F6S496_MACMU Loading...

EF-hand domain-containing protein 1

AlphaFold DB , UniProt , Accession F6S496, Species MACMU (Macaca mulatta, Rhesus macaque), Gene EFHC1, Length 640 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	34.4	Very low	52.5	Low	230 Å²	230	121.1 Å²	121.1	100%	1.133	69%	0.687	S	S	*	*				0	135.3	0	-83.2	179.1	177	0	0	107.2	S3	M1-S3 PolarHBondContact O-N 3.32Å
2	V	30.2	Very low	54.4	Low	118 Å²	118	120.2 Å²	120.2	72%	0.715	68%	0.677	S	S	*	*			trans	-65.7	118.4	-170.7	-179.1	0	0	0	0	110.3	N4	V2-N4 HydrophobicContact CG1-CB 4Å; V2-N4 VanDerWaalsContact CG1-CG 3.43Å; V2-N4 WeakPolarHBondContact CG1-ND2 3.37Å; V2-N4 PolarHBondContact O-N 2.99Å
3	S	41.6	Very low	55.5	Low	70 Å²	70	121.2 Å²	121.2	49%	0.49	69%	0.692	S	S	.	*			trans	-77.3	56.3	172.3	63.6	0	0	0	0	111.3	M1	M1-S3 PolarHBondContact O-N 3.32Å
4	N	49.1	Very low	56.6	Low	88 Å²	88	117.6 Å²	117.6	47%	0.471	70%	0.695	S	S	.	*	P	Polyproline II helix	trans	-90.1	136.8	166.4	-77.1	-13.6	0	0	0	108.1	V2 V6 Q53	V2-N4 HydrophobicContact CG1-CB 4Å; V2-N4 VanDerWaalsContact CG1-CG 3.43Å; V2-N4 WeakPolarHBondContact CG1-ND2 3.37Å; V2-N4 PolarHBondContact O-N 2.99Å; N4-V6 PolarHBondContact O-N 2.89Å; N4-Q53 PolarHBondContact ND2-NE2 2.93Å; N4-Q53 VanDerWaalsContact ND2-NE2 3.17Å; N4-Q53 PolarHBondContact OD1-NE2 3.12Å; N4-Q53 VanDerWaalsContact OD1-NE2 3.17Å
5	P	49.5	Very low	57.6	Low	102 Å²	102	113.1 Å²	113.1	66%	0.662	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-60.6	125.7	166.5	26.2	-30.6	0	0	0	108.2	H7	P5-H7 PolarHBondContact O-N 3.28Å; P5-H7 VanDerWaalsContact O-N 3.15Å
6	V	50.8	Low	58.1	Low	103 Å²	103	111.4 Å²	111.4	62%	0.624	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-57	119.4	170	-179.7	0	0	0	0	107.1	N4 G8 L9	N4-V6 PolarHBondContact O-N 2.89Å; V6-G8 PolarHBondContact O-N 2.63Å; V6-L9 HydrophobicContact CB-CD1 4.18Å
7	H	54.2	Low	58.9	Low	181 Å²	181	115.2 Å²	115.2	84%	0.838	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	123	179.6	-110.1	-77	0	0	0	110.2	P5	P5-H7 PolarHBondContact O-N 3.28Å; P5-H7 VanDerWaalsContact O-N 3.15Å
8	G	61.7	Low	59.3	Low	77 Å²	77	120 Å²	120	79%	0.794	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.7	3.5	168.1	0	0	0	0	0	117.6	V6	V6-G8 PolarHBondContact O-N 2.63Å
9	L	69.9	Low	59.9	Low	91 Å²	91	117.3 Å²	117.3	48%	0.476	67%	0.666	S	S	.	*			trans	-85	135.6	172.5	-70.6	171.6	0	0	0	111.8	V6	V6-L9 HydrophobicContact CB-CD1 4.18Å
10	P	67.5	Low	60.5	Low	74 Å²	74	117.5 Å²	117.5	48%	0.481	68%	0.675	S	S	.	*			trans	-69.3	143.2	175.8	26.6	-31.7	0	0	0	111.2	L12 T15	P10-L12 HydrophobicContact CB-CD1 4.26Å; P10-L12 HydrophobicContact CB-CG 4.3Å; P10-L12 HydrophobicContact CG-CD1 4.22Å; P10-L12 PolarHBondContact O-N 3.18Å; P10-T15 PolarHBondContact O-OG1 3.42Å
11	F	68.3	Low	61.2	Low	198 Å²	198	116.9 Å²	116.9	87%	0.868	67%	0.674	S	S	*	*			trans	-78	66.4	177.4	-80.1	-83.2	0	0	0	111.8
12	L	75.3	Confident	63	Low	110 Å²	110	108.7 Å²	108.7	58%	0.576	63%	0.631	S	S	*	*			trans	-103.9	154	175.5	-67.5	170.1	0	0	0	110.6	P10 G14 T15	P10-L12 HydrophobicContact CB-CD1 4.26Å; P10-L12 HydrophobicContact CB-CG 4.3Å; P10-L12 HydrophobicContact CG-CD1 4.22Å; P10-L12 PolarHBondContact O-N 3.18Å; L12-G14 PolarHBondContact O-N 2.93Å; L12-G14 VanDerWaalsContact O-N 3.12Å; L12-T15 PolarHBondContact N-OG1 3.49Å; L12-T15 PolarHBondContact O-N 3.31Å; L12-T15 PolarHBondContact O-OG1 2.93Å
13	P	68.5	Low	65.2	Low	133 Å²	133	109.5 Å²	109.5	86%	0.864	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	119.8	172.7	-20.3	31.4	0	0	0	110.2
14	G	71.7	Confident	66.8	Low	72 Å²	72	107.8 Å²	107.8	74%	0.742	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.1	-16.4	-178.8	0	0	0	0	0	115.4	L12	L12-G14 PolarHBondContact O-N 2.93Å; L12-G14 VanDerWaalsContact O-N 3.12Å
15	T	72.1	Confident	68.2	Low	50 Å²	50	110.2 Å²	110.2	31%	0.307	63%	0.634	S	S	.	*	S	Bend	trans	-99.1	7.7	175.7	55.7	0	0	0	0	113.4	P10 L12	P10-T15 PolarHBondContact O-OG1 3.42Å; L12-T15 PolarHBondContact N-OG1 3.49Å; L12-T15 PolarHBondContact O-N 3.31Å; L12-T15 PolarHBondContact O-OG1 2.93Å
16	S	64.9	Low	69.7	Low	85 Å²	85	110.9 Å²	110.9	59%	0.594	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-103	121.7	177.2	64.6	0	0	0	0	111.6
17	F	71.1	Confident	70.9	Confident	177 Å²	177	116.2 Å²	116.2	78%	0.776	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-93.6	128.6	175.3	-57.6	-80.5	0	0	0	110.5
18	K	66.3	Low	72	Confident	201 Å²	201	109.7 Å²	109.7	87%	0.874	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-92.5	125.6	172.3	-70.1	-176	-179.6	179	0	109.2	S20	K18-S20 PolarHBondContact O-N 3.1Å
19	D	70.5	Confident	72.8	Confident	68 Å²	68	113.6 Å²	113.6	36%	0.364	61%	0.609	S	S	.	*			trans	-80	109.8	173.3	-170.1	-13.6	0	0	0	110.1	T21	D19-T21 PolarHBondContact O-N 3.03Å; D19-T21 WeakPolarHBondContact OD1-CB 3.25Å; D19-T21 PolarHBondContact OD1-N 2.74Å; D19-T21 PolarHBondContact OD1-OG1 2.77Å
20	S	73.2	Confident	73.2	Confident	121 Å²	121	111.4 Å²	111.4	85%	0.846	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-6.5	-179.5	56.5	0	0	0	0	113.8	K18	K18-S20 PolarHBondContact O-N 3.1Å
21	T	75.2	Confident	74	Confident	106 Å²	106	112.8 Å²	112.8	65%	0.65	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-6.7	-179.5	67.3	0	0	0	0	113.5	D19 T23	D19-T21 PolarHBondContact O-N 3.03Å; D19-T21 WeakPolarHBondContact OD1-CB 3.25Å; D19-T21 PolarHBondContact OD1-N 2.74Å; D19-T21 PolarHBondContact OD1-OG1 2.77Å; T21-T23 PolarHBondContact O-N 3.15Å
22	K	72.1	Confident	74.6	Confident	57 Å²	57	104.9 Å²	104.9	25%	0.248	58%	0.577	C	S	.	*			trans	-75.8	120.9	-177.9	-168.2	167.4	-176.6	172.1	0	111.5	A24 F25 I47 D50	K22-A24 VanDerWaalsContact CE-O 3.28Å; K22-A24 WeakPolarHBondContact CE-O 3.37Å; K22-F25 HydrophobicContact CB-CE1 4.39Å; K22-F25 HydrophobicContact CB-CZ 4.15Å; K22-F25 HydrophobicContact CD-CE1 4.17Å; K22-F25 HydrophobicContact CG-CE1 4.13Å; K22-F25 HydrophobicContact CG-CZ 4.2Å; K22-F25 VanDerWaalsContact O-CE2 3.24Å; K22-F25 WeakPolarHBondContact O-CE2 3.35Å; K22-F25 WeakPolarHBondContact O-CZ 3.38Å; K22-I47 WeakPolarHBondContact CE-O 3.14Å; K22-I47 PolarHBondContact NZ-O 3.02Å; K22-D50 IonicContact NZ-OD1 3.78Å; K22-D50 IonicContact NZ-OD2 2.6Å; K22-D50 PolarHBondContact NZ-OD2 3.21Å
23	T	75.6	Confident	75	Confident	135 Å²	135	108.4 Å²	108.4	83%	0.828	58%	0.584	S	S	*	*			trans	-105.6	-18.2	-178	53.6	0	0	0	0	113.5	T21	T21-T23 PolarHBondContact O-N 3.15Å
24	A	74.4	Confident	75.2	Confident	35 Å²	35	110.1 Å²	110.1	29%	0.289	57%	0.573	S	S	.	*			trans	-106.7	122.2	-178.9	0	0	0	0	0	112.1	K22 G48	K22-A24 VanDerWaalsContact CE-O 3.28Å; K22-A24 WeakPolarHBondContact CE-O 3.37Å; A24-G48 VanDerWaalsContact O-CA 3.24Å; A24-G48 WeakPolarHBondContact O-CA 3.37Å
25	F	80.4	Confident	75.2	Confident	138 Å²	138	113.7 Å²	113.7	61%	0.605	58%	0.575	S	S	*	*			trans	-125.3	19.8	-179.2	-59.8	-81.5	0	0	0	113.6	K22 I47	K22-F25 HydrophobicContact CB-CE1 4.39Å; K22-F25 HydrophobicContact CB-CZ 4.15Å; K22-F25 HydrophobicContact CD-CE1 4.17Å; K22-F25 HydrophobicContact CG-CE1 4.13Å; K22-F25 HydrophobicContact CG-CZ 4.2Å; K22-F25 VanDerWaalsContact O-CE2 3.24Å; K22-F25 WeakPolarHBondContact O-CE2 3.35Å; K22-F25 WeakPolarHBondContact O-CZ 3.38Å; F25-I47 HydrophobicContact CB-CG2 4.49Å
26	H	80	Confident	75.4	Confident	117 Å²	117	114.5 Å²	114.5	54%	0.542	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-66.5	139.4	179.3	58.4	-89.4	0	0	0	111.1	G48	H26-G48 PolarHBondContact O-N 3.3Å
27	R	76.7	Confident	75.4	Confident	214 Å²	214	119 Å²	119	81%	0.808	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-88.6	137.9	175.6	-79.1	-178.9	156.2	-170	-6	110.1	I47	R27-I47 HydrophobicContact CG-CG1 4.39Å
28	S	76.8	Confident	75.9	Confident	44 Å²	44	113.9 Å²	113.9	31%	0.308	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-71.9	134.9	170.7	46	0	0	0	0	110.2	T30 V45	S28-T30 PolarHBondContact O-N 3.25Å; S28-V45 PolarHBondContact OG-O 3.36Å
29	Q	78.3	Confident	76.5	Confident	160 Å²	160	107.4 Å²	107.4	75%	0.748	56%	0.563	S	S	*	*			trans	-75.8	94.3	-179.7	-168.6	70.5	8.7	0	0	110.2	L31	Q29-L31 WeakPolarHBondContact CG-O 3.38Å; Q29-L31 PolarHBondContact NE2-O 3.4Å
30	T	79.4	Confident	76.9	Confident	44 Å²	44	109.6 Å²	109.6	27%	0.27	58%	0.578	S	S	.	*			trans	-90.2	-15.2	-179.9	52.3	0	0	0	0	113.3	S28 V40 R41 P43	S28-T30 PolarHBondContact O-N 3.25Å; T30-V40 CarbonylContact O-C 3.58Å; T30-R41 WeakPolarHBondContact CA-O 3.47Å; T30-R41 WeakPolarHBondContact CB-O 3.22Å; T30-R41 WeakPolarHBondContact CG2-O 3.45Å; T30-R41 PolarHBondContact O-N 2.85Å; T30-P43 HydrophobicContact CG2-CB 3.61Å; T30-P43 HydrophobicContact CG2-CG 3.88Å
31	L	83.3	Confident	77	Confident	103 Å²	103	111.9 Å²	111.9	54%	0.539	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.6	127.9	-179	-60.1	171.5	0	0	0	108.9	Q29 V40	Q29-L31 WeakPolarHBondContact CG-O 3.38Å; Q29-L31 PolarHBondContact NE2-O 3.4Å; L31-V40 HydrophobicContact CD2-CB 4.19Å; L31-V40 HydrophobicContact CD2-CG1 3.89Å; L31-V40 HydrophobicContact CD2-CG2 3.71Å
32	G	80.8	Confident	76.8	Confident	33 Å²	33	116.3 Å²	116.3	34%	0.34	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-151.6	162.4	178.6	0	0	0	0	0	112.1	I39	G32-I39 PolarHBondContact N-O 3.43Å; G32-I39 PolarHBondContact O-N 3.35Å
33	Y	83.6	Confident	76.7	Confident	184 Å²	184	116 Å²	116	72%	0.722	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.6	133.8	173.4	-80	-96.2	0	0	0	109.9	Y37 A38	Y33-Y37 WeakPolarHBondContact CA-O 3.24Å; Y33-A38 HydrophobicContact CD1-CB 4.35Å; Y33-A38 HydrophobicContact CE1-CB 3.78Å; Y33-A38 HydrophobicContact CE2-CB 4.42Å
34	R	73.4	Confident	76.4	Confident	169 Å²	169	115 Å²	115	64%	0.638	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-129.5	120.9	169.5	-167.3	-179.4	-179.5	-173.7	0.6	108.2	G36 Y37 I39	R34-G36 VanDerWaalsContact C-N 3.25Å; R34-G36 PolarHBondContact O-N 2.91Å; R34-Y37 PolarHBondContact N-O 3.39Å; R34-Y37 PolarHBondContact O-N 3.47Å; R34-I39 HydrophobicContact CB-CD1 3.5Å; R34-I39 HydrophobicContact CB-CG1 4.5Å; R34-I39 HydrophobicContact CG-CD1 4.49Å
35	N	70.9	Confident	76.3	Confident	147 Å²	147	115.9 Å²	115.9	79%	0.786	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.2	41.3	-179.4	-56.8	-11	0	0	0	113.2	Y37	N35-Y37 VanDerWaalsContact O-CD2 3.32Å; N35-Y37 WeakPolarHBondContact O-CD2 3.26Å; N35-Y37 PolarHBondContact O-N 2.88Å
36	G	76.6	Confident	75.9	Confident	66 Å²	66	110.2 Å²	110.2	68%	0.68	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.1	-8.1	176.9	0	0	0	0	0	116.2	R34	R34-G36 VanDerWaalsContact C-N 3.25Å; R34-G36 PolarHBondContact O-N 2.91Å
37	Y	65.9	Low	75.5	Confident	181 Å²	181	108.6 Å²	108.6	71%	0.71	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	138.3	178.8	-60.9	-82.3	0	0	0	112.3	Y33 R34 N35 I39	Y33-Y37 WeakPolarHBondContact CA-O 3.24Å; R34-Y37 PolarHBondContact N-O 3.39Å; R34-Y37 PolarHBondContact O-N 3.47Å; N35-Y37 VanDerWaalsContact O-CD2 3.32Å; N35-Y37 WeakPolarHBondContact O-CD2 3.26Å; N35-Y37 PolarHBondContact O-N 2.88Å; Y37-I39 PolarHBondContact O-N 3.23Å
38	A	80.6	Confident	75.3	Confident	69 Å²	69	99.1 Å²	99.1	57%	0.57	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	121	174.8	0	0	0	0	0	110.3	Y33	Y33-A38 HydrophobicContact CD1-CB 4.35Å; Y33-A38 HydrophobicContact CE1-CB 3.78Å; Y33-A38 HydrophobicContact CE2-CB 4.42Å
39	I	78.9	Confident	74.9	Confident	65 Å²	65	99 Å²	99	33%	0.333	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.3	177.6	-60.4	-179.1	0	0	0	108.7	G32 R34 Y37 R41	G32-I39 PolarHBondContact N-O 3.43Å; G32-I39 PolarHBondContact O-N 3.35Å; R34-I39 HydrophobicContact CB-CD1 3.5Å; R34-I39 HydrophobicContact CB-CG1 4.5Å; R34-I39 HydrophobicContact CG-CD1 4.49Å; Y37-I39 PolarHBondContact O-N 3.23Å; I39-R41 HydrophobicContact CG2-CG 4.33Å
40	V	79.3	Confident	74.6	Confident	113 Å²	113	94.7 Å²	94.7	69%	0.685	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.9	173.7	-173.5	0	0	0	0	109	T30 L31	T30-V40 CarbonylContact O-C 3.58Å; L31-V40 HydrophobicContact CD2-CB 4.19Å; L31-V40 HydrophobicContact CD2-CG1 3.89Å; L31-V40 HydrophobicContact CD2-CG2 3.71Å
41	R	74.8	Confident	73.9	Confident	169 Å²	169	103.4 Å²	103.4	64%	0.638	53%	0.532	S	S	*	.			trans	-110.5	132.2	172	-66.4	-174.5	179.6	-167.4	-0.2	109.1	T30 I39	T30-R41 WeakPolarHBondContact CA-O 3.47Å; T30-R41 WeakPolarHBondContact CB-O 3.22Å; T30-R41 WeakPolarHBondContact CG2-O 3.45Å; T30-R41 PolarHBondContact O-N 2.85Å; I39-R41 HydrophobicContact CG2-CG 4.33Å
42	R	71.2	Confident	73.1	Confident	200 Å²	200	101.7 Å²	101.7	76%	0.755	52%	0.523	S	S	*	.			trans	-71.4	136.2	174.3	-65.7	-172.1	-178.7	-157.3	1	109.6	T44	R42-T44 PolarHBondContact O-N 2.98Å
43	P	69.4	Low	72	Confident	49 Å²	49	105.9 Å²	105.9	32%	0.318	53%	0.534	S	S	.	.			trans	-68.2	126.2	178.4	26	-29.8	0	0	0	109.5	T30 L52 N55	T30-P43 HydrophobicContact CG2-CB 3.61Å; T30-P43 HydrophobicContact CG2-CG 3.88Å; P43-L52 HydrophobicContact CB-CD1 4.13Å; P43-L52 HydrophobicContact CG-CD1 4.24Å; P43-L52 VanDerWaalsContact O-CD1 3.26Å; P43-L52 WeakPolarHBondContact O-CD1 3.28Å; P43-N55 PolarHBondContact O-ND2 2.92Å
44	T	69.2	Low	70.9	Confident	114 Å²	114	104.3 Å²	104.3	70%	0.699	53%	0.531	S	S	*	.	S	Bend	trans	-85	-23.1	172.4	47.1	0	0	0	0	112	R42	R42-T44 PolarHBondContact O-N 2.98Å
45	V	72.6	Confident	70	Confident	55 Å²	55	99.9 Å²	99.9	33%	0.333	52%	0.52	S	S	.	.	B	Isolated β-bridge	trans	-129.4	147	176.6	-63.6	0	0	0	0	110.4	S28 D50	S28-V45 PolarHBondContact OG-O 3.36Å; V45-D50 CarbonylContact C-O 3.52Å; V45-D50 WeakPolarHBondContact CA-O 3.24Å
46	G	71.6	Confident	69.4	Low	18 Å²	18	101 Å²	101	19%	0.186	52%	0.521	C	S	.	.			trans	-76.1	-176.9	175.6	0	0	0	0	0	112.3	G48 G49 D50	G46-G48 PolarHBondContact O-N 3.31Å; G46-G49 PolarHBondContact O-N 3.18Å; G46-G49 VanDerWaalsContact O-N 3.16Å; G46-D50 PolarHBondContact N-O 2.81Å
47	I	73.2	Confident	68.6	Low	84 Å²	84	102.4 Å²	102.4	43%	0.431	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-59.6	130	-179.2	-65.3	161.9	0	0	0	109.6	K22 F25 R27 G49	K22-I47 WeakPolarHBondContact CE-O 3.14Å; K22-I47 PolarHBondContact NZ-O 3.02Å; F25-I47 HydrophobicContact CB-CG2 4.49Å; R27-I47 HydrophobicContact CG-CG1 4.39Å; I47-G49 VanDerWaalsContact C-N 3.32Å
48	G	71.2	Confident	68.4	Low	15 Å²	15	96.4 Å²	96.4	16%	0.155	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	79.2	8	179.5	0	0	0	0	0	115.5	A24 H26 G46	A24-G48 VanDerWaalsContact O-CA 3.24Å; A24-G48 WeakPolarHBondContact O-CA 3.37Å; H26-G48 PolarHBondContact O-N 3.3Å; G46-G48 PolarHBondContact O-N 3.31Å
49	G	69.4	Low	67.5	Low	41 Å²	41	100 Å²	100	42%	0.423	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	94.8	5.8	176.1	0	0	0	0	0	115.4	G46 I47	G46-G49 PolarHBondContact O-N 3.18Å; G46-G49 VanDerWaalsContact O-N 3.16Å; I47-G49 VanDerWaalsContact C-N 3.32Å
50	D	71	Confident	66.8	Low	69 Å²	69	100.1 Å²	100.1	37%	0.369	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-63.2	137.6	178.6	-63.7	-15.6	0	0	0	111.3	K22 V45 G46 L52	K22-D50 IonicContact NZ-OD1 3.78Å; K22-D50 IonicContact NZ-OD2 2.6Å; K22-D50 PolarHBondContact NZ-OD2 3.21Å; V45-D50 CarbonylContact C-O 3.52Å; V45-D50 WeakPolarHBondContact CA-O 3.24Å; G46-D50 PolarHBondContact N-O 2.81Å; D50-L52 PolarHBondContact O-N 3.44Å
51	R	64.8	Low	66.1	Low	227 Å²	227	98.5 Å²	98.5	86%	0.857	50%	0.497	S	S	*	.	B	Isolated β-bridge	trans	-70.8	122	179.3	-169.6	173.7	-179.5	175.2	-0.4	110.6
52	L	66.4	Low	65.8	Low	68 Å²	68	94.4 Å²	94.4	36%	0.356	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-75.6	122.3	172.2	-67.6	167	0	0	0	108.9	P43 D50	P43-L52 HydrophobicContact CB-CD1 4.13Å; P43-L52 HydrophobicContact CG-CD1 4.24Å; P43-L52 VanDerWaalsContact O-CD1 3.26Å; P43-L52 WeakPolarHBondContact O-CD1 3.28Å; D50-L52 PolarHBondContact O-N 3.44Å
53	Q	57.6	Low	65.4	Low	121 Å²	121	89.4 Å²	89.4	57%	0.565	48%	0.475	S	S	*	.	S	Bend	trans	-79.9	-23.6	-173.3	-71	-166	10.4	0	0	114.6	N4	N4-Q53 PolarHBondContact ND2-NE2 2.93Å; N4-Q53 VanDerWaalsContact ND2-NE2 3.17Å; N4-Q53 PolarHBondContact OD1-NE2 3.12Å; N4-Q53 VanDerWaalsContact OD1-NE2 3.17Å
54	F	60.1	Low	65.3	Low	150 Å²	150	91.9 Å²	91.9	66%	0.658	48%	0.483	S	S	*	.			trans	-137.7	115	-179.8	-71.7	-87.7	0	0	0	110.1
55	N	55.3	Low	65.1	Low	76 Å²	76	91.5 Å²	91.5	41%	0.406	48%	0.476	S	S	.	.	S	Bend	trans	-128.8	-6.4	171	-96	-27.8	0	0	0	114	P43	P43-N55 PolarHBondContact O-ND2 2.92Å
56	Q	57.7	Low	64.4	Low	172 Å²	172	92.5 Å²	92.5	80%	0.804	49%	0.49	S	S	*	.			trans	-146.4	129.9	171.9	-71.2	-178.5	-21.8	0	0	109.5
57	L	59.6	Low	63.8	Low	94 Å²	94	95.9 Å²	95.9	49%	0.492	51%	0.511	S	S	.	.			trans	-72.6	135.6	160	-75.7	155.8	0	0	0	107	E61 L62 L65	L57-E61 HydrophobicContact CB-CB 4.41Å; L57-E61 HydrophobicContact CD2-CB 3.86Å; L57-L62 HydrophobicContact CB-CD1 4.18Å; L57-L62 HydrophobicContact CB-CG 4.1Å; L57-L65 HydrophobicContact CD1-CD1 4Å; L57-L65 HydrophobicContact CD2-CD1 4.2Å
58	S	63.2	Low	63.3	Low	55 Å²	55	98.6 Å²	98.6	39%	0.385	52%	0.52	S	S	.	.			trans	-65.3	156.2	171.2	63.6	0	0	0	0	110.4	A60 E61 L62	S58-A60 PolarHBondContact O-N 3.17Å; S58-E61 PolarHBondContact N-OE2 3.43Å; S58-E61 PolarHBondContact O-N 2.94Å; S58-E61 VanDerWaalsContact OG-CD 3.23Å; S58-E61 WeakPolarHBondContact OG-CG 3.42Å; S58-E61 PolarHBondContact OG-N 3.17Å; S58-E61 PolarHBondContact OG-OE2 2.65Å; S58-L62 PolarHBondContact O-N 3.34Å
59	Q	62.3	Low	62.5	Low	145 Å²	145	101.6 Å²	101.6	68%	0.678	54%	0.543	S	S	*	.	H	α-helix	trans	-54.2	-37.6	177.1	-157	77.5	19.1	0	0	111.2	L62 D63	Q59-L62 PolarHBondContact O-N 3.39Å; Q59-D63 WeakPolarHBondContact O-CB 3.47Å; Q59-D63 VanDerWaalsContact O-CG 3.23Å; Q59-D63 PolarHBondContact O-N 2.76Å
60	A	63.4	Low	61.5	Low	68 Å²	68	103.7 Å²	103.7	56%	0.562	55%	0.549	S	S	*	.	H	α-helix	trans	-64	-41.1	176.3	0	0	0	0	0	113	S58 D63 E64	S58-A60 PolarHBondContact O-N 3.17Å; A60-D63 PolarHBondContact O-N 2.6Å; A60-E64 WeakPolarHBondContact O-CB 3.15Å; A60-E64 PolarHBondContact O-N 2.73Å
61	E	65.3	Low	60.7	Low	78 Å²	78	106.1 Å²	106.1	36%	0.364	57%	0.566	S	S	.	*	H	α-helix	trans	-72.7	-31.8	177.4	-70.2	163.3	151.3	0	0	112.3	L57 S58 E64 L65	L57-E61 HydrophobicContact CB-CB 4.41Å; L57-E61 HydrophobicContact CD2-CB 3.86Å; S58-E61 PolarHBondContact N-OE2 3.43Å; S58-E61 PolarHBondContact O-N 2.94Å; S58-E61 VanDerWaalsContact OG-CD 3.23Å; S58-E61 WeakPolarHBondContact OG-CG 3.42Å; S58-E61 PolarHBondContact OG-N 3.17Å; S58-E61 PolarHBondContact OG-OE2 2.65Å; E61-E64 PolarHBondContact O-N 2.96Å; E61-L65 WeakPolarHBondContact O-CB 3.37Å; E61-L65 PolarHBondContact O-N 3.35Å
62	L	66.7	Low	60.3	Low	83 Å²	83	103.6 Å²	103.6	44%	0.435	57%	0.568	S	S	.	*	H	α-helix	trans	-66.1	-42.1	171.4	-95.4	152.3	0	0	0	111.6	L57 S58 Q59 L65 A66	L57-L62 HydrophobicContact CB-CD1 4.18Å; L57-L62 HydrophobicContact CB-CG 4.1Å; S58-L62 PolarHBondContact O-N 3.34Å; Q59-L62 PolarHBondContact O-N 3.39Å; L62-L65 PolarHBondContact O-N 2.78Å; L62-A66 WeakPolarHBondContact O-CB 3.38Å; L62-A66 PolarHBondContact O-N 3.13Å
63	D	64.6	Low	59.7	Low	95 Å²	95	105.5 Å²	105.5	51%	0.508	58%	0.583	S	S	.	*	H	α-helix	trans	-69.9	-33.5	175	-68.5	-24	0	0	0	111.6	Q59 A60 A66 S67	Q59-D63 WeakPolarHBondContact O-CB 3.47Å; Q59-D63 VanDerWaalsContact O-CG 3.23Å; Q59-D63 PolarHBondContact O-N 2.76Å; A60-D63 PolarHBondContact O-N 2.6Å; D63-A66 PolarHBondContact O-N 2.75Å; D63-S67 WeakPolarHBondContact O-CB 3.34Å; D63-S67 PolarHBondContact O-N 3.03Å; D63-S67 PolarHBondContact O-OG 3.37Å
64	E	66.2	Low	59.4	Low	101 Å²	101	108.8 Å²	108.8	47%	0.472	59%	0.592	S	S	.	*	H	α-helix	trans	-68.7	-34.9	172.6	-141.6	-165	147.9	0	0	112.2	A60 E61 S67 K68	A60-E64 WeakPolarHBondContact O-CB 3.15Å; A60-E64 PolarHBondContact O-N 2.73Å; E61-E64 PolarHBondContact O-N 2.96Å; E64-S67 VanDerWaalsContact CA-OG 3.25Å; E64-S67 WeakPolarHBondContact CA-OG 3.34Å; E64-S67 PolarHBondContact O-OG 2.94Å; E64-K68 WeakPolarHBondContact O-CG 3.47Å; E64-K68 PolarHBondContact O-N 3.27Å; E64-K68 VanDerWaalsContact O-N 3.1Å; E64-K68 IonicContact OE1-NZ 2.74Å; E64-K68 PolarHBondContact OE1-NZ 3.16Å
65	L	64.9	Low	59.4	Low	107 Å²	107	104.9 Å²	104.9	56%	0.56	59%	0.594	S	S	*	*	H	α-helix	trans	-71	-38.9	171.8	-99.8	148.8	0	0	0	112	L57 E61 L62 S67 K68	L57-L65 HydrophobicContact CD1-CD1 4Å; L57-L65 HydrophobicContact CD2-CD1 4.2Å; E61-L65 WeakPolarHBondContact O-CB 3.37Å; E61-L65 PolarHBondContact O-N 3.35Å; L62-L65 PolarHBondContact O-N 2.78Å; L65-S67 VanDerWaalsContact C-N 3.29Å; L65-S67 PolarHBondContact O-N 3.42Å; L65-K68 PolarHBondContact O-N 3.41Å
66	A	58.5	Low	59.5	Low	76 Å²	76	110.2 Å²	110.2	63%	0.628	62%	0.616	S	S	*	*	H	α-helix	trans	-68.4	-28.9	175.6	0	0	0	0	0	112.4	L62 D63	L62-A66 WeakPolarHBondContact O-CB 3.38Å; L62-A66 PolarHBondContact O-N 3.13Å; D63-A66 PolarHBondContact O-N 2.75Å
67	S	59.7	Low	59.5	Low	89 Å²	89	107.8 Å²	107.8	62%	0.622	62%	0.615	S	S	*	*	H	α-helix	trans	-85.2	-20	176.4	51.8	0	0	0	0	113.8	D63 E64 L65 A69	D63-S67 WeakPolarHBondContact O-CB 3.34Å; D63-S67 PolarHBondContact O-N 3.03Å; D63-S67 PolarHBondContact O-OG 3.37Å; E64-S67 VanDerWaalsContact CA-OG 3.25Å; E64-S67 WeakPolarHBondContact CA-OG 3.34Å; E64-S67 PolarHBondContact O-OG 2.94Å; L65-S67 VanDerWaalsContact C-N 3.29Å; L65-S67 PolarHBondContact O-N 3.42Å; S67-A69 PolarHBondContact O-N 3.36Å
68	K	60.7	Low	59.4	Low	141 Å²	141	113 Å²	113	61%	0.613	63%	0.634	S	S	*	*	S	Bend	trans	-81.4	65.1	170.1	-74.8	171.4	-173	161.2	0	111.7	E64 L65	E64-K68 WeakPolarHBondContact O-CG 3.47Å; E64-K68 PolarHBondContact O-N 3.27Å; E64-K68 VanDerWaalsContact O-N 3.1Å; E64-K68 IonicContact OE1-NZ 2.74Å; E64-K68 PolarHBondContact OE1-NZ 3.16Å; L65-K68 PolarHBondContact O-N 3.41Å
69	A	56.1	Low	59.3	Low	77 Å²	77	119.3 Å²	119.3	64%	0.636	66%	0.657	S	S	*	*			trans	57.8	122.1	160.1	0	0	0	0	0	120.4	S67	S67-A69 PolarHBondContact O-N 3.36Å
70	P	47.6	Very low	59.3	Low	86 Å²	86	116.6 Å²	116.6	56%	0.558	66%	0.66	S	S	*	*				-133.3	56.3	122.1	40	-29.2	0	0	0	112	L72	P70-L72 PolarHBondContact O-N 2.91Å
71	V	53.3	Low	59.7	Low	120 Å²	120	118.8 Å²	118.8	73%	0.727	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-9.3	176.3	-180	0	0	0	0	112.6
72	L	56.6	Low	60.1	Low	173 Å²	173	120.7 Å²	120.7	91%	0.906	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-0.3	-177.5	-80.6	159.3	0	0	0	115.1	P70	P70-L72 PolarHBondContact O-N 2.91Å
73	T	54.2	Low	60.4	Low	109 Å²	109	121.5 Å²	121.5	67%	0.669	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.2	-25.1	179.3	-23.6	0	0	0	0	115.8
74	Y	51.9	Low	61	Low	190 Å²	190	124.1 Å²	124.1	75%	0.745	72%	0.72	S	S	*	*	S	Bend	trans	-140	126.4	176.6	-59.6	-87.1	0	0	0	107.3
75	G	59.3	Low	61.8	Low	68 Å²	68	128.2 Å²	128.2	70%	0.701	74%	0.737	S	S	*	*			trans	-61	-171.1	-167.5	0	0	0	0	0	116.8
76	Q	58.5	Low	62.6	Low	187 Å²	187	128 Å²	128	87%	0.874	74%	0.735	S	S	*	*	S	Bend	trans	-52	133.1	-175.6	-81.3	-169.9	-22.4	0	0	112.6	K78	Q76-K78 PolarHBondContact O-N 2.95Å
77	P	56.4	Low	63.9	Low	121 Å²	121	126.6 Å²	126.6	79%	0.786	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-62.4	128.6	178.2	24.5	-31.5	0	0	0	109.9	Q79	P77-Q79 PolarHBondContact O-N 3.06Å
78	K	58	Low	64.8	Low	204 Å²	204	125 Å²	125	89%	0.887	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-57.2	122.2	177.6	-158.3	176	-173.2	-178	0	108.5	Q76 A80	Q76-K78 PolarHBondContact O-N 2.95Å; K78-A80 PolarHBondContact O-N 3.24Å
79	Q	61.4	Low	65.8	Low	187 Å²	187	123.4 Å²	123.4	87%	0.874	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-54.5	130.9	173.9	-100.7	178.1	-12.4	0	0	109.1	P77	P77-Q79 PolarHBondContact O-N 3.06Å
80	A	61.9	Low	67.1	Low	88 Å²	88	123.7 Å²	123.7	73%	0.727	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-56.8	136.2	176.1	0	0	0	0	0	109	K78	K78-A80 PolarHBondContact O-N 3.24Å
81	P	72.3	Confident	68.9	Low	115 Å²	115	121.3 Å²	121.3	75%	0.747	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-57.9	145	175.4	24.2	-31.8	0	0	0	109.8	A83	P81-A83 PolarHBondContact O-N 3.46Å
82	P	72.4	Confident	70.5	Confident	118 Å²	118	118.6 Å²	118.6	77%	0.766	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-57.6	137.9	173.3	24.9	-32.2	0	0	0	109	D84	P82-D84 PolarHBondContact O-N 2.76Å
83	A	73	Confident	72	Confident	100 Å²	100	114.1 Å²	114.1	83%	0.826	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-60.1	133.6	-179.5	0	0	0	0	0	110.2	P81 F85	P81-A83 PolarHBondContact O-N 3.46Å; A83-F85 PolarHBondContact O-N 2.73Å
84	D	78.3	Confident	73.6	Confident	149 Å²	149	117.4 Å²	117.4	80%	0.797	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-58.7	133.3	176.6	-66.2	-35.2	0	0	0	110	P82 I86	P82-D84 PolarHBondContact O-N 2.76Å; D84-I86 PolarHBondContact O-N 2.98Å; D84-I86 VanDerWaalsContact O-N 3.13Å
85	F	82.3	Confident	75.5	Confident	188 Å²	188	112.5 Å²	112.5	83%	0.825	63%	0.631	S	S	*	*			trans	-70.1	109.1	175.9	173.3	-101.4	0	0	0	109.5	A83 P87	A83-F85 PolarHBondContact O-N 2.73Å; F85-P87 HydrophobicContact CE1-CG 4.25Å
86	I	82.3	Confident	77.2	Confident	102 Å²	102	111.1 Å²	111.1	52%	0.523	61%	0.608	S	S	.	*			trans	-96.6	118.8	175.3	-55.9	173.6	0	0	0	108.1	D84 V90 A91	D84-I86 PolarHBondContact O-N 2.98Å; D84-I86 VanDerWaalsContact O-N 3.13Å; I86-V90 HydrophobicContact CG2-CB 3.86Å; I86-V90 HydrophobicContact CG2-CG1 3.92Å; I86-A91 HydrophobicContact CB-CB 4.5Å; I86-A91 HydrophobicContact CG2-CB 3.87Å
87	P	85.8	Confident	78.9	Confident	46 Å²	46	102.2 Å²	102.2	30%	0.299	57%	0.567	S	S	.	*			trans	-57.8	147.9	175.1	-25.1	34.7	0	0	0	112.4	F85 H89 V90 A91	F85-P87 HydrophobicContact CE1-CG 4.25Å; P87-H89 VanDerWaalsContact C-N 3.31Å; P87-H89 WeakPolarHBondContact CB-CE1 3.32Å; P87-H89 PolarHBondContact O-N 3.45Å; P87-V90 HydrophobicContact CB-CG2 4.38Å; P87-V90 PolarHBondContact O-N 3.2Å; P87-A91 PolarHBondContact O-N 3.26Å
88	A	78.9	Confident	80.8	Confident	57 Å²	57	98.8 Å²	98.8	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-55	-42.3	-176.6	0	0	0	0	0	113.4	V90 A91 F92	A88-V90 PolarHBondContact O-N 3.37Å; A88-A91 PolarHBondContact O-N 3.24Å; A88-F92 HydrophobicContact CB-CD2 4.19Å; A88-F92 WeakPolarHBondContact O-CB 3.32Å; A88-F92 WeakPolarHBondContact O-CD2 3.4Å; A88-F92 PolarHBondContact O-N 3.23Å
89	H	80.6	Confident	82.7	Confident	107 Å²	107	89.1 Å²	89.1	50%	0.495	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-27.5	178.1	64.8	-90.4	0	0	0	113.2	P87 D93 E127	P87-H89 VanDerWaalsContact C-N 3.31Å; P87-H89 WeakPolarHBondContact CB-CE1 3.32Å; P87-H89 PolarHBondContact O-N 3.45Å; H89-D93 PolarHBondContact O-N 2.87Å; H89-E127 HydrophobicContact CB-CG 3.92Å
90	V	85.3	Confident	84.3	Confident	83 Å²	83	81.9 Å²	81.9	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-85.5	-42.3	175.1	-175.7	0	0	0	0	110.8	I86 P87 A88 F92	I86-V90 HydrophobicContact CG2-CB 3.86Å; I86-V90 HydrophobicContact CG2-CG1 3.92Å; P87-V90 HydrophobicContact CB-CG2 4.38Å; P87-V90 PolarHBondContact O-N 3.2Å; A88-V90 PolarHBondContact O-N 3.37Å; V90-F92 VanDerWaalsContact C-N 3.27Å; V90-F92 PolarHBondContact O-N 3.38Å
91	A	84.9	Confident	85.9	Confident	35 Å²	35	77.7 Å²	77.7	29%	0.289	43%	0.43	S	S	.	.	H	α-helix	trans	-65.9	-31.2	-178.9	0	0	0	0	0	113	I86 P87 A88 K95	I86-A91 HydrophobicContact CB-CB 4.5Å; I86-A91 HydrophobicContact CG2-CB 3.87Å; P87-A91 PolarHBondContact O-N 3.26Å; A88-A91 PolarHBondContact O-N 3.24Å; A91-K95 PolarHBondContact O-NZ 3.15Å
92	F	87.2	Confident	87	Confident	64 Å²	64	74.8 Å²	74.8	28%	0.281	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	14	-176.9	-60	-67.9	0	0	0	114.2	A88 V90 K94 K95 L126 F193	A88-F92 HydrophobicContact CB-CD2 4.19Å; A88-F92 WeakPolarHBondContact O-CB 3.32Å; A88-F92 WeakPolarHBondContact O-CD2 3.4Å; A88-F92 PolarHBondContact O-N 3.23Å; V90-F92 VanDerWaalsContact C-N 3.27Å; V90-F92 PolarHBondContact O-N 3.38Å; F92-K94 PolarHBondContact O-N 3.43Å; F92-K95 HydrophobicContact CD1-CD 3.99Å; F92-K95 WeakPolarHBondContact O-CB 3.26Å; F92-K95 PolarHBondContact O-N 2.91Å; F92-L126 HydrophobicContact CB-CB 3.7Å; F92-L126 HydrophobicContact CD1-CB 4.07Å; F92-L126 HydrophobicContact CD1-CD1 4.07Å; F92-L126 HydrophobicContact CG-CB 3.95Å; F92-F193 HydrophobicContact CE1-CE2 4.11Å; F92-F193 HydrophobicContact CE1-CZ 4.47Å
93	D	87.9	Confident	88	Confident	79 Å²	79	69.5 Å²	69.5	42%	0.422	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	131.1	174	-178.6	36.6	0	0	0	110.6	H89 K95	H89-D93 PolarHBondContact O-N 2.87Å; D93-K95 PolarHBondContact O-N 2.89Å
94	K	87.6	Confident	89	Confident	177 Å²	177	70 Å²	70	77%	0.77	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	6.4	-177.6	-60.1	167.1	-168.6	171.2	0	116.3	F92 V96	F92-K94 PolarHBondContact O-N 3.43Å; K94-V96 PolarHBondContact O-N 2.67Å
95	K	91.1	Very high	89.6	Confident	88 Å²	88	65.5 Å²	65.5	38%	0.383	33%	0.329	S	S	.	.			trans	-84.6	110.3	172.9	-64.4	-177	-174.1	157.1	0	109	A91 F92 D93 L126 F189	A91-K95 PolarHBondContact O-NZ 3.15Å; F92-K95 HydrophobicContact CD1-CD 3.99Å; F92-K95 WeakPolarHBondContact O-CB 3.26Å; F92-K95 PolarHBondContact O-N 2.91Å; D93-K95 PolarHBondContact O-N 2.89Å; K95-L126 HydrophobicContact CB-CD1 3.93Å; K95-L126 WeakPolarHBondContact O-CB 3.37Å; K95-L126 PolarHBondContact O-N 3.07Å; K95-F189 HydrophobicContact CB-CE1 4.4Å; K95-F189 HydrophobicContact CB-CZ 4.03Å; K95-F189 HydrophobicContact CD-CZ 4.41Å; K95-F189 HydrophobicContact CG-CZ 4.16Å
96	V	95.1	Very high	89.9	Confident	38 Å²	38	62.2 Å²	62.2	23%	0.23	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.9	-176.8	-173.9	0	0	0	0	108.8	K94 Y123 Y124 Y125 F189	K94-V96 PolarHBondContact O-N 2.67Å; V96-Y123 HydrophobicContact CG1-CD1 4.02Å; V96-Y123 HydrophobicContact CG1-CG 4.45Å; V96-Y124 CarbonylContact C-O 3.53Å; V96-Y124 WeakPolarHBondContact CA-O 3.43Å; V96-Y124 WeakPolarHBondContact CG1-O 3.46Å; V96-Y125 HydrophobicContact CB-CD1 4.43Å; V96-Y125 HydrophobicContact CG1-CD1 4.05Å; V96-Y125 HydrophobicContact CG1-CE1 4.08Å; V96-Y125 HydrophobicContact CG1-CG 4.41Å; V96-Y125 HydrophobicContact CG2-CD1 3.51Å; V96-Y125 HydrophobicContact CG2-CE1 3.83Å; V96-Y125 HydrophobicContact CG2-CG 4.38Å; V96-F189 WeakPolarHBondContact O-CD1 3.3Å; V96-F189 WeakPolarHBondContact O-CE1 3.35Å
97	L	95.3	Very high	90.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.3	171.6	-51.1	179.1	0	0	0	109.5	F99 Y123 Y124 L126 W165 F189 T190 F193	L97-F99 HydrophobicContact CB-CE2 3.85Å; L97-F99 HydrophobicContact CB-CZ 4.47Å; L97-Y123 CarbonylContact O-C 3.54Å; L97-Y123 VanDerWaalsContact O-CA 3.27Å; L97-Y123 WeakPolarHBondContact O-CA 3.49Å; L97-Y124 HydrophobicContact CD1-CD1 4.31Å; L97-Y124 PolarHBondContact N-O 3.29Å; L97-Y124 PolarHBondContact O-N 3.5Å; L97-L126 HydrophobicContact CD1-CD2 4.01Å; L97-L126 HydrophobicContact CD1-CG 4.46Å; L97-L126 HydrophobicContact CD2-CD1 4.04Å; L97-L126 HydrophobicContact CD2-CG 4.49Å; L97-L126 HydrophobicContact CG-CD1 4.22Å; L97-L126 HydrophobicContact CG-CD2 4.23Å; L97-L126 HydrophobicContact CG-CG 4.13Å; L97-W165 HydrophobicContact CD1-CB 3.66Å; L97-W165 HydrophobicContact CD1-CG 4.47Å; L97-F189 HydrophobicContact CD2-CD1 4.45Å; L97-F189 HydrophobicContact CD2-CE1 4.04Å; L97-T190 HydrophobicContact CB-CG2 3.37Å; L97-T190 HydrophobicContact CD2-CG2 3.7Å; L97-T190 HydrophobicContact CG-CG2 4.11Å; L97-F193 HydrophobicContact CD1-CD1 4.05Å; L97-F193 HydrophobicContact CD1-CE1 4.09Å; L97-F193 HydrophobicContact CD2-CB 4.01Å; L97-F193 HydrophobicContact CD2-CD1 3.45Å; L97-F193 VanDerWaalsContact CD2-CD1 3.45Å; L97-F193 HydrophobicContact CD2-CE1 4.09Å; L97-F193 HydrophobicContact CD2-CG 3.8Å; L97-F193 HydrophobicContact CG-CD1 4.36Å
98	K	96.3	Very high	90.2	Very high	50 Å²	50	61.4 Å²	61.4	22%	0.217	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.2	176.2	-178.7	-167.2	170.2	-125.4	0	110.7	D100 N121 I122 Y123 D187 T190	K98-D100 WeakPolarHBondContact CE-OD1 3.45Å; K98-D100 IonicContact NZ-OD1 3.71Å; K98-D100 PolarHBondContact NZ-OD1 3.21Å; K98-D100 IonicContact NZ-OD2 3.57Å; K98-N121 WeakPolarHBondContact CE-ND2 3.38Å; K98-I122 WeakPolarHBondContact CA-O 3.41Å; K98-Y123 HydrophobicContact CB-CD1 4.07Å; K98-Y123 HydrophobicContact CB-CE1 4.03Å; K98-Y123 HydrophobicContact CD-CE1 3.95Å; K98-Y123 HydrophobicContact CG-CD1 4.09Å; K98-Y123 HydrophobicContact CG-CE1 3.68Å; K98-D187 HydrophobicContact CB-CB 4.03Å; K98-D187 HydrophobicContact CD-CB 4.35Å; K98-D187 PolarHBondContact O-N 2.78Å; K98-T190 WeakPolarHBondContact O-CG2 3.43Å; K98-T190 PolarHBondContact O-OG1 3Å
99	F	96.1	Very high	90.3	Very high	1 Å²	1	68 Å²	68	0%	0.004	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.5	172.5	-60.3	-89.9	0	0	0	110.3	L97 N121 I122 L168 V183 D185 C186 L194	L97-F99 HydrophobicContact CB-CE2 3.85Å; L97-F99 HydrophobicContact CB-CZ 4.47Å; F99-N121 CarbonylContact O-C 3.57Å; F99-N121 WeakPolarHBondContact O-CA 3.46Å; F99-I122 HydrophobicContact CB-CB 4.31Å; F99-I122 PolarHBondContact N-O 3.36Å; F99-I122 PolarHBondContact O-N 2.92Å; F99-L168 HydrophobicContact CD2-CD1 4.24Å; F99-L168 HydrophobicContact CE1-CB 4.23Å; F99-L168 HydrophobicContact CE2-CB 3.95Å; F99-L168 HydrophobicContact CE2-CD1 3.6Å; F99-L168 HydrophobicContact CE2-CG 4.41Å; F99-L168 HydrophobicContact CZ-CB 3.66Å; F99-L168 HydrophobicContact CZ-CD1 4.17Å; F99-V183 HydrophobicContact CB-CG1 3.97Å; F99-V183 HydrophobicContact CD1-CG1 3.85Å; F99-V183 HydrophobicContact CG-CG1 4.26Å; F99-D185 CarbonylContact C-O 3.55Å; F99-D185 WeakPolarHBondContact CA-O 3.36Å; F99-C186 HydrophobicContact CD1-CB 3.61Å; F99-C186 HydrophobicContact CE1-CB 3.94Å; F99-C186 HydrophobicContact CG-CB 4.45Å; F99-L194 HydrophobicContact CE1-CD1 4.03Å; F99-L194 HydrophobicContact CZ-CD1 3.95Å
100	D	95.9	Very high	90.3	Very high	35 Å²	35	65.1 Å²	65.1	19%	0.187	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.4	173.1	-60.5	-35.3	0	0	0	108.3	K98 N121 V184 D185 M207	K98-D100 WeakPolarHBondContact CE-OD1 3.45Å; K98-D100 IonicContact NZ-OD1 3.71Å; K98-D100 PolarHBondContact NZ-OD1 3.21Å; K98-D100 IonicContact NZ-OD2 3.57Å; D100-N121 PolarHBondContact OD1-OD1 3.39Å; D100-V184 PolarHBondContact O-N 2.87Å; D100-D185 HydrophobicContact CB-CB 4.46Å; D100-D185 PolarHBondContact N-O 2.82Å; D100-D185 PolarHBondContact O-N 3.03Å; D100-M207 HydrophobicContact CB-CE 3.99Å
101	A	95.7	Very high	90.1	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	168.8	-172.3	0	0	0	0	0	111.6	V120 I122 R182	A101-V120 CarbonylContact C-O 3.59Å; A101-V120 WeakPolarHBondContact CA-O 3.3Å; A101-V120 HydrophobicContact CB-CG2 4.04Å; A101-V120 PolarHBondContact N-O 3.18Å; A101-V120 PolarHBondContact O-N 3.15Å; A101-I122 HydrophobicContact CB-CD1 3.83Å; A101-I122 HydrophobicContact CB-CG1 4.16Å; A101-R182 CarbonylContact C-O 3.49Å; A101-R182 WeakPolarHBondContact CA-O 3.31Å; A101-R182 WeakPolarHBondContact CB-O 3.41Å
102	Y	95.1	Very high	89.8	Confident	53 Å²	53	71.9 Å²	71.9	21%	0.208	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	161.6	168.3	69.7	-89.6	0	0	0	111.2	I117 R118 F181 R182 V184 M207 A208	Y102-I117 HydrophobicContact CD2-CG2 3.62Å; Y102-I117 HydrophobicContact CE2-CG2 4.44Å; Y102-I117 HydrophobicContact CG-CG2 3.93Å; Y102-R118 VanDerWaalsContact CA-O 3.24Å; Y102-R118 WeakPolarHBondContact CA-O 3.49Å; Y102-R118 WeakPolarHBondContact CB-O 3.31Å; Y102-F181 CarbonylContact O-C 3.58Å; Y102-F181 WeakPolarHBondContact O-CA 3.39Å; Y102-R182 HydrophobicContact CD1-CB 4.22Å; Y102-R182 HydrophobicContact CE1-CB 3.83Å; Y102-R182 HydrophobicContact CE1-CG 3.76Å; Y102-R182 HydrophobicContact CE2-CB 4.25Å; Y102-R182 PolarHBondContact N-O 2.82Å; Y102-R182 PolarHBondContact O-N 2.88Å; Y102-V184 HydrophobicContact CD1-CG2 3.41Å; Y102-V184 VanDerWaalsContact CD1-CG2 3.41Å; Y102-V184 HydrophobicContact CE1-CG2 3.41Å; Y102-V184 VanDerWaalsContact CE1-CG2 3.41Å; Y102-M207 HydrophobicContact CD1-SD 3.81Å; Y102-M207 HydrophobicContact CG-SD 4.34Å; Y102-A208 HydrophobicContact CD1-CB 4.22Å; Y102-A208 HydrophobicContact CD2-CB 4.23Å; Y102-A208 HydrophobicContact CE1-CB 3.83Å; Y102-A208 HydrophobicContact CE2-CB 3.83Å; Y102-A208 HydrophobicContact CG-CB 4.41Å
103	F	94.6	Very high	89.6	Confident	7 Å²	7	69.8 Å²	69.8	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151.4	165.7	72.3	-79.5	0	0	0	110	E105 R118 V120 L148 K179 T180 F181	F103-E105 HydrophobicContact CE2-CB 4.08Å; F103-R118 HydrophobicContact CD1-CB 4.05Å; F103-R118 HydrophobicContact CE1-CB 3.53Å; F103-R118 HydrophobicContact CE2-CB 4.42Å; F103-R118 HydrophobicContact CZ-CB 3.75Å; F103-R118 HydrophobicContact CZ-CG 4.27Å; F103-R118 PolarHBondContact N-O 3.3Å; F103-R118 PolarHBondContact O-N 3.41Å; F103-V120 HydrophobicContact CD1-CG1 4.12Å; F103-V120 HydrophobicContact CE1-CG1 3.89Å; F103-L148 HydrophobicContact CE1-CD2 3.9Å; F103-L148 HydrophobicContact CZ-CD2 4.29Å; F103-K179 HydrophobicContact CD2-CD 4.23Å; F103-K179 HydrophobicContact CE2-CD 3.91Å; F103-K179 HydrophobicContact CZ-CD 4.32Å; F103-T180 VanDerWaalsContact CB-O 3.27Å; F103-T180 WeakPolarHBondContact CB-O 3.5Å; F103-F181 HydrophobicContact CB-CD1 3.94Å; F103-F181 HydrophobicContact CB-CE1 4.23Å; F103-F181 AromaticContact CD1-CD1 3.75Å; F103-F181 HydrophobicContact CD1-CD1 3.75Å; F103-F181 AromaticContact CD1-CE1 3.36Å; F103-F181 HydrophobicContact CD1-CE1 3.36Å; F103-F181 HydrophobicContact CD1-CZ 4.32Å; F103-F181 AromaticContact CE1-CE1 3.92Å; F103-F181 HydrophobicContact CE1-CE1 3.92Å; F103-F181 HydrophobicContact CG-CD1 4.15Å; F103-F181 AromaticContact CG-CE1 3.95Å; F103-F181 HydrophobicContact CG-CE1 3.95Å
104	Q	92.6	Very high	89.5	Confident	111 Å²	111	74 Å²	74	52%	0.519	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	133.2	174.6	-178.7	177.5	-31.7	0	0	109.4	D106 Y115	Q104-D106 PolarHBondContact NE2-OD1 3.04Å; Q104-Y115 HydrophobicContact CG-CD2 3.81Å; Q104-Y115 HydrophobicContact CG-CG 4.16Å
105	E	90.5	Very high	89.6	Confident	54 Å²	54	69.7 Å²	69.7	25%	0.252	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.5	173.9	-176.9	162.3	-129.9	0	0	108.6	F103 Y115 R116 R118 K179	F103-E105 HydrophobicContact CE2-CB 4.08Å; E105-Y115 WeakPolarHBondContact O-CA 3.33Å; E105-R116 HydrophobicContact CB-CG 4.13Å; E105-R116 PolarHBondContact N-O 3.46Å; E105-R116 PolarHBondContact O-N 3.03Å; E105-R118 IonicContact OE1-NH1 2.79Å; E105-R118 WeakPolarHBondContact OE2-CD 3.2Å; E105-R118 IonicContact OE2-CZ 2.73Å; E105-R118 IonicContact OE2-NE 3.16Å; E105-R118 IonicContact OE2-NH1 3.68Å; E105-R118 PolarHBondContact OE2-NH1 3.09Å; E105-K179 IonicContact OE1-NZ 2.71Å
106	D	90	Very high	89.5	Confident	119 Å²	119	68.4 Å²	68.4	64%	0.636	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	135	179.3	-63.5	-31.1	0	0	0	110.4	Q104 P108	Q104-D106 PolarHBondContact NE2-OD1 3.04Å; D106-P108 WeakPolarHBondContact O-CD 3.44Å
107	V	88.6	Confident	89.3	Confident	23 Å²	23	67.8 Å²	67.8	14%	0.139	34%	0.343	C	S	.	.			trans	-116	94.6	-175.6	-175	0	0	0	0	108.9	E113 Q114 R116	V107-E113 HydrophobicContact CB-CG 4.49Å; V107-E113 HydrophobicContact CG1-CG 4.45Å; V107-Q114 PolarHBondContact N-O 2.98Å; V107-R116 HydrophobicContact CG2-CB 4.28Å; V107-R116 HydrophobicContact CG2-CG 3.81Å; V107-R116 VanDerWaalsContact CG2-NE 3.31Å
108	P	84.8	Confident	89.2	Confident	109 Å²	109	69 Å²	69	71%	0.708	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	142	176.4	28.7	-32.8	0	0	0	110.5	D106 S110	D106-P108 WeakPolarHBondContact O-CD 3.44Å; P108-S110 PolarHBondContact O-N 2.91Å
109	M	80.4	Confident	89	Confident	196 Å²	196	70.3 Å²	70.3	97%	0.966	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	23.2	169.9	-50.1	-61.7	-172.9	0	0	117.2
110	S	81.3	Confident	88.9	Confident	46 Å²	46	70.3 Å²	70.3	32%	0.322	35%	0.354	S	S	.	.			trans	-92.3	139.8	167.6	175.7	0	0	0	0	111.3	P108 E112 E113	P108-S110 PolarHBondContact O-N 2.91Å; S110-E112 VanDerWaalsContact C-N 3.34Å; S110-E112 PolarHBondContact OG-N 3.23Å; S110-E113 VanDerWaalsContact CB-O 3.31Å; S110-E113 WeakPolarHBondContact CB-O 3.31Å; S110-E113 PolarHBondContact OG-N 3.29Å
111	T	80.4	Confident	88.9	Confident	148 Å²	148	70.1 Å²	70.1	91%	0.908	35%	0.353	S	S	*	.	S	Bend	trans	-79	-20.4	172.7	52.2	0	0	0	0	112.6
112	E	78.8	Confident	89	Confident	111 Å²	111	70.1 Å²	70.1	52%	0.519	35%	0.353	S	S	.	.	S	Bend	trans	-97.5	-31.7	-172.3	-57.5	-174.3	139.3	0	0	112.8	S110 Y212 R216	S110-E112 VanDerWaalsContact C-N 3.34Å; S110-E112 PolarHBondContact OG-N 3.23Å; E112-Y212 HydrophobicContact CB-CD2 4.12Å; E112-Y212 HydrophobicContact CB-CE2 3.67Å; E112-Y212 HydrophobicContact CG-CE2 4.33Å; E112-Y212 WeakPolarHBondContact OE2-CE2 3.38Å; E112-Y212 VanDerWaalsContact OE2-CZ 3.28Å; E112-Y212 PolarHBondContact OE2-OH 3.06Å; E112-R216 IonicContact OE1-NH2 2.67Å; E112-R216 IonicContact OE2-NH2 3.61Å; E112-R216 PolarHBondContact OE2-NH2 3.38Å
113	E	82.8	Confident	89	Confident	20 Å²	20	70.4 Å²	70.4	9%	0.093	35%	0.354	C	S	.	.			trans	-146.4	150.4	-175.9	60.9	177.7	-169.9	0	0	112.3	V107 S110 R116 Y212	V107-E113 HydrophobicContact CB-CG 4.49Å; V107-E113 HydrophobicContact CG1-CG 4.45Å; S110-E113 VanDerWaalsContact CB-O 3.31Å; S110-E113 WeakPolarHBondContact CB-O 3.31Å; S110-E113 PolarHBondContact OG-N 3.29Å; E113-R116 IonicContact OE1-CZ 3.27Å; E113-R116 IonicContact OE1-NE 3.47Å; E113-R116 PolarHBondContact OE1-NE 3.19Å; E113-R116 IonicContact OE1-NH2 2.84Å; E113-R116 PolarHBondContact OE1-NH2 3.03Å; E113-Y212 HydrophobicContact CB-CD2 4.49Å; E113-Y212 VanDerWaalsContact OE2-CB 3.28Å; E113-Y212 WeakPolarHBondContact OE2-CB 3.41Å
114	Q	86.8	Confident	89	Confident	167 Å²	167	70.1 Å²	70.1	78%	0.78	35%	0.353	S	S	*	.	S	Bend	trans	-101.4	-32.4	176	-68.5	-179.3	-18.4	0	0	112.6	V107	V107-Q114 PolarHBondContact N-O 2.98Å
115	Y	89.6	Confident	89.2	Confident	87 Å²	87	67.1 Å²	67.1	34%	0.341	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.6	174.3	66.6	-89.5	0	0	0	107.6	Q104 E105 I117	Q104-Y115 HydrophobicContact CG-CD2 3.81Å; Q104-Y115 HydrophobicContact CG-CG 4.16Å; E105-Y115 WeakPolarHBondContact O-CA 3.33Å; Y115-I117 HydrophobicContact CD2-CG1 4.3Å; Y115-I117 HydrophobicContact CE2-CD1 4.29Å; Y115-I117 HydrophobicContact CE2-CG1 4.11Å
116	R	89.5	Confident	89.2	Confident	62 Å²	62	64.9 Å²	64.9	23%	0.234	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.8	173.2	65.3	178.9	66.4	148.1	4.9	110.8	E105 V107 E113 I143	E105-R116 HydrophobicContact CB-CG 4.13Å; E105-R116 PolarHBondContact N-O 3.46Å; E105-R116 PolarHBondContact O-N 3.03Å; V107-R116 HydrophobicContact CG2-CB 4.28Å; V107-R116 HydrophobicContact CG2-CG 3.81Å; V107-R116 VanDerWaalsContact CG2-NE 3.31Å; E113-R116 IonicContact OE1-CZ 3.27Å; E113-R116 IonicContact OE1-NE 3.47Å; E113-R116 PolarHBondContact OE1-NE 3.19Å; E113-R116 IonicContact OE1-NH2 2.84Å; E113-R116 PolarHBondContact OE1-NH2 3.03Å; R116-I143 VanDerWaalsContact NH1-CD1 3.33Å
117	I	91.5	Very high	89.3	Confident	25 Å²	25	62.7 Å²	62.7	13%	0.128	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	119.9	178.9	-57.5	-174.8	0	0	0	109.3	Y102 Y115 A208 D210	Y102-I117 HydrophobicContact CD2-CG2 3.62Å; Y102-I117 HydrophobicContact CE2-CG2 4.44Å; Y102-I117 HydrophobicContact CG-CG2 3.93Å; Y115-I117 HydrophobicContact CD2-CG1 4.3Å; Y115-I117 HydrophobicContact CE2-CD1 4.29Å; Y115-I117 HydrophobicContact CE2-CG1 4.11Å; I117-A208 HydrophobicContact CD1-CB 3.55Å; I117-A208 HydrophobicContact CG2-CB 4.22Å; I117-D210 HydrophobicContact CB-CB 4.19Å
