A0A087XEJ8_POEFO Loading...

Integrin beta

AlphaFold DB , UniProt , Accession A0A087XEJ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 792 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	35.6	Very low	38.9	Very low	240 Å²	240	166.5 Å²	166.5	100%	1.182	88%	0.876	S	S	*	*				0	94.9	0	-65.6	174	-153.6	0	0	105.5
2	A	34.4	Very low	38.6	Very low	104 Å²	104	167.9 Å²	167.9	86%	0.86	88%	0.879	S	S	*	*				64.9	129.6	95.4	0	0	0	0	0	110.9
3	A	33.3	Very low	38.6	Very low	101 Å²	101	164.3 Å²	164.3	84%	0.835	87%	0.874	S	S	*	*			cis	-165.7	159.5	-2.6	0	0	0	0	0	107.2
4	L	39.8	Very low	38.6	Very low	140 Å²	140	162 Å²	162	73%	0.733	87%	0.869	S	S	*	*			trans	-56.8	168.1	164.1	-91.4	146.6	0	0	0	112.3	T6	L4-T6 HydrophobicContact CD2-CG2 3.47Å; L4-T6 VanDerWaalsContact CD2-CG2 3.47Å
5	P	49.1	Very low	38.5	Very low	117 Å²	117	164.4 Å²	164.4	76%	0.76	87%	0.869	S	S	*	*			cis	-142.9	145.8	46.1	32.6	-9	0	0	0	116.7
6	T	47	Very low	38.4	Very low	108 Å²	108	162.1 Å²	162.1	66%	0.663	86%	0.863	S	S	*	*				47.9	85.3	76.8	47.1	0	0	0	0	116.9	L4	L4-T6 HydrophobicContact CD2-CG2 3.47Å; L4-T6 VanDerWaalsContact CD2-CG2 3.47Å
7	L	40.2	Very low	38.4	Very low	162 Å²	162	165.5 Å²	165.5	85%	0.848	87%	0.869	S	S	*	*			trans	-166.9	142.8	140.8	-128.6	76.9	0	0	0	105.1
8	W	37.2	Very low	38.1	Very low	256 Å²	256	161.1 Å²	161.1	97%	0.97	86%	0.86	S	S	*	*			trans	114	43.4	-178.7	-71.9	63.6	0	0	0	116.9
9	L	36.1	Very low	37.8	Very low	175 Å²	175	156.4 Å²	156.4	92%	0.916	85%	0.854	S	S	*	*	S	Bend	trans	-135.6	17.3	169.4	-105.8	156.1	0	0	0	115.4
10	L	38.1	Very low	37.4	Very low	172 Å²	172	159.3 Å²	159.3	90%	0.901	86%	0.858	S	S	*	*	S	Bend	trans	-122.7	15.8	-176.8	-106.6	141.4	0	0	0	115.6
11	W	37.2	Very low	37.2	Very low	256 Å²	256	159 Å²	159	97%	0.97	86%	0.855	S	S	*	*	S	Bend	trans	-130.7	39.5	179.1	-120.6	43.3	0	0	0	113.6
12	M	35.1	Very low	36.9	Very low	184 Å²	184	152.1 Å²	152.1	91%	0.906	84%	0.835	S	S	*	*	S	Bend	trans	-138.4	35.6	175.6	-89.5	-74.3	-106.7	0	0	112.3
13	C	38.2	Very low	36.9	Very low	121 Å²	121	151.5 Å²	151.5	82%	0.818	83%	0.83	S	S	*	*	S	Bend	trans	-135.2	14.8	176.7	-88.7	0	0	0	0	115.5
14	V	39.6	Very low	37.3	Very low	132 Å²	132	151 Å²	151	80%	0.8	82%	0.821	S	S	*	*	S	Bend	trans	-127	6.9	179.1	-172.5	0	0	0	0	114.3
15	F	37.2	Very low	37.8	Very low	198 Å²	198	147 Å²	147	87%	0.868	81%	0.813	S	S	*	*	S	Bend	trans	-124.3	44.4	177.1	-92.7	-77.6	0	0	0	114.4
16	T	36.2	Very low	38.4	Very low	128 Å²	128	146 Å²	146	79%	0.785	81%	0.809	S	S	*	*			trans	-126.2	39.4	166.5	49.6	0	0	0	0	112.3
17	F	39.1	Very low	39.9	Very low	220 Å²	220	142.3 Å²	142.3	97%	0.965	79%	0.785	S	S	*	*			trans	-135.4	64.8	161.2	-116.3	-92.2	0	0	0	109.3
18	A	32.7	Very low	41.7	Very low	85 Å²	85	136.9 Å²	136.9	70%	0.702	76%	0.759	S	S	*	*	S	Bend	trans	-128.4	130.1	164	0	0	0	0	0	107.9
19	G	32.8	Very low	43.7	Very low	72 Å²	72	124.8 Å²	124.8	74%	0.742	71%	0.713	S	S	*	*			trans	-53.8	135.6	-154.6	0	0	0	0	0	116.8	I21	G19-I21 PolarHBondContact O-N 3.29Å
20	K	28.7	Very low	45.7	Very low	214 Å²	214	118.6 Å²	118.6	93%	0.93	68%	0.683	S	S	*	*			trans	-69.2	82.6	147.3	-72.4	-169.5	178.4	-175	0	107.9	A22	K20-A22 VanDerWaalsContact C-N 3.3Å; K20-A22 PolarHBondContact O-N 3.02Å; K20-A22 VanDerWaalsContact O-N 3.13Å
21	I	32.9	Very low	47	Very low	155 Å²	155	114 Å²	114	80%	0.795	67%	0.665	S	S	*	*			trans	-71	100.2	154.2	-63.1	174.9	0	0	0	104.6	G19 A23	G19-I21 PolarHBondContact O-N 3.29Å; I21-A23 VanDerWaalsContact C-N 3.29Å; I21-A23 PolarHBondContact O-N 3.06Å
22	A	30.5	Very low	48.2	Very low	94 Å²	94	108.3 Å²	108.3	78%	0.777	64%	0.643	S	S	*	*			trans	-63.7	97.4	165.2	0	0	0	0	0	106.8	K20 S24	K20-A22 VanDerWaalsContact C-N 3.3Å; K20-A22 PolarHBondContact O-N 3.02Å; K20-A22 VanDerWaalsContact O-N 3.13Å; A22-S24 PolarHBondContact O-N 3.18Å
23	A	33.3	Very low	49.6	Very low	91 Å²	91	102.7 Å²	102.7	75%	0.752	63%	0.632	S	S	*	*			trans	-59.8	107.2	163.9	0	0	0	0	0	106.8	I21 G25	I21-A23 VanDerWaalsContact C-N 3.29Å; I21-A23 PolarHBondContact O-N 3.06Å; A23-G25 PolarHBondContact O-N 3.41Å
24	S	43.2	Very low	51.1	Low	90 Å²	90	97.7 Å²	97.7	63%	0.629	60%	0.6	S	S	*	*			trans	-61.7	106.9	174.6	-163.7	0	0	0	0	107.7	A22	A22-S24 PolarHBondContact O-N 3.18Å
25	G	48.5	Very low	52.8	Low	56 Å²	56	94.4 Å²	94.4	58%	0.577	58%	0.583	S	S	*	*			trans	-63.5	141	178	0	0	0	0	0	110.8	A23 N27	A23-G25 PolarHBondContact O-N 3.41Å; G25-N27 PolarHBondContact O-N 3.05Å
26	S	62.9	Low	55.1	Low	96 Å²	96	86.1 Å²	86.1	67%	0.671	55%	0.549	S	S	*	.			trans	-57	130.2	171.4	-173.8	0	0	0	0	109.9
27	N	79.1	Confident	57.6	Low	32 Å²	32	80.1 Å²	80.1	17%	0.171	51%	0.512	C	S	.	.			trans	-123.6	176.9	176.9	67.8	68.3	0	0	0	110.8	G25 C29 T30 S31 D66 N70	G25-N27 PolarHBondContact O-N 3.05Å; N27-C29 PolarHBondContact O-N 2.7Å; N27-C29 VanDerWaalsContact OD1-CB 3.24Å; N27-C29 WeakPolarHBondContact OD1-CB 2.97Å; N27-C29 PolarHBondContact OD1-N 3.25Å; N27-T30 PolarHBondContact N-OG1 2.99Å; N27-T30 PolarHBondContact O-N 3.06Å; N27-T30 VanDerWaalsContact O-N 3.07Å; N27-T30 PolarHBondContact O-OG1 3.49Å; N27-T30 VanDerWaalsContact O-OG1 3.1Å; N27-S31 WeakPolarHBondContact O-CB 3.5Å; N27-S31 PolarHBondContact O-N 3.36Å; N27-S31 PolarHBondContact O-OG 3.46Å; N27-S31 VanDerWaalsContact O-OG 3.04Å; N27-D66 PolarHBondContact ND2-OD1 3.26Å; N27-N70 PolarHBondContact ND2-ND2 2.93Å
28	V	77.3	Confident	59.8	Low	48 Å²	48	73.9 Å²	73.9	29%	0.291	48%	0.484	S	S	.	.	H	α-helix	trans	-54.2	-30.8	-176.1	69	0	0	0	0	114	V43 H44	V28-V43 HydrophobicContact CG2-CG1 4.3Å; V28-V43 VanDerWaalsContact O-CG1 3.23Å; V28-V43 WeakPolarHBondContact O-CG1 3.44Å; V28-H44 HydrophobicContact CG1-CB 3.97Å; V28-H44 HydrophobicContact CG2-CB 4.24Å
29	C	80.1	Confident	62.2	Low	1 Å²	1	74.1 Å²	74.1	1%	0.007	47%	0.471	C	S	.	.	H	α-helix	trans	-78.5	-35.8	-179.3	-54.3	0	0	0	0	112.4	N27 C47	N27-C29 PolarHBondContact O-N 2.7Å; N27-C29 VanDerWaalsContact OD1-CB 3.24Å; N27-C29 WeakPolarHBondContact OD1-CB 2.97Å; N27-C29 PolarHBondContact OD1-N 3.25Å; C29-C47 WeakPolarHBondContact CA-SG 3.33Å; C29-C47 HydrophobicContact CB-CB 3.83Å; C29-C47 WeakPolarHBondContact CB-SG 3.41Å; C29-C47 WeakPolarHBondContact SG-CA 3.39Å; C29-C47 WeakPolarHBondContact SG-CB 3.47Å; C29-C47 CovalentContact SG-SG 2.03Å; C29-C47 PolarHBondContact SG-SG 3.16Å
30	T	77.1	Confident	64.8	Low	45 Å²	45	70.7 Å²	70.7	28%	0.276	44%	0.435	S	S	.	.	H	α-helix	trans	-88.8	-22.8	-178.2	59.2	0	0	0	0	112.8	N27 D66	N27-T30 PolarHBondContact N-OG1 2.99Å; N27-T30 PolarHBondContact O-N 3.06Å; N27-T30 VanDerWaalsContact O-N 3.07Å; N27-T30 PolarHBondContact O-OG1 3.49Å; N27-T30 VanDerWaalsContact O-OG1 3.1Å; T30-D66 HydrophobicContact CG2-CB 4.13Å
31	S	64.4	Low	67.5	Low	75 Å²	75	60.6 Å²	60.6	52%	0.524	39%	0.392	S	S	.	.	H	α-helix	trans	-85.1	-18.1	-175.3	65.1	0	0	0	0	114.9	N27	N27-S31 WeakPolarHBondContact O-CB 3.5Å; N27-S31 PolarHBondContact O-N 3.36Å; N27-S31 PolarHBondContact O-OG 3.46Å; N27-S31 VanDerWaalsContact O-OG 3.04Å
32	R	62.8	Low	69.8	Low	137 Å²	137	55.3 Å²	55.3	52%	0.517	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	9.3	-176.8	-66.4	-159.4	-178	171.1	-6.8	115.1	A34 V43	R32-A34 PolarHBondContact O-N 2.91Å; R32-V43 HydrophobicContact CB-CG1 4.22Å; R32-V43 HydrophobicContact CB-CG2 4.06Å; R32-V43 HydrophobicContact CG-CG1 4.35Å; R32-V43 PolarHBondContact NH1-O 3.01Å
33	G	64.2	Low	72.2	Confident	66 Å²	66	51.6 Å²	51.6	68%	0.68	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	34.3	169.8	0	0	0	0	0	115.4	S35	G33-S35 PolarHBondContact O-N 3.26Å
34	A	71.2	Confident	74.5	Confident	17 Å²	17	51.1 Å²	51.1	14%	0.14	32%	0.321	C	S	.	.			trans	-66.3	116.5	-178.2	0	0	0	0	0	111.3	R32 Q39 C40 V43 C65	R32-A34 PolarHBondContact O-N 2.91Å; A34-Q39 HydrophobicContact CB-CB 4.14Å; A34-C40 HydrophobicContact CB-CB 4.09Å; A34-V43 HydrophobicContact CB-CG2 4.02Å; A34-C65 HydrophobicContact CB-CB 4.37Å
35	S	75.4	Confident	76.5	Confident	63 Å²	63	48.3 Å²	48.3	44%	0.441	30%	0.3	S	S	.	.			trans	-90.2	-23.1	-174.3	65.8	0	0	0	0	113.6	G33 Q39 M486	G33-S35 PolarHBondContact O-N 3.26Å; S35-Q39 PolarHBondContact OG-OE1 3.43Å; S35-M486 WeakPolarHBondContact O-CE 3.41Å
36	T	84.9	Confident	78.3	Confident	24 Å²	24	47.9 Å²	47.9	15%	0.147	29%	0.289	C	S	.	.	S	Bend	trans	-125.4	160.5	-178.3	63.2	0	0	0	0	111.6	K38 Q39 C40 L488	T36-K38 VanDerWaalsContact C-N 3.28Å; T36-K38 PolarHBondContact O-N 3.49Å; T36-Q39 PolarHBondContact O-N 3.23Å; T36-Q39 WeakPolarHBondContact OG1-CB 3.45Å; T36-Q39 VanDerWaalsContact OG1-CG 3.3Å; T36-Q39 WeakPolarHBondContact OG1-CG 3.45Å; T36-Q39 PolarHBondContact OG1-N 2.88Å; T36-C40 PolarHBondContact O-N 3.44Å; T36-L488 HydrophobicContact CG2-CD2 3.87Å
37	C	87.7	Confident	79.6	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-55.5	-44.3	176.3	-174.8	0	0	0	0	112.1	Q39 C40 L41 W49 C462 C484	C37-Q39 PolarHBondContact O-N 3.16Å; C37-C40 WeakPolarHBondContact O-CB 3.4Å; C37-C40 PolarHBondContact O-N 3.12Å; C37-L41 WeakPolarHBondContact O-CG 3.32Å; C37-L41 PolarHBondContact O-N 3.38Å; C37-W49 HydrophobicContact CB-CB 4.27Å; C37-W49 HydrophobicContact CB-CD2 3.87Å; C37-W49 HydrophobicContact CB-CG 3.67Å; C37-W49 VanDerWaalsContact SG-CB 3.52Å; C37-C462 HydrophobicContact CB-CB 3.96Å; C37-C462 WeakPolarHBondContact CB-SG 3.46Å; C37-C462 WeakPolarHBondContact SG-CB 3.48Å; C37-C462 CovalentContact SG-SG 2.02Å; C37-C462 PolarHBondContact SG-SG 2.83Å; C37-C484 HydrophobicContact CB-CB 3.96Å
38	K	86.3	Confident	80.2	Confident	89 Å²	89	41.8 Å²	41.8	39%	0.387	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-45.4	178.1	-179.6	168.3	-177.5	155.1	0	112.6	T36 C40 L41 A42 D461	T36-K38 VanDerWaalsContact C-N 3.28Å; T36-K38 PolarHBondContact O-N 3.49Å; K38-C40 VanDerWaalsContact C-N 3.31Å; K38-C40 PolarHBondContact O-N 2.7Å; K38-L41 PolarHBondContact O-N 2.79Å; K38-A42 PolarHBondContact O-N 3.07Å; K38-D461 WeakPolarHBondContact CE-OD1 3.42Å; K38-D461 IonicContact NZ-OD1 2.77Å; K38-D461 PolarHBondContact NZ-OD1 3Å
39	Q	83.1	Confident	80.9	Confident	90 Å²	90	39.9 Å²	39.9	42%	0.421	24%	0.236	S	C	.	.	H	α-helix	trans	-62.4	-41.3	175.3	-73.8	172.9	-3.3	0	0	111	A34 S35 T36 C37 L41 A42 V43	A34-Q39 HydrophobicContact CB-CB 4.14Å; S35-Q39 PolarHBondContact OG-OE1 3.43Å; T36-Q39 PolarHBondContact O-N 3.23Å; T36-Q39 WeakPolarHBondContact OG1-CB 3.45Å; T36-Q39 VanDerWaalsContact OG1-CG 3.3Å; T36-Q39 WeakPolarHBondContact OG1-CG 3.45Å; T36-Q39 PolarHBondContact OG1-N 2.88Å; C37-Q39 PolarHBondContact O-N 3.16Å; Q39-L41 PolarHBondContact O-N 3.11Å; Q39-A42 PolarHBondContact O-N 3.43Å; Q39-V43 WeakPolarHBondContact O-CG2 3.5Å; Q39-V43 PolarHBondContact O-N 3.41Å; Q39-V43 VanDerWaalsContact O-N 3.16Å
40	C	86.6	Confident	81.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-45.7	178.7	178.9	0	0	0	0	112.2	A34 T36 C37 K38 A42 V43 C47 A48 W49 C65	A34-C40 HydrophobicContact CB-CB 4.09Å; T36-C40 PolarHBondContact O-N 3.44Å; C37-C40 WeakPolarHBondContact O-CB 3.4Å; C37-C40 PolarHBondContact O-N 3.12Å; K38-C40 VanDerWaalsContact C-N 3.31Å; K38-C40 PolarHBondContact O-N 2.7Å; C40-A42 VanDerWaalsContact C-N 3.25Å; C40-A42 PolarHBondContact O-N 3.37Å; C40-V43 PolarHBondContact O-N 3.22Å; C40-C47 WeakPolarHBondContact O-CB 3.17Å; C40-A48 PolarHBondContact SG-O 2.89Å; C40-W49 HydrophobicContact CB-CE3 3.77Å; C40-W49 HydrophobicContact CB-CZ3 4.4Å; C40-C65 WeakPolarHBondContact CA-SG 3.25Å; C40-C65 HydrophobicContact CB-CB 3.64Å; C40-C65 WeakPolarHBondContact CB-SG 3.4Å; C40-C65 WeakPolarHBondContact SG-CA 3.22Å; C40-C65 WeakPolarHBondContact SG-CB 3.34Å; C40-C65 CovalentContact SG-SG 2.03Å; C40-C65 PolarHBondContact SG-SG 3.28Å
41	L	86.6	Confident	82.1	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-67.9	-27.9	179.7	-64.1	-172.6	0	0	0	112.9	C37 K38 Q39 P84 R120 C462	C37-L41 WeakPolarHBondContact O-CG 3.32Å; C37-L41 PolarHBondContact O-N 3.38Å; K38-L41 PolarHBondContact O-N 2.79Å; Q39-L41 PolarHBondContact O-N 3.11Å; L41-P84 HydrophobicContact CD1-CG 3.73Å; L41-R120 PolarHBondContact O-NE 3.49Å; L41-R120 PolarHBondContact O-NH2 3.38Å; L41-C462 HydrophobicContact CD1-CB 4.49Å; L41-C462 WeakPolarHBondContact CD1-SG 3.42Å
42	A	81.3	Confident	83.2	Confident	45 Å²	45	38.1 Å²	38.1	37%	0.372	22%	0.216	S	C	.	.	H	α-helix	trans	-78.9	-13.5	175.9	0	0	0	0	0	114.3	K38 Q39 C40	K38-A42 PolarHBondContact O-N 3.07Å; Q39-A42 PolarHBondContact O-N 3.43Å; C40-A42 VanDerWaalsContact C-N 3.25Å; C40-A42 PolarHBondContact O-N 3.37Å
43	V	80.5	Confident	84	Confident	15 Å²	15	36.4 Å²	36.4	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-67.4	-50.2	-178.8	160.2	0	0	0	0	112.3	V28 R32 A34 Q39 C40	V28-V43 HydrophobicContact CG2-CG1 4.3Å; V28-V43 VanDerWaalsContact O-CG1 3.23Å; V28-V43 WeakPolarHBondContact O-CG1 3.44Å; R32-V43 HydrophobicContact CB-CG1 4.22Å; R32-V43 HydrophobicContact CB-CG2 4.06Å; R32-V43 HydrophobicContact CG-CG1 4.35Å; R32-V43 PolarHBondContact NH1-O 3.01Å; A34-V43 HydrophobicContact CB-CG2 4.02Å; Q39-V43 WeakPolarHBondContact O-CG2 3.5Å; Q39-V43 PolarHBondContact O-N 3.41Å; Q39-V43 VanDerWaalsContact O-N 3.16Å; C40-V43 PolarHBondContact O-N 3.22Å
44	H	81.8	Confident	84.6	Confident	81 Å²	81	38 Å²	38	38%	0.375	21%	0.207	S	C	.	.			trans	-165.3	146.5	-179.8	-173.6	-99.2	0	0	0	110.1	V28 S46 C47 R120	V28-H44 HydrophobicContact CG1-CB 3.97Å; V28-H44 HydrophobicContact CG2-CB 4.24Å; H44-S46 WeakPolarHBondContact ND1-CB 3.47Å; H44-S46 PolarHBondContact ND1-N 2.93Å; H44-S46 PolarHBondContact ND1-OG 2.99Å; H44-S46 PolarHBondContact O-N 3.4Å; H44-C47 WeakPolarHBondContact O-CB 3.45Å; H44-C47 PolarHBondContact O-N 2.71Å; H44-C47 PolarHBondContact O-SG 3.33Å; H44-R120 PolarHBondContact O-NH2 2.95Å
45	P	84.4	Confident	84.9	Confident	31 Å²	31	37.7 Å²	37.7	20%	0.201	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.4	-179.6	-31.1	38.3	0	0	0	116.6	R120 D122 D123	P45-R120 VanDerWaalsContact C-CZ 3.5Å; P45-R120 PolarHBondContact O-NH1 3.13Å; P45-D122 VanDerWaalsContact CG-C 3.43Å; P45-D122 HydrophobicContact CG-CB 4.23Å; P45-D122 WeakPolarHBondContact CG-O 3.38Å; P45-D123 HydrophobicContact CB-CB 3.89Å; P45-D123 HydrophobicContact CG-CB 3.79Å
46	S	87.3	Confident	84.3	Confident	48 Å²	48	36.2 Å²	36.2	34%	0.336	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-12.1	178.4	67.6	0	0	0	0	114.2	H44 L67	H44-S46 WeakPolarHBondContact ND1-CB 3.47Å; H44-S46 PolarHBondContact ND1-N 2.93Å; H44-S46 PolarHBondContact ND1-OG 2.99Å; H44-S46 PolarHBondContact O-N 3.4Å; S46-L67 VanDerWaalsContact OG-CD2 3.27Å; S46-L67 WeakPolarHBondContact OG-CD2 3.3Å
47	C	89	Confident	82.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	147.5	-177.8	-55	0	0	0	0	111.3	C29 C40 H44 R120	C29-C47 WeakPolarHBondContact CA-SG 3.33Å; C29-C47 HydrophobicContact CB-CB 3.83Å; C29-C47 WeakPolarHBondContact CB-SG 3.41Å; C29-C47 WeakPolarHBondContact SG-CA 3.39Å; C29-C47 WeakPolarHBondContact SG-CB 3.47Å; C29-C47 CovalentContact SG-SG 2.03Å; C29-C47 PolarHBondContact SG-SG 3.16Å; C40-C47 WeakPolarHBondContact O-CB 3.17Å; H44-C47 WeakPolarHBondContact O-CB 3.45Å; H44-C47 PolarHBondContact O-N 2.71Å; H44-C47 PolarHBondContact O-SG 3.33Å; C47-R120 VanDerWaalsContact O-CZ 3.24Å; C47-R120 PolarHBondContact O-NH1 3.39Å; C47-R120 PolarHBondContact O-NH2 3.45Å
48	A	91.6	Very high	80.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	160.6	174.4	0	0	0	0	0	108.7	C40 D66 K68 L71 L81 E82	C40-A48 PolarHBondContact SG-O 2.89Å; A48-D66 PolarHBondContact N-O 3.27Å; A48-D66 PolarHBondContact O-N 2.91Å; A48-D66 VanDerWaalsContact O-N 3.13Å; A48-D66 VanDerWaalsContact O-O 3.05Å; A48-K68 HydrophobicContact CB-CB 4.11Å; A48-L71 HydrophobicContact CB-CD1 3.87Å; A48-L71 WeakPolarHBondContact O-CD1 3.42Å; A48-L81 HydrophobicContact CB-CD1 4.35Å; A48-L81 HydrophobicContact CB-CG 4.49Å; A48-E82 WeakPolarHBondContact CA-O 3.38Å
49	W	92	Very high	78.8	Confident	7 Å²	7	45.6 Å²	45.6	3%	0.027	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.9	178.9	178.5	-93.5	0	0	0	111.1	C37 C40 R64 C65 L81 E82 C484 M486	C37-W49 HydrophobicContact CB-CB 4.27Å; C37-W49 HydrophobicContact CB-CD2 3.87Å; C37-W49 HydrophobicContact CB-CG 3.67Å; C37-W49 VanDerWaalsContact SG-CB 3.52Å; C40-W49 HydrophobicContact CB-CE3 3.77Å; C40-W49 HydrophobicContact CB-CZ3 4.4Å; W49-R64 CarbonylContact C-O 3.51Å; W49-R64 VanDerWaalsContact CA-O 3.31Å; W49-R64 WeakPolarHBondContact CA-O 3.41Å; W49-R64 HydrophobicContact CD2-CB 4.11Å; W49-R64 HydrophobicContact CE3-CB 3.91Å; W49-R64 HydrophobicContact CH2-CB 3.51Å; W49-R64 HydrophobicContact CH2-CG 4.41Å; W49-R64 HydrophobicContact CZ2-CB 3.67Å; W49-R64 HydrophobicContact CZ2-CG 4.35Å; W49-R64 HydrophobicContact CZ3-CB 3.62Å; W49-C65 HydrophobicContact CE3-CB 3.84Å; W49-C65 HydrophobicContact CZ3-CB 4Å; W49-L81 WeakPolarHBondContact O-CA 3.35Å; W49-E82 HydrophobicContact CB-CB 4.19Å; W49-E82 PolarHBondContact N-O 3.47Å; W49-E82 PolarHBondContact O-N 3.47Å; W49-C484 PolarHBondContact NE1-O 2.58Å; W49-M486 HydrophobicContact CH2-SD 3.74Å; W49-M486 HydrophobicContact CZ2-CG 4.31Å; W49-M486 HydrophobicContact CZ2-SD 3.63Å
50	C	91.8	Very high	76.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.5	172	-168.4	0	0	0	0	111	F55 R64 L71 C76 G80	C50-F55 HydrophobicContact CB-CD1 3.86Å; C50-F55 HydrophobicContact CB-CD2 4.46Å; C50-F55 HydrophobicContact CB-CE1 3.96Å; C50-F55 HydrophobicContact CB-CG 4.11Å; C50-F55 HydrophobicContact CB-CZ 4.31Å; C50-F55 VanDerWaalsContact SG-CD2 3.6Å; C50-F55 WeakPolarHBondContact SG-CG 3.26Å; C50-R64 PolarHBondContact N-O 3.03Å; C50-R64 PolarHBondContact O-NH1 3.49Å; C50-L71 HydrophobicContact CB-CD1 4.23Å; C50-L71 HydrophobicContact CB-CD2 4.18Å; C50-C76 HydrophobicContact CB-CB 3.93Å; C50-C76 WeakPolarHBondContact CB-SG 3.46Å; C50-C76 WeakPolarHBondContact SG-CB 3.45Å; C50-C76 CovalentContact SG-SG 2.04Å; C50-C76 PolarHBondContact SG-SG 3.01Å; C50-G80 CarbonylContact C-O 3.57Å; C50-G80 WeakPolarHBondContact CA-O 3.46Å
51	F	90.6	Very high	75.2	Confident	56 Å²	56	51.8 Å²	51.8	25%	0.246	33%	0.329	C	S	.	.			trans	-100.3	6.6	178.7	67.9	-93.2	0	0	0	114	S79 G80 E82 C464 C484 G485	F51-S79 WeakPolarHBondContact CZ-O 3.33Å; F51-G80 WeakPolarHBondContact CD1-O 3.24Å; F51-G80 WeakPolarHBondContact CE1-O 3.48Å; F51-G80 PolarHBondContact N-O 3.46Å; F51-E82 HydrophobicContact CD1-CG 3.69Å; F51-E82 HydrophobicContact CE1-CG 3.83Å; F51-C464 HydrophobicContact CD1-CB 4.23Å; F51-C464 HydrophobicContact CD2-CB 4.43Å; F51-C464 HydrophobicContact CG-CB 4.17Å; F51-C484 WeakPolarHBondContact CA-O 3.27Å; F51-C484 HydrophobicContact CB-CB 4.24Å; F51-C484 WeakPolarHBondContact CB-O 3.08Å; F51-G485 VanDerWaalsContact O-CA 3.3Å; F51-G485 WeakPolarHBondContact O-CA 3.41Å
52	Q	88.9	Confident	74.1	Confident	28 Å²	28	53.8 Å²	53.8	13%	0.131	34%	0.343	C	S	.	.			trans	-63.6	134.9	175.2	172.7	173.6	-16.8	0	0	111	D54 F55 R64	Q52-D54 WeakPolarHBondContact CG-OD1 3.28Å; Q52-D54 PolarHBondContact NE2-OD1 3.24Å; Q52-D54 PolarHBondContact NE2-OD2 3.38Å; Q52-F55 HydrophobicContact CB-CB 4.16Å; Q52-F55 HydrophobicContact CG-CB 4.36Å; Q52-F55 WeakPolarHBondContact O-CB 3.49Å; Q52-F55 PolarHBondContact O-N 3.33Å; Q52-R64 PolarHBondContact O-NH1 3.04Å
53	E	80	Confident	73.9	Confident	101 Å²	101	53.8 Å²	53.8	47%	0.472	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-46.6	-168	-52.1	-160.9	167.3	0	0	112.3	F55 R64 K474 Y482	E53-F55 PolarHBondContact O-N 3.34Å; E53-R64 PolarHBondContact O-NH2 3.3Å; E53-K474 IonicContact OE1-NZ 2.71Å; E53-K474 PolarHBondContact OE1-NZ 3.12Å; E53-K474 IonicContact OE2-NZ 3.87Å; E53-K474 PolarHBondContact OE2-NZ 3.27Å; E53-Y482 WeakPolarHBondContact CG-OH 3.4Å; E53-Y482 PolarHBondContact OE1-OH 2.75Å
54	D	76.6	Confident	74.2	Confident	100 Å²	100	55.4 Å²	55.4	54%	0.535	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-2.9	-179.4	60.8	-42.5	0	0	0	113.9	Q52 G56 H57	Q52-D54 WeakPolarHBondContact CG-OD1 3.28Å; Q52-D54 PolarHBondContact NE2-OD1 3.24Å; Q52-D54 PolarHBondContact NE2-OD2 3.38Å; D54-G56 PolarHBondContact O-N 2.84Å; D54-H57 PolarHBondContact O-N 2.82Å
55	F	76.7	Confident	74.5	Confident	10 Å²	10	51.6 Å²	51.6	4%	0.044	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	118.5	-179.8	-171.6	-101.7	0	0	0	111.5	C50 Q52 E53 R64 L71 A74 C76	C50-F55 HydrophobicContact CB-CD1 3.86Å; C50-F55 HydrophobicContact CB-CD2 4.46Å; C50-F55 HydrophobicContact CB-CE1 3.96Å; C50-F55 HydrophobicContact CB-CG 4.11Å; C50-F55 HydrophobicContact CB-CZ 4.31Å; C50-F55 VanDerWaalsContact SG-CD2 3.6Å; C50-F55 WeakPolarHBondContact SG-CG 3.26Å; Q52-F55 HydrophobicContact CB-CB 4.16Å; Q52-F55 HydrophobicContact CG-CB 4.36Å; Q52-F55 WeakPolarHBondContact O-CB 3.49Å; Q52-F55 PolarHBondContact O-N 3.33Å; E53-F55 PolarHBondContact O-N 3.34Å; F55-R64 HydrophobicContact CD1-CG 4.26Å; F55-R64 PolarHBondContact O-NH2 3.13Å; F55-L71 HydrophobicContact CE1-CD2 3.93Å; F55-L71 HydrophobicContact CZ-CD2 3.71Å; F55-A74 HydrophobicContact CE2-CB 3.84Å; F55-A74 HydrophobicContact CZ-CB 3.84Å; F55-C76 HydrophobicContact CD2-CB 3.76Å; F55-C76 HydrophobicContact CE2-CB 3.56Å; F55-C76 HydrophobicContact CZ-CB 4.3Å
56	G	62.7	Low	74.7	Confident	33 Å²	33	50.9 Å²	50.9	34%	0.34	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	3.2	179.5	0	0	0	0	0	115.8	D54 G58 S62	D54-G56 PolarHBondContact O-N 2.84Å; G56-G58 PolarHBondContact O-N 2.93Å; G56-G58 VanDerWaalsContact O-N 3.11Å; G56-S62 WeakPolarHBondContact CA-OG 3.42Å
57	H	53.9	Low	74.9	Confident	131 Å²	131	51.1 Å²	51.1	61%	0.606	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	100.1	169.3	-83.6	-84.8	0	0	0	110.6	D54 Y497	D54-H57 PolarHBondContact O-N 2.82Å; H57-Y497 PolarHBondContact NE2-OH 2.86Å
58	G	46.8	Very low	74.9	Confident	82 Å²	82	56.2 Å²	56.2	85%	0.845	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	123.4	-11.4	172.8	0	0	0	0	0	115.8	G56	G56-G58 PolarHBondContact O-N 2.93Å; G56-G58 VanDerWaalsContact O-N 3.11Å
59	V	43.7	Very low	74.9	Confident	98 Å²	98	64.5 Å²	64.5	59%	0.594	38%	0.377	S	S	*	.			trans	-124.8	105.1	172.1	-173.7	0	0	0	0	108.4	S61	V59-S61 PolarHBondContact O-N 2.83Å
60	A	41.6	Very low	74.8	Confident	112 Å²	112	66.1 Å²	66.1	93%	0.926	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	72	178.3	0	0	0	0	0	111.4
61	S	52.2	Low	74.6	Confident	107 Å²	107	66.2 Å²	66.2	75%	0.748	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	174.9	1.6	165.2	59.8	0	0	0	0	115.3	V59 S63	V59-S61 PolarHBondContact O-N 2.83Å; S61-S63 PolarHBondContact O-N 3.13Å
62	S	62.3	Low	74.5	Confident	45 Å²	45	67.8 Å²	67.8	32%	0.315	40%	0.396	S	S	.	.			trans	-76.8	110.5	-175.8	50	0	0	0	0	112	G56	G56-S62 WeakPolarHBondContact CA-OG 3.42Å
63	S	78.1	Confident	74.4	Confident	44 Å²	44	71.2 Å²	71.2	31%	0.308	42%	0.423	S	S	.	.			trans	-70.6	133.1	174.7	176.9	0	0	0	0	110.5	S61 C65	S61-S63 PolarHBondContact O-N 3.13Å; S63-C65 WeakPolarHBondContact CB-O 3.42Å; S63-C65 PolarHBondContact O-N 2.96Å; S63-C65 PolarHBondContact OG-N 2.67Å; S63-C65 VanDerWaalsContact OG-N 3.12Å; S63-C65 PolarHBondContact OG-O 3.23Å
64	R	85.7	Confident	74.6	Confident	50 Å²	50	69.2 Å²	69.2	19%	0.189	42%	0.424	C	S	.	.	S	Bend	trans	-65.9	-19	170.2	-69.5	-178	177.7	-78.7	-1.6	112.4	W49 C50 Q52 E53 F55 G485	W49-R64 CarbonylContact C-O 3.51Å; W49-R64 VanDerWaalsContact CA-O 3.31Å; W49-R64 WeakPolarHBondContact CA-O 3.41Å; W49-R64 HydrophobicContact CD2-CB 4.11Å; W49-R64 HydrophobicContact CE3-CB 3.91Å; W49-R64 HydrophobicContact CH2-CB 3.51Å; W49-R64 HydrophobicContact CH2-CG 4.41Å; W49-R64 HydrophobicContact CZ2-CB 3.67Å; W49-R64 HydrophobicContact CZ2-CG 4.35Å; W49-R64 HydrophobicContact CZ3-CB 3.62Å; C50-R64 PolarHBondContact N-O 3.03Å; C50-R64 PolarHBondContact O-NH1 3.49Å; Q52-R64 PolarHBondContact O-NH1 3.04Å; E53-R64 PolarHBondContact O-NH2 3.3Å; F55-R64 HydrophobicContact CD1-CG 4.26Å; F55-R64 PolarHBondContact O-NH2 3.13Å; R64-G485 PolarHBondContact NH2-O 3.28Å
65	C	88	Confident	75	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.007	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	112.4	172.5	-173.7	0	0	0	0	110.9	A34 C40 W49 S63	A34-C65 HydrophobicContact CB-CB 4.37Å; C40-C65 WeakPolarHBondContact CA-SG 3.25Å; C40-C65 HydrophobicContact CB-CB 3.64Å; C40-C65 WeakPolarHBondContact CB-SG 3.4Å; C40-C65 WeakPolarHBondContact SG-CA 3.22Å; C40-C65 WeakPolarHBondContact SG-CB 3.34Å; C40-C65 CovalentContact SG-SG 2.03Å; C40-C65 PolarHBondContact SG-SG 3.28Å; W49-C65 HydrophobicContact CE3-CB 3.84Å; W49-C65 HydrophobicContact CZ3-CB 4Å; S63-C65 WeakPolarHBondContact CB-O 3.42Å; S63-C65 PolarHBondContact O-N 2.96Å; S63-C65 PolarHBondContact OG-N 2.67Å; S63-C65 VanDerWaalsContact OG-N 3.12Å; S63-C65 PolarHBondContact OG-O 3.23Å
66	D	89.8	Confident	75.6	Confident	16 Å²	16	66.4 Å²	66.4	9%	0.086	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	178.7	176.9	-155.7	-17.8	0	0	0	110.4	N27 T30 A48 N70 L71	N27-D66 PolarHBondContact ND2-OD1 3.26Å; T30-D66 HydrophobicContact CG2-CB 4.13Å; A48-D66 PolarHBondContact N-O 3.27Å; A48-D66 PolarHBondContact O-N 2.91Å; A48-D66 VanDerWaalsContact O-N 3.13Å; A48-D66 VanDerWaalsContact O-O 3.05Å; D66-N70 HydrophobicContact CB-CB 4.29Å; D66-N70 PolarHBondContact OD1-ND2 2.76Å; D66-N70 VanDerWaalsContact OD2-CB 3.29Å; D66-N70 WeakPolarHBondContact OD2-CB 3.46Å; D66-N70 PolarHBondContact OD2-ND2 3.3Å; D66-L71 HydrophobicContact CB-CD2 3.7Å; D66-L71 HydrophobicContact CB-CG 3.92Å
67	L	90.4	Very high	76.9	Confident	53 Å²	53	70.4 Å²	70.4	28%	0.277	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	140.1	168.5	-59.4	177.7	0	0	0	109.9	S46 K69 N70 L71	S46-L67 VanDerWaalsContact OG-CD2 3.27Å; S46-L67 WeakPolarHBondContact OG-CD2 3.3Å; L67-K69 PolarHBondContact O-N 3.33Å; L67-N70 HydrophobicContact CB-CB 4.43Å; L67-N70 WeakPolarHBondContact O-CB 3.44Å; L67-N70 PolarHBondContact O-N 2.9Å; L67-L71 PolarHBondContact O-N 2.71Å; L67-L71 VanDerWaalsContact O-N 3.08Å
68	K	90.6	Very high	78.5	Confident	106 Å²	106	69.3 Å²	69.3	46%	0.461	44%	0.438	S	S	.	.	H	α-helix	trans	-48.4	-41.1	179.1	175.4	171.6	-179.2	177.3	0	113.6	A48 I72 L81	A48-K68 HydrophobicContact CB-CB 4.11Å; K68-I72 HydrophobicContact CG-CD1 3.91Å; K68-I72 WeakPolarHBondContact O-CD1 3.47Å; K68-I72 VanDerWaalsContact O-CG1 3.29Å; K68-I72 WeakPolarHBondContact O-CG1 3.36Å; K68-I72 PolarHBondContact O-N 2.93Å; K68-L81 HydrophobicContact CD-CD2 3.83Å; K68-L81 HydrophobicContact CG-CD2 3.79Å
69	K	90.2	Very high	80.4	Confident	175 Å²	175	69.2 Å²	69.2	76%	0.761	42%	0.424	S	S	*	.	H	α-helix	trans	-65.3	-40.3	179.4	-66.6	-176.7	-180	-179.4	0	112.1	L67 S73	L67-K69 PolarHBondContact O-N 3.33Å; K69-S73 WeakPolarHBondContact O-CB 3.46Å; K69-S73 PolarHBondContact O-N 2.94Å; K69-S73 PolarHBondContact O-OG 3.06Å
70	N	89.4	Confident	82.5	Confident	41 Å²	41	64.7 Å²	64.7	22%	0.219	40%	0.398	C	S	.	.	H	α-helix	trans	-67.7	-45.4	-179.9	-64.9	-0	0	0	0	110.6	N27 D66 L67 I72 S73 A74	N27-N70 PolarHBondContact ND2-ND2 2.93Å; D66-N70 HydrophobicContact CB-CB 4.29Å; D66-N70 PolarHBondContact OD1-ND2 2.76Å; D66-N70 VanDerWaalsContact OD2-CB 3.29Å; D66-N70 WeakPolarHBondContact OD2-CB 3.46Å; D66-N70 PolarHBondContact OD2-ND2 3.3Å; L67-N70 HydrophobicContact CB-CB 4.43Å; L67-N70 WeakPolarHBondContact O-CB 3.44Å; L67-N70 PolarHBondContact O-N 2.9Å; N70-I72 VanDerWaalsContact C-N 3.34Å; N70-I72 PolarHBondContact O-N 3.13Å; N70-S73 WeakPolarHBondContact CA-OG 3.45Å; N70-S73 PolarHBondContact O-N 3.37Å; N70-S73 PolarHBondContact O-OG 3.19Å; N70-A74 WeakPolarHBondContact O-CB 3.21Å; N70-A74 PolarHBondContact O-N 3.1Å
71	L	89	Confident	84.9	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-59	-43.9	177.2	-65.9	178.8	0	0	0	112.2	A48 C50 F55 D66 L67 A74 G75 C76 L81	A48-L71 HydrophobicContact CB-CD1 3.87Å; A48-L71 WeakPolarHBondContact O-CD1 3.42Å; C50-L71 HydrophobicContact CB-CD1 4.23Å; C50-L71 HydrophobicContact CB-CD2 4.18Å; F55-L71 HydrophobicContact CE1-CD2 3.93Å; F55-L71 HydrophobicContact CZ-CD2 3.71Å; D66-L71 HydrophobicContact CB-CD2 3.7Å; D66-L71 HydrophobicContact CB-CG 3.92Å; L67-L71 PolarHBondContact O-N 2.71Å; L67-L71 VanDerWaalsContact O-N 3.08Å; L71-A74 PolarHBondContact O-N 3.04Å; L71-G75 PolarHBondContact O-N 3.03Å; L71-C76 HydrophobicContact CB-CB 4.05Å; L71-C76 WeakPolarHBondContact O-CB 3.36Å; L71-C76 PolarHBondContact O-N 3.21Å; L71-L81 HydrophobicContact CB-CD1 3.99Å; L71-L81 HydrophobicContact CD1-CD1 3.79Å
72	I	88.6	Confident	86.8	Confident	88 Å²	88	56.3 Å²	56.3	45%	0.451	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-43.9	176.6	-66.5	167.6	0	0	0	110.6	K68 N70 A74 G75	K68-I72 HydrophobicContact CG-CD1 3.91Å; K68-I72 WeakPolarHBondContact O-CD1 3.47Å; K68-I72 VanDerWaalsContact O-CG1 3.29Å; K68-I72 WeakPolarHBondContact O-CG1 3.36Å; K68-I72 PolarHBondContact O-N 2.93Å; N70-I72 VanDerWaalsContact C-N 3.34Å; N70-I72 PolarHBondContact O-N 3.13Å; I72-A74 PolarHBondContact O-N 3.21Å; I72-G75 PolarHBondContact O-N 3.49Å
73	S	86.3	Confident	88.1	Confident	100 Å²	100	55.8 Å²	55.8	70%	0.699	33%	0.325	S	S	*	.	H	α-helix	trans	-64.9	-26	177	67.1	0	0	0	0	113.4	K69 N70 G75	K69-S73 WeakPolarHBondContact O-CB 3.46Å; K69-S73 PolarHBondContact O-N 2.94Å; K69-S73 PolarHBondContact O-OG 3.06Å; N70-S73 WeakPolarHBondContact CA-OG 3.45Å; N70-S73 PolarHBondContact O-N 3.37Å; N70-S73 PolarHBondContact O-OG 3.19Å; S73-G75 VanDerWaalsContact C-N 3.28Å
74	A	83.2	Confident	88.5	Confident	59 Å²	59	54.5 Å²	54.5	49%	0.488	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	0.6	175.6	0	0	0	0	0	113.3	F55 N70 L71 I72	F55-A74 HydrophobicContact CE2-CB 3.84Å; F55-A74 HydrophobicContact CZ-CB 3.84Å; N70-A74 WeakPolarHBondContact O-CB 3.21Å; N70-A74 PolarHBondContact O-N 3.1Å; L71-A74 PolarHBondContact O-N 3.04Å; I72-A74 PolarHBondContact O-N 3.21Å
75	G	86.6	Confident	88.7	Confident	47 Å²	47	56.1 Å²	56.1	49%	0.485	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	11.2	175.3	0	0	0	0	0	115.7	L71 I72 S73 E77	L71-G75 PolarHBondContact O-N 3.03Å; I72-G75 PolarHBondContact O-N 3.49Å; S73-G75 VanDerWaalsContact C-N 3.28Å; G75-E77 PolarHBondContact O-N 2.97Å
76	C	89.6	Confident	88.9	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.027	33%	0.332	C	S	.	.			trans	-73	122.5	173.4	-168.4	0	0	0	0	110.7	C50 F55 L71	C50-C76 HydrophobicContact CB-CB 3.93Å; C50-C76 WeakPolarHBondContact CB-SG 3.46Å; C50-C76 WeakPolarHBondContact SG-CB 3.45Å; C50-C76 CovalentContact SG-SG 2.04Å; C50-C76 PolarHBondContact SG-SG 3.01Å; F55-C76 HydrophobicContact CD2-CB 3.76Å; F55-C76 HydrophobicContact CE2-CB 3.56Å; F55-C76 HydrophobicContact CZ-CB 4.3Å; L71-C76 HydrophobicContact CB-CB 4.05Å; L71-C76 WeakPolarHBondContact O-CB 3.36Å; L71-C76 PolarHBondContact O-N 3.21Å
77	E	89.6	Confident	89.2	Confident	117 Å²	117	61 Å²	61	55%	0.547	35%	0.352	S	S	.	.			trans	-67.8	152.1	174.2	-67.7	-171.1	178	0	0	112.2	G75 S79 G80 L81	G75-E77 PolarHBondContact O-N 2.97Å; E77-S79 WeakPolarHBondContact CB-OG 3.32Å; E77-S79 PolarHBondContact O-N 2.72Å; E77-S79 PolarHBondContact OE2-OG 3Å; E77-G80 PolarHBondContact O-N 2.9Å; E77-L81 PolarHBondContact O-N 3.07Å
78	S	86.2	Confident	89.4	Confident	109 Å²	109	61.3 Å²	61.3	76%	0.762	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-61.8	-27.6	177.7	65.6	0	0	0	0	113.9
79	S	87.9	Confident	89.7	Confident	79 Å²	79	61.1 Å²	61.1	55%	0.552	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-70.3	-30.6	175.4	53.6	0	0	0	0	112.5	F51 E77	F51-S79 WeakPolarHBondContact CZ-O 3.33Å; E77-S79 WeakPolarHBondContact CB-OG 3.32Å; E77-S79 PolarHBondContact O-N 2.72Å; E77-S79 PolarHBondContact OE2-OG 3Å
80	G	88.2	Confident	90	Very high	4 Å²	4	56.7 Å²	56.7	4%	0.041	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-92.7	10.1	179.6	0	0	0	0	0	114.4	C50 F51 E77	C50-G80 CarbonylContact C-O 3.57Å; C50-G80 WeakPolarHBondContact CA-O 3.46Å; F51-G80 WeakPolarHBondContact CD1-O 3.24Å; F51-G80 WeakPolarHBondContact CE1-O 3.48Å; F51-G80 PolarHBondContact N-O 3.46Å; E77-G80 PolarHBondContact O-N 2.9Å
81	L	91.2	Very high	90.4	Very high	26 Å²	26	59.7 Å²	59.7	14%	0.136	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.1	-174.1	-167.1	101.5	0	0	0	112.3	A48 W49 K68 L71 E77	A48-L81 HydrophobicContact CB-CD1 4.35Å; A48-L81 HydrophobicContact CB-CG 4.49Å; W49-L81 WeakPolarHBondContact O-CA 3.35Å; K68-L81 HydrophobicContact CD-CD2 3.83Å; K68-L81 HydrophobicContact CG-CD2 3.79Å; L71-L81 HydrophobicContact CB-CD1 3.99Å; L71-L81 HydrophobicContact CD1-CD1 3.79Å; E77-L81 PolarHBondContact O-N 3.07Å
82	E	91.6	Very high	90.7	Very high	17 Å²	17	61.7 Å²	61.7	8%	0.079	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	109.8	168.9	-72.8	-73.5	-179.5	0	0	110.1	A48 W49 F51 C462 K463 C464	A48-E82 WeakPolarHBondContact CA-O 3.38Å; W49-E82 HydrophobicContact CB-CB 4.19Å; W49-E82 PolarHBondContact N-O 3.47Å; W49-E82 PolarHBondContact O-N 3.47Å; F51-E82 HydrophobicContact CD1-CG 3.69Å; F51-E82 HydrophobicContact CE1-CG 3.83Å; E82-C462 HydrophobicContact CB-CB 4.5Å; E82-C462 HydrophobicContact CG-CB 4.08Å; E82-K463 WeakPolarHBondContact OE1-CA 3.49Å; E82-K463 VanDerWaalsContact OE1-CB 3.3Å; E82-K463 WeakPolarHBondContact OE1-CB 3.34Å; E82-K463 PolarHBondContact OE1-N 3.22Å; E82-K463 VanDerWaalsContact OE1-N 3.1Å; E82-K463 PolarHBondContact OE2-N 3.34Å; E82-C464 HydrophobicContact CG-CB 4.42Å; E82-C464 PolarHBondContact OE1-N 2.88Å
83	S	89.6	Confident	91	Very high	34 Å²	34	61.7 Å²	61.7	24%	0.238	37%	0.367	C	S	.	.			trans	-150	72.7	179.5	-168.3	0	0	0	0	109.9
84	P	88	Confident	91.3	Very high	16 Å²	16	61.3 Å²	61.3	10%	0.104	35%	0.35	C	S	.	.			trans	-63.1	144.3	174.8	27.2	-32.6	0	0	0	109.9	L41 E459	L41-P84 HydrophobicContact CD1-CG 3.73Å; P84-E459 HydrophobicContact CB-CG 4.38Å
85	T	88.6	Confident	91.8	Very high	84 Å²	84	63.2 Å²	63.2	52%	0.515	36%	0.357	S	S	.	.			trans	-120.4	134.9	179.2	46.7	0	0	0	0	108.6
86	S	93.2	Very high	92	Very high	5 Å²	5	62.1 Å²	62.1	4%	0.035	34%	0.34	C	S	.	.			trans	-64.7	142.6	176.7	-58.5	0	0	0	0	110.3	T118 R120 D123 K125	S86-T118 CarbonylContact C-O 3.54Å; S86-T118 WeakPolarHBondContact CA-O 3.49Å; S86-T118 WeakPolarHBondContact CB-O 3.49Å; S86-R120 PolarHBondContact OG-N 3.3Å; S86-D123 WeakPolarHBondContact CB-OD2 3.42Å; S86-D123 WeakPolarHBondContact OG-CB 3.41Å; S86-D123 VanDerWaalsContact OG-CG 3.28Å; S86-D123 PolarHBondContact OG-OD2 3.05Å; S86-K125 WeakPolarHBondContact O-CE 3.41Å; S86-K125 PolarHBondContact O-NZ 3.39Å
87	K	94.6	Very high	91.9	Very high	114 Å²	114	63.3 Å²	63.3	50%	0.496	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.9	-175	-67.6	174.6	-173.3	176.4	0	110.8	I117 T118	K87-I117 WeakPolarHBondContact O-CA 3.32Å; K87-T118 PolarHBondContact N-O 2.95Å; K87-T118 PolarHBondContact O-N 3.37Å
88	L	95.7	Very high	91.4	Very high	61 Å²	61	63.4 Å²	63.4	32%	0.319	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.7	171.7	172.8	67.8	0	0	0	107.7	L115 I117 F127	L88-L115 HydrophobicContact CD1-CB 4.44Å; L88-L115 HydrophobicContact CD1-CD1 4.31Å; L88-L115 HydrophobicContact CD1-CD2 4.18Å; L88-I117 HydrophobicContact CD1-CD1 4.19Å; L88-I117 HydrophobicContact CD1-CG1 3.74Å; L88-F127 HydrophobicContact CD1-CB 4.33Å; L88-F127 HydrophobicContact CD2-CB 3.74Å
89	Q	96.7	Very high	90.9	Very high	101 Å²	101	64.5 Å²	64.5	47%	0.472	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.8	175.1	-66.6	177.7	-12.2	0	0	109	I91 H116	Q89-I91 HydrophobicContact CB-CD1 4.43Å; Q89-H116 HydrophobicContact CB-CB 4.32Å; Q89-H116 PolarHBondContact N-O 3.03Å; Q89-H116 PolarHBondContact O-N 3.35Å
90	V	96.6	Very high	89.9	Confident	83 Å²	83	61.7 Å²	61.7	50%	0.503	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117	174.7	-174.1	0	0	0	0	107.8	D93 P112 L115	V90-D93 HydrophobicContact CG1-CB 3.65Å; V90-P112 HydrophobicContact CG1-CB 3.96Å; V90-L115 HydrophobicContact CB-CD2 4.08Å; V90-L115 HydrophobicContact CG1-CD2 4.07Å; V90-L115 HydrophobicContact CG2-CD2 3.75Å
91	I	97.1	Very high	88.3	Confident	104 Å²	104	65.1 Å²	65.1	53%	0.533	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-38.6	-176	-55.6	-61.1	0	0	0	110.5	Q89 K114 H116	Q89-I91 HydrophobicContact CB-CD1 4.43Å; I91-K114 HydrophobicContact CB-CB 3.86Å; I91-K114 HydrophobicContact CG2-CB 4.24Å; I91-K114 PolarHBondContact N-O 3.5Å; I91-H116 HydrophobicContact CD1-CB 3.94Å; I91-H116 HydrophobicContact CG1-CB 3.89Å
92	E	95.8	Very high	86.4	Confident	44 Å²	44	66.7 Å²	66.7	21%	0.206	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	121.9	179.4	-164.3	-173.7	141.1	0	0	109.5	R94 P112 Q113 K114	E92-R94 HydrophobicContact CG-CG 4.42Å; E92-R94 IonicContact OE1-CZ 2.79Å; E92-R94 IonicContact OE1-NE 3.2Å; E92-R94 PolarHBondContact OE1-NE 3.41Å; E92-R94 IonicContact OE1-NH2 3.08Å; E92-R94 PolarHBondContact OE1-NH2 3.13Å; E92-P112 VanDerWaalsContact O-CB 3.31Å; E92-P112 WeakPolarHBondContact O-CB 3.42Å; E92-Q113 HydrophobicContact CB-CB 4.35Å; E92-Q113 HydrophobicContact CG-CB 4.28Å; E92-Q113 PolarHBondContact O-N 3.48Å; E92-Q113 PolarHBondContact O-OE1 2.93Å; E92-K114 HydrophobicContact CB-CB 3.76Å; E92-K114 HydrophobicContact CB-CD 4.32Å; E92-K114 HydrophobicContact CB-CG 4.04Å; E92-K114 PolarHBondContact N-O 3.05Å; E92-K114 PolarHBondContact O-N 2.86Å; E92-K114 WeakPolarHBondContact OE2-CD 3.46Å; E92-K114 WeakPolarHBondContact OE2-CE 3.48Å; E92-K114 IonicContact OE2-NZ 2.87Å; E92-K114 PolarHBondContact OE2-NZ 3.33Å
93	D	94.6	Very high	84.2	Confident	87 Å²	87	70.1 Å²	70.1	47%	0.465	41%	0.407	S	S	.	.			trans	-139.8	66.3	-179.5	-172.8	27.3	0	0	0	111.5	V90 P112	V90-D93 HydrophobicContact CG1-CB 3.65Å; D93-P112 HydrophobicContact CB-CB 4.08Å
94	R	93.6	Very high	82.3	Confident	93 Å²	93	75.5 Å²	75.5	35%	0.351	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-66	138.3	171.9	-65.2	-174.7	-80.1	175.8	-2.1	110	E92 D106 T108 K111 Q113	E92-R94 HydrophobicContact CG-CG 4.42Å; E92-R94 IonicContact OE1-CZ 2.79Å; E92-R94 IonicContact OE1-NE 3.2Å; E92-R94 PolarHBondContact OE1-NE 3.41Å; E92-R94 IonicContact OE1-NH2 3.08Å; E92-R94 PolarHBondContact OE1-NH2 3.13Å; R94-D106 IonicContact CZ-OD2 2.86Å; R94-D106 IonicContact NH1-OD2 3.68Å; R94-D106 PolarHBondContact NH1-OD2 3.49Å; R94-T108 HydrophobicContact CB-CG2 4.2Å; R94-K111 WeakPolarHBondContact O-CB 3.28Å; R94-Q113 PolarHBondContact O-NE2 2.94Å
95	P	92.8	Very high	80.6	Confident	98 Å²	98	83.1 Å²	83.1	64%	0.636	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-67.1	151.9	-179.7	28.8	-34.9	0	0	0	111.6	T108	P95-T108 WeakPolarHBondContact O-CB 3.33Å
96	L	91.4	Very high	79.7	Confident	25 Å²	25	83.9 Å²	83.9	13%	0.131	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-67.8	134.3	176	-63.1	170.6	0	0	0	110.2	T108 Q109 K111 K130 R132 T421	L96-T108 WeakPolarHBondContact CA-O 3.33Å; L96-Q109 VanDerWaalsContact CD2-C 3.41Å; L96-Q109 WeakPolarHBondContact CD2-O 3.34Å; L96-K111 HydrophobicContact CD1-CD 4.42Å; L96-K111 HydrophobicContact CD1-CG 4.22Å; L96-K111 HydrophobicContact CD2-CB 4.15Å; L96-K111 HydrophobicContact CD2-CG 4.02Å; L96-K111 HydrophobicContact CG-CB 4.41Å; L96-K111 HydrophobicContact CG-CD 3.96Å; L96-K111 HydrophobicContact CG-CG 3.86Å; L96-K130 HydrophobicContact CD1-CB 4.09Å; L96-R132 HydrophobicContact CB-CB 4.37Å; L96-R132 HydrophobicContact CD1-CB 3.85Å; L96-R132 HydrophobicContact CD2-CB 4.36Å; L96-R132 HydrophobicContact CG-CB 4.41Å; L96-T421 HydrophobicContact CD1-CG2 3.85Å
97	S	87.1	Confident	79.2	Confident	28 Å²	28	85 Å²	85	20%	0.196	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-71.7	154.7	177.4	-55.9	0	0	0	0	111.4	T108 R132	S97-T108 PolarHBondContact N-O 2.9Å; S97-T108 PolarHBondContact OG-N 3.1Å; S97-R132 VanDerWaalsContact O-CD 3.23Å; S97-R132 WeakPolarHBondContact O-CD 3.39Å; S97-R132 PolarHBondContact O-NH1 3.28Å
98	N	79.1	Confident	78.9	Confident	119 Å²	119	80 Å²	80	64%	0.636	46%	0.459	S	S	*	.	S	Bend	trans	-95.1	-46.3	174.8	-68	-30.6	0	0	0	111.7	R132	N98-R132 PolarHBondContact OD1-NH1 3.02Å
99	K	74.9	Confident	78.6	Confident	133 Å²	133	77.1 Å²	77.1	58%	0.578	44%	0.444	S	S	*	.	B	Isolated β-bridge	trans	-134.4	154.4	177.1	-71	-168	173.2	-170.5	0	110.6	E135	K99-E135 WeakPolarHBondContact CE-OE2 3.39Å; K99-E135 HydrophobicContact CG-CB 4.29Å; K99-E135 IonicContact NZ-OE2 3.85Å
100	A	68.2	Low	78.4	Confident	19 Å²	19	72.3 Å²	72.3	16%	0.157	42%	0.422	C	S	.	.			trans	-89.6	1.8	175.4	0	0	0	0	0	114.3	G102 V107 V134 E135 D136 Y137	A100-G102 PolarHBondContact O-N 3.43Å; A100-V107 HydrophobicContact CB-CG2 3.75Å; A100-V134 HydrophobicContact CB-CG1 4.15Å; A100-E135 PolarHBondContact N-O 3.41Å; A100-D136 WeakPolarHBondContact CB-O 3.42Å; A100-Y137 HydrophobicContact CB-CD2 4.41Å
101	A	53.3	Low	78.3	Confident	77 Å²	77	71 Å²	71	64%	0.636	41%	0.409	S	S	*	.			trans	-77.4	106.3	-174.7	0	0	0	0	0	113.2
102	G	51.9	Low	78.3	Confident	58 Å²	58	66.7 Å²	66.7	60%	0.598	39%	0.388	S	S	*	.	S	Bend	trans	151.9	134.5	175.7	0	0	0	0	0	110.1	A100 T104	A100-G102 PolarHBondContact O-N 3.43Å; G102-T104 PolarHBondContact O-N 3.34Å
103	A	46.1	Very low	78.3	Confident	89 Å²	89	65 Å²	65	74%	0.736	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	110.5	-171.7	0	0	0	0	0	113.2	Q105	A103-Q105 VanDerWaalsContact C-N 3.28Å; A103-Q105 PolarHBondContact O-N 3.18Å
104	T	49.3	Very low	78.4	Confident	148 Å²	148	65.4 Å²	65.4	91%	0.908	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	30.3	156.5	51.8	0	0	0	0	117.5	G102	G102-T104 PolarHBondContact O-N 3.34Å
105	Q	52.8	Low	78.6	Confident	176 Å²	176	61.1 Å²	61.1	82%	0.822	36%	0.362	S	S	*	.			trans	-103.9	115.2	171.1	-74.9	-163.6	-13.7	0	0	111.5	A103 V107	A103-Q105 VanDerWaalsContact C-N 3.28Å; A103-Q105 PolarHBondContact O-N 3.18Å; Q105-V107 PolarHBondContact O-N 3.46Å
106	D	68.3	Low	78.9	Confident	100 Å²	100	58.4 Å²	58.4	54%	0.535	34%	0.34	S	S	.	.			trans	-7.9	85.2	173.8	-80.6	-14	0	0	0	116	R94 T108	R94-D106 IonicContact CZ-OD2 2.86Å; R94-D106 IonicContact NH1-OD2 3.68Å; R94-D106 PolarHBondContact NH1-OD2 3.49Å; D106-T108 PolarHBondContact O-N 3.49Å; D106-T108 PolarHBondContact O-OG1 3.29Å
107	V	82.9	Confident	79.1	Confident	29 Å²	29	57.2 Å²	57.2	18%	0.176	33%	0.334	C	S	.	.			trans	-61.7	123.2	164.9	-179.5	0	0	0	0	107.8	A100 Q105 Q109 V134 Y137 D450	A100-V107 HydrophobicContact CB-CG2 3.75Å; Q105-V107 PolarHBondContact O-N 3.46Å; V107-Q109 HydrophobicContact CG1-CG 4.05Å; V107-V134 HydrophobicContact CG1-CB 4.02Å; V107-V134 HydrophobicContact CG1-CG1 3.85Å; V107-V134 HydrophobicContact CG1-CG2 3.8Å; V107-Y137 HydrophobicContact CB-CE2 4.13Å; V107-Y137 HydrophobicContact CG1-CD2 4.04Å; V107-Y137 HydrophobicContact CG1-CE2 3.86Å; V107-D450 VanDerWaalsContact O-OD2 3.1Å
108	T	88.4	Confident	79.5	Confident	8 Å²	8	56.9 Å²	56.9	5%	0.049	33%	0.331	C	S	.	.			trans	-108.5	111.9	-179.7	-58.1	0	0	0	0	109.6	R94 P95 L96 S97 D106 I110 Q113 D450	R94-T108 HydrophobicContact CB-CG2 4.2Å; P95-T108 WeakPolarHBondContact O-CB 3.33Å; L96-T108 WeakPolarHBondContact CA-O 3.33Å; S97-T108 PolarHBondContact N-O 2.9Å; S97-T108 PolarHBondContact OG-N 3.1Å; D106-T108 PolarHBondContact O-N 3.49Å; D106-T108 PolarHBondContact O-OG1 3.29Å; T108-I110 VanDerWaalsContact CG2-O 3.27Å; T108-I110 WeakPolarHBondContact CG2-O 3.39Å; T108-Q113 VanDerWaalsContact CG2-NE2 3.34Å; T108-D450 VanDerWaalsContact CA-OD2 3.3Å; T108-D450 WeakPolarHBondContact CA-OD2 3.48Å
109	Q	89.5	Confident	80.1	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	30%	0.301	C	S	.	.			trans	-104.7	-17.4	-177.4	-62.5	-175.6	-62.1	0	0	113.2	L96 V107 V131 R132 V134 F448 D450	L96-Q109 VanDerWaalsContact CD2-C 3.41Å; L96-Q109 WeakPolarHBondContact CD2-O 3.34Å; V107-Q109 HydrophobicContact CG1-CG 4.05Å; Q109-V131 CarbonylContact O-C 3.43Å; Q109-V131 WeakPolarHBondContact O-CA 3.39Å; Q109-R132 PolarHBondContact O-N 2.92Å; Q109-V134 HydrophobicContact CG-CB 4.32Å; Q109-V134 HydrophobicContact CG-CG2 3.74Å; Q109-F448 HydrophobicContact CB-CD1 3.76Å; Q109-F448 HydrophobicContact CB-CE1 3.94Å; Q109-F448 VanDerWaalsContact CD-CD1 3.49Å; Q109-F448 VanDerWaalsContact CD-CE1 3.49Å; Q109-F448 HydrophobicContact CG-CD1 4.23Å; Q109-F448 HydrophobicContact CG-CE1 4.24Å; Q109-D450 PolarHBondContact N-OD2 2.9Å
110	I	93.3	Very high	80.8	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	143.1	175.4	-165.2	166.3	0	0	0	110.7	T108 Q113 V129 K130 V131 P445 D450 L452	T108-I110 VanDerWaalsContact CG2-O 3.27Å; T108-I110 WeakPolarHBondContact CG2-O 3.39Å; I110-Q113 PolarHBondContact O-NE2 3.5Å; I110-V129 HydrophobicContact CD1-CG1 3.63Å; I110-V129 HydrophobicContact CG1-CG1 3.64Å; I110-K130 WeakPolarHBondContact CA-O 3.43Å; I110-V131 HydrophobicContact CD1-CG2 4.41Å; I110-V131 HydrophobicContact CG1-CG2 4.23Å; I110-P445 HydrophobicContact CD1-CG 4.27Å; I110-D450 HydrophobicContact CB-CB 4.34Å; I110-D450 HydrophobicContact CG2-CB 3.54Å; I110-L452 HydrophobicContact CD1-CB 3.99Å
111	K	94.7	Very high	81.5	Confident	56 Å²	56	44.5 Å²	44.5	24%	0.243	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	147.3	166.8	74.5	167.8	-163.1	156.3	0	112.7	R94 L96 K130	R94-K111 WeakPolarHBondContact O-CB 3.28Å; L96-K111 HydrophobicContact CD1-CD 4.42Å; L96-K111 HydrophobicContact CD1-CG 4.22Å; L96-K111 HydrophobicContact CD2-CB 4.15Å; L96-K111 HydrophobicContact CD2-CG 4.02Å; L96-K111 HydrophobicContact CG-CB 4.41Å; L96-K111 HydrophobicContact CG-CD 3.96Å; L96-K111 HydrophobicContact CG-CG 3.86Å; K111-K130 HydrophobicContact CG-CB 4.01Å; K111-K130 PolarHBondContact N-O 3.48Å; K111-K130 PolarHBondContact O-N 3.29Å
112	P	96.6	Very high	82.7	Confident	12 Å²	12	44 Å²	44	8%	0.078	26%	0.256	C	S	.	.			cis	-68.8	170.6	-9.3	28.9	-32.8	0	0	0	112.1	V90 E92 D93 L115 T128 L452	V90-P112 HydrophobicContact CG1-CB 3.96Å; E92-P112 VanDerWaalsContact O-CB 3.31Å; E92-P112 WeakPolarHBondContact O-CB 3.42Å; D93-P112 HydrophobicContact CB-CB 4.08Å; P112-L115 HydrophobicContact CB-CD2 4.27Å; P112-L115 HydrophobicContact CG-CD1 4.07Å; P112-L115 HydrophobicContact CG-CD2 3.69Å; P112-L115 HydrophobicContact CG-CG 3.91Å; P112-T128 WeakPolarHBondContact CD-O 3.46Å; P112-L452 HydrophobicContact CG-CD1 4.27Å; P112-L452 WeakPolarHBondContact O-CD1 3.43Å
113	Q	95.2	Very high	84.4	Confident	10 Å²	10	43.1 Å²	43.1	5%	0.047	24%	0.237	C	C	.	.	S	Bend	trans	-99.9	-28.9	179.5	-56.7	76.4	34.2	0	0	112.4	E92 R94 T108 I110 L452 T453	E92-Q113 HydrophobicContact CB-CB 4.35Å; E92-Q113 HydrophobicContact CG-CB 4.28Å; E92-Q113 PolarHBondContact O-N 3.48Å; E92-Q113 PolarHBondContact O-OE1 2.93Å; R94-Q113 PolarHBondContact O-NE2 2.94Å; T108-Q113 VanDerWaalsContact CG2-NE2 3.34Å; I110-Q113 PolarHBondContact O-NE2 3.5Å; Q113-L452 WeakPolarHBondContact O-CA 3.46Å; Q113-T453 PolarHBondContact O-N 3.34Å
114	K	97.6	Very high	86.4	Confident	94 Å²	94	39.9 Å²	39.9	41%	0.409	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	130.5	177.1	-64.3	-175.7	-178.7	125.5	0	112.5	I91 E92 T453	I91-K114 HydrophobicContact CB-CB 3.86Å; I91-K114 HydrophobicContact CG2-CB 4.24Å; I91-K114 PolarHBondContact N-O 3.5Å; E92-K114 HydrophobicContact CB-CB 3.76Å; E92-K114 HydrophobicContact CB-CD 4.32Å; E92-K114 HydrophobicContact CB-CG 4.04Å; E92-K114 PolarHBondContact N-O 3.05Å; E92-K114 PolarHBondContact O-N 2.86Å; E92-K114 WeakPolarHBondContact OE2-CD 3.46Å; E92-K114 WeakPolarHBondContact OE2-CE 3.48Å; E92-K114 IonicContact OE2-NZ 2.87Å; E92-K114 PolarHBondContact OE2-NZ 3.33Å; K114-T453 WeakPolarHBondContact CA-O 3.49Å
115	L	97.4	Very high	88.6	Confident	4 Å²	4	36 Å²	36	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.4	175.5	-67.3	177.9	0	0	0	111.2	L88 V90 P112 F127 L452 T453 I454 T455	L88-L115 HydrophobicContact CD1-CB 4.44Å; L88-L115 HydrophobicContact CD1-CD1 4.31Å; L88-L115 HydrophobicContact CD1-CD2 4.18Å; V90-L115 HydrophobicContact CB-CD2 4.08Å; V90-L115 HydrophobicContact CG1-CD2 4.07Å; V90-L115 HydrophobicContact CG2-CD2 3.75Å; P112-L115 HydrophobicContact CB-CD2 4.27Å; P112-L115 HydrophobicContact CG-CD1 4.07Å; P112-L115 HydrophobicContact CG-CD2 3.69Å; P112-L115 HydrophobicContact CG-CG 3.91Å; L115-F127 HydrophobicContact CD1-CB 4.02Å; L115-F127 HydrophobicContact CD1-CD1 4.42Å; L115-F127 HydrophobicContact CD1-CD2 3.49Å; L115-F127 VanDerWaalsContact CD1-CD2 3.49Å; L115-F127 HydrophobicContact CD1-CE2 3.99Å; L115-F127 HydrophobicContact CD1-CG 3.73Å; L115-L452 HydrophobicContact CB-CD1 4.31Å; L115-L452 HydrophobicContact CD1-CD1 3.96Å; L115-L452 HydrophobicContact CD1-CD2 3.97Å; L115-L452 HydrophobicContact CG-CD1 3.73Å; L115-T453 PolarHBondContact N-O 2.96Å; L115-I454 HydrophobicContact CB-CG1 4.25Å; L115-I454 HydrophobicContact CB-CG2 4.3Å; L115-I454 HydrophobicContact CD1-CG1 4.42Å; L115-I454 WeakPolarHBondContact O-CA 3.2Å; L115-T455 PolarHBondContact O-N 3.24Å
116	H	97.9	Very high	90.6	Very high	40 Å²	40	35.5 Å²	35.5	19%	0.185	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.4	166.9	-172.6	68	0	0	0	109.7	Q89 I91 T455 T457	Q89-H116 HydrophobicContact CB-CB 4.32Å; Q89-H116 PolarHBondContact N-O 3.03Å; Q89-H116 PolarHBondContact O-N 3.35Å; I91-H116 HydrophobicContact CD1-CB 3.94Å; I91-H116 HydrophobicContact CG1-CB 3.89Å; H116-T455 WeakPolarHBondContact CA-O 3.42Å; H116-T455 PolarHBondContact ND1-O 3.47Å; H116-T457 PolarHBondContact CE1-OG1 3.27Å
117	I	96.1	Very high	91.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.6	-179.1	-44.9	-174.9	0	0	0	108.4	K87 L88 L119 K125 F127 A428 I454 T455 V456 T457	K87-I117 WeakPolarHBondContact O-CA 3.32Å; L88-I117 HydrophobicContact CD1-CD1 4.19Å; L88-I117 HydrophobicContact CD1-CG1 3.74Å; I117-L119 HydrophobicContact CG2-CD1 4.32Å; I117-L119 HydrophobicContact CG2-CD2 3.69Å; I117-L119 HydrophobicContact CG2-CG 3.73Å; I117-K125 HydrophobicContact CG2-CB 4.05Å; I117-K125 HydrophobicContact CG2-CG 4.31Å; I117-F127 HydrophobicContact CD1-CD1 3.8Å; I117-F127 HydrophobicContact CD1-CE1 3.63Å; I117-A428 HydrophobicContact CD1-CB 4.28Å; I117-I454 HydrophobicContact CD1-CG2 3.55Å; I117-I454 HydrophobicContact CG1-CG2 3.74Å; I117-T455 PolarHBondContact N-O 2.95Å; I117-V456 HydrophobicContact CB-CG2 4.44Å; I117-V456 CarbonylContact O-C 3.36Å; I117-V456 VanDerWaalsContact O-CA 3.28Å; I117-V456 WeakPolarHBondContact O-CA 3.4Å; I117-T457 PolarHBondContact O-N 3.43Å
118	T	95.1	Very high	92.5	Very high	21 Å²	21	33.2 Å²	33.2	13%	0.129	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.7	168.5	-46.9	0	0	0	0	107.7	S86 K87 T457 E459	S86-T118 CarbonylContact C-O 3.54Å; S86-T118 WeakPolarHBondContact CA-O 3.49Å; S86-T118 WeakPolarHBondContact CB-O 3.49Å; K87-T118 PolarHBondContact N-O 2.95Å; K87-T118 PolarHBondContact O-N 3.37Å; T118-T457 CarbonylContact C-O 3.57Å; T118-T457 WeakPolarHBondContact CA-O 3.27Å; T118-E459 HydrophobicContact CG2-CB 3.97Å
119	L	92.3	Very high	92.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.3	-178.5	-65.6	177	0	0	0	110.6	I117 K125 L393 A430 V456 T457 F458 E459	I117-L119 HydrophobicContact CG2-CD1 4.32Å; I117-L119 HydrophobicContact CG2-CD2 3.69Å; I117-L119 HydrophobicContact CG2-CG 3.73Å; L119-K125 HydrophobicContact CD2-CB 4.06Å; L119-K125 HydrophobicContact CD2-CG 3.82Å; L119-L393 HydrophobicContact CD1-CD1 3.47Å; L119-L393 VanDerWaalsContact CD1-CD1 3.47Å; L119-A430 HydrophobicContact CB-CB 3.87Å; L119-A430 HydrophobicContact CD1-CB 4.05Å; L119-V456 HydrophobicContact CD1-CG1 3.96Å; L119-V456 HydrophobicContact CG-CG1 4.3Å; L119-T457 PolarHBondContact N-O 2.93Å; L119-F458 WeakPolarHBondContact O-CA 3.31Å; L119-E459 PolarHBondContact O-N 3.32Å
120	R	89.3	Confident	93.1	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.011	18%	0.176	C	C	.	.			trans	-80.6	151.7	163.1	146	176.5	-164.5	169.5	3.1	109.5	L41 H44 P45 C47 S86 D122 D123	L41-R120 PolarHBondContact O-NE 3.49Å; L41-R120 PolarHBondContact O-NH2 3.38Å; H44-R120 PolarHBondContact O-NH2 2.95Å; P45-R120 VanDerWaalsContact C-CZ 3.5Å; P45-R120 PolarHBondContact O-NH1 3.13Å; C47-R120 VanDerWaalsContact O-CZ 3.24Å; C47-R120 PolarHBondContact O-NH1 3.39Å; C47-R120 PolarHBondContact O-NH2 3.45Å; S86-R120 PolarHBondContact OG-N 3.3Å; R120-D122 PolarHBondContact O-N 2.7Å; R120-D123 HydrophobicContact CB-CB 4.2Å; R120-D123 HydrophobicContact CG-CB 4.15Å; R120-D123 WeakPolarHBondContact O-CB 3.31Å; R120-D123 PolarHBondContact O-N 2.97Å; R120-D123 VanDerWaalsContact O-N 3.14Å
121	P	83.1	Confident	93.1	Very high	8 Å²	8	37.1 Å²	37.1	5%	0.052	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	133.2	172.1	-31.3	34.9	0	0	0	113.7	D123 E459 C460	P121-D123 PolarHBondContact O-N 3.37Å; P121-E459 WeakPolarHBondContact CD-O 3.41Å; P121-C460 HydrophobicContact CG-CB 3.92Å
122	D	78.1	Confident	93	Very high	67 Å²	67	37.3 Å²	37.3	36%	0.358	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	3.3	-180	-62.8	-29.7	0	0	0	116.7	P45 R120 A430	P45-D122 VanDerWaalsContact CG-C 3.43Å; P45-D122 HydrophobicContact CG-CB 4.23Å; P45-D122 WeakPolarHBondContact CG-O 3.38Å; R120-D122 PolarHBondContact O-N 2.7Å; D122-A430 WeakPolarHBondContact CA-O 3.46Å; D122-A430 PolarHBondContact N-O 3.41Å; D122-A430 VanDerWaalsContact N-O 3.11Å
123	D	87.8	Confident	92.4	Very high	39 Å²	39	36.8 Å²	36.8	21%	0.209	17%	0.172	C	C	.	.			trans	-91.5	160.3	176.2	-163	15.3	0	0	0	111.7	P45 S86 R120 P121 R429 A430	P45-D123 HydrophobicContact CB-CB 3.89Å; P45-D123 HydrophobicContact CG-CB 3.79Å; S86-D123 WeakPolarHBondContact CB-OD2 3.42Å; S86-D123 WeakPolarHBondContact OG-CB 3.41Å; S86-D123 VanDerWaalsContact OG-CG 3.28Å; S86-D123 PolarHBondContact OG-OD2 3.05Å; R120-D123 HydrophobicContact CB-CB 4.2Å; R120-D123 HydrophobicContact CG-CB 4.15Å; R120-D123 WeakPolarHBondContact O-CB 3.31Å; R120-D123 PolarHBondContact O-N 2.97Å; R120-D123 VanDerWaalsContact O-N 3.14Å; P121-D123 PolarHBondContact O-N 3.37Å; D123-R429 WeakPolarHBondContact O-CA 3.26Å; D123-A430 PolarHBondContact O-N 3.39Å
124	A	89.4	Confident	91.9	Very high	20 Å²	20	36.3 Å²	36.3	17%	0.165	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.7	-175.2	0	0	0	0	0	113	E427 A428 R429	A124-E427 HydrophobicContact CB-CG 3.76Å; A124-A428 CarbonylContact C-O 3.51Å; A124-A428 VanDerWaalsContact CA-O 3.27Å; A124-A428 WeakPolarHBondContact CA-O 3.41Å; A124-R429 HydrophobicContact CB-CB 3.8Å; A124-R429 HydrophobicContact CB-CG 4.04Å
