContact O-N 2.97Å; S529-F531 VanDerWaalsContact OG-CD2 3.3Å; S529-F531 WeakPolarHBondContact OG-CD2 3.15Å; S529-F531 PolarHBondContact OG-N 2.82Å; S529-Y532 PolarHBondContact O-N 3.06Å; S529-Y532 VanDerWaalsContact O-N 3.11Å; S529-Q533 PolarHBondContact O-N 2.87Å; S529-I557 CarbonylContact C-O 3.47Å; S529-I557 VanDerWaalsContact CA-O 3.24Å; S529-I557 WeakPolarHBondContact CA-O 3.44Å; S529-I557 WeakPolarHBondContact CB-O 3.48Å; S529-I557 PolarHBondContact OG-O 3.12Å
530	S	92.9	Very high	92.4	Very high	20 Å²	20	49 Å²	49	14%	0.14	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.9	174.6	63.4	0	0	0	0	114	Y532 Q533 N537 I557	S530-Y532 VanDerWaalsContact C-N 3.3Å; S530-Y532 PolarHBondContact O-N 3.16Å; S530-Q533 VanDerWaalsContact CA-O 3.29Å; S530-Q533 WeakPolarHBondContact CA-O 3.27Å; S530-N537 PolarHBondContact N-ND2 3.43Å; S530-I557 PolarHBondContact N-O 2.95Å; S530-I557 PolarHBondContact OG-O 2.95Å
531	F	89.6	Confident	92.6	Very high	140 Å²	140	48 Å²	48	61%	0.614	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.9	173.5	-68.8	-58.2	0	0	0	113.3	S529 R558	S529-F531 PolarHBondContact O-N 2.97Å; S529-F531 VanDerWaalsContact OG-CD2 3.3Å; S529-F531 WeakPolarHBondContact OG-CD2 3.15Å; S529-F531 PolarHBondContact OG-N 2.82Å; F531-R558 HydrophobicContact CE2-CB 3.93Å; F531-R558 HydrophobicContact CE2-CG 4.3Å; F531-R558 VanDerWaalsContact CE2-O 3.29Å; F531-R558 WeakPolarHBondContact CE2-O 3.44Å; F531-R558 HydrophobicContact CZ-CB 4.18Å; F531-R558 HydrophobicContact CZ-CG 4.15Å
532	Y	88.2	Confident	92.8	Very high	128 Å²	128	48.1 Å²	48.1	50%	0.502	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-39.1	-179.7	-62.4	-78	0	0	0	111.9	R487 S529 S530	R487-Y532 HydrophobicContact CG-CD1 4.44Å; R487-Y532 VanDerWaalsContact CZ-CE1 3.46Å; R487-Y532 PolarHBondContact NH2-OH 3.22Å; S529-Y532 PolarHBondContact O-N 3.06Å; S529-Y532 VanDerWaalsContact O-N 3.11Å; S530-Y532 VanDerWaalsContact C-N 3.3Å; S530-Y532 PolarHBondContact O-N 3.16Å
533	Q	88.6	Confident	92.9	Very high	70 Å²	70	45.3 Å²	45.3	33%	0.327	21%	0.212	S	C	.	.			trans	-136.3	119.6	-176.6	-179.7	65.2	-12.8	0	0	110.1	V528 S529 S530 N535 N537	V528-Q533 HydrophobicContact CG1-CB 3.88Å; V528-Q533 HydrophobicContact CG1-CG 4.19Å; S529-Q533 PolarHBondContact O-N 2.87Å; S530-Q533 VanDerWaalsContact CA-O 3.29Å; S530-Q533 WeakPolarHBondContact CA-O 3.27Å; Q533-N535 VanDerWaalsContact C-N 3.33Å; Q533-N535 VanDerWaalsContact CG-O 3.29Å; Q533-N535 WeakPolarHBondContact CG-O 3.43Å; Q533-N535 PolarHBondContact O-N 3.39Å; Q533-N537 PolarHBondContact O-ND2 3.15Å
534	K	87	Confident	92.8	Very high	180 Å²	180	44.5 Å²	44.5	78%	0.783	21%	0.214	S	C	*	.	S	Bend	trans	-73.8	-22.2	-173.9	-66.1	-174.3	179	-178.7	0	114.4	N537	K534-N537 PolarHBondContact O-OD1 3.45Å
535	N	86.6	Confident	92.5	Very high	111 Å²	111	48.4 Å²	48.4	59%	0.594	24%	0.237	S	C	*	.	S	Bend	trans	-114.9	169.3	-176.9	-61.4	-17.9	0	0	0	110.3	Q533 N537	Q533-N535 VanDerWaalsContact C-N 3.33Å; Q533-N535 VanDerWaalsContact CG-O 3.29Å; Q533-N535 WeakPolarHBondContact CG-O 3.43Å; Q533-N535 PolarHBondContact O-N 3.39Å; N535-N537 PolarHBondContact O-N 3.1Å
536	D	88.6	Confident	92.3	Very high	137 Å²	137	48.8 Å²	48.8	73%	0.733	24%	0.241	S	C	*	.	S	Bend	trans	52.6	30.3	175.1	-53.7	-34.8	0	0	0	114.6	A538	D536-A538 PolarHBondContact O-N 3.21Å; D536-A538 VanDerWaalsContact O-N 3.17Å
537	N	93.7	Very high	92.2	Very high	10 Å²	10	57.5 Å²	57.5	5%	0.053	27%	0.274	C	S	.	.			trans	-62.8	119.9	174.9	-62	133.8	0	0	0	109.4	V528 S530 Q533 K534 N535 L554 G556 I557	V528-N537 WeakPolarHBondContact O-CA 3.4Å; V528-N537 PolarHBondContact O-ND2 2.9Å; S530-N537 PolarHBondContact N-ND2 3.43Å; Q533-N537 PolarHBondContact O-ND2 3.15Å; K534-N537 PolarHBondContact O-OD1 3.45Å; N535-N537 PolarHBondContact O-N 3.1Å; N537-L554 CarbonylContact C-O 3.59Å; N537-L554 WeakPolarHBondContact CB-O 3.39Å; N537-L554 PolarHBondContact O-N 2.78Å; N537-L554 VanDerWaalsContact O-N 3.16Å; N537-G556 PolarHBondContact OD1-N 3.49Å; N537-G556 VanDerWaalsContact OD1-N 3.08Å; N537-I557 HydrophobicContact CB-CB 4.43Å; N537-I557 HydrophobicContact CB-CD1 3.97Å; N537-I557 HydrophobicContact CB-CG1 4.04Å
538	A	94.6	Very high	92	Very high	3 Å²	3	59 Å²	59	3%	0.025	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	158.7	-178.9	0	0	0	0	0	111.3	V528 D536 M552 N553	V528-A538 PolarHBondContact N-O 2.85Å; D536-A538 PolarHBondContact O-N 3.21Å; D536-A538 VanDerWaalsContact O-N 3.17Å; A538-M552 WeakPolarHBondContact CA-O 3.48Å; A538-N553 WeakPolarHBondContact CB-OD1 3.34Å
539	I	95.4	Very high	91.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.5	170.1	-50	-168.2	0	0	0	107.6	V155 A525 T526 T527 F541 M552 I557 F560	V155-I539 HydrophobicContact CG2-CD1 3.55Å; A525-I539 HydrophobicContact CB-CG2 4.25Å; T526-I539 WeakPolarHBondContact O-CA 3.44Å; T527-I539 HydrophobicContact CG2-CB 4.46Å; T527-I539 HydrophobicContact CG2-CD1 4.18Å; T527-I539 HydrophobicContact CG2-CG1 4.07Å; T527-I539 HydrophobicContact CG2-CG2 3.96Å; I539-F541 HydrophobicContact CB-CE2 4.14Å; I539-F541 HydrophobicContact CG2-CD2 4.17Å; I539-F541 HydrophobicContact CG2-CE1 4.27Å; I539-F541 HydrophobicContact CG2-CE2 3.55Å; I539-F541 HydrophobicContact CG2-CZ 3.61Å; I539-M552 HydrophobicContact CB-CB 4.46Å; I539-M552 HydrophobicContact CB-CE 4.1Å; I539-M552 HydrophobicContact CD1-CE 3.7Å; I539-M552 HydrophobicContact CG1-CE 4.08Å; I539-M552 PolarHBondContact N-O 3.04Å; I539-M552 PolarHBondContact O-N 3.03Å; I539-I557 HydrophobicContact CD1-CD1 4.28Å; I539-I557 HydrophobicContact CG1-CD1 3.71Å; I539-F560 HydrophobicContact CD1-CB 4.28Å; I539-F560 HydrophobicContact CD1-CD2 3.51Å; I539-F560 HydrophobicContact CD1-CE2 4.16Å; I539-F560 HydrophobicContact CD1-CG 4.15Å; I539-F560 HydrophobicContact CG2-CD2 4.41Å; I539-F560 HydrophobicContact CG2-CE2 4.2Å
540	W	95.4	Very high	91.7	Very high	39 Å²	39	62.1 Å²	62.1	15%	0.148	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.6	176.1	-63.5	27.2	0	0	0	108.3	E508 H509 A525 T526 W542 K551	E508-W540 WeakPolarHBondContact O-CZ3 3.36Å; H509-W540 HydrophobicContact CB-CE3 4.3Å; H509-W540 HydrophobicContact CB-CZ3 4.43Å; H509-W540 AromaticContact CD2-CD1 3.99Å; H509-W540 AromaticContact CD2-CD2 3.66Å; H509-W540 AromaticContact CD2-CE2 3.4Å; H509-W540 VanDerWaalsContact CD2-CE2 3.4Å; H509-W540 AromaticContact CD2-CZ2 3.7Å; H509-W540 AromaticContact CD2-NE1 3.65Å; H509-W540 AromaticContact CE1-CD1 3.67Å; H509-W540 AromaticContact CE1-CG 3.81Å; H509-W540 AromaticContact CG-CD2 3.96Å; H509-W540 AromaticContact NE2-CD1 3.38Å; H509-W540 AromaticContact NE2-CD2 3.88Å; H509-W540 AromaticContact NE2-CE2 3.57Å; H509-W540 AromaticContact NE2-CG 3.76Å; H509-W540 AromaticContact NE2-NE1 3.27Å; H509-W540 PolarHBondContact NE2-NE1 2.79Å; A525-W540 WeakPolarHBondContact CA-O 3.35Å; T526-W540 PolarHBondContact N-O 2.86Å; T526-W540 PolarHBondContact O-N 2.92Å; T526-W540 WeakPolarHBondContact OG1-CB 3.26Å; T526-W540 PolarHBondContact OG1-O 2.8Å; W540-W542 HydrophobicContact CB-CZ2 4.35Å; W540-W542 HydrophobicContact CD2-CZ2 4.38Å; W540-W542 AromaticContact CE3-CH2 3.87Å; W540-W542 HydrophobicContact CE3-CH2 3.87Å; W540-W542 AromaticContact CE3-CZ2 3.43Å; W540-W542 HydrophobicContact CE3-CZ2 3.43Å; W540-W542 VanDerWaalsContact CE3-CZ2 3.43Å; W540-W542 HydrophobicContact CZ3-CH2 4.1Å; W540-W542 HydrophobicContact CZ3-CZ2 4.04Å; W540-K551 HydrophobicContact CD2-CD 3.74Å; W540-K551 HydrophobicContact CD2-CG 3.78Å; W540-K551 HydrophobicContact CE3-CD 4.12Å; W540-K551 HydrophobicContact CE3-CG 4.31Å; W540-K551 HydrophobicContact CG-CB 4.32Å; W540-K551 HydrophobicContact CG-CD 4.26Å; W540-K551 HydrophobicContact CG-CG 3.8Å; W540-K551 HydrophobicContact CH2-CD 4.26Å; W540-K551 HydrophobicContact CZ2-CD 3.81Å; W540-K551 HydrophobicContact CZ3-CD 4.36Å; W540-K551 VanDerWaalsContact CZ3-CE 3.48Å; W540-K551 VanDerWaalsContact CZ3-NZ 3.34Å
541	F	95.4	Very high	91.8	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.6	177.6	-65.6	-90.9	0	0	0	109.1	F153 H168 I524 A525 I539 L549 Y550 M552 F560 W562	F153-F541 HydrophobicContact CD1-CE1 4.32Å; F153-F541 HydrophobicContact CD1-CZ 4.32Å; F153-F541 HydrophobicContact CE1-CE1 4.04Å; F153-F541 AromaticContact CE1-CZ 3.73Å; F153-F541 HydrophobicContact CE1-CZ 3.73Å; F153-F541 HydrophobicContact CE2-CZ 4.15Å; F153-F541 HydrophobicContact CZ-CE1 4.38Å; F153-F541 HydrophobicContact CZ-CE2 4.4Å; F153-F541 AromaticContact CZ-CZ 3.61Å; F153-F541 HydrophobicContact CZ-CZ 3.61Å; H168-F541 AromaticContact CE1-CD1 3.57Å; H168-F541 AromaticContact CE1-CG 3.88Å; H168-F541 AromaticContact ND1-CD1 3.64Å; H168-F541 AromaticContact ND1-CE1 3.89Å; I524-F541 WeakPolarHBondContact O-CA 3.47Å; A525-F541 HydrophobicContact CB-CD1 4.03Å; A525-F541 HydrophobicContact CB-CE1 3.92Å; I539-F541 HydrophobicContact CB-CE2 4.14Å; I539-F541 HydrophobicContact CG2-CD2 4.17Å; I539-F541 HydrophobicContact CG2-CE1 4.27Å; I539-F541 HydrophobicContact CG2-CE2 3.55Å; I539-F541 HydrophobicContact CG2-CZ 3.61Å; F541-L549 PolarHBondContact O-N 3.15Å; F541-Y550 HydrophobicContact CB-CD1 4.28Å; F541-Y550 HydrophobicContact CB-CE1 3.86Å; F541-Y550 HydrophobicContact CB-CE2 4.48Å; F541-Y550 AromaticContact CD2-CD2 3.89Å; F541-Y550 HydrophobicContact CD2-CD2 3.89Å; F541-Y550 AromaticContact CD2-CE1 3.96Å; F541-Y550 HydrophobicContact CD2-CE1 3.96Å; F541-Y550 AromaticContact CD2-CE2 3.14Å; F541-Y550 HydrophobicContact CD2-CE2 3.14Å; F541-Y550 AromaticContact CD2-CZ 3.2Å; F541-Y550 VanDerWaalsContact CD2-OH 3.3Å; F541-Y550 WeakPolarHBondContact CD2-OH 3.41Å; F541-Y550 HydrophobicContact CE2-CD2 4.48Å; F541-Y550 AromaticContact CE2-CE2 3.46Å; F541-Y550 HydrophobicContact CE2-CE2 3.46Å; F541-Y550 VanDerWaalsContact CE2-CE2 3.46Å; F541-Y550 AromaticContact CE2-CZ 3.64Å; F541-Y550 WeakPolarHBondContact CE2-OH 3.36Å; F541-Y550 AromaticContact CG-CE1 3.97Å; F541-Y550 HydrophobicContact CG-CE1 3.97Å; F541-Y550 AromaticContact CG-CE2 4Å; F541-Y550 HydrophobicContact CG-CE2 4Å; F541-Y550 AromaticContact CG-CZ 3.59Å; F541-Y550 PolarHBondContact N-O 3.22Å; F541-M552 HydrophobicContact CE2-CB 4.4Å; F541-M552 HydrophobicContact CE2-CE 4.44Å; F541-F560 HydrophobicContact CE1-CE2 4.36Å; F541-F560 HydrophobicContact CE1-CZ 4.32Å; F541-F560 HydrophobicContact CZ-CE2 4.24Å; F541-W562 AromaticContact CD1-CH2 3.96Å; F541-W562 HydrophobicContact CD1-CH2 3.96Å; F541-W562 AromaticContact CD1-CZ2 3.88Å; F541-W562 HydrophobicContact CD1-CZ2 3.88Å; F541-W562 AromaticContact CE1-CH2 3.6Å; F541-W562 HydrophobicContact CE1-CH2 3.6Å; F541-W562 AromaticContact CE1-CZ2 3.63Å; F541-W562 HydrophobicContact CE1-CZ2 3.63Å