118	R	91.7	Very high	89.4	Confident	26 Å²	26	64.8 Å²	64.8	10%	0.098	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	114.6	177.8	-70	-179.1	72.5	169.4	6.5	110.4	Y102 F103 E105 E135	Y102-R118 VanDerWaalsContact CA-O 3.24Å; Y102-R118 WeakPolarHBondContact CA-O 3.49Å; Y102-R118 WeakPolarHBondContact CB-O 3.31Å; F103-R118 HydrophobicContact CD1-CB 4.05Å; F103-R118 HydrophobicContact CE1-CB 3.53Å; F103-R118 HydrophobicContact CE2-CB 4.42Å; F103-R118 HydrophobicContact CZ-CB 3.75Å; F103-R118 HydrophobicContact CZ-CG 4.27Å; F103-R118 PolarHBondContact N-O 3.3Å; F103-R118 PolarHBondContact O-N 3.41Å; E105-R118 IonicContact OE1-NH1 2.79Å; E105-R118 WeakPolarHBondContact OE2-CD 3.2Å; E105-R118 IonicContact OE2-CZ 2.73Å; E105-R118 IonicContact OE2-NE 3.16Å; E105-R118 IonicContact OE2-NH1 3.68Å; E105-R118 PolarHBondContact OE2-NH1 3.09Å; R118-E135 IonicContact CZ-OE1 3.99Å; R118-E135 IonicContact CZ-OE2 3.2Å; R118-E135 IonicContact NE-OE1 3.47Å; R118-E135 PolarHBondContact NE-OE1 2.59Å; R118-E135 IonicContact NE-OE2 2.82Å; R118-E135 PolarHBondContact NE-OE2 3.17Å; R118-E135 IonicContact NH2-OE1 3.83Å; R118-E135 PolarHBondContact NH2-OE1 3.36Å; R118-E135 IonicContact NH2-OE2 2.67Å; R118-E135 PolarHBondContact NH2-OE2 3.28Å
119	Q	92.9	Very high	89.7	Confident	77 Å²	77	61.9 Å²	61.9	36%	0.36	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	136.1	177.1	-60.9	179.2	-0.6	0	0	109.2	E135 P136 M207	Q119-E135 WeakPolarHBondContact O-CG 3.33Å; Q119-P136 VanDerWaalsContact O-CD 3.25Å; Q119-P136 WeakPolarHBondContact O-CD 3.46Å; Q119-M207 HydrophobicContact CG-CG 4.07Å; Q119-M207 HydrophobicContact CG-SD 4.03Å
120	V	94.7	Very high	90.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	149.7	-178.9	-60.9	0	0	0	0	111.1	A101 F103 V133 E135 L148 F181	A101-V120 CarbonylContact C-O 3.59Å; A101-V120 WeakPolarHBondContact CA-O 3.3Å; A101-V120 HydrophobicContact CB-CG2 4.04Å; A101-V120 PolarHBondContact N-O 3.18Å; A101-V120 PolarHBondContact O-N 3.15Å; F103-V120 HydrophobicContact CD1-CG1 4.12Å; F103-V120 HydrophobicContact CE1-CG1 3.89Å; V120-V133 HydrophobicContact CB-CG1 3.76Å; V120-V133 HydrophobicContact CG1-CG1 4.21Å; V120-V133 HydrophobicContact CG2-CG1 3.81Å; V120-E135 HydrophobicContact CG1-CB 4.21Å; V120-L148 HydrophobicContact CG1-CD2 4.33Å; V120-F181 HydrophobicContact CG1-CE1 4.44Å; V120-F181 HydrophobicContact CG2-CD1 3.55Å; V120-F181 HydrophobicContact CG2-CE1 3.82Å
121	N	96	Very high	91	Very high	31 Å²	31	50.5 Å²	50.5	17%	0.166	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.1	172.4	-62.6	-6.5	0	0	0	108.7	K98 F99 D100 Y123 V133 I134	K98-N121 WeakPolarHBondContact CE-ND2 3.38Å; F99-N121 CarbonylContact O-C 3.57Å; F99-N121 WeakPolarHBondContact O-CA 3.46Å; D100-N121 PolarHBondContact OD1-OD1 3.39Å; N121-Y123 HydrophobicContact CB-CE2 3.75Å; N121-V133 WeakPolarHBondContact O-CA 3.45Å; N121-I134 PolarHBondContact N-O 3.41Å; N121-I134 PolarHBondContact O-N 2.87Å
122	I	95.8	Very high	91.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.7	175.8	-55.7	177.2	0	0	0	107.8	K98 F99 A101 M131 V133 I174 F181 V183	K98-I122 WeakPolarHBondContact CA-O 3.41Å; F99-I122 HydrophobicContact CB-CB 4.31Å; F99-I122 PolarHBondContact N-O 3.36Å; F99-I122 PolarHBondContact O-N 2.92Å; A101-I122 HydrophobicContact CB-CD1 3.83Å; A101-I122 HydrophobicContact CB-CG1 4.16Å; I122-M131 HydrophobicContact CG2-CE 3.55Å; I122-V133 HydrophobicContact CG1-CG1 4.33Å; I122-V133 HydrophobicContact CG1-CG2 4.16Å; I122-V133 HydrophobicContact CG2-CG2 4.46Å; I122-I174 HydrophobicContact CD1-CD1 4.36Å; I122-F181 HydrophobicContact CD1-CB 4.19Å; I122-V183 HydrophobicContact CD1-CG2 4.34Å
123	Y	96	Very high	92.5	Very high	59 Å²	59	38.4 Å²	38.4	23%	0.231	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.8	174.7	-60.6	-85.8	0	0	0	109.6	V96 L97 K98 N121 M131 S132 I134	V96-Y123 HydrophobicContact CG1-CD1 4.02Å; V96-Y123 HydrophobicContact CG1-CG 4.45Å; L97-Y123 CarbonylContact O-C 3.54Å; L97-Y123 VanDerWaalsContact O-CA 3.27Å; L97-Y123 WeakPolarHBondContact O-CA 3.49Å; K98-Y123 HydrophobicContact CB-CD1 4.07Å; K98-Y123 HydrophobicContact CB-CE1 4.03Å; K98-Y123 HydrophobicContact CD-CE1 3.95Å; K98-Y123 HydrophobicContact CG-CD1 4.09Å; K98-Y123 HydrophobicContact CG-CE1 3.68Å; N121-Y123 HydrophobicContact CB-CE2 3.75Å; Y123-M131 CarbonylContact O-C 3.55Å; Y123-M131 WeakPolarHBondContact O-CA 3.45Å; Y123-S132 PolarHBondContact N-O 3.43Å; Y123-S132 PolarHBondContact O-N 3.21Å; Y123-I134 HydrophobicContact CD2-CD1 3.86Å; Y123-I134 HydrophobicContact CD2-CG1 4.03Å; Y123-I134 HydrophobicContact CE2-CB 4.05Å; Y123-I134 HydrophobicContact CE2-CD1 3.71Å; Y123-I134 HydrophobicContact CE2-CG1 3.97Å
124	Y	95.1	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.4	173.7	-174	-77.6	0	0	0	109.1	V96 L97 L126 D129 S130 M131 Y163 H164 W165 L168	V96-Y124 CarbonylContact C-O 3.53Å; V96-Y124 WeakPolarHBondContact CA-O 3.43Å; V96-Y124 WeakPolarHBondContact CG1-O 3.46Å; L97-Y124 HydrophobicContact CD1-CD1 4.31Å; L97-Y124 PolarHBondContact N-O 3.29Å; L97-Y124 PolarHBondContact O-N 3.5Å; Y124-L126 HydrophobicContact CD1-CD2 4.15Å; Y124-L126 HydrophobicContact CE1-CD2 4.09Å; Y124-D129 VanDerWaalsContact OH-CB 3.31Å; Y124-D129 WeakPolarHBondContact OH-CB 3.27Å; Y124-D129 PolarHBondContact OH-OD1 3.34Å; Y124-S130 WeakPolarHBondContact CA-O 3.42Å; Y124-M131 HydrophobicContact CD2-CE 4.45Å; Y124-M131 HydrophobicContact CD2-CG 3.3Å; Y124-M131 HydrophobicContact CD2-SD 3.73Å; Y124-M131 HydrophobicContact CE2-CG 3.89Å; Y124-M131 HydrophobicContact CE2-SD 4.09Å; Y124-M131 HydrophobicContact CG-CG 4.15Å; Y124-Y163 WeakPolarHBondContact CE2-O 3.41Å; Y124-Y163 PolarHBondContact OH-O 3.44Å; Y124-H164 WeakPolarHBondContact OH-CA 3.45Å; Y124-W165 HydrophobicContact CD1-CB 4.01Å; Y124-W165 HydrophobicContact CE1-CB 3.75Å; Y124-W165 AromaticContact CE1-CD1 3.91Å; Y124-W165 HydrophobicContact CE1-CG 4.27Å; Y124-W165 PolarHBondContact OH-N 2.98Å; Y124-L168 HydrophobicContact CD2-CD1 3.7Å; Y124-L168 HydrophobicContact CE2-CD1 4.47Å; Y124-L168 HydrophobicContact CG-CD1 4.11Å
125	Y	95.4	Very high	93.5	Very high	48 Å²	48	32 Å²	32	19%	0.188	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.1	-177.3	-58	-95.9	0	0	0	108.9	V96 E127 D128 D129 S130 S132 R151	V96-Y125 HydrophobicContact CB-CD1 4.43Å; V96-Y125 HydrophobicContact CG1-CD1 4.05Å; V96-Y125 HydrophobicContact CG1-CE1 4.08Å; V96-Y125 HydrophobicContact CG1-CG 4.41Å; V96-Y125 HydrophobicContact CG2-CD1 3.51Å; V96-Y125 HydrophobicContact CG2-CE1 3.83Å; V96-Y125 HydrophobicContact CG2-CG 4.38Å; Y125-E127 PolarHBondContact O-N 2.95Å; Y125-D128 WeakPolarHBondContact CB-OD1 3.45Å; Y125-D129 WeakPolarHBondContact O-CA 3.25Å; Y125-D129 PolarHBondContact O-N 3.01Å; Y125-D129 VanDerWaalsContact O-N 3.09Å; Y125-S130 WeakPolarHBondContact CD2-O 3.47Å; Y125-S130 WeakPolarHBondContact CD2-OG 3.33Å; Y125-S130 PolarHBondContact N-O 2.9Å; Y125-S132 WeakPolarHBondContact CE2-OG 3.45Å; Y125-S132 PolarHBondContact OH-OG 2.85Å; Y125-S132 VanDerWaalsContact OH-OG 3.13Å; Y125-R151 HydrophobicContact CD2-CG 3.88Å; Y125-R151 HydrophobicContact CE2-CB 4.31Å; Y125-R151 HydrophobicContact CE2-CG 3.76Å
126	L	92.4	Very high	93.6	Very high	8 Å²	8	30 Å²	30	4%	0.042	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-14	-177.6	-70.1	171.5	0	0	0	113.5	F92 K95 L97 Y124 W165 F193	F92-L126 HydrophobicContact CB-CB 3.7Å; F92-L126 HydrophobicContact CD1-CB 4.07Å; F92-L126 HydrophobicContact CD1-CD1 4.07Å; F92-L126 HydrophobicContact CG-CB 3.95Å; K95-L126 HydrophobicContact CB-CD1 3.93Å; K95-L126 WeakPolarHBondContact O-CB 3.37Å; K95-L126 PolarHBondContact O-N 3.07Å; L97-L126 HydrophobicContact CD1-CD2 4.01Å; L97-L126 HydrophobicContact CD1-CG 4.46Å; L97-L126 HydrophobicContact CD2-CD1 4.04Å; L97-L126 HydrophobicContact CD2-CG 4.49Å; L97-L126 HydrophobicContact CG-CD1 4.22Å; L97-L126 HydrophobicContact CG-CD2 4.23Å; L97-L126 HydrophobicContact CG-CG 4.13Å; Y124-L126 HydrophobicContact CD1-CD2 4.15Å; Y124-L126 HydrophobicContact CE1-CD2 4.09Å; L126-W165 HydrophobicContact CD2-CB 4.4Å; L126-W165 HydrophobicContact CD2-CG 4.09Å; L126-F193 HydrophobicContact CD1-CD1 4.4Å; L126-F193 HydrophobicContact CD1-CD2 4.14Å; L126-F193 HydrophobicContact CD1-CE1 3.92Å; L126-F193 HydrophobicContact CD1-CE2 3.63Å; L126-F193 HydrophobicContact CD1-CG 4.49Å; L126-F193 HydrophobicContact CD1-CZ 3.5Å; L126-F193 HydrophobicContact CD2-CE1 3.86Å; L126-F193 HydrophobicContact CD2-CZ 3.78Å; L126-F193 HydrophobicContact CG-CZ 4.31Å
127	E	91.6	Very high	93.6	Very high	72 Å²	72	32.9 Å²	32.9	34%	0.336	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-41.5	178.8	-174.4	-166.8	-179.7	0	0	112.5	H89 Y125 R151	H89-E127 HydrophobicContact CB-CG 3.92Å; Y125-E127 PolarHBondContact O-N 2.95Å; E127-R151 IonicContact OE2-CZ 2.79Å; E127-R151 IonicContact OE2-NH1 3.01Å; E127-R151 IonicContact OE2-NH2 3.61Å; E127-R151 PolarHBondContact OE2-NH2 3.34Å
128	D	90.2	Very high	93.4	Very high	67 Å²	67	35.1 Å²	35.1	36%	0.358	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.2	11.8	-167.6	68.5	-23.6	0	0	0	114.3	Y125 S130 R151	Y125-D128 WeakPolarHBondContact CB-OD1 3.45Å; D128-S130 PolarHBondContact O-N 3.25Å; D128-S130 VanDerWaalsContact O-N 3.17Å; D128-S130 WeakPolarHBondContact OD1-CB 3.47Å; D128-S130 PolarHBondContact OD1-N 3.41Å; D128-S130 PolarHBondContact OD1-OG 3.01Å; D128-S130 WeakPolarHBondContact OD2-CB 3.42Å; D128-S130 PolarHBondContact OD2-OG 3.02Å; D128-S130 VanDerWaalsContact OD2-OG 3.12Å; D128-R151 IonicContact OD1-CZ 3.03Å; D128-R151 IonicContact OD1-NE 3.21Å; D128-R151 IonicContact OD1-NH2 3.69Å; D128-R151 PolarHBondContact OD1-NH2 3.34Å; D128-R151 IonicContact OD2-CZ 3.98Å; D128-R151 IonicContact OD2-NE 3.69Å; D128-R151 IonicContact OD2-NH2 3.95Å; D128-R151 PolarHBondContact OD2-NH2 2.96Å
129	D	91.3	Very high	93	Very high	49 Å²	49	42.2 Å²	42.2	26%	0.262	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	29.6	-177	-58	-35.3	0	0	0	113.6	Y124 Y125	Y124-D129 VanDerWaalsContact OH-CB 3.31Å; Y124-D129 WeakPolarHBondContact OH-CB 3.27Å; Y124-D129 PolarHBondContact OH-OD1 3.34Å; Y125-D129 WeakPolarHBondContact O-CA 3.25Å; Y125-D129 PolarHBondContact O-N 3.01Å; Y125-D129 VanDerWaalsContact O-N 3.09Å
130	S	93.5	Very high	92.4	Very high	2 Å²	2	46 Å²	46	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	157.4	177.6	67.5	0	0	0	0	111.8	Y124 Y125 D128 R151	Y124-S130 WeakPolarHBondContact CA-O 3.42Å; Y125-S130 WeakPolarHBondContact CD2-O 3.47Å; Y125-S130 WeakPolarHBondContact CD2-OG 3.33Å; Y125-S130 PolarHBondContact N-O 2.9Å; D128-S130 PolarHBondContact O-N 3.25Å; D128-S130 VanDerWaalsContact O-N 3.17Å; D128-S130 WeakPolarHBondContact OD1-CB 3.47Å; D128-S130 PolarHBondContact OD1-N 3.41Å; D128-S130 PolarHBondContact OD1-OG 3.01Å; D128-S130 WeakPolarHBondContact OD2-CB 3.42Å; D128-S130 PolarHBondContact OD2-OG 3.02Å; D128-S130 VanDerWaalsContact OD2-OG 3.12Å; S130-R151 VanDerWaalsContact OG-CG 3.25Å; S130-R151 WeakPolarHBondContact OG-CG 3.37Å; S130-R151 PolarHBondContact OG-NE 3.26Å
131	M	94.4	Very high	91.7	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.5	178.9	-70.3	175.8	75.2	0	0	111.3	I122 Y123 Y124 R151 Q152 L154 Y163 L168 I176	I122-M131 HydrophobicContact CG2-CE 3.55Å; Y123-M131 CarbonylContact O-C 3.55Å; Y123-M131 WeakPolarHBondContact O-CA 3.45Å; Y124-M131 HydrophobicContact CD2-CE 4.45Å; Y124-M131 HydrophobicContact CD2-CG 3.3Å; Y124-M131 HydrophobicContact CD2-SD 3.73Å; Y124-M131 HydrophobicContact CE2-CG 3.89Å; Y124-M131 HydrophobicContact CE2-SD 4.09Å; Y124-M131 HydrophobicContact CG-CG 4.15Å; M131-R151 WeakPolarHBondContact O-CA 3.3Å; M131-Q152 PolarHBondContact N-O 2.73Å; M131-Q152 PolarHBondContact O-N 2.73Å; M131-Q152 VanDerWaalsContact O-N 3.09Å; M131-L154 HydrophobicContact CB-CD1 3.5Å; M131-L154 VanDerWaalsContact CB-CD1 3.5Å; M131-L154 HydrophobicContact CB-CG 3.93Å; M131-L154 HydrophobicContact CE-CD1 4.29Å; M131-L154 HydrophobicContact CG-CD1 4.33Å; M131-L154 HydrophobicContact SD-CB 4.44Å; M131-L154 HydrophobicContact SD-CD1 4Å; M131-Y163 WeakPolarHBondContact SD-CB 3.36Å; M131-Y163 HydrophobicContact SD-CD2 4.38Å; M131-Y163 HydrophobicContact SD-CG 4.06Å; M131-L168 HydrophobicContact CE-CD1 4.3Å; M131-L168 HydrophobicContact CE-CD2 4.19Å; M131-I176 HydrophobicContact CE-CD1 4.47Å
132	S	95.3	Very high	91.1	Very high	5 Å²	5	50.8 Å²	50.8	4%	0.035	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	143.2	169.1	63	0	0	0	0	110.5	Y123 Y125 I149	Y123-S132 PolarHBondContact N-O 3.43Å; Y123-S132 PolarHBondContact O-N 3.21Å; Y125-S132 WeakPolarHBondContact CE2-OG 3.45Å; Y125-S132 PolarHBondContact OH-OG 2.85Å; Y125-S132 VanDerWaalsContact OH-OG 3.13Å; S132-I149 WeakPolarHBondContact CA-O 3.23Å; S132-I149 WeakPolarHBondContact CB-O 3.22Å
133	V	96	Very high	90.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.9	178.3	-175	0	0	0	0	108.3	V120 N121 I122 L148 I149 I176 F181	V120-V133 HydrophobicContact CB-CG1 3.76Å; V120-V133 HydrophobicContact CG1-CG1 4.21Å; V120-V133 HydrophobicContact CG2-CG1 3.81Å; N121-V133 WeakPolarHBondContact O-CA 3.45Å; I122-V133 HydrophobicContact CG1-CG1 4.33Å; I122-V133 HydrophobicContact CG1-CG2 4.16Å; I122-V133 HydrophobicContact CG2-CG2 4.46Å; V133-L148 HydrophobicContact CG1-CB 4.45Å; V133-L148 HydrophobicContact CG1-CD2 4.24Å; V133-L148 PolarHBondContact O-N 3.14Å; V133-I149 HydrophobicContact CB-CB 3.95Å; V133-I149 HydrophobicContact CB-CD1 4.2Å; V133-I149 HydrophobicContact CB-CG1 4.1Å; V133-I149 HydrophobicContact CG2-CB 4.14Å; V133-I149 HydrophobicContact CG2-CD1 3.89Å; V133-I149 HydrophobicContact CG2-CG1 4.28Å; V133-I149 PolarHBondContact N-O 2.86Å; V133-I149 VanDerWaalsContact N-O 3.11Å; V133-I149 PolarHBondContact O-N 3.07Å; V133-I176 HydrophobicContact CG2-CD1 4.33Å; V133-F181 HydrophobicContact CG1-CE1 4.06Å; V133-F181 HydrophobicContact CG1-CZ 4.36Å
134	I	95.9	Very high	90.2	Very high	41 Å²	41	55.4 Å²	55.4	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.9	-174	-51.1	-176.4	0	0	0	108.9	N121 Y123 G146 K147	N121-I134 PolarHBondContact N-O 3.41Å; N121-I134 PolarHBondContact O-N 2.87Å; Y123-I134 HydrophobicContact CD2-CD1 3.86Å; Y123-I134 HydrophobicContact CD2-CG1 4.03Å; Y123-I134 HydrophobicContact CE2-CB 4.05Å; Y123-I134 HydrophobicContact CE2-CD1 3.71Å; Y123-I134 HydrophobicContact CE2-CG1 3.97Å; I134-G146 CarbonylContact C-O 3.5Å; I134-G146 WeakPolarHBondContact CA-O 3.24Å; I134-K147 HydrophobicContact CD1-CG 4.23Å; I134-K147 HydrophobicContact CG1-CG 4.2Å
135	E	94.1	Very high	90	Very high	11 Å²	11	57.9 Å²	57.9	5%	0.051	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-79.7	125.7	170	-176.8	169.4	-150.1	0	0	109.5	R118 Q119 V120 Q145 G146	R118-E135 IonicContact CZ-OE1 3.99Å; R118-E135 IonicContact CZ-OE2 3.2Å; R118-E135 IonicContact NE-OE1 3.47Å; R118-E135 PolarHBondContact NE-OE1 2.59Å; R118-E135 IonicContact NE-OE2 2.82Å; R118-E135 PolarHBondContact NE-OE2 3.17Å; R118-E135 IonicContact NH2-OE1 3.83Å; R118-E135 PolarHBondContact NH2-OE1 3.36Å; R118-E135 IonicContact NH2-OE2 2.67Å; R118-E135 PolarHBondContact NH2-OE2 3.28Å; Q119-E135 WeakPolarHBondContact O-CG 3.33Å; V120-E135 HydrophobicContact CG1-CB 4.21Å; E135-Q145 HydrophobicContact CG-CB 4.45Å; E135-Q145 HydrophobicContact CG-CG 4.2Å; E135-G146 PolarHBondContact N-O 2.86Å; E135-G146 WeakPolarHBondContact O-CA 3.34Å; E135-G146 PolarHBondContact O-N 3.12Å
136	P	92.7	Very high	89.9	Confident	44 Å²	44	56.6 Å²	56.6	29%	0.286	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-64.8	148.6	174.9	29.2	-32.8	0	0	0	110.5	Q119 V138	Q119-P136 VanDerWaalsContact O-CD 3.25Å; Q119-P136 WeakPolarHBondContact O-CD 3.46Å; P136-V138 PolarHBondContact O-N 2.78Å
137	V	90.1	Very high	89.9	Confident	124 Å²	124	64.3 Å²	64.3	75%	0.752	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-76.1	125.2	178.1	-179.5	0	0	0	0	109
138	V	87.3	Confident	89.9	Confident	71 Å²	71	63.8 Å²	63.8	43%	0.43	37%	0.369	S	S	.	.			trans	-120	122.2	178.1	-177.4	0	0	0	0	108.4	P136 S141 Q145	P136-V138 PolarHBondContact O-N 2.78Å; V138-S141 WeakPolarHBondContact O-CB 3.28Å; V138-S141 PolarHBondContact O-N 2.78Å; V138-Q145 PolarHBondContact O-OE1 2.58Å
139	E	82.1	Confident	90.1	Very high	175 Å²	175	61.3 Å²	61.3	82%	0.818	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	140.2	178.4	-65.2	-174.9	172	0	0	111.3	S141	E139-S141 PolarHBondContact O-N 2.83Å; E139-S141 VanDerWaalsContact O-N 3.15Å
140	N	80.1	Confident	90.2	Very high	157 Å²	157	66.9 Å²	66.9	84%	0.84	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	16.7	178.9	-52	-52.1	0	0	0	115.7	G142	N140-G142 VanDerWaalsContact C-N 3.33Å; N140-G142 PolarHBondContact O-N 3.31Å
141	S	80.6	Confident	90.2	Very high	47 Å²	47	72 Å²	72	33%	0.329	40%	0.396	S	S	.	.			trans	-68.3	-29.3	176.7	176.2	0	0	0	0	113.6	V138 E139 I143 Q145	V138-S141 WeakPolarHBondContact O-CB 3.28Å; V138-S141 PolarHBondContact O-N 2.78Å; E139-S141 PolarHBondContact O-N 2.83Å; E139-S141 VanDerWaalsContact O-N 3.15Å; S141-I143 PolarHBondContact O-N 3.34Å; S141-I143 VanDerWaalsContact O-N 3.13Å; S141-Q145 PolarHBondContact OG-NE2 3.3Å; S141-Q145 VanDerWaalsContact OG-NE2 3.13Å
142	G	82.4	Confident	90.2	Very high	85 Å²	85	75.6 Å²	75.6	88%	0.876	41%	0.413	S	S	*	.			trans	71.5	-1.2	177.9	0	0	0	0	0	115.7	N140	N140-G142 VanDerWaalsContact C-N 3.33Å; N140-G142 PolarHBondContact O-N 3.31Å
143	I	86.9	Confident	90	Very high	38 Å²	38	81.6 Å²	81.6	20%	0.195	44%	0.435	C	S	.	.	S	Bend	trans	-103.8	145.1	178.5	-57.5	169.3	0	0	0	108.8	R116 S141 Q145	R116-I143 VanDerWaalsContact NH1-CD1 3.33Å; S141-I143 PolarHBondContact O-N 3.34Å; S141-I143 VanDerWaalsContact O-N 3.13Å; I143-Q145 PolarHBondContact O-N 3.3Å; I143-Q145 VanDerWaalsContact O-N 3.13Å
144	P	87.1	Confident	89.8	Confident	119 Å²	119	81.7 Å²	81.7	77%	0.773	44%	0.436	S	S	*	.			trans	-63.3	113.8	169.3	25.8	-34.3	0	0	0	110.7
145	Q	91	Very high	89.5	Confident	52 Å²	52	82.4 Å²	82.4	24%	0.243	45%	0.447	C	S	.	.			trans	-105.6	166.8	-178.3	-70	170.3	-30.6	0	0	112	E135 V138 S141 I143	E135-Q145 HydrophobicContact CG-CB 4.45Å; E135-Q145 HydrophobicContact CG-CG 4.2Å; V138-Q145 PolarHBondContact O-OE1 2.58Å; S141-Q145 PolarHBondContact OG-NE2 3.3Å; S141-Q145 VanDerWaalsContact OG-NE2 3.13Å; I143-Q145 PolarHBondContact O-N 3.3Å; I143-Q145 VanDerWaalsContact O-N 3.13Å
146	G	92.1	Very high	89.2	Confident	21 Å²	21	85.6 Å²	85.6	22%	0.216	46%	0.461	C	S	.	.	S	Bend	trans	121.7	-137.9	177.2	0	0	0	0	0	112.9	I134 E135 L148	I134-G146 CarbonylContact C-O 3.5Å; I134-G146 WeakPolarHBondContact CA-O 3.24Å; E135-G146 PolarHBondContact N-O 2.86Å; E135-G146 WeakPolarHBondContact O-CA 3.34Å; E135-G146 PolarHBondContact O-N 3.12Å; G146-L148 PolarHBondContact O-N 3.26Å
147	K	92.5	Very high	88.9	Confident	170 Å²	170	87.1 Å²	87.1	74%	0.739	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	100.8	-175.2	-66.5	-179.7	-178.2	176.5	0	110.9	I134	I134-K147 HydrophobicContact CD1-CG 4.23Å; I134-K147 HydrophobicContact CG1-CG 4.2Å
148	L	91.9	Very high	88.5	Confident	60 Å²	60	90 Å²	90	31%	0.314	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-41.9	175.8	-170.1	69.8	0	0	0	111.2	F103 V120 V133 G146 F181	F103-L148 HydrophobicContact CE1-CD2 3.9Å; F103-L148 HydrophobicContact CZ-CD2 4.29Å; V120-L148 HydrophobicContact CG1-CD2 4.33Å; V133-L148 HydrophobicContact CG1-CB 4.45Å; V133-L148 HydrophobicContact CG1-CD2 4.24Å; V133-L148 PolarHBondContact O-N 3.14Å; G146-L148 PolarHBondContact O-N 3.26Å; L148-F181 HydrophobicContact CD2-CE1 3.99Å; L148-F181 HydrophobicContact CD2-CZ 3.94Å
149	I	93.9	Very high	88.2	Confident	16 Å²	16	97.4 Å²	97.4	8%	0.082	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	123.4	177	-57.4	-178.8	0	0	0	108.6	S132 V133 L154 I176 Y177	S132-I149 WeakPolarHBondContact CA-O 3.23Å; S132-I149 WeakPolarHBondContact CB-O 3.22Å; V133-I149 HydrophobicContact CB-CB 3.95Å; V133-I149 HydrophobicContact CB-CD1 4.2Å; V133-I149 HydrophobicContact CB-CG1 4.1Å; V133-I149 HydrophobicContact CG2-CB 4.14Å; V133-I149 HydrophobicContact CG2-CD1 3.89Å; V133-I149 HydrophobicContact CG2-CG1 4.28Å; V133-I149 PolarHBondContact N-O 2.86Å; V133-I149 VanDerWaalsContact N-O 3.11Å; V133-I149 PolarHBondContact O-N 3.07Å; I149-L154 HydrophobicContact CG2-CD2 3.96Å; I149-I176 HydrophobicContact CD1-CB 4.2Å; I149-I176 HydrophobicContact CD1-CG2 3.49Å; I149-I176 VanDerWaalsContact CD1-CG2 3.49Å; I149-Y177 HydrophobicContact CD1-CD2 4.04Å; I149-Y177 HydrophobicContact CG2-CE2 4.21Å
150	K	94.1	Very high	88.1	Confident	165 Å²	165	91.1 Å²	91.1	72%	0.717	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	155.6	177.4	-66.4	-178.4	-179.5	176.8	0	110.8	Q152	K150-Q152 PolarHBondContact O-N 3.16Å; K150-Q152 VanDerWaalsContact O-N 3.11Å
151	R	94.4	Very high	88.4	Confident	109 Å²	109	87.5 Å²	87.5	41%	0.411	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	113.1	178.1	-177.4	179	177.4	-177.4	1.2	110	Y125 E127 D128 S130 M131	Y125-R151 HydrophobicContact CD2-CG 3.88Å; Y125-R151 HydrophobicContact CE2-CB 4.31Å; Y125-R151 HydrophobicContact CE2-CG 3.76Å; E127-R151 IonicContact OE2-CZ 2.79Å; E127-R151 IonicContact OE2-NH1 3.01Å; E127-R151 IonicContact OE2-NH2 3.61Å; E127-R151 PolarHBondContact OE2-NH2 3.34Å; D128-R151 IonicContact OD1-CZ 3.03Å; D128-R151 IonicContact OD1-NE 3.21Å; D128-R151 IonicContact OD1-NH2 3.69Å; D128-R151 PolarHBondContact OD1-NH2 3.34Å; D128-R151 IonicContact OD2-CZ 3.98Å; D128-R151 IonicContact OD2-NE 3.69Å; D128-R151 IonicContact OD2-NH2 3.95Å; D128-R151 PolarHBondContact OD2-NH2 2.96Å; S130-R151 VanDerWaalsContact OG-CG 3.25Å; S130-R151 WeakPolarHBondContact OG-CG 3.37Å; S130-R151 PolarHBondContact OG-NE 3.26Å; M131-R151 WeakPolarHBondContact O-CA 3.3Å
152	Q	93.5	Very high	88.9	Confident	77 Å²	77	89.1 Å²	89.1	36%	0.36	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	163.3	176	65.8	-167.9	-15.9	0	0	109.9	M131 K150 L154 Y177	M131-Q152 PolarHBondContact N-O 2.73Å; M131-Q152 PolarHBondContact O-N 2.73Å; M131-Q152 VanDerWaalsContact O-N 3.09Å; K150-Q152 PolarHBondContact O-N 3.16Å; K150-Q152 VanDerWaalsContact O-N 3.11Å; Q152-L154 HydrophobicContact CG-CD2 3.76Å; Q152-L154 PolarHBondContact O-N 3.35Å; Q152-Y177 PolarHBondContact NE2-OH 2.7Å
153	R	92.1	Very high	89.3	Confident	132 Å²	132	85.9 Å²	85.9	50%	0.498	43%	0.425	S	S	.	.			trans	-76.2	115.7	173.2	-60.8	-178.9	70.9	-171.8	4.9	108.7
154	L	91.7	Very high	89.6	Confident	2 Å²	2	87 Å²	87	1%	0.01	43%	0.429	C	S	.	.			trans	-87.8	129.2	-175.9	-64.4	176.8	0	0	0	110.4	M131 I149 Q152 H162 Y163 I176 Y177	M131-L154 HydrophobicContact CB-CD1 3.5Å; M131-L154 VanDerWaalsContact CB-CD1 3.5Å; M131-L154 HydrophobicContact CB-CG 3.93Å; M131-L154 HydrophobicContact CE-CD1 4.29Å; M131-L154 HydrophobicContact CG-CD1 4.33Å; M131-L154 HydrophobicContact SD-CB 4.44Å; M131-L154 HydrophobicContact SD-CD1 4Å; I149-L154 HydrophobicContact CG2-CD2 3.96Å; Q152-L154 HydrophobicContact CG-CD2 3.76Å; Q152-L154 PolarHBondContact O-N 3.35Å; L154-H162 CarbonylContact O-C 3.48Å; L154-H162 VanDerWaalsContact O-CA 3.28Å; L154-H162 WeakPolarHBondContact O-CA 3.46Å; L154-Y163 HydrophobicContact CB-CD2 3.91Å; L154-Y163 PolarHBondContact O-N 3.11Å; L154-I176 HydrophobicContact CD1-CD1 3.66Å; L154-I176 HydrophobicContact CD1-CG1 4.04Å; L154-I176 HydrophobicContact CD1-CG2 3.77Å; L154-I176 HydrophobicContact CD2-CG2 3.92Å; L154-I176 HydrophobicContact CG-CG2 4.35Å; L154-Y177 HydrophobicContact CD2-CE2 3.85Å
155	A	89.6	Confident	89.7	Confident	55 Å²	55	82.6 Å²	82.6	46%	0.455	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-73.6	132.5	172.8	0	0	0	0	0	110.3	D161	A155-D161 CarbonylContact C-O 3.49Å; A155-D161 WeakPolarHBondContact CA-O 3.4Å
156	K	87.1	Confident	89.8	Confident	78 Å²	78	86.7 Å²	86.7	34%	0.339	41%	0.414	S	S	.	.	S	Bend	trans	-85.2	-38.7	176.8	-178.1	178.9	-177	-177.9	0	111.9	D161 Y163 D167	K156-D161 PolarHBondContact N-O 3.13Å; K156-Y163 HydrophobicContact CB-CD1 4.26Å; K156-Y163 HydrophobicContact CB-CD2 4.1Å; K156-Y163 HydrophobicContact CB-CE1 4.14Å; K156-Y163 HydrophobicContact CB-CE2 4Å; K156-Y163 HydrophobicContact CB-CG 4.23Å; K156-Y163 HydrophobicContact CD-CD1 4.29Å; K156-Y163 HydrophobicContact CD-CE1 4.19Å; K156-Y163 HydrophobicContact CG-CD1 4.17Å; K156-Y163 HydrophobicContact CG-CE1 3.75Å; K156-Y163 HydrophobicContact CG-CE2 4.39Å; K156-D167 IonicContact NZ-OD1 3.96Å; K156-D167 PolarHBondContact NZ-OD1 3.19Å; K156-D167 IonicContact NZ-OD2 3.06Å; K156-D167 PolarHBondContact NZ-OD2 3.14Å; K156-D167 VanDerWaalsContact NZ-OD2 3.16Å
157	N	85.8	Confident	89.6	Confident	77 Å²	77	88.2 Å²	88.2	41%	0.412	42%	0.417	S	S	.	.	S	Bend	trans	-134.5	161	-176.2	-59.3	-37.3	0	0	0	110.9	R159 G160 D161	N157-R159 PolarHBondContact O-N 3.16Å; N157-G160 PolarHBondContact O-N 2.83Å; N157-D161 PolarHBondContact ND2-OD2 2.83Å
158	D	81.8	Confident	89.6	Confident	184 Å²	184	80.1 Å²	80.1	98%	0.984	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-10.8	173.8	-60	-29.8	0	0	0	113.9	G160	D158-G160 VanDerWaalsContact C-N 3.29Å
159	R	81.6	Confident	89.6	Confident	226 Å²	226	78.3 Å²	78.3	85%	0.853	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-5.7	175.4	-62.8	-176.6	-178.2	177.7	0.6	113.9	N157	N157-R159 PolarHBondContact O-N 3.16Å
160	G	80.3	Confident	89.5	Confident	43 Å²	43	78.5 Å²	78.5	44%	0.443	37%	0.373	S	S	.	.			trans	85.3	10	-179.6	0	0	0	0	0	115	N157 D158 H162	N157-G160 PolarHBondContact O-N 2.83Å; D158-G160 VanDerWaalsContact C-N 3.29Å; G160-H162 PolarHBondContact O-CE1 3.09Å; G160-H162 VanDerWaalsContact O-CE1 3.3Å; G160-H162 PolarHBondContact O-ND1 3.33Å
161	D	87.1	Confident	89.4	Confident	82 Å²	82	71.4 Å²	71.4	44%	0.439	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-65	138.7	169.8	-60.4	-40.9	0	0	0	109.6	A155 K156 N157	A155-D161 CarbonylContact C-O 3.49Å; A155-D161 WeakPolarHBondContact CA-O 3.4Å; K156-D161 PolarHBondContact N-O 3.13Å; N157-D161 PolarHBondContact ND2-OD2 2.83Å
162	H	90.6	Very high	89.3	Confident	81 Å²	81	69.3 Å²	69.3	38%	0.375	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-99.9	153.8	179.6	-59.2	84.1	0	0	0	111.1	L154 G160 H164	L154-H162 CarbonylContact O-C 3.48Å; L154-H162 VanDerWaalsContact O-CA 3.28Å; L154-H162 WeakPolarHBondContact O-CA 3.46Å; G160-H162 PolarHBondContact O-CE1 3.09Å; G160-H162 VanDerWaalsContact O-CE1 3.3Å; G160-H162 PolarHBondContact O-ND1 3.33Å; H162-H164 PolarHBondContact O-N 2.84Å
163	Y	91.3	Very high	89.3	Confident	16 Å²	16	69.9 Å²	69.9	6%	0.063	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-62	127.9	170.4	-80.6	-74.9	0	0	0	110.9	Y124 M131 L154 K156 D167 I174 T175 I176	Y124-Y163 WeakPolarHBondContact CE2-O 3.41Å; Y124-Y163 PolarHBondContact OH-O 3.44Å; M131-Y163 WeakPolarHBondContact SD-CB 3.36Å; M131-Y163 HydrophobicContact SD-CD2 4.38Å; M131-Y163 HydrophobicContact SD-CG 4.06Å; L154-Y163 HydrophobicContact CB-CD2 3.91Å; L154-Y163 PolarHBondContact O-N 3.11Å; K156-Y163 HydrophobicContact CB-CD1 4.26Å; K156-Y163 HydrophobicContact CB-CD2 4.1Å; K156-Y163 HydrophobicContact CB-CE1 4.14Å; K156-Y163 HydrophobicContact CB-CE2 4Å; K156-Y163 HydrophobicContact CB-CG 4.23Å; K156-Y163 HydrophobicContact CD-CD1 4.29Å; K156-Y163 HydrophobicContact CD-CE1 4.19Å; K156-Y163 HydrophobicContact CG-CD1 4.17Å; K156-Y163 HydrophobicContact CG-CE1 3.75Å; K156-Y163 HydrophobicContact CG-CE2 4.39Å; Y163-D167 HydrophobicContact CD1-CB 4.35Å; Y163-I174 HydrophobicContact CD1-CG2 4.35Å; Y163-I174 HydrophobicContact CE1-CG2 3.64Å; Y163-I174 HydrophobicContact CE2-CG2 4.14Å; Y163-T175 PolarHBondContact OH-N 2.79Å; Y163-T175 PolarHBondContact OH-O 2.82Å; Y163-I176 HydrophobicContact CE2-CG1 4.06Å
164	H	91.6	Very high	89.3	Confident	61 Å²	61	63.8 Å²	63.8	28%	0.282	33%	0.325	S	S	.	.			trans	-106.6	152.6	171.7	-166	-96.9	0	0	0	109.5	Y124 H162 K166 D167	Y124-H164 WeakPolarHBondContact OH-CA 3.45Å; H162-H164 PolarHBondContact O-N 2.84Å; H164-K166 WeakPolarHBondContact ND1-CB 3.19Å; H164-K166 VanDerWaalsContact ND1-CG 3.31Å; H164-K166 WeakPolarHBondContact ND1-CG 3.44Å; H164-K166 PolarHBondContact ND1-N 3.2Å; H164-K166 PolarHBondContact O-N 2.71Å; H164-D167 PolarHBondContact N-OD2 2.86Å; H164-D167 WeakPolarHBondContact O-CB 3.45Å; H164-D167 PolarHBondContact O-N 2.8Å
165	W	90.8	Very high	89.3	Confident	28 Å²	28	67.4 Å²	67.4	11%	0.106	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-57.9	-22.3	177.5	56.9	-95.3	0	0	0	113.4	L97 Y124 L126 D167 L168 F193 L194 Q197 I199	L97-W165 HydrophobicContact CD1-CB 3.66Å; L97-W165 HydrophobicContact CD1-CG 4.47Å; Y124-W165 HydrophobicContact CD1-CB 4.01Å; Y124-W165 HydrophobicContact CE1-CB 3.75Å; Y124-W165 AromaticContact CE1-CD1 3.91Å; Y124-W165 HydrophobicContact CE1-CG 4.27Å; Y124-W165 PolarHBondContact OH-N 2.98Å; L126-W165 HydrophobicContact CD2-CB 4.4Å; L126-W165 HydrophobicContact CD2-CG 4.09Å; W165-D167 PolarHBondContact O-N 3.05Å; W165-L168 PolarHBondContact O-N 2.98Å; W165-F193 HydrophobicContact CD2-CE1 4.23Å; W165-F193 HydrophobicContact CE3-CE1 4.23Å; W165-L194 HydrophobicContact CE3-CD2 3.75Å; W165-L194 HydrophobicContact CZ3-CD2 4.26Å; W165-Q197 HydrophobicContact CH2-CB 3.66Å; W165-Q197 HydrophobicContact CH2-CG 3.87Å; W165-Q197 HydrophobicContact CZ3-CB 3.76Å; W165-Q197 HydrophobicContact CZ3-CG 4.13Å; W165-I199 HydrophobicContact CE3-CD1 3.8Å; W165-I199 HydrophobicContact CZ3-CD1 3.43Å; W165-I199 VanDerWaalsContact CZ3-CD1 3.43Å; W165-I199 HydrophobicContact CZ3-CG1 4.25Å
166	K	91.3	Very high	89.4	Confident	137 Å²	137	65 Å²	65	60%	0.596	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-67.2	-22.3	173.5	-68.8	176.4	179.4	-178.7	0	113.7	H164 L168 I199	H164-K166 WeakPolarHBondContact ND1-CB 3.19Å; H164-K166 VanDerWaalsContact ND1-CG 3.31Å; H164-K166 WeakPolarHBondContact ND1-CG 3.44Å; H164-K166 PolarHBondContact ND1-N 3.2Å; H164-K166 PolarHBondContact O-N 2.71Å; K166-L168 VanDerWaalsContact C-N 3.29Å; K166-I199 HydrophobicContact CB-CD1 4.36Å; K166-I199 HydrophobicContact CG-CD1 4.17Å
167	D	89.6	Confident	89.5	Confident	53 Å²	53	69 Å²	69	28%	0.283	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-84.7	-5.9	177.2	-63.5	-48	0	0	0	112.6	K156 Y163 H164 W165	K156-D167 IonicContact NZ-OD1 3.96Å; K156-D167 PolarHBondContact NZ-OD1 3.19Å; K156-D167 IonicContact NZ-OD2 3.06Å; K156-D167 PolarHBondContact NZ-OD2 3.14Å; K156-D167 VanDerWaalsContact NZ-OD2 3.16Å; Y163-D167 HydrophobicContact CD1-CB 4.35Å; H164-D167 PolarHBondContact N-OD2 2.86Å; H164-D167 WeakPolarHBondContact O-CB 3.45Å; H164-D167 PolarHBondContact O-N 2.8Å; W165-D167 PolarHBondContact O-N 3.05Å
168	L	91.2	Very high	89.5	Confident	1 Å²	1	69 Å²	69	1%	0.005	36%	0.359	C	S	.	.			trans	-103.8	119.2	-174.5	-53.3	178.1	0	0	0	109.6	F99 Y124 M131 W165 K166 I174	F99-L168 HydrophobicContact CD2-CD1 4.24Å; F99-L168 HydrophobicContact CE1-CB 4.23Å; F99-L168 HydrophobicContact CE2-CB 3.95Å; F99-L168 HydrophobicContact CE2-CD1 3.6Å; F99-L168 HydrophobicContact CE2-CG 4.41Å; F99-L168 HydrophobicContact CZ-CB 3.66Å; F99-L168 HydrophobicContact CZ-CD1 4.17Å; Y124-L168 HydrophobicContact CD2-CD1 3.7Å; Y124-L168 HydrophobicContact CE2-CD1 4.47Å; Y124-L168 HydrophobicContact CG-CD1 4.11Å; M131-L168 HydrophobicContact CE-CD1 4.3Å; M131-L168 HydrophobicContact CE-CD2 4.19Å; W165-L168 PolarHBondContact O-N 2.98Å; K166-L168 VanDerWaalsContact C-N 3.29Å; L168-I174 HydrophobicContact CD2-CD1 3.27Å; L168-I174 HydrophobicContact CD2-CG1 4.32Å
169	N	92.1	Very high	90	Very high	21 Å²	21	63.7 Å²	63.7	11%	0.112	33%	0.328	C	S	.	.			trans	-145.6	164.6	171.5	-158.5	-20.7	0	0	0	109	I172 E200 L201 N202	N169-I172 HydrophobicContact CB-CD1 3.53Å; N169-I172 HydrophobicContact CB-CG1 4.14Å; N169-E200 PolarHBondContact ND2-O 3.28Å; N169-L201 WeakPolarHBondContact OD1-CA 3.45Å; N169-L201 VanDerWaalsContact OD1-CD2 3.23Å; N169-L201 WeakPolarHBondContact OD1-CD2 3.33Å; N169-N202 PolarHBondContact OD1-N 3.2Å; N169-N202 VanDerWaalsContact OD1-N 3.16Å
170	R	93.1	Very high	90.6	Very high	21 Å²	21	56.4 Å²	56.4	8%	0.079	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	144	174.8	-61.5	159.4	75	-177.9	36.4	110	I172 D185 L201 N202 P204	R170-I172 VanDerWaalsContact C-N 3.28Å; R170-I172 PolarHBondContact O-N 3.44Å; R170-D185 IonicContact CZ-OD1 2.85Å; R170-D185 IonicContact NE-OD1 2.91Å; R170-D185 PolarHBondContact NE-OD1 2.82Å; R170-D185 IonicContact NH2-OD1 3.35Å; R170-D185 PolarHBondContact NH2-OD1 2.78Å; R170-L201 HydrophobicContact CG-CD2 4.36Å; R170-N202 HydrophobicContact CB-CB 4.13Å; R170-N202 VanDerWaalsContact CD-O 3.24Å; R170-N202 WeakPolarHBondContact CD-O 3.21Å; R170-N202 VanDerWaalsContact CZ-O 3.28Å; R170-N202 PolarHBondContact NE-O 3.28Å; R170-N202 PolarHBondContact NH1-O 3.01Å; R170-N202 VanDerWaalsContact O-CB 3.3Å; R170-N202 WeakPolarHBondContact O-CB 3.27Å; R170-N202 PolarHBondContact O-ND2 3.26Å; R170-P204 VanDerWaalsContact CZ-CA 3.41Å
171	G	90.4	Very high	91.3	Very high	16 Å²	16	54.4 Å²	54.4	17%	0.165	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	15.6	-178.1	0	0	0	0	0	115	R182 V183 E205	G171-R182 VanDerWaalsContact C-CZ 3.45Å; G171-R182 PolarHBondContact O-NH1 2.98Å; G171-R182 PolarHBondContact O-NH2 2.99Å; G171-V183 WeakPolarHBondContact CA-O 3.09Å; G171-V183 PolarHBondContact N-O 2.84Å; G171-E205 WeakPolarHBondContact CA-OE1 3.5Å
172	I	92.6	Very high	91.7	Very high	64 Å²	64	53.4 Å²	53.4	33%	0.328	28%	0.278	S	S	.	.			trans	-100.8	146.4	174.8	-62.8	-174.1	0	0	0	110.5	N169 R170 V183	N169-I172 HydrophobicContact CB-CD1 3.53Å; N169-I172 HydrophobicContact CB-CG1 4.14Å; R170-I172 VanDerWaalsContact C-N 3.28Å; R170-I172 PolarHBondContact O-N 3.44Å; I172-V183 PolarHBondContact O-N 3.44Å
173	N	93.9	Very high	91.9	Very high	90 Å²	90	49.6 Å²	49.6	48%	0.481	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.9	172.3	-67	-11.7	0	0	0	110.1	T180 F181 R182	N173-T180 HydrophobicContact CB-CG2 3.82Å; N173-F181 CarbonylContact C-O 3.5Å; N173-F181 WeakPolarHBondContact CA-O 3.49Å; N173-R182 WeakPolarHBondContact OD1-CD 3.18Å; N173-R182 PolarHBondContact OD1-NH1 2.77Å
174	I	92.6	Very high	92.1	Very high	3 Å²	3	49 Å²	49	2%	0.015	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.4	-179.9	-54.9	173.5	0	0	0	108.8	I122 Y163 L168 I176 T180 F181 V183	I122-I174 HydrophobicContact CD1-CD1 4.36Å; Y163-I174 HydrophobicContact CD1-CG2 4.35Å; Y163-I174 HydrophobicContact CE1-CG2 3.64Å; Y163-I174 HydrophobicContact CE2-CG2 4.14Å; L168-I174 HydrophobicContact CD2-CD1 3.27Å; L168-I174 HydrophobicContact CD2-CG1 4.32Å; I174-I176 HydrophobicContact CG2-CD1 3.84Å; I174-I176 HydrophobicContact CG2-CG1 3.84Å; I174-T180 WeakPolarHBondContact O-CA 3.38Å; I174-F181 PolarHBondContact N-O 3.29Å; I174-F181 PolarHBondContact O-N 2.81Å; I174-V183 HydrophobicContact CD1-CG2 3.42Å; I174-V183 VanDerWaalsContact CD1-CG2 3.42Å; I174-V183 HydrophobicContact CG1-CG2 4.09Å
175	T	91.8	Very high	92.3	Very high	78 Å²	78	48.5 Å²	48.5	48%	0.479	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	110.7	-179.8	-0.5	0	0	0	0	110.8	Y163 K179 T180	Y163-T175 PolarHBondContact OH-N 2.79Å; Y163-T175 PolarHBondContact OH-O 2.82Å; T175-K179 CarbonylContact C-O 3.31Å; T175-K179 WeakPolarHBondContact CA-O 3.48Å; T175-T180 HydrophobicContact CG2-CG2 4.47Å; T175-T180 VanDerWaalsContact CG2-OG1 3.3Å; T175-T180 WeakPolarHBondContact CG2-OG1 3.46Å
176	I	90.9	Very high	92.4	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	125	178.5	-56.3	158.3	0	0	0	108.3	M131 V133 I149 L154 Y163 I174 G178 K179 F181	M131-I176 HydrophobicContact CE-CD1 4.47Å; V133-I176 HydrophobicContact CG2-CD1 4.33Å; I149-I176 HydrophobicContact CD1-CB 4.2Å; I149-I176 HydrophobicContact CD1-CG2 3.49Å; I149-I176 VanDerWaalsContact CD1-CG2 3.49Å; L154-I176 HydrophobicContact CD1-CD1 3.66Å; L154-I176 HydrophobicContact CD1-CG1 4.04Å; L154-I176 HydrophobicContact CD1-CG2 3.77Å; L154-I176 HydrophobicContact CD2-CG2 3.92Å; L154-I176 HydrophobicContact CG-CG2 4.35Å; Y163-I176 HydrophobicContact CE2-CG1 4.06Å; I174-I176 HydrophobicContact CG2-CD1 3.84Å; I174-I176 HydrophobicContact CG2-CG1 3.84Å; I176-G178 PolarHBondContact O-N 2.95Å; I176-K179 PolarHBondContact N-O 3.38Å; I176-K179 PolarHBondContact O-N 2.85Å; I176-F181 HydrophobicContact CB-CD2 4.4Å; I176-F181 HydrophobicContact CB-CE2 4.04Å; I176-F181 HydrophobicContact CD1-CD2 4.15Å; I176-F181 HydrophobicContact CD1-CE2 4.31Å
177	Y	89.4	Confident	92.5	Very high	162 Å²	162	44.5 Å²	44.5	64%	0.635	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	43.5	-180	-60.5	-51.2	0	0	0	114.1	I149 Q152 L154 K179	I149-Y177 HydrophobicContact CD1-CD2 4.04Å; I149-Y177 HydrophobicContact CG2-CE2 4.21Å; Q152-Y177 PolarHBondContact NE2-OH 2.7Å; L154-Y177 HydrophobicContact CD2-CE2 3.85Å; Y177-K179 PolarHBondContact O-N 3.11Å
178	G	86.8	Confident	92.8	Very high	78 Å²	78	48 Å²	48	80%	0.804	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	1.8	178.5	0	0	0	0	0	115.3	I176	I176-G178 PolarHBondContact O-N 2.95Å
179	K	90.6	Very high	92.9	Very high	72 Å²	72	51.9 Å²	51.9	31%	0.313	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134.8	172.2	-66.9	-170.2	174	-163	0	110.8	F103 E105 T175 I176 Y177 F181	F103-K179 HydrophobicContact CD2-CD 4.23Å; F103-K179 HydrophobicContact CE2-CD 3.91Å; F103-K179 HydrophobicContact CZ-CD 4.32Å; E105-K179 IonicContact OE1-NZ 2.71Å; T175-K179 CarbonylContact C-O 3.31Å; T175-K179 WeakPolarHBondContact CA-O 3.48Å; I176-K179 PolarHBondContact N-O 3.38Å; I176-K179 PolarHBondContact O-N 2.85Å; Y177-K179 PolarHBondContact O-N 3.11Å; K179-F181 HydrophobicContact CB-CE2 3.85Å; K179-F181 HydrophobicContact CB-CZ 4.03Å
180	T	94	Very high	93	Very high	74 Å²	74	50.9 Å²	50.9	45%	0.454	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115	178.9	-50.4	0	0	0	0	110.3	F103 N173 I174 T175	F103-T180 VanDerWaalsContact CB-O 3.27Å; F103-T180 WeakPolarHBondContact CB-O 3.5Å; N173-T180 HydrophobicContact CB-CG2 3.82Å; I174-T180 WeakPolarHBondContact O-CA 3.38Å; T175-T180 HydrophobicContact CG2-CG2 4.47Å; T175-T180 VanDerWaalsContact CG2-OG1 3.3Å; T175-T180 WeakPolarHBondContact CG2-OG1 3.46Å
181	F	95.1	Very high	92.9	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.9	177.8	-60	-87.2	0	0	0	110.2	Y102 F103 V120 I122 V133 L148 N173 I174 I176 K179	Y102-F181 CarbonylContact O-C 3.58Å; Y102-F181 WeakPolarHBondContact O-CA 3.39Å; F103-F181 HydrophobicContact CB-CD1 3.94Å; F103-F181 HydrophobicContact CB-CE1 4.23Å; F103-F181 AromaticContact CD1-CD1 3.75Å; F103-F181 HydrophobicContact CD1-CD1 3.75Å; F103-F181 AromaticContact CD1-CE1 3.36Å; F103-F181 HydrophobicContact CD1-CE1 3.36Å; F103-F181 HydrophobicContact CD1-CZ 4.32Å; F103-F181 AromaticContact CE1-CE1 3.92Å; F103-F181 HydrophobicContact CE1-CE1 3.92Å; F103-F181 HydrophobicContact CG-CD1 4.15Å; F103-F181 AromaticContact CG-CE1 3.95Å; F103-F181 HydrophobicContact CG-CE1 3.95Å; V120-F181 HydrophobicContact CG1-CE1 4.44Å; V120-F181 HydrophobicContact CG2-CD1 3.55Å; V120-F181 HydrophobicContact CG2-CE1 3.82Å; I122-F181 HydrophobicContact CD1-CB 4.19Å; V133-F181 HydrophobicContact CG1-CE1 4.06Å; V133-F181 HydrophobicContact CG1-CZ 4.36Å; L148-F181 HydrophobicContact CD2-CE1 3.99Å; L148-F181 HydrophobicContact CD2-CZ 3.94Å; N173-F181 CarbonylContact C-O 3.5Å; N173-F181 WeakPolarHBondContact CA-O 3.49Å; I174-F181 PolarHBondContact N-O 3.29Å; I174-F181 PolarHBondContact O-N 2.81Å; I176-F181 HydrophobicContact CB-CD2 4.4Å; I176-F181 HydrophobicContact CB-CE2 4.04Å; I176-F181 HydrophobicContact CD1-CD2 4.15Å; I176-F181 HydrophobicContact CD1-CE2 4.31Å; K179-F181 HydrophobicContact CB-CE2 3.85Å; K179-F181 HydrophobicContact CB-CZ 4.03Å
182	R	95.6	Very high	93.1	Very high	61 Å²	61	55.4 Å²	55.4	23%	0.23	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	115.8	170.5	-178.2	69.3	175.8	178.7	1.8	108.8	A101 Y102 G171 N173 V184 E205	A101-R182 CarbonylContact C-O 3.49Å; A101-R182 WeakPolarHBondContact CA-O 3.31Å; A101-R182 WeakPolarHBondContact CB-O 3.41Å; Y102-R182 HydrophobicContact CD1-CB 4.22Å; Y102-R182 HydrophobicContact CE1-CB 3.83Å; Y102-R182 HydrophobicContact CE1-CG 3.76Å; Y102-R182 HydrophobicContact CE2-CB 4.25Å; Y102-R182 PolarHBondContact N-O 2.82Å; Y102-R182 PolarHBondContact O-N 2.88Å; G171-R182 VanDerWaalsContact C-CZ 3.45Å; G171-R182 PolarHBondContact O-NH1 2.98Å; G171-R182 PolarHBondContact O-NH2 2.99Å; N173-R182 WeakPolarHBondContact OD1-CD 3.18Å; N173-R182 PolarHBondContact OD1-NH1 2.77Å; R182-V184 HydrophobicContact CG-CG2 4.32Å; R182-E205 IonicContact CZ-OE1 3.74Å; R182-E205 IonicContact CZ-OE2 2.7Å; R182-E205 IonicContact NE-OE1 3.87Å; R182-E205 IonicContact NE-OE2 2.81Å; R182-E205 PolarHBondContact NE-OE2 3.15Å; R182-E205 IonicContact NH2-OE1 2.67Å; R182-E205 PolarHBondContact NH2-OE1 3.05Å; R182-E205 IonicContact NH2-OE2 3.14Å; R182-E205 PolarHBondContact NH2-OE2 3.47Å
183	V	95.6	Very high	93.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	120.9	172.5	-179.2	0	0	0	0	108.9	F99 I122 G171 I172 I174	F99-V183 HydrophobicContact CB-CG1 3.97Å; F99-V183 HydrophobicContact CD1-CG1 3.85Å; F99-V183 HydrophobicContact CG-CG1 4.26Å; I122-V183 HydrophobicContact CD1-CG2 4.34Å; G171-V183 WeakPolarHBondContact CA-O 3.09Å; G171-V183 PolarHBondContact N-O 2.84Å; I172-V183 PolarHBondContact O-N 3.44Å; I174-V183 HydrophobicContact CD1-CG2 3.42Å; I174-V183 VanDerWaalsContact CD1-CG2 3.42Å; I174-V183 HydrophobicContact CG1-CG2 4.09Å
184	V	94.5	Very high	93	Very high	3 Å²	3	49 Å²	49	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-49.9	-172.8	174.5	0	0	0	0	110.7	D100 Y102 R182 E205 M207	D100-V184 PolarHBondContact O-N 2.87Å; Y102-V184 HydrophobicContact CD1-CG2 3.41Å; Y102-V184 VanDerWaalsContact CD1-CG2 3.41Å; Y102-V184 HydrophobicContact CE1-CG2 3.41Å; Y102-V184 VanDerWaalsContact CE1-CG2 3.41Å; R182-V184 HydrophobicContact CG-CG2 4.32Å; V184-E205 HydrophobicContact CB-CB 4.47Å; V184-E205 VanDerWaalsContact CG1-C 3.42Å; V184-E205 HydrophobicContact CG1-CB 3.87Å; V184-E205 WeakPolarHBondContact CG1-O 3Å; V184-E205 PolarHBondContact O-N 2.86Å; V184-E205 VanDerWaalsContact O-N 3.14Å; V184-M207 HydrophobicContact CB-CE 4.37Å; V184-M207 HydrophobicContact CG2-SD 4.21Å
185	D	95.8	Very high	93	Very high	52 Å²	52	53.5 Å²	53.5	28%	0.278	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	172	-176.9	-152.5	9.3	0	0	0	111.8	F99 D100 R170	F99-D185 CarbonylContact C-O 3.55Å; F99-D185 WeakPolarHBondContact CA-O 3.36Å; D100-D185 HydrophobicContact CB-CB 4.46Å; D100-D185 PolarHBondContact N-O 2.82Å; D100-D185 PolarHBondContact O-N 3.03Å; R170-D185 IonicContact CZ-OD1 2.85Å; R170-D185 IonicContact NE-OD1 2.91Å; R170-D185 PolarHBondContact NE-OD1 2.82Å; R170-D185 IonicContact NH2-OD1 3.35Å; R170-D185 PolarHBondContact NH2-OD1 2.78Å