125	K	94.4	Very high	91.1	Very high	66 Å²	66	35.6 Å²	35.6	29%	0.287	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.4	169.2	-71.9	-69.3	153.3	170.3	0	111.3	S86 I117 L119 A428	S86-K125 WeakPolarHBondContact O-CE 3.41Å; S86-K125 PolarHBondContact O-NZ 3.39Å; I117-K125 HydrophobicContact CG2-CB 4.05Å; I117-K125 HydrophobicContact CG2-CG 4.31Å; L119-K125 HydrophobicContact CD2-CB 4.06Å; L119-K125 HydrophobicContact CD2-CG 3.82Å; K125-A428 PolarHBondContact N-O 3.26Å; K125-A428 PolarHBondContact O-N 2.98Å
126	R	94.6	Very high	90.3	Very high	166 Å²	166	37.7 Å²	37.7	63%	0.626	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.5	173.9	-81	-177.6	-93.5	-100.5	-8.8	110.6	V426 E427	R126-V426 CarbonylContact C-O 3.33Å; R126-V426 VanDerWaalsContact CA-O 3.27Å; R126-V426 WeakPolarHBondContact CA-O 3.44Å; R126-E427 HydrophobicContact CG-CB 3.69Å; R126-E427 HydrophobicContact CG-CG 3.98Å; R126-E427 IonicContact CZ-OE2 2.59Å; R126-E427 IonicContact NE-OE2 3.91Å; R126-E427 IonicContact NH1-OE2 3.84Å; R126-E427 PolarHBondContact NH1-OE2 2.96Å; R126-E427 IonicContact NH2-OE2 2.77Å
127	F	95.6	Very high	89.6	Confident	9 Å²	9	36.1 Å²	36.1	4%	0.039	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	160.4	170.1	59	-88.6	0	0	0	109.8	L88 L115 I117 V129 V426 A428 I443 L452 I454	L88-F127 HydrophobicContact CD1-CB 4.33Å; L88-F127 HydrophobicContact CD2-CB 3.74Å; L115-F127 HydrophobicContact CD1-CB 4.02Å; L115-F127 HydrophobicContact CD1-CD1 4.42Å; L115-F127 HydrophobicContact CD1-CD2 3.49Å; L115-F127 VanDerWaalsContact CD1-CD2 3.49Å; L115-F127 HydrophobicContact CD1-CE2 3.99Å; L115-F127 HydrophobicContact CD1-CG 3.73Å; I117-F127 HydrophobicContact CD1-CD1 3.8Å; I117-F127 HydrophobicContact CD1-CE1 3.63Å; F127-V129 HydrophobicContact CD2-CG2 4Å; F127-V129 HydrophobicContact CE2-CG2 3.89Å; F127-V426 HydrophobicContact CD2-CB 4.14Å; F127-V426 HydrophobicContact CE1-CB 4.1Å; F127-V426 HydrophobicContact CE1-CG1 4.04Å; F127-V426 HydrophobicContact CE2-CB 3.69Å; F127-V426 HydrophobicContact CE2-CG1 4.09Å; F127-V426 HydrophobicContact CE2-CG2 4Å; F127-V426 HydrophobicContact CZ-CB 3.67Å; F127-V426 HydrophobicContact CZ-CG1 3.59Å; F127-V426 HydrophobicContact CZ-CG2 4.37Å; F127-V426 PolarHBondContact N-O 3.25Å; F127-V426 PolarHBondContact O-N 3.39Å; F127-A428 HydrophobicContact CE1-CB 3.97Å; F127-I443 HydrophobicContact CE2-CD1 4.01Å; F127-I443 HydrophobicContact CZ-CD1 3.95Å; F127-L452 HydrophobicContact CD2-CD2 4.29Å; F127-L452 HydrophobicContact CE2-CD2 3.89Å; F127-I454 HydrophobicContact CZ-CG1 4.42Å
128	T	95.7	Very high	89.2	Confident	72 Å²	72	37.1 Å²	37.1	44%	0.442	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.8	-178.3	-54.4	0	0	0	0	110	P112 K130 F424	P112-T128 WeakPolarHBondContact CD-O 3.46Å; T128-K130 HydrophobicContact CG2-CG 4.46Å; T128-F424 CarbonylContact C-O 3.6Å; T128-F424 WeakPolarHBondContact CA-O 3.29Å
129	V	95.9	Very high	89	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.3	174	-172.5	0	0	0	0	107.8	I110 F127 V131 S423 F424 V426 L452	I110-V129 HydrophobicContact CD1-CG1 3.63Å; I110-V129 HydrophobicContact CG1-CG1 3.64Å; F127-V129 HydrophobicContact CD2-CG2 4Å; F127-V129 HydrophobicContact CE2-CG2 3.89Å; V129-V131 HydrophobicContact CG1-CG2 4.33Å; V129-S423 CarbonylContact O-C 3.52Å; V129-S423 VanDerWaalsContact O-CA 3.28Å; V129-S423 WeakPolarHBondContact O-CA 3.49Å; V129-F424 PolarHBondContact N-O 2.03Å; V129-F424 PolarHBondContact O-N 3.05Å; V129-V426 HydrophobicContact CG2-CG2 4.09Å; V129-L452 HydrophobicContact CG1-CD2 4.39Å; V129-L452 HydrophobicContact CG2-CD2 3.47Å; V129-L452 VanDerWaalsContact CG2-CD2 3.47Å
130	K	95.1	Very high	89	Confident	91 Å²	91	36 Å²	36	40%	0.396	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.4	173.1	-60.7	-166.8	178.1	-172.4	0	109.3	L96 I110 K111 T128 V422	L96-K130 HydrophobicContact CD1-CB 4.09Å; I110-K130 WeakPolarHBondContact CA-O 3.43Å; K111-K130 HydrophobicContact CG-CB 4.01Å; K111-K130 PolarHBondContact N-O 3.48Å; K111-K130 PolarHBondContact O-N 3.29Å; T128-K130 HydrophobicContact CG2-CG 4.46Å; K130-V422 WeakPolarHBondContact CA-O 3.11Å
131	V	94.2	Very high	89.2	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.9	178	-174.6	0	0	0	0	108.1	Q109 I110 V129 V382 L384 T421 V422 F424 P445	Q109-V131 CarbonylContact O-C 3.43Å; Q109-V131 WeakPolarHBondContact O-CA 3.39Å; I110-V131 HydrophobicContact CD1-CG2 4.41Å; I110-V131 HydrophobicContact CG1-CG2 4.23Å; V129-V131 HydrophobicContact CG1-CG2 4.33Å; V131-V382 HydrophobicContact CB-CG1 4.01Å; V131-V382 HydrophobicContact CG1-CG1 3.76Å; V131-V382 HydrophobicContact CG1-CG2 4.39Å; V131-V382 HydrophobicContact CG2-CG1 4.33Å; V131-L384 HydrophobicContact CG2-CD2 4.17Å; V131-T421 WeakPolarHBondContact O-CA 3.4Å; V131-V422 HydrophobicContact CB-CG2 4.2Å; V131-V422 PolarHBondContact N-O 3.46Å; V131-V422 PolarHBondContact O-N 2.9Å; V131-F424 HydrophobicContact CG2-CD2 4.38Å; V131-F424 HydrophobicContact CG2-CE2 4.23Å; V131-P445 HydrophobicContact CG1-CB 4.24Å; V131-P445 HydrophobicContact CG1-CG 3.73Å; V131-P445 HydrophobicContact CG2-CG 3.96Å
132	R	90.6	Very high	89.9	Confident	59 Å²	59	35.5 Å²	35.5	22%	0.223	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	136.9	174.6	170.6	-180	-75.9	-177.4	-14.6	110.3	L96 S97 N98 Q109 V134 D420 T421	L96-R132 HydrophobicContact CB-CB 4.37Å; L96-R132 HydrophobicContact CD1-CB 3.85Å; L96-R132 HydrophobicContact CD2-CB 4.36Å; L96-R132 HydrophobicContact CG-CB 4.41Å; S97-R132 VanDerWaalsContact O-CD 3.23Å; S97-R132 WeakPolarHBondContact O-CD 3.39Å; S97-R132 PolarHBondContact O-NH1 3.28Å; N98-R132 PolarHBondContact OD1-NH1 3.02Å; Q109-R132 PolarHBondContact O-N 2.92Å; R132-V134 PolarHBondContact O-N 3.39Å; R132-D420 WeakPolarHBondContact CA-O 3.23Å; R132-T421 HydrophobicContact CB-CG2 4.22Å; R132-T421 PolarHBondContact NE-OG1 3.07Å; R132-T421 PolarHBondContact NH2-OG1 3.17Å
133	Q	85.5	Confident	90.7	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	15%	0.152	C	C	.	.			trans	-85.5	97.1	169.9	-63.3	-167.8	-11	0	0	110.3	E135 R379 V382 G419 D420 F448	Q133-E135 PolarHBondContact O-N 2.86Å; Q133-R379 PolarHBondContact NE2-O 2.85Å; Q133-R379 PolarHBondContact OE1-O 2.96Å; Q133-V382 HydrophobicContact CG-CG2 4.05Å; Q133-G419 VanDerWaalsContact O-CA 3.27Å; Q133-G419 WeakPolarHBondContact O-CA 3.44Å; Q133-G419 PolarHBondContact O-N 3.15Å; Q133-D420 PolarHBondContact N-O 2.85Å; Q133-F448 HydrophobicContact CG-CZ 4.17Å
134	V	84.1	Confident	91.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.142	C	C	.	.			trans	-62.1	136.8	-179.4	174.6	0	0	0	0	110.9	A100 V107 Q109 R132 R379	A100-V134 HydrophobicContact CB-CG1 4.15Å; V107-V134 HydrophobicContact CG1-CB 4.02Å; V107-V134 HydrophobicContact CG1-CG1 3.85Å; V107-V134 HydrophobicContact CG1-CG2 3.8Å; Q109-V134 HydrophobicContact CG-CB 4.32Å; Q109-V134 HydrophobicContact CG-CG2 3.74Å; R132-V134 PolarHBondContact O-N 3.39Å; V134-R379 PolarHBondContact O-NH2 3.18Å
135	E	80.9	Confident	91.5	Very high	80 Å²	80	29.5 Å²	29.5	37%	0.374	13%	0.134	S	C	.	.	B	Isolated β-bridge	trans	-67.9	147.7	173	-73.2	178.1	-170.5	0	0	111.4	K99 A100 Q133 Y137 I418	K99-E135 WeakPolarHBondContact CE-OE2 3.39Å; K99-E135 HydrophobicContact CG-CB 4.29Å; K99-E135 IonicContact NZ-OE2 3.85Å; A100-E135 PolarHBondContact N-O 3.41Å; Q133-E135 PolarHBondContact O-N 2.86Å; E135-Y137 VanDerWaalsContact C-N 3.27Å; E135-Y137 PolarHBondContact O-N 3.14Å; E135-I418 HydrophobicContact CB-CG2 4.4Å; E135-I418 HydrophobicContact CG-CG2 3.91Å
136	D	79.9	Confident	91.7	Very high	47 Å²	47	26.4 Å²	26.4	25%	0.251	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	33.3	175.4	-162.5	30.9	0	0	0	114.2	A100 T173 S174	A100-D136 WeakPolarHBondContact CB-O 3.42Å; D136-T173 WeakPolarHBondContact OD1-CA 3.43Å; D136-S174 WeakPolarHBondContact OD1-CB 3.35Å; D136-S174 PolarHBondContact OD1-N 3.44Å; D136-S174 PolarHBondContact OD1-OG 3.44Å; D136-S174 VanDerWaalsContact OD1-OG 3.06Å; D136-S174 WeakPolarHBondContact OD2-CB 3.48Å; D136-S174 PolarHBondContact OD2-OG 3.39Å
137	Y	83.1	Confident	91.8	Very high	8 Å²	8	18.5 Å²	18.5	3%	0.031	9%	0.09	C	C	.	.			trans	-68.2	141.1	179.6	-161.7	-108.5	0	0	0	111	A100 V107 E135 T173 G268 S270	A100-Y137 HydrophobicContact CB-CD2 4.41Å; V107-Y137 HydrophobicContact CB-CE2 4.13Å; V107-Y137 HydrophobicContact CG1-CD2 4.04Å; V107-Y137 HydrophobicContact CG1-CE2 3.86Å; E135-Y137 VanDerWaalsContact C-N 3.27Å; E135-Y137 PolarHBondContact O-N 3.14Å; Y137-T173 PolarHBondContact O-OG1 3.06Å; Y137-G268 PolarHBondContact OH-O 3.19Å; Y137-S270 WeakPolarHBondContact CD1-OG 3.3Å
138	P	88.7	Confident	91.8	Very high	20 Å²	20	18.1 Å²	18.1	13%	0.13	9%	0.089	C	C	.	.			trans	-60.2	144.6	-179.7	-22.6	33.3	0	0	0	112.2	N175 A269 S270	P138-N175 WeakPolarHBondContact CA-O 3.48Å; P138-N175 HydrophobicContact CB-CB 4.18Å; P138-N175 HydrophobicContact CG-CB 4.4Å; P138-A269 HydrophobicContact CB-CB 3.94Å; P138-A269 CarbonylContact O-C 3.58Å; P138-A269 WeakPolarHBondContact O-CA 3.35Å; P138-S270 PolarHBondContact O-N 3.48Å
139	V	90.1	Very high	91.9	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.3	179.6	-179.1	0	0	0	0	110.2	M169 T173 N175 L176 R177 R266 L272 Y375	V139-M169 HydrophobicContact CG1-CE 4.3Å; V139-T173 HydrophobicContact CB-CG2 3.84Å; V139-T173 HydrophobicContact CG2-CG2 3.65Å; V139-N175 PolarHBondContact N-O 2.94Å; V139-L176 HydrophobicContact CB-CD1 4.19Å; V139-L176 HydrophobicContact CG1-CD1 4.23Å; V139-L176 WeakPolarHBondContact O-CA 3.45Å; V139-R177 PolarHBondContact O-N 3.3Å; V139-R266 PolarHBondContact O-NH2 2.89Å; V139-L272 HydrophobicContact CG1-CD1 3.57Å; V139-L272 HydrophobicContact CG1-CG 3.98Å; V139-Y375 HydrophobicContact CG2-CE2 3.86Å
140	D	93.3	Very high	91.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.8	168.1	-69	-10.6	0	0	0	108.1	L223 W265 R266 S270 H271 L272	D140-L223 HydrophobicContact CB-CD1 3.95Å; D140-L223 HydrophobicContact CB-CD2 4.04Å; D140-W265 HydrophobicContact CB-CE3 3.6Å; D140-W265 HydrophobicContact CB-CZ3 3.58Å; D140-R266 IonicContact OD1-CZ 3.07Å; D140-R266 IonicContact OD1-NE 2.71Å; D140-R266 PolarHBondContact OD1-NE 2.89Å; D140-R266 IonicContact OD1-NH2 3.98Å; D140-R266 PolarHBondContact OD1-NH2 2.84Å; D140-R266 VanDerWaalsContact OD2-CB 3.32Å; D140-R266 WeakPolarHBondContact OD2-CB 3.41Å; D140-R266 PolarHBondContact OD2-N 3.36Å; D140-R266 IonicContact OD2-NE 3.3Å; D140-S270 PolarHBondContact N-O 3.08Å; D140-H271 IonicContact OD2-CD2 3.53Å; D140-L272 PolarHBondContact O-N 2.98Å
141	L	94.1	Very high	91.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	110.9	-179.4	-171.5	162.9	0	0	0	109	Y143 M169 L176 R177 M178 G179 L223 L272 I274 I371	L141-Y143 HydrophobicContact CD2-CD2 4.48Å; L141-M169 HydrophobicContact CD1-CE 4.34Å; L141-M169 HydrophobicContact CD1-CG 4.45Å; L141-L176 HydrophobicContact CB-CD1 4.41Å; L141-R177 PolarHBondContact N-O 3.18Å; L141-M178 HydrophobicContact CD2-CE 4.48Å; L141-M178 CarbonylContact O-C 3.55Å; L141-M178 VanDerWaalsContact O-CA 3.31Å; L141-M178 WeakPolarHBondContact O-CA 3.27Å; L141-G179 PolarHBondContact O-N 3.15Å; L141-L223 WeakPolarHBondContact O-CD2 3.48Å; L141-L272 WeakPolarHBondContact CA-O 3.34Å; L141-I274 HydrophobicContact CD1-CG1 4.49Å; L141-I274 HydrophobicContact CD2-CG1 3.92Å; L141-I274 HydrophobicContact CG-CG1 4Å; L141-I371 HydrophobicContact CD1-CD1 4.4Å; L141-I371 HydrophobicContact CD1-CG2 3.92Å
142	Y	96.8	Very high	91.6	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.7	173.1	-165.8	-97	0	0	0	109.5	L144 F180 G181 Y217 H219 A256 I263 W265 L272 L273 I274	Y142-L144 HydrophobicContact CD1-CB 4.41Å; Y142-L144 HydrophobicContact CE1-CD1 4.28Å; Y142-F180 PolarHBondContact OH-O 3.05Å; Y142-G181 VanDerWaalsContact OH-CA 3.28Å; Y142-G181 WeakPolarHBondContact OH-CA 3.3Å; Y142-G181 PolarHBondContact OH-N 2.95Å; Y142-Y217 PolarHBondContact OH-OH 3.12Å; Y142-H219 AromaticContact CE2-CE1 3.91Å; Y142-H219 AromaticContact CE2-ND1 3.75Å; Y142-H219 AromaticContact CZ-ND1 3.69Å; Y142-H219 PolarHBondContact OH-ND1 3.41Å; Y142-A256 HydrophobicContact CD1-CB 4.17Å; Y142-A256 HydrophobicContact CE1-CB 3.98Å; Y142-I263 HydrophobicContact CD2-CG2 3.55Å; Y142-I263 HydrophobicContact CE2-CD1 3.91Å; Y142-I263 HydrophobicContact CE2-CG2 3.76Å; Y142-I263 HydrophobicContact CG-CG2 4.12Å; Y142-W265 HydrophobicContact CG-CH2 4.49Å; Y142-W265 HydrophobicContact CG-CZ2 4.28Å; Y142-L272 PolarHBondContact N-O 3.48Å; Y142-L273 HydrophobicContact CD1-CD1 3.66Å; Y142-L273 HydrophobicContact CG-CD1 4.4Å; Y142-I274 PolarHBondContact O-N 3.46Å
143	Y	95.6	Very high	91.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	110.8	-178.8	-161.7	-73.6	0	0	0	109.5	L141 M145 L158 G179 F180 G181 F230 I274 T276 V367	L141-Y143 HydrophobicContact CD2-CD2 4.48Å; Y143-M145 HydrophobicContact CD1-CB 4.02Å; Y143-M145 HydrophobicContact CE1-CB 3.89Å; Y143-M145 HydrophobicContact CE1-CG 4.17Å; Y143-M145 HydrophobicContact CE1-SD 4.12Å; Y143-L158 HydrophobicContact CD1-CD2 3.97Å; Y143-L158 HydrophobicContact CE1-CD1 4.28Å; Y143-L158 HydrophobicContact CE1-CD2 3.55Å; Y143-L158 HydrophobicContact CE2-CD1 3.86Å; Y143-G179 PolarHBondContact N-O 3.38Å; Y143-F180 HydrophobicContact CD1-CD2 4.07Å; Y143-F180 AromaticContact CD1-CE2 3.87Å; Y143-F180 HydrophobicContact CD1-CE2 3.87Å; Y143-F180 HydrophobicContact CG-CD2 4.46Å; Y143-F180 WeakPolarHBondContact O-CA 3.4Å; Y143-G181 PolarHBondContact O-N 2.9Å; Y143-F230 HydrophobicContact CG-CZ 4.3Å; Y143-I274 HydrophobicContact CD2-CB 4.4Å; Y143-I274 HydrophobicContact CD2-CG2 4.38Å; Y143-I274 HydrophobicContact CE2-CG2 4.36Å; Y143-T276 HydrophobicContact CE1-CG2 4.07Å; Y143-T276 HydrophobicContact CE2-CG2 4.47Å; Y143-V367 HydrophobicContact CE2-CG2 3.97Å
144	L	97.6	Very high	91.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	106.4	-177.1	-175.8	63.2	0	0	0	109.9	Y142 F183 Y217 A252 I253 L273 I274 F275 T276	Y142-L144 HydrophobicContact CD1-CB 4.41Å; Y142-L144 HydrophobicContact CE1-CD1 4.28Å; L144-F183 HydrophobicContact CD1-CD1 3.94Å; L144-F183 HydrophobicContact CD2-CD1 4.44Å; L144-F183 HydrophobicContact CG-CD1 3.81Å; L144-F183 HydrophobicContact CG-CE1 3.96Å; L144-Y217 HydrophobicContact CD1-CD2 4.04Å; L144-Y217 HydrophobicContact CD1-CE2 3.56Å; L144-A252 HydrophobicContact CD1-CB 3.96Å; L144-A252 HydrophobicContact CD2-CB 3.87Å; L144-A252 HydrophobicContact CG-CB 4.34Å; L144-I253 HydrophobicContact CD2-CG1 3.86Å; L144-L273 HydrophobicContact CB-CD1 3.97Å; L144-L273 HydrophobicContact CD2-CD1 4.24Å; L144-I274 WeakPolarHBondContact CA-O 3.44Å; L144-I274 WeakPolarHBondContact CB-O 3.21Å; L144-I274 PolarHBondContact N-O 3.3Å; L144-F275 HydrophobicContact CD2-CD2 4.19Å; L144-T276 PolarHBondContact O-N 3.2Å; L144-T276 PolarHBondContact O-OG1 3.47Å
145	M	96.3	Very high	91.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.7	-168.2	-170.3	169.1	-178.1	0	0	113	Y143 L147 M151 D154 L155 L158 F180 G181 A182 F183 T276	Y143-M145 HydrophobicContact CD1-CB 4.02Å; Y143-M145 HydrophobicContact CE1-CB 3.89Å; Y143-M145 HydrophobicContact CE1-CG 4.17Å; Y143-M145 HydrophobicContact CE1-SD 4.12Å; M145-L147 HydrophobicContact CE-CD2 4.3Å; M145-L147 HydrophobicContact CG-CD2 4.05Å; M145-L147 PolarHBondContact O-N 2.99Å; M145-L147 HydrophobicContact SD-CD2 4.05Å; M145-M151 HydrophobicContact CE-CB 4.44Å; M145-M151 HydrophobicContact CE-CE 4.01Å; M145-D154 HydrophobicContact CE-CB 3.75Å; M145-L155 HydrophobicContact CE-CB 3.99Å; M145-L155 HydrophobicContact CE-CD1 4.49Å; M145-L155 HydrophobicContact SD-CD1 4.21Å; M145-L158 HydrophobicContact SD-CD2 3.58Å; M145-L158 VanDerWaalsContact SD-CD2 3.58Å; M145-F180 HydrophobicContact CB-CE2 3.86Å; M145-F180 HydrophobicContact CB-CZ 3.87Å; M145-F180 HydrophobicContact SD-CE2 4.28Å; M145-F180 HydrophobicContact SD-CZ 4.29Å; M145-G181 PolarHBondContact N-O 2.63Å; M145-A182 CarbonylContact O-C 2.93Å; M145-A182 VanDerWaalsContact O-CA 3.29Å; M145-A182 WeakPolarHBondContact O-CA 3.38Å; M145-F183 VanDerWaalsContact C-CE1 3.48Å; M145-F183 WeakPolarHBondContact O-CD1 3.48Å; M145-F183 PolarHBondContact O-N 2.83Å; M145-T276 WeakPolarHBondContact CA-OG1 3.37Å
146	D	97.5	Very high	92.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	123.9	162.3	-172.5	-10.4	0	0	0	110	S148 M151 F183 T276 S277	D146-S148 WeakPolarHBondContact OD1-CB 3.33Å; D146-S148 PolarHBondContact OD1-N 3.32Å; D146-S148 PolarHBondContact OD1-OG 3.39Å; D146-M151 HydrophobicContact CB-CE 4.48Å; D146-M151 HydrophobicContact CB-CG 3.93Å; D146-M151 VanDerWaalsContact O-CB 3.23Å; D146-M151 WeakPolarHBondContact O-CB 3.17Å; D146-M151 WeakPolarHBondContact O-CG 3.42Å; D146-F183 HydrophobicContact CB-CE1 4.22Å; D146-F183 HydrophobicContact CB-CE2 3.8Å; D146-F183 HydrophobicContact CB-CZ 3.58Å; D146-T276 WeakPolarHBondContact CB-O 3.27Å; D146-T276 PolarHBondContact N-O 3.06Å; D146-S277 WeakPolarHBondContact OD2-CB 3.41Å; D146-S277 PolarHBondContact OD2-OG 3.16Å
147	L	97.4	Very high	92.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.133	C	C	.	.			trans	-113.6	28	176.1	-67.6	-169	0	0	0	111.9	M145 L155 A182 F183 V184 F215 Q237 V239 S240	M145-L147 HydrophobicContact CE-CD2 4.3Å; M145-L147 HydrophobicContact CG-CD2 4.05Å; M145-L147 PolarHBondContact O-N 2.99Å; M145-L147 HydrophobicContact SD-CD2 4.05Å; L147-L155 HydrophobicContact CD2-CD1 4.17Å; L147-L155 HydrophobicContact CD2-CD2 4.21Å; L147-A182 HydrophobicContact CD1-CB 3.42Å; L147-A182 VanDerWaalsContact CD1-CB 3.42Å; L147-A182 HydrophobicContact CG-CB 3.83Å; L147-F183 PolarHBondContact N-O 2.86Å; L147-V184 HydrophobicContact CB-CG2 4.33Å; L147-F215 HydrophobicContact CB-CZ 4.37Å; L147-F215 HydrophobicContact CD1-CZ 4.32Å; L147-Q237 HydrophobicContact CD1-CB 4.14Å; L147-V239 CarbonylContact O-C 3.5Å; L147-V239 WeakPolarHBondContact O-CA 3.46Å; L147-S240 PolarHBondContact O-N 3.37Å
148	S	96.6	Very high	92.2	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.007	13%	0.132	C	C	.	.	S	Bend	trans	-57.2	165.6	161.8	69.8	0	0	0	0	111	D146 S150 M151 S240	D146-S148 WeakPolarHBondContact OD1-CB 3.33Å; D146-S148 PolarHBondContact OD1-N 3.32Å; D146-S148 PolarHBondContact OD1-OG 3.39Å; S148-S150 PolarHBondContact O-N 3.47Å; S148-S150 PolarHBondContact OG-OG 3.16Å; S148-M151 PolarHBondContact O-N 2.94Å; S148-S240 CarbonylContact C-O 3.59Å
149	Y	95.8	Very high	92	Very high	91 Å²	91	29.9 Å²	29.9	36%	0.357	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-66.6	-28	-171	-171.6	-99	0	0	0	112.9	M151 C204 I207 T209 V239 S240	Y149-M151 VanDerWaalsContact C-N 3.28Å; Y149-M151 PolarHBondContact O-N 3.39Å; Y149-C204 VanDerWaalsContact CD2-SG 3.54Å; Y149-I207 HydrophobicContact CD1-CD1 4.29Å; Y149-I207 HydrophobicContact CD2-CD1 4.27Å; Y149-I207 HydrophobicContact CE1-CD1 3.76Å; Y149-I207 HydrophobicContact CE2-CD1 3.72Å; Y149-I207 VanDerWaalsContact CZ-CD1 3.45Å; Y149-T209 HydrophobicContact CE2-CG2 3.86Å; Y149-V239 HydrophobicContact CD2-CG2 4.13Å; Y149-S240 VanDerWaalsContact CA-O 3.29Å; Y149-S240 WeakPolarHBondContact CA-O 3.16Å; Y149-S240 WeakPolarHBondContact CB-O 3.49Å; Y149-S240 PolarHBondContact N-O 2.69Å
150	S	93.4	Very high	91.2	Very high	55 Å²	55	33.8 Å²	33.8	39%	0.385	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-66	-31	178	48.8	0	0	0	0	112.4	S148 N152 D153 D278	S148-S150 PolarHBondContact O-N 3.47Å; S148-S150 PolarHBondContact OG-OG 3.16Å; S150-N152 PolarHBondContact O-N 3.11Å; S150-N152 VanDerWaalsContact O-N 3.11Å; S150-D153 VanDerWaalsContact O-OD1 3.08Å; S150-D278 WeakPolarHBondContact CB-OD2 3.39Å; S150-D278 PolarHBondContact OG-OD1 3.44Å; S150-D278 VanDerWaalsContact OG-OD1 3.09Å; S150-D278 PolarHBondContact OG-OD2 3.07Å
151	M	93.8	Very high	90.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-79.6	14.3	-176.8	-61.8	-68	-62.2	0	0	114.5	M145 D146 S148 Y149 D154 L155 D278	M145-M151 HydrophobicContact CE-CB 4.44Å; M145-M151 HydrophobicContact CE-CE 4.01Å; D146-M151 HydrophobicContact CB-CE 4.48Å; D146-M151 HydrophobicContact CB-CG 3.93Å; D146-M151 VanDerWaalsContact O-CB 3.23Å; D146-M151 WeakPolarHBondContact O-CB 3.17Å; D146-M151 WeakPolarHBondContact O-CG 3.42Å; S148-M151 PolarHBondContact O-N 2.94Å; Y149-M151 VanDerWaalsContact C-N 3.28Å; Y149-M151 PolarHBondContact O-N 3.39Å; M151-D154 HydrophobicContact CE-CB 3.85Å; M151-D154 PolarHBondContact O-N 2.94Å; M151-L155 WeakPolarHBondContact O-CB 3.34Å; M151-L155 PolarHBondContact O-N 2.97Å; M151-D278 HydrophobicContact SD-CB 3.82Å
152	N	91.8	Very high	89.2	Confident	80 Å²	80	34.9 Å²	34.9	43%	0.428	17%	0.169	S	C	.	.	H	α-helix	trans	-70.9	-36.5	-173	-176.2	55.2	0	0	0	113.1	S150 F156 V239	S150-N152 PolarHBondContact O-N 3.11Å; S150-N152 VanDerWaalsContact O-N 3.11Å; N152-F156 PolarHBondContact O-N 2.88Å; N152-V239 HydrophobicContact CB-CG1 3.87Å; N152-V239 HydrophobicContact CB-CG2 4.06Å
153	D	88.3	Confident	88.2	Confident	84 Å²	84	43.4 Å²	43.4	45%	0.449	20%	0.201	S	C	.	.	H	α-helix	trans	-73	-38.1	173.1	56.1	-36.7	0	0	0	111.9	S150 L155 F156 R157	S150-D153 VanDerWaalsContact O-OD1 3.08Å; D153-L155 VanDerWaalsContact C-N 3.3Å; D153-L155 PolarHBondContact O-N 2.88Å; D153-F156 WeakPolarHBondContact O-CB 3.42Å; D153-F156 PolarHBondContact O-N 2.97Å; D153-F156 VanDerWaalsContact O-N 3.15Å; D153-R157 PolarHBondContact O-N 3.23Å
154	D	88.2	Confident	87.4	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-58.1	-43.1	170.7	-60.4	-92.6	0	0	0	111.8	M145 M151 F156 R157 L158 S364	M145-D154 HydrophobicContact CE-CB 3.75Å; M151-D154 HydrophobicContact CE-CB 3.85Å; M151-D154 PolarHBondContact O-N 2.94Å; D154-F156 VanDerWaalsContact C-N 3.3Å; D154-F156 PolarHBondContact O-N 3.49Å; D154-R157 PolarHBondContact O-N 3.42Å; D154-R157 VanDerWaalsContact O-N 3.14Å; D154-L158 WeakPolarHBondContact O-CB 3.41Å; D154-L158 PolarHBondContact O-N 2.71Å; D154-S364 VanDerWaalsContact OD1-CB 3.25Å; D154-S364 WeakPolarHBondContact OD1-CB 3.4Å; D154-S364 PolarHBondContact OD1-N 3.26Å; D154-S364 PolarHBondContact OD1-OG 3.24Å
155	L	88.6	Confident	86.4	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-40.9	177.3	-179.6	62.2	0	0	0	110.8	M145 L147 M151 D153 R157 L158 R159 V234 Q237 V239	M145-L155 HydrophobicContact CE-CB 3.99Å; M145-L155 HydrophobicContact CE-CD1 4.49Å; M145-L155 HydrophobicContact SD-CD1 4.21Å; L147-L155 HydrophobicContact CD2-CD1 4.17Å; L147-L155 HydrophobicContact CD2-CD2 4.21Å; M151-L155 WeakPolarHBondContact O-CB 3.34Å; M151-L155 PolarHBondContact O-N 2.97Å; D153-L155 VanDerWaalsContact C-N 3.3Å; D153-L155 PolarHBondContact O-N 2.88Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 3.08Å; L155-L158 PolarHBondContact O-N 3.01Å; L155-R159 VanDerWaalsContact O-CG 3.28Å; L155-R159 WeakPolarHBondContact O-CG 3.32Å; L155-R159 PolarHBondContact O-N 2.79Å; L155-R159 VanDerWaalsContact O-N 3.16Å; L155-V234 HydrophobicContact CD1-CG1 3.99Å; L155-Q237 HydrophobicContact CD1-CB 4.28Å; L155-Q237 HydrophobicContact CD2-CB 4.39Å; L155-V239 HydrophobicContact CD2-CG1 4.23Å
156	F	86.6	Confident	85.4	Confident	138 Å²	138	45 Å²	45	61%	0.605	22%	0.216	S	C	*	.	H	α-helix	trans	-60.7	-43.6	174.2	-178	-94.6	0	0	0	111.4	N152 D153 D154 R159	N152-F156 PolarHBondContact O-N 2.88Å; D153-F156 WeakPolarHBondContact O-CB 3.42Å; D153-F156 PolarHBondContact O-N 2.97Å; D153-F156 VanDerWaalsContact O-N 3.15Å; D154-F156 VanDerWaalsContact C-N 3.3Å; D154-F156 PolarHBondContact O-N 3.49Å; F156-R159 WeakPolarHBondContact O-CB 3.18Å; F156-R159 PolarHBondContact O-N 3.27Å
157	R	83.8	Confident	84.6	Confident	100 Å²	100	50 Å²	50	38%	0.377	24%	0.24	S	C	.	.	H	α-helix	trans	-64.8	-45.5	177.2	-171.5	70.1	178.8	-166.1	-4.3	111.7	D153 D154 L155 R159 T160 L161 D363	D153-R157 PolarHBondContact O-N 3.23Å; D154-R157 PolarHBondContact O-N 3.42Å; D154-R157 VanDerWaalsContact O-N 3.14Å; L155-R157 VanDerWaalsContact C-N 3.33Å; L155-R157 PolarHBondContact O-N 3.08Å; R157-R159 VanDerWaalsContact C-N 3.27Å; R157-R159 PolarHBondContact O-N 2.71Å; R157-T160 WeakPolarHBondContact O-CA 3.31Å; R157-T160 PolarHBondContact O-N 2.71Å; R157-T160 PolarHBondContact O-OG1 3Å; R157-L161 HydrophobicContact CG-CD1 3.61Å; R157-L161 HydrophobicContact CG-CG 3.98Å; R157-L161 WeakPolarHBondContact O-CG 3.09Å; R157-L161 PolarHBondContact O-N 2.94Å; R157-D363 WeakPolarHBondContact CB-O 3.07Å; R157-D363 WeakPolarHBondContact CG-O 3.35Å
158	L	82.8	Confident	83.9	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-36.8	-178.9	-170.6	64	0	0	0	112.3	Y143 M145 D154 L155 T160 L161 G162 F180 V234	Y143-L158 HydrophobicContact CD1-CD2 3.97Å; Y143-L158 HydrophobicContact CE1-CD1 4.28Å; Y143-L158 HydrophobicContact CE1-CD2 3.55Å; Y143-L158 HydrophobicContact CE2-CD1 3.86Å; M145-L158 HydrophobicContact SD-CD2 3.58Å; M145-L158 VanDerWaalsContact SD-CD2 3.58Å; D154-L158 WeakPolarHBondContact O-CB 3.41Å; D154-L158 PolarHBondContact O-N 2.71Å; L155-L158 PolarHBondContact O-N 3.01Å; L158-T160 PolarHBondContact O-N 3.06Å; L158-L161 PolarHBondContact O-N 2.88Å; L158-L161 VanDerWaalsContact O-N 3.13Å; L158-G162 PolarHBondContact O-N 2.94Å; L158-F180 HydrophobicContact CD2-CE2 3.87Å; L158-V234 HydrophobicContact CB-CG1 4.27Å; L158-V234 HydrophobicContact CD2-CG1 3.96Å; L158-V234 HydrophobicContact CD2-CG2 4.35Å; L158-V234 HydrophobicContact CG-CG1 3.99Å
159	R	83.2	Confident	82.9	Confident	73 Å²	73	50.6 Å²	50.6	28%	0.275	24%	0.244	S	C	.	.	H	α-helix	trans	-57.5	-32	173	-70.1	170.1	179.9	173.7	-0.3	113	L155 F156 R157 V234 K235 Q237	L155-R159 VanDerWaalsContact O-CG 3.28Å; L155-R159 WeakPolarHBondContact O-CG 3.32Å; L155-R159 PolarHBondContact O-N 2.79Å; L155-R159 VanDerWaalsContact O-N 3.16Å; F156-R159 WeakPolarHBondContact O-CB 3.18Å; F156-R159 PolarHBondContact O-N 3.27Å; R157-R159 VanDerWaalsContact C-N 3.27Å; R157-R159 PolarHBondContact O-N 2.71Å; R159-V234 HydrophobicContact CG-CG1 3.87Å; R159-K235 HydrophobicContact CB-CG 4.1Å; R159-K235 HydrophobicContact CG-CG 3.9Å; R159-Q237 PolarHBondContact NH2-O 2.74Å
160	T	74.8	Confident	82	Confident	82 Å²	82	51.4 Å²	51.4	50%	0.503	25%	0.254	S	S	.	.	H	α-helix	trans	-87.1	-29.9	177.5	68.4	0	0	0	0	112.4	R157 L158	R157-T160 WeakPolarHBondContact O-CA 3.31Å; R157-T160 PolarHBondContact O-N 2.71Å; R157-T160 PolarHBondContact O-OG1 3Å; L158-T160 PolarHBondContact O-N 3.06Å
161	L	72.1	Confident	81.4	Confident	23 Å²	23	59.1 Å²	59.1	12%	0.12	28%	0.275	C	S	.	.	H	α-helix	trans	-84.8	-18.4	-175.7	-69.7	-179.4	0	0	0	114.6	R157 L158 R163 G164 L165 V367 I368	R157-L161 HydrophobicContact CG-CD1 3.61Å; R157-L161 HydrophobicContact CG-CG 3.98Å; R157-L161 WeakPolarHBondContact O-CG 3.09Å; R157-L161 PolarHBondContact O-N 2.94Å; L158-L161 PolarHBondContact O-N 2.88Å; L158-L161 VanDerWaalsContact O-N 3.13Å; L161-R163 VanDerWaalsContact C-N 3.28Å; L161-R163 PolarHBondContact O-N 2.85Å; L161-R163 VanDerWaalsContact O-N 3.13Å; L161-G164 CarbonylContact O-C 3.58Å; L161-G164 WeakPolarHBondContact O-CA 3.5Å; L161-G164 PolarHBondContact O-N 3.49Å; L161-L165 PolarHBondContact O-N 3.21Å; L161-V367 HydrophobicContact CD1-CG1 3.81Å; L161-I368 HydrophobicContact CB-CD1 4.47Å; L161-I368 HydrophobicContact CD2-CD1 4.02Å
162	G	72.6	Confident	80.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-48.9	-44.3	-174.9	0	0	0	0	0	114.4	L158 A166	L158-G162 PolarHBondContact O-N 2.94Å; G162-A166 PolarHBondContact O-N 3.27Å
163	R	75.6	Confident	80	Confident	178 Å²	178	57.7 Å²	57.7	67%	0.672	27%	0.269	S	S	*	.	H	α-helix	trans	-66.9	-45.1	174.7	-173.9	176.4	65.9	-171.1	-1	112.6	L161 L165 A166 E167	L161-R163 VanDerWaalsContact C-N 3.28Å; L161-R163 PolarHBondContact O-N 2.85Å; L161-R163 VanDerWaalsContact O-N 3.13Å; R163-L165 VanDerWaalsContact C-N 3.34Å; R163-L165 PolarHBondContact O-N 2.94Å; R163-A166 PolarHBondContact O-N 3.41Å; R163-E167 WeakPolarHBondContact CG-OE1 3.28Å; R163-E167 IonicContact NE-OE1 3.19Å; R163-E167 WeakPolarHBondContact O-CG 3.46Å; R163-E167 PolarHBondContact O-N 2.82Å
164	G	79.6	Confident	79.7	Confident	25 Å²	25	57.4 Å²	57.4	26%	0.258	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-36.2	-179.8	0	0	0	0	0	113	L161 E167 A168	L161-G164 CarbonylContact O-C 3.58Å; L161-G164 WeakPolarHBondContact O-CA 3.5Å; L161-G164 PolarHBondContact O-N 3.49Å; G164-E167 PolarHBondContact O-N 3.14Å; G164-A168 WeakPolarHBondContact O-CB 3.42Å; G164-A168 PolarHBondContact O-N 2.94Å
165	L	76.3	Confident	79.6	Confident	1 Å²	1	60 Å²	60	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-46.2	176.4	177	58	0	0	0	110.8	L161 R163 A168 M169 M178 I368 I371	L161-L165 PolarHBondContact O-N 3.21Å; R163-L165 VanDerWaalsContact C-N 3.34Å; R163-L165 PolarHBondContact O-N 2.94Å; L165-A168 PolarHBondContact O-N 3.15Å; L165-M169 HydrophobicContact CD1-CG 4.09Å; L165-M169 WeakPolarHBondContact O-CB 3.29Å; L165-M169 VanDerWaalsContact O-CG 3.3Å; L165-M169 WeakPolarHBondContact O-CG 3.38Å; L165-M169 PolarHBondContact O-N 3.42Å; L165-M178 HydrophobicContact CD2-CE 3.6Å; L165-M178 HydrophobicContact CG-CE 3.95Å; L165-I368 HydrophobicContact CB-CD1 4.25Å; L165-I368 HydrophobicContact CB-CG1 4Å; L165-I368 HydrophobicContact CD1-CB 4.39Å; L165-I368 HydrophobicContact CD1-CG1 3.99Å; L165-I368 HydrophobicContact CD1-CG2 4.35Å; L165-I371 HydrophobicContact CD1-CD1 3.71Å; L165-I371 HydrophobicContact CD2-CD1 4.17Å
166	A	75.5	Confident	79.6	Confident	7 Å²	7	60.8 Å²	60.8	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-65.5	-43.6	176.9	0	0	0	0	0	113	G162 R163 A168 M169 N170 M178 V227	G162-A166 PolarHBondContact O-N 3.27Å; R163-A166 PolarHBondContact O-N 3.41Å; A166-A168 VanDerWaalsContact C-N 3.28Å; A166-A168 PolarHBondContact O-N 2.94Å; A166-M169 PolarHBondContact O-N 3.44Å; A166-N170 VanDerWaalsContact O-CB 3.25Å; A166-N170 WeakPolarHBondContact O-CB 3.39Å; A166-N170 PolarHBondContact O-N 2.81Å; A166-M178 HydrophobicContact CB-SD 4.02Å; A166-V227 HydrophobicContact CB-CB 3.93Å; A166-V227 HydrophobicContact CB-CG1 3.14Å; A166-V227 HydrophobicContact CB-CG2 3.49Å; A166-V227 VanDerWaalsContact CB-CG2 3.49Å
167	E	81	Confident	79.8	Confident	107 Å²	107	57.7 Å²	57.7	50%	0.5	28%	0.276	S	S	.	.	H	α-helix	trans	-58.7	-41.2	174.4	-74.9	173.2	-168.9	0	0	111.7	R163 G164	R163-E167 WeakPolarHBondContact CG-OE1 3.28Å; R163-E167 IonicContact NE-OE1 3.19Å; R163-E167 WeakPolarHBondContact O-CG 3.46Å; R163-E167 PolarHBondContact O-N 2.82Å; G164-E167 PolarHBondContact O-N 3.14Å
168	A	80.7	Confident	80.2	Confident	12 Å²	12	53 Å²	53	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-67.8	-37.1	178	0	0	0	0	0	112.7	G164 L165 A166 I368 Q372	G164-A168 WeakPolarHBondContact O-CB 3.42Å; G164-A168 PolarHBondContact O-N 2.94Å; L165-A168 PolarHBondContact O-N 3.15Å; A166-A168 VanDerWaalsContact C-N 3.28Å; A166-A168 PolarHBondContact O-N 2.94Å; A168-I368 HydrophobicContact CB-CG2 3.38Å; A168-Q372 PolarHBondContact O-NE2 3.39Å
169	M	77	Confident	80.8	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-79.7	-29.9	178.7	-70.2	-59.8	-67.9	0	0	112.9	V139 L141 L165 A166 R171 T172 T173 L176 L272 I371 Q372	V139-M169 HydrophobicContact CG1-CE 4.3Å; L141-M169 HydrophobicContact CD1-CE 4.34Å; L141-M169 HydrophobicContact CD1-CG 4.45Å; L165-M169 HydrophobicContact CD1-CG 4.09Å; L165-M169 WeakPolarHBondContact O-CB 3.29Å; L165-M169 VanDerWaalsContact O-CG 3.3Å; L165-M169 WeakPolarHBondContact O-CG 3.38Å; L165-M169 PolarHBondContact O-N 3.42Å; A166-M169 PolarHBondContact O-N 3.44Å; M169-R171 PolarHBondContact O-N 2.94Å; M169-T172 WeakPolarHBondContact O-CA 3.11Å; M169-T172 WeakPolarHBondContact O-CB 3.06Å; M169-T172 PolarHBondContact O-N 2.87Å; M169-T173 PolarHBondContact O-N 3.28Å; M169-L176 HydrophobicContact CB-CD1 4.26Å; M169-L176 HydrophobicContact CB-CD2 3.56Å; M169-L272 HydrophobicContact CE-CD1 4.42Å; M169-I371 HydrophobicContact CE-CG2 4.35Å; M169-I371 HydrophobicContact SD-CG2 3.89Å; M169-Q372 HydrophobicContact SD-CG 4.42Å
170	N	75.9	Confident	81.4	Confident	107 Å²	107	49.4 Å²	49.4	57%	0.572	25%	0.245	S	C	*	.	H	α-helix	trans	-66.3	-19.6	174.9	-159.9	24.9	0	0	0	112.5	A166 T172 T173	A166-N170 VanDerWaalsContact O-CB 3.25Å; A166-N170 WeakPolarHBondContact O-CB 3.39Å; A166-N170 PolarHBondContact O-N 2.81Å; N170-T172 VanDerWaalsContact C-N 3.29Å; N170-T173 CarbonylContact C-O 3.6Å; N170-T173 WeakPolarHBondContact CA-O 3.28Å
171	R	80.5	Confident	82.5	Confident	218 Å²	218	45.5 Å²	45.5	82%	0.823	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-21.3	169.1	-66.9	177.5	-175.3	177.2	2.2	113	M169	M169-R171 PolarHBondContact O-N 2.94Å
172	T	75.3	Confident	83.8	Confident	48 Å²	48	44.4 Å²	44.4	29%	0.294	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-36.4	-174.8	-51.7	0	0	0	0	111.7	M169 N170 Y375	M169-T172 WeakPolarHBondContact O-CA 3.11Å; M169-T172 WeakPolarHBondContact O-CB 3.06Å; M169-T172 PolarHBondContact O-N 2.87Å; N170-T172 VanDerWaalsContact C-N 3.29Å; T172-Y375 HydrophobicContact CG2-CD1 3.61Å; T172-Y375 HydrophobicContact CG2-CE1 3.36Å
173	T	81.3	Confident	85	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	22%	0.215	C	C	.	.			trans	-143.5	141.7	176.7	-179.1	0	0	0	0	109.9	D136 Y137 V139 M169 N170 N175 L176	D136-T173 WeakPolarHBondContact OD1-CA 3.43Å; Y137-T173 PolarHBondContact O-OG1 3.06Å; V139-T173 HydrophobicContact CB-CG2 3.84Å; V139-T173 HydrophobicContact CG2-CG2 3.65Å; M169-T173 PolarHBondContact O-N 3.28Å; N170-T173 CarbonylContact C-O 3.6Å; N170-T173 WeakPolarHBondContact CA-O 3.28Å; T173-N175 VanDerWaalsContact C-N 3.27Å; T173-N175 PolarHBondContact OG1-N 3.46Å; T173-L176 HydrophobicContact CG2-CB 4.21Å
174	S	81.8	Confident	86.1	Confident	78 Å²	78	35.9 Å²	35.9	55%	0.545	18%	0.183	S	C	.	.	S	Bend	trans	-76.5	-14.1	174.6	64.4	0	0	0	0	113	D136	D136-S174 WeakPolarHBondContact OD1-CB 3.35Å; D136-S174 PolarHBondContact OD1-N 3.44Å; D136-S174 PolarHBondContact OD1-OG 3.44Å; D136-S174 VanDerWaalsContact OD1-OG 3.06Å; D136-S174 WeakPolarHBondContact OD2-CB 3.48Å; D136-S174 PolarHBondContact OD2-OG 3.39Å
175	N	86.2	Confident	87	Confident	57 Å²	57	34.7 Å²	34.7	31%	0.305	17%	0.171	S	C	.	.	S	Bend	trans	-129.6	78.2	-172.4	-165.6	-12.6	0	0	0	112.5	P138 V139 T173 R266	P138-N175 WeakPolarHBondContact CA-O 3.48Å; P138-N175 HydrophobicContact CB-CB 4.18Å; P138-N175 HydrophobicContact CG-CB 4.4Å; V139-N175 PolarHBondContact N-O 2.94Å; T173-N175 VanDerWaalsContact C-N 3.27Å; T173-N175 PolarHBondContact OG1-N 3.46Å; N175-R266 PolarHBondContact ND2-NH1 3.06Å; N175-R266 PolarHBondContact O-NH2 3.02Å; N175-R266 PolarHBondContact OD1-NH1 2.83Å
176	L	88.8	Confident	88	Confident	18 Å²	18	34.7 Å²	34.7	9%	0.094	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.3	-177.8	-179.9	68	0	0	0	112	V139 L141 M169 T173 M178	V139-L176 HydrophobicContact CB-CD1 4.19Å; V139-L176 HydrophobicContact CG1-CD1 4.23Å; V139-L176 WeakPolarHBondContact O-CA 3.45Å; L141-L176 HydrophobicContact CB-CD1 4.41Å; M169-L176 HydrophobicContact CB-CD1 4.26Å; M169-L176 HydrophobicContact CB-CD2 3.56Å; T173-L176 HydrophobicContact CG2-CB 4.21Å; L176-M178 HydrophobicContact CD1-CG 4.44Å; L176-M178 HydrophobicContact CD2-CG 4.04Å; L176-M178 HydrophobicContact CD2-SD 4.01Å; L176-M178 HydrophobicContact CG-CG 4.06Å
177	R	92.1	Very high	89	Confident	73 Å²	73	36.2 Å²	36.2	28%	0.275	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.9	161.4	-66.4	-173.5	176.9	-173	-3.8	111.3	V139 L141 L223 T224 E225	V139-R177 PolarHBondContact O-N 3.3Å; L141-R177 PolarHBondContact N-O 3.18Å; R177-L223 HydrophobicContact CB-CB 4.1Å; R177-L223 HydrophobicContact CB-CD2 4.28Å; R177-T224 CarbonylContact C-O 3.55Å; R177-T224 VanDerWaalsContact CA-O 3.26Å; R177-T224 WeakPolarHBondContact CA-O 3.47Å; R177-E225 HydrophobicContact CG-CG 3.65Å; R177-E225 IonicContact CZ-OE1 3.67Å; R177-E225 IonicContact NE-OE1 3.94Å; R177-E225 PolarHBondContact NE-OE1 3.39Å; R177-E225 VanDerWaalsContact NE-OE1 3.07Å; R177-E225 IonicContact NH2-OE1 3.56Å; R177-E225 PolarHBondContact NH2-OE1 3.19Å
178	M	91.8	Very high	89.7	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.3	179.8	-64	-175.5	70.5	0	0	111.2	L141 L165 A166 L176 L223 T224 V227 F230	L141-M178 HydrophobicContact CD2-CE 4.48Å; L141-M178 CarbonylContact O-C 3.55Å; L141-M178 VanDerWaalsContact O-CA 3.31Å; L141-M178 WeakPolarHBondContact O-CA 3.27Å; L165-M178 HydrophobicContact CD2-CE 3.6Å; L165-M178 HydrophobicContact CG-CE 3.95Å; A166-M178 HydrophobicContact CB-SD 4.02Å; L176-M178 HydrophobicContact CD1-CG 4.44Å; L176-M178 HydrophobicContact CD2-CG 4.04Å; L176-M178 HydrophobicContact CD2-SD 4.01Å; L176-M178 HydrophobicContact CG-CG 4.06Å; M178-L223 WeakPolarHBondContact O-CA 3.27Å; M178-T224 PolarHBondContact N-O 3.49Å; M178-T224 PolarHBondContact O-N 2.87Å; M178-V227 HydrophobicContact SD-CG2 4.34Å; M178-F230 HydrophobicContact CB-CD2 4.31Å; M178-F230 HydrophobicContact CE-CD1 4.16Å; M178-F230 HydrophobicContact CE-CD2 4.3Å; M178-F230 HydrophobicContact CE-CE1 4.22Å; M178-F230 HydrophobicContact CE-CE2 4.33Å; M178-F230 HydrophobicContact CE-CG 4.21Å; M178-F230 HydrophobicContact CE-CZ 4.3Å
179	G	95.3	Very high	90.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	165	176	0	0	0	0	0	111	L141 Y143 L221	L141-G179 PolarHBondContact O-N 3.15Å; Y143-G179 PolarHBondContact N-O 3.38Å; G179-L221 CarbonylContact C-O 3.56Å; G179-L221 WeakPolarHBondContact CA-O 3.49Å
180	F	96.3	Very high	91.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.1	-176.9	-172.7	-97.6	0	0	0	111.3	Y142 Y143 M145 L158 A182 V220 L221 F230 V234 Q237	Y142-F180 PolarHBondContact OH-O 3.05Å; Y143-F180 HydrophobicContact CD1-CD2 4.07Å; Y143-F180 AromaticContact CD1-CE2 3.87Å; Y143-F180 HydrophobicContact CD1-CE2 3.87Å; Y143-F180 HydrophobicContact CG-CD2 4.46Å; Y143-F180 WeakPolarHBondContact O-CA 3.4Å; M145-F180 HydrophobicContact CB-CE2 3.86Å; M145-F180 HydrophobicContact CB-CZ 3.87Å; M145-F180 HydrophobicContact SD-CE2 4.28Å; M145-F180 HydrophobicContact SD-CZ 4.29Å; L158-F180 HydrophobicContact CD2-CE2 3.87Å; F180-A182 HydrophobicContact CE1-CB 4.25Å; F180-V220 HydrophobicContact CD1-CB 3.81Å; F180-V220 HydrophobicContact CD1-CG1 4.1Å; F180-V220 HydrophobicContact CD1-CG2 3.93Å; F180-V220 HydrophobicContact CE1-CG2 4.25Å; F180-V220 WeakPolarHBondContact O-CB 3.38Å; F180-V220 PolarHBondContact O-N 3.11Å; F180-V220 VanDerWaalsContact O-N 3.08Å; F180-L221 HydrophobicContact CB-CB 4.1Å; F180-L221 PolarHBondContact N-O 3.23Å; F180-L221 PolarHBondContact O-N 3.47Å; F180-F230 HydrophobicContact CB-CD2 4.1Å; F180-F230 HydrophobicContact CB-CE2 3.86Å; F180-F230 AromaticContact CD2-CE2 3.84Å; F180-F230 HydrophobicContact CD2-CE2 3.84Å; F180-F230 HydrophobicContact CD2-CZ 4.1Å; F180-F230 HydrophobicContact CG-CE2 4.28Å; F180-V234 HydrophobicContact CD1-CG2 4.46Å; F180-V234 HydrophobicContact CD2-CG2 3.73Å; F180-V234 HydrophobicContact CE2-CG2 3.92Å; F180-V234 HydrophobicContact CG-CG2 4.03Å; F180-V234 HydrophobicContact CZ-CG2 4.4Å; F180-Q237 HydrophobicContact CD1-CG 4.42Å; F180-Q237 HydrophobicContact CE1-CG 3.73Å; F180-Q237 HydrophobicContact CZ-CG 4.4Å
181	G	97.8	Very high	92.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	155.6	171.6	0	0	0	0	0	110.7	Y142 Y143 M145 K218	Y142-G181 VanDerWaalsContact OH-CA 3.28Å; Y142-G181 WeakPolarHBondContact OH-CA 3.3Å; Y142-G181 PolarHBondContact OH-N 2.95Å; Y143-G181 PolarHBondContact O-N 2.9Å; M145-G181 PolarHBondContact N-O 2.63Å; G181-K218 WeakPolarHBondContact CA-O 3.14Å
182	A	98	Very high	93.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.6	-179.2	0	0	0	0	0	111.2	M145 L147 F180 F215 Y217 K218	M145-A182 CarbonylContact O-C 2.93Å; M145-A182 VanDerWaalsContact O-CA 3.29Å; M145-A182 WeakPolarHBondContact O-CA 3.38Å; L147-A182 HydrophobicContact CD1-CB 3.42Å; L147-A182 VanDerWaalsContact CD1-CB 3.42Å; L147-A182 HydrophobicContact CG-CB 3.83Å; F180-A182 HydrophobicContact CE1-CB 4.25Å; A182-F215 HydrophobicContact CB-CE2 4.03Å; A182-F215 HydrophobicContact CB-CZ 4.09Å; A182-Y217 VanDerWaalsContact O-CD2 3.24Å; A182-Y217 WeakPolarHBondContact O-CD2 3.37Å; A182-K218 PolarHBondContact N-O 2.93Å; A182-K218 PolarHBondContact O-N 2.78Å
183	F	98.5	Very high	94	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	160.5	172.6	68.4	-89.5	0	0	0	111.4	L144 M145 D146 L147 G216 Y217 E247 G249 A252 F275	L144-F183 HydrophobicContact CD1-CD1 3.94Å; L144-F183 HydrophobicContact CD2-CD1 4.44Å; L144-F183 HydrophobicContact CG-CD1 3.81Å; L144-F183 HydrophobicContact CG-CE1 3.96Å; M145-F183 VanDerWaalsContact C-CE1 3.48Å; M145-F183 WeakPolarHBondContact O-CD1 3.48Å; M145-F183 PolarHBondContact O-N 2.83Å; D146-F183 HydrophobicContact CB-CE1 4.22Å; D146-F183 HydrophobicContact CB-CE2 3.8Å; D146-F183 HydrophobicContact CB-CZ 3.58Å; L147-F183 PolarHBondContact N-O 2.86Å; F183-G216 WeakPolarHBondContact CA-O 3.25Å; F183-G216 VanDerWaalsContact CB-O 3.28Å; F183-G216 WeakPolarHBondContact CB-O 3.28Å; F183-Y217 HydrophobicContact CB-CD2 4.5Å; F183-E247 HydrophobicContact CE2-CB 4.24Å; F183-G249 VanDerWaalsContact CD2-CA 3.5Å; F183-G249 VanDerWaalsContact CE2-CA 3.41Å; F183-A252 HydrophobicContact CB-CB 3.63Å; F183-A252 HydrophobicContact CD1-CB 3.97Å; F183-A252 HydrophobicContact CG-CB 3.92Å; F183-F275 AromaticContact CE1-CD2 3.92Å; F183-F275 HydrophobicContact CE1-CD2 3.92Å; F183-F275 AromaticContact CE1-CE2 3.52Å; F183-F275 HydrophobicContact CE1-CE2 3.52Å; F183-F275 HydrophobicContact CE1-CZ 4.27Å; F183-F275 HydrophobicContact CE2-CE2 4.02Å; F183-F275 HydrophobicContact CE2-CZ 4.18Å; F183-F275 HydrophobicContact CZ-CD2 4.01Å; F183-F275 AromaticContact CZ-CE2 3.19Å; F183-F275 HydrophobicContact CZ-CE2 3.19Å; F183-F275 AromaticContact CZ-CZ 3.52Å; F183-F275 HydrophobicContact CZ-CZ 3.52Å
184	V	98.3	Very high	94.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.149	C	C	.	.			trans	-134.2	-93	168.3	-173.3	0	0	0	0	106.2	L147 Q214 F215 G216 N242 G248	L147-V184 HydrophobicContact CB-CG2 4.33Å; V184-Q214 HydrophobicContact CB-CG 4.49Å; V184-Q214 HydrophobicContact CG1-CG 4.25Å; V184-F215 WeakPolarHBondContact CB-O 3.37Å; V184-F215 HydrophobicContact CG2-CD1 4.25Å; V184-F215 HydrophobicContact CG2-CE1 3.8Å; V184-F215 HydrophobicContact CG2-CE2 4.13Å; V184-F215 HydrophobicContact CG2-CZ 3.73Å; V184-F215 PolarHBondContact N-O 2.79Å; V184-G216 PolarHBondContact N-O 2.91Å; V184-G216 VanDerWaalsContact N-O 3.14Å; V184-N242 HydrophobicContact CG1-CB 4.05Å; V184-G248 PolarHBondContact O-N 3.37Å
185	D	98.3	Very high	95.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.154	C	C	.	.			trans	-160.3	170.5	172.7	-162.7	9.3	0	0	0	110.4	Y191 Q214 F215 G216 G248 H282 Y316	D185-Y191 WeakPolarHBondContact OD2-CB 3.36Å; D185-Q214 PolarHBondContact O-NE2 3.5Å; D185-F215 PolarHBondContact N-O 3.11Å; D185-F215 CarbonylContact O-C 3.47Å; D185-G216 WeakPolarHBondContact O-CA 3.39Å; D185-G216 PolarHBondContact O-N 2.81Å; D185-G248 VanDerWaalsContact OD1-CA 3.26Å; D185-G248 WeakPolarHBondContact OD1-CA 3.49Å; D185-G248 PolarHBondContact OD1-N 2.93Å; D185-H282 IonicContact OD1-CD2 2.65Å; D185-H282 IonicContact OD2-CD2 3.53Å; D185-H282 PolarHBondContact OD2-CD2 3.1Å; D185-H282 VanDerWaalsContact OD2-CD2 3.29Å; D185-H282 IonicContact OD2-NE2 3.07Å; D185-Y316 WeakPolarHBondContact OD1-CE1 3.25Å; D185-Y316 PolarHBondContact OD1-OH 2.88Å; D185-Y316 PolarHBondContact OD2-OH 2.91Å
186	K	98.2	Very high	95.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.			trans	-54.4	128.3	-175.7	-57	179.9	172.6	-60.2	0	110.8	L188 Y191 Q214 D251 I292 S311 M314 Y316	K186-L188 HydrophobicContact CB-CD2 3.18Å; K186-L188 HydrophobicContact CD-CD2 4.18Å; K186-L188 HydrophobicContact CG-CD2 4.31Å; K186-L188 PolarHBondContact O-N 2.94Å; K186-Y191 HydrophobicContact CB-CD2 4.08Å; K186-Y191 HydrophobicContact CB-CE2 4.42Å; K186-Y191 HydrophobicContact CD-CE2 4.3Å; K186-Q214 PolarHBondContact O-NE2 3.06Å; K186-D251 IonicContact NZ-OD1 2.83Å; K186-D251 IonicContact NZ-OD2 3.36Å; K186-D251 PolarHBondContact NZ-OD2 3.33Å; K186-I292 HydrophobicContact CD-CD1 3.78Å; K186-S311 VanDerWaalsContact CD-O 3.29Å; K186-S311 WeakPolarHBondContact CD-O 3.23Å; K186-S311 WeakPolarHBondContact CG-O 3.38Å; K186-S311 PolarHBondContact NZ-O 2.89Å; K186-M314 PolarHBondContact NZ-O 3.37Å; K186-Y316 HydrophobicContact CD-CE1 3.83Å; K186-Y316 HydrophobicContact CD-CE2 3.84Å; K186-Y316 VanDerWaalsContact CD-CZ 3.44Å; K186-Y316 WeakPolarHBondContact CD-OH 3.32Å; K186-Y316 VanDerWaalsContact CE-CE1 3.4Å; K186-Y316 VanDerWaalsContact CE-CE2 3.42Å; K186-Y316 HydrophobicContact CG-CE1 3.79Å; K186-Y316 WeakPolarHBondContact CG-OH 3.36Å
187	P	96.5	Very high	95.8	Very high	39 Å²	39	34 Å²	34	25%	0.253	19%	0.187	S	C	.	.	S	Bend	trans	-81.5	59.8	-172.8	33.9	-36.3	0	0	0	112.1	M192 S311 T312	P187-M192 HydrophobicContact CB-SD 3.89Å; P187-M192 WeakPolarHBondContact O-CE 3.27Å; P187-S311 WeakPolarHBondContact CD-OG 2.97Å; P187-T312 HydrophobicContact CG-CG2 3.77Å
188	L	95.8	Very high	95.8	Very high	31 Å²	31	32.6 Å²	32.6	16%	0.162	19%	0.191	C	C	.	.	S	Bend	trans	-147	163.4	177.3	73.4	166.6	0	0	0	111.6	K186 Y191 M192 A290 I292 T312	K186-L188 HydrophobicContact CB-CD2 3.18Å; K186-L188 HydrophobicContact CD-CD2 4.18Å; K186-L188 HydrophobicContact CG-CD2 4.31Å; K186-L188 PolarHBondContact O-N 2.94Å; L188-Y191 HydrophobicContact CD2-CD2 3.91Å; L188-Y191 HydrophobicContact CD2-CE2 4.14Å; L188-Y191 HydrophobicContact CG-CD2 4.27Å; L188-Y191 HydrophobicContact CG-CE2 4.46Å; L188-Y191 PolarHBondContact O-N 2.9Å; L188-M192 PolarHBondContact O-N 3.01Å; L188-A290 HydrophobicContact CD1-CB 3.54Å; L188-A290 HydrophobicContact CD2-CB 4.44Å; L188-A290 HydrophobicContact CG-CB 3.84Å; L188-I292 HydrophobicContact CD1-CD1 3.77Å; L188-I292 HydrophobicContact CD1-CG1 4.04Å; L188-I292 HydrophobicContact CD2-CD1 4.11Å; L188-T312 HydrophobicContact CD2-CG2 4.38Å
189	S	95.9	Very high	95.9	Very high	55 Å²	55	32.9 Å²	32.9	39%	0.385	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	140.5	173.4	176.8	0	0	0	0	110.5	A290	S189-A290 VanDerWaalsContact O-CB 3.29Å; S189-A290 WeakPolarHBondContact O-CB 3.4Å
190	P	96.4	Very high	95.8	Very high	48 Å²	48	35.4 Å²	35.4	31%	0.312	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.6	-2.9	8.5	35.1	-35	0	0	0	116	R243	P190-R243 WeakPolarHBondContact O-CD 3.47Å
191	Y	97.1	Very high	95.8	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-31.9	-173	-39.4	-62.9	0	0	0	113.5	D185 K186 L188 Q214 R243 D244 H282 D286 G287 A290	D185-Y191 WeakPolarHBondContact OD2-CB 3.36Å; K186-Y191 HydrophobicContact CB-CD2 4.08Å; K186-Y191 HydrophobicContact CB-CE2 4.42Å; K186-Y191 HydrophobicContact CD-CE2 4.3Å; L188-Y191 HydrophobicContact CD2-CD2 3.91Å; L188-Y191 HydrophobicContact CD2-CE2 4.14Å; L188-Y191 HydrophobicContact CG-CD2 4.27Å; L188-Y191 HydrophobicContact CG-CE2 4.46Å; L188-Y191 PolarHBondContact O-N 2.9Å; Y191-Q214 PolarHBondContact O-OE1 2.8Å; Y191-R243 VanDerWaalsContact O-CB 3.29Å; Y191-R243 WeakPolarHBondContact O-CB 3.21Å; Y191-R243 PolarHBondContact O-N 3.02Å; Y191-D244 WeakPolarHBondContact CA-OD1 3.32Å; Y191-H282 AromaticContact CD1-NE2 3.6Å; Y191-H282 AromaticContact CE1-CE1 3.83Å; Y191-H282 AromaticContact CE1-NE2 3.5Å; Y191-D286 PolarHBondContact OH-O 3.49Å; Y191-G287 WeakPolarHBondContact OH-CA 3.34Å; Y191-A290 HydrophobicContact CD2-CB 4.18Å; Y191-A290 HydrophobicContact CE2-CB 3.31Å
192	M	95.6	Very high	95.7	Very high	24 Å²	24	43.3 Å²	43.3	12%	0.118	25%	0.245	C	C	.	.	S	Bend	trans	-102.8	147.9	-178.4	-174.1	178.7	70.4	0	0	113.5	P187 L188 I194 Q214	P187-M192 HydrophobicContact CB-SD 3.89Å; P187-M192 WeakPolarHBondContact O-CE 3.27Å; L188-M192 PolarHBondContact O-N 3.01Å; M192-I194 HydrophobicContact CE-CG2 4.05Å; M192-I194 PolarHBondContact O-N 2.04Å; M192-Q214 VanDerWaalsContact CB-OE1 3.3Å; M192-Q214 HydrophobicContact CG-CB 3.95Å; M192-Q214 HydrophobicContact CG-CG 4.43Å; M192-Q214 HydrophobicContact SD-CB 3.97Å
193	Y	94.8	Very high	95.6	Very high	49 Å²	49	43.5 Å²	43.5	19%	0.192	25%	0.246	C	C	.	.			trans	-69	106.2	166.2	-65.5	-80.2	0	0	0	111.2	P203 R241 N242 R243	Y193-P203 HydrophobicContact CD2-CB 4.22Å; Y193-R241 HydrophobicContact CE2-CG 4.08Å; Y193-N242 VanDerWaalsContact CE2-O 3.29Å; Y193-N242 WeakPolarHBondContact CE2-O 3.31Å; Y193-R243 HydrophobicContact CE1-CB 4.4Å; Y193-R243 HydrophobicContact CE1-CG 4.13Å; Y193-R243 HydrophobicContact CE2-CB 4.26Å
194	I	95.1	Very high	95.5	Very high	95 Å²	95	43.5 Å²	43.5	49%	0.487	25%	0.246	S	C	.	.			trans	-95.3	-8.6	178.5	61.8	165	0	0	0	114.3	M192	M192-I194 HydrophobicContact CE-CG2 4.05Å; M192-I194 PolarHBondContact O-N 2.04Å
195	S	93	Very high	95.2	Very high	92 Å²	92	49.6 Å²	49.6	64%	0.643	27%	0.27	S	S	*	.	S	Bend	trans	-152.3	141	-176.8	179.8	0	0	0	0	111.1
196	P	94.4	Very high	94.9	Very high	70 Å²	70	53.4 Å²	53.4	46%	0.455	30%	0.296	S	S	.	.	S	Bend	cis	-70.2	171.8	-4.6	30.6	-36.8	0	0	0	112.9	A198 A199	P196-A198 PolarHBondContact O-N 3.13Å; P196-A198 VanDerWaalsContact O-N 3.1Å; P196-A199 HydrophobicContact CG-CB 4.34Å; P196-A199 WeakPolarHBondContact O-CA 3.36Å; P196-A199 VanDerWaalsContact O-CB 3.29Å; P196-A199 WeakPolarHBondContact O-CB 3.35Å; P196-A199 PolarHBondContact O-N 3.31Å
197	E	92.6	Very high	94.5	Very high	136 Å²	136	56.7 Å²	56.7	64%	0.636	31%	0.313	S	S	*	.	H	α-helix	trans	-55.4	-33	-178.8	-164.3	-166.5	146.7	0	0	112.7	A199 V200 K201	E197-A199 VanDerWaalsContact C-N 3.25Å; E197-A199 PolarHBondContact O-N 2.83Å; E197-V200 PolarHBondContact O-N 3.3Å; E197-K201 PolarHBondContact O-N 3.4Å; E197-K201 IonicContact OE1-NZ 3.33Å; E197-K201 PolarHBondContact OE1-NZ 2.99Å
198	A	92.9	Very high	94.3	Very high	44 Å²	44	62.4 Å²	62.4	36%	0.364	34%	0.342	S	S	.	.	H	α-helix	trans	-59.9	-33.7	173.2	0	0	0	0	0	113	P196 V200 K201 N202 Y205	P196-A198 PolarHBondContact O-N 3.13Å; P196-A198 VanDerWaalsContact O-N 3.1Å; A198-V200 VanDerWaalsContact C-N 3.35Å; A198-K201 PolarHBondContact O-N 3.38Å; A198-N202 PolarHBondContact O-N 3.19Å; A198-Y205 HydrophobicContact CB-CD2 4.05Å; A198-Y205 HydrophobicContact CB-CE2 4.22Å; A198-Y205 HydrophobicContact CB-CG 4.28Å
199	A	93.3	Very high	94.2	Very high	7 Å²	7	63.5 Å²	63.5	6%	0.058	35%	0.349	C	S	.	.	H	α-helix	trans	-73.8	-24.1	177.9	0	0	0	0	0	113	P196 E197 N202 P203	P196-A199 HydrophobicContact CG-CB 4.34Å; P196-A199 WeakPolarHBondContact O-CA 3.36Å; P196-A199 VanDerWaalsContact O-CB 3.29Å; P196-A199 WeakPolarHBondContact O-CB 3.35Å; P196-A199 PolarHBondContact O-N 3.31Å; E197-A199 VanDerWaalsContact C-N 3.25Å; E197-A199 PolarHBondContact O-N 2.83Å; A199-N202 WeakPolarHBondContact CA-O 3.33Å; A199-N202 CarbonylContact O-C 3.35Å; A199-P203 WeakPolarHBondContact O-CA 3.39Å
200	V	93.7	Very high	94.1	Very high	52 Å²	52	65.8 Å²	65.8	32%	0.315	36%	0.361	S	S	.	.	H	α-helix	trans	-70.1	-41.1	174.2	-177.3	0	0	0	0	110.6	E197 A198	E197-V200 PolarHBondContact O-N 3.3Å; A198-V200 VanDerWaalsContact C-N 3.35Å
201	K	94.9	Very high	94.1	Very high	137 Å²	137	64 Å²	64	60%	0.596	35%	0.35	S	S	*	.	H	α-helix	trans	-78.6	-31.9	177.6	-66.1	174.8	-172.8	155	0	112.5	E197 A198	E197-K201 PolarHBondContact O-N 3.4Å; E197-K201 IonicContact OE1-NZ 3.33Å; E197-K201 PolarHBondContact OE1-NZ 2.99Å; A198-K201 PolarHBondContact O-N 3.38Å
202	N	96.6	Very high	94	Very high	30 Å²	30	66.7 Å²	66.7	16%	0.16	36%	0.364	C	S	.	.			trans	-139.2	92.4	176.6	175.5	18.3	0	0	0	109.7	A198 A199 C204 Y205 T209 C211	A198-N202 PolarHBondContact O-N 3.19Å; A199-N202 WeakPolarHBondContact CA-O 3.33Å; A199-N202 CarbonylContact O-C 3.35Å; N202-C204 PolarHBondContact O-N 3.08Å; N202-C204 WeakPolarHBondContact OD1-CB 3.3Å; N202-C204 PolarHBondContact OD1-N 2.8Å; N202-C204 VanDerWaalsContact OD1-N 3.13Å; N202-Y205 WeakPolarHBondContact O-CB 3.31Å; N202-Y205 PolarHBondContact O-N 3.39Å; N202-T209 PolarHBondContact ND2-O 2.91Å; N202-T209 PolarHBondContact OD1-O 3.19Å; N202-C211 PolarHBondContact OD1-N 2.78Å
203	P	96.4	Very high	94.1	Very high	3 Å²	3	68.8 Å²	68.8	2%	0.019	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-20.9	177.9	-30	38.9	0	0	0	114.4	Y193 A199 Y205 L212 R241	Y193-P203 HydrophobicContact CD2-CB 4.22Å; A199-P203 WeakPolarHBondContact O-CA 3.39Å; P203-Y205 VanDerWaalsContact C-N 3.32Å; P203-L212 WeakPolarHBondContact CD-O 3.35Å; P203-R241 HydrophobicContact CB-CB 3.82Å; P203-R241 VanDerWaalsContact CB-O 3.27Å; P203-R241 WeakPolarHBondContact CB-O 3.24Å; P203-R241 WeakPolarHBondContact O-CD 3.2Å; P203-R241 PolarHBondContact O-NH1 3.28Å
204	C	95.7	Very high	94.2	Very high	0 Å²	0	67 Å²	67	0%	0	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	8.8	178.4	-56.4	0	0	0	0	113.8	Y149 N202 S206 I207 T209 C211	Y149-C204 VanDerWaalsContact CD2-SG 3.54Å; N202-C204 PolarHBondContact O-N 3.08Å; N202-C204 WeakPolarHBondContact OD1-CB 3.3Å; N202-C204 PolarHBondContact OD1-N 2.8Å; N202-C204 VanDerWaalsContact OD1-N 3.13Å; C204-S206 VanDerWaalsContact C-N 3.26Å; C204-S206 PolarHBondContact O-N 2.95Å; C204-I207 HydrophobicContact CB-CD1 3.97Å; C204-I207 HydrophobicContact CB-CG1 3.91Å; C204-I207 WeakPolarHBondContact O-CG1 3.43Å; C204-I207 PolarHBondContact O-N 3.07Å; C204-T209 CarbonylContact C-O 3.59Å; C204-T209 HydrophobicContact CB-CG2 3.49Å; C204-T209 VanDerWaalsContact CB-CG2 3.49Å; C204-T209 PolarHBondContact O-N 2.84Å; C204-C211 HydrophobicContact CB-CB 3.88Å; C204-C211 WeakPolarHBondContact CB-SG 3.26Å; C204-C211 PolarHBondContact N-SG 2.94Å; C204-C211 WeakPolarHBondContact SG-CB 3.48Å; C204-C211 CovalentContact SG-SG 2.03Å; C204-C211 PolarHBondContact SG-SG 3.21Å
205	Y	92.8	Very high	94.3	Very high	128 Å²	128	63.3 Å²	63.3	50%	0.502	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-51.1	-42.7	178.1	172.9	-96.3	0	0	0	113	A198 N202 P203 I207 N208	A198-Y205 HydrophobicContact CB-CD2 4.05Å; A198-Y205 HydrophobicContact CB-CE2 4.22Å; A198-Y205 HydrophobicContact CB-CG 4.28Å; N202-Y205 WeakPolarHBondContact O-CB 3.31Å; N202-Y205 PolarHBondContact O-N 3.39Å; P203-Y205 VanDerWaalsContact C-N 3.32Å; Y205-I207 PolarHBondContact O-N 2.81Å; Y205-N208 PolarHBondContact O-N 3.41Å
206	S	90.4	Very high	94.5	Very high	80 Å²	80	59.2 Å²	59.2	56%	0.559	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-70.4	-13.7	-177	57.7	0	0	0	0	115	C204 R241	C204-S206 VanDerWaalsContact C-N 3.26Å; C204-S206 PolarHBondContact O-N 2.95Å; S206-R241 PolarHBondContact OG-NH1 2.77Å