542	W	95.2	Very high	91.9	Very high	11 Å²	11	60.7 Å²	60.7	4%	0.042	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153	178.2	-37.5	65.9	0	0	0	109.4	L493 F495 H509 Y523 I524 T526 W540 R547 C548	L493-W542 HydrophobicContact CD1-CH2 4.36Å; L493-W542 HydrophobicContact CD1-CZ2 3.76Å; F495-W542 HydrophobicContact CE2-CE3 4.45Å; F495-W542 HydrophobicContact CZ-CB 4.04Å; F495-W542 HydrophobicContact CZ-CD2 4.38Å; F495-W542 HydrophobicContact CZ-CE3 4.46Å; F495-W542 HydrophobicContact CZ-CG 4.21Å; H509-W542 HydrophobicContact CB-CZ2 4.18Å; Y523-W542 CarbonylContact C-O 3.59Å; Y523-W542 VanDerWaalsContact CA-O 3.27Å; Y523-W542 WeakPolarHBondContact CA-O 3.16Å; I524-W542 HydrophobicContact CG2-CB 3.5Å; I524-W542 VanDerWaalsContact CG2-CB 3.5Å; I524-W542 HydrophobicContact CG2-CG 3.95Å; I524-W542 PolarHBondContact N-O 2.86Å; I524-W542 PolarHBondContact O-N 2.88Å; T526-W542 PolarHBondContact OG1-NE1 2.93Å; W540-W542 HydrophobicContact CB-CZ2 4.35Å; W540-W542 HydrophobicContact CD2-CZ2 4.38Å; W540-W542 AromaticContact CE3-CH2 3.87Å; W540-W542 HydrophobicContact CE3-CH2 3.87Å; W540-W542 AromaticContact CE3-CZ2 3.43Å; W540-W542 HydrophobicContact CE3-CZ2 3.43Å; W540-W542 VanDerWaalsContact CE3-CZ2 3.43Å; W540-W542 HydrophobicContact CZ3-CH2 4.1Å; W540-W542 HydrophobicContact CZ3-CZ2 4.04Å; W542-R547 CarbonylContact C-O 3.52Å; W542-R547 VanDerWaalsContact CA-O 3.25Å; W542-R547 WeakPolarHBondContact CA-O 3.43Å; W542-C548 HydrophobicContact CD2-CB 4.05Å; W542-C548 HydrophobicContact CE3-CB 3.57Å; W542-C548 HydrophobicContact CH2-CB 4.11Å; W542-C548 HydrophobicContact CZ3-CB 3.61Å
543	N	93.2	Very high	92.2	Very high	36 Å²	36	60.8 Å²	60.8	19%	0.193	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	168.6	166.9	72.8	5.2	0	0	0	110.7	R522 V545 G546 R547 L549	R522-N543 CarbonylContact O-C 3.3Å; R522-N543 WeakPolarHBondContact O-CA 3.26Å; N543-V545 PolarHBondContact O-N 3.27Å; N543-V545 VanDerWaalsContact O-N 3.11Å; N543-V545 PolarHBondContact OD1-N 2.83Å; N543-V545 VanDerWaalsContact OD1-N 3.15Å; N543-G546 PolarHBondContact O-N 2.95Å; N543-G546 PolarHBondContact OD1-N 2.86Å; N543-R547 PolarHBondContact N-O 2.83Å; N543-R547 WeakPolarHBondContact OD1-CB 3.3Å; N543-R547 PolarHBondContact OD1-N 2.94Å; N543-R547 PolarHBondContact OD1-O 3.04Å; N543-L549 HydrophobicContact CB-CD1 4.34Å; N543-L549 HydrophobicContact CB-CD2 4.3Å; N543-L549 HydrophobicContact CB-CG 4.44Å
544	C	91.7	Very high	92.4	Very high	33 Å²	33	58.6 Å²	58.6	22%	0.223	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.2	179.5	61.3	0	0	0	0	114.6	I480 W517 R522	I480-C544 HydrophobicContact CD1-CB 3.71Å; W517-C544 HydrophobicContact CH2-CB 4.09Å; W517-C544 HydrophobicContact CZ3-CB 3.94Å; R522-C544 PolarHBondContact O-N 3.12Å
545	V	90.5	Very high	92.7	Very high	81 Å²	81	58.9 Å²	58.9	49%	0.491	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.7	177.8	-169.9	0	0	0	0	111.7	A505 N543	A505-V545 WeakPolarHBondContact CB-O 3.26Å; N543-V545 PolarHBondContact O-N 3.27Å; N543-V545 VanDerWaalsContact O-N 3.11Å; N543-V545 PolarHBondContact OD1-N 2.83Å; N543-V545 VanDerWaalsContact OD1-N 3.15Å
546	G	92	Very high	92.9	Very high	8 Å²	8	53.7 Å²	53.7	8%	0.082	26%	0.258	C	S	.	.	S	Bend	trans	93.2	13.7	177.9	0	0	0	0	0	115.8	F495 N543	F495-G546 VanDerWaalsContact CD2-CA 3.47Å; N543-G546 PolarHBondContact O-N 2.95Å; N543-G546 PolarHBondContact OD1-N 2.86Å
547	R	92.6	Very high	93.2	Very high	183 Å²	183	47.2 Å²	47.2	69%	0.691	22%	0.223	S	C	*	.			trans	-83	125.2	170.1	-178.8	-179.1	174.1	176.3	0.3	110	W542 N543 L549	W542-R547 CarbonylContact C-O 3.52Å; W542-R547 VanDerWaalsContact CA-O 3.25Å; W542-R547 WeakPolarHBondContact CA-O 3.43Å; N543-R547 PolarHBondContact N-O 2.83Å; N543-R547 WeakPolarHBondContact OD1-CB 3.3Å; N543-R547 PolarHBondContact OD1-N 2.94Å; N543-R547 PolarHBondContact OD1-O 3.04Å; R547-L549 PolarHBondContact O-N 2.78Å
548	C	93	Very high	93.2	Very high	38 Å²	38	50.4 Å²	50.4	26%	0.257	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	124	168.9	-170.2	0	0	0	0	109.5	W542	W542-C548 HydrophobicContact CD2-CB 4.05Å; W542-C548 HydrophobicContact CE3-CB 3.57Å; W542-C548 HydrophobicContact CH2-CB 4.11Å; W542-C548 HydrophobicContact CZ3-CB 3.61Å
549	L	91.4	Very high	93.1	Very high	50 Å²	50	51.9 Å²	51.9	26%	0.262	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-56.9	-178.7	-62.4	175	0	0	0	110.6	Y523 F541 N543 R547	Y523-L549 HydrophobicContact CD1-CD1 3.5Å; Y523-L549 VanDerWaalsContact CD1-CD1 3.5Å; Y523-L549 HydrophobicContact CE1-CD1 3.45Å; Y523-L549 VanDerWaalsContact CE1-CD1 3.45Å; F541-L549 PolarHBondContact O-N 3.15Å; N543-L549 HydrophobicContact CB-CD1 4.34Å; N543-L549 HydrophobicContact CB-CD2 4.3Å; N543-L549 HydrophobicContact CB-CG 4.44Å; R547-L549 PolarHBondContact O-N 2.78Å
550	Y	90.7	Very high	93.1	Very high	27 Å²	27	52.5 Å²	52.5	11%	0.106	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	166.3	177.3	67	-86.8	0	0	0	110.5	H168 T169 V171 P173 F541	H168-Y550 AromaticContact CE1-CE1 3.64Å; H168-Y550 AromaticContact CE1-CZ 3.95Å; H168-Y550 PolarHBondContact CE1-OH 2.83Å; H168-Y550 AromaticContact ND1-CE1 3.93Å; H168-Y550 AromaticContact ND1-CZ 3.82Å; H168-Y550 PolarHBondContact ND1-OH 2.82Å; T169-Y550 WeakPolarHBondContact O-CE1 3.42Å; V171-Y550 WeakPolarHBondContact O-CB 3.17Å; V171-Y550 WeakPolarHBondContact O-CD1 3.43Å; P173-Y550 VanDerWaalsContact CD-CE2 3.47Å; P173-Y550 HydrophobicContact CG-CE2 4.08Å; F541-Y550 HydrophobicContact CB-CD1 4.28Å; F541-Y550 HydrophobicContact CB-CE1 3.86Å; F541-Y550 HydrophobicContact CB-CE2 4.48Å; F541-Y550 AromaticContact CD2-CD2 3.89Å; F541-Y550 HydrophobicContact CD2-CD2 3.89Å; F541-Y550 AromaticContact CD2-CE1 3.96Å; F541-Y550 HydrophobicContact CD2-CE1 3.96Å; F541-Y550 AromaticContact CD2-CE2 3.14Å; F541-Y550 HydrophobicContact CD2-CE2 3.14Å; F541-Y550 AromaticContact CD2-CZ 3.2Å; F541-Y550 VanDerWaalsContact CD2-OH 3.3Å; F541-Y550 WeakPolarHBondContact CD2-OH 3.41Å; F541-Y550 HydrophobicContact CE2-CD2 4.48Å; F541-Y550 AromaticContact CE2-CE2 3.46Å; F541-Y550 HydrophobicContact CE2-CE2 3.46Å; F541-Y550 VanDerWaalsContact CE2-CE2 3.46Å; F541-Y550 AromaticContact CE2-CZ 3.64Å; F541-Y550 WeakPolarHBondContact CE2-OH 3.36Å; F541-Y550 AromaticContact CG-CE1 3.97Å; F541-Y550 HydrophobicContact CG-CE1 3.97Å; F541-Y550 AromaticContact CG-CE2 4Å; F541-Y550 HydrophobicContact CG-CE2 4Å; F541-Y550 AromaticContact CG-CZ 3.59Å; F541-Y550 PolarHBondContact N-O 3.22Å
551	K	93.5	Very high	93.1	Very high	110 Å²	110	52.1 Å²	52.1	48%	0.478	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134	-179.6	-53.7	177.4	-175.9	-172	0	108.8	W540	W540-K551 HydrophobicContact CD2-CD 3.74Å; W540-K551 HydrophobicContact CD2-CG 3.78Å; W540-K551 HydrophobicContact CE3-CD 4.12Å; W540-K551 HydrophobicContact CE3-CG 4.31Å; W540-K551 HydrophobicContact CG-CB 4.32Å; W540-K551 HydrophobicContact CG-CD 4.26Å; W540-K551 HydrophobicContact CG-CG 3.8Å; W540-K551 HydrophobicContact CH2-CD 4.26Å; W540-K551 HydrophobicContact CZ2-CD 3.81Å; W540-K551 HydrophobicContact CZ3-CD 4.36Å; W540-K551 VanDerWaalsContact CZ3-CE 3.48Å; W540-K551 VanDerWaalsContact CZ3-NZ 3.34Å
552	M	93.6	Very high	93.1	Very high	20 Å²	20	52.6 Å²	52.6	10%	0.099	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	100.7	177.6	-169.1	179.4	61.6	0	0	108.4	F153 P173 A538 I539 F541 L554	F153-M552 HydrophobicContact CE2-CE 3.98Å; F153-M552 HydrophobicContact CZ-CE 4.25Å; P173-M552 HydrophobicContact CG-SD 3.72Å; A538-M552 WeakPolarHBondContact CA-O 3.48Å; I539-M552 HydrophobicContact CB-CB 4.46Å; I539-M552 HydrophobicContact CB-CE 4.1Å; I539-M552 HydrophobicContact CD1-CE 3.7Å; I539-M552 HydrophobicContact CG1-CE 4.08Å; I539-M552 PolarHBondContact N-O 3.04Å; I539-M552 PolarHBondContact O-N 3.03Å; F541-M552 HydrophobicContact CE2-CB 4.4Å; F541-M552 HydrophobicContact CE2-CE 4.44Å; M552-L554 HydrophobicContact CE-CD1 3.45Å; M552-L554 VanDerWaalsContact CE-CD1 3.45Å; M552-L554 HydrophobicContact CE-CG 4.16Å; M552-L554 HydrophobicContact CG-CD1 4.36Å; M552-L554 HydrophobicContact CG-CD2 4.3Å; M552-L554 HydrophobicContact CG-CG 4.05Å; M552-L554 PolarHBondContact O-N 3.38Å; M552-L554 HydrophobicContact SD-CD1 4.14Å; M552-L554 HydrophobicContact SD-CG 4.45Å
553	N	93.3	Very high	93.2	Very high	129 Å²	129	52.1 Å²	52.1	69%	0.69	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	115.4	178.4	-62.2	-28.4	0	0	0	108.6	A538	A538-N553 WeakPolarHBondContact CB-OD1 3.34Å