186	C	93.5	Very high	92.9	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.061	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	155.9	177.4	70.7	0	0	0	0	111.3	F99 T190	F99-C186 HydrophobicContact CD1-CB 3.61Å; F99-C186 HydrophobicContact CE1-CB 3.94Å; F99-C186 HydrophobicContact CG-CB 4.45Å; C186-T190 VanDerWaalsContact CB-OG1 3.22Å; C186-T190 WeakPolarHBondContact CB-OG1 3.43Å
187	D	94.3	Very high	92.8	Very high	72 Å²	72	58.1 Å²	58.1	39%	0.385	31%	0.306	S	S	.	.			trans	-63.4	160.4	176.7	-172.4	31.2	0	0	0	112.9	K98 F189 T190 Q191	K98-D187 HydrophobicContact CB-CB 4.03Å; K98-D187 HydrophobicContact CD-CB 4.35Å; K98-D187 PolarHBondContact O-N 2.78Å; D187-F189 VanDerWaalsContact C-N 3.26Å; D187-F189 PolarHBondContact O-N 2.67Å; D187-T190 VanDerWaalsContact C-OG1 3.28Å; D187-T190 WeakPolarHBondContact CA-OG1 3.25Å; D187-T190 PolarHBondContact N-OG1 3.31Å; D187-T190 PolarHBondContact O-N 2.85Å; D187-T190 VanDerWaalsContact O-N 3.14Å; D187-T190 PolarHBondContact O-OG1 2.96Å; D187-Q191 PolarHBondContact O-N 2.92Å
188	Q	94.2	Very high	92.7	Very high	126 Å²	126	53.6 Å²	53.6	59%	0.589	31%	0.309	S	S	*	.	H	α-helix	trans	-60	-38.2	180	-171.8	68.7	51	0	0	111.7	Q191 V192	Q188-Q191 PolarHBondContact O-N 3.27Å; Q188-V192 WeakPolarHBondContact O-CG2 3.47Å; Q188-V192 PolarHBondContact O-N 2.84Å
189	F	93.8	Very high	92.8	Very high	82 Å²	82	51.5 Å²	51.5	36%	0.36	28%	0.279	S	S	.	.	H	α-helix	trans	-64.1	-44.1	176.8	171.3	-107.7	0	0	0	111.7	K95 V96 L97 D187 Q191 V192 F193	K95-F189 HydrophobicContact CB-CE1 4.4Å; K95-F189 HydrophobicContact CB-CZ 4.03Å; K95-F189 HydrophobicContact CD-CZ 4.41Å; K95-F189 HydrophobicContact CG-CZ 4.16Å; V96-F189 WeakPolarHBondContact O-CD1 3.3Å; V96-F189 WeakPolarHBondContact O-CE1 3.35Å; L97-F189 HydrophobicContact CD2-CD1 4.45Å; L97-F189 HydrophobicContact CD2-CE1 4.04Å; D187-F189 VanDerWaalsContact C-N 3.26Å; D187-F189 PolarHBondContact O-N 2.67Å; F189-Q191 VanDerWaalsContact C-N 3.29Å; F189-Q191 PolarHBondContact O-N 2.79Å; F189-V192 PolarHBondContact O-N 3.01Å; F189-F193 WeakPolarHBondContact O-CB 3.46Å; F189-F193 PolarHBondContact O-N 3.31Å
190	T	93.8	Very high	92.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.2	-38.7	177.4	38.7	0	0	0	0	112.9	L97 K98 C186 D187 F193 L194	L97-T190 HydrophobicContact CB-CG2 3.37Å; L97-T190 HydrophobicContact CD2-CG2 3.7Å; L97-T190 HydrophobicContact CG-CG2 4.11Å; K98-T190 WeakPolarHBondContact O-CG2 3.43Å; K98-T190 PolarHBondContact O-OG1 3Å; C186-T190 VanDerWaalsContact CB-OG1 3.22Å; C186-T190 WeakPolarHBondContact CB-OG1 3.43Å; D187-T190 VanDerWaalsContact C-OG1 3.28Å; D187-T190 WeakPolarHBondContact CA-OG1 3.25Å; D187-T190 PolarHBondContact N-OG1 3.31Å; D187-T190 PolarHBondContact O-N 2.85Å; D187-T190 VanDerWaalsContact O-N 3.14Å; D187-T190 PolarHBondContact O-OG1 2.96Å; T190-F193 PolarHBondContact O-N 3.2Å; T190-L194 WeakPolarHBondContact O-CB 3.5Å; T190-L194 VanDerWaalsContact O-CG 3.31Å; T190-L194 WeakPolarHBondContact O-CG 2.92Å; T190-L194 PolarHBondContact O-N 2.79Å
191	Q	92.6	Very high	92.4	Very high	53 Å²	53	54.4 Å²	54.4	25%	0.248	29%	0.289	C	S	.	.	H	α-helix	trans	-58.7	-55.5	177.9	176	171.7	5.8	0	0	110.5	D187 Q188 F189 F193 L194 E195 L201	D187-Q191 PolarHBondContact O-N 2.92Å; Q188-Q191 PolarHBondContact O-N 3.27Å; F189-Q191 VanDerWaalsContact C-N 3.29Å; F189-Q191 PolarHBondContact O-N 2.79Å; Q191-F193 VanDerWaalsContact C-N 3.3Å; Q191-F193 PolarHBondContact O-N 3.43Å; Q191-L194 PolarHBondContact O-N 3.47Å; Q191-E195 WeakPolarHBondContact CG-OE1 3.47Å; Q191-E195 PolarHBondContact NE2-OE1 3.46Å; Q191-E195 WeakPolarHBondContact O-CB 3.24Å; Q191-E195 VanDerWaalsContact O-CG 3.3Å; Q191-E195 WeakPolarHBondContact O-CG 3.27Å; Q191-E195 PolarHBondContact O-N 3.13Å; Q191-L201 HydrophobicContact CB-CD1 3.95Å; Q191-L201 HydrophobicContact CG-CD1 3.68Å
192	V	94.1	Very high	92.3	Very high	79 Å²	79	57.8 Å²	57.8	48%	0.479	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-39.1	-179.6	175	0	0	0	0	111.5	Q188 F189 S196	Q188-V192 WeakPolarHBondContact O-CG2 3.47Å; Q188-V192 PolarHBondContact O-N 2.84Å; F189-V192 PolarHBondContact O-N 3.01Å; V192-S196 VanDerWaalsContact O-CB 3.26Å; V192-S196 WeakPolarHBondContact O-CB 3.03Å; V192-S196 PolarHBondContact O-N 2.99Å; V192-S196 PolarHBondContact O-OG 2.84Å
193	F	92.8	Very high	92.1	Very high	19 Å²	19	59.5 Å²	59.5	8%	0.083	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-50.9	178.3	178.1	-95.5	0	0	0	111.7	F92 L97 L126 W165 F189 T190 Q191 E195 S196 Q197	F92-F193 HydrophobicContact CE1-CE2 4.11Å; F92-F193 HydrophobicContact CE1-CZ 4.47Å; L97-F193 HydrophobicContact CD1-CD1 4.05Å; L97-F193 HydrophobicContact CD1-CE1 4.09Å; L97-F193 HydrophobicContact CD2-CB 4.01Å; L97-F193 HydrophobicContact CD2-CD1 3.45Å; L97-F193 VanDerWaalsContact CD2-CD1 3.45Å; L97-F193 HydrophobicContact CD2-CE1 4.09Å; L97-F193 HydrophobicContact CD2-CG 3.8Å; L97-F193 HydrophobicContact CG-CD1 4.36Å; L126-F193 HydrophobicContact CD1-CD1 4.4Å; L126-F193 HydrophobicContact CD1-CD2 4.14Å; L126-F193 HydrophobicContact CD1-CE1 3.92Å; L126-F193 HydrophobicContact CD1-CE2 3.63Å; L126-F193 HydrophobicContact CD1-CG 4.49Å; L126-F193 HydrophobicContact CD1-CZ 3.5Å; L126-F193 HydrophobicContact CD2-CE1 3.86Å; L126-F193 HydrophobicContact CD2-CZ 3.78Å; L126-F193 HydrophobicContact CG-CZ 4.31Å; W165-F193 HydrophobicContact CD2-CE1 4.23Å; W165-F193 HydrophobicContact CE3-CE1 4.23Å; F189-F193 WeakPolarHBondContact O-CB 3.46Å; F189-F193 PolarHBondContact O-N 3.31Å; T190-F193 PolarHBondContact O-N 3.2Å; Q191-F193 VanDerWaalsContact C-N 3.3Å; Q191-F193 PolarHBondContact O-N 3.43Å; F193-E195 PolarHBondContact O-N 3.31Å; F193-S196 PolarHBondContact O-N 3.33Å; F193-S196 PolarHBondContact O-OG 3.46Å; F193-Q197 HydrophobicContact CD1-CG 4.43Å; F193-Q197 HydrophobicContact CE1-CG 4.02Å; F193-Q197 HydrophobicContact CE2-CG 4.21Å; F193-Q197 HydrophobicContact CZ-CG 3.9Å; F193-Q197 WeakPolarHBondContact O-CG 3.4Å; F193-Q197 PolarHBondContact O-N 2.87Å
194	L	92.1	Very high	92	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.2	-41.7	-178.2	-68.8	168.8	0	0	0	111.5	F99 W165 T190 Q191 S196 Q197 G198 I199 L201	F99-L194 HydrophobicContact CE1-CD1 4.03Å; F99-L194 HydrophobicContact CZ-CD1 3.95Å; W165-L194 HydrophobicContact CE3-CD2 3.75Å; W165-L194 HydrophobicContact CZ3-CD2 4.26Å; T190-L194 WeakPolarHBondContact O-CB 3.5Å; T190-L194 VanDerWaalsContact O-CG 3.31Å; T190-L194 WeakPolarHBondContact O-CG 2.92Å; T190-L194 PolarHBondContact O-N 2.79Å; Q191-L194 PolarHBondContact O-N 3.47Å; L194-S196 VanDerWaalsContact C-N 3.35Å; L194-S196 PolarHBondContact O-N 2.64Å; L194-Q197 CarbonylContact O-C 3.5Å; L194-Q197 PolarHBondContact O-N 2.95Å; L194-Q197 VanDerWaalsContact O-N 3.15Å; L194-G198 PolarHBondContact O-N 2.92Å; L194-I199 CarbonylContact C-O 3.54Å; L194-I199 HydrophobicContact CB-CB 4.25Å; L194-I199 HydrophobicContact CD2-CD1 3.99Å; L194-I199 PolarHBondContact O-N 3.3Å; L194-L201 HydrophobicContact CB-CD1 4.27Å; L194-L201 HydrophobicContact CB-CD2 4.42Å; L194-L201 HydrophobicContact CB-CG 4.38Å; L194-L201 HydrophobicContact CD1-CD1 4.45Å; L194-L201 HydrophobicContact CD1-CD2 3.67Å; L194-L201 HydrophobicContact CD1-CG 4.45Å
195	E	91.7	Very high	91.9	Very high	99 Å²	99	66.5 Å²	66.5	46%	0.463	37%	0.365	S	S	.	.	H	α-helix	trans	-60.3	-42.9	173.4	-71.9	171.7	-175	0	0	111.4	Q191 F193 Q197 G198 L201	Q191-E195 WeakPolarHBondContact CG-OE1 3.47Å; Q191-E195 PolarHBondContact NE2-OE1 3.46Å; Q191-E195 WeakPolarHBondContact O-CB 3.24Å; Q191-E195 VanDerWaalsContact O-CG 3.3Å; Q191-E195 WeakPolarHBondContact O-CG 3.27Å; Q191-E195 PolarHBondContact O-N 3.13Å; F193-E195 PolarHBondContact O-N 3.31Å; E195-Q197 PolarHBondContact O-N 2.72Å; E195-G198 PolarHBondContact O-N 3.13Å; E195-L201 HydrophobicContact CG-CD1 4.39Å
196	S	90.4	Very high	91.7	Very high	79 Å²	79	73.3 Å²	73.3	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-64.6	-27.1	177.1	78.8	0	0	0	0	113.6	V192 F193 L194 G198	V192-S196 VanDerWaalsContact O-CB 3.26Å; V192-S196 WeakPolarHBondContact O-CB 3.03Å; V192-S196 PolarHBondContact O-N 2.99Å; V192-S196 PolarHBondContact O-OG 2.84Å; F193-S196 PolarHBondContact O-N 3.33Å; F193-S196 PolarHBondContact O-OG 3.46Å; L194-S196 VanDerWaalsContact C-N 3.35Å; L194-S196 PolarHBondContact O-N 2.64Å; S196-G198 VanDerWaalsContact C-N 3.31Å
197	Q	88.4	Confident	91.4	Very high	100 Å²	100	75.6 Å²	75.6	47%	0.467	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	4.9	176.5	-63.7	-56.3	-58.4	0	0	112.8	W165 F193 L194 E195	W165-Q197 HydrophobicContact CH2-CB 3.66Å; W165-Q197 HydrophobicContact CH2-CG 3.87Å; W165-Q197 HydrophobicContact CZ3-CB 3.76Å; W165-Q197 HydrophobicContact CZ3-CG 4.13Å; F193-Q197 HydrophobicContact CD1-CG 4.43Å; F193-Q197 HydrophobicContact CE1-CG 4.02Å; F193-Q197 HydrophobicContact CE2-CG 4.21Å; F193-Q197 HydrophobicContact CZ-CG 3.9Å; F193-Q197 WeakPolarHBondContact O-CG 3.4Å; F193-Q197 PolarHBondContact O-N 2.87Å; L194-Q197 CarbonylContact O-C 3.5Å; L194-Q197 PolarHBondContact O-N 2.95Å; L194-Q197 VanDerWaalsContact O-N 3.15Å; E195-Q197 PolarHBondContact O-N 2.72Å
198	G	86.9	Confident	91.1	Very high	67 Å²	67	73.2 Å²	73.2	69%	0.691	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	18.4	176.8	0	0	0	0	0	114.9	L194 E195 S196	L194-G198 PolarHBondContact O-N 2.92Å; E195-G198 PolarHBondContact O-N 3.13Å; S196-G198 VanDerWaalsContact C-N 3.31Å
199	I	89.1	Confident	90.6	Very high	34 Å²	34	72.1 Å²	72.1	17%	0.174	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-94.6	117	172.2	-61.6	-176.4	0	0	0	109	W165 K166 L194	W165-I199 HydrophobicContact CE3-CD1 3.8Å; W165-I199 HydrophobicContact CZ3-CD1 3.43Å; W165-I199 VanDerWaalsContact CZ3-CD1 3.43Å; W165-I199 HydrophobicContact CZ3-CG1 4.25Å; K166-I199 HydrophobicContact CB-CD1 4.36Å; K166-I199 HydrophobicContact CG-CD1 4.17Å; L194-I199 CarbonylContact C-O 3.54Å; L194-I199 HydrophobicContact CB-CB 4.25Å; L194-I199 HydrophobicContact CD2-CD1 3.99Å; L194-I199 PolarHBondContact O-N 3.3Å
200	E	88.4	Confident	90.1	Very high	176 Å²	176	69 Å²	69	82%	0.822	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-75.7	124.1	170.6	-66.5	-177.5	179.2	0	0	110.2	N169	N169-E200 PolarHBondContact ND2-O 3.28Å
201	L	89.1	Confident	89.5	Confident	30 Å²	30	72 Å²	72	16%	0.157	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-84.1	134.5	-179.5	-76	164.1	0	0	0	111.2	N169 R170 Q191 L194 E195	N169-L201 WeakPolarHBondContact OD1-CA 3.45Å; N169-L201 VanDerWaalsContact OD1-CD2 3.23Å; N169-L201 WeakPolarHBondContact OD1-CD2 3.33Å; R170-L201 HydrophobicContact CG-CD2 4.36Å; Q191-L201 HydrophobicContact CB-CD1 3.95Å; Q191-L201 HydrophobicContact CG-CD1 3.68Å; L194-L201 HydrophobicContact CB-CD1 4.27Å; L194-L201 HydrophobicContact CB-CD2 4.42Å; L194-L201 HydrophobicContact CB-CG 4.38Å; L194-L201 HydrophobicContact CD1-CD1 4.45Å; L194-L201 HydrophobicContact CD1-CD2 3.67Å; L194-L201 HydrophobicContact CD1-CG 4.45Å; E195-L201 HydrophobicContact CG-CD1 4.39Å
202	N	92.5	Very high	89	Confident	72 Å²	72	72 Å²	72	39%	0.385	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-62.8	157	170.8	-70.2	-24.5	0	0	0	110.7	N169 R170	N169-N202 PolarHBondContact OD1-N 3.2Å; N169-N202 VanDerWaalsContact OD1-N 3.16Å; R170-N202 HydrophobicContact CB-CB 4.13Å; R170-N202 VanDerWaalsContact CD-O 3.24Å; R170-N202 WeakPolarHBondContact CD-O 3.21Å; R170-N202 VanDerWaalsContact CZ-O 3.28Å; R170-N202 PolarHBondContact NE-O 3.28Å; R170-N202 PolarHBondContact NH1-O 3.01Å; R170-N202 VanDerWaalsContact O-CB 3.3Å; R170-N202 WeakPolarHBondContact O-CB 3.27Å; R170-N202 PolarHBondContact O-ND2 3.26Å
203	P	91.9	Very high	88.3	Confident	98 Å²	98	71.4 Å²	71.4	64%	0.636	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-60	152.1	176.6	25.2	-34.6	0	0	0	112.3	E205	P203-E205 PolarHBondContact O-N 2.83Å
204	P	92.6	Very high	87.7	Confident	79 Å²	79	74.7 Å²	74.7	51%	0.513	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-60.9	134.3	177.1	10.3	-12	0	0	0	110.8	R170	R170-P204 VanDerWaalsContact CZ-CA 3.41Å
205	E	92.7	Very high	87.1	Confident	71 Å²	71	81.7 Å²	81.7	33%	0.332	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-87.1	160.9	164.4	-67.2	-175.8	174.9	0	0	109.9	G171 R182 V184 P203	G171-E205 WeakPolarHBondContact CA-OE1 3.5Å; R182-E205 IonicContact CZ-OE1 3.74Å; R182-E205 IonicContact CZ-OE2 2.7Å; R182-E205 IonicContact NE-OE1 3.87Å; R182-E205 IonicContact NE-OE2 2.81Å; R182-E205 PolarHBondContact NE-OE2 3.15Å; R182-E205 IonicContact NH2-OE1 2.67Å; R182-E205 PolarHBondContact NH2-OE1 3.05Å; R182-E205 IonicContact NH2-OE2 3.14Å; R182-E205 PolarHBondContact NH2-OE2 3.47Å; V184-E205 HydrophobicContact CB-CB 4.47Å; V184-E205 VanDerWaalsContact CG1-C 3.42Å; V184-E205 HydrophobicContact CG1-CB 3.87Å; V184-E205 WeakPolarHBondContact CG1-O 3Å; V184-E205 PolarHBondContact O-N 2.86Å; V184-E205 VanDerWaalsContact O-N 3.14Å; P203-E205 PolarHBondContact O-N 2.83Å
206	K	90.3	Very high	86.3	Confident	194 Å²	194	83.6 Å²	83.6	84%	0.843	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-83.8	136.8	170.9	-70.6	-177.8	179.2	179.1	0	108.9	A208	K206-A208 PolarHBondContact O-N 3.3Å
207	M	88.6	Confident	85.5	Confident	57 Å²	57	85.9 Å²	85.9	28%	0.281	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-58.9	128.7	172.4	-169.9	63.9	71.3	0	0	109.3	D100 Y102 Q119 V184 L209	D100-M207 HydrophobicContact CB-CE 3.99Å; Y102-M207 HydrophobicContact CD1-SD 3.81Å; Y102-M207 HydrophobicContact CG-SD 4.34Å; Q119-M207 HydrophobicContact CG-CG 4.07Å; Q119-M207 HydrophobicContact CG-SD 4.03Å; V184-M207 HydrophobicContact CB-CE 4.37Å; V184-M207 HydrophobicContact CG2-SD 4.21Å; M207-L209 PolarHBondContact O-N 3.13Å
208	A	87.5	Confident	84.3	Confident	22 Å²	22	88.8 Å²	88.8	18%	0.182	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-66.4	132.7	179.4	0	0	0	0	0	110.1	Y102 I117 K206	Y102-A208 HydrophobicContact CD1-CB 4.22Å; Y102-A208 HydrophobicContact CD2-CB 4.23Å; Y102-A208 HydrophobicContact CE1-CB 3.83Å; Y102-A208 HydrophobicContact CE2-CB 3.83Å; Y102-A208 HydrophobicContact CG-CB 4.41Å; I117-A208 HydrophobicContact CD1-CB 3.55Å; I117-A208 HydrophobicContact CG2-CB 4.22Å; K206-A208 PolarHBondContact O-N 3.3Å
209	L	83.4	Confident	83.3	Confident	104 Å²	104	91.3 Å²	91.3	55%	0.545	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-87.6	130.6	179.1	-64.2	173.2	0	0	0	109.1	M207 P211 E214	M207-L209 PolarHBondContact O-N 3.13Å; L209-P211 WeakPolarHBondContact O-CD 3.4Å; L209-E214 HydrophobicContact CB-CG 4.12Å
210	D	83.3	Confident	82	Confident	16 Å²	16	97.2 Å²	97.2	9%	0.086	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-75.4	118	173	174.7	39.8	0	0	0	109.9	I117 Y212 T213 E214	I117-D210 HydrophobicContact CB-CB 4.19Å; D210-Y212 PolarHBondContact O-N 2.64Å; D210-T213 PolarHBondContact O-N 3.48Å; D210-T213 WeakPolarHBondContact OD2-CB 3.19Å; D210-T213 PolarHBondContact OD2-N 3.34Å; D210-T213 PolarHBondContact OD2-OG1 3.17Å; D210-E214 PolarHBondContact O-N 3.19Å
211	P	82.3	Confident	80.5	Confident	63 Å²	63	97.9 Å²	97.9	41%	0.409	49%	0.491	S	S	.	.	H	α-helix	trans	-55.7	-35.5	-178.4	-25.6	34.5	0	0	0	112.9	L209 L215	L209-P211 WeakPolarHBondContact O-CD 3.4Å; P211-L215 WeakPolarHBondContact O-CG 3.37Å; P211-L215 PolarHBondContact O-N 3.3Å
212	Y	81.7	Confident	78.9	Confident	52 Å²	52	104.9 Å²	104.9	20%	0.204	52%	0.521	C	S	.	.	H	α-helix	trans	-68.2	-45.6	179.7	-178.6	-113.4	0	0	0	112.5	E112 E113 D210 E214 L215 R216	E112-Y212 HydrophobicContact CB-CD2 4.12Å; E112-Y212 HydrophobicContact CB-CE2 3.67Å; E112-Y212 HydrophobicContact CG-CE2 4.33Å; E112-Y212 WeakPolarHBondContact OE2-CE2 3.38Å; E112-Y212 VanDerWaalsContact OE2-CZ 3.28Å; E112-Y212 PolarHBondContact OE2-OH 3.06Å; E113-Y212 HydrophobicContact CB-CD2 4.49Å; E113-Y212 VanDerWaalsContact OE2-CB 3.28Å; E113-Y212 WeakPolarHBondContact OE2-CB 3.41Å; D210-Y212 PolarHBondContact O-N 2.64Å; Y212-E214 PolarHBondContact O-N 2.88Å; Y212-L215 PolarHBondContact O-N 3.27Å; Y212-R216 PolarHBondContact O-N 3.27Å; Y212-R216 PolarHBondContact OH-NH1 2.96Å; Y212-R216 PolarHBondContact OH-NH2 2.84Å
213	T	78.9	Confident	77.3	Confident	68 Å²	68	110.6 Å²	110.6	42%	0.417	54%	0.538	S	S	.	.	H	α-helix	trans	-64.1	-38.1	176.3	-59.9	0	0	0	0	112.1	D210 R216 K217	D210-T213 PolarHBondContact O-N 3.48Å; D210-T213 WeakPolarHBondContact OD2-CB 3.19Å; D210-T213 PolarHBondContact OD2-N 3.34Å; D210-T213 PolarHBondContact OD2-OG1 3.17Å; T213-R216 PolarHBondContact O-N 3.06Å; T213-K217 PolarHBondContact O-N 3.17Å
214	E	80	Confident	75.4	Confident	87 Å²	87	111.3 Å²	111.3	41%	0.407	54%	0.541	S	S	.	.	H	α-helix	trans	-62.5	-44.7	175.7	-74.4	-88.3	121.6	0	0	112.3	L209 D210 Y212 R216 K217	L209-E214 HydrophobicContact CB-CG 4.12Å; D210-E214 PolarHBondContact O-N 3.19Å; Y212-E214 PolarHBondContact O-N 2.88Å; E214-R216 PolarHBondContact O-N 2.66Å; E214-K217 PolarHBondContact O-N 3.3Å; E214-K217 IonicContact OE1-NZ 3.2Å; E214-K217 PolarHBondContact OE1-NZ 3.44Å
215	L	79.3	Confident	73.6	Confident	147 Å²	147	113.5 Å²	113.5	77%	0.77	55%	0.553	S	S	*	*	H	α-helix	trans	-60.3	-28.8	178.2	-76.2	167.6	0	0	0	113	P211 Y212	P211-L215 WeakPolarHBondContact O-CG 3.37Å; P211-L215 PolarHBondContact O-N 3.3Å; Y212-L215 PolarHBondContact O-N 3.27Å
216	R	75.9	Confident	71.7	Confident	140 Å²	140	114.9 Å²	114.9	53%	0.528	57%	0.568	S	S	.	*	H	α-helix	trans	-92.8	-7.7	-178.4	-74	-174.4	169.3	-177.7	-0.4	114.7	E112 Y212 T213 E214 Q218	E112-R216 IonicContact OE1-NH2 2.67Å; E112-R216 IonicContact OE2-NH2 3.61Å; E112-R216 PolarHBondContact OE2-NH2 3.38Å; Y212-R216 PolarHBondContact O-N 3.27Å; Y212-R216 PolarHBondContact OH-NH1 2.96Å; Y212-R216 PolarHBondContact OH-NH2 2.84Å; T213-R216 PolarHBondContact O-N 3.06Å; E214-R216 PolarHBondContact O-N 2.66Å; R216-Q218 PolarHBondContact O-N 3.47Å
217	K	73.3	Confident	69.9	Low	126 Å²	126	111.7 Å²	111.7	55%	0.548	57%	0.57	S	S	.	*			trans	-66.3	95.9	175.2	-78.3	175.3	-173.5	170.9	0	109.4	T213 E214	T213-K217 PolarHBondContact O-N 3.17Å; E214-K217 PolarHBondContact O-N 3.3Å; E214-K217 IonicContact OE1-NZ 3.2Å; E214-K217 PolarHBondContact OE1-NZ 3.44Å
218	Q	63.7	Low	68.1	Low	162 Å²	162	115.4 Å²	115.4	76%	0.757	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-64.8	138.6	166.5	-68.5	-170	-1.9	0	0	108.9	R216 L220	R216-Q218 PolarHBondContact O-N 3.47Å; Q218-L220 PolarHBondContact O-N 2.83Å
219	P	64.4	Low	66.7	Low	119 Å²	119	122.8 Å²	122.8	77%	0.773	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-57.4	133.3	170.1	25.1	-32.5	0	0	0	108.5	R221	P219-R221 PolarHBondContact O-N 3.36Å
220	L	62.7	Low	66.1	Low	158 Å²	158	122.3 Å²	122.3	83%	0.827	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-50.7	120	172.4	-74.7	164.6	0	0	0	108.1	Q218 K222	Q218-L220 PolarHBondContact O-N 2.83Å; L220-K222 VanDerWaalsContact C-N 3.32Å; L220-K222 PolarHBondContact O-N 3.12Å
221	R	56.4	Low	65.7	Low	191 Å²	191	129.1 Å²	129.1	72%	0.721	65%	0.648	S	S	*	*			trans	-60.4	98.9	171	-74.4	-173.5	-178.3	-177.3	0.4	107.7	P219 Y223	P219-R221 PolarHBondContact O-N 3.36Å; R221-Y223 HydrophobicContact CB-CE2 4.13Å; R221-Y223 PolarHBondContact O-N 3.16Å
222	K	56.5	Low	65.7	Low	177 Å²	177	131.1 Å²	131.1	77%	0.77	66%	0.655	S	S	*	*			trans	-76.9	104.4	171.3	-72.3	-178.5	-179.5	178.1	0	107.2	L220 V224	L220-K222 VanDerWaalsContact C-N 3.32Å; L220-K222 PolarHBondContact O-N 3.12Å; K222-V224 HydrophobicContact CB-CG2 4.41Å; K222-V224 PolarHBondContact O-N 2.95Å
223	Y	57.9	Low	65.9	Low	191 Å²	191	135.1 Å²	135.1	75%	0.749	67%	0.674	S	S	*	*			trans	-78.3	44.5	167.7	-56.7	-80.9	0	0	0	111.1	R221 T225	R221-Y223 HydrophobicContact CB-CE2 4.13Å; R221-Y223 PolarHBondContact O-N 3.16Å; Y223-T225 PolarHBondContact O-N 3.39Å
224	V	52.1	Low	66.2	Low	114 Å²	114	134 Å²	134	69%	0.691	66%	0.663	S	S	*	*			trans	-81.4	98.8	167.2	-178.3	0	0	0	0	104.5	K222 P226	K222-V224 HydrophobicContact CB-CG2 4.41Å; K222-V224 PolarHBondContact O-N 2.95Å; V224-P226 VanDerWaalsContact O-CD 3.27Å; V224-P226 WeakPolarHBondContact O-CD 3.35Å; V224-P226 VanDerWaalsContact O-N 3.12Å
225	T	55.1	Low	66.6	Low	125 Å²	125	133.8 Å²	133.8	77%	0.767	66%	0.661	S	S	*	*			trans	-52.8	117	161.7	17.5	0	0	0	0	106.4	Y223 S227	Y223-T225 PolarHBondContact O-N 3.39Å; T225-S227 PolarHBondContact O-N 3.22Å
226	P	52.4	Low	67.1	Low	100 Å²	100	132.3 Å²	132.3	65%	0.649	65%	0.654	S	S	*	*			trans	-54.1	134	169.9	-17.1	29.4	0	0	0	106.9	V224 D228	V224-P226 VanDerWaalsContact O-CD 3.27Å; V224-P226 WeakPolarHBondContact O-CD 3.35Å; V224-P226 VanDerWaalsContact O-N 3.12Å; P226-D228 PolarHBondContact O-N 3.24Å
227	S	52.5	Low	67.7	Low	126 Å²	126	129.3 Å²	129.3	88%	0.881	65%	0.651	S	S	*	*			trans	-72	66.6	166.3	58.4	0	0	0	0	107.9	T225	T225-S227 PolarHBondContact O-N 3.22Å
228	D	51.8	Low	68.5	Low	136 Å²	136	125 Å²	125	73%	0.727	63%	0.632	S	S	*	*			trans	-64.6	150	160.8	-104.2	-31.3	0	0	0	107.8	P226 D230	P226-D228 PolarHBondContact O-N 3.24Å; D228-D230 PolarHBondContact O-N 2.73Å
229	F	58.1	Low	69.8	Low	177 Å²	177	120.5 Å²	120.5	78%	0.776	61%	0.613	S	S	*	*			trans	-28.7	127.3	178.9	-137.7	-103	0	0	0	112.7	Q231	F229-Q231 VanDerWaalsContact C-N 3.33Å; F229-Q231 PolarHBondContact O-N 3.36Å
230	D	69.8	Low	71	Confident	94 Å²	94	123.3 Å²	123.3	50%	0.503	61%	0.613	S	S	.	*			trans	-61.4	90.7	-174.9	-173.4	-2.4	0	0	0	110.8	D228 L232 K233 Q234	D228-D230 PolarHBondContact O-N 2.73Å; D230-L232 PolarHBondContact O-N 2.79Å; D230-L232 VanDerWaalsContact OD1-CB 3.32Å; D230-L232 WeakPolarHBondContact OD1-CB 3.31Å; D230-L232 PolarHBondContact OD1-N 2.85Å; D230-K233 HydrophobicContact CB-CB 3.75Å; D230-K233 WeakPolarHBondContact O-CA 3.46Å; D230-K233 VanDerWaalsContact O-CB 3.31Å; D230-K233 WeakPolarHBondContact O-CB 3.32Å; D230-K233 PolarHBondContact O-N 3.39Å; D230-K233 PolarHBondContact OD1-N 3.21Å; D230-K233 VanDerWaalsContact OD1-N 3.16Å; D230-K233 WeakPolarHBondContact OD2-CB 3.31Å; D230-Q234 PolarHBondContact O-N 3Å; D230-Q234 VanDerWaalsContact O-N 3.12Å
231	Q	75.1	Confident	72.4	Confident	159 Å²	159	118.8 Å²	118.8	74%	0.743	59%	0.588	S	S	*	*	H	α-helix	trans	-56.1	-34.3	178.9	-73.3	-179.2	-5.7	0	0	110.6	F229 Q234 F235	F229-Q231 VanDerWaalsContact C-N 3.33Å; F229-Q231 PolarHBondContact O-N 3.36Å; Q231-Q234 PolarHBondContact O-N 2.74Å; Q231-F235 WeakPolarHBondContact O-CB 3.07Å; Q231-F235 PolarHBondContact O-N 3.39Å
232	L	82.9	Confident	74.3	Confident	105 Å²	105	111.5 Å²	111.5	55%	0.55	57%	0.565	S	S	.	*	H	α-helix	trans	-66.2	-40.4	175.9	-179.8	66.5	0	0	0	110.8	D230 F235 L236	D230-L232 PolarHBondContact O-N 2.79Å; D230-L232 VanDerWaalsContact OD1-CB 3.32Å; D230-L232 WeakPolarHBondContact OD1-CB 3.31Å; D230-L232 PolarHBondContact OD1-N 2.85Å; L232-F235 HydrophobicContact CD1-CD1 4.37Å; L232-F235 PolarHBondContact O-N 3.22Å; L232-L236 HydrophobicContact CD1-CD1 4.17Å; L232-L236 HydrophobicContact CD1-CG 4.13Å; L232-L236 HydrophobicContact CD2-CD1 4.45Å; L232-L236 HydrophobicContact CG-CD1 3.86Å; L232-L236 HydrophobicContact CG-CG 4.25Å; L232-L236 WeakPolarHBondContact O-CB 3.28Å; L232-L236 WeakPolarHBondContact O-CG 3.31Å; L232-L236 PolarHBondContact O-N 2.99Å
233	K	85	Confident	76.2	Confident	136 Å²	136	103.1 Å²	103.1	59%	0.591	53%	0.528	S	S	*	.	H	α-helix	trans	-61.9	-43.6	174.2	-178.6	-178.2	178.6	-177.6	0	112.2	D230 L236 T237	D230-K233 HydrophobicContact CB-CB 3.75Å; D230-K233 WeakPolarHBondContact O-CA 3.46Å; D230-K233 VanDerWaalsContact O-CB 3.31Å; D230-K233 WeakPolarHBondContact O-CB 3.32Å; D230-K233 PolarHBondContact O-N 3.39Å; D230-K233 PolarHBondContact OD1-N 3.21Å; D230-K233 VanDerWaalsContact OD1-N 3.16Å; D230-K233 WeakPolarHBondContact OD2-CB 3.31Å; K233-L236 PolarHBondContact O-N 3.04Å; K233-T237 VanDerWaalsContact O-CB 3.31Å; K233-T237 WeakPolarHBondContact O-CB 3.33Å; K233-T237 PolarHBondContact O-N 2.86Å; K233-T237 PolarHBondContact O-OG1 2.92Å
234	Q	85.8	Confident	78	Confident	43 Å²	43	97.9 Å²	97.9	20%	0.201	51%	0.507	C	S	.	.	H	α-helix	trans	-62	-47.4	176.7	-174.3	173.7	-7.6	0	0	110.6	D230 Q231 L236 T237 F238 L268 D271	D230-Q234 PolarHBondContact O-N 3Å; D230-Q234 VanDerWaalsContact O-N 3.12Å; Q231-Q234 PolarHBondContact O-N 2.74Å; Q234-L236 PolarHBondContact O-N 2.98Å; Q234-T237 PolarHBondContact O-N 3.46Å; Q234-F238 HydrophobicContact CG-CD2 4.05Å; Q234-F238 WeakPolarHBondContact O-CD2 3.47Å; Q234-F238 PolarHBondContact O-N 3.15Å; Q234-L268 PolarHBondContact NE2-O 2.62Å; Q234-L268 VanDerWaalsContact NE2-O 3.1Å; Q234-D271 PolarHBondContact NE2-OD1 2.62Å; Q234-D271 PolarHBondContact NE2-OD2 2.65Å
235	F	88.3	Confident	80.1	Confident	83 Å²	83	92.5 Å²	92.5	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-55.5	-51.5	174.8	175	-99.6	0	0	0	112.1	Q231 L232 T237 F238 D239 M269	Q231-F235 WeakPolarHBondContact O-CB 3.07Å; Q231-F235 PolarHBondContact O-N 3.39Å; L232-F235 HydrophobicContact CD1-CD1 4.37Å; L232-F235 PolarHBondContact O-N 3.22Å; F235-T237 VanDerWaalsContact C-N 3.33Å; F235-T237 PolarHBondContact O-N 3.03Å; F235-F238 PolarHBondContact O-N 3.1Å; F235-D239 WeakPolarHBondContact O-CA 3.36Å; F235-D239 WeakPolarHBondContact O-CB 3.38Å; F235-D239 PolarHBondContact O-N 3.37Å; F235-M269 HydrophobicContact CD2-CB 4.25Å; F235-M269 HydrophobicContact CD2-CE 4.15Å; F235-M269 HydrophobicContact CD2-CG 4.44Å; F235-M269 HydrophobicContact CD2-SD 4.13Å; F235-M269 HydrophobicContact CE2-CE 4.05Å; F235-M269 HydrophobicContact CE2-SD 4.1Å
236	L	89.3	Confident	82	Confident	117 Å²	117	89.2 Å²	89.2	61%	0.613	45%	0.449	S	S	*	.	H	α-helix	trans	-66	-32.9	-178.6	-70.2	173.3	0	0	0	113.3	L232 K233 Q234	L232-L236 HydrophobicContact CD1-CD1 4.17Å; L232-L236 HydrophobicContact CD1-CG 4.13Å; L232-L236 HydrophobicContact CD2-CD1 4.45Å; L232-L236 HydrophobicContact CG-CD1 3.86Å; L232-L236 HydrophobicContact CG-CG 4.25Å; L232-L236 WeakPolarHBondContact O-CB 3.28Å; L232-L236 WeakPolarHBondContact O-CG 3.31Å; L232-L236 PolarHBondContact O-N 2.99Å; K233-L236 PolarHBondContact O-N 3.04Å; Q234-L236 PolarHBondContact O-N 2.98Å
237	T	89.1	Confident	84.1	Confident	76 Å²	76	84.5 Å²	84.5	47%	0.466	42%	0.418	S	S	.	.	H	α-helix	trans	-75.8	-37.9	-178.3	-54.4	0	0	0	0	111.7	K233 Q234 F235 Q241	K233-T237 VanDerWaalsContact O-CB 3.31Å; K233-T237 WeakPolarHBondContact O-CB 3.33Å; K233-T237 PolarHBondContact O-N 2.86Å; K233-T237 PolarHBondContact O-OG1 2.92Å; Q234-T237 PolarHBondContact O-N 3.46Å; F235-T237 VanDerWaalsContact C-N 3.33Å; F235-T237 PolarHBondContact O-N 3.03Å; T237-Q241 PolarHBondContact O-NE2 2.93Å
238	F	90.8	Very high	86.1	Confident	36 Å²	36	79.5 Å²	79.5	16%	0.158	38%	0.381	C	S	.	.	H	α-helix	trans	-115.6	16.2	-171.4	-61	-67.7	0	0	0	113.5	Q234 F235 K240 Q241 L268 Y354	Q234-F238 HydrophobicContact CG-CD2 4.05Å; Q234-F238 WeakPolarHBondContact O-CD2 3.47Å; Q234-F238 PolarHBondContact O-N 3.15Å; F235-F238 PolarHBondContact O-N 3.1Å; F238-K240 PolarHBondContact O-N 2.94Å; F238-Q241 WeakPolarHBondContact O-CB 3.49Å; F238-Q241 PolarHBondContact O-N 3.49Å; F238-L268 HydrophobicContact CB-CB 3.65Å; F238-L268 HydrophobicContact CD1-CB 4.11Å; F238-L268 HydrophobicContact CD1-CD1 4.06Å; F238-L268 HydrophobicContact CG-CB 3.89Å; F238-Y354 HydrophobicContact CE1-CE2 4.28Å
239	D	89.6	Confident	88.1	Confident	68 Å²	68	74.3 Å²	74.3	36%	0.364	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	132.2	176.4	-175.5	34.6	0	0	0	110.2	F235 Q241	F235-D239 WeakPolarHBondContact O-CA 3.36Å; F235-D239 WeakPolarHBondContact O-CB 3.38Å; F235-D239 PolarHBondContact O-N 3.37Å; D239-Q241 PolarHBondContact O-N 2.95Å
240	K	89.3	Confident	89.6	Confident	177 Å²	177	69.5 Å²	69.5	77%	0.77	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	8.7	-177.5	-55.3	170	-171.6	174.2	0	115.7	F238	F238-K240 PolarHBondContact O-N 2.94Å
241	Q	93.4	Very high	90.6	Very high	63 Å²	63	66.9 Å²	66.9	29%	0.294	32%	0.32	S	S	.	.			trans	-90.2	110.6	173.4	-60.5	-176.3	28.3	0	0	109.7	T237 F238 D239 L268 F350	T237-Q241 PolarHBondContact O-NE2 2.93Å; F238-Q241 WeakPolarHBondContact O-CB 3.49Å; F238-Q241 PolarHBondContact O-N 3.49Å; D239-Q241 PolarHBondContact O-N 2.95Å; Q241-L268 HydrophobicContact CB-CD1 3.92Å; Q241-L268 PolarHBondContact O-N 3.32Å; Q241-F350 HydrophobicContact CB-CE1 4.25Å; Q241-F350 HydrophobicContact CB-CZ 3.91Å; Q241-F350 HydrophobicContact CG-CZ 4.07Å
242	V	95.8	Very high	91.2	Very high	39 Å²	39	62.3 Å²	62.3	24%	0.236	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.2	-178	-172.4	0	0	0	0	108.8	H265 Y267 F350	V242-H265 HydrophobicContact CG1-CB 3.73Å; V242-Y267 HydrophobicContact CB-CD1 4.44Å; V242-Y267 HydrophobicContact CG1-CD1 4.18Å; V242-Y267 HydrophobicContact CG1-CE1 4.13Å; V242-Y267 HydrophobicContact CG1-CG 4.41Å; V242-Y267 HydrophobicContact CG2-CD1 3.48Å; V242-Y267 VanDerWaalsContact CG2-CD1 3.48Å; V242-Y267 HydrophobicContact CG2-CE1 3.53Å; V242-Y267 HydrophobicContact CG2-CG 4.37Å; V242-F350 WeakPolarHBondContact O-CD1 3.47Å
243	L	95.4	Very high	91.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117.7	172	-51.1	173.7	0	0	0	109.5	F245 H265 Y266 L268 A326 F350 T351 Y354 Y355	L243-F245 HydrophobicContact CB-CE2 3.65Å; L243-F245 HydrophobicContact CB-CZ 4.01Å; L243-F245 HydrophobicContact CD1-CZ 4.46Å; L243-H265 CarbonylContact O-C 3.59Å; L243-H265 WeakPolarHBondContact O-CA 3.37Å; L243-Y266 HydrophobicContact CD1-CD1 3.94Å; L243-Y266 PolarHBondContact N-O 3.33Å; L243-Y266 PolarHBondContact O-N 2.78Å; L243-L268 HydrophobicContact CD1-CD2 3.79Å; L243-L268 HydrophobicContact CD1-CG 4.34Å; L243-L268 HydrophobicContact CD2-CD1 4.13Å; L243-L268 HydrophobicContact CG-CD1 4.25Å; L243-L268 HydrophobicContact CG-CD2 4.08Å; L243-L268 HydrophobicContact CG-CG 4.08Å; L243-A326 HydrophobicContact CD1-CB 3.84Å; L243-F350 HydrophobicContact CD2-CD1 4.42Å; L243-F350 HydrophobicContact CD2-CE1 4.05Å; L243-T351 HydrophobicContact CB-CG2 3.5Å; L243-T351 VanDerWaalsContact CB-CG2 3.5Å; L243-T351 HydrophobicContact CD2-CG2 3.73Å; L243-T351 HydrophobicContact CG-CG2 4.23Å; L243-Y354 HydrophobicContact CD1-CD1 4.06Å; L243-Y354 HydrophobicContact CD1-CE1 3.99Å; L243-Y354 HydrophobicContact CD2-CD1 3.54Å; L243-Y354 HydrophobicContact CD2-CD2 4.43Å; L243-Y354 HydrophobicContact CD2-CE1 4.15Å; L243-Y354 HydrophobicContact CD2-CG 3.7Å; L243-Y354 HydrophobicContact CG-CD1 4.42Å; L243-Y355 HydrophobicContact CD1-CE2 3.97Å
244	R	96.4	Very high	91.7	Very high	82 Å²	82	61.5 Å²	61.5	31%	0.309	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.3	177	-170.4	170.5	77.7	-169.7	-3.7	111.7	Y246 I263 I264 H265 D348 T351	R244-Y246 VanDerWaalsContact CZ-OH 3.3Å; R244-Y246 PolarHBondContact NE-OH 3.49Å; R244-Y246 PolarHBondContact NH2-OH 3.49Å; R244-I263 HydrophobicContact CG-CG2 3.58Å; R244-I264 WeakPolarHBondContact CA-O 3.39Å; R244-H265 WeakPolarHBondContact CD-NE2 3.29Å; R244-D348 HydrophobicContact CB-CB 4.16Å; R244-D348 VanDerWaalsContact CZ-CG 3.48Å; R244-D348 IonicContact CZ-OD1 3.2Å; R244-D348 IonicContact CZ-OD2 2.67Å; R244-D348 IonicContact NE-OD1 3.92Å; R244-D348 PolarHBondContact NE-OD1 3.44Å; R244-D348 IonicContact NE-OD2 2.64Å; R244-D348 PolarHBondContact NE-OD2 2.75Å; R244-D348 IonicContact NH1-OD2 2.91Å; R244-D348 IonicContact NH2-OD1 2.66Å; R244-D348 PolarHBondContact NH2-OD1 3.21Å; R244-D348 IonicContact NH2-OD2 3.87Å; R244-D348 PolarHBondContact NH2-OD2 2.71Å; R244-D348 PolarHBondContact O-N 2.78Å; R244-D348 VanDerWaalsContact O-N 3.12Å; R244-T351 WeakPolarHBondContact O-CG2 3.36Å
245	F	96.1	Very high	91.7	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.3	175.3	-56.2	-85.6	0	0	0	110.4	L243 I263 I264 F329 I344 C347 T351 Y355	L243-F245 HydrophobicContact CB-CE2 3.65Å; L243-F245 HydrophobicContact CB-CZ 4.01Å; L243-F245 HydrophobicContact CD1-CZ 4.46Å; F245-I263 WeakPolarHBondContact O-CA 3.47Å; F245-I264 HydrophobicContact CB-CB 4.28Å; F245-I264 PolarHBondContact N-O 3.27Å; F245-I264 PolarHBondContact O-N 3.2Å; F245-F329 HydrophobicContact CD2-CB 4.26Å; F245-F329 HydrophobicContact CD2-CD1 4.36Å; F245-F329 HydrophobicContact CE1-CB 4.1Å; F245-F329 HydrophobicContact CE2-CB 3.72Å; F245-F329 HydrophobicContact CE2-CD1 4.39Å; F245-F329 HydrophobicContact CE2-CG 4.15Å; F245-F329 HydrophobicContact CZ-CB 3.65Å; F245-I344 HydrophobicContact CB-CG2 3.97Å; F245-I344 HydrophobicContact CD1-CG2 4.07Å; F245-I344 HydrophobicContact CG-CG2 4.4Å; F245-C347 HydrophobicContact CD1-CB 3.66Å; F245-C347 HydrophobicContact CE1-CB 4.05Å; F245-T351 HydrophobicContact CZ-CG2 4.49Å; F245-Y355 HydrophobicContact CE1-CE2 4.26Å; F245-Y355 AromaticContact CZ-CE2 3.83Å; F245-Y355 HydrophobicContact CZ-CE2 3.83Å; F245-Y355 AromaticContact CZ-CZ 3.87Å; F245-Y355 VanDerWaalsContact CZ-OH 3.27Å; F245-Y355 WeakPolarHBondContact CZ-OH 3.35Å
246	Y	95.7	Very high	91.6	Very high	57 Å²	57	72.4 Å²	72.4	22%	0.224	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124.4	173	-58.8	-82.2	0	0	0	108.7	R244 I263 Y345 D346 D348	R244-Y246 VanDerWaalsContact CZ-OH 3.3Å; R244-Y246 PolarHBondContact NE-OH 3.49Å; R244-Y246 PolarHBondContact NH2-OH 3.49Å; Y246-I263 HydrophobicContact CD1-CG1 4.01Å; Y246-I263 HydrophobicContact CE1-CD1 4.3Å; Y246-I263 HydrophobicContact CE1-CG1 4.17Å; Y246-Y345 WeakPolarHBondContact O-CD1 3.43Å; Y246-Y345 PolarHBondContact O-N 3.34Å; Y246-D346 HydrophobicContact CD2-CB 3.86Å; Y246-D346 HydrophobicContact CG-CB 4.35Å; Y246-D346 PolarHBondContact N-O 3.14Å; Y246-D346 PolarHBondContact O-N 2.94Å; Y246-D348 WeakPolarHBondContact CE2-OD1 3.22Å; Y246-D348 PolarHBondContact OH-OD1 3.18Å
247	A	95.4	Very high	91.3	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154.7	-176.9	0	0	0	0	0	111.3	Y262 I264 F342 F343 I344	A247-Y262 PolarHBondContact N-O 3.26Å; A247-Y262 PolarHBondContact O-N 3.32Å; A247-Y262 VanDerWaalsContact O-O 3.12Å; A247-I264 HydrophobicContact CB-CD1 3.73Å; A247-I264 HydrophobicContact CB-CG1 4.17Å; A247-F342 HydrophobicContact CB-CB 4.12Å; A247-F343 CarbonylContact C-O 3.59Å; A247-F343 WeakPolarHBondContact CA-O 3.41Å; A247-I344 HydrophobicContact CB-CG1 4.3Å
248	I	94.7	Very high	91.1	Very high	21 Å²	21	68.7 Å²	68.7	11%	0.108	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	143.4	165.2	62.3	172.4	0	0	0	109.1	R260 T261 F342 F343 Y345 V369	I248-R260 CarbonylContact C-O 3.59Å; I248-R260 WeakPolarHBondContact CA-O 3.38Å; I248-T261 HydrophobicContact CG2-CG2 4.1Å; I248-F342 CarbonylContact O-C 3.5Å; I248-F342 WeakPolarHBondContact O-CA 3.43Å; I248-F343 HydrophobicContact CD1-CB 4.49Å; I248-F343 HydrophobicContact CD1-CD1 4.13Å; I248-F343 HydrophobicContact CG1-CB 3.85Å; I248-F343 HydrophobicContact CG1-CD1 4.02Å; I248-F343 HydrophobicContact CG1-CG 4.43Å; I248-F343 PolarHBondContact N-O 3.26Å; I248-F343 PolarHBondContact O-N 3.16Å; I248-Y345 HydrophobicContact CG2-CD1 3.79Å; I248-Y345 HydrophobicContact CG2-CE1 3.71Å; I248-V369 HydrophobicContact CD1-CB 3.94Å; I248-V369 HydrophobicContact CD1-CG1 3.7Å; I248-V369 HydrophobicContact CG2-CG2 4.1Å
249	W	93.6	Very high	91.1	Very high	27 Å²	27	69.5 Å²	69.5	10%	0.102	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.9	165.1	175.9	32	0	0	0	106.9	D251 C259 R260 Y262 R340 F342	W249-D251 HydrophobicContact CH2-CB 4.42Å; W249-D251 HydrophobicContact CZ2-CB 3.91Å; W249-C259 WeakPolarHBondContact O-CA 3.4Å; W249-R260 PolarHBondContact N-O 3.46Å; W249-R260 PolarHBondContact O-N 3.09Å; W249-Y262 HydrophobicContact CB-CD2 3.85Å; W249-Y262 HydrophobicContact CB-CE2 3.7Å; W249-Y262 HydrophobicContact CD2-CE2 4.5Å; W249-Y262 AromaticContact CE3-CE2 3.83Å; W249-Y262 HydrophobicContact CE3-CE2 3.83Å; W249-R340 HydrophobicContact CZ2-CG 4Å; W249-F342 HydrophobicContact CB-CD1 3.8Å; W249-F342 HydrophobicContact CB-CE1 3.79Å; W249-F342 HydrophobicContact CG-CE1 4.28Å
250	D	91.2	Very high	91.1	Very high	76 Å²	76	69.2 Å²	69.2	41%	0.406	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	107.4	176.6	-160.1	3	0	0	0	109.2	T252 C259	D250-T252 WeakPolarHBondContact OD1-CG2 3.35Å; D250-T252 PolarHBondContact OD1-N 2.98Å; D250-T252 PolarHBondContact OD1-OG1 3.19Å; D250-T252 VanDerWaalsContact OD1-OG1 3.05Å; D250-C259 WeakPolarHBondContact OD1-CB 3.34Å
251	D	90.3	Very high	91.3	Very high	40 Å²	40	63.1 Å²	63.1	21%	0.214	32%	0.316	C	S	.	.			trans	-109.5	13.9	176	-167	30.3	0	0	0	111.1	W249 D253 S254 G257 E258	W249-D251 HydrophobicContact CH2-CB 4.42Å; W249-D251 HydrophobicContact CZ2-CB 3.91Å; D251-D253 PolarHBondContact O-N 3.39Å; D251-S254 WeakPolarHBondContact O-CB 3.38Å; D251-S254 PolarHBondContact O-N 2.86Å; D251-S254 WeakPolarHBondContact OD1-CB 3.49Å; D251-S254 PolarHBondContact OD1-OG 2.89Å; D251-G257 CarbonylContact O-C 3.56Å; D251-G257 WeakPolarHBondContact O-CA 3.5Å; D251-E258 PolarHBondContact N-O 3.2Å
252	T	87.6	Confident	91.3	Very high	63 Å²	63	60.2 Å²	60.2	39%	0.387	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.5	-172.8	55.8	0	0	0	0	115.1	D250 S254 C259	D250-T252 WeakPolarHBondContact OD1-CG2 3.35Å; D250-T252 PolarHBondContact OD1-N 2.98Å; D250-T252 PolarHBondContact OD1-OG1 3.19Å; D250-T252 VanDerWaalsContact OD1-OG1 3.05Å; T252-S254 PolarHBondContact O-N 3.31Å; T252-C259 HydrophobicContact CG2-CB 4.17Å
253	D	88.3	Confident	91.4	Very high	165 Å²	165	60 Å²	60	88%	0.882	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-21.3	174.1	-66.3	-19.3	0	0	0	112.3	D251	D251-D253 PolarHBondContact O-N 3.39Å
254	S	90.3	Very high	91.4	Very high	59 Å²	59	60 Å²	60	41%	0.413	30%	0.3	S	S	.	.	S	Bend	trans	-77.6	148.2	175.4	-67.2	0	0	0	0	111.4	D251 T252 Y256 G257	D251-S254 WeakPolarHBondContact O-CB 3.38Å; D251-S254 PolarHBondContact O-N 2.86Å; D251-S254 WeakPolarHBondContact OD1-CB 3.49Å; D251-S254 PolarHBondContact OD1-OG 2.89Å; T252-S254 PolarHBondContact O-N 3.31Å; S254-Y256 PolarHBondContact O-N 3.31Å; S254-G257 PolarHBondContact O-N 3.35Å
255	M	85.2	Confident	91.4	Very high	164 Å²	164	57.4 Å²	57.4	81%	0.808	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-31.8	-174.6	-174.3	179.2	-177.7	0	0	115
256	Y	85.9	Confident	91.4	Very high	190 Å²	190	57.4 Å²	57.4	75%	0.745	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	21.8	176.8	-55.5	-74.9	0	0	0	111.4	S254	S254-Y256 PolarHBondContact O-N 3.31Å
257	G	82.3	Confident	91.4	Very high	14 Å²	14	56.5 Å²	56.5	14%	0.144	29%	0.287	C	S	.	.			trans	-82.4	148.7	-174.5	0	0	0	0	0	111.8	D251 S254	D251-G257 CarbonylContact O-C 3.56Å; D251-G257 WeakPolarHBondContact O-CA 3.5Å; S254-G257 PolarHBondContact O-N 3.35Å
258	E	86.7	Confident	91.3	Very high	102 Å²	102	56.7 Å²	56.7	48%	0.477	29%	0.289	S	S	.	.			trans	-133	150	-175.4	-69.1	174.9	-178.7	0	0	108.6	D251 R260 R285	D251-E258 PolarHBondContact N-O 3.2Å; E258-R260 HydrophobicContact CB-CG 4.37Å; E258-R285 IonicContact OE2-CZ 3.85Å; E258-R285 IonicContact OE2-NH2 3.77Å; E258-R285 PolarHBondContact OE2-NH2 2.79Å
259	C	89.2	Confident	91.2	Very high	53 Å²	53	57.8 Å²	57.8	36%	0.358	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122.5	170.8	-169.3	0	0	0	0	109	W249 D250 T252	W249-C259 WeakPolarHBondContact O-CA 3.4Å; D250-C259 WeakPolarHBondContact OD1-CB 3.34Å; T252-C259 HydrophobicContact CG2-CB 4.17Å
260	R	90.1	Very high	91.1	Very high	62 Å²	62	59.2 Å²	59.2	23%	0.234	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.7	-168.3	-67.3	166.5	-169.7	-146	-4.5	110.9	I248 W249 E258 Y262 R285	I248-R260 CarbonylContact C-O 3.59Å; I248-R260 WeakPolarHBondContact CA-O 3.38Å; W249-R260 PolarHBondContact N-O 3.46Å; W249-R260 PolarHBondContact O-N 3.09Å; E258-R260 HydrophobicContact CB-CG 4.37Å; R260-Y262 HydrophobicContact CB-CD2 4.2Å; R260-Y262 HydrophobicContact CB-CE2 3.43Å; R260-Y262 VanDerWaalsContact CB-CE2 3.43Å; R260-Y262 WeakPolarHBondContact CD-OH 3.22Å; R260-Y262 HydrophobicContact CG-CE2 4.49Å; R260-R285 VanDerWaalsContact CD-NH1 3.31Å; R260-R285 VanDerWaalsContact NH1-NH1 3.13Å
261	T	92.9	Very high	91.1	Very high	48 Å²	48	57.7 Å²	57.7	29%	0.294	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	140.7	176.8	60.1	0	0	0	0	111.3	I248 V278	I248-T261 HydrophobicContact CG2-CG2 4.1Å; T261-V278 PolarHBondContact O-N 2.92Å
262	Y	94.9	Very high	91.2	Very high	3 Å²	3	56.5 Å²	56.5	1%	0.012	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151.2	-175.8	-71.4	-83.4	0	0	0	110.7	A247 W249 R260 I275 R276 E277 L291 F342	A247-Y262 PolarHBondContact N-O 3.26Å; A247-Y262 PolarHBondContact O-N 3.32Å; A247-Y262 VanDerWaalsContact O-O 3.12Å; W249-Y262 HydrophobicContact CB-CD2 3.85Å; W249-Y262 HydrophobicContact CB-CE2 3.7Å; W249-Y262 HydrophobicContact CD2-CE2 4.5Å; W249-Y262 AromaticContact CE3-CE2 3.83Å; W249-Y262 HydrophobicContact CE3-CE2 3.83Å; R260-Y262 HydrophobicContact CB-CD2 4.2Å; R260-Y262 HydrophobicContact CB-CE2 3.43Å; R260-Y262 VanDerWaalsContact CB-CE2 3.43Å; R260-Y262 WeakPolarHBondContact CD-OH 3.22Å; R260-Y262 HydrophobicContact CG-CE2 4.49Å; Y262-I275 HydrophobicContact CD1-CG2 3.91Å; Y262-I275 HydrophobicContact CG-CG2 4.34Å; Y262-R276 WeakPolarHBondContact CA-O 3.48Å; Y262-E277 HydrophobicContact CD1-CG 4.29Å; Y262-E277 HydrophobicContact CE1-CB 4.23Å; Y262-E277 HydrophobicContact CE1-CG 3.67Å; Y262-E277 WeakPolarHBondContact CE1-OE1 3.29Å; Y262-E277 PolarHBondContact OH-OE1 3.46Å; Y262-L291 HydrophobicContact CD1-CB 4.31Å; Y262-L291 HydrophobicContact CD1-CD2 3.92Å; Y262-L291 HydrophobicContact CE1-CB 3.94Å; Y262-L291 HydrophobicContact CE1-CD1 4.19Å; Y262-L291 HydrophobicContact CE1-CD2 3.43Å; Y262-L291 VanDerWaalsContact CE1-CD2 3.43Å; Y262-L291 HydrophobicContact CE1-CG 4.02Å; Y262-F342 HydrophobicContact CD1-CE1 4.39Å; Y262-F342 HydrophobicContact CD2-CD1 4.15Å; Y262-F342 AromaticContact CD2-CE1 3.71Å; Y262-F342 HydrophobicContact CD2-CE1 3.71Å; Y262-F342 HydrophobicContact CE2-CE1 4.15Å; Y262-F342 HydrophobicContact CG-CD1 4.36Å; Y262-F342 AromaticContact CG-CE1 3.86Å; Y262-F342 HydrophobicContact CG-CE1 3.86Å
263	I	96.5	Very high	91.6	Very high	34 Å²	34	53.6 Å²	53.6	17%	0.174	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.5	171.2	-64.4	169	0	0	0	108.3	R244 F245 Y246 I275 R276 V278	R244-I263 HydrophobicContact CG-CG2 3.58Å; F245-I263 WeakPolarHBondContact O-CA 3.47Å; Y246-I263 HydrophobicContact CD1-CG1 4.01Å; Y246-I263 HydrophobicContact CE1-CD1 4.3Å; Y246-I263 HydrophobicContact CE1-CG1 4.17Å; I263-I275 WeakPolarHBondContact O-CA 3.27Å; I263-R276 HydrophobicContact CB-CB 4.37Å; I263-R276 PolarHBondContact N-O 3.46Å; I263-R276 PolarHBondContact O-N 3.14Å; I263-V278 HydrophobicContact CD1-CG2 3.58Å; I263-V278 HydrophobicContact CG1-CG2 3.59Å