207	I	91.6	Very high	94.7	Very high	69 Å²	69	56 Å²	56	35%	0.354	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-111.7	18.3	179.1	54.6	164.3	0	0	0	111.7	Y149 C204 Y205 T209	Y149-I207 HydrophobicContact CD1-CD1 4.29Å; Y149-I207 HydrophobicContact CD2-CD1 4.27Å; Y149-I207 HydrophobicContact CE1-CD1 3.76Å; Y149-I207 HydrophobicContact CE2-CD1 3.72Å; Y149-I207 VanDerWaalsContact CZ-CD1 3.45Å; C204-I207 HydrophobicContact CB-CD1 3.97Å; C204-I207 HydrophobicContact CB-CG1 3.91Å; C204-I207 WeakPolarHBondContact O-CG1 3.43Å; C204-I207 PolarHBondContact O-N 3.07Å; Y205-I207 PolarHBondContact O-N 2.81Å; I207-T209 HydrophobicContact CD1-CG2 3.75Å; I207-T209 HydrophobicContact CG1-CG2 3.9Å; I207-T209 PolarHBondContact O-N 3.47Å
208	N	91.1	Very high	95	Very high	160 Å²	160	52.8 Å²	52.8	86%	0.856	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	34.7	176.7	-65.8	-23	0	0	0	114.5	Y205	Y205-N208 PolarHBondContact O-N 3.41Å
209	T	93.6	Very high	95.2	Very high	53 Å²	53	50.8 Å²	50.8	33%	0.325	27%	0.271	S	S	.	.			trans	-131.8	172.4	172	-166.6	0	0	0	0	110.7	Y149 N202 C204 I207	Y149-T209 HydrophobicContact CE2-CG2 3.86Å; N202-T209 PolarHBondContact ND2-O 2.91Å; N202-T209 PolarHBondContact OD1-O 3.19Å; C204-T209 CarbonylContact C-O 3.59Å; C204-T209 HydrophobicContact CB-CG2 3.49Å; C204-T209 VanDerWaalsContact CB-CG2 3.49Å; C204-T209 PolarHBondContact O-N 2.84Å; I207-T209 HydrophobicContact CD1-CG2 3.75Å; I207-T209 HydrophobicContact CG1-CG2 3.9Å; I207-T209 PolarHBondContact O-N 3.47Å
210	T	94.4	Very high	95.4	Very high	103 Å²	103	51.7 Å²	51.7	63%	0.632	28%	0.276	S	S	*	.			trans	-114	124.1	179.8	54.2	0	0	0	0	110.6
211	C	95.4	Very high	95.5	Very high	11 Å²	11	49.5 Å²	49.5	7%	0.074	26%	0.263	C	S	.	.			trans	-133	168.3	172.3	65	0	0	0	0	110.5	N202 C204 V239	N202-C211 PolarHBondContact OD1-N 2.78Å; C204-C211 HydrophobicContact CB-CB 3.88Å; C204-C211 WeakPolarHBondContact CB-SG 3.26Å; C204-C211 PolarHBondContact N-SG 2.94Å; C204-C211 WeakPolarHBondContact SG-CB 3.48Å; C204-C211 CovalentContact SG-SG 2.03Å; C204-C211 PolarHBondContact SG-SG 3.21Å; C211-V239 VanDerWaalsContact CB-O 3.29Å; C211-V239 WeakPolarHBondContact CB-O 3Å
212	L	96.3	Very high	95.6	Very high	58 Å²	58	45.7 Å²	45.7	30%	0.304	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-68.1	153.4	-179.1	-66.7	179.2	0	0	0	111.4	P203 M238 V239 S240	P203-L212 WeakPolarHBondContact CD-O 3.35Å; L212-M238 HydrophobicContact CD1-CB 3.94Å; L212-M238 WeakPolarHBondContact CD1-O 2.93Å; L212-M238 HydrophobicContact CG-CB 3.86Å; L212-V239 PolarHBondContact N-O 2.8Å; L212-S240 PolarHBondContact O-OG 3.12Å
213	P	96.6	Very high	95.6	Very high	68 Å²	68	44.9 Å²	44.9	44%	0.442	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-55.1	147.5	164.2	-21.3	31.4	0	0	0	111.1
214	Q	96.9	Very high	95.5	Very high	11 Å²	11	46 Å²	46	5%	0.051	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-64.5	143.5	178.4	-176.3	170	-17.2	0	0	112.1	V184 D185 K186 Y191 M192 S240 R241	V184-Q214 HydrophobicContact CB-CG 4.49Å; V184-Q214 HydrophobicContact CG1-CG 4.25Å; D185-Q214 PolarHBondContact O-NE2 3.5Å; K186-Q214 PolarHBondContact O-NE2 3.06Å; Y191-Q214 PolarHBondContact O-OE1 2.8Å; M192-Q214 VanDerWaalsContact CB-OE1 3.3Å; M192-Q214 HydrophobicContact CG-CB 3.95Å; M192-Q214 HydrophobicContact CG-CG 4.43Å; M192-Q214 HydrophobicContact SD-CB 3.97Å; Q214-S240 VanDerWaalsContact CA-OG 3.31Å; Q214-S240 WeakPolarHBondContact CA-OG 3.45Å; Q214-S240 PolarHBondContact N-OG 3.02Å; Q214-R241 PolarHBondContact OE1-O 2.92Å
215	F	97.4	Very high	95.2	Very high	18 Å²	18	51.1 Å²	51.1	8%	0.079	28%	0.28	C	S	.	.			trans	-144.3	152.4	177.6	59.5	-88.2	0	0	0	110	L147 A182 V184 D185 K218 M307	L147-F215 HydrophobicContact CB-CZ 4.37Å; L147-F215 HydrophobicContact CD1-CZ 4.32Å; A182-F215 HydrophobicContact CB-CE2 4.03Å; A182-F215 HydrophobicContact CB-CZ 4.09Å; V184-F215 WeakPolarHBondContact CB-O 3.37Å; V184-F215 HydrophobicContact CG2-CD1 4.25Å; V184-F215 HydrophobicContact CG2-CE1 3.8Å; V184-F215 HydrophobicContact CG2-CE2 4.13Å; V184-F215 HydrophobicContact CG2-CZ 3.73Å; V184-F215 PolarHBondContact N-O 2.79Å; D185-F215 PolarHBondContact N-O 3.11Å; D185-F215 CarbonylContact O-C 3.47Å; F215-K218 HydrophobicContact CD2-CB 4.01Å; F215-K218 HydrophobicContact CE2-CB 3.97Å; F215-M307 HydrophobicContact CB-CE 3.5Å; F215-M307 HydrophobicContact CD2-CE 4.44Å; F215-M307 HydrophobicContact CG-CE 4.17Å
216	G	97.7	Very high	95	Very high	6 Å²	6	50.6 Å²	50.6	6%	0.062	28%	0.282	C	S	.	.	S	Bend	trans	-71.2	-78.5	176.6	0	0	0	0	0	111.9	F183 V184 D185	F183-G216 WeakPolarHBondContact CA-O 3.25Å; F183-G216 VanDerWaalsContact CB-O 3.28Å; F183-G216 WeakPolarHBondContact CB-O 3.28Å; V184-G216 PolarHBondContact N-O 2.91Å; V184-G216 VanDerWaalsContact N-O 3.14Å; D185-G216 WeakPolarHBondContact O-CA 3.39Å; D185-G216 PolarHBondContact O-N 2.81Å
217	Y	98.6	Very high	94.4	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140	176.6	169	-119.1	0	0	0	110.8	Y142 L144 A182 F183 H219 A252 Q255 L302 Y308	Y142-Y217 PolarHBondContact OH-OH 3.12Å; L144-Y217 HydrophobicContact CD1-CD2 4.04Å; L144-Y217 HydrophobicContact CD1-CE2 3.56Å; A182-Y217 VanDerWaalsContact O-CD2 3.24Å; A182-Y217 WeakPolarHBondContact O-CD2 3.37Å; F183-Y217 HydrophobicContact CB-CD2 4.5Å; Y217-H219 HydrophobicContact CE1-CB 4.41Å; Y217-A252 HydrophobicContact CD2-CB 3.46Å; Y217-A252 VanDerWaalsContact CD2-CB 3.46Å; Y217-A252 HydrophobicContact CE2-CB 4.18Å; Y217-A252 HydrophobicContact CG-CB 3.81Å; Y217-Q255 HydrophobicContact CD1-CB 3.55Å; Y217-Q255 HydrophobicContact CD1-CG 4.12Å; Y217-Q255 HydrophobicContact CE1-CB 3.56Å; Y217-L302 HydrophobicContact CD1-CD2 3.89Å; Y217-L302 HydrophobicContact CE1-CD1 4.37Å; Y217-L302 HydrophobicContact CE1-CD2 3.77Å; Y217-Y308 PolarHBondContact O-N 2.82Å
218	K	97.7	Very high	94	Very high	69 Å²	69	47.6 Å²	47.6	30%	0.3	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.6	175.7	-178.6	177.9	-178.7	-173.7	0	110.2	G181 A182 F215 V220 N306 M307	G181-K218 WeakPolarHBondContact CA-O 3.14Å; A182-K218 PolarHBondContact N-O 2.93Å; A182-K218 PolarHBondContact O-N 2.78Å; F215-K218 HydrophobicContact CD2-CB 4.01Å; F215-K218 HydrophobicContact CE2-CB 3.97Å; K218-V220 HydrophobicContact CD-CG2 4.29Å; K218-V220 HydrophobicContact CG-CG2 4.12Å; K218-N306 WeakPolarHBondContact CA-O 3.21Å; K218-M307 HydrophobicContact CB-CE 4.44Å; K218-M307 HydrophobicContact CB-SD 3.58Å; K218-M307 VanDerWaalsContact CB-SD 3.58Å; K218-M307 HydrophobicContact CD-SD 3.73Å; K218-M307 HydrophobicContact CG-SD 3.49Å; K218-M307 WeakPolarHBondContact CG-SD 3.46Å
219	H	98.3	Very high	93.9	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	132.3	164.4	172.8	59.1	0	0	0	109.8	Y142 Y217 L221 S222 Q262 I263 L302 N306	Y142-H219 AromaticContact CE2-CE1 3.91Å; Y142-H219 AromaticContact CE2-ND1 3.75Å; Y142-H219 AromaticContact CZ-ND1 3.69Å; Y142-H219 PolarHBondContact OH-ND1 3.41Å; Y217-H219 HydrophobicContact CE1-CB 4.41Å; H219-L221 PolarHBondContact CE1-O 2.97Å; H219-L221 VanDerWaalsContact CE1-O 3.28Å; H219-S222 PolarHBondContact CE1-N 2.82Å; H219-S222 VanDerWaalsContact CE1-N 3.26Å; H219-S222 PolarHBondContact NE2-N 3.02Å; H219-S222 PolarHBondContact NE2-OG 2.73Å; H219-S222 VanDerWaalsContact NE2-OG 3.11Å; H219-Q262 PolarHBondContact NE2-O 2.86Å; H219-I263 HydrophobicContact CB-CD1 4.31Å; H219-I263 VanDerWaalsContact ND1-CD1 3.31Å; H219-I263 WeakPolarHBondContact ND1-CD1 3.44Å; H219-L302 HydrophobicContact CB-CD1 4.01Å; H219-N306 HydrophobicContact CB-CB 4.03Å; H219-N306 PolarHBondContact N-O 3.4Å; H219-N306 WeakPolarHBondContact O-CB 3.39Å
220	V	97.1	Very high	93.7	Very high	26 Å²	26	42.8 Å²	42.8	16%	0.158	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-48.7	-174.1	178.4	0	0	0	0	111.3	F180 K218 E233	F180-V220 HydrophobicContact CD1-CB 3.81Å; F180-V220 HydrophobicContact CD1-CG1 4.1Å; F180-V220 HydrophobicContact CD1-CG2 3.93Å; F180-V220 HydrophobicContact CE1-CG2 4.25Å; F180-V220 WeakPolarHBondContact O-CB 3.38Å; F180-V220 PolarHBondContact O-N 3.11Å; F180-V220 VanDerWaalsContact O-N 3.08Å; K218-V220 HydrophobicContact CD-CG2 4.29Å; K218-V220 HydrophobicContact CG-CG2 4.12Å; V220-E233 HydrophobicContact CG1-CB 4.05Å
221	L	96.5	Very high	93.2	Very high	6 Å²	6	39 Å²	39	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	117.2	-176	178.5	64.5	0	0	0	110.6	G179 F180 H219 T224 R229 F230 E233	G179-L221 CarbonylContact C-O 3.56Å; G179-L221 WeakPolarHBondContact CA-O 3.49Å; F180-L221 HydrophobicContact CB-CB 4.1Å; F180-L221 PolarHBondContact N-O 3.23Å; F180-L221 PolarHBondContact O-N 3.47Å; H219-L221 PolarHBondContact CE1-O 2.97Å; H219-L221 VanDerWaalsContact CE1-O 3.28Å; L221-T224 HydrophobicContact CD1-CG2 4.19Å; L221-T224 HydrophobicContact CD2-CG2 4.33Å; L221-T224 HydrophobicContact CG-CG2 4.43Å; L221-R229 HydrophobicContact CD1-CB 4.45Å; L221-F230 VanDerWaalsContact CD2-CA 3.41Å; L221-F230 HydrophobicContact CD2-CB 3.92Å; L221-F230 HydrophobicContact CD2-CD2 4.29Å; L221-E233 HydrophobicContact CB-CG 4.36Å; L221-E233 HydrophobicContact CD1-CG 4.32Å; L221-E233 HydrophobicContact CD2-CG 4.47Å
222	S	97.3	Very high	93	Very high	58 Å²	58	43.7 Å²	43.7	41%	0.406	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	151.3	169.1	-47	0	0	0	0	111.2	H219 T224 Q262	H219-S222 PolarHBondContact CE1-N 2.82Å; H219-S222 VanDerWaalsContact CE1-N 3.26Å; H219-S222 PolarHBondContact NE2-N 3.02Å; H219-S222 PolarHBondContact NE2-OG 2.73Å; H219-S222 VanDerWaalsContact NE2-OG 3.11Å; S222-T224 PolarHBondContact O-N 2.83Å; S222-T224 VanDerWaalsContact O-N 3.08Å; S222-Q262 PolarHBondContact OG-O 2.51Å
223	L	95.9	Very high	92.8	Very high	13 Å²	13	42.6 Å²	42.6	7%	0.068	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	113.5	-179.7	-74.7	162.3	0	0	0	111.3	D140 L141 R177 M178 I263 W265	D140-L223 HydrophobicContact CB-CD1 3.95Å; D140-L223 HydrophobicContact CB-CD2 4.04Å; L141-L223 WeakPolarHBondContact O-CD2 3.48Å; R177-L223 HydrophobicContact CB-CB 4.1Å; R177-L223 HydrophobicContact CB-CD2 4.28Å; M178-L223 WeakPolarHBondContact O-CA 3.27Å; L223-I263 WeakPolarHBondContact CB-O 3.2Å; L223-I263 HydrophobicContact CD1-CG2 4.01Å; L223-I263 HydrophobicContact CG-CG2 4.37Å; L223-I263 WeakPolarHBondContact CG-O 3.44Å; L223-I263 PolarHBondContact N-O 3.04Å; L223-W265 HydrophobicContact CD1-CD2 3.73Å; L223-W265 HydrophobicContact CD1-CE3 3.48Å; L223-W265 VanDerWaalsContact CD1-CE3 3.48Å; L223-W265 HydrophobicContact CD1-CG 4.22Å; L223-W265 HydrophobicContact CD1-CZ3 3.92Å
224	T	93.4	Very high	92.5	Very high	27 Å²	27	39.3 Å²	39.3	17%	0.166	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	152.7	-178.6	-176.4	0	0	0	0	111.6	R177 M178 L221 S222 E226 R229	R177-T224 CarbonylContact C-O 3.55Å; R177-T224 VanDerWaalsContact CA-O 3.26Å; R177-T224 WeakPolarHBondContact CA-O 3.47Å; M178-T224 PolarHBondContact N-O 3.49Å; M178-T224 PolarHBondContact O-N 2.87Å; L221-T224 HydrophobicContact CD1-CG2 4.19Å; L221-T224 HydrophobicContact CD2-CG2 4.33Å; L221-T224 HydrophobicContact CG-CG2 4.43Å; S222-T224 PolarHBondContact O-N 2.83Å; S222-T224 VanDerWaalsContact O-N 3.08Å; T224-E226 HydrophobicContact CG2-CB 4.37Å; T224-E226 PolarHBondContact OG1-N 2.9Å; T224-R229 HydrophobicContact CG2-CB 4.49Å
225	E	89.5	Confident	92.2	Very high	107 Å²	107	44.8 Å²	44.8	50%	0.5	23%	0.23	S	C	.	.	S	Bend	trans	-76.5	-17.7	173.5	-63.5	171.5	-162	0	0	111.1	R177 V227	R177-E225 HydrophobicContact CG-CG 3.65Å; R177-E225 IonicContact CZ-OE1 3.67Å; R177-E225 IonicContact NE-OE1 3.94Å; R177-E225 PolarHBondContact NE-OE1 3.39Å; R177-E225 VanDerWaalsContact NE-OE1 3.07Å; R177-E225 IonicContact NH2-OE1 3.56Å; R177-E225 PolarHBondContact NH2-OE1 3.19Å; E225-V227 PolarHBondContact O-N 3.24Å
226	E	88.3	Confident	92.1	Very high	117 Å²	117	50.1 Å²	50.1	55%	0.547	25%	0.252	S	S	.	.			trans	-80.1	84.9	179.8	-66.9	179.5	-178.8	0	0	112.1	T224 G228 R229	T224-E226 HydrophobicContact CG2-CB 4.37Å; T224-E226 PolarHBondContact OG1-N 2.9Å; E226-G228 PolarHBondContact O-N 3.01Å; E226-G228 VanDerWaalsContact O-N 3.11Å; E226-R229 HydrophobicContact CB-CB 4.49Å; E226-R229 HydrophobicContact CB-CG 4.12Å; E226-R229 WeakPolarHBondContact O-CB 3.15Å; E226-R229 PolarHBondContact O-N 3.05Å; E226-R229 WeakPolarHBondContact OE2-CD 3.01Å; E226-R229 WeakPolarHBondContact OE2-CG 3.4Å
227	V	78.6	Confident	91.9	Very high	42 Å²	42	50.3 Å²	50.3	26%	0.255	25%	0.252	S	S	.	.	H	α-helix	trans	-50.9	-35.4	176.2	169.2	0	0	0	0	113.4	A166 M178 E225 R229 F230 T231	A166-V227 HydrophobicContact CB-CB 3.93Å; A166-V227 HydrophobicContact CB-CG1 3.14Å; A166-V227 HydrophobicContact CB-CG2 3.49Å; A166-V227 VanDerWaalsContact CB-CG2 3.49Å; M178-V227 HydrophobicContact SD-CG2 4.34Å; E225-V227 PolarHBondContact O-N 3.24Å; V227-R229 PolarHBondContact O-N 3.48Å; V227-F230 WeakPolarHBondContact O-CB 3.48Å; V227-F230 PolarHBondContact O-N 3.15Å; V227-F230 VanDerWaalsContact O-N 3.16Å; V227-T231 PolarHBondContact O-N 2.63Å
228	G	83.4	Confident	91.7	Very high	44 Å²	44	54.4 Å²	54.4	45%	0.454	27%	0.272	S	S	.	.	H	α-helix	trans	-55.5	-40.7	178.4	0	0	0	0	0	112.3	E226 F230 T231 E232	E226-G228 PolarHBondContact O-N 3.01Å; E226-G228 VanDerWaalsContact O-N 3.11Å; G228-F230 VanDerWaalsContact C-N 3.34Å; G228-F230 PolarHBondContact O-N 2.71Å; G228-T231 PolarHBondContact O-N 2.84Å; G228-E232 WeakPolarHBondContact O-CG 3.49Å; G228-E232 PolarHBondContact O-N 3.36Å
229	R	89.3	Confident	91.7	Very high	112 Å²	112	51.5 Å²	51.5	42%	0.423	26%	0.26	S	S	.	.	H	α-helix	trans	-64.4	-36.2	179.4	-70.4	-169.7	64.6	-171.5	-0.6	112.8	L221 T224 E226 V227 T231 E232 E233	L221-R229 HydrophobicContact CD1-CB 4.45Å; T224-R229 HydrophobicContact CG2-CB 4.49Å; E226-R229 HydrophobicContact CB-CB 4.49Å; E226-R229 HydrophobicContact CB-CG 4.12Å; E226-R229 WeakPolarHBondContact O-CB 3.15Å; E226-R229 PolarHBondContact O-N 3.05Å; E226-R229 WeakPolarHBondContact OE2-CD 3.01Å; E226-R229 WeakPolarHBondContact OE2-CG 3.4Å; V227-R229 PolarHBondContact O-N 3.48Å; R229-T231 VanDerWaalsContact C-N 3.32Å; R229-T231 PolarHBondContact O-N 2.89Å; R229-E232 PolarHBondContact O-N 3.44Å; R229-E233 WeakPolarHBondContact O-CG 3.49Å; R229-E233 PolarHBondContact O-N 3.36Å
230	F	88.3	Confident	91.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.2	-48.6	174	178.1	-90.2	0	0	0	111.1	Y143 M178 F180 L221 V227 G228 E232 E233 V234	Y143-F230 HydrophobicContact CG-CZ 4.3Å; M178-F230 HydrophobicContact CB-CD2 4.31Å; M178-F230 HydrophobicContact CE-CD1 4.16Å; M178-F230 HydrophobicContact CE-CD2 4.3Å; M178-F230 HydrophobicContact CE-CE1 4.22Å; M178-F230 HydrophobicContact CE-CE2 4.33Å; M178-F230 HydrophobicContact CE-CG 4.21Å; M178-F230 HydrophobicContact CE-CZ 4.3Å; F180-F230 HydrophobicContact CB-CD2 4.1Å; F180-F230 HydrophobicContact CB-CE2 3.86Å; F180-F230 AromaticContact CD2-CE2 3.84Å; F180-F230 HydrophobicContact CD2-CE2 3.84Å; F180-F230 HydrophobicContact CD2-CZ 4.1Å; F180-F230 HydrophobicContact CG-CE2 4.28Å; L221-F230 VanDerWaalsContact CD2-CA 3.41Å; L221-F230 HydrophobicContact CD2-CB 3.92Å; L221-F230 HydrophobicContact CD2-CD2 4.29Å; V227-F230 WeakPolarHBondContact O-CB 3.48Å; V227-F230 PolarHBondContact O-N 3.15Å; V227-F230 VanDerWaalsContact O-N 3.16Å; G228-F230 VanDerWaalsContact C-N 3.34Å; G228-F230 PolarHBondContact O-N 2.71Å; F230-E232 VanDerWaalsContact C-N 3.32Å; F230-E232 PolarHBondContact O-N 3.47Å; F230-E233 PolarHBondContact O-N 2.84Å; F230-V234 HydrophobicContact CD1-CG2 4.19Å; F230-V234 HydrophobicContact CE1-CG2 3.84Å; F230-V234 HydrophobicContact CE2-CG2 4.21Å; F230-V234 HydrophobicContact CZ-CG2 3.85Å; F230-V234 WeakPolarHBondContact O-CB 3.4Å; F230-V234 VanDerWaalsContact O-CG2 3.24Å; F230-V234 WeakPolarHBondContact O-CG2 3.37Å; F230-V234 PolarHBondContact O-N 2.86Å
231	T	85.1	Confident	91.6	Very high	22 Å²	22	52.4 Å²	52.4	14%	0.135	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-37.2	-179.2	-54.7	0	0	0	0	111.6	V227 G228 R229 K235	V227-T231 PolarHBondContact O-N 2.63Å; G228-T231 PolarHBondContact O-N 2.84Å; R229-T231 VanDerWaalsContact C-N 3.32Å; R229-T231 PolarHBondContact O-N 2.89Å; T231-K235 HydrophobicContact CG2-CD 4.49Å; T231-K235 VanDerWaalsContact O-CG 3.27Å; T231-K235 WeakPolarHBondContact O-CG 3.46Å; T231-K235 PolarHBondContact O-N 3.36Å
232	E	90.4	Very high	91.5	Very high	111 Å²	111	52.9 Å²	52.9	52%	0.519	26%	0.263	S	S	.	.	H	α-helix	trans	-66	-45.5	176.2	-71.4	175.3	-173.5	0	0	112.6	G228 R229 F230 K235 K236	G228-E232 WeakPolarHBondContact O-CG 3.49Å; G228-E232 PolarHBondContact O-N 3.36Å; R229-E232 PolarHBondContact O-N 3.44Å; F230-E232 VanDerWaalsContact C-N 3.32Å; F230-E232 PolarHBondContact O-N 3.47Å; E232-K235 PolarHBondContact O-N 3.37Å; E232-K236 WeakPolarHBondContact O-CG 3.47Å; E232-K236 PolarHBondContact O-N 2.93Å
233	E	92.8	Very high	91.3	Very high	34 Å²	34	57.4 Å²	57.4	16%	0.159	27%	0.271	C	S	.	.	H	α-helix	trans	-69.3	-38.8	-179.5	-68.8	-50.7	139	0	0	112.3	V220 L221 R229 F230 K235 K236 Q237	V220-E233 HydrophobicContact CG1-CB 4.05Å; L221-E233 HydrophobicContact CB-CG 4.36Å; L221-E233 HydrophobicContact CD1-CG 4.32Å; L221-E233 HydrophobicContact CD2-CG 4.47Å; R229-E233 WeakPolarHBondContact O-CG 3.49Å; R229-E233 PolarHBondContact O-N 3.36Å; F230-E233 PolarHBondContact O-N 2.84Å; E233-K235 VanDerWaalsContact C-N 3.29Å; E233-K235 PolarHBondContact O-N 3.28Å; E233-K236 WeakPolarHBondContact O-CB 3.29Å; E233-K236 PolarHBondContact O-N 2.92Å; E233-K236 VanDerWaalsContact O-N 3.13Å; E233-K236 IonicContact OE1-NZ 4Å; E233-K236 PolarHBondContact OE1-NZ 3.25Å; E233-K236 IonicContact OE2-NZ 2.7Å; E233-Q237 WeakPolarHBondContact O-CG 3.49Å; E233-Q237 PolarHBondContact O-N 2.81Å; E233-Q237 PolarHBondContact O-NE2 3.06Å
234	V	90.4	Very high	91.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-36	175.3	173.4	0	0	0	0	111.5	L155 L158 R159 F180 F230 K236 Q237	L155-V234 HydrophobicContact CD1-CG1 3.99Å; L158-V234 HydrophobicContact CB-CG1 4.27Å; L158-V234 HydrophobicContact CD2-CG1 3.96Å; L158-V234 HydrophobicContact CD2-CG2 4.35Å; L158-V234 HydrophobicContact CG-CG1 3.99Å; R159-V234 HydrophobicContact CG-CG1 3.87Å; F180-V234 HydrophobicContact CD1-CG2 4.46Å; F180-V234 HydrophobicContact CD2-CG2 3.73Å; F180-V234 HydrophobicContact CE2-CG2 3.92Å; F180-V234 HydrophobicContact CG-CG2 4.03Å; F180-V234 HydrophobicContact CZ-CG2 4.4Å; F230-V234 HydrophobicContact CD1-CG2 4.19Å; F230-V234 HydrophobicContact CE1-CG2 3.84Å; F230-V234 HydrophobicContact CE2-CG2 4.21Å; F230-V234 HydrophobicContact CZ-CG2 3.85Å; F230-V234 WeakPolarHBondContact O-CB 3.4Å; F230-V234 VanDerWaalsContact O-CG2 3.24Å; F230-V234 WeakPolarHBondContact O-CG2 3.37Å; F230-V234 PolarHBondContact O-N 2.86Å; V234-K236 PolarHBondContact O-N 2.84Å; V234-Q237 PolarHBondContact O-N 2.88Å
235	K	90.8	Very high	91.3	Very high	126 Å²	126	61.1 Å²	61.1	55%	0.548	30%	0.299	S	S	.	.	H	α-helix	trans	-63.7	-28.6	175.6	-78.5	173	-179.7	177.6	0	113.3	R159 T231 E232 E233 Q237	R159-K235 HydrophobicContact CB-CG 4.1Å; R159-K235 HydrophobicContact CG-CG 3.9Å; T231-K235 HydrophobicContact CG2-CD 4.49Å; T231-K235 VanDerWaalsContact O-CG 3.27Å; T231-K235 WeakPolarHBondContact O-CG 3.46Å; T231-K235 PolarHBondContact O-N 3.36Å; E232-K235 PolarHBondContact O-N 3.37Å; E233-K235 VanDerWaalsContact C-N 3.29Å; E233-K235 PolarHBondContact O-N 3.28Å; K235-Q237 VanDerWaalsContact C-N 3.35Å
236	K	94.1	Very high	91.6	Very high	129 Å²	129	57.5 Å²	57.5	56%	0.561	29%	0.285	S	S	*	.	H	α-helix	trans	-79.8	-15.6	178.8	-63.2	170.4	-166.4	169.8	0	113.3	E232 E233 V234	E232-K236 WeakPolarHBondContact O-CG 3.47Å; E232-K236 PolarHBondContact O-N 2.93Å; E233-K236 WeakPolarHBondContact O-CB 3.29Å; E233-K236 PolarHBondContact O-N 2.92Å; E233-K236 VanDerWaalsContact O-N 3.13Å; E233-K236 IonicContact OE1-NZ 4Å; E233-K236 PolarHBondContact OE1-NZ 3.25Å; E233-K236 IonicContact OE2-NZ 2.7Å; V234-K236 PolarHBondContact O-N 2.84Å
237	Q	94.5	Very high	92.1	Very high	11 Å²	11	52.3 Å²	52.3	5%	0.051	26%	0.261	C	S	.	.			trans	-76	152.7	-178.3	-53.5	-46.4	-58.7	0	0	111.4	L147 L155 R159 F180 E233 V234 K235	L147-Q237 HydrophobicContact CD1-CB 4.14Å; L155-Q237 HydrophobicContact CD1-CB 4.28Å; L155-Q237 HydrophobicContact CD2-CB 4.39Å; R159-Q237 PolarHBondContact NH2-O 2.74Å; F180-Q237 HydrophobicContact CD1-CG 4.42Å; F180-Q237 HydrophobicContact CE1-CG 3.73Å; F180-Q237 HydrophobicContact CZ-CG 4.4Å; E233-Q237 WeakPolarHBondContact O-CG 3.49Å; E233-Q237 PolarHBondContact O-N 2.81Å; E233-Q237 PolarHBondContact O-NE2 3.06Å; V234-Q237 PolarHBondContact O-N 2.88Å; K235-Q237 VanDerWaalsContact C-N 3.35Å
238	M	94.8	Very high	93	Very high	86 Å²	86	50.4 Å²	50.4	42%	0.424	25%	0.25	S	C	.	.			trans	-136.3	150.4	173.8	-70.5	-179.7	65.5	0	0	108.3	L212	L212-M238 HydrophobicContact CD1-CB 3.94Å; L212-M238 WeakPolarHBondContact CD1-O 2.93Å; L212-M238 HydrophobicContact CG-CB 3.86Å
239	V	96.5	Very high	93.7	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.048	23%	0.228	C	C	.	.			trans	-69.5	164	175	-63.9	0	0	0	0	111.8	L147 Y149 N152 L155 C211 L212	L147-V239 CarbonylContact O-C 3.5Å; L147-V239 WeakPolarHBondContact O-CA 3.46Å; Y149-V239 HydrophobicContact CD2-CG2 4.13Å; N152-V239 HydrophobicContact CB-CG1 3.87Å; N152-V239 HydrophobicContact CB-CG2 4.06Å; L155-V239 HydrophobicContact CD2-CG1 4.23Å; C211-V239 VanDerWaalsContact CB-O 3.29Å; C211-V239 WeakPolarHBondContact CB-O 3Å; L212-V239 PolarHBondContact N-O 2.8Å
240	S	97.2	Very high	94.1	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.			trans	-118.9	-167.9	169.9	-175	0	0	0	0	109.1	L147 S148 Y149 L212 Q214	L147-S240 PolarHBondContact O-N 3.37Å; S148-S240 CarbonylContact C-O 3.59Å; Y149-S240 VanDerWaalsContact CA-O 3.29Å; Y149-S240 WeakPolarHBondContact CA-O 3.16Å; Y149-S240 WeakPolarHBondContact CB-O 3.49Å; Y149-S240 PolarHBondContact N-O 2.69Å; L212-S240 PolarHBondContact O-OG 3.12Å; Q214-S240 VanDerWaalsContact CA-OG 3.31Å; Q214-S240 WeakPolarHBondContact CA-OG 3.45Å; Q214-S240 PolarHBondContact N-OG 3.02Å
241	R	96.1	Very high	94.6	Very high	47 Å²	47	43.1 Å²	43.1	18%	0.177	21%	0.209	C	C	.	.			trans	-149.2	132.5	171.3	-172.7	-168.5	176	-175	7.2	111	Y193 P203 S206 Q214	Y193-R241 HydrophobicContact CE2-CG 4.08Å; P203-R241 HydrophobicContact CB-CB 3.82Å; P203-R241 VanDerWaalsContact CB-O 3.27Å; P203-R241 WeakPolarHBondContact CB-O 3.24Å; P203-R241 WeakPolarHBondContact O-CD 3.2Å; P203-R241 PolarHBondContact O-NH1 3.28Å; S206-R241 PolarHBondContact OG-NH1 2.77Å; Q214-R241 PolarHBondContact OE1-O 2.92Å
242	N	94.4	Very high	95.2	Very high	16 Å²	16	42 Å²	42	9%	0.086	20%	0.202	C	C	.	.			trans	-106	173.3	173.6	61.2	-44	0	0	0	110.8	V184 Y193 D244 E247	V184-N242 HydrophobicContact CG1-CB 4.05Å; Y193-N242 VanDerWaalsContact CE2-O 3.29Å; Y193-N242 WeakPolarHBondContact CE2-O 3.31Å; N242-D244 PolarHBondContact ND2-O 2.88Å; N242-E247 VanDerWaalsContact CG-OE1 3.29Å; N242-E247 VanDerWaalsContact CG-OE2 3.3Å; N242-E247 PolarHBondContact ND2-OE1 3.36Å; N242-E247 PolarHBondContact ND2-OE2 2.93Å; N242-E247 PolarHBondContact OD1-OE1 2.86Å
243	R	94.6	Very high	95.6	Very high	153 Å²	153	36.8 Å²	36.8	58%	0.577	18%	0.177	S	C	*	.	S	Bend	trans	-99.3	-46.4	-170.6	-174.3	177.5	-178.9	171.5	-0.6	113.8	P190 Y191 Y193	P190-R243 WeakPolarHBondContact O-CD 3.47Å; Y191-R243 VanDerWaalsContact O-CB 3.29Å; Y191-R243 WeakPolarHBondContact O-CB 3.21Å; Y191-R243 PolarHBondContact O-N 3.02Å; Y193-R243 HydrophobicContact CE1-CB 4.4Å; Y193-R243 HydrophobicContact CE1-CG 4.13Å; Y193-R243 HydrophobicContact CE2-CB 4.26Å
244	D	94.6	Very high	95.9	Very high	54 Å²	54	35.1 Å²	35.1	29%	0.289	17%	0.17	S	C	.	.	S	Bend	trans	-92	-178.9	176	58.1	-35.9	0	0	0	111.4	Y191 N242 H282	Y191-D244 WeakPolarHBondContact CA-OD1 3.32Å; N242-D244 PolarHBondContact ND2-O 2.88Å; D244-H282 IonicContact OD2-CE1 3.77Å; D244-H282 IonicContact OD2-NE2 2.73Å; D244-H282 PolarHBondContact OD2-NE2 2.99Å
245	A	94	Very high	96.2	Very high	65 Å²	65	35.1 Å²	35.1	54%	0.537	17%	0.17	S	C	.	.	S	Bend	trans	-95.2	-32.8	-172.4	0	0	0	0	0	114.8
246	P	96.8	Very high	96.6	Very high	31 Å²	31	29.1 Å²	29.1	20%	0.201	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	146.6	172.1	-12.6	29.2	0	0	0	111.3	K280	P246-K280 CarbonylContact C-O 3.49Å; P246-K280 WeakPolarHBondContact CA-O 3Å; P246-K280 HydrophobicContact CB-CB 4.25Å
247	E	97.4	Very high	96.7	Very high	7 Å²	7	23 Å²	23	3%	0.033	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	165.7	-178.5	-54.8	-62.4	166.4	0	0	112	F183 N242 G249 A279 K280 T281 H282	F183-E247 HydrophobicContact CE2-CB 4.24Å; N242-E247 VanDerWaalsContact CG-OE1 3.29Å; N242-E247 VanDerWaalsContact CG-OE2 3.3Å; N242-E247 PolarHBondContact ND2-OE1 3.36Å; N242-E247 PolarHBondContact ND2-OE2 2.93Å; N242-E247 PolarHBondContact OD1-OE1 2.86Å; E247-G249 PolarHBondContact O-N 3.44Å; E247-G249 VanDerWaalsContact O-N 3.15Å; E247-A279 HydrophobicContact CG-CB 4.06Å; E247-K280 PolarHBondContact N-O 2.86Å; E247-T281 CarbonylContact O-C 3.6Å; E247-T281 WeakPolarHBondContact O-CA 3.43Å; E247-T281 PolarHBondContact O-OG1 3.22Å; E247-H282 PolarHBondContact O-N 2.85Å
248	G	97.6	Very high	96.9	Very high	2 Å²	2	23.6 Å²	23.6	2%	0.021	12%	0.122	C	C	.	.			trans	-85	29.7	-178.8	0	0	0	0	0	115	V184 D185 F250 D251	V184-G248 PolarHBondContact O-N 3.37Å; D185-G248 VanDerWaalsContact OD1-CA 3.26Å; D185-G248 WeakPolarHBondContact OD1-CA 3.49Å; D185-G248 PolarHBondContact OD1-N 2.93Å; G248-F250 VanDerWaalsContact C-N 3.26Å; G248-F250 PolarHBondContact O-N 3.05Å; G248-D251 PolarHBondContact O-N 2.79Å
249	G	97.7	Very high	97	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.2	-32.8	-172	0	0	0	0	0	114.8	F183 E247 A252 I253	F183-G249 VanDerWaalsContact CD2-CA 3.5Å; F183-G249 VanDerWaalsContact CE2-CA 3.41Å; E247-G249 PolarHBondContact O-N 3.44Å; E247-G249 VanDerWaalsContact O-N 3.15Å; G249-A252 WeakPolarHBondContact O-CB 2.74Å; G249-A252 PolarHBondContact O-N 3.45Å; G249-I253 WeakPolarHBondContact O-CG1 3.23Å; G249-I253 PolarHBondContact O-N 3.06Å
250	F	98.4	Very high	96.9	Very high	1 Å²	1	23.9 Å²	23.9	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-69.1	-32.3	-179.2	-81.9	9.9	0	0	0	114	G248 A252 I253 I254 T281 H282 V283 P317 L319 I322 F335 Y348	G248-F250 VanDerWaalsContact C-N 3.26Å; G248-F250 PolarHBondContact O-N 3.05Å; F250-A252 VanDerWaalsContact C-N 3.29Å; F250-A252 PolarHBondContact O-N 3.35Å; F250-I253 HydrophobicContact CD1-CD1 3.84Å; F250-I253 HydrophobicContact CE1-CD1 4.18Å; F250-I253 PolarHBondContact O-N 2.87Å; F250-I254 PolarHBondContact O-N 3.44Å; F250-I254 VanDerWaalsContact O-N 3.15Å; F250-T281 HydrophobicContact CD1-CG2 3.9Å; F250-T281 WeakPolarHBondContact CD1-OG1 3.2Å; F250-T281 HydrophobicContact CD2-CG2 4.3Å; F250-T281 HydrophobicContact CE1-CG2 3.55Å; F250-T281 HydrophobicContact CE2-CG2 3.95Å; F250-T281 HydrophobicContact CG-CG2 4.3Å; F250-T281 HydrophobicContact CZ-CG2 3.57Å; F250-H282 WeakPolarHBondContact CD2-O 3.1Å; F250-V283 HydrophobicContact CD2-CG1 4.34Å; F250-V283 HydrophobicContact CE2-CG1 4.02Å; F250-P317 HydrophobicContact CB-CG 3.89Å; F250-P317 VanDerWaalsContact O-CG 3.3Å; F250-P317 WeakPolarHBondContact O-CG 3.1Å; F250-L319 HydrophobicContact CE2-CD2 3.53Å; F250-L319 HydrophobicContact CZ-CD2 3.82Å; F250-I322 HydrophobicContact CB-CD1 4.07Å; F250-I322 HydrophobicContact CD1-CD1 4.08Å; F250-I322 HydrophobicContact CD2-CD1 3.53Å; F250-I322 HydrophobicContact CE1-CD1 4.36Å; F250-I322 HydrophobicContact CE2-CD1 3.89Å; F250-I322 HydrophobicContact CG-CD1 3.63Å; F250-I322 HydrophobicContact CZ-CD1 4.28Å; F250-F335 HydrophobicContact CE1-CE1 4.33Å; F250-Y348 HydrophobicContact CZ-CD2 4.17Å; F250-Y348 HydrophobicContact CZ-CE2 4.26Å
251	D	98.5	Very high	96.8	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.011	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-44.9	170.5	-89.4	-16.7	0	0	0	110.3	K186 G248 I253 I254 Q255 Y308 P317	K186-D251 IonicContact NZ-OD1 2.83Å; K186-D251 IonicContact NZ-OD2 3.36Å; K186-D251 PolarHBondContact NZ-OD2 3.33Å; G248-D251 PolarHBondContact O-N 2.79Å; D251-I253 PolarHBondContact O-N 3.33Å; D251-I254 PolarHBondContact O-N 3.34Å; D251-Q255 WeakPolarHBondContact O-CG 3.24Å; D251-Q255 PolarHBondContact O-N 2.87Å; D251-Y308 HydrophobicContact CB-CD1 4.31Å; D251-Y308 HydrophobicContact CB-CE1 4.02Å; D251-Y308 WeakPolarHBondContact OD2-CE1 3.33Å; D251-P317 WeakPolarHBondContact OD1-CD 3.37Å
252	A	98.5	Very high	96.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66	-39.2	-178.5	0	0	0	0	0	112.4	L144 F183 Y217 G249 F250 Q255 A256	L144-A252 HydrophobicContact CD1-CB 3.96Å; L144-A252 HydrophobicContact CD2-CB 3.87Å; L144-A252 HydrophobicContact CG-CB 4.34Å; F183-A252 HydrophobicContact CB-CB 3.63Å; F183-A252 HydrophobicContact CD1-CB 3.97Å; F183-A252 HydrophobicContact CG-CB 3.92Å; Y217-A252 HydrophobicContact CD2-CB 3.46Å; Y217-A252 VanDerWaalsContact CD2-CB 3.46Å; Y217-A252 HydrophobicContact CE2-CB 4.18Å; Y217-A252 HydrophobicContact CG-CB 3.81Å; G249-A252 WeakPolarHBondContact O-CB 2.74Å; G249-A252 PolarHBondContact O-N 3.45Å; F250-A252 VanDerWaalsContact C-N 3.29Å; F250-A252 PolarHBondContact O-N 3.35Å; A252-Q255 PolarHBondContact O-N 2.87Å; A252-A256 VanDerWaalsContact O-CB 3.23Å; A252-A256 WeakPolarHBondContact O-CB 3.22Å; A252-A256 PolarHBondContact O-N 3.39Å
253	I	98.4	Very high	96.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-49.1	174.3	-74	173.8	0	0	0	111.1	L144 G249 F250 D251 A256 A257 L273 F275 I322 M326 L333 F335	L144-I253 HydrophobicContact CD2-CG1 3.86Å; G249-I253 WeakPolarHBondContact O-CG1 3.23Å; G249-I253 PolarHBondContact O-N 3.06Å; F250-I253 HydrophobicContact CD1-CD1 3.84Å; F250-I253 HydrophobicContact CE1-CD1 4.18Å; F250-I253 PolarHBondContact O-N 2.87Å; D251-I253 PolarHBondContact O-N 3.33Å; I253-A256 PolarHBondContact O-N 2.7Å; I253-A257 PolarHBondContact O-N 2.95Å; I253-A257 VanDerWaalsContact O-N 3.09Å; I253-L273 HydrophobicContact CG1-CD2 4.5Å; I253-L273 HydrophobicContact CG2-CD2 4.21Å; I253-F275 HydrophobicContact CD1-CB 4.48Å; I253-F275 HydrophobicContact CD1-CD2 3.62Å; I253-F275 HydrophobicContact CD1-CE2 4.01Å; I253-F275 HydrophobicContact CD1-CG 4.11Å; I253-F275 HydrophobicContact CG1-CD2 3.79Å; I253-F275 HydrophobicContact CG1-CE2 4.3Å; I253-I322 HydrophobicContact CG2-CG2 4.22Å; I253-M326 HydrophobicContact CG2-CE 3.25Å; I253-M326 HydrophobicContact CG2-SD 4.33Å; I253-L333 HydrophobicContact CD1-CD1 3.95Å; I253-L333 HydrophobicContact CD1-CD2 3.96Å; I253-L333 HydrophobicContact CG1-CD1 4.21Å; I253-L333 HydrophobicContact CG2-CD2 4.18Å; I253-F335 HydrophobicContact CD1-CE1 4.15Å
254	I	98	Very high	97	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.2	-50.3	178.8	-77.5	-62.6	0	0	0	110.5	F250 D251 A256 A257 V258 P317 L321 I322 K325	F250-I254 PolarHBondContact O-N 3.44Å; F250-I254 VanDerWaalsContact O-N 3.15Å; D251-I254 PolarHBondContact O-N 3.34Å; I254-A256 VanDerWaalsContact C-N 3.31Å; I254-A256 PolarHBondContact O-N 3.09Å; I254-A257 PolarHBondContact O-N 3.17Å; I254-V258 HydrophobicContact CG2-CG1 4.34Å; I254-V258 HydrophobicContact CG2-CG2 4.34Å; I254-V258 VanDerWaalsContact O-CG2 3.29Å; I254-V258 WeakPolarHBondContact O-CG2 3.29Å; I254-V258 PolarHBondContact O-N 3.31Å; I254-P317 HydrophobicContact CB-CG 4.31Å; I254-P317 HydrophobicContact CD1-CB 4.38Å; I254-P317 HydrophobicContact CG1-CB 3.57Å; I254-P317 HydrophobicContact CG1-CG 3.5Å; I254-L321 HydrophobicContact CD1-CG 4.43Å; I254-I322 HydrophobicContact CD1-CB 4.38Å; I254-I322 HydrophobicContact CD1-CG1 3.87Å; I254-I322 HydrophobicContact CG1-CG1 4Å; I254-K325 HydrophobicContact CD1-CB 3.99Å; I254-K325 HydrophobicContact CD1-CG 4.17Å
255	Q	98.4	Very high	97	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-40.9	-178.8	-68.1	-58.1	-57.7	0	0	111.8	Y217 D251 A252 A257 C259 Q299 Y308	Y217-Q255 HydrophobicContact CD1-CB 3.55Å; Y217-Q255 HydrophobicContact CD1-CG 4.12Å; Y217-Q255 HydrophobicContact CE1-CB 3.56Å; D251-Q255 WeakPolarHBondContact O-CG 3.24Å; D251-Q255 PolarHBondContact O-N 2.87Å; A252-Q255 PolarHBondContact O-N 2.87Å; Q255-A257 VanDerWaalsContact C-N 3.28Å; Q255-A257 PolarHBondContact O-N 2.93Å; Q255-C259 WeakPolarHBondContact O-CB 2.95Å; Q255-C259 PolarHBondContact O-N 2.88Å; Q255-C259 PolarHBondContact O-SG 3Å; Q255-C259 VanDerWaalsContact O-SG 3.33Å; Q255-C259 PolarHBondContact OE1-SG 3.17Å; Q255-Q299 PolarHBondContact NE2-O 3.21Å; Q255-Y308 HydrophobicContact CG-CD2 3.63Å; Q255-Y308 HydrophobicContact CG-CE2 3.9Å; Q255-Y308 HydrophobicContact CG-CG 3.98Å
256	A	98.3	Very high	96.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-30.8	175.8	0	0	0	0	0	113.2	Y142 A252 I253 I254 W265 L273	Y142-A256 HydrophobicContact CD1-CB 4.17Å; Y142-A256 HydrophobicContact CE1-CB 3.98Å; A252-A256 VanDerWaalsContact O-CB 3.23Å; A252-A256 WeakPolarHBondContact O-CB 3.22Å; A252-A256 PolarHBondContact O-N 3.39Å; I253-A256 PolarHBondContact O-N 2.7Å; I254-A256 VanDerWaalsContact C-N 3.31Å; I254-A256 PolarHBondContact O-N 3.09Å; A256-W265 PolarHBondContact O-NE1 3.48Å; A256-L273 HydrophobicContact CB-CD1 4.05Å; A256-L273 HydrophobicContact CB-CD2 4.35Å
257	A	97	Very high	96.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-81.6	-40	178.7	0	0	0	0	0	113.4	I253 I254 Q255 M326 N329 I331	I253-A257 PolarHBondContact O-N 2.95Å; I253-A257 VanDerWaalsContact O-N 3.09Å; I254-A257 PolarHBondContact O-N 3.17Å; Q255-A257 VanDerWaalsContact C-N 3.28Å; Q255-A257 PolarHBondContact O-N 2.93Å; A257-M326 HydrophobicContact CB-CE 3.34Å; A257-M326 HydrophobicContact CB-SD 4.09Å; A257-N329 PolarHBondContact O-ND2 3.09Å; A257-I331 HydrophobicContact CB-CG1 4.03Å
258	V	97.8	Very high	95.6	Very high	24 Å²	24	27.6 Å²	27.6	15%	0.145	15%	0.15	C	C	.	.	H	α-helix	trans	-89.9	-27.6	-171.9	-55	0	0	0	0	113.4	I254 K260 G298 Q299 C300 K325	I254-V258 HydrophobicContact CG2-CG1 4.34Å; I254-V258 HydrophobicContact CG2-CG2 4.34Å; I254-V258 VanDerWaalsContact O-CG2 3.29Å; I254-V258 WeakPolarHBondContact O-CG2 3.29Å; I254-V258 PolarHBondContact O-N 3.31Å; V258-K260 PolarHBondContact O-N 2.83Å; V258-G298 WeakPolarHBondContact CG1-O 3.47Å; V258-Q299 VanDerWaalsContact CG2-C 3.5Å; V258-Q299 WeakPolarHBondContact CG2-O 3.4Å; V258-C300 HydrophobicContact CG2-CB 4.08Å; V258-K325 HydrophobicContact CG1-CB 4.02Å; V258-K325 HydrophobicContact CG1-CD 4.01Å; V258-K325 HydrophobicContact CG1-CG 3.99Å
259	C	97.6	Very high	95.2	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	15%	0.152	C	C	.	.			trans	-78.9	58.1	177.8	-65	0	0	0	0	112.7	Q255 E261 Q262 I263 C300 L302	Q255-C259 WeakPolarHBondContact O-CB 2.95Å; Q255-C259 PolarHBondContact O-N 2.88Å; Q255-C259 PolarHBondContact O-SG 3Å; Q255-C259 VanDerWaalsContact O-SG 3.33Å; Q255-C259 PolarHBondContact OE1-SG 3.17Å; C259-E261 VanDerWaalsContact C-N 3.28Å; C259-E261 PolarHBondContact O-N 2.95Å; C259-Q262 HydrophobicContact CB-CB 4.35Å; C259-Q262 PolarHBondContact O-N 3.13Å; C259-Q262 PolarHBondContact O-OE1 3.22Å; C259-I263 HydrophobicContact CB-CG1 4.25Å; C259-I263 WeakPolarHBondContact O-CB 3.42Å; C259-I263 VanDerWaalsContact O-CG1 3.29Å; C259-I263 WeakPolarHBondContact O-CG1 3.5Å; C259-I263 PolarHBondContact O-N 2.98Å; C259-C300 WeakPolarHBondContact CA-SG 3.29Å; C259-C300 HydrophobicContact CB-CB 3.98Å; C259-C300 WeakPolarHBondContact CB-SG 3.39Å; C259-C300 WeakPolarHBondContact SG-CA 3.44Å; C259-C300 WeakPolarHBondContact SG-CB 3.38Å; C259-C300 CovalentContact SG-SG 2.03Å; C259-C300 PolarHBondContact SG-SG 3.18Å; C259-L302 HydrophobicContact CB-CD1 3.87Å; C259-L302 HydrophobicContact CB-CG 4.48Å
260	K	94.5	Very high	94.8	Very high	98 Å²	98	28.2 Å²	28.2	43%	0.426	16%	0.155	S	C	.	.	H	α-helix	trans	-53.8	-41.6	-171.7	-67.4	178.6	-178.2	169.6	0	113.8	V258 G264 W265 N329	V258-K260 PolarHBondContact O-N 2.83Å; K260-G264 WeakPolarHBondContact O-CA 3.39Å; K260-G264 PolarHBondContact O-N 2.91Å; K260-W265 PolarHBondContact O-N 3.21Å; K260-N329 VanDerWaalsContact CE-CG 3.43Å; K260-N329 WeakPolarHBondContact CE-OD1 3.41Å; K260-N329 PolarHBondContact NZ-OD1 3Å
261	E	93.4	Very high	94.5	Very high	178 Å²	178	28.7 Å²	28.7	83%	0.832	16%	0.157	S	C	*	.	H	α-helix	trans	-73.3	-43.3	-175.3	-63.2	-175.6	172.7	0	0	111.8	C259	C259-E261 VanDerWaalsContact C-N 3.28Å; C259-E261 PolarHBondContact O-N 2.95Å
262	Q	95.9	Very high	94.3	Very high	67 Å²	67	28.7 Å²	28.7	31%	0.313	16%	0.157	S	C	.	.	H	α-helix	trans	-69.1	-43.3	179.6	-61.9	81.1	-2.5	0	0	111.2	H219 S222 C259 L302	H219-Q262 PolarHBondContact NE2-O 2.86Å; S222-Q262 PolarHBondContact OG-O 2.51Å; C259-Q262 HydrophobicContact CB-CB 4.35Å; C259-Q262 PolarHBondContact O-N 3.13Å; C259-Q262 PolarHBondContact O-OE1 3.22Å; Q262-L302 HydrophobicContact CB-CD1 4Å; Q262-L302 HydrophobicContact CG-CD1 4.27Å
263	I	97.8	Very high	94.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-74.4	-40.4	179.2	-56.6	-52.1	0	0	0	111.3	Y142 H219 L223 C259 W265	Y142-I263 HydrophobicContact CD2-CG2 3.55Å; Y142-I263 HydrophobicContact CE2-CD1 3.91Å; Y142-I263 HydrophobicContact CE2-CG2 3.76Å; Y142-I263 HydrophobicContact CG-CG2 4.12Å; H219-I263 HydrophobicContact CB-CD1 4.31Å; H219-I263 VanDerWaalsContact ND1-CD1 3.31Å; H219-I263 WeakPolarHBondContact ND1-CD1 3.44Å; L223-I263 WeakPolarHBondContact CB-O 3.2Å; L223-I263 HydrophobicContact CD1-CG2 4.01Å; L223-I263 HydrophobicContact CG-CG2 4.37Å; L223-I263 WeakPolarHBondContact CG-O 3.44Å; L223-I263 PolarHBondContact N-O 3.04Å; C259-I263 HydrophobicContact CB-CG1 4.25Å; C259-I263 WeakPolarHBondContact O-CB 3.42Å; C259-I263 VanDerWaalsContact O-CG1 3.29Å; C259-I263 WeakPolarHBondContact O-CG1 3.5Å; C259-I263 PolarHBondContact O-N 2.98Å; I263-W265 HydrophobicContact CG2-CD2 4.3Å; I263-W265 HydrophobicContact CG2-CG 4.44Å; I263-W265 HydrophobicContact CG2-CZ2 4.12Å
264	G	96.2	Very high	94.1	Very high	26 Å²	26	28.7 Å²	28.7	27%	0.268	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	32.8	175.1	0	0	0	0	0	115.6	K260 R266	K260-G264 WeakPolarHBondContact O-CA 3.39Å; K260-G264 PolarHBondContact O-N 2.91Å; G264-R266 PolarHBondContact O-N 3.2Å
265	W	95.1	Very high	94.1	Very high	22 Å²	22	28.7 Å²	28.7	8%	0.083	16%	0.157	C	C	.	.			trans	-62	125.9	179.3	-66.3	114.8	0	0	0	112.1	D140 Y142 L223 A256 K260 I263 H271 I331	D140-W265 HydrophobicContact CB-CE3 3.6Å; D140-W265 HydrophobicContact CB-CZ3 3.58Å; Y142-W265 HydrophobicContact CG-CH2 4.49Å; Y142-W265 HydrophobicContact CG-CZ2 4.28Å; L223-W265 HydrophobicContact CD1-CD2 3.73Å; L223-W265 HydrophobicContact CD1-CE3 3.48Å; L223-W265 VanDerWaalsContact CD1-CE3 3.48Å; L223-W265 HydrophobicContact CD1-CG 4.22Å; L223-W265 HydrophobicContact CD1-CZ3 3.92Å; A256-W265 PolarHBondContact O-NE1 3.48Å; K260-W265 PolarHBondContact O-N 3.21Å; I263-W265 HydrophobicContact CG2-CD2 4.3Å; I263-W265 HydrophobicContact CG2-CG 4.44Å; I263-W265 HydrophobicContact CG2-CZ2 4.12Å; W265-H271 HydrophobicContact CD2-CB 4.32Å; W265-H271 HydrophobicContact CE3-CB 3.59Å; W265-H271 AromaticContact CE3-CD2 3.5Å; W265-H271 AromaticContact CE3-CG 3.54Å; W265-H271 HydrophobicContact CH2-CB 4.26Å; W265-H271 HydrophobicContact CZ3-CB 3.56Å; W265-I331 HydrophobicContact CD2-CD1 3.85Å; W265-I331 HydrophobicContact CE3-CD1 4.3Å; W265-I331 HydrophobicContact CG-CD1 4.25Å; W265-I331 HydrophobicContact CH2-CD1 4.34Å; W265-I331 HydrophobicContact CZ2-CD1 3.9Å
266	R	91.5	Very high	94	Very high	33 Å²	33	28.7 Å²	28.7	13%	0.125	16%	0.157	C	C	.	.			trans	-82.1	127.7	-179.9	-68	-177	-71.7	-178.6	-1.4	111.1	V139 D140 N175 G264 G268 A269 H271	V139-R266 PolarHBondContact O-NH2 2.89Å; D140-R266 IonicContact OD1-CZ 3.07Å; D140-R266 IonicContact OD1-NE 2.71Å; D140-R266 PolarHBondContact OD1-NE 2.89Å; D140-R266 IonicContact OD1-NH2 3.98Å; D140-R266 PolarHBondContact OD1-NH2 2.84Å; D140-R266 VanDerWaalsContact OD2-CB 3.32Å; D140-R266 WeakPolarHBondContact OD2-CB 3.41Å; D140-R266 PolarHBondContact OD2-N 3.36Å; D140-R266 IonicContact OD2-NE 3.3Å; N175-R266 PolarHBondContact ND2-NH1 3.06Å; N175-R266 PolarHBondContact O-NH2 3.02Å; N175-R266 PolarHBondContact OD1-NH1 2.83Å; G264-R266 PolarHBondContact O-N 3.2Å; R266-G268 PolarHBondContact O-N 3.42Å; R266-A269 HydrophobicContact CB-CB 3.86Å; R266-A269 PolarHBondContact O-N 2.03Å; R266-A269 VanDerWaalsContact O-N 3.11Å; R266-H271 PolarHBondContact O-NE2 3Å
267	P	84.9	Confident	93.9	Very high	98 Å²	98	28.7 Å²	28.7	64%	0.636	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.3	-178.3	24.5	-34.4	0	0	0	114.3	K449	P267-K449 VanDerWaalsContact O-CB 3.28Å; P267-K449 WeakPolarHBondContact O-CB 3.45Å; P267-K449 WeakPolarHBondContact O-CD 3.47Å; P267-K449 WeakPolarHBondContact O-CG 3.38Å
268	G	83.1	Confident	93.7	Very high	27 Å²	27	30.8 Å²	30.8	28%	0.278	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	32.1	179.4	0	0	0	0	0	114.8	Y137 R266	Y137-G268 PolarHBondContact OH-O 3.19Å; R266-G268 PolarHBondContact O-N 3.42Å
269	A	87.9	Confident	93.6	Very high	8 Å²	8	30.4 Å²	30.4	7%	0.066	17%	0.168	C	C	.	.	S	Bend	trans	-126.3	160.9	177.8	0	0	0	0	0	111.7	P138 R266	P138-A269 HydrophobicContact CB-CB 3.94Å; P138-A269 CarbonylContact O-C 3.58Å; P138-A269 WeakPolarHBondContact O-CA 3.35Å; R266-A269 HydrophobicContact CB-CB 3.86Å; R266-A269 PolarHBondContact O-N 2.03Å; R266-A269 VanDerWaalsContact O-N 3.11Å
270	S	89.1	Confident	93.6	Very high	8 Å²	8	36.1 Å²	36.1	6%	0.056	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	118.6	165.3	-70.8	0	0	0	0	108.9	Y137 P138 D140	Y137-S270 WeakPolarHBondContact CD1-OG 3.3Å; P138-S270 PolarHBondContact O-N 3.48Å; D140-S270 PolarHBondContact N-O 3.08Å
271	H	93.6	Very high	93.7	Very high	11 Å²	11	31.8 Å²	31.8	5%	0.051	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.9	178.9	-53	154.3	0	0	0	110.5	D140 W265 R266 N329 N330 I331 N332	D140-H271 IonicContact OD2-CD2 3.53Å; W265-H271 HydrophobicContact CD2-CB 4.32Å; W265-H271 HydrophobicContact CE3-CB 3.59Å; W265-H271 AromaticContact CE3-CD2 3.5Å; W265-H271 AromaticContact CE3-CG 3.54Å; W265-H271 HydrophobicContact CH2-CB 4.26Å; W265-H271 HydrophobicContact CZ3-CB 3.56Å; R266-H271 PolarHBondContact O-NE2 3Å; H271-N329 PolarHBondContact ND1-O 2.81Å; H271-N329 VanDerWaalsContact ND1-O 3.14Å; H271-N330 PolarHBondContact ND1-O 3.13Å; H271-I331 HydrophobicContact CB-CD1 3.55Å; H271-N332 WeakPolarHBondContact O-CB 3.36Å; H271-N332 PolarHBondContact O-N 3.02Å; H271-N332 PolarHBondContact O-ND2 3.12Å
272	L	94.1	Very high	94	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.8	176	-54.2	-179.6	0	0	0	109	V139 D140 L141 Y142 M169 I274 N332 I334 Y375 I378	V139-L272 HydrophobicContact CG1-CD1 3.57Å; V139-L272 HydrophobicContact CG1-CG 3.98Å; D140-L272 PolarHBondContact O-N 2.98Å; L141-L272 WeakPolarHBondContact CA-O 3.34Å; Y142-L272 PolarHBondContact N-O 3.48Å; M169-L272 HydrophobicContact CE-CD1 4.42Å; L272-I274 HydrophobicContact CB-CD1 4.25Å; L272-N332 HydrophobicContact CD2-CB 4.15Å; L272-I334 HydrophobicContact CB-CD1 4.47Å; L272-I334 HydrophobicContact CD2-CD1 4.32Å; L272-Y375 HydrophobicContact CD1-CD2 3.67Å; L272-Y375 HydrophobicContact CD1-CE2 4.33Å; L272-Y375 HydrophobicContact CD1-CG 4.43Å; L272-Y375 HydrophobicContact CD2-CD2 4.08Å; L272-Y375 HydrophobicContact CG-CD2 4.4Å; L272-I378 HydrophobicContact CD2-CD1 4.04Å
273	L	96.8	Very high	94	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	107	173.3	178.3	59.1	0	0	0	108.3	Y142 L144 I253 A256 M326 I331 N332 L333 I334	Y142-L273 HydrophobicContact CD1-CD1 3.66Å; Y142-L273 HydrophobicContact CG-CD1 4.4Å; L144-L273 HydrophobicContact CB-CD1 3.97Å; L144-L273 HydrophobicContact CD2-CD1 4.24Å; I253-L273 HydrophobicContact CG1-CD2 4.5Å; I253-L273 HydrophobicContact CG2-CD2 4.21Å; A256-L273 HydrophobicContact CB-CD1 4.05Å; A256-L273 HydrophobicContact CB-CD2 4.35Å; L273-M326 HydrophobicContact CD2-CE 4.5Å; L273-M326 HydrophobicContact CD2-SD 4.43Å; L273-I331 HydrophobicContact CB-CG2 3.5Å; L273-I331 HydrophobicContact CD2-CG2 4.05Å; L273-I331 HydrophobicContact CG-CG2 4.44Å; L273-N332 PolarHBondContact N-O 3Å; L273-L333 HydrophobicContact CB-CD1 4.4Å; L273-L333 HydrophobicContact CD2-CD1 4.01Å; L273-L333 HydrophobicContact CG-CD1 3.99Å; L273-I334 PolarHBondContact O-N 3.35Å
274	I	95.9	Very high	94	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.5	-178.9	-47.4	-53	0	0	0	108	L141 Y142 Y143 L144 L272 T276 I334 A336 I371	L141-I274 HydrophobicContact CD1-CG1 4.49Å; L141-I274 HydrophobicContact CD2-CG1 3.92Å; L141-I274 HydrophobicContact CG-CG1 4Å; Y142-I274 PolarHBondContact O-N 3.46Å; Y143-I274 HydrophobicContact CD2-CB 4.4Å; Y143-I274 HydrophobicContact CD2-CG2 4.38Å; Y143-I274 HydrophobicContact CE2-CG2 4.36Å; L144-I274 WeakPolarHBondContact CA-O 3.44Å; L144-I274 WeakPolarHBondContact CB-O 3.21Å; L144-I274 PolarHBondContact N-O 3.3Å; L272-I274 HydrophobicContact CB-CD1 4.25Å; I274-T276 HydrophobicContact CG2-CG2 4.04Å; I274-I334 HydrophobicContact CD1-CB 3.91Å; I274-I334 HydrophobicContact CD1-CD1 3.42Å; I274-I334 VanDerWaalsContact CD1-CD1 3.42Å; I274-I334 HydrophobicContact CD1-CG1 4.12Å; I274-I334 HydrophobicContact CD1-CG2 4.39Å; I274-A336 HydrophobicContact CG2-CB 4.43Å; I274-I371 HydrophobicContact CD1-CG1 4.01Å; I274-I371 HydrophobicContact CD1-CG2 4.43Å; I274-I371 HydrophobicContact CG1-CD1 4.19Å; I274-I371 HydrophobicContact CG1-CG1 4.22Å; I274-I371 HydrophobicContact CG2-CD1 4.33Å; I274-I371 HydrophobicContact CG2-CG1 4.3Å
275	F	97.6	Very high	94.1	Very high	1 Å²	1	29 Å²	29	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.7	175.2	177	-91.4	0	0	0	109.6	L144 F183 I253 L333 I334 F335 A336 V337 Y345	L144-F275 HydrophobicContact CD2-CD2 4.19Å; F183-F275 AromaticContact CE1-CD2 3.92Å; F183-F275 HydrophobicContact CE1-CD2 3.92Å; F183-F275 AromaticContact CE1-CE2 3.52Å; F183-F275 HydrophobicContact CE1-CE2 3.52Å; F183-F275 HydrophobicContact CE1-CZ 4.27Å; F183-F275 HydrophobicContact CE2-CE2 4.02Å; F183-F275 HydrophobicContact CE2-CZ 4.18Å; F183-F275 HydrophobicContact CZ-CD2 4.01Å; F183-F275 AromaticContact CZ-CE2 3.19Å; F183-F275 HydrophobicContact CZ-CE2 3.19Å; F183-F275 AromaticContact CZ-CZ 3.52Å; F183-F275 HydrophobicContact CZ-CZ 3.52Å; I253-F275 HydrophobicContact CD1-CB 4.48Å; I253-F275 HydrophobicContact CD1-CD2 3.62Å; I253-F275 HydrophobicContact CD1-CE2 4.01Å; I253-F275 HydrophobicContact CD1-CG 4.11Å; I253-F275 HydrophobicContact CG1-CD2 3.79Å; I253-F275 HydrophobicContact CG1-CE2 4.3Å; F275-L333 HydrophobicContact CB-CD1 3.87Å; F275-I334 PolarHBondContact N-O 2.79Å; F275-F335 HydrophobicContact CB-CD1 4.21Å; F275-F335 AromaticContact CD1-CD1 3.66Å; F275-F335 HydrophobicContact CD1-CD1 3.66Å; F275-F335 HydrophobicContact CD1-CE1 4.23Å; F275-F335 HydrophobicContact CE1-CD1 4.34Å; F275-F335 HydrophobicContact CG-CD1 4.13Å; F275-F335 HydrophobicContact CG-CE1 4.47Å; F275-A336 PolarHBondContact O-N 2.92Å; F275-V337 HydrophobicContact CD1-CG1 4.41Å; F275-V337 HydrophobicContact CE1-CG1 4.45Å; F275-Y345 HydrophobicContact CD1-CE1 4.41Å; F275-Y345 AromaticContact CE1-CE1 3.76Å; F275-Y345 HydrophobicContact CE1-CE1 3.76Å; F275-Y345 AromaticContact CE1-CZ 3.96Å
276	T	95.7	Very high	94.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.2	179	57.4	0	0	0	0	111.5	Y143 L144 M145 D146 I274 A336 L360	Y143-T276 HydrophobicContact CE1-CG2 4.07Å; Y143-T276 HydrophobicContact CE2-CG2 4.47Å; L144-T276 PolarHBondContact O-N 3.2Å; L144-T276 PolarHBondContact O-OG1 3.47Å; M145-T276 WeakPolarHBondContact CA-OG1 3.37Å; D146-T276 WeakPolarHBondContact CB-O 3.27Å; D146-T276 PolarHBondContact N-O 3.06Å; I274-T276 HydrophobicContact CG2-CG2 4.04Å; T276-A336 VanDerWaalsContact CA-O 3.29Å; T276-A336 WeakPolarHBondContact CA-O 3.16Å; T276-A336 HydrophobicContact CG2-CB 3.7Å; T276-L360 HydrophobicContact CG2-CD2 4.33Å
277	S	95.8	Very high	94.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	150.8	175.3	178.7	0	0	0	0	109.9	D146 A279 A336 V337	D146-S277 WeakPolarHBondContact OD2-CB 3.41Å; D146-S277 PolarHBondContact OD2-OG 3.16Å; S277-A279 PolarHBondContact OG-N 3.26Å; S277-A279 VanDerWaalsContact OG-N 3.17Å; S277-A336 PolarHBondContact N-O 3.2Å; S277-V337 VanDerWaalsContact O-CA 3.26Å; S277-V337 WeakPolarHBondContact O-CA 3.23Å; S277-V337 WeakPolarHBondContact O-CB 3.2Å
278	D	94.3	Very high	95.1	Very high	43 Å²	43	33.5 Å²	33.5	23%	0.23	17%	0.174	C	C	.	.	S	Bend	trans	-99.6	2.7	173.7	69.4	-28	0	0	0	113.1	S150 M151 T338	S150-D278 WeakPolarHBondContact CB-OD2 3.39Å; S150-D278 PolarHBondContact OG-OD1 3.44Å; S150-D278 VanDerWaalsContact OG-OD1 3.09Å; S150-D278 PolarHBondContact OG-OD2 3.07Å; M151-D278 HydrophobicContact SD-CB 3.82Å; D278-T338 VanDerWaalsContact CA-OG1 3.29Å; D278-T338 WeakPolarHBondContact CA-OG1 3.31Å; D278-T338 HydrophobicContact CB-CG2 3.53Å; D278-T338 PolarHBondContact O-OG1 3.5Å
279	A	95.6	Very high	95.7	Very high	17 Å²	17	38.8 Å²	38.8	14%	0.14	19%	0.194	C	C	.	.	S	Bend	trans	-126.1	178.5	-170.2	0	0	0	0	0	113.5	E247 S277 Y345	E247-A279 HydrophobicContact CG-CB 4.06Å; S277-A279 PolarHBondContact OG-N 3.26Å; S277-A279 VanDerWaalsContact OG-N 3.17Å; A279-Y345 WeakPolarHBondContact O-CE2 3.4Å; A279-Y345 PolarHBondContact O-OH 3.02Å
280	K	96.7	Very high	96.1	Very high	120 Å²	120	39.4 Å²	39.4	52%	0.522	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	166.5	173.6	-62.2	-178.1	-178.1	176.4	0	109.4	P246 E247 V341 L344	P246-K280 CarbonylContact C-O 3.49Å; P246-K280 WeakPolarHBondContact CA-O 3Å; P246-K280 HydrophobicContact CB-CB 4.25Å; E247-K280 PolarHBondContact N-O 2.86Å; K280-V341 HydrophobicContact CG-CG1 4.32Å; K280-L344 HydrophobicContact CB-CD2 4.2Å; K280-L344 HydrophobicContact CD-CD2 4.4Å; K280-L344 HydrophobicContact CG-CD2 3.86Å
281	T	97.7	Very high	96.5	Very high	8 Å²	8	42 Å²	42	5%	0.049	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.1	174.3	-177	0	0	0	0	110.1	E247 F250 Y345 Y348	E247-T281 CarbonylContact O-C 3.6Å; E247-T281 WeakPolarHBondContact O-CA 3.43Å; E247-T281 PolarHBondContact O-OG1 3.22Å; F250-T281 HydrophobicContact CD1-CG2 3.9Å; F250-T281 WeakPolarHBondContact CD1-OG1 3.2Å; F250-T281 HydrophobicContact CD2-CG2 4.3Å; F250-T281 HydrophobicContact CE1-CG2 3.55Å; F250-T281 HydrophobicContact CE2-CG2 3.95Å; F250-T281 HydrophobicContact CG-CG2 4.3Å; F250-T281 HydrophobicContact CZ-CG2 3.57Å; T281-Y345 HydrophobicContact CG2-CE1 4.17Å; T281-Y348 HydrophobicContact CG2-CE2 3.95Å
282	H	98.2	Very high	96.7	Very high	8 Å²	8	41.8 Å²	41.8	4%	0.037	23%	0.227	C	C	.	.			trans	-66.9	150.6	166.5	-84.1	-57.3	0	0	0	111.5	D185 Y191 D244 E247 F250 D286 Y316	D185-H282 IonicContact OD1-CD2 2.65Å; D185-H282 IonicContact OD2-CD2 3.53Å; D185-H282 PolarHBondContact OD2-CD2 3.1Å; D185-H282 VanDerWaalsContact OD2-CD2 3.29Å; D185-H282 IonicContact OD2-NE2 3.07Å; Y191-H282 AromaticContact CD1-NE2 3.6Å; Y191-H282 AromaticContact CE1-CE1 3.83Å; Y191-H282 AromaticContact CE1-NE2 3.5Å; D244-H282 IonicContact OD2-CE1 3.77Å; D244-H282 IonicContact OD2-NE2 2.73Å; D244-H282 PolarHBondContact OD2-NE2 2.99Å; E247-H282 PolarHBondContact O-N 2.85Å; F250-H282 WeakPolarHBondContact CD2-O 3.1Å; H282-D286 WeakPolarHBondContact CA-OD2 3.26Å; H282-D286 HydrophobicContact CB-CB 4.35Å; H282-D286 IonicContact CE1-OD2 3.63Å; H282-D286 IonicContact CG-OD2 2.87Å; H282-D286 WeakPolarHBondContact ND1-CB 3.29Å; H282-D286 IonicContact ND1-OD2 3.57Å; H282-D286 PolarHBondContact ND1-OD2 2.79Å; H282-Y316 HydrophobicContact CB-CD1 3.79Å; H282-Y316 HydrophobicContact CB-CD2 3.79Å; H282-Y316 HydrophobicContact CB-CE1 3.56Å; H282-Y316 HydrophobicContact CB-CE2 3.57Å; H282-Y316 HydrophobicContact CB-CG 3.89Å; H282-Y316 VanDerWaalsContact CB-CZ 3.43Å; H282-Y316 AromaticContact CD2-CZ 3.7Å; H282-Y316 PolarHBondContact CD2-OH 2.89Å; H282-Y316 VanDerWaalsContact CD2-OH 3.31Å; H282-Y316 AromaticContact CG-CE2 3.81Å; H282-Y316 AromaticContact CG-CZ 3.64Å
283	V	97	Very high	96.8	Very high	41 Å²	41	47.2 Å²	47.2	25%	0.248	26%	0.26	C	S	.	.			trans	-124	166	178	-61.6	0	0	0	0	110.7	F250 L285 D286	F250-V283 HydrophobicContact CD2-CG1 4.34Å; F250-V283 HydrophobicContact CE2-CG1 4.02Å; V283-L285 PolarHBondContact O-N 2.88Å; V283-D286 PolarHBondContact N-OD2 2.73Å; V283-D286 VanDerWaalsContact O-CB 3.26Å; V283-D286 WeakPolarHBondContact O-CB 3.46Å; V283-D286 PolarHBondContact O-N 3.05Å; V283-D286 VanDerWaalsContact O-N 3.09Å
284	A	97.4	Very high	96.9	Very high	28 Å²	28	52.3 Å²	52.3	23%	0.231	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	142.2	173.9	0	0	0	0	0	112	D286 Y316 P317	A284-D286 VanDerWaalsContact C-N 3.3Å; A284-Y316 WeakPolarHBondContact CA-O 3.44Å; A284-Y316 WeakPolarHBondContact CB-O 2.96Å; A284-P317 PolarHBondContact N-O 2.65Å
285	L	97.4	Very high	97	Very high	136 Å²	136	56.7 Å²	56.7	71%	0.712	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	-14.4	-172.7	-49.3	175.3	0	0	0	115.9	V283 G287 R288 D315	V283-L285 PolarHBondContact O-N 2.88Å; L285-G287 VanDerWaalsContact C-N 3.25Å; L285-G287 PolarHBondContact O-N 3.3Å; L285-R288 VanDerWaalsContact O-CB 3.23Å; L285-R288 WeakPolarHBondContact O-CB 3.06Å; L285-R288 PolarHBondContact O-N 2.91Å; L285-D315 WeakPolarHBondContact CA-OD2 2.73Å; L285-D315 PolarHBondContact N-OD2 3.01Å
286	D	97.8	Very high	97	Very high	51 Å²	51	57.6 Å²	57.6	27%	0.273	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-65.4	-32.1	174.1	-72.5	-13.9	0	0	0	111.7	Y191 H282 V283 A284 R288 L289 Y316	Y191-D286 PolarHBondContact OH-O 3.49Å; H282-D286 WeakPolarHBondContact CA-OD2 3.26Å; H282-D286 HydrophobicContact CB-CB 4.35Å; H282-D286 IonicContact CE1-OD2 3.63Å; H282-D286 IonicContact CG-OD2 2.87Å; H282-D286 WeakPolarHBondContact ND1-CB 3.29Å; H282-D286 IonicContact ND1-OD2 3.57Å; H282-D286 PolarHBondContact ND1-OD2 2.79Å; V283-D286 PolarHBondContact N-OD2 2.73Å; V283-D286 VanDerWaalsContact O-CB 3.26Å; V283-D286 WeakPolarHBondContact O-CB 3.46Å; V283-D286 PolarHBondContact O-N 3.05Å; V283-D286 VanDerWaalsContact O-N 3.09Å; A284-D286 VanDerWaalsContact C-N 3.3Å; D286-R288 PolarHBondContact O-N 3.41Å; D286-L289 PolarHBondContact O-N 2.95Å; D286-L289 VanDerWaalsContact O-N 3.14Å; D286-Y316 HydrophobicContact CB-CD2 4.09Å; D286-Y316 HydrophobicContact CB-CE2 4.1Å