554	L	92.8	Very high	93.2	Very high	24 Å²	24	52.1 Å²	52.1	13%	0.126	25%	0.25	C	C	.	.			trans	-131.9	132.1	178.7	-63.2	177.5	0	0	0	108.3	V155 Y157 N537 M552 I557	V155-L554 HydrophobicContact CG1-CD1 3.92Å; V155-L554 HydrophobicContact CG2-CD1 4.4Å; Y157-L554 HydrophobicContact CD1-CD1 4.25Å; Y157-L554 HydrophobicContact CD2-CB 4.17Å; Y157-L554 HydrophobicContact CD2-CD1 4.41Å; Y157-L554 HydrophobicContact CD2-CD2 4Å; Y157-L554 HydrophobicContact CD2-CG 4.44Å; Y157-L554 HydrophobicContact CE2-CD2 4.01Å; Y157-L554 HydrophobicContact CG-CB 4.31Å; Y157-L554 HydrophobicContact CG-CD1 4.05Å; Y157-L554 HydrophobicContact CG-CD2 4.46Å; N537-L554 CarbonylContact C-O 3.59Å; N537-L554 WeakPolarHBondContact CB-O 3.39Å; N537-L554 PolarHBondContact O-N 2.78Å; N537-L554 VanDerWaalsContact O-N 3.16Å; M552-L554 HydrophobicContact CE-CD1 3.45Å; M552-L554 VanDerWaalsContact CE-CD1 3.45Å; M552-L554 HydrophobicContact CE-CG 4.16Å; M552-L554 HydrophobicContact CG-CD1 4.36Å; M552-L554 HydrophobicContact CG-CD2 4.3Å; M552-L554 HydrophobicContact CG-CG 4.05Å; M552-L554 PolarHBondContact O-N 3.38Å; M552-L554 HydrophobicContact SD-CD1 4.14Å; M552-L554 HydrophobicContact SD-CG 4.45Å; L554-I557 HydrophobicContact CB-CD1 3.97Å; L554-I557 HydrophobicContact CB-CG1 3.76Å; L554-I557 WeakPolarHBondContact O-CG1 3.46Å
555	R	93	Very high	93.2	Very high	187 Å²	187	54.6 Å²	54.6	71%	0.706	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	141.1	177.5	-174.6	177	174.3	-173.5	-2.4	110.7	N158 I557	N158-R555 WeakPolarHBondContact CA-O 3.29Å; N158-R555 PolarHBondContact N-O 3.22Å; R555-I557 PolarHBondContact O-N 2.79Å
556	G	92.4	Very high	93.2	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.01	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	37.7	165.1	0	0	0	0	0	114.6	D159 N537 R558	D159-G556 PolarHBondContact N-O 2.8Å; D159-G556 VanDerWaalsContact OD1-CA 3.28Å; D159-G556 WeakPolarHBondContact OD1-CA 3.24Å; N537-G556 PolarHBondContact OD1-N 3.49Å; N537-G556 VanDerWaalsContact OD1-N 3.08Å; G556-R558 PolarHBondContact O-N 3.48Å
557	I	94.9	Very high	92.9	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.01	27%	0.266	C	S	.	.			trans	-65	113.5	-178	-59.8	167.8	0	0	0	110.3	V155 S529 S530 N537 I539 L554 R555	V155-I557 HydrophobicContact CG2-CG2 4.25Å; S529-I557 CarbonylContact C-O 3.47Å; S529-I557 VanDerWaalsContact CA-O 3.24Å; S529-I557 WeakPolarHBondContact CA-O 3.44Å; S529-I557 WeakPolarHBondContact CB-O 3.48Å; S529-I557 PolarHBondContact OG-O 3.12Å; S530-I557 PolarHBondContact N-O 2.95Å; S530-I557 PolarHBondContact OG-O 2.95Å; N537-I557 HydrophobicContact CB-CB 4.43Å; N537-I557 HydrophobicContact CB-CD1 3.97Å; N537-I557 HydrophobicContact CB-CG1 4.04Å; I539-I557 HydrophobicContact CD1-CD1 4.28Å; I539-I557 HydrophobicContact CG1-CD1 3.71Å; L554-I557 HydrophobicContact CB-CD1 3.97Å; L554-I557 HydrophobicContact CB-CG1 3.76Å; L554-I557 WeakPolarHBondContact O-CG1 3.46Å; R555-I557 PolarHBondContact O-N 2.79Å
558	R	92	Very high	92.6	Very high	77 Å²	77	51.7 Å²	51.7	29%	0.291	26%	0.258	S	S	.	.			trans	-89.9	-51.7	176.6	-69.6	-172.9	171.7	-172.6	0.2	112.2	V156 D159 F531 G556	V156-R558 HydrophobicContact CB-CB 4.35Å; V156-R558 HydrophobicContact CG1-CB 4.18Å; V156-R558 PolarHBondContact O-N 2.96Å; D159-R558 VanDerWaalsContact C-CZ 3.48Å; D159-R558 PolarHBondContact O-NE 2.77Å; D159-R558 VanDerWaalsContact O-NE 3.11Å; D159-R558 PolarHBondContact O-NH2 3.17Å; F531-R558 HydrophobicContact CE2-CB 3.93Å; F531-R558 HydrophobicContact CE2-CG 4.3Å; F531-R558 VanDerWaalsContact CE2-O 3.29Å; F531-R558 WeakPolarHBondContact CE2-O 3.44Å; F531-R558 HydrophobicContact CZ-CB 4.18Å; F531-R558 HydrophobicContact CZ-CG 4.15Å; G556-R558 PolarHBondContact O-N 3.48Å
559	T	92.6	Very high	92.4	Very high	34 Å²	34	57.8 Å²	57.8	21%	0.209	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	140.5	-175.1	60.6	0	0	0	0	111.2	V155 V156 W186	V155-T559 CarbonylContact C-O 3.54Å; V155-T559 VanDerWaalsContact CA-O 3.31Å; V155-T559 WeakPolarHBondContact CA-O 3.36Å; V155-T559 WeakPolarHBondContact CG2-O 3.32Å; V156-T559 WeakPolarHBondContact CB-OG1 3.29Å; V156-T559 VanDerWaalsContact CG2-OG1 3.24Å; V156-T559 WeakPolarHBondContact CG2-OG1 3.39Å; V156-T559 PolarHBondContact N-O 3.11Å; W186-T559 HydrophobicContact CB-CG2 3.95Å
560	F	95.3	Very high	92.4	Very high	13 Å²	13	58.9 Å²	58.9	6%	0.057	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.8	169.2	170.3	-91.9	0	0	0	108.8	F153 A154 V155 Q516 A525 T527 I539 F541 W562	F153-F560 HydrophobicContact CB-CE2 3.78Å; F153-F560 HydrophobicContact CB-CZ 4.03Å; F153-F560 HydrophobicContact CD1-CE2 4.49Å; F153-F560 AromaticContact CD2-CD2 3.95Å; F153-F560 HydrophobicContact CD2-CD2 3.95Å; F153-F560 AromaticContact CD2-CE2 3.43Å; F153-F560 HydrophobicContact CD2-CE2 3.43Å; F153-F560 VanDerWaalsContact CD2-CE2 3.43Å; F153-F560 HydrophobicContact CD2-CZ 4.43Å; F153-F560 HydrophobicContact CE2-CE2 4.08Å; F153-F560 AromaticContact CG-CE2 3.66Å; F153-F560 HydrophobicContact CG-CE2 3.66Å; F153-F560 HydrophobicContact CG-CZ 4.25Å; A154-F560 WeakPolarHBondContact O-CA 3.38Å; V155-F560 HydrophobicContact CG2-CB 4.28Å; V155-F560 HydrophobicContact CG2-CD2 4.22Å; Q516-F560 HydrophobicContact CB-CE1 4.27Å; Q516-F560 PolarHBondContact NE2-O 2.93Å; A525-F560 HydrophobicContact CB-CD1 4.41Å; A525-F560 HydrophobicContact CB-CE1 3.42Å; A525-F560 VanDerWaalsContact CB-CE1 3.42Å; A525-F560 HydrophobicContact CB-CE2 4.21Å; A525-F560 HydrophobicContact CB-CZ 3.28Å; T527-F560 HydrophobicContact CG2-CB 3.72Å; T527-F560 HydrophobicContact CG2-CD1 3.72Å; T527-F560 HydrophobicContact CG2-CD2 4.31Å; T527-F560 HydrophobicContact CG2-CE1 4.45Å; T527-F560 HydrophobicContact CG2-CG 3.64Å; I539-F560 HydrophobicContact CD1-CB 4.28Å; I539-F560 HydrophobicContact CD1-CD2 3.51Å; I539-F560 HydrophobicContact CD1-CE2 4.16Å; I539-F560 HydrophobicContact CD1-CG 4.15Å; I539-F560 HydrophobicContact CG2-CD2 4.41Å; I539-F560 HydrophobicContact CG2-CE2 4.2Å; F541-F560 HydrophobicContact CE1-CE2 4.36Å; F541-F560 HydrophobicContact CE1-CZ 4.32Å; F541-F560 HydrophobicContact CZ-CE2 4.24Å; F560-W562 AromaticContact CE1-CD1 3.77Å; F560-W562 HydrophobicContact CE1-CD2 4.49Å; F560-W562 HydrophobicContact CE1-CG 4.3Å; F560-W562 AromaticContact CE1-NE1 3.63Å; F560-W562 HydrophobicContact CZ-CD2 4.06Å; F560-W562 AromaticContact CZ-CE2 3.66Å; F560-W562 HydrophobicContact CZ-CG 4.31Å; F560-W562 HydrophobicContact CZ-CZ2 4.05Å; F560-W562 AromaticContact CZ-NE1 3.68Å
561	T	95.7	Very high	92.4	Very high	30 Å²	30	60 Å²	60	18%	0.184	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	129.3	175.3	177.9	0	0	0	0	111.9	F153 A154 W189	F153-T561 CarbonylContact C-O 3.59Å; F153-T561 WeakPolarHBondContact CA-O 3.49Å; A154-T561 HydrophobicContact CB-CG2 4.14Å; A154-T561 PolarHBondContact N-O 3.47Å; A154-T561 PolarHBondContact O-N 2.76Å; W189-T561 VanDerWaalsContact CD1-CG2 3.44Å; W189-T561 PolarHBondContact NE1-O 2.84Å
562	W	96.2	Very high	92.2	Very high	10 Å²	10	58 Å²	58	4%	0.038	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140.6	168.3	-70.9	111.3	0	0	0	111	D151 F153 H168 Q516 D518 P519 A525 F541 F560 P564	D151-W562 HydrophobicContact CB-CE3 4.41Å; D151-W562 HydrophobicContact CB-CZ3 4.35Å; F153-W562 HydrophobicContact CB-CD2 4.18Å; F153-W562 HydrophobicContact CB-CE3 3.71Å; F153-W562 HydrophobicContact CB-CZ3 4.03Å; F153-W562 HydrophobicContact CD1-CE3 4.25Å; F153-W562 HydrophobicContact CD1-CH2 4.06Å; F153-W562 AromaticContact CD1-CZ3 3.67Å; F153-W562 HydrophobicContact CD1-CZ3 3.67Å; F153-W562 HydrophobicContact CG-CE3 4.44Å; F153-W562 HydrophobicContact CG-CZ3 4.28Å; H168-W562 HydrophobicContact CB-CH2 3.81Å; H168-W562 HydrophobicContact CB-CZ3 3.7Å; H168-W562 AromaticContact CD2-CH2 3.99Å; H168-W562 AromaticContact CG-CH2 3.67Å; Q516-W562 PolarHBondContact O-NE1 3.44Å; Q516-W562 VanDerWaalsContact O-NE1 3.11Å; D518-W562 HydrophobicContact CB-CD2 3.99Å; D518-W562 HydrophobicContact CB-CE3 4.21Å; D518-W562 HydrophobicContact CB-CG 4.47Å; D518-W562 HydrophobicContact CB-CH2 4.35Å; D518-W562 HydrophobicContact CB-CZ2 4.09Å; D518-W562 HydrophobicContact CB-CZ3 4.4Å; P519-W562 HydrophobicContact CG-CB 4.48Å; A525-W562 HydrophobicContact CB-CZ2 3.79Å; F541-W562 AromaticContact CD1-CH2 3.96Å; F541-W562 HydrophobicContact CD1-CH2 3.96Å; F541-W562 AromaticContact CD1-CZ2 3.88Å; F541-W562 HydrophobicContact CD1-CZ2 3.88Å; F541-W562 AromaticContact CE1-CH2 3.6Å; F541-W562 HydrophobicContact CE1-CH2 3.6Å; F541-W562 AromaticContact CE1-CZ2 3.63Å; F541-W562 HydrophobicContact CE1-CZ2 3.63Å; F560-W562 AromaticContact CE1-CD1 3.77Å; F560-W562 HydrophobicContact CE1-CD2 4.49Å; F560-W562 HydrophobicContact CE1-CG 4.3Å; F560-W562 AromaticContact CE1-NE1 3.63Å; F560-W562 HydrophobicContact CZ-CD2 4.06Å; F560-W562 AromaticContact CZ-CE2 3.66Å; F560-W562 HydrophobicContact CZ-CG 4.31Å; F560-W562 HydrophobicContact CZ-CZ2 4.05Å; F560-W562 AromaticContact CZ-NE1 3.68Å; W562-P564 VanDerWaalsContact O-CD 3.22Å; W562-P564 WeakPolarHBondContact O-CD 3.39Å
563	R	96.3	Very high	92.2	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.008	34%	0.339	C	S	.	.			trans	-70.8	114.9	173.1	-174.1	173.6	-169.4	168.5	5	108.7	W143 Q152 W189 G193 P519	W143-R563 VanDerWaalsContact CD1-NH1 3.27Å; W143-R563 VanDerWaalsContact CG-NH1 3.34Å; Q152-R563 HydrophobicContact CB-CB 3.95Å; Q152-R563 VanDerWaalsContact O-CB 3.24Å; Q152-R563 WeakPolarHBondContact O-CB 3.21Å; Q152-R563 PolarHBondContact O-N 3.31Å; Q152-R563 VanDerWaalsContact OE1-CD 3.3Å; W189-R563 HydrophobicContact CD2-CB 4.06Å; W189-R563 HydrophobicContact CD2-CG 3.86Å; W189-R563 HydrophobicContact CE3-CB 4.5Å; W189-R563 HydrophobicContact CE3-CG 3.82Å; W189-R563 HydrophobicContact CG-CB 4.49Å; W189-R563 HydrophobicContact CH2-CB 4.37Å; W189-R563 HydrophobicContact CH2-CG 4.01Å; W189-R563 HydrophobicContact CZ2-CB 3.92Å; W189-R563 HydrophobicContact CZ2-CG 4.04Å; W189-R563 HydrophobicContact CZ3-CG 3.89Å; G193-R563 PolarHBondContact O-NE 3.45Å; G193-R563 PolarHBondContact O-NH2 3.47Å; P519-R563 WeakPolarHBondContact CG-O 3.29Å