264	I	96.6	Very high	91.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.5	176.3	-53.6	176.2	0	0	0	108.1	R244 F245 A247 V273 I275 F329 L335 F342 I344	R244-I264 WeakPolarHBondContact CA-O 3.39Å; F245-I264 HydrophobicContact CB-CB 4.28Å; F245-I264 PolarHBondContact N-O 3.27Å; F245-I264 PolarHBondContact O-N 3.2Å; A247-I264 HydrophobicContact CB-CD1 3.73Å; A247-I264 HydrophobicContact CB-CG1 4.17Å; I264-V273 HydrophobicContact CG2-CG1 3.8Å; I264-I275 HydrophobicContact CG1-CG1 4.31Å; I264-I275 HydrophobicContact CG2-CG1 4.47Å; I264-F329 HydrophobicContact CG2-CD1 4.31Å; I264-F329 HydrophobicContact CG2-CE1 3.94Å; I264-L335 HydrophobicContact CD1-CD2 4.02Å; I264-F342 HydrophobicContact CD1-CB 4.24Å; I264-F342 HydrophobicContact CD1-CG 4.48Å; I264-I344 HydrophobicContact CD1-CG1 4.41Å
265	H	96.7	Very high	92.2	Very high	27 Å²	27	43.7 Å²	43.7	13%	0.125	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	127.5	171.6	-69.6	134.2	0	0	0	110.1	V242 L243 R244 Y267 V273 E274	V242-H265 HydrophobicContact CG1-CB 3.73Å; L243-H265 CarbonylContact O-C 3.59Å; L243-H265 WeakPolarHBondContact O-CA 3.37Å; R244-H265 WeakPolarHBondContact CD-NE2 3.29Å; H265-Y267 HydrophobicContact CB-CE2 3.96Å; H265-V273 CarbonylContact O-C 3.56Å; H265-V273 WeakPolarHBondContact O-CA 3.47Å; H265-E274 HydrophobicContact CB-CB 4.31Å; H265-E274 PolarHBondContact N-O 3.42Å; H265-E274 PolarHBondContact O-N 2.63Å
266	Y	96.1	Very high	92.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	116.1	170.8	-176	-81.3	0	0	0	109.2	L243 L268 D271 T272 V273 Y324 T325 A326 F329	L243-Y266 HydrophobicContact CD1-CD1 3.94Å; L243-Y266 PolarHBondContact N-O 3.33Å; L243-Y266 PolarHBondContact O-N 2.78Å; Y266-L268 HydrophobicContact CD1-CD2 4.07Å; Y266-L268 HydrophobicContact CE1-CD2 3.99Å; Y266-D271 WeakPolarHBondContact OH-CB 3.35Å; Y266-D271 PolarHBondContact OH-OD1 3.23Å; Y266-D271 VanDerWaalsContact OH-OD1 3.14Å; Y266-T272 WeakPolarHBondContact CA-O 3.37Å; Y266-V273 HydrophobicContact CD2-CG2 3.82Å; Y266-V273 HydrophobicContact CE2-CG2 4.21Å; Y266-Y324 PolarHBondContact OH-O 3.43Å; Y266-T325 WeakPolarHBondContact OH-CA 3.28Å; Y266-A326 HydrophobicContact CD1-CB 4.21Å; Y266-A326 HydrophobicContact CE1-CB 3.78Å; Y266-A326 VanDerWaalsContact CZ-N 3.29Å; Y266-A326 PolarHBondContact OH-N 3.46Å; Y266-A326 VanDerWaalsContact OH-N 3.14Å; Y266-F329 AromaticContact CD2-CD2 3.94Å; Y266-F329 HydrophobicContact CD2-CD2 3.94Å; Y266-F329 AromaticContact CD2-CE2 3.35Å; Y266-F329 HydrophobicContact CD2-CE2 3.35Å; Y266-F329 AromaticContact CD2-CZ 3.77Å; Y266-F329 HydrophobicContact CD2-CZ 3.77Å; Y266-F329 HydrophobicContact CE2-CD2 4.33Å; Y266-F329 AromaticContact CE2-CE2 3.64Å; Y266-F329 HydrophobicContact CE2-CE2 3.64Å; Y266-F329 HydrophobicContact CE2-CZ 4.32Å; Y266-F329 HydrophobicContact CG-CE2 4.35Å
267	Y	95.8	Very high	93	Very high	38 Å²	38	33 Å²	33	15%	0.149	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.7	-177.1	-67.6	-93.9	0	0	0	110	V242 H265 M269 D270 D271 T272 E274 R294	V242-Y267 HydrophobicContact CB-CD1 4.44Å; V242-Y267 HydrophobicContact CG1-CD1 4.18Å; V242-Y267 HydrophobicContact CG1-CE1 4.13Å; V242-Y267 HydrophobicContact CG1-CG 4.41Å; V242-Y267 HydrophobicContact CG2-CD1 3.48Å; V242-Y267 VanDerWaalsContact CG2-CD1 3.48Å; V242-Y267 HydrophobicContact CG2-CE1 3.53Å; V242-Y267 HydrophobicContact CG2-CG 4.37Å; H265-Y267 HydrophobicContact CB-CE2 3.96Å; Y267-M269 PolarHBondContact O-N 3.19Å; Y267-D270 WeakPolarHBondContact CB-OD1 3.49Å; Y267-D271 VanDerWaalsContact O-CA 3.29Å; Y267-D271 WeakPolarHBondContact O-CA 3.36Å; Y267-D271 PolarHBondContact O-N 3.21Å; Y267-T272 PolarHBondContact N-O 2.93Å; Y267-E274 HydrophobicContact CE2-CB 3.87Å; Y267-E274 WeakPolarHBondContact CE2-OE2 3.25Å; Y267-E274 PolarHBondContact OH-OE2 3.45Å; Y267-R294 HydrophobicContact CD2-CG 4.12Å; Y267-R294 HydrophobicContact CE2-CG 4.03Å
268	L	93.1	Very high	93.5	Very high	5 Å²	5	35.2 Å²	35.2	3%	0.026	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-19.5	-177.6	-68.8	175.3	0	0	0	113.6	Q234 F238 Q241 L243 Y266 D270 A326 Y354	Q234-L268 PolarHBondContact NE2-O 2.62Å; Q234-L268 VanDerWaalsContact NE2-O 3.1Å; F238-L268 HydrophobicContact CB-CB 3.65Å; F238-L268 HydrophobicContact CD1-CB 4.11Å; F238-L268 HydrophobicContact CD1-CD1 4.06Å; F238-L268 HydrophobicContact CG-CB 3.89Å; Q241-L268 HydrophobicContact CB-CD1 3.92Å; Q241-L268 PolarHBondContact O-N 3.32Å; L243-L268 HydrophobicContact CD1-CD2 3.79Å; L243-L268 HydrophobicContact CD1-CG 4.34Å; L243-L268 HydrophobicContact CD2-CD1 4.13Å; L243-L268 HydrophobicContact CG-CD1 4.25Å; L243-L268 HydrophobicContact CG-CD2 4.08Å; L243-L268 HydrophobicContact CG-CG 4.08Å; Y266-L268 HydrophobicContact CD1-CD2 4.07Å; Y266-L268 HydrophobicContact CE1-CD2 3.99Å; L268-D270 VanDerWaalsContact C-N 3.33Å; L268-D270 PolarHBondContact O-N 3.42Å; L268-A326 HydrophobicContact CD2-CB 4.48Å; L268-Y354 HydrophobicContact CD1-CD2 3.87Å; L268-Y354 HydrophobicContact CD1-CE1 4.31Å; L268-Y354 HydrophobicContact CD1-CE2 3.4Å; L268-Y354 HydrophobicContact CD2-CE1 3.99Å; L268-Y354 HydrophobicContact CD2-CE2 4.26Å; L268-Y354 WeakPolarHBondContact CD2-OH 3.48Å; L268-Y354 HydrophobicContact CG-CE2 4.49Å
269	M	92.4	Very high	93.7	Very high	43 Å²	43	33.3 Å²	33.3	21%	0.212	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-29	-177.1	77.4	-173.9	-135.4	0	0	113.3	F235 Y267 R294	F235-M269 HydrophobicContact CD2-CB 4.25Å; F235-M269 HydrophobicContact CD2-CE 4.15Å; F235-M269 HydrophobicContact CD2-CG 4.44Å; F235-M269 HydrophobicContact CD2-SD 4.13Å; F235-M269 HydrophobicContact CE2-CE 4.05Å; F235-M269 HydrophobicContact CE2-SD 4.1Å; Y267-M269 PolarHBondContact O-N 3.19Å; M269-R294 PolarHBondContact SD-NH2 2.56Å
270	D	90.3	Very high	93.7	Very high	58 Å²	58	37.5 Å²	37.5	31%	0.31	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-145.7	10.6	-173.3	60.2	-0.9	0	0	0	113.6	Y267 L268 T272 R294	Y267-D270 WeakPolarHBondContact CB-OD1 3.49Å; L268-D270 VanDerWaalsContact C-N 3.33Å; L268-D270 PolarHBondContact O-N 3.42Å; D270-T272 HydrophobicContact CB-CG2 4.22Å; D270-T272 VanDerWaalsContact CG-CG2 3.47Å; D270-T272 VanDerWaalsContact CG-OG1 3.29Å; D270-T272 PolarHBondContact O-N 3.27Å; D270-T272 WeakPolarHBondContact OD1-CB 3.46Å; D270-T272 WeakPolarHBondContact OD1-CG2 3.45Å; D270-T272 PolarHBondContact OD1-N 3.29Å; D270-T272 PolarHBondContact OD1-OG1 3.46Å; D270-T272 PolarHBondContact OD2-OG1 3.02Å; D270-R294 IonicContact OD1-CZ 3.82Å; D270-R294 IonicContact OD1-NE 3.71Å; D270-R294 IonicContact OD1-NH2 3.46Å; D270-R294 PolarHBondContact OD1-NH2 2.83Å; D270-R294 IonicContact OD2-CZ 2.75Å; D270-R294 VanDerWaalsContact OD2-CZ 3.28Å; D270-R294 IonicContact OD2-NE 3.56Å; D270-R294 IonicContact OD2-NH2 3.77Å; D270-R294 PolarHBondContact OD2-NH2 2.74Å
271	D	91.3	Very high	93.8	Very high	44 Å²	44	45.9 Å²	45.9	24%	0.235	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	33.4	179.3	-58.9	-41.5	0	0	0	113.7	Q234 Y266 Y267	Q234-D271 PolarHBondContact NE2-OD1 2.62Å; Q234-D271 PolarHBondContact NE2-OD2 2.65Å; Y266-D271 WeakPolarHBondContact OH-CB 3.35Å; Y266-D271 PolarHBondContact OH-OD1 3.23Å; Y266-D271 VanDerWaalsContact OH-OD1 3.14Å; Y267-D271 VanDerWaalsContact O-CA 3.29Å; Y267-D271 WeakPolarHBondContact O-CA 3.36Å; Y267-D271 PolarHBondContact O-N 3.21Å
272	T	93.9	Very high	93.6	Very high	15 Å²	15	51.7 Å²	51.7	9%	0.092	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	153.9	178.5	59.1	0	0	0	0	112.5	Y266 Y267 D270 R294 R296	Y266-T272 WeakPolarHBondContact CA-O 3.37Å; Y267-T272 PolarHBondContact N-O 2.93Å; D270-T272 HydrophobicContact CB-CG2 4.22Å; D270-T272 VanDerWaalsContact CG-CG2 3.47Å; D270-T272 VanDerWaalsContact CG-OG1 3.29Å; D270-T272 PolarHBondContact O-N 3.27Å; D270-T272 WeakPolarHBondContact OD1-CB 3.46Å; D270-T272 WeakPolarHBondContact OD1-CG2 3.45Å; D270-T272 PolarHBondContact OD1-N 3.29Å; D270-T272 PolarHBondContact OD1-OG1 3.46Å; D270-T272 PolarHBondContact OD2-OG1 3.02Å; T272-R294 WeakPolarHBondContact OG1-CG 3.47Å; T272-R294 PolarHBondContact OG1-NE 2.81Å; T272-R294 PolarHBondContact OG1-NH2 3Å; T272-R296 HydrophobicContact CG2-CB 4.36Å
273	V	95.2	Very high	93.3	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.4	-179	-169.4	0	0	0	0	109.8	I264 H265 Y266 I275 M292 R294 Q295 M297 F329	I264-V273 HydrophobicContact CG2-CG1 3.8Å; H265-V273 CarbonylContact O-C 3.56Å; H265-V273 WeakPolarHBondContact O-CA 3.47Å; Y266-V273 HydrophobicContact CD2-CG2 3.82Å; Y266-V273 HydrophobicContact CE2-CG2 4.21Å; V273-I275 HydrophobicContact CG1-CG1 4.5Å; V273-M292 HydrophobicContact CB-CE 4.01Å; V273-M292 HydrophobicContact CG1-CE 4.02Å; V273-M292 WeakPolarHBondContact O-CE 3.41Å; V273-R294 WeakPolarHBondContact O-CA 3.33Å; V273-Q295 PolarHBondContact N-O 3.17Å; V273-Q295 PolarHBondContact O-N 2.74Å; V273-M297 HydrophobicContact CB-CG 3.85Å; V273-M297 HydrophobicContact CG2-CB 4.3Å; V273-M297 HydrophobicContact CG2-CG 3.97Å; V273-F329 HydrophobicContact CG1-CE1 4.39Å; V273-F329 HydrophobicContact CG1-CZ 4.35Å; V273-F329 HydrophobicContact CG2-CZ 3.85Å
274	E	95.4	Very high	92.8	Very high	13 Å²	13	56.6 Å²	56.6	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.1	173.5	-178.5	-164.9	139.9	0	0	108.5	H265 Y267 R276 L290 R294	H265-E274 HydrophobicContact CB-CB 4.31Å; H265-E274 PolarHBondContact N-O 3.42Å; H265-E274 PolarHBondContact O-N 2.63Å; Y267-E274 HydrophobicContact CE2-CB 3.87Å; Y267-E274 WeakPolarHBondContact CE2-OE2 3.25Å; Y267-E274 PolarHBondContact OH-OE2 3.45Å; E274-R276 WeakPolarHBondContact OE1-CD 3.3Å; E274-R276 WeakPolarHBondContact OE1-CG 3.34Å; E274-R276 IonicContact OE1-CZ 2.84Å; E274-R276 IonicContact OE1-NE 2.8Å; E274-R276 PolarHBondContact OE1-NE 2.6Å; E274-R276 IonicContact OE1-NH1 3.57Å; E274-R276 PolarHBondContact OE1-NH1 3.12Å; E274-L290 HydrophobicContact CG-CD2 3.54Å; E274-L290 VanDerWaalsContact OE1-CD2 3.27Å; E274-L290 WeakPolarHBondContact OE1-CD2 3.46Å; E274-R294 HydrophobicContact CB-CB 4.08Å; E274-R294 HydrophobicContact CB-CG 4.49Å; E274-R294 HydrophobicContact CG-CB 4.36Å
275	I	96.5	Very high	92.3	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.9	179	-56.3	175.6	0	0	0	108.7	Y262 I263 I264 V273 L291 M292 V337 F342	Y262-I275 HydrophobicContact CD1-CG2 3.91Å; Y262-I275 HydrophobicContact CG-CG2 4.34Å; I263-I275 WeakPolarHBondContact O-CA 3.27Å; I264-I275 HydrophobicContact CG1-CG1 4.31Å; I264-I275 HydrophobicContact CG2-CG1 4.47Å; V273-I275 HydrophobicContact CG1-CG1 4.5Å; I275-L291 HydrophobicContact CB-CB 4.4Å; I275-L291 HydrophobicContact CG2-CB 4.07Å; I275-L291 HydrophobicContact CG2-CD2 4.04Å; I275-L291 PolarHBondContact O-N 3.42Å; I275-M292 HydrophobicContact CB-CB 3.93Å; I275-M292 HydrophobicContact CD1-CB 4.36Å; I275-M292 HydrophobicContact CD1-CE 4.09Å; I275-M292 HydrophobicContact CD1-SD 4.14Å; I275-M292 HydrophobicContact CG1-CB 4.24Å; I275-M292 HydrophobicContact CG1-CE 3.98Å; I275-M292 PolarHBondContact N-O 3.14Å; I275-M292 VanDerWaalsContact N-O 3.14Å; I275-M292 PolarHBondContact O-N 2.7Å; I275-M292 VanDerWaalsContact O-N 3.08Å; I275-V337 HydrophobicContact CD1-CB 4.41Å; I275-V337 HydrophobicContact CD1-CG1 4.16Å; I275-F342 HydrophobicContact CD1-CE2 3.99Å; I275-F342 HydrophobicContact CD1-CZ 4.15Å; I275-F342 HydrophobicContact CG2-CE1 4.43Å
276	R	95.1	Very high	91.9	Very high	95 Å²	95	64 Å²	64	36%	0.358	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	137.6	179.1	-72.2	-175.2	126.5	119.4	-8.1	111.3	Y262 I263 E274 L290	Y262-R276 WeakPolarHBondContact CA-O 3.48Å; I263-R276 HydrophobicContact CB-CB 4.37Å; I263-R276 PolarHBondContact N-O 3.46Å; I263-R276 PolarHBondContact O-N 3.14Å; E274-R276 WeakPolarHBondContact OE1-CD 3.3Å; E274-R276 WeakPolarHBondContact OE1-CG 3.34Å; E274-R276 IonicContact OE1-CZ 2.84Å; E274-R276 IonicContact OE1-NE 2.8Å; E274-R276 PolarHBondContact OE1-NE 2.6Å; E274-R276 IonicContact OE1-NH1 3.57Å; E274-R276 PolarHBondContact OE1-NH1 3.12Å; R276-L290 HydrophobicContact CG-CD2 3.76Å
277	E	93	Very high	91.6	Very high	34 Å²	34	68.7 Å²	68.7	16%	0.159	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	140.9	170.7	-53.4	-137	128.1	0	0	109.4	Y262 H279 L291	Y262-E277 HydrophobicContact CD1-CG 4.29Å; Y262-E277 HydrophobicContact CE1-CB 4.23Å; Y262-E277 HydrophobicContact CE1-CG 3.67Å; Y262-E277 WeakPolarHBondContact CE1-OE1 3.29Å; Y262-E277 PolarHBondContact OH-OE1 3.46Å; E277-H279 IonicContact OE2-CE1 3.46Å; E277-L291 HydrophobicContact CG-CB 3.91Å; E277-L291 HydrophobicContact CG-CD1 4.47Å; E277-L291 WeakPolarHBondContact OE1-CD1 3.32Å
278	V	92.5	Very high	91.3	Very high	61 Å²	61	72.7 Å²	72.7	37%	0.37	37%	0.371	S	S	.	.			trans	-104.6	116.2	170.3	-179.1	0	0	0	0	107.7	T261 I263	T261-V278 PolarHBondContact O-N 2.92Å; I263-V278 HydrophobicContact CD1-CG2 3.58Å; I263-V278 HydrophobicContact CG1-CG2 3.59Å
279	H	89.9	Confident	91.1	Very high	61 Å²	61	76.3 Å²	76.3	28%	0.282	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-95.3	136.5	177.7	-69.3	-74.7	0	0	0	111.1	E277 D283 F288	E277-H279 IonicContact OE2-CE1 3.46Å; H279-D283 IonicContact CE1-OD2 3.31Å; H279-D283 IonicContact CG-OD2 3.15Å; H279-D283 IonicContact ND1-OD2 2.97Å; H279-D283 PolarHBondContact ND1-OD2 3.27Å; H279-F288 PolarHBondContact NE2-N 3.46Å; H279-F288 PolarHBondContact NE2-O 2.91Å
280	E	89.2	Confident	91.1	Very high	142 Å²	142	77.7 Å²	77.7	66%	0.664	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-98	162.2	171.3	-64.3	-170.2	168	0	0	110.6	N282 D283	E280-N282 PolarHBondContact O-N 3.12Å; E280-D283 PolarHBondContact O-N 2.97Å
281	R	91.6	Very high	91.2	Very high	238 Å²	238	77.3 Å²	77.3	90%	0.898	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	129.9	176	-69	-177.8	-178.9	-179.4	0.8	109.1	D283	R281-D283 VanDerWaalsContact C-N 3.35Å
282	N	90.3	Very high	91.3	Very high	169 Å²	169	75.6 Å²	75.6	90%	0.904	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	35.7	-178.8	-48.4	-41.2	0	0	0	113.6	E280 G284	E280-N282 PolarHBondContact O-N 3.12Å; N282-G284 PolarHBondContact O-N 3.02Å
283	D	87.6	Confident	91.3	Very high	60 Å²	60	80 Å²	80	32%	0.321	41%	0.414	S	S	.	.			trans	-72.5	-11.4	174.9	72.6	-12	0	0	0	114.1	H279 E280 R281 R285	H279-D283 IonicContact CE1-OD2 3.31Å; H279-D283 IonicContact CG-OD2 3.15Å; H279-D283 IonicContact ND1-OD2 2.97Å; H279-D283 PolarHBondContact ND1-OD2 3.27Å; E280-D283 PolarHBondContact O-N 2.97Å; R281-D283 VanDerWaalsContact C-N 3.35Å; D283-R285 VanDerWaalsContact C-N 3.32Å; D283-R285 PolarHBondContact O-N 3.45Å; D283-R285 PolarHBondContact OD1-N 2.9Å
284	G	87.2	Confident	91.2	Very high	81 Å²	81	84.5 Å²	84.5	84%	0.835	43%	0.431	S	S	*	.			trans	76.1	13.7	178.2	0	0	0	0	0	114.6	N282	N282-G284 PolarHBondContact O-N 3.02Å
285	R	85.2	Confident	91	Very high	74 Å²	74	87.1 Å²	87.1	28%	0.279	44%	0.443	S	S	.	.	S	Bend	trans	-111.2	158.7	-179.4	-62.5	-168.8	-173.4	159.9	13.4	112.8	E258 R260 D283	E258-R285 IonicContact OE2-CZ 3.85Å; E258-R285 IonicContact OE2-NH2 3.77Å; E258-R285 PolarHBondContact OE2-NH2 2.79Å; R260-R285 VanDerWaalsContact CD-NH1 3.31Å; R260-R285 VanDerWaalsContact NH1-NH1 3.13Å; D283-R285 VanDerWaalsContact C-N 3.32Å; D283-R285 PolarHBondContact O-N 3.45Å; D283-R285 PolarHBondContact OD1-N 2.9Å
286	D	89.4	Confident	90.8	Very high	107 Å²	107	92 Å²	92	57%	0.572	46%	0.461	S	S	*	.			trans	-69.8	127	170.2	-163.5	10.1	0	0	0	108.7	F288	D286-F288 VanDerWaalsContact C-N 3.34Å; D286-F288 HydrophobicContact CB-CD2 3.95Å; D286-F288 HydrophobicContact CB-CE2 3.74Å; D286-F288 PolarHBondContact O-N 3.01Å; D286-F288 WeakPolarHBondContact OD2-CE2 3.46Å; D286-F288 WeakPolarHBondContact OD2-CZ 3.37Å
287	P	89.7	Confident	90.5	Very high	99 Å²	99	87.8 Å²	87.8	64%	0.643	45%	0.445	S	S	*	.			trans	-70.6	83.8	-175.5	27.7	-38.5	0	0	0	112.5
288	F	88.5	Confident	90.3	Very high	122 Å²	122	87.4 Å²	87.4	54%	0.535	45%	0.446	S	S	.	.			trans	-97.1	120.1	171.8	-75.9	-69.5	0	0	0	111.1	H279 D286 L290	H279-F288 PolarHBondContact NE2-N 3.46Å; H279-F288 PolarHBondContact NE2-O 2.91Å; D286-F288 VanDerWaalsContact C-N 3.34Å; D286-F288 HydrophobicContact CB-CD2 3.95Å; D286-F288 HydrophobicContact CB-CE2 3.74Å; D286-F288 PolarHBondContact O-N 3.01Å; D286-F288 WeakPolarHBondContact OD2-CE2 3.46Å; D286-F288 WeakPolarHBondContact OD2-CZ 3.37Å; F288-L290 VanDerWaalsContact C-N 3.27Å; F288-L290 PolarHBondContact O-N 3.24Å
289	P	88.8	Confident	90.1	Very high	81 Å²	81	88 Å²	88	53%	0.526	44%	0.444	S	S	.	.	S	Bend	trans	-72.3	-17.1	-171.8	28.7	-36.2	0	0	0	114.6
290	L	92.4	Very high	89.8	Confident	72 Å²	72	88.1 Å²	88.1	38%	0.377	45%	0.449	S	S	.	.			trans	-131.1	131	-170.2	-72.2	160.8	0	0	0	109.9	E274 R276 F288	E274-L290 HydrophobicContact CG-CD2 3.54Å; E274-L290 VanDerWaalsContact OE1-CD2 3.27Å; E274-L290 WeakPolarHBondContact OE1-CD2 3.46Å; R276-L290 HydrophobicContact CG-CD2 3.76Å; F288-L290 VanDerWaalsContact C-N 3.27Å; F288-L290 PolarHBondContact O-N 3.24Å
291	L	92.8	Very high	89.4	Confident	51 Å²	51	85.1 Å²	85.1	27%	0.267	44%	0.436	S	S	.	.	S	Bend	trans	-85.1	-41.3	164.4	-172.1	64.9	0	0	0	111.1	Y262 I275 E277 F342	Y262-L291 HydrophobicContact CD1-CB 4.31Å; Y262-L291 HydrophobicContact CD1-CD2 3.92Å; Y262-L291 HydrophobicContact CE1-CB 3.94Å; Y262-L291 HydrophobicContact CE1-CD1 4.19Å; Y262-L291 HydrophobicContact CE1-CD2 3.43Å; Y262-L291 VanDerWaalsContact CE1-CD2 3.43Å; Y262-L291 HydrophobicContact CE1-CG 4.02Å; I275-L291 HydrophobicContact CB-CB 4.4Å; I275-L291 HydrophobicContact CG2-CB 4.07Å; I275-L291 HydrophobicContact CG2-CD2 4.04Å; I275-L291 PolarHBondContact O-N 3.42Å; E277-L291 HydrophobicContact CG-CB 3.91Å; E277-L291 HydrophobicContact CG-CD1 4.47Å; E277-L291 WeakPolarHBondContact OE1-CD1 3.32Å; L291-F342 HydrophobicContact CD2-CE1 4.13Å; L291-F342 HydrophobicContact CD2-CZ 3.71Å
292	M	93.4	Very high	88.8	Confident	8 Å²	8	76.7 Å²	76.7	4%	0.039	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	122.7	-177.6	-168.7	-173.7	80.5	0	0	109	V273 I275 Q295 M297 V337 L338	V273-M292 HydrophobicContact CB-CE 4.01Å; V273-M292 HydrophobicContact CG1-CE 4.02Å; V273-M292 WeakPolarHBondContact O-CE 3.41Å; I275-M292 HydrophobicContact CB-CB 3.93Å; I275-M292 HydrophobicContact CD1-CB 4.36Å; I275-M292 HydrophobicContact CD1-CE 4.09Å; I275-M292 HydrophobicContact CD1-SD 4.14Å; I275-M292 HydrophobicContact CG1-CB 4.24Å; I275-M292 HydrophobicContact CG1-CE 3.98Å; I275-M292 PolarHBondContact N-O 3.14Å; I275-M292 VanDerWaalsContact N-O 3.14Å; I275-M292 PolarHBondContact O-N 2.7Å; I275-M292 VanDerWaalsContact O-N 3.08Å; M292-Q295 HydrophobicContact CE-CG 4.48Å; M292-M297 HydrophobicContact CE-CG 3.88Å; M292-M297 HydrophobicContact CE-SD 3.7Å; M292-M297 HydrophobicContact SD-CE 3.97Å; M292-M297 HydrophobicContact SD-CG 4.45Å; M292-M297 HydrophobicContact SD-SD 3.64Å; M292-M297 VanDerWaalsContact SD-SD 3.64Å; M292-V337 HydrophobicContact SD-CG1 3.86Å; M292-L338 HydrophobicContact CG-CD1 4.42Å; M292-L338 HydrophobicContact SD-CD1 3.94Å
293	N	93.1	Very high	87.7	Confident	108 Å²	108	77.3 Å²	77.3	58%	0.578	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59	149.9	170.7	37.9	-37.5	0	0	0	111.3	Q295	N293-Q295 PolarHBondContact O-N 3.12Å; N293-Q295 VanDerWaalsContact O-N 3.16Å
294	R	94.2	Very high	86.3	Confident	96 Å²	96	81 Å²	81	36%	0.362	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	115.4	-179.4	-177.9	-178.7	179.2	-163.7	1.4	110.3	Y267 M269 D270 T272 V273 E274	Y267-R294 HydrophobicContact CD2-CG 4.12Å; Y267-R294 HydrophobicContact CE2-CG 4.03Å; M269-R294 PolarHBondContact SD-NH2 2.56Å; D270-R294 IonicContact OD1-CZ 3.82Å; D270-R294 IonicContact OD1-NE 3.71Å; D270-R294 IonicContact OD1-NH2 3.46Å; D270-R294 PolarHBondContact OD1-NH2 2.83Å; D270-R294 IonicContact OD2-CZ 2.75Å; D270-R294 VanDerWaalsContact OD2-CZ 3.28Å; D270-R294 IonicContact OD2-NE 3.56Å; D270-R294 IonicContact OD2-NH2 3.77Å; D270-R294 PolarHBondContact OD2-NH2 2.74Å; T272-R294 WeakPolarHBondContact OG1-CG 3.47Å; T272-R294 PolarHBondContact OG1-NE 2.81Å; T272-R294 PolarHBondContact OG1-NH2 3Å; V273-R294 WeakPolarHBondContact O-CA 3.33Å; E274-R294 HydrophobicContact CB-CB 4.08Å; E274-R294 HydrophobicContact CB-CG 4.49Å; E274-R294 HydrophobicContact CG-CB 4.36Å
295	Q	91.6	Very high	84.8	Confident	68 Å²	68	79.3 Å²	79.3	32%	0.318	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	161.1	179.4	67.1	-172.1	-1.3	0	0	110.9	V273 M292 N293 M297	V273-Q295 PolarHBondContact N-O 3.17Å; V273-Q295 PolarHBondContact O-N 2.74Å; M292-Q295 HydrophobicContact CE-CG 4.48Å; N293-Q295 PolarHBondContact O-N 3.12Å; N293-Q295 VanDerWaalsContact O-N 3.16Å; Q295-M297 HydrophobicContact CG-SD 3.47Å; Q295-M297 WeakPolarHBondContact CG-SD 3.35Å; Q295-M297 PolarHBondContact NE2-SD 2.97Å
296	R	90.4	Very high	83.2	Confident	106 Å²	106	85.6 Å²	85.6	40%	0.4	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-77.9	128.9	174.2	-156.5	-173.9	-179.1	-167.9	1.7	108.7	T272 D317 W323	T272-R296 HydrophobicContact CG2-CB 4.36Å; R296-D317 IonicContact NH1-OD1 2.62Å; R296-D317 PolarHBondContact NH1-OD1 3.36Å; R296-W323 HydrophobicContact CB-CE3 4.13Å; R296-W323 HydrophobicContact CB-CH2 4.49Å; R296-W323 HydrophobicContact CB-CZ3 3.8Å; R296-W323 HydrophobicContact CG-CD2 4.16Å; R296-W323 HydrophobicContact CG-CE3 3.5Å; R296-W323 VanDerWaalsContact CG-CE3 3.5Å; R296-W323 HydrophobicContact CG-CH2 4.47Å; R296-W323 HydrophobicContact CG-CZ3 3.69Å
297	M	90.3	Very high	81.6	Confident	5 Å²	5	85.1 Å²	85.1	3%	0.025	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-102.4	122.5	-171.8	-67.5	-52.4	-59.9	0	0	112.1	V273 M292 Q295 Y324 V337 L338	V273-M297 HydrophobicContact CB-CG 3.85Å; V273-M297 HydrophobicContact CG2-CB 4.3Å; V273-M297 HydrophobicContact CG2-CG 3.97Å; M292-M297 HydrophobicContact CE-CG 3.88Å; M292-M297 HydrophobicContact CE-SD 3.7Å; M292-M297 HydrophobicContact SD-CE 3.97Å; M292-M297 HydrophobicContact SD-CG 4.45Å; M292-M297 HydrophobicContact SD-SD 3.64Å; M292-M297 VanDerWaalsContact SD-SD 3.64Å; Q295-M297 HydrophobicContact CG-SD 3.47Å; Q295-M297 WeakPolarHBondContact CG-SD 3.35Å; Q295-M297 PolarHBondContact NE2-SD 2.97Å; M297-Y324 HydrophobicContact CB-CD2 3.71Å; M297-Y324 HydrophobicContact CB-CG 4.47Å; M297-Y324 WeakPolarHBondContact O-CD2 3.38Å; M297-Y324 PolarHBondContact O-N 3.5Å; M297-V337 HydrophobicContact CE-CG1 3.61Å; M297-L338 HydrophobicContact CE-CD1 4.02Å; M297-L338 HydrophobicContact CE-CD2 3.73Å; M297-L338 HydrophobicContact CE-CG 3.58Å
298	P	89.3	Confident	79.9	Confident	27 Å²	27	88.1 Å²	88.1	18%	0.175	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	136	172.4	30.4	-33.1	0	0	0	109.9	L301 I315 V320 W323	P298-L301 HydrophobicContact CB-CD2 3.78Å; P298-L301 HydrophobicContact CB-CG 4.34Å; P298-L301 HydrophobicContact CG-CD2 4.04Å; P298-I315 HydrophobicContact CG-CD1 4.3Å; P298-V320 HydrophobicContact CB-CB 4.45Å; P298-V320 HydrophobicContact CB-CG1 3.69Å; P298-V320 HydrophobicContact CB-CG2 3.88Å; P298-W323 HydrophobicContact CB-CE3 4.47Å; P298-W323 HydrophobicContact CB-CZ3 4.32Å
299	K	86.6	Confident	78.5	Confident	74 Å²	74	86 Å²	86	32%	0.322	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-45.7	175.8	-179.9	178	166.4	-172.6	0	110.9	E322 Y324 D328	K299-E322 WeakPolarHBondContact CA-O 3.42Å; K299-E322 HydrophobicContact CB-CB 4.44Å; K299-E322 WeakPolarHBondContact CB-O 3.24Å; K299-E322 HydrophobicContact CD-CG 4.19Å; K299-E322 PolarHBondContact N-O 2.96Å; K299-E322 IonicContact NZ-OE1 2.81Å; K299-E322 PolarHBondContact NZ-OE1 2.98Å; K299-E322 IonicContact NZ-OE2 3.82Å; K299-Y324 HydrophobicContact CB-CD1 4.26Å; K299-Y324 HydrophobicContact CB-CD2 3.9Å; K299-Y324 HydrophobicContact CB-CE1 4.21Å; K299-Y324 HydrophobicContact CB-CE2 3.89Å; K299-Y324 HydrophobicContact CB-CG 4.12Å; K299-Y324 HydrophobicContact CD-CD1 4.22Å; K299-Y324 HydrophobicContact CD-CE1 4.1Å; K299-Y324 HydrophobicContact CG-CD1 4.32Å; K299-Y324 HydrophobicContact CG-CE1 3.93Å; K299-Y324 HydrophobicContact CG-CE2 4.29Å; K299-D328 IonicContact NZ-OD1 3.9Å; K299-D328 PolarHBondContact NZ-OD1 3.37Å; K299-D328 IonicContact NZ-OD2 3.39Å
300	V	84.6	Confident	77.1	Confident	63 Å²	63	89.4 Å²	89.4	38%	0.382	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	123.9	176.3	-174.6	0	0	0	0	109.4	L321 E322	V300-L321 HydrophobicContact CB-CB 4.19Å; V300-L321 HydrophobicContact CG1-CB 4.2Å; V300-L321 HydrophobicContact CG1-CD1 4.27Å; V300-L321 PolarHBondContact O-N 2.96Å; V300-E322 HydrophobicContact CB-CB 4.31Å; V300-E322 HydrophobicContact CG2-CB 4.34Å; V300-E322 PolarHBondContact N-O 3.36Å; V300-E322 PolarHBondContact O-N 2.82Å
301	L	80.9	Confident	75.6	Confident	78 Å²	78	91.3 Å²	91.3	41%	0.408	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	147.1	174.2	-66.9	169.5	0	0	0	110	P298 E303 I315 V320	P298-L301 HydrophobicContact CB-CD2 3.78Å; P298-L301 HydrophobicContact CB-CG 4.34Å; P298-L301 HydrophobicContact CG-CD2 4.04Å; L301-E303 PolarHBondContact O-N 2.79Å; L301-I315 HydrophobicContact CD2-CG2 4.09Å; L301-V320 HydrophobicContact CD2-CG2 4.09Å
302	V	79.3	Confident	74	Confident	61 Å²	61	93.9 Å²	93.9	37%	0.37	48%	0.48	S	S	.	.			trans	-71.7	118	175.3	178.8	0	0	0	0	109.5	N304 E319 L321	V302-N304 PolarHBondContact O-N 2.82Å; V302-E319 WeakPolarHBondContact CG2-O 3.38Å; V302-E319 PolarHBondContact N-O 3.24Å; V302-L321 HydrophobicContact CB-CD1 4.4Å; V302-L321 HydrophobicContact CG2-CB 4.48Å; V302-L321 HydrophobicContact CG2-CD1 3.65Å; V302-L321 HydrophobicContact CG2-CG 3.76Å
303	E	67.4	Low	72.6	Confident	182 Å²	182	98.8 Å²	98.8	85%	0.85	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-7.6	-173.3	-66.7	-167.7	155.5	0	0	115.4	L301	L301-E303 PolarHBondContact O-N 2.79Å
304	N	57.2	Low	71.5	Confident	138 Å²	138	102.4 Å²	102.4	74%	0.738	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.4	40.9	-171.1	-74.2	-59.6	0	0	0	114.9	V302 K306	V302-N304 PolarHBondContact O-N 2.82Å; N304-K306 PolarHBondContact O-N 2.86Å; N304-K306 VanDerWaalsContact O-N 3.08Å
305	A	55.7	Low	70.4	Confident	45 Å²	45	101 Å²	101	37%	0.372	52%	0.518	S	S	.	.			trans	-72.6	101.4	165.5	0	0	0	0	0	109	N307 E319	A305-N307 PolarHBondContact O-N 2.85Å; A305-E319 HydrophobicContact CB-CG 4.06Å
306	K	52.2	Low	69.5	Low	206 Å²	206	99.8 Å²	99.8	90%	0.896	52%	0.517	S	S	*	.			trans	-69	29.8	167.8	-68.8	-177.7	177.1	178.1	0	112.3	N304	N304-K306 PolarHBondContact O-N 2.86Å; N304-K306 VanDerWaalsContact O-N 3.08Å
307	N	55.3	Low	68.7	Low	97 Å²	97	100.1 Å²	100.1	52%	0.519	53%	0.527	S	S	.	.	S	Bend	trans	-86.3	156.2	173.9	-72.3	-12.3	0	0	0	108.7	A305	A305-N307 PolarHBondContact O-N 2.85Å
308	F	53.2	Low	67.9	Low	163 Å²	163	107.8 Å²	107.8	72%	0.715	56%	0.562	S	S	*	*	S	Bend	trans	-37.5	150.3	-175.1	-113.8	-111.9	0	0	0	114.7	Q310 L313	F308-Q310 PolarHBondContact O-N 2.89Å; F308-L313 HydrophobicContact CB-CD1 4.1Å
309	P	60.9	Low	67.1	Low	76 Å²	76	108.6 Å²	108.6	49%	0.494	56%	0.564	S	S	.	*			trans	-55.5	135.3	-172.4	24.6	-36	0	0	0	112.9	C311 V312	P309-C311 PolarHBondContact O-N 3.09Å; P309-V312 HydrophobicContact CG-CG2 4.49Å; P309-V312 PolarHBondContact O-N 2.64Å; P309-V312 VanDerWaalsContact O-N 3.07Å
310	Q	58.7	Low	66.9	Low	153 Å²	153	105.7 Å²	105.7	72%	0.715	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-11.7	179.7	-163.2	173.9	7.1	0	0	114.3	F308 V312	F308-Q310 PolarHBondContact O-N 2.89Å; Q310-V312 VanDerWaalsContact C-N 3.29Å; Q310-V312 PolarHBondContact O-N 2.67Å
311	C	60.9	Low	66.8	Low	113 Å²	113	108.7 Å²	108.7	76%	0.764	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-12.2	175.4	62.5	0	0	0	0	114.3	P309	P309-C311 PolarHBondContact O-N 3.09Å
312	V	58.8	Low	67.2	Low	104 Å²	104	109.1 Å²	109.1	63%	0.63	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	-28.1	-174	-170.4	0	0	0	0	113.8	P309 Q310	P309-V312 HydrophobicContact CG-CG2 4.49Å; P309-V312 PolarHBondContact O-N 2.64Å; P309-V312 VanDerWaalsContact O-N 3.07Å; Q310-V312 VanDerWaalsContact C-N 3.29Å; Q310-V312 PolarHBondContact O-N 2.67Å
313	L	63.9	Low	67.7	Low	111 Å²	111	108.4 Å²	108.4	58%	0.581	56%	0.556	S	S	*	*	S	Bend	trans	-121.6	143.1	-175.6	-69	170.5	0	0	0	111.3	F308	F308-L313 HydrophobicContact CB-CD1 4.1Å
314	E	69.7	Low	68.8	Low	184 Å²	184	101 Å²	101	86%	0.86	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-67.2	152.2	170.1	-64.3	-178.1	172.3	0	0	110.6	S316	E314-S316 PolarHBondContact O-N 3.32Å; E314-S316 VanDerWaalsContact O-N 3.14Å
315	I	72.3	Confident	70.5	Confident	66 Å²	66	97.7 Å²	97.7	34%	0.338	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-60.4	117.6	179.7	-60.9	170.7	0	0	0	108.7	P298 L301 E319 V320	P298-I315 HydrophobicContact CG-CD1 4.3Å; L301-I315 HydrophobicContact CD2-CG2 4.09Å; I315-E319 HydrophobicContact CG2-CB 4.44Å; I315-V320 HydrophobicContact CG2-CG2 3.41Å; I315-V320 VanDerWaalsContact CG2-CG2 3.41Å
316	S	72.6	Confident	72.2	Confident	43 Å²	43	95.7 Å²	95.7	30%	0.301	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-86.2	157	-179.9	74.5	0	0	0	0	112	E314 Q318 E319	E314-S316 PolarHBondContact O-N 3.32Å; E314-S316 VanDerWaalsContact O-N 3.14Å; S316-Q318 PolarHBondContact O-N 3.05Å; S316-E319 PolarHBondContact N-OE2 3.14Å; S316-E319 PolarHBondContact O-N 2.81Å
317	D	72.8	Confident	74	Confident	114 Å²	114	92.1 Å²	92.1	61%	0.61	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-22.2	175.6	-72.6	-39.9	0	0	0	113.2	R296 E319 W323	R296-D317 IonicContact NH1-OD1 2.62Å; R296-D317 PolarHBondContact NH1-OD1 3.36Å; D317-E319 VanDerWaalsContact C-N 3.33Å; D317-W323 VanDerWaalsContact OD1-CZ2 3.28Å; D317-W323 WeakPolarHBondContact OD1-CZ2 3.48Å
318	Q	73.6	Confident	75.6	Confident	165 Å²	165	89.5 Å²	89.5	77%	0.771	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-19.9	178.6	-61	179.6	2.5	0	0	113.1	S316	S316-Q318 PolarHBondContact O-N 3.05Å
319	E	73.5	Confident	77.5	Confident	45 Å²	45	81.9 Å²	81.9	21%	0.21	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-11.8	-177	-67.4	168	178.6	0	0	112.3	V302 A305 I315 S316 D317	V302-E319 WeakPolarHBondContact CG2-O 3.38Å; V302-E319 PolarHBondContact N-O 3.24Å; A305-E319 HydrophobicContact CB-CG 4.06Å; I315-E319 HydrophobicContact CG2-CB 4.44Å; S316-E319 PolarHBondContact N-OE2 3.14Å; S316-E319 PolarHBondContact O-N 2.81Å; D317-E319 VanDerWaalsContact C-N 3.33Å
320	V	81.1	Confident	78.9	Confident	13 Å²	13	80.1 Å²	80.1	8%	0.079	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.8	-179.2	-173.8	0	0	0	0	110	P298 L301 I315 E322 W323	P298-V320 HydrophobicContact CB-CB 4.45Å; P298-V320 HydrophobicContact CB-CG1 3.69Å; P298-V320 HydrophobicContact CB-CG2 3.88Å; L301-V320 HydrophobicContact CD2-CG2 4.09Å; I315-V320 HydrophobicContact CG2-CG2 3.41Å; I315-V320 VanDerWaalsContact CG2-CG2 3.41Å; V320-E322 WeakPolarHBondContact CG1-O 3.3Å; V320-W323 HydrophobicContact CB-CD2 4.39Å; V320-W323 HydrophobicContact CB-CH2 4.35Å; V320-W323 HydrophobicContact CB-CZ2 3.75Å; V320-W323 HydrophobicContact CG1-CD2 3.71Å; V320-W323 HydrophobicContact CG1-CE3 4.17Å; V320-W323 HydrophobicContact CG1-CG 4.04Å; V320-W323 HydrophobicContact CG1-CH2 4.44Å; V320-W323 HydrophobicContact CG1-CZ2 3.99Å; V320-W323 HydrophobicContact CG2-CH2 3.73Å; V320-W323 HydrophobicContact CG2-CZ2 3.55Å; V320-W323 HydrophobicContact CG2-CZ3 4.35Å
321	L	83.3	Confident	80.5	Confident	126 Å²	126	73.5 Å²	73.5	66%	0.66	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	-45	175.4	-103.5	150.4	0	0	0	111.5	V300 V302	V300-L321 HydrophobicContact CB-CB 4.19Å; V300-L321 HydrophobicContact CG1-CB 4.2Å; V300-L321 HydrophobicContact CG1-CD1 4.27Å; V300-L321 PolarHBondContact O-N 2.96Å; V302-L321 HydrophobicContact CB-CD1 4.4Å; V302-L321 HydrophobicContact CG2-CB 4.48Å; V302-L321 HydrophobicContact CG2-CD1 3.65Å; V302-L321 HydrophobicContact CG2-CG 3.76Å
322	E	88.3	Confident	81.9	Confident	86 Å²	86	69.7 Å²	69.7	40%	0.402	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	131	-176.1	-163.8	-176.6	171.2	0	0	110	K299 V300 V320	K299-E322 WeakPolarHBondContact CA-O 3.42Å; K299-E322 HydrophobicContact CB-CB 4.44Å; K299-E322 WeakPolarHBondContact CB-O 3.24Å; K299-E322 HydrophobicContact CD-CG 4.19Å; K299-E322 PolarHBondContact N-O 2.96Å; K299-E322 IonicContact NZ-OE1 2.81Å; K299-E322 PolarHBondContact NZ-OE1 2.98Å; K299-E322 IonicContact NZ-OE2 3.82Å; V300-E322 HydrophobicContact CB-CB 4.31Å; V300-E322 HydrophobicContact CG2-CB 4.34Å; V300-E322 PolarHBondContact N-O 3.36Å; V300-E322 PolarHBondContact O-N 2.82Å; V320-E322 WeakPolarHBondContact CG1-O 3.3Å
323	W	90	Very high	83.4	Confident	47 Å²	47	70.6 Å²	70.6	18%	0.178	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	146.7	174.2	-67.3	96.7	0	0	0	110.5	R296 P298 D317 V320 T325	R296-W323 HydrophobicContact CB-CE3 4.13Å; R296-W323 HydrophobicContact CB-CH2 4.49Å; R296-W323 HydrophobicContact CB-CZ3 3.8Å; R296-W323 HydrophobicContact CG-CD2 4.16Å; R296-W323 HydrophobicContact CG-CE3 3.5Å; R296-W323 VanDerWaalsContact CG-CE3 3.5Å; R296-W323 HydrophobicContact CG-CH2 4.47Å; R296-W323 HydrophobicContact CG-CZ3 3.69Å; P298-W323 HydrophobicContact CB-CE3 4.47Å; P298-W323 HydrophobicContact CB-CZ3 4.32Å; D317-W323 VanDerWaalsContact OD1-CZ2 3.28Å; D317-W323 WeakPolarHBondContact OD1-CZ2 3.48Å; V320-W323 HydrophobicContact CB-CD2 4.39Å; V320-W323 HydrophobicContact CB-CH2 4.35Å; V320-W323 HydrophobicContact CB-CZ2 3.75Å; V320-W323 HydrophobicContact CG1-CD2 3.71Å; V320-W323 HydrophobicContact CG1-CE3 4.17Å; V320-W323 HydrophobicContact CG1-CG 4.04Å; V320-W323 HydrophobicContact CG1-CH2 4.44Å; V320-W323 HydrophobicContact CG1-CZ2 3.99Å; V320-W323 HydrophobicContact CG2-CH2 3.73Å; V320-W323 HydrophobicContact CG2-CZ2 3.55Å; V320-W323 HydrophobicContact CG2-CZ3 4.35Å; W323-T325 PolarHBondContact O-N 3.41Å; W323-T325 PolarHBondContact O-OG1 3.23Å
324	Y	91.8	Very high	84.7	Confident	27 Å²	27	69.4 Å²	69.4	11%	0.106	36%	0.359	C	S	.	.			trans	-61	126	171.4	-85.4	-70.4	0	0	0	111.1	Y266 M297 K299 D328 L335 T336	Y266-Y324 PolarHBondContact OH-O 3.43Å; M297-Y324 HydrophobicContact CB-CD2 3.71Å; M297-Y324 HydrophobicContact CB-CG 4.47Å; M297-Y324 WeakPolarHBondContact O-CD2 3.38Å; M297-Y324 PolarHBondContact O-N 3.5Å; K299-Y324 HydrophobicContact CB-CD1 4.26Å; K299-Y324 HydrophobicContact CB-CD2 3.9Å; K299-Y324 HydrophobicContact CB-CE1 4.21Å; K299-Y324 HydrophobicContact CB-CE2 3.89Å; K299-Y324 HydrophobicContact CB-CG 4.12Å; K299-Y324 HydrophobicContact CD-CD1 4.22Å; K299-Y324 HydrophobicContact CD-CE1 4.1Å; K299-Y324 HydrophobicContact CG-CD1 4.32Å; K299-Y324 HydrophobicContact CG-CE1 3.93Å; K299-Y324 HydrophobicContact CG-CE2 4.29Å; Y324-D328 HydrophobicContact CD1-CB 3.83Å; Y324-D328 HydrophobicContact CE1-CB 4.26Å; Y324-L335 HydrophobicContact CD1-CD1 4Å; Y324-L335 HydrophobicContact CE1-CD1 3.43Å; Y324-L335 VanDerWaalsContact CE1-CD1 3.43Å; Y324-T336 PolarHBondContact OH-O 2.88Å
325	T	91.8	Very high	85.9	Confident	67 Å²	67	61 Å²	61	41%	0.411	32%	0.32	S	S	.	.			trans	-111.4	158.4	177	-54.4	0	0	0	0	109.4	Y266 W323 K327 D328 F329	Y266-T325 WeakPolarHBondContact OH-CA 3.28Å; W323-T325 PolarHBondContact O-N 3.41Å; W323-T325 PolarHBondContact O-OG1 3.23Å; T325-K327 PolarHBondContact O-N 3.06Å; T325-D328 PolarHBondContact N-OD2 2.97Å; T325-D328 WeakPolarHBondContact O-CB 3.27Å; T325-D328 PolarHBondContact O-N 3.11Å; T325-F329 WeakPolarHBondContact O-CD2 3.37Å
326	A	91	Very high	86.8	Confident	4 Å²	4	61.3 Å²	61.3	3%	0.033	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-46	-36.1	172.9	0	0	0	0	0	112.9	L243 Y266 L268 D328 F329 Y355 F359	L243-A326 HydrophobicContact CD1-CB 3.84Å; Y266-A326 HydrophobicContact CD1-CB 4.21Å; Y266-A326 HydrophobicContact CE1-CB 3.78Å; Y266-A326 VanDerWaalsContact CZ-N 3.29Å; Y266-A326 PolarHBondContact OH-N 3.46Å; Y266-A326 VanDerWaalsContact OH-N 3.14Å; L268-A326 HydrophobicContact CD2-CB 4.48Å; A326-D328 PolarHBondContact O-N 3.42Å; A326-D328 VanDerWaalsContact O-N 3.12Å; A326-F329 PolarHBondContact O-N 3.22Å; A326-F329 VanDerWaalsContact O-N 3.12Å; A326-Y355 PolarHBondContact O-OH 3Å; A326-F359 HydrophobicContact CB-CE2 4.27Å; A326-F359 HydrophobicContact CB-CZ 4.13Å
327	K	89.8	Confident	87.6	Confident	130 Å²	130	59.6 Å²	59.6	57%	0.565	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-58.5	-26.5	178.5	-67.5	-178	-179.1	179	0	115.1	T325 F329 I330 F359	T325-K327 PolarHBondContact O-N 3.06Å; K327-F329 VanDerWaalsContact C-N 3.31Å; K327-I330 WeakPolarHBondContact O-CD1 3.46Å; K327-I330 WeakPolarHBondContact O-CG1 3.5Å; K327-F359 HydrophobicContact CD-CD1 4.39Å; K327-F359 HydrophobicContact CD-CE1 3.97Å; K327-F359 HydrophobicContact CG-CD1 3.91Å; K327-F359 HydrophobicContact CG-CE1 3.34Å; K327-F359 HydrophobicContact CG-CE2 4.34Å; K327-F359 HydrophobicContact CG-CZ 3.59Å
328	D	90.5	Very high	88.3	Confident	43 Å²	43	60.2 Å²	60.2	23%	0.23	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-76.4	-22	-178.2	-61.2	-56.8	0	0	0	112	K299 Y324 T325 A326 I330	K299-D328 IonicContact NZ-OD1 3.9Å; K299-D328 PolarHBondContact NZ-OD1 3.37Å; K299-D328 IonicContact NZ-OD2 3.39Å; Y324-D328 HydrophobicContact CD1-CB 3.83Å; Y324-D328 HydrophobicContact CE1-CB 4.26Å; T325-D328 PolarHBondContact N-OD2 2.97Å; T325-D328 WeakPolarHBondContact O-CB 3.27Å; T325-D328 PolarHBondContact O-N 3.11Å; A326-D328 PolarHBondContact O-N 3.42Å; A326-D328 VanDerWaalsContact O-N 3.12Å; D328-I330 PolarHBondContact O-N 3.49Å
329	F	92.3	Very high	88.9	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.009	31%	0.313	C	S	.	.			trans	-87.4	100.6	179.2	-58.5	-97.4	0	0	0	109.5	F245 I264 Y266 V273 T325 A326 K327 L335 I344 Y355	F245-F329 HydrophobicContact CD2-CB 4.26Å; F245-F329 HydrophobicContact CD2-CD1 4.36Å; F245-F329 HydrophobicContact CE1-CB 4.1Å; F245-F329 HydrophobicContact CE2-CB 3.72Å; F245-F329 HydrophobicContact CE2-CD1 4.39Å; F245-F329 HydrophobicContact CE2-CG 4.15Å; F245-F329 HydrophobicContact CZ-CB 3.65Å; I264-F329 HydrophobicContact CG2-CD1 4.31Å; I264-F329 HydrophobicContact CG2-CE1 3.94Å; Y266-F329 AromaticContact CD2-CD2 3.94Å; Y266-F329 HydrophobicContact CD2-CD2 3.94Å; Y266-F329 AromaticContact CD2-CE2 3.35Å; Y266-F329 HydrophobicContact CD2-CE2 3.35Å; Y266-F329 AromaticContact CD2-CZ 3.77Å; Y266-F329 HydrophobicContact CD2-CZ 3.77Å; Y266-F329 HydrophobicContact CE2-CD2 4.33Å; Y266-F329 AromaticContact CE2-CE2 3.64Å; Y266-F329 HydrophobicContact CE2-CE2 3.64Å; Y266-F329 HydrophobicContact CE2-CZ 4.32Å; Y266-F329 HydrophobicContact CG-CE2 4.35Å; V273-F329 HydrophobicContact CG1-CE1 4.39Å; V273-F329 HydrophobicContact CG1-CZ 4.35Å; V273-F329 HydrophobicContact CG2-CZ 3.85Å; T325-F329 WeakPolarHBondContact O-CD2 3.37Å; A326-F329 PolarHBondContact O-N 3.22Å; A326-F329 VanDerWaalsContact O-N 3.12Å; K327-F329 VanDerWaalsContact C-N 3.31Å; F329-L335 HydrophobicContact CD1-CD1 4.49Å; F329-L335 HydrophobicContact CD1-CD2 3.75Å; F329-L335 HydrophobicContact CE1-CD1 4.25Å; F329-L335 HydrophobicContact CE1-CD2 3.34Å; F329-L335 HydrophobicContact CE1-CG 4.44Å; F329-L335 HydrophobicContact CZ-CD2 4.21Å; F329-I344 HydrophobicContact CB-CD1 4.33Å; F329-I344 HydrophobicContact CD1-CD1 4.21Å; F329-Y355 VanDerWaalsContact O-CE1 3.25Å; F329-Y355 WeakPolarHBondContact O-CE1 3.41Å; F329-Y355 VanDerWaalsContact O-CZ 3.26Å; F329-Y355 PolarHBondContact O-OH 3.31Å
330	I	90.4	Very high	89.7	Confident	39 Å²	39	58.3 Å²	58.3	20%	0.2	32%	0.321	C	S	.	.			trans	-128.5	134.7	-179.5	-59.9	171.8	0	0	0	108.8	K327 D328 G332 K333 L364	K327-I330 WeakPolarHBondContact O-CD1 3.46Å; K327-I330 WeakPolarHBondContact O-CG1 3.5Å; D328-I330 PolarHBondContact O-N 3.49Å; I330-G332 PolarHBondContact O-N 2.88Å; I330-K333 HydrophobicContact CB-CD 4.12Å; I330-K333 HydrophobicContact CB-CG 4.27Å; I330-K333 HydrophobicContact CD1-CD 4.2Å; I330-K333 HydrophobicContact CG2-CD 4.47Å; I330-K333 HydrophobicContact CG2-CG 4.42Å; I330-K333 PolarHBondContact O-N 2.67Å; I330-L364 HydrophobicContact CG2-CD2 4.33Å
331	V	92.4	Very high	90.3	Very high	15 Å²	15	61.2 Å²	61.2	9%	0.091	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	131.1	175.1	-179.7	0	0	0	0	109.8	I344 Y345 C347 L364 P365 I367	V331-I344 HydrophobicContact CG2-CG2 4.15Å; V331-Y345 WeakPolarHBondContact CG1-O 3.47Å; V331-C347 HydrophobicContact CG2-CB 3.73Å; V331-C347 VanDerWaalsContact CG2-SG 3.54Å; V331-L364 HydrophobicContact CB-CB 4.4Å; V331-L364 HydrophobicContact CB-CD2 3.87Å; V331-L364 HydrophobicContact CG2-CB 4.23Å; V331-L364 HydrophobicContact CG2-CD2 3.94Å; V331-P365 WeakPolarHBondContact CG1-O 3.36Å; V331-I367 HydrophobicContact CG1-CD1 4.43Å
332	G	89.1	Confident	90.9	Very high	33 Å²	33	55.3 Å²	55.3	34%	0.34	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	-1.4	-175.3	0	0	0	0	0	115.1	I330 F343 I344	I330-G332 PolarHBondContact O-N 2.88Å; G332-F343 WeakPolarHBondContact O-CE2 3.42Å; G332-I344 PolarHBondContact N-O 3.33Å
333	K	91.1	Very high	91.2	Very high	122 Å²	122	54.2 Å²	54.2	53%	0.53	30%	0.301	S	S	.	.	S	Bend	trans	-104.6	150.8	171.5	-66	-167.3	-177.7	179.2	0	111.3	I330 I344	I330-K333 HydrophobicContact CB-CD 4.12Å; I330-K333 HydrophobicContact CB-CG 4.27Å; I330-K333 HydrophobicContact CD1-CD 4.2Å; I330-K333 HydrophobicContact CG2-CD 4.47Å; I330-K333 HydrophobicContact CG2-CG 4.42Å; I330-K333 PolarHBondContact O-N 2.67Å; K333-I344 PolarHBondContact O-N 3.47Å
334	S	92.4	Very high	91.5	Very high	87 Å²	87	52 Å²	52	61%	0.608	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	143.1	167.9	50.6	0	0	0	0	110.8	F342	S334-F342 CarbonylContact C-O 3.54Å; S334-F342 VanDerWaalsContact CA-O 3.27Å; S334-F342 WeakPolarHBondContact CA-O 3.33Å
335	L	92.9	Very high	91.6	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.042	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119.7	-179.9	178.6	77.5	0	0	0	108.6	I264 Y324 F329 V337 F342 I344	I264-L335 HydrophobicContact CD1-CD2 4.02Å; Y324-L335 HydrophobicContact CD1-CD1 4Å; Y324-L335 HydrophobicContact CE1-CD1 3.43Å; Y324-L335 VanDerWaalsContact CE1-CD1 3.43Å; F329-L335 HydrophobicContact CD1-CD1 4.49Å; F329-L335 HydrophobicContact CD1-CD2 3.75Å; F329-L335 HydrophobicContact CE1-CD1 4.25Å; F329-L335 HydrophobicContact CE1-CD2 3.34Å; F329-L335 HydrophobicContact CE1-CG 4.44Å; F329-L335 HydrophobicContact CZ-CD2 4.21Å; L335-V337 HydrophobicContact CD2-CG2 3.55Å; L335-V337 HydrophobicContact CG-CG2 3.67Å; L335-F342 PolarHBondContact N-O 2.83Å; L335-F342 PolarHBondContact O-N 3.3Å; L335-I344 HydrophobicContact CB-CD1 4.4Å
336	T	91.9	Very high	91.7	Very high	72 Å²	72	50.5 Å²	50.5	44%	0.442	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	110.9	179.2	-50.2	0	0	0	0	110.5	Y324 R340 T341	Y324-T336 PolarHBondContact OH-O 2.88Å; T336-R340 CarbonylContact C-O 3.56Å; T336-R340 WeakPolarHBondContact CA-O 3.45Å; T336-T341 HydrophobicContact CG2-CG2 4.13Å