287	G	97.3	Very high	97.1	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-58.7	-19.8	177.2	0	0	0	0	0	113.7	Y191 L285 L289 A290 G291 I292 D315	Y191-G287 WeakPolarHBondContact OH-CA 3.34Å; L285-G287 VanDerWaalsContact C-N 3.25Å; L285-G287 PolarHBondContact O-N 3.3Å; G287-L289 PolarHBondContact O-N 3.14Å; G287-A290 CarbonylContact O-C 3.52Å; G287-A290 WeakPolarHBondContact O-CA 3.36Å; G287-A290 PolarHBondContact O-N 3.48Å; G287-G291 PolarHBondContact O-N 2.98Å; G287-I292 CarbonylContact C-O 3.22Å; G287-I292 WeakPolarHBondContact O-CB 3.41Å; G287-I292 PolarHBondContact O-N 2.83Å; G287-D315 VanDerWaalsContact CA-OD1 3.25Å; G287-D315 WeakPolarHBondContact CA-OD1 3.02Å; G287-D315 PolarHBondContact N-OD1 2.95Å
288	R	97.7	Very high	97.2	Very high	196 Å²	196	60.7 Å²	60.7	74%	0.74	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-57.5	-33	176.3	-173.3	177.9	178.7	-178	0.5	112.2	L285 D286 A290 G291 I292 V293	L285-R288 VanDerWaalsContact O-CB 3.23Å; L285-R288 WeakPolarHBondContact O-CB 3.06Å; L285-R288 PolarHBondContact O-N 2.91Å; D286-R288 PolarHBondContact O-N 3.41Å; R288-A290 PolarHBondContact O-N 3.36Å; R288-G291 PolarHBondContact O-N 3.02Å; R288-G291 VanDerWaalsContact O-N 3.09Å; R288-I292 VanDerWaalsContact CA-O 3.29Å; R288-I292 WeakPolarHBondContact CA-O 3.31Å; R288-I292 PolarHBondContact N-O 3.21Å; R288-I292 VanDerWaalsContact N-O 3.15Å; R288-V293 HydrophobicContact CG-CG1 4.43Å
289	L	96.9	Very high	97.3	Very high	137 Å²	137	63.9 Å²	63.9	72%	0.717	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-63.9	-29.2	176.7	-69.8	174.1	0	0	0	112.6	D286 G287 G291	D286-L289 PolarHBondContact O-N 2.95Å; D286-L289 VanDerWaalsContact O-N 3.14Å; G287-L289 PolarHBondContact O-N 3.14Å; L289-G291 VanDerWaalsContact C-N 3.34Å
290	A	96.5	Very high	97.5	Very high	22 Å²	22	65 Å²	65	18%	0.182	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-93.8	9.5	176.3	0	0	0	0	0	113.4	L188 S189 Y191 G287 R288 I292	L188-A290 HydrophobicContact CD1-CB 3.54Å; L188-A290 HydrophobicContact CD2-CB 4.44Å; L188-A290 HydrophobicContact CG-CB 3.84Å; S189-A290 VanDerWaalsContact O-CB 3.29Å; S189-A290 WeakPolarHBondContact O-CB 3.4Å; Y191-A290 HydrophobicContact CD2-CB 4.18Å; Y191-A290 HydrophobicContact CE2-CB 3.31Å; G287-A290 CarbonylContact O-C 3.52Å; G287-A290 WeakPolarHBondContact O-CA 3.36Å; G287-A290 PolarHBondContact O-N 3.48Å; R288-A290 PolarHBondContact O-N 3.36Å; A290-I292 VanDerWaalsContact C-N 3.3Å
291	G	97.4	Very high	97.5	Very high	62 Å²	62	61 Å²	61	64%	0.639	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	9.7	-177.7	0	0	0	0	0	114.3	G287 R288 L289	G287-G291 PolarHBondContact O-N 2.98Å; R288-G291 PolarHBondContact O-N 3.02Å; R288-G291 VanDerWaalsContact O-N 3.09Å; L289-G291 VanDerWaalsContact C-N 3.34Å
292	I	98	Very high	97.5	Very high	7 Å²	7	61.6 Å²	61.6	4%	0.036	34%	0.34	C	S	.	.			trans	-88.9	116.5	176.5	-59.4	175.7	0	0	0	108.8	K186 L188 G287 R288 A290 T312 D315	K186-I292 HydrophobicContact CD-CD1 3.78Å; L188-I292 HydrophobicContact CD1-CD1 3.77Å; L188-I292 HydrophobicContact CD1-CG1 4.04Å; L188-I292 HydrophobicContact CD2-CD1 4.11Å; G287-I292 CarbonylContact C-O 3.22Å; G287-I292 WeakPolarHBondContact O-CB 3.41Å; G287-I292 PolarHBondContact O-N 2.83Å; R288-I292 VanDerWaalsContact CA-O 3.29Å; R288-I292 WeakPolarHBondContact CA-O 3.31Å; R288-I292 PolarHBondContact N-O 3.21Å; R288-I292 VanDerWaalsContact N-O 3.15Å; A290-I292 VanDerWaalsContact C-N 3.3Å; I292-T312 WeakPolarHBondContact CD1-O 3.47Å; I292-D315 HydrophobicContact CG2-CB 4.05Å; I292-D315 VanDerWaalsContact CG2-N 3.27Å
293	V	96.3	Very high	97.3	Very high	114 Å²	114	64 Å²	64	69%	0.691	35%	0.353	S	S	*	.			trans	-123.9	-1.4	-179.5	-62	0	0	0	0	113.2	R288 P295	R288-V293 HydrophobicContact CG-CG1 4.43Å; V293-P295 WeakPolarHBondContact O-CD 3.38Å
294	H	97.6	Very high	97.2	Very high	107 Å²	107	67 Å²	67	50%	0.495	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-80.6	117.4	176.9	-171.8	-77	0	0	0	109.2	T313 D315	H294-T313 WeakPolarHBondContact CB-O 3.37Å; H294-D315 WeakPolarHBondContact O-CB 3.28Å; H294-D315 PolarHBondContact O-N 3.43Å
295	P	97.8	Very high	97	Very high	92 Å²	92	71.4 Å²	71.4	60%	0.597	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-61.1	155.9	-179.8	-22.4	34.2	0	0	0	112.6	V293 M314	V293-P295 WeakPolarHBondContact O-CD 3.38Å; P295-M314 WeakPolarHBondContact O-CG 3.34Å
296	N	98.4	Very high	97	Very high	20 Å²	20	67.9 Å²	67.9	11%	0.107	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-66.6	132.4	172.6	-158.8	-71	0	0	0	111.3	G298 M314 D315 P317 L321	N296-G298 PolarHBondContact OD1-N 3.27Å; N296-M314 HydrophobicContact CB-CG 4.35Å; N296-M314 HydrophobicContact CB-SD 4.34Å; N296-D315 WeakPolarHBondContact CB-O 3.44Å; N296-D315 PolarHBondContact ND2-O 3.46Å; N296-D315 VanDerWaalsContact ND2-O 3.13Å; N296-P317 HydrophobicContact CB-CB 4.07Å; N296-L321 HydrophobicContact CB-CD2 3.83Å
297	D	97.4	Very high	97	Very high	63 Å²	63	68.1 Å²	68.1	34%	0.337	38%	0.383	S	S	.	.			trans	-94.1	-7	-176.2	67.5	1.4	0	0	0	113.9	Q299 H301 M314	D297-Q299 VanDerWaalsContact C-N 3.26Å; D297-Q299 HydrophobicContact CB-CG 4.34Å; D297-Q299 PolarHBondContact O-N 3.17Å; D297-Q299 WeakPolarHBondContact OD1-CB 3.5Å; D297-Q299 PolarHBondContact OD1-N 2.89Å; D297-H301 VanDerWaalsContact CG-NE2 3.34Å; D297-H301 IonicContact OD1-CD2 3.83Å; D297-H301 IonicContact OD1-NE2 3.39Å; D297-H301 PolarHBondContact OD1-NE2 3.45Å; D297-H301 IonicContact OD2-CE1 2.7Å; D297-H301 PolarHBondContact OD2-CE1 3.19Å; D297-H301 IonicContact OD2-NE2 3.64Å; D297-H301 PolarHBondContact OD2-NE2 3.18Å; D297-M314 HydrophobicContact CB-CE 4.21Å; D297-M314 HydrophobicContact CB-SD 4.47Å; D297-M314 WeakPolarHBondContact OD2-CE 3.4Å
298	G	97.1	Very high	97	Very high	2 Å²	2	68.7 Å²	68.7	2%	0.021	39%	0.385	C	S	.	.			trans	65.7	25.1	-177.6	0	0	0	0	0	114.1	V258 N296	V258-G298 WeakPolarHBondContact CG1-O 3.47Å; N296-G298 PolarHBondContact OD1-N 3.27Å
299	Q	97.8	Very high	97	Very high	111 Å²	111	62.1 Å²	62.1	52%	0.519	37%	0.37	S	S	.	.			trans	-106.7	164.2	177.8	-58.8	-64.8	-23.9	0	0	112.2	Q255 V258 D297 H301	Q255-Q299 PolarHBondContact NE2-O 3.21Å; V258-Q299 VanDerWaalsContact CG2-C 3.5Å; V258-Q299 WeakPolarHBondContact CG2-O 3.4Å; D297-Q299 VanDerWaalsContact C-N 3.26Å; D297-Q299 HydrophobicContact CB-CG 4.34Å; D297-Q299 PolarHBondContact O-N 3.17Å; D297-Q299 WeakPolarHBondContact OD1-CB 3.5Å; D297-Q299 PolarHBondContact OD1-N 2.89Å; Q299-H301 PolarHBondContact O-CD2 2.89Å
300	C	98.1	Very high	97	Very high	40 Å²	40	58.9 Å²	58.9	27%	0.27	35%	0.352	S	S	.	.			trans	-80.8	126.5	176.4	-178.8	0	0	0	0	111.5	V258 C259	V258-C300 HydrophobicContact CG2-CB 4.08Å; C259-C300 WeakPolarHBondContact CA-SG 3.29Å; C259-C300 HydrophobicContact CB-CB 3.98Å; C259-C300 WeakPolarHBondContact CB-SG 3.39Å; C259-C300 WeakPolarHBondContact SG-CA 3.44Å; C259-C300 WeakPolarHBondContact SG-CB 3.38Å; C259-C300 CovalentContact SG-SG 2.03Å; C259-C300 PolarHBondContact SG-SG 3.18Å
301	H	98	Very high	97	Very high	35 Å²	35	58 Å²	58	16%	0.162	35%	0.345	C	S	.	.			trans	-134.6	45.9	178.9	-58.3	-76.9	0	0	0	111.6	D297 Q299 Y308 S309 M310	D297-H301 VanDerWaalsContact CG-NE2 3.34Å; D297-H301 IonicContact OD1-CD2 3.83Å; D297-H301 IonicContact OD1-NE2 3.39Å; D297-H301 PolarHBondContact OD1-NE2 3.45Å; D297-H301 IonicContact OD2-CE1 2.7Å; D297-H301 PolarHBondContact OD2-CE1 3.19Å; D297-H301 IonicContact OD2-NE2 3.64Å; D297-H301 PolarHBondContact OD2-NE2 3.18Å; Q299-H301 PolarHBondContact O-CD2 2.89Å; H301-Y308 HydrophobicContact CB-CD2 3.94Å; H301-Y308 HydrophobicContact CB-CE2 3.79Å; H301-S309 PolarHBondContact O-N 2.8Å; H301-S309 PolarHBondContact O-OG 2.85Å; H301-M310 HydrophobicContact CB-CB 4.27Å; H301-M310 HydrophobicContact CB-CG 3.78Å
302	L	97.4	Very high	97	Very high	22 Å²	22	58.1 Å²	58.1	12%	0.115	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-83.1	127.3	168.8	-71.3	179.1	0	0	0	110.2	Y217 H219 C259 Q262 M307	Y217-L302 HydrophobicContact CD1-CD2 3.89Å; Y217-L302 HydrophobicContact CE1-CD1 4.37Å; Y217-L302 HydrophobicContact CE1-CD2 3.77Å; H219-L302 HydrophobicContact CB-CD1 4.01Å; C259-L302 HydrophobicContact CB-CD1 3.87Å; C259-L302 HydrophobicContact CB-CG 4.48Å; Q262-L302 HydrophobicContact CB-CD1 4Å; Q262-L302 HydrophobicContact CG-CD1 4.27Å; L302-M307 WeakPolarHBondContact CA-O 3.39Å
303	N	95	Very high	97	Very high	58 Å²	58	61.3 Å²	61.3	31%	0.31	35%	0.352	S	S	.	.			trans	-81.6	-179.8	175.2	73.3	2.5	0	0	0	112	D305 N306 M307	N303-D305 PolarHBondContact O-N 2.98Å; N303-D305 VanDerWaalsContact O-N 3.17Å; N303-D305 WeakPolarHBondContact OD1-CA 3.29Å; N303-D305 WeakPolarHBondContact OD1-CB 3.42Å; N303-D305 PolarHBondContact OD1-N 2.92Å; N303-N306 PolarHBondContact O-N 2.93Å; N303-N306 PolarHBondContact OD1-N 2.83Å; N303-M307 PolarHBondContact N-O 2.79Å; N303-M307 WeakPolarHBondContact OD1-CB 3.43Å; N303-M307 PolarHBondContact OD1-N 3.47Å; N303-M307 PolarHBondContact OD1-O 2.85Å
304	A	94.3	Very high	97.1	Very high	103 Å²	103	56.2 Å²	56.2	85%	0.851	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-21	178.5	0	0	0	0	0	114.1	N306	A304-N306 VanDerWaalsContact C-N 3.27Å
305	D	93.5	Very high	97.1	Very high	122 Å²	122	51.5 Å²	51.5	65%	0.652	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	9.1	176.3	-56.2	-51.3	0	0	0	112.5	N303 M307	N303-D305 PolarHBondContact O-N 2.98Å; N303-D305 VanDerWaalsContact O-N 3.17Å; N303-D305 WeakPolarHBondContact OD1-CA 3.29Å; N303-D305 WeakPolarHBondContact OD1-CB 3.42Å; N303-D305 PolarHBondContact OD1-N 2.92Å; D305-M307 HydrophobicContact CB-CG 4.15Å; D305-M307 PolarHBondContact O-N 2.86Å
306	N	96.6	Very high	97.1	Very high	62 Å²	62	47.1 Å²	47.1	33%	0.332	27%	0.271	S	S	.	.	S	Bend	trans	60.1	26.9	-175.5	-65.1	-35.6	0	0	0	114.2	K218 H219 N303 A304	K218-N306 WeakPolarHBondContact CA-O 3.21Å; H219-N306 HydrophobicContact CB-CB 4.03Å; H219-N306 PolarHBondContact N-O 3.4Å; H219-N306 WeakPolarHBondContact O-CB 3.39Å; N303-N306 PolarHBondContact O-N 2.93Å; N303-N306 PolarHBondContact OD1-N 2.83Å; A304-N306 VanDerWaalsContact C-N 3.27Å
307	M	97.3	Very high	97.1	Very high	56 Å²	56	46.2 Å²	46.2	28%	0.276	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-103.4	145.3	177	-59.5	-70.1	-66.2	0	0	110.7	F215 K218 L302 N303 D305 S309	F215-M307 HydrophobicContact CB-CE 3.5Å; F215-M307 HydrophobicContact CD2-CE 4.44Å; F215-M307 HydrophobicContact CG-CE 4.17Å; K218-M307 HydrophobicContact CB-CE 4.44Å; K218-M307 HydrophobicContact CB-SD 3.58Å; K218-M307 VanDerWaalsContact CB-SD 3.58Å; K218-M307 HydrophobicContact CD-SD 3.73Å; K218-M307 HydrophobicContact CG-SD 3.49Å; K218-M307 WeakPolarHBondContact CG-SD 3.46Å; L302-M307 WeakPolarHBondContact CA-O 3.39Å; N303-M307 PolarHBondContact N-O 2.79Å; N303-M307 WeakPolarHBondContact OD1-CB 3.43Å; N303-M307 PolarHBondContact OD1-N 3.47Å; N303-M307 PolarHBondContact OD1-O 2.85Å; D305-M307 HydrophobicContact CB-CG 4.15Å; D305-M307 PolarHBondContact O-N 2.86Å; M307-S309 PolarHBondContact O-N 3.09Å; M307-S309 VanDerWaalsContact O-N 3.13Å
308	Y	98.2	Very high	97.1	Very high	11 Å²	11	45.6 Å²	45.6	4%	0.043	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-70.6	105.4	173.2	177	-138.7	0	0	0	110.9	Y217 D251 Q255 H301 M310	Y217-Y308 PolarHBondContact O-N 2.82Å; D251-Y308 HydrophobicContact CB-CD1 4.31Å; D251-Y308 HydrophobicContact CB-CE1 4.02Å; D251-Y308 WeakPolarHBondContact OD2-CE1 3.33Å; Q255-Y308 HydrophobicContact CG-CD2 3.63Å; Q255-Y308 HydrophobicContact CG-CE2 3.9Å; Q255-Y308 HydrophobicContact CG-CG 3.98Å; H301-Y308 HydrophobicContact CB-CD2 3.94Å; H301-Y308 HydrophobicContact CB-CE2 3.79Å; Y308-M310 HydrophobicContact CD2-CB 4.47Å; Y308-M310 HydrophobicContact CE2-CB 3.69Å; Y308-M310 PolarHBondContact O-N 2.92Å
309	S	96.9	Very high	97	Very high	59 Å²	59	47.5 Å²	47.5	41%	0.413	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-25.3	-171.7	59.8	0	0	0	0	113.9	H301 M307 S311	H301-S309 PolarHBondContact O-N 2.8Å; H301-S309 PolarHBondContact O-OG 2.85Å; M307-S309 PolarHBondContact O-N 3.09Å; M307-S309 VanDerWaalsContact O-N 3.13Å; S309-S311 VanDerWaalsContact C-N 3.34Å
310	M	97.2	Very high	96.7	Very high	68 Å²	68	45.7 Å²	45.7	34%	0.335	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	9.5	-178.6	-62.9	-62.3	-174.5	0	0	113.4	H301 Y308 T312 T313 M314	H301-M310 HydrophobicContact CB-CB 4.27Å; H301-M310 HydrophobicContact CB-CG 3.78Å; Y308-M310 HydrophobicContact CD2-CB 4.47Å; Y308-M310 HydrophobicContact CE2-CB 3.69Å; Y308-M310 PolarHBondContact O-N 2.92Å; M310-T312 PolarHBondContact O-N 3.06Å; M310-T312 VanDerWaalsContact O-N 3.14Å; M310-T313 WeakPolarHBondContact CA-OG1 3.2Å; M310-T313 PolarHBondContact O-N 3.34Å; M310-T313 VanDerWaalsContact O-N 3.11Å; M310-T313 PolarHBondContact O-OG1 2.82Å; M310-T313 PolarHBondContact SD-OG1 2.92Å; M310-M314 HydrophobicContact CB-CB 4.05Å; M310-M314 HydrophobicContact CB-CE 4.37Å; M310-M314 HydrophobicContact CG-CE 4.39Å; M310-M314 WeakPolarHBondContact O-CB 3.19Å; M310-M314 PolarHBondContact O-N 2.93Å
311	S	97	Very high	96.5	Very high	5 Å²	5	45 Å²	45	4%	0.035	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-36.1	-177.3	-173.7	0	0	0	0	113.7	K186 P187 S309	K186-S311 VanDerWaalsContact CD-O 3.29Å; K186-S311 WeakPolarHBondContact CD-O 3.23Å; K186-S311 WeakPolarHBondContact CG-O 3.38Å; K186-S311 PolarHBondContact NZ-O 2.89Å; P187-S311 WeakPolarHBondContact CD-OG 2.97Å; S309-S311 VanDerWaalsContact C-N 3.34Å
312	T	97.2	Very high	96.4	Very high	64 Å²	64	43.3 Å²	43.3	39%	0.393	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-3.8	-177.3	55.5	0	0	0	0	114.3	P187 L188 I292 M310	P187-T312 HydrophobicContact CG-CG2 3.77Å; L188-T312 HydrophobicContact CD2-CG2 4.38Å; I292-T312 WeakPolarHBondContact CD1-O 3.47Å; M310-T312 PolarHBondContact O-N 3.06Å; M310-T312 VanDerWaalsContact O-N 3.14Å
313	T	97.5	Very high	96.2	Very high	73 Å²	73	44.2 Å²	44.2	45%	0.448	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-23.2	-174.4	53.8	0	0	0	0	113.3	H294 M310	H294-T313 WeakPolarHBondContact CB-O 3.37Å; M310-T313 WeakPolarHBondContact CA-OG1 3.2Å; M310-T313 PolarHBondContact O-N 3.34Å; M310-T313 VanDerWaalsContact O-N 3.11Å; M310-T313 PolarHBondContact O-OG1 2.82Å; M310-T313 PolarHBondContact SD-OG1 2.92Å
314	M	98.1	Very high	96	Very high	7 Å²	7	46.5 Å²	46.5	3%	0.034	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-118.3	139.3	-175.5	-169.5	177.1	-68.4	0	0	111	K186 P295 N296 D297 M310	K186-M314 PolarHBondContact NZ-O 3.37Å; P295-M314 WeakPolarHBondContact O-CG 3.34Å; N296-M314 HydrophobicContact CB-CG 4.35Å; N296-M314 HydrophobicContact CB-SD 4.34Å; D297-M314 HydrophobicContact CB-CE 4.21Å; D297-M314 HydrophobicContact CB-SD 4.47Å; D297-M314 WeakPolarHBondContact OD2-CE 3.4Å; M310-M314 HydrophobicContact CB-CB 4.05Å; M310-M314 HydrophobicContact CB-CE 4.37Å; M310-M314 HydrophobicContact CG-CE 4.39Å; M310-M314 WeakPolarHBondContact O-CB 3.19Å; M310-M314 PolarHBondContact O-N 2.93Å
315	D	98.5	Very high	96	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.043	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-70.3	165.1	-177.8	-163.6	10.6	0	0	0	111.6	L285 G287 I292 H294 N296	L285-D315 WeakPolarHBondContact CA-OD2 2.73Å; L285-D315 PolarHBondContact N-OD2 3.01Å; G287-D315 VanDerWaalsContact CA-OD1 3.25Å; G287-D315 WeakPolarHBondContact CA-OD1 3.02Å; G287-D315 PolarHBondContact N-OD1 2.95Å; I292-D315 HydrophobicContact CG2-CB 4.05Å; I292-D315 VanDerWaalsContact CG2-N 3.27Å; H294-D315 WeakPolarHBondContact O-CB 3.28Å; H294-D315 PolarHBondContact O-N 3.43Å; N296-D315 WeakPolarHBondContact CB-O 3.44Å; N296-D315 PolarHBondContact ND2-O 3.46Å; N296-D315 VanDerWaalsContact ND2-O 3.13Å
316	Y	98.6	Very high	95.9	Very high	1 Å²	1	37.1 Å²	37.1	0%	0.004	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-61.7	150.9	172.5	-55.5	-82.9	0	0	0	110.4	D185 K186 H282 A284 D286	D185-Y316 WeakPolarHBondContact OD1-CE1 3.25Å; D185-Y316 PolarHBondContact OD1-OH 2.88Å; D185-Y316 PolarHBondContact OD2-OH 2.91Å; K186-Y316 HydrophobicContact CD-CE1 3.83Å; K186-Y316 HydrophobicContact CD-CE2 3.84Å; K186-Y316 VanDerWaalsContact CD-CZ 3.44Å; K186-Y316 WeakPolarHBondContact CD-OH 3.32Å; K186-Y316 VanDerWaalsContact CE-CE1 3.4Å; K186-Y316 VanDerWaalsContact CE-CE2 3.42Å; K186-Y316 HydrophobicContact CG-CE1 3.79Å; K186-Y316 WeakPolarHBondContact CG-OH 3.36Å; H282-Y316 HydrophobicContact CB-CD1 3.79Å; H282-Y316 HydrophobicContact CB-CD2 3.79Å; H282-Y316 HydrophobicContact CB-CE1 3.56Å; H282-Y316 HydrophobicContact CB-CE2 3.57Å; H282-Y316 HydrophobicContact CB-CG 3.89Å; H282-Y316 VanDerWaalsContact CB-CZ 3.43Å; H282-Y316 AromaticContact CD2-CZ 3.7Å; H282-Y316 PolarHBondContact CD2-OH 2.89Å; H282-Y316 VanDerWaalsContact CD2-OH 3.31Å; H282-Y316 AromaticContact CG-CE2 3.81Å; H282-Y316 AromaticContact CG-CZ 3.64Å; A284-Y316 WeakPolarHBondContact CA-O 3.44Å; A284-Y316 WeakPolarHBondContact CB-O 2.96Å; D286-Y316 HydrophobicContact CB-CD2 4.09Å; D286-Y316 HydrophobicContact CB-CE2 4.1Å
317	P	98	Very high	95.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-75.5	151.2	179.9	30.9	-34.8	0	0	0	112	F250 D251 I254 A284 N296 L321 I322	F250-P317 HydrophobicContact CB-CG 3.89Å; F250-P317 VanDerWaalsContact O-CG 3.3Å; F250-P317 WeakPolarHBondContact O-CG 3.1Å; D251-P317 WeakPolarHBondContact OD1-CD 3.37Å; I254-P317 HydrophobicContact CB-CG 4.31Å; I254-P317 HydrophobicContact CD1-CB 4.38Å; I254-P317 HydrophobicContact CG1-CB 3.57Å; I254-P317 HydrophobicContact CG1-CG 3.5Å; A284-P317 PolarHBondContact N-O 2.65Å; N296-P317 HydrophobicContact CB-CB 4.07Å; P317-L321 HydrophobicContact CB-CD2 3.97Å; P317-I322 HydrophobicContact CB-CG1 4.24Å; P317-I322 HydrophobicContact CG-CD1 4.2Å; P317-I322 HydrophobicContact CG-CG1 4.16Å
318	S	96.9	Very high	95.1	Very high	51 Å²	51	38 Å²	38	36%	0.357	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-78.6	157	173.1	71.9	0	0	0	0	110.7	A320 L321 I322	S318-A320 PolarHBondContact O-N 3.28Å; S318-L321 PolarHBondContact O-N 3.22Å; S318-L321 VanDerWaalsContact O-N 3.11Å; S318-L321 PolarHBondContact OG-N 2.79Å; S318-I322 WeakPolarHBondContact O-CG1 3.47Å; S318-I322 PolarHBondContact O-N 3.01Å
319	L	94.8	Very high	94.8	Very high	42 Å²	42	38 Å²	38	22%	0.22	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-36.7	175.4	-65.2	174.7	0	0	0	112	F250 I322 T323 Y348 L351 I352	F250-L319 HydrophobicContact CE2-CD2 3.53Å; F250-L319 HydrophobicContact CZ-CD2 3.82Å; L319-I322 PolarHBondContact O-N 2.96Å; L319-T323 PolarHBondContact O-N 3.37Å; L319-T323 PolarHBondContact O-OG1 2.54Å; L319-T323 VanDerWaalsContact O-OG1 3.08Å; L319-Y348 HydrophobicContact CD1-CD1 3.77Å; L319-Y348 HydrophobicContact CD1-CE1 4.03Å; L319-Y348 HydrophobicContact CD2-CD1 3.88Å; L319-Y348 HydrophobicContact CD2-CE1 4.3Å; L319-Y348 HydrophobicContact CD2-CG 4.37Å; L319-Y348 HydrophobicContact CG-CD1 4.48Å; L319-L351 HydrophobicContact CD1-CD1 3.77Å; L319-I352 HydrophobicContact CD2-CD1 4.05Å
320	A	91.9	Very high	94.5	Very high	72 Å²	72	36.8 Å²	36.8	60%	0.595	21%	0.21	S	C	*	.	H	α-helix	trans	-64.2	-42.2	177.1	0	0	0	0	0	112.1	S318 T323 E324	S318-A320 PolarHBondContact O-N 3.28Å; A320-T323 PolarHBondContact O-N 3.08Å; A320-E324 PolarHBondContact O-N 3.48Å
321	L	94.7	Very high	94.3	Very high	25 Å²	25	34 Å²	34	13%	0.131	20%	0.197	C	C	.	.	H	α-helix	trans	-65.9	-39.7	176.5	-177.6	62.5	0	0	0	111.5	I254 N296 P317 S318 E324 K325	I254-L321 HydrophobicContact CD1-CG 4.43Å; N296-L321 HydrophobicContact CB-CD2 3.83Å; P317-L321 HydrophobicContact CB-CD2 3.97Å; S318-L321 PolarHBondContact O-N 3.22Å; S318-L321 VanDerWaalsContact O-N 3.11Å; S318-L321 PolarHBondContact OG-N 2.79Å; L321-E324 PolarHBondContact O-N 2.76Å; L321-K325 HydrophobicContact CD1-CG 4.18Å; L321-K325 WeakPolarHBondContact O-CG 3.48Å; L321-K325 PolarHBondContact O-N 2.96Å
322	I	96	Very high	94.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-52.2	172.3	-66.3	171	0	0	0	109.8	F250 I253 I254 P317 S318 L319 E324 K325 M326 I352	F250-I322 HydrophobicContact CB-CD1 4.07Å; F250-I322 HydrophobicContact CD1-CD1 4.08Å; F250-I322 HydrophobicContact CD2-CD1 3.53Å; F250-I322 HydrophobicContact CE1-CD1 4.36Å; F250-I322 HydrophobicContact CE2-CD1 3.89Å; F250-I322 HydrophobicContact CG-CD1 3.63Å; F250-I322 HydrophobicContact CZ-CD1 4.28Å; I253-I322 HydrophobicContact CG2-CG2 4.22Å; I254-I322 HydrophobicContact CD1-CB 4.38Å; I254-I322 HydrophobicContact CD1-CG1 3.87Å; I254-I322 HydrophobicContact CG1-CG1 4Å; P317-I322 HydrophobicContact CB-CG1 4.24Å; P317-I322 HydrophobicContact CG-CD1 4.2Å; P317-I322 HydrophobicContact CG-CG1 4.16Å; S318-I322 WeakPolarHBondContact O-CG1 3.47Å; S318-I322 PolarHBondContact O-N 3.01Å; L319-I322 PolarHBondContact O-N 2.96Å; I322-E324 VanDerWaalsContact C-N 3.32Å; I322-E324 PolarHBondContact O-N 2.86Å; I322-K325 PolarHBondContact O-N 3.27Å; I322-M326 HydrophobicContact CG2-CE 4.26Å; I322-M326 HydrophobicContact CG2-CG 3.93Å; I322-M326 WeakPolarHBondContact O-CB 3.47Å; I322-M326 WeakPolarHBondContact O-CG 3.29Å; I322-M326 PolarHBondContact O-N 3.21Å; I322-I352 HydrophobicContact CG2-CD1 4.04Å
323	T	91.8	Very high	94	Very high	41 Å²	41	31.2 Å²	31.2	25%	0.252	18%	0.179	S	C	.	.	H	α-helix	trans	-56.2	-44.9	178.9	-64.4	0	0	0	0	112.3	L319 A320 S327	L319-T323 PolarHBondContact O-N 3.37Å; L319-T323 PolarHBondContact O-OG1 2.54Å; L319-T323 VanDerWaalsContact O-OG1 3.08Å; A320-T323 PolarHBondContact O-N 3.08Å; T323-S327 PolarHBondContact O-N 3.05Å; T323-S327 VanDerWaalsContact O-N 3.09Å
324	E	90.6	Very high	93.9	Very high	105 Å²	105	27.7 Å²	27.7	49%	0.491	16%	0.158	S	C	.	.	H	α-helix	trans	-59.1	-53.4	177	-174.3	-167.8	139.1	0	0	111.3	A320 L321 I322 S327 E328	A320-E324 PolarHBondContact O-N 3.48Å; L321-E324 PolarHBondContact O-N 2.76Å; I322-E324 VanDerWaalsContact C-N 3.32Å; I322-E324 PolarHBondContact O-N 2.86Å; E324-S327 PolarHBondContact O-N 3.32Å; E324-E328 WeakPolarHBondContact O-CB 3.47Å; E324-E328 PolarHBondContact O-N 3.23Å
325	K	94.1	Very high	93.8	Very high	21 Å²	21	27.4 Å²	27.4	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-72.9	-30.3	-175.3	-61.9	-60.9	163.6	-151.2	0	113.3	I254 V258 L321 I322 E328 N329	I254-K325 HydrophobicContact CD1-CB 3.99Å; I254-K325 HydrophobicContact CD1-CG 4.17Å; V258-K325 HydrophobicContact CG1-CB 4.02Å; V258-K325 HydrophobicContact CG1-CD 4.01Å; V258-K325 HydrophobicContact CG1-CG 3.99Å; L321-K325 HydrophobicContact CD1-CG 4.18Å; L321-K325 WeakPolarHBondContact O-CG 3.48Å; L321-K325 PolarHBondContact O-N 2.96Å; I322-K325 PolarHBondContact O-N 3.27Å; K325-E328 WeakPolarHBondContact CD-OE2 3.06Å; K325-E328 IonicContact NZ-OE2 3.61Å; K325-E328 PolarHBondContact NZ-OE2 2.7Å; K325-N329 VanDerWaalsContact O-CB 3.25Å; K325-N329 WeakPolarHBondContact O-CB 3.46Å; K325-N329 VanDerWaalsContact O-CG 3.25Å; K325-N329 PolarHBondContact O-N 2.79Å; K325-N329 VanDerWaalsContact O-N 3.14Å; K325-N329 PolarHBondContact O-ND2 2Å
326	M	92.1	Very high	93.6	Very high	8 Å²	8	27 Å²	27	4%	0.039	15%	0.154	C	C	.	.	H	α-helix	trans	-64.9	-44.7	171.4	-67.6	-56.2	128.1	0	0	110.8	I253 A257 L273 I322 N330 I331 L333	I253-M326 HydrophobicContact CG2-CE 3.25Å; I253-M326 HydrophobicContact CG2-SD 4.33Å; A257-M326 HydrophobicContact CB-CE 3.34Å; A257-M326 HydrophobicContact CB-SD 4.09Å; L273-M326 HydrophobicContact CD2-CE 4.5Å; L273-M326 HydrophobicContact CD2-SD 4.43Å; I322-M326 HydrophobicContact CG2-CE 4.26Å; I322-M326 HydrophobicContact CG2-CG 3.93Å; I322-M326 WeakPolarHBondContact O-CB 3.47Å; I322-M326 WeakPolarHBondContact O-CG 3.29Å; I322-M326 PolarHBondContact O-N 3.21Å; M326-N330 WeakPolarHBondContact O-CA 3.18Å; M326-N330 PolarHBondContact O-N 3.26Å; M326-I331 PolarHBondContact O-N 3.22Å; M326-I331 HydrophobicContact SD-CB 3.67Å; M326-I331 HydrophobicContact SD-CG1 4.39Å; M326-I331 HydrophobicContact SD-CG2 3.62Å; M326-L333 HydrophobicContact SD-CB 4.36Å
327	S	88.5	Confident	93.4	Very high	31 Å²	31	27 Å²	27	22%	0.217	15%	0.154	C	C	.	.	H	α-helix	trans	-67	-46.8	177.7	-179.7	0	0	0	0	112.5	T323 E324 N329 N330 E385 K444	T323-S327 PolarHBondContact O-N 3.05Å; T323-S327 VanDerWaalsContact O-N 3.09Å; E324-S327 PolarHBondContact O-N 3.32Å; S327-N329 PolarHBondContact O-N 2.83Å; S327-N330 PolarHBondContact O-N 2.03Å; S327-N330 VanDerWaalsContact O-N 3.16Å; S327-N330 PolarHBondContact O-OD1 3.39Å; S327-E385 PolarHBondContact OG-OE1 2.78Å; S327-E385 PolarHBondContact OG-OE2 2.9Å; S327-K444 PolarHBondContact O-NZ 2.89Å
328	E	88.8	Confident	93	Very high	106 Å²	106	27.3 Å²	27.3	50%	0.495	16%	0.156	S	C	.	.	H	α-helix	trans	-57.5	-37.5	-179.6	-172.2	-176.7	167.9	0	0	111.3	E324 K325	E324-E328 WeakPolarHBondContact O-CB 3.47Å; E324-E328 PolarHBondContact O-N 3.23Å; K325-E328 WeakPolarHBondContact CD-OE2 3.06Å; K325-E328 IonicContact NZ-OE2 3.61Å; K325-E328 PolarHBondContact NZ-OE2 2.7Å
329	N	91.3	Very high	92.6	Very high	10 Å²	10	30.3 Å²	30.3	5%	0.053	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	5.8	-175.9	-56.5	-39.1	0	0	0	113.4	A257 K260 H271 K325 S327 I331	A257-N329 PolarHBondContact O-ND2 3.09Å; K260-N329 VanDerWaalsContact CE-CG 3.43Å; K260-N329 WeakPolarHBondContact CE-OD1 3.41Å; K260-N329 PolarHBondContact NZ-OD1 3Å; H271-N329 PolarHBondContact ND1-O 2.81Å; H271-N329 VanDerWaalsContact ND1-O 3.14Å; K325-N329 VanDerWaalsContact O-CB 3.25Å; K325-N329 WeakPolarHBondContact O-CB 3.46Å; K325-N329 VanDerWaalsContact O-CG 3.25Å; K325-N329 PolarHBondContact O-N 2.79Å; K325-N329 VanDerWaalsContact O-N 3.14Å; K325-N329 PolarHBondContact O-ND2 2Å; S327-N329 PolarHBondContact O-N 2.83Å; N329-I331 HydrophobicContact CB-CD1 4.46Å; N329-I331 HydrophobicContact CB-CG1 3.87Å; N329-I331 PolarHBondContact O-N 3.1Å
330	N	90.4	Very high	92.3	Very high	33 Å²	33	33.4 Å²	33.4	18%	0.176	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	40.4	-178.7	-56.3	-46.5	0	0	0	113.2	H271 M326 S327 K444	H271-N330 PolarHBondContact ND1-O 3.13Å; M326-N330 WeakPolarHBondContact O-CA 3.18Å; M326-N330 PolarHBondContact O-N 3.26Å; S327-N330 PolarHBondContact O-N 2.03Å; S327-N330 VanDerWaalsContact O-N 3.16Å; S327-N330 PolarHBondContact O-OD1 3.39Å; N330-K444 PolarHBondContact OD1-NZ 2.65Å
331	I	92.8	Very high	92.4	Very high	11 Å²	11	30.6 Å²	30.6	6%	0.056	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.5	-179.6	-55	-61.3	0	0	0	109.8	A257 W265 H271 L273 M326 N329	A257-I331 HydrophobicContact CB-CG1 4.03Å; W265-I331 HydrophobicContact CD2-CD1 3.85Å; W265-I331 HydrophobicContact CE3-CD1 4.3Å; W265-I331 HydrophobicContact CG-CD1 4.25Å; W265-I331 HydrophobicContact CH2-CD1 4.34Å; W265-I331 HydrophobicContact CZ2-CD1 3.9Å; H271-I331 HydrophobicContact CB-CD1 3.55Å; L273-I331 HydrophobicContact CB-CG2 3.5Å; L273-I331 HydrophobicContact CD2-CG2 4.05Å; L273-I331 HydrophobicContact CG-CG2 4.44Å; M326-I331 PolarHBondContact O-N 3.22Å; M326-I331 HydrophobicContact SD-CB 3.67Å; M326-I331 HydrophobicContact SD-CG1 4.39Å; M326-I331 HydrophobicContact SD-CG2 3.62Å; N329-I331 HydrophobicContact CB-CD1 4.46Å; N329-I331 HydrophobicContact CB-CG1 3.87Å; N329-I331 PolarHBondContact O-N 3.1Å
332	N	92.9	Very high	92.2	Very high	8 Å²	8	30.4 Å²	30.4	4%	0.043	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	108	169.7	-53.9	-88.4	0	0	0	108.5	H271 L272 L273 I378	H271-N332 WeakPolarHBondContact O-CB 3.36Å; H271-N332 PolarHBondContact O-N 3.02Å; H271-N332 PolarHBondContact O-ND2 3.12Å; L272-N332 HydrophobicContact CD2-CB 4.15Å; L273-N332 PolarHBondContact N-O 3Å; N332-I378 HydrophobicContact CB-CD1 3.78Å
333	L	95.3	Very high	92	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126.5	179.9	171.5	67	0	0	0	110.6	I253 L273 F275 M326 F335 T355 T356	I253-L333 HydrophobicContact CD1-CD1 3.95Å; I253-L333 HydrophobicContact CD1-CD2 3.96Å; I253-L333 HydrophobicContact CG1-CD1 4.21Å; I253-L333 HydrophobicContact CG2-CD2 4.18Å; L273-L333 HydrophobicContact CB-CD1 4.4Å; L273-L333 HydrophobicContact CD2-CD1 4.01Å; L273-L333 HydrophobicContact CG-CD1 3.99Å; F275-L333 HydrophobicContact CB-CD1 3.87Å; M326-L333 HydrophobicContact SD-CB 4.36Å; L333-F335 HydrophobicContact CD1-CE1 4.43Å; L333-F335 HydrophobicContact CD2-CE1 3.78Å; L333-F335 HydrophobicContact CD2-CE2 4.02Å; L333-F335 HydrophobicContact CD2-CZ 3.43Å; L333-F335 VanDerWaalsContact CD2-CZ 3.43Å; L333-F335 HydrophobicContact CG-CE1 4.17Å; L333-F335 HydrophobicContact CG-CE2 4.37Å; L333-F335 HydrophobicContact CG-CZ 4.07Å; L333-T355 HydrophobicContact CB-CG2 3.79Å; L333-T355 HydrophobicContact CD2-CG2 4.2Å; L333-T355 HydrophobicContact CG-CG2 4.23Å; L333-T355 WeakPolarHBondContact O-CA 3.25Å; L333-T355 VanDerWaalsContact O-CB 3.28Å; L333-T355 WeakPolarHBondContact O-CB 3.4Å; L333-T356 PolarHBondContact O-N 3.45Å
334	I	95.8	Very high	92	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.1	-180	-60.1	170.2	0	0	0	108	L272 L273 I274 F275 A336 T356 L370 A374 I378	L272-I334 HydrophobicContact CB-CD1 4.47Å; L272-I334 HydrophobicContact CD2-CD1 4.32Å; L273-I334 PolarHBondContact O-N 3.35Å; I274-I334 HydrophobicContact CD1-CB 3.91Å; I274-I334 HydrophobicContact CD1-CD1 3.42Å; I274-I334 VanDerWaalsContact CD1-CD1 3.42Å; I274-I334 HydrophobicContact CD1-CG1 4.12Å; I274-I334 HydrophobicContact CD1-CG2 4.39Å; F275-I334 PolarHBondContact N-O 2.79Å; I334-A336 PolarHBondContact O-N 2.97Å; I334-T356 CarbonylContact C-O 3.17Å; I334-T356 WeakPolarHBondContact CA-O 3.18Å; I334-L370 HydrophobicContact CG2-CD2 3.93Å; I334-A374 HydrophobicContact CD1-CB 3.68Å; I334-A374 HydrophobicContact CG1-CB 4.09Å; I334-A374 HydrophobicContact CG2-CB 3.79Å; I334-I378 HydrophobicContact CD1-CD1 3.89Å; I334-I378 HydrophobicContact CG1-CD1 4.04Å
335	F	96.4	Very high	92.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	104.2	173.2	-64.9	-64.1	0	0	0	109.5	F250 I253 F275 L333 V337 Y345 I352 T355 T356 V357 G358	F250-F335 HydrophobicContact CE1-CE1 4.33Å; I253-F335 HydrophobicContact CD1-CE1 4.15Å; F275-F335 HydrophobicContact CB-CD1 4.21Å; F275-F335 AromaticContact CD1-CD1 3.66Å; F275-F335 HydrophobicContact CD1-CD1 3.66Å; F275-F335 HydrophobicContact CD1-CE1 4.23Å; F275-F335 HydrophobicContact CE1-CD1 4.34Å; F275-F335 HydrophobicContact CG-CD1 4.13Å; F275-F335 HydrophobicContact CG-CE1 4.47Å; L333-F335 HydrophobicContact CD1-CE1 4.43Å; L333-F335 HydrophobicContact CD2-CE1 3.78Å; L333-F335 HydrophobicContact CD2-CE2 4.02Å; L333-F335 HydrophobicContact CD2-CZ 3.43Å; L333-F335 VanDerWaalsContact CD2-CZ 3.43Å; L333-F335 HydrophobicContact CG-CE1 4.17Å; L333-F335 HydrophobicContact CG-CE2 4.37Å; L333-F335 HydrophobicContact CG-CZ 4.07Å; F335-V337 HydrophobicContact CB-CG1 4.33Å; F335-Y345 HydrophobicContact CB-CD1 4.31Å; F335-Y345 AromaticContact CD1-CD1 3.5Å; F335-Y345 HydrophobicContact CD1-CD1 3.5Å; F335-Y345 VanDerWaalsContact CD1-CD1 3.5Å; F335-Y345 AromaticContact CD1-CE1 3.95Å; F335-Y345 HydrophobicContact CD1-CE1 3.95Å; F335-Y345 HydrophobicContact CD1-CG 4.46Å; F335-Y345 HydrophobicContact CD2-CD1 4.41Å; F335-Y345 AromaticContact CE1-CD1 3.78Å; F335-Y345 HydrophobicContact CE1-CD1 3.78Å; F335-Y345 HydrophobicContact CE1-CE1 4.08Å; F335-Y345 AromaticContact CG-CD1 3.84Å; F335-Y345 HydrophobicContact CG-CD1 3.84Å; F335-Y345 HydrophobicContact CG-CG 4.44Å; F335-Y345 HydrophobicContact CZ-CD1 4.34Å; F335-I352 HydrophobicContact CZ-CD1 4.28Å; F335-T355 HydrophobicContact CE2-CG2 4.48Å; F335-T356 PolarHBondContact N-O 3.27Å; F335-V357 HydrophobicContact CB-CB 4.5Å; F335-V357 HydrophobicContact CB-CG1 4.31Å; F335-V357 HydrophobicContact CB-CG2 4.2Å; F335-V357 HydrophobicContact CD2-CG2 4.18Å; F335-V357 CarbonylContact O-C 3.37Å; F335-V357 WeakPolarHBondContact O-CA 3.44Å; F335-G358 PolarHBondContact O-N 3.08Å
336	A	94.9	Very high	91.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	94.2	172.1	0	0	0	0	0	108.6	I274 F275 T276 S277 I334 G358 L360 L370	I274-A336 HydrophobicContact CG2-CB 4.43Å; F275-A336 PolarHBondContact O-N 2.92Å; T276-A336 VanDerWaalsContact CA-O 3.29Å; T276-A336 WeakPolarHBondContact CA-O 3.16Å; T276-A336 HydrophobicContact CG2-CB 3.7Å; S277-A336 PolarHBondContact N-O 3.2Å; I334-A336 PolarHBondContact O-N 2.97Å; A336-G358 WeakPolarHBondContact CA-O 3.33Å; A336-L360 HydrophobicContact CB-CD1 4.5Å; A336-L360 WeakPolarHBondContact O-CD2 3.37Å; A336-L370 HydrophobicContact CB-CD1 3.8Å; A336-L370 HydrophobicContact CB-CD2 3.91Å
337	V	94.1	Very high	91.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	152.5	-169.5	-58.3	0	0	0	0	112.1	F275 S277 F335 V341 V342 Y345 V357 G358 T359 L360	F275-V337 HydrophobicContact CD1-CG1 4.41Å; F275-V337 HydrophobicContact CE1-CG1 4.45Å; S277-V337 VanDerWaalsContact O-CA 3.26Å; S277-V337 WeakPolarHBondContact O-CA 3.23Å; S277-V337 WeakPolarHBondContact O-CB 3.2Å; F335-V337 HydrophobicContact CB-CG1 4.33Å; V337-V341 HydrophobicContact CB-CG2 3.85Å; V337-V341 HydrophobicContact CG2-CG2 4.14Å; V337-V342 HydrophobicContact CG2-CG2 3.94Å; V337-Y345 HydrophobicContact CB-CD2 4.05Å; V337-Y345 HydrophobicContact CB-CE2 4.29Å; V337-Y345 HydrophobicContact CG1-CD1 4.28Å; V337-Y345 HydrophobicContact CG1-CD2 3.72Å; V337-Y345 HydrophobicContact CG1-CE1 4.35Å; V337-Y345 HydrophobicContact CG1-CE2 3.8Å; V337-Y345 HydrophobicContact CG1-CG 3.96Å; V337-Y345 HydrophobicContact CG2-CD2 3.79Å; V337-Y345 HydrophobicContact CG2-CG 4.14Å; V337-V357 HydrophobicContact CG2-CG1 4.18Å; V337-G358 PolarHBondContact N-O 3.29Å; V337-T359 WeakPolarHBondContact O-CA 3.29Å; V337-L360 PolarHBondContact O-N 3.49Å
338	T	89.9	Confident	92	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.043	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	156.6	-179	62.4	0	0	0	0	111.9	D278 P340 V341 V342	D278-T338 VanDerWaalsContact CA-OG1 3.29Å; D278-T338 WeakPolarHBondContact CA-OG1 3.31Å; D278-T338 HydrophobicContact CB-CG2 3.53Å; D278-T338 PolarHBondContact O-OG1 3.5Å; T338-P340 VanDerWaalsContact C-N 3.35Å; T338-P340 WeakPolarHBondContact O-CD 3.01Å; T338-P340 VanDerWaalsContact O-N 3.14Å; T338-V341 VanDerWaalsContact O-CG2 3.29Å; T338-V341 WeakPolarHBondContact O-CG2 3.49Å; T338-V341 PolarHBondContact O-N 3.07Å; T338-V341 VanDerWaalsContact O-N 3.11Å; T338-V342 WeakPolarHBondContact O-CG2 3.47Å; T338-V342 PolarHBondContact O-N 2.96Å
339	N	87.3	Confident	92.1	Very high	114 Å²	114	31.7 Å²	31.7	61%	0.61	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-48.2	-41.9	-172.9	-164.4	21.7	0	0	0	115.5	V341 V342 T359	N339-V341 PolarHBondContact O-N 3.35Å; N339-V341 VanDerWaalsContact O-N 3.13Å; N339-V342 PolarHBondContact O-N 3.38Å; N339-T359 HydrophobicContact CB-CG2 4.25Å
340	P	89.1	Confident	91.7	Very high	107 Å²	107	37 Å²	37	70%	0.695	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-60	-27.2	-177.9	-24.4	35.4	0	0	0	114.8	T338	T338-P340 VanDerWaalsContact C-N 3.35Å; T338-P340 WeakPolarHBondContact O-CD 3.01Å; T338-P340 VanDerWaalsContact O-N 3.14Å
341	V	93.3	Very high	91.5	Very high	13 Å²	13	40.7 Å²	40.7	8%	0.079	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-110	-4.8	-175.3	-65.7	0	0	0	0	113.4	K280 V337 T338 N339 P343 L344 Y345	K280-V341 HydrophobicContact CG-CG1 4.32Å; V337-V341 HydrophobicContact CB-CG2 3.85Å; V337-V341 HydrophobicContact CG2-CG2 4.14Å; T338-V341 VanDerWaalsContact O-CG2 3.29Å; T338-V341 WeakPolarHBondContact O-CG2 3.49Å; T338-V341 PolarHBondContact O-N 3.07Å; T338-V341 VanDerWaalsContact O-N 3.11Å; N339-V341 PolarHBondContact O-N 3.35Å; N339-V341 VanDerWaalsContact O-N 3.13Å; V341-P343 VanDerWaalsContact C-CD 3.47Å; V341-P343 VanDerWaalsContact C-N 3.35Å; V341-L344 WeakPolarHBondContact O-CB 3.29Å; V341-L344 PolarHBondContact O-N 2.95Å; V341-Y345 HydrophobicContact CB-CD2 4.1Å; V341-Y345 HydrophobicContact CB-CE2 3.99Å; V341-Y345 HydrophobicContact CG2-CD2 4.15Å; V341-Y345 HydrophobicContact CG2-CE2 3.95Å; V341-Y345 WeakPolarHBondContact O-CD2 3.47Å; V341-Y345 PolarHBondContact O-N 3.11Å
342	V	90.7	Very high	91.2	Very high	21 Å²	21	40.2 Å²	40.2	13%	0.127	22%	0.219	C	C	.	.	H	α-helix	trans	-48.9	-47.4	177.1	168.7	0	0	0	0	112.9	V337 T338 N339 L344 Y345 Q346 V357 T359	V337-V342 HydrophobicContact CG2-CG2 3.94Å; T338-V342 WeakPolarHBondContact O-CG2 3.47Å; T338-V342 PolarHBondContact O-N 2.96Å; N339-V342 PolarHBondContact O-N 3.38Å; V342-L344 PolarHBondContact O-N 3.05Å; V342-Y345 PolarHBondContact O-N 2.85Å; V342-Q346 WeakPolarHBondContact O-CB 3.46Å; V342-Q346 PolarHBondContact O-N 3.25Å; V342-V357 HydrophobicContact CG1-CG1 4.44Å; V342-T359 HydrophobicContact CG2-CG2 4.1Å
343	P	91.6	Very high	90.5	Very high	82 Å²	82	43.7 Å²	43.7	53%	0.532	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-33.3	-179.3	-24.2	35.1	0	0	0	113.5	V341 N347	V341-P343 VanDerWaalsContact C-CD 3.47Å; V341-P343 VanDerWaalsContact C-N 3.35Å; P343-N347 VanDerWaalsContact O-CG 3.31Å; P343-N347 PolarHBondContact O-N 3.34Å; P343-N347 PolarHBondContact O-ND2 3.22Å; P343-N347 PolarHBondContact O-OD1 3.46Å
344	L	92.1	Very high	89.6	Confident	50 Å²	50	45.3 Å²	45.3	26%	0.262	26%	0.259	S	S	.	.	H	α-helix	trans	-68.2	-49.5	178.6	177.4	63.7	0	0	0	111	K280 V341 V342 Q346 N347 Y348	K280-L344 HydrophobicContact CB-CD2 4.2Å; K280-L344 HydrophobicContact CD-CD2 4.4Å; K280-L344 HydrophobicContact CG-CD2 3.86Å; V341-L344 WeakPolarHBondContact O-CB 3.29Å; V341-L344 PolarHBondContact O-N 2.95Å; V342-L344 PolarHBondContact O-N 3.05Å; L344-Q346 VanDerWaalsContact C-N 3.29Å; L344-Q346 PolarHBondContact O-N 2.59Å; L344-N347 WeakPolarHBondContact O-CB 3.36Å; L344-N347 PolarHBondContact O-N 2.94Å; L344-Y348 HydrophobicContact CD1-CE2 3.93Å; L344-Y348 HydrophobicContact CD2-CE2 4.17Å; L344-Y348 HydrophobicContact CG-CD2 4.3Å; L344-Y348 HydrophobicContact CG-CE2 3.71Å; L344-Y348 PolarHBondContact O-N 3.15Å; L344-Y348 VanDerWaalsContact O-N 3.12Å
345	Y	94.5	Very high	89.3	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-71.4	-25.6	-179.8	-72.1	-86.2	0	0	0	112.6	F275 A279 T281 F335 V337 V341 V342 Y348 S349 V357	F275-Y345 HydrophobicContact CD1-CE1 4.41Å; F275-Y345 AromaticContact CE1-CE1 3.76Å; F275-Y345 HydrophobicContact CE1-CE1 3.76Å; F275-Y345 AromaticContact CE1-CZ 3.96Å; A279-Y345 WeakPolarHBondContact O-CE2 3.4Å; A279-Y345 PolarHBondContact O-OH 3.02Å; T281-Y345 HydrophobicContact CG2-CE1 4.17Å; F335-Y345 HydrophobicContact CB-CD1 4.31Å; F335-Y345 AromaticContact CD1-CD1 3.5Å; F335-Y345 HydrophobicContact CD1-CD1 3.5Å; F335-Y345 VanDerWaalsContact CD1-CD1 3.5Å; F335-Y345 AromaticContact CD1-CE1 3.95Å; F335-Y345 HydrophobicContact CD1-CE1 3.95Å; F335-Y345 HydrophobicContact CD1-CG 4.46Å; F335-Y345 HydrophobicContact CD2-CD1 4.41Å; F335-Y345 AromaticContact CE1-CD1 3.78Å; F335-Y345 HydrophobicContact CE1-CD1 3.78Å; F335-Y345 HydrophobicContact CE1-CE1 4.08Å; F335-Y345 AromaticContact CG-CD1 3.84Å; F335-Y345 HydrophobicContact CG-CD1 3.84Å; F335-Y345 HydrophobicContact CG-CG 4.44Å; F335-Y345 HydrophobicContact CZ-CD1 4.34Å; V337-Y345 HydrophobicContact CB-CD2 4.05Å; V337-Y345 HydrophobicContact CB-CE2 4.29Å; V337-Y345 HydrophobicContact CG1-CD1 4.28Å; V337-Y345 HydrophobicContact CG1-CD2 3.72Å; V337-Y345 HydrophobicContact CG1-CE1 4.35Å; V337-Y345 HydrophobicContact CG1-CE2 3.8Å; V337-Y345 HydrophobicContact CG1-CG 3.96Å; V337-Y345 HydrophobicContact CG2-CD2 3.79Å; V337-Y345 HydrophobicContact CG2-CG 4.14Å; V341-Y345 HydrophobicContact CB-CD2 4.1Å; V341-Y345 HydrophobicContact CB-CE2 3.99Å; V341-Y345 HydrophobicContact CG2-CD2 4.15Å; V341-Y345 HydrophobicContact CG2-CE2 3.95Å; V341-Y345 WeakPolarHBondContact O-CD2 3.47Å; V341-Y345 PolarHBondContact O-N 3.11Å; V342-Y345 PolarHBondContact O-N 2.85Å; Y345-Y348 HydrophobicContact CD1-CD2 4.02Å; Y345-Y348 HydrophobicContact CE1-CD2 4.44Å; Y345-Y348 HydrophobicContact CG-CD2 4.46Å; Y345-Y348 PolarHBondContact O-N 2.95Å; Y345-S349 WeakPolarHBondContact O-CB 3.27Å; Y345-S349 PolarHBondContact O-N 3.46Å; Y345-V357 WeakPolarHBondContact O-CG2 3.45Å
346	Q	89	Confident	88.9	Confident	64 Å²	64	46.5 Å²	46.5	30%	0.299	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-45.7	170.1	-169.4	65.4	20.8	0	0	110.9	V342 L344 Y348 S349 E350	V342-Q346 WeakPolarHBondContact O-CB 3.46Å; V342-Q346 PolarHBondContact O-N 3.25Å; L344-Q346 VanDerWaalsContact C-N 3.29Å; L344-Q346 PolarHBondContact O-N 2.59Å; Q346-Y348 VanDerWaalsContact C-N 3.34Å; Q346-Y348 PolarHBondContact O-N 2.97Å; Q346-S349 WeakPolarHBondContact O-CB 3.4Å; Q346-S349 PolarHBondContact O-N 3.17Å; Q346-S349 VanDerWaalsContact O-N 3.11Å; Q346-E350 PolarHBondContact O-N 3.34Å; Q346-E350 VanDerWaalsContact O-N 3.08Å
347	N	89.8	Confident	88.8	Confident	92 Å²	92	47.9 Å²	47.9	49%	0.492	27%	0.274	S	S	.	.	H	α-helix	trans	-63.4	-38.5	175.5	-65.1	-13.5	0	0	0	112	P343 L344 S349 E350	P343-N347 VanDerWaalsContact O-CG 3.31Å; P343-N347 PolarHBondContact O-N 3.34Å; P343-N347 PolarHBondContact O-ND2 3.22Å; P343-N347 PolarHBondContact O-OD1 3.46Å; L344-N347 WeakPolarHBondContact O-CB 3.36Å; L344-N347 PolarHBondContact O-N 2.94Å; N347-S349 VanDerWaalsContact C-N 3.33Å; N347-E350 PolarHBondContact O-N 2.81Å
348	Y	92.5	Very high	88.5	Confident	34 Å²	34	48.6 Å²	48.6	13%	0.133	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-40	172.2	-67.2	-38.7	0	0	0	112.1	F250 T281 L319 L344 Y345 Q346 E350 L351 I352	F250-Y348 HydrophobicContact CZ-CD2 4.17Å; F250-Y348 HydrophobicContact CZ-CE2 4.26Å; T281-Y348 HydrophobicContact CG2-CE2 3.95Å; L319-Y348 HydrophobicContact CD1-CD1 3.77Å; L319-Y348 HydrophobicContact CD1-CE1 4.03Å; L319-Y348 HydrophobicContact CD2-CD1 3.88Å; L319-Y348 HydrophobicContact CD2-CE1 4.3Å; L319-Y348 HydrophobicContact CD2-CG 4.37Å; L319-Y348 HydrophobicContact CG-CD1 4.48Å; L344-Y348 HydrophobicContact CD1-CE2 3.93Å; L344-Y348 HydrophobicContact CD2-CE2 4.17Å; L344-Y348 HydrophobicContact CG-CD2 4.3Å; L344-Y348 HydrophobicContact CG-CE2 3.71Å; L344-Y348 PolarHBondContact O-N 3.15Å; L344-Y348 VanDerWaalsContact O-N 3.12Å; Y345-Y348 HydrophobicContact CD1-CD2 4.02Å; Y345-Y348 HydrophobicContact CE1-CD2 4.44Å; Y345-Y348 HydrophobicContact CG-CD2 4.46Å; Y345-Y348 PolarHBondContact O-N 2.95Å; Q346-Y348 VanDerWaalsContact C-N 3.34Å; Q346-Y348 PolarHBondContact O-N 2.97Å; Y348-E350 PolarHBondContact O-N 3.1Å; Y348-L351 PolarHBondContact O-N 3.47Å; Y348-I352 WeakPolarHBondContact O-CG1 3.28Å; Y348-I352 PolarHBondContact O-N 2.03Å
349	S	89.6	Confident	88.4	Confident	19 Å²	19	51.3 Å²	51.3	13%	0.133	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-22.5	178.8	-174.2	0	0	0	0	113.6	Y345 Q346 N347 L351 T355	Y345-S349 WeakPolarHBondContact O-CB 3.27Å; Y345-S349 PolarHBondContact O-N 3.46Å; Q346-S349 WeakPolarHBondContact O-CB 3.4Å; Q346-S349 PolarHBondContact O-N 3.17Å; Q346-S349 VanDerWaalsContact O-N 3.11Å; N347-S349 VanDerWaalsContact C-N 3.33Å; S349-L351 VanDerWaalsContact C-N 3.31Å; S349-T355 VanDerWaalsContact CA-OG1 3.24Å; S349-T355 WeakPolarHBondContact CA-OG1 3.2Å; S349-T355 WeakPolarHBondContact CB-OG1 3.44Å; S349-T355 PolarHBondContact OG-O 2.89Å; S349-T355 PolarHBondContact OG-OG1 3.39Å
350	E	84.6	Confident	88.3	Confident	120 Å²	120	46 Å²	46	56%	0.561	27%	0.27	S	S	*	.	H	α-helix	trans	-72.4	-28.2	171.4	-69.7	178.3	-178.8	0	0	112	Q346 N347 Y348	Q346-E350 PolarHBondContact O-N 3.34Å; Q346-E350 VanDerWaalsContact O-N 3.08Å; N347-E350 PolarHBondContact O-N 2.81Å; Y348-E350 PolarHBondContact O-N 3.1Å
351	L	86.4	Confident	88	Confident	111 Å²	111	42.6 Å²	42.6	58%	0.581	25%	0.249	S	C	*	.	H	α-helix	trans	-90.9	-19.7	-179.6	-60.3	176.3	0	0	0	113.5	L319 Y348 S349 P353	L319-L351 HydrophobicContact CD1-CD1 3.77Å; Y348-L351 PolarHBondContact O-N 3.47Å; S349-L351 VanDerWaalsContact C-N 3.31Å; L351-P353 WeakPolarHBondContact O-CD 3.29Å
352	I	85.6	Confident	87.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	28%	0.275	C	S	.	.	S	Bend	trans	-111	97.3	178.7	-50.6	170.6	0	0	0	108.6	L319 I322 F335 Y348 G354 T355	L319-I352 HydrophobicContact CD2-CD1 4.05Å; I322-I352 HydrophobicContact CG2-CD1 4.04Å; F335-I352 HydrophobicContact CZ-CD1 4.28Å; Y348-I352 WeakPolarHBondContact O-CG1 3.28Å; Y348-I352 PolarHBondContact O-N 2.03Å; I352-G354 PolarHBondContact O-N 3.47Å; I352-T355 HydrophobicContact CB-CG2 3.84Å; I352-T355 HydrophobicContact CG2-CG2 3.46Å; I352-T355 VanDerWaalsContact CG2-CG2 3.46Å; I352-T355 PolarHBondContact O-N 3.33Å; I352-T355 PolarHBondContact O-OG1 3.3Å
353	P	77.4	Confident	86.4	Confident	82 Å²	82	49.7 Å²	49.7	53%	0.532	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	140.5	-178.8	-24.5	34.6	0	0	0	112.7	L351 T355	L351-P353 WeakPolarHBondContact O-CD 3.29Å; P353-T355 VanDerWaalsContact C-N 3.33Å
354	G	77.5	Confident	85.7	Confident	34 Å²	34	45.8 Å²	45.8	35%	0.351	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-2.1	177.2	0	0	0	0	0	114.8	I352	I352-G354 PolarHBondContact O-N 3.47Å
355	T	88.6	Confident	85	Confident	16 Å²	16	44.6 Å²	44.6	10%	0.098	26%	0.261	C	S	.	.			trans	-84.5	158.4	174.3	63.5	0	0	0	0	112.6	L333 F335 S349 I352 P353	L333-T355 HydrophobicContact CB-CG2 3.79Å; L333-T355 HydrophobicContact CD2-CG2 4.2Å; L333-T355 HydrophobicContact CG-CG2 4.23Å; L333-T355 WeakPolarHBondContact O-CA 3.25Å; L333-T355 VanDerWaalsContact O-CB 3.28Å; L333-T355 WeakPolarHBondContact O-CB 3.4Å; F335-T355 HydrophobicContact CE2-CG2 4.48Å; S349-T355 VanDerWaalsContact CA-OG1 3.24Å; S349-T355 WeakPolarHBondContact CA-OG1 3.2Å; S349-T355 WeakPolarHBondContact CB-OG1 3.44Å; S349-T355 PolarHBondContact OG-O 2.89Å; S349-T355 PolarHBondContact OG-OG1 3.39Å; I352-T355 HydrophobicContact CB-CG2 3.84Å; I352-T355 HydrophobicContact CG2-CG2 3.46Å; I352-T355 VanDerWaalsContact CG2-CG2 3.46Å; I352-T355 PolarHBondContact O-N 3.33Å; I352-T355 PolarHBondContact O-OG1 3.3Å; P353-T355 VanDerWaalsContact C-N 3.33Å
356	T	89.2	Confident	84.6	Confident	10 Å²	10	47 Å²	47	6%	0.061	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	142.1	174.2	59.7	0	0	0	0	110.4	L333 I334 F335 K377 I378	L333-T356 PolarHBondContact O-N 3.45Å; I334-T356 CarbonylContact C-O 3.17Å; I334-T356 WeakPolarHBondContact CA-O 3.18Å; F335-T356 PolarHBondContact N-O 3.27Å; T356-K377 HydrophobicContact CG2-CD 4.08Å; T356-K377 HydrophobicContact CG2-CG 4.21Å; T356-I378 HydrophobicContact CG2-CG1 3.97Å
357	V	91.3	Very high	84.3	Confident	28 Å²	28	44 Å²	44	17%	0.17	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.6	173.1	-170.1	0	0	0	0	109.7	F335 V337 V342 Y345	F335-V357 HydrophobicContact CB-CB 4.5Å; F335-V357 HydrophobicContact CB-CG1 4.31Å; F335-V357 HydrophobicContact CB-CG2 4.2Å; F335-V357 HydrophobicContact CD2-CG2 4.18Å; F335-V357 CarbonylContact O-C 3.37Å; F335-V357 WeakPolarHBondContact O-CA 3.44Å; V337-V357 HydrophobicContact CG2-CG1 4.18Å; V342-V357 HydrophobicContact CG1-CG1 4.44Å; Y345-V357 WeakPolarHBondContact O-CG2 3.45Å
358	G	89.3	Confident	84	Confident	15 Å²	15	41 Å²	41	16%	0.155	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.6	170.4	0	0	0	0	0	110.9	F335 A336 V337 L360	F335-G358 PolarHBondContact O-N 3.08Å; A336-G358 WeakPolarHBondContact CA-O 3.33Å; V337-G358 PolarHBondContact N-O 3.29Å; G358-L360 PolarHBondContact O-N 3.47Å
359	T	88.1	Confident	83.7	Confident	64 Å²	64	45 Å²	45	39%	0.393	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	112.5	176.2	-48.8	0	0	0	0	110.1	V337 N339 V342 N366	V337-T359 WeakPolarHBondContact O-CA 3.29Å; N339-T359 HydrophobicContact CB-CG2 4.25Å; V342-T359 HydrophobicContact CG2-CG2 4.1Å; T359-N366 PolarHBondContact O-ND2 3.46Å
360	L	84.9	Confident	83.6	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	135.2	173.5	-166.3	63	0	0	0	109.3	T276 A336 V337 G358 S364 V367 L370	T276-L360 HydrophobicContact CG2-CD2 4.33Å; A336-L360 HydrophobicContact CB-CD1 4.5Å; A336-L360 WeakPolarHBondContact O-CD2 3.37Å; V337-L360 PolarHBondContact O-N 3.49Å; G358-L360 PolarHBondContact O-N 3.47Å; L360-S364 WeakPolarHBondContact CD2-OG 2.93Å; L360-V367 HydrophobicContact CD1-CB 3.93Å; L360-V367 HydrophobicContact CD1-CG2 4.15Å; L360-L370 HydrophobicContact CD1-CD1 4.41Å
361	S	82	Confident	83.7	Confident	37 Å²	37	39 Å²	39	26%	0.259	23%	0.233	S	C	.	.			trans	-67.2	154.1	168	59.5	0	0	0	0	109.7	D363 S364 G365 N366	S361-D363 WeakPolarHBondContact CB-OD1 3.42Å; S361-D363 PolarHBondContact O-N 3.5Å; S361-D363 PolarHBondContact OG-OD1 3.32Å; S361-S364 PolarHBondContact O-N 2.72Å; S361-G365 PolarHBondContact OG-N 2.88Å; S361-N366 PolarHBondContact N-OD1 2.89Å; S361-N366 PolarHBondContact OG-N 3.05Å; S361-N366 PolarHBondContact OG-OD1 3.48Å
362	N	75.6	Confident	83.7	Confident	116 Å²	116	37 Å²	37	62%	0.62	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.4	-177.3	-65.3	-4.3	0	0	0	114
363	D	74.8	Confident	83.7	Confident	66 Å²	66	44.2 Å²	44.2	35%	0.353	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	6.8	176.8	72.6	-27.1	0	0	0	113.1	R157 S361 G365	R157-D363 WeakPolarHBondContact CB-O 3.07Å; R157-D363 WeakPolarHBondContact CG-O 3.35Å; S361-D363 WeakPolarHBondContact CB-OD1 3.42Å; S361-D363 PolarHBondContact O-N 3.5Å; S361-D363 PolarHBondContact OG-OD1 3.32Å; D363-G365 PolarHBondContact O-N 2.95Å; D363-G365 PolarHBondContact OD1-N 3.37Å
364	S	77.8	Confident	84.1	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.007	23%	0.23	C	C	.	.	S	Bend	trans	56.1	16.7	-170.2	-71.4	0	0	0	0	115.7	D154 L360 S361 N366 V367	D154-S364 VanDerWaalsContact OD1-CB 3.25Å; D154-S364 WeakPolarHBondContact OD1-CB 3.4Å; D154-S364 PolarHBondContact OD1-N 3.26Å; D154-S364 PolarHBondContact OD1-OG 3.24Å; L360-S364 WeakPolarHBondContact CD2-OG 2.93Å; S361-S364 PolarHBondContact O-N 2.72Å; S364-N366 PolarHBondContact O-N 3.09Å; S364-N366 VanDerWaalsContact O-N 3.15Å; S364-V367 WeakPolarHBondContact O-CB 3.44Å; S364-V367 WeakPolarHBondContact O-CG1 3.29Å; S364-V367 PolarHBondContact O-N 3Å
365	G	77.1	Confident	84.5	Confident	25 Å²	25	39.5 Å²	39.5	26%	0.258	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-25.3	-178.2	0	0	0	0	0	114.8	S361 D363	S361-G365 PolarHBondContact OG-N 2.88Å; D363-G365 PolarHBondContact O-N 2.95Å; D363-G365 PolarHBondContact OD1-N 3.37Å
366	N	85.3	Confident	84.3	Confident	50 Å²	50	41.5 Å²	41.5	27%	0.267	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	4.6	-179.2	74.2	-25.4	0	0	0	114.7	T359 S361 S364 I368 Q369 L370	T359-N366 PolarHBondContact O-ND2 3.46Å; S361-N366 PolarHBondContact N-OD1 2.89Å; S361-N366 PolarHBondContact OG-N 3.05Å; S361-N366 PolarHBondContact OG-OD1 3.48Å; S364-N366 PolarHBondContact O-N 3.09Å; S364-N366 VanDerWaalsContact O-N 3.15Å; N366-I368 VanDerWaalsContact C-N 3.28Å; N366-I368 PolarHBondContact O-N 3.5Å; N366-Q369 PolarHBondContact O-N 3.48Å; N366-Q369 VanDerWaalsContact O-N 3.1Å; N366-L370 PolarHBondContact O-N 3.36Å
367	V	83.7	Confident	84	Confident	1 Å²	1	45 Å²	45	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-57.6	-35.9	-171.9	70.5	0	0	0	0	113.8	Y143 L161 L360 S364 L370 I371	Y143-V367 HydrophobicContact CE2-CG2 3.97Å; L161-V367 HydrophobicContact CD1-CG1 3.81Å; L360-V367 HydrophobicContact CD1-CB 3.93Å; L360-V367 HydrophobicContact CD1-CG2 4.15Å; S364-V367 WeakPolarHBondContact O-CB 3.44Å; S364-V367 WeakPolarHBondContact O-CG1 3.29Å; S364-V367 PolarHBondContact O-N 3Å; V367-L370 WeakPolarHBondContact O-CB 3.38Å; V367-L370 PolarHBondContact O-N 3.15Å; V367-I371 HydrophobicContact CG2-CD1 3.95Å; V367-I371 HydrophobicContact CG2-CG1 4.42Å; V367-I371 VanDerWaalsContact O-CG1 3.3Å; V367-I371 WeakPolarHBondContact O-CG1 3.33Å; V367-I371 PolarHBondContact O-N 3.36Å
368	I	83.6	Confident	83.7	Confident	29 Å²	29	45 Å²	45	15%	0.149	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-47.5	178.8	-61.1	175	0	0	0	110.6	L161 L165 A168 N366 L370 I371 Q372	L161-I368 HydrophobicContact CB-CD1 4.47Å; L161-I368 HydrophobicContact CD2-CD1 4.02Å; L165-I368 HydrophobicContact CB-CD1 4.25Å; L165-I368 HydrophobicContact CB-CG1 4Å; L165-I368 HydrophobicContact CD1-CB 4.39Å; L165-I368 HydrophobicContact CD1-CG1 3.99Å; L165-I368 HydrophobicContact CD1-CG2 4.35Å; A168-I368 HydrophobicContact CB-CG2 3.38Å; N366-I368 VanDerWaalsContact C-N 3.28Å; N366-I368 PolarHBondContact O-N 3.5Å; I368-L370 VanDerWaalsContact C-N 3.29Å; I368-L370 PolarHBondContact O-N 3.43Å; I368-I371 PolarHBondContact O-N 3Å; I368-Q372 WeakPolarHBondContact O-CG 3.31Å; I368-Q372 PolarHBondContact O-N 3.2Å
369	Q	85.3	Confident	83.5	Confident	119 Å²	119	44.7 Å²	44.7	56%	0.556	24%	0.24	S	C	*	.	H	α-helix	trans	-66.3	-36.6	179.4	-63.3	179.3	4.6	0	0	111	N366 Q372 K373	N366-Q369 PolarHBondContact O-N 3.48Å; N366-Q369 VanDerWaalsContact O-N 3.1Å; Q369-Q372 PolarHBondContact O-N 3.24Å; Q369-K373 WeakPolarHBondContact O-CB 3.33Å; Q369-K373 VanDerWaalsContact O-CG 3.3Å; Q369-K373 WeakPolarHBondContact O-CG 3.24Å; Q369-K373 PolarHBondContact O-N 2.83Å
370	L	87.6	Confident	83.3	Confident	13 Å²	13	43.2 Å²	43.2	7%	0.068	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-49.8	176.1	-169.8	164.3	0	0	0	110.7	I334 A336 L360 N366 V367 I368 Q372 K373 A374	I334-L370 HydrophobicContact CG2-CD2 3.93Å; A336-L370 HydrophobicContact CB-CD1 3.8Å; A336-L370 HydrophobicContact CB-CD2 3.91Å; L360-L370 HydrophobicContact CD1-CD1 4.41Å; N366-L370 PolarHBondContact O-N 3.36Å; V367-L370 WeakPolarHBondContact O-CB 3.38Å; V367-L370 PolarHBondContact O-N 3.15Å; I368-L370 VanDerWaalsContact C-N 3.29Å; I368-L370 PolarHBondContact O-N 3.43Å; L370-Q372 VanDerWaalsContact C-N 3.35Å; L370-Q372 PolarHBondContact O-N 3.14Å; L370-K373 PolarHBondContact O-N 3.3Å; L370-A374 VanDerWaalsContact O-CB 3.27Å; L370-A374 WeakPolarHBondContact O-CB 3.21Å; L370-A374 PolarHBondContact O-N 2.84Å