564	P	94.5	Very high	92.2	Very high	35 Å²	35	62.9 Å²	62.9	23%	0.227	33%	0.327	C	S	.	.			trans	-62.5	153.5	-179.2	-23.6	35.6	0	0	0	112.1	W143 W189 P191 W562	W143-P564 WeakPolarHBondContact CZ2-O 3.33Å; W189-P564 HydrophobicContact CB-CG 4.09Å; P191-P564 VanDerWaalsContact O-CB 3.24Å; P191-P564 WeakPolarHBondContact O-CB 3.49Å; W562-P564 VanDerWaalsContact O-CD 3.22Å; W562-P564 WeakPolarHBondContact O-CD 3.39Å
565	R	91.2	Very high	92	Very high	85 Å²	85	65 Å²	65	32%	0.321	34%	0.339	S	S	.	.			trans	-104.5	137.2	171.1	-48.8	-168.8	71.9	172.7	-2	111.6	W143 D151 P519	W143-R565 HydrophobicContact CH2-CB 3.67Å; W143-R565 HydrophobicContact CH2-CG 3.39Å; W143-R565 HydrophobicContact CZ3-CB 4.44Å; W143-R565 HydrophobicContact CZ3-CG 3.69Å; D151-R565 WeakPolarHBondContact OD1-CD 3.44Å; P519-R565 HydrophobicContact CB-CB 4.26Å; P519-R565 HydrophobicContact CB-CG 3.53Å; P519-R565 HydrophobicContact CG-CG 4.01Å
566	P	90.1	Very high	91.9	Very high	24 Å²	24	61.9 Å²	61.9	16%	0.156	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-62.9	158.4	170.7	26	-31.7	0	0	0	110.8	L144 R192	L144-P566 HydrophobicContact CD1-CG 3.7Å; L144-P566 HydrophobicContact CD2-CG 4.47Å; R192-P566 HydrophobicContact CB-CB 4.16Å; R192-P566 WeakPolarHBondContact O-CD 3.42Å
567	P	86.1	Confident	91.9	Very high	102 Å²	102	64 Å²	64	66%	0.662	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-52	145.8	169.5	-26.6	34.7	0	0	0	112.1
568	T	86.7	Confident	91.7	Very high	85 Å²	85	66.7 Å²	66.7	52%	0.521	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-62	143.1	179.4	-175	0	0	0	0	111.4	L570 L575	T568-L570 VanDerWaalsContact C-N 3.3Å; T568-L570 WeakPolarHBondContact OG1-CB 3.37Å; T568-L570 WeakPolarHBondContact OG1-CG 3.42Å; T568-L570 PolarHBondContact OG1-N 2.92Å; T568-L575 HydrophobicContact CG2-CD1 4.26Å
569	L	88.8	Confident	91.5	Very high	167 Å²	167	70.5 Å²	70.5	87%	0.874	38%	0.382	S	S	*	.			trans	-84.5	-8.3	172.9	-63.4	174.9	0	0	0	112.4
570	L	90	Very high	91.4	Very high	72 Å²	72	77.1 Å²	77.1	38%	0.377	41%	0.408	S	S	.	.			trans	-70.4	139.5	-176.2	-62.5	175.2	0	0	0	111.4	T568 Q574 L575 I578	T568-L570 VanDerWaalsContact C-N 3.3Å; T568-L570 WeakPolarHBondContact OG1-CB 3.37Å; T568-L570 WeakPolarHBondContact OG1-CG 3.42Å; T568-L570 PolarHBondContact OG1-N 2.92Å; L570-Q574 HydrophobicContact CB-CB 4.28Å; L570-Q574 HydrophobicContact CD2-CB 4.37Å; L570-L575 HydrophobicContact CB-CD2 4.09Å; L570-L575 HydrophobicContact CB-CG 4.03Å; L570-L575 HydrophobicContact CD1-CD2 3.83Å; L570-I578 HydrophobicContact CD1-CD1 3.7Å
571	S	91.3	Very high	91.2	Very high	50 Å²	50	80.5 Å²	80.5	35%	0.35	43%	0.426	S	S	.	.			trans	-68.9	160.3	171.9	76.5	0	0	0	0	111.3	E573 Q574 L575	S571-E573 PolarHBondContact O-N 3.06Å; S571-Q574 PolarHBondContact O-N 3.42Å; S571-Q574 WeakPolarHBondContact OG-CG 3.4Å; S571-Q574 PolarHBondContact OG-N 3.15Å; S571-L575 WeakPolarHBondContact O-CG 3.07Å; S571-L575 PolarHBondContact O-N 3.32Å
572	A	89.4	Confident	90.9	Very high	70 Å²	70	82.8 Å²	82.8	58%	0.579	44%	0.436	S	S	*	.	H	α-helix	trans	-57.2	-36.5	175.3	0	0	0	0	0	112.1	L575 Q576	A572-L575 PolarHBondContact O-N 3.27Å; A572-Q576 WeakPolarHBondContact O-CG 3.12Å; A572-Q576 PolarHBondContact O-N 3.37Å
573	E	92.7	Very high	90.6	Very high	153 Å²	153	86.7 Å²	86.7	72%	0.715	47%	0.465	S	S	*	.	H	α-helix	trans	-65.4	-43.9	176.9	-63.9	177	176.4	0	0	112.1	S571 L575 Q576 A577	S571-E573 PolarHBondContact O-N 3.06Å; E573-L575 PolarHBondContact O-N 2.78Å; E573-Q576 PolarHBondContact O-N 3.1Å; E573-A577 WeakPolarHBondContact O-CB 3.33Å; E573-A577 PolarHBondContact O-N 2.89Å
574	Q	93.7	Very high	90.3	Very high	97 Å²	97	92.9 Å²	92.9	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-63.2	-42.8	176.6	-72.3	172.1	-29.7	0	0	111.1	L570 S571 Q576 A577 I578	L570-Q574 HydrophobicContact CB-CB 4.28Å; L570-Q574 HydrophobicContact CD2-CB 4.37Å; S571-Q574 PolarHBondContact O-N 3.42Å; S571-Q574 WeakPolarHBondContact OG-CG 3.4Å; S571-Q574 PolarHBondContact OG-N 3.15Å; Q574-Q576 VanDerWaalsContact C-N 3.33Å; Q574-Q576 PolarHBondContact O-N 2.74Å; Q574-A577 PolarHBondContact O-N 3.41Å; Q574-I578 VanDerWaalsContact O-CG1 3.29Å; Q574-I578 WeakPolarHBondContact O-CG1 3.49Å; Q574-I578 PolarHBondContact O-N 3.25Å
575	L	89.5	Confident	89.9	Confident	70 Å²	70	95.5 Å²	95.5	37%	0.366	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-40.8	175.1	-70.6	173.2	0	0	0	112	T568 L570 S571 A572 E573 I578 K579	T568-L575 HydrophobicContact CG2-CD1 4.26Å; L570-L575 HydrophobicContact CB-CD2 4.09Å; L570-L575 HydrophobicContact CB-CG 4.03Å; L570-L575 HydrophobicContact CD1-CD2 3.83Å; S571-L575 WeakPolarHBondContact O-CG 3.07Å; S571-L575 PolarHBondContact O-N 3.32Å; A572-L575 PolarHBondContact O-N 3.27Å; E573-L575 PolarHBondContact O-N 2.78Å; L575-I578 PolarHBondContact O-N 3.1Å; L575-K579 WeakPolarHBondContact O-CG 3.31Å; L575-K579 PolarHBondContact O-N 3.12Å
576	Q	90.5	Very high	89.8	Confident	120 Å²	120	95.6 Å²	95.6	56%	0.561	51%	0.505	S	S	*	.	H	α-helix	trans	-66.4	-40.6	174.6	-73.8	-179	7.1	0	0	112.3	A572 E573 Q574 I578 K579 K580	A572-Q576 WeakPolarHBondContact O-CG 3.12Å; A572-Q576 PolarHBondContact O-N 3.37Å; E573-Q576 PolarHBondContact O-N 3.1Å; Q574-Q576 VanDerWaalsContact C-N 3.33Å; Q574-Q576 PolarHBondContact O-N 2.74Å; Q576-I578 VanDerWaalsContact C-N 3.32Å; Q576-I578 PolarHBondContact O-N 2.99Å; Q576-K579 PolarHBondContact O-N 2.71Å; Q576-K580 WeakPolarHBondContact O-CG 3.46Å; Q576-K580 PolarHBondContact O-N 3.03Å
577	A	92.1	Very high	89.8	Confident	45 Å²	45	98.2 Å²	98.2	37%	0.372	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-38.9	175.9	0	0	0	0	0	111.9	E573 Q574 K580 N581	E573-A577 WeakPolarHBondContact O-CB 3.33Å; E573-A577 PolarHBondContact O-N 2.89Å; Q574-A577 PolarHBondContact O-N 3.41Å; A577-K580 PolarHBondContact O-N 3.4Å; A577-N581 PolarHBondContact O-N 2.68Å; A577-N581 VanDerWaalsContact O-N 3.07Å; A577-N581 PolarHBondContact O-ND2 3.07Å
578	I	90.1	Very high	89.9	Confident	59 Å²	59	97.7 Å²	97.7	30%	0.303	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-46	173.5	-68.6	163.8	0	0	0	110.6	L570 Q574 L575 Q576 K580 N581 M582 Y585	L570-I578 HydrophobicContact CD1-CD1 3.7Å; Q574-I578 VanDerWaalsContact O-CG1 3.29Å; Q574-I578 WeakPolarHBondContact O-CG1 3.49Å; Q574-I578 PolarHBondContact O-N 3.25Å; L575-I578 PolarHBondContact O-N 3.1Å; Q576-I578 VanDerWaalsContact C-N 3.32Å; Q576-I578 PolarHBondContact O-N 2.99Å; I578-K580 VanDerWaalsContact C-N 3.32Å; I578-K580 PolarHBondContact O-N 3.41Å; I578-N581 CarbonylContact O-C 3.56Å; I578-N581 PolarHBondContact O-N 2.67Å; I578-M582 HydrophobicContact CG2-CE 4.43Å; I578-M582 PolarHBondContact O-N 3.14Å; I578-M582 VanDerWaalsContact O-N 3.08Å; I578-Y585 HydrophobicContact CG2-CD2 4.43Å; I578-Y585 HydrophobicContact CG2-CE2 4.34Å
579	K	88.2	Confident	89.9	Confident	157 Å²	157	98 Å²	98	68%	0.683	51%	0.51	S	S	*	.	H	α-helix	trans	-59.6	-40.9	176.6	-72.8	-179.4	-179.6	-173.7	0	112.4	L575 Q576 N581 M582	L575-K579 WeakPolarHBondContact O-CG 3.31Å; L575-K579 PolarHBondContact O-N 3.12Å; Q576-K579 PolarHBondContact O-N 2.71Å; K579-N581 VanDerWaalsContact C-N 3.34Å; K579-N581 PolarHBondContact O-N 2.88Å; K579-M582 WeakPolarHBondContact O-CB 3.31Å; K579-M582 PolarHBondContact O-N 3.38Å
580	K	91.6	Very high	89.8	Confident	174 Å²	174	92.3 Å²	92.3	76%	0.757	49%	0.487	S	S	*	.	H	α-helix	trans	-64.1	-37.8	176.3	-72.5	-179.3	-179.9	-178.7	0	112.5	Q576 A577 I578	Q576-K580 WeakPolarHBondContact O-CG 3.46Å; Q576-K580 PolarHBondContact O-N 3.03Å; A577-K580 PolarHBondContact O-N 3.4Å; I578-K580 VanDerWaalsContact C-N 3.32Å; I578-K580 PolarHBondContact O-N 3.41Å
581	N	90.6	Very high	89.6	Confident	84 Å²	84	92.9 Å²	92.9	45%	0.449	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	14.5	-178.1	-69.1	-35.7	0	0	0	113.9	A577 I578 K579 S583 K584 Y585	A577-N581 PolarHBondContact O-N 2.68Å; A577-N581 VanDerWaalsContact O-N 3.07Å; A577-N581 PolarHBondContact O-ND2 3.07Å; I578-N581 CarbonylContact O-C 3.56Å; I578-N581 PolarHBondContact O-N 2.67Å; K579-N581 VanDerWaalsContact C-N 3.34Å; K579-N581 PolarHBondContact O-N 2.88Å; N581-S583 VanDerWaalsContact C-N 3.28Å; N581-S583 PolarHBondContact O-N 2.98Å; N581-K584 WeakPolarHBondContact O-CB 3.5Å; N581-K584 PolarHBondContact O-N 2.91Å; N581-K584 VanDerWaalsContact O-N 3.07Å; N581-Y585 HydrophobicContact CB-CD2 4.2Å; N581-Y585 HydrophobicContact CB-CE2 3.71Å; N581-Y585 VanDerWaalsContact O-CD2 3.27Å; N581-Y585 WeakPolarHBondContact O-CD2 3.42Å; N581-Y585 PolarHBondContact O-N 2.87Å
582	M	88.7	Confident	89.3	Confident	78 Å²	78	95.3 Å²	95.3	38%	0.384	50%	0.497	S	S	.	.	H	α-helix	trans	-57	-38.1	-173.1	-168.3	65.5	72.8	0	0	113.1	I578 K579 K584 Y585 N586	I578-M582 HydrophobicContact CG2-CE 4.43Å; I578-M582 PolarHBondContact O-N 3.14Å; I578-M582 VanDerWaalsContact O-N 3.08Å; K579-M582 WeakPolarHBondContact O-CB 3.31Å; K579-M582 PolarHBondContact O-N 3.38Å; M582-K584 VanDerWaalsContact C-N 3.29Å; M582-K584 PolarHBondContact O-N 3.36Å; M582-Y585 PolarHBondContact O-N 3.41Å; M582-N586 WeakPolarHBondContact O-CB 3.46Å; M582-N586 PolarHBondContact O-N 3.06Å; M582-N586 PolarHBondContact O-OD1 3.5Å