337	V	90.3	Very high	91.9	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.036	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121	-179.5	-171.6	0	0	0	0	109	I275 M292 M297 L335 G339 R340 F342	I275-V337 HydrophobicContact CD1-CB 4.41Å; I275-V337 HydrophobicContact CD1-CG1 4.16Å; M292-V337 HydrophobicContact SD-CG1 3.86Å; M297-V337 HydrophobicContact CE-CG1 3.61Å; L335-V337 HydrophobicContact CD2-CG2 3.55Å; L335-V337 HydrophobicContact CG-CG2 3.67Å; V337-G339 PolarHBondContact O-N 2.86Å; V337-G339 VanDerWaalsContact O-N 3.13Å; V337-R340 PolarHBondContact N-O 3.04Å; V337-R340 PolarHBondContact O-N 2.83Å; V337-F342 HydrophobicContact CB-CD2 4.27Å; V337-F342 HydrophobicContact CB-CE2 4.12Å; V337-F342 HydrophobicContact CG2-CD2 4.26Å
338	L	86	Confident	92.1	Very high	127 Å²	127	45.6 Å²	45.6	67%	0.665	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	38.2	179.2	-59.7	173.9	0	0	0	113.7	M292 M297 R340	M292-L338 HydrophobicContact CG-CD1 4.42Å; M292-L338 HydrophobicContact SD-CD1 3.94Å; M297-L338 HydrophobicContact CE-CD1 4.02Å; M297-L338 HydrophobicContact CE-CD2 3.73Å; M297-L338 HydrophobicContact CE-CG 3.58Å; L338-R340 VanDerWaalsContact C-N 3.33Å; L338-R340 PolarHBondContact O-N 3.14Å
339	G	86.6	Confident	92.2	Very high	71 Å²	71	47.8 Å²	47.8	73%	0.732	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-0.1	-179.2	0	0	0	0	0	115.5	V337	V337-G339 PolarHBondContact O-N 2.86Å; V337-G339 VanDerWaalsContact O-N 3.13Å
340	R	91.1	Very high	92.3	Very high	100 Å²	100	51.6 Å²	51.6	38%	0.377	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.3	174.3	-60.7	-178.6	-175.1	175.6	1.2	110.8	W249 T336 V337 L338 F342	W249-R340 HydrophobicContact CZ2-CG 4Å; T336-R340 CarbonylContact C-O 3.56Å; T336-R340 WeakPolarHBondContact CA-O 3.45Å; V337-R340 PolarHBondContact N-O 3.04Å; V337-R340 PolarHBondContact O-N 2.83Å; L338-R340 VanDerWaalsContact C-N 3.33Å; L338-R340 PolarHBondContact O-N 3.14Å; R340-F342 HydrophobicContact CB-CD2 4.48Å; R340-F342 HydrophobicContact CB-CE2 3.76Å; R340-F342 HydrophobicContact CB-CZ 4.13Å
341	T	93.5	Very high	92.4	Very high	74 Å²	74	49.7 Å²	49.7	45%	0.454	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	109.5	-179.2	48.2	0	0	0	0	110.9	T336	T336-T341 HydrophobicContact CG2-CG2 4.13Å
342	F	95.1	Very high	92.4	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	127.9	176.4	-64.7	-86	0	0	0	110.3	A247 I248 W249 Y262 I264 I275 L291 S334 L335 V337 R340	A247-F342 HydrophobicContact CB-CB 4.12Å; I248-F342 CarbonylContact O-C 3.5Å; I248-F342 WeakPolarHBondContact O-CA 3.43Å; W249-F342 HydrophobicContact CB-CD1 3.8Å; W249-F342 HydrophobicContact CB-CE1 3.79Å; W249-F342 HydrophobicContact CG-CE1 4.28Å; Y262-F342 HydrophobicContact CD1-CE1 4.39Å; Y262-F342 HydrophobicContact CD2-CD1 4.15Å; Y262-F342 AromaticContact CD2-CE1 3.71Å; Y262-F342 HydrophobicContact CD2-CE1 3.71Å; Y262-F342 HydrophobicContact CE2-CE1 4.15Å; Y262-F342 HydrophobicContact CG-CD1 4.36Å; Y262-F342 AromaticContact CG-CE1 3.86Å; Y262-F342 HydrophobicContact CG-CE1 3.86Å; I264-F342 HydrophobicContact CD1-CB 4.24Å; I264-F342 HydrophobicContact CD1-CG 4.48Å; I275-F342 HydrophobicContact CD1-CE2 3.99Å; I275-F342 HydrophobicContact CD1-CZ 4.15Å; I275-F342 HydrophobicContact CG2-CE1 4.43Å; L291-F342 HydrophobicContact CD2-CE1 4.13Å; L291-F342 HydrophobicContact CD2-CZ 3.71Å; S334-F342 CarbonylContact C-O 3.54Å; S334-F342 VanDerWaalsContact CA-O 3.27Å; S334-F342 WeakPolarHBondContact CA-O 3.33Å; L335-F342 PolarHBondContact N-O 2.83Å; L335-F342 PolarHBondContact O-N 3.3Å; V337-F342 HydrophobicContact CB-CD2 4.27Å; V337-F342 HydrophobicContact CB-CE2 4.12Å; V337-F342 HydrophobicContact CG2-CD2 4.26Å; R340-F342 HydrophobicContact CB-CD2 4.48Å; R340-F342 HydrophobicContact CB-CE2 3.76Å; R340-F342 HydrophobicContact CB-CZ 4.13Å
343	F	95.1	Very high	92.6	Very high	62 Å²	62	59.6 Å²	59.6	27%	0.272	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	115.8	171.3	178.8	-101.7	0	0	0	110.1	A247 I248 G332 Y345 I367 V369	A247-F343 CarbonylContact C-O 3.59Å; A247-F343 WeakPolarHBondContact CA-O 3.41Å; I248-F343 HydrophobicContact CD1-CB 4.49Å; I248-F343 HydrophobicContact CD1-CD1 4.13Å; I248-F343 HydrophobicContact CG1-CB 3.85Å; I248-F343 HydrophobicContact CG1-CD1 4.02Å; I248-F343 HydrophobicContact CG1-CG 4.43Å; I248-F343 PolarHBondContact N-O 3.26Å; I248-F343 PolarHBondContact O-N 3.16Å; G332-F343 WeakPolarHBondContact O-CE2 3.42Å; F343-Y345 PolarHBondContact O-N 2.9Å; F343-I367 HydrophobicContact CE1-CD1 4.41Å; F343-I367 HydrophobicContact CE1-CG2 4.27Å; F343-I367 HydrophobicContact CZ-CD1 3.9Å; F343-I367 HydrophobicContact CZ-CG2 4.4Å; F343-V369 HydrophobicContact CD1-CG1 4.01Å; F343-V369 HydrophobicContact CE1-CG1 3.81Å
344	I	95.6	Very high	92.6	Very high	2 Å²	2	55 Å²	55	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	115.6	-179.7	-58	173.8	0	0	0	108.7	F245 A247 I264 F329 V331 G332 K333 L335	F245-I344 HydrophobicContact CB-CG2 3.97Å; F245-I344 HydrophobicContact CD1-CG2 4.07Å; F245-I344 HydrophobicContact CG-CG2 4.4Å; A247-I344 HydrophobicContact CB-CG1 4.3Å; I264-I344 HydrophobicContact CD1-CG1 4.41Å; F329-I344 HydrophobicContact CB-CD1 4.33Å; F329-I344 HydrophobicContact CD1-CD1 4.21Å; V331-I344 HydrophobicContact CG2-CG2 4.15Å; G332-I344 PolarHBondContact N-O 3.33Å; K333-I344 PolarHBondContact O-N 3.47Å; L335-I344 HydrophobicContact CB-CD1 4.4Å
345	Y	94.5	Very high	92.6	Very high	39 Å²	39	50.9 Å²	50.9	15%	0.153	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-21.9	-176.1	70.4	-92	0	0	0	113.6	Y246 I248 V331 F343 I367 V369	Y246-Y345 WeakPolarHBondContact O-CD1 3.43Å; Y246-Y345 PolarHBondContact O-N 3.34Å; I248-Y345 HydrophobicContact CG2-CD1 3.79Å; I248-Y345 HydrophobicContact CG2-CE1 3.71Å; V331-Y345 WeakPolarHBondContact CG1-O 3.47Å; F343-Y345 PolarHBondContact O-N 2.9Å; Y345-I367 PolarHBondContact O-N 3.48Å; Y345-V369 HydrophobicContact CD1-CG2 3.91Å; Y345-V369 HydrophobicContact CD2-CG2 3.81Å; Y345-V369 HydrophobicContact CE1-CG2 4.26Å; Y345-V369 HydrophobicContact CE2-CG2 4.2Å; Y345-V369 HydrophobicContact CG-CG1 4.29Å; Y345-V369 HydrophobicContact CG-CG2 3.65Å
346	D	94.5	Very high	92.5	Very high	23 Å²	23	56.5 Å²	56.5	12%	0.123	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	165.7	178.4	-161.7	7.5	0	0	0	111.8	Y246 R352 R366	Y246-D346 HydrophobicContact CD2-CB 3.86Å; Y246-D346 HydrophobicContact CG-CB 4.35Å; Y246-D346 PolarHBondContact N-O 3.14Å; Y246-D346 PolarHBondContact O-N 2.94Å; D346-R352 IonicContact OD1-CZ 3.45Å; D346-R352 IonicContact OD1-NH2 2.64Å; D346-R352 PolarHBondContact OD1-NH2 3.21Å; D346-R366 HydrophobicContact CB-CG 4.14Å; D346-R366 WeakPolarHBondContact OD2-CD 3.38Å; D346-R366 IonicContact OD2-NE 2.77Å
347	C	93.9	Very high	92.5	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.02	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.1	177	68.2	0	0	0	0	111.5	F245 V331 T351 R352	F245-C347 HydrophobicContact CD1-CB 3.66Å; F245-C347 HydrophobicContact CE1-CB 4.05Å; V331-C347 HydrophobicContact CG2-CB 3.73Å; V331-C347 VanDerWaalsContact CG2-SG 3.54Å; C347-T351 WeakPolarHBondContact CB-OG1 3.46Å; C347-R352 PolarHBondContact O-NE 3.45Å; C347-R352 WeakPolarHBondContact SG-CG 3.31Å
348	D	94.4	Very high	92.5	Very high	27 Å²	27	66.2 Å²	66.2	14%	0.144	32%	0.323	C	S	.	.			trans	-60.5	158.2	-177.8	-97.7	16.5	0	0	0	115.8	R244 Y246 F350 T351 R352	R244-D348 HydrophobicContact CB-CB 4.16Å; R244-D348 VanDerWaalsContact CZ-CG 3.48Å; R244-D348 IonicContact CZ-OD1 3.2Å; R244-D348 IonicContact CZ-OD2 2.67Å; R244-D348 IonicContact NE-OD1 3.92Å; R244-D348 PolarHBondContact NE-OD1 3.44Å; R244-D348 IonicContact NE-OD2 2.64Å; R244-D348 PolarHBondContact NE-OD2 2.75Å; R244-D348 IonicContact NH1-OD2 2.91Å; R244-D348 IonicContact NH2-OD1 2.66Å; R244-D348 PolarHBondContact NH2-OD1 3.21Å; R244-D348 IonicContact NH2-OD2 3.87Å; R244-D348 PolarHBondContact NH2-OD2 2.71Å; R244-D348 PolarHBondContact O-N 2.78Å; R244-D348 VanDerWaalsContact O-N 3.12Å; Y246-D348 WeakPolarHBondContact CE2-OD1 3.22Å; Y246-D348 PolarHBondContact OH-OD1 3.18Å; D348-F350 PolarHBondContact O-N 3.39Å; D348-T351 HydrophobicContact CB-CG2 4.29Å; D348-T351 PolarHBondContact N-OG1 3.08Å; D348-T351 PolarHBondContact O-N 2.97Å; D348-T351 PolarHBondContact O-OG1 2.86Å; D348-R352 VanDerWaalsContact O-CG 3.3Å; D348-R352 WeakPolarHBondContact O-CG 3.32Å; D348-R352 PolarHBondContact O-N 3.28Å
349	P	93.6	Very high	92.6	Very high	89 Å²	89	63.1 Å²	63.1	58%	0.578	31%	0.305	S	S	*	.	H	α-helix	trans	-57.5	-34.8	171.9	-25.4	35.1	0	0	0	113.7	R353	P349-R353 WeakPolarHBondContact O-CG 3.24Å; P349-R353 PolarHBondContact O-N 3.01Å
350	F	93.9	Very high	92.5	Very high	82 Å²	82	62.3 Å²	62.3	36%	0.36	30%	0.296	S	S	.	.	H	α-helix	trans	-67.1	-46	176.4	172.8	-106.7	0	0	0	111.8	Q241 V242 L243 D348 R352 R353 Y354	Q241-F350 HydrophobicContact CB-CE1 4.25Å; Q241-F350 HydrophobicContact CB-CZ 3.91Å; Q241-F350 HydrophobicContact CG-CZ 4.07Å; V242-F350 WeakPolarHBondContact O-CD1 3.47Å; L243-F350 HydrophobicContact CD2-CD1 4.42Å; L243-F350 HydrophobicContact CD2-CE1 4.05Å; D348-F350 PolarHBondContact O-N 3.39Å; F350-R352 VanDerWaalsContact C-N 3.34Å; F350-R352 PolarHBondContact O-N 3.29Å; F350-R353 PolarHBondContact O-N 3.22Å; F350-Y354 PolarHBondContact O-N 2.7Å
351	T	93.3	Very high	92.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.1	-42.6	178.5	51.3	0	0	0	0	111.4	L243 R244 F245 C347 D348 R353 Y354 Y355	L243-T351 HydrophobicContact CB-CG2 3.5Å; L243-T351 VanDerWaalsContact CB-CG2 3.5Å; L243-T351 HydrophobicContact CD2-CG2 3.73Å; L243-T351 HydrophobicContact CG-CG2 4.23Å; R244-T351 WeakPolarHBondContact O-CG2 3.36Å; F245-T351 HydrophobicContact CZ-CG2 4.49Å; C347-T351 WeakPolarHBondContact CB-OG1 3.46Å; D348-T351 HydrophobicContact CB-CG2 4.29Å; D348-T351 PolarHBondContact N-OG1 3.08Å; D348-T351 PolarHBondContact O-N 2.97Å; D348-T351 PolarHBondContact O-OG1 2.86Å; T351-R353 VanDerWaalsContact C-N 3.28Å; T351-R353 PolarHBondContact O-N 3.09Å; T351-Y354 PolarHBondContact O-N 3.21Å; T351-Y354 VanDerWaalsContact O-N 3.15Å; T351-Y355 VanDerWaalsContact O-CD2 3.22Å; T351-Y355 WeakPolarHBondContact O-CD2 3.31Å; T351-Y355 PolarHBondContact O-N 3.01Å
352	R	92.1	Very high	91.3	Very high	81 Å²	81	62.2 Å²	62.2	31%	0.306	30%	0.304	S	S	.	.	H	α-helix	trans	-54.1	-44.5	174.4	-68.5	165.6	180	-90	-4.9	112.2	D346 C347 D348 F350 K356 L364	D346-R352 IonicContact OD1-CZ 3.45Å; D346-R352 IonicContact OD1-NH2 2.64Å; D346-R352 PolarHBondContact OD1-NH2 3.21Å; C347-R352 PolarHBondContact O-NE 3.45Å; C347-R352 WeakPolarHBondContact SG-CG 3.31Å; D348-R352 VanDerWaalsContact O-CG 3.3Å; D348-R352 WeakPolarHBondContact O-CG 3.32Å; D348-R352 PolarHBondContact O-N 3.28Å; F350-R352 VanDerWaalsContact C-N 3.34Å; F350-R352 PolarHBondContact O-N 3.29Å; R352-K356 WeakPolarHBondContact O-CB 3.46Å; R352-K356 PolarHBondContact O-N 2.88Å; R352-K356 VanDerWaalsContact O-N 3.14Å; R352-L364 PolarHBondContact NH1-O 2.7Å; R352-L364 PolarHBondContact NH2-O 3.43Å; R352-L364 VanDerWaalsContact NH2-O 3.09Å
353	R	91.8	Very high	90.2	Very high	174 Å²	174	68 Å²	68	66%	0.657	34%	0.335	S	S	*	.	H	α-helix	trans	-66.8	-46.1	176.7	-68.9	174.5	-172.6	178.3	2.3	111.8	P349 F350 T351 Y355 K356 E357	P349-R353 WeakPolarHBondContact O-CG 3.24Å; P349-R353 PolarHBondContact O-N 3.01Å; F350-R353 PolarHBondContact O-N 3.22Å; T351-R353 VanDerWaalsContact C-N 3.28Å; T351-R353 PolarHBondContact O-N 3.09Å; R353-Y355 VanDerWaalsContact C-N 3.34Å; R353-Y355 PolarHBondContact O-N 3.38Å; R353-K356 WeakPolarHBondContact O-CB 3.49Å; R353-K356 PolarHBondContact O-N 3.02Å; R353-E357 WeakPolarHBondContact O-CG 3.41Å; R353-E357 PolarHBondContact O-N 3.04Å
354	Y	92.4	Very high	89.6	Confident	25 Å²	25	65.4 Å²	65.4	10%	0.098	32%	0.324	C	S	.	.	H	α-helix	trans	-57.4	-45.1	178.1	-179.9	-94.7	0	0	0	112.1	F238 L243 L268 F350 T351 K356 E357 K358 F359	F238-Y354 HydrophobicContact CE1-CE2 4.28Å; L243-Y354 HydrophobicContact CD1-CD1 4.06Å; L243-Y354 HydrophobicContact CD1-CE1 3.99Å; L243-Y354 HydrophobicContact CD2-CD1 3.54Å; L243-Y354 HydrophobicContact CD2-CD2 4.43Å; L243-Y354 HydrophobicContact CD2-CE1 4.15Å; L243-Y354 HydrophobicContact CD2-CG 3.7Å; L243-Y354 HydrophobicContact CG-CD1 4.42Å; L268-Y354 HydrophobicContact CD1-CD2 3.87Å; L268-Y354 HydrophobicContact CD1-CE1 4.31Å; L268-Y354 HydrophobicContact CD1-CE2 3.4Å; L268-Y354 HydrophobicContact CD2-CE1 3.99Å; L268-Y354 HydrophobicContact CD2-CE2 4.26Å; L268-Y354 WeakPolarHBondContact CD2-OH 3.48Å; L268-Y354 HydrophobicContact CG-CE2 4.49Å; F350-Y354 PolarHBondContact O-N 2.7Å; T351-Y354 PolarHBondContact O-N 3.21Å; T351-Y354 VanDerWaalsContact O-N 3.15Å; Y354-K356 VanDerWaalsContact C-N 3.35Å; Y354-K356 PolarHBondContact O-N 3.5Å; Y354-E357 PolarHBondContact O-N 3.49Å; Y354-K358 HydrophobicContact CD2-CG 4.05Å; Y354-K358 HydrophobicContact CE1-CB 4.31Å; Y354-K358 HydrophobicContact CE1-CG 4.13Å; Y354-K358 HydrophobicContact CE2-CD 4.42Å; Y354-K358 HydrophobicContact CE2-CG 3.61Å; Y354-K358 HydrophobicContact CG-CG 4.47Å; Y354-K358 WeakPolarHBondContact O-CB 3.27Å; Y354-K358 PolarHBondContact O-N 3.29Å; Y354-F359 HydrophobicContact CD1-CE2 4.42Å; Y354-F359 AromaticContact CE1-CE2 3.92Å; Y354-F359 HydrophobicContact CE1-CE2 3.92Å; Y354-F359 HydrophobicContact CE1-CZ 4.35Å
355	Y	92.3	Very high	89.1	Confident	1 Å²	1	68.8 Å²	68.8	0%	0.004	35%	0.346	C	S	.	.	H	α-helix	trans	-66.8	-37.1	178.5	-85.9	-112.5	0	0	0	112.5	L243 F245 A326 F329 T351 R353 F359 G360 I361 L364	L243-Y355 HydrophobicContact CD1-CE2 3.97Å; F245-Y355 HydrophobicContact CE1-CE2 4.26Å; F245-Y355 AromaticContact CZ-CE2 3.83Å; F245-Y355 HydrophobicContact CZ-CE2 3.83Å; F245-Y355 AromaticContact CZ-CZ 3.87Å; F245-Y355 VanDerWaalsContact CZ-OH 3.27Å; F245-Y355 WeakPolarHBondContact CZ-OH 3.35Å; A326-Y355 PolarHBondContact O-OH 3Å; F329-Y355 VanDerWaalsContact O-CE1 3.25Å; F329-Y355 WeakPolarHBondContact O-CE1 3.41Å; F329-Y355 VanDerWaalsContact O-CZ 3.26Å; F329-Y355 PolarHBondContact O-OH 3.31Å; T351-Y355 VanDerWaalsContact O-CD2 3.22Å; T351-Y355 WeakPolarHBondContact O-CD2 3.31Å; T351-Y355 PolarHBondContact O-N 3.01Å; R353-Y355 VanDerWaalsContact C-N 3.34Å; R353-Y355 PolarHBondContact O-N 3.38Å; Y355-F359 AromaticContact CD1-CD2 3.65Å; Y355-F359 HydrophobicContact CD1-CD2 3.65Å; Y355-F359 HydrophobicContact CD1-CE2 4.22Å; Y355-F359 HydrophobicContact CD2-CD2 4.45Å; Y355-F359 AromaticContact CE1-CD2 3.95Å; Y355-F359 HydrophobicContact CE1-CD2 3.95Å; Y355-F359 HydrophobicContact CE1-CE2 4.11Å; Y355-F359 HydrophobicContact CE2-CE2 4.47Å; Y355-F359 AromaticContact CG-CD2 3.92Å; Y355-F359 HydrophobicContact CG-CD2 3.92Å; Y355-F359 HydrophobicContact CG-CE2 4.44Å; Y355-F359 CarbonylContact O-C 3.6Å; Y355-F359 WeakPolarHBondContact O-CA 3.45Å; Y355-F359 WeakPolarHBondContact O-CB 3.31Å; Y355-F359 PolarHBondContact O-N 3.46Å; Y355-G360 PolarHBondContact O-N 3.44Å; Y355-G360 VanDerWaalsContact O-N 3.09Å; Y355-I361 HydrophobicContact CD1-CD1 4.16Å; Y355-I361 PolarHBondContact O-N 3.28Å; Y355-L364 HydrophobicContact CD1-CD1 4.27Å; Y355-L364 HydrophobicContact CG-CD1 4Å
356	K	91.6	Very high	88.9	Confident	127 Å²	127	75 Å²	75	55%	0.552	37%	0.369	S	S	*	.	H	α-helix	trans	-63.5	-43.1	174.4	-175	176.5	176.9	177	0	111.8	R352 R353 Y354 G360 I361 T362	R352-K356 WeakPolarHBondContact O-CB 3.46Å; R352-K356 PolarHBondContact O-N 2.88Å; R352-K356 VanDerWaalsContact O-N 3.14Å; R353-K356 WeakPolarHBondContact O-CB 3.49Å; R353-K356 PolarHBondContact O-N 3.02Å; Y354-K356 VanDerWaalsContact C-N 3.35Å; Y354-K356 PolarHBondContact O-N 3.5Å; K356-G360 VanDerWaalsContact O-CA 3.29Å; K356-G360 WeakPolarHBondContact O-CA 3.17Å; K356-G360 PolarHBondContact O-N 3.11Å; K356-I361 WeakPolarHBondContact CA-O 3.46Å; K356-I361 PolarHBondContact N-O 3.2Å; K356-T362 HydrophobicContact CD-CG2 4.3Å; K356-T362 HydrophobicContact CG-CG2 4.12Å
357	E	91.1	Very high	88.6	Confident	163 Å²	163	76.7 Å²	76.7	76%	0.762	38%	0.378	S	S	*	.	H	α-helix	trans	-76.7	-45	-178.1	-71.6	176.6	-173	0	0	113.3	R353 Y354	R353-E357 WeakPolarHBondContact O-CG 3.41Å; R353-E357 PolarHBondContact O-N 3.04Å; Y354-E357 PolarHBondContact O-N 3.49Å
358	K	89.3	Confident	88.3	Confident	118 Å²	118	82 Å²	82	51%	0.513	41%	0.406	S	S	.	.	H	α-helix	trans	-85.8	-37.6	-174.4	-73.6	-73	-170.2	179.1	0	114	Y354	Y354-K358 HydrophobicContact CD2-CG 4.05Å; Y354-K358 HydrophobicContact CE1-CB 4.31Å; Y354-K358 HydrophobicContact CE1-CG 4.13Å; Y354-K358 HydrophobicContact CE2-CD 4.42Å; Y354-K358 HydrophobicContact CE2-CG 3.61Å; Y354-K358 HydrophobicContact CG-CG 4.47Å; Y354-K358 WeakPolarHBondContact O-CB 3.27Å; Y354-K358 PolarHBondContact O-N 3.29Å
359	F	88	Confident	87.8	Confident	62 Å²	62	83 Å²	83	27%	0.272	41%	0.413	S	S	.	.	H	α-helix	trans	-113.5	-7.1	-173.5	-54.2	-55.4	0	0	0	113.2	A326 K327 Y354 Y355 I361	A326-F359 HydrophobicContact CB-CE2 4.27Å; A326-F359 HydrophobicContact CB-CZ 4.13Å; K327-F359 HydrophobicContact CD-CD1 4.39Å; K327-F359 HydrophobicContact CD-CE1 3.97Å; K327-F359 HydrophobicContact CG-CD1 3.91Å; K327-F359 HydrophobicContact CG-CE1 3.34Å; K327-F359 HydrophobicContact CG-CE2 4.34Å; K327-F359 HydrophobicContact CG-CZ 3.59Å; Y354-F359 HydrophobicContact CD1-CE2 4.42Å; Y354-F359 AromaticContact CE1-CE2 3.92Å; Y354-F359 HydrophobicContact CE1-CE2 3.92Å; Y354-F359 HydrophobicContact CE1-CZ 4.35Å; Y355-F359 AromaticContact CD1-CD2 3.65Å; Y355-F359 HydrophobicContact CD1-CD2 3.65Å; Y355-F359 HydrophobicContact CD1-CE2 4.22Å; Y355-F359 HydrophobicContact CD2-CD2 4.45Å; Y355-F359 AromaticContact CE1-CD2 3.95Å; Y355-F359 HydrophobicContact CE1-CD2 3.95Å; Y355-F359 HydrophobicContact CE1-CE2 4.11Å; Y355-F359 HydrophobicContact CE2-CE2 4.47Å; Y355-F359 AromaticContact CG-CD2 3.92Å; Y355-F359 HydrophobicContact CG-CD2 3.92Å; Y355-F359 HydrophobicContact CG-CE2 4.44Å; Y355-F359 CarbonylContact O-C 3.6Å; Y355-F359 WeakPolarHBondContact O-CA 3.45Å; Y355-F359 WeakPolarHBondContact O-CB 3.31Å; Y355-F359 PolarHBondContact O-N 3.46Å; F359-I361 HydrophobicContact CB-CD1 3.87Å; F359-I361 HydrophobicContact CB-CG1 3.98Å; F359-I361 PolarHBondContact O-N 2.82Å
360	G	85.9	Confident	87.3	Confident	54 Å²	54	84.6 Å²	84.6	56%	0.557	42%	0.416	S	S	*	.			trans	69.7	13.4	-177.3	0	0	0	0	0	113.8	Y355 K356 T362	Y355-G360 PolarHBondContact O-N 3.44Å; Y355-G360 VanDerWaalsContact O-N 3.09Å; K356-G360 VanDerWaalsContact O-CA 3.29Å; K356-G360 WeakPolarHBondContact O-CA 3.17Å; K356-G360 PolarHBondContact O-N 3.11Å; G360-T362 PolarHBondContact O-N 2.92Å
361	I	84.9	Confident	86.6	Confident	60 Å²	60	87.7 Å²	87.7	31%	0.308	43%	0.43	S	S	.	.			trans	-84.7	104.8	-178.3	-59.8	169.9	0	0	0	107.9	Y355 K356 F359 L364	Y355-I361 HydrophobicContact CD1-CD1 4.16Å; Y355-I361 PolarHBondContact O-N 3.28Å; K356-I361 WeakPolarHBondContact CA-O 3.46Å; K356-I361 PolarHBondContact N-O 3.2Å; F359-I361 HydrophobicContact CB-CD1 3.87Å; F359-I361 HydrophobicContact CB-CG1 3.98Å; F359-I361 PolarHBondContact O-N 2.82Å; I361-L364 HydrophobicContact CG2-CD2 4.42Å; I361-L364 HydrophobicContact CG2-CG 4.28Å
362	T	74.3	Confident	85.8	Confident	112 Å²	112	96.7 Å²	96.7	69%	0.687	47%	0.472	S	S	*	.			trans	-83.4	-23.7	-176.4	34.5	0	0	0	0	114.4	K356 G360	K356-T362 HydrophobicContact CD-CG2 4.3Å; K356-T362 HydrophobicContact CG-CG2 4.12Å; G360-T362 PolarHBondContact O-N 2.92Å
363	D	72.4	Confident	85.1	Confident	123 Å²	123	101.2 Å²	101.2	66%	0.658	50%	0.497	S	S	*	.			trans	-122.4	106.3	-170.1	-150.7	3.3	0	0	0	111.3	P365	D363-P365 VanDerWaalsContact C-CD 3.48Å
364	L	82.4	Confident	84.6	Confident	9 Å²	9	98.4 Å²	98.4	5%	0.047	50%	0.501	C	S	.	.			trans	-122.6	69.8	172.6	-73.5	164.9	0	0	0	107.4	I330 V331 R352 Y355 I361	I330-L364 HydrophobicContact CG2-CD2 4.33Å; V331-L364 HydrophobicContact CB-CB 4.4Å; V331-L364 HydrophobicContact CB-CD2 3.87Å; V331-L364 HydrophobicContact CG2-CB 4.23Å; V331-L364 HydrophobicContact CG2-CD2 3.94Å; R352-L364 PolarHBondContact NH1-O 2.7Å; R352-L364 PolarHBondContact NH2-O 3.43Å; R352-L364 VanDerWaalsContact NH2-O 3.09Å; Y355-L364 HydrophobicContact CD1-CD1 4.27Å; Y355-L364 HydrophobicContact CG-CD1 4Å; I361-L364 HydrophobicContact CG2-CD2 4.42Å; I361-L364 HydrophobicContact CG2-CG 4.28Å
365	P	85.6	Confident	84.2	Confident	73 Å²	73	102.6 Å²	102.6	47%	0.474	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-63.5	142.1	-173.4	26.4	-34.3	0	0	0	110.8	V331 D363 I367	V331-P365 WeakPolarHBondContact CG1-O 3.36Å; D363-P365 VanDerWaalsContact C-CD 3.48Å; P365-I367 PolarHBondContact O-N 2.86Å
366	R	88.6	Confident	83.8	Confident	169 Å²	169	108.1 Å²	108.1	64%	0.638	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-68.6	127.9	170.5	172.2	179.1	171.4	-178.6	-1.8	108.3	D346	D346-R366 HydrophobicContact CB-CG 4.14Å; D346-R366 WeakPolarHBondContact OD2-CD 3.38Å; D346-R366 IonicContact OD2-NE 2.77Å
367	I	89.8	Confident	83.5	Confident	58 Å²	58	108.6 Å²	108.6	30%	0.297	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-97.2	130	176.9	-59.4	170.8	0	0	0	108.1	V331 F343 Y345 P365 V369	V331-I367 HydrophobicContact CG1-CD1 4.43Å; F343-I367 HydrophobicContact CE1-CD1 4.41Å; F343-I367 HydrophobicContact CE1-CG2 4.27Å; F343-I367 HydrophobicContact CZ-CD1 3.9Å; F343-I367 HydrophobicContact CZ-CG2 4.4Å; Y345-I367 PolarHBondContact O-N 3.48Å; P365-I367 PolarHBondContact O-N 2.86Å; I367-V369 HydrophobicContact CG2-CG1 4.49Å
368	D	86.4	Confident	83	Confident	116 Å²	116	109.8 Å²	109.8	62%	0.62	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-79.6	120.8	172.8	-164.5	2.7	0	0	0	109.5	N370	D368-N370 WeakPolarHBondContact OD1-CB 3.47Å; D368-N370 PolarHBondContact OD1-N 3.19Å; D368-N370 VanDerWaalsContact OD1-N 3.12Å; D368-N370 PolarHBondContact OD1-ND2 2.93Å
369	V	84.4	Confident	82.5	Confident	46 Å²	46	113.4 Å²	113.4	28%	0.279	60%	0.602	S	S	.	*			trans	-111.3	4.7	-178.8	-80	0	0	0	0	111.8	I248 F343 Y345 I367 K371	I248-V369 HydrophobicContact CD1-CB 3.94Å; I248-V369 HydrophobicContact CD1-CG1 3.7Å; I248-V369 HydrophobicContact CG2-CG2 4.1Å; F343-V369 HydrophobicContact CD1-CG1 4.01Å; F343-V369 HydrophobicContact CE1-CG1 3.81Å; Y345-V369 HydrophobicContact CD1-CG2 3.91Å; Y345-V369 HydrophobicContact CD2-CG2 3.81Å; Y345-V369 HydrophobicContact CE1-CG2 4.26Å; Y345-V369 HydrophobicContact CE2-CG2 4.2Å; Y345-V369 HydrophobicContact CG-CG1 4.29Å; Y345-V369 HydrophobicContact CG-CG2 3.65Å; I367-V369 HydrophobicContact CG2-CG1 4.49Å; V369-K371 PolarHBondContact O-N 3.03Å
370	N	82.9	Confident	82.3	Confident	123 Å²	123	119 Å²	119	66%	0.658	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-68.7	130	177.9	-75.6	-29.7	0	0	0	111.3	D368 Q372	D368-N370 WeakPolarHBondContact OD1-CB 3.47Å; D368-N370 PolarHBondContact OD1-N 3.19Å; D368-N370 VanDerWaalsContact OD1-N 3.12Å; D368-N370 PolarHBondContact OD1-ND2 2.93Å; N370-Q372 PolarHBondContact O-N 2.89Å
371	K	78.9	Confident	82.3	Confident	148 Å²	148	120.9 Å²	120.9	64%	0.643	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-72.1	124.2	169.1	-66	-178.9	-178.2	179	0	108	V369 E373	V369-K371 PolarHBondContact O-N 3.03Å; K371-E373 PolarHBondContact O-N 2.83Å
372	Q	76.4	Confident	82.4	Confident	188 Å²	188	121.8 Å²	121.8	88%	0.879	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-71	117.4	171.5	-69.6	-171.5	-1.8	0	0	108.6	N370	N370-Q372 PolarHBondContact O-N 2.89Å
373	E	78.6	Confident	83.1	Confident	177 Å²	177	121.4 Å²	121.4	83%	0.827	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-64.5	138.5	172.7	-67.5	-178	178.9	0	0	109.6	K371	K371-E373 PolarHBondContact O-N 2.83Å
374	P	81.4	Confident	83.8	Confident	115 Å²	115	117.8 Å²	117.8	75%	0.747	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-59.2	137.7	173.7	25.9	-32.7	0	0	0	108.8
375	P	83.6	Confident	84.1	Confident	112 Å²	112	122.2 Å²	122.2	73%	0.727	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-58	141	179	24.6	-33.3	0	0	0	109.3	V377	P375-V377 PolarHBondContact O-N 3.08Å
376	P	83.9	Confident	84.1	Confident	118 Å²	118	121.2 Å²	121.2	77%	0.766	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-57.3	136.1	177.8	24.3	-33.4	0	0	0	109.3	K378	P376-K378 PolarHBondContact O-N 2.88Å; P376-K378 VanDerWaalsContact O-N 3.07Å
377	V	84.6	Confident	83.9	Confident	136 Å²	136	120.7 Å²	120.7	82%	0.824	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-60.2	116.3	177.4	-178.8	0	0	0	0	107.9	P375 Q379	P375-V377 PolarHBondContact O-N 3.08Å; V377-Q379 PolarHBondContact O-N 3.48Å
378	K	80.9	Confident	83.7	Confident	188 Å²	188	120.9 Å²	120.9	82%	0.817	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-67.9	122.7	176.1	-67.9	-178.1	-179.5	177.7	0	108.2	P376 E380	P376-K378 PolarHBondContact O-N 2.88Å; P376-K378 VanDerWaalsContact O-N 3.07Å; K378-E380 PolarHBondContact O-N 2.86Å
379	Q	79.3	Confident	83.6	Confident	195 Å²	195	120.5 Å²	120.5	91%	0.911	66%	0.655	S	S	*	*			trans	-76.2	111.6	172.7	-66.5	178.8	-9.2	0	0	108.2	V377	V377-Q379 PolarHBondContact O-N 3.48Å
380	E	83.9	Confident	83.7	Confident	179 Å²	179	119.8 Å²	119.8	84%	0.836	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-80.2	147.9	173.4	-63.2	-175.1	169.3	0	0	110	K378	K378-E380 PolarHBondContact O-N 2.86Å
381	L	84.9	Confident	83.9	Confident	94 Å²	94	117.6 Å²	117.6	49%	0.492	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-67.5	136.5	174	-72.3	171.5	0	0	0	109.4	C397 F398	L381-C397 HydrophobicContact CD2-CB 3.7Å; L381-F398 HydrophobicContact CD1-CE1 3.99Å; L381-F398 HydrophobicContact CD1-CZ 3.71Å; L381-F398 HydrophobicContact CD2-CD1 4.15Å; L381-F398 HydrophobicContact CD2-CE1 3.68Å; L381-F398 HydrophobicContact CD2-CZ 4.07Å; L381-F398 HydrophobicContact CG-CE1 4.22Å; L381-F398 HydrophobicContact CG-CZ 4.41Å
382	P	87	Confident	84.4	Confident	79 Å²	79	113.9 Å²	113.9	51%	0.513	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-63.6	155.4	172.1	29.1	-34.5	0	0	0	110.4	C397	P382-C397 VanDerWaalsContact CG-SG 3.57Å
383	P	88.3	Confident	85	Confident	103 Å²	103	105.7 Å²	105.7	67%	0.669	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-58.5	146.8	175.8	25.7	-34.2	0	0	0	111	N385 D480	P383-N385 PolarHBondContact O-N 2.77Å; P383-D480 WeakPolarHBondContact CA-OD1 3.26Å
384	Y	88.4	Confident	85.4	Confident	48 Å²	48	98.3 Å²	98.3	19%	0.188	56%	0.557	C	S	.	*	P	Polyproline II helix	trans	-64.6	132.7	-177.5	173.3	-110.5	0	0	0	111.1	G386 F387 G388 V390 V479 D480	Y384-G386 VanDerWaalsContact C-N 3.28Å; Y384-G386 VanDerWaalsContact CD1-N 3.34Å; Y384-G386 PolarHBondContact O-N 2.83Å; Y384-F387 WeakPolarHBondContact CE2-O 3.3Å; Y384-F387 PolarHBondContact OH-N 3.07Å; Y384-F387 PolarHBondContact OH-O 2.92Å; Y384-G388 PolarHBondContact OH-N 2.89Å; Y384-G388 PolarHBondContact OH-O 2.78Å; Y384-V390 HydrophobicContact CD1-CG2 4.07Å; Y384-V390 HydrophobicContact CD2-CB 4.44Å; Y384-V390 HydrophobicContact CD2-CG2 4.1Å; Y384-V390 HydrophobicContact CE1-CG2 4.05Å; Y384-V390 HydrophobicContact CE2-CG2 4.12Å; Y384-V390 HydrophobicContact CG-CG2 4.06Å; Y384-V479 HydrophobicContact CD1-CG1 3.8Å; Y384-V479 HydrophobicContact CE1-CG1 4.39Å; Y384-D480 WeakPolarHBondContact CB-OD1 3.41Å; Y384-D480 PolarHBondContact N-OD1 3.02Å
385	N	87.4	Confident	85.8	Confident	101 Å²	101	95.1 Å²	95.1	54%	0.54	53%	0.532	S	S	.	.			trans	-80.4	-0.5	-172.1	66.8	-0.9	0	0	0	114.8	P383 F387	P383-N385 PolarHBondContact O-N 2.77Å; N385-F387 WeakPolarHBondContact O-CD2 3.11Å; N385-F387 PolarHBondContact OD1-N 2.8Å; N385-F387 VanDerWaalsContact OD1-N 3.08Å; N385-F387 PolarHBondContact OD1-O 3.13Å
386	G	85.5	Confident	86.1	Confident	53 Å²	53	94.2 Å²	94.2	55%	0.546	52%	0.521	S	S	.	.	S	Bend	trans	87.1	-6.1	179.6	0	0	0	0	0	115.6	Y384	Y384-G386 VanDerWaalsContact C-N 3.28Å; Y384-G386 VanDerWaalsContact CD1-N 3.34Å; Y384-G386 PolarHBondContact O-N 2.83Å
387	F	85.5	Confident	86.3	Confident	157 Å²	157	91.9 Å²	91.9	69%	0.689	51%	0.507	S	S	*	.	S	Bend	trans	-107.7	134.9	-177.8	-65.8	-80.9	0	0	0	112.1	Y384 N385 S393	Y384-F387 WeakPolarHBondContact CE2-O 3.3Å; Y384-F387 PolarHBondContact OH-N 3.07Å; Y384-F387 PolarHBondContact OH-O 2.92Å; N385-F387 WeakPolarHBondContact O-CD2 3.11Å; N385-F387 PolarHBondContact OD1-N 2.8Å; N385-F387 VanDerWaalsContact OD1-N 3.08Å; N385-F387 PolarHBondContact OD1-O 3.13Å; F387-S393 PolarHBondContact O-OG 3.04Å
388	G	85.2	Confident	86.4	Confident	62 Å²	62	91.2 Å²	91.2	64%	0.639	49%	0.493	S	S	*	.	S	Bend	trans	84.5	-150.7	176.8	0	0	0	0	0	113.8	Y384	Y384-G388 PolarHBondContact OH-N 2.89Å; Y384-G388 PolarHBondContact OH-O 2.78Å
389	L	85	Confident	86.7	Confident	109 Å²	109	84.2 Å²	84.2	57%	0.571	47%	0.47	S	S	*	.			trans	-99.7	145.8	168.2	-70.9	169.9	0	0	0	108.3	E391 D392 S393	L389-E391 PolarHBondContact O-N 3.34Å; L389-D392 HydrophobicContact CB-CB 4.06Å; L389-D392 PolarHBondContact O-N 3.27Å; L389-D392 VanDerWaalsContact O-N 3.07Å; L389-S393 PolarHBondContact O-N 3.48Å; L389-S393 PolarHBondContact O-OG 2.88Å
390	V	86.8	Confident	87.2	Confident	30 Å²	30	83.3 Å²	83.3	18%	0.182	47%	0.471	C	S	.	.	H	α-helix	trans	-58	-41.5	-179.7	178.3	0	0	0	0	110.7	Y384 D392 A394 P482	Y384-V390 HydrophobicContact CD1-CG2 4.07Å; Y384-V390 HydrophobicContact CD2-CB 4.44Å; Y384-V390 HydrophobicContact CD2-CG2 4.1Å; Y384-V390 HydrophobicContact CE1-CG2 4.05Å; Y384-V390 HydrophobicContact CE2-CG2 4.12Å; Y384-V390 HydrophobicContact CG-CG2 4.06Å; V390-D392 VanDerWaalsContact C-N 3.29Å; V390-D392 PolarHBondContact O-N 3.02Å; V390-A394 WeakPolarHBondContact O-CB 3.22Å; V390-A394 PolarHBondContact O-N 3.33Å; V390-P482 HydrophobicContact CB-CG 4.23Å; V390-P482 HydrophobicContact CG2-CG 3.98Å
391	E	86.4	Confident	87.6	Confident	77 Å²	77	81.2 Å²	81.2	36%	0.36	46%	0.464	S	S	.	.	H	α-helix	trans	-68.6	-28.5	-179.8	-54	89.8	161.3	0	0	113.2	L389 Q395 P405	L389-E391 PolarHBondContact O-N 3.34Å; E391-Q395 WeakPolarHBondContact O-CG 3.34Å; E391-P405 HydrophobicContact CB-CB 4.35Å
392	D	88.9	Confident	87.8	Confident	70 Å²	70	79.9 Å²	79.9	37%	0.374	46%	0.461	S	S	.	.	H	α-helix	trans	-82.1	-45.9	179.1	-167.6	47.1	0	0	0	110.7	L389 V390 A394 Q395 P405	L389-D392 HydrophobicContact CB-CB 4.06Å; L389-D392 PolarHBondContact O-N 3.27Å; L389-D392 VanDerWaalsContact O-N 3.07Å; V390-D392 VanDerWaalsContact C-N 3.29Å; V390-D392 PolarHBondContact O-N 3.02Å; D392-A394 VanDerWaalsContact C-N 3.29Å; D392-A394 PolarHBondContact O-N 3.13Å; D392-Q395 VanDerWaalsContact O-CB 3.31Å; D392-Q395 WeakPolarHBondContact O-CB 3.29Å; D392-Q395 PolarHBondContact O-N 3.36Å; D392-P405 HydrophobicContact CB-CG 4.26Å; D392-P405 VanDerWaalsContact OD1-CD 3.24Å; D392-P405 WeakPolarHBondContact OD1-CD 3.41Å
393	S	89.4	Confident	88	Confident	17 Å²	17	83.4 Å²	83.4	12%	0.119	47%	0.468	C	S	.	.	H	α-helix	trans	-65.2	-30.9	177.3	-68.7	0	0	0	0	112.9	F387 L389 Q395 N396	F387-S393 PolarHBondContact O-OG 3.04Å; L389-S393 PolarHBondContact O-N 3.48Å; L389-S393 PolarHBondContact O-OG 2.88Å; S393-Q395 PolarHBondContact O-N 2.86Å; S393-N396 WeakPolarHBondContact O-CB 3.22Å; S393-N396 PolarHBondContact O-N 3.42Å
394	A	88.1	Confident	88.1	Confident	22 Å²	22	82.5 Å²	82.5	18%	0.182	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.1	172.2	0	0	0	0	0	112.8	V390 D392 N396 C397 F398	V390-A394 WeakPolarHBondContact O-CB 3.22Å; V390-A394 PolarHBondContact O-N 3.33Å; D392-A394 VanDerWaalsContact C-N 3.29Å; D392-A394 PolarHBondContact O-N 3.13Å; A394-N396 VanDerWaalsContact C-N 3.27Å; A394-N396 PolarHBondContact O-N 2.99Å; A394-C397 WeakPolarHBondContact O-CB 3.31Å; A394-C397 PolarHBondContact O-N 3.22Å; A394-F398 HydrophobicContact CB-CD2 4.4Å; A394-F398 HydrophobicContact CB-CE2 3.8Å; A394-F398 HydrophobicContact CB-CZ 4.45Å; A394-F398 WeakPolarHBondContact O-CD2 3.49Å; A394-F398 PolarHBondContact O-N 2.83Å
395	Q	89.5	Confident	88.1	Confident	47 Å²	47	82.4 Å²	82.4	22%	0.22	47%	0.474	C	S	.	.	H	α-helix	trans	-66	-29.3	179.7	-61.8	-65.8	-36.9	0	0	112.9	E391 D392 S393 C397 F398 A399 P402 K403	E391-Q395 WeakPolarHBondContact O-CG 3.34Å; D392-Q395 VanDerWaalsContact O-CB 3.31Å; D392-Q395 WeakPolarHBondContact O-CB 3.29Å; D392-Q395 PolarHBondContact O-N 3.36Å; S393-Q395 PolarHBondContact O-N 2.86Å; Q395-C397 PolarHBondContact O-N 2.74Å; Q395-F398 PolarHBondContact O-N 2.91Å; Q395-A399 PolarHBondContact O-N 2.84Å; Q395-A399 VanDerWaalsContact O-N 3.15Å; Q395-P402 HydrophobicContact CB-CB 4.23Å; Q395-K403 VanDerWaalsContact CG-O 3.23Å; Q395-K403 WeakPolarHBondContact CG-O 3.39Å
396	N	89.8	Confident	88.1	Confident	94 Å²	94	87.3 Å²	87.3	50%	0.503	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-26.1	172.9	-64	-37.1	0	0	0	112.3	S393 A394 P402	S393-N396 WeakPolarHBondContact O-CB 3.22Å; S393-N396 PolarHBondContact O-N 3.42Å; A394-N396 VanDerWaalsContact C-N 3.27Å; A394-N396 PolarHBondContact O-N 2.99Å; N396-P402 WeakPolarHBondContact OD1-CB 3.35Å; N396-P402 WeakPolarHBondContact OD1-CG 3.25Å
397	C	87.1	Confident	88.2	Confident	69 Å²	69	92.5 Å²	92.5	47%	0.466	50%	0.498	S	S	.	.	H	α-helix	trans	-89	-24.6	177.7	-58.4	0	0	0	0	112.3	L381 P382 A394 Q395	L381-C397 HydrophobicContact CD2-CB 3.7Å; P382-C397 VanDerWaalsContact CG-SG 3.57Å; A394-C397 WeakPolarHBondContact O-CB 3.31Å; A394-C397 PolarHBondContact O-N 3.22Å; Q395-C397 PolarHBondContact O-N 2.74Å
398	F	86.8	Confident	88.3	Confident	122 Å²	122	90.8 Å²	90.8	54%	0.535	50%	0.496	S	S	.	.	H	α-helix	trans	-82.2	-34	179.6	-66.3	-49.8	0	0	0	113.8	L381 A394 Q395	L381-F398 HydrophobicContact CD1-CE1 3.99Å; L381-F398 HydrophobicContact CD1-CZ 3.71Å; L381-F398 HydrophobicContact CD2-CD1 4.15Å; L381-F398 HydrophobicContact CD2-CE1 3.68Å; L381-F398 HydrophobicContact CD2-CZ 4.07Å; L381-F398 HydrophobicContact CG-CE1 4.22Å; L381-F398 HydrophobicContact CG-CZ 4.41Å; A394-F398 HydrophobicContact CB-CD2 4.4Å; A394-F398 HydrophobicContact CB-CE2 3.8Å; A394-F398 HydrophobicContact CB-CZ 4.45Å; A394-F398 WeakPolarHBondContact O-CD2 3.49Å; A394-F398 PolarHBondContact O-N 2.83Å; Q395-F398 PolarHBondContact O-N 2.91Å
399	A	87	Confident	88.6	Confident	41 Å²	41	92.2 Å²	92.2	34%	0.339	49%	0.492	S	S	.	.			trans	-146.3	147.5	-176.4	0	0	0	0	0	111.9	Q395 I401	Q395-A399 PolarHBondContact O-N 2.84Å; Q395-A399 VanDerWaalsContact O-N 3.15Å; A399-I401 VanDerWaalsContact C-N 3.26Å; A399-I401 PolarHBondContact O-N 3.34Å
400	L	89.7	Confident	88.9	Confident	176 Å²	176	93.7 Å²	93.7	92%	0.921	50%	0.499	S	S	*	.	S	Bend	trans	-59.3	-37.2	176.3	-178.6	65.8	0	0	0	112.6
401	I	92.9	Very high	89.1	Confident	135 Å²	135	95.5 Å²	95.5	69%	0.692	51%	0.505	S	S	*	.	S	Bend	trans	-106.1	104.9	172.9	-58.5	174.2	0	0	0	106.5	A399 K403	A399-I401 VanDerWaalsContact C-N 3.26Å; A399-I401 PolarHBondContact O-N 3.34Å; I401-K403 PolarHBondContact O-N 3.1Å
402	P	90.1	Very high	89.2	Confident	66 Å²	66	95.4 Å²	95.4	43%	0.429	51%	0.505	S	S	.	.			trans	-65	137.2	-176.7	26.7	-34.4	0	0	0	110.1	Q395 N396	Q395-P402 HydrophobicContact CB-CB 4.23Å; N396-P402 WeakPolarHBondContact OD1-CB 3.35Å; N396-P402 WeakPolarHBondContact OD1-CG 3.25Å
403	K	90.2	Very high	89.3	Confident	153 Å²	153	98 Å²	98	67%	0.665	52%	0.519	S	S	*	.			trans	-104.5	138.2	174.8	-67.1	-179.9	-178	174.2	0	108.2	Q395 I401	Q395-K403 VanDerWaalsContact CG-O 3.23Å; Q395-K403 WeakPolarHBondContact CG-O 3.39Å; I401-K403 PolarHBondContact O-N 3.1Å
404	A	89.8	Confident	89.4	Confident	83 Å²	83	101.5 Å²	101.5	69%	0.686	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-55.8	135.1	175.8	0	0	0	0	0	110.4	K406	A404-K406 PolarHBondContact O-N 2.74Å
405	P	89	Confident	89.5	Confident	47 Å²	47	101.7 Å²	101.7	31%	0.305	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-60.8	134.6	178.9	24.3	-33.4	0	0	0	110	E391 D392 K407	E391-P405 HydrophobicContact CB-CB 4.35Å; D392-P405 HydrophobicContact CB-CG 4.26Å; D392-P405 VanDerWaalsContact OD1-CD 3.24Å; D392-P405 WeakPolarHBondContact OD1-CD 3.41Å; P405-K407 PolarHBondContact O-N 3.49Å
406	K	88	Confident	89.3	Confident	204 Å²	204	104.2 Å²	104.2	89%	0.887	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-74	127.6	179	-66.5	-178.8	179.6	179.2	0	109.1	A404	A404-K406 PolarHBondContact O-N 2.74Å
407	K	87.4	Confident	89.1	Confident	162 Å²	162	106.5 Å²	106.5	70%	0.704	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-83.6	150.5	172.3	-61.1	-179.2	-177.6	178	0	109.8	P405 V409 M412	P405-K407 PolarHBondContact O-N 3.49Å; K407-V409 VanDerWaalsContact C-N 3.27Å; K407-V409 WeakPolarHBondContact O-CG2 3.44Å; K407-V409 PolarHBondContact O-N 2.78Å; K407-M412 HydrophobicContact CB-SD 4.34Å
408	D	88.2	Confident	89.4	Confident	121 Å²	121	106.5 Å²	106.5	65%	0.647	56%	0.556	S	S	*	*			trans	-73.8	80.9	175	-69.4	-29.4	0	0	0	111	I410 K411 M412	D408-I410 VanDerWaalsContact C-N 3.25Å; D408-I410 PolarHBondContact O-N 3.34Å; D408-K411 HydrophobicContact CB-CB 3.9Å; D408-K411 WeakPolarHBondContact O-CB 3.23Å; D408-K411 PolarHBondContact O-N 3.02Å; D408-K411 VanDerWaalsContact O-N 3.13Å; D408-M412 PolarHBondContact O-N 3.46Å
409	V	89.8	Confident	89.7	Confident	91 Å²	91	102 Å²	102	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-57	-40.2	-177.1	-179.8	0	0	0	0	111.2	K407 K411 M412 L413	K407-V409 VanDerWaalsContact C-N 3.27Å; K407-V409 WeakPolarHBondContact O-CG2 3.44Å; K407-V409 PolarHBondContact O-N 2.78Å; V409-K411 PolarHBondContact O-N 3.42Å; V409-M412 WeakPolarHBondContact O-CB 3.12Å; V409-M412 PolarHBondContact O-N 3.22Å; V409-M412 VanDerWaalsContact O-N 3.16Å; V409-L413 HydrophobicContact CG1-CD1 3.4Å; V409-L413 VanDerWaalsContact CG1-CD1 3.4Å; V409-L413 WeakPolarHBondContact O-CD1 3.21Å; V409-L413 PolarHBondContact O-N 3.06Å
410	I	91.6	Very high	90	Very high	140 Å²	140	100 Å²	100	72%	0.718	52%	0.523	S	S	*	.	H	α-helix	trans	-59.9	-46.4	178.5	-59.9	173.2	0	0	0	110.9	D408 M412 L413 V414	D408-I410 VanDerWaalsContact C-N 3.25Å; D408-I410 PolarHBondContact O-N 3.34Å; I410-M412 VanDerWaalsContact C-N 3.29Å; I410-M412 PolarHBondContact O-N 3.29Å; I410-L413 PolarHBondContact O-N 3.28Å; I410-V414 HydrophobicContact CG2-CG2 4.16Å; I410-V414 WeakPolarHBondContact O-CB 3.49Å; I410-V414 VanDerWaalsContact O-CG2 3.29Å; I410-V414 WeakPolarHBondContact O-CG2 3.44Å; I410-V414 PolarHBondContact O-N 2.81Å
411	K	90.9	Very high	90.3	Very high	68 Å²	68	97.7 Å²	97.7	30%	0.296	50%	0.501	S	S	.	.	H	α-helix	trans	-61.4	-41.2	177.4	-175.7	176.5	-179.9	176.1	0	111.1	D408 V409 N415 L444 D447	D408-K411 HydrophobicContact CB-CB 3.9Å; D408-K411 WeakPolarHBondContact O-CB 3.23Å; D408-K411 PolarHBondContact O-N 3.02Å; D408-K411 VanDerWaalsContact O-N 3.13Å; V409-K411 PolarHBondContact O-N 3.42Å; K411-N415 WeakPolarHBondContact O-CB 3.34Å; K411-N415 PolarHBondContact O-N 3.46Å; K411-N415 VanDerWaalsContact O-N 3.13Å; K411-L444 VanDerWaalsContact CE-O 3.27Å; K411-L444 WeakPolarHBondContact CE-O 3.44Å; K411-D447 VanDerWaalsContact CE-OD1 3.27Å; K411-D447 WeakPolarHBondContact CE-OD1 3.15Å; K411-D447 IonicContact NZ-OD1 2.65Å; K411-D447 PolarHBondContact NZ-OD1 3.42Å; K411-D447 IonicContact NZ-OD2 3.12Å; K411-D447 PolarHBondContact NZ-OD2 2.99Å
412	M	89.3	Confident	90.3	Very high	75 Å²	75	91.3 Å²	91.3	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-43.3	177.2	-68.7	-177.4	64.6	0	0	112.5	K407 D408 V409 I410 D416 A445	K407-M412 HydrophobicContact CB-SD 4.34Å; D408-M412 PolarHBondContact O-N 3.46Å; V409-M412 WeakPolarHBondContact O-CB 3.12Å; V409-M412 PolarHBondContact O-N 3.22Å; V409-M412 VanDerWaalsContact O-N 3.16Å; I410-M412 VanDerWaalsContact C-N 3.29Å; I410-M412 PolarHBondContact O-N 3.29Å; M412-D416 WeakPolarHBondContact O-CB 3.48Å; M412-D416 PolarHBondContact O-N 2.91Å; M412-A445 WeakPolarHBondContact CG-O 3.41Å
413	L	91.3	Very high	90.5	Very high	125 Å²	125	91.1 Å²	91.1	65%	0.654	46%	0.464	S	S	*	.	H	α-helix	trans	-72.4	-45	179.7	-83.8	86.2	0	0	0	112.6	V409 I410 N415 D416	V409-L413 HydrophobicContact CG1-CD1 3.4Å; V409-L413 VanDerWaalsContact CG1-CD1 3.4Å; V409-L413 WeakPolarHBondContact O-CD1 3.21Å; V409-L413 PolarHBondContact O-N 3.06Å; I410-L413 PolarHBondContact O-N 3.28Å; L413-N415 VanDerWaalsContact C-N 3.3Å; L413-N415 PolarHBondContact O-N 3.12Å; L413-D416 PolarHBondContact O-N 2.8Å
414	V	90.4	Very high	90.7	Very high	90 Å²	90	83.8 Å²	83.8	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-68.3	-32.7	-175	172.1	0	0	0	0	112	I410 K418	I410-V414 HydrophobicContact CG2-CG2 4.16Å; I410-V414 WeakPolarHBondContact O-CB 3.49Å; I410-V414 VanDerWaalsContact O-CG2 3.29Å; I410-V414 WeakPolarHBondContact O-CG2 3.44Å; I410-V414 PolarHBondContact O-N 2.81Å; V414-K418 WeakPolarHBondContact O-CE 3.32Å; V414-K418 PolarHBondContact O-NZ 3.16Å
415	N	90.2	Very high	90.9	Very high	26 Å²	26	80.5 Å²	80.5	14%	0.139	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	15.8	-178.4	-64.3	-28	0	0	0	113.2	K411 L413 N417 K418 L444 A445	K411-N415 WeakPolarHBondContact O-CB 3.34Å; K411-N415 PolarHBondContact O-N 3.46Å; K411-N415 VanDerWaalsContact O-N 3.13Å; L413-N415 VanDerWaalsContact C-N 3.3Å; L413-N415 PolarHBondContact O-N 3.12Å; N415-N417 PolarHBondContact O-N 3.44Å; N415-K418 HydrophobicContact CB-CD 4.4Å; N415-K418 WeakPolarHBondContact O-CB 3.48Å; N415-K418 PolarHBondContact O-N 3.47Å; N415-K418 VanDerWaalsContact O-N 3.09Å; N415-K418 PolarHBondContact OD1-NZ 3.29Å; N415-L444 HydrophobicContact CB-CB 3.75Å; N415-L444 PolarHBondContact ND2-O 2.83Å; N415-A445 HydrophobicContact CB-CB 4.43Å
416	D	85.1	Confident	91	Very high	101 Å²	101	78.8 Å²	78.8	54%	0.54	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137.2	174.3	-166.2	37.2	0	0	0	110.1	M412 L413 K418	M412-D416 WeakPolarHBondContact O-CB 3.48Å; M412-D416 PolarHBondContact O-N 2.91Å; L413-D416 PolarHBondContact O-N 2.8Å; D416-K418 PolarHBondContact O-N 3.44Å
417	N	86.9	Confident	91	Very high	142 Å²	142	73.2 Å²	73.2	76%	0.759	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	2.5	-173.2	-53.4	-57.7	0	0	0	117.2	N415 V419	N415-N417 PolarHBondContact O-N 3.44Å; N417-V419 PolarHBondContact O-N 3.46Å
418	K	91.8	Very high	91	Very high	68 Å²	68	66.6 Å²	66.6	30%	0.296	34%	0.344	S	S	.	.			trans	-85.4	110.8	174.1	-58	-173.4	-175.1	152	0	110.6	V414 N415 D416 L444 Y511	V414-K418 WeakPolarHBondContact O-CE 3.32Å; V414-K418 PolarHBondContact O-NZ 3.16Å; N415-K418 HydrophobicContact CB-CD 4.4Å; N415-K418 WeakPolarHBondContact O-CB 3.48Å; N415-K418 PolarHBondContact O-N 3.47Å; N415-K418 VanDerWaalsContact O-N 3.09Å; N415-K418 PolarHBondContact OD1-NZ 3.29Å; D416-K418 PolarHBondContact O-N 3.44Å; K418-L444 HydrophobicContact CB-CB 4.31Å; K418-L444 HydrophobicContact CB-CD1 3.84Å; K418-L444 PolarHBondContact O-N 3.13Å; K418-Y511 WeakPolarHBondContact CG-OH 3.47Å
419	V	93.9	Very high	90.8	Very high	28 Å²	28	66.8 Å²	66.8	17%	0.17	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125	-179.7	-172.6	0	0	0	0	109.4	N417 R421 Y442 F443 Y511	N417-V419 PolarHBondContact O-N 3.46Å; V419-R421 HydrophobicContact CG1-CG 4.29Å; V419-Y442 CarbonylContact C-O 3.54Å; V419-Y442 WeakPolarHBondContact CA-O 3.25Å; V419-F443 HydrophobicContact CB-CD1 4.48Å; V419-F443 HydrophobicContact CG1-CD1 4.2Å; V419-F443 HydrophobicContact CG1-CE1 4.03Å; V419-F443 HydrophobicContact CG1-CZ 4.3Å; V419-F443 HydrophobicContact CG2-CD1 3.53Å; V419-F443 HydrophobicContact CG2-CE1 3.59Å; V419-F443 HydrophobicContact CG2-CG 4.49Å; V419-Y511 WeakPolarHBondContact O-CD1 3.5Å