371	I	86.9	Confident	83.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.1	-43.8	178.5	-67.7	165.1	0	0	0	110.8	L141 L165 M169 I274 V367 I368 A374 Y375	L141-I371 HydrophobicContact CD1-CD1 4.4Å; L141-I371 HydrophobicContact CD1-CG2 3.92Å; L165-I371 HydrophobicContact CD1-CD1 3.71Å; L165-I371 HydrophobicContact CD2-CD1 4.17Å; M169-I371 HydrophobicContact CE-CG2 4.35Å; M169-I371 HydrophobicContact SD-CG2 3.89Å; I274-I371 HydrophobicContact CD1-CG1 4.01Å; I274-I371 HydrophobicContact CD1-CG2 4.43Å; I274-I371 HydrophobicContact CG1-CD1 4.19Å; I274-I371 HydrophobicContact CG1-CG1 4.22Å; I274-I371 HydrophobicContact CG2-CD1 4.33Å; I274-I371 HydrophobicContact CG2-CG1 4.3Å; V367-I371 HydrophobicContact CG2-CD1 3.95Å; V367-I371 HydrophobicContact CG2-CG1 4.42Å; V367-I371 VanDerWaalsContact O-CG1 3.3Å; V367-I371 WeakPolarHBondContact O-CG1 3.33Å; V367-I371 PolarHBondContact O-N 3.36Å; I368-I371 PolarHBondContact O-N 3Å; I371-A374 PolarHBondContact O-N 3.2Å; I371-Y375 VanDerWaalsContact O-CB 3.32Å; I371-Y375 WeakPolarHBondContact O-CB 3.48Å; I371-Y375 PolarHBondContact O-N 3.02Å
372	Q	86	Confident	83.5	Confident	67 Å²	67	46 Å²	46	31%	0.313	24%	0.24	S	C	.	.	H	α-helix	trans	-62.6	-44.6	177.4	-73.5	-179.3	-35.9	0	0	112.3	A168 M169 I368 Q369 L370 Y375 A376	A168-Q372 PolarHBondContact O-NE2 3.39Å; M169-Q372 HydrophobicContact SD-CG 4.42Å; I368-Q372 WeakPolarHBondContact O-CG 3.31Å; I368-Q372 PolarHBondContact O-N 3.2Å; Q369-Q372 PolarHBondContact O-N 3.24Å; L370-Q372 VanDerWaalsContact C-N 3.35Å; L370-Q372 PolarHBondContact O-N 3.14Å; Q372-Y375 PolarHBondContact O-N 3.23Å; Q372-A376 WeakPolarHBondContact O-CB 3.39Å; Q372-A376 PolarHBondContact O-N 2.88Å
373	K	85.4	Confident	84.1	Confident	153 Å²	153	42.9 Å²	42.9	67%	0.665	22%	0.222	S	C	*	.	H	α-helix	trans	-64.3	-43.3	176.3	-75.4	177.9	179.7	-178.2	0	111.6	Q369 L370 A376 K377	Q369-K373 WeakPolarHBondContact O-CB 3.33Å; Q369-K373 VanDerWaalsContact O-CG 3.3Å; Q369-K373 WeakPolarHBondContact O-CG 3.24Å; Q369-K373 PolarHBondContact O-N 2.83Å; L370-K373 PolarHBondContact O-N 3.3Å; K373-A376 PolarHBondContact O-N 3.28Å; K373-K377 WeakPolarHBondContact O-CB 3.28Å; K373-K377 PolarHBondContact O-N 3.31Å
374	A	86.9	Confident	84.8	Confident	8 Å²	8	39.7 Å²	39.7	7%	0.066	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-46.1	177.4	0	0	0	0	0	111.2	I334 L370 I371 A376 K377 I378	I334-A374 HydrophobicContact CD1-CB 3.68Å; I334-A374 HydrophobicContact CG1-CB 4.09Å; I334-A374 HydrophobicContact CG2-CB 3.79Å; L370-A374 VanDerWaalsContact O-CB 3.27Å; L370-A374 WeakPolarHBondContact O-CB 3.21Å; L370-A374 PolarHBondContact O-N 2.84Å; I371-A374 PolarHBondContact O-N 3.2Å; A374-A376 PolarHBondContact O-N 2.9Å; A374-K377 PolarHBondContact O-N 3.09Å; A374-K377 VanDerWaalsContact O-N 3.15Å; A374-I378 VanDerWaalsContact O-CG1 3.31Å; A374-I378 WeakPolarHBondContact O-CG1 3.49Å; A374-I378 PolarHBondContact O-N 3.16Å
375	Y	85.6	Confident	85.2	Confident	10 Å²	10	41.1 Å²	41.1	4%	0.039	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-46.9	174.8	-177.5	-106.3	0	0	0	111.7	V139 T172 L272 I371 Q372 K377 I378 R379	V139-Y375 HydrophobicContact CG2-CE2 3.86Å; T172-Y375 HydrophobicContact CG2-CD1 3.61Å; T172-Y375 HydrophobicContact CG2-CE1 3.36Å; L272-Y375 HydrophobicContact CD1-CD2 3.67Å; L272-Y375 HydrophobicContact CD1-CE2 4.33Å; L272-Y375 HydrophobicContact CD1-CG 4.43Å; L272-Y375 HydrophobicContact CD2-CD2 4.08Å; L272-Y375 HydrophobicContact CG-CD2 4.4Å; I371-Y375 VanDerWaalsContact O-CB 3.32Å; I371-Y375 WeakPolarHBondContact O-CB 3.48Å; I371-Y375 PolarHBondContact O-N 3.02Å; Q372-Y375 PolarHBondContact O-N 3.23Å; Y375-K377 VanDerWaalsContact C-N 3.28Å; Y375-K377 PolarHBondContact O-N 2.83Å; Y375-I378 PolarHBondContact O-N 3.14Å; Y375-R379 HydrophobicContact CD1-CG 4.3Å; Y375-R379 HydrophobicContact CD2-CG 4.3Å; Y375-R379 HydrophobicContact CE1-CG 3.95Å; Y375-R379 HydrophobicContact CE2-CG 3.99Å; Y375-R379 HydrophobicContact CG-CG 4.47Å; Y375-R379 WeakPolarHBondContact O-CB 3.49Å; Y375-R379 WeakPolarHBondContact O-CG 3.37Å; Y375-R379 PolarHBondContact O-N 2.89Å
376	A	84.3	Confident	85.7	Confident	58 Å²	58	42.6 Å²	42.6	48%	0.479	21%	0.213	S	C	.	.	H	α-helix	trans	-61.3	-35.9	175.7	0	0	0	0	0	112.3	Q372 K373 A374 R379 S380	Q372-A376 WeakPolarHBondContact O-CB 3.39Å; Q372-A376 PolarHBondContact O-N 2.88Å; K373-A376 PolarHBondContact O-N 3.28Å; A374-A376 PolarHBondContact O-N 2.9Å; A376-R379 CarbonylContact O-C 3.43Å; A376-R379 PolarHBondContact O-N 2.7Å; A376-S380 WeakPolarHBondContact O-CB 3.29Å; A376-S380 PolarHBondContact O-N 2.86Å
377	K	83.6	Confident	85.7	Confident	84 Å²	84	43.4 Å²	43.4	37%	0.365	22%	0.217	S	C	.	.	H	α-helix	trans	-70.6	-43.3	176.9	-175.6	170.7	178.7	169.5	0	112.4	T356 K373 A374 Y375 R379 S380	T356-K377 HydrophobicContact CG2-CD 4.08Å; T356-K377 HydrophobicContact CG2-CG 4.21Å; K373-K377 WeakPolarHBondContact O-CB 3.28Å; K373-K377 PolarHBondContact O-N 3.31Å; A374-K377 PolarHBondContact O-N 3.09Å; A374-K377 VanDerWaalsContact O-N 3.15Å; Y375-K377 VanDerWaalsContact C-N 3.28Å; Y375-K377 PolarHBondContact O-N 2.83Å; K377-R379 VanDerWaalsContact C-N 3.27Å; K377-R379 PolarHBondContact O-N 2.7Å; K377-S380 PolarHBondContact O-N 2.9Å; K377-S380 PolarHBondContact O-OG 3.15Å
378	I	84.2	Confident	85.8	Confident	28 Å²	28	46.4 Å²	46.4	14%	0.144	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-44.8	173	-68.5	159.7	0	0	0	109.2	L272 N332 I334 T356 A374 Y375 S380 K381	L272-I378 HydrophobicContact CD2-CD1 4.04Å; N332-I378 HydrophobicContact CB-CD1 3.78Å; I334-I378 HydrophobicContact CD1-CD1 3.89Å; I334-I378 HydrophobicContact CG1-CD1 4.04Å; T356-I378 HydrophobicContact CG2-CG1 3.97Å; A374-I378 VanDerWaalsContact O-CG1 3.31Å; A374-I378 WeakPolarHBondContact O-CG1 3.49Å; A374-I378 PolarHBondContact O-N 3.16Å; Y375-I378 PolarHBondContact O-N 3.14Å; I378-S380 VanDerWaalsContact C-N 3.26Å; I378-S380 PolarHBondContact O-N 2.81Å; I378-K381 PolarHBondContact O-N 3.05Å
379	R	84.1	Confident	86	Confident	8 Å²	8	47.4 Å²	47.4	3%	0.03	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-4.3	176.1	-60.3	-66.9	-68.9	-165.3	-10	113.3	Q133 V134 Y375 A376 K377 K381 I418	Q133-R379 PolarHBondContact NE2-O 2.85Å; Q133-R379 PolarHBondContact OE1-O 2.96Å; V134-R379 PolarHBondContact O-NH2 3.18Å; Y375-R379 HydrophobicContact CD1-CG 4.3Å; Y375-R379 HydrophobicContact CD2-CG 4.3Å; Y375-R379 HydrophobicContact CE1-CG 3.95Å; Y375-R379 HydrophobicContact CE2-CG 3.99Å; Y375-R379 HydrophobicContact CG-CG 4.47Å; Y375-R379 WeakPolarHBondContact O-CB 3.49Å; Y375-R379 WeakPolarHBondContact O-CG 3.37Å; Y375-R379 PolarHBondContact O-N 2.89Å; A376-R379 CarbonylContact O-C 3.43Å; A376-R379 PolarHBondContact O-N 2.7Å; K377-R379 VanDerWaalsContact C-N 3.27Å; K377-R379 PolarHBondContact O-N 2.7Å; R379-K381 VanDerWaalsContact C-N 3.33Å; R379-I418 HydrophobicContact CB-CG1 4.34Å
380	S	84.8	Confident	86.1	Confident	33 Å²	33	42.2 Å²	42.2	23%	0.231	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.6	173.8	76.1	0	0	0	0	112.9	A376 K377 I378 S414 G415 L416	A376-S380 WeakPolarHBondContact O-CB 3.29Å; A376-S380 PolarHBondContact O-N 2.86Å; K377-S380 PolarHBondContact O-N 2.9Å; K377-S380 PolarHBondContact O-OG 3.15Å; I378-S380 VanDerWaalsContact C-N 3.26Å; I378-S380 PolarHBondContact O-N 2.81Å; S380-S414 CarbonylContact O-C 3.49Å; S380-S414 WeakPolarHBondContact O-CA 3.4Å; S380-G415 PolarHBondContact O-N 3.04Å; S380-L416 VanDerWaalsContact CA-O 3.31Å; S380-L416 WeakPolarHBondContact CA-O 3.42Å; S380-L416 WeakPolarHBondContact CB-O 3.37Å; S380-L416 WeakPolarHBondContact O-CB 3.47Å; S380-L416 PolarHBondContact O-N 2.64Å
381	K	84.2	Confident	85.8	Confident	94 Å²	94	50.1 Å²	50.1	41%	0.409	27%	0.268	S	S	.	.			trans	-125	139.2	-178	-166.9	178.3	174.1	-165.6	0	110.9	I378 R379 E383 C413	I378-K381 PolarHBondContact O-N 3.05Å; R379-K381 VanDerWaalsContact C-N 3.33Å; K381-E383 WeakPolarHBondContact CE-OE2 3.15Å; K381-E383 IonicContact NZ-OE2 4Å; K381-E383 PolarHBondContact NZ-OE2 2.86Å; K381-C413 CarbonylContact C-O 3.57Å; K381-C413 VanDerWaalsContact CA-O 3.29Å; K381-C413 WeakPolarHBondContact CA-O 3.28Å
382	V	87.9	Confident	85.5	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.7	165.8	171.2	0	0	0	0	106.8	V131 Q133 S412 C413 L416 V422 F424 P445	V131-V382 HydrophobicContact CB-CG1 4.01Å; V131-V382 HydrophobicContact CG1-CG1 3.76Å; V131-V382 HydrophobicContact CG1-CG2 4.39Å; V131-V382 HydrophobicContact CG2-CG1 4.33Å; Q133-V382 HydrophobicContact CG-CG2 4.05Å; V382-S412 CarbonylContact O-C 3.52Å; V382-S412 WeakPolarHBondContact O-CA 3.12Å; V382-C413 PolarHBondContact N-O 3.32Å; V382-C413 PolarHBondContact O-N 2.9Å; V382-L416 HydrophobicContact CB-CD1 3.94Å; V382-L416 HydrophobicContact CG2-CD1 3.63Å; V382-V422 HydrophobicContact CB-CG2 4.19Å; V382-V422 HydrophobicContact CG1-CG2 4.06Å; V382-V422 HydrophobicContact CG2-CG2 4.48Å; V382-F424 HydrophobicContact CG1-CE2 3.95Å; V382-F424 HydrophobicContact CG1-CZ 4.15Å; V382-P445 HydrophobicContact CG1-CB 4.42Å
383	E	87.3	Confident	85.3	Confident	50 Å²	50	49.9 Å²	49.9	23%	0.234	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134.5	177.9	177.7	164.3	-177.5	0	0	109.6	K381 P445 V446	K381-E383 WeakPolarHBondContact CE-OE2 3.15Å; K381-E383 IonicContact NZ-OE2 4Å; K381-E383 PolarHBondContact NZ-OE2 2.86Å; E383-P445 CarbonylContact O-C 3.5Å; E383-P445 VanDerWaalsContact O-CA 3.31Å; E383-P445 WeakPolarHBondContact O-CA 3.35Å; E383-V446 HydrophobicContact CB-CG2 4.3Å; E383-V446 HydrophobicContact CG-CG2 4.37Å; E383-V446 PolarHBondContact O-N 3.17Å
384	L	88.5	Confident	85	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.7	178.2	-63.5	-176.5	0	0	0	111.7	V131 F397 K411 F424 I443 P445	V131-L384 HydrophobicContact CG2-CD2 4.17Å; L384-F397 HydrophobicContact CD1-CD1 4.39Å; L384-F397 HydrophobicContact CD1-CE1 4.46Å; L384-K411 PolarHBondContact N-O 3.26Å; L384-F424 HydrophobicContact CD1-CB 3.67Å; L384-F424 HydrophobicContact CD1-CD1 4.07Å; L384-F424 HydrophobicContact CD1-CD2 3.55Å; L384-F424 HydrophobicContact CD1-CE2 4.17Å; L384-F424 HydrophobicContact CD1-CG 3.47Å; L384-F424 VanDerWaalsContact CD1-CG 3.47Å; L384-F424 HydrophobicContact CD2-CD2 4.2Å; L384-F424 HydrophobicContact CD2-CE2 4.22Å; L384-F424 HydrophobicContact CG-CD2 3.89Å; L384-F424 HydrophobicContact CG-CE2 3.98Å; L384-F424 HydrophobicContact CG-CG 4.15Å; L384-F424 HydrophobicContact CG-CZ 4.35Å; L384-I443 HydrophobicContact CB-CG2 4.29Å; L384-I443 HydrophobicContact CD1-CG2 4.02Å; L384-I443 HydrophobicContact CD2-CG2 4.18Å; L384-I443 HydrophobicContact CG-CG2 4.41Å; L384-P445 HydrophobicContact CD2-CG 4.39Å
385	E	86.3	Confident	84.9	Confident	30 Å²	30	44.3 Å²	44.3	14%	0.14	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	148.1	171.3	175.7	-176.8	165.7	0	0	110.5	S327 L387 I443 K444 V446	S327-E385 PolarHBondContact OG-OE1 2.78Å; S327-E385 PolarHBondContact OG-OE2 2.9Å; E385-L387 HydrophobicContact CG-CD2 4.45Å; E385-L387 HydrophobicContact CG-CG 4.38Å; E385-L387 VanDerWaalsContact OE1-CD2 3.23Å; E385-L387 WeakPolarHBondContact OE1-CD2 3.12Å; E385-I443 WeakPolarHBondContact O-CA 3.48Å; E385-K444 HydrophobicContact CB-CG 4.21Å; E385-K444 PolarHBondContact N-O 3.41Å; E385-K444 PolarHBondContact O-N 2.75Å; E385-K444 WeakPolarHBondContact OE1-CE 3.49Å; E385-K444 IonicContact OE1-NZ 3.56Å; E385-K444 WeakPolarHBondContact OE2-CE 3.49Å; E385-K444 IonicContact OE2-NZ 2.87Å; E385-V446 HydrophobicContact CB-CG2 4.11Å
386	L	88.1	Confident	84.5	Confident	57 Å²	57	46.4 Å²	46.4	30%	0.298	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.7	-179.5	-53.7	176.1	0	0	0	109.6	V389 L395 F397 I443	L386-V389 HydrophobicContact CB-CG2 3.69Å; L386-V389 HydrophobicContact CD1-CG2 4.39Å; L386-V389 HydrophobicContact CG-CG2 4.48Å; L386-L395 HydrophobicContact CD1-CD1 4.18Å; L386-L395 HydrophobicContact CD2-CD1 4.08Å; L386-F397 HydrophobicContact CD1-CE2 3.95Å; L386-F397 HydrophobicContact CD1-CZ 3.78Å; L386-F397 HydrophobicContact CD2-CE1 4.12Å; L386-F397 HydrophobicContact CD2-CZ 3.57Å; L386-F397 HydrophobicContact CG-CZ 4.21Å; L386-I443 HydrophobicContact CD2-CB 4.42Å; L386-I443 HydrophobicContact CD2-CD1 4.28Å; L386-I443 HydrophobicContact CD2-CG1 3.74Å; L386-I443 HydrophobicContact CD2-CG2 4.28Å
387	L	86.2	Confident	84.4	Confident	67 Å²	67	44.6 Å²	44.6	35%	0.351	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.6	-179.5	-67.5	175.7	0	0	0	110.2	E385 V389 F441 I442 K444	E385-L387 HydrophobicContact CG-CD2 4.45Å; E385-L387 HydrophobicContact CG-CG 4.38Å; E385-L387 VanDerWaalsContact OE1-CD2 3.23Å; E385-L387 WeakPolarHBondContact OE1-CD2 3.12Å; L387-V389 PolarHBondContact O-N 3.49Å; L387-F441 WeakPolarHBondContact O-CB 3.35Å; L387-I442 HydrophobicContact CB-CB 4.16Å; L387-I442 PolarHBondContact N-O 3.04Å; L387-I442 PolarHBondContact O-N 2.94Å; L387-K444 HydrophobicContact CD1-CD 3.96Å; L387-K444 HydrophobicContact CD1-CG 4.45Å
388	G	86	Confident	84.3	Confident	63 Å²	63	42.6 Å²	42.6	65%	0.649	24%	0.236	S	C	*	.	S	Bend	trans	65.7	31.1	173.9	0	0	0	0	0	114.8	P390 F441	G388-P390 WeakPolarHBondContact O-CD 3.05Å; G388-F441 VanDerWaalsContact O-CB 3.26Å; G388-F441 WeakPolarHBondContact O-CB 3.15Å
389	V	87.8	Confident	84.3	Confident	50 Å²	50	41.3 Å²	41.3	30%	0.303	23%	0.229	S	C	.	.			trans	-65.1	126.8	178.1	-177.2	0	0	0	0	109.8	L386 L387 L395 F441	L386-V389 HydrophobicContact CB-CG2 3.69Å; L386-V389 HydrophobicContact CD1-CG2 4.39Å; L386-V389 HydrophobicContact CG-CG2 4.48Å; L387-V389 PolarHBondContact O-N 3.49Å; V389-L395 HydrophobicContact CG1-CD1 4.05Å; V389-L395 HydrophobicContact CG1-CG 4.37Å; V389-L395 HydrophobicContact CG2-CD1 3.98Å; V389-F441 HydrophobicContact CG2-CB 4.45Å; V389-F441 HydrophobicContact CG2-CD2 3.93Å; V389-F441 HydrophobicContact CG2-CG 4.42Å
390	P	86.6	Confident	84.5	Confident	11 Å²	11	42.3 Å²	42.3	7%	0.071	24%	0.237	C	C	.	.			trans	-64	140.2	175.7	-22.8	34.4	0	0	0	112.2	G388 E392 L393 K439	G388-P390 WeakPolarHBondContact O-CD 3.05Å; P390-E392 WeakPolarHBondContact CB-OE2 3.29Å; P390-E392 PolarHBondContact O-N 3.21Å; P390-L393 HydrophobicContact CB-CB 4.33Å; P390-L393 WeakPolarHBondContact O-CB 3.45Å; P390-L393 PolarHBondContact O-N 2.93Å; P390-K439 HydrophobicContact CB-CD 3.62Å; P390-K439 HydrophobicContact CG-CB 3.76Å; P390-K439 HydrophobicContact CG-CD 3.7Å; P390-K439 HydrophobicContact CG-CG 4.39Å
391	E	80.5	Confident	84.5	Confident	178 Å²	178	42.1 Å²	42.1	83%	0.832	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.9	177.2	-63.8	179.8	175.5	0	0	113.1	L393	E391-L393 PolarHBondContact O-N 3.25Å
392	E	81.7	Confident	84	Confident	51 Å²	51	41.8 Å²	41.8	24%	0.238	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	0.4	179.5	-48.1	86.9	160.4	0	0	113	P390 R431 P434 K439 F458	P390-E392 WeakPolarHBondContact CB-OE2 3.29Å; P390-E392 PolarHBondContact O-N 3.21Å; E392-R431 PolarHBondContact O-N 2.74Å; E392-P434 HydrophobicContact CG-CB 4.08Å; E392-P434 WeakPolarHBondContact OE1-CB 3.37Å; E392-K439 IonicContact OE1-NZ 2.76Å; E392-K439 PolarHBondContact OE1-NZ 2.69Å; E392-K439 IonicContact OE2-NZ 2.7Å; E392-K439 PolarHBondContact OE2-NZ 2.82Å; E392-F458 HydrophobicContact CB-CE1 4.42Å; E392-F458 HydrophobicContact CB-CZ 4.46Å
393	L	80.8	Confident	83.1	Confident	11 Å²	11	46.6 Å²	46.6	6%	0.058	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.4	-179.5	-163.2	75.3	0	0	0	110.9	L119 P390 E391 L395 A428 F441 V456 F458	L119-L393 HydrophobicContact CD1-CD1 3.47Å; L119-L393 VanDerWaalsContact CD1-CD1 3.47Å; P390-L393 HydrophobicContact CB-CB 4.33Å; P390-L393 WeakPolarHBondContact O-CB 3.45Å; P390-L393 PolarHBondContact O-N 2.93Å; E391-L393 PolarHBondContact O-N 3.25Å; L393-L395 HydrophobicContact CD2-CD2 3.84Å; L393-L395 HydrophobicContact CD2-CG 4.49Å; L393-L395 HydrophobicContact CG-CD2 4.25Å; L393-A428 HydrophobicContact CD1-CB 4.32Å; L393-A428 HydrophobicContact CD2-CB 4.42Å; L393-F441 HydrophobicContact CD2-CD1 4.08Å; L393-F441 HydrophobicContact CD2-CE1 3.44Å; L393-F441 VanDerWaalsContact CD2-CE1 3.44Å; L393-F441 HydrophobicContact CD2-CZ 3.81Å; L393-V456 HydrophobicContact CD1-CG1 4.41Å; L393-V456 HydrophobicContact CD2-CG2 4.11Å; L393-F458 HydrophobicContact CD1-CE1 4.47Å; L393-F458 HydrophobicContact CD1-CZ 4.43Å
394	S	80.1	Confident	82.3	Confident	17 Å²	17	46.9 Å²	46.9	12%	0.119	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.5	171.1	175.7	0	0	0	0	111.1	A428 R429 R431	S394-A428 WeakPolarHBondContact O-CA 3.3Å; S394-R429 PolarHBondContact N-O 3.11Å; S394-R429 PolarHBondContact O-N 3.42Å; S394-R431 PolarHBondContact OG-NE 3.11Å; S394-R431 PolarHBondContact OG-NH1 3.13Å; S394-R431 PolarHBondContact OG-NH2 3.31Å
395	L	83.6	Confident	81.7	Confident	28 Å²	28	51.7 Å²	51.7	15%	0.147	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.6	174.5	-57.2	179.9	0	0	0	109.3	L386 V389 L393 F397 V426 E427 A428 F441	L386-L395 HydrophobicContact CD1-CD1 4.18Å; L386-L395 HydrophobicContact CD2-CD1 4.08Å; V389-L395 HydrophobicContact CG1-CD1 4.05Å; V389-L395 HydrophobicContact CG1-CG 4.37Å; V389-L395 HydrophobicContact CG2-CD1 3.98Å; L393-L395 HydrophobicContact CD2-CD2 3.84Å; L393-L395 HydrophobicContact CD2-CG 4.49Å; L393-L395 HydrophobicContact CG-CD2 4.25Å; L395-F397 HydrophobicContact CB-CE2 3.61Å; L395-F397 HydrophobicContact CB-CZ 3.7Å; L395-F397 HydrophobicContact CD1-CZ 4.1Å; L395-V426 HydrophobicContact CB-CG1 4.45Å; L395-V426 HydrophobicContact CD2-CG1 4.24Å; L395-E427 WeakPolarHBondContact CA-O 3.42Å; L395-A428 HydrophobicContact CD2-CB 3.66Å; L395-F441 HydrophobicContact CD1-CD2 4.33Å; L395-F441 HydrophobicContact CD1-CE2 3.61Å; L395-F441 HydrophobicContact CD1-CZ 4.14Å; L395-F441 HydrophobicContact CD2-CE2 4.34Å; L395-F441 HydrophobicContact CD2-CZ 4.03Å
396	S	78.4	Confident	81.2	Confident	53 Å²	53	54.6 Å²	54.6	37%	0.371	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145	166.2	66.8	0	0	0	0	110.3	V426 E427	S396-V426 CarbonylContact O-C 3.6Å; S396-V426 VanDerWaalsContact O-CA 3.31Å; S396-V426 WeakPolarHBondContact O-CA 3.45Å; S396-E427 PolarHBondContact N-O 3.28Å; S396-E427 PolarHBondContact O-N 3.32Å; S396-E427 WeakPolarHBondContact OG-CB 3.41Å
397	F	82.4	Confident	80.6	Confident	20 Å²	20	55 Å²	55	9%	0.088	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.5	-170.7	-61.1	-93.2	0	0	0	109.9	L384 L386 L395 G409 L410 K411 S425 V426	L384-F397 HydrophobicContact CD1-CD1 4.39Å; L384-F397 HydrophobicContact CD1-CE1 4.46Å; L386-F397 HydrophobicContact CD1-CE2 3.95Å; L386-F397 HydrophobicContact CD1-CZ 3.78Å; L386-F397 HydrophobicContact CD2-CE1 4.12Å; L386-F397 HydrophobicContact CD2-CZ 3.57Å; L386-F397 HydrophobicContact CG-CZ 4.21Å; L395-F397 HydrophobicContact CB-CE2 3.61Å; L395-F397 HydrophobicContact CB-CZ 3.7Å; L395-F397 HydrophobicContact CD1-CZ 4.1Å; F397-G409 CarbonylContact O-C 3.53Å; F397-G409 WeakPolarHBondContact O-CA 3.18Å; F397-G409 PolarHBondContact O-N 2.75Å; F397-L410 PolarHBondContact O-N 2.89Å; F397-K411 HydrophobicContact CB-CB 3.92Å; F397-K411 HydrophobicContact CD1-CB 4.1Å; F397-K411 HydrophobicContact CD2-CB 4.37Å; F397-K411 HydrophobicContact CG-CB 3.86Å; F397-S425 WeakPolarHBondContact CA-O 3.46Å; F397-V426 HydrophobicContact CD1-CB 4.49Å; F397-V426 HydrophobicContact CD1-CG1 4.21Å; F397-V426 HydrophobicContact CD1-CG2 3.75Å; F397-V426 HydrophobicContact CE1-CB 4.39Å; F397-V426 HydrophobicContact CE1-CG1 3.78Å; F397-V426 HydrophobicContact CE1-CG2 3.74Å; F397-V426 HydrophobicContact CZ-CG1 4.14Å
398	N	80.8	Confident	79.9	Confident	43 Å²	43	56.3 Å²	56.3	23%	0.23	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.9	164.1	-60.2	-20.8	0	0	0	108	L406 I407 P408 G409 L410 F424 S425	N398-L406 HydrophobicContact CB-CD1 3.71Å; N398-L406 HydrophobicContact CB-CD2 4.46Å; N398-L406 HydrophobicContact CB-CG 4.04Å; N398-I407 WeakPolarHBondContact CA-O 3.16Å; N398-P408 WeakPolarHBondContact OD1-CA 3.47Å; N398-G409 PolarHBondContact OD1-N 2.04Å; N398-L410 CarbonylContact C-O 3.59Å; N398-F424 CarbonylContact O-C 3.53Å; N398-F424 WeakPolarHBondContact O-CA 3.37Å; N398-S425 PolarHBondContact N-O 3.04Å; N398-S425 PolarHBondContact O-N 2.87Å
399	A	84.1	Confident	79.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	142.4	179.6	0	0	0	0	0	110.9	I407 L410 F424	A399-I407 PolarHBondContact N-O 2.84Å; A399-I407 PolarHBondContact O-N 2.97Å; A399-L410 HydrophobicContact CB-CB 4.02Å; A399-L410 HydrophobicContact CB-CD2 4.25Å; A399-L410 HydrophobicContact CB-CG 4.23Å; A399-L410 WeakPolarHBondContact CB-O 3.35Å; A399-L410 PolarHBondContact N-O 2.78Å; A399-F424 HydrophobicContact CB-CD1 3.79Å; A399-F424 HydrophobicContact CB-CE1 3.72Å
400	T	88.6	Confident	78.5	Confident	30 Å²	30	54.4 Å²	54.4	18%	0.184	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	103.1	168.6	-52.3	0	0	0	0	107.6	E405 S423	T400-E405 WeakPolarHBondContact CA-O 3.37Å; T400-S423 WeakPolarHBondContact CB-OG 3.42Å; T400-S423 PolarHBondContact N-O 3.45Å; T400-S423 PolarHBondContact O-N 3.04Å
401	C	85.4	Confident	78.3	Confident	28 Å²	28	57.3 Å²	57.3	19%	0.189	33%	0.328	C	S	.	.			trans	-94.1	-152.2	-178.6	-45.8	0	0	0	0	110.5	N403 G404 C413	C401-N403 VanDerWaalsContact C-N 3.32Å; C401-N403 PolarHBondContact O-N 2.82Å; C401-G404 PolarHBondContact O-N 2.7Å; C401-C413 VanDerWaalsContact CA-SG 3.59Å; C401-C413 HydrophobicContact CB-CB 3.87Å; C401-C413 WeakPolarHBondContact CB-SG 3.04Å; C401-C413 WeakPolarHBondContact SG-CB 3.35Å; C401-C413 CovalentContact SG-SG 2.04Å; C401-C413 PolarHBondContact SG-SG 2.78Å
402	L	74	Confident	78.6	Confident	87 Å²	87	49.9 Å²	49.9	46%	0.455	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.7	-169.8	-65.1	171	0	0	0	115.9	G404 L416 D420	L402-G404 VanDerWaalsContact C-N 3.26Å; L402-G404 PolarHBondContact O-N 3.34Å; L402-L416 HydrophobicContact CD1-CD2 4Å; L402-L416 HydrophobicContact CD2-CD2 4.17Å; L402-L416 HydrophobicContact CG-CD2 3.79Å; L402-D420 HydrophobicContact CD2-CB 3.82Å; L402-D420 VanDerWaalsContact CD2-CG 3.4Å; L402-D420 VanDerWaalsContact CD2-OD2 3.24Å; L402-D420 WeakPolarHBondContact CD2-OD2 3.5Å
403	N	68.4	Low	78.7	Confident	105 Å²	105	47.6 Å²	47.6	56%	0.561	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	0.9	-175.3	-63.9	-5.5	0	0	0	113.1	C401 E405	C401-N403 VanDerWaalsContact C-N 3.32Å; C401-N403 PolarHBondContact O-N 2.82Å; N403-E405 HydrophobicContact CB-CB 4.43Å; N403-E405 PolarHBondContact O-N 2.83Å; N403-E405 VanDerWaalsContact O-N 3.08Å
404	G	70.3	Confident	78.8	Confident	56 Å²	56	51.5 Å²	51.5	58%	0.577	31%	0.313	S	S	*	.			trans	67.9	0.7	-172.5	0	0	0	0	0	114.3	C401 L402	C401-G404 PolarHBondContact O-N 2.7Å; L402-G404 VanDerWaalsContact C-N 3.26Å; L402-G404 PolarHBondContact O-N 3.34Å
405	E	74.9	Confident	78.6	Confident	100 Å²	100	53.2 Å²	53.2	47%	0.467	33%	0.334	S	S	.	.			trans	-73.9	132.6	177.9	-169.8	175.4	-177.9	0	0	110.6	T400 N403	T400-E405 WeakPolarHBondContact CA-O 3.37Å; N403-E405 HydrophobicContact CB-CB 4.43Å; N403-E405 PolarHBondContact O-N 2.83Å; N403-E405 VanDerWaalsContact O-N 3.08Å
406	L	76.1	Confident	78.6	Confident	92 Å²	92	52.4 Å²	52.4	48%	0.482	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	114.2	174.9	-173.9	85.2	0	0	0	109.2	N398 P408	N398-L406 HydrophobicContact CB-CD1 3.71Å; N398-L406 HydrophobicContact CB-CD2 4.46Å; N398-L406 HydrophobicContact CB-CG 4.04Å; L406-P408 WeakPolarHBondContact O-CD 3.07Å
407	I	75.9	Confident	78.9	Confident	64 Å²	64	57.5 Å²	57.5	33%	0.328	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	109.5	178.3	-53.4	170.8	0	0	0	108.5	N398 A399 L410	N398-I407 WeakPolarHBondContact CA-O 3.16Å; A399-I407 PolarHBondContact N-O 2.84Å; A399-I407 PolarHBondContact O-N 2.97Å; I407-L410 HydrophobicContact CB-CB 4.36Å; I407-L410 HydrophobicContact CB-CD2 4.29Å; I407-L410 HydrophobicContact CD1-CD2 4.13Å; I407-L410 HydrophobicContact CG2-CB 3.9Å; I407-L410 HydrophobicContact CG2-CD2 3.87Å
408	P	72.4	Confident	78.8	Confident	96 Å²	96	60 Å²	60	62%	0.623	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	144.6	-178.5	-18.4	32.4	0	0	0	112.7	N398 L406 L410	N398-P408 WeakPolarHBondContact OD1-CA 3.47Å; L406-P408 WeakPolarHBondContact O-CD 3.07Å; P408-L410 PolarHBondContact O-N 2.84Å
409	G	67.8	Low	78.9	Confident	48 Å²	48	59.1 Å²	59.1	50%	0.495	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	-1.2	174.5	0	0	0	0	0	115.4	F397 N398	F397-G409 CarbonylContact O-C 3.53Å; F397-G409 WeakPolarHBondContact O-CA 3.18Å; F397-G409 PolarHBondContact O-N 2.75Å; N398-G409 PolarHBondContact OD1-N 2.04Å
410	L	76	Confident	79.1	Confident	24 Å²	24	61 Å²	61	13%	0.126	37%	0.37	C	S	.	.			trans	-99.3	136.2	-176.8	-166.7	65.6	0	0	0	111.5	F397 N398 A399 I407 P408 S412 M597	F397-L410 PolarHBondContact O-N 2.89Å; N398-L410 CarbonylContact C-O 3.59Å; A399-L410 HydrophobicContact CB-CB 4.02Å; A399-L410 HydrophobicContact CB-CD2 4.25Å; A399-L410 HydrophobicContact CB-CG 4.23Å; A399-L410 WeakPolarHBondContact CB-O 3.35Å; A399-L410 PolarHBondContact N-O 2.78Å; I407-L410 HydrophobicContact CB-CB 4.36Å; I407-L410 HydrophobicContact CB-CD2 4.29Å; I407-L410 HydrophobicContact CD1-CD2 4.13Å; I407-L410 HydrophobicContact CG2-CB 3.9Å; I407-L410 HydrophobicContact CG2-CD2 3.87Å; P408-L410 PolarHBondContact O-N 2.84Å; L410-S412 WeakPolarHBondContact CD2-O 3.01Å; L410-S412 VanDerWaalsContact CG-O 3.29Å; L410-S412 WeakPolarHBondContact CG-O 3.2Å; L410-M597 HydrophobicContact CD1-SD 3.98Å
411	K	83.1	Confident	79.2	Confident	73 Å²	73	62 Å²	62	32%	0.317	38%	0.376	S	S	.	.			trans	-118	16.1	177.4	66.7	173.5	-175.7	164.7	0	113.4	L384 F397 F424	L384-K411 PolarHBondContact N-O 3.26Å; F397-K411 HydrophobicContact CB-CB 3.92Å; F397-K411 HydrophobicContact CD1-CB 4.1Å; F397-K411 HydrophobicContact CD2-CB 4.37Å; F397-K411 HydrophobicContact CG-CB 3.86Å; K411-F424 VanDerWaalsContact C-CE1 3.44Å
412	S	86.1	Confident	79.5	Confident	21 Å²	21	60.9 Å²	60.9	15%	0.147	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155.7	179.1	61.2	0	0	0	0	111.8	V382 L410	V382-S412 CarbonylContact O-C 3.52Å; V382-S412 WeakPolarHBondContact O-CA 3.12Å; L410-S412 WeakPolarHBondContact CD2-O 3.01Å; L410-S412 VanDerWaalsContact CG-O 3.29Å; L410-S412 WeakPolarHBondContact CG-O 3.2Å
413	C	83.8	Confident	80.5	Confident	3 Å²	3	58 Å²	58	2%	0.02	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	136.5	171.4	-73.7	0	0	0	0	108.3	K381 V382 C401 L416 V422	K381-C413 CarbonylContact C-O 3.57Å; K381-C413 VanDerWaalsContact CA-O 3.29Å; K381-C413 WeakPolarHBondContact CA-O 3.28Å; V382-C413 PolarHBondContact N-O 3.32Å; V382-C413 PolarHBondContact O-N 2.9Å; C401-C413 VanDerWaalsContact CA-SG 3.59Å; C401-C413 HydrophobicContact CB-CB 3.87Å; C401-C413 WeakPolarHBondContact CB-SG 3.04Å; C401-C413 WeakPolarHBondContact SG-CB 3.35Å; C401-C413 CovalentContact SG-SG 2.04Å; C401-C413 PolarHBondContact SG-SG 2.78Å; C413-L416 HydrophobicContact CB-CD1 4.03Å; C413-L416 HydrophobicContact CB-CD2 4.27Å; C413-L416 HydrophobicContact CB-CG 4.4Å; C413-V422 HydrophobicContact CB-CB 4.43Å; C413-V422 HydrophobicContact CB-CG1 3.93Å
414	S	82.9	Confident	81.7	Confident	93 Å²	93	53 Å²	53	65%	0.65	33%	0.329	S	S	*	.			trans	-122	164.2	178.7	57.4	0	0	0	0	111.5	S380 L416	S380-S414 CarbonylContact O-C 3.49Å; S380-S414 WeakPolarHBondContact O-CA 3.4Å; S414-L416 VanDerWaalsContact C-N 3.33Å
415	G	75.6	Confident	82.9	Confident	54 Å²	54	51.6 Å²	51.6	56%	0.557	31%	0.31	S	S	*	.	S	Bend	trans	74.2	23.6	-179.4	0	0	0	0	0	114	S380	S380-G415 PolarHBondContact O-N 3.04Å
416	L	82.9	Confident	83.7	Confident	10 Å²	10	46.9 Å²	46.9	5%	0.052	29%	0.288	C	S	.	.			trans	-78.2	152.2	178.7	-54.7	176.3	0	0	0	111.1	S380 V382 L402 C413 S414 D420 V422	S380-L416 VanDerWaalsContact CA-O 3.31Å; S380-L416 WeakPolarHBondContact CA-O 3.42Å; S380-L416 WeakPolarHBondContact CB-O 3.37Å; S380-L416 WeakPolarHBondContact O-CB 3.47Å; S380-L416 PolarHBondContact O-N 2.64Å; V382-L416 HydrophobicContact CB-CD1 3.94Å; V382-L416 HydrophobicContact CG2-CD1 3.63Å; L402-L416 HydrophobicContact CD1-CD2 4Å; L402-L416 HydrophobicContact CD2-CD2 4.17Å; L402-L416 HydrophobicContact CG-CD2 3.79Å; C413-L416 HydrophobicContact CB-CD1 4.03Å; C413-L416 HydrophobicContact CB-CD2 4.27Å; C413-L416 HydrophobicContact CB-CG 4.4Å; S414-L416 VanDerWaalsContact C-N 3.33Å; L416-D420 HydrophobicContact CB-CB 4.47Å; L416-V422 HydrophobicContact CD1-CG1 3.82Å; L416-V422 HydrophobicContact CD2-CG1 3.58Å; L416-V422 HydrophobicContact CG-CG1 4.37Å
417	K	84.6	Confident	84.3	Confident	160 Å²	160	43.6 Å²	43.6	70%	0.696	27%	0.27	S	S	*	.			trans	-105	156.6	167.7	-62.7	-179.3	-178.7	179.8	0	109.5	G419 D420	K417-G419 PolarHBondContact O-N 2.89Å; K417-D420 PolarHBondContact N-OD2 3.37Å; K417-D420 WeakPolarHBondContact O-CB 3.47Å; K417-D420 VanDerWaalsContact O-CG 3.28Å; K417-D420 PolarHBondContact O-N 3.5Å
418	I	81.5	Confident	85	Confident	73 Å²	73	40.6 Å²	40.6	37%	0.374	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	133.7	173.6	-56.5	173.8	0	0	0	108.3	E135 R379	E135-I418 HydrophobicContact CB-CG2 4.4Å; E135-I418 HydrophobicContact CG-CG2 3.91Å; R379-I418 HydrophobicContact CB-CG1 4.34Å
419	G	82.7	Confident	85.7	Confident	24 Å²	24	41 Å²	41	25%	0.247	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	-21	-173.2	0	0	0	0	0	114	Q133 K417	Q133-G419 VanDerWaalsContact O-CA 3.27Å; Q133-G419 WeakPolarHBondContact O-CA 3.44Å; Q133-G419 PolarHBondContact O-N 3.15Å; K417-G419 PolarHBondContact O-N 2.89Å
420	D	87.5	Confident	86.5	Confident	40 Å²	40	38.7 Å²	38.7	21%	0.214	22%	0.22	C	C	.	.			trans	-65.4	150.1	-178.8	-71.3	-18.2	0	0	0	112.2	R132 Q133 L402 L416 K417	R132-D420 WeakPolarHBondContact CA-O 3.23Å; Q133-D420 PolarHBondContact N-O 2.85Å; L402-D420 HydrophobicContact CD2-CB 3.82Å; L402-D420 VanDerWaalsContact CD2-CG 3.4Å; L402-D420 VanDerWaalsContact CD2-OD2 3.24Å; L402-D420 WeakPolarHBondContact CD2-OD2 3.5Å; L416-D420 HydrophobicContact CB-CB 4.47Å; K417-D420 PolarHBondContact N-OD2 3.37Å; K417-D420 WeakPolarHBondContact O-CB 3.47Å; K417-D420 VanDerWaalsContact O-CG 3.28Å; K417-D420 PolarHBondContact O-N 3.5Å
421	T	90.8	Very high	86.2	Confident	51 Å²	51	40.9 Å²	40.9	31%	0.313	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.9	179.1	-49.9	0	0	0	0	109.6	L96 V131 R132	L96-T421 HydrophobicContact CD1-CG2 3.85Å; V131-T421 WeakPolarHBondContact O-CA 3.4Å; R132-T421 HydrophobicContact CB-CG2 4.22Å; R132-T421 PolarHBondContact NE-OG1 3.07Å; R132-T421 PolarHBondContact NH2-OG1 3.17Å
422	V	92.8	Very high	85.7	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	157.2	176.8	-61.6	0	0	0	0	110.1	K130 V131 V382 C413 L416 F424	K130-V422 WeakPolarHBondContact CA-O 3.11Å; V131-V422 HydrophobicContact CB-CG2 4.2Å; V131-V422 PolarHBondContact N-O 3.46Å; V131-V422 PolarHBondContact O-N 2.9Å; V382-V422 HydrophobicContact CB-CG2 4.19Å; V382-V422 HydrophobicContact CG1-CG2 4.06Å; V382-V422 HydrophobicContact CG2-CG2 4.48Å; C413-V422 HydrophobicContact CB-CB 4.43Å; C413-V422 HydrophobicContact CB-CG1 3.93Å; L416-V422 HydrophobicContact CD1-CG1 3.82Å; L416-V422 HydrophobicContact CD2-CG1 3.58Å; L416-V422 HydrophobicContact CG-CG1 4.37Å; V422-F424 HydrophobicContact CG2-CE2 3.66Å; V422-F424 HydrophobicContact CG2-CZ 4.01Å
423	S	94.6	Very high	85.3	Confident	27 Å²	27	40.2 Å²	40.2	19%	0.189	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.8	176.5	60.7	0	0	0	0	112.4	V129 T400	V129-S423 CarbonylContact O-C 3.52Å; V129-S423 VanDerWaalsContact O-CA 3.28Å; V129-S423 WeakPolarHBondContact O-CA 3.49Å; T400-S423 WeakPolarHBondContact CB-OG 3.42Å; T400-S423 PolarHBondContact N-O 3.45Å; T400-S423 PolarHBondContact O-N 3.04Å
424	F	94.6	Very high	85.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.3	176.7	-58.5	-83.6	0	0	0	108.9	T128 V129 V131 V382 L384 N398 A399 K411 V422	T128-F424 CarbonylContact C-O 3.6Å; T128-F424 WeakPolarHBondContact CA-O 3.29Å; V129-F424 PolarHBondContact N-O 2.03Å; V129-F424 PolarHBondContact O-N 3.05Å; V131-F424 HydrophobicContact CG2-CD2 4.38Å; V131-F424 HydrophobicContact CG2-CE2 4.23Å; V382-F424 HydrophobicContact CG1-CE2 3.95Å; V382-F424 HydrophobicContact CG1-CZ 4.15Å; L384-F424 HydrophobicContact CD1-CB 3.67Å; L384-F424 HydrophobicContact CD1-CD1 4.07Å; L384-F424 HydrophobicContact CD1-CD2 3.55Å; L384-F424 HydrophobicContact CD1-CE2 4.17Å; L384-F424 HydrophobicContact CD1-CG 3.47Å; L384-F424 VanDerWaalsContact CD1-CG 3.47Å; L384-F424 HydrophobicContact CD2-CD2 4.2Å; L384-F424 HydrophobicContact CD2-CE2 4.22Å; L384-F424 HydrophobicContact CG-CD2 3.89Å; L384-F424 HydrophobicContact CG-CE2 3.98Å; L384-F424 HydrophobicContact CG-CG 4.15Å; L384-F424 HydrophobicContact CG-CZ 4.35Å; N398-F424 CarbonylContact O-C 3.53Å; N398-F424 WeakPolarHBondContact O-CA 3.37Å; A399-F424 HydrophobicContact CB-CD1 3.79Å; A399-F424 HydrophobicContact CB-CE1 3.72Å; K411-F424 VanDerWaalsContact C-CE1 3.44Å; V422-F424 HydrophobicContact CG2-CE2 3.66Å; V422-F424 HydrophobicContact CG2-CZ 4.01Å
425	S	93.4	Very high	85.3	Confident	27 Å²	27	48.2 Å²	48.2	19%	0.189	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.5	170	175	0	0	0	0	108.5	F397 N398	F397-S425 WeakPolarHBondContact CA-O 3.46Å; N398-S425 PolarHBondContact N-O 3.04Å; N398-S425 PolarHBondContact O-N 2.87Å
426	V	93.1	Very high	85.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.4	-178.2	-170.6	0	0	0	0	109.1	R126 F127 V129 L395 S396 F397 I443	R126-V426 CarbonylContact C-O 3.33Å; R126-V426 VanDerWaalsContact CA-O 3.27Å; R126-V426 WeakPolarHBondContact CA-O 3.44Å; F127-V426 HydrophobicContact CD2-CB 4.14Å; F127-V426 HydrophobicContact CE1-CB 4.1Å; F127-V426 HydrophobicContact CE1-CG1 4.04Å; F127-V426 HydrophobicContact CE2-CB 3.69Å; F127-V426 HydrophobicContact CE2-CG1 4.09Å; F127-V426 HydrophobicContact CE2-CG2 4Å; F127-V426 HydrophobicContact CZ-CB 3.67Å; F127-V426 HydrophobicContact CZ-CG1 3.59Å; F127-V426 HydrophobicContact CZ-CG2 4.37Å; F127-V426 PolarHBondContact N-O 3.25Å; F127-V426 PolarHBondContact O-N 3.39Å; V129-V426 HydrophobicContact CG2-CG2 4.09Å; L395-V426 HydrophobicContact CB-CG1 4.45Å; L395-V426 HydrophobicContact CD2-CG1 4.24Å; S396-V426 CarbonylContact O-C 3.6Å; S396-V426 VanDerWaalsContact O-CA 3.31Å; S396-V426 WeakPolarHBondContact O-CA 3.45Å; F397-V426 HydrophobicContact CD1-CB 4.49Å; F397-V426 HydrophobicContact CD1-CG1 4.21Å; F397-V426 HydrophobicContact CD1-CG2 3.75Å; F397-V426 HydrophobicContact CE1-CB 4.39Å; F397-V426 HydrophobicContact CE1-CG1 3.78Å; F397-V426 HydrophobicContact CE1-CG2 3.74Å; F397-V426 HydrophobicContact CZ-CG1 4.14Å; V426-I443 HydrophobicContact CG1-CD1 4.31Å; V426-I443 HydrophobicContact CG2-CD1 4.46Å
427	E	88.9	Confident	86	Confident	24 Å²	24	56.6 Å²	56.6	11%	0.112	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117	168	-178.3	178.8	109.8	0	0	109.1	A124 R126 L395 S396 R429	A124-E427 HydrophobicContact CB-CG 3.76Å; R126-E427 HydrophobicContact CG-CB 3.69Å; R126-E427 HydrophobicContact CG-CG 3.98Å; R126-E427 IonicContact CZ-OE2 2.59Å; R126-E427 IonicContact NE-OE2 3.91Å; R126-E427 IonicContact NH1-OE2 3.84Å; R126-E427 PolarHBondContact NH1-OE2 2.96Å; R126-E427 IonicContact NH2-OE2 2.77Å; L395-E427 WeakPolarHBondContact CA-O 3.42Å; S396-E427 PolarHBondContact N-O 3.28Å; S396-E427 PolarHBondContact O-N 3.32Å; S396-E427 WeakPolarHBondContact OG-CB 3.41Å; E427-R429 IonicContact OE1-CZ 2.87Å; E427-R429 IonicContact OE1-NE 3.66Å; E427-R429 PolarHBondContact OE1-NE 3.14Å; E427-R429 IonicContact OE1-NH2 3.04Å; E427-R429 PolarHBondContact OE1-NH2 3.18Å
428	A	90.1	Very high	86.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	116.8	170.1	0	0	0	0	0	109.9	I117 A124 K125 F127 L393 S394 L395	I117-A428 HydrophobicContact CD1-CB 4.28Å; A124-A428 CarbonylContact C-O 3.51Å; A124-A428 VanDerWaalsContact CA-O 3.27Å; A124-A428 WeakPolarHBondContact CA-O 3.41Å; K125-A428 PolarHBondContact N-O 3.26Å; K125-A428 PolarHBondContact O-N 2.98Å; F127-A428 HydrophobicContact CE1-CB 3.97Å; L393-A428 HydrophobicContact CD1-CB 4.32Å; L393-A428 HydrophobicContact CD2-CB 4.42Å; S394-A428 WeakPolarHBondContact O-CA 3.3Å; L395-A428 HydrophobicContact CD2-CB 3.66Å
429	R	86.1	Confident	87	Confident	104 Å²	104	54.5 Å²	54.5	39%	0.392	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.4	179.7	-178.7	-179.5	-62.2	-121.6	1.1	110.3	D123 A124 S394 E427	D123-R429 WeakPolarHBondContact O-CA 3.26Å; A124-R429 HydrophobicContact CB-CB 3.8Å; A124-R429 HydrophobicContact CB-CG 4.04Å; S394-R429 PolarHBondContact N-O 3.11Å; S394-R429 PolarHBondContact O-N 3.42Å; E427-R429 IonicContact OE1-CZ 2.87Å; E427-R429 IonicContact OE1-NE 3.66Å; E427-R429 PolarHBondContact OE1-NE 3.14Å; E427-R429 IonicContact OE1-NH2 3.04Å; E427-R429 PolarHBondContact OE1-NH2 3.18Å
430	A	86.2	Confident	87.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	129.9	171	0	0	0	0	0	108.5	L119 D122 D123 F458	L119-A430 HydrophobicContact CB-CB 3.87Å; L119-A430 HydrophobicContact CD1-CB 4.05Å; D122-A430 WeakPolarHBondContact CA-O 3.46Å; D122-A430 PolarHBondContact N-O 3.41Å; D122-A430 VanDerWaalsContact N-O 3.11Å; D123-A430 PolarHBondContact O-N 3.39Å; A430-F458 HydrophobicContact CB-CD1 4.03Å; A430-F458 HydrophobicContact CB-CE1 3.91Å
431	R	69.6	Low	88	Confident	70 Å²	70	55.1 Å²	55.1	26%	0.264	26%	0.263	S	S	.	.			trans	-105.7	16.3	179	-66	-175.6	162.4	159	-6.8	112.3	E392 S394 P580 D581	E392-R431 PolarHBondContact O-N 2.74Å; S394-R431 PolarHBondContact OG-NE 3.11Å; S394-R431 PolarHBondContact OG-NH1 3.13Å; S394-R431 PolarHBondContact OG-NH2 3.31Å; R431-P580 HydrophobicContact CB-CG 4.38Å; R431-P580 VanDerWaalsContact CD-CA 3.49Å; R431-P580 VanDerWaalsContact NH1-CA 3.26Å; R431-P580 PolarHBondContact NH1-O 3.46Å; R431-P580 PolarHBondContact NH2-O 2.92Å; R431-D581 IonicContact CZ-OD1 3.39Å; R431-D581 IonicContact NH1-OD1 2.79Å; R431-D581 PolarHBondContact NH1-OD1 2.97Å; R431-D581 IonicContact NH2-OD1 3.71Å
432	G	71.8	Confident	88.1	Confident	24 Å²	24	55.3 Å²	55.3	25%	0.247	26%	0.261	C	S	.	.	S	Bend	trans	164.5	-164.4	-178.7	0	0	0	0	0	112.8
433	C	78.4	Confident	88.2	Confident	57 Å²	57	55.1 Å²	55.1	39%	0.385	26%	0.26	S	S	.	.			trans	-123.2	110.9	176	-171.2	0	0	0	0	112.5	C460	C433-C460 HydrophobicContact CB-CB 3.58Å; C433-C460 WeakPolarHBondContact CB-SG 3.36Å; C433-C460 WeakPolarHBondContact SG-CB 3.5Å; C433-C460 CovalentContact SG-SG 2Å; C433-C460 PolarHBondContact SG-SG 2.89Å
434	P	83.4	Confident	88	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.058	25%	0.254	C	S	.	.			trans	-72.4	156.1	176.1	28.3	-33.3	0	0	0	112.8	E392 Q436 F458	E392-P434 HydrophobicContact CG-CB 4.08Å; E392-P434 WeakPolarHBondContact OE1-CB 3.37Å; P434-Q436 WeakPolarHBondContact CB-O 3.29Å; P434-Q436 VanDerWaalsContact CG-O 3.27Å; P434-Q436 WeakPolarHBondContact CG-O 3.49Å; P434-F458 VanDerWaalsContact CD-CG 3.4Å; P434-F458 HydrophobicContact CG-CB 3.98Å; P434-F458 HydrophobicContact CG-CD1 4.03Å; P434-F458 HydrophobicContact CG-CD2 3.27Å; P434-F458 HydrophobicContact CG-CE1 4.33Å; P434-F458 HydrophobicContact CG-CE2 3.64Å; P434-F458 HydrophobicContact CG-CG 3.49Å; P434-F458 VanDerWaalsContact CG-CG 3.49Å; P434-F458 HydrophobicContact CG-CZ 4.15Å
435	R	82.4	Confident	87.8	Confident	255 Å²	255	54.6 Å²	54.6	96%	0.962	25%	0.254	S	S	*	.	S	Bend	trans	-62.4	-45.2	170.5	-68.8	-175.6	178.2	176	0.2	111.6	K437	R435-K437 PolarHBondContact O-N 3.03Å
436	Q	86.3	Confident	87.4	Confident	139 Å²	139	55.4 Å²	55.4	65%	0.65	26%	0.258	S	S	*	.	S	Bend	trans	-81.6	108.6	169.9	-83.1	-177.5	-9.4	0	0	109.6	P434 K438	P434-Q436 WeakPolarHBondContact CB-O 3.29Å; P434-Q436 VanDerWaalsContact CG-O 3.27Å; P434-Q436 WeakPolarHBondContact CG-O 3.49Å; Q436-K438 VanDerWaalsContact C-N 3.29Å; Q436-K438 PolarHBondContact O-N 2.97Å
437	K	87.9	Confident	86.7	Confident	101 Å²	101	55.9 Å²	55.9	44%	0.439	26%	0.263	S	S	.	.	S	Bend	trans	-70.8	-20.8	-175.6	-64.1	-177.3	179.5	176.9	0	114.3	R435 T457 F458 D461	R435-K437 PolarHBondContact O-N 3.03Å; K437-T457 CarbonylContact O-C 3.21Å; K437-T457 VanDerWaalsContact O-CA 3.24Å; K437-T457 WeakPolarHBondContact O-CA 3.3Å; K437-F458 WeakPolarHBondContact O-CD2 3.23Å; K437-F458 PolarHBondContact O-N 3.13Å; K437-D461 WeakPolarHBondContact CE-OD2 3.24Å; K437-D461 IonicContact NZ-OD2 4Å; K437-D461 PolarHBondContact NZ-OD2 3.35Å
438	K	93.6	Very high	86.4	Confident	139 Å²	139	55.5 Å²	55.5	60%	0.604	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.6	-177.1	-169.7	177.5	-178.3	-178.9	0	109.5	Q436 T455 V456	Q436-K438 VanDerWaalsContact C-N 3.29Å; Q436-K438 PolarHBondContact O-N 2.97Å; K438-T455 HydrophobicContact CD-CG2 4.23Å; K438-T455 HydrophobicContact CG-CG2 3.85Å; K438-V456 WeakPolarHBondContact CA-O 3.38Å
439	K	93.8	Very high	86.1	Confident	49 Å²	49	59.9 Å²	59.9	21%	0.213	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	156.8	177.2	-65.6	-172.6	179.2	-176.8	0	110	P390 E392 T455 V456	P390-K439 HydrophobicContact CB-CD 3.62Å; P390-K439 HydrophobicContact CG-CB 3.76Å; P390-K439 HydrophobicContact CG-CD 3.7Å; P390-K439 HydrophobicContact CG-CG 4.39Å; E392-K439 IonicContact OE1-NZ 2.76Å; E392-K439 PolarHBondContact OE1-NZ 2.69Å; E392-K439 IonicContact OE2-NZ 2.7Å; E392-K439 PolarHBondContact OE2-NZ 2.82Å; K439-T455 CarbonylContact O-C 3.56Å; K439-T455 WeakPolarHBondContact O-CA 3.49Å; K439-V456 PolarHBondContact N-O 3.34Å; K439-V456 PolarHBondContact O-N 2.71Å
440	T	95.6	Very high	86.2	Confident	75 Å²	75	56.1 Å²	56.1	46%	0.46	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.7	179.5	-59.8	0	0	0	0	109.4	T453 I454 T455	T440-T453 HydrophobicContact CG2-CG2 3.52Å; T440-I454 VanDerWaalsContact CA-O 3.3Å; T440-I454 WeakPolarHBondContact CA-O 3.35Å; T440-T455 PolarHBondContact OG1-OG1 3Å
441	F	94.5	Very high	86.6	Confident	3 Å²	3	57.9 Å²	57.9	1%	0.013	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	165.9	173.7	73.7	-83.7	0	0	0	110.3	L387 G388 V389 L393 L395 I443 I454 V456	L387-F441 WeakPolarHBondContact O-CB 3.35Å; G388-F441 VanDerWaalsContact O-CB 3.26Å; G388-F441 WeakPolarHBondContact O-CB 3.15Å; V389-F441 HydrophobicContact CG2-CB 4.45Å; V389-F441 HydrophobicContact CG2-CD2 3.93Å; V389-F441 HydrophobicContact CG2-CG 4.42Å; L393-F441 HydrophobicContact CD2-CD1 4.08Å; L393-F441 HydrophobicContact CD2-CE1 3.44Å; L393-F441 VanDerWaalsContact CD2-CE1 3.44Å; L393-F441 HydrophobicContact CD2-CZ 3.81Å; L395-F441 HydrophobicContact CD1-CD2 4.33Å; L395-F441 HydrophobicContact CD1-CE2 3.61Å; L395-F441 HydrophobicContact CD1-CZ 4.14Å; L395-F441 HydrophobicContact CD2-CE2 4.34Å; L395-F441 HydrophobicContact CD2-CZ 4.03Å; F441-I443 HydrophobicContact CD2-CG1 4.26Å; F441-I443 HydrophobicContact CE2-CD1 3.96Å; F441-I443 HydrophobicContact CE2-CG1 3.79Å; F441-I454 HydrophobicContact CD1-CB 4.03Å; F441-I454 HydrophobicContact CD1-CG2 4.36Å; F441-I454 HydrophobicContact CD2-CD1 4.08Å; F441-I454 HydrophobicContact CE1-CB 3.57Å; F441-I454 HydrophobicContact CE1-CD1 4.47Å; F441-I454 HydrophobicContact CE1-CG1 4.36Å; F441-I454 HydrophobicContact CE1-CG2 3.57Å; F441-I454 HydrophobicContact CE2-CB 4.28Å; F441-I454 HydrophobicContact CE2-CD1 3.64Å; F441-I454 HydrophobicContact CE2-CG1 4.3Å; F441-I454 HydrophobicContact CZ-CB 3.71Å; F441-I454 HydrophobicContact CZ-CD1 3.85Å; F441-I454 HydrophobicContact CZ-CG1 3.99Å; F441-I454 HydrophobicContact CZ-CG2 3.87Å; F441-I454 PolarHBondContact N-O 3.29Å; F441-I454 PolarHBondContact O-N 2.96Å; F441-V456 HydrophobicContact CD1-CG2 4.11Å; F441-V456 HydrophobicContact CE1-CG2 3.59Å
442	I	94.2	Very high	87.8	Confident	55 Å²	55	54.6 Å²	54.6	28%	0.282	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.1	-174.5	-64.2	161.2	0	0	0	109.7	L387 K444 L452	L387-I442 HydrophobicContact CB-CB 4.16Å; L387-I442 PolarHBondContact N-O 3.04Å; L387-I442 PolarHBondContact O-N 2.94Å; I442-K444 HydrophobicContact CG2-CB 4.38Å; I442-L452 WeakPolarHBondContact CA-O 3.41Å
443	I	94.2	Very high	89	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.1	165.9	-58.2	-179.8	0	0	0	106.9	F127 L384 E385 L386 V426 F441 L452 I454	F127-I443 HydrophobicContact CE2-CD1 4.01Å; F127-I443 HydrophobicContact CZ-CD1 3.95Å; L384-I443 HydrophobicContact CB-CG2 4.29Å; L384-I443 HydrophobicContact CD1-CG2 4.02Å; L384-I443 HydrophobicContact CD2-CG2 4.18Å; L384-I443 HydrophobicContact CG-CG2 4.41Å; E385-I443 WeakPolarHBondContact O-CA 3.48Å; L386-I443 HydrophobicContact CD2-CB 4.42Å; L386-I443 HydrophobicContact CD2-CD1 4.28Å; L386-I443 HydrophobicContact CD2-CG1 3.74Å; L386-I443 HydrophobicContact CD2-CG2 4.28Å; V426-I443 HydrophobicContact CG1-CD1 4.31Å; V426-I443 HydrophobicContact CG2-CD1 4.46Å; F441-I443 HydrophobicContact CD2-CG1 4.26Å; F441-I443 HydrophobicContact CE2-CD1 3.96Å; F441-I443 HydrophobicContact CE2-CG1 3.79Å; I443-L452 PolarHBondContact N-O 3.33Å; I443-L452 PolarHBondContact O-N 3.17Å; I443-I454 HydrophobicContact CB-CD1 4.23Å; I443-I454 HydrophobicContact CD1-CD1 3.88Å; I443-I454 HydrophobicContact CG1-CD1 3.69Å
444	K	90.7	Very high	89.9	Confident	14 Å²	14	52.5 Å²	52.5	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	151.2	177.9	70.8	172.4	-170	167.6	0	111.2	S327 N330 E385 L387 I442	S327-K444 PolarHBondContact O-NZ 2.89Å; N330-K444 PolarHBondContact OD1-NZ 2.65Å; E385-K444 HydrophobicContact CB-CG 4.21Å; E385-K444 PolarHBondContact N-O 3.41Å; E385-K444 PolarHBondContact O-N 2.75Å; E385-K444 WeakPolarHBondContact OE1-CE 3.49Å; E385-K444 IonicContact OE1-NZ 3.56Å; E385-K444 WeakPolarHBondContact OE2-CE 3.49Å; E385-K444 IonicContact OE2-NZ 2.87Å; L387-K444 HydrophobicContact CD1-CD 3.96Å; L387-K444 HydrophobicContact CD1-CG 4.45Å; I442-K444 HydrophobicContact CG2-CB 4.38Å
445	P	90.2	Very high	90.6	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	141.2	167.4	-10.2	27.9	0	0	0	110.2	I110 V131 V382 E383 L384 G447 F448 D450	I110-P445 HydrophobicContact CD1-CG 4.27Å; V131-P445 HydrophobicContact CG1-CB 4.24Å; V131-P445 HydrophobicContact CG1-CG 3.73Å; V131-P445 HydrophobicContact CG2-CG 3.96Å; V382-P445 HydrophobicContact CG1-CB 4.42Å; E383-P445 CarbonylContact O-C 3.5Å; E383-P445 VanDerWaalsContact O-CA 3.31Å; E383-P445 WeakPolarHBondContact O-CA 3.35Å; L384-P445 HydrophobicContact CD2-CG 4.39Å; P445-G447 PolarHBondContact O-N 3.31Å; P445-F448 HydrophobicContact CB-CB 3.99Å; P445-F448 HydrophobicContact CB-CD1 4.46Å; P445-F448 HydrophobicContact CB-CD2 3.81Å; P445-F448 HydrophobicContact CB-CE2 4.45Å; P445-F448 HydrophobicContact CB-CG 3.84Å; P445-F448 HydrophobicContact CG-CB 4.08Å; P445-F448 HydrophobicContact CG-CD1 4.4Å; P445-F448 HydrophobicContact CG-CG 4.12Å; P445-F448 PolarHBondContact O-N 3.28Å; P445-D450 WeakPolarHBondContact CD-O 3.45Å
446	V	85.2	Confident	91.2	Very high	44 Å²	44	41.3 Å²	41.3	27%	0.267	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	127.8	177	176.9	0	0	0	0	110.2	E383 E385 F448	E383-V446 HydrophobicContact CB-CG2 4.3Å; E383-V446 HydrophobicContact CG-CG2 4.37Å; E383-V446 PolarHBondContact O-N 3.17Å; E385-V446 HydrophobicContact CB-CG2 4.11Å; V446-F448 VanDerWaalsContact C-N 3.31Å; V446-F448 WeakPolarHBondContact O-CD2 3.34Å; V446-F448 PolarHBondContact O-N 3.29Å
447	G	78.6	Confident	91.6	Very high	11 Å²	11	36.4 Å²	36.4	11%	0.113	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	6.9	178.5	0	0	0	0	0	115.4	P445	P445-G447 PolarHBondContact O-N 3.31Å
448	F	82.5	Confident	91.8	Very high	16 Å²	16	31.7 Å²	31.7	7%	0.07	17%	0.167	C	C	.	.			trans	-103.5	146.3	176.6	-76.4	-121.9	0	0	0	110.8	Q109 Q133 P445 V446	Q109-F448 HydrophobicContact CB-CD1 3.76Å; Q109-F448 HydrophobicContact CB-CE1 3.94Å; Q109-F448 VanDerWaalsContact CD-CD1 3.49Å; Q109-F448 VanDerWaalsContact CD-CE1 3.49Å; Q109-F448 HydrophobicContact CG-CD1 4.23Å; Q109-F448 HydrophobicContact CG-CE1 4.24Å; Q133-F448 HydrophobicContact CG-CZ 4.17Å; P445-F448 HydrophobicContact CB-CB 3.99Å; P445-F448 HydrophobicContact CB-CD1 4.46Å; P445-F448 HydrophobicContact CB-CD2 3.81Å; P445-F448 HydrophobicContact CB-CE2 4.45Å; P445-F448 HydrophobicContact CB-CG 3.84Å; P445-F448 HydrophobicContact CG-CB 4.08Å; P445-F448 HydrophobicContact CG-CD1 4.4Å; P445-F448 HydrophobicContact CG-CG 4.12Å; P445-F448 PolarHBondContact O-N 3.28Å; V446-F448 VanDerWaalsContact C-N 3.31Å; V446-F448 WeakPolarHBondContact O-CD2 3.34Å; V446-F448 PolarHBondContact O-N 3.29Å
449	K	84.1	Confident	91.6	Very high	92 Å²	92	27.7 Å²	27.7	40%	0.4	15%	0.151	S	C	.	.	S	Bend	trans	-69.9	-47.6	171.5	-179.1	-154.8	-173.3	-175.9	0	111.3	P267	P267-K449 VanDerWaalsContact O-CB 3.28Å; P267-K449 WeakPolarHBondContact O-CB 3.45Å; P267-K449 WeakPolarHBondContact O-CD 3.47Å; P267-K449 WeakPolarHBondContact O-CG 3.38Å
450	D	88.1	Confident	91.1	Very high	25 Å²	25	25.6 Å²	25.6	13%	0.134	14%	0.142	C	C	.	.			trans	-70.3	140.4	-171.7	-65.9	-14.2	0	0	0	111	V107 T108 Q109 I110 P445	V107-D450 VanDerWaalsContact O-OD2 3.1Å; T108-D450 VanDerWaalsContact CA-OD2 3.3Å; T108-D450 WeakPolarHBondContact CA-OD2 3.48Å; Q109-D450 PolarHBondContact N-OD2 2.9Å; I110-D450 HydrophobicContact CB-CB 4.34Å; I110-D450 HydrophobicContact CG2-CB 3.54Å; P445-D450 WeakPolarHBondContact CD-O 3.45Å
451	S	92.7	Very high	90.7	Very high	37 Å²	37	24.3 Å²	24.3	26%	0.259	13%	0.133	S	C	.	.			trans	-140.1	157.4	-178.9	63.3	0	0	0	0	111.2
452	L	96.3	Very high	90.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.7	168.9	166.6	58.6	0	0	0	108.1	I110 P112 Q113 L115 F127 V129 I442 I443 I454	I110-L452 HydrophobicContact CD1-CB 3.99Å; P112-L452 HydrophobicContact CG-CD1 4.27Å; P112-L452 WeakPolarHBondContact O-CD1 3.43Å; Q113-L452 WeakPolarHBondContact O-CA 3.46Å; L115-L452 HydrophobicContact CB-CD1 4.31Å; L115-L452 HydrophobicContact CD1-CD1 3.96Å; L115-L452 HydrophobicContact CD1-CD2 3.97Å; L115-L452 HydrophobicContact CG-CD1 3.73Å; F127-L452 HydrophobicContact CD2-CD2 4.29Å; F127-L452 HydrophobicContact CE2-CD2 3.89Å; V129-L452 HydrophobicContact CG1-CD2 4.39Å; V129-L452 HydrophobicContact CG2-CD2 3.47Å; V129-L452 VanDerWaalsContact CG2-CD2 3.47Å; I442-L452 WeakPolarHBondContact CA-O 3.41Å; I443-L452 PolarHBondContact N-O 3.33Å; I443-L452 PolarHBondContact O-N 3.17Å; L452-I454 HydrophobicContact CD1-CD1 4.4Å; L452-I454 HydrophobicContact CD1-CG1 4.22Å; L452-I454 HydrophobicContact CD2-CD1 3.98Å; L452-I454 HydrophobicContact CD2-CG1 4.2Å; L452-I454 HydrophobicContact CG-CD1 3.61Å; L452-I454 HydrophobicContact CG-CG1 3.92Å; L452-I454 WeakPolarHBondContact O-CD1 3.37Å
453	T	97.3	Very high	90.2	Very high	38 Å²	38	28.3 Å²	28.3	23%	0.233	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	126.6	172.3	-57.9	0	0	0	0	109.9	Q113 K114 L115 T440	Q113-T453 PolarHBondContact O-N 3.34Å; K114-T453 WeakPolarHBondContact CA-O 3.49Å; L115-T453 PolarHBondContact N-O 2.96Å; T440-T453 HydrophobicContact CG2-CG2 3.52Å
454	I	97.5	Very high	89.9	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.9	179.8	-54	93.6	0	0	0	109.5	L115 I117 F127 T440 F441 I443 L452 V456	L115-I454 HydrophobicContact CB-CG1 4.25Å; L115-I454 HydrophobicContact CB-CG2 4.3Å; L115-I454 HydrophobicContact CD1-CG1 4.42Å; L115-I454 WeakPolarHBondContact O-CA 3.2Å; I117-I454 HydrophobicContact CD1-CG2 3.55Å; I117-I454 HydrophobicContact CG1-CG2 3.74Å; F127-I454 HydrophobicContact CZ-CG1 4.42Å; T440-I454 VanDerWaalsContact CA-O 3.3Å; T440-I454 WeakPolarHBondContact CA-O 3.35Å; F441-I454 HydrophobicContact CD1-CB 4.03Å; F441-I454 HydrophobicContact CD1-CG2 4.36Å; F441-I454 HydrophobicContact CD2-CD1 4.08Å; F441-I454 HydrophobicContact CE1-CB 3.57Å; F441-I454 HydrophobicContact CE1-CD1 4.47Å; F441-I454 HydrophobicContact CE1-CG1 4.36Å; F441-I454 HydrophobicContact CE1-CG2 3.57Å; F441-I454 HydrophobicContact CE2-CB 4.28Å; F441-I454 HydrophobicContact CE2-CD1 3.64Å; F441-I454 HydrophobicContact CE2-CG1 4.3Å; F441-I454 HydrophobicContact CZ-CB 3.71Å; F441-I454 HydrophobicContact CZ-CD1 3.85Å; F441-I454 HydrophobicContact CZ-CG1 3.99Å; F441-I454 HydrophobicContact CZ-CG2 3.87Å; F441-I454 PolarHBondContact N-O 3.29Å; F441-I454 PolarHBondContact O-N 2.96Å; I443-I454 HydrophobicContact CB-CD1 4.23Å; I443-I454 HydrophobicContact CD1-CD1 3.88Å; I443-I454 HydrophobicContact CG1-CD1 3.69Å; L452-I454 HydrophobicContact CD1-CD1 4.4Å; L452-I454 HydrophobicContact CD1-CG1 4.22Å; L452-I454 HydrophobicContact CD2-CD1 3.98Å; L452-I454 HydrophobicContact CD2-CG1 4.2Å; L452-I454 HydrophobicContact CG-CD1 3.61Å; L452-I454 HydrophobicContact CG-CG1 3.92Å; L452-I454 WeakPolarHBondContact O-CD1 3.37Å; I454-V456 HydrophobicContact CG2-CG2 4.05Å
455	T	97.3	Very high	89.8	Confident	29 Å²	29	30 Å²	30	18%	0.178	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	119.4	170	-60.8	0	0	0	0	109.7	L115 H116 I117 K438 K439 T440	L115-T455 PolarHBondContact O-N 3.24Å; H116-T455 WeakPolarHBondContact CA-O 3.42Å; H116-T455 PolarHBondContact ND1-O 3.47Å; I117-T455 PolarHBondContact N-O 2.95Å; K438-T455 HydrophobicContact CD-CG2 4.23Å; K438-T455 HydrophobicContact CG-CG2 3.85Å; K439-T455 CarbonylContact O-C 3.56Å; K439-T455 WeakPolarHBondContact O-CA 3.49Å; T440-T455 PolarHBondContact OG1-OG1 3Å
456	V	95.2	Very high	89.7	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.2	177.9	-174.9	0	0	0	0	109.9	I117 L119 L393 K438 K439 F441 I454 F458	I117-V456 HydrophobicContact CB-CG2 4.44Å; I117-V456 CarbonylContact O-C 3.36Å; I117-V456 VanDerWaalsContact O-CA 3.28Å; I117-V456 WeakPolarHBondContact O-CA 3.4Å; L119-V456 HydrophobicContact CD1-CG1 3.96Å; L119-V456 HydrophobicContact CG-CG1 4.3Å; L393-V456 HydrophobicContact CD1-CG1 4.41Å; L393-V456 HydrophobicContact CD2-CG2 4.11Å; K438-V456 WeakPolarHBondContact CA-O 3.38Å; K439-V456 PolarHBondContact N-O 3.34Å; K439-V456 PolarHBondContact O-N 2.71Å; F441-V456 HydrophobicContact CD1-CG2 4.11Å; F441-V456 HydrophobicContact CE1-CG2 3.59Å; I454-V456 HydrophobicContact CG2-CG2 4.05Å; V456-F458 HydrophobicContact CB-CE2 4.3Å; V456-F458 HydrophobicContact CG1-CD2 4.23Å; V456-F458 HydrophobicContact CG1-CE1 4.28Å; V456-F458 HydrophobicContact CG1-CE2 3.83Å; V456-F458 HydrophobicContact CG1-CZ 3.87Å
457	T	95.1	Very high	89.9	Confident	35 Å²	35	41 Å²	41	22%	0.215	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.5	170.5	-57.1	0	0	0	0	109.9	H116 I117 T118 L119 K437	H116-T457 PolarHBondContact CE1-OG1 3.27Å; I117-T457 PolarHBondContact O-N 3.43Å; T118-T457 CarbonylContact C-O 3.57Å; T118-T457 WeakPolarHBondContact CA-O 3.27Å; L119-T457 PolarHBondContact N-O 2.93Å; K437-T457 CarbonylContact O-C 3.21Å; K437-T457 VanDerWaalsContact O-CA 3.24Å; K437-T457 WeakPolarHBondContact O-CA 3.3Å