583	S	89.9	Confident	89	Confident	92 Å²	92	97 Å²	97	64%	0.643	50%	0.496	S	S	*	.	H	α-helix	trans	-58.7	-39.1	178.4	-178	0	0	0	0	112.9	N581 S587	N581-S583 VanDerWaalsContact C-N 3.28Å; N581-S583 PolarHBondContact O-N 2.98Å; S583-S587 PolarHBondContact O-N 2.82Å; S583-S587 VanDerWaalsContact O-N 3.14Å; S583-S587 PolarHBondContact O-OG 3.39Å
584	K	89.8	Confident	88.6	Confident	132 Å²	132	98 Å²	98	57%	0.574	49%	0.493	S	S	*	.	H	α-helix	trans	-66.6	-48.1	177	-177.3	-177.4	177.2	-177.7	0	110.9	N581 M582 S587 Q588	N581-K584 WeakPolarHBondContact O-CB 3.5Å; N581-K584 PolarHBondContact O-N 2.91Å; N581-K584 VanDerWaalsContact O-N 3.07Å; M582-K584 VanDerWaalsContact C-N 3.29Å; M582-K584 PolarHBondContact O-N 3.36Å; K584-S587 PolarHBondContact O-N 2.97Å; K584-Q588 WeakPolarHBondContact O-CG 3.47Å; K584-Q588 PolarHBondContact O-N 3.43Å; K584-Q588 VanDerWaalsContact O-N 3.12Å
585	Y	87.7	Confident	88.2	Confident	89 Å²	89	99.4 Å²	99.4	35%	0.349	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-41.5	179.5	-63.8	-58.1	0	0	0	112	I578 N581 M582 S587 Q588 L589	I578-Y585 HydrophobicContact CG2-CD2 4.43Å; I578-Y585 HydrophobicContact CG2-CE2 4.34Å; N581-Y585 HydrophobicContact CB-CD2 4.2Å; N581-Y585 HydrophobicContact CB-CE2 3.71Å; N581-Y585 VanDerWaalsContact O-CD2 3.27Å; N581-Y585 WeakPolarHBondContact O-CD2 3.42Å; N581-Y585 PolarHBondContact O-N 2.87Å; M582-Y585 PolarHBondContact O-N 3.41Å; Y585-S587 VanDerWaalsContact C-N 3.3Å; Y585-S587 PolarHBondContact O-N 3.4Å; Y585-Q588 PolarHBondContact O-N 3.2Å; Y585-L589 WeakPolarHBondContact O-CB 3.41Å; Y585-L589 VanDerWaalsContact O-CG 3.29Å; Y585-L589 WeakPolarHBondContact O-CG 3.31Å; Y585-L589 PolarHBondContact O-N 3.09Å
586	N	89.2	Confident	87.8	Confident	88 Å²	88	98.1 Å²	98.1	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-56.6	-44.7	174.9	-73.7	-8.8	0	0	0	111.6	M582 A590	M582-N586 WeakPolarHBondContact O-CB 3.46Å; M582-N586 PolarHBondContact O-N 3.06Å; M582-N586 PolarHBondContact O-OD1 3.5Å; N586-A590 WeakPolarHBondContact O-CB 3.44Å; N586-A590 PolarHBondContact O-N 2.8Å
587	S	89.1	Confident	87.2	Confident	79 Å²	79	95.2 Å²	95.2	55%	0.552	49%	0.491	S	S	*	.	H	α-helix	trans	-64.9	-40.2	178.5	-57.9	0	0	0	0	112.4	S583 K584 Y585 N591	S583-S587 PolarHBondContact O-N 2.82Å; S583-S587 VanDerWaalsContact O-N 3.14Å; S583-S587 PolarHBondContact O-OG 3.39Å; K584-S587 PolarHBondContact O-N 2.97Å; Y585-S587 VanDerWaalsContact C-N 3.3Å; Y585-S587 PolarHBondContact O-N 3.4Å; S587-N591 WeakPolarHBondContact O-CB 3.31Å; S587-N591 PolarHBondContact O-N 3.04Å
588	Q	88.6	Confident	86.7	Confident	91 Å²	91	96.9 Å²	96.9	43%	0.425	50%	0.5	S	S	.	.	H	α-helix	trans	-66.2	-52.5	177.1	-70.7	175.7	-28.5	0	0	111.3	K584 Y585 A590 N591 E592	K584-Q588 WeakPolarHBondContact O-CG 3.47Å; K584-Q588 PolarHBondContact O-N 3.43Å; K584-Q588 VanDerWaalsContact O-N 3.12Å; Y585-Q588 PolarHBondContact O-N 3.2Å; Q588-A590 PolarHBondContact O-N 3.23Å; Q588-N591 WeakPolarHBondContact O-CB 3.24Å; Q588-N591 PolarHBondContact O-N 3.42Å; Q588-N591 VanDerWaalsContact O-N 3.13Å; Q588-E592 PolarHBondContact O-N 3.44Å
589	L	86.4	Confident	86.3	Confident	90 Å²	90	99.2 Å²	99.2	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-63	-41.4	-179.7	-68.4	172.5	0	0	0	111.9	Y585 N591 E592 D593	Y585-L589 WeakPolarHBondContact O-CB 3.41Å; Y585-L589 VanDerWaalsContact O-CG 3.29Å; Y585-L589 WeakPolarHBondContact O-CG 3.31Å; Y585-L589 PolarHBondContact O-N 3.09Å; L589-N591 VanDerWaalsContact C-N 3.26Å; L589-N591 PolarHBondContact O-N 3.13Å; L589-E592 PolarHBondContact O-N 2.85Å; L589-D593 WeakPolarHBondContact O-CB 3.32Å; L589-D593 PolarHBondContact O-N 3.41Å
590	A	85.8	Confident	85.7	Confident	48 Å²	48	93.4 Å²	93.4	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-63.5	-32.8	176.2	0	0	0	0	0	112.5	N586 Q588 R594	N586-A590 WeakPolarHBondContact O-CB 3.44Å; N586-A590 PolarHBondContact O-N 2.8Å; Q588-A590 PolarHBondContact O-N 3.23Å; A590-R594 WeakPolarHBondContact O-CB 3.35Å; A590-R594 PolarHBondContact O-N 3.17Å; A590-R594 VanDerWaalsContact O-N 3.1Å
591	N	87.7	Confident	85.1	Confident	85 Å²	85	88.1 Å²	88.1	46%	0.455	47%	0.474	S	S	.	.	H	α-helix	trans	-71.7	-43.4	174.5	-168.8	42.8	0	0	0	111.3	S587 Q588 L589 R594 M595	S587-N591 WeakPolarHBondContact O-CB 3.31Å; S587-N591 PolarHBondContact O-N 3.04Å; Q588-N591 WeakPolarHBondContact O-CB 3.24Å; Q588-N591 PolarHBondContact O-N 3.42Å; Q588-N591 VanDerWaalsContact O-N 3.13Å; L589-N591 VanDerWaalsContact C-N 3.26Å; L589-N591 PolarHBondContact O-N 3.13Å; N591-R594 PolarHBondContact O-N 2.84Å; N591-M595 VanDerWaalsContact O-CG 3.27Å; N591-M595 WeakPolarHBondContact O-CG 3.35Å; N591-M595 PolarHBondContact O-N 3.21Å
592	E	84.5	Confident	84.7	Confident	101 Å²	101	91 Å²	91	47%	0.472	48%	0.478	S	S	.	.	H	α-helix	trans	-60.5	-46.8	174.6	-71.7	175	-176.8	0	0	111.7	Q588 L589 R594 M595 L596	Q588-E592 PolarHBondContact O-N 3.44Å; L589-E592 PolarHBondContact O-N 2.85Å; E592-R594 VanDerWaalsContact C-N 3.32Å; E592-R594 PolarHBondContact O-N 3.14Å; E592-M595 PolarHBondContact O-N 3.04Å; E592-M595 VanDerWaalsContact O-N 3.15Å; E592-L596 WeakPolarHBondContact O-CB 3.33Å; E592-L596 VanDerWaalsContact O-CG 3.31Å; E592-L596 WeakPolarHBondContact O-CG 3.49Å; E592-L596 PolarHBondContact O-N 2.91Å
593	D	83.3	Confident	84.3	Confident	106 Å²	106	92 Å²	92	57%	0.567	48%	0.482	S	S	*	.	H	α-helix	trans	-59.9	-41.8	176.7	-77.7	-18.4	0	0	0	111.6	L589 L596 A597	L589-D593 WeakPolarHBondContact O-CB 3.32Å; L589-D593 PolarHBondContact O-N 3.41Å; D593-L596 PolarHBondContact O-N 3.11Å; D593-A597 VanDerWaalsContact O-CB 3.27Å; D593-A597 WeakPolarHBondContact O-CB 2.98Å; D593-A597 PolarHBondContact O-N 3.01Å
594	R	84.5	Confident	83.7	Confident	172 Å²	172	90.4 Å²	90.4	65%	0.649	47%	0.466	S	S	*	.	H	α-helix	trans	-62.8	-42.9	175.5	-171.2	-173.3	-59.1	152.4	1.6	111.6	A590 N591 E592 S598	A590-R594 WeakPolarHBondContact O-CB 3.35Å; A590-R594 PolarHBondContact O-N 3.17Å; A590-R594 VanDerWaalsContact O-N 3.1Å; N591-R594 PolarHBondContact O-N 2.84Å; E592-R594 VanDerWaalsContact C-N 3.32Å; E592-R594 PolarHBondContact O-N 3.14Å; R594-S598 WeakPolarHBondContact O-CB 3.41Å; R594-S598 PolarHBondContact O-N 2.84Å
595	M	84.8	Confident	83.2	Confident	127 Å²	127	88.3 Å²	88.3	63%	0.626	46%	0.461	S	S	*	.	H	α-helix	trans	-65.7	-41.6	177.6	-70.5	-64.7	-71.8	0	0	111.6	N591 E592 S598 K599	N591-M595 VanDerWaalsContact O-CG 3.27Å; N591-M595 WeakPolarHBondContact O-CG 3.35Å; N591-M595 PolarHBondContact O-N 3.21Å; E592-M595 PolarHBondContact O-N 3.04Å; E592-M595 VanDerWaalsContact O-N 3.15Å; M595-S598 PolarHBondContact O-N 2.97Å; M595-K599 WeakPolarHBondContact O-CB 3.35Å; M595-K599 PolarHBondContact O-N 2.9Å
596	L	80	Confident	83.1	Confident	44 Å²	44	88.9 Å²	88.9	23%	0.23	47%	0.467	C	S	.	.	H	α-helix	trans	-66.7	-43.4	176.5	-71.1	169.5	0	0	0	112.2	F148 E592 D593 S598 K599 A600	F148-L596 HydrophobicContact CD1-CD1 3.45Å; F148-L596 VanDerWaalsContact CD1-CD1 3.45Å; F148-L596 HydrophobicContact CD1-CD2 4.32Å; F148-L596 HydrophobicContact CD1-CG 4.46Å; F148-L596 HydrophobicContact CE1-CD1 3.55Å; F148-L596 HydrophobicContact CE1-CD2 3.66Å; F148-L596 HydrophobicContact CE1-CG 4.11Å; F148-L596 HydrophobicContact CG-CD1 4.29Å; F148-L596 HydrophobicContact CZ-CD1 4.46Å; F148-L596 HydrophobicContact CZ-CD2 3.84Å; E592-L596 WeakPolarHBondContact O-CB 3.33Å; E592-L596 VanDerWaalsContact O-CG 3.31Å; E592-L596 WeakPolarHBondContact O-CG 3.49Å; E592-L596 PolarHBondContact O-N 2.91Å; D593-L596 PolarHBondContact O-N 3.11Å; L596-S598 VanDerWaalsContact C-N 3.3Å; L596-S598 PolarHBondContact O-N 3.01Å; L596-K599 PolarHBondContact O-N 3.04Å; L596-A600 VanDerWaalsContact O-CB 3.31Å; L596-A600 WeakPolarHBondContact O-CB 3.44Å; L596-A600 PolarHBondContact O-N 2.82Å
597	A	79	Confident	82.9	Confident	59 Å²	59	90.8 Å²	90.8	49%	0.488	47%	0.471	S	S	.	.	H	α-helix	trans	-61.5	-40.5	175.2	0	0	0	0	0	111.3	D593 S601	D593-A597 VanDerWaalsContact O-CB 3.27Å; D593-A597 WeakPolarHBondContact O-CB 2.98Å; D593-A597 PolarHBondContact O-N 3.01Å; A597-S601 WeakPolarHBondContact O-CB 3.21Å; A597-S601 PolarHBondContact O-N 2.87Å
598	S	82.3	Confident	82.8	Confident	79 Å²	79	94.7 Å²	94.7	55%	0.552	47%	0.474	S	S	*	.	H	α-helix	trans	-63.2	-45.6	174.4	-176.2	0	0	0	0	112	R594 M595 L596 S601 R602	R594-S598 WeakPolarHBondContact O-CB 3.41Å; R594-S598 PolarHBondContact O-N 2.84Å; M595-S598 PolarHBondContact O-N 2.97Å; L596-S598 VanDerWaalsContact C-N 3.3Å; L596-S598 PolarHBondContact O-N 3.01Å; S598-S601 PolarHBondContact O-N 2.94Å; S598-R602 WeakPolarHBondContact O-CB 3.41Å; S598-R602 PolarHBondContact O-N 3.07Å
599	K	81.7	Confident	82.8	Confident	108 Å²	108	96 Å²	96	47%	0.47	48%	0.479	S	S	.	.	H	α-helix	trans	-62.9	-47.1	176.6	-173.4	-178.8	175	-176.1	0	112.1	M595 L596 R602 E603	M595-K599 WeakPolarHBondContact O-CB 3.35Å; M595-K599 PolarHBondContact O-N 2.9Å; L596-K599 PolarHBondContact O-N 3.04Å; K599-R602 PolarHBondContact O-N 3.25Å; K599-E603 WeakPolarHBondContact CE-OE1 3.3Å; K599-E603 WeakPolarHBondContact O-CG 3.41Å; K599-E603 PolarHBondContact O-N 2.8Å
600	A	75.5	Confident	83.1	Confident	35 Å²	35	98.1 Å²	98.1	29%	0.289	49%	0.485	S	S	.	.	H	α-helix	trans	-64.6	-40.6	178.5	0	0	0	0	0	111.8	L596 E603 L604	L596-A600 VanDerWaalsContact O-CB 3.31Å; L596-A600 WeakPolarHBondContact O-CB 3.44Å; L596-A600 PolarHBondContact O-N 2.82Å; A600-E603 PolarHBondContact O-N 2.79Å; A600-L604 VanDerWaalsContact O-CB 3.26Å; A600-L604 WeakPolarHBondContact O-CB 3.45Å; A600-L604 PolarHBondContact O-N 3Å