420	L	93.8	Very high	90.5	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.5	174.7	-52.9	177.7	0	0	0	108.9	Y422 S441 Y442 L444 P487 Y511 V512 Y515	L420-Y422 HydrophobicContact CB-CE2 3.52Å; L420-Y422 WeakPolarHBondContact CD1-OH 3.4Å; L420-S441 CarbonylContact O-C 3.56Å; L420-S441 WeakPolarHBondContact O-CA 3.25Å; L420-Y442 PolarHBondContact N-O 3.02Å; L420-Y442 PolarHBondContact O-N 3.13Å; L420-L444 HydrophobicContact CD1-CD1 4.17Å; L420-L444 HydrophobicContact CD1-CD2 3.96Å; L420-L444 HydrophobicContact CD1-CG 4.18Å; L420-L444 HydrophobicContact CD2-CD1 4.06Å; L420-L444 HydrophobicContact CG-CD1 3.94Å; L420-L444 HydrophobicContact CG-CD2 4.45Å; L420-L444 HydrophobicContact CG-CG 4.12Å; L420-P487 HydrophobicContact CD1-CB 4.17Å; L420-Y511 HydrophobicContact CD2-CD1 4.29Å; L420-Y511 HydrophobicContact CD2-CE1 4.01Å; L420-V512 HydrophobicContact CB-CG2 3.8Å; L420-V512 HydrophobicContact CD2-CG2 4.02Å; L420-Y515 HydrophobicContact CD1-CD1 3.9Å; L420-Y515 HydrophobicContact CD1-CE1 3.87Å; L420-Y515 HydrophobicContact CD2-CD1 3.71Å; L420-Y515 HydrophobicContact CD2-CD2 4.27Å; L420-Y515 HydrophobicContact CD2-CE1 4.32Å; L420-Y515 HydrophobicContact CD2-CG 3.69Å; L420-Y515 HydrophobicContact CG-CD1 4.46Å
421	R	95.1	Very high	90.1	Very high	126 Å²	126	63.6 Å²	63.6	48%	0.475	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.3	-176.5	-68.9	178.4	-175.6	159.5	3	111.2	V419 F440 D509 V512	V419-R421 HydrophobicContact CG1-CG 4.29Å; R421-F440 CarbonylContact C-O 3.54Å; R421-F440 WeakPolarHBondContact CA-O 3.4Å; R421-D509 HydrophobicContact CB-CB 4.29Å; R421-D509 VanDerWaalsContact CB-OD2 3.29Å; R421-D509 WeakPolarHBondContact CB-OD2 3.15Å; R421-D509 WeakPolarHBondContact CD-OD2 3.36Å; R421-D509 PolarHBondContact O-N 3.21Å; R421-D509 VanDerWaalsContact O-N 3.11Å; R421-V512 VanDerWaalsContact N-CG2 3.31Å; R421-V512 WeakPolarHBondContact O-CG2 3.38Å
422	Y	94.3	Very high	89.7	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.008	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.9	-176.7	-52.9	-95.8	0	0	0	109.7	L420 V439 F440 F490 I505 T508 V512	L420-Y422 HydrophobicContact CB-CE2 3.52Å; L420-Y422 WeakPolarHBondContact CD1-OH 3.4Å; Y422-V439 CarbonylContact O-C 3.59Å; Y422-V439 WeakPolarHBondContact O-CA 3.31Å; Y422-F440 HydrophobicContact CD2-CB 4.41Å; Y422-F440 PolarHBondContact N-O 3.4Å; Y422-F440 PolarHBondContact O-N 2.81Å; Y422-F490 HydrophobicContact CD1-CB 4.29Å; Y422-F490 HydrophobicContact CD2-CB 4.5Å; Y422-F490 HydrophobicContact CD2-CD1 4.25Å; Y422-F490 HydrophobicContact CE1-CB 3.69Å; Y422-F490 HydrophobicContact CE2-CB 3.9Å; Y422-F490 HydrophobicContact CE2-CD1 4.26Å; Y422-F490 HydrophobicContact CE2-CG 4.08Å; Y422-F490 VanDerWaalsContact CZ-CB 3.48Å; Y422-I505 HydrophobicContact CD1-CG2 4.09Å; Y422-T508 HydrophobicContact CD1-CG2 3.53Å; Y422-T508 HydrophobicContact CE1-CG2 3.87Å; Y422-V512 HydrophobicContact CD1-CG1 4.45Å; Y422-V512 HydrophobicContact CE1-CG1 3.55Å
423	L	94.3	Very high	89.4	Confident	61 Å²	61	64 Å²	64	32%	0.319	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.2	169.2	-172.3	68.5	0	0	0	108.6	R437 L506 D507	L423-R437 HydrophobicContact CD1-CB 4.19Å; L423-L506 PolarHBondContact O-N 3.04Å; L423-D507 HydrophobicContact CB-CB 3.93Å; L423-D507 HydrophobicContact CD2-CB 4.15Å; L423-D507 PolarHBondContact N-O 3.08Å; L423-D507 PolarHBondContact O-N 3.17Å
424	A	94.6	Very high	89	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.7	-178.9	0	0	0	0	0	111.6	F438 F440 F503 I504 I505	A424-F438 PolarHBondContact N-O 2.91Å; A424-F438 PolarHBondContact O-N 3.27Å; A424-F440 HydrophobicContact CB-CD2 3.56Å; A424-F440 HydrophobicContact CB-CE2 3.66Å; A424-F503 HydrophobicContact CB-CB 4.3Å; A424-I504 CarbonylContact C-O 3.48Å; A424-I504 WeakPolarHBondContact CA-O 3.37Å; A424-I505 HydrophobicContact CB-CD1 3.9Å
425	A	92.9	Very high	88.7	Confident	14 Å²	14	65.9 Å²	65.9	12%	0.116	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	146.1	167.8	0	0	0	0	0	110.1	F503 I504 L506	A425-F503 CarbonylContact O-C 3.6Å; A425-F503 WeakPolarHBondContact O-CA 3.43Å; A425-I504 PolarHBondContact N-O 2.96Å; A425-I504 PolarHBondContact O-N 3.36Å; A425-L506 HydrophobicContact CB-CD1 3.72Å; A425-L506 HydrophobicContact CB-CG 4.12Å
426	L	91.6	Very high	88.7	Confident	10 Å²	10	66.6 Å²	66.6	5%	0.052	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	124.6	177	177.1	64.9	0	0	0	109.8	S428 D433 F438 H501 F503	L426-S428 PolarHBondContact O-N 3.13Å; L426-D433 HydrophobicContact CD2-CB 4.1Å; L426-F438 HydrophobicContact CB-CD2 4.17Å; L426-F438 HydrophobicContact CB-CE2 3.51Å; L426-F438 HydrophobicContact CB-CZ 4.29Å; L426-F438 HydrophobicContact CD2-CE2 4.41Å; L426-F438 HydrophobicContact CD2-CZ 4.41Å; L426-H501 HydrophobicContact CD1-CB 3.95Å; L426-F503 HydrophobicContact CB-CD1 4.16Å; L426-F503 HydrophobicContact CB-CE1 3.99Å; L426-F503 HydrophobicContact CD1-CD1 4.07Å; L426-F503 HydrophobicContact CD1-CE1 3.68Å; L426-F503 HydrophobicContact CD1-CE2 4.25Å; L426-F503 HydrophobicContact CD1-CZ 3.78Å; L426-F503 HydrophobicContact CG-CE1 4.35Å
427	E	88.5	Confident	89	Confident	87 Å²	87	66.5 Å²	66.5	41%	0.407	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	88.8	171.6	-170.5	-179.1	-164.3	0	0	108.4	R502 I504	E427-R502 HydrophobicContact CB-CB 4.15Å; E427-R502 WeakPolarHBondContact CB-O 3.32Å; E427-R502 PolarHBondContact N-O 3.31Å; E427-R502 IonicContact OE1-NH2 3.28Å; E427-R502 PolarHBondContact OE1-NH2 3.42Å; E427-R502 IonicContact OE2-CZ 3.65Å; E427-R502 IonicContact OE2-NE 3.73Å; E427-R502 PolarHBondContact OE2-NE 3.44Å; E427-R502 IonicContact OE2-NH2 2.72Å; E427-R502 PolarHBondContact OE2-NH2 3.46Å; E427-I504 HydrophobicContact CB-CD1 4.12Å; E427-I504 HydrophobicContact CB-CG1 4.27Å; E427-I504 HydrophobicContact CG-CD1 4.24Å
428	S	85.9	Confident	89.4	Confident	23 Å²	23	59.7 Å²	59.7	16%	0.161	30%	0.298	C	S	.	.			trans	-119.6	144.2	-179.8	179.5	0	0	0	0	110.7	L426 I430 D433	L426-S428 PolarHBondContact O-N 3.13Å; S428-I430 PolarHBondContact O-N 3.17Å; S428-I430 WeakPolarHBondContact OG-CB 3.48Å; S428-I430 PolarHBondContact OG-N 2.93Å; S428-D433 PolarHBondContact OG-OD2 2.75Å
429	P	84.2	Confident	89.5	Confident	125 Å²	125	58.2 Å²	58.2	81%	0.812	29%	0.294	S	S	*	.	S	Bend	trans	-67.3	-17	171.6	28.7	-34.6	0	0	0	112.5	P431	P429-P431 WeakPolarHBondContact O-CD 3.21Å
430	I	85.1	Confident	89.6	Confident	83 Å²	83	57 Å²	57	43%	0.426	29%	0.287	S	S	.	.	S	Bend	trans	-77.6	119.4	-179.9	-60	175.5	0	0	0	108.9	S428 E432 D433	S428-I430 PolarHBondContact O-N 3.17Å; S428-I430 WeakPolarHBondContact OG-CB 3.48Å; S428-I430 PolarHBondContact OG-N 2.93Å; I430-E432 VanDerWaalsContact C-N 3.25Å; I430-E432 HydrophobicContact CG2-CB 4.1Å; I430-E432 WeakPolarHBondContact CG2-OE2 3.2Å; I430-E432 PolarHBondContact O-N 2.96Å; I430-D433 HydrophobicContact CB-CB 4.39Å; I430-D433 PolarHBondContact O-N 2.84Å; I430-D433 VanDerWaalsContact O-N 3.16Å
431	P	82.8	Confident	89.7	Confident	81 Å²	81	57.9 Å²	57.9	53%	0.526	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-56.8	-36.3	-179.2	-26.1	34.7	0	0	0	114.1	P429 D433 K434	P429-P431 WeakPolarHBondContact O-CD 3.21Å; P431-D433 PolarHBondContact O-N 3.32Å; P431-K434 WeakPolarHBondContact O-CB 3.34Å; P431-K434 PolarHBondContact O-N 3.42Å
432	E	82	Confident	89.7	Confident	129 Å²	129	52 Å²	52	60%	0.603	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-64.6	-25.4	-179	-62.6	76.9	-171.7	0	0	112.6	I430	I430-E432 VanDerWaalsContact C-N 3.25Å; I430-E432 HydrophobicContact CG2-CB 4.1Å; I430-E432 WeakPolarHBondContact CG2-OE2 3.2Å; I430-E432 PolarHBondContact O-N 2.96Å
433	D	83.6	Confident	89.7	Confident	22 Å²	22	53.3 Å²	53.3	12%	0.118	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-83.1	-17.7	179.5	-78.2	-29.3	0	0	0	113.4	L426 S428 I430 P431 D435 R436	L426-D433 HydrophobicContact CD2-CB 4.1Å; S428-D433 PolarHBondContact OG-OD2 2.75Å; I430-D433 HydrophobicContact CB-CB 4.39Å; I430-D433 PolarHBondContact O-N 2.84Å; I430-D433 VanDerWaalsContact O-N 3.16Å; P431-D433 PolarHBondContact O-N 3.32Å; D433-D435 VanDerWaalsContact C-N 3.28Å; D433-D435 PolarHBondContact O-N 2.62Å; D433-R436 WeakPolarHBondContact O-CB 3.35Å; D433-R436 PolarHBondContact O-N 3.28Å; D433-R436 WeakPolarHBondContact OD1-CD 3.38Å; D433-R436 IonicContact OD1-CZ 3.97Å; D433-R436 IonicContact OD1-NE 3.76Å; D433-R436 IonicContact OD1-NH1 3.46Å; D433-R436 PolarHBondContact OD1-NH1 3.47Å
434	K	82.3	Confident	89.6	Confident	124 Å²	124	50.6 Å²	50.6	54%	0.539	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.8	-174.8	-68.6	-176.5	177.2	179.1	0	113.2	P431 R436 R437	P431-K434 WeakPolarHBondContact O-CB 3.34Å; P431-K434 PolarHBondContact O-N 3.42Å; K434-R436 VanDerWaalsContact C-N 3.34Å; K434-R437 PolarHBondContact O-NH1 3.05Å
435	D	84.6	Confident	89.5	Confident	131 Å²	131	51.4 Å²	51.4	70%	0.701	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-6.5	-179.4	-66.7	-32.7	0	0	0	112.9	D433 R437	D433-D435 VanDerWaalsContact C-N 3.28Å; D433-D435 PolarHBondContact O-N 2.62Å; D435-R437 VanDerWaalsContact C-NH1 3.33Å; D435-R437 PolarHBondContact O-NH1 3.33Å
436	R	90.2	Very high	89.3	Confident	42 Å²	42	52.9 Å²	52.9	16%	0.158	28%	0.277	C	S	.	.			trans	-71.5	138.3	177.5	-60.1	173.4	71.6	-177.8	-0	110.3	D433 K434 F438 E453 I461	D433-R436 WeakPolarHBondContact O-CB 3.35Å; D433-R436 PolarHBondContact O-N 3.28Å; D433-R436 WeakPolarHBondContact OD1-CD 3.38Å; D433-R436 IonicContact OD1-CZ 3.97Å; D433-R436 IonicContact OD1-NE 3.76Å; D433-R436 IonicContact OD1-NH1 3.46Å; D433-R436 PolarHBondContact OD1-NH1 3.47Å; K434-R436 VanDerWaalsContact C-N 3.34Å; R436-F438 HydrophobicContact CB-CE2 3.6Å; R436-F438 HydrophobicContact CB-CZ 3.83Å; R436-E453 IonicContact CZ-OE1 3.72Å; R436-E453 IonicContact CZ-OE2 3.49Å; R436-E453 IonicContact NE-OE1 3.87Å; R436-E453 PolarHBondContact NE-OE1 2.92Å; R436-E453 IonicContact NE-OE2 2.79Å; R436-E453 IonicContact NH2-OE1 2.77Å; R436-E453 PolarHBondContact NH2-OE1 3.39Å; R436-E453 IonicContact NH2-OE2 3.32Å; R436-E453 PolarHBondContact NH2-OE2 3.26Å; R436-I461 HydrophobicContact CG-CD1 4.03Å
437	R	91.3	Very high	89.3	Confident	98 Å²	98	54.1 Å²	54.1	37%	0.37	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.2	178.7	-62.3	-65.1	177.2	-89.9	-4.6	109	L423 K434 D435 P454	L423-R437 HydrophobicContact CD1-CB 4.19Å; K434-R437 PolarHBondContact O-NH1 3.05Å; D435-R437 VanDerWaalsContact C-NH1 3.33Å; D435-R437 PolarHBondContact O-NH1 3.33Å; R437-P454 VanDerWaalsContact O-CD 3.27Å; R437-P454 WeakPolarHBondContact O-CD 3.29Å
438	F	94.6	Very high	89.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	139.7	-176.3	-59.7	-87.9	0	0	0	109.2	A424 L426 R436 F440 I451 F452 E453 Y466 F503	A424-F438 PolarHBondContact N-O 2.91Å; A424-F438 PolarHBondContact O-N 3.27Å; L426-F438 HydrophobicContact CB-CD2 4.17Å; L426-F438 HydrophobicContact CB-CE2 3.51Å; L426-F438 HydrophobicContact CB-CZ 4.29Å; L426-F438 HydrophobicContact CD2-CE2 4.41Å; L426-F438 HydrophobicContact CD2-CZ 4.41Å; R436-F438 HydrophobicContact CB-CE2 3.6Å; R436-F438 HydrophobicContact CB-CZ 3.83Å; F438-F440 HydrophobicContact CB-CD2 4.49Å; F438-F440 HydrophobicContact CB-CE2 4.38Å; F438-I451 HydrophobicContact CB-CG2 3.83Å; F438-I451 HydrophobicContact CD1-CG2 3.93Å; F438-I451 HydrophobicContact CG-CG2 4.22Å; F438-F452 CarbonylContact C-O 3.55Å; F438-E453 HydrophobicContact CD1-CB 3.92Å; F438-E453 HydrophobicContact CD1-CG 4.33Å; F438-E453 HydrophobicContact CE1-CB 3.94Å; F438-E453 HydrophobicContact CE1-CG 4.08Å; F438-Y466 HydrophobicContact CD1-CD2 4.36Å; F438-Y466 HydrophobicContact CD1-CG 4.24Å; F438-Y466 AromaticContact CE1-CD2 3.65Å; F438-Y466 HydrophobicContact CE1-CD2 3.65Å; F438-Y466 HydrophobicContact CE1-CE2 4Å; F438-Y466 AromaticContact CE1-CG 3.97Å; F438-Y466 HydrophobicContact CE1-CG 3.97Å; F438-Y466 HydrophobicContact CZ-CE2 4.46Å; F438-F503 HydrophobicContact CB-CE1 4.49Å; F438-F503 HydrophobicContact CD1-CE1 4.32Å; F438-F503 HydrophobicContact CD2-CD1 4.08Å; F438-F503 AromaticContact CD2-CE1 3.75Å; F438-F503 HydrophobicContact CD2-CE1 3.75Å; F438-F503 HydrophobicContact CE2-CE1 4.02Å; F438-F503 HydrophobicContact CG-CD1 4.38Å; F438-F503 AromaticContact CG-CE1 3.92Å; F438-F503 HydrophobicContact CG-CE1 3.92Å; F438-F503 HydrophobicContact CZ-CE1 4.4Å
439	V	94.9	Very high	90	Very high	37 Å²	37	51.8 Å²	51.8	22%	0.224	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	111.7	173.2	-177.6	0	0	0	0	107.7	Y422 F452 P454	Y422-V439 CarbonylContact O-C 3.59Å; Y422-V439 WeakPolarHBondContact O-CA 3.31Å; V439-F452 PolarHBondContact N-O 2.97Å; V439-F452 PolarHBondContact O-N 2.67Å; V439-P454 HydrophobicContact CG2-CG 3.87Å
440	F	95.6	Very high	90.5	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	122.4	171.8	-88.2	-115	0	0	0	108.9	R421 Y422 A424 F438 I449 I451 F490 I496 V498 F503	R421-F440 CarbonylContact C-O 3.54Å; R421-F440 WeakPolarHBondContact CA-O 3.4Å; Y422-F440 HydrophobicContact CD2-CB 4.41Å; Y422-F440 PolarHBondContact N-O 3.4Å; Y422-F440 PolarHBondContact O-N 2.81Å; A424-F440 HydrophobicContact CB-CD2 3.56Å; A424-F440 HydrophobicContact CB-CE2 3.66Å; F438-F440 HydrophobicContact CB-CD2 4.49Å; F438-F440 HydrophobicContact CB-CE2 4.38Å; F440-I449 HydrophobicContact CD1-CG2 3.75Å; F440-I449 HydrophobicContact CE1-CG2 4.1Å; F440-I451 HydrophobicContact CD1-CD1 4.46Å; F440-I451 HydrophobicContact CD1-CG1 4.09Å; F440-I451 HydrophobicContact CD2-CG1 4.2Å; F440-I451 HydrophobicContact CD2-CG2 4.19Å; F440-I451 HydrophobicContact CE1-CD1 3.69Å; F440-I451 HydrophobicContact CE1-CG1 3.82Å; F440-I451 HydrophobicContact CE2-CD1 3.89Å; F440-I451 HydrophobicContact CE2-CG1 3.92Å; F440-I451 HydrophobicContact CE2-CG2 3.91Å; F440-I451 HydrophobicContact CG-CG1 4.28Å; F440-I451 HydrophobicContact CZ-CD1 3.35Å; F440-I451 HydrophobicContact CZ-CG1 3.72Å; F440-I451 HydrophobicContact CZ-CG2 4.47Å; F440-F490 AromaticContact CD1-CE1 3.93Å; F440-F490 HydrophobicContact CD1-CE1 3.93Å; F440-F490 HydrophobicContact CE1-CE1 4.46Å; F440-I496 HydrophobicContact CE1-CG2 4.32Å; F440-V498 HydrophobicContact CE1-CG2 4.01Å; F440-V498 HydrophobicContact CZ-CG2 4.19Å; F440-F503 HydrophobicContact CE2-CB 3.87Å; F440-F503 AromaticContact CE2-CD1 3.78Å; F440-F503 HydrophobicContact CE2-CD1 3.78Å; F440-F503 HydrophobicContact CE2-CD2 4.22Å; F440-F503 HydrophobicContact CE2-CE1 4.35Å; F440-F503 AromaticContact CE2-CG 3.7Å; F440-F503 HydrophobicContact CE2-CG 3.7Å; F440-F503 HydrophobicContact CZ-CB 3.71Å; F440-F503 HydrophobicContact CZ-CD1 4.07Å; F440-F503 AromaticContact CZ-CD2 3.65Å; F440-F503 HydrophobicContact CZ-CD2 3.65Å; F440-F503 HydrophobicContact CZ-CE2 4.24Å; F440-F503 AromaticContact CZ-CG 3.54Å; F440-F503 HydrophobicContact CZ-CG 3.54Å
441	S	94.9	Very high	91	Very high	19 Å²	19	42.7 Å²	42.7	13%	0.133	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.6	172.4	-65.3	0	0	0	0	109.4	L420 I449 S450	L420-S441 CarbonylContact O-C 3.56Å; L420-S441 WeakPolarHBondContact O-CA 3.25Å; S441-I449 WeakPolarHBondContact O-CA 3.49Å; S441-S450 PolarHBondContact N-O 2.99Å; S441-S450 PolarHBondContact O-N 3.2Å
442	Y	94.8	Very high	91.6	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.2	174.4	-170.6	-85.1	0	0	0	110.3	V419 L420 L444 D447 I449 Y485 P487 F490	V419-Y442 CarbonylContact C-O 3.54Å; V419-Y442 WeakPolarHBondContact CA-O 3.25Å; L420-Y442 PolarHBondContact N-O 3.02Å; L420-Y442 PolarHBondContact O-N 3.13Å; Y442-L444 HydrophobicContact CD1-CD2 4.06Å; Y442-L444 HydrophobicContact CD1-CG 4.36Å; Y442-L444 HydrophobicContact CE1-CD2 3.96Å; Y442-D447 WeakPolarHBondContact OH-CB 3.47Å; Y442-D447 PolarHBondContact OH-OD1 3.49Å; Y442-I449 HydrophobicContact CD2-CD1 4.2Å; Y442-I449 HydrophobicContact CD2-CG1 3.55Å; Y442-I449 HydrophobicContact CE2-CD1 4.31Å; Y442-I449 HydrophobicContact CE2-CG1 4.02Å; Y442-Y485 WeakPolarHBondContact CE2-O 3.29Å; Y442-Y485 PolarHBondContact OH-O 2.8Å; Y442-Y485 VanDerWaalsContact OH-O 3.05Å; Y442-P487 HydrophobicContact CE1-CB 4.42Å; Y442-F490 HydrophobicContact CD2-CD2 4.11Å; Y442-F490 AromaticContact CD2-CE2 3.48Å; Y442-F490 HydrophobicContact CD2-CE2 3.48Å; Y442-F490 VanDerWaalsContact CD2-CE2 3.48Å; Y442-F490 HydrophobicContact CD2-CZ 4.05Å; Y442-F490 HydrophobicContact CE2-CD2 4.49Å; Y442-F490 AromaticContact CE2-CE2 3.79Å; Y442-F490 HydrophobicContact CE2-CE2 3.79Å; Y442-F490 HydrophobicContact CG-CE2 4.41Å
443	F	94.9	Very high	92.2	Very high	31 Å²	31	37.8 Å²	37.8	14%	0.136	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	108.2	-178.6	-63.6	-89.5	0	0	0	110.2	V419 A445 T446 D447 M448 R469	V419-F443 HydrophobicContact CB-CD1 4.48Å; V419-F443 HydrophobicContact CG1-CD1 4.2Å; V419-F443 HydrophobicContact CG1-CE1 4.03Å; V419-F443 HydrophobicContact CG1-CZ 4.3Å; V419-F443 HydrophobicContact CG2-CD1 3.53Å; V419-F443 HydrophobicContact CG2-CE1 3.59Å; V419-F443 HydrophobicContact CG2-CG 4.49Å; F443-A445 PolarHBondContact O-N 3.24Å; F443-T446 PolarHBondContact O-N 3.28Å; F443-D447 WeakPolarHBondContact O-CA 3.34Å; F443-D447 PolarHBondContact O-N 3.01Å; F443-M448 WeakPolarHBondContact CD2-O 3.25Å; F443-M448 PolarHBondContact N-O 2.99Å; F443-R469 HydrophobicContact CD2-CG 4.24Å; F443-R469 VanDerWaalsContact CE1-NH2 3.28Å; F443-R469 HydrophobicContact CE2-CG 3.82Å; F443-R469 HydrophobicContact CZ-CG 4.36Å
444	L	92.4	Very high	92.6	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.4	-176.1	-73.4	168.8	0	0	0	114	K411 N415 K418 L420 Y442 P487 Y515	K411-L444 VanDerWaalsContact CE-O 3.27Å; K411-L444 WeakPolarHBondContact CE-O 3.44Å; N415-L444 HydrophobicContact CB-CB 3.75Å; N415-L444 PolarHBondContact ND2-O 2.83Å; K418-L444 HydrophobicContact CB-CB 4.31Å; K418-L444 HydrophobicContact CB-CD1 3.84Å; K418-L444 PolarHBondContact O-N 3.13Å; L420-L444 HydrophobicContact CD1-CD1 4.17Å; L420-L444 HydrophobicContact CD1-CD2 3.96Å; L420-L444 HydrophobicContact CD1-CG 4.18Å; L420-L444 HydrophobicContact CD2-CD1 4.06Å; L420-L444 HydrophobicContact CG-CD1 3.94Å; L420-L444 HydrophobicContact CG-CD2 4.45Å; L420-L444 HydrophobicContact CG-CG 4.12Å; Y442-L444 HydrophobicContact CD1-CD2 4.06Å; Y442-L444 HydrophobicContact CD1-CG 4.36Å; Y442-L444 HydrophobicContact CE1-CD2 3.96Å; L444-P487 HydrophobicContact CD2-CB 4.2Å; L444-P487 HydrophobicContact CD2-CG 4.39Å; L444-Y515 HydrophobicContact CD1-CD2 4.12Å; L444-Y515 HydrophobicContact CD1-CE1 4.28Å; L444-Y515 HydrophobicContact CD1-CE2 3.48Å; L444-Y515 VanDerWaalsContact CD1-CE2 3.48Å; L444-Y515 HydrophobicContact CD2-CE1 4.46Å
445	A	91.9	Very high	92.9	Very high	17 Å²	17	38 Å²	38	14%	0.14	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-33.1	176.7	0	0	0	0	0	113.2	M412 N415 F443	M412-A445 WeakPolarHBondContact CG-O 3.41Å; N415-A445 HydrophobicContact CB-CB 4.43Å; F443-A445 PolarHBondContact O-N 3.24Å
446	T	89.8	Confident	93.1	Very high	45 Å²	45	36.6 Å²	36.6	28%	0.276	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.8	-3	-170.4	59.3	0	0	0	0	114.6	F443 M448 K471	F443-T446 PolarHBondContact O-N 3.28Å; T446-M448 PolarHBondContact O-N 3.27Å; T446-M448 WeakPolarHBondContact OG1-CG 3.4Å; T446-K471 WeakPolarHBondContact O-CE 3.44Å
447	D	91.7	Very high	92.8	Very high	36 Å²	36	45.6 Å²	45.6	19%	0.193	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	27.6	-173.3	-52.4	-42.4	0	0	0	113.4	K411 Y442 F443	K411-D447 VanDerWaalsContact CE-OD1 3.27Å; K411-D447 WeakPolarHBondContact CE-OD1 3.15Å; K411-D447 IonicContact NZ-OD1 2.65Å; K411-D447 PolarHBondContact NZ-OD1 3.42Å; K411-D447 IonicContact NZ-OD2 3.12Å; K411-D447 PolarHBondContact NZ-OD2 2.99Å; Y442-D447 WeakPolarHBondContact OH-CB 3.47Å; Y442-D447 PolarHBondContact OH-OD1 3.49Å; F443-D447 WeakPolarHBondContact O-CA 3.34Å; F443-D447 PolarHBondContact O-N 3.01Å
448	M	92.8	Very high	92.4	Very high	59 Å²	59	49.1 Å²	49.1	29%	0.291	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	147.8	178	-67.8	177.9	176.5	0	0	110.5	F443 T446 R469 K471	F443-M448 WeakPolarHBondContact CD2-O 3.25Å; F443-M448 PolarHBondContact N-O 2.99Å; T446-M448 PolarHBondContact O-N 3.27Å; T446-M448 WeakPolarHBondContact OG1-CG 3.4Å; M448-R469 HydrophobicContact CB-CB 4.27Å; M448-R469 HydrophobicContact SD-CB 4.08Å; M448-K471 HydrophobicContact CG-CG 4.01Å
449	I	94.8	Very high	91.7	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	139.2	174.8	-65.2	150.4	0	0	0	108	F440 S441 Y442 I451 G468 R469 T470 V472 F490	F440-I449 HydrophobicContact CD1-CG2 3.75Å; F440-I449 HydrophobicContact CE1-CG2 4.1Å; S441-I449 WeakPolarHBondContact O-CA 3.49Å; Y442-I449 HydrophobicContact CD2-CD1 4.2Å; Y442-I449 HydrophobicContact CD2-CG1 3.55Å; Y442-I449 HydrophobicContact CE2-CD1 4.31Å; Y442-I449 HydrophobicContact CE2-CG1 4.02Å; I449-I451 HydrophobicContact CG2-CG1 4.18Å; I449-G468 VanDerWaalsContact O-O 3.04Å; I449-R469 WeakPolarHBondContact O-CA 3.21Å; I449-T470 PolarHBondContact N-O 3.31Å; I449-T470 PolarHBondContact O-N 2.71Å; I449-T470 VanDerWaalsContact O-N 3.07Å; I449-V472 HydrophobicContact CB-CG2 4.12Å; I449-V472 HydrophobicContact CD1-CB 3.85Å; I449-V472 HydrophobicContact CD1-CG2 3.79Å; I449-F490 HydrophobicContact CD1-CE2 4.24Å; I449-F490 HydrophobicContact CD1-CZ 3.68Å; I449-F490 HydrophobicContact CG1-CZ 4.05Å
450	S	95.5	Very high	91.1	Very high	17 Å²	17	54 Å²	54	12%	0.119	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.6	166.4	-173.8	0	0	0	0	108.9	S441 L467	S441-S450 PolarHBondContact N-O 2.99Å; S441-S450 PolarHBondContact O-N 3.2Å; S450-L467 WeakPolarHBondContact CA-O 3.47Å; S450-L467 PolarHBondContact OG-O 3.06Å
451	I	95.8	Very high	90.5	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.7	-179.6	-53.9	172.6	0	0	0	107.5	F438 F440 I449 Y466 L467 V498 F503	F438-I451 HydrophobicContact CB-CG2 3.83Å; F438-I451 HydrophobicContact CD1-CG2 3.93Å; F438-I451 HydrophobicContact CG-CG2 4.22Å; F440-I451 HydrophobicContact CD1-CD1 4.46Å; F440-I451 HydrophobicContact CD1-CG1 4.09Å; F440-I451 HydrophobicContact CD2-CG1 4.2Å; F440-I451 HydrophobicContact CD2-CG2 4.19Å; F440-I451 HydrophobicContact CE1-CD1 3.69Å; F440-I451 HydrophobicContact CE1-CG1 3.82Å; F440-I451 HydrophobicContact CE2-CD1 3.89Å; F440-I451 HydrophobicContact CE2-CG1 3.92Å; F440-I451 HydrophobicContact CE2-CG2 3.91Å; F440-I451 HydrophobicContact CG-CG1 4.28Å; F440-I451 HydrophobicContact CZ-CD1 3.35Å; F440-I451 HydrophobicContact CZ-CG1 3.72Å; F440-I451 HydrophobicContact CZ-CG2 4.47Å; I449-I451 HydrophobicContact CG2-CG1 4.18Å; I451-Y466 HydrophobicContact CB-CD1 4.32Å; I451-Y466 HydrophobicContact CG2-CD1 4.06Å; I451-Y466 HydrophobicContact CG2-CG 4.33Å; I451-Y466 PolarHBondContact O-N 3.33Å; I451-L467 HydrophobicContact CB-CB 3.81Å; I451-L467 HydrophobicContact CD1-CB 3.99Å; I451-L467 HydrophobicContact CD1-CD2 3.89Å; I451-L467 HydrophobicContact CG1-CB 3.92Å; I451-L467 HydrophobicContact CG1-CD2 4.21Å; I451-L467 PolarHBondContact N-O 3.3Å; I451-L467 PolarHBondContact O-N 2.97Å; I451-V498 HydrophobicContact CD1-CB 4.39Å; I451-V498 HydrophobicContact CD1-CG1 4.06Å; I451-V498 HydrophobicContact CD1-CG2 4.27Å; I451-F503 HydrophobicContact CD1-CE2 4.23Å; I451-F503 HydrophobicContact CD1-CZ 4.4Å
452	F	95.3	Very high	90.1	Very high	90 Å²	90	63.8 Å²	63.8	40%	0.395	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.7	179.8	-175.9	-94.9	0	0	0	110.3	F438 V439 P454 G464 K465	F438-F452 CarbonylContact C-O 3.55Å; V439-F452 PolarHBondContact N-O 2.97Å; V439-F452 PolarHBondContact O-N 2.67Å; F452-P454 WeakPolarHBondContact O-CD 3.01Å; F452-G464 WeakPolarHBondContact CD2-O 3.37Å; F452-K465 HydrophobicContact CD2-CB 4.43Å
453	E	94.3	Very high	89.7	Confident	17 Å²	17	64.7 Å²	64.7	8%	0.079	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	113	175	-177	170.6	-165.2	0	0	109.1	R436 F438 G463 G464	R436-E453 IonicContact CZ-OE1 3.72Å; R436-E453 IonicContact CZ-OE2 3.49Å; R436-E453 IonicContact NE-OE1 3.87Å; R436-E453 PolarHBondContact NE-OE1 2.92Å; R436-E453 IonicContact NE-OE2 2.79Å; R436-E453 IonicContact NH2-OE1 2.77Å; R436-E453 PolarHBondContact NH2-OE1 3.39Å; R436-E453 IonicContact NH2-OE2 3.32Å; R436-E453 PolarHBondContact NH2-OE2 3.26Å; F438-E453 HydrophobicContact CD1-CB 3.92Å; F438-E453 HydrophobicContact CD1-CG 4.33Å; F438-E453 HydrophobicContact CE1-CB 3.94Å; F438-E453 HydrophobicContact CE1-CG 4.08Å; E453-G463 CarbonylContact O-C 3.57Å; E453-G464 PolarHBondContact N-O 3.47Å; E453-G464 PolarHBondContact O-N 3.44Å
454	P	91.5	Very high	89.5	Confident	51 Å²	51	64.3 Å²	64.3	33%	0.331	37%	0.37	S	S	.	.			trans	-61.5	136	175.4	-22.2	34.7	0	0	0	111.4	R437 V439 F452 V456	R437-P454 VanDerWaalsContact O-CD 3.27Å; R437-P454 WeakPolarHBondContact O-CD 3.29Å; V439-P454 HydrophobicContact CG2-CG 3.87Å; F452-P454 WeakPolarHBondContact O-CD 3.01Å; P454-V456 PolarHBondContact O-N 2.99Å
455	P	90.3	Very high	89.5	Confident	101 Å²	101	71.6 Å²	71.6	66%	0.656	40%	0.402	S	S	*	.			trans	-70.7	122.9	178	28.2	-33.5	0	0	0	111
456	V	87.4	Confident	89.5	Confident	101 Å²	101	74.7 Å²	74.7	61%	0.612	41%	0.41	S	S	*	.			trans	-104	130.5	176.7	-178.8	0	0	0	0	109.5	P454 S459	P454-V456 PolarHBondContact O-N 2.99Å; V456-S459 PolarHBondContact O-OG 3.46Å; V456-S459 VanDerWaalsContact O-OG 3.11Å
457	R	85	Confident	89.7	Confident	230 Å²	230	73.9 Å²	73.9	87%	0.868	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	139.3	176.7	-69.5	-175.7	-179.9	-175.4	0.8	110	S459	R457-S459 PolarHBondContact O-N 3.48Å
458	N	82.4	Confident	89.8	Confident	172 Å²	172	73.5 Å²	73.5	92%	0.92	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	15.5	176.3	-48.6	-33.8	0	0	0	115.8
459	S	80	Confident	89.8	Confident	57 Å²	57	78.4 Å²	78.4	40%	0.399	42%	0.424	S	S	.	.	S	Bend	trans	-78.6	-19.9	177	64.9	0	0	0	0	114.1	V456 R457 I461	V456-S459 PolarHBondContact O-OG 3.46Å; V456-S459 VanDerWaalsContact O-OG 3.11Å; R457-S459 PolarHBondContact O-N 3.48Å; S459-I461 PolarHBondContact O-N 3.48Å; S459-I461 PolarHBondContact OG-N 3.23Å; S459-I461 PolarHBondContact OG-O 3.13Å
460	G	82.1	Confident	89.7	Confident	84 Å²	84	81 Å²	81	87%	0.866	44%	0.44	S	S	*	.	S	Bend	trans	74.4	-1.2	-172.3	0	0	0	0	0	114.7
461	I	83.9	Confident	89.4	Confident	61 Å²	61	84 Å²	84	31%	0.313	45%	0.451	S	S	.	.	S	Bend	trans	-111.8	129.8	-179.5	-56.9	174.3	0	0	0	109.2	R436 S459 G463	R436-I461 HydrophobicContact CG-CD1 4.03Å; S459-I461 PolarHBondContact O-N 3.48Å; S459-I461 PolarHBondContact OG-N 3.23Å; S459-I461 PolarHBondContact OG-O 3.13Å; I461-G463 PolarHBondContact O-N 2.97Å; I461-G463 VanDerWaalsContact O-N 3.17Å
462	I	84.9	Confident	89.3	Confident	164 Å²	164	84.1 Å²	84.1	84%	0.841	45%	0.452	S	S	*	.			trans	-75.3	105.9	176.3	-58.4	173.8	0	0	0	108.3
463	G	87.1	Confident	89.1	Confident	21 Å²	21	82.9 Å²	82.9	22%	0.216	45%	0.451	C	S	.	.			trans	-68.6	157.3	171.4	0	0	0	0	0	112.1	E453 I461	E453-G463 CarbonylContact O-C 3.57Å; I461-G463 PolarHBondContact O-N 2.97Å; I461-G463 VanDerWaalsContact O-N 3.17Å
464	G	90.6	Very high	88.9	Confident	23 Å²	23	83 Å²	83	24%	0.237	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.5	-159.4	-179.6	0	0	0	0	0	113.1	F452 E453 Y466	F452-G464 WeakPolarHBondContact CD2-O 3.37Å; E453-G464 PolarHBondContact N-O 3.47Å; E453-G464 PolarHBondContact O-N 3.44Å; G464-Y466 PolarHBondContact O-N 3.14Å; G464-Y466 VanDerWaalsContact O-N 3.15Å
465	K	92.8	Very high	88.6	Confident	156 Å²	156	84.1 Å²	84.1	68%	0.678	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	109	178.4	-176.9	-176.6	-70.2	172.5	0	109.8	F452	F452-K465 HydrophobicContact CD2-CB 4.43Å
466	Y	92.2	Very high	88.2	Confident	82 Å²	82	86.8 Å²	86.8	32%	0.322	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-41.4	177.4	-169.7	-91.4	0	0	0	111.4	F438 I451 G464 F503	F438-Y466 HydrophobicContact CD1-CD2 4.36Å; F438-Y466 HydrophobicContact CD1-CG 4.24Å; F438-Y466 AromaticContact CE1-CD2 3.65Å; F438-Y466 HydrophobicContact CE1-CD2 3.65Å; F438-Y466 HydrophobicContact CE1-CE2 4Å; F438-Y466 AromaticContact CE1-CG 3.97Å; F438-Y466 HydrophobicContact CE1-CG 3.97Å; F438-Y466 HydrophobicContact CZ-CE2 4.46Å; I451-Y466 HydrophobicContact CB-CD1 4.32Å; I451-Y466 HydrophobicContact CG2-CD1 4.06Å; I451-Y466 HydrophobicContact CG2-CG 4.33Å; I451-Y466 PolarHBondContact O-N 3.33Å; G464-Y466 PolarHBondContact O-N 3.14Å; G464-Y466 VanDerWaalsContact O-N 3.15Å; Y466-F503 HydrophobicContact CD1-CZ 4.33Å; Y466-F503 AromaticContact CE1-CZ 3.76Å; Y466-F503 HydrophobicContact CE1-CZ 3.76Å
467	L	94.3	Very high	88	Confident	28 Å²	28	83.3 Å²	83.3	15%	0.147	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	127.3	174.1	-172	68.4	0	0	0	111.1	S450 I451 V472 V498 F499	S450-L467 WeakPolarHBondContact CA-O 3.47Å; S450-L467 PolarHBondContact OG-O 3.06Å; I451-L467 HydrophobicContact CB-CB 3.81Å; I451-L467 HydrophobicContact CD1-CB 3.99Å; I451-L467 HydrophobicContact CD1-CD2 3.89Å; I451-L467 HydrophobicContact CG1-CB 3.92Å; I451-L467 HydrophobicContact CG1-CD2 4.21Å; I451-L467 PolarHBondContact N-O 3.3Å; I451-L467 PolarHBondContact O-N 2.97Å; L467-V472 HydrophobicContact CD2-CG2 4.23Å; L467-V498 HydrophobicContact CD2-CG1 3.65Å; L467-F499 HydrophobicContact CD1-CD2 4.04Å; L467-F499 HydrophobicContact CD1-CE2 3.75Å; L467-F499 HydrophobicContact CD2-CD2 4.4Å; L467-F499 HydrophobicContact CD2-CE2 4.08Å
468	G	93.1	Very high	87.9	Confident	28 Å²	28	76.5 Å²	76.5	29%	0.289	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	170.6	170	0	0	0	0	0	112.6	I449 T470	I449-G468 VanDerWaalsContact O-O 3.04Å; G468-T470 PolarHBondContact O-N 3.32Å; G468-T470 PolarHBondContact O-OG1 3.18Å
469	R	93.3	Very high	87.7	Confident	163 Å²	163	73.2 Å²	73.2	62%	0.615	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	106	178	-69	-177.6	179.7	170.4	1	109.6	F443 M448 I449	F443-R469 HydrophobicContact CD2-CG 4.24Å; F443-R469 VanDerWaalsContact CE1-NH2 3.28Å; F443-R469 HydrophobicContact CE2-CG 3.82Å; F443-R469 HydrophobicContact CZ-CG 4.36Å; M448-R469 HydrophobicContact CB-CB 4.27Å; M448-R469 HydrophobicContact SD-CB 4.08Å; I449-R469 WeakPolarHBondContact O-CA 3.21Å
470	T	91.7	Very high	87.5	Confident	55 Å²	55	73.9 Å²	73.9	34%	0.337	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	145.3	-177.2	-55.6	0	0	0	0	109.4	I449 G468 F499	I449-T470 PolarHBondContact N-O 3.31Å; I449-T470 PolarHBondContact O-N 2.71Å; I449-T470 VanDerWaalsContact O-N 3.07Å; G468-T470 PolarHBondContact O-N 3.32Å; G468-T470 PolarHBondContact O-OG1 3.18Å; T470-F499 HydrophobicContact CG2-CZ 4.18Å
471	K	90.4	Very high	87.5	Confident	79 Å²	79	75.7 Å²	75.7	34%	0.343	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-76.2	123.8	169.6	-72.4	-169.6	175	-173.7	0	108.9	T446 M448 Y484	T446-K471 WeakPolarHBondContact O-CE 3.44Å; M448-K471 HydrophobicContact CG-CG 4.01Å; K471-Y484 HydrophobicContact CB-CD1 3.72Å; K471-Y484 HydrophobicContact CB-CE1 3.76Å; K471-Y484 HydrophobicContact CB-CG 4.5Å; K471-Y484 HydrophobicContact CD-CD1 4.37Å; K471-Y484 HydrophobicContact CD-CE1 4.29Å; K471-Y484 HydrophobicContact CD-CE2 4.5Å
472	V	91.7	Very high	87.6	Confident	3 Å²	3	74.1 Å²	74.1	2%	0.018	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-100	126.8	-178.2	-175.1	0	0	0	0	109.1	I449 L467 Y484 Y485 V498	I449-V472 HydrophobicContact CB-CG2 4.12Å; I449-V472 HydrophobicContact CD1-CB 3.85Å; I449-V472 HydrophobicContact CD1-CG2 3.79Å; L467-V472 HydrophobicContact CD2-CG2 4.23Å; V472-Y484 WeakPolarHBondContact O-CA 3.4Å; V472-Y485 HydrophobicContact CB-CD2 3.98Å; V472-Y485 HydrophobicContact CG1-CD2 3.77Å; V472-Y485 HydrophobicContact CG1-CE2 3.82Å; V472-Y485 WeakPolarHBondContact O-CD2 3.4Å; V472-Y485 PolarHBondContact O-N 3.35Å; V472-Y485 VanDerWaalsContact O-N 3.09Å; V472-V498 HydrophobicContact CG1-CB 4.28Å; V472-V498 HydrophobicContact CG1-CG1 3.96Å; V472-V498 HydrophobicContact CG1-CG2 4.17Å; V472-V498 HydrophobicContact CG2-CG1 3.95Å
473	V	91.4	Very high	87.8	Confident	64 Å²	64	70.3 Å²	70.3	39%	0.388	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-82.6	148.5	175.5	-66.3	0	0	0	0	110.8	P482 Y484 Y485	V473-P482 HydrophobicContact CG1-CB 3.92Å; V473-Y484 HydrophobicContact CG1-CD1 3.73Å; V473-Y484 HydrophobicContact CG1-CE1 3.44Å; V473-Y484 VanDerWaalsContact CG1-CE1 3.44Å; V473-Y485 WeakPolarHBondContact O-CE2 3.41Å
474	K	90.8	Very high	88	Confident	21 Å²	21	72.1 Å²	72.1	9%	0.091	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-74.4	147	173.8	-63	-168.8	-177.4	-170.6	0	110.1	Y476 S477 I483 Y484 Y485 D489	K474-Y476 HydrophobicContact CB-CD1 4.18Å; K474-Y476 HydrophobicContact CB-CE1 3.83Å; K474-Y476 HydrophobicContact CB-CE2 4.32Å; K474-Y476 HydrophobicContact CD-CE1 3.81Å; K474-Y476 HydrophobicContact CD-CE2 4.13Å; K474-Y476 WeakPolarHBondContact CD-OH 3.49Å; K474-Y476 HydrophobicContact CG-CE1 4.41Å; K474-Y476 PolarHBondContact NZ-OH 3.35Å; K474-Y476 PolarHBondContact O-N 3.06Å; K474-Y476 VanDerWaalsContact O-N 3.13Å; K474-S477 PolarHBondContact O-N 3.41Å; K474-S477 VanDerWaalsContact O-N 3.11Å; K474-S477 PolarHBondContact O-OG 2.97Å; K474-I483 HydrophobicContact CD-CG2 3.97Å; K474-I483 HydrophobicContact CG-CG2 4.45Å; K474-I483 WeakPolarHBondContact CG-O 3.39Å; K474-I483 PolarHBondContact N-O 3.11Å; K474-Y484 WeakPolarHBondContact CE-O 3.31Å; K474-Y485 HydrophobicContact CD-CD1 4.46Å; K474-Y485 HydrophobicContact CD-CE1 4.5Å; K474-Y485 HydrophobicContact CG-CD1 4.05Å; K474-Y485 HydrophobicContact CG-CD2 4.15Å; K474-Y485 HydrophobicContact CG-CE1 4.02Å; K474-Y485 HydrophobicContact CG-CE2 4.12Å; K474-Y485 HydrophobicContact CG-CG 4.13Å; K474-D489 WeakPolarHBondContact CE-OD2 3.47Å; K474-D489 IonicContact NZ-OD1 3.72Å; K474-D489 PolarHBondContact NZ-OD1 3Å; K474-D489 IonicContact NZ-OD2 2.74Å; K474-D489 PolarHBondContact NZ-OD2 3.37Å
475	P	85.4	Confident	88.1	Confident	74 Å²	74	71.9 Å²	71.9	48%	0.481	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.8	-174.2	24	-34.4	0	0	0	114	Y485 E497	P475-Y485 WeakPolarHBondContact CD-OH 3.44Å; P475-E497 WeakPolarHBondContact CB-OE2 3.22Å; P475-E497 HydrophobicContact CG-CB 4.28Å; P475-E497 WeakPolarHBondContact CG-OE2 3.47Å
476	Y	82.3	Confident	88.1	Confident	157 Å²	157	65.2 Å²	65.2	62%	0.616	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	4.2	179.8	56.4	-96.8	0	0	0	114.3	K474 I483	K474-Y476 HydrophobicContact CB-CD1 4.18Å; K474-Y476 HydrophobicContact CB-CE1 3.83Å; K474-Y476 HydrophobicContact CB-CE2 4.32Å; K474-Y476 HydrophobicContact CD-CE1 3.81Å; K474-Y476 HydrophobicContact CD-CE2 4.13Å; K474-Y476 WeakPolarHBondContact CD-OH 3.49Å; K474-Y476 HydrophobicContact CG-CE1 4.41Å; K474-Y476 PolarHBondContact NZ-OH 3.35Å; K474-Y476 PolarHBondContact O-N 3.06Å; K474-Y476 VanDerWaalsContact O-N 3.13Å; Y476-I483 HydrophobicContact CE2-CD1 4.32Å
477	S	83.2	Confident	88	Confident	27 Å²	27	62.4 Å²	62.4	19%	0.189	33%	0.33	C	S	.	.			trans	-79.7	141.8	179.4	66.9	0	0	0	0	112.3	K474 I483	K474-S477 PolarHBondContact O-N 3.41Å; K474-S477 VanDerWaalsContact O-N 3.11Å; K474-S477 PolarHBondContact O-OG 2.97Å; S477-I483 VanDerWaalsContact CB-N 3.32Å
478	T	81.5	Confident	87.8	Confident	87 Å²	87	63.3 Å²	63.3	53%	0.534	34%	0.339	S	S	.	.			trans	-77.4	154.2	170.5	56.6	0	0	0	0	110.5	D480 N481	T478-D480 PolarHBondContact O-N 3.39Å; T478-N481 CarbonylContact O-C 3.55Å; T478-N481 PolarHBondContact O-N 2.84Å
479	V	78.9	Confident	87.6	Confident	104 Å²	104	63.7 Å²	63.7	63%	0.63	33%	0.334	S	S	*	.	S	Bend	trans	-62	-35.5	-179.6	-175.2	0	0	0	0	111.4	Y384	Y384-V479 HydrophobicContact CD1-CG1 3.8Å; Y384-V479 HydrophobicContact CE1-CG1 4.39Å
480	D	75.1	Confident	87.5	Confident	70 Å²	70	56 Å²	56	37%	0.374	31%	0.305	S	S	.	.	S	Bend	trans	-73.8	-28.7	-178.9	-57.3	-46.9	0	0	0	113.2	P383 Y384 T478	P383-D480 WeakPolarHBondContact CA-OD1 3.26Å; Y384-D480 WeakPolarHBondContact CB-OD1 3.41Å; Y384-D480 PolarHBondContact N-OD1 3.02Å; T478-D480 PolarHBondContact O-N 3.39Å
481	N	83	Confident	87.3	Confident	122 Å²	122	55.4 Å²	55.4	65%	0.652	30%	0.298	S	S	*	.	S	Bend	trans	-131.3	76.7	179.5	-75.1	-43.7	0	0	0	109.8	T478 I483	T478-N481 CarbonylContact O-C 3.55Å; T478-N481 PolarHBondContact O-N 2.84Å; N481-I483 PolarHBondContact O-N 3.36Å
482	P	85.4	Confident	87.3	Confident	29 Å²	29	52.5 Å²	52.5	19%	0.188	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-67.4	124.6	-178.6	27.5	-34	0	0	0	110.5	V390 V473 Y484	V390-P482 HydrophobicContact CB-CG 4.23Å; V390-P482 HydrophobicContact CG2-CG 3.98Å; V473-P482 HydrophobicContact CG1-CB 3.92Å; P482-Y484 HydrophobicContact CB-CE1 4.43Å; P482-Y484 HydrophobicContact CB-CE2 4.17Å; P482-Y484 HydrophobicContact CG-CE2 4.11Å
483	I	90.3	Very high	87.1	Confident	83 Å²	83	54.6 Å²	54.6	43%	0.426	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-100.7	117.3	173.9	-57.1	174.7	0	0	0	107	K474 Y476 S477 N481	K474-I483 HydrophobicContact CD-CG2 3.97Å; K474-I483 HydrophobicContact CG-CG2 4.45Å; K474-I483 WeakPolarHBondContact CG-O 3.39Å; K474-I483 PolarHBondContact N-O 3.11Å; Y476-I483 HydrophobicContact CE2-CD1 4.32Å; S477-I483 VanDerWaalsContact CB-N 3.32Å; N481-I483 PolarHBondContact O-N 3.36Å
484	Y	91.4	Very high	87	Confident	59 Å²	59	51.9 Å²	51.9	23%	0.231	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-89.9	156.1	-179.3	-60.6	-74.4	0	0	0	112	K471 V472 V473 K474 P482 G486	K471-Y484 HydrophobicContact CB-CD1 3.72Å; K471-Y484 HydrophobicContact CB-CE1 3.76Å; K471-Y484 HydrophobicContact CB-CG 4.5Å; K471-Y484 HydrophobicContact CD-CD1 4.37Å; K471-Y484 HydrophobicContact CD-CE1 4.29Å; K471-Y484 HydrophobicContact CD-CE2 4.5Å; V472-Y484 WeakPolarHBondContact O-CA 3.4Å; V473-Y484 HydrophobicContact CG1-CD1 3.73Å; V473-Y484 HydrophobicContact CG1-CE1 3.44Å; V473-Y484 VanDerWaalsContact CG1-CE1 3.44Å; K474-Y484 WeakPolarHBondContact CE-O 3.31Å; P482-Y484 HydrophobicContact CB-CE1 4.43Å; P482-Y484 HydrophobicContact CB-CE2 4.17Å; P482-Y484 HydrophobicContact CG-CE2 4.11Å; Y484-G486 PolarHBondContact O-N 3.47Å
485	Y	92.6	Very high	87.1	Confident	19 Å²	19	54.1 Å²	54.1	8%	0.075	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-66.7	129.4	171.5	-75.7	-80.2	0	0	0	111.6	Y442 V472 V473 K474 P475 D489 I496 E497	Y442-Y485 WeakPolarHBondContact CE2-O 3.29Å; Y442-Y485 PolarHBondContact OH-O 2.8Å; Y442-Y485 VanDerWaalsContact OH-O 3.05Å; V472-Y485 HydrophobicContact CB-CD2 3.98Å; V472-Y485 HydrophobicContact CG1-CD2 3.77Å; V472-Y485 HydrophobicContact CG1-CE2 3.82Å; V472-Y485 WeakPolarHBondContact O-CD2 3.4Å; V472-Y485 PolarHBondContact O-N 3.35Å; V472-Y485 VanDerWaalsContact O-N 3.09Å; V473-Y485 WeakPolarHBondContact O-CE2 3.41Å; K474-Y485 HydrophobicContact CD-CD1 4.46Å; K474-Y485 HydrophobicContact CD-CE1 4.5Å; K474-Y485 HydrophobicContact CG-CD1 4.05Å; K474-Y485 HydrophobicContact CG-CD2 4.15Å; K474-Y485 HydrophobicContact CG-CE1 4.02Å; K474-Y485 HydrophobicContact CG-CE2 4.12Å; K474-Y485 HydrophobicContact CG-CG 4.13Å; P475-Y485 WeakPolarHBondContact CD-OH 3.44Å; Y485-D489 WeakPolarHBondContact CA-OD2 3.49Å; Y485-D489 HydrophobicContact CD1-CB 3.83Å; Y485-I496 HydrophobicContact CD1-CD1 4.24Å; Y485-I496 HydrophobicContact CD1-CG2 4.41Å; Y485-I496 HydrophobicContact CE1-CD1 4.03Å; Y485-I496 HydrophobicContact CE1-CG2 4.08Å; Y485-I496 HydrophobicContact CE2-CG2 4.18Å; Y485-E497 VanDerWaalsContact CE2-O 3.29Å; Y485-E497 WeakPolarHBondContact CE2-O 3.39Å; Y485-E497 PolarHBondContact OH-N 3.39Å; Y485-E497 VanDerWaalsContact OH-N 3.1Å; Y485-E497 PolarHBondContact OH-O 3.01Å; Y485-E497 VanDerWaalsContact OH-O 3.14Å
486	G	91.3	Very high	87.4	Confident	15 Å²	15	50.7 Å²	50.7	16%	0.155	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-101.5	171.3	175.1	0	0	0	0	0	112.3	Y484 S488 D489 F490	Y484-G486 PolarHBondContact O-N 3.47Å; G486-S488 PolarHBondContact O-N 2.95Å; G486-D489 PolarHBondContact N-OD2 3.48Å; G486-D489 PolarHBondContact O-N 3.03Å; G486-D489 VanDerWaalsContact O-N 3.17Å; G486-F490 VanDerWaalsContact O-CD2 3.23Å; G486-F490 WeakPolarHBondContact O-CD2 3.41Å
487	P	90.2	Very high	87.9	Confident	23 Å²	23	46.6 Å²	46.6	15%	0.149	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-61.1	-29.8	176	25.5	-33.7	0	0	0	112.6	L420 Y442 L444 D489 F490 Y523	L420-P487 HydrophobicContact CD1-CB 4.17Å; Y442-P487 HydrophobicContact CE1-CB 4.42Å; L444-P487 HydrophobicContact CD2-CB 4.2Å; L444-P487 HydrophobicContact CD2-CG 4.39Å; P487-D489 PolarHBondContact O-N 3.42Å; P487-F490 PolarHBondContact O-N 3.34Å; P487-Y523 WeakPolarHBondContact O-CE1 3.38Å
488	S	90	Very high	88.4	Confident	48 Å²	48	45.5 Å²	45.5	34%	0.336	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-64.2	-23.5	177.8	56	0	0	0	0	114.2	G486 F490 Q522	G486-S488 PolarHBondContact O-N 2.95Å; S488-F490 VanDerWaalsContact C-N 3.31Å; S488-Q522 WeakPolarHBondContact CB-O 3.23Å
489	D	89.8	Confident	88.7	Confident	36 Å²	36	47.8 Å²	47.8	19%	0.193	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-80.9	-16	-179.2	-57	-48.9	0	0	0	112	K474 Y485 G486 P487	K474-D489 WeakPolarHBondContact CE-OD2 3.47Å; K474-D489 IonicContact NZ-OD1 3.72Å; K474-D489 PolarHBondContact NZ-OD1 3Å; K474-D489 IonicContact NZ-OD2 2.74Å; K474-D489 PolarHBondContact NZ-OD2 3.37Å; Y485-D489 WeakPolarHBondContact CA-OD2 3.49Å; Y485-D489 HydrophobicContact CD1-CB 3.83Å; G486-D489 PolarHBondContact N-OD2 3.48Å; G486-D489 PolarHBondContact O-N 3.03Å; G486-D489 VanDerWaalsContact O-N 3.17Å; P487-D489 PolarHBondContact O-N 3.42Å
490	F	90.1	Very high	89.1	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	26%	0.264	C	S	.	.			trans	-95.7	108.9	-179.5	-66.2	-87.4	0	0	0	110.8	Y422 F440 Y442 I449 G486 P487 S488 I496 I505	Y422-F490 HydrophobicContact CD1-CB 4.29Å; Y422-F490 HydrophobicContact CD2-CB 4.5Å; Y422-F490 HydrophobicContact CD2-CD1 4.25Å; Y422-F490 HydrophobicContact CE1-CB 3.69Å; Y422-F490 HydrophobicContact CE2-CB 3.9Å; Y422-F490 HydrophobicContact CE2-CD1 4.26Å; Y422-F490 HydrophobicContact CE2-CG 4.08Å; Y422-F490 VanDerWaalsContact CZ-CB 3.48Å; F440-F490 AromaticContact CD1-CE1 3.93Å; F440-F490 HydrophobicContact CD1-CE1 3.93Å; F440-F490 HydrophobicContact CE1-CE1 4.46Å; Y442-F490 HydrophobicContact CD2-CD2 4.11Å; Y442-F490 AromaticContact CD2-CE2 3.48Å; Y442-F490 HydrophobicContact CD2-CE2 3.48Å; Y442-F490 VanDerWaalsContact CD2-CE2 3.48Å; Y442-F490 HydrophobicContact CD2-CZ 4.05Å; Y442-F490 HydrophobicContact CE2-CD2 4.49Å; Y442-F490 AromaticContact CE2-CE2 3.79Å; Y442-F490 HydrophobicContact CE2-CE2 3.79Å; Y442-F490 HydrophobicContact CG-CE2 4.41Å; I449-F490 HydrophobicContact CD1-CE2 4.24Å; I449-F490 HydrophobicContact CD1-CZ 3.68Å; I449-F490 HydrophobicContact CG1-CZ 4.05Å; G486-F490 VanDerWaalsContact O-CD2 3.23Å; G486-F490 WeakPolarHBondContact O-CD2 3.41Å; P487-F490 PolarHBondContact O-N 3.34Å; S488-F490 VanDerWaalsContact C-N 3.31Å; F490-I496 HydrophobicContact CD1-CD1 4.23Å; F490-I496 HydrophobicContact CD1-CG1 4.1Å; F490-I496 HydrophobicContact CE1-CD1 4.15Å; F490-I496 HydrophobicContact CE1-CG1 3.87Å; F490-I496 HydrophobicContact CE1-CG2 4.26Å; F490-I496 HydrophobicContact CZ-CG2 4.43Å; F490-I505 HydrophobicContact CD1-CD1 4.29Å