458	F	91.2	Very high	90.4	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	110.8	178.4	-61.3	-93.1	0	0	0	109.5	L119 E392 L393 A430 P434 K437 V456	L119-F458 WeakPolarHBondContact O-CA 3.31Å; E392-F458 HydrophobicContact CB-CE1 4.42Å; E392-F458 HydrophobicContact CB-CZ 4.46Å; L393-F458 HydrophobicContact CD1-CE1 4.47Å; L393-F458 HydrophobicContact CD1-CZ 4.43Å; A430-F458 HydrophobicContact CB-CD1 4.03Å; A430-F458 HydrophobicContact CB-CE1 3.91Å; P434-F458 VanDerWaalsContact CD-CG 3.4Å; P434-F458 HydrophobicContact CG-CB 3.98Å; P434-F458 HydrophobicContact CG-CD1 4.03Å; P434-F458 HydrophobicContact CG-CD2 3.27Å; P434-F458 HydrophobicContact CG-CE1 4.33Å; P434-F458 HydrophobicContact CG-CE2 3.64Å; P434-F458 HydrophobicContact CG-CG 3.49Å; P434-F458 VanDerWaalsContact CG-CG 3.49Å; P434-F458 HydrophobicContact CG-CZ 4.15Å; K437-F458 WeakPolarHBondContact O-CD2 3.23Å; K437-F458 PolarHBondContact O-N 3.13Å; V456-F458 HydrophobicContact CB-CE2 4.3Å; V456-F458 HydrophobicContact CG1-CD2 4.23Å; V456-F458 HydrophobicContact CG1-CE1 4.28Å; V456-F458 HydrophobicContact CG1-CE2 3.83Å; V456-F458 HydrophobicContact CG1-CZ 3.87Å
459	E	88.9	Confident	90.9	Very high	56 Å²	56	45.7 Å²	45.7	26%	0.262	24%	0.24	S	C	.	.			trans	-99.9	87.3	-179.4	-168.8	172.6	-160.8	0	0	109.4	P84 T118 L119 P121	P84-E459 HydrophobicContact CB-CG 4.38Å; T118-E459 HydrophobicContact CG2-CB 3.97Å; L119-E459 PolarHBondContact O-N 3.32Å; P121-E459 WeakPolarHBondContact CD-O 3.41Å
460	C	83.4	Confident	91.3	Very high	4 Å²	4	45.6 Å²	45.6	3%	0.027	25%	0.249	C	C	.	.			trans	-109.2	-20.9	-174.1	-34.5	0	0	0	0	114.2	P121 C433	P121-C460 HydrophobicContact CG-CB 3.92Å; C433-C460 HydrophobicContact CB-CB 3.58Å; C433-C460 WeakPolarHBondContact CB-SG 3.36Å; C433-C460 WeakPolarHBondContact SG-CB 3.5Å; C433-C460 CovalentContact SG-SG 2Å; C433-C460 PolarHBondContact SG-SG 2.89Å
461	D	86.8	Confident	91.4	Very high	49 Å²	49	49.1 Å²	49.1	26%	0.262	27%	0.267	S	S	.	.	S	Bend	trans	-91.2	144.2	-179	-63.4	-29.3	0	0	0	109	K38 K437 Q465	K38-D461 WeakPolarHBondContact CE-OD1 3.42Å; K38-D461 IonicContact NZ-OD1 2.77Å; K38-D461 PolarHBondContact NZ-OD1 3Å; K437-D461 WeakPolarHBondContact CE-OD2 3.24Å; K437-D461 IonicContact NZ-OD2 4Å; K437-D461 PolarHBondContact NZ-OD2 3.35Å; D461-Q465 VanDerWaalsContact CA-OE1 3.24Å; D461-Q465 VanDerWaalsContact CB-OE1 3.26Å
462	C	88.3	Confident	91.4	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.034	26%	0.255	C	S	.	.			trans	-79.1	145.7	175	-52.5	0	0	0	0	110.2	C37 L41 E82 C464 Q465	C37-C462 HydrophobicContact CB-CB 3.96Å; C37-C462 WeakPolarHBondContact CB-SG 3.46Å; C37-C462 WeakPolarHBondContact SG-CB 3.48Å; C37-C462 CovalentContact SG-SG 2.02Å; C37-C462 PolarHBondContact SG-SG 2.83Å; L41-C462 HydrophobicContact CD1-CB 4.49Å; L41-C462 WeakPolarHBondContact CD1-SG 3.42Å; E82-C462 HydrophobicContact CB-CB 4.5Å; E82-C462 HydrophobicContact CG-CB 4.08Å; C462-C464 VanDerWaalsContact CB-SG 3.51Å; C462-C464 PolarHBondContact O-N 2.82Å; C462-Q465 HydrophobicContact CB-CG 3.95Å; C462-Q465 WeakPolarHBondContact O-CB 3.29Å; C462-Q465 WeakPolarHBondContact O-CG 3.48Å; C462-Q465 PolarHBondContact O-N 2.9Å
463	K	89.9	Confident	91.1	Very high	137 Å²	137	51.1 Å²	51.1	60%	0.596	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-65.5	-32.9	-178.8	-61	176	-179.8	176.2	0	111.3	E82 Q465 S466	E82-K463 WeakPolarHBondContact OE1-CA 3.49Å; E82-K463 VanDerWaalsContact OE1-CB 3.3Å; E82-K463 WeakPolarHBondContact OE1-CB 3.34Å; E82-K463 PolarHBondContact OE1-N 3.22Å; E82-K463 VanDerWaalsContact OE1-N 3.1Å; E82-K463 PolarHBondContact OE2-N 3.34Å; K463-Q465 PolarHBondContact O-N 2.88Å; K463-S466 WeakPolarHBondContact O-CB 3.34Å; K463-S466 PolarHBondContact O-N 2.88Å; K463-S466 PolarHBondContact O-OG 2.95Å
464	C	89.1	Confident	90.6	Very high	8 Å²	8	53.8 Å²	53.8	5%	0.054	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-58.5	-23.4	173.4	58.7	0	0	0	0	114.2	F51 E82 C462 S466 K467 C484	F51-C464 HydrophobicContact CD1-CB 4.23Å; F51-C464 HydrophobicContact CD2-CB 4.43Å; F51-C464 HydrophobicContact CG-CB 4.17Å; E82-C464 HydrophobicContact CG-CB 4.42Å; E82-C464 PolarHBondContact OE1-N 2.88Å; C462-C464 VanDerWaalsContact CB-SG 3.51Å; C462-C464 PolarHBondContact O-N 2.82Å; C464-S466 PolarHBondContact O-N 2.92Å; C464-K467 PolarHBondContact O-N 2.66Å; C464-K467 VanDerWaalsContact O-N 3.1Å; C464-C484 HydrophobicContact CB-CB 3.95Å; C464-C484 WeakPolarHBondContact CB-SG 3.42Å; C464-C484 WeakPolarHBondContact SG-CB 3.39Å; C464-C484 CovalentContact SG-SG 2.03Å; C464-C484 PolarHBondContact SG-SG 2.86Å
465	Q	88.9	Confident	90.2	Very high	42 Å²	42	53.8 Å²	53.8	20%	0.196	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-67.4	-28.2	178.6	-55.2	-172.6	-79	0	0	111.9	D461 C462 K463 K467 A468 E483 C484	D461-Q465 VanDerWaalsContact CA-OE1 3.24Å; D461-Q465 VanDerWaalsContact CB-OE1 3.26Å; C462-Q465 HydrophobicContact CB-CG 3.95Å; C462-Q465 WeakPolarHBondContact O-CB 3.29Å; C462-Q465 WeakPolarHBondContact O-CG 3.48Å; C462-Q465 PolarHBondContact O-N 2.9Å; K463-Q465 PolarHBondContact O-N 2.88Å; Q465-K467 PolarHBondContact O-N 3.08Å; Q465-K467 VanDerWaalsContact O-N 3.16Å; Q465-A468 VanDerWaalsContact O-CB 3.26Å; Q465-A468 WeakPolarHBondContact O-CB 3.33Å; Q465-A468 PolarHBondContact O-N 3.42Å; Q465-A468 VanDerWaalsContact O-N 3.09Å; Q465-E483 HydrophobicContact CB-CG 4.47Å; Q465-E483 HydrophobicContact CG-CG 4.28Å; Q465-E483 VanDerWaalsContact CG-OE1 3.24Å; Q465-E483 WeakPolarHBondContact CG-OE1 3.22Å; Q465-E483 PolarHBondContact NE2-OE1 2.98Å; Q465-C484 PolarHBondContact N-SG 2.92Å; Q465-C484 VanDerWaalsContact N-SG 3.4Å
466	S	87.9	Confident	89.7	Confident	105 Å²	105	54 Å²	54	73%	0.734	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-64.3	-17.4	175.1	66.9	0	0	0	0	113.5	K463 C464	K463-S466 WeakPolarHBondContact O-CB 3.34Å; K463-S466 PolarHBondContact O-N 2.88Å; K463-S466 PolarHBondContact O-OG 2.95Å; C464-S466 PolarHBondContact O-N 2.92Å
467	K	88.9	Confident	89.3	Confident	171 Å²	171	61.2 Å²	61.2	74%	0.743	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-102.8	13.5	177.9	-57.5	-179	-178.1	178.2	0	112.4	C464 Q465 Q469	C464-K467 PolarHBondContact O-N 2.66Å; C464-K467 VanDerWaalsContact O-N 3.1Å; Q465-K467 PolarHBondContact O-N 3.08Å; Q465-K467 VanDerWaalsContact O-N 3.16Å; K467-Q469 PolarHBondContact O-N 3.03Å
468	A	89.9	Confident	89	Confident	34 Å²	34	60.3 Å²	60.3	28%	0.281	33%	0.327	S	S	.	.			trans	-59	137.3	178.3	0	0	0	0	0	110.6	Q465 P470 T481 Y482 E483	Q465-A468 VanDerWaalsContact O-CB 3.26Å; Q465-A468 WeakPolarHBondContact O-CB 3.33Å; Q465-A468 PolarHBondContact O-N 3.42Å; Q465-A468 VanDerWaalsContact O-N 3.09Å; A468-P470 WeakPolarHBondContact O-CD 3.26Å; A468-T481 HydrophobicContact CB-CG2 4.32Å; A468-Y482 CarbonylContact C-O 3.51Å; A468-Y482 WeakPolarHBondContact CA-O 3.25Å; A468-E483 HydrophobicContact CB-CB 4.1Å; A468-E483 HydrophobicContact CB-CG 4.06Å
469	Q	92.6	Very high	88.8	Confident	91 Å²	91	62.2 Å²	62.2	43%	0.425	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-113.5	101.9	177.6	-173.4	-176.9	8.9	0	0	109.3	K467 S472 T481 Y482	K467-Q469 PolarHBondContact O-N 3.03Å; Q469-S472 PolarHBondContact OE1-OG 3.36Å; Q469-S472 VanDerWaalsContact OE1-OG 3.08Å; Q469-T481 WeakPolarHBondContact O-CA 3.28Å; Q469-Y482 PolarHBondContact N-O 3.31Å; Q469-Y482 PolarHBondContact O-N 3.47Å
470	P	92	Very high	88.9	Confident	90 Å²	90	59.6 Å²	59.6	58%	0.584	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	144.2	171.6	-20.8	32.6	0	0	0	110.8	A468 S472	A468-P470 WeakPolarHBondContact O-CD 3.26Å; P470-S472 VanDerWaalsContact C-N 3.27Å; P470-S472 PolarHBondContact O-N 3.08Å
471	N	90.8	Very high	89.3	Confident	98 Å²	98	60.9 Å²	60.9	52%	0.524	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	47.6	-179.2	-56.5	-31.7	0	0	0	112.3	G478 G480 H490	N471-G478 PolarHBondContact OD1-O 3.48Å; N471-G480 CarbonylContact C-O 3.44Å; N471-G480 VanDerWaalsContact CA-O 3.24Å; N471-G480 WeakPolarHBondContact CA-O 3.44Å; N471-G480 PolarHBondContact N-O 3.02Å; N471-H490 PolarHBondContact OD1-CE1 3.23Å; N471-H490 PolarHBondContact OD1-NE2 3.11Å
472	S	91.4	Very high	89.5	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.327	C	S	.	.			trans	-67.9	139.5	-175	-175.5	0	0	0	0	111	Q469 P470 K474 C475 G478 G480 Y482	Q469-S472 PolarHBondContact OE1-OG 3.36Å; Q469-S472 VanDerWaalsContact OE1-OG 3.08Å; P470-S472 VanDerWaalsContact C-N 3.27Å; P470-S472 PolarHBondContact O-N 3.08Å; S472-K474 PolarHBondContact O-N 3.44Å; S472-K474 PolarHBondContact OG-N 3.11Å; S472-C475 PolarHBondContact O-N 3.28Å; S472-G478 PolarHBondContact O-N 3.26Å; S472-G478 VanDerWaalsContact O-N 3.16Å; S472-G480 PolarHBondContact N-O 2.85Å; S472-Y482 VanDerWaalsContact CB-CB 3.41Å
473	P	90.4	Very high	89.6	Confident	80 Å²	80	61.3 Å²	61.3	52%	0.519	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-30	170.3	-25.1	34.2	0	0	0	113.1	C475 N477	P473-C475 PolarHBondContact O-N 3.35Å; P473-N477 PolarHBondContact O-N 2.9Å
474	K	86.7	Confident	89.6	Confident	94 Å²	94	55.1 Å²	55.1	41%	0.409	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-24.2	178.7	-62.1	-168.4	179.5	-165.3	0	113.2	E53 S472 S476 Y482	E53-K474 IonicContact OE1-NZ 2.71Å; E53-K474 PolarHBondContact OE1-NZ 3.12Å; E53-K474 IonicContact OE2-NZ 3.87Å; E53-K474 PolarHBondContact OE2-NZ 3.27Å; S472-K474 PolarHBondContact O-N 3.44Å; S472-K474 PolarHBondContact OG-N 3.11Å; K474-S476 PolarHBondContact O-N 3.44Å; K474-Y482 HydrophobicContact CB-CD2 4.27Å; K474-Y482 HydrophobicContact CD-CD1 4.42Å; K474-Y482 HydrophobicContact CD-CD2 4.37Å; K474-Y482 HydrophobicContact CD-CE1 4.26Å; K474-Y482 HydrophobicContact CD-CE2 4.21Å; K474-Y482 HydrophobicContact CD-CG 4.46Å
475	C	88.7	Confident	89.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	61.7	179.5	-53.7	0	0	0	0	109.6	S472 P473 N477 G478 N479 C487 Y497 C498	S472-C475 PolarHBondContact O-N 3.28Å; P473-C475 PolarHBondContact O-N 3.35Å; C475-N477 PolarHBondContact O-N 2.83Å; C475-G478 PolarHBondContact O-N 2.91Å; C475-N479 WeakPolarHBondContact O-CB 3.38Å; C475-N479 PolarHBondContact O-N 3.24Å; C475-C487 WeakPolarHBondContact CA-SG 3.35Å; C475-C487 HydrophobicContact CB-CB 3.78Å; C475-C487 WeakPolarHBondContact CB-SG 3.42Å; C475-C487 VanDerWaalsContact SG-CA 3.57Å; C475-C487 WeakPolarHBondContact SG-CB 3.26Å; C475-C487 CovalentContact SG-SG 2.04Å; C475-C487 PolarHBondContact SG-SG 3.04Å; C475-Y497 CarbonylContact C-O 3.59Å; C475-Y497 WeakPolarHBondContact CA-O 3.42Å; C475-C498 HydrophobicContact CB-CB 4.5Å
476	S	87.5	Confident	89.3	Confident	34 Å²	34	55.3 Å²	55.3	24%	0.238	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	53.6	-179.3	-62.3	0	0	0	0	113.9	K474 G478 N479 Y497 C498 E499	K474-S476 PolarHBondContact O-N 3.44Å; S476-G478 VanDerWaalsContact C-N 3.35Å; S476-G478 PolarHBondContact O-N 3.23Å; S476-N479 PolarHBondContact O-ND2 2.96Å; S476-Y497 WeakPolarHBondContact CB-O 3.47Å; S476-Y497 PolarHBondContact N-O 3.01Å; S476-Y497 VanDerWaalsContact N-O 3.09Å; S476-Y497 PolarHBondContact OG-O 2.79Å; S476-C498 WeakPolarHBondContact CB-O 3.44Å; S476-C498 PolarHBondContact OG-O 2.89Å; S476-E499 VanDerWaalsContact OG-CA 3.28Å; S476-E499 WeakPolarHBondContact OG-CA 3.3Å; S476-E499 PolarHBondContact OG-N 2.84Å
477	N	86.6	Confident	89.3	Confident	150 Å²	150	50.9 Å²	50.9	80%	0.802	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	37.5	176.4	-61.3	-50.4	0	0	0	114.8	P473 C475	P473-N477 PolarHBondContact O-N 2.9Å; C475-N477 PolarHBondContact O-N 2.83Å
478	G	87.9	Confident	89.2	Confident	17 Å²	17	45.4 Å²	45.4	18%	0.175	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	112.1	7.3	172.2	0	0	0	0	0	115.9	N471 S472 C475 S476 G480 H490	N471-G478 PolarHBondContact OD1-O 3.48Å; S472-G478 PolarHBondContact O-N 3.26Å; S472-G478 VanDerWaalsContact O-N 3.16Å; C475-G478 PolarHBondContact O-N 2.91Å; S476-G478 VanDerWaalsContact C-N 3.35Å; S476-G478 PolarHBondContact O-N 3.23Å; G478-G480 PolarHBondContact O-N 3.47Å; G478-H490 PolarHBondContact O-CD2 2.9Å; G478-H490 PolarHBondContact O-NE2 3.26Å
479	N	89.1	Confident	89	Confident	42 Å²	42	45.8 Å²	45.8	23%	0.225	26%	0.256	C	S	.	.	S	Bend	trans	-80.3	7.3	-179.9	-69.4	-26.1	0	0	0	114.2	C475 S476 H490 R493 C498	C475-N479 WeakPolarHBondContact O-CB 3.38Å; C475-N479 PolarHBondContact O-N 3.24Å; S476-N479 PolarHBondContact O-ND2 2.96Å; N479-H490 PolarHBondContact O-CD2 2.81Å; N479-H490 PolarHBondContact O-N 3.19Å; N479-R493 HydrophobicContact CB-CG 4.11Å; N479-R493 PolarHBondContact ND2-NE 3.22Å; N479-R493 PolarHBondContact ND2-NH1 3.23Å; N479-R493 PolarHBondContact ND2-NH2 3.38Å; N479-C498 HydrophobicContact CB-CB 3.97Å
480	G	90	Very high	88.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	175.7	177.1	0	0	0	0	0	113.7	N471 S472 G478 L488	N471-G480 CarbonylContact C-O 3.44Å; N471-G480 VanDerWaalsContact CA-O 3.24Å; N471-G480 WeakPolarHBondContact CA-O 3.44Å; N471-G480 PolarHBondContact N-O 3.02Å; S472-G480 PolarHBondContact N-O 2.85Å; G478-G480 PolarHBondContact O-N 3.47Å; G480-L488 CarbonylContact C-O 2.86Å; G480-L488 VanDerWaalsContact CA-O 3.23Å; G480-L488 WeakPolarHBondContact CA-O 3.33Å
481	T	92	Very high	88.3	Confident	32 Å²	32	46.8 Å²	46.8	20%	0.196	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.5	175.3	-60.9	0	0	0	0	109.5	A468 Q469 L488	A468-T481 HydrophobicContact CB-CG2 4.32Å; Q469-T481 WeakPolarHBondContact O-CA 3.28Å; T481-L488 PolarHBondContact N-O 3.42Å; T481-L488 PolarHBondContact O-N 3.38Å
482	Y	90.8	Very high	87.7	Confident	31 Å²	31	43.4 Å²	43.4	12%	0.122	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.1	173.9	-173.2	-104.3	0	0	0	109.8	E53 A468 Q469 S472 K474 G485 M486	E53-Y482 WeakPolarHBondContact CG-OH 3.4Å; E53-Y482 PolarHBondContact OE1-OH 2.75Å; A468-Y482 CarbonylContact C-O 3.51Å; A468-Y482 WeakPolarHBondContact CA-O 3.25Å; Q469-Y482 PolarHBondContact N-O 3.31Å; Q469-Y482 PolarHBondContact O-N 3.47Å; S472-Y482 VanDerWaalsContact CB-CB 3.41Å; K474-Y482 HydrophobicContact CB-CD2 4.27Å; K474-Y482 HydrophobicContact CD-CD1 4.42Å; K474-Y482 HydrophobicContact CD-CD2 4.37Å; K474-Y482 HydrophobicContact CD-CE1 4.26Å; K474-Y482 HydrophobicContact CD-CE2 4.21Å; K474-Y482 HydrophobicContact CD-CG 4.46Å; Y482-G485 WeakPolarHBondContact OH-CA 3.27Å; Y482-M486 WeakPolarHBondContact CA-O 3.32Å; Y482-M486 WeakPolarHBondContact CD2-O 2.96Å
483	E	90.9	Very high	87.2	Confident	31 Å²	31	47.3 Å²	47.3	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	131.3	-175.9	-177.2	-178.7	136.3	0	0	110	Q465 A468 G485 M486 L488	Q465-E483 HydrophobicContact CB-CG 4.47Å; Q465-E483 HydrophobicContact CG-CG 4.28Å; Q465-E483 VanDerWaalsContact CG-OE1 3.24Å; Q465-E483 WeakPolarHBondContact CG-OE1 3.22Å; Q465-E483 PolarHBondContact NE2-OE1 2.98Å; A468-E483 HydrophobicContact CB-CB 4.1Å; A468-E483 HydrophobicContact CB-CG 4.06Å; E483-G485 VanDerWaalsContact C-N 3.26Å; E483-G485 PolarHBondContact O-N 3.27Å; E483-G485 VanDerWaalsContact O-N 3.09Å; E483-M486 PolarHBondContact N-O 2.83Å; E483-M486 WeakPolarHBondContact O-CG 3.11Å; E483-M486 PolarHBondContact O-N 2.93Å; E483-M486 VanDerWaalsContact O-O 3.07Å; E483-L488 HydrophobicContact CB-CD1 4.11Å
484	C	89	Confident	86.4	Confident	8 Å²	8	45.3 Å²	45.3	5%	0.054	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	40.9	171.4	-63.9	0	0	0	0	115.2	C37 W49 F51 C464 Q465	C37-C484 HydrophobicContact CB-CB 3.96Å; W49-C484 PolarHBondContact NE1-O 2.58Å; F51-C484 WeakPolarHBondContact CA-O 3.27Å; F51-C484 HydrophobicContact CB-CB 4.24Å; F51-C484 WeakPolarHBondContact CB-O 3.08Å; C464-C484 HydrophobicContact CB-CB 3.95Å; C464-C484 WeakPolarHBondContact CB-SG 3.42Å; C464-C484 WeakPolarHBondContact SG-CB 3.39Å; C464-C484 CovalentContact SG-SG 2.03Å; C464-C484 PolarHBondContact SG-SG 2.86Å; Q465-C484 PolarHBondContact N-SG 2.92Å; Q465-C484 VanDerWaalsContact N-SG 3.4Å
485	G	86.2	Confident	85.7	Confident	9 Å²	9	41.2 Å²	41.2	9%	0.093	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	8.2	175.2	0	0	0	0	0	114.9	F51 R64 Y482 E483	F51-G485 VanDerWaalsContact O-CA 3.3Å; F51-G485 WeakPolarHBondContact O-CA 3.41Å; R64-G485 PolarHBondContact NH2-O 3.28Å; Y482-G485 WeakPolarHBondContact OH-CA 3.27Å; E483-G485 VanDerWaalsContact C-N 3.26Å; E483-G485 PolarHBondContact O-N 3.27Å; E483-G485 VanDerWaalsContact O-N 3.09Å
486	M	86.4	Confident	85	Confident	45 Å²	45	45 Å²	45	22%	0.222	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	163.1	-178.8	62.2	176.2	-59.8	0	0	112.5	S35 W49 Y482 E483 L488	S35-M486 WeakPolarHBondContact O-CE 3.41Å; W49-M486 HydrophobicContact CH2-SD 3.74Å; W49-M486 HydrophobicContact CZ2-CG 4.31Å; W49-M486 HydrophobicContact CZ2-SD 3.63Å; Y482-M486 WeakPolarHBondContact CA-O 3.32Å; Y482-M486 WeakPolarHBondContact CD2-O 2.96Å; E483-M486 PolarHBondContact N-O 2.83Å; E483-M486 WeakPolarHBondContact O-CG 3.11Å; E483-M486 PolarHBondContact O-N 2.93Å; E483-M486 VanDerWaalsContact O-O 3.07Å; M486-L488 HydrophobicContact CE-CD2 4.1Å
487	C	86.7	Confident	84.8	Confident	11 Å²	11	48 Å²	48	7%	0.074	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.9	173.3	-72.8	0	0	0	0	111.6	C475 P496	C475-C487 WeakPolarHBondContact CA-SG 3.35Å; C475-C487 HydrophobicContact CB-CB 3.78Å; C475-C487 WeakPolarHBondContact CB-SG 3.42Å; C475-C487 VanDerWaalsContact SG-CA 3.57Å; C475-C487 WeakPolarHBondContact SG-CB 3.26Å; C475-C487 CovalentContact SG-SG 2.04Å; C475-C487 PolarHBondContact SG-SG 3.04Å; C487-P496 WeakPolarHBondContact CB-O 3.09Å
488	L	87.4	Confident	84.6	Confident	56 Å²	56	40.9 Å²	40.9	29%	0.293	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	101.2	166.4	-59.2	177.1	0	0	0	107.9	T36 G480 T481 E483 M486	T36-L488 HydrophobicContact CG2-CD2 3.87Å; G480-L488 CarbonylContact C-O 2.86Å; G480-L488 VanDerWaalsContact CA-O 3.23Å; G480-L488 WeakPolarHBondContact CA-O 3.33Å; T481-L488 PolarHBondContact N-O 3.42Å; T481-L488 PolarHBondContact O-N 3.38Å; E483-L488 HydrophobicContact CB-CD1 4.11Å; M486-L488 HydrophobicContact CE-CD2 4.1Å
489	C	85.8	Confident	84.3	Confident	42 Å²	42	44.2 Å²	44.2	28%	0.284	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	146.2	-173	-55.3	0	0	0	0	112.9	R493 C498	C489-R493 HydrophobicContact CB-CB 3.95Å; C489-R493 WeakPolarHBondContact CB-O 3.17Å; C489-C498 WeakPolarHBondContact CA-SG 3.2Å; C489-C498 HydrophobicContact CB-CB 3.77Å; C489-C498 WeakPolarHBondContact CB-SG 3.23Å; C489-C498 WeakPolarHBondContact SG-CA 3.36Å; C489-C498 WeakPolarHBondContact SG-CB 3.49Å; C489-C498 CovalentContact SG-SG 2.04Å; C489-C498 PolarHBondContact SG-SG 2.85Å
490	H	87.9	Confident	83.6	Confident	69 Å²	69	42.6 Å²	42.6	32%	0.319	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-64.3	157.7	170.3	-68.6	-43.3	0	0	0	110.7	N471 G478 N479 G492 R493	N471-H490 PolarHBondContact OD1-CE1 3.23Å; N471-H490 PolarHBondContact OD1-NE2 3.11Å; G478-H490 PolarHBondContact O-CD2 2.9Å; G478-H490 PolarHBondContact O-NE2 3.26Å; N479-H490 PolarHBondContact O-CD2 2.81Å; N479-H490 PolarHBondContact O-N 3.19Å; H490-G492 PolarHBondContact O-N 2.9Å; H490-R493 PolarHBondContact O-N 2.99Å
491	P	82.8	Confident	83	Confident	134 Å²	134	44.1 Å²	44.1	87%	0.87	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	131.6	175.3	-26.9	35.1	0	0	0	111.8
492	G	76.7	Confident	81.7	Confident	27 Å²	27	48.8 Å²	48.8	28%	0.278	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	6.7	-177.9	0	0	0	0	0	115.9	H490 E502	H490-G492 PolarHBondContact O-N 2.9Å; G492-E502 VanDerWaalsContact CA-OE2 3.3Å; G492-E502 WeakPolarHBondContact CA-OE2 3.47Å; G492-E502 PolarHBondContact O-N 3.47Å
493	R	82.3	Confident	80.3	Confident	81 Å²	81	50.4 Å²	50.4	31%	0.306	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.9	173.4	-68.9	-72.7	-165.8	165.6	-1.6	111.1	N479 C489 H490 C498 C500	N479-R493 HydrophobicContact CB-CG 4.11Å; N479-R493 PolarHBondContact ND2-NE 3.22Å; N479-R493 PolarHBondContact ND2-NH1 3.23Å; N479-R493 PolarHBondContact ND2-NH2 3.38Å; C489-R493 HydrophobicContact CB-CB 3.95Å; C489-R493 WeakPolarHBondContact CB-O 3.17Å; H490-R493 PolarHBondContact O-N 2.99Å; R493-C498 HydrophobicContact CB-CB 4.22Å; R493-C500 VanDerWaalsContact CA-O 3.3Å; R493-C500 WeakPolarHBondContact CA-O 3.49Å; R493-C500 VanDerWaalsContact CD-O 3.27Å; R493-C500 WeakPolarHBondContact CD-O 3.35Å
494	L	73.4	Confident	79	Confident	38 Å²	38	53.5 Å²	53.5	20%	0.199	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	167.5	-174.7	-60.8	168.7	0	0	0	111	C498 E499 C500 V531 V536	L494-C498 CarbonylContact O-C 3.43Å; L494-C498 WeakPolarHBondContact O-CA 3.29Å; L494-E499 PolarHBondContact O-N 3.01Å; L494-C500 PolarHBondContact N-O 2.6Å; L494-C500 PolarHBondContact O-N 3Å; L494-C500 VanDerWaalsContact O-N 3.12Å; L494-V531 HydrophobicContact CD1-CB 3.81Å; L494-V531 HydrophobicContact CD1-CG1 3.78Å; L494-V536 HydrophobicContact CD1-CG2 3.51Å; L494-V536 HydrophobicContact CD2-CG2 4.32Å
495	G	71.9	Confident	77.3	Confident	9 Å²	9	60.2 Å²	60.2	9%	0.093	33%	0.334	C	S	.	.	S	Bend	trans	99.7	162	-178.4	0	0	0	0	0	113.9	Y497 C498	G495-Y497 PolarHBondContact O-N 2.86Å; G495-Y497 VanDerWaalsContact O-N 3.15Å; G495-C498 PolarHBondContact O-N 2.86Å
496	P	73.6	Confident	76.1	Confident	79 Å²	79	63.7 Å²	63.7	51%	0.513	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.8	-178.5	24.7	-34.8	0	0	0	114.2	C487 E499	C487-P496 WeakPolarHBondContact CB-O 3.09Å; P496-E499 WeakPolarHBondContact CD-OE1 3.41Å
497	Y	82.6	Confident	74.7	Confident	98 Å²	98	65.5 Å²	65.5	38%	0.384	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	15.3	179.2	-59.9	-76.9	0	0	0	113	H57 C475 S476 G495 E499	H57-Y497 PolarHBondContact NE2-OH 2.86Å; C475-Y497 CarbonylContact C-O 3.59Å; C475-Y497 WeakPolarHBondContact CA-O 3.42Å; S476-Y497 WeakPolarHBondContact CB-O 3.47Å; S476-Y497 PolarHBondContact N-O 3.01Å; S476-Y497 VanDerWaalsContact N-O 3.09Å; S476-Y497 PolarHBondContact OG-O 2.79Å; G495-Y497 PolarHBondContact O-N 2.86Å; G495-Y497 VanDerWaalsContact O-N 3.15Å; Y497-E499 VanDerWaalsContact C-N 3.26Å; Y497-E499 VanDerWaalsContact CA-OE2 3.23Å; Y497-E499 WeakPolarHBondContact CA-OE2 2.98Å; Y497-E499 WeakPolarHBondContact CB-OE2 3.49Å; Y497-E499 PolarHBondContact N-OE2 2.87Å; Y497-E499 PolarHBondContact O-N 2.9Å
498	C	84.1	Confident	73.2	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	40%	0.401	C	S	.	.	S	Bend	trans	59.8	33.1	-178.1	-45.7	0	0	0	0	114.2	C475 S476 N479 C489 R493 L494 G495	C475-C498 HydrophobicContact CB-CB 4.5Å; S476-C498 WeakPolarHBondContact CB-O 3.44Å; S476-C498 PolarHBondContact OG-O 2.89Å; N479-C498 HydrophobicContact CB-CB 3.97Å; C489-C498 WeakPolarHBondContact CA-SG 3.2Å; C489-C498 HydrophobicContact CB-CB 3.77Å; C489-C498 WeakPolarHBondContact CB-SG 3.23Å; C489-C498 WeakPolarHBondContact SG-CA 3.36Å; C489-C498 WeakPolarHBondContact SG-CB 3.49Å; C489-C498 CovalentContact SG-SG 2.04Å; C489-C498 PolarHBondContact SG-SG 2.85Å; R493-C498 HydrophobicContact CB-CB 4.22Å; L494-C498 CarbonylContact O-C 3.43Å; L494-C498 WeakPolarHBondContact O-CA 3.29Å; G495-C498 PolarHBondContact O-N 2.86Å
499	E	80.5	Confident	71.9	Confident	86 Å²	86	72.4 Å²	72.4	40%	0.402	40%	0.398	S	S	.	.			trans	-76.6	-28.3	-174.3	61.4	-89.9	-138.9	0	0	113.1	S476 L494 P496 Y497	S476-E499 VanDerWaalsContact OG-CA 3.28Å; S476-E499 WeakPolarHBondContact OG-CA 3.3Å; S476-E499 PolarHBondContact OG-N 2.84Å; L494-E499 PolarHBondContact O-N 3.01Å; P496-E499 WeakPolarHBondContact CD-OE1 3.41Å; Y497-E499 VanDerWaalsContact C-N 3.26Å; Y497-E499 VanDerWaalsContact CA-OE2 3.23Å; Y497-E499 WeakPolarHBondContact CA-OE2 2.98Å; Y497-E499 WeakPolarHBondContact CB-OE2 3.49Å; Y497-E499 PolarHBondContact N-OE2 2.87Å; Y497-E499 PolarHBondContact O-N 2.9Å
500	C	75.3	Confident	70.6	Confident	8 Å²	8	74 Å²	74	5%	0.054	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	144.9	-174.3	-27.5	0	0	0	0	112	R493 L494 C532	R493-C500 VanDerWaalsContact CA-O 3.3Å; R493-C500 WeakPolarHBondContact CA-O 3.49Å; R493-C500 VanDerWaalsContact CD-O 3.27Å; R493-C500 WeakPolarHBondContact CD-O 3.35Å; L494-C500 PolarHBondContact N-O 2.6Å; L494-C500 PolarHBondContact O-N 3Å; L494-C500 VanDerWaalsContact O-N 3.12Å; C500-C532 HydrophobicContact CB-CB 3.49Å; C500-C532 VanDerWaalsContact CB-CB 3.49Å; C500-C532 WeakPolarHBondContact CB-SG 3.24Å; C500-C532 WeakPolarHBondContact SG-CB 3.27Å; C500-C532 CovalentContact SG-SG 2.03Å; C500-C532 PolarHBondContact SG-SG 3.09Å
501	A	76.8	Confident	69.4	Low	33 Å²	33	77.7 Å²	77.7	27%	0.273	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	151.5	170.1	0	0	0	0	0	111.6	G503 D504	A501-G503 PolarHBondContact O-N 2.85Å; A501-D504 PolarHBondContact N-OD2 3.32Å; A501-D504 PolarHBondContact O-N 3.05Å; A501-D504 VanDerWaalsContact O-N 3.11Å
502	E	63.9	Low	68.5	Low	130 Å²	130	79.7 Å²	79.7	61%	0.607	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	104.7	174.9	-151.6	170	-162.8	0	0	109.7	G492	G492-E502 VanDerWaalsContact CA-OE2 3.3Å; G492-E502 WeakPolarHBondContact CA-OE2 3.47Å; G492-E502 PolarHBondContact O-N 3.47Å
503	G	61.4	Low	68.2	Low	64 Å²	64	78.4 Å²	78.4	66%	0.66	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.6	-11.2	-174.7	0	0	0	0	0	115.5	A501 Y505	A501-G503 PolarHBondContact O-N 2.85Å; G503-Y505 PolarHBondContact O-N 2.86Å
504	D	64.3	Low	67.7	Low	97 Å²	97	76.3 Å²	76.3	52%	0.519	40%	0.398	S	S	.	.			trans	-74.2	86.6	172.6	-74.5	-32.7	0	0	0	110.2	A501	A501-D504 PolarHBondContact N-OD2 3.32Å; A501-D504 PolarHBondContact O-N 3.05Å; A501-D504 VanDerWaalsContact O-N 3.11Å
505	Y	53.5	Low	67.2	Low	148 Å²	148	75.5 Å²	75.5	58%	0.58	40%	0.399	S	S	*	.			trans	-89.1	114.3	179.1	-179.1	-104.4	0	0	0	111.2	G503 P507 Q510	G503-Y505 PolarHBondContact O-N 2.86Å; Y505-P507 HydrophobicContact CD1-CG 4.26Å; Y505-P507 HydrophobicContact CE1-CB 4.36Å; Y505-P507 HydrophobicContact CE1-CG 3.8Å; Y505-Q510 PolarHBondContact OH-OE1 3.3Å
506	N	60.9	Low	66.6	Low	83 Å²	83	80.1 Å²	80.1	44%	0.444	43%	0.427	S	S	.	.			trans	-112.2	113.6	169	-167.9	-2.3	0	0	0	110.6	M508 E509	N506-M508 PolarHBondContact O-N 3.28Å; N506-M508 VanDerWaalsContact O-N 3.08Å; N506-M508 PolarHBondContact OD1-N 3.14Å; N506-E509 HydrophobicContact CB-CG 4.35Å; N506-E509 PolarHBondContact O-N 3.02Å
507	P	56.3	Low	65.3	Low	82 Å²	82	81.9 Å²	81.9	53%	0.532	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-59.1	-22.2	-177.9	-21.4	29	0	0	0	114.7	Y505 E509	Y505-P507 HydrophobicContact CD1-CG 4.26Å; Y505-P507 HydrophobicContact CE1-CB 4.36Å; Y505-P507 HydrophobicContact CE1-CG 3.8Å; P507-E509 VanDerWaalsContact C-N 3.26Å; P507-E509 PolarHBondContact O-N 3.24Å
508	M	56.9	Low	63.8	Low	165 Å²	165	81.3 Å²	81.3	81%	0.813	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-75.7	-9	-178.8	-68.1	-170.4	68	0	0	114.3	N506	N506-M508 PolarHBondContact O-N 3.28Å; N506-M508 VanDerWaalsContact O-N 3.08Å; N506-M508 PolarHBondContact OD1-N 3.14Å
509	E	58.5	Low	62.3	Low	48 Å²	48	84.3 Å²	84.3	22%	0.224	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-100.8	-0.1	-176.6	-59.6	-168.4	148.8	0	0	113.7	N506 P507 D511 R512 C532 G533	N506-E509 HydrophobicContact CB-CG 4.35Å; N506-E509 PolarHBondContact O-N 3.02Å; P507-E509 VanDerWaalsContact C-N 3.26Å; P507-E509 PolarHBondContact O-N 3.24Å; E509-D511 PolarHBondContact O-N 2.95Å; E509-R512 WeakPolarHBondContact O-CB 3.07Å; E509-R512 PolarHBondContact O-N 3.16Å; E509-C532 VanDerWaalsContact OE2-CA 3.24Å; E509-C532 WeakPolarHBondContact OE2-CA 3.44Å; E509-G533 PolarHBondContact OE2-N 3.46Å; E509-G533 VanDerWaalsContact OE2-N 3.14Å
510	Q	58.4	Low	61.3	Low	76 Å²	76	92.6 Å²	92.6	36%	0.355	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-64.7	-25.4	-174.3	-159.4	153.3	-7	0	0	113.5	Y505 R512 C513 S514 V523	Y505-Q510 PolarHBondContact OH-OE1 3.3Å; Q510-R512 VanDerWaalsContact C-N 3.25Å; Q510-R512 PolarHBondContact O-N 3.33Å; Q510-C513 PolarHBondContact O-N 2.86Å; Q510-S514 PolarHBondContact O-OG 2.98Å; Q510-V523 HydrophobicContact CG-CG2 3.89Å
511	D	62.3	Low	60.8	Low	146 Å²	146	93.8 Å²	93.8	78%	0.781	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-66.7	-24.3	174.5	-75.2	-17.3	0	0	0	112.8	E509	E509-D511 PolarHBondContact O-N 2.95Å
512	R	65.4	Low	60.7	Low	175 Å²	175	96.3 Å²	96.3	66%	0.66	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-80.1	-19.5	-179.3	-67.1	-178.3	173.6	177.7	-0	113.9	E509 Q510	E509-R512 WeakPolarHBondContact O-CB 3.07Å; E509-R512 PolarHBondContact O-N 3.16Å; Q510-R512 VanDerWaalsContact C-N 3.25Å; Q510-R512 PolarHBondContact O-N 3.33Å
513	C	70	Confident	61.4	Low	1 Å²	1	92.1 Å²	92.1	1%	0.007	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-101.5	13.5	179.1	-64.9	0	0	0	0	113	Q510 V523 C524 C530 L549	Q510-C513 PolarHBondContact O-N 2.86Å; C513-V523 HydrophobicContact CB-CG1 3.92Å; C513-C524 PolarHBondContact O-N 2.81Å; C513-C530 HydrophobicContact CB-CB 3.41Å; C513-C530 VanDerWaalsContact CB-CB 3.41Å; C513-C530 WeakPolarHBondContact CB-SG 3.48Å; C513-C530 WeakPolarHBondContact SG-CB 3.43Å; C513-C530 CovalentContact SG-SG 2.03Å; C513-C530 PolarHBondContact SG-SG 3.36Å; C513-L549 WeakPolarHBondContact O-CD2 3.41Å
514	S	70.7	Confident	62.2	Low	36 Å²	36	89 Å²	89	25%	0.252	50%	0.5	S	S	.	.	S	Bend	trans	-110.1	155.1	176.1	-58.8	0	0	0	0	109.5	Q510	Q510-S514 PolarHBondContact O-OG 2.98Å
515	G	64.1	Low	63	Low	21 Å²	21	86.8 Å²	86.8	22%	0.216	49%	0.491	C	S	.	.	S	Bend	trans	-59.9	175.1	-179	0	0	0	0	0	114	A517	G515-A517 PolarHBondContact O-N 3.21Å
516	P	58.3	Low	64.4	Low	106 Å²	106	82.3 Å²	82.3	69%	0.688	49%	0.491	S	S	*	.	S	Bend	trans	-48.9	135.8	-177.8	-22.8	30.6	0	0	0	112.1	G518 S519	P516-G518 PolarHBondContact O-N 3.08Å; P516-S519 PolarHBondContact O-N 2.02Å; P516-S519 PolarHBondContact O-OG 3.27Å
517	A	47.1	Very low	65.6	Low	116 Å²	116	82.8 Å²	82.8	96%	0.959	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	109.2	-174.9	0	0	0	0	0	111.1	G515	G515-A517 PolarHBondContact O-N 3.21Å
518	G	51.5	Low	66.7	Low	87 Å²	87	79.2 Å²	79.2	90%	0.897	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	127.7	-18.4	-175.4	0	0	0	0	0	114.6	P516	P516-G518 PolarHBondContact O-N 3.08Å
519	S	52.3	Low	67.8	Low	63 Å²	63	75.8 Å²	75.8	44%	0.441	45%	0.449	S	S	.	.			trans	-103.2	110.9	171.9	50.1	0	0	0	0	110.1	P516 G521	P516-S519 PolarHBondContact O-N 2.02Å; P516-S519 PolarHBondContact O-OG 3.27Å; S519-G521 PolarHBondContact O-N 3.32Å
520	R	58.6	Low	68.6	Low	260 Å²	260	74.4 Å²	74.4	98%	0.981	45%	0.445	S	S	*	.			trans	-70.8	60.9	171	-76.2	-177.1	-174	160.7	1.9	110.4
521	G	65.1	Low	69.2	Low	33 Å²	33	71.7 Å²	71.7	34%	0.34	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-72.6	149.2	169.6	0	0	0	0	0	110.4	S519	S519-G521 PolarHBondContact O-N 3.32Å
522	P	74.9	Confident	69.5	Low	86 Å²	86	66.5 Å²	66.5	56%	0.558	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-60.9	147.3	171	25.8	-32	0	0	0	110.5	C524 S525	P522-C524 PolarHBondContact O-N 3.28Å; P522-S525 PolarHBondContact O-N 3.15Å; P522-S525 VanDerWaalsContact O-N 3.09Å
523	V	78.4	Confident	69.7	Low	41 Å²	41	58.9 Å²	58.9	25%	0.248	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-53.8	129.8	174.9	177.3	0	0	0	0	108.9	Q510 C513 S525 G526 C530	Q510-V523 HydrophobicContact CG-CG2 3.89Å; C513-V523 HydrophobicContact CB-CG1 3.92Å; V523-S525 PolarHBondContact O-N 2.96Å; V523-S525 VanDerWaalsContact O-N 3.15Å; V523-G526 PolarHBondContact O-N 3.26Å; V523-C530 HydrophobicContact CG1-CB 3.52Å
524	C	78.4	Confident	69.6	Low	0 Å²	0	63 Å²	63	0%	0	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	51.1	38.5	-178.6	-53.6	0	0	0	0	113.9	C513 P522 G526 R527 G528 C535 L549	C513-C524 PolarHBondContact O-N 2.81Å; P522-C524 PolarHBondContact O-N 3.28Å; C524-G526 PolarHBondContact O-N 3.04Å; C524-R527 PolarHBondContact O-N 3.09Å; C524-G528 WeakPolarHBondContact CB-O 3.41Å; C524-C535 WeakPolarHBondContact CA-SG 3.42Å; C524-C535 HydrophobicContact CB-CB 3.61Å; C524-C535 WeakPolarHBondContact CB-SG 3.3Å; C524-C535 WeakPolarHBondContact SG-CA 3.44Å; C524-C535 WeakPolarHBondContact SG-CB 3.41Å; C524-C535 CovalentContact SG-SG 2.02Å; C524-C535 PolarHBondContact SG-SG 2.8Å; C524-L549 CarbonylContact C-O 3.53Å; C524-L549 VanDerWaalsContact CA-O 3.31Å; C524-L549 WeakPolarHBondContact CA-O 3.3Å; C524-L549 VanDerWaalsContact O-O 3.06Å
525	S	82.1	Confident	69.9	Low	49 Å²	49	62.2 Å²	62.2	34%	0.343	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	55.8	17.8	-178.5	-50.5	0	0	0	0	114.1	P522 V523 R527 L549	P522-S525 PolarHBondContact O-N 3.15Å; P522-S525 VanDerWaalsContact O-N 3.09Å; V523-S525 PolarHBondContact O-N 2.96Å; V523-S525 VanDerWaalsContact O-N 3.15Å; S525-R527 PolarHBondContact O-N 3.36Å; S525-L549 VanDerWaalsContact CB-O 3.27Å; S525-L549 WeakPolarHBondContact CB-O 3.32Å; S525-L549 PolarHBondContact N-O 2.85Å; S525-L549 PolarHBondContact OG-O 2.86Å
526	G	82.8	Confident	70.4	Confident	55 Å²	55	63.1 Å²	63.1	57%	0.567	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	68.8	13.8	-174.1	0	0	0	0	0	114.5	V523 C524	V523-G526 PolarHBondContact O-N 3.26Å; C524-G526 PolarHBondContact O-N 3.04Å
527	R	84.6	Confident	71.5	Confident	92 Å²	92	59.8 Å²	59.8	35%	0.347	38%	0.377	S	S	.	.	S	Bend	trans	-118.5	18.5	-177.7	-60.8	-176.8	178.2	-164.2	2	112.6	C524 S525 C537 H538 V545 C550 D553	C524-R527 PolarHBondContact O-N 3.09Å; S525-R527 PolarHBondContact O-N 3.36Å; R527-C537 WeakPolarHBondContact O-CA 3.41Å; R527-H538 PolarHBondContact O-N 2.87Å; R527-V545 HydrophobicContact CB-CG1 4.14Å; R527-C550 HydrophobicContact CB-CB 4.1Å; R527-D553 IonicContact CZ-OD2 3.69Å; R527-D553 IonicContact NH1-OD2 3.59Å; R527-D553 PolarHBondContact NH1-OD2 3.16Å; R527-D553 IonicContact NH2-OD2 3.88Å
528	G	81.1	Confident	73.1	Confident	7 Å²	7	58.6 Å²	58.6	7%	0.072	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	172.2	-177.7	0	0	0	0	0	112.6	C524 V536	C524-G528 WeakPolarHBondContact CB-O 3.41Å; G528-V536 CarbonylContact C-O 3.6Å; G528-V536 WeakPolarHBondContact CA-O 3.49Å
529	D	79.7	Confident	74.3	Confident	93 Å²	93	60.3 Å²	60.3	50%	0.497	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	139.1	177.4	-62.5	-56.4	0	0	0	110.1	V531 V536 H538	D529-V531 HydrophobicContact CB-CG2 4.34Å; D529-V531 PolarHBondContact O-N 2.95Å; D529-V536 PolarHBondContact N-O 2.85Å; D529-V536 PolarHBondContact O-N 3.35Å; D529-H538 IonicContact OD1-NE2 3.63Å; D529-H538 IonicContact OD2-CD2 3.97Å; D529-H538 IonicContact OD2-CE1 3.29Å; D529-H538 IonicContact OD2-NE2 2.75Å; D529-H538 PolarHBondContact OD2-NE2 2.98Å
530	C	75.3	Confident	75.6	Confident	19 Å²	19	59.2 Å²	59.2	13%	0.128	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	107.4	174.7	-179	0	0	0	0	109.6	C513 V523 Q534	C513-C530 HydrophobicContact CB-CB 3.41Å; C513-C530 VanDerWaalsContact CB-CB 3.41Å; C513-C530 WeakPolarHBondContact CB-SG 3.48Å; C513-C530 WeakPolarHBondContact SG-CB 3.43Å; C513-C530 CovalentContact SG-SG 2.03Å; C513-C530 PolarHBondContact SG-SG 3.36Å; V523-C530 HydrophobicContact CG1-CB 3.52Å; C530-Q534 CarbonylContact C-O 3.57Å; C530-Q534 WeakPolarHBondContact CA-O 3.46Å
531	V	69.8	Low	76.8	Confident	20 Å²	20	54.9 Å²	54.9	12%	0.121	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.3	179.2	-173.2	0	0	0	0	107.9	L494 D529 G533 Q534 V536	L494-V531 HydrophobicContact CD1-CB 3.81Å; L494-V531 HydrophobicContact CD1-CG1 3.78Å; D529-V531 HydrophobicContact CB-CG2 4.34Å; D529-V531 PolarHBondContact O-N 2.95Å; V531-G533 VanDerWaalsContact C-N 3.35Å; V531-G533 PolarHBondContact O-N 2.73Å; V531-Q534 PolarHBondContact N-O 3.2Å; V531-Q534 PolarHBondContact O-N 3.41Å; V531-Q534 VanDerWaalsContact O-N 3.17Å; V531-V536 HydrophobicContact CB-CG2 4.09Å; V531-V536 HydrophobicContact CG2-CG2 4.06Å
532	C	69.1	Low	77.4	Confident	36 Å²	36	61.3 Å²	61.3	24%	0.243	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	56	40.7	-178.1	-144.7	0	0	0	0	114.9	C500 E509 Q534	C500-C532 HydrophobicContact CB-CB 3.49Å; C500-C532 VanDerWaalsContact CB-CB 3.49Å; C500-C532 WeakPolarHBondContact CB-SG 3.24Å; C500-C532 WeakPolarHBondContact SG-CB 3.27Å; C500-C532 CovalentContact SG-SG 2.03Å; C500-C532 PolarHBondContact SG-SG 3.09Å; E509-C532 VanDerWaalsContact OE2-CA 3.24Å; E509-C532 WeakPolarHBondContact OE2-CA 3.44Å; C532-Q534 PolarHBondContact O-N 3.14Å; C532-Q534 VanDerWaalsContact O-N 3.17Å
533	G	68.9	Low	77.7	Confident	15 Å²	15	58.5 Å²	58.5	16%	0.155	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	13.9	-179.1	0	0	0	0	0	114.9	E509 V531	E509-G533 PolarHBondContact OE2-N 3.46Å; E509-G533 VanDerWaalsContact OE2-N 3.14Å; V531-G533 VanDerWaalsContact C-N 3.35Å; V531-G533 PolarHBondContact O-N 2.73Å
534	Q	69.7	Low	77.8	Confident	87 Å²	87	63.8 Å²	63.8	41%	0.407	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	149.3	173.1	-64.9	-175	-14.5	0	0	110.5	C530 V531 C532	C530-Q534 CarbonylContact C-O 3.57Å; C530-Q534 WeakPolarHBondContact CA-O 3.46Å; V531-Q534 PolarHBondContact N-O 3.2Å; V531-Q534 PolarHBondContact O-N 3.41Å; V531-Q534 VanDerWaalsContact O-N 3.17Å; C532-Q534 PolarHBondContact O-N 3.14Å; C532-Q534 VanDerWaalsContact O-N 3.17Å
535	C	75.4	Confident	77.7	Confident	21 Å²	21	65 Å²	65	14%	0.142	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.2	178.2	-69.9	0	0	0	0	112.2	C524 K548	C524-C535 WeakPolarHBondContact CA-SG 3.42Å; C524-C535 HydrophobicContact CB-CB 3.61Å; C524-C535 WeakPolarHBondContact CB-SG 3.3Å; C524-C535 WeakPolarHBondContact SG-CA 3.44Å; C524-C535 WeakPolarHBondContact SG-CB 3.41Å; C524-C535 CovalentContact SG-SG 2.02Å; C524-C535 PolarHBondContact SG-SG 2.8Å; C535-K548 VanDerWaalsContact CB-O 3.27Å; C535-K548 WeakPolarHBondContact CB-O 3.44Å; C535-K548 PolarHBondContact SG-O 3.02Å
536	V	76.3	Confident	77.2	Confident	40 Å²	40	66.7 Å²	66.7	24%	0.242	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	111.7	169.6	-177.8	0	0	0	0	108	L494 G528 D529 V531	L494-V536 HydrophobicContact CD1-CG2 3.51Å; L494-V536 HydrophobicContact CD2-CG2 4.32Å; G528-V536 CarbonylContact C-O 3.6Å; G528-V536 WeakPolarHBondContact CA-O 3.49Å; D529-V536 PolarHBondContact N-O 2.85Å; D529-V536 PolarHBondContact O-N 3.35Å; V531-V536 HydrophobicContact CB-CG2 4.09Å; V531-V536 HydrophobicContact CG2-CG2 4.06Å
537	C	79.9	Confident	76.6	Confident	35 Å²	35	65.4 Å²	65.4	24%	0.236	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	138.9	-173.9	-48.3	0	0	0	0	111.8	R527 V545 C550	R527-C537 WeakPolarHBondContact O-CA 3.41Å; C537-V545 HydrophobicContact CB-CB 4.14Å; C537-V545 HydrophobicContact CB-CG1 4Å; C537-V545 WeakPolarHBondContact CB-O 3.34Å; C537-C550 WeakPolarHBondContact CA-SG 3Å; C537-C550 HydrophobicContact CB-CB 3.79Å; C537-C550 WeakPolarHBondContact CB-SG 3.05Å; C537-C550 PolarHBondContact N-SG 2.69Å; C537-C550 VanDerWaalsContact N-SG 3.41Å; C537-C550 WeakPolarHBondContact SG-CA 3.44Å; C537-C550 WeakPolarHBondContact SG-CB 3.39Å; C537-C550 CovalentContact SG-SG 2.04Å; C537-C550 PolarHBondContact SG-SG 2.85Å
538	H	82.2	Confident	75.9	Confident	91 Å²	91	69 Å²	69	42%	0.421	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-67.1	143.6	176.2	-61.6	159.7	0	0	0	110.8	R527 D529	R527-H538 PolarHBondContact O-N 2.87Å; D529-H538 IonicContact OD1-NE2 3.63Å; D529-H538 IonicContact OD2-CD2 3.97Å; D529-H538 IonicContact OD2-CE1 3.29Å; D529-H538 IonicContact OD2-NE2 2.75Å; D529-H538 PolarHBondContact OD2-NE2 2.98Å
539	S	76.1	Confident	75.8	Confident	124 Å²	124	70.3 Å²	70.3	87%	0.867	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-67.1	140.5	170.6	51.1	0	0	0	0	110.7
540	S	80.1	Confident	75.8	Confident	40 Å²	40	65.9 Å²	65.9	28%	0.28	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-120.5	143	177.4	-175	0	0	0	0	111	F542 G543	S540-F542 PolarHBondContact O-N 3.32Å; S540-F542 PolarHBondContact OG-N 3.16Å; S540-G543 WeakPolarHBondContact CB-O 2.96Å; S540-G543 PolarHBondContact O-N 3.17Å
541	D	83.7	Confident	76	Confident	169 Å²	169	69.4 Å²	69.4	90%	0.904	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.9	174	-63.4	-34.2	0	0	0	112.5
542	F	77.3	Confident	76.6	Confident	168 Å²	168	69.1 Å²	69.1	74%	0.737	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-14.4	-178	-60.6	-75.9	0	0	0	113.5	S540 F555	S540-F542 PolarHBondContact O-N 3.32Å; S540-F542 PolarHBondContact OG-N 3.16Å; F542-F555 HydrophobicContact CB-CB 4.4Å; F542-F555 HydrophobicContact CB-CD1 4.08Å; F542-F555 HydrophobicContact CB-CD2 4.03Å; F542-F555 HydrophobicContact CB-CE1 4.35Å; F542-F555 HydrophobicContact CB-CE2 4.28Å; F542-F555 HydrophobicContact CB-CG 3.92Å; F542-F555 HydrophobicContact CB-CZ 4.44Å
543	G	81.6	Confident	77.2	Confident	26 Å²	26	67.9 Å²	67.9	27%	0.268	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	153.8	-152.4	-179.1	0	0	0	0	0	113	S540 D554	S540-G543 WeakPolarHBondContact CB-O 2.96Å; S540-G543 PolarHBondContact O-N 3.17Å; G543-D554 WeakPolarHBondContact CA-OD1 3.44Å
544	K	78.9	Confident	77.8	Confident	152 Å²	152	69.6 Å²	69.6	66%	0.661	37%	0.367	S	S	*	.			trans	-102.1	141.6	-175.5	-65.5	179.2	-177.6	176.9	0	111.1	W546 D553 D554	K544-W546 HydrophobicContact CB-CE3 4.12Å; K544-W546 HydrophobicContact CB-CZ3 4.25Å; K544-W546 VanDerWaalsContact O-CZ3 3.26Å; K544-W546 WeakPolarHBondContact O-CZ3 3.01Å; K544-D553 VanDerWaalsContact O-CA 3.28Å; K544-D553 WeakPolarHBondContact O-CA 3.4Å; K544-D554 PolarHBondContact N-OD1 3.22Å; K544-D554 PolarHBondContact N-OD2 3.11Å; K544-D554 PolarHBondContact O-N 3.29Å
545	V	77.8	Confident	78.7	Confident	26 Å²	26	67 Å²	67	16%	0.158	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.5	169.7	-176.5	0	0	0	0	108	R527 C537 C550 C552 D553 F555	R527-V545 HydrophobicContact CB-CG1 4.14Å; C537-V545 HydrophobicContact CB-CB 4.14Å; C537-V545 HydrophobicContact CB-CG1 4Å; C537-V545 WeakPolarHBondContact CB-O 3.34Å; V545-C550 HydrophobicContact CG1-CB 4.05Å; V545-C552 CarbonylContact C-O 3.57Å; V545-C552 VanDerWaalsContact CA-O 3.32Å; V545-C552 WeakPolarHBondContact CA-O 3.26Å; V545-C552 WeakPolarHBondContact CG1-O 3.37Å; V545-D553 HydrophobicContact CG2-CB 4.41Å; V545-F555 HydrophobicContact CG2-CE1 4.12Å; V545-F555 HydrophobicContact CG2-CZ 4.12Å
546	W	71.9	Confident	79.3	Confident	84 Å²	84	70.4 Å²	70.4	32%	0.318	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	-176.9	-179.6	70.5	93.4	0	0	0	110.9	K544 C550 E551 C552 D553 D554 N572 C573	K544-W546 HydrophobicContact CB-CE3 4.12Å; K544-W546 HydrophobicContact CB-CZ3 4.25Å; K544-W546 VanDerWaalsContact O-CZ3 3.26Å; K544-W546 WeakPolarHBondContact O-CZ3 3.01Å; W546-C550 CarbonylContact O-C 3.57Å; W546-C550 WeakPolarHBondContact O-CA 3.3Å; W546-E551 PolarHBondContact O-N 3.39Å; W546-C552 HydrophobicContact CD2-CB 3.88Å; W546-C552 VanDerWaalsContact CE2-CB 3.5Å; W546-C552 HydrophobicContact CG-CB 4.05Å; W546-C552 HydrophobicContact CZ2-CB 3.96Å; W546-C552 PolarHBondContact N-O 3.32Å; W546-C552 WeakPolarHBondContact O-CA 2.99Å; W546-C552 VanDerWaalsContact O-CB 3.32Å; W546-C552 WeakPolarHBondContact O-CB 3.08Å; W546-C552 PolarHBondContact O-N 3.14Å; W546-C552 VanDerWaalsContact O-O 3.14Å; W546-D553 WeakPolarHBondContact CH2-O 3.04Å; W546-D553 VanDerWaalsContact CZ3-CA 3.46Å; W546-D554 HydrophobicContact CH2-CB 3.67Å; W546-D554 HydrophobicContact CZ3-CB 3.61Å; W546-N572 WeakPolarHBondContact CZ2-OD1 3.3Å; W546-C573 HydrophobicContact CZ2-CB 4.25Å
547	G	68.6	Low	79.9	Confident	29 Å²	29	69 Å²	69	30%	0.299	36%	0.363	S	S	.	.	S	Bend	trans	111.6	163.6	-177.9	0	0	0	0	0	111.6	L549 C550 E551	G547-L549 PolarHBondContact O-N 3Å; G547-C550 PolarHBondContact O-N 2.58Å; G547-E551 VanDerWaalsContact C-OE2 3.27Å; G547-E551 WeakPolarHBondContact CA-OE2 3.49Å
548	K	71.1	Confident	80.4	Confident	166 Å²	166	71.7 Å²	71.7	72%	0.722	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-30.7	-174.9	-178.3	-179.4	175.1	-173.1	0	111.6	C535 E551	C535-K548 VanDerWaalsContact CB-O 3.27Å; C535-K548 WeakPolarHBondContact CB-O 3.44Å; C535-K548 PolarHBondContact SG-O 3.02Å; K548-E551 PolarHBondContact N-OE1 3.36Å; K548-E551 PolarHBondContact N-OE2 2.97Å; K548-E551 VanDerWaalsContact N-OE2 3.15Å
549	L	78.4	Confident	80.8	Confident	35 Å²	35	74.8 Å²	74.8	18%	0.183	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	22.2	179.2	-58.7	178.6	0	0	0	111	C513 C524 S525 G547 E551	C513-L549 WeakPolarHBondContact O-CD2 3.41Å; C524-L549 CarbonylContact C-O 3.53Å; C524-L549 VanDerWaalsContact CA-O 3.31Å; C524-L549 WeakPolarHBondContact CA-O 3.3Å; C524-L549 VanDerWaalsContact O-O 3.06Å; S525-L549 VanDerWaalsContact CB-O 3.27Å; S525-L549 WeakPolarHBondContact CB-O 3.32Å; S525-L549 PolarHBondContact N-O 2.85Å; S525-L549 PolarHBondContact OG-O 2.86Å; G547-L549 PolarHBondContact O-N 3Å; L549-E551 VanDerWaalsContact CA-OE2 3.23Å; L549-E551 WeakPolarHBondContact CA-OE2 3.03Å; L549-E551 WeakPolarHBondContact CB-OE2 3.47Å; L549-E551 PolarHBondContact N-OE2 3.4Å; L549-E551 PolarHBondContact O-N 2.87Å
550	C	79.9	Confident	81.4	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.359	C	S	.	.	S	Bend	trans	54.4	34.6	-176	-55.8	0	0	0	0	114.2	R527 C537 V545 W546 G547	R527-C550 HydrophobicContact CB-CB 4.1Å; C537-C550 WeakPolarHBondContact CA-SG 3Å; C537-C550 HydrophobicContact CB-CB 3.79Å; C537-C550 WeakPolarHBondContact CB-SG 3.05Å; C537-C550 PolarHBondContact N-SG 2.69Å; C537-C550 VanDerWaalsContact N-SG 3.41Å; C537-C550 WeakPolarHBondContact SG-CA 3.44Å; C537-C550 WeakPolarHBondContact SG-CB 3.39Å; C537-C550 CovalentContact SG-SG 2.04Å; C537-C550 PolarHBondContact SG-SG 2.85Å; V545-C550 HydrophobicContact CG1-CB 4.05Å; W546-C550 CarbonylContact O-C 3.57Å; W546-C550 WeakPolarHBondContact O-CA 3.3Å; G547-C550 PolarHBondContact O-N 2.58Å
551	E	79.4	Confident	81.7	Confident	94 Å²	94	80.3 Å²	80.3	44%	0.439	38%	0.384	S	S	.	.			trans	-83.9	-13.7	-175.3	70.3	-82.3	-163.1	0	0	113.8	W546 G547 K548 L549	W546-E551 PolarHBondContact O-N 3.39Å; G547-E551 VanDerWaalsContact C-OE2 3.27Å; G547-E551 WeakPolarHBondContact CA-OE2 3.49Å; K548-E551 PolarHBondContact N-OE1 3.36Å; K548-E551 PolarHBondContact N-OE2 2.97Å; K548-E551 VanDerWaalsContact N-OE2 3.15Å; L549-E551 VanDerWaalsContact CA-OE2 3.23Å; L549-E551 WeakPolarHBondContact CA-OE2 3.03Å; L549-E551 WeakPolarHBondContact CB-OE2 3.47Å; L549-E551 PolarHBondContact N-OE2 3.4Å; L549-E551 PolarHBondContact O-N 2.87Å
552	C	81.6	Confident	81.8	Confident	14 Å²	14	74.7 Å²	74.7	10%	0.095	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	147	-175.1	-67.3	0	0	0	0	112.7	V545 W546 C573	V545-C552 CarbonylContact C-O 3.57Å; V545-C552 VanDerWaalsContact CA-O 3.32Å; V545-C552 WeakPolarHBondContact CA-O 3.26Å; V545-C552 WeakPolarHBondContact CG1-O 3.37Å; W546-C552 HydrophobicContact CD2-CB 3.88Å; W546-C552 VanDerWaalsContact CE2-CB 3.5Å; W546-C552 HydrophobicContact CG-CB 4.05Å; W546-C552 HydrophobicContact CZ2-CB 3.96Å; W546-C552 PolarHBondContact N-O 3.32Å; W546-C552 WeakPolarHBondContact O-CA 2.99Å; W546-C552 VanDerWaalsContact O-CB 3.32Å; W546-C552 WeakPolarHBondContact O-CB 3.08Å; W546-C552 PolarHBondContact O-N 3.14Å; W546-C552 VanDerWaalsContact O-O 3.14Å; C552-C573 WeakPolarHBondContact CA-SG 3.09Å; C552-C573 HydrophobicContact CB-CB 3.47Å; C552-C573 VanDerWaalsContact CB-CB 3.47Å; C552-C573 WeakPolarHBondContact CB-SG 3.19Å; C552-C573 WeakPolarHBondContact SG-CB 3.41Å; C552-C573 CovalentContact SG-SG 2.03Å; C552-C573 PolarHBondContact SG-SG 2.78Å
553	D	82.8	Confident	82.5	Confident	9 Å²	9	72.1 Å²	72.1	5%	0.048	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	167.8	171.1	64.9	69.4	0	0	0	112.2	R527 K544 V545 W546 F555 N556 C573	R527-D553 IonicContact CZ-OD2 3.69Å; R527-D553 IonicContact NH1-OD2 3.59Å; R527-D553 PolarHBondContact NH1-OD2 3.16Å; R527-D553 IonicContact NH2-OD2 3.88Å; K544-D553 VanDerWaalsContact O-CA 3.28Å; K544-D553 WeakPolarHBondContact O-CA 3.4Å; V545-D553 HydrophobicContact CG2-CB 4.41Å; W546-D553 WeakPolarHBondContact CH2-O 3.04Å; W546-D553 VanDerWaalsContact CZ3-CA 3.46Å; D553-F555 HydrophobicContact CB-CD1 4.07Å; D553-F555 HydrophobicContact CB-CE1 3.7Å; D553-F555 HydrophobicContact CB-CE2 4.29Å; D553-F555 HydrophobicContact CB-CZ 3.82Å; D553-F555 PolarHBondContact OD1-N 2.04Å; D553-N556 VanDerWaalsContact CG-ND2 3.27Å; D553-N556 WeakPolarHBondContact OD1-CB 3.45Å; D553-N556 PolarHBondContact OD1-N 2.65Å; D553-N556 PolarHBondContact OD1-ND2 2.87Å; D553-N556 PolarHBondContact OD2-ND2 2.03Å; D553-C573 WeakPolarHBondContact O-CA 3.16Å; D553-C573 PolarHBondContact O-N 3.07Å
554	D	82.1	Confident	82.9	Confident	51 Å²	51	73 Å²	73	27%	0.273	35%	0.354	S	S	.	.	S	Bend	trans	-107	14.3	-179.2	60.7	1.1	0	0	0	113.4	G543 K544 W546 L564 C571	G543-D554 WeakPolarHBondContact CA-OD1 3.44Å; K544-D554 PolarHBondContact N-OD1 3.22Å; K544-D554 PolarHBondContact N-OD2 3.11Å; K544-D554 PolarHBondContact O-N 3.29Å; W546-D554 HydrophobicContact CH2-CB 3.67Å; W546-D554 HydrophobicContact CZ3-CB 3.61Å; D554-L564 WeakPolarHBondContact O-CD2 3.36Å; D554-C571 WeakPolarHBondContact O-CB 2.81Å; D554-C571 PolarHBondContact O-SG 3.21Å
555	F	86.8	Confident	83.4	Confident	34 Å²	34	65.7 Å²	65.7	15%	0.149	32%	0.323	C	S	.	.	S	Bend	trans	-130.2	-13.6	-174.4	52.5	-99	0	0	0	115.4	F542 V545 D553 L564	F542-F555 HydrophobicContact CB-CB 4.4Å; F542-F555 HydrophobicContact CB-CD1 4.08Å; F542-F555 HydrophobicContact CB-CD2 4.03Å; F542-F555 HydrophobicContact CB-CE1 4.35Å; F542-F555 HydrophobicContact CB-CE2 4.28Å; F542-F555 HydrophobicContact CB-CG 3.92Å; F542-F555 HydrophobicContact CB-CZ 4.44Å; V545-F555 HydrophobicContact CG2-CE1 4.12Å; V545-F555 HydrophobicContact CG2-CZ 4.12Å; D553-F555 HydrophobicContact CB-CD1 4.07Å; D553-F555 HydrophobicContact CB-CE1 3.7Å; D553-F555 HydrophobicContact CB-CE2 4.29Å; D553-F555 HydrophobicContact CB-CZ 3.82Å; D553-F555 PolarHBondContact OD1-N 2.04Å; F555-L564 WeakPolarHBondContact O-CD1 3.47Å
556	N	88.3	Confident	84.1	Confident	92 Å²	92	65 Å²	65	49%	0.492	32%	0.319	S	S	.	.			trans	-94.9	21.8	179.5	-68.6	-43.6	0	0	0	114.5	D553	D553-N556 VanDerWaalsContact CG-ND2 3.27Å; D553-N556 WeakPolarHBondContact OD1-CB 3.45Å; D553-N556 PolarHBondContact OD1-N 2.65Å; D553-N556 PolarHBondContact OD1-ND2 2.87Å; D553-N556 PolarHBondContact OD2-ND2 2.03Å
557	C	89.5	Confident	84.8	Confident	10 Å²	10	63.1 Å²	63.1	7%	0.068	33%	0.326	C	S	.	.	S	Bend	trans	-75.5	168	171.7	-65.1	0	0	0	0	113.1	L564 C571 F575 C576	C557-L564 HydrophobicContact CB-CD1 3.87Å; C557-L564 HydrophobicContact CB-CG 4.28Å; C557-L564 WeakPolarHBondContact O-CD1 3.1Å; C557-C571 HydrophobicContact CB-CB 3.64Å; C557-C571 WeakPolarHBondContact CB-SG 3.5Å; C557-C571 PolarHBondContact N-SG 2.64Å; C557-C571 VanDerWaalsContact N-SG 3.41Å; C557-C571 WeakPolarHBondContact SG-CA 2.91Å; C557-C571 WeakPolarHBondContact SG-CB 3.42Å; C557-C571 CovalentContact SG-SG 2.02Å; C557-C571 PolarHBondContact SG-SG 3.09Å; C557-F575 PolarHBondContact SG-N 3.31Å; C557-F575 VanDerWaalsContact SG-N 3.43Å; C557-F575 PolarHBondContact SG-O 3.06Å; C557-F575 VanDerWaalsContact SG-O 3.42Å; C557-C576 VanDerWaalsContact CB-SG 3.59Å
558	L	89.4	Confident	85.8	Confident	92 Å²	92	64.7 Å²	64.7	48%	0.482	33%	0.325	S	S	.	.			trans	-61.7	143.9	178.2	-64.1	174.3	0	0	0	112.1	C565 E585 N586	L558-C565 PolarHBondContact O-N 3.16Å; L558-E585 HydrophobicContact CD1-CB 3.93Å; L558-N586 HydrophobicContact CB-CB 4Å
559	R	91	Very high	86.4	Confident	155 Å²	155	58 Å²	58	59%	0.585	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	144.6	176.2	-67.1	178.8	177.4	-112.9	1.4	111.1	G562 E563 L564	R559-G562 PolarHBondContact NH1-O 2.8Å; R559-E563 CarbonylContact C-O 3.56Å; R559-E563 WeakPolarHBondContact CA-O 3.01Å; R559-L564 HydrophobicContact CG-CD1 4.03Å
560	Y	89.2	Confident	86.6	Confident	99 Å²	99	61 Å²	61	39%	0.388	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	130.3	170.1	-176	-107.1	0	0	0	108.6	G562 E563 S566 N588	Y560-G562 PolarHBondContact O-N 3.49Å; Y560-G562 VanDerWaalsContact O-N 3.08Å; Y560-E563 PolarHBondContact N-O 2.88Å; Y560-E563 PolarHBondContact O-N 3.14Å; Y560-E563 VanDerWaalsContact O-N 3.08Å; Y560-S566 VanDerWaalsContact CB-OG 3.25Å; Y560-S566 WeakPolarHBondContact CB-OG 2.99Å; Y560-N588 HydrophobicContact CD1-CB 4Å; Y560-N588 HydrophobicContact CE1-CB 4.32Å; Y560-N588 HydrophobicContact CG-CB 4.19Å
561	K	87.3	Confident	86.8	Confident	181 Å²	181	61.4 Å²	61.4	79%	0.787	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	33.2	-174.2	-63.6	179.7	176.7	178.7	0	113.9
562	G	85.8	Confident	86.8	Confident	52 Å²	52	59.5 Å²	59.5	54%	0.536	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-16.6	178.1	0	0	0	0	0	115.4	R559 Y560	R559-G562 PolarHBondContact NH1-O 2.8Å; Y560-G562 PolarHBondContact O-N 3.49Å; Y560-G562 VanDerWaalsContact O-N 3.08Å
563	E	90.8	Very high	86.7	Confident	114 Å²	114	60.7 Å²	60.7	53%	0.533	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137	-178.5	-64.1	-159.9	171.6	0	0	112.8	R559 Y560 C565 S566 G567	R559-E563 CarbonylContact C-O 3.56Å; R559-E563 WeakPolarHBondContact CA-O 3.01Å; Y560-E563 PolarHBondContact N-O 2.88Å; Y560-E563 PolarHBondContact O-N 3.14Å; Y560-E563 VanDerWaalsContact O-N 3.08Å; E563-C565 PolarHBondContact O-N 2.77Å; E563-S566 PolarHBondContact O-N 3.1Å; E563-G567 WeakPolarHBondContact OE2-CA 3.4Å; E563-G567 PolarHBondContact OE2-N 3.27Å
564	L	90.4	Very high	86.6	Confident	43 Å²	43	62 Å²	62	23%	0.225	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	126.7	174.6	-165.2	73	0	0	0	109.3	D554 F555 C557 R559 S566 G567 C571	D554-L564 WeakPolarHBondContact O-CD2 3.36Å; F555-L564 WeakPolarHBondContact O-CD1 3.47Å; C557-L564 HydrophobicContact CB-CD1 3.87Å; C557-L564 HydrophobicContact CB-CG 4.28Å; C557-L564 WeakPolarHBondContact O-CD1 3.1Å; R559-L564 HydrophobicContact CG-CD1 4.03Å; L564-S566 PolarHBondContact O-N 2.03Å; L564-S566 VanDerWaalsContact O-N 3.14Å; L564-G567 PolarHBondContact O-N 3.24Å; L564-C571 HydrophobicContact CD2-CB 3.66Å; L564-C571 HydrophobicContact CG-CB 4.26Å
565	C	89.8	Confident	86.6	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	52	34.5	-175.4	-53.4	0	0	0	0	113.4	L558 E563 G567 H568 G569 C576 N586 C587	L558-C565 PolarHBondContact O-N 3.16Å; E563-C565 PolarHBondContact O-N 2.77Å; C565-G567 PolarHBondContact O-N 3.08Å; C565-G567 VanDerWaalsContact O-N 3.08Å; C565-H568 CarbonylContact O-C 3.43Å; C565-H568 PolarHBondContact O-N 3.03Å; C565-G569 PolarHBondContact O-N 3.1Å; C565-C576 WeakPolarHBondContact CA-SG 3.33Å; C565-C576 HydrophobicContact CB-CB 3.64Å; C565-C576 WeakPolarHBondContact CB-SG 3.48Å; C565-C576 WeakPolarHBondContact SG-CA 3.29Å; C565-C576 WeakPolarHBondContact SG-CB 3.29Å; C565-C576 CovalentContact SG-SG 2.03Å; C565-C576 PolarHBondContact SG-SG 2.59Å; C565-N586 CarbonylContact C-O 3.54Å; C565-N586 WeakPolarHBondContact CA-O 2.94Å; C565-C587 WeakPolarHBondContact O-CB 3.02Å