601	S	77.6	Confident	83.3	Confident	63 Å²	63	100.5 Å²	100.5	44%	0.441	49%	0.491	S	S	.	.	H	α-helix	trans	-61.4	-44.2	174.2	-173.9	0	0	0	0	111.1	A597 S598 L604 L605	A597-S601 WeakPolarHBondContact O-CB 3.21Å; A597-S601 PolarHBondContact O-N 2.87Å; S598-S601 PolarHBondContact O-N 2.94Å; S601-L604 PolarHBondContact O-N 2.76Å; S601-L605 VanDerWaalsContact O-CB 3.25Å; S601-L605 WeakPolarHBondContact O-CB 3.02Å; S601-L605 WeakPolarHBondContact O-CD1 3.4Å; S601-L605 WeakPolarHBondContact O-CG 3.47Å; S601-L605 PolarHBondContact O-N 3.11Å
602	R	83	Confident	83.5	Confident	144 Å²	144	101.3 Å²	101.3	54%	0.543	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-49.1	175.8	-175.9	179.7	65.6	-169	1.1	112.2	S598 K599 L604 L605 E606	S598-R602 WeakPolarHBondContact O-CB 3.41Å; S598-R602 PolarHBondContact O-N 3.07Å; K599-R602 PolarHBondContact O-N 3.25Å; R602-L604 VanDerWaalsContact C-N 3.33Å; R602-L604 PolarHBondContact O-N 2.89Å; R602-L605 WeakPolarHBondContact O-CB 3.23Å; R602-L605 PolarHBondContact O-N 2.95Å; R602-E606 HydrophobicContact CG-CG 4.48Å; R602-E606 WeakPolarHBondContact CG-OE1 3.38Å; R602-E606 WeakPolarHBondContact O-CB 3.4Å; R602-E606 WeakPolarHBondContact O-CG 3.44Å; R602-E606 PolarHBondContact O-N 2.9Å
603	E	80.2	Confident	84	Confident	99 Å²	99	100.1 Å²	100.1	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-62.7	-40	179	-73.1	172.6	-173.4	0	0	111.9	K599 A600 E606 K607	K599-E603 WeakPolarHBondContact CE-OE1 3.3Å; K599-E603 WeakPolarHBondContact O-CG 3.41Å; K599-E603 PolarHBondContact O-N 2.8Å; A600-E603 PolarHBondContact O-N 2.79Å; E603-E606 PolarHBondContact O-N 2.86Å; E603-K607 WeakPolarHBondContact O-CB 3.5Å; E603-K607 PolarHBondContact O-N 2.94Å
604	L	76.1	Confident	84.5	Confident	59 Å²	59	99.7 Å²	99.7	31%	0.309	49%	0.489	S	S	.	.	H	α-helix	trans	-65.6	-43.6	175	-176.4	68	0	0	0	111.6	A600 S601 R602 K607 R608	A600-L604 VanDerWaalsContact O-CB 3.26Å; A600-L604 WeakPolarHBondContact O-CB 3.45Å; A600-L604 PolarHBondContact O-N 3Å; S601-L604 PolarHBondContact O-N 2.76Å; R602-L604 VanDerWaalsContact C-N 3.33Å; R602-L604 PolarHBondContact O-N 2.89Å; L604-K607 PolarHBondContact O-N 2.83Å; L604-R608 WeakPolarHBondContact O-CB 3.5Å; L604-R608 VanDerWaalsContact O-CG 3.29Å; L604-R608 WeakPolarHBondContact O-CG 3.5Å; L604-R608 PolarHBondContact O-N 3.16Å
605	L	80.1	Confident	85	Confident	88 Å²	88	96.6 Å²	96.6	46%	0.461	48%	0.48	S	S	.	.	H	α-helix	trans	-61	-45.1	175.5	-80.8	161.1	0	0	0	111	S601 R602 R608 Q609	S601-L605 VanDerWaalsContact O-CB 3.25Å; S601-L605 WeakPolarHBondContact O-CB 3.02Å; S601-L605 WeakPolarHBondContact O-CD1 3.4Å; S601-L605 WeakPolarHBondContact O-CG 3.47Å; S601-L605 PolarHBondContact O-N 3.11Å; R602-L605 WeakPolarHBondContact O-CB 3.23Å; R602-L605 PolarHBondContact O-N 2.95Å; L605-R608 PolarHBondContact O-N 3.32Å; L605-Q609 VanDerWaalsContact O-CB 3.32Å; L605-Q609 WeakPolarHBondContact O-CB 3.35Å; L605-Q609 VanDerWaalsContact O-CG 3.24Å; L605-Q609 WeakPolarHBondContact O-CG 3.25Å; L605-Q609 PolarHBondContact O-N 2.89Å
606	E	86.7	Confident	85.4	Confident	102 Å²	102	93.6 Å²	93.6	48%	0.477	47%	0.467	S	S	.	.	H	α-helix	trans	-62.4	-45	176.4	-75.4	171.6	-171.6	0	0	111.7	R602 E603 R608 Q609 K610	R602-E606 HydrophobicContact CG-CG 4.48Å; R602-E606 WeakPolarHBondContact CG-OE1 3.38Å; R602-E606 WeakPolarHBondContact O-CB 3.4Å; R602-E606 WeakPolarHBondContact O-CG 3.44Å; R602-E606 PolarHBondContact O-N 2.9Å; E603-E606 PolarHBondContact O-N 2.86Å; E606-R608 PolarHBondContact O-N 3.39Å; E606-Q609 PolarHBondContact O-N 3.48Å; E606-K610 WeakPolarHBondContact O-CB 3.49Å; E606-K610 PolarHBondContact O-N 3.26Å
607	K	84.1	Confident	86.1	Confident	128 Å²	128	96.9 Å²	96.9	56%	0.557	48%	0.483	S	S	*	.	H	α-helix	trans	-61.8	-43.8	175.6	-172.4	179.4	179.5	-177.1	0	111.5	E603 L604 K610 L611	E603-K607 WeakPolarHBondContact O-CB 3.5Å; E603-K607 PolarHBondContact O-N 2.94Å; L604-K607 PolarHBondContact O-N 2.83Å; K607-K610 PolarHBondContact O-N 2.93Å; K607-L611 HydrophobicContact CG-CD1 4.47Å; K607-L611 WeakPolarHBondContact O-CG 3.36Å; K607-L611 PolarHBondContact O-N 3.01Å
608	R	87.2	Confident	86.8	Confident	161 Å²	161	101.3 Å²	101.3	61%	0.608	49%	0.487	S	S	*	.	H	α-helix	trans	-64.9	-42.1	175.9	-75.8	178.1	177.1	-174.7	-0.1	111.8	L604 L605 E606 L611 L612	L604-R608 WeakPolarHBondContact O-CB 3.5Å; L604-R608 VanDerWaalsContact O-CG 3.29Å; L604-R608 WeakPolarHBondContact O-CG 3.5Å; L604-R608 PolarHBondContact O-N 3.16Å; L605-R608 PolarHBondContact O-N 3.32Å; E606-R608 PolarHBondContact O-N 3.39Å; R608-L611 PolarHBondContact O-N 3.03Å; R608-L612 WeakPolarHBondContact O-CB 3.37Å; R608-L612 PolarHBondContact O-N 2.96Å
609	Q	88	Confident	87.4	Confident	117 Å²	117	102.1 Å²	102.1	55%	0.547	48%	0.481	S	S	.	.	H	α-helix	trans	-63	-41.5	175.4	-78.2	176.4	0	0	0	111.4	L605 E606 L612 T613	L605-Q609 VanDerWaalsContact O-CB 3.32Å; L605-Q609 WeakPolarHBondContact O-CB 3.35Å; L605-Q609 VanDerWaalsContact O-CG 3.24Å; L605-Q609 WeakPolarHBondContact O-CG 3.25Å; L605-Q609 PolarHBondContact O-N 2.89Å; E606-Q609 PolarHBondContact O-N 3.48Å; Q609-L612 PolarHBondContact O-N 2.77Å; Q609-T613 VanDerWaalsContact O-CB 3.31Å; Q609-T613 WeakPolarHBondContact O-CB 3.44Å; Q609-T613 PolarHBondContact O-N 2.82Å; Q609-T613 PolarHBondContact O-OG1 2.84Å
610	K	92	Very high	88	Confident	136 Å²	136	101 Å²	101	59%	0.591	48%	0.48	S	S	*	.	H	α-helix	trans	-61.6	-50.2	175.1	-173.5	178.6	176.7	-177	0	111.6	E606 K607 L612 T613 E614	E606-K610 WeakPolarHBondContact O-CB 3.49Å; E606-K610 PolarHBondContact O-N 3.26Å; K607-K610 PolarHBondContact O-N 2.93Å; K610-L612 VanDerWaalsContact C-N 3.34Å; K610-L612 PolarHBondContact O-N 3.41Å; K610-T613 WeakPolarHBondContact O-CB 3.46Å; K610-T613 PolarHBondContact O-N 2.92Å; K610-T613 VanDerWaalsContact O-N 3.17Å; K610-E614 WeakPolarHBondContact CE-OE1 3.41Å; K610-E614 WeakPolarHBondContact O-CG 3.41Å; K610-E614 PolarHBondContact O-N 3.07Å
611	L	91.2	Very high	88.9	Confident	98 Å²	98	102 Å²	102	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-41.7	176.3	-73.1	171	0	0	0	112.2	K607 R608 T613 E614 F615	K607-L611 HydrophobicContact CG-CD1 4.47Å; K607-L611 WeakPolarHBondContact O-CG 3.36Å; K607-L611 PolarHBondContact O-N 3.01Å; R608-L611 PolarHBondContact O-N 3.03Å; L611-T613 VanDerWaalsContact C-N 3.31Å; L611-T613 PolarHBondContact O-N 2.89Å; L611-E614 PolarHBondContact O-N 3.47Å; L611-F615 VanDerWaalsContact O-CB 3.24Å; L611-F615 WeakPolarHBondContact O-CB 3.46Å; L611-F615 PolarHBondContact O-N 3.45Å
612	L	92.4	Very high	89.6	Confident	101 Å²	101	103 Å²	103	53%	0.529	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-38.2	176.2	-176.1	65.2	0	0	0	111.4	R608 Q609 K610 N616	R608-L612 WeakPolarHBondContact O-CB 3.37Å; R608-L612 PolarHBondContact O-N 2.96Å; Q609-L612 PolarHBondContact O-N 2.77Å; K610-L612 VanDerWaalsContact C-N 3.34Å; K610-L612 PolarHBondContact O-N 3.41Å; L612-N616 VanDerWaalsContact O-CB 3.26Å; L612-N616 WeakPolarHBondContact O-CB 3.48Å; L612-N616 PolarHBondContact O-N 3.42Å; L612-N616 PolarHBondContact O-ND2 3.09Å
613	T	94.2	Very high	90	Very high	77 Å²	77	99.5 Å²	99.5	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-68.2	-47.3	176.9	-57.6	0	0	0	0	111	Q609 K610 L611 F615 N616 I617	Q609-T613 VanDerWaalsContact O-CB 3.31Å; Q609-T613 WeakPolarHBondContact O-CB 3.44Å; Q609-T613 PolarHBondContact O-N 2.82Å; Q609-T613 PolarHBondContact O-OG1 2.84Å; K610-T613 WeakPolarHBondContact O-CB 3.46Å; K610-T613 PolarHBondContact O-N 2.92Å; K610-T613 VanDerWaalsContact O-N 3.17Å; L611-T613 VanDerWaalsContact C-N 3.31Å; L611-T613 PolarHBondContact O-N 2.89Å; T613-F615 VanDerWaalsContact C-N 3.33Å; T613-F615 PolarHBondContact O-N 3.46Å; T613-N616 PolarHBondContact O-N 3.23Å; T613-I617 HydrophobicContact CG2-CD1 3.92Å; T613-I617 HydrophobicContact CG2-CG1 4.48Å; T613-I617 WeakPolarHBondContact O-CB 3.37Å; T613-I617 VanDerWaalsContact O-CG1 3.25Å; T613-I617 WeakPolarHBondContact O-CG1 3.36Å; T613-I617 PolarHBondContact O-N 3Å
614	E	94	Very high	90.6	Very high	96 Å²	96	102 Å²	102	45%	0.449	49%	0.489	S	S	.	.	H	α-helix	trans	-58	-45.3	174.1	-73.3	172.7	-176.1	0	0	111.2	K610 L611 I617 W618	K610-E614 WeakPolarHBondContact CE-OE1 3.41Å; K610-E614 WeakPolarHBondContact O-CG 3.41Å; K610-E614 PolarHBondContact O-N 3.07Å; L611-E614 PolarHBondContact O-N 3.47Å; E614-I617 PolarHBondContact O-N 2.88Å; E614-W618 WeakPolarHBondContact O-CB 3.39Å; E614-W618 PolarHBondContact O-N 3.21Å
615	F	94.5	Very high	91.3	Very high	108 Å²	108	103.8 Å²	103.8	47%	0.474	50%	0.498	S	S	.	.	H	α-helix	trans	-62.2	-43.9	175.3	-179.9	-100.3	0	0	0	112.2	L611 T613 W618 K619	L611-F615 VanDerWaalsContact O-CB 3.24Å; L611-F615 WeakPolarHBondContact O-CB 3.46Å; L611-F615 PolarHBondContact O-N 3.45Å; T613-F615 VanDerWaalsContact C-N 3.33Å; T613-F615 PolarHBondContact O-N 3.46Å; F615-W618 HydrophobicContact CD2-CE3 4.01Å; F615-W618 HydrophobicContact CD2-CZ3 4.23Å; F615-W618 AromaticContact CE2-CE3 3.95Å; F615-W618 HydrophobicContact CE2-CE3 3.95Å; F615-W618 AromaticContact CE2-CZ3 3.71Å; F615-W618 HydrophobicContact CE2-CZ3 3.71Å; F615-W618 HydrophobicContact CZ-CZ3 4.35Å; F615-W618 PolarHBondContact O-N 2.91Å; F615-K619 HydrophobicContact CE1-CD 4.19Å; F615-K619 WeakPolarHBondContact O-CB 3.33Å; F615-K619 PolarHBondContact O-N 3.41Å
616	N	94.1	Very high	91.6	Very high	63 Å²	63	104.8 Å²	104.8	34%	0.337	50%	0.496	S	S	.	.	H	α-helix	trans	-67.5	-38.6	178.1	-78.2	-29.1	0	0	0	112.3	L612 T613 N620	L612-N616 VanDerWaalsContact O-CB 3.26Å; L612-N616 WeakPolarHBondContact O-CB 3.48Å; L612-N616 PolarHBondContact O-N 3.42Å; L612-N616 PolarHBondContact O-ND2 3.09Å; T613-N616 PolarHBondContact O-N 3.23Å; N616-N620 WeakPolarHBondContact O-CB 3.37Å; N616-N620 PolarHBondContact O-N 2.89Å; N616-N620 PolarHBondContact O-ND2 3.24Å; N616-N620 VanDerWaalsContact O-ND2 3.13Å