491	F	89.1	Confident	89.8	Confident	42 Å²	42	46.3 Å²	46.3	18%	0.184	27%	0.266	C	S	.	.			trans	-148.5	163.8	172	58.3	-88.6	0	0	0	110.4	G493 A494 I505 M516 A527	F491-G493 PolarHBondContact O-N 2.94Å; F491-A494 HydrophobicContact CD1-CB 3.87Å; F491-A494 HydrophobicContact CD2-CB 4.01Å; F491-A494 HydrophobicContact CE1-CB 3.78Å; F491-A494 HydrophobicContact CE2-CB 3.94Å; F491-A494 HydrophobicContact CG-CB 3.97Å; F491-A494 HydrophobicContact CZ-CB 3.82Å; F491-A494 WeakPolarHBondContact O-CB 3.19Å; F491-A494 PolarHBondContact O-N 3.26Å; F491-I505 WeakPolarHBondContact O-CB 3.39Å; F491-M516 HydrophobicContact CB-CE 4.39Å; F491-A527 HydrophobicContact CB-CB 3.48Å; F491-A527 VanDerWaalsContact CB-CB 3.48Å; F491-A527 HydrophobicContact CD1-CB 3.9Å; F491-A527 HydrophobicContact CD2-CB 4.28Å; F491-A527 HydrophobicContact CG-CB 3.64Å
492	I	89.4	Confident	90.2	Very high	19 Å²	19	45.9 Å²	45.9	10%	0.097	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	125.1	-178	-61.3	172.1	0	0	0	109.6	L506 T508 S530 V531 H534	I492-L506 WeakPolarHBondContact CG2-O 3.38Å; I492-T508 HydrophobicContact CD1-CG2 4.21Å; I492-T508 HydrophobicContact CG1-CG2 3.7Å; I492-S530 WeakPolarHBondContact CB-OG 3.44Å; I492-S530 PolarHBondContact O-OG 3.31Å; I492-V531 HydrophobicContact CD1-CG2 4.32Å; I492-H534 HydrophobicContact CD1-CB 3.6Å
493	G	86.9	Confident	90.6	Very high	46 Å²	46	44.6 Å²	44.6	47%	0.474	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	-4.3	-174.6	0	0	0	0	0	115.1	F491 I505	F491-G493 PolarHBondContact O-N 2.94Å; G493-I505 WeakPolarHBondContact CA-O 3.42Å; G493-I505 PolarHBondContact N-O 2.97Å
494	A	90.4	Very high	90.8	Very high	7 Å²	7	43.2 Å²	43.2	6%	0.058	24%	0.239	C	C	.	.			trans	-67.5	142.3	176.7	0	0	0	0	0	111.7	F491 I496 I504 I505	F491-A494 HydrophobicContact CD1-CB 3.87Å; F491-A494 HydrophobicContact CD2-CB 4.01Å; F491-A494 HydrophobicContact CE1-CB 3.78Å; F491-A494 HydrophobicContact CE2-CB 3.94Å; F491-A494 HydrophobicContact CG-CB 3.97Å; F491-A494 HydrophobicContact CZ-CB 3.82Å; F491-A494 WeakPolarHBondContact O-CB 3.19Å; F491-A494 PolarHBondContact O-N 3.26Å; A494-I496 HydrophobicContact CB-CD1 4.42Å; A494-I504 WeakPolarHBondContact O-CA 3.45Å; A494-I505 HydrophobicContact CB-CG1 4.39Å; A494-I505 PolarHBondContact O-N 3.49Å
495	V	92.4	Very high	90.9	Very high	69 Å²	69	40.4 Å²	40.4	42%	0.418	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	113.6	174.8	-173.9	0	0	0	0	108.8	R502 F503 I504	V495-R502 HydrophobicContact CG1-CB 4.15Å; V495-R502 HydrophobicContact CG1-CG 4.43Å; V495-F503 CarbonylContact C-O 3.56Å; V495-F503 WeakPolarHBondContact CA-O 3.31Å; V495-I504 HydrophobicContact CG2-CG1 4.32Å
496	I	92.9	Very high	90.8	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	118	179.9	-52.4	-60.6	0	0	0	108.8	F440 Y485 F490 A494 V498 F503 I505	F440-I496 HydrophobicContact CE1-CG2 4.32Å; Y485-I496 HydrophobicContact CD1-CD1 4.24Å; Y485-I496 HydrophobicContact CD1-CG2 4.41Å; Y485-I496 HydrophobicContact CE1-CD1 4.03Å; Y485-I496 HydrophobicContact CE1-CG2 4.08Å; Y485-I496 HydrophobicContact CE2-CG2 4.18Å; F490-I496 HydrophobicContact CD1-CD1 4.23Å; F490-I496 HydrophobicContact CD1-CG1 4.1Å; F490-I496 HydrophobicContact CE1-CD1 4.15Å; F490-I496 HydrophobicContact CE1-CG1 3.87Å; F490-I496 HydrophobicContact CE1-CG2 4.26Å; F490-I496 HydrophobicContact CZ-CG2 4.43Å; A494-I496 HydrophobicContact CB-CD1 4.42Å; I496-V498 HydrophobicContact CG2-CG2 3.77Å; I496-F503 PolarHBondContact N-O 3.26Å; I496-F503 PolarHBondContact O-N 2.98Å; I496-I505 HydrophobicContact CG1-CD1 4.3Å; I496-I505 HydrophobicContact CG1-CG1 4.21Å
497	E	92.4	Very high	90.8	Very high	70 Å²	70	44.8 Å²	44.8	33%	0.327	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	121.9	174.3	-168.1	-179.1	153.1	0	0	110.3	P475 Y485 H501 R502	P475-E497 WeakPolarHBondContact CB-OE2 3.22Å; P475-E497 HydrophobicContact CG-CB 4.28Å; P475-E497 WeakPolarHBondContact CG-OE2 3.47Å; Y485-E497 VanDerWaalsContact CE2-O 3.29Å; Y485-E497 WeakPolarHBondContact CE2-O 3.39Å; Y485-E497 PolarHBondContact OH-N 3.39Å; Y485-E497 VanDerWaalsContact OH-N 3.1Å; Y485-E497 PolarHBondContact OH-O 3.01Å; Y485-E497 VanDerWaalsContact OH-O 3.14Å; E497-H501 CarbonylContact C-O 3.54Å; E497-H501 WeakPolarHBondContact CA-O 3.5Å; E497-R502 HydrophobicContact CB-CG 4.45Å; E497-R502 HydrophobicContact CG-CG 4.23Å
498	V	92.5	Very high	90.8	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.03	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	110.5	-178.6	-173.3	0	0	0	0	108.8	F440 I451 L467 V472 I496 G500 H501 F503	F440-V498 HydrophobicContact CE1-CG2 4.01Å; F440-V498 HydrophobicContact CZ-CG2 4.19Å; I451-V498 HydrophobicContact CD1-CB 4.39Å; I451-V498 HydrophobicContact CD1-CG1 4.06Å; I451-V498 HydrophobicContact CD1-CG2 4.27Å; L467-V498 HydrophobicContact CD2-CG1 3.65Å; V472-V498 HydrophobicContact CG1-CB 4.28Å; V472-V498 HydrophobicContact CG1-CG1 3.96Å; V472-V498 HydrophobicContact CG1-CG2 4.17Å; V472-V498 HydrophobicContact CG2-CG1 3.95Å; I496-V498 HydrophobicContact CG2-CG2 3.77Å; V498-G500 PolarHBondContact O-N 3.07Å; V498-H501 PolarHBondContact N-O 2.9Å; V498-H501 PolarHBondContact O-N 3.02Å; V498-F503 HydrophobicContact CB-CD2 4.33Å; V498-F503 HydrophobicContact CB-CE2 4.17Å; V498-F503 HydrophobicContact CG2-CD2 4.17Å; V498-F503 HydrophobicContact CG2-CE2 4.44Å
499	F	88.7	Confident	90.8	Very high	135 Å²	135	45.4 Å²	45.4	59%	0.592	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	40.5	-180	-59.5	-68.6	0	0	0	114.1	L467 T470 H501	L467-F499 HydrophobicContact CD1-CD2 4.04Å; L467-F499 HydrophobicContact CD1-CE2 3.75Å; L467-F499 HydrophobicContact CD2-CD2 4.4Å; L467-F499 HydrophobicContact CD2-CE2 4.08Å; T470-F499 HydrophobicContact CG2-CZ 4.18Å; F499-H501 VanDerWaalsContact C-N 3.33Å
500	G	86.6	Confident	90.8	Very high	56 Å²	56	49.8 Å²	49.8	58%	0.577	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	-5.4	-180	0	0	0	0	0	115.3	V498	V498-G500 PolarHBondContact O-N 3.07Å
501	H	89.9	Confident	90.8	Very high	87 Å²	87	54.6 Å²	54.6	40%	0.403	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.8	172.7	-64.3	-76.3	0	0	0	110.7	L426 E497 V498 F499 F503	L426-H501 HydrophobicContact CD1-CB 3.95Å; E497-H501 CarbonylContact C-O 3.54Å; E497-H501 WeakPolarHBondContact CA-O 3.5Å; V498-H501 PolarHBondContact N-O 2.9Å; V498-H501 PolarHBondContact O-N 3.02Å; F499-H501 VanDerWaalsContact C-N 3.33Å; H501-F503 HydrophobicContact CB-CD2 4.37Å; H501-F503 HydrophobicContact CB-CE2 3.6Å; H501-F503 HydrophobicContact CB-CZ 4.07Å
502	R	92.8	Very high	90.8	Very high	113 Å²	113	52.6 Å²	52.6	43%	0.426	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.9	179.7	-70.3	175	51.1	173.5	-7	110.3	E427 V495 E497	E427-R502 HydrophobicContact CB-CB 4.15Å; E427-R502 WeakPolarHBondContact CB-O 3.32Å; E427-R502 PolarHBondContact N-O 3.31Å; E427-R502 IonicContact OE1-NH2 3.28Å; E427-R502 PolarHBondContact OE1-NH2 3.42Å; E427-R502 IonicContact OE2-CZ 3.65Å; E427-R502 IonicContact OE2-NE 3.73Å; E427-R502 PolarHBondContact OE2-NE 3.44Å; E427-R502 IonicContact OE2-NH2 2.72Å; E427-R502 PolarHBondContact OE2-NH2 3.46Å; V495-R502 HydrophobicContact CG1-CB 4.15Å; V495-R502 HydrophobicContact CG1-CG 4.43Å; E497-R502 HydrophobicContact CB-CG 4.45Å; E497-R502 HydrophobicContact CG-CG 4.23Å
503	F	93.8	Very high	90.7	Very high	1 Å²	1	53 Å²	53	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133.3	179.1	-65.4	-89.8	0	0	0	110.2	A424 A425 L426 F438 F440 I451 Y466 V495 I496 V498 H501	A424-F503 HydrophobicContact CB-CB 4.3Å; A425-F503 CarbonylContact O-C 3.6Å; A425-F503 WeakPolarHBondContact O-CA 3.43Å; L426-F503 HydrophobicContact CB-CD1 4.16Å; L426-F503 HydrophobicContact CB-CE1 3.99Å; L426-F503 HydrophobicContact CD1-CD1 4.07Å; L426-F503 HydrophobicContact CD1-CE1 3.68Å; L426-F503 HydrophobicContact CD1-CE2 4.25Å; L426-F503 HydrophobicContact CD1-CZ 3.78Å; L426-F503 HydrophobicContact CG-CE1 4.35Å; F438-F503 HydrophobicContact CB-CE1 4.49Å; F438-F503 HydrophobicContact CD1-CE1 4.32Å; F438-F503 HydrophobicContact CD2-CD1 4.08Å; F438-F503 AromaticContact CD2-CE1 3.75Å; F438-F503 HydrophobicContact CD2-CE1 3.75Å; F438-F503 HydrophobicContact CE2-CE1 4.02Å; F438-F503 HydrophobicContact CG-CD1 4.38Å; F438-F503 AromaticContact CG-CE1 3.92Å; F438-F503 HydrophobicContact CG-CE1 3.92Å; F438-F503 HydrophobicContact CZ-CE1 4.4Å; F440-F503 HydrophobicContact CE2-CB 3.87Å; F440-F503 AromaticContact CE2-CD1 3.78Å; F440-F503 HydrophobicContact CE2-CD1 3.78Å; F440-F503 HydrophobicContact CE2-CD2 4.22Å; F440-F503 HydrophobicContact CE2-CE1 4.35Å; F440-F503 AromaticContact CE2-CG 3.7Å; F440-F503 HydrophobicContact CE2-CG 3.7Å; F440-F503 HydrophobicContact CZ-CB 3.71Å; F440-F503 HydrophobicContact CZ-CD1 4.07Å; F440-F503 AromaticContact CZ-CD2 3.65Å; F440-F503 HydrophobicContact CZ-CD2 3.65Å; F440-F503 HydrophobicContact CZ-CE2 4.24Å; F440-F503 AromaticContact CZ-CG 3.54Å; F440-F503 HydrophobicContact CZ-CG 3.54Å; I451-F503 HydrophobicContact CD1-CE2 4.23Å; I451-F503 HydrophobicContact CD1-CZ 4.4Å; Y466-F503 HydrophobicContact CD1-CZ 4.33Å; Y466-F503 AromaticContact CE1-CZ 3.76Å; Y466-F503 HydrophobicContact CE1-CZ 3.76Å; V495-F503 CarbonylContact C-O 3.56Å; V495-F503 WeakPolarHBondContact CA-O 3.31Å; I496-F503 PolarHBondContact N-O 3.26Å; I496-F503 PolarHBondContact O-N 2.98Å; V498-F503 HydrophobicContact CB-CD2 4.33Å; V498-F503 HydrophobicContact CB-CE2 4.17Å; V498-F503 HydrophobicContact CG2-CD2 4.17Å; V498-F503 HydrophobicContact CG2-CE2 4.44Å; H501-F503 HydrophobicContact CB-CD2 4.37Å; H501-F503 HydrophobicContact CB-CE2 3.6Å; H501-F503 HydrophobicContact CB-CZ 4.07Å
504	I	93.3	Very high	90.8	Very high	54 Å²	54	56.1 Å²	56.1	28%	0.277	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	122.7	175.7	-56.4	172.5	0	0	0	107.8	A424 A425 E427 A494 V495 L506	A424-I504 CarbonylContact C-O 3.48Å; A424-I504 WeakPolarHBondContact CA-O 3.37Å; A425-I504 PolarHBondContact N-O 2.96Å; A425-I504 PolarHBondContact O-N 3.36Å; E427-I504 HydrophobicContact CB-CD1 4.12Å; E427-I504 HydrophobicContact CB-CG1 4.27Å; E427-I504 HydrophobicContact CG-CD1 4.24Å; A494-I504 WeakPolarHBondContact O-CA 3.45Å; V495-I504 HydrophobicContact CG2-CG1 4.32Å; I504-L506 PolarHBondContact O-N 3.37Å
505	I	94.1	Very high	90.8	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	117.7	174.1	-55.5	-54.8	0	0	0	108.8	Y422 A424 F490 F491 G493 A494 I496	Y422-I505 HydrophobicContact CD1-CG2 4.09Å; A424-I505 HydrophobicContact CB-CD1 3.9Å; F490-I505 HydrophobicContact CD1-CD1 4.29Å; F491-I505 WeakPolarHBondContact O-CB 3.39Å; G493-I505 WeakPolarHBondContact CA-O 3.42Å; G493-I505 PolarHBondContact N-O 2.97Å; A494-I505 HydrophobicContact CB-CG1 4.39Å; A494-I505 PolarHBondContact O-N 3.49Å; I496-I505 HydrophobicContact CG1-CD1 4.3Å; I496-I505 HydrophobicContact CG1-CG1 4.21Å
506	L	90.8	Very high	90.6	Very high	71 Å²	71	54 Å²	54	37%	0.372	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-43.8	179.8	-65.5	-178.8	0	0	0	112	L423 A425 I492 I504	L423-L506 PolarHBondContact O-N 3.04Å; A425-L506 HydrophobicContact CB-CD1 3.72Å; A425-L506 HydrophobicContact CB-CG 4.12Å; I492-L506 WeakPolarHBondContact CG2-O 3.38Å; I504-L506 PolarHBondContact O-N 3.37Å
507	D	90.7	Very high	90.3	Very high	55 Å²	55	60.1 Å²	60.1	29%	0.294	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	166.5	-170.6	-156	-1.8	0	0	0	111.7	L423 H534	L423-D507 HydrophobicContact CB-CB 3.93Å; L423-D507 HydrophobicContact CD2-CB 4.15Å; L423-D507 PolarHBondContact N-O 3.08Å; L423-D507 PolarHBondContact O-N 3.17Å; D507-H534 IonicContact OD1-CD2 2.78Å; D507-H534 IonicContact OD1-CE1 2.63Å; D507-H534 PolarHBondContact OD1-CE1 3.16Å; D507-H534 IonicContact OD1-NE2 3.19Å; D507-H534 PolarHBondContact OD1-NE2 2.91Å; D507-H534 IonicContact OD2-NE2 3.65Å
508	T	90.6	Very high	90.1	Very high	12 Å²	12	61.6 Å²	61.6	7%	0.074	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146.3	-176.4	63.6	0	0	0	0	111.8	Y422 I492 V512 L513	Y422-T508 HydrophobicContact CD1-CG2 3.53Å; Y422-T508 HydrophobicContact CE1-CG2 3.87Å; I492-T508 HydrophobicContact CD1-CG2 4.21Å; I492-T508 HydrophobicContact CG1-CG2 3.7Å; T508-V512 HydrophobicContact CG2-CG1 4.46Å; T508-L513 VanDerWaalsContact OG1-CD2 3.24Å; T508-L513 WeakPolarHBondContact OG1-CD2 3.45Å
509	D	90.6	Very high	89.9	Confident	72 Å²	72	63.5 Å²	63.5	39%	0.385	32%	0.32	S	S	.	.			trans	-63.6	151.4	172.4	-82.6	11.5	0	0	0	111.8	R421 Y511 V512 L513	R421-D509 HydrophobicContact CB-CB 4.29Å; R421-D509 VanDerWaalsContact CB-OD2 3.29Å; R421-D509 WeakPolarHBondContact CB-OD2 3.15Å; R421-D509 WeakPolarHBondContact CD-OD2 3.36Å; R421-D509 PolarHBondContact O-N 3.21Å; R421-D509 VanDerWaalsContact O-N 3.11Å; D509-Y511 PolarHBondContact O-N 3.01Å; D509-Y511 VanDerWaalsContact O-N 3.14Å; D509-V512 HydrophobicContact CB-CG2 4.22Å; D509-V512 WeakPolarHBondContact O-CA 3.41Å; D509-V512 VanDerWaalsContact O-CB 3.32Å; D509-V512 WeakPolarHBondContact O-CB 3.24Å; D509-V512 PolarHBondContact O-N 2.91Å; D509-L513 PolarHBondContact O-N 3.5Å
510	E	87.9	Confident	89.7	Confident	128 Å²	128	58.9 Å²	58.9	60%	0.598	31%	0.306	S	S	*	.	H	α-helix	trans	-55.3	-34.5	176	-166.1	-164.4	151.5	0	0	112.6	V512 L513 K514	E510-V512 VanDerWaalsContact C-N 3.3Å; E510-V512 PolarHBondContact O-N 3.4Å; E510-L513 WeakPolarHBondContact O-CB 3.38Å; E510-L513 PolarHBondContact O-N 2.94Å; E510-K514 PolarHBondContact O-N 3.15Å; E510-K514 VanDerWaalsContact O-N 3.15Å; E510-K514 WeakPolarHBondContact OE1-CE 3.45Å; E510-K514 IonicContact OE1-NZ 2.72Å; E510-K514 PolarHBondContact OE1-NZ 3.09Å
511	Y	90.4	Very high	89.8	Confident	102 Å²	102	61.4 Å²	61.4	40%	0.4	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-38.3	174.7	177	-104.5	0	0	0	112.4	K418 V419 L420 D509 Y515	K418-Y511 WeakPolarHBondContact CG-OH 3.47Å; V419-Y511 WeakPolarHBondContact O-CD1 3.5Å; L420-Y511 HydrophobicContact CD2-CD1 4.29Å; L420-Y511 HydrophobicContact CD2-CE1 4.01Å; D509-Y511 PolarHBondContact O-N 3.01Å; D509-Y511 VanDerWaalsContact O-N 3.14Å; Y511-Y515 WeakPolarHBondContact O-CB 3.49Å; Y511-Y515 PolarHBondContact O-N 3.49Å
512	V	90.3	Very high	89.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-67.5	-41.1	177.8	179	0	0	0	0	110.4	L420 R421 Y422 T508 D509 E510 K514 Y515 M516	L420-V512 HydrophobicContact CB-CG2 3.8Å; L420-V512 HydrophobicContact CD2-CG2 4.02Å; R421-V512 VanDerWaalsContact N-CG2 3.31Å; R421-V512 WeakPolarHBondContact O-CG2 3.38Å; Y422-V512 HydrophobicContact CD1-CG1 4.45Å; Y422-V512 HydrophobicContact CE1-CG1 3.55Å; T508-V512 HydrophobicContact CG2-CG1 4.46Å; D509-V512 HydrophobicContact CB-CG2 4.22Å; D509-V512 WeakPolarHBondContact O-CA 3.41Å; D509-V512 VanDerWaalsContact O-CB 3.32Å; D509-V512 WeakPolarHBondContact O-CB 3.24Å; D509-V512 PolarHBondContact O-N 2.91Å; E510-V512 VanDerWaalsContact C-N 3.3Å; E510-V512 PolarHBondContact O-N 3.4Å; V512-K514 PolarHBondContact O-N 3.16Å; V512-Y515 CarbonylContact O-C 3.21Å; V512-Y515 WeakPolarHBondContact O-CB 3.4Å; V512-Y515 PolarHBondContact O-N 3.39Å; V512-Y515 VanDerWaalsContact O-N 3.16Å; V512-M516 HydrophobicContact CG1-CG 4.18Å; V512-M516 HydrophobicContact CG1-SD 4.02Å; V512-M516 WeakPolarHBondContact O-CB 3.37Å; V512-M516 VanDerWaalsContact O-CG 3.31Å; V512-M516 WeakPolarHBondContact O-CG 3.46Å; V512-M516 PolarHBondContact O-N 3.05Å
513	L	87.6	Confident	89.1	Confident	26 Å²	26	57.7 Å²	57.7	14%	0.136	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-50.7	176.6	-62.2	177.1	0	0	0	111.4	T508 D509 E510 Y515 M516 E517 V531 V535	T508-L513 VanDerWaalsContact OG1-CD2 3.24Å; T508-L513 WeakPolarHBondContact OG1-CD2 3.45Å; D509-L513 PolarHBondContact O-N 3.5Å; E510-L513 WeakPolarHBondContact O-CB 3.38Å; E510-L513 PolarHBondContact O-N 2.94Å; L513-Y515 VanDerWaalsContact C-N 3.28Å; L513-Y515 PolarHBondContact O-N 3.02Å; L513-M516 PolarHBondContact O-N 3.47Å; L513-M516 VanDerWaalsContact O-N 3.17Å; L513-E517 WeakPolarHBondContact O-CG 3.29Å; L513-E517 PolarHBondContact O-N 3.48Å; L513-V531 HydrophobicContact CD2-CB 4.35Å; L513-V531 HydrophobicContact CD2-CG1 3.42Å; L513-V531 VanDerWaalsContact CD2-CG1 3.42Å; L513-V531 HydrophobicContact CD2-CG2 4.11Å; L513-V535 HydrophobicContact CD1-CG2 4.48Å
514	K	89	Confident	88.7	Confident	112 Å²	112	59.9 Å²	59.9	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-60.2	-38.5	175.9	-68.7	176.7	-175.1	166.9	0	112.3	E510 V512 S518	E510-K514 PolarHBondContact O-N 3.15Å; E510-K514 VanDerWaalsContact O-N 3.15Å; E510-K514 WeakPolarHBondContact OE1-CE 3.45Å; E510-K514 IonicContact OE1-NZ 2.72Å; E510-K514 PolarHBondContact OE1-NZ 3.09Å; V512-K514 PolarHBondContact O-N 3.16Å; K514-S518 WeakPolarHBondContact O-CB 3.46Å; K514-S518 PolarHBondContact O-N 2.67Å; K514-S518 PolarHBondContact O-OG 3.49Å
515	Y	89.4	Confident	88.2	Confident	29 Å²	29	62.6 Å²	62.6	11%	0.114	35%	0.345	C	S	.	.	H	α-helix	trans	-66.3	-42.1	176.4	179.9	-89.8	0	0	0	112.1	L420 L444 Y511 V512 L513 S518 N519 Y523	L420-Y515 HydrophobicContact CD1-CD1 3.9Å; L420-Y515 HydrophobicContact CD1-CE1 3.87Å; L420-Y515 HydrophobicContact CD2-CD1 3.71Å; L420-Y515 HydrophobicContact CD2-CD2 4.27Å; L420-Y515 HydrophobicContact CD2-CE1 4.32Å; L420-Y515 HydrophobicContact CD2-CG 3.69Å; L420-Y515 HydrophobicContact CG-CD1 4.46Å; L444-Y515 HydrophobicContact CD1-CD2 4.12Å; L444-Y515 HydrophobicContact CD1-CE1 4.28Å; L444-Y515 HydrophobicContact CD1-CE2 3.48Å; L444-Y515 VanDerWaalsContact CD1-CE2 3.48Å; L444-Y515 HydrophobicContact CD2-CE1 4.46Å; Y511-Y515 WeakPolarHBondContact O-CB 3.49Å; Y511-Y515 PolarHBondContact O-N 3.49Å; V512-Y515 CarbonylContact O-C 3.21Å; V512-Y515 WeakPolarHBondContact O-CB 3.4Å; V512-Y515 PolarHBondContact O-N 3.39Å; V512-Y515 VanDerWaalsContact O-N 3.16Å; L513-Y515 VanDerWaalsContact C-N 3.28Å; L513-Y515 PolarHBondContact O-N 3.02Å; Y515-S518 PolarHBondContact O-N 3.15Å; Y515-N519 WeakPolarHBondContact CD2-ND2 3.27Å; Y515-N519 HydrophobicContact CE1-CB 4.49Å; Y515-N519 WeakPolarHBondContact CE2-ND2 3.32Å; Y515-N519 WeakPolarHBondContact O-CB 3.47Å; Y515-N519 PolarHBondContact O-N 3.17Å; Y515-N519 PolarHBondContact O-ND2 3.48Å; Y515-Y523 HydrophobicContact CE1-CE2 4.46Å
516	M	88.3	Confident	87.5	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-66.5	-40.6	177.6	-72.1	-178.8	78.2	0	0	111.6	F491 V512 L513 N519 A520 Y523 A527 V531	F491-M516 HydrophobicContact CB-CE 4.39Å; V512-M516 HydrophobicContact CG1-CG 4.18Å; V512-M516 HydrophobicContact CG1-SD 4.02Å; V512-M516 WeakPolarHBondContact O-CB 3.37Å; V512-M516 VanDerWaalsContact O-CG 3.31Å; V512-M516 WeakPolarHBondContact O-CG 3.46Å; V512-M516 PolarHBondContact O-N 3.05Å; L513-M516 PolarHBondContact O-N 3.47Å; L513-M516 VanDerWaalsContact O-N 3.17Å; M516-N519 CarbonylContact O-C 3.52Å; M516-N519 VanDerWaalsContact O-C 3.31Å; M516-N519 PolarHBondContact O-N 2.8Å; M516-A520 WeakPolarHBondContact O-CA 3.38Å; M516-A520 PolarHBondContact O-N 3.13Å; M516-Y523 HydrophobicContact CB-CD2 4.46Å; M516-Y523 HydrophobicContact CB-CE2 4.21Å; M516-Y523 HydrophobicContact CE-CD1 3.61Å; M516-Y523 HydrophobicContact CE-CE1 3.7Å; M516-Y523 HydrophobicContact CE-CG 4.11Å; M516-Y523 HydrophobicContact CG-CD2 4.41Å; M516-Y523 HydrophobicContact CG-CE1 3.99Å; M516-Y523 HydrophobicContact CG-CE2 3.87Å; M516-Y523 HydrophobicContact SD-CE1 4.39Å; M516-A527 HydrophobicContact CE-CB 4.36Å; M516-V531 HydrophobicContact CE-CG2 3.79Å; M516-V531 HydrophobicContact SD-CG2 3.83Å
517	E	86.3	Confident	87	Confident	132 Å²	132	65.8 Å²	65.8	62%	0.617	36%	0.359	S	S	*	.	H	α-helix	trans	-63.3	-46.1	174.8	-72.2	176	173.8	0	0	111.7	L513 N519 A520	L513-E517 WeakPolarHBondContact O-CG 3.29Å; L513-E517 PolarHBondContact O-N 3.48Å; E517-N519 VanDerWaalsContact C-N 3.25Å; E517-N519 PolarHBondContact O-N 3.36Å; E517-A520 PolarHBondContact O-N 3.38Å
518	S	89.4	Confident	86.6	Confident	100 Å²	100	65.4 Å²	65.4	70%	0.699	36%	0.356	S	S	*	.	H	α-helix	trans	-65.3	-29.7	178.5	-57.6	0	0	0	0	112.6	K514 Y515	K514-S518 WeakPolarHBondContact O-CB 3.46Å; K514-S518 PolarHBondContact O-N 2.67Å; K514-S518 PolarHBondContact O-OG 3.49Å; Y515-S518 PolarHBondContact O-N 3.15Å
519	N	88.3	Confident	86.2	Confident	45 Å²	45	67.2 Å²	67.2	24%	0.241	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	30.7	-178.8	-61.3	-72.4	0	0	0	112.6	Y515 M516 E517 A521 Q522 Y523	Y515-N519 WeakPolarHBondContact CD2-ND2 3.27Å; Y515-N519 HydrophobicContact CE1-CB 4.49Å; Y515-N519 WeakPolarHBondContact CE2-ND2 3.32Å; Y515-N519 WeakPolarHBondContact O-CB 3.47Å; Y515-N519 PolarHBondContact O-N 3.17Å; Y515-N519 PolarHBondContact O-ND2 3.48Å; M516-N519 CarbonylContact O-C 3.52Å; M516-N519 VanDerWaalsContact O-C 3.31Å; M516-N519 PolarHBondContact O-N 2.8Å; E517-N519 VanDerWaalsContact C-N 3.25Å; E517-N519 PolarHBondContact O-N 3.36Å; N519-A521 PolarHBondContact O-N 3.16Å; N519-Q522 WeakPolarHBondContact O-CB 3.5Å; N519-Q522 PolarHBondContact O-N 2.91Å; N519-Y523 HydrophobicContact CB-CE2 4.37Å; N519-Y523 WeakPolarHBondContact O-CD2 3.41Å
520	A	84.4	Confident	85.7	Confident	38 Å²	38	65.3 Å²	65.3	31%	0.314	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-54.2	-29.2	-171.6	0	0	0	0	0	114	M516 E517 Q522 Y523 L528	M516-A520 WeakPolarHBondContact O-CA 3.38Å; M516-A520 PolarHBondContact O-N 3.13Å; E517-A520 PolarHBondContact O-N 3.38Å; A520-Q522 PolarHBondContact O-N 3.34Å; A520-Y523 PolarHBondContact O-N 3.01Å; A520-L528 HydrophobicContact CB-CD1 4.09Å; A520-L528 HydrophobicContact CB-CD2 4.2Å
521	A	87.3	Confident	85.2	Confident	110 Å²	110	59.6 Å²	59.6	91%	0.909	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.5	177	0	0	0	0	0	114.6	N519	N519-A521 PolarHBondContact O-N 3.16Å
522	Q	82.9	Confident	84.7	Confident	106 Å²	106	60.1 Å²	60.1	50%	0.495	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-86.5	-12.1	-179.9	-63.1	-180	10.2	0	0	113.1	S488 N519 A520	S488-Q522 WeakPolarHBondContact CB-O 3.23Å; N519-Q522 WeakPolarHBondContact O-CB 3.5Å; N519-Q522 PolarHBondContact O-N 2.91Å; A520-Q522 PolarHBondContact O-N 3.34Å
523	Y	86.1	Confident	84.2	Confident	16 Å²	16	67.9 Å²	67.9	6%	0.063	38%	0.378	C	S	.	.	S	Bend	trans	-105.5	151.7	-174	-70.5	-86	0	0	0	111.5	P487 Y515 M516 N519 A520 A527	P487-Y523 WeakPolarHBondContact O-CE1 3.38Å; Y515-Y523 HydrophobicContact CE1-CE2 4.46Å; M516-Y523 HydrophobicContact CB-CD2 4.46Å; M516-Y523 HydrophobicContact CB-CE2 4.21Å; M516-Y523 HydrophobicContact CE-CD1 3.61Å; M516-Y523 HydrophobicContact CE-CE1 3.7Å; M516-Y523 HydrophobicContact CE-CG 4.11Å; M516-Y523 HydrophobicContact CG-CD2 4.41Å; M516-Y523 HydrophobicContact CG-CE1 3.99Å; M516-Y523 HydrophobicContact CG-CE2 3.87Å; M516-Y523 HydrophobicContact SD-CE1 4.39Å; N519-Y523 HydrophobicContact CB-CE2 4.37Å; N519-Y523 WeakPolarHBondContact O-CD2 3.41Å; A520-Y523 PolarHBondContact O-N 3.01Å; Y523-A527 HydrophobicContact CD1-CB 4.4Å
524	S	85.6	Confident	83.6	Confident	46 Å²	46	68.3 Å²	68.3	32%	0.322	38%	0.379	S	S	.	.			trans	-68.7	152.2	173.2	71.3	0	0	0	0	110.7	E526 A527 L528	S524-E526 PolarHBondContact O-N 2.95Å; S524-A527 WeakPolarHBondContact O-CB 3.38Å; S524-A527 PolarHBondContact O-N 2.96Å; S524-A527 VanDerWaalsContact O-N 3.08Å; S524-A527 WeakPolarHBondContact OG-CB 3.13Å; S524-A527 PolarHBondContact OG-N 3.13Å; S524-A527 VanDerWaalsContact OG-N 3.16Å; S524-L528 PolarHBondContact O-N 3.26Å; S524-L528 VanDerWaalsContact O-N 3.17Å
525	P	81.4	Confident	83	Confident	111 Å²	111	65 Å²	65	72%	0.721	37%	0.369	S	S	*	.	H	α-helix	trans	-60.7	-28.1	176	23.8	-33.6	0	0	0	112.4	A529	P525-A529 VanDerWaalsContact O-CB 3.29Å; P525-A529 WeakPolarHBondContact O-CB 3.45Å; P525-A529 PolarHBondContact O-N 2.92Å
526	E	80.2	Confident	82.4	Confident	140 Å²	140	72.1 Å²	72.1	65%	0.654	40%	0.395	S	S	*	.	H	α-helix	trans	-66.8	-42.3	173.7	-174.3	175.9	-171.5	0	0	112.1	S524 A529 S530	S524-E526 PolarHBondContact O-N 2.95Å; E526-A529 PolarHBondContact O-N 3Å; E526-S530 WeakPolarHBondContact O-CB 3.48Å; E526-S530 PolarHBondContact O-N 3.06Å
527	A	80.5	Confident	81.5	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-61.7	-44.5	175.7	0	0	0	0	0	111.7	F491 M516 Y523 S524 S530 V531	F491-A527 HydrophobicContact CB-CB 3.48Å; F491-A527 VanDerWaalsContact CB-CB 3.48Å; F491-A527 HydrophobicContact CD1-CB 3.9Å; F491-A527 HydrophobicContact CD2-CB 4.28Å; F491-A527 HydrophobicContact CG-CB 3.64Å; M516-A527 HydrophobicContact CE-CB 4.36Å; Y523-A527 HydrophobicContact CD1-CB 4.4Å; S524-A527 WeakPolarHBondContact O-CB 3.38Å; S524-A527 PolarHBondContact O-N 2.96Å; S524-A527 VanDerWaalsContact O-N 3.08Å; S524-A527 WeakPolarHBondContact OG-CB 3.13Å; S524-A527 PolarHBondContact OG-N 3.13Å; S524-A527 VanDerWaalsContact OG-N 3.16Å; A527-S530 PolarHBondContact O-N 3.02Å; A527-V531 PolarHBondContact O-N 3.22Å
528	L	82	Confident	80.5	Confident	47 Å²	47	79.7 Å²	79.7	25%	0.246	43%	0.432	C	S	.	.	H	α-helix	trans	-66.8	-40.4	177.3	-64.3	174.5	0	0	0	112	A520 S524 S530 V531 Q532	A520-L528 HydrophobicContact CB-CD1 4.09Å; A520-L528 HydrophobicContact CB-CD2 4.2Å; S524-L528 PolarHBondContact O-N 3.26Å; S524-L528 VanDerWaalsContact O-N 3.17Å; L528-S530 VanDerWaalsContact C-N 3.34Å; L528-S530 PolarHBondContact O-N 3.06Å; L528-V531 PolarHBondContact O-N 3.05Å; L528-Q532 WeakPolarHBondContact O-CG 3.44Å; L528-Q532 PolarHBondContact O-N 3.07Å
529	A	81.9	Confident	79.2	Confident	50 Å²	50	82 Å²	82	41%	0.413	43%	0.431	S	S	.	.	H	α-helix	trans	-65.2	-37	176.7	0	0	0	0	0	112.4	P525 E526 Q532 K533	P525-A529 VanDerWaalsContact O-CB 3.29Å; P525-A529 WeakPolarHBondContact O-CB 3.45Å; P525-A529 PolarHBondContact O-N 2.92Å; E526-A529 PolarHBondContact O-N 3Å; A529-Q532 PolarHBondContact O-N 3.33Å; A529-K533 VanDerWaalsContact O-CB 3.31Å; A529-K533 WeakPolarHBondContact O-CB 2.93Å; A529-K533 PolarHBondContact O-N 3.45Å
530	S	80	Confident	77.2	Confident	32 Å²	32	82.3 Å²	82.3	22%	0.224	44%	0.44	C	S	.	.	H	α-helix	trans	-62.7	-43.6	176.1	-167.1	0	0	0	0	111.5	I492 E526 A527 L528 K533 H534	I492-S530 WeakPolarHBondContact CB-OG 3.44Å; I492-S530 PolarHBondContact O-OG 3.31Å; E526-S530 WeakPolarHBondContact O-CB 3.48Å; E526-S530 PolarHBondContact O-N 3.06Å; A527-S530 PolarHBondContact O-N 3.02Å; L528-S530 VanDerWaalsContact C-N 3.34Å; L528-S530 PolarHBondContact O-N 3.06Å; S530-K533 PolarHBondContact O-N 3.35Å; S530-H534 PolarHBondContact O-N 2.68Å
531	V	78.5	Confident	75.3	Confident	7 Å²	7	86.7 Å²	86.7	4%	0.042	47%	0.465	C	S	.	.	H	α-helix	trans	-62.2	-50.1	174.3	166.6	0	0	0	0	111.7	I492 L513 M516 A527 L528 K533 H534 V535	I492-V531 HydrophobicContact CD1-CG2 4.32Å; L513-V531 HydrophobicContact CD2-CB 4.35Å; L513-V531 HydrophobicContact CD2-CG1 3.42Å; L513-V531 VanDerWaalsContact CD2-CG1 3.42Å; L513-V531 HydrophobicContact CD2-CG2 4.11Å; M516-V531 HydrophobicContact CE-CG2 3.79Å; M516-V531 HydrophobicContact SD-CG2 3.83Å; A527-V531 PolarHBondContact O-N 3.22Å; L528-V531 PolarHBondContact O-N 3.05Å; V531-K533 VanDerWaalsContact C-N 3.28Å; V531-K533 PolarHBondContact O-N 3.42Å; V531-H534 WeakPolarHBondContact O-CB 2.99Å; V531-H534 PolarHBondContact O-N 2.94Å; V531-V535 HydrophobicContact CG1-CG2 4.44Å; V531-V535 WeakPolarHBondContact O-CG2 3.44Å; V531-V535 PolarHBondContact O-N 3.29Å
532	Q	79.6	Confident	72.9	Confident	113 Å²	113	86 Å²	86	53%	0.528	46%	0.46	S	S	.	.	H	α-helix	trans	-60.5	-37.3	178.5	-72.3	178.1	-3	0	0	112.5	L528 A529 H534 R536	L528-Q532 WeakPolarHBondContact O-CG 3.44Å; L528-Q532 PolarHBondContact O-N 3.07Å; A529-Q532 PolarHBondContact O-N 3.33Å; Q532-H534 VanDerWaalsContact C-N 3.35Å; Q532-R536 WeakPolarHBondContact O-CB 3.48Å; Q532-R536 VanDerWaalsContact O-CG 3.26Å; Q532-R536 WeakPolarHBondContact O-CG 3.27Å; Q532-R536 PolarHBondContact O-N 3.39Å
533	K	79.1	Confident	70.6	Confident	164 Å²	164	86.4 Å²	86.4	71%	0.713	47%	0.474	S	S	*	.	H	α-helix	trans	-65.7	-38.3	174.9	-175.2	-179.4	179.5	-177.5	0	111.6	A529 S530 V531 K537	A529-K533 VanDerWaalsContact O-CB 3.31Å; A529-K533 WeakPolarHBondContact O-CB 2.93Å; A529-K533 PolarHBondContact O-N 3.45Å; S530-K533 PolarHBondContact O-N 3.35Å; V531-K533 VanDerWaalsContact C-N 3.28Å; V531-K533 PolarHBondContact O-N 3.42Å; K533-K537 WeakPolarHBondContact O-CB 3.38Å; K533-K537 PolarHBondContact O-N 3.38Å
534	H	75.9	Confident	68.1	Low	34 Å²	34	94.8 Å²	94.8	16%	0.157	51%	0.514	C	S	.	.	H	α-helix	trans	-68.6	-45.8	177.2	-168.9	97	0	0	0	111.8	I492 D507 S530 V531 Q532 R536 K537 L538	I492-H534 HydrophobicContact CD1-CB 3.6Å; D507-H534 IonicContact OD1-CD2 2.78Å; D507-H534 IonicContact OD1-CE1 2.63Å; D507-H534 PolarHBondContact OD1-CE1 3.16Å; D507-H534 IonicContact OD1-NE2 3.19Å; D507-H534 PolarHBondContact OD1-NE2 2.91Å; D507-H534 IonicContact OD2-NE2 3.65Å; S530-H534 PolarHBondContact O-N 2.68Å; V531-H534 WeakPolarHBondContact O-CB 2.99Å; V531-H534 PolarHBondContact O-N 2.94Å; Q532-H534 VanDerWaalsContact C-N 3.35Å; H534-R536 PolarHBondContact O-N 3.25Å; H534-K537 WeakPolarHBondContact O-CA 3.5Å; H534-K537 WeakPolarHBondContact O-CB 3.43Å; H534-K537 PolarHBondContact O-N 3.42Å; H534-L538 PolarHBondContact O-N 2.96Å
535	V	76.3	Confident	65.4	Low	44 Å²	44	98 Å²	98	27%	0.267	54%	0.536	S	S	.	.	H	α-helix	trans	-58.6	-46.8	175.2	174.8	0	0	0	0	110.9	L513 V531 K537 L538 E539	L513-V535 HydrophobicContact CD1-CG2 4.48Å; V531-V535 HydrophobicContact CG1-CG2 4.44Å; V531-V535 WeakPolarHBondContact O-CG2 3.44Å; V531-V535 PolarHBondContact O-N 3.29Å; V535-K537 PolarHBondContact O-N 3.13Å; V535-L538 PolarHBondContact O-N 3.41Å; V535-L538 VanDerWaalsContact O-N 3.13Å; V535-E539 HydrophobicContact CG1-CG 4.49Å; V535-E539 WeakPolarHBondContact O-CG 3.29Å; V535-E539 PolarHBondContact O-N 3.42Å
536	R	75.9	Confident	63	Low	177 Å²	177	101.4 Å²	101.4	67%	0.668	54%	0.543	S	S	*	.	H	α-helix	trans	-62.5	-28.8	175.1	-72.8	176.3	-177	179.2	3.6	113.7	Q532 H534 A540	Q532-R536 WeakPolarHBondContact O-CB 3.48Å; Q532-R536 VanDerWaalsContact O-CG 3.26Å; Q532-R536 WeakPolarHBondContact O-CG 3.27Å; Q532-R536 PolarHBondContact O-N 3.39Å; H534-R536 PolarHBondContact O-N 3.25Å; R536-A540 WeakPolarHBondContact O-CB 3.48Å; R536-A540 PolarHBondContact O-N 2.86Å
537	K	70.1	Confident	60.6	Low	166 Å²	166	100.1 Å²	100.1	72%	0.722	55%	0.549	S	S	*	.	H	α-helix	trans	-74.9	-32.6	176.5	-171.5	-176.4	176.7	-169.9	0	111.7	K533 H534 V535	K533-K537 WeakPolarHBondContact O-CB 3.38Å; K533-K537 PolarHBondContact O-N 3.38Å; H534-K537 WeakPolarHBondContact O-CA 3.5Å; H534-K537 WeakPolarHBondContact O-CB 3.43Å; H534-K537 PolarHBondContact O-N 3.42Å; V535-K537 PolarHBondContact O-N 3.13Å
538	L	65	Low	58.4	Low	127 Å²	127	109.6 Å²	109.6	67%	0.665	59%	0.59	S	S	*	*	H	α-helix	trans	-74.7	-34.2	172.7	-71.4	168.7	0	0	0	112.2	H534 V535	H534-L538 PolarHBondContact O-N 2.96Å; V535-L538 PolarHBondContact O-N 3.41Å; V535-L538 VanDerWaalsContact O-N 3.13Å
539	E	61.8	Low	56	Low	149 Å²	149	116.5 Å²	116.5	70%	0.696	62%	0.621	S	S	*	*	H	α-helix	trans	-80.8	-15.3	177	-69.3	179.5	163.7	0	0	113.8	V535	V535-E539 HydrophobicContact CG1-CG 4.49Å; V535-E539 WeakPolarHBondContact O-CG 3.29Å; V535-E539 PolarHBondContact O-N 3.42Å
540	A	47.5	Very low	53.7	Low	51 Å²	51	120.8 Å²	120.8	42%	0.421	64%	0.642	S	S	.	*	S	Bend	trans	-69.9	130.7	169.2	0	0	0	0	0	109.4	R536 A542	R536-A540 WeakPolarHBondContact O-CB 3.48Å; R536-A540 PolarHBondContact O-N 2.86Å; A540-A542 PolarHBondContact O-N 3.13Å
541	P	43	Very low	51.6	Low	130 Å²	130	128.7 Å²	128.7	84%	0.844	68%	0.676	S	S	*	*			trans	-62	111.6	179.1	24.3	-31	0	0	0	109.1	S543	P541-S543 PolarHBondContact O-N 3.42Å
542	A	37	Very low	49.8	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	71%	0.709	S	S	*	*			trans	-59	128.8	172.7	0	0	0	0	0	108.9	A540 E544	A540-A542 PolarHBondContact O-N 3.13Å; A542-E544 PolarHBondContact O-N 3.29Å
543	S	36.3	Very low	48	Very low	115 Å²	115	137 Å²	137	80%	0.804	72%	0.716	S	S	*	*			trans	-49.5	132.8	168.8	47.1	0	0	0	0	110.8	P541	P541-S543 PolarHBondContact O-N 3.42Å
544	E	33.3	Very low	46.8	Very low	192 Å²	192	133.4 Å²	133.4	90%	0.897	71%	0.709	S	S	*	*			trans	-34.6	123.6	-177.1	-59.4	173.6	156.4	0	0	116.2	A542	A542-E544 PolarHBondContact O-N 3.29Å
545	S	28.3	Very low	46	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	72%	0.722	S	S	*	*			trans	-170.9	107.2	132.7	13.2	0	0	0	0	112.2
546	E	31.8	Very low	45.3	Very low	183 Å²	183	135.7 Å²	135.7	86%	0.855	73%	0.734	S	S	*	*			trans	69.9	109.6	141	-57.2	-170	160.7	0	0	122.7
547	S	29.9	Very low	44.7	Very low	113 Å²	113	132.6 Å²	132.6	79%	0.79	73%	0.727	S	S	*	*			trans	84.3	93.7	136.3	66.6	0	0	0	0	120.9
548	K	33.9	Very low	44.7	Very low	200 Å²	200	130.6 Å²	130.6	87%	0.87	72%	0.72	S	S	*	*			trans	19.5	115.8	130.9	-63.7	179	178.4	178.5	0	118
549	Q	30.8	Very low	45.1	Very low	192 Å²	192	126 Å²	126	90%	0.897	70%	0.696	S	S	*	*				179.8	103.5	104.3	-94.3	173.4	7.3	0	0	109.1
550	T	34	Very low	45.6	Very low	139 Å²	139	123.4 Å²	123.4	85%	0.853	68%	0.684	S	S	*	*			trans	-102.7	113.8	161.7	21.5	0	0	0	0	107.7	K552	T550-K552 PolarHBondContact O-N 3.27Å
551	E	35.6	Very low	47	Very low	199 Å²	199	123.7 Å²	123.7	93%	0.93	69%	0.686	S	S	*	*			trans	-57.9	121.5	170.8	-67.2	-178.5	153.3	0	0	108.9
552	K	39.8	Very low	48.6	Very low	169 Å²	169	118.7 Å²	118.7	74%	0.735	65%	0.652	S	S	*	*			trans	-84.9	136.7	172.9	-71.6	-179.1	174.4	-175.9	0	108.6	T550	T550-K552 PolarHBondContact O-N 3.27Å
553	D	42.8	Very low	50.4	Low	126 Å²	126	114.5 Å²	114.5	67%	0.674	62%	0.616	S	S	*	*			trans	-44.1	130.5	177.8	-91.7	-42.5	0	0	0	113.4	G555 V556	D553-G555 VanDerWaalsContact C-N 3.27Å; D553-G555 PolarHBondContact O-N 3.33Å; D553-V556 PolarHBondContact O-N 3.39Å
554	P	53	Low	52.4	Low	88 Å²	88	113.1 Å²	113.1	57%	0.571	60%	0.6	S	S	*	*	H	α-helix	trans	-63.6	-28	-176.1	21.3	-30.3	0	0	0	113.7	V556 Q557 E558	P554-V556 VanDerWaalsContact C-N 3.33Å; P554-V556 PolarHBondContact O-N 3.43Å; P554-Q557 PolarHBondContact O-N 2.88Å; P554-E558 PolarHBondContact O-N 3.14Å
555	G	59.2	Low	54.5	Low	42 Å²	42	106.9 Å²	106.9	43%	0.433	58%	0.575	S	S	.	*	H	α-helix	trans	-69.5	-23.2	-178	0	0	0	0	0	115.2	D553	D553-G555 VanDerWaalsContact C-N 3.27Å; D553-G555 PolarHBondContact O-N 3.33Å
556	V	62	Low	56.6	Low	84 Å²	84	101.6 Å²	101.6	51%	0.509	54%	0.538	S	S	.	.	H	α-helix	trans	-82.2	-33.9	177.9	-177	0	0	0	0	111	D553 P554 L559 E560	D553-V556 PolarHBondContact O-N 3.39Å; P554-V556 VanDerWaalsContact C-N 3.33Å; P554-V556 PolarHBondContact O-N 3.43Å; V556-L559 PolarHBondContact O-N 3.29Å; V556-E560 WeakPolarHBondContact O-CG 3.46Å; V556-E560 PolarHBondContact O-N 2.64Å; V556-E560 VanDerWaalsContact O-N 3.13Å
557	Q	63.8	Low	58.6	Low	111 Å²	111	95 Å²	95	52%	0.519	51%	0.507	S	S	.	.	H	α-helix	trans	-69.9	-38.3	177.7	-66.2	-179.4	9	0	0	112.2	P554 E560 A561	P554-Q557 PolarHBondContact O-N 2.88Å; Q557-E560 PolarHBondContact O-N 2.66Å; Q557-A561 WeakPolarHBondContact O-CB 3.36Å; Q557-A561 PolarHBondContact O-N 3.21Å
558	E	69.3	Low	60.6	Low	125 Å²	125	96.6 Å²	96.6	58%	0.584	50%	0.5	S	S	*	.	H	α-helix	trans	-64.7	-39.6	175.5	-72	179.2	178.8	0	0	112	P554 L562 M621	P554-E558 PolarHBondContact O-N 3.14Å; E558-L562 WeakPolarHBondContact O-CB 3.46Å; E558-L562 PolarHBondContact O-N 3.3Å; E558-M621 HydrophobicContact CB-CE 4.23Å
559	L	73.4	Confident	62.2	Low	29 Å²	29	93.5 Å²	93.5	15%	0.152	49%	0.489	C	S	.	.	H	α-helix	trans	-66.9	-41.4	177.4	-176.6	60.7	0	0	0	112.1	V556 L562 I563 L618 M621	V556-L559 PolarHBondContact O-N 3.29Å; L559-L562 PolarHBondContact O-N 3.26Å; L559-I563 HydrophobicContact CD1-CD1 4.41Å; L559-I563 HydrophobicContact CG-CD1 4.17Å; L559-I563 VanDerWaalsContact O-CG1 3.29Å; L559-I563 WeakPolarHBondContact O-CG1 3.48Å; L559-I563 PolarHBondContact O-N 3.39Å; L559-L618 HydrophobicContact CD1-CD1 4.15Å; L559-M621 HydrophobicContact CB-CE 3.91Å; L559-M621 HydrophobicContact CD1-CB 3.87Å; L559-M621 HydrophobicContact CD1-CE 4.28Å; L559-M621 HydrophobicContact CD1-SD 4Å
560	E	73.9	Confident	63.8	Low	96 Å²	96	85.5 Å²	85.5	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-66.4	-40.7	177.2	-75.7	-179.9	159.9	0	0	112	V556 Q557 L562 I563 D564	V556-E560 WeakPolarHBondContact O-CG 3.46Å; V556-E560 PolarHBondContact O-N 2.64Å; V556-E560 VanDerWaalsContact O-N 3.13Å; Q557-E560 PolarHBondContact O-N 2.66Å; E560-L562 VanDerWaalsContact C-N 3.35Å; E560-L562 PolarHBondContact O-N 3.17Å; E560-I563 PolarHBondContact O-N 2.97Å; E560-D564 PolarHBondContact O-N 2.8Å; E560-D564 VanDerWaalsContact O-N 3.11Å
561	A	76.8	Confident	64.9	Low	57 Å²	57	85 Å²	85	47%	0.471	44%	0.438	S	S	.	.	H	α-helix	trans	-65.1	-37.3	174.8	0	0	0	0	0	112.7	Q557 D564 T565	Q557-A561 WeakPolarHBondContact O-CB 3.36Å; Q557-A561 PolarHBondContact O-N 3.21Å; A561-D564 PolarHBondContact O-N 3.24Å; A561-T565 WeakPolarHBondContact O-CG2 3.16Å; A561-T565 PolarHBondContact O-N 2.77Å; A561-T565 VanDerWaalsContact O-N 3.09Å; A561-T565 PolarHBondContact O-OG1 3.37Å
562	L	76.2	Confident	65.8	Low	25 Å²	25	83.1 Å²	83.1	13%	0.131	43%	0.434	C	S	.	.	H	α-helix	trans	-67.2	-40.4	176.4	-165.2	72.6	0	0	0	111.7	E558 L559 E560 T565 I566 L614 E617 L618 M621	E558-L562 WeakPolarHBondContact O-CB 3.46Å; E558-L562 PolarHBondContact O-N 3.3Å; L559-L562 PolarHBondContact O-N 3.26Å; E560-L562 VanDerWaalsContact C-N 3.35Å; E560-L562 PolarHBondContact O-N 3.17Å; L562-T565 WeakPolarHBondContact CA-OG1 3.22Å; L562-T565 PolarHBondContact O-N 3.31Å; L562-T565 PolarHBondContact O-OG1 3.2Å; L562-I566 HydrophobicContact CG-CD1 4.07Å; L562-I566 WeakPolarHBondContact O-CB 3.44Å; L562-I566 VanDerWaalsContact O-CG1 3.25Å; L562-I566 WeakPolarHBondContact O-CG1 3.29Å; L562-I566 PolarHBondContact O-N 3.31Å; L562-L614 HydrophobicContact CD1-CD2 4.27Å; L562-E617 HydrophobicContact CD2-CB 4.29Å; L562-E617 HydrophobicContact CD2-CG 3.97Å; L562-L618 HydrophobicContact CD2-CB 4.27Å; L562-L618 HydrophobicContact CD2-CD1 4.43Å; L562-M621 HydrophobicContact CD2-SD 3.85Å
563	I	75	Confident	66.6	Low	7 Å²	7	80.9 Å²	80.9	4%	0.036	43%	0.426	C	S	.	.	H	α-helix	trans	-61	-45.7	174.8	-72.7	168.6	0	0	0	111	L559 E560 T565 I566 Q567 L618 A637	L559-I563 HydrophobicContact CD1-CD1 4.41Å; L559-I563 HydrophobicContact CG-CD1 4.17Å; L559-I563 VanDerWaalsContact O-CG1 3.29Å; L559-I563 WeakPolarHBondContact O-CG1 3.48Å; L559-I563 PolarHBondContact O-N 3.39Å; E560-I563 PolarHBondContact O-N 2.97Å; I563-T565 VanDerWaalsContact C-N 3.34Å; I563-T565 PolarHBondContact O-N 3.27Å; I563-I566 PolarHBondContact O-N 2.79Å; I563-Q567 WeakPolarHBondContact O-CG 3.45Å; I563-Q567 PolarHBondContact O-N 3.44Å; I563-L618 HydrophobicContact CG1-CD1 4.15Å; I563-A637 HydrophobicContact CG1-CB 4.25Å; I563-A637 HydrophobicContact CG2-CB 4.47Å
564	D	76.6	Confident	67.2	Low	86 Å²	86	81.2 Å²	81.2	46%	0.46	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-36.5	178.5	-91.1	9.5	0	0	0	113	E560 A561 K568	E560-D564 PolarHBondContact O-N 2.8Å; E560-D564 VanDerWaalsContact O-N 3.11Å; A561-D564 PolarHBondContact O-N 3.24Å; D564-K568 WeakPolarHBondContact O-CG 3.5Å; D564-K568 PolarHBondContact O-N 3.04Å
565	T	77.6	Confident	67.4	Low	62 Å²	62	78.9 Å²	78.9	38%	0.38	42%	0.424	S	S	.	.	H	α-helix	trans	-70.6	-41.1	177.4	48.9	0	0	0	0	112.1	A561 L562 I563 K568 Q569	A561-T565 WeakPolarHBondContact O-CG2 3.16Å; A561-T565 PolarHBondContact O-N 2.77Å; A561-T565 VanDerWaalsContact O-N 3.09Å; A561-T565 PolarHBondContact O-OG1 3.37Å; L562-T565 WeakPolarHBondContact CA-OG1 3.22Å; L562-T565 PolarHBondContact O-N 3.31Å; L562-T565 PolarHBondContact O-OG1 3.2Å; I563-T565 VanDerWaalsContact C-N 3.34Å; I563-T565 PolarHBondContact O-N 3.27Å; T565-K568 PolarHBondContact O-N 3.21Å; T565-Q569 PolarHBondContact O-N 3.16Å
566	I	74	Confident	67.4	Low	1 Å²	1	81.4 Å²	81.4	1%	0.005	42%	0.423	C	S	.	.	H	α-helix	trans	-63.9	-45.6	176.2	-70.2	174.8	0	0	0	110.5	L562 I563 K568 Q569 L570 L614 L618 A637	L562-I566 HydrophobicContact CG-CD1 4.07Å; L562-I566 WeakPolarHBondContact O-CB 3.44Å; L562-I566 VanDerWaalsContact O-CG1 3.25Å; L562-I566 WeakPolarHBondContact O-CG1 3.29Å; L562-I566 PolarHBondContact O-N 3.31Å; I563-I566 PolarHBondContact O-N 2.79Å; I566-K568 VanDerWaalsContact C-N 3.29Å; I566-K568 PolarHBondContact O-N 2.97Å; I566-Q569 PolarHBondContact O-N 3.07Å; I566-L570 HydrophobicContact CB-CD1 4.49Å; I566-L570 HydrophobicContact CG2-CD1 3.42Å; I566-L570 VanDerWaalsContact CG2-CD1 3.42Å; I566-L570 WeakPolarHBondContact O-CB 3.44Å; I566-L570 PolarHBondContact O-N 2.86Å; I566-L614 HydrophobicContact CD1-CB 4.31Å; I566-L614 HydrophobicContact CG1-CB 4.1Å; I566-L618 HydrophobicContact CD1-CB 3.9Å; I566-L618 HydrophobicContact CD1-CD1 4.38Å; I566-L618 HydrophobicContact CD1-CD2 3.88Å; I566-L618 HydrophobicContact CD1-CG 4.27Å; I566-A637 HydrophobicContact CG2-CB 4.05Å
567	Q	73.1	Confident	67.1	Low	43 Å²	43	84.1 Å²	84.1	20%	0.201	43%	0.434	C	S	.	.	H	α-helix	trans	-61.4	-34	175.9	-75.2	-177.9	-14.1	0	0	113.3	I563 R636 A637 S639	I563-Q567 WeakPolarHBondContact O-CG 3.45Å; I563-Q567 PolarHBondContact O-N 3.44Å; Q567-R636 PolarHBondContact NE2-O 3.26Å; Q567-A637 VanDerWaalsContact CG-O 3.25Å; Q567-A637 WeakPolarHBondContact CG-O 2.96Å; Q567-S639 PolarHBondContact NE2-O 3.28Å; Q567-S639 VanDerWaalsContact NE2-O 3.17Å
568	K	73	Confident	67.2	Low	148 Å²	148	83.6 Å²	83.6	64%	0.643	44%	0.435	S	S	*	.	H	α-helix	trans	-73.3	-38.8	176.6	-78.1	173.7	-175.1	166.6	0	113	D564 T565 I566	D564-K568 WeakPolarHBondContact O-CG 3.5Å; D564-K568 PolarHBondContact O-N 3.04Å; T565-K568 PolarHBondContact O-N 3.21Å; I566-K568 VanDerWaalsContact C-N 3.29Å; I566-K568 PolarHBondContact O-N 2.97Å
569	Q	66.8	Low	67.4	Low	134 Å²	134	78 Å²	78	63%	0.626	41%	0.409	S	S	*	.	H	α-helix	trans	-80.4	-33.2	-176.7	-73.2	-167.5	-9.2	0	0	113.5	T565 I566 K571	T565-Q569 PolarHBondContact O-N 3.16Å; I566-Q569 PolarHBondContact O-N 3.07Å; Q569-K571 VanDerWaalsContact C-N 3.26Å; Q569-K571 PolarHBondContact O-N 3.21Å
570	L	63.7	Low	67.4	Low	24 Å²	24	83.7 Å²	83.7	13%	0.126	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	24.4	-178.2	-71.3	150.1	0	0	0	113.4	I566 D572 H573 K576 F638	I566-L570 HydrophobicContact CB-CD1 4.49Å; I566-L570 HydrophobicContact CG2-CD1 3.42Å; I566-L570 VanDerWaalsContact CG2-CD1 3.42Å; I566-L570 WeakPolarHBondContact O-CB 3.44Å; I566-L570 PolarHBondContact O-N 2.86Å; L570-D572 PolarHBondContact O-N 3.23Å; L570-D572 VanDerWaalsContact O-N 3.16Å; L570-H573 HydrophobicContact CD2-CB 4.41Å; L570-K576 WeakPolarHBondContact O-CE 3.41Å; L570-K576 PolarHBondContact O-NZ 3.44Å; L570-F638 HydrophobicContact CD1-CD1 4.2Å; L570-F638 HydrophobicContact CD1-CE1 3.57Å; L570-F638 HydrophobicContact CD1-CZ 4.23Å
571	K	58.2	Low	67.5	Low	130 Å²	130	84.9 Å²	84.9	57%	0.565	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.4	-177.3	-108.6	178.6	178.5	-178.3	0	114	Q569 K576	Q569-K571 VanDerWaalsContact C-N 3.26Å; Q569-K571 PolarHBondContact O-N 3.21Å; K571-K576 PolarHBondContact O-NZ 3.09Å