566	S	91.5	Very high	86.4	Confident	10 Å²	10	66.4 Å²	66.4	7%	0.07	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	56.7	19.5	-177.8	-47.4	0	0	0	0	114.8	Y560 E563 L564 H568 N586 N588	Y560-S566 VanDerWaalsContact CB-OG 3.25Å; Y560-S566 WeakPolarHBondContact CB-OG 2.99Å; E563-S566 PolarHBondContact O-N 3.1Å; L564-S566 PolarHBondContact O-N 2.03Å; L564-S566 VanDerWaalsContact O-N 3.14Å; S566-H568 PolarHBondContact O-CD2 3.28Å; S566-H568 PolarHBondContact O-N 2.91Å; S566-H568 PolarHBondContact O-NE2 3.41Å; S566-N586 WeakPolarHBondContact CB-O 3.34Å; S566-N586 PolarHBondContact N-O 3.25Å; S566-N586 PolarHBondContact OG-O 3.29Å; S566-N588 WeakPolarHBondContact OG-CB 3.05Å
567	G	88.1	Confident	86.1	Confident	45 Å²	45	65.8 Å²	65.8	46%	0.464	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	68.8	8.2	-171.9	0	0	0	0	0	113.6	E563 L564 C565	E563-G567 WeakPolarHBondContact OE2-CA 3.4Å; E563-G567 PolarHBondContact OE2-N 3.27Å; L564-G567 PolarHBondContact O-N 3.24Å; C565-G567 PolarHBondContact O-N 3.08Å; C565-G567 VanDerWaalsContact O-N 3.08Å
568	H	88.4	Confident	85.6	Confident	63 Å²	63	67.4 Å²	67.4	29%	0.292	37%	0.366	S	S	.	.	S	Bend	trans	-126.1	35.6	-171.7	-59.4	-32.9	0	0	0	110.4	C565 S566 A579 W582 C587	C565-H568 CarbonylContact O-C 3.43Å; C565-H568 PolarHBondContact O-N 3.03Å; S566-H568 PolarHBondContact O-CD2 3.28Å; S566-H568 PolarHBondContact O-N 2.91Å; S566-H568 PolarHBondContact O-NE2 3.41Å; H568-A579 VanDerWaalsContact C-CB 3.48Å; H568-A579 HydrophobicContact CB-CB 4.42Å; H568-A579 WeakPolarHBondContact O-CA 3.17Å; H568-A579 WeakPolarHBondContact O-CB 3.5Å; H568-A579 PolarHBondContact O-N 2Å; H568-W582 HydrophobicContact CB-CB 4.08Å; H568-W582 HydrophobicContact CB-CD2 3.78Å; H568-W582 HydrophobicContact CB-CE3 4.46Å; H568-W582 HydrophobicContact CB-CG 3.55Å; H568-W582 AromaticContact CD2-CD2 3.44Å; H568-W582 VanDerWaalsContact CD2-CD2 3.44Å; H568-W582 AromaticContact CD2-CE2 3.26Å; H568-W582 AromaticContact CD2-CE3 3.6Å; H568-W582 AromaticContact CD2-CH2 3.47Å; H568-W582 VanDerWaalsContact CD2-CH2 3.47Å; H568-W582 WeakPolarHBondContact CD2-CH2 3.46Å; H568-W582 AromaticContact CD2-CZ2 3.3Å; H568-W582 WeakPolarHBondContact CD2-CZ2 3.24Å; H568-W582 AromaticContact CD2-CZ3 3.62Å; H568-W582 AromaticContact CD2-NE1 3.88Å; H568-W582 AromaticContact CE1-CE2 3.98Å; H568-W582 AromaticContact CE1-CZ2 3.73Å; H568-W582 AromaticContact CG-CD1 3.87Å; H568-W582 AromaticContact CG-CD2 3.66Å; H568-W582 AromaticContact CG-CE2 3.44Å; H568-W582 VanDerWaalsContact CG-CE2 3.44Å; H568-W582 AromaticContact CG-CG 3.94Å; H568-W582 AromaticContact CG-CZ2 3.89Å; H568-W582 AromaticContact CG-NE1 3.55Å; H568-W582 AromaticContact ND1-CE2 3.89Å; H568-W582 AromaticContact ND1-NE1 3.78Å; H568-W582 AromaticContact NE2-CE2 3.63Å; H568-W582 AromaticContact NE2-CH2 3.41Å; H568-W582 WeakPolarHBondContact NE2-CH2 3.35Å; H568-W582 AromaticContact NE2-CZ2 3.19Å; H568-W582 WeakPolarHBondContact NE2-CZ2 3.33Å; H568-C587 HydrophobicContact CB-CB 4.25Å; H568-C587 VanDerWaalsContact O-CB 3.28Å; H568-C587 WeakPolarHBondContact O-CB 3.02Å
569	G	83.9	Confident	84.8	Confident	24 Å²	24	64.5 Å²	64.5	25%	0.247	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.9	163.7	177.8	0	0	0	0	0	112.4	C565 Q577	C565-G569 PolarHBondContact O-N 3.1Å; G569-Q577 CarbonylContact C-O 3.56Å; G569-Q577 WeakPolarHBondContact CA-O 2.95Å
570	V	82.7	Confident	83.3	Confident	100 Å²	100	59.5 Å²	59.5	61%	0.606	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.2	174.9	-178.5	0	0	0	0	108.6	Q577	V570-Q577 PolarHBondContact N-O 3.16Å; V570-Q577 WeakPolarHBondContact O-CB 3.49Å; V570-Q577 PolarHBondContact O-N 2.77Å
571	C	83.1	Confident	82.5	Confident	8 Å²	8	57.9 Å²	57.9	5%	0.054	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	129.4	175.1	179.6	0	0	0	0	110.6	D554 C557 L564	D554-C571 WeakPolarHBondContact O-CB 2.81Å; D554-C571 PolarHBondContact O-SG 3.21Å; C557-C571 HydrophobicContact CB-CB 3.64Å; C557-C571 WeakPolarHBondContact CB-SG 3.5Å; C557-C571 PolarHBondContact N-SG 2.64Å; C557-C571 VanDerWaalsContact N-SG 3.41Å; C557-C571 WeakPolarHBondContact SG-CA 2.91Å; C557-C571 WeakPolarHBondContact SG-CB 3.42Å; C557-C571 CovalentContact SG-SG 2.02Å; C557-C571 PolarHBondContact SG-SG 3.09Å; L564-C571 HydrophobicContact CD2-CB 3.66Å; L564-C571 HydrophobicContact CG-CB 4.26Å
572	N	80.5	Confident	82.2	Confident	54 Å²	54	52.5 Å²	52.5	29%	0.289	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	105.1	177.3	-172	-24.1	0	0	0	109.7	W546 G574 F575 Q577	W546-N572 WeakPolarHBondContact CZ2-OD1 3.3Å; N572-G574 PolarHBondContact O-N 3.41Å; N572-F575 PolarHBondContact N-O 3.4Å; N572-F575 PolarHBondContact O-N 3.19Å; N572-F575 VanDerWaalsContact O-N 3.12Å; N572-Q577 HydrophobicContact CB-CG 4.03Å; N572-Q577 PolarHBondContact ND2-NE2 3.35Å
573	C	79.8	Confident	82	Confident	38 Å²	38	53.7 Å²	53.7	26%	0.257	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	48.3	175.9	-162.8	0	0	0	0	113	W546 C552 D553 F575	W546-C573 HydrophobicContact CZ2-CB 4.25Å; C552-C573 WeakPolarHBondContact CA-SG 3.09Å; C552-C573 HydrophobicContact CB-CB 3.47Å; C552-C573 VanDerWaalsContact CB-CB 3.47Å; C552-C573 WeakPolarHBondContact CB-SG 3.19Å; C552-C573 WeakPolarHBondContact SG-CB 3.41Å; C552-C573 CovalentContact SG-SG 2.03Å; C552-C573 PolarHBondContact SG-SG 2.78Å; D553-C573 WeakPolarHBondContact O-CA 3.16Å; D553-C573 PolarHBondContact O-N 3.07Å; C573-F575 VanDerWaalsContact C-N 3.27Å; C573-F575 WeakPolarHBondContact O-CD2 3.5Å; C573-F575 PolarHBondContact O-N 3.2Å
574	G	80.1	Confident	81.6	Confident	37 Å²	37	50.4 Å²	50.4	38%	0.381	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	-2.9	-179.7	0	0	0	0	0	115.5	N572	N572-G574 PolarHBondContact O-N 3.41Å
575	F	82.2	Confident	81.4	Confident	157 Å²	157	56 Å²	56	69%	0.689	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.9	176	-60.6	-84.1	0	0	0	111.8	C557 N572 C573 Q577	C557-F575 PolarHBondContact SG-N 3.31Å; C557-F575 VanDerWaalsContact SG-N 3.43Å; C557-F575 PolarHBondContact SG-O 3.06Å; C557-F575 VanDerWaalsContact SG-O 3.42Å; N572-F575 PolarHBondContact N-O 3.4Å; N572-F575 PolarHBondContact O-N 3.19Å; N572-F575 VanDerWaalsContact O-N 3.12Å; C573-F575 VanDerWaalsContact C-N 3.27Å; C573-F575 WeakPolarHBondContact O-CD2 3.5Å; C573-F575 PolarHBondContact O-N 3.2Å; F575-Q577 PolarHBondContact O-N 2.03Å
576	C	83.6	Confident	81.4	Confident	20 Å²	20	57.4 Å²	57.4	14%	0.135	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	114.9	172.1	-71.2	0	0	0	0	111	C557 C565 C578 E585 C587	C557-C576 VanDerWaalsContact CB-SG 3.59Å; C565-C576 WeakPolarHBondContact CA-SG 3.33Å; C565-C576 HydrophobicContact CB-CB 3.64Å; C565-C576 WeakPolarHBondContact CB-SG 3.48Å; C565-C576 WeakPolarHBondContact SG-CA 3.29Å; C565-C576 WeakPolarHBondContact SG-CB 3.29Å; C565-C576 CovalentContact SG-SG 2.03Å; C565-C576 PolarHBondContact SG-SG 2.59Å; C576-C578 PolarHBondContact O-N 3.1Å; C576-E585 WeakPolarHBondContact CB-O 3.44Å; C576-C587 WeakPolarHBondContact CB-SG 3.32Å
577	Q	81.6	Confident	81.3	Confident	80 Å²	80	57 Å²	57	37%	0.374	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	94.1	168.1	-64.1	-177.1	-15.6	0	0	108.1	G569 V570 N572 F575	G569-Q577 CarbonylContact C-O 3.56Å; G569-Q577 WeakPolarHBondContact CA-O 2.95Å; V570-Q577 PolarHBondContact N-O 3.16Å; V570-Q577 WeakPolarHBondContact O-CB 3.49Å; V570-Q577 PolarHBondContact O-N 2.77Å; N572-Q577 HydrophobicContact CB-CG 4.03Å; N572-Q577 PolarHBondContact ND2-NE2 3.35Å; F575-Q577 PolarHBondContact O-N 2.03Å
578	C	79.4	Confident	81.5	Confident	43 Å²	43	57.8 Å²	57.8	29%	0.291	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	142.3	-174.5	-55.7	0	0	0	0	113.1	C576 W582 G584 C587	C576-C578 PolarHBondContact O-N 3.1Å; C578-W582 HydrophobicContact CB-CB 4.31Å; C578-W582 WeakPolarHBondContact CB-O 3.27Å; C578-G584 PolarHBondContact SG-O 2.02Å; C578-C587 WeakPolarHBondContact CA-SG 3.42Å; C578-C587 HydrophobicContact CB-CB 3.61Å; C578-C587 WeakPolarHBondContact CB-SG 3.46Å; C578-C587 PolarHBondContact N-SG 3.38Å; C578-C587 WeakPolarHBondContact SG-CA 3.27Å; C578-C587 WeakPolarHBondContact SG-CB 3.31Å; C578-C587 CovalentContact SG-SG 2.03Å; C578-C587 PolarHBondContact SG-SG 2.97Å
579	A	72.7	Confident	81.5	Confident	31 Å²	31	55.3 Å²	55.3	26%	0.256	32%	0.317	S	S	.	.			trans	-57.6	150.3	170.8	0	0	0	0	0	109.7	H568 D581 W582	H568-A579 VanDerWaalsContact C-CB 3.48Å; H568-A579 HydrophobicContact CB-CB 4.42Å; H568-A579 WeakPolarHBondContact O-CA 3.17Å; H568-A579 WeakPolarHBondContact O-CB 3.5Å; H568-A579 PolarHBondContact O-N 2Å; A579-D581 VanDerWaalsContact C-N 3.3Å; A579-D581 PolarHBondContact O-N 3.06Å; A579-W582 PolarHBondContact O-N 3.25Å
580	P	58.5	Low	81.4	Confident	50 Å²	50	55.1 Å²	55.1	33%	0.325	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-19.6	-60.9	174.2	-37.4	28.4	0	0	0	117.3	R431 W582	R431-P580 HydrophobicContact CB-CG 4.38Å; R431-P580 VanDerWaalsContact CD-CA 3.49Å; R431-P580 VanDerWaalsContact NH1-CA 3.26Å; R431-P580 PolarHBondContact NH1-O 3.46Å; R431-P580 PolarHBondContact NH2-O 2.92Å; P580-W582 PolarHBondContact O-N 2.85Å
581	D	71.7	Confident	81	Confident	65 Å²	65	57 Å²	57	35%	0.348	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	18.7	-170.7	-60.3	-26.5	0	0	0	113.8	R431 A579 S590 R591 R592	R431-D581 IonicContact CZ-OD1 3.39Å; R431-D581 IonicContact NH1-OD1 2.79Å; R431-D581 PolarHBondContact NH1-OD1 2.97Å; R431-D581 IonicContact NH2-OD1 3.71Å; A579-D581 VanDerWaalsContact C-N 3.3Å; A579-D581 PolarHBondContact O-N 3.06Å; D581-S590 CarbonylContact O-C 3.59Å; D581-S590 WeakPolarHBondContact O-CA 3.41Å; D581-R591 PolarHBondContact O-N 2.81Å; D581-R592 HydrophobicContact CB-CG 4.27Å
582	W	81.1	Confident	80.5	Confident	68 Å²	68	62.8 Å²	62.8	26%	0.258	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	153.4	-175.1	-61.9	88.5	0	0	0	111.9	H568 C578 A579 P580 C587 N588 C589	H568-W582 HydrophobicContact CB-CB 4.08Å; H568-W582 HydrophobicContact CB-CD2 3.78Å; H568-W582 HydrophobicContact CB-CE3 4.46Å; H568-W582 HydrophobicContact CB-CG 3.55Å; H568-W582 AromaticContact CD2-CD2 3.44Å; H568-W582 VanDerWaalsContact CD2-CD2 3.44Å; H568-W582 AromaticContact CD2-CE2 3.26Å; H568-W582 AromaticContact CD2-CE3 3.6Å; H568-W582 AromaticContact CD2-CH2 3.47Å; H568-W582 VanDerWaalsContact CD2-CH2 3.47Å; H568-W582 WeakPolarHBondContact CD2-CH2 3.46Å; H568-W582 AromaticContact CD2-CZ2 3.3Å; H568-W582 WeakPolarHBondContact CD2-CZ2 3.24Å; H568-W582 AromaticContact CD2-CZ3 3.62Å; H568-W582 AromaticContact CD2-NE1 3.88Å; H568-W582 AromaticContact CE1-CE2 3.98Å; H568-W582 AromaticContact CE1-CZ2 3.73Å; H568-W582 AromaticContact CG-CD1 3.87Å; H568-W582 AromaticContact CG-CD2 3.66Å; H568-W582 AromaticContact CG-CE2 3.44Å; H568-W582 VanDerWaalsContact CG-CE2 3.44Å; H568-W582 AromaticContact CG-CG 3.94Å; H568-W582 AromaticContact CG-CZ2 3.89Å; H568-W582 AromaticContact CG-NE1 3.55Å; H568-W582 AromaticContact ND1-CE2 3.89Å; H568-W582 AromaticContact ND1-NE1 3.78Å; H568-W582 AromaticContact NE2-CE2 3.63Å; H568-W582 AromaticContact NE2-CH2 3.41Å; H568-W582 WeakPolarHBondContact NE2-CH2 3.35Å; H568-W582 AromaticContact NE2-CZ2 3.19Å; H568-W582 WeakPolarHBondContact NE2-CZ2 3.33Å; C578-W582 HydrophobicContact CB-CB 4.31Å; C578-W582 WeakPolarHBondContact CB-O 3.27Å; A579-W582 PolarHBondContact O-N 3.25Å; P580-W582 PolarHBondContact O-N 2.85Å; W582-C587 HydrophobicContact CB-CB 4.28Å; W582-C587 VanDerWaalsContact CE3-O 3.26Å; W582-N588 VanDerWaalsContact CZ3-O 3.31Å; W582-N588 WeakPolarHBondContact CZ3-O 3.44Å; W582-C589 CarbonylContact C-O 3.59Å; W582-C589 VanDerWaalsContact CA-O 3.26Å; W582-C589 WeakPolarHBondContact CA-O 3.35Å
583	Q	81.4	Confident	80.2	Confident	78 Å²	78	62.6 Å²	62.6	36%	0.364	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	177.9	178.1	68.4	-177.3	10.4	0	0	111.2	C587 N588 C589 R591	Q583-C587 CarbonylContact O-C 3.45Å; Q583-C587 WeakPolarHBondContact O-CA 3.3Å; Q583-N588 PolarHBondContact O-N 3.11Å; Q583-C589 HydrophobicContact CG-CB 3.78Å; Q583-C589 WeakPolarHBondContact CG-O 3.15Å; Q583-C589 PolarHBondContact N-O 3.02Å; Q583-C589 PolarHBondContact NE2-SG 3.44Å; Q583-C589 WeakPolarHBondContact O-CB 3.37Å; Q583-C589 PolarHBondContact O-N 3.05Å; Q583-C589 VanDerWaalsContact O-N 3.14Å; Q583-R591 HydrophobicContact CB-CG 4.14Å; Q583-R591 HydrophobicContact CG-CG 4.01Å
584	G	83.8	Confident	79.7	Confident	44 Å²	44	64.2 Å²	64.2	45%	0.454	34%	0.336	S	S	.	.	S	Bend	trans	92.6	162.7	-173.2	0	0	0	0	0	111.7	C578 N586 C587	C578-G584 PolarHBondContact SG-O 2.02Å; G584-N586 PolarHBondContact O-N 2.93Å; G584-C587 PolarHBondContact O-N 2.72Å; G584-C587 VanDerWaalsContact O-N 3.13Å
585	E	85.9	Confident	79.5	Confident	161 Å²	161	66.4 Å²	66.4	75%	0.752	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.3	-174.5	-62.3	-175	159.7	0	0	113.6	L558 C576	L558-E585 HydrophobicContact CD1-CB 3.93Å; C576-E585 WeakPolarHBondContact CB-O 3.44Å
586	N	89.5	Confident	79.3	Confident	30 Å²	30	58.9 Å²	58.9	16%	0.16	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	6.9	176.6	64.6	-7.4	0	0	0	112.9	L558 C565 S566 G584 N588	L558-N586 HydrophobicContact CB-CB 4Å; C565-N586 CarbonylContact C-O 3.54Å; C565-N586 WeakPolarHBondContact CA-O 2.94Å; S566-N586 WeakPolarHBondContact CB-O 3.34Å; S566-N586 PolarHBondContact N-O 3.25Å; S566-N586 PolarHBondContact OG-O 3.29Å; G584-N586 PolarHBondContact O-N 2.93Å; N586-N588 VanDerWaalsContact C-N 3.31Å; N586-N588 PolarHBondContact ND2-ND2 2.98Å; N586-N588 PolarHBondContact O-N 2.8Å; N586-N588 WeakPolarHBondContact OD1-CB 3.46Å; N586-N588 PolarHBondContact OD1-N 2.8Å; N586-N588 PolarHBondContact OD1-OD1 2.8Å
587	C	89.4	Confident	78.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.32	C	S	.	.	S	Bend	trans	60.1	31	179.8	-45.7	0	0	0	0	115.8	C565 H568 C576 C578 W582 Q583 G584	C565-C587 WeakPolarHBondContact O-CB 3.02Å; H568-C587 HydrophobicContact CB-CB 4.25Å; H568-C587 VanDerWaalsContact O-CB 3.28Å; H568-C587 WeakPolarHBondContact O-CB 3.02Å; C576-C587 WeakPolarHBondContact CB-SG 3.32Å; C578-C587 WeakPolarHBondContact CA-SG 3.42Å; C578-C587 HydrophobicContact CB-CB 3.61Å; C578-C587 WeakPolarHBondContact CB-SG 3.46Å; C578-C587 PolarHBondContact N-SG 3.38Å; C578-C587 WeakPolarHBondContact SG-CA 3.27Å; C578-C587 WeakPolarHBondContact SG-CB 3.31Å; C578-C587 CovalentContact SG-SG 2.03Å; C578-C587 PolarHBondContact SG-SG 2.97Å; W582-C587 HydrophobicContact CB-CB 4.28Å; W582-C587 VanDerWaalsContact CE3-O 3.26Å; Q583-C587 CarbonylContact O-C 3.45Å; Q583-C587 WeakPolarHBondContact O-CA 3.3Å; G584-C587 PolarHBondContact O-N 2.72Å; G584-C587 VanDerWaalsContact O-N 3.13Å
588	N	91.7	Very high	78	Confident	62 Å²	62	58.2 Å²	58.2	33%	0.332	31%	0.306	S	S	.	.			trans	-89.5	-6.3	-179.3	72.8	-14.8	0	0	0	114.5	Y560 S566 W582 Q583 N586	Y560-N588 HydrophobicContact CD1-CB 4Å; Y560-N588 HydrophobicContact CE1-CB 4.32Å; Y560-N588 HydrophobicContact CG-CB 4.19Å; S566-N588 WeakPolarHBondContact OG-CB 3.05Å; W582-N588 VanDerWaalsContact CZ3-O 3.31Å; W582-N588 WeakPolarHBondContact CZ3-O 3.44Å; Q583-N588 PolarHBondContact O-N 3.11Å; N586-N588 VanDerWaalsContact C-N 3.31Å; N586-N588 PolarHBondContact ND2-ND2 2.98Å; N586-N588 PolarHBondContact O-N 2.8Å; N586-N588 WeakPolarHBondContact OD1-CB 3.46Å; N586-N588 PolarHBondContact OD1-N 2.8Å; N586-N588 PolarHBondContact OD1-OD1 2.8Å
589	C	88.4	Confident	76.7	Confident	12 Å²	12	63.7 Å²	63.7	8%	0.081	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	117.4	-171.5	179	0	0	0	0	110.5	W582 Q583 C612	W582-C589 CarbonylContact C-O 3.59Å; W582-C589 VanDerWaalsContact CA-O 3.26Å; W582-C589 WeakPolarHBondContact CA-O 3.35Å; Q583-C589 HydrophobicContact CG-CB 3.78Å; Q583-C589 WeakPolarHBondContact CG-O 3.15Å; Q583-C589 PolarHBondContact N-O 3.02Å; Q583-C589 PolarHBondContact NE2-SG 3.44Å; Q583-C589 WeakPolarHBondContact O-CB 3.37Å; Q583-C589 PolarHBondContact O-N 3.05Å; Q583-C589 VanDerWaalsContact O-N 3.14Å; C589-C612 HydrophobicContact CB-CB 3.89Å; C589-C612 WeakPolarHBondContact CB-SG 2.97Å; C589-C612 WeakPolarHBondContact SG-CA 2.96Å; C589-C612 WeakPolarHBondContact SG-CB 3.38Å; C589-C612 CovalentContact SG-SG 2.03Å; C589-C612 PolarHBondContact SG-SG 3.47Å
590	S	82.6	Confident	75.7	Confident	20 Å²	20	68 Å²	68	14%	0.14	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	140.5	178.2	178.6	0	0	0	0	111.9	D581 R592 C612	D581-S590 CarbonylContact O-C 3.59Å; D581-S590 WeakPolarHBondContact O-CA 3.41Å; S590-R592 WeakPolarHBondContact OG-CB 3.35Å; S590-R592 PolarHBondContact OG-N 3.21Å; S590-R592 VanDerWaalsContact OG-N 3.16Å; S590-C612 CarbonylContact O-C 3.44Å; S590-C612 WeakPolarHBondContact O-CA 3.46Å
591	R	73.8	Confident	75.5	Confident	138 Å²	138	67.5 Å²	67.5	52%	0.521	35%	0.354	S	S	.	.			trans	-90	-6.7	172.5	-73	-178.5	157.9	164.1	1.6	113.2	D581 Q583	D581-R591 PolarHBondContact O-N 2.81Å; Q583-R591 HydrophobicContact CB-CG 4.14Å; Q583-R591 HydrophobicContact CG-CG 4.01Å
592	R	72.8	Confident	74.9	Confident	130 Å²	130	68.9 Å²	68.9	49%	0.491	36%	0.36	S	S	.	.			trans	-71.6	140.9	-179.3	-69.1	175.9	58.3	162.7	-0.4	110.7	D581 S590 D594 G613	D581-R592 HydrophobicContact CB-CG 4.27Å; S590-R592 WeakPolarHBondContact OG-CB 3.35Å; S590-R592 PolarHBondContact OG-N 3.21Å; S590-R592 VanDerWaalsContact OG-N 3.16Å; R592-D594 VanDerWaalsContact CB-OD1 3.3Å; R592-D594 WeakPolarHBondContact CB-OD1 3.48Å; R592-D594 IonicContact CZ-OD1 2.79Å; R592-D594 IonicContact CZ-OD2 2.84Å; R592-D594 IonicContact NE-OD1 2.7Å; R592-D594 PolarHBondContact NE-OD1 3.49Å; R592-D594 VanDerWaalsContact NE-OD1 3.07Å; R592-D594 IonicContact NE-OD2 3.91Å; R592-D594 IonicContact NH2-OD1 3.82Å; R592-D594 IonicContact NH2-OD2 2.61Å; R592-D594 PolarHBondContact NH2-OD2 2.85Å; R592-G613 VanDerWaalsContact O-CA 3.27Å; R592-G613 WeakPolarHBondContact O-CA 2.97Å
593	T	74.8	Confident	74.3	Confident	51 Å²	51	69 Å²	69	31%	0.313	37%	0.366	S	S	.	.			trans	-116	2	179.9	57	0	0	0	0	113	C596 M597 L603	T593-C596 WeakPolarHBondContact O-CB 3.46Å; T593-C596 PolarHBondContact O-N 2.84Å; T593-C596 VanDerWaalsContact O-N 3.11Å; T593-M597 PolarHBondContact O-N 3.23Å; T593-L603 HydrophobicContact CG2-CD1 4.04Å
594	D	68.7	Low	74.3	Confident	72 Å²	72	65.3 Å²	65.3	39%	0.385	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-65.4	-40.7	-177.7	61.4	-46.7	0	0	0	111.8	R592 C596 M597	R592-D594 VanDerWaalsContact CB-OD1 3.3Å; R592-D594 WeakPolarHBondContact CB-OD1 3.48Å; R592-D594 IonicContact CZ-OD1 2.79Å; R592-D594 IonicContact CZ-OD2 2.84Å; R592-D594 IonicContact NE-OD1 2.7Å; R592-D594 PolarHBondContact NE-OD1 3.49Å; R592-D594 VanDerWaalsContact NE-OD1 3.07Å; R592-D594 IonicContact NE-OD2 3.91Å; R592-D594 IonicContact NH2-OD1 3.82Å; R592-D594 IonicContact NH2-OD2 2.61Å; R592-D594 PolarHBondContact NH2-OD2 2.85Å; D594-C596 PolarHBondContact O-N 2.76Å; D594-M597 PolarHBondContact O-N 3.49Å; D594-M597 VanDerWaalsContact O-N 3.16Å
595	T	75	Confident	73.9	Confident	82 Å²	82	63.8 Å²	63.8	50%	0.503	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-65.8	-16.4	173.1	51.1	0	0	0	0	113.7	G613	T595-G613 PolarHBondContact OG1-O 2.61Å
596	C	79.9	Confident	73.4	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-96.3	-6.6	177.5	-67.7	0	0	0	0	113.2	T593 D594 L603 C604 C610 V614 C615	T593-C596 WeakPolarHBondContact O-CB 3.46Å; T593-C596 PolarHBondContact O-N 2.84Å; T593-C596 VanDerWaalsContact O-N 3.11Å; D594-C596 PolarHBondContact O-N 2.76Å; C596-L603 HydrophobicContact CB-CG 4.34Å; C596-C604 PolarHBondContact O-N 3.16Å; C596-C610 HydrophobicContact CB-CB 3.51Å; C596-C610 WeakPolarHBondContact CB-SG 3.23Å; C596-C610 WeakPolarHBondContact SG-CB 3.03Å; C596-C610 CovalentContact SG-SG 2.04Å; C596-C610 PolarHBondContact SG-SG 2.8Å; C596-V614 PolarHBondContact SG-N 2.99Å; C596-C615 VanDerWaalsContact CB-SG 3.54Å
597	M	69.4	Low	73	Confident	76 Å²	76	60.3 Å²	60.3	37%	0.374	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-77.2	128.2	176	-89.6	-154.5	-73.4	0	0	110.4	L410 T593 D594	L410-M597 HydrophobicContact CD1-SD 3.98Å; T593-M597 PolarHBondContact O-N 3.23Å; D594-M597 PolarHBondContact O-N 3.49Å; D594-M597 VanDerWaalsContact O-N 3.16Å
598	S	66.9	Low	72.8	Confident	10 Å²	10	61 Å²	61	7%	0.07	34%	0.335	C	S	.	.			trans	-84.4	168.8	171.5	74	0	0	0	0	111.9	L600 G601 L602 S605	S598-L600 PolarHBondContact O-N 3.17Å; S598-L600 PolarHBondContact OG-N 3.4Å; S598-G601 PolarHBondContact O-N 2.99Å; S598-L602 PolarHBondContact N-O 3.08Å; S598-L602 PolarHBondContact OG-O 2.91Å; S598-S605 WeakPolarHBondContact CB-OG 3.45Å; S598-S605 PolarHBondContact OG-OG 3.3Å
599	N	53.4	Low	72.6	Confident	158 Å²	158	64.1 Å²	64.1	85%	0.845	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.1	175.8	-66	-6.6	0	0	0	113.2	G601	N599-G601 PolarHBondContact O-N 3.05Å
600	L	51.4	Low	72.4	Confident	121 Å²	121	65 Å²	65	63%	0.634	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.7	175.1	-63.4	165.6	0	0	0	112.9	S598 L602	S598-L600 PolarHBondContact O-N 3.17Å; S598-L600 PolarHBondContact OG-N 3.4Å; L600-L602 PolarHBondContact O-N 3.18Å
601	G	53.2	Low	72.7	Confident	39 Å²	39	67.1 Å²	67.1	40%	0.402	37%	0.366	S	S	.	.	S	Bend	trans	70.7	16.5	-175.6	0	0	0	0	0	113.6	S598 N599	S598-G601 PolarHBondContact O-N 2.99Å; N599-G601 PolarHBondContact O-N 3.05Å
602	L	59.7	Low	73.4	Confident	94 Å²	94	63 Å²	63	49%	0.492	36%	0.357	S	S	.	.			trans	-107.4	138.5	178.6	-65.9	175.9	0	0	0	110.1	S598 L600 C604 S605	S598-L602 PolarHBondContact N-O 3.08Å; S598-L602 PolarHBondContact OG-O 2.91Å; L600-L602 PolarHBondContact O-N 3.18Å; L602-C604 PolarHBondContact O-N 3.32Å; L602-S605 PolarHBondContact O-N 3.06Å
603	L	69.1	Low	73.8	Confident	71 Å²	71	57.3 Å²	57.3	37%	0.372	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-69.3	120.3	177.9	-158.3	134.5	0	0	0	109	T593 C596 S605 G606 C610	T593-L603 HydrophobicContact CG2-CD1 4.04Å; C596-L603 HydrophobicContact CB-CG 4.34Å; L603-S605 PolarHBondContact O-N 2.79Å; L603-S605 VanDerWaalsContact O-N 3.16Å; L603-G606 PolarHBondContact O-N 2.81Å; L603-C610 HydrophobicContact CD2-CB 3.43Å; L603-C610 VanDerWaalsContact CD2-CB 3.43Å; L603-C610 HydrophobicContact CG-CB 4.18Å
604	C	80.3	Confident	74.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	50.2	37.3	-173.5	-52.9	0	0	0	0	113.3	C596 L602 G606 R607 C615 T626	C596-C604 PolarHBondContact O-N 3.16Å; L602-C604 PolarHBondContact O-N 3.32Å; C604-G606 PolarHBondContact O-N 3.47Å; C604-R607 PolarHBondContact O-N 3.01Å; C604-C615 WeakPolarHBondContact CA-SG 3.26Å; C604-C615 HydrophobicContact CB-CB 3.66Å; C604-C615 WeakPolarHBondContact CB-SG 3.48Å; C604-C615 WeakPolarHBondContact SG-CA 3.12Å; C604-C615 WeakPolarHBondContact SG-CB 3.41Å; C604-C615 CovalentContact SG-SG 2.03Å; C604-C615 PolarHBondContact SG-SG 2.65Å; C604-T626 CarbonylContact C-O 3.44Å; C604-T626 VanDerWaalsContact CA-O 3.3Å; C604-T626 WeakPolarHBondContact CA-O 3.32Å
605	S	76	Confident	75.4	Confident	13 Å²	13	56.9 Å²	56.9	9%	0.091	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	54.5	18.3	-176.7	-55	0	0	0	0	114.4	S598 L602 L603 R607 T626	S598-S605 WeakPolarHBondContact CB-OG 3.45Å; S598-S605 PolarHBondContact OG-OG 3.3Å; L602-S605 PolarHBondContact O-N 3.06Å; L603-S605 PolarHBondContact O-N 2.79Å; L603-S605 VanDerWaalsContact O-N 3.16Å; S605-R607 PolarHBondContact O-N 3.38Å; S605-T626 WeakPolarHBondContact CB-O 3.45Å; S605-T626 PolarHBondContact N-O 3.23Å; S605-T626 PolarHBondContact OG-O 3.5Å
606	G	75.2	Confident	76.2	Confident	61 Å²	61	58.8 Å²	58.8	63%	0.629	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	70.2	8.4	-172	0	0	0	0	0	114.5	L603 C604	L603-G606 PolarHBondContact O-N 2.81Å; C604-G606 PolarHBondContact O-N 3.47Å
607	R	82.1	Confident	76.7	Confident	56 Å²	56	60.8 Å²	60.8	21%	0.211	36%	0.356	C	S	.	.	S	Bend	trans	-108.7	8	-175.3	-54.5	-165.1	176	152.8	-5.6	113.4	C604 S605 T618 Q619 A622 C627 D628 C630	C604-R607 PolarHBondContact O-N 3.01Å; S605-R607 PolarHBondContact O-N 3.38Å; R607-T618 PolarHBondContact O-N 3.23Å; R607-T618 PolarHBondContact O-OG1 3.29Å; R607-Q619 HydrophobicContact CB-CB 3.94Å; R607-Q619 PolarHBondContact O-N 3.48Å; R607-A622 HydrophobicContact CB-CB 4.26Å; R607-C627 HydrophobicContact CB-CB 3.92Å; R607-C627 WeakPolarHBondContact CD-O 3.49Å; R607-D628 PolarHBondContact NH1-O 2.83Å; R607-D628 VanDerWaalsContact NH1-O 3.08Å; R607-C630 VanDerWaalsContact NH1-CB 3.25Å
608	G	85.4	Confident	77.6	Confident	14 Å²	14	61.6 Å²	61.6	14%	0.144	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	-176.6	-175.9	0	0	0	0	0	113.3	E616	G608-E616 CarbonylContact C-O 3.48Å; G608-E616 WeakPolarHBondContact CA-O 3.01Å
609	Q	86.2	Confident	78.3	Confident	128 Å²	128	64.2 Å²	64.2	60%	0.598	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	139.7	176.5	-63	-173.9	-4.8	0	0	109.9	V611 E616 T618	Q609-V611 HydrophobicContact CB-CG2 4.45Å; Q609-V611 PolarHBondContact O-N 3.08Å; Q609-E616 PolarHBondContact N-O 3.3Å; Q609-E616 PolarHBondContact O-N 2.91Å; Q609-T618 HydrophobicContact CG-CG2 4.28Å
610	C	84.6	Confident	79.6	Confident	32 Å²	32	62 Å²	62	22%	0.216	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	109.7	174.4	-175.3	0	0	0	0	109.4	C596 L603 V614	C596-C610 HydrophobicContact CB-CB 3.51Å; C596-C610 WeakPolarHBondContact CB-SG 3.23Å; C596-C610 WeakPolarHBondContact SG-CB 3.03Å; C596-C610 CovalentContact SG-SG 2.04Å; C596-C610 PolarHBondContact SG-SG 2.8Å; L603-C610 HydrophobicContact CD2-CB 3.43Å; L603-C610 VanDerWaalsContact CD2-CB 3.43Å; L603-C610 HydrophobicContact CG-CB 4.18Å; C610-V614 CarbonylContact C-O 3.12Å; C610-V614 WeakPolarHBondContact CA-O 3.11Å
611	V	89.4	Confident	81	Confident	64 Å²	64	58.1 Å²	58.1	39%	0.388	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119	178.1	-175.9	0	0	0	0	107.7	Q609 G613 V614 E616	Q609-V611 HydrophobicContact CB-CG2 4.45Å; Q609-V611 PolarHBondContact O-N 3.08Å; V611-G613 VanDerWaalsContact C-N 3.26Å; V611-G613 PolarHBondContact O-N 2.87Å; V611-V614 PolarHBondContact N-O 3.2Å; V611-V614 PolarHBondContact O-N 2.79Å; V611-E616 HydrophobicContact CG2-CB 4.35Å
612	C	87.1	Confident	82.4	Confident	51 Å²	51	56.8 Å²	56.8	35%	0.345	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	29.6	179.4	-52.5	0	0	0	0	115.4	C589 S590 V614	C589-C612 HydrophobicContact CB-CB 3.89Å; C589-C612 WeakPolarHBondContact CB-SG 2.97Å; C589-C612 WeakPolarHBondContact SG-CA 2.96Å; C589-C612 WeakPolarHBondContact SG-CB 3.38Å; C589-C612 CovalentContact SG-SG 2.03Å; C589-C612 PolarHBondContact SG-SG 3.47Å; S590-C612 CarbonylContact O-C 3.44Å; S590-C612 WeakPolarHBondContact O-CA 3.46Å; C612-V614 VanDerWaalsContact C-N 3.33Å
613	G	81.3	Confident	83.6	Confident	10 Å²	10	58.3 Å²	58.3	10%	0.103	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	12.3	-175.3	0	0	0	0	0	114.5	R592 T595 V611	R592-G613 VanDerWaalsContact O-CA 3.27Å; R592-G613 WeakPolarHBondContact O-CA 2.97Å; T595-G613 PolarHBondContact OG1-O 2.61Å; V611-G613 VanDerWaalsContact C-N 3.26Å; V611-G613 PolarHBondContact O-N 2.87Å
614	V	89.4	Confident	84.1	Confident	100 Å²	100	56.4 Å²	56.4	61%	0.606	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.5	175.9	-176.7	0	0	0	0	109.3	C596 C610 V611 C612 E616	C596-V614 PolarHBondContact SG-N 2.99Å; C610-V614 CarbonylContact C-O 3.12Å; C610-V614 WeakPolarHBondContact CA-O 3.11Å; V611-V614 PolarHBondContact N-O 3.2Å; V611-V614 PolarHBondContact O-N 2.79Å; C612-V614 VanDerWaalsContact C-N 3.33Å; V614-E616 PolarHBondContact O-N 2.71Å
615	C	87.8	Confident	84.1	Confident	14 Å²	14	60.4 Å²	60.4	10%	0.095	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	121.9	177.1	-73.4	0	0	0	0	112	C596 C604 A625	C596-C615 VanDerWaalsContact CB-SG 3.54Å; C604-C615 WeakPolarHBondContact CA-SG 3.26Å; C604-C615 HydrophobicContact CB-CB 3.66Å; C604-C615 WeakPolarHBondContact CB-SG 3.48Å; C604-C615 WeakPolarHBondContact SG-CA 3.12Å; C604-C615 WeakPolarHBondContact SG-CB 3.41Å; C604-C615 CovalentContact SG-SG 2.03Å; C604-C615 PolarHBondContact SG-SG 2.65Å; C615-A625 WeakPolarHBondContact CB-O 3.47Å
616	E	93.2	Very high	84.4	Confident	122 Å²	122	60.8 Å²	60.8	57%	0.57	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	106.2	168	-167.5	169.4	-168.4	0	0	108.6	G608 Q609 V611 V614 T618	G608-E616 CarbonylContact C-O 3.48Å; G608-E616 WeakPolarHBondContact CA-O 3.01Å; Q609-E616 PolarHBondContact N-O 3.3Å; Q609-E616 PolarHBondContact O-N 2.91Å; V611-E616 HydrophobicContact CG2-CB 4.35Å; V614-E616 PolarHBondContact O-N 2.71Å; E616-T618 PolarHBondContact O-N 3.31Å
617	C	89.8	Confident	84.9	Confident	43 Å²	43	57.9 Å²	57.9	29%	0.291	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	115.9	-174.1	-51.1	0	0	0	0	110.6	A622 C627	C617-A622 HydrophobicContact CB-CB 4.3Å; C617-A622 WeakPolarHBondContact CB-O 3.31Å; C617-C627 WeakPolarHBondContact CA-SG 3.34Å; C617-C627 HydrophobicContact CB-CB 3.88Å; C617-C627 WeakPolarHBondContact CB-SG 3.35Å; C617-C627 WeakPolarHBondContact SG-CA 3.29Å; C617-C627 WeakPolarHBondContact SG-CB 3.24Å; C617-C627 CovalentContact SG-SG 2.03Å; C617-C627 PolarHBondContact SG-SG 3.38Å
618	T	87.3	Confident	84.5	Confident	93 Å²	93	58.9 Å²	58.9	57%	0.571	36%	0.357	S	S	*	.			trans	-88.4	-21.6	178.8	54.9	0	0	0	0	112	R607 Q609 E616	R607-T618 PolarHBondContact O-N 3.23Å; R607-T618 PolarHBondContact O-OG1 3.29Å; Q609-T618 HydrophobicContact CG-CG2 4.28Å; E616-T618 PolarHBondContact O-N 3.31Å
619	Q	82.6	Confident	84.1	Confident	65 Å²	65	63.6 Å²	63.6	30%	0.304	37%	0.374	S	S	.	.	S	Bend	trans	-78.8	127.5	179.2	-170.7	164	2.2	0	0	111.2	R607 G621 A622 C633	R607-Q619 HydrophobicContact CB-CB 3.94Å; R607-Q619 PolarHBondContact O-N 3.48Å; Q619-G621 PolarHBondContact O-N 3.2Å; Q619-A622 HydrophobicContact CB-CB 4Å; Q619-A622 WeakPolarHBondContact O-CB 3.19Å; Q619-A622 PolarHBondContact O-N 3.21Å; Q619-A622 VanDerWaalsContact O-N 3.08Å; Q619-C633 PolarHBondContact NE2-SG 3.26Å
620	P	81.5	Confident	83.6	Confident	110 Å²	110	58.5 Å²	58.5	71%	0.714	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	123.2	-178.6	-25.3	33.9	0	0	0	113	A622	P620-A622 VanDerWaalsContact C-N 3.26Å; P620-A622 PolarHBondContact O-N 3.42Å
621	G	79.5	Confident	83.1	Confident	40 Å²	40	61.6 Å²	61.6	41%	0.412	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	6.3	179.5	0	0	0	0	0	115.6	Q619 T632	Q619-G621 PolarHBondContact O-N 3.2Å; G621-T632 WeakPolarHBondContact CA-OG1 3.3Å
622	A	83.9	Confident	82.3	Confident	12 Å²	12	63.5 Å²	63.5	10%	0.099	38%	0.384	C	S	.	.			trans	-78.9	136.5	162.5	0	0	0	0	0	110.3	R607 C617 Q619 P620 C627 K629 C630	R607-A622 HydrophobicContact CB-CB 4.26Å; C617-A622 HydrophobicContact CB-CB 4.3Å; C617-A622 WeakPolarHBondContact CB-O 3.31Å; Q619-A622 HydrophobicContact CB-CB 4Å; Q619-A622 WeakPolarHBondContact O-CB 3.19Å; Q619-A622 PolarHBondContact O-N 3.21Å; Q619-A622 VanDerWaalsContact O-N 3.08Å; P620-A622 VanDerWaalsContact C-N 3.26Å; P620-A622 PolarHBondContact O-N 3.42Å; A622-C627 HydrophobicContact CB-CB 4.49Å; A622-K629 CarbonylContact C-O 3.2Å; A622-K629 WeakPolarHBondContact CA-O 3.03Å; A622-C630 HydrophobicContact CB-CB 3.98Å
623	Y	83.4	Confident	81.5	Confident	125 Å²	125	61.9 Å²	61.9	49%	0.49	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-150.6	179.5	179	68.2	-90.8	0	0	0	110.6	C627 K629 P631	Y623-C627 CarbonylContact O-C 3.03Å; Y623-C627 WeakPolarHBondContact O-CA 3.36Å; Y623-K629 HydrophobicContact CD1-CB 4.3Å; Y623-K629 HydrophobicContact CD2-CB 3.95Å; Y623-K629 HydrophobicContact CD2-CD 4.2Å; Y623-K629 HydrophobicContact CE1-CB 4.06Å; Y623-K629 HydrophobicContact CE2-CB 3.64Å; Y623-K629 HydrophobicContact CE2-CD 3.59Å; Y623-K629 HydrophobicContact CE2-CG 4.24Å; Y623-K629 HydrophobicContact CG-CB 4.26Å; Y623-K629 PolarHBondContact N-O 2.04Å; Y623-K629 WeakPolarHBondContact O-CB 3.41Å; Y623-K629 PolarHBondContact O-N 2.77Å; Y623-K629 VanDerWaalsContact O-N 3.1Å; Y623-K629 VanDerWaalsContact O-O 3.13Å; Y623-P631 HydrophobicContact CE1-CG 3.76Å
624	G	80.7	Confident	80.9	Confident	31 Å²	31	64.9 Å²	64.9	32%	0.32	39%	0.391	S	S	.	.	S	Bend	trans	101.6	166.1	-174.2	0	0	0	0	0	111.6	T626 C627	G624-T626 PolarHBondContact O-N 3.27Å; G624-T626 VanDerWaalsContact O-N 3.14Å; G624-C627 PolarHBondContact O-N 3.48Å
625	A	80.6	Confident	80	Confident	84 Å²	84	64.4 Å²	64.4	69%	0.694	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.8	-174.1	0	0	0	0	0	113.2	C615	C615-A625 WeakPolarHBondContact CB-O 3.47Å
626	T	82.5	Confident	79.3	Confident	22 Å²	22	65.6 Å²	65.6	14%	0.135	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	22	178.2	65.2	0	0	0	0	112.9	C604 S605 G624 D628	C604-T626 CarbonylContact C-O 3.44Å; C604-T626 VanDerWaalsContact CA-O 3.3Å; C604-T626 WeakPolarHBondContact CA-O 3.32Å; S605-T626 WeakPolarHBondContact CB-O 3.45Å; S605-T626 PolarHBondContact N-O 3.23Å; S605-T626 PolarHBondContact OG-O 3.5Å; G624-T626 PolarHBondContact O-N 3.27Å; G624-T626 VanDerWaalsContact O-N 3.14Å; T626-D628 PolarHBondContact O-N 3.32Å; T626-D628 VanDerWaalsContact O-N 3.16Å
627	C	84.5	Confident	78.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	55.8	26.7	-178.2	-49.9	0	0	0	0	114.6	R607 C617 A622 Y623 G624	R607-C627 HydrophobicContact CB-CB 3.92Å; R607-C627 WeakPolarHBondContact CD-O 3.49Å; C617-C627 WeakPolarHBondContact CA-SG 3.34Å; C617-C627 HydrophobicContact CB-CB 3.88Å; C617-C627 WeakPolarHBondContact CB-SG 3.35Å; C617-C627 WeakPolarHBondContact SG-CA 3.29Å; C617-C627 WeakPolarHBondContact SG-CB 3.24Å; C617-C627 CovalentContact SG-SG 2.03Å; C617-C627 PolarHBondContact SG-SG 3.38Å; A622-C627 HydrophobicContact CB-CB 4.49Å; Y623-C627 CarbonylContact O-C 3.03Å; Y623-C627 WeakPolarHBondContact O-CA 3.36Å; G624-C627 PolarHBondContact O-N 3.48Å
628	D	74.8	Confident	78.3	Confident	77 Å²	77	62.1 Å²	62.1	41%	0.412	38%	0.382	S	S	.	.			trans	-73.6	-35.1	-178.1	56.6	-51.3	0	0	0	112.1	R607 T626	R607-D628 PolarHBondContact NH1-O 2.83Å; R607-D628 VanDerWaalsContact NH1-O 3.08Å; T626-D628 PolarHBondContact O-N 3.32Å; T626-D628 VanDerWaalsContact O-N 3.16Å
629	K	76.4	Confident	77.9	Confident	113 Å²	113	62.5 Å²	62.5	49%	0.491	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-86.8	117.2	-176.4	-56.4	-179.6	-177.5	-179.5	0	109.9	A622 Y623	A622-K629 CarbonylContact C-O 3.2Å; A622-K629 WeakPolarHBondContact CA-O 3.03Å; Y623-K629 HydrophobicContact CD1-CB 4.3Å; Y623-K629 HydrophobicContact CD2-CB 3.95Å; Y623-K629 HydrophobicContact CD2-CD 4.2Å; Y623-K629 HydrophobicContact CE1-CB 4.06Å; Y623-K629 HydrophobicContact CE2-CB 3.64Å; Y623-K629 HydrophobicContact CE2-CD 3.59Å; Y623-K629 HydrophobicContact CE2-CG 4.24Å; Y623-K629 HydrophobicContact CG-CB 4.26Å; Y623-K629 PolarHBondContact N-O 2.04Å; Y623-K629 WeakPolarHBondContact O-CB 3.41Å; Y623-K629 PolarHBondContact O-N 2.77Å; Y623-K629 VanDerWaalsContact O-N 3.1Å; Y623-K629 VanDerWaalsContact O-O 3.13Å
630	C	76.2	Confident	77.9	Confident	20 Å²	20	61.2 Å²	61.2	14%	0.135	37%	0.372	C	S	.	.			trans	-145.3	83	175.6	-169.8	0	0	0	0	111.4	R607 A622 T632 C633	R607-C630 VanDerWaalsContact NH1-CB 3.25Å; A622-C630 HydrophobicContact CB-CB 3.98Å; C630-T632 PolarHBondContact O-N 2.87Å; C630-C633 HydrophobicContact CB-CB 3.7Å; C630-C633 WeakPolarHBondContact CB-SG 3.46Å; C630-C633 WeakPolarHBondContact O-CB 3.04Å; C630-C633 PolarHBondContact O-N 3.29Å; C630-C633 VanDerWaalsContact SG-CA 3.58Å; C630-C633 WeakPolarHBondContact SG-CB 3.38Å; C630-C633 PolarHBondContact SG-N 2.03Å; C630-C633 CovalentContact SG-SG 2.02Å; C630-C633 PolarHBondContact SG-SG 3.02Å
631	P	73.9	Confident	78.1	Confident	97 Å²	97	59.6 Å²	59.6	63%	0.63	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.1	-179.5	-21.2	33.6	0	0	0	114	Y623	Y623-P631 HydrophobicContact CE1-CG 3.76Å
632	T	72.8	Confident	78.4	Confident	104 Å²	104	62.2 Å²	62.2	64%	0.638	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-0.4	179.6	58.3	0	0	0	0	113.1	G621 C630	G621-T632 WeakPolarHBondContact CA-OG1 3.3Å; C630-T632 PolarHBondContact O-N 2.87Å
633	C	68.4	Low	78.5	Confident	17 Å²	17	62 Å²	62	12%	0.115	35%	0.353	C	S	.	.	S	Bend	trans	-65.4	153.2	170.5	-79.1	0	0	0	0	109.1	Q619 C630 D635	Q619-C633 PolarHBondContact NE2-SG 3.26Å; C630-C633 HydrophobicContact CB-CB 3.7Å; C630-C633 WeakPolarHBondContact CB-SG 3.46Å; C630-C633 WeakPolarHBondContact O-CB 3.04Å; C630-C633 PolarHBondContact O-N 3.29Å; C630-C633 VanDerWaalsContact SG-CA 3.58Å; C630-C633 WeakPolarHBondContact SG-CB 3.38Å; C630-C633 PolarHBondContact SG-N 2.03Å; C630-C633 CovalentContact SG-SG 2.02Å; C630-C633 PolarHBondContact SG-SG 3.02Å; C633-D635 PolarHBondContact O-N 3.19Å
634	P	69.4	Low	78.7	Confident	74 Å²	74	56.1 Å²	56.1	48%	0.481	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-48.5	134.7	168.4	-22	31.5	0	0	0	109	T638	P634-T638 HydrophobicContact CB-CG2 3.94Å
635	D	70.3	Confident	79.1	Confident	89 Å²	89	55.5 Å²	55.5	48%	0.476	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-57.4	159.8	179.7	62.2	-9.8	0	0	0	111.1	C633 C637 T638 M639	C633-D635 PolarHBondContact O-N 3.19Å; D635-C637 PolarHBondContact O-N 3.16Å; D635-T638 PolarHBondContact O-N 3.18Å; D635-T638 VanDerWaalsContact OD1-CB 3.24Å; D635-T638 WeakPolarHBondContact OD1-CB 3.45Å; D635-T638 PolarHBondContact OD1-N 3.43Å; D635-T638 PolarHBondContact OD1-OG1 2.91Å; D635-M639 PolarHBondContact O-N 3.3Å
636	A	73.1	Confident	79.4	Confident	40 Å²	40	51.7 Å²	51.7	33%	0.331	29%	0.287	S	S	.	.	H	α-helix	trans	-52.5	-32.3	177.7	0	0	0	0	0	111.2	M639 K640 Y698	A636-M639 PolarHBondContact O-N 3.23Å; A636-K640 WeakPolarHBondContact O-CB 3.3Å; A636-K640 WeakPolarHBondContact O-CG 3.49Å; A636-K640 PolarHBondContact O-N 3.13Å; A636-Y698 HydrophobicContact CB-CD1 4.45Å
637	C	80.4	Confident	79.5	Confident	19 Å²	19	54.6 Å²	54.6	13%	0.128	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-48	174.8	-61.9	0	0	0	0	113.1	D635 M639 K640 K641 C684 F696	D635-C637 PolarHBondContact O-N 3.16Å; C637-M639 PolarHBondContact O-N 3.37Å; C637-K640 PolarHBondContact O-N 2.03Å; C637-K641 WeakPolarHBondContact O-CB 3.15Å; C637-K641 PolarHBondContact O-N 2.7Å; C637-C684 WeakPolarHBondContact CA-SG 3.47Å; C637-C684 HydrophobicContact CB-CB 3.54Å; C637-C684 WeakPolarHBondContact CB-SG 3.2Å; C637-C684 VanDerWaalsContact SG-CA 3.6Å; C637-C684 WeakPolarHBondContact SG-CB 3.15Å; C637-C684 CovalentContact SG-SG 2.03Å; C637-C684 PolarHBondContact SG-SG 3.04Å; C637-F696 HydrophobicContact CB-CZ 4.47Å; C637-F696 WeakPolarHBondContact O-CZ 3.38Å
638	T	82.4	Confident	79.6	Confident	73 Å²	73	57.2 Å²	57.2	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-65.2	-39.9	179.7	-57.9	0	0	0	0	111.9	P634 D635	P634-T638 HydrophobicContact CB-CG2 3.94Å; D635-T638 PolarHBondContact O-N 3.18Å; D635-T638 VanDerWaalsContact OD1-CB 3.24Å; D635-T638 WeakPolarHBondContact OD1-CB 3.45Å; D635-T638 PolarHBondContact OD1-N 3.43Å; D635-T638 PolarHBondContact OD1-OG1 2.91Å
639	M	77.8	Confident	80.1	Confident	100 Å²	100	56.1 Å²	56.1	49%	0.493	30%	0.301	S	S	.	.	H	α-helix	trans	-70.9	-44.7	177.9	-69.7	-172.6	60.3	0	0	112.4	D635 A636 C637 K641 E642	D635-M639 PolarHBondContact O-N 3.3Å; A636-M639 PolarHBondContact O-N 3.23Å; C637-M639 PolarHBondContact O-N 3.37Å; M639-K641 VanDerWaalsContact C-N 3.33Å; M639-E642 PolarHBondContact O-N 3.12Å
640	K	83	Confident	80.5	Confident	39 Å²	39	57.8 Å²	57.8	17%	0.17	31%	0.309	C	S	.	.	H	α-helix	trans	-74.1	-25.8	-177.1	-63	-73.7	172.8	173.6	0	112	A636 C637 E642 C643 V644 D666 F696 Y698 S706 L708	A636-K640 WeakPolarHBondContact O-CB 3.3Å; A636-K640 WeakPolarHBondContact O-CG 3.49Å; A636-K640 PolarHBondContact O-N 3.13Å; C637-K640 PolarHBondContact O-N 2.03Å; K640-E642 VanDerWaalsContact C-N 3.28Å; K640-E642 PolarHBondContact O-N 3.37Å; K640-C643 WeakPolarHBondContact O-CA 3.11Å; K640-C643 WeakPolarHBondContact O-CB 3.18Å; K640-C643 PolarHBondContact O-N 2.91Å; K640-V644 PolarHBondContact O-N 2.72Å; K640-D666 WeakPolarHBondContact CD-OD2 3.23Å; K640-D666 IonicContact NZ-OD1 2.85Å; K640-D666 PolarHBondContact NZ-OD1 3.33Å; K640-D666 IonicContact NZ-OD2 2.69Å; K640-D666 PolarHBondContact NZ-OD2 3.34Å; K640-F696 HydrophobicContact CB-CE2 3.84Å; K640-F696 HydrophobicContact CB-CZ 4.16Å; K640-Y698 HydrophobicContact CD-CD2 4.22Å; K640-Y698 HydrophobicContact CD-CE2 4.33Å; K640-Y698 HydrophobicContact CG-CD2 4.11Å; K640-Y698 HydrophobicContact CG-CE2 4.5Å; K640-S706 PolarHBondContact NZ-OG 2.83Å; K640-L708 HydrophobicContact CB-CD1 4.39Å; K640-L708 HydrophobicContact CB-CD2 3.94Å; K640-L708 HydrophobicContact CD-CD1 4.19Å; K640-L708 HydrophobicContact CD-CD2 4.26Å; K640-L708 HydrophobicContact CG-CD2 4.22Å
641	K	87	Confident	80.9	Confident	76 Å²	76	59.7 Å²	59.7	33%	0.33	31%	0.313	S	S	.	.	H	α-helix	trans	-50.2	-47.9	168.6	169.2	-172.6	167.7	178.9	0	111.4	C637 M639 C643 V644 E645 Y686 F696	C637-K641 WeakPolarHBondContact O-CB 3.15Å; C637-K641 PolarHBondContact O-N 2.7Å; M639-K641 VanDerWaalsContact C-N 3.33Å; K641-C643 PolarHBondContact O-N 2.86Å; K641-V644 PolarHBondContact O-N 3.3Å; K641-V644 VanDerWaalsContact O-N 3.12Å; K641-E645 HydrophobicContact CG-CG 4.43Å; K641-E645 PolarHBondContact O-N 3.44Å; K641-Y686 HydrophobicContact CB-CD1 4.28Å; K641-Y686 HydrophobicContact CB-CE1 4.34Å; K641-Y686 HydrophobicContact CD-CD1 4.15Å; K641-Y686 HydrophobicContact CD-CD2 3.72Å; K641-Y686 HydrophobicContact CD-CE2 4.17Å; K641-Y686 HydrophobicContact CD-CG 3.7Å; K641-Y686 VanDerWaalsContact CE-CD2 3.45Å; K641-Y686 HydrophobicContact CG-CD1 3.86Å; K641-Y686 HydrophobicContact CG-CD2 3.96Å; K641-Y686 HydrophobicContact CG-CE1 3.85Å; K641-Y686 HydrophobicContact CG-CE2 3.97Å; K641-Y686 HydrophobicContact CG-CG 3.9Å; K641-F696 HydrophobicContact CB-CE1 4.39Å; K641-F696 HydrophobicContact CB-CZ 4.49Å
642	E	85.6	Confident	81.4	Confident	95 Å²	95	56.6 Å²	56.6	44%	0.444	30%	0.298	S	S	.	.	H	α-helix	trans	-60.8	-32	-179.4	-60	-171.4	163	0	0	111.9	M639 K640 C646 L654	M639-E642 PolarHBondContact O-N 3.12Å; K640-E642 VanDerWaalsContact C-N 3.28Å; K640-E642 PolarHBondContact O-N 3.37Å; E642-C646 WeakPolarHBondContact O-CB 3.4Å; E642-C646 PolarHBondContact O-N 2.71Å; E642-L654 HydrophobicContact CB-CD1 3.53Å; E642-L654 HydrophobicContact CB-CG 4.15Å
643	C	85.3	Confident	81.8	Confident	7 Å²	7	58.7 Å²	58.7	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-75	-36.6	175.6	-69.9	0	0	0	0	113.7	K640 K641 K647 C664	K640-C643 WeakPolarHBondContact O-CA 3.11Å; K640-C643 WeakPolarHBondContact O-CB 3.18Å; K640-C643 PolarHBondContact O-N 2.91Å; K641-C643 PolarHBondContact O-N 2.86Å; C643-K647 WeakPolarHBondContact O-CB 2.96Å; C643-K647 PolarHBondContact O-N 3.07Å; C643-C664 WeakPolarHBondContact CA-SG 3.23Å; C643-C664 HydrophobicContact CB-CB 3.57Å; C643-C664 WeakPolarHBondContact CB-SG 3.45Å; C643-C664 WeakPolarHBondContact SG-CA 3.44Å; C643-C664 WeakPolarHBondContact SG-CB 3.03Å; C643-C664 CovalentContact SG-SG 2.03Å; C643-C664 PolarHBondContact SG-SG 2.79Å
644	V	88.1	Confident	82.4	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-50.1	173.7	175	0	0	0	0	109.9	K640 K641 C646 H648 F649 F696 L708 V710	K640-V644 PolarHBondContact O-N 2.72Å; K641-V644 PolarHBondContact O-N 3.3Å; K641-V644 VanDerWaalsContact O-N 3.12Å; V644-C646 VanDerWaalsContact C-N 3.3Å; V644-C646 PolarHBondContact O-N 2.97Å; V644-H648 VanDerWaalsContact O-CB 3.28Å; V644-H648 WeakPolarHBondContact O-CB 3.45Å; V644-H648 PolarHBondContact O-N 3.14Å; V644-F649 HydrophobicContact CG1-CD2 4.19Å; V644-F649 HydrophobicContact CG1-CE2 3.94Å; V644-F649 PolarHBondContact O-N 2.03Å; V644-F696 HydrophobicContact CG2-CB 4.49Å; V644-F696 HydrophobicContact CG2-CD1 4.33Å; V644-F696 HydrophobicContact CG2-CD2 4.25Å; V644-F696 HydrophobicContact CG2-CG 4.12Å; V644-L708 HydrophobicContact CG2-CD1 4.33Å; V644-V710 HydrophobicContact CG1-CG1 3.95Å; V644-V710 HydrophobicContact CG1-CG2 3.98Å; V644-V710 HydrophobicContact CG2-CG2 3.88Å
645	E	87.8	Confident	83.1	Confident	18 Å²	18	58.7 Å²	58.7	8%	0.084	29%	0.291	C	S	.	.	I	π-helix	trans	-55.4	-45.9	175.8	-77	-60.6	152.7	0	0	112.1	K641 F649 K650 R651 Y686	K641-E645 HydrophobicContact CG-CG 4.43Å; K641-E645 PolarHBondContact O-N 3.44Å; E645-F649 CarbonylContact O-C 3.35Å; E645-F649 WeakPolarHBondContact O-CB 3.12Å; E645-F649 PolarHBondContact O-N 3.19Å; E645-K650 PolarHBondContact O-N 3.3Å; E645-R651 CarbonylContact C-O 3.44Å; E645-R651 VanDerWaalsContact C-O 3.22Å; E645-R651 PolarHBondContact O-N 3.32Å; E645-R651 IonicContact OE1-CZ 3.1Å; E645-R651 IonicContact OE1-NE 2.69Å; E645-R651 IonicContact OE1-NH2 2.8Å; E645-R651 PolarHBondContact OE1-NH2 3.06Å; E645-R651 WeakPolarHBondContact OE2-CD 3.4Å; E645-R651 WeakPolarHBondContact OE2-CG 3Å; E645-R651 IonicContact OE2-CZ 2.71Å; E645-R651 IonicContact OE2-NE 3.88Å; E645-R651 PolarHBondContact OE2-NE 2.88Å; E645-R651 IonicContact OE2-NH2 2.8Å; E645-Y686 HydrophobicContact CG-CE2 4.22Å; E645-Y686 WeakPolarHBondContact OE1-CE2 3.19Å; E645-Y686 VanDerWaalsContact OE1-CZ 3.23Å; E645-Y686 PolarHBondContact OE1-OH 3.17Å
646	C	87.8	Confident	83.8	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.027	30%	0.299	C	S	.	.	I	π-helix	trans	-75.3	-44.8	-174.6	-173.9	0	0	0	0	114.3	E642 V644 K650 R651 L654 H655 C660	E642-C646 WeakPolarHBondContact O-CB 3.4Å; E642-C646 PolarHBondContact O-N 2.71Å; V644-C646 VanDerWaalsContact C-N 3.3Å; V644-C646 PolarHBondContact O-N 2.97Å; C646-K650 WeakPolarHBondContact O-CA 3.47Å; C646-R651 PolarHBondContact N-O 2.93Å; C646-L654 HydrophobicContact CB-CB 3.93Å; C646-H655 HydrophobicContact CB-CB 4.37Å; C646-H655 WeakPolarHBondContact SG-CA 3.39Å; C646-H655 PolarHBondContact SG-N 2.89Å; C646-C660 HydrophobicContact CB-CB 4.24Å; C646-C660 WeakPolarHBondContact CB-SG 3.44Å; C646-C660 VanDerWaalsContact SG-CA 3.59Å; C646-C660 WeakPolarHBondContact SG-CB 3.34Å; C646-C660 CovalentContact SG-SG 2Å; C646-C660 PolarHBondContact SG-SG 3.08Å
647	K	84.9	Confident	84.1	Confident	83 Å²	83	63 Å²	63	36%	0.361	31%	0.308	S	S	.	.	I	π-helix	trans	-84	-40.3	-177	-82.6	-163.6	176.1	175.8	0	113.3	C643 C664 D666 I668	C643-K647 WeakPolarHBondContact O-CB 2.96Å; C643-K647 PolarHBondContact O-N 3.07Å; K647-C664 HydrophobicContact CD-CB 4.46Å; K647-C664 WeakPolarHBondContact CE-O 3.35Å; K647-C664 HydrophobicContact CG-CB 4.48Å; K647-C664 PolarHBondContact NZ-O 3.46Å; K647-D666 PolarHBondContact NZ-O 2.03Å; K647-I668 HydrophobicContact CB-CD1 3.49Å; K647-I668 VanDerWaalsContact CB-CD1 3.49Å; K647-I668 HydrophobicContact CD-CD1 3.78Å; K647-I668 HydrophobicContact CD-CG1 4.47Å; K647-I668 HydrophobicContact CG-CD1 4.22Å
648	H	86.8	Confident	83.9	Confident	56 Å²	56	69 Å²	69	26%	0.259	34%	0.339	S	S	.	.	I	π-helix	trans	-89.3	-59	-175.2	-175.8	48.9	0	0	0	111.1	V644 K650 L670	V644-H648 VanDerWaalsContact O-CB 3.28Å; V644-H648 WeakPolarHBondContact O-CB 3.45Å; V644-H648 PolarHBondContact O-N 3.14Å; H648-K650 VanDerWaalsContact C-N 3.33Å; H648-K650 PolarHBondContact O-N 2.78Å; H648-L670 VanDerWaalsContact CE1-CD2 3.41Å; H648-L670 WeakPolarHBondContact CE1-CD2 3.32Å
649	F	84.4	Confident	83.5	Confident	53 Å²	53	67 Å²	67	23%	0.232	33%	0.327	C	S	.	.	I	π-helix	trans	-81.5	-10.9	-177.2	-63.5	-72.3	0	0	0	114	V644 E645 R651 E694	V644-F649 HydrophobicContact CG1-CD2 4.19Å; V644-F649 HydrophobicContact CG1-CE2 3.94Å; V644-F649 PolarHBondContact O-N 2.03Å; E645-F649 CarbonylContact O-C 3.35Å; E645-F649 WeakPolarHBondContact O-CB 3.12Å; E645-F649 PolarHBondContact O-N 3.19Å; F649-R651 VanDerWaalsContact C-N 3.28Å; F649-R651 HydrophobicContact CB-CG 3.88Å; F649-R651 PolarHBondContact O-N 2.98Å; F649-E694 HydrophobicContact CE2-CG 4.36Å; F649-E694 HydrophobicContact CZ-CG 4.4Å; F649-E694 VanDerWaalsContact CZ-OE1 3.27Å; F649-E694 WeakPolarHBondContact CZ-OE1 3.46Å; F649-E694 WeakPolarHBondContact CZ-OE2 3.28Å
650	K	85.6	Confident	83.5	Confident	149 Å²	149	62.8 Å²	62.8	65%	0.648	31%	0.307	S	S	*	.			trans	54	41.9	179.9	-57.5	-177.9	-178.8	177.8	0	113	E645 C646 H648 H655	E645-K650 PolarHBondContact O-N 3.3Å; C646-K650 WeakPolarHBondContact O-CA 3.47Å; H648-K650 VanDerWaalsContact C-N 3.33Å; H648-K650 PolarHBondContact O-N 2.78Å; K650-H655 PolarHBondContact O-CE1 3.21Å; K650-H655 PolarHBondContact O-ND1 2.67Å; K650-H655 PolarHBondContact O-NE2 3.18Å
651	R	84.9	Confident	83	Confident	60 Å²	60	65.7 Å²	65.7	23%	0.226	33%	0.332	C	S	.	.			trans	-141.4	170.3	178.8	66.1	-174.1	177.2	177.4	-6.7	110.9	E645 C646 F649 D688	E645-R651 CarbonylContact C-O 3.44Å; E645-R651 VanDerWaalsContact C-O 3.22Å; E645-R651 PolarHBondContact O-N 3.32Å; E645-R651 IonicContact OE1-CZ 3.1Å; E645-R651 IonicContact OE1-NE 2.69Å; E645-R651 IonicContact OE1-NH2 2.8Å; E645-R651 PolarHBondContact OE1-NH2 3.06Å; E645-R651 WeakPolarHBondContact OE2-CD 3.4Å; E645-R651 WeakPolarHBondContact OE2-CG 3Å; E645-R651 IonicContact OE2-CZ 2.71Å; E645-R651 IonicContact OE2-NE 3.88Å; E645-R651 PolarHBondContact OE2-NE 2.88Å; E645-R651 IonicContact OE2-NH2 2.8Å; C646-R651 PolarHBondContact N-O 2.93Å; F649-R651 VanDerWaalsContact C-N 3.28Å; F649-R651 HydrophobicContact CB-CG 3.88Å; F649-R651 PolarHBondContact O-N 2.98Å; R651-D688 IonicContact CZ-OD2 3.73Å; R651-D688 IonicContact NH1-OD2 3.88Å; R651-D688 PolarHBondContact NH1-OD2 3.32Å; R651-D688 VanDerWaalsContact NH2-CB 3.31Å; R651-D688 IonicContact NH2-OD2 2.6Å; R651-D688 PolarHBondContact NH2-OD2 3.2Å
652	G	83.6	Confident	82	Confident	31 Å²	31	68.1 Å²	68.1	32%	0.32	34%	0.339	S	S	.	.	S	Bend	trans	90.5	174.3	177.3	0	0	0	0	0	115.1	L654 H655 D656	G652-L654 PolarHBondContact O-N 3.09Å; G652-H655 WeakPolarHBondContact O-CA 3.4Å; G652-H655 VanDerWaalsContact O-CB 3.29Å; G652-H655 WeakPolarHBondContact O-CB 3.25Å; G652-H655 PolarHBondContact O-N 2.78Å; G652-D656 PolarHBondContact O-N 3.31Å; G652-D656 VanDerWaalsContact O-N 3.07Å
653	K	81.6	Confident	81.2	Confident	148 Å²	148	67.6 Å²	67.6	64%	0.643	34%	0.338	S	S	*	.	H	α-helix	trans	-55.4	-42.9	-167.3	-170.2	179.1	179.5	-176.3	0	114.9	H655 D656 D657	K653-H655 VanDerWaalsContact C-N 3.25Å; K653-H655 PolarHBondContact O-N 3.44Å; K653-D656 PolarHBondContact O-N 3.39Å; K653-D657 WeakPolarHBondContact O-CB 3.48Å; K653-D657 PolarHBondContact O-N 3.19Å
654	L	81.6	Confident	80.9	Confident	13 Å²	13	67.3 Å²	67.3	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-27.1	179.1	-70.6	-179.2	0	0	0	113.1	E642 C646 G652 T659 C660 I663	E642-L654 HydrophobicContact CB-CD1 3.53Å; E642-L654 HydrophobicContact CB-CG 4.15Å; C646-L654 HydrophobicContact CB-CB 3.93Å; G652-L654 PolarHBondContact O-N 3.09Å; L654-T659 PolarHBondContact O-N 3.49Å; L654-T659 VanDerWaalsContact O-N 3.09Å; L654-C660 PolarHBondContact O-N 3.17Å; L654-I663 HydrophobicContact CD1-CG2 4.4Å; L654-I663 HydrophobicContact CD2-CD1 3.56Å
655	H	84	Confident	80.1	Confident	79 Å²	79	75.2 Å²	75.2	37%	0.366	37%	0.371	S	S	.	.	H	α-helix	trans	-75.8	-46	175.3	-179.6	-91.4	0	0	0	109.9	C646 K650 G652 K653 D657 N658	C646-H655 HydrophobicContact CB-CB 4.37Å; C646-H655 WeakPolarHBondContact SG-CA 3.39Å; C646-H655 PolarHBondContact SG-N 2.89Å; K650-H655 PolarHBondContact O-CE1 3.21Å; K650-H655 PolarHBondContact O-ND1 2.67Å; K650-H655 PolarHBondContact O-NE2 3.18Å; G652-H655 WeakPolarHBondContact O-CA 3.4Å; G652-H655 VanDerWaalsContact O-CB 3.29Å; G652-H655 WeakPolarHBondContact O-CB 3.25Å; G652-H655 PolarHBondContact O-N 2.78Å; K653-H655 VanDerWaalsContact C-N 3.25Å; K653-H655 PolarHBondContact O-N 3.44Å; H655-D657 PolarHBondContact O-N 3.31Å; H655-N658 PolarHBondContact O-N 3Å; H655-N658 VanDerWaalsContact O-N 3.08Å
656	D	83.1	Confident	79.7	Confident	121 Å²	121	75.2 Å²	75.2	65%	0.647	37%	0.372	S	S	*	.	H	α-helix	trans	-64.8	-40.9	-179.4	-58.7	-25.2	0	0	0	112.4	G652 K653 N658	G652-D656 PolarHBondContact O-N 3.31Å; G652-D656 VanDerWaalsContact O-N 3.07Å; K653-D656 PolarHBondContact O-N 3.39Å; D656-N658 PolarHBondContact O-N 2.88Å
657	D	79.4	Confident	79.3	Confident	97 Å²	97	79.6 Å²	79.6	52%	0.519	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-1.3	176.4	-70.5	-19.9	0	0	0	112.9	K653 H655 T659	K653-D657 WeakPolarHBondContact O-CB 3.48Å; K653-D657 PolarHBondContact O-N 3.19Å; H655-D657 PolarHBondContact O-N 3.31Å; D657-T659 HydrophobicContact CB-CG2 4.32Å; D657-T659 PolarHBondContact O-N 2.91Å; D657-T659 VanDerWaalsContact O-N 3.1Å
658	N	76.4	Confident	79.3	Confident	145 Å²	145	77.8 Å²	77.8	78%	0.775	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	29.1	-175.7	-154.5	17.9	0	0	0	113.8	H655 D656	H655-N658 PolarHBondContact O-N 3Å; H655-N658 VanDerWaalsContact O-N 3.08Å; D656-N658 PolarHBondContact O-N 2.88Å
659	T	75.4	Confident	79.2	Confident	33 Å²	33	77.7 Å²	77.7	20%	0.202	39%	0.389	C	S	.	.			trans	-102.7	-1.6	-179.3	53.8	0	0	0	0	113.5	L654 D657 S661 R662 I663	L654-T659 PolarHBondContact O-N 3.49Å; L654-T659 VanDerWaalsContact O-N 3.09Å; D657-T659 HydrophobicContact CB-CG2 4.32Å; D657-T659 PolarHBondContact O-N 2.91Å; D657-T659 VanDerWaalsContact O-N 3.1Å; T659-S661 PolarHBondContact O-N 3.2Å; T659-R662 WeakPolarHBondContact O-CB 3.24Å; T659-R662 PolarHBondContact O-N 2.72Å; T659-I663 PolarHBondContact O-N 3.47Å; T659-I663 VanDerWaalsContact O-N 3.15Å
660	C	77.7	Confident	79.2	Confident	11 Å²	11	78.9 Å²	78.9	7%	0.074	40%	0.397	C	S	.	.	H	α-helix	trans	-41.3	-59.4	177.5	-155.5	0	0	0	0	114.6	C646 L654 R662 I663 C664	C646-C660 HydrophobicContact CB-CB 4.24Å; C646-C660 WeakPolarHBondContact CB-SG 3.44Å; C646-C660 VanDerWaalsContact SG-CA 3.59Å; C646-C660 WeakPolarHBondContact SG-CB 3.34Å; C646-C660 CovalentContact SG-SG 2Å; C646-C660 PolarHBondContact SG-SG 3.08Å; L654-C660 PolarHBondContact O-N 3.17Å; C660-R662 PolarHBondContact O-N 3.25Å; C660-I663 PolarHBondContact O-N 3.42Å; C660-C664 VanDerWaalsContact O-CB 3.23Å; C660-C664 WeakPolarHBondContact O-CB 3.34Å; C660-C664 PolarHBondContact O-N 3.06Å