617	I	94.6	Very high	91.7	Very high	113 Å²	113	104.1 Å²	104.1	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-61.6	-49.6	173.6	-70.7	165.8	0	0	0	109.8	T613 E614 N620 A621	T613-I617 HydrophobicContact CG2-CD1 3.92Å; T613-I617 HydrophobicContact CG2-CG1 4.48Å; T613-I617 WeakPolarHBondContact O-CB 3.37Å; T613-I617 VanDerWaalsContact O-CG1 3.25Å; T613-I617 WeakPolarHBondContact O-CG1 3.36Å; T613-I617 PolarHBondContact O-N 3Å; E614-I617 PolarHBondContact O-N 2.88Å; I617-N620 PolarHBondContact O-N 2.79Å; I617-A621 WeakPolarHBondContact O-CB 3.49Å; I617-A621 PolarHBondContact O-N 2.72Å
618	W	94.2	Very high	91.9	Very high	152 Å²	152	106 Å²	106	58%	0.576	50%	0.504	S	S	*	.	H	α-helix	trans	-59.3	-51.1	176.9	171.4	81.1	0	0	0	111.6	E614 F615 N620 A621 I622	E614-W618 WeakPolarHBondContact O-CB 3.39Å; E614-W618 PolarHBondContact O-N 3.21Å; F615-W618 HydrophobicContact CD2-CE3 4.01Å; F615-W618 HydrophobicContact CD2-CZ3 4.23Å; F615-W618 AromaticContact CE2-CE3 3.95Å; F615-W618 HydrophobicContact CE2-CE3 3.95Å; F615-W618 AromaticContact CE2-CZ3 3.71Å; F615-W618 HydrophobicContact CE2-CZ3 3.71Å; F615-W618 HydrophobicContact CZ-CZ3 4.35Å; F615-W618 PolarHBondContact O-N 2.91Å; W618-N620 VanDerWaalsContact C-N 3.34Å; W618-N620 PolarHBondContact O-N 3.45Å; W618-A621 WeakPolarHBondContact O-CB 3.41Å; W618-A621 PolarHBondContact O-N 2.87Å; W618-A621 VanDerWaalsContact O-N 3.13Å; W618-I622 HydrophobicContact CD2-CG1 4.38Å; W618-I622 HydrophobicContact CZ2-CG1 4.17Å; W618-I622 WeakPolarHBondContact O-CG1 3.48Å; W618-I622 PolarHBondContact O-N 3.04Å
619	K	93.9	Very high	91.8	Very high	96 Å²	96	100.9 Å²	100.9	42%	0.417	49%	0.489	S	S	.	.	H	α-helix	trans	-56.2	-47.2	177.3	179.4	-177.4	175	-178.4	0	111.3	F615 A621 I622 I623	F615-K619 HydrophobicContact CE1-CD 4.19Å; F615-K619 WeakPolarHBondContact O-CB 3.33Å; F615-K619 PolarHBondContact O-N 3.41Å; K619-A621 VanDerWaalsContact C-N 3.35Å; K619-A621 PolarHBondContact O-N 2.99Å; K619-I622 PolarHBondContact O-N 3.08Å; K619-I623 HydrophobicContact CG-CD1 3.87Å; K619-I623 VanDerWaalsContact O-CG1 3.3Å; K619-I623 WeakPolarHBondContact O-CG1 3.23Å; K619-I623 PolarHBondContact O-N 2.76Å
620	N	94.7	Very high	91.4	Very high	84 Å²	84	100.5 Å²	100.5	45%	0.449	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-33.6	178.9	-72.2	-25.1	0	0	0	112.4	N616 I617 W618 K624	N616-N620 WeakPolarHBondContact O-CB 3.37Å; N616-N620 PolarHBondContact O-N 2.89Å; N616-N620 PolarHBondContact O-ND2 3.24Å; N616-N620 VanDerWaalsContact O-ND2 3.13Å; I617-N620 PolarHBondContact O-N 2.79Å; W618-N620 VanDerWaalsContact C-N 3.34Å; W618-N620 PolarHBondContact O-N 3.45Å; N620-K624 WeakPolarHBondContact O-CB 3.23Å; N620-K624 VanDerWaalsContact O-CG 3.23Å; N620-K624 WeakPolarHBondContact O-CG 3.4Å; N620-K624 PolarHBondContact O-N 3.26Å
621	A	93.7	Very high	90.8	Very high	56 Å²	56	102 Å²	102	46%	0.463	50%	0.496	S	S	.	.	H	α-helix	trans	-65.7	-42.7	173.5	0	0	0	0	0	111.3	I617 W618 K619 K624 L625	I617-A621 WeakPolarHBondContact O-CB 3.49Å; I617-A621 PolarHBondContact O-N 2.72Å; W618-A621 WeakPolarHBondContact O-CB 3.41Å; W618-A621 PolarHBondContact O-N 2.87Å; W618-A621 VanDerWaalsContact O-N 3.13Å; K619-A621 VanDerWaalsContact C-N 3.35Å; K619-A621 PolarHBondContact O-N 2.99Å; A621-K624 PolarHBondContact O-N 3.47Å; A621-L625 WeakPolarHBondContact O-CB 3.16Å; A621-L625 PolarHBondContact O-N 2.84Å
622	I	92	Very high	90.3	Very high	85 Å²	85	102.5 Å²	102.5	44%	0.436	50%	0.496	S	S	.	.	H	α-helix	trans	-64.4	-44.9	174.6	-63.9	-63.2	0	0	0	111.1	W618 K619 K624 L625 Y626	W618-I622 HydrophobicContact CD2-CG1 4.38Å; W618-I622 HydrophobicContact CZ2-CG1 4.17Å; W618-I622 WeakPolarHBondContact O-CG1 3.48Å; W618-I622 PolarHBondContact O-N 3.04Å; K619-I622 PolarHBondContact O-N 3.08Å; I622-K624 VanDerWaalsContact C-N 3.34Å; I622-K624 PolarHBondContact O-N 2.85Å; I622-L625 PolarHBondContact O-N 2.93Å; I622-Y626 WeakPolarHBondContact O-CB 3.44Å; I622-Y626 PolarHBondContact O-N 3.33Å
623	I	92.3	Very high	89.7	Confident	71 Å²	71	99.6 Å²	99.6	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-62.5	-40.9	176.3	-68.9	168.2	0	0	0	111	K619 Y626 N627	K619-I623 HydrophobicContact CG-CD1 3.87Å; K619-I623 VanDerWaalsContact O-CG1 3.3Å; K619-I623 WeakPolarHBondContact O-CG1 3.23Å; K619-I623 PolarHBondContact O-N 2.76Å; I623-Y626 PolarHBondContact O-N 2.94Å; I623-N627 WeakPolarHBondContact O-CB 3.48Å; I623-N627 PolarHBondContact O-N 2.81Å; I623-N627 PolarHBondContact O-OD1 2.93Å
624	K	92.2	Very high	88.8	Confident	152 Å²	152	101.9 Å²	101.9	66%	0.661	48%	0.482	S	S	*	.	H	α-helix	trans	-64.6	-42	175.8	-78.6	176.7	-178.8	-177.1	0	112.4	N620 A621 I622 N627 K628	N620-K624 WeakPolarHBondContact O-CB 3.23Å; N620-K624 VanDerWaalsContact O-CG 3.23Å; N620-K624 WeakPolarHBondContact O-CG 3.4Å; N620-K624 PolarHBondContact O-N 3.26Å; A621-K624 PolarHBondContact O-N 3.47Å; I622-K624 VanDerWaalsContact C-N 3.34Å; I622-K624 PolarHBondContact O-N 2.85Å; K624-N627 PolarHBondContact O-N 3.27Å; K624-K628 WeakPolarHBondContact O-CB 3.39Å; K624-K628 PolarHBondContact O-N 3.12Å
625	L	90.2	Very high	88.2	Confident	96 Å²	96	106.5 Å²	106.5	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-46.1	175	-174.4	67.2	0	0	0	110.4	A621 I622 N627 K628 D629	A621-L625 WeakPolarHBondContact O-CB 3.16Å; A621-L625 PolarHBondContact O-N 2.84Å; I622-L625 PolarHBondContact O-N 2.93Å; L625-N627 PolarHBondContact O-N 2.89Å; L625-K628 PolarHBondContact O-N 2.83Å; L625-D629 WeakPolarHBondContact O-CB 3.46Å; L625-D629 VanDerWaalsContact O-CG 3.26Å; L625-D629 PolarHBondContact O-N 3.4Å
626	Y	87.6	Confident	87.5	Confident	108 Å²	108	107 Å²	107	42%	0.424	50%	0.502	S	S	.	.	H	α-helix	trans	-56.3	-48.6	174.1	-173.1	-95.1	0	0	0	110.8	I622 I623 K628 D629 E630 R633	I622-Y626 WeakPolarHBondContact O-CB 3.44Å; I622-Y626 PolarHBondContact O-N 3.33Å; I623-Y626 PolarHBondContact O-N 2.94Å; Y626-K628 PolarHBondContact O-N 3.44Å; Y626-D629 PolarHBondContact O-N 2.68Å; Y626-E630 PolarHBondContact O-N 3.4Å; Y626-R633 PolarHBondContact O-NH1 3.3Å; Y626-R633 PolarHBondContact O-NH2 3.28Å
627	N	88.9	Confident	86.6	Confident	88 Å²	88	111.9 Å²	111.9	47%	0.471	52%	0.516	S	S	.	.	H	α-helix	trans	-69	-34.9	179.7	-65.5	-7.1	0	0	0	112.7	I623 K624 L625 E630	I623-N627 WeakPolarHBondContact O-CB 3.48Å; I623-N627 PolarHBondContact O-N 2.81Å; I623-N627 PolarHBondContact O-OD1 2.93Å; K624-N627 PolarHBondContact O-N 3.27Å; L625-N627 PolarHBondContact O-N 2.89Å; N627-E630 WeakPolarHBondContact O-CB 3.38Å; N627-E630 PolarHBondContact O-N 3.3Å
628	K	88	Confident	85.1	Confident	167 Å²	167	109.6 Å²	109.6	73%	0.726	52%	0.521	S	S	*	.	H	α-helix	trans	-65.5	-40.4	176.8	-174.2	-176.3	176.3	-171.3	0	112.1	K624 L625 Y626 E630	K624-K628 WeakPolarHBondContact O-CB 3.39Å; K624-K628 PolarHBondContact O-N 3.12Å; L625-K628 PolarHBondContact O-N 2.83Å; Y626-K628 PolarHBondContact O-N 3.44Å; K628-E630 PolarHBondContact O-N 2.67Å
629	D	85.1	Confident	83.5	Confident	55 Å²	55	105.4 Å²	105.4	29%	0.294	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	3.4	179.6	-63.1	-6.1	0	0	0	111.8	L625 Y626 E632 R633	L625-D629 WeakPolarHBondContact O-CB 3.46Å; L625-D629 VanDerWaalsContact O-CG 3.26Å; L625-D629 PolarHBondContact O-N 3.4Å; Y626-D629 PolarHBondContact O-N 2.68Å; D629-E632 PolarHBondContact O-N 2.86Å; D629-R633 VanDerWaalsContact O-CB 3.31Å; D629-R633 WeakPolarHBondContact O-CB 3.43Å; D629-R633 VanDerWaalsContact O-CG 3.25Å; D629-R633 WeakPolarHBondContact O-CG 3.25Å; D629-R633 PolarHBondContact O-N 3.2Å; D629-R633 PolarHBondContact O-NH1 2.96Å
630	E	79.8	Confident	81.8	Confident	108 Å²	108	101.7 Å²	101.7	51%	0.505	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-47.5	179.9	-173.5	179.7	-174.2	0	0	112.3	Y626 N627 K628 E632 R633 F634	Y626-E630 PolarHBondContact O-N 3.4Å; N627-E630 WeakPolarHBondContact O-CB 3.38Å; N627-E630 PolarHBondContact O-N 3.3Å; K628-E630 PolarHBondContact O-N 2.67Å; E630-E632 VanDerWaalsContact C-N 3.34Å; E630-E632 PolarHBondContact O-N 3.04Å; E630-R633 PolarHBondContact O-N 3.1Å; E630-F634 WeakPolarHBondContact O-CB 3.33Å; E630-F634 PolarHBondContact O-N 3.49Å
631	E	78.6	Confident	80	Confident	168 Å²	168	100 Å²	100	79%	0.785	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-39.7	178	-70.8	-175.5	173	0	0	111.8	F634 R635	E631-F634 PolarHBondContact O-N 3.33Å; E631-R635 WeakPolarHBondContact O-CB 3.38Å; E631-R635 PolarHBondContact O-N 2.81Å
632	E	80.5	Confident	78.2	Confident	109 Å²	109	102.5 Å²	102.5	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-70	-39.9	177.8	-169.7	166.4	-169	0	0	111.3	D629 E630 F634 R635 L636	D629-E632 PolarHBondContact O-N 2.86Å; E630-E632 VanDerWaalsContact C-N 3.34Å; E630-E632 PolarHBondContact O-N 3.04Å; E632-F634 VanDerWaalsContact C-N 3.34Å; E632-F634 PolarHBondContact O-N 2.92Å; E632-R635 PolarHBondContact O-N 2.73Å; E632-L636 HydrophobicContact CG-CD1 3.84Å; E632-L636 HydrophobicContact CG-CG 4.34Å; E632-L636 VanDerWaalsContact O-CB 3.3Å; E632-L636 WeakPolarHBondContact O-CB 3.45Å; E632-L636 VanDerWaalsContact O-CG 3.25Å; E632-L636 WeakPolarHBondContact O-CG 3.34Å; E632-L636 PolarHBondContact O-N 3Å
633	R	80.5	Confident	76.4	Confident	40 Å²	40	103.7 Å²	103.7	15%	0.151	52%	0.518	C	S	.	.	H	α-helix	trans	-60.5	-43.2	170.6	-76.7	-166	-55.1	-82.5	2.6	111.2	Y626 D629 E630 R637	Y626-R633 PolarHBondContact O-NH1 3.3Å; Y626-R633 PolarHBondContact O-NH2 3.28Å; D629-R633 VanDerWaalsContact O-CB 3.31Å; D629-R633 WeakPolarHBondContact O-CB 3.43Å; D629-R633 VanDerWaalsContact O-CG 3.25Å; D629-R633 WeakPolarHBondContact O-CG 3.25Å; D629-R633 PolarHBondContact O-N 3.2Å; D629-R633 PolarHBondContact O-NH1 2.96Å; E630-R633 PolarHBondContact O-N 3.1Å; R633-R637 VanDerWaalsContact O-CB 3.24Å; R633-R637 WeakPolarHBondContact O-CB 3.32Å; R633-R637 WeakPolarHBondContact O-CG 3.31Å; R633-R637 PolarHBondContact O-N 3.33Å