572	D	54.8	Low	67.5	Low	159 Å²	159	82.9 Å²	82.9	85%	0.85	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	8.4	-171.5	-66.4	-22.7	0	0	0	115.3	L570	L570-D572 PolarHBondContact O-N 3.23Å; L570-D572 VanDerWaalsContact O-N 3.16Å
573	H	55.7	Low	67.6	Low	121 Å²	121	81.7 Å²	81.7	56%	0.56	41%	0.411	S	S	*	.			trans	-92.3	122.1	178.1	-75.1	-78.5	0	0	0	112.4	L570 C575	L570-H573 HydrophobicContact CD2-CB 4.41Å; H573-C575 PolarHBondContact O-N 3.19Å
574	S	55.4	Low	67.7	Low	134 Å²	134	85.5 Å²	85.5	94%	0.937	43%	0.429	S	S	*	.	S	Bend	trans	-72.9	52.9	-176.9	-178.3	0	0	0	0	114
575	C	57.2	Low	67.8	Low	38 Å²	38	87.3 Å²	87.3	26%	0.257	44%	0.437	S	S	.	.			trans	-125.6	27	176	-168.3	0	0	0	0	112.3	H573 I579 L606	H573-C575 PolarHBondContact O-N 3.19Å; C575-I579 VanDerWaalsContact O-CD1 3.24Å; C575-I579 WeakPolarHBondContact O-CD1 3.01Å; C575-I579 WeakPolarHBondContact O-CG1 3.48Å; C575-L606 PolarHBondContact SG-O 2.75Å
576	K	58.3	Low	67.6	Low	95 Å²	95	90.7 Å²	90.7	41%	0.413	44%	0.444	S	S	.	.			trans	-85.2	-21.8	-164	-71.2	-177.4	174.3	-177.7	0	115.3	L570 K571	L570-K576 WeakPolarHBondContact O-CE 3.41Å; L570-K576 PolarHBondContact O-NZ 3.44Å; K571-K576 PolarHBondContact O-NZ 3.09Å
577	D	56.5	Low	67.8	Low	141 Å²	141	91.3 Å²	91.3	75%	0.754	45%	0.447	S	S	*	.	S	Bend	trans	-101.2	-10.2	-160.8	-62.9	-24.3	0	0	0	115.9
578	N	65.6	Low	67.8	Low	100 Å²	100	98.7 Å²	98.7	54%	0.535	48%	0.479	S	S	.	.	S	Bend	trans	-128.7	2.2	-170.9	-62.7	-23	0	0	0	115.8	A582	N578-A582 VanDerWaalsContact O-CB 3.31Å; N578-A582 WeakPolarHBondContact O-CB 3.36Å; N578-A582 PolarHBondContact O-N 3.47Å
579	I	73.5	Confident	67.9	Low	8 Å²	8	100 Å²	100	4%	0.041	49%	0.487	C	S	.	.	H	α-helix	trans	-67.1	-45.2	-174.3	-60.3	173.9	0	0	0	111.4	C575 E581 A582 F583 L606 V608 V635 F638	C575-I579 VanDerWaalsContact O-CD1 3.24Å; C575-I579 WeakPolarHBondContact O-CD1 3.01Å; C575-I579 WeakPolarHBondContact O-CG1 3.48Å; I579-E581 PolarHBondContact O-N 2.79Å; I579-A582 PolarHBondContact O-N 3.31Å; I579-F583 HydrophobicContact CG2-CD2 3.82Å; I579-F583 HydrophobicContact CG2-CE2 3.64Å; I579-F583 WeakPolarHBondContact O-CD2 3.46Å; I579-F583 PolarHBondContact O-N 3.4Å; I579-L606 HydrophobicContact CB-CD1 4.4Å; I579-L606 HydrophobicContact CG1-CD1 4.12Å; I579-L606 HydrophobicContact CG2-CD1 4.44Å; I579-V608 HydrophobicContact CD1-CG2 4.36Å; I579-V635 HydrophobicContact CG2-CG2 4.26Å; I579-F638 HydrophobicContact CD1-CB 3.9Å; I579-F638 HydrophobicContact CD1-CD1 4.48Å; I579-F638 HydrophobicContact CD1-CG 4.21Å
580	R	73.8	Confident	68.2	Low	149 Å²	149	97.2 Å²	97.2	56%	0.562	49%	0.487	S	S	*	.	H	α-helix	trans	-63.9	-43.1	-179.2	-175.5	176	178.5	173.9	1	112	F583 Q584 V635	R580-F583 PolarHBondContact O-N 2.86Å; R580-Q584 WeakPolarHBondContact O-CG 3.46Å; R580-Q584 PolarHBondContact O-N 3.48Å; R580-Q584 VanDerWaalsContact O-N 3.11Å; R580-V635 HydrophobicContact CB-CG1 3.94Å; R580-V635 HydrophobicContact CG-CG1 4.17Å
581	E	75	Confident	68.7	Low	120 Å²	120	98.8 Å²	98.8	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-67.8	-39.5	179.6	-62	-173.3	173.1	0	0	111.4	I579 F583 Q584 I585	I579-E581 PolarHBondContact O-N 2.79Å; E581-F583 PolarHBondContact O-N 2.87Å; E581-Q584 PolarHBondContact O-N 2.92Å; E581-I585 VanDerWaalsContact O-CG1 3.3Å; E581-I585 WeakPolarHBondContact O-CG1 3.48Å; E581-I585 PolarHBondContact O-N 2.82Å
582	A	76.8	Confident	69.5	Low	15 Å²	15	92.6 Å²	92.6	12%	0.124	47%	0.473	C	S	.	.	H	α-helix	trans	-59.3	-46.6	176.1	0	0	0	0	0	111.9	N578 I579 Q584 I585 Y586 I602 L606	N578-A582 VanDerWaalsContact O-CB 3.31Å; N578-A582 WeakPolarHBondContact O-CB 3.36Å; N578-A582 PolarHBondContact O-N 3.47Å; I579-A582 PolarHBondContact O-N 3.31Å; A582-Q584 PolarHBondContact O-N 2.91Å; A582-I585 PolarHBondContact O-N 3.11Å; A582-Y586 VanDerWaalsContact O-CD2 3.24Å; A582-Y586 WeakPolarHBondContact O-CD2 3.24Å; A582-I602 HydrophobicContact CB-CG2 4.14Å; A582-L606 HydrophobicContact CB-CD1 3.8Å; A582-L606 HydrophobicContact CB-CD2 4.44Å
583	F	78.6	Confident	70.7	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	45%	0.453	C	S	.	.	H	α-helix	trans	-67.2	-35.1	176.8	-75.8	-69.1	0	0	0	112.9	I579 R580 E581 Y586 D587 V594 F599 I602 Y631 F634 V635	I579-F583 HydrophobicContact CG2-CD2 3.82Å; I579-F583 HydrophobicContact CG2-CE2 3.64Å; I579-F583 WeakPolarHBondContact O-CD2 3.46Å; I579-F583 PolarHBondContact O-N 3.4Å; R580-F583 PolarHBondContact O-N 2.86Å; E581-F583 PolarHBondContact O-N 2.87Å; F583-Y586 PolarHBondContact O-N 3.22Å; F583-D587 WeakPolarHBondContact O-CB 3.42Å; F583-D587 PolarHBondContact O-N 2.82Å; F583-V594 HydrophobicContact CD1-CG2 4.21Å; F583-F599 AromaticContact CE1-CD2 3.47Å; F583-F599 HydrophobicContact CE1-CD2 3.47Å; F583-F599 VanDerWaalsContact CE1-CD2 3.47Å; F583-F599 AromaticContact CE1-CE2 3.87Å; F583-F599 HydrophobicContact CE1-CE2 3.87Å; F583-F599 HydrophobicContact CE1-CG 4.3Å; F583-F599 AromaticContact CZ-CD2 3.7Å; F583-F599 HydrophobicContact CZ-CD2 3.7Å; F583-F599 AromaticContact CZ-CE2 3.62Å; F583-F599 HydrophobicContact CZ-CE2 3.62Å; F583-F599 HydrophobicContact CZ-CZ 4.44Å; F583-I602 HydrophobicContact CD1-CD1 3.63Å; F583-I602 HydrophobicContact CD1-CG2 4.11Å; F583-I602 HydrophobicContact CD2-CG2 4.36Å; F583-I602 HydrophobicContact CE1-CB 3.94Å; F583-I602 HydrophobicContact CE1-CD1 3.71Å; F583-I602 HydrophobicContact CE1-CG1 4.44Å; F583-I602 HydrophobicContact CE1-CG2 3.73Å; F583-I602 HydrophobicContact CE2-CG2 4Å; F583-I602 HydrophobicContact CG-CG2 4.41Å; F583-I602 HydrophobicContact CZ-CB 4.17Å; F583-I602 HydrophobicContact CZ-CG2 3.67Å; F583-Y631 HydrophobicContact CB-CD2 3.62Å; F583-Y631 HydrophobicContact CB-CE2 3.77Å; F583-Y631 HydrophobicContact CB-CG 4.04Å; F583-Y631 HydrophobicContact CD1-CG 4.24Å; F583-Y631 HydrophobicContact CD2-CD2 4.46Å; F583-Y631 HydrophobicContact CG-CD2 4.01Å; F583-Y631 HydrophobicContact CG-CG 4.11Å; F583-F634 HydrophobicContact CE2-CD1 4.26Å; F583-F634 HydrophobicContact CE2-CE1 4.34Å; F583-F634 HydrophobicContact CZ-CD1 4.48Å; F583-F634 HydrophobicContact CZ-CE1 4.46Å; F583-V635 HydrophobicContact CD2-CG2 3.94Å; F583-V635 HydrophobicContact CE2-CG2 4.49Å
584	Q	77.4	Confident	72	Confident	88 Å²	88	84.8 Å²	84.8	41%	0.411	43%	0.428	S	S	.	.	H	α-helix	trans	-68.5	-31.8	176.6	-75.8	-179.3	-7	0	0	113.8	R580 E581 A582 Y586 D587	R580-Q584 WeakPolarHBondContact O-CG 3.46Å; R580-Q584 PolarHBondContact O-N 3.48Å; R580-Q584 VanDerWaalsContact O-N 3.11Å; E581-Q584 PolarHBondContact O-N 2.92Å; A582-Q584 PolarHBondContact O-N 2.91Å; Q584-Y586 VanDerWaalsContact C-N 3.28Å; Q584-Y586 PolarHBondContact O-N 2.77Å; Q584-D587 PolarHBondContact O-N 3.05Å
585	I	78.3	Confident	73.3	Confident	123 Å²	123	82.9 Å²	82.9	63%	0.631	41%	0.408	S	S	*	.	H	α-helix	trans	-63.7	-36.1	175.9	-70.9	163.7	0	0	0	111.3	E581 A582	E581-I585 VanDerWaalsContact O-CG1 3.3Å; E581-I585 WeakPolarHBondContact O-CG1 3.48Å; E581-I585 PolarHBondContact O-N 2.82Å; A582-I585 PolarHBondContact O-N 3.11Å
586	Y	73.7	Confident	74.4	Confident	133 Å²	133	87.9 Å²	87.9	52%	0.522	42%	0.422	S	S	.	.	H	α-helix	trans	-87.5	-25.3	-179.1	-70.9	-78.2	0	0	0	113.1	A582 F583 Q584 K588 M598 I602	A582-Y586 VanDerWaalsContact O-CD2 3.24Å; A582-Y586 WeakPolarHBondContact O-CD2 3.24Å; F583-Y586 PolarHBondContact O-N 3.22Å; Q584-Y586 VanDerWaalsContact C-N 3.28Å; Q584-Y586 PolarHBondContact O-N 2.77Å; Y586-K588 PolarHBondContact O-N 2.79Å; Y586-M598 HydrophobicContact CD1-SD 3.93Å; Y586-M598 HydrophobicContact CG-SD 4.37Å; Y586-I602 HydrophobicContact CD2-CD1 3.64Å; Y586-I602 HydrophobicContact CD2-CG1 3.92Å; Y586-I602 HydrophobicContact CE2-CD1 4.34Å; Y586-I602 HydrophobicContact CE2-CG1 4.11Å; Y586-I602 HydrophobicContact CG-CD1 4.06Å
587	D	78.9	Confident	75.5	Confident	14 Å²	14	89.3 Å²	89.3	8%	0.075	43%	0.434	C	S	.	.			trans	-88.3	71.9	175.2	-174.2	16.7	0	0	0	111.9	F583 Q584 E589 A590 S591 G592 Y631	F583-D587 WeakPolarHBondContact O-CB 3.42Å; F583-D587 PolarHBondContact O-N 2.82Å; Q584-D587 PolarHBondContact O-N 3.05Å; D587-E589 PolarHBondContact O-N 3.09Å; D587-E589 VanDerWaalsContact O-N 3.11Å; D587-A590 PolarHBondContact O-N 2.83Å; D587-A590 PolarHBondContact OD1-N 3.32Å; D587-A590 WeakPolarHBondContact OD2-CA 3.23Å; D587-S591 VanDerWaalsContact CG-N 3.34Å; D587-S591 PolarHBondContact OD1-N 3.28Å; D587-S591 PolarHBondContact OD1-OG 3.32Å; D587-S591 PolarHBondContact OD2-N 2.95Å; D587-G592 PolarHBondContact OD2-N 2.91Å; D587-Y631 HydrophobicContact CB-CE1 4.14Å; D587-Y631 WeakPolarHBondContact OD2-CE1 3.47Å; D587-Y631 PolarHBondContact OD2-OH 3.25Å
588	K	72.7	Confident	76.6	Confident	199 Å²	199	86.4 Å²	86.4	87%	0.865	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.9	-178.2	-66.6	-176.8	-178.8	177.8	0	114.3	Y586	Y586-K588 PolarHBondContact O-N 2.79Å
589	E	76	Confident	77.5	Confident	176 Å²	176	81.6 Å²	81.6	82%	0.822	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	0.3	-178.2	-64.2	-175.7	171	0	0	112.8	D587 S591	D587-E589 PolarHBondContact O-N 3.09Å; D587-E589 VanDerWaalsContact O-N 3.11Å; E589-S591 PolarHBondContact O-N 3.1Å
590	A	72.8	Confident	77.9	Confident	74 Å²	74	84 Å²	84	61%	0.612	40%	0.401	S	S	*	.			trans	51.9	33	-174.2	0	0	0	0	0	113.3	D587 G592	D587-A590 PolarHBondContact O-N 2.83Å; D587-A590 PolarHBondContact OD1-N 3.32Å; D587-A590 WeakPolarHBondContact OD2-CA 3.23Å; A590-G592 VanDerWaalsContact C-N 3.31Å; A590-G592 PolarHBondContact O-N 3.14Å
591	S	73.4	Confident	78.2	Confident	57 Å²	57	83.5 Å²	83.5	40%	0.399	40%	0.403	S	S	.	.			trans	-72	-22.8	-173.1	67	0	0	0	0	113.3	D587 E589 Y593	D587-S591 VanDerWaalsContact CG-N 3.34Å; D587-S591 PolarHBondContact OD1-N 3.28Å; D587-S591 PolarHBondContact OD1-OG 3.32Å; D587-S591 PolarHBondContact OD2-N 2.95Å; E589-S591 PolarHBondContact O-N 3.1Å; S591-Y593 VanDerWaalsContact C-N 3.32Å; S591-Y593 VanDerWaalsContact O-CD2 3.23Å; S591-Y593 WeakPolarHBondContact O-CD2 3.41Å; S591-Y593 PolarHBondContact OG-N 3.13Å; S591-Y593 PolarHBondContact OG-O 3.11Å
592	G	75.8	Confident	78.4	Confident	1 Å²	1	78 Å²	78	1%	0.01	38%	0.377	C	S	.	.	S	Bend	trans	83.3	3.3	-175.9	0	0	0	0	0	115.3	D587 A590 Y631	D587-G592 PolarHBondContact OD2-N 2.91Å; A590-G592 VanDerWaalsContact C-N 3.31Å; A590-G592 PolarHBondContact O-N 3.14Å; G592-Y631 VanDerWaalsContact C-CD1 3.47Å; G592-Y631 VanDerWaalsContact CA-CE1 3.43Å; G592-Y631 VanDerWaalsContact O-CD1 3.25Å; G592-Y631 WeakPolarHBondContact O-CD1 3.27Å; G592-Y631 WeakPolarHBondContact O-CE1 3.43Å; G592-Y631 PolarHBondContact O-N 3.32Å
593	Y	80.4	Confident	78.4	Confident	107 Å²	107	77.3 Å²	77.3	42%	0.42	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.7	-178.2	-63.6	-87.5	0	0	0	110.9	S591 I629 N630	S591-Y593 VanDerWaalsContact C-N 3.32Å; S591-Y593 VanDerWaalsContact O-CD2 3.23Å; S591-Y593 WeakPolarHBondContact O-CD2 3.41Å; S591-Y593 PolarHBondContact OG-N 3.13Å; S591-Y593 PolarHBondContact OG-O 3.11Å; Y593-I629 WeakPolarHBondContact CA-O 3.47Å; Y593-N630 HydrophobicContact CD1-CB 4.01Å; Y593-N630 HydrophobicContact CE1-CB 3.72Å
594	V	81.7	Confident	78.4	Confident	8 Å²	8	84 Å²	84	5%	0.048	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.2	175.4	175.9	0	0	0	0	109.5	F583 M598 F599 I602 I629 Y631	F583-V594 HydrophobicContact CD1-CG2 4.21Å; V594-M598 HydrophobicContact CG1-CB 3.83Å; V594-M598 HydrophobicContact CG1-CG 3.95Å; V594-F599 HydrophobicContact CG1-CB 4.31Å; V594-I602 HydrophobicContact CG1-CD1 4.42Å; V594-I629 PolarHBondContact N-O 3.31Å; V594-I629 PolarHBondContact O-N 3.48Å; V594-Y631 HydrophobicContact CG2-CD1 3.69Å; V594-Y631 HydrophobicContact CG2-CE1 3.96Å
595	D	83.2	Confident	78.4	Confident	95 Å²	95	84 Å²	84	51%	0.508	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	143.2	177.1	-70.6	-20.3	0	0	0	111.3	D597 M598 F599	D595-D597 VanDerWaalsContact C-N 3.32Å; D595-D597 PolarHBondContact O-N 2.92Å; D595-M598 HydrophobicContact CB-CB 4.49Å; D595-M598 PolarHBondContact O-N 3.23Å; D595-F599 PolarHBondContact O-N 3.32Å
596	R	80.6	Confident	78.1	Confident	143 Å²	143	79.8 Å²	79.8	54%	0.54	39%	0.391	S	S	.	.	H	α-helix	trans	-50.9	-46.6	-175.2	-176.2	176	-179.2	161.3	2.8	113.5	M598 F599 F600 G627 I629	R596-M598 VanDerWaalsContact C-N 3.3Å; R596-M598 PolarHBondContact O-N 3.07Å; R596-F599 PolarHBondContact O-N 3.03Å; R596-F600 HydrophobicContact CG-CD2 3.93Å; R596-F600 HydrophobicContact CG-CE2 3.58Å; R596-F600 WeakPolarHBondContact O-CD2 3.34Å; R596-F600 PolarHBondContact O-N 3.34Å; R596-F600 VanDerWaalsContact O-N 3.13Å; R596-G627 WeakPolarHBondContact CB-O 3.49Å; R596-G627 PolarHBondContact N-O 3.33Å; R596-I629 HydrophobicContact CB-CD1 4.35Å; R596-I629 HydrophobicContact CG-CD1 4.23Å
597	D	80.9	Confident	77.9	Confident	125 Å²	125	80.3 Å²	80.3	67%	0.668	40%	0.403	S	S	*	.	H	α-helix	trans	-68.1	-31.6	-178.6	-64.3	-20.9	0	0	0	112.4	D595 K601	D595-D597 VanDerWaalsContact C-N 3.32Å; D595-D597 PolarHBondContact O-N 2.92Å; D597-K601 VanDerWaalsContact O-CG 3.31Å; D597-K601 WeakPolarHBondContact O-CG 3.43Å; D597-K601 PolarHBondContact O-N 3.01Å
598	M	79.9	Confident	77.7	Confident	79 Å²	79	80.1 Å²	80.1	39%	0.389	40%	0.402	S	S	.	.	H	α-helix	trans	-78.4	-36.8	177.5	-170.8	152.9	-77.1	0	0	111.2	Y586 V594 D595 R596 K601 I602	Y586-M598 HydrophobicContact CD1-SD 3.93Å; Y586-M598 HydrophobicContact CG-SD 4.37Å; V594-M598 HydrophobicContact CG1-CB 3.83Å; V594-M598 HydrophobicContact CG1-CG 3.95Å; D595-M598 HydrophobicContact CB-CB 4.49Å; D595-M598 PolarHBondContact O-N 3.23Å; R596-M598 VanDerWaalsContact C-N 3.3Å; R596-M598 PolarHBondContact O-N 3.07Å; M598-K601 PolarHBondContact O-N 3.39Å; M598-I602 HydrophobicContact CG-CD1 4.23Å; M598-I602 VanDerWaalsContact O-CG1 3.31Å; M598-I602 WeakPolarHBondContact O-CG1 3.31Å; M598-I602 PolarHBondContact O-N 3.25Å
599	F	83.7	Confident	77.6	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-58.8	-47.4	173.6	-179.8	-88.7	0	0	0	111.9	F583 V594 D595 R596 K601 I602 C603 I619 I629 F634	F583-F599 AromaticContact CE1-CD2 3.47Å; F583-F599 HydrophobicContact CE1-CD2 3.47Å; F583-F599 VanDerWaalsContact CE1-CD2 3.47Å; F583-F599 AromaticContact CE1-CE2 3.87Å; F583-F599 HydrophobicContact CE1-CE2 3.87Å; F583-F599 HydrophobicContact CE1-CG 4.3Å; F583-F599 AromaticContact CZ-CD2 3.7Å; F583-F599 HydrophobicContact CZ-CD2 3.7Å; F583-F599 AromaticContact CZ-CE2 3.62Å; F583-F599 HydrophobicContact CZ-CE2 3.62Å; F583-F599 HydrophobicContact CZ-CZ 4.44Å; V594-F599 HydrophobicContact CG1-CB 4.31Å; D595-F599 PolarHBondContact O-N 3.32Å; R596-F599 PolarHBondContact O-N 3.03Å; F599-K601 PolarHBondContact O-N 3.15Å; F599-I602 PolarHBondContact O-N 3.17Å; F599-C603 PolarHBondContact O-N 3.33Å; F599-C603 PolarHBondContact O-SG 2.74Å; F599-C603 VanDerWaalsContact O-SG 3.34Å; F599-I619 HydrophobicContact CE1-CD1 3.94Å; F599-I619 HydrophobicContact CE1-CG1 3.9Å; F599-I619 HydrophobicContact CZ-CG1 4.21Å; F599-I629 HydrophobicContact CB-CD1 3.92Å; F599-I629 HydrophobicContact CD1-CD1 3.59Å; F599-I629 HydrophobicContact CD2-CB 4.2Å; F599-I629 HydrophobicContact CD2-CD1 4.32Å; F599-I629 HydrophobicContact CD2-CG2 3.89Å; F599-I629 HydrophobicContact CE1-CD1 4.18Å; F599-I629 HydrophobicContact CE2-CG2 3.84Å; F599-I629 HydrophobicContact CG-CB 4.36Å; F599-I629 HydrophobicContact CG-CD1 3.67Å; F599-I629 HydrophobicContact CG-CG2 4.32Å; F599-I629 HydrophobicContact CZ-CG2 4.22Å; F599-F634 HydrophobicContact CE1-CE2 4.45Å; F599-F634 HydrophobicContact CE1-CZ 4.4Å; F599-F634 HydrophobicContact CE2-CB 4.46Å; F599-F634 AromaticContact CE2-CD1 3.81Å; F599-F634 HydrophobicContact CE2-CD1 3.81Å; F599-F634 HydrophobicContact CE2-CD2 4.46Å; F599-F634 HydrophobicContact CE2-CE1 4.11Å; F599-F634 AromaticContact CE2-CG 3.99Å; F599-F634 HydrophobicContact CE2-CG 3.99Å; F599-F634 AromaticContact CZ-CD1 3.7Å; F599-F634 HydrophobicContact CZ-CD1 3.7Å; F599-F634 AromaticContact CZ-CD2 3.76Å; F599-F634 HydrophobicContact CZ-CD2 3.76Å; F599-F634 AromaticContact CZ-CE1 3.67Å; F599-F634 HydrophobicContact CZ-CE1 3.67Å; F599-F634 AromaticContact CZ-CE2 3.74Å; F599-F634 HydrophobicContact CZ-CE2 3.74Å; F599-F634 AromaticContact CZ-CG 3.73Å; F599-F634 HydrophobicContact CZ-CG 3.73Å; F599-F634 AromaticContact CZ-CZ 3.69Å; F599-F634 HydrophobicContact CZ-CZ 3.69Å
600	F	82.1	Confident	77.1	Confident	58 Å²	58	66.5 Å²	66.5	25%	0.254	35%	0.349	S	S	.	.	H	α-helix	trans	-65.2	-38.2	177.2	-74.6	-66.5	0	0	0	112.7	R596 I602 C603 E604 V610 I619	R596-F600 HydrophobicContact CG-CD2 3.93Å; R596-F600 HydrophobicContact CG-CE2 3.58Å; R596-F600 WeakPolarHBondContact O-CD2 3.34Å; R596-F600 PolarHBondContact O-N 3.34Å; R596-F600 VanDerWaalsContact O-N 3.13Å; F600-I602 VanDerWaalsContact C-N 3.34Å; F600-I602 PolarHBondContact O-N 3.32Å; F600-C603 PolarHBondContact O-N 3.27Å; F600-E604 WeakPolarHBondContact O-CG 3.37Å; F600-E604 PolarHBondContact O-N 2.8Å; F600-V610 HydrophobicContact CD1-CG1 3.71Å; F600-V610 HydrophobicContact CE1-CG1 3.44Å; F600-V610 VanDerWaalsContact CE1-CG1 3.44Å; F600-I619 HydrophobicContact CE1-CD1 4.23Å; F600-I619 HydrophobicContact CZ-CG2 4.41Å
601	K	80.8	Confident	76.9	Confident	139 Å²	139	69.3 Å²	69.3	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-61.3	-39.7	173.9	-75.3	173.8	-177.3	175.8	0	112.8	D597 M598 F599 S605	D597-K601 VanDerWaalsContact O-CG 3.31Å; D597-K601 WeakPolarHBondContact O-CG 3.43Å; D597-K601 PolarHBondContact O-N 3.01Å; M598-K601 PolarHBondContact O-N 3.39Å; F599-K601 PolarHBondContact O-N 3.15Å; K601-S605 WeakPolarHBondContact O-CB 3.32Å; K601-S605 PolarHBondContact O-N 2.92Å
602	I	78.8	Confident	77.1	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.015	35%	0.349	C	S	.	.	H	α-helix	trans	-66.5	-44.8	176.6	-66.8	165.4	0	0	0	109.9	A582 F583 Y586 V594 M598 F599 F600 E604 S605 L606	A582-I602 HydrophobicContact CB-CG2 4.14Å; F583-I602 HydrophobicContact CD1-CD1 3.63Å; F583-I602 HydrophobicContact CD1-CG2 4.11Å; F583-I602 HydrophobicContact CD2-CG2 4.36Å; F583-I602 HydrophobicContact CE1-CB 3.94Å; F583-I602 HydrophobicContact CE1-CD1 3.71Å; F583-I602 HydrophobicContact CE1-CG1 4.44Å; F583-I602 HydrophobicContact CE1-CG2 3.73Å; F583-I602 HydrophobicContact CE2-CG2 4Å; F583-I602 HydrophobicContact CG-CG2 4.41Å; F583-I602 HydrophobicContact CZ-CB 4.17Å; F583-I602 HydrophobicContact CZ-CG2 3.67Å; Y586-I602 HydrophobicContact CD2-CD1 3.64Å; Y586-I602 HydrophobicContact CD2-CG1 3.92Å; Y586-I602 HydrophobicContact CE2-CD1 4.34Å; Y586-I602 HydrophobicContact CE2-CG1 4.11Å; Y586-I602 HydrophobicContact CG-CD1 4.06Å; V594-I602 HydrophobicContact CG1-CD1 4.42Å; M598-I602 HydrophobicContact CG-CD1 4.23Å; M598-I602 VanDerWaalsContact O-CG1 3.31Å; M598-I602 WeakPolarHBondContact O-CG1 3.31Å; M598-I602 PolarHBondContact O-N 3.25Å; F599-I602 PolarHBondContact O-N 3.17Å; F600-I602 VanDerWaalsContact C-N 3.34Å; F600-I602 PolarHBondContact O-N 3.32Å; I602-E604 PolarHBondContact O-N 3Å; I602-S605 PolarHBondContact O-N 3.29Å; I602-S605 PolarHBondContact O-OG 2.77Å; I602-L606 HydrophobicContact CG2-CD1 3.71Å; I602-L606 WeakPolarHBondContact O-CG 3.21Å; I602-L606 PolarHBondContact O-N 2.82Å; I602-L606 VanDerWaalsContact O-N 3.09Å
603	C	77.3	Confident	77.1	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.007	38%	0.378	C	S	.	.	H	α-helix	trans	-62.6	-39.3	176.9	-68.6	0	0	0	0	113.2	F599 F600 L606 N607 V608 V610	F599-C603 PolarHBondContact O-N 3.33Å; F599-C603 PolarHBondContact O-SG 2.74Å; F599-C603 VanDerWaalsContact O-SG 3.34Å; F600-C603 PolarHBondContact O-N 3.27Å; C603-L606 PolarHBondContact O-N 3.34Å; C603-N607 PolarHBondContact O-N 2.85Å; C603-V608 HydrophobicContact CB-CB 4.26Å; C603-V608 PolarHBondContact O-N 2.85Å; C603-V610 HydrophobicContact CB-CG2 3.63Å
604	E	78	Confident	76.8	Confident	142 Å²	142	70.3 Å²	70.3	66%	0.664	37%	0.368	S	S	*	.	H	α-helix	trans	-63.4	-42.8	172.6	-77.6	-179.8	176.7	0	0	111.7	F600 I602 L606 N607	F600-E604 WeakPolarHBondContact O-CG 3.37Å; F600-E604 PolarHBondContact O-N 2.8Å; I602-E604 PolarHBondContact O-N 3Å; E604-L606 PolarHBondContact O-N 2.81Å; E604-N607 PolarHBondContact O-N 2.93Å
605	S	76.4	Confident	76.4	Confident	86 Å²	86	69.9 Å²	69.9	60%	0.601	37%	0.366	S	S	*	.	H	α-helix	trans	-65.8	-24.9	179	74.2	0	0	0	0	113.7	K601 I602	K601-S605 WeakPolarHBondContact O-CB 3.32Å; K601-S605 PolarHBondContact O-N 2.92Å; I602-S605 PolarHBondContact O-N 3.29Å; I602-S605 PolarHBondContact O-OG 2.77Å
606	L	73.3	Confident	76.1	Confident	35 Å²	35	70.1 Å²	70.1	18%	0.183	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	5.5	-178.4	-64.7	170.7	0	0	0	112.5	C575 I579 A582 I602 C603 E604 V608	C575-L606 PolarHBondContact SG-O 2.75Å; I579-L606 HydrophobicContact CB-CD1 4.4Å; I579-L606 HydrophobicContact CG1-CD1 4.12Å; I579-L606 HydrophobicContact CG2-CD1 4.44Å; A582-L606 HydrophobicContact CB-CD1 3.8Å; A582-L606 HydrophobicContact CB-CD2 4.44Å; I602-L606 HydrophobicContact CG2-CD1 3.71Å; I602-L606 WeakPolarHBondContact O-CG 3.21Å; I602-L606 PolarHBondContact O-N 2.82Å; I602-L606 VanDerWaalsContact O-N 3.09Å; C603-L606 PolarHBondContact O-N 3.34Å; E604-L606 PolarHBondContact O-N 2.81Å; L606-V608 HydrophobicContact CB-CG2 4.07Å; L606-V608 PolarHBondContact O-N 3.3Å
607	N	69.6	Low	76	Confident	144 Å²	144	67.3 Å²	67.3	77%	0.77	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	34.2	-175.9	-75.9	18.2	0	0	0	113.9	C603 E604	C603-N607 PolarHBondContact O-N 2.85Å; E604-N607 PolarHBondContact O-N 2.93Å
608	V	74.3	Confident	75.9	Confident	11 Å²	11	61.4 Å²	61.4	7%	0.067	32%	0.323	C	S	.	.			trans	-72.1	131	173.6	179.6	0	0	0	0	108.2	I579 C603 L606 V610 F634 F638	I579-V608 HydrophobicContact CD1-CG2 4.36Å; C603-V608 HydrophobicContact CB-CB 4.26Å; C603-V608 PolarHBondContact O-N 2.85Å; L606-V608 HydrophobicContact CB-CG2 4.07Å; L606-V608 PolarHBondContact O-N 3.3Å; V608-V610 VanDerWaalsContact O-CG2 3.3Å; V608-V610 WeakPolarHBondContact O-CG2 3.42Å; V608-V610 PolarHBondContact O-N 2.84Å; V608-F634 HydrophobicContact CG1-CZ 4.33Å; V608-F638 HydrophobicContact CG1-CE1 4.31Å; V608-F638 HydrophobicContact CG1-CZ 4.05Å
609	P	69.9	Low	75.8	Confident	60 Å²	60	58.4 Å²	58.4	39%	0.39	31%	0.309	S	S	.	.			trans	-73.6	78.2	-179.1	30.2	-34.9	0	0	0	110.9	D611 D612	P609-D611 PolarHBondContact O-N 2.82Å; P609-D611 VanDerWaalsContact O-N 3.13Å; P609-D612 WeakPolarHBondContact O-CB 3.47Å; P609-D612 PolarHBondContact O-N 2.92Å
610	V	67.3	Low	75.6	Confident	28 Å²	28	65.9 Å²	65.9	17%	0.17	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-19.4	178.6	-165.9	0	0	0	0	111.9	F600 C603 V608 K616 I619	F600-V610 HydrophobicContact CD1-CG1 3.71Å; F600-V610 HydrophobicContact CE1-CG1 3.44Å; F600-V610 VanDerWaalsContact CE1-CG1 3.44Å; C603-V610 HydrophobicContact CB-CG2 3.63Å; V608-V610 VanDerWaalsContact O-CG2 3.3Å; V608-V610 WeakPolarHBondContact O-CG2 3.42Å; V608-V610 PolarHBondContact O-N 2.84Å; V610-K616 WeakPolarHBondContact O-CE 3.4Å; V610-K616 VanDerWaalsContact O-CG 3.31Å; V610-K616 WeakPolarHBondContact O-CG 3.41Å; V610-I619 HydrophobicContact CG1-CD1 3.94Å
611	D	67.8	Low	75.3	Confident	134 Å²	134	65.3 Å²	65.3	72%	0.717	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-13	179.9	-87.6	-42.7	0	0	0	115.5	P609 K616	P609-D611 PolarHBondContact O-N 2.82Å; P609-D611 VanDerWaalsContact O-N 3.13Å; D611-K616 PolarHBondContact O-NZ 3.4Å; D611-K616 IonicContact OD1-NZ 2.87Å; D611-K616 PolarHBondContact OD1-NZ 2.97Å
612	D	76.8	Confident	75	Confident	57 Å²	57	58.8 Å²	58.8	31%	0.305	31%	0.307	S	S	.	.	S	Bend	trans	-65.4	136.5	176.9	-169.8	-2.3	0	0	0	111.2	P609 L614 V615 K616	P609-D612 WeakPolarHBondContact O-CB 3.47Å; P609-D612 PolarHBondContact O-N 2.92Å; D612-L614 VanDerWaalsContact C-N 3.25Å; D612-L614 PolarHBondContact O-N 2.82Å; D612-V615 HydrophobicContact CB-CB 4.32Å; D612-V615 HydrophobicContact CB-CG2 4.05Å; D612-V615 PolarHBondContact O-N 2.84Å; D612-K616 PolarHBondContact O-N 2.9Å
613	S	76.4	Confident	74.9	Confident	88 Å²	88	60.9 Å²	60.9	62%	0.615	32%	0.323	S	S	*	.	H	α-helix	trans	-59.4	-35.8	-177	46.6	0	0	0	0	112.6	E617	S613-E617 PolarHBondContact O-N 2.97Å; S613-E617 VanDerWaalsContact O-N 3.15Å
614	L	74.4	Confident	74.4	Confident	40 Å²	40	66.9 Å²	66.9	21%	0.209	35%	0.35	C	S	.	.	H	α-helix	trans	-72.5	-38.1	-179.8	-63.8	176.5	0	0	0	112	L562 I566 D612 E617 L618	L562-L614 HydrophobicContact CD1-CD2 4.27Å; I566-L614 HydrophobicContact CD1-CB 4.31Å; I566-L614 HydrophobicContact CG1-CB 4.1Å; D612-L614 VanDerWaalsContact C-N 3.25Å; D612-L614 PolarHBondContact O-N 2.82Å; L614-E617 PolarHBondContact O-N 2.74Å; L614-L618 PolarHBondContact O-N 3.07Å
615	V	73.6	Confident	73.5	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-71.3	-37.5	178.1	-178.3	0	0	0	0	110.7	D612 E617 L618 I619 F634 F638	D612-V615 HydrophobicContact CB-CB 4.32Å; D612-V615 HydrophobicContact CB-CG2 4.05Å; D612-V615 PolarHBondContact O-N 2.84Å; V615-E617 VanDerWaalsContact C-N 3.33Å; V615-E617 PolarHBondContact O-N 2.89Å; V615-L618 PolarHBondContact O-N 3.43Å; V615-I619 HydrophobicContact CG1-CD1 4.05Å; V615-I619 VanDerWaalsContact O-CG1 3.25Å; V615-I619 WeakPolarHBondContact O-CG1 3.21Å; V615-I619 PolarHBondContact O-N 2.78Å; V615-F634 HydrophobicContact CG1-CE2 4.07Å; V615-F634 HydrophobicContact CG1-CZ 4.42Å; V615-F638 HydrophobicContact CG1-CZ 4.48Å; V615-F638 HydrophobicContact CG2-CZ 4.15Å
616	K	77.2	Confident	72.7	Confident	99 Å²	99	67.8 Å²	67.8	43%	0.43	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-41.2	172	-77.8	173.5	172.9	152.9	0	112.3	V610 D611 D612 I619 R620	V610-K616 WeakPolarHBondContact O-CE 3.4Å; V610-K616 VanDerWaalsContact O-CG 3.31Å; V610-K616 WeakPolarHBondContact O-CG 3.41Å; D611-K616 PolarHBondContact O-NZ 3.4Å; D611-K616 IonicContact OD1-NZ 2.87Å; D611-K616 PolarHBondContact OD1-NZ 2.97Å; D612-K616 PolarHBondContact O-N 2.9Å; K616-I619 PolarHBondContact O-N 2.94Å; K616-R620 WeakPolarHBondContact O-CB 3.35Å; K616-R620 PolarHBondContact O-N 3.04Å
617	E	77.8	Confident	72.5	Confident	85 Å²	85	68.1 Å²	68.1	40%	0.397	38%	0.379	S	S	.	.	H	α-helix	trans	-68.5	-40.9	176.9	-171.6	130.3	-134.2	0	0	111.9	L562 S613 L614 V615 I619 R620 M621	L562-E617 HydrophobicContact CD2-CB 4.29Å; L562-E617 HydrophobicContact CD2-CG 3.97Å; S613-E617 PolarHBondContact O-N 2.97Å; S613-E617 VanDerWaalsContact O-N 3.15Å; L614-E617 PolarHBondContact O-N 2.74Å; V615-E617 VanDerWaalsContact C-N 3.33Å; V615-E617 PolarHBondContact O-N 2.89Å; E617-I619 PolarHBondContact O-N 2.7Å; E617-R620 WeakPolarHBondContact O-CB 3.48Å; E617-R620 PolarHBondContact O-N 3.38Å; E617-R620 IonicContact OE1-CZ 3.81Å; E617-R620 IonicContact OE1-NE 3.72Å; E617-R620 IonicContact OE1-NH2 2.84Å; E617-R620 PolarHBondContact OE1-NH2 3.49Å; E617-M621 WeakPolarHBondContact O-CG 3.34Å; E617-M621 PolarHBondContact O-N 3.18Å
618	L	78.6	Confident	72.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-44.5	173.3	-175.7	69.3	0	0	0	112	L559 L562 I563 I566 L614 V615 R620 M621 C622 F634 A637 F638	L559-L618 HydrophobicContact CD1-CD1 4.15Å; L562-L618 HydrophobicContact CD2-CB 4.27Å; L562-L618 HydrophobicContact CD2-CD1 4.43Å; I563-L618 HydrophobicContact CG1-CD1 4.15Å; I566-L618 HydrophobicContact CD1-CB 3.9Å; I566-L618 HydrophobicContact CD1-CD1 4.38Å; I566-L618 HydrophobicContact CD1-CD2 3.88Å; I566-L618 HydrophobicContact CD1-CG 4.27Å; L614-L618 PolarHBondContact O-N 3.07Å; V615-L618 PolarHBondContact O-N 3.43Å; L618-R620 VanDerWaalsContact C-N 3.32Å; L618-R620 PolarHBondContact O-N 3.08Å; L618-M621 PolarHBondContact O-N 2.98Å; L618-C622 WeakPolarHBondContact O-CB 3.33Å; L618-C622 PolarHBondContact O-N 2.77Å; L618-C622 PolarHBondContact O-SG 2.98Å; L618-F634 HydrophobicContact CD2-CD2 3.67Å; L618-F634 HydrophobicContact CD2-CE2 4.09Å; L618-F634 HydrophobicContact CG-CD2 4.15Å; L618-A637 HydrophobicContact CD1-CB 4.4Å; L618-A637 HydrophobicContact CD2-CB 3.44Å; L618-A637 VanDerWaalsContact CD2-CB 3.44Å; L618-F638 HydrophobicContact CD2-CE2 4.24Å
619	I	78.5	Confident	73.1	Confident	17 Å²	17	65.7 Å²	65.7	9%	0.087	36%	0.361	C	S	.	.	H	α-helix	trans	-62.3	-40.8	176.3	-67.9	165.3	0	0	0	110.7	F599 F600 V610 V615 K616 E617 M621 C622 S623 I629 F634	F599-I619 HydrophobicContact CE1-CD1 3.94Å; F599-I619 HydrophobicContact CE1-CG1 3.9Å; F599-I619 HydrophobicContact CZ-CG1 4.21Å; F600-I619 HydrophobicContact CE1-CD1 4.23Å; F600-I619 HydrophobicContact CZ-CG2 4.41Å; V610-I619 HydrophobicContact CG1-CD1 3.94Å; V615-I619 HydrophobicContact CG1-CD1 4.05Å; V615-I619 VanDerWaalsContact O-CG1 3.25Å; V615-I619 WeakPolarHBondContact O-CG1 3.21Å; V615-I619 PolarHBondContact O-N 2.78Å; K616-I619 PolarHBondContact O-N 2.94Å; E617-I619 PolarHBondContact O-N 2.7Å; I619-M621 VanDerWaalsContact C-N 3.35Å; I619-M621 PolarHBondContact O-N 3.18Å; I619-C622 PolarHBondContact O-N 3.41Å; I619-S623 WeakPolarHBondContact O-CB 3.43Å; I619-S623 PolarHBondContact O-N 3.38Å; I619-S623 VanDerWaalsContact O-N 3.14Å; I619-I629 HydrophobicContact CG2-CD1 4.27Å; I619-F634 HydrophobicContact CD1-CE2 4.36Å; I619-F634 HydrophobicContact CG1-CD2 4.24Å; I619-F634 HydrophobicContact CG1-CE2 3.85Å
620	R	79.4	Confident	73.7	Confident	157 Å²	157	64 Å²	64	59%	0.592	35%	0.348	S	S	*	.	H	α-helix	trans	-59.9	-44.5	175.5	-176.1	-176.1	70.1	88.2	-5.6	111.5	K616 E617 L618 C622 S623	K616-R620 WeakPolarHBondContact O-CB 3.35Å; K616-R620 PolarHBondContact O-N 3.04Å; E617-R620 WeakPolarHBondContact O-CB 3.48Å; E617-R620 PolarHBondContact O-N 3.38Å; E617-R620 IonicContact OE1-CZ 3.81Å; E617-R620 IonicContact OE1-NE 3.72Å; E617-R620 IonicContact OE1-NH2 2.84Å; E617-R620 PolarHBondContact OE1-NH2 3.49Å; L618-R620 VanDerWaalsContact C-N 3.32Å; L618-R620 PolarHBondContact O-N 3.08Å; R620-C622 VanDerWaalsContact C-N 3.34Å; R620-S623 PolarHBondContact O-N 3.3Å
621	M	74.8	Confident	74.2	Confident	45 Å²	45	62.8 Å²	62.8	22%	0.222	34%	0.341	C	S	.	.	H	α-helix	trans	-72.6	-26	179.8	-64.5	-175.2	87.7	0	0	113.1	E558 L559 L562 E617 L618 I619	E558-M621 HydrophobicContact CB-CE 4.23Å; L559-M621 HydrophobicContact CB-CE 3.91Å; L559-M621 HydrophobicContact CD1-CB 3.87Å; L559-M621 HydrophobicContact CD1-CE 4.28Å; L559-M621 HydrophobicContact CD1-SD 4Å; L562-M621 HydrophobicContact CD2-SD 3.85Å; E617-M621 WeakPolarHBondContact O-CG 3.34Å; E617-M621 PolarHBondContact O-N 3.18Å; L618-M621 PolarHBondContact O-N 2.98Å; I619-M621 VanDerWaalsContact C-N 3.35Å; I619-M621 PolarHBondContact O-N 3.18Å
622	C	74.7	Confident	74.7	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.014	33%	0.328	C	S	.	.	H	α-helix	trans	-86.9	-4.7	177.3	-62.4	0	0	0	0	113.9	L618 I619 R620 I629 N630	L618-C622 WeakPolarHBondContact O-CB 3.33Å; L618-C622 PolarHBondContact O-N 2.77Å; L618-C622 PolarHBondContact O-SG 2.98Å; I619-C622 PolarHBondContact O-N 3.41Å; R620-C622 VanDerWaalsContact C-N 3.34Å; C622-I629 HydrophobicContact CB-CG2 4.29Å; C622-N630 PolarHBondContact O-N 3.22Å; C622-N630 VanDerWaalsContact O-N 3.13Å
623	S	77.9	Confident	74.5	Confident	48 Å²	48	61.6 Å²	61.6	34%	0.336	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-95.7	105.2	-179	175.7	0	0	0	0	111	I619 R620	I619-S623 WeakPolarHBondContact O-CB 3.43Å; I619-S623 PolarHBondContact O-N 3.38Å; I619-S623 VanDerWaalsContact O-N 3.14Å; R620-S623 PolarHBondContact O-N 3.3Å
624	H	65.8	Low	74.5	Confident	126 Å²	126	57.4 Å²	57.4	58%	0.583	30%	0.297	S	S	*	.			trans	-97.5	91.4	173.7	-71.6	-63.9	0	0	0	110.9	E626	H624-E626 PolarHBondContact O-N 3.33Å
625	G	59.8	Low	74.7	Confident	83 Å²	83	56 Å²	56	86%	0.856	29%	0.29	S	S	*	.	S	Bend	trans	61.1	-20.9	153.6	0	0	0	0	0	121.5
626	E	60.1	Low	74.7	Confident	165 Å²	165	62.4 Å²	62.4	77%	0.771	31%	0.314	S	S	*	.	S	Bend	trans	-124.4	21.6	-164	-63.3	-168.7	163	0	0	114.2	H624 K628	H624-E626 PolarHBondContact O-N 3.33Å; E626-K628 PolarHBondContact O-N 3.21Å; E626-K628 VanDerWaalsContact O-N 3.13Å
627	G	68.4	Low	74.4	Confident	41 Å²	41	57.8 Å²	57.8	42%	0.423	30%	0.295	S	S	.	.	S	Bend	trans	70.4	5.6	-179	0	0	0	0	0	114.5	R596	R596-G627 WeakPolarHBondContact CB-O 3.49Å; R596-G627 PolarHBondContact N-O 3.33Å
628	K	76.9	Confident	74.1	Confident	102 Å²	102	55.2 Å²	55.2	44%	0.443	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140.3	172.7	-66	-178.5	178.8	-178.2	0	110.3	E626	E626-K628 PolarHBondContact O-N 3.21Å; E626-K628 VanDerWaalsContact O-N 3.13Å
629	I	79.9	Confident	73.4	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.8	-178.8	-61.8	175	0	0	0	108.6	Y593 V594 R596 F599 I619 C622 Y631	Y593-I629 WeakPolarHBondContact CA-O 3.47Å; V594-I629 PolarHBondContact N-O 3.31Å; V594-I629 PolarHBondContact O-N 3.48Å; R596-I629 HydrophobicContact CB-CD1 4.35Å; R596-I629 HydrophobicContact CG-CD1 4.23Å; F599-I629 HydrophobicContact CB-CD1 3.92Å; F599-I629 HydrophobicContact CD1-CD1 3.59Å; F599-I629 HydrophobicContact CD2-CB 4.2Å; F599-I629 HydrophobicContact CD2-CD1 4.32Å; F599-I629 HydrophobicContact CD2-CG2 3.89Å; F599-I629 HydrophobicContact CE1-CD1 4.18Å; F599-I629 HydrophobicContact CE2-CG2 3.84Å; F599-I629 HydrophobicContact CG-CB 4.36Å; F599-I629 HydrophobicContact CG-CD1 3.67Å; F599-I629 HydrophobicContact CG-CG2 4.32Å; F599-I629 HydrophobicContact CZ-CG2 4.22Å; I619-I629 HydrophobicContact CG2-CD1 4.27Å; C622-I629 HydrophobicContact CB-CG2 4.29Å; I629-Y631 PolarHBondContact O-N 2.84Å
630	N	80.7	Confident	72.3	Confident	23 Å²	23	64.9 Å²	64.9	12%	0.123	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	107.5	171.4	-175.8	-26.8	0	0	0	108.9	Y593 C622 Y632	Y593-N630 HydrophobicContact CD1-CB 4.01Å; Y593-N630 HydrophobicContact CE1-CB 3.72Å; C622-N630 PolarHBondContact O-N 3.22Å; C622-N630 VanDerWaalsContact O-N 3.13Å; N630-Y632 WeakPolarHBondContact OD1-CB 3.33Å; N630-Y632 PolarHBondContact OD1-N 3.34Å
631	Y	79.1	Confident	71.9	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-83.9	-9.8	-175.9	70.8	-94.1	0	0	0	113.1	F583 D587 G592 V594 I629 F634 V635	F583-Y631 HydrophobicContact CB-CD2 3.62Å; F583-Y631 HydrophobicContact CB-CE2 3.77Å; F583-Y631 HydrophobicContact CB-CG 4.04Å; F583-Y631 HydrophobicContact CD1-CG 4.24Å; F583-Y631 HydrophobicContact CD2-CD2 4.46Å; F583-Y631 HydrophobicContact CG-CD2 4.01Å; F583-Y631 HydrophobicContact CG-CG 4.11Å; D587-Y631 HydrophobicContact CB-CE1 4.14Å; D587-Y631 WeakPolarHBondContact OD2-CE1 3.47Å; D587-Y631 PolarHBondContact OD2-OH 3.25Å; G592-Y631 VanDerWaalsContact C-CD1 3.47Å; G592-Y631 VanDerWaalsContact CA-CE1 3.43Å; G592-Y631 VanDerWaalsContact O-CD1 3.25Å; G592-Y631 WeakPolarHBondContact O-CD1 3.27Å; G592-Y631 WeakPolarHBondContact O-CE1 3.43Å; G592-Y631 PolarHBondContact O-N 3.32Å; V594-Y631 HydrophobicContact CG2-CD1 3.69Å; V594-Y631 HydrophobicContact CG2-CE1 3.96Å; I629-Y631 PolarHBondContact O-N 2.84Å; Y631-F634 PolarHBondContact O-N 3.15Å; Y631-V635 HydrophobicContact CD2-CG2 3.89Å; Y631-V635 WeakPolarHBondContact O-CB 3.39Å; Y631-V635 VanDerWaalsContact O-CG2 3.22Å; Y631-V635 WeakPolarHBondContact O-CG2 3.43Å; Y631-V635 PolarHBondContact O-N 3.32Å
632	Y	78.1	Confident	71.8	Confident	115 Å²	115	61.1 Å²	61.1	45%	0.451	33%	0.331	S	S	.	.	H	α-helix	trans	-64.9	-46.3	-179.5	-82.7	-71	0	0	0	112.4	N630 F634 V635 R636	N630-Y632 WeakPolarHBondContact OD1-CB 3.33Å; N630-Y632 PolarHBondContact OD1-N 3.34Å; Y632-F634 VanDerWaalsContact C-N 3.31Å; Y632-V635 PolarHBondContact O-N 2.77Å; Y632-R636 WeakPolarHBondContact O-CB 3.16Å; Y632-R636 PolarHBondContact O-N 2.92Å
633	N	72.4	Confident	71.6	Confident	50 Å²	50	64.4 Å²	64.4	27%	0.267	35%	0.348	S	S	.	.	H	α-helix	trans	-68.9	-33.8	177.1	-70.7	-25.2	0	0	0	111.5	R636 A637	N633-R636 PolarHBondContact O-N 2.72Å; N633-A637 PolarHBondContact O-N 3.28Å
634	F	77.1	Confident	71.2	Confident	1 Å²	1	65.4 Å²	65.4	0%	0.004	35%	0.349	C	S	.	.	H	α-helix	trans	-65.4	-50.4	174.1	-173.7	-98.1	0	0	0	111.6	F583 F599 V608 V615 L618 I619 Y631 Y632 R636 A637 F638	F583-F634 HydrophobicContact CE2-CD1 4.26Å; F583-F634 HydrophobicContact CE2-CE1 4.34Å; F583-F634 HydrophobicContact CZ-CD1 4.48Å; F583-F634 HydrophobicContact CZ-CE1 4.46Å; F599-F634 HydrophobicContact CE1-CE2 4.45Å; F599-F634 HydrophobicContact CE1-CZ 4.4Å; F599-F634 HydrophobicContact CE2-CB 4.46Å; F599-F634 AromaticContact CE2-CD1 3.81Å; F599-F634 HydrophobicContact CE2-CD1 3.81Å; F599-F634 HydrophobicContact CE2-CD2 4.46Å; F599-F634 HydrophobicContact CE2-CE1 4.11Å; F599-F634 AromaticContact CE2-CG 3.99Å; F599-F634 HydrophobicContact CE2-CG 3.99Å; F599-F634 AromaticContact CZ-CD1 3.7Å; F599-F634 HydrophobicContact CZ-CD1 3.7Å; F599-F634 AromaticContact CZ-CD2 3.76Å; F599-F634 HydrophobicContact CZ-CD2 3.76Å; F599-F634 AromaticContact CZ-CE1 3.67Å; F599-F634 HydrophobicContact CZ-CE1 3.67Å; F599-F634 AromaticContact CZ-CE2 3.74Å; F599-F634 HydrophobicContact CZ-CE2 3.74Å; F599-F634 AromaticContact CZ-CG 3.73Å; F599-F634 HydrophobicContact CZ-CG 3.73Å; F599-F634 AromaticContact CZ-CZ 3.69Å; F599-F634 HydrophobicContact CZ-CZ 3.69Å; V608-F634 HydrophobicContact CG1-CZ 4.33Å; V615-F634 HydrophobicContact CG1-CE2 4.07Å; V615-F634 HydrophobicContact CG1-CZ 4.42Å; L618-F634 HydrophobicContact CD2-CD2 3.67Å; L618-F634 HydrophobicContact CD2-CE2 4.09Å; L618-F634 HydrophobicContact CG-CD2 4.15Å; I619-F634 HydrophobicContact CD1-CE2 4.36Å; I619-F634 HydrophobicContact CG1-CD2 4.24Å; I619-F634 HydrophobicContact CG1-CE2 3.85Å; Y631-F634 PolarHBondContact O-N 3.15Å; Y632-F634 VanDerWaalsContact C-N 3.31Å; F634-R636 VanDerWaalsContact C-N 3.26Å; F634-R636 PolarHBondContact O-N 2.79Å; F634-A637 WeakPolarHBondContact O-CB 3.45Å; F634-A637 PolarHBondContact O-N 3.17Å; F634-F638 HydrophobicContact CD1-CD2 4.42Å; F634-F638 HydrophobicContact CD1-CE2 4.4Å; F634-F638 HydrophobicContact CD2-CE2 4.25Å; F634-F638 HydrophobicContact CE1-CD2 4.16Å; F634-F638 AromaticContact CE1-CE2 3.91Å; F634-F638 HydrophobicContact CE1-CE2 3.91Å; F634-F638 AromaticContact CE2-CE2 3.74Å; F634-F638 HydrophobicContact CE2-CE2 3.74Å; F634-F638 HydrophobicContact CZ-CD2 4.27Å; F634-F638 AromaticContact CZ-CE2 3.55Å; F634-F638 HydrophobicContact CZ-CE2 3.55Å; F634-F638 HydrophobicContact CZ-CZ 4.25Å; F634-F638 VanDerWaalsContact O-CD2 3.32Å; F634-F638 WeakPolarHBondContact O-CD2 3.46Å
635	V	77.2	Confident	71.6	Confident	11 Å²	11	61.6 Å²	61.6	7%	0.067	34%	0.335	C	S	.	.	H	α-helix	trans	-59.3	-37.8	175.8	169.6	0	0	0	0	111.1	I579 R580 F583 Y631 Y632 A637 F638 S639	I579-V635 HydrophobicContact CG2-CG2 4.26Å; R580-V635 HydrophobicContact CB-CG1 3.94Å; R580-V635 HydrophobicContact CG-CG1 4.17Å; F583-V635 HydrophobicContact CD2-CG2 3.94Å; F583-V635 HydrophobicContact CE2-CG2 4.49Å; Y631-V635 HydrophobicContact CD2-CG2 3.89Å; Y631-V635 WeakPolarHBondContact O-CB 3.39Å; Y631-V635 VanDerWaalsContact O-CG2 3.22Å; Y631-V635 WeakPolarHBondContact O-CG2 3.43Å; Y631-V635 PolarHBondContact O-N 3.32Å; Y632-V635 PolarHBondContact O-N 2.77Å; V635-A637 VanDerWaalsContact C-N 3.26Å; V635-A637 PolarHBondContact O-N 3.28Å; V635-F638 CarbonylContact O-C 3.58Å; V635-F638 PolarHBondContact O-N 3.16Å; V635-F638 VanDerWaalsContact O-N 3.1Å; V635-S639 VanDerWaalsContact CG1-OG 3.31Å; V635-S639 WeakPolarHBondContact CG1-OG 3.48Å; V635-S639 VanDerWaalsContact O-CB 3.29Å; V635-S639 WeakPolarHBondContact O-CB 3.43Å; V635-S639 PolarHBondContact O-N 3.25Å; V635-S639 PolarHBondContact O-OG 3.28Å
636	R	74.8	Confident	72.3	Confident	133 Å²	133	60.1 Å²	60.1	50%	0.502	30%	0.3	S	S	.	.	H	α-helix	trans	-60.5	-32.9	175.6	-172	178	177.8	-164.5	-4.2	112.8	Q567 Y632 N633 F634 F638 S639	Q567-R636 PolarHBondContact NE2-O 3.26Å; Y632-R636 WeakPolarHBondContact O-CB 3.16Å; Y632-R636 PolarHBondContact O-N 2.92Å; N633-R636 PolarHBondContact O-N 2.72Å; F634-R636 VanDerWaalsContact C-N 3.26Å; F634-R636 PolarHBondContact O-N 2.79Å; R636-F638 VanDerWaalsContact C-N 3.26Å; R636-F638 PolarHBondContact O-N 3.11Å; R636-S639 VanDerWaalsContact O-O 3.1Å
637	A	70.4	Confident	73.2	Confident	2 Å²	2	52.6 Å²	52.6	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-70.1	-22.4	176.5	0	0	0	0	0	113.8	I563 I566 Q567 L618 N633 F634 V635	I563-A637 HydrophobicContact CG1-CB 4.25Å; I563-A637 HydrophobicContact CG2-CB 4.47Å; I566-A637 HydrophobicContact CG2-CB 4.05Å; Q567-A637 VanDerWaalsContact CG-O 3.25Å; Q567-A637 WeakPolarHBondContact CG-O 2.96Å; L618-A637 HydrophobicContact CD1-CB 4.4Å; L618-A637 HydrophobicContact CD2-CB 3.44Å; L618-A637 VanDerWaalsContact CD2-CB 3.44Å; N633-A637 PolarHBondContact O-N 3.28Å; F634-A637 WeakPolarHBondContact O-CB 3.45Å; F634-A637 PolarHBondContact O-N 3.17Å; V635-A637 VanDerWaalsContact C-N 3.26Å; V635-A637 PolarHBondContact O-N 3.28Å
638	F	71.3	Confident	73.6	Confident	32 Å²	32	53.5 Å²	53.5	14%	0.14	25%	0.254	C	S	.	.	H	α-helix	trans	-108.6	-9.1	179.5	-64.9	-87.2	0	0	0	113.7	L570 I579 V608 V615 L618 F634 V635 R636	L570-F638 HydrophobicContact CD1-CD1 4.2Å; L570-F638 HydrophobicContact CD1-CE1 3.57Å; L570-F638 HydrophobicContact CD1-CZ 4.23Å; I579-F638 HydrophobicContact CD1-CB 3.9Å; I579-F638 HydrophobicContact CD1-CD1 4.48Å; I579-F638 HydrophobicContact CD1-CG 4.21Å; V608-F638 HydrophobicContact CG1-CE1 4.31Å; V608-F638 HydrophobicContact CG1-CZ 4.05Å; V615-F638 HydrophobicContact CG1-CZ 4.48Å; V615-F638 HydrophobicContact CG2-CZ 4.15Å; L618-F638 HydrophobicContact CD2-CE2 4.24Å; F634-F638 HydrophobicContact CD1-CD2 4.42Å; F634-F638 HydrophobicContact CD1-CE2 4.4Å; F634-F638 HydrophobicContact CD2-CE2 4.25Å; F634-F638 HydrophobicContact CE1-CD2 4.16Å; F634-F638 AromaticContact CE1-CE2 3.91Å; F634-F638 HydrophobicContact CE1-CE2 3.91Å; F634-F638 AromaticContact CE2-CE2 3.74Å; F634-F638 HydrophobicContact CE2-CE2 3.74Å; F634-F638 HydrophobicContact CZ-CD2 4.27Å; F634-F638 AromaticContact CZ-CE2 3.55Å; F634-F638 HydrophobicContact CZ-CE2 3.55Å; F634-F638 HydrophobicContact CZ-CZ 4.25Å; F634-F638 VanDerWaalsContact O-CD2 3.32Å; F634-F638 WeakPolarHBondContact O-CD2 3.46Å; V635-F638 CarbonylContact O-C 3.58Å; V635-F638 PolarHBondContact O-N 3.16Å; V635-F638 VanDerWaalsContact O-N 3.1Å; R636-F638 VanDerWaalsContact C-N 3.26Å; R636-F638 PolarHBondContact O-N 3.11Å
639	S	64.8	Low	73.3	Confident	50 Å²	50	49.5 Å²	49.5	35%	0.35	24%	0.238	S	C	.	.			trans	-97.8	117.3	175.5	-52.9	0	0	0	0	109	Q567 V635 R636	Q567-S639 PolarHBondContact NE2-O 3.28Å; Q567-S639 VanDerWaalsContact NE2-O 3.17Å; V635-S639 VanDerWaalsContact CG1-OG 3.31Å; V635-S639 WeakPolarHBondContact CG1-OG 3.48Å; V635-S639 VanDerWaalsContact O-CB 3.29Å; V635-S639 WeakPolarHBondContact O-CB 3.43Å; V635-S639 PolarHBondContact O-N 3.25Å; V635-S639 PolarHBondContact O-OG 3.28Å; R636-S639 VanDerWaalsContact O-O 3.1Å
640	N	54	Low	72.7	Confident	170 Å²	170	53.7 Å²	53.7	91%	0.909	26%	0.259	S	S	*	.			trans	-84	0	170.4	-100.8	1.1	0	0	0	111.2

Retrieved 640 of 640 residues in 694.2 ms (Link to these results)

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