661	S	71.3	Confident	79.2	Confident	99 Å²	99	73.2 Å²	73.2	69%	0.692	38%	0.375	S	S	*	.	H	α-helix	trans	-68.5	-20.7	-174	-54.2	0	0	0	0	112.8	T659	T659-S661 PolarHBondContact O-N 3.2Å
662	R	66.2	Low	79.1	Confident	128 Å²	128	76.2 Å²	76.2	48%	0.483	40%	0.395	S	S	.	.	H	α-helix	trans	-81	-45.7	179.4	-174	-178.7	68.1	100.4	1.7	111.4	T659 C660	T659-R662 WeakPolarHBondContact O-CB 3.24Å; T659-R662 PolarHBondContact O-N 2.72Å; C660-R662 PolarHBondContact O-N 3.25Å
663	I	70.1	Confident	78.9	Confident	83 Å²	83	82.3 Å²	82.3	43%	0.426	42%	0.416	S	S	.	.	H	α-helix	trans	-87.3	-42	-173.3	-67.2	169.1	0	0	0	110.9	L654 T659 C660 K665	L654-I663 HydrophobicContact CD1-CG2 4.4Å; L654-I663 HydrophobicContact CD2-CD1 3.56Å; T659-I663 PolarHBondContact O-N 3.47Å; T659-I663 VanDerWaalsContact O-N 3.15Å; C660-I663 PolarHBondContact O-N 3.42Å; I663-K665 PolarHBondContact O-N 3.37Å
664	C	78.1	Confident	78.8	Confident	1 Å²	1	77.1 Å²	77.1	1%	0.007	39%	0.394	C	S	.	.			trans	-92.2	85.2	-173.6	-57.2	0	0	0	0	111.2	C643 K647 C660	C643-C664 WeakPolarHBondContact CA-SG 3.23Å; C643-C664 HydrophobicContact CB-CB 3.57Å; C643-C664 WeakPolarHBondContact CB-SG 3.45Å; C643-C664 WeakPolarHBondContact SG-CA 3.44Å; C643-C664 WeakPolarHBondContact SG-CB 3.03Å; C643-C664 CovalentContact SG-SG 2.03Å; C643-C664 PolarHBondContact SG-SG 2.79Å; K647-C664 HydrophobicContact CD-CB 4.46Å; K647-C664 WeakPolarHBondContact CE-O 3.35Å; K647-C664 HydrophobicContact CG-CB 4.48Å; K647-C664 PolarHBondContact NZ-O 3.46Å; C660-C664 VanDerWaalsContact O-CB 3.23Å; C660-C664 WeakPolarHBondContact O-CB 3.34Å; C660-C664 PolarHBondContact O-N 3.06Å
665	K	72.1	Confident	78.2	Confident	167 Å²	167	80.5 Å²	80.5	73%	0.726	42%	0.416	S	S	*	.			trans	-89.1	-6.7	177.9	-65.8	-174.5	-178.7	178.3	0	114	I663	I663-K665 PolarHBondContact O-N 3.37Å
666	D	79	Confident	77	Confident	19 Å²	19	83.1 Å²	83.1	10%	0.102	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-63.1	144.9	-178.8	-52.6	-61.9	0	0	0	111.8	K640 K647 S706 L708	K640-D666 WeakPolarHBondContact CD-OD2 3.23Å; K640-D666 IonicContact NZ-OD1 2.85Å; K640-D666 PolarHBondContact NZ-OD1 3.33Å; K640-D666 IonicContact NZ-OD2 2.69Å; K640-D666 PolarHBondContact NZ-OD2 3.34Å; K647-D666 PolarHBondContact NZ-O 2.03Å; D666-S706 WeakPolarHBondContact OD1-CB 3.42Å; D666-S706 PolarHBondContact OD1-OG 2.04Å; D666-L708 HydrophobicContact CB-CD1 3.73Å; D666-L708 HydrophobicContact CB-CG 4.13Å
667	E	79	Confident	75.5	Confident	95 Å²	95	84.6 Å²	84.6	44%	0.444	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124	171.7	-172.6	170.9	-175.9	0	0	108.6	K705 L708	E667-K705 VanDerWaalsContact OE2-CE 3.26Å; E667-K705 WeakPolarHBondContact OE2-CE 3.45Å; E667-K705 IonicContact OE2-NZ 2.71Å; E667-K705 PolarHBondContact OE2-NZ 3.34Å; E667-L708 PolarHBondContact O-N 2.62Å
668	I	85.4	Confident	74.3	Confident	46 Å²	46	84.2 Å²	84.2	24%	0.236	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.3	179.7	-61.9	179	0	0	0	108.6	K647 L670 L708 V710	K647-I668 HydrophobicContact CB-CD1 3.49Å; K647-I668 VanDerWaalsContact CB-CD1 3.49Å; K647-I668 HydrophobicContact CD-CD1 3.78Å; K647-I668 HydrophobicContact CD-CG1 4.47Å; K647-I668 HydrophobicContact CG-CD1 4.22Å; I668-L670 HydrophobicContact CG2-CD2 4.34Å; I668-L708 CarbonylContact C-O 3.54Å; I668-L708 WeakPolarHBondContact CA-O 3.35Å; I668-L708 HydrophobicContact CG1-CB 4.24Å; I668-L708 HydrophobicContact CG1-CD1 4.34Å; I668-V710 HydrophobicContact CG2-CB 4.37Å; I668-V710 HydrophobicContact CG2-CG2 3.82Å
669	V	85.3	Confident	73.3	Confident	54 Å²	54	84 Å²	84	33%	0.327	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.5	175.8	-177.5	0	0	0	0	108.3	V671 I707 L708 F709 V710	V669-V671 HydrophobicContact CG1-CG1 4.34Å; V669-I707 HydrophobicContact CG2-CG2 4.06Å; V669-L708 PolarHBondContact N-O 3.27Å; V669-F709 HydrophobicContact CB-CD1 3.8Å; V669-F709 HydrophobicContact CB-CE1 4.02Å; V669-F709 HydrophobicContact CG1-CD1 4.07Å; V669-F709 HydrophobicContact CG1-CE1 4.18Å; V669-F709 HydrophobicContact CG2-CE1 4.32Å; V669-F709 CarbonylContact O-C 3.55Å; V669-F709 WeakPolarHBondContact O-CA 2.98Å; V669-V710 PolarHBondContact O-N 3.47Å
670	L	84.1	Confident	72.7	Confident	78 Å²	78	87.7 Å²	87.7	41%	0.408	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	124.5	178.6	-60.8	178.4	0	0	0	110.2	H648 I668 V710 K712	H648-L670 VanDerWaalsContact CE1-CD2 3.41Å; H648-L670 WeakPolarHBondContact CE1-CD2 3.32Å; I668-L670 HydrophobicContact CG2-CD2 4.34Å; L670-V710 WeakPolarHBondContact CA-O 3.42Å; L670-V710 HydrophobicContact CD2-CB 4.13Å; L670-V710 HydrophobicContact CD2-CG1 4.49Å; L670-K712 HydrophobicContact CB-CG 3.89Å
671	V	85.8	Confident	72.5	Confident	30 Å²	30	88.5 Å²	88.5	18%	0.182	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	152.4	-178.3	-62.7	0	0	0	0	110.6	V669 I674 F709 V710 V711 K712	V669-V671 HydrophobicContact CG1-CG1 4.34Å; V671-I674 HydrophobicContact CG2-CG1 4.44Å; V671-F709 HydrophobicContact CG1-CB 4.28Å; V671-F709 HydrophobicContact CG1-CD1 3.83Å; V671-F709 HydrophobicContact CG2-CB 4.15Å; V671-V710 PolarHBondContact N-O 3.14Å; V671-V711 WeakPolarHBondContact O-CA 3.36Å; V671-K712 PolarHBondContact O-N 3.16Å
672	D	81.9	Confident	73	Confident	123 Å²	123	87 Å²	87	66%	0.658	45%	0.449	S	S	*	.	S	Bend	trans	-80.2	-33.8	175	-60.7	-48.5	0	0	0	111	K712	D672-K712 WeakPolarHBondContact OD1-CD 3.26Å; D672-K712 WeakPolarHBondContact OD1-CE 3.45Å; D672-K712 IonicContact OD1-NZ 3.38Å; D672-K712 PolarHBondContact OD1-NZ 2.79Å; D672-K712 IonicContact OD2-NZ 2.79Å; D672-K712 PolarHBondContact OD2-NZ 2.87Å
673	E	79.9	Confident	74	Confident	159 Å²	159	85 Å²	85	74%	0.743	45%	0.448	S	S	*	.	S	Bend	trans	-146.5	146.7	175.9	-164.7	175	-172.9	0	0	109.9	V675	E673-V675 PolarHBondContact O-N 2.97Å
674	I	78.8	Confident	74.8	Confident	38 Å²	38	81.3 Å²	81.3	20%	0.195	43%	0.429	C	S	.	.			trans	-80.5	110.6	177.9	-61.3	172.8	0	0	0	108.8	V671 H695 Q697 V711	V671-I674 HydrophobicContact CG2-CG1 4.44Å; I674-H695 HydrophobicContact CD1-CB 4Å; I674-Q697 HydrophobicContact CD1-CB 4.28Å; I674-Q697 HydrophobicContact CG2-CB 3.79Å; I674-Q697 HydrophobicContact CG2-CG 4.26Å; I674-V711 HydrophobicContact CD1-CG2 3.9Å; I674-V711 HydrophobicContact CG1-CG2 3.68Å
675	V	70.3	Confident	75.2	Confident	85 Å²	85	85 Å²	85	52%	0.515	46%	0.455	S	S	.	.			trans	-91.7	120.4	177.5	-163.1	0	0	0	0	110.2	E673 H677	E673-V675 PolarHBondContact O-N 2.97Å; V675-H677 WeakPolarHBondContact CG1-CD2 3.22Å; V675-H677 WeakPolarHBondContact CG1-NE2 3Å; V675-H677 PolarHBondContact O-N 3.1Å; V675-H677 VanDerWaalsContact O-N 3.12Å
676	L	58	Low	76	Confident	133 Å²	133	78.2 Å²	78.2	70%	0.696	43%	0.425	S	S	*	.			trans	-71.9	99.3	176.8	-95	138.4	0	0	0	110.5
677	H	51.7	Low	76.3	Confident	152 Å²	152	83.5 Å²	83.5	70%	0.704	45%	0.447	S	S	*	.			trans	-116.9	-14.4	178.9	-82.6	-55.4	0	0	0	116.1	V675	V675-H677 WeakPolarHBondContact CG1-CD2 3.22Å; V675-H677 WeakPolarHBondContact CG1-NE2 3Å; V675-H677 PolarHBondContact O-N 3.1Å; V675-H677 VanDerWaalsContact O-N 3.12Å
678	D	54.1	Low	76.5	Confident	89 Å²	89	79.9 Å²	79.9	48%	0.476	43%	0.431	S	S	.	.			trans	-141	147.7	-172.9	-83.2	-41.6	0	0	0	115	N680 Y699	D678-N680 PolarHBondContact O-N 3.07Å; D678-Y699 HydrophobicContact CB-CD2 4.24Å; D678-Y699 HydrophobicContact CB-CE2 3.71Å; D678-Y699 WeakPolarHBondContact OD2-CE2 3.5Å; D678-Y699 PolarHBondContact OD2-OH 3.49Å
679	T	55.3	Low	76.1	Confident	141 Å²	141	86.3 Å²	86.3	87%	0.865	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-8.9	179.1	47.8	0	0	0	0	114.8
680	N	62.5	Low	75.7	Confident	111 Å²	111	88.9 Å²	88.9	59%	0.594	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	20.1	-177.5	-71.7	-2.4	0	0	0	113.6	D678	D678-N680 PolarHBondContact O-N 3.07Å
681	A	73.7	Confident	75.5	Confident	28 Å²	28	90 Å²	90	23%	0.231	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.7	178.1	0	0	0	0	0	111.9	Q697 Y698 Y699	A681-Q697 HydrophobicContact CB-CG 3.91Å; A681-Y698 CarbonylContact C-O 3.59Å; A681-Y698 WeakPolarHBondContact CA-O 3.43Å; A681-Y699 HydrophobicContact CB-CD2 4.19Å
682	V	82.3	Confident	75.5	Confident	67 Å²	67	89 Å²	89	41%	0.406	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.6	177	-176.2	0	0	0	0	109.2	Q697 Y698	V682-Q697 WeakPolarHBondContact O-CA 3.28Å; V682-Y698 HydrophobicContact CB-CD1 4.28Å; V682-Y698 HydrophobicContact CG2-CD1 4.25Å; V682-Y698 PolarHBondContact N-O 3.26Å; V682-Y698 PolarHBondContact O-N 3.5Å
683	N	85.9	Confident	75.8	Confident	86 Å²	86	85.2 Å²	85.2	46%	0.46	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.3	174.9	-67	-8.3	0	0	0	109.6	Q697	N683-Q697 VanDerWaalsContact OD1-CG 3.28Å; N683-Q697 WeakPolarHBondContact OD1-CG 3.38Å; N683-Q697 PolarHBondContact OD1-NE2 3.44Å
684	C	86.9	Confident	76.2	Confident	6 Å²	6	77.7 Å²	77.7	4%	0.041	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	140.3	-177.8	-57.7	0	0	0	0	109.2	C637 F696	C637-C684 WeakPolarHBondContact CA-SG 3.47Å; C637-C684 HydrophobicContact CB-CB 3.54Å; C637-C684 WeakPolarHBondContact CB-SG 3.2Å; C637-C684 VanDerWaalsContact SG-CA 3.6Å; C637-C684 WeakPolarHBondContact SG-CB 3.15Å; C637-C684 CovalentContact SG-SG 2.03Å; C637-C684 PolarHBondContact SG-SG 3.04Å; C684-F696 WeakPolarHBondContact CA-O 3.46Å; C684-F696 HydrophobicContact CB-CD1 3.81Å; C684-F696 HydrophobicContact CB-CD2 3.92Å; C684-F696 HydrophobicContact CB-CE1 3.39Å; C684-F696 HydrophobicContact CB-CE2 3.51Å; C684-F696 HydrophobicContact CB-CG 4.08Å; C684-F696 HydrophobicContact CB-CZ 3.23Å; C684-F696 PolarHBondContact N-O 3.38Å; C684-F696 PolarHBondContact O-N 2.76Å
685	S	88.4	Confident	76.6	Confident	78 Å²	78	79.1 Å²	79.1	55%	0.545	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	146.9	169.4	60.2	0	0	0	0	110.8	E694	S685-E694 WeakPolarHBondContact CA-O 3Å; S685-E694 WeakPolarHBondContact CB-O 3.34Å
686	Y	87.3	Confident	77.5	Confident	24 Å²	24	75.2 Å²	75.2	9%	0.094	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.7	175.3	69.5	-84.7	0	0	0	110.3	K641 E645 E694 F696	K641-Y686 HydrophobicContact CB-CD1 4.28Å; K641-Y686 HydrophobicContact CB-CE1 4.34Å; K641-Y686 HydrophobicContact CD-CD1 4.15Å; K641-Y686 HydrophobicContact CD-CD2 3.72Å; K641-Y686 HydrophobicContact CD-CE2 4.17Å; K641-Y686 HydrophobicContact CD-CG 3.7Å; K641-Y686 VanDerWaalsContact CE-CD2 3.45Å; K641-Y686 HydrophobicContact CG-CD1 3.86Å; K641-Y686 HydrophobicContact CG-CD2 3.96Å; K641-Y686 HydrophobicContact CG-CE1 3.85Å; K641-Y686 HydrophobicContact CG-CE2 3.97Å; K641-Y686 HydrophobicContact CG-CG 3.9Å; E645-Y686 HydrophobicContact CG-CE2 4.22Å; E645-Y686 WeakPolarHBondContact OE1-CE2 3.19Å; E645-Y686 VanDerWaalsContact OE1-CZ 3.23Å; E645-Y686 PolarHBondContact OE1-OH 3.17Å; Y686-E694 HydrophobicContact CD1-CB 3.99Å; Y686-E694 HydrophobicContact CD2-CB 4.4Å; Y686-E694 HydrophobicContact CE1-CB 3.58Å; Y686-E694 HydrophobicContact CE1-CG 4.28Å; Y686-E694 HydrophobicContact CE2-CB 4.02Å; Y686-E694 HydrophobicContact CE2-CG 3.91Å; Y686-E694 HydrophobicContact CG-CB 4.39Å; Y686-E694 PolarHBondContact N-O 2.91Å; Y686-E694 VanDerWaalsContact N-O 3.11Å; Y686-E694 PolarHBondContact O-N 3.41Å; Y686-F696 HydrophobicContact CD1-CD1 4.08Å; Y686-F696 AromaticContact CD1-CE1 3.76Å; Y686-F696 HydrophobicContact CD1-CE1 3.76Å; Y686-F696 AromaticContact CE1-CD1 3.91Å; Y686-F696 HydrophobicContact CE1-CD1 3.91Å; Y686-F696 AromaticContact CE1-CE1 3.85Å; Y686-F696 HydrophobicContact CE1-CE1 3.85Å
687	K	86.5	Confident	78.9	Confident	130 Å²	130	69.4 Å²	69.4	57%	0.565	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	135	171.6	-73.4	-174.1	174.9	-166.4	0	110.7	C692 V693	K687-C692 WeakPolarHBondContact CA-O 3.22Å; K687-V693 HydrophobicContact CG-CG2 4.16Å
688	D	81.8	Confident	80.5	Confident	19 Å²	19	63.6 Å²	63.6	10%	0.102	34%	0.341	C	S	.	.			trans	-84.7	-177.4	173	89.1	-25.7	0	0	0	112.1	R651 N690 D691 C692 E694	R651-D688 IonicContact CZ-OD2 3.73Å; R651-D688 IonicContact NH1-OD2 3.88Å; R651-D688 PolarHBondContact NH1-OD2 3.32Å; R651-D688 VanDerWaalsContact NH2-CB 3.31Å; R651-D688 IonicContact NH2-OD2 2.6Å; R651-D688 PolarHBondContact NH2-OD2 3.2Å; D688-N690 PolarHBondContact O-N 3.02Å; D688-N690 WeakPolarHBondContact OD1-CA 2.98Å; D688-N690 WeakPolarHBondContact OD1-CB 3.34Å; D688-N690 PolarHBondContact OD1-N 3.13Å; D688-N690 PolarHBondContact OD2-ND2 3.48Å; D688-D691 PolarHBondContact O-N 2.99Å; D688-D691 PolarHBondContact OD1-N 3Å; D688-C692 PolarHBondContact N-O 3.13Å; D688-C692 WeakPolarHBondContact OD1-CB 3.02Å; D688-C692 PolarHBondContact OD1-N 3.37Å; D688-E694 HydrophobicContact CB-CG 4.37Å
689	E	78	Confident	81.7	Confident	181 Å²	181	61.8 Å²	61.8	85%	0.846	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.1	179	-63.4	-177.7	167.7	0	0	113.7
690	N	77.4	Confident	82.4	Confident	108 Å²	108	58.7 Å²	58.7	58%	0.578	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	15.6	-179.7	-57.1	-58.1	0	0	0	112.8	D688 C692	D688-N690 PolarHBondContact O-N 3.02Å; D688-N690 WeakPolarHBondContact OD1-CA 2.98Å; D688-N690 WeakPolarHBondContact OD1-CB 3.34Å; D688-N690 PolarHBondContact OD1-N 3.13Å; D688-N690 PolarHBondContact OD2-ND2 3.48Å; N690-C692 PolarHBondContact O-N 2.97Å; N690-C692 VanDerWaalsContact O-N 3.17Å
691	D	79.7	Confident	82.3	Confident	103 Å²	103	55.4 Å²	55.4	55%	0.551	29%	0.287	S	S	*	.	S	Bend	trans	59.6	17.3	-174.5	-90.1	-43	0	0	0	114.3	D688	D688-D691 PolarHBondContact O-N 2.99Å; D688-D691 PolarHBondContact OD1-N 3Å
692	C	86.1	Confident	81	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.061	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-82.1	139.8	173.2	-57	0	0	0	0	110.1	K687 D688 N690 P714 C716	K687-C692 WeakPolarHBondContact CA-O 3.22Å; D688-C692 PolarHBondContact N-O 3.13Å; D688-C692 WeakPolarHBondContact OD1-CB 3.02Å; D688-C692 PolarHBondContact OD1-N 3.37Å; N690-C692 PolarHBondContact O-N 2.97Å; N690-C692 VanDerWaalsContact O-N 3.17Å; C692-P714 HydrophobicContact CB-CB 4.03Å; C692-P714 HydrophobicContact CB-CG 4.34Å; C692-C716 HydrophobicContact CB-CB 4.08Å; C692-C716 WeakPolarHBondContact CB-SG 3.41Å; C692-C716 WeakPolarHBondContact SG-CB 2.98Å; C692-C716 CovalentContact SG-SG 2.04Å; C692-C716 PolarHBondContact SG-SG 3.43Å
693	V	87.4	Confident	79.1	Confident	42 Å²	42	58 Å²	58	26%	0.255	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.4	177.3	-173.8	0	0	0	0	109.1	K687 H695 D715	K687-V693 HydrophobicContact CG-CG2 4.16Å; V693-H695 WeakPolarHBondContact CG1-NE2 3.18Å; V693-D715 HydrophobicContact CB-CB 4.35Å; V693-D715 PolarHBondContact N-O 2.94Å; V693-D715 PolarHBondContact O-N 3.35Å; V693-D715 VanDerWaalsContact O-N 3.09Å
694	E	87.8	Confident	77.5	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.009	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	135.3	176.6	-63.6	-65.2	168.9	0	0	109.8	F649 S685 Y686 D688 P714	F649-E694 HydrophobicContact CE2-CG 4.36Å; F649-E694 HydrophobicContact CZ-CG 4.4Å; F649-E694 VanDerWaalsContact CZ-OE1 3.27Å; F649-E694 WeakPolarHBondContact CZ-OE1 3.46Å; F649-E694 WeakPolarHBondContact CZ-OE2 3.28Å; S685-E694 WeakPolarHBondContact CA-O 3Å; S685-E694 WeakPolarHBondContact CB-O 3.34Å; Y686-E694 HydrophobicContact CD1-CB 3.99Å; Y686-E694 HydrophobicContact CD2-CB 4.4Å; Y686-E694 HydrophobicContact CE1-CB 3.58Å; Y686-E694 HydrophobicContact CE1-CG 4.28Å; Y686-E694 HydrophobicContact CE2-CB 4.02Å; Y686-E694 HydrophobicContact CE2-CG 3.91Å; Y686-E694 HydrophobicContact CG-CB 4.39Å; Y686-E694 PolarHBondContact N-O 2.91Å; Y686-E694 VanDerWaalsContact N-O 3.11Å; Y686-E694 PolarHBondContact O-N 3.41Å; D688-E694 HydrophobicContact CB-CG 4.37Å; E694-P714 VanDerWaalsContact CD-CB 3.43Å; E694-P714 WeakPolarHBondContact OE1-CB 3.5Å; E694-P714 WeakPolarHBondContact OE1-CG 3.23Å; E694-P714 WeakPolarHBondContact OE2-CB 2.99Å
695	H	88.7	Confident	76.2	Confident	68 Å²	68	60.6 Å²	60.6	32%	0.315	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.2	178.9	-72	-74.9	0	0	0	110.6	I674 V693 V711	I674-H695 HydrophobicContact CD1-CB 4Å; V693-H695 WeakPolarHBondContact CG1-NE2 3.18Å; H695-V711 HydrophobicContact CB-CB 4.32Å; H695-V711 HydrophobicContact CB-CG2 3.79Å; H695-V711 WeakPolarHBondContact O-CG2 3.28Å; H695-V711 PolarHBondContact O-N 3.11Å
696	F	89.2	Confident	75.5	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153.4	171.7	74.3	-87.5	0	0	0	111.8	C637 K640 K641 V644 C684 Y686 L708 F709 V710	C637-F696 HydrophobicContact CB-CZ 4.47Å; C637-F696 WeakPolarHBondContact O-CZ 3.38Å; K640-F696 HydrophobicContact CB-CE2 3.84Å; K640-F696 HydrophobicContact CB-CZ 4.16Å; K641-F696 HydrophobicContact CB-CE1 4.39Å; K641-F696 HydrophobicContact CB-CZ 4.49Å; V644-F696 HydrophobicContact CG2-CB 4.49Å; V644-F696 HydrophobicContact CG2-CD1 4.33Å; V644-F696 HydrophobicContact CG2-CD2 4.25Å; V644-F696 HydrophobicContact CG2-CG 4.12Å; C684-F696 WeakPolarHBondContact CA-O 3.46Å; C684-F696 HydrophobicContact CB-CD1 3.81Å; C684-F696 HydrophobicContact CB-CD2 3.92Å; C684-F696 HydrophobicContact CB-CE1 3.39Å; C684-F696 HydrophobicContact CB-CE2 3.51Å; C684-F696 HydrophobicContact CB-CG 4.08Å; C684-F696 HydrophobicContact CB-CZ 3.23Å; C684-F696 PolarHBondContact N-O 3.38Å; C684-F696 PolarHBondContact O-N 2.76Å; Y686-F696 HydrophobicContact CD1-CD1 4.08Å; Y686-F696 AromaticContact CD1-CE1 3.76Å; Y686-F696 HydrophobicContact CD1-CE1 3.76Å; Y686-F696 AromaticContact CE1-CD1 3.91Å; Y686-F696 HydrophobicContact CE1-CD1 3.91Å; Y686-F696 AromaticContact CE1-CE1 3.85Å; Y686-F696 HydrophobicContact CE1-CE1 3.85Å; F696-L708 HydrophobicContact CD2-CD2 3.81Å; F696-L708 HydrophobicContact CE2-CD2 3.92Å; F696-F709 CarbonylContact C-O 3.56Å; F696-F709 WeakPolarHBondContact CA-O 3.32Å; F696-F709 WeakPolarHBondContact CB-O 3.43Å; F696-V710 HydrophobicContact CB-CB 4.47Å; F696-V710 HydrophobicContact CB-CG2 3.98Å
697	Q	87	Confident	75.2	Confident	12 Å²	12	57.7 Å²	57.7	6%	0.056	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.9	176.5	179.7	178.1	63.1	0	0	109.8	I674 A681 V682 N683 L708 F709	I674-Q697 HydrophobicContact CD1-CB 4.28Å; I674-Q697 HydrophobicContact CG2-CB 3.79Å; I674-Q697 HydrophobicContact CG2-CG 4.26Å; A681-Q697 HydrophobicContact CB-CG 3.91Å; V682-Q697 WeakPolarHBondContact O-CA 3.28Å; N683-Q697 VanDerWaalsContact OD1-CG 3.28Å; N683-Q697 WeakPolarHBondContact OD1-CG 3.38Å; N683-Q697 PolarHBondContact OD1-NE2 3.44Å; Q697-L708 WeakPolarHBondContact O-CA 3.43Å; Q697-F709 HydrophobicContact CB-CB 4.32Å; Q697-F709 PolarHBondContact N-O 3.15Å; Q697-F709 PolarHBondContact O-N 2.82Å
698	Y	84.4	Confident	75.2	Confident	29 Å²	29	51.5 Å²	51.5	11%	0.114	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.5	171.4	168.6	-100.4	0	0	0	109.6	A636 K640 A681 V682 E700 S706 L708	A636-Y698 HydrophobicContact CB-CD1 4.45Å; K640-Y698 HydrophobicContact CD-CD2 4.22Å; K640-Y698 HydrophobicContact CD-CE2 4.33Å; K640-Y698 HydrophobicContact CG-CD2 4.11Å; K640-Y698 HydrophobicContact CG-CE2 4.5Å; A681-Y698 CarbonylContact C-O 3.59Å; A681-Y698 WeakPolarHBondContact CA-O 3.43Å; V682-Y698 HydrophobicContact CB-CD1 4.28Å; V682-Y698 HydrophobicContact CG2-CD1 4.25Å; V682-Y698 PolarHBondContact N-O 3.26Å; V682-Y698 PolarHBondContact O-N 3.5Å; Y698-E700 HydrophobicContact CE1-CB 4.13Å; Y698-E700 VanDerWaalsContact OH-CD 3.26Å; Y698-E700 PolarHBondContact OH-OE2 3.17Å; Y698-S706 WeakPolarHBondContact CE2-OG 3.32Å; Y698-L708 HydrophobicContact CD2-CD2 4.04Å
699	Y	79.6	Confident	75.4	Confident	52 Å²	52	53.2 Å²	53.2	20%	0.204	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132	174	173.8	-99.2	0	0	0	109.9	D678 A681 D701 S706 I707	D678-Y699 HydrophobicContact CB-CD2 4.24Å; D678-Y699 HydrophobicContact CB-CE2 3.71Å; D678-Y699 WeakPolarHBondContact OD2-CE2 3.5Å; D678-Y699 PolarHBondContact OD2-OH 3.49Å; A681-Y699 HydrophobicContact CB-CD2 4.19Å; Y699-D701 HydrophobicContact CE1-CB 3.89Å; Y699-S706 WeakPolarHBondContact O-CA 3.35Å; Y699-I707 PolarHBondContact N-O 3.05Å; Y699-I707 PolarHBondContact O-N 2.04Å
700	E	69.1	Low	75.9	Confident	75 Å²	75	44.6 Å²	44.6	35%	0.35	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.7	173.7	-163.3	172.3	-180	0	0	109.3	Y698	Y698-E700 HydrophobicContact CE1-CB 4.13Å; Y698-E700 VanDerWaalsContact OH-CD 3.26Å; Y698-E700 PolarHBondContact OH-OE2 3.17Å
701	D	60.5	Low	76.4	Confident	43 Å²	43	40.5 Å²	40.5	23%	0.23	23%	0.23	C	C	.	.			trans	-75	163.3	176.5	77.7	8.9	0	0	0	111.2	Y699 S703 G704 K705	Y699-D701 HydrophobicContact CE1-CB 3.89Å; D701-S703 PolarHBondContact O-N 3.48Å; D701-S703 WeakPolarHBondContact OD1-CA 3.31Å; D701-S703 WeakPolarHBondContact OD1-CB 3.01Å; D701-S703 PolarHBondContact OD1-N 3.16Å; D701-S703 PolarHBondContact OD1-OG 3.37Å; D701-S703 PolarHBondContact OD2-OG 3.09Å; D701-G704 PolarHBondContact O-N 3.35Å; D701-G704 PolarHBondContact OD1-N 3.34Å; D701-K705 PolarHBondContact N-O 3.06Å; D701-K705 WeakPolarHBondContact OD1-CB 3.15Å; D701-K705 PolarHBondContact OD1-N 2.94Å; D701-K705 WeakPolarHBondContact OD2-CB 3.34Å
702	A	47.4	Very low	76.5	Confident	89 Å²	89	40.1 Å²	40.1	74%	0.736	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-5.6	176.3	0	0	0	0	0	113.8
703	S	43	Very low	76.2	Confident	60 Å²	60	47.6 Å²	47.6	42%	0.42	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-1.5	-179.9	94.2	0	0	0	0	113.2	D701	D701-S703 PolarHBondContact O-N 3.48Å; D701-S703 WeakPolarHBondContact OD1-CA 3.31Å; D701-S703 WeakPolarHBondContact OD1-CB 3.01Å; D701-S703 PolarHBondContact OD1-N 3.16Å; D701-S703 PolarHBondContact OD1-OG 3.37Å; D701-S703 PolarHBondContact OD2-OG 3.09Å
704	G	51.1	Low	75.8	Confident	48 Å²	48	47.6 Å²	47.6	50%	0.495	26%	0.259	S	S	.	.	S	Bend	trans	81.9	11.3	-178	0	0	0	0	0	114.1	D701	D701-G704 PolarHBondContact O-N 3.35Å; D701-G704 PolarHBondContact OD1-N 3.34Å
705	K	60.4	Low	75.4	Confident	98 Å²	98	52.8 Å²	52.8	43%	0.426	29%	0.287	S	S	.	.			trans	-85.3	120.8	174.4	-169.2	-172.9	175.8	-166.6	0	108.8	E667 D701	E667-K705 VanDerWaalsContact OE2-CE 3.26Å; E667-K705 WeakPolarHBondContact OE2-CE 3.45Å; E667-K705 IonicContact OE2-NZ 2.71Å; E667-K705 PolarHBondContact OE2-NZ 3.34Å; D701-K705 PolarHBondContact N-O 3.06Å; D701-K705 WeakPolarHBondContact OD1-CB 3.15Å; D701-K705 PolarHBondContact OD1-N 2.94Å; D701-K705 WeakPolarHBondContact OD2-CB 3.34Å
706	S	72.6	Confident	75.1	Confident	12 Å²	12	52.4 Å²	52.4	8%	0.084	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.4	177.8	148.2	0	0	0	0	111.3	K640 D666 Y698 Y699	K640-S706 PolarHBondContact NZ-OG 2.83Å; D666-S706 WeakPolarHBondContact OD1-CB 3.42Å; D666-S706 PolarHBondContact OD1-OG 2.04Å; Y698-S706 WeakPolarHBondContact CE2-OG 3.32Å; Y699-S706 WeakPolarHBondContact O-CA 3.35Å
707	I	81.1	Confident	74.6	Confident	30 Å²	30	57 Å²	57	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	134.6	178.1	-54.2	174.6	0	0	0	108	V669 Y699 F709	V669-I707 HydrophobicContact CG2-CG2 4.06Å; Y699-I707 PolarHBondContact N-O 3.05Å; Y699-I707 PolarHBondContact O-N 2.04Å; I707-F709 HydrophobicContact CB-CE2 4.39Å; I707-F709 HydrophobicContact CG2-CD2 4.43Å; I707-F709 HydrophobicContact CG2-CE1 4.17Å; I707-F709 HydrophobicContact CG2-CE2 3.92Å; I707-F709 HydrophobicContact CG2-CZ 3.78Å
708	L	86.4	Confident	73.8	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.5	175.8	-70.4	168.3	0	0	0	109.4	K640 V644 D666 E667 I668 V669 F696 Q697 Y698	K640-L708 HydrophobicContact CB-CD1 4.39Å; K640-L708 HydrophobicContact CB-CD2 3.94Å; K640-L708 HydrophobicContact CD-CD1 4.19Å; K640-L708 HydrophobicContact CD-CD2 4.26Å; K640-L708 HydrophobicContact CG-CD2 4.22Å; V644-L708 HydrophobicContact CG2-CD1 4.33Å; D666-L708 HydrophobicContact CB-CD1 3.73Å; D666-L708 HydrophobicContact CB-CG 4.13Å; E667-L708 PolarHBondContact O-N 2.62Å; I668-L708 CarbonylContact C-O 3.54Å; I668-L708 WeakPolarHBondContact CA-O 3.35Å; I668-L708 HydrophobicContact CG1-CB 4.24Å; I668-L708 HydrophobicContact CG1-CD1 4.34Å; V669-L708 PolarHBondContact N-O 3.27Å; F696-L708 HydrophobicContact CD2-CD2 3.81Å; F696-L708 HydrophobicContact CE2-CD2 3.92Å; Q697-L708 WeakPolarHBondContact O-CA 3.43Å; Y698-L708 HydrophobicContact CD2-CD2 4.04Å
709	F	87.2	Confident	73	Confident	54 Å²	54	67.5 Å²	67.5	24%	0.237	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.6	170.7	-59.7	-81.4	0	0	0	108.8	V669 V671 F696 Q697 I707	V669-F709 HydrophobicContact CB-CD1 3.8Å; V669-F709 HydrophobicContact CB-CE1 4.02Å; V669-F709 HydrophobicContact CG1-CD1 4.07Å; V669-F709 HydrophobicContact CG1-CE1 4.18Å; V669-F709 HydrophobicContact CG2-CE1 4.32Å; V669-F709 CarbonylContact O-C 3.55Å; V669-F709 WeakPolarHBondContact O-CA 2.98Å; V671-F709 HydrophobicContact CG1-CB 4.28Å; V671-F709 HydrophobicContact CG1-CD1 3.83Å; V671-F709 HydrophobicContact CG2-CB 4.15Å; F696-F709 CarbonylContact C-O 3.56Å; F696-F709 WeakPolarHBondContact CA-O 3.32Å; F696-F709 WeakPolarHBondContact CB-O 3.43Å; Q697-F709 HydrophobicContact CB-CB 4.32Å; Q697-F709 PolarHBondContact N-O 3.15Å; Q697-F709 PolarHBondContact O-N 2.82Å; I707-F709 HydrophobicContact CB-CE2 4.39Å; I707-F709 HydrophobicContact CG2-CD2 4.43Å; I707-F709 HydrophobicContact CG2-CE1 4.17Å; I707-F709 HydrophobicContact CG2-CE2 3.92Å; I707-F709 HydrophobicContact CG2-CZ 3.78Å
710	V	88	Confident	72.6	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.006	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.8	-176.6	-179	0	0	0	0	109.1	V644 I668 V669 L670 V671 F696	V644-V710 HydrophobicContact CG1-CG1 3.95Å; V644-V710 HydrophobicContact CG1-CG2 3.98Å; V644-V710 HydrophobicContact CG2-CG2 3.88Å; I668-V710 HydrophobicContact CG2-CB 4.37Å; I668-V710 HydrophobicContact CG2-CG2 3.82Å; V669-V710 PolarHBondContact O-N 3.47Å; L670-V710 WeakPolarHBondContact CA-O 3.42Å; L670-V710 HydrophobicContact CD2-CB 4.13Å; L670-V710 HydrophobicContact CD2-CG1 4.49Å; V671-V710 PolarHBondContact N-O 3.14Å; F696-V710 HydrophobicContact CB-CB 4.47Å; F696-V710 HydrophobicContact CB-CG2 3.98Å
711	V	88.4	Confident	72.6	Confident	21 Å²	21	71.4 Å²	71.4	13%	0.127	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	133.2	176.4	179.4	0	0	0	0	109.6	V671 I674 H695	V671-V711 WeakPolarHBondContact O-CA 3.36Å; I674-V711 HydrophobicContact CD1-CG2 3.9Å; I674-V711 HydrophobicContact CG1-CG2 3.68Å; H695-V711 HydrophobicContact CB-CB 4.32Å; H695-V711 HydrophobicContact CB-CG2 3.79Å; H695-V711 WeakPolarHBondContact O-CG2 3.28Å; H695-V711 PolarHBondContact O-N 3.11Å
712	K	81.9	Confident	73.2	Confident	95 Å²	95	75.6 Å²	75.6	41%	0.413	44%	0.438	S	S	.	.	S	Bend	trans	-67.3	-39.6	-174.4	-72.6	179.6	-159.5	152.9	0	114.5	L670 V671 D672	L670-K712 HydrophobicContact CB-CG 3.89Å; V671-K712 PolarHBondContact O-N 3.16Å; D672-K712 WeakPolarHBondContact OD1-CD 3.26Å; D672-K712 WeakPolarHBondContact OD1-CE 3.45Å; D672-K712 IonicContact OD1-NZ 3.38Å; D672-K712 PolarHBondContact OD1-NZ 2.79Å; D672-K712 IonicContact OD2-NZ 2.79Å; D672-K712 PolarHBondContact OD2-NZ 2.87Å
713	E	79.3	Confident	74.6	Confident	166 Å²	166	76.8 Å²	76.8	78%	0.776	43%	0.431	S	S	*	.	S	Bend	trans	-116.5	121.6	-177.1	-70.7	-169.9	174.1	0	0	110
714	P	79.3	Confident	76.4	Confident	43 Å²	43	78.1 Å²	78.1	28%	0.279	44%	0.437	S	S	.	.			trans	-79.3	150.9	179.6	30.2	-33.9	0	0	0	113	C692 E694 C716	C692-P714 HydrophobicContact CB-CB 4.03Å; C692-P714 HydrophobicContact CB-CG 4.34Å; E694-P714 VanDerWaalsContact CD-CB 3.43Å; E694-P714 WeakPolarHBondContact OE1-CB 3.5Å; E694-P714 WeakPolarHBondContact OE1-CG 3.23Å; E694-P714 WeakPolarHBondContact OE2-CB 2.99Å; P714-C716 PolarHBondContact O-N 3.42Å
715	D	79.8	Confident	77.8	Confident	110 Å²	110	79.4 Å²	79.4	59%	0.588	44%	0.435	S	S	*	.	B	Isolated β-bridge	trans	-78.7	89.9	177.5	-80.7	-37.1	0	0	0	110.1	V693	V693-D715 HydrophobicContact CB-CB 4.35Å; V693-D715 PolarHBondContact N-O 2.94Å; V693-D715 PolarHBondContact O-N 3.35Å; V693-D715 VanDerWaalsContact O-N 3.09Å
716	C	81.6	Confident	78.7	Confident	61 Å²	61	80.4 Å²	80.4	41%	0.412	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-89.3	146.7	175.4	-59.4	0	0	0	0	111.8	C692 P714 K718	C692-C716 HydrophobicContact CB-CB 4.08Å; C692-C716 WeakPolarHBondContact CB-SG 3.41Å; C692-C716 WeakPolarHBondContact SG-CB 2.98Å; C692-C716 CovalentContact SG-SG 2.04Å; C692-C716 PolarHBondContact SG-SG 3.43Å; P714-C716 PolarHBondContact O-N 3.42Å; C716-K718 PolarHBondContact O-N 3.12Å; C716-K718 VanDerWaalsContact O-N 3.13Å
717	P	77.7	Confident	79.3	Confident	98 Å²	98	85.2 Å²	85.2	64%	0.636	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-60.4	117.9	175	22.2	-30.6	0	0	0	111.1
718	K	70.9	Confident	79.4	Confident	202 Å²	202	87.1 Å²	87.1	88%	0.878	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-76.1	126.3	172.9	-62.5	177.7	-175.6	174.4	0	108.4	C716	C716-K718 PolarHBondContact O-N 3.12Å; C716-K718 VanDerWaalsContact O-N 3.13Å
719	G	67.4	Low	79.5	Confident	60 Å²	60	91 Å²	91	62%	0.619	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-56.9	160.5	173.6	0	0	0	0	0	112.1	D721	G719-D721 PolarHBondContact O-N 3.41Å
720	P	70.9	Confident	79.5	Confident	110 Å²	110	91.2 Å²	91.2	71%	0.714	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-58.4	134.5	-179.2	23.4	-32.2	0	0	0	110.9	I722 V725	P720-I722 PolarHBondContact O-N 2.02Å; P720-V725 HydrophobicContact CB-CG2 4.49Å
721	D	69.5	Low	79.6	Confident	99 Å²	99	93 Å²	93	53%	0.529	54%	0.538	S	S	.	.			trans	-63.8	110.6	178.7	-170.9	-27	0	0	0	109.6	G719 L723 V724 V725	G719-D721 PolarHBondContact O-N 3.41Å; D721-L723 PolarHBondContact O-N 3.41Å; D721-L723 VanDerWaalsContact O-N 3.13Å; D721-L723 VanDerWaalsContact OD1-CB 3.22Å; D721-L723 WeakPolarHBondContact OD1-CB 3.18Å; D721-L723 PolarHBondContact OD1-N 3.25Å; D721-V724 HydrophobicContact CB-CB 4.22Å; D721-V724 HydrophobicContact CB-CG2 3.84Å; D721-V724 PolarHBondContact O-N 2.9Å; D721-V725 PolarHBondContact O-N 2.03Å
722	I	74.1	Confident	79.6	Confident	131 Å²	131	94.5 Å²	94.5	67%	0.672	55%	0.553	S	S	*	*	H	α-helix	trans	-55.3	-33.4	-177.2	-62	172.1	0	0	0	110.5	P720 L726	P720-I722 PolarHBondContact O-N 2.02Å; I722-L726 HydrophobicContact CG2-CD1 3.98Å; I722-L726 WeakPolarHBondContact O-CG 3.3Å; I722-L726 PolarHBondContact O-N 3.19Å; I722-L726 VanDerWaalsContact O-N 3.1Å
723	L	75.9	Confident	80	Confident	113 Å²	113	95.5 Å²	95.5	59%	0.592	56%	0.561	S	S	*	*	H	α-helix	trans	-67.9	-41.5	179.5	-161.5	95.5	0	0	0	111.7	D721 L726 L727	D721-L723 PolarHBondContact O-N 3.41Å; D721-L723 VanDerWaalsContact O-N 3.13Å; D721-L723 VanDerWaalsContact OD1-CB 3.22Å; D721-L723 WeakPolarHBondContact OD1-CB 3.18Å; D721-L723 PolarHBondContact OD1-N 3.25Å; L723-L726 PolarHBondContact O-N 3.25Å; L723-L727 HydrophobicContact CD2-CD1 4Å; L723-L727 HydrophobicContact CG-CD1 4.14Å; L723-L727 WeakPolarHBondContact O-CB 3.07Å; L723-L727 WeakPolarHBondContact O-CG 3.3Å; L723-L727 PolarHBondContact O-N 3.38Å
724	V	79.9	Confident	80.6	Confident	88 Å²	88	93.4 Å²	93.4	53%	0.533	56%	0.555	S	S	.	*	H	α-helix	trans	-67.6	-40.6	-179.2	177.4	0	0	0	0	110.7	D721 L727 S728	D721-V724 HydrophobicContact CB-CB 4.22Å; D721-V724 HydrophobicContact CB-CG2 3.84Å; D721-V724 PolarHBondContact O-N 2.9Å; V724-L727 PolarHBondContact O-N 2.98Å; V724-S728 WeakPolarHBondContact O-CB 3.48Å; V724-S728 PolarHBondContact O-N 3.43Å; V724-S728 PolarHBondContact O-OG 3.01Å
725	V	80.4	Confident	81.1	Confident	76 Å²	76	98.5 Å²	98.5	46%	0.461	57%	0.573	S	S	.	*	H	α-helix	trans	-63.9	-43.4	175.9	179.4	0	0	0	0	110.6	P720 D721 S728 V729	P720-V725 HydrophobicContact CB-CG2 4.49Å; D721-V725 PolarHBondContact O-N 2.03Å; V725-S728 WeakPolarHBondContact CA-OG 3.19Å; V725-S728 PolarHBondContact O-OG 3.08Å; V725-V729 VanDerWaalsContact O-CG2 3.32Å; V725-V729 WeakPolarHBondContact O-CG2 3.27Å; V725-V729 PolarHBondContact O-N 3.08Å
726	L	81.3	Confident	81.7	Confident	118 Å²	118	99.2 Å²	99.2	62%	0.618	58%	0.576	S	S	*	*	H	α-helix	trans	-64.9	-44.6	177.9	-75.9	168.1	0	0	0	112.7	I722 L723 A730	I722-L726 HydrophobicContact CG2-CD1 3.98Å; I722-L726 WeakPolarHBondContact O-CG 3.3Å; I722-L726 PolarHBondContact O-N 3.19Å; I722-L726 VanDerWaalsContact O-N 3.1Å; L723-L726 PolarHBondContact O-N 3.25Å; L726-A730 WeakPolarHBondContact O-CB 3.01Å; L726-A730 PolarHBondContact O-N 3.48Å; L726-A730 VanDerWaalsContact O-N 3.07Å
727	L	84.3	Confident	82.1	Confident	114 Å²	114	98.1 Å²	98.1	60%	0.597	58%	0.575	S	S	*	*	H	α-helix	trans	-67.9	-38.4	-179.2	-73.5	172.4	0	0	0	112.7	L723 V724 A730 G731	L723-L727 HydrophobicContact CD2-CD1 4Å; L723-L727 HydrophobicContact CG-CD1 4.14Å; L723-L727 WeakPolarHBondContact O-CB 3.07Å; L723-L727 WeakPolarHBondContact O-CG 3.3Å; L723-L727 PolarHBondContact O-N 3.38Å; V724-L727 PolarHBondContact O-N 2.98Å; L727-A730 PolarHBondContact O-N 3.3Å; L727-G731 PolarHBondContact O-N 3.05Å
728	S	82.4	Confident	82.7	Confident	69 Å²	69	98 Å²	98	48%	0.483	57%	0.568	S	S	.	*	H	α-helix	trans	-66.7	-41.7	178.4	49.4	0	0	0	0	112	V724 V725 G731 A732	V724-S728 WeakPolarHBondContact O-CB 3.48Å; V724-S728 PolarHBondContact O-N 3.43Å; V724-S728 PolarHBondContact O-OG 3.01Å; V725-S728 WeakPolarHBondContact CA-OG 3.19Å; V725-S728 PolarHBondContact O-OG 3.08Å; S728-G731 PolarHBondContact O-N 2.7Å; S728-A732 WeakPolarHBondContact O-CB 3.07Å; S728-A732 PolarHBondContact O-N 3.38Å
729	V	88.6	Confident	83.5	Confident	83 Å²	83	89.9 Å²	89.9	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-64	-45.9	174.5	174.2	0	0	0	0	111.2	V725 G731 A732 I733	V725-V729 VanDerWaalsContact O-CG2 3.32Å; V725-V729 WeakPolarHBondContact O-CG2 3.27Å; V725-V729 PolarHBondContact O-N 3.08Å; V729-G731 PolarHBondContact O-N 3.12Å; V729-A732 PolarHBondContact O-N 3.34Å; V729-I733 HydrophobicContact CG1-CD1 4.08Å; V729-I733 WeakPolarHBondContact O-CG1 3.24Å; V729-I733 PolarHBondContact O-N 3.28Å
730	A	87.4	Confident	84.6	Confident	57 Å²	57	90 Å²	90	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-62.5	-42.2	178.1	0	0	0	0	0	112.4	L726 L727 I733 L734	L726-A730 WeakPolarHBondContact O-CB 3.01Å; L726-A730 PolarHBondContact O-N 3.48Å; L726-A730 VanDerWaalsContact O-N 3.07Å; L727-A730 PolarHBondContact O-N 3.3Å; A730-I733 PolarHBondContact O-N 3.4Å; A730-L734 PolarHBondContact O-N 3.26Å; A730-L734 VanDerWaalsContact O-N 3.12Å
731	G	89.9	Confident	85.4	Confident	38 Å²	38	89.6 Å²	89.6	39%	0.392	53%	0.525	S	S	.	.	H	α-helix	trans	-63.9	-40.8	177.5	0	0	0	0	0	113.2	L727 S728 V729 I733 L734 F735	L727-G731 PolarHBondContact O-N 3.05Å; S728-G731 PolarHBondContact O-N 2.7Å; V729-G731 PolarHBondContact O-N 3.12Å; G731-I733 PolarHBondContact O-N 3.44Å; G731-L734 PolarHBondContact O-N 2.79Å; G731-F735 WeakPolarHBondContact O-CB 3.21Å; G731-F735 PolarHBondContact O-N 3.25Å
732	A	89	Confident	86.3	Confident	53 Å²	53	90.5 Å²	90.5	44%	0.438	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-42.2	177.7	0	0	0	0	0	112.2	S728 V729 F735 L736	S728-A732 WeakPolarHBondContact O-CB 3.07Å; S728-A732 PolarHBondContact O-N 3.38Å; V729-A732 PolarHBondContact O-N 3.34Å; A732-F735 PolarHBondContact O-N 2.9Å; A732-L736 WeakPolarHBondContact O-CG 3.45Å; A732-L736 PolarHBondContact O-N 2.93Å
733	I	91.2	Very high	87.1	Confident	116 Å²	116	89.1 Å²	89.1	60%	0.595	52%	0.523	S	S	*	.	H	α-helix	trans	-62.7	-45.3	176.8	-66	167.3	0	0	0	110.5	V729 A730 G731 F735 G737	V729-I733 HydrophobicContact CG1-CD1 4.08Å; V729-I733 WeakPolarHBondContact O-CG1 3.24Å; V729-I733 PolarHBondContact O-N 3.28Å; A730-I733 PolarHBondContact O-N 3.4Å; G731-I733 PolarHBondContact O-N 3.44Å; I733-F735 PolarHBondContact O-N 3.38Å; I733-G737 PolarHBondContact O-N 3.27Å; I733-G737 VanDerWaalsContact O-N 3.13Å
734	L	91.1	Very high	87.8	Confident	122 Å²	122	92 Å²	92	64%	0.639	53%	0.526	S	S	*	.	H	α-helix	trans	-62	-43.8	178.6	-165.1	91.5	0	0	0	111.8	A730 G731 G737 L738	A730-L734 PolarHBondContact O-N 3.26Å; A730-L734 VanDerWaalsContact O-N 3.12Å; G731-L734 PolarHBondContact O-N 2.79Å; L734-G737 PolarHBondContact O-N 2.88Å; L734-L738 HydrophobicContact CD2-CD1 4.36Å; L734-L738 HydrophobicContact CG-CD1 4.39Å; L734-L738 PolarHBondContact O-N 3.2Å
735	F	90.5	Very high	88.2	Confident	151 Å²	151	94.9 Å²	94.9	66%	0.662	53%	0.531	S	S	*	.	H	α-helix	trans	-66	-43.8	-178.3	-170.4	-92.2	0	0	0	112.2	G731 A732 I733 G737 L738 A739	G731-F735 WeakPolarHBondContact O-CB 3.21Å; G731-F735 PolarHBondContact O-N 3.25Å; A732-F735 PolarHBondContact O-N 2.9Å; I733-F735 PolarHBondContact O-N 3.38Å; F735-G737 VanDerWaalsContact C-N 3.3Å; F735-G737 PolarHBondContact O-N 3.37Å; F735-L738 PolarHBondContact O-N 3.48Å; F735-A739 WeakPolarHBondContact O-CB 3.44Å; F735-A739 PolarHBondContact O-N 3.01Å
736	L	90.7	Very high	88.6	Confident	125 Å²	125	96.4 Å²	96.4	65%	0.654	54%	0.536	S	S	*	.	H	α-helix	trans	-61.2	-39.8	175.6	-74.3	170.7	0	0	0	111.7	A732 A740	A732-L736 WeakPolarHBondContact O-CG 3.45Å; A732-L736 PolarHBondContact O-N 2.93Å; L736-A740 PolarHBondContact O-N 3.15Å; L736-A740 VanDerWaalsContact O-N 3.1Å
737	G	90.5	Very high	88.9	Confident	38 Å²	38	96 Å²	96	39%	0.392	53%	0.534	S	S	.	.	H	α-helix	trans	-62.1	-45.7	174.5	0	0	0	0	0	113.1	I733 L734 F735 A740 L741	I733-G737 PolarHBondContact O-N 3.27Å; I733-G737 VanDerWaalsContact O-N 3.13Å; L734-G737 PolarHBondContact O-N 2.88Å; F735-G737 VanDerWaalsContact C-N 3.3Å; F735-G737 PolarHBondContact O-N 3.37Å; G737-A740 PolarHBondContact O-N 2.73Å; G737-L741 WeakPolarHBondContact O-CG 2.99Å; G737-L741 PolarHBondContact O-N 2.03Å
738	L	89.8	Confident	89.1	Confident	95 Å²	95	93.7 Å²	93.7	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-41.5	177.5	-85.6	161.4	0	0	0	112.7	L734 F735 A740 L741 L742	L734-L738 HydrophobicContact CD2-CD1 4.36Å; L734-L738 HydrophobicContact CG-CD1 4.39Å; L734-L738 PolarHBondContact O-N 3.2Å; F735-L738 PolarHBondContact O-N 3.48Å; L738-A740 PolarHBondContact O-N 3.37Å; L738-L741 PolarHBondContact O-N 3.33Å; L738-L742 WeakPolarHBondContact O-CG 3.36Å; L738-L742 PolarHBondContact O-N 3.02Å
739	A	89.6	Confident	89.4	Confident	32 Å²	32	93.7 Å²	93.7	26%	0.264	52%	0.521	S	S	.	.	H	α-helix	trans	-62	-43.3	177.9	0	0	0	0	0	111.6	F735 L741 L742 I743	F735-A739 WeakPolarHBondContact O-CB 3.44Å; F735-A739 PolarHBondContact O-N 3.01Å; A739-L741 PolarHBondContact O-N 2.8Å; A739-L742 PolarHBondContact O-N 2.03Å; A739-I743 VanDerWaalsContact O-CG1 3.28Å; A739-I743 WeakPolarHBondContact O-CG1 3.27Å; A739-I743 PolarHBondContact O-N 2.84Å
740	A	88.7	Confident	89.3	Confident	61 Å²	61	93.5 Å²	93.5	50%	0.504	52%	0.517	S	S	.	.	H	α-helix	trans	-61.1	-42.6	175.9	0	0	0	0	0	112.1	L736 G737 L738 I743 W744	L736-A740 PolarHBondContact O-N 3.15Å; L736-A740 VanDerWaalsContact O-N 3.1Å; G737-A740 PolarHBondContact O-N 2.73Å; L738-A740 PolarHBondContact O-N 3.37Å; A740-I743 PolarHBondContact O-N 3.41Å; A740-W744 WeakPolarHBondContact O-CB 3.44Å; A740-W744 PolarHBondContact O-N 2.86Å
741	L	89.3	Confident	89.3	Confident	102 Å²	102	96.4 Å²	96.4	53%	0.534	52%	0.52	S	S	.	.	H	α-helix	trans	-64.8	-39.7	176.1	-73.7	172.1	0	0	0	112.6	G737 L738 A739 W744 K745	G737-L741 WeakPolarHBondContact O-CG 2.99Å; G737-L741 PolarHBondContact O-N 2.03Å; L738-L741 PolarHBondContact O-N 3.33Å; A739-L741 PolarHBondContact O-N 2.8Å; L741-W744 HydrophobicContact CD2-CE3 4.19Å; L741-W744 HydrophobicContact CD2-CZ3 4.5Å; L741-W744 PolarHBondContact O-N 2.9Å; L741-K745 WeakPolarHBondContact O-CB 2.99Å; L741-K745 PolarHBondContact O-N 3.21Å
742	L	88.4	Confident	89	Confident	118 Å²	118	99.4 Å²	99.4	62%	0.618	53%	0.527	S	S	*	.	H	α-helix	trans	-67.8	-42.9	177.1	-75.4	172.5	0	0	0	112	L738 A739 W744 K745 L746	L738-L742 WeakPolarHBondContact O-CG 3.36Å; L738-L742 PolarHBondContact O-N 3.02Å; A739-L742 PolarHBondContact O-N 2.03Å; L742-W744 VanDerWaalsContact C-N 3.34Å; L742-K745 PolarHBondContact O-N 3.17Å; L742-L746 WeakPolarHBondContact O-CB 3.45Å; L742-L746 PolarHBondContact O-N 3.37Å
743	I	90.2	Very high	88.8	Confident	103 Å²	103	106.3 Å²	106.3	53%	0.528	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-45.7	175.5	-69.1	166.3	0	0	0	109.9	A739 A740 K745 L746 L747	A739-I743 VanDerWaalsContact O-CG1 3.28Å; A739-I743 WeakPolarHBondContact O-CG1 3.27Å; A739-I743 PolarHBondContact O-N 2.84Å; A740-I743 PolarHBondContact O-N 3.41Å; I743-K745 PolarHBondContact O-N 3.36Å; I743-L746 PolarHBondContact O-N 3.17Å; I743-L747 HydrophobicContact CG2-CD1 4.03Å; I743-L747 HydrophobicContact CG2-CG 4.42Å; I743-L747 WeakPolarHBondContact O-CG 2.93Å; I743-L747 PolarHBondContact O-N 3.5Å
744	W	90	Very high	88.5	Confident	174 Å²	174	109.7 Å²	109.7	66%	0.659	55%	0.547	S	S	*	.	H	α-helix	trans	-58.5	-49.4	175.7	179.9	10.9	0	0	0	111.4	A740 L741 L742 L746 L747 V748	A740-W744 WeakPolarHBondContact O-CB 3.44Å; A740-W744 PolarHBondContact O-N 2.86Å; L741-W744 HydrophobicContact CD2-CE3 4.19Å; L741-W744 HydrophobicContact CD2-CZ3 4.5Å; L741-W744 PolarHBondContact O-N 2.9Å; L742-W744 VanDerWaalsContact C-N 3.34Å; W744-L746 VanDerWaalsContact C-N 3.32Å; W744-L746 PolarHBondContact O-N 3.14Å; W744-L747 PolarHBondContact O-N 2.02Å; W744-V748 WeakPolarHBondContact O-CG2 3.45Å; W744-V748 PolarHBondContact O-N 3.41Å
745	K	89.6	Confident	88.1	Confident	148 Å²	148	108.8 Å²	108.8	64%	0.643	54%	0.54	S	S	*	.	H	α-helix	trans	-61.4	-39.2	178.5	-172.9	169.9	-178.8	173.4	0	112.5	L741 L742 I743 T749	L741-K745 WeakPolarHBondContact O-CB 2.99Å; L741-K745 PolarHBondContact O-N 3.21Å; L742-K745 PolarHBondContact O-N 3.17Å; I743-K745 PolarHBondContact O-N 3.36Å; K745-T749 WeakPolarHBondContact O-CB 3.39Å; K745-T749 PolarHBondContact O-N 3.49Å; K745-T749 PolarHBondContact O-OG1 3.36Å
746	L	88.3	Confident	87.8	Confident	108 Å²	108	107.4 Å²	107.4	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-63.7	-47.4	177	-173.3	76.6	0	0	0	111.1	L742 I743 W744 V748 T749 I750	L742-L746 WeakPolarHBondContact O-CB 3.45Å; L742-L746 PolarHBondContact O-N 3.37Å; I743-L746 PolarHBondContact O-N 3.17Å; W744-L746 VanDerWaalsContact C-N 3.32Å; W744-L746 PolarHBondContact O-N 3.14Å; L746-V748 PolarHBondContact O-N 3.22Å; L746-T749 PolarHBondContact O-N 2.74Å; L746-I750 HydrophobicContact CG-CD1 4.05Å; L746-I750 WeakPolarHBondContact O-CG1 3.42Å; L746-I750 PolarHBondContact O-N 2.74Å
747	L	88.6	Confident	87.4	Confident	110 Å²	110	104 Å²	104	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-60.9	-43.9	179.2	-72.3	174	0	0	0	111.7	I743 W744 I750 H751	I743-L747 HydrophobicContact CG2-CD1 4.03Å; I743-L747 HydrophobicContact CG2-CG 4.42Å; I743-L747 WeakPolarHBondContact O-CG 2.93Å; I743-L747 PolarHBondContact O-N 3.5Å; W744-L747 PolarHBondContact O-N 2.02Å; L747-I750 PolarHBondContact O-N 2.77Å; L747-H751 PolarHBondContact O-N 2.04Å
748	V	88.4	Confident	87	Confident	65 Å²	65	107.9 Å²	107.9	39%	0.394	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-44.3	176.1	173.1	0	0	0	0	110.9	W744 L746 I750 H751 D752	W744-V748 WeakPolarHBondContact O-CG2 3.45Å; W744-V748 PolarHBondContact O-N 3.41Å; L746-V748 PolarHBondContact O-N 3.22Å; V748-I750 VanDerWaalsContact C-N 3.33Å; V748-I750 PolarHBondContact O-N 3.37Å; V748-H751 PolarHBondContact O-N 2.9Å; V748-D752 PolarHBondContact O-N 3.02Å
749	T	87.4	Confident	86.4	Confident	68 Å²	68	109.2 Å²	109.2	42%	0.417	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-36.9	179.7	-53.6	0	0	0	0	112.3	K745 L746 R753	K745-T749 WeakPolarHBondContact O-CB 3.39Å; K745-T749 PolarHBondContact O-N 3.49Å; K745-T749 PolarHBondContact O-OG1 3.36Å; L746-T749 PolarHBondContact O-N 2.74Å; T749-R753 WeakPolarHBondContact O-CB 3.27Å; T749-R753 PolarHBondContact O-N 3.24Å
750	I	87.4	Confident	85.9	Confident	79 Å²	79	113 Å²	113	41%	0.405	54%	0.544	S	S	.	.	H	α-helix	trans	-67.5	-41.3	175.6	-70	169	0	0	0	110.7	L746 L747 V748 R753 R754	L746-I750 HydrophobicContact CG-CD1 4.05Å; L746-I750 WeakPolarHBondContact O-CG1 3.42Å; L746-I750 PolarHBondContact O-N 2.74Å; L747-I750 PolarHBondContact O-N 2.77Å; V748-I750 VanDerWaalsContact C-N 3.33Å; V748-I750 PolarHBondContact O-N 3.37Å; I750-R753 PolarHBondContact O-N 3.38Å; I750-R754 PolarHBondContact O-N 2.79Å; I750-R754 VanDerWaalsContact O-N 3.08Å
751	H	86.4	Confident	85.3	Confident	118 Å²	118	116.9 Å²	116.9	55%	0.546	55%	0.552	S	S	.	*	H	α-helix	trans	-62.7	-49.4	177	-169.8	68.3	0	0	0	111.1	L747 V748 R753 R754 E755	L747-H751 PolarHBondContact O-N 2.04Å; V748-H751 PolarHBondContact O-N 2.9Å; H751-R753 VanDerWaalsContact C-N 3.35Å; H751-R753 PolarHBondContact O-N 3.02Å; H751-R754 PolarHBondContact O-N 2.97Å; H751-R754 VanDerWaalsContact O-N 3.17Å; H751-E755 PolarHBondContact O-N 3.11Å
752	D	83.6	Confident	84.7	Confident	101 Å²	101	118.5 Å²	118.5	54%	0.54	56%	0.557	S	S	.	*	H	α-helix	trans	-61.1	-40.2	177.2	-80.9	-6.8	0	0	0	112.4	V748 R754 E755 F756	V748-D752 PolarHBondContact O-N 3.02Å; D752-R754 PolarHBondContact O-N 2.9Å; D752-E755 PolarHBondContact O-N 3.38Å; D752-F756 WeakPolarHBondContact O-CB 2.99Å; D752-F756 PolarHBondContact O-N 2.03Å
753	R	84.8	Confident	83.8	Confident	198 Å²	198	122 Å²	122	75%	0.747	56%	0.562	S	S	*	*	H	α-helix	trans	-64.8	-37.4	176.2	-96.4	-168.7	163.9	-164.5	-3.7	113	T749 I750 H751 A757	T749-R753 WeakPolarHBondContact O-CB 3.27Å; T749-R753 PolarHBondContact O-N 3.24Å; I750-R753 PolarHBondContact O-N 3.38Å; H751-R753 VanDerWaalsContact C-N 3.35Å; H751-R753 PolarHBondContact O-N 3.02Å; R753-A757 WeakPolarHBondContact O-CB 3.31Å; R753-A757 PolarHBondContact O-N 2.85Å
754	R	85.6	Confident	82.8	Confident	188 Å²	188	120.7 Å²	120.7	71%	0.709	57%	0.566	S	S	*	*	H	α-helix	trans	-66.9	-43.4	176.9	-80.4	-176.9	174.6	178.8	-0.2	111.2	I750 H751 D752 K758	I750-R754 PolarHBondContact O-N 2.79Å; I750-R754 VanDerWaalsContact O-N 3.08Å; H751-R754 PolarHBondContact O-N 2.97Å; H751-R754 VanDerWaalsContact O-N 3.17Å; D752-R754 PolarHBondContact O-N 2.9Å; R754-K758 PolarHBondContact O-N 3.2Å; R754-K758 VanDerWaalsContact O-N 3.14Å
755	E	83	Confident	81.5	Confident	102 Å²	102	123.2 Å²	123.2	48%	0.477	58%	0.576	S	S	.	*	H	α-helix	trans	-64.7	-41.1	175.3	-71.1	-60	139.3	0	0	111.6	H751 D752 K758 F759	H751-E755 PolarHBondContact O-N 3.11Å; D752-E755 PolarHBondContact O-N 3.38Å; E755-K758 PolarHBondContact O-N 3Å; E755-F759 PolarHBondContact O-N 2.99Å
756	F	82.7	Confident	80	Confident	123 Å²	123	120 Å²	120	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-64.7	-42.7	177	-172.6	-95.7	0	0	0	113	D752 K758 F759 E760	D752-F756 WeakPolarHBondContact O-CB 2.99Å; D752-F756 PolarHBondContact O-N 2.03Å; F756-K758 VanDerWaalsContact C-N 3.33Å; F756-K758 PolarHBondContact O-N 3.37Å; F756-F759 WeakPolarHBondContact O-CB 2.93Å; F756-F759 PolarHBondContact O-N 2.94Å; F756-E760 HydrophobicContact CD1-CG 4.35Å; F756-E760 HydrophobicContact CE1-CG 3.8Å; F756-E760 WeakPolarHBondContact CE1-OE1 3.05Å; F756-E760 HydrophobicContact CZ-CG 4.12Å; F756-E760 PolarHBondContact O-N 3.36Å
757	A	82.4	Confident	78.2	Confident	54 Å²	54	124.1 Å²	124.1	45%	0.446	59%	0.59	S	S	.	*	H	α-helix	trans	-64.1	-39.3	177.6	0	0	0	0	0	112	R753 F759 E760 E761	R753-A757 WeakPolarHBondContact O-CB 3.31Å; R753-A757 PolarHBondContact O-N 2.85Å; A757-F759 VanDerWaalsContact C-N 3.3Å; A757-F759 PolarHBondContact O-N 3.04Å; A757-E760 PolarHBondContact O-N 3.23Å; A757-E761 PolarHBondContact O-N 3.15Å; A757-E761 VanDerWaalsContact O-N 3.12Å
758	K	82.4	Confident	76.3	Confident	119 Å²	119	131 Å²	131	52%	0.517	61%	0.609	S	S	.	*	H	α-helix	trans	-61.2	-40.4	174	-170.9	-179.5	176.1	-170.1	0	111.3	R754 E755 F756 E762	R754-K758 PolarHBondContact O-N 3.2Å; R754-K758 VanDerWaalsContact O-N 3.14Å; E755-K758 PolarHBondContact O-N 3Å; F756-K758 VanDerWaalsContact C-N 3.33Å; F756-K758 PolarHBondContact O-N 3.37Å; K758-E762 PolarHBondContact O-N 2.95Å
759	F	77.9	Confident	74	Confident	123 Å²	123	135.4 Å²	135.4	54%	0.539	63%	0.63	S	S	.	*	H	α-helix	trans	-66	-39.4	175.6	-178	-101.1	0	0	0	113.3	E755 F756 A757 E762 R763	E755-F759 PolarHBondContact O-N 2.99Å; F756-F759 WeakPolarHBondContact O-CB 2.93Å; F756-F759 PolarHBondContact O-N 2.94Å; A757-F759 VanDerWaalsContact C-N 3.3Å; A757-F759 PolarHBondContact O-N 3.04Å; F759-E762 PolarHBondContact O-N 3.09Å; F759-R763 PolarHBondContact O-N 2.8Å; F759-R763 VanDerWaalsContact O-N 3.16Å
760	E	78.4	Confident	72.1	Confident	112 Å²	112	138.7 Å²	138.7	52%	0.523	65%	0.65	S	S	.	*	H	α-helix	trans	-68.2	-37.5	177.2	-80.8	-161.9	154.3	0	0	113.4	F756 A757 E762 R763 A764	F756-E760 HydrophobicContact CD1-CG 4.35Å; F756-E760 HydrophobicContact CE1-CG 3.8Å; F756-E760 WeakPolarHBondContact CE1-OE1 3.05Å; F756-E760 HydrophobicContact CZ-CG 4.12Å; F756-E760 PolarHBondContact O-N 3.36Å; A757-E760 PolarHBondContact O-N 3.23Å; E760-E762 VanDerWaalsContact C-N 3.32Å; E760-E762 PolarHBondContact O-N 3.33Å; E760-R763 PolarHBondContact O-N 2.96Å; E760-R763 VanDerWaalsContact O-N 3.16Å; E760-A764 WeakPolarHBondContact O-CB 3.46Å; E760-A764 PolarHBondContact O-N 3.15Å
761	E	77.6	Confident	69.9	Low	141 Å²	141	138 Å²	138	66%	0.659	66%	0.662	S	S	*	*	H	α-helix	trans	-62.2	-39	174.5	-80.6	-170.3	168	0	0	112.2	A757 R763	A757-E761 PolarHBondContact O-N 3.15Å; A757-E761 VanDerWaalsContact O-N 3.12Å; E761-R763 VanDerWaalsContact C-N 3.32Å
762	E	75	Confident	67.7	Low	137 Å²	137	141.1 Å²	141.1	64%	0.64	68%	0.677	S	S	*	*	H	α-helix	trans	-64.7	-36.5	174.2	-72.2	-179.1	179.7	0	0	111.5	K758 F759 E760	K758-E762 PolarHBondContact O-N 2.95Å; F759-E762 PolarHBondContact O-N 3.09Å; E760-E762 VanDerWaalsContact C-N 3.32Å; E760-E762 PolarHBondContact O-N 3.33Å
763	R	69.8	Low	65.9	Low	191 Å²	191	142.6 Å²	142.6	72%	0.721	69%	0.685	S	S	*	*	H	α-helix	trans	-75.1	-36.2	179.9	-146.4	-179.3	98.1	175.1	4.6	113.6	F759 E760 E761 R765 A766	F759-R763 PolarHBondContact O-N 2.8Å; F759-R763 VanDerWaalsContact O-N 3.16Å; E760-R763 PolarHBondContact O-N 2.96Å; E760-R763 VanDerWaalsContact O-N 3.16Å; E761-R763 VanDerWaalsContact C-N 3.32Å; R763-R765 VanDerWaalsContact C-N 3.32Å; R763-R765 PolarHBondContact O-N 3.49Å; R763-A766 PolarHBondContact O-N 3.08Å
764	A	68.9	Low	64.4	Low	76 Å²	76	138.7 Å²	138.7	63%	0.628	69%	0.685	S	S	*	*	H	α-helix	trans	-72.3	-18.6	-173.5	0	0	0	0	0	114.5	E760 A766	E760-A764 WeakPolarHBondContact O-CB 3.46Å; E760-A764 PolarHBondContact O-N 3.15Å; A764-A766 VanDerWaalsContact C-N 3.26Å; A764-A766 PolarHBondContact O-N 3Å
765	R	63.8	Low	62.4	Low	226 Å²	226	137.6 Å²	137.6	85%	0.853	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-6.5	178.2	-72.8	-175.3	-178.3	-177	2.9	114.5	R763	R763-R765 VanDerWaalsContact C-N 3.32Å; R763-R765 PolarHBondContact O-N 3.49Å
766	A	57.8	Low	61.2	Low	81 Å²	81	143.1 Å²	143.1	67%	0.669	71%	0.71	S	S	*	*			trans	-99.5	97.3	176.3	0	0	0	0	0	110.8	R763 A764	R763-A766 PolarHBondContact O-N 3.08Å; A764-A766 VanDerWaalsContact C-N 3.26Å; A764-A766 PolarHBondContact O-N 3Å
767	K	49.5	Very low	59.7	Low	194 Å²	194	147.4 Å²	147.4	84%	0.843	73%	0.729	S	S	*	*			trans	-127.4	133.8	168.5	-91.2	-171.4	176.3	-178.7	0	111.7
768	W	50.3	Low	58.3	Low	256 Å²	256	147.9 Å²	147.9	97%	0.97	74%	0.739	S	S	*	*			trans	-127.7	138.2	165.9	-78.2	80.6	0	0	0	109
769	D	38.8	Very low	56.6	Low	156 Å²	156	147 Å²	147	83%	0.834	75%	0.754	S	S	*	*			trans	-100.9	142.2	-173.5	-163.9	5.3	0	0	0	111.3
770	T	48.9	Very low	55.3	Low	137 Å²	137	148.1 Å²	148.1	84%	0.84	77%	0.771	S	S	*	*			trans	-143.5	108	-180	41.5	0	0	0	0	111.4
771	G	40.7	Very low	54	Low	64 Å²	64	147.8 Å²	147.8	66%	0.66	78%	0.781	S	S	*	*			trans	-100.6	151.7	164.8	0	0	0	0	0	111.8
772	H	40.3	Very low	52.8	Low	184 Å²	184	147.8 Å²	147.8	85%	0.852	79%	0.791	S	S	*	*			trans	160.2	137.5	133.4	-88.6	82.3	0	0	0	111.5
773	N	45.8	Very low	51.4	Low	133 Å²	133	150.6 Å²	150.6	71%	0.711	80%	0.801	S	S	*	*				175.6	132	91.3	-164.9	-17.4	0	0	0	111.9
774	P	52.5	Low	50.3	Low	115 Å²	115	147.6 Å²	147.6	75%	0.747	81%	0.805	S	S	*	*			trans	-99	31.3	-158.7	-1.5	25.4	0	0	0	118.7
775	L	44.5	Very low	48.8	Very low	165 Å²	165	151.3 Å²	151.3	86%	0.864	81%	0.814	S	S	*	*			trans	-113.6	14	-170.5	-81	167.8	0	0	0	117.9
776	Y	56.8	Low	48	Very low	218 Å²	218	147.5 Å²	147.5	86%	0.855	81%	0.809	S	S	*	*			trans	-104.5	116.3	-174.8	-167.2	-101.3	0	0	0	113.8
777	K	51.6	Low	47.2	Very low	213 Å²	213	149.5 Å²	149.5	93%	0.926	81%	0.813	S	S	*	*			trans	-139.2	122.8	162.1	-87.1	-172.8	176.6	179.3	0	110.5
778	G	53.6	Low	47.1	Very low	65 Å²	65	151.4 Å²	151.4	67%	0.67	82%	0.816	S	S	*	*			trans	-136.9	152.6	174.8	0	0	0	0	0	111.4
779	A	45.7	Very low	46.7	Very low	100 Å²	100	151.1 Å²	151.1	83%	0.826	82%	0.815	S	S	*	*			trans	-101.7	122	-154	0	0	0	0	0	115.5
780	T	50.9	Low	47	Very low	147 Å²	147	147.5 Å²	147.5	90%	0.902	81%	0.814	S	S	*	*			trans	-169.7	139.4	154.7	-3.4	0	0	0	0	110
781	S	52.3	Low	47.1	Very low	105 Å²	105	150.4 Å²	150.4	73%	0.734	82%	0.815	S	S	*	*			trans	-131	143.9	177.3	49.1	0	0	0	0	111.2
782	T	50.6	Low	47.2	Very low	140 Å²	140	158.8 Å²	158.8	86%	0.859	85%	0.845	S	S	*	*			trans	-151.3	140.1	175.5	-40.4	0	0	0	0	111.2
783	F	45.7	Very low	47.6	Very low	196 Å²	196	157.5 Å²	157.5	86%	0.86	85%	0.845	S	S	*	*			trans	-108.5	167.7	-170.2	-80.7	-95.9	0	0	0	113.5
784	T	46.8	Very low	47.7	Very low	129 Å²	129	158.8 Å²	158.8	79%	0.791	85%	0.852	S	S	*	*			trans	-83.8	160.3	-174	37.7	0	0	0	0	115.6
785	N	38.8	Very low	47.4	Very low	154 Å²	154	161.2 Å²	161.2	82%	0.824	86%	0.857	S	S	*	*			trans	-133	142.8	163.6	-162.9	-14.8	0	0	0	111.5
786	I	46.1	Very low	47.6	Very low	145 Å²	145	161 Å²	161	74%	0.744	86%	0.857	S	S	*	*			trans	-123.7	119.7	-166.1	-53.1	155.8	0	0	0	106.2
787	T	42.1	Very low	47	Very low	123 Å²	123	157.4 Å²	157.4	76%	0.755	86%	0.857	S	S	*	*			trans	175.4	97.9	155.5	22	0	0	0	0	110.6
788	Y	46.8	Very low	46.7	Very low	235 Å²	235	153.7 Å²	153.7	92%	0.922	85%	0.853	S	S	*	*				164.1	114.2	129.2	-111.9	-100	0	0	0	109.9
789	R	42.4	Very low	46.2	Very low	250 Å²	250	160.1 Å²	160.1	94%	0.943	87%	0.866	S	S	*	*			trans	-102.8	136.2	163.6	-96.3	-179.1	174.2	172.7	-1.8	106.8
790	G	45.4	Very low	46.2	Very low	79 Å²	79	164.7 Å²	164.7	81%	0.814	87%	0.869	S	S	*	*			trans	-147.3	132.8	167.4	0	0	0	0	0	109.7
791	K	49.6	Very low	45.8	Very low	198 Å²	198	166.2 Å²	166.2	86%	0.861	87%	0.866	S	S	*	*			trans	-84.2	140.1	-178.4	-72.4	174	169.8	179.8	0	110.9
792	D	43.6	Very low	45.3	Very low	240 Å²	240	171.7 Å²	171.7	100%	1.283	88%	0.878	S	S	*	*				-156.2	0	101.4	-90.3	-20.2	0	0	0	109.6

Retrieved 792 of 792 residues in 551 ms (Link to these results)

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