634	F	76	Confident	74.4	Confident	124 Å²	124	104 Å²	104	54%	0.544	53%	0.527	S	S	.	.	H	α-helix	trans	-65	-44.4	178	-167.4	-92.8	0	0	0	111.1	E630 E631 E632 G638	E630-F634 WeakPolarHBondContact O-CB 3.33Å; E630-F634 PolarHBondContact O-N 3.49Å; E631-F634 PolarHBondContact O-N 3.33Å; E632-F634 VanDerWaalsContact C-N 3.34Å; E632-F634 PolarHBondContact O-N 2.92Å; F634-G638 WeakPolarHBondContact O-CA 3.44Å; F634-G638 PolarHBondContact O-N 3.32Å
635	R	80.4	Confident	72.4	Confident	193 Å²	193	103.5 Å²	103.5	73%	0.728	54%	0.536	S	S	*	.	H	α-helix	trans	-64	-41.1	177.1	-164.4	-172.9	82.8	171	2	112.8	E631 E632	E631-R635 WeakPolarHBondContact O-CB 3.38Å; E631-R635 PolarHBondContact O-N 2.81Å; E632-R635 PolarHBondContact O-N 2.73Å
636	L	80.6	Confident	70.5	Confident	120 Å²	120	108.3 Å²	108.3	63%	0.628	55%	0.548	S	S	*	.	H	α-helix	trans	-80.1	-31.2	-177.5	-70.2	172.3	0	0	0	113.1	E632	E632-L636 HydrophobicContact CG-CD1 3.84Å; E632-L636 HydrophobicContact CG-CG 4.34Å; E632-L636 VanDerWaalsContact O-CB 3.3Å; E632-L636 WeakPolarHBondContact O-CB 3.45Å; E632-L636 VanDerWaalsContact O-CG 3.25Å; E632-L636 WeakPolarHBondContact O-CG 3.34Å; E632-L636 PolarHBondContact O-N 3Å
637	R	74.7	Confident	68.7	Low	164 Å²	164	111.2 Å²	111.2	62%	0.619	57%	0.565	S	S	*	*	H	α-helix	trans	-102.2	-10.8	-175.2	-57.8	-177	-160.8	-158.5	3.9	114.1	R633 S639	R633-R637 VanDerWaalsContact O-CB 3.24Å; R633-R637 WeakPolarHBondContact O-CB 3.32Å; R633-R637 WeakPolarHBondContact O-CG 3.31Å; R633-R637 PolarHBondContact O-N 3.33Å; R637-S639 PolarHBondContact O-N 3.42Å
638	G	63.9	Low	66.6	Low	66 Å²	66	112.9 Å²	112.9	68%	0.68	58%	0.581	S	S	*	*	S	Bend	trans	65.2	3.3	176.6	0	0	0	0	0	115.3	F634	F634-G638 WeakPolarHBondContact O-CA 3.44Å; F634-G638 PolarHBondContact O-N 3.32Å
639	S	60.8	Low	64.8	Low	63 Å²	63	112.3 Å²	112.3	44%	0.441	58%	0.581	S	S	.	*	S	Bend	trans	-155.1	134	-178.5	165.8	0	0	0	0	106.7	R637 A641	R637-S639 PolarHBondContact O-N 3.42Å; S639-A641 PolarHBondContact O-N 3.23Å
640	G	58.2	Low	62.9	Low	19 Å²	19	116.1 Å²	116.1	20%	0.196	61%	0.606	C	S	.	*			trans	-55.7	127.8	167.8	0	0	0	0	0	108.6	D642 T643	G640-D642 PolarHBondContact O-N 3Å; G640-D642 VanDerWaalsContact O-N 3.08Å; G640-T643 PolarHBondContact O-N 3.43Å; G640-T643 VanDerWaalsContact O-N 3.1Å; G640-T643 PolarHBondContact O-OG1 3.09Å
641	A	55.9	Low	61.4	Low	49 Å²	49	119 Å²	119	41%	0.405	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.3	-13.7	174.7	0	0	0	0	0	111.9	S639 S644	S639-A641 PolarHBondContact O-N 3.23Å; A641-S644 PolarHBondContact O-OG 2.81Å
642	D	56.3	Low	59.9	Low	108 Å²	108	119 Å²	119	58%	0.578	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-8.2	177.5	-63.7	-31.3	0	0	0	113.8	G640	G640-D642 PolarHBondContact O-N 3Å; G640-D642 VanDerWaalsContact O-N 3.08Å
643	T	53.6	Low	58.3	Low	110 Å²	110	121.7 Å²	121.7	68%	0.675	63%	0.633	S	S	*	*	S	Bend	trans	-91.5	-6.8	177.2	28.7	0	0	0	0	114.9	G640 T645	G640-T643 PolarHBondContact O-N 3.43Å; G640-T643 VanDerWaalsContact O-N 3.1Å; G640-T643 PolarHBondContact O-OG1 3.09Å; T643-T645 PolarHBondContact O-N 2.76Å
644	S	51.5	Low	56.8	Low	77 Å²	77	126.4 Å²	126.4	54%	0.538	66%	0.66	S	S	.	*	S	Bend	trans	-75.6	114	165.6	57.2	0	0	0	0	108.1	A641 R646	A641-S644 PolarHBondContact O-OG 2.81Å; S644-R646 PolarHBondContact O-N 3.06Å
645	T	50.1	Low	55.4	Low	141 Å²	141	129.3 Å²	129.3	87%	0.865	68%	0.675	S	S	*	*			trans	-30.7	99.8	162.6	18.9	0	0	0	0	109.8	T643 E647	T643-T645 PolarHBondContact O-N 2.76Å; T645-E647 PolarHBondContact O-N 3.46Å; T645-E647 VanDerWaalsContact O-N 3.1Å
646	R	49.9	Very low	53.9	Low	197 Å²	197	126.5 Å²	126.5	74%	0.743	67%	0.673	S	S	*	*			trans	-63.5	114.4	166.3	-85.2	-178.8	166.7	173.3	-2.2	105	S644	S644-R646 PolarHBondContact O-N 3.06Å
647	E	50.7	Low	52.5	Low	169 Å²	169	127.6 Å²	127.6	79%	0.79	68%	0.679	S	S	*	*			trans	-44.9	137.6	159.1	-71.6	-178.9	154.9	0	0	107.4	T645 Q649	T645-E647 PolarHBondContact O-N 3.46Å; T645-E647 VanDerWaalsContact O-N 3.1Å; E647-Q649 VanDerWaalsContact C-N 3.34Å; E647-Q649 PolarHBondContact O-N 2.89Å
648	P	44.8	Very low	51.6	Low	124 Å²	124	127.4 Å²	127.4	81%	0.805	69%	0.689	S	S	*	*			trans	-56.1	103	-179.3	22.8	-31.3	0	0	0	107.8	T650	P648-T650 PolarHBondContact O-N 3.23Å; P648-T650 VanDerWaalsContact O-N 3.14Å
649	Q	49.6	Very low	51.1	Low	154 Å²	154	128.8 Å²	128.8	72%	0.72	69%	0.688	S	S	*	*			trans	-65.3	114.9	165.9	-72.8	-171.1	-38	0	0	104.4	E647 E651	E647-Q649 VanDerWaalsContact C-N 3.34Å; E647-Q649 PolarHBondContact O-N 2.89Å; Q649-E651 VanDerWaalsContact C-N 3.3Å; Q649-E651 PolarHBondContact O-N 2.98Å
650	T	45.2	Very low	50.7	Low	135 Å²	135	129 Å²	129	83%	0.828	69%	0.693	S	S	*	*			trans	-57.9	99	169.7	-22.9	0	0	0	0	106.8	P648 E652	P648-T650 PolarHBondContact O-N 3.23Å; P648-T650 VanDerWaalsContact O-N 3.14Å; T650-E652 VanDerWaalsContact C-N 3.35Å; T650-E652 PolarHBondContact O-N 3.08Å
651	E	48.2	Very low	50.3	Low	170 Å²	170	134.3 Å²	134.3	79%	0.794	72%	0.722	S	S	*	*			trans	-68.7	98	165.8	-75.5	-177.8	159.2	0	0	106.3	Q649 E653	Q649-E651 VanDerWaalsContact C-N 3.3Å; Q649-E651 PolarHBondContact O-N 2.98Å; E651-E653 VanDerWaalsContact C-N 3.34Å; E651-E653 PolarHBondContact O-N 2.86Å; E651-E653 VanDerWaalsContact O-N 3.12Å
652	E	47.6	Very low	49.9	Very low	166 Å²	166	140.2 Å²	140.2	78%	0.776	74%	0.74	S	S	*	*			trans	-72.3	95.9	161.6	-81.7	-171.9	158	0	0	107.8	T650 L654	T650-E652 VanDerWaalsContact C-N 3.35Å; T650-E652 PolarHBondContact O-N 3.08Å; E652-L654 PolarHBondContact O-N 2.79Å; E652-L654 VanDerWaalsContact O-N 3.08Å
653	E	46.4	Very low	49.5	Very low	167 Å²	167	143.1 Å²	143.1	78%	0.78	75%	0.75	S	S	*	*			trans	-68	98	163.1	-73	-171.3	151.6	0	0	108.9	E651 E655	E651-E653 VanDerWaalsContact C-N 3.34Å; E651-E653 PolarHBondContact O-N 2.86Å; E651-E653 VanDerWaalsContact O-N 3.12Å; E653-E655 PolarHBondContact O-N 3.21Å
654	L	48	Very low	49.2	Very low	139 Å²	139	144 Å²	144	73%	0.728	76%	0.756	S	S	*	*			trans	-82.2	95.9	168.2	-89	152.4	0	0	0	109.4	E652 I656	E652-L654 PolarHBondContact O-N 2.79Å; E652-L654 VanDerWaalsContact O-N 3.08Å; L654-I656 PolarHBondContact O-N 3.35Å; L654-I656 VanDerWaalsContact O-N 3.15Å
655	E	46.9	Very low	49.4	Very low	185 Å²	185	146.8 Å²	146.8	86%	0.864	76%	0.763	S	S	*	*			trans	-71.3	100.3	165.3	-72.6	-168.6	160.6	0	0	110	E653	E653-E655 PolarHBondContact O-N 3.21Å
656	I	48.7	Very low	49.1	Very low	134 Å²	134	151 Å²	151	69%	0.687	76%	0.763	S	S	*	*			trans	-91.7	118.4	170.8	-56.5	174.4	0	0	0	107.9	L654 I658	L654-I656 PolarHBondContact O-N 3.35Å; L654-I656 VanDerWaalsContact O-N 3.15Å; I656-I658 WeakPolarHBondContact O-CG1 3.47Å; I656-I658 PolarHBondContact O-N 3.04Å
657	L	51	Low	49.1	Very low	142 Å²	142	150.5 Å²	150.5	74%	0.743	77%	0.767	S	S	*	*			trans	-72.4	98.5	177.7	-158.3	126.7	0	0	0	110.2	S659 A660	L657-S659 PolarHBondContact O-N 3.11Å; L657-A660 HydrophobicContact CD2-CB 3.92Å
658	I	55.3	Low	48.9	Very low	161 Å²	161	149.5 Å²	149.5	83%	0.826	77%	0.767	S	S	*	*			trans	-72.9	-25.8	-171.5	-58.2	-179.9	0	0	0	112.6	I656	I656-I658 WeakPolarHBondContact O-CG1 3.47Å; I656-I658 PolarHBondContact O-N 3.04Å
659	S	55.2	Low	49.1	Very low	95 Å²	95	149.6 Å²	149.6	66%	0.664	77%	0.765	S	S	*	*			trans	-173.4	138.2	167.9	59.7	0	0	0	0	111.2	L657	L657-S659 PolarHBondContact O-N 3.11Å
660	A	50.7	Low	48.8	Very low	67 Å²	67	149.6 Å²	149.6	55%	0.554	77%	0.77	S	S	*	*			trans	-102.1	124.1	166	0	0	0	0	0	110.5	L657	L657-A660 HydrophobicContact CD2-CB 3.92Å
661	V	50.4	Low	48.6	Very low	130 Å²	130	154.6 Å²	154.6	79%	0.788	79%	0.792	S	S	*	*			trans	-92.2	114	166.3	180	0	0	0	0	107.4
662	H	48.4	Very low	48.6	Very low	173 Å²	173	153.8 Å²	153.8	80%	0.801	79%	0.792	S	S	*	*			trans	-89.1	109.7	170.6	-82.9	69.8	0	0	0	109.3
663	E	47.7	Very low	48.7	Very low	169 Å²	169	153.2 Å²	153.2	79%	0.79	79%	0.793	S	S	*	*			trans	-94.6	116.3	169.7	-137.8	175.3	-164	0	0	108.8	I665	E663-I665 PolarHBondContact O-N 2.93Å
664	T	47.7	Very low	48.8	Very low	129 Å²	129	152.4 Å²	152.4	79%	0.791	79%	0.793	S	S	*	*			trans	-87.5	96.6	178	-44.3	0	0	0	0	109.3	R666	T664-R666 PolarHBondContact O-N 2.79Å
665	I	54	Low	48.8	Very low	135 Å²	135	153.2 Å²	153.2	69%	0.692	80%	0.797	S	S	*	*			trans	-82.3	105.4	173.5	-55.4	173.5	0	0	0	108.3	E663 K667	E663-I665 PolarHBondContact O-N 2.93Å; I665-K667 PolarHBondContact O-N 2.76Å
666	R	44.9	Very low	48.9	Very low	229 Å²	229	151.2 Å²	151.2	86%	0.864	79%	0.793	S	S	*	*			trans	-72.4	107.8	164.6	-77	-175.8	177.7	172.2	-0.4	108.4	T664	T664-R666 PolarHBondContact O-N 2.79Å
667	K	50.2	Low	49	Very low	187 Å²	187	152.3 Å²	152.3	81%	0.813	80%	0.8	S	S	*	*			trans	-80.1	113.7	160.7	-82	-175.2	175.2	-178.8	0	108.1	I665 T669	I665-K667 PolarHBondContact O-N 2.76Å; K667-T669 PolarHBondContact O-N 3.47Å
668	N	46.5	Very low	48.8	Very low	149 Å²	149	153.1 Å²	153.1	80%	0.797	80%	0.804	S	S	*	*			trans	-66.3	116.7	158.1	-79.5	-6.9	0	0	0	107.1
669	T	48.4	Very low	48.3	Very low	126 Å²	126	152.5 Å²	152.5	77%	0.773	80%	0.802	S	S	*	*			trans	-92.7	99.1	159.8	43.4	0	0	0	0	106.7	K667	K667-T669 PolarHBondContact O-N 3.47Å
670	D	44.1	Very low	47.7	Very low	154 Å²	154	157.3 Å²	157.3	82%	0.824	81%	0.814	S	S	*	*			trans	-88.3	102.8	151	-79	-31.4	0	0	0	106
671	D	40	Very low	47.5	Very low	239 Å²	239	165.5 Å²	165.5	100%	1.278	84%	0.837	S	S	*	*			trans	-157.4	0	149.7	-100.1	-16.8	0	0	0	108

Retrieved 671 of 671 residues in 1000.6 ms (Link to these results)

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