A0A5K4F0N4_SCHMA Loading...

WD_REPEATS_REGION domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0N4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 492 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	39.9	Very low	48.3	Very low	235 Å²	235	127.9 Å²	127.9	100%	1.158	64%	0.64	S	S	*	*				0	95.2	0	-78.6	-160.8	-99.1	0	0	107.2	T3	M1-T3 PolarHBondContact O-N 3.22Å
2	T	37.4	Very low	48.7	Very low	115 Å²	115	126.3 Å²	126.3	71%	0.706	63%	0.629	S	S	*	*			trans	-59.8	108.3	174.6	44.4	0	0	0	0	108.3
3	T	46.4	Very low	49	Very low	91 Å²	91	121.2 Å²	121.2	56%	0.558	62%	0.618	S	S	*	*			trans	-73.9	156.7	-179.5	52.1	0	0	0	0	109.3	M1 A5 D6	M1-T3 PolarHBondContact O-N 3.22Å; T3-A5 PolarHBondContact O-N 3.32Å; T3-D6 PolarHBondContact O-N 3.32Å
4	L	45.6	Very low	49	Very low	149 Å²	149	122.6 Å²	122.6	78%	0.78	62%	0.621	S	S	*	*	H	α-helix	trans	-48.1	-21.2	-179.6	-94.9	147.8	0	0	0	114.8	L7 H8	L4-L7 PolarHBondContact O-N 3.36Å; L4-H8 PolarHBondContact O-N 2.47Å
5	A	52.9	Low	49.1	Very low	54 Å²	54	120.9 Å²	120.9	45%	0.446	62%	0.619	S	S	.	*	H	α-helix	trans	-65.7	-34.3	172.9	0	0	0	0	0	113.4	T3 H8 R9	T3-A5 PolarHBondContact O-N 3.32Å; A5-H8 PolarHBondContact O-N 3.26Å; A5-R9 WeakPolarHBondContact O-CG 3.22Å; A5-R9 PolarHBondContact O-N 3.04Å
6	D	51.1	Low	49.1	Very low	62 Å²	62	117.8 Å²	117.8	33%	0.332	62%	0.617	S	S	.	*	H	α-helix	trans	-74.1	-32.1	178.6	-66.2	-26.8	0	0	0	111.6	T3 L10	T3-D6 PolarHBondContact O-N 3.32Å; D6-L10 WeakPolarHBondContact O-CG 3.12Å; D6-L10 PolarHBondContact O-N 3.05Å; D6-L10 VanDerWaalsContact O-N 3.11Å
7	L	49	Very low	49.1	Very low	110 Å²	110	115.4 Å²	115.4	58%	0.576	62%	0.618	S	S	*	*	H	α-helix	trans	-72.5	-31.8	174.2	-86.7	168.2	0	0	0	112.7	L4 R11	L4-L7 PolarHBondContact O-N 3.36Å; L7-R11 PolarHBondContact O-N 3.34Å; L7-R11 VanDerWaalsContact O-N 3.15Å
8	H	52.9	Low	49.1	Very low	116 Å²	116	117.7 Å²	117.7	54%	0.537	63%	0.631	S	S	.	*	H	α-helix	trans	-69.6	-42.7	174	-127	-85.1	0	0	0	111.5	L4 A5 L10 R11 E12	L4-H8 PolarHBondContact O-N 2.47Å; A5-H8 PolarHBondContact O-N 3.26Å; H8-L10 PolarHBondContact O-N 3.08Å; H8-R11 PolarHBondContact O-N 3.48Å; H8-E12 IonicContact CE1-OE1 2.85Å; H8-E12 IonicContact ND1-OE1 3.59Å; H8-E12 PolarHBondContact ND1-OE1 3.33Å; H8-E12 PolarHBondContact O-N 3.31Å
9	R	53.9	Low	48.9	Very low	176 Å²	176	114.5 Å²	114.5	66%	0.664	62%	0.623	S	S	*	*	H	α-helix	trans	-62.9	-38.3	175.9	-76.4	178.8	177.9	163.6	-1.6	113.4	A5 A13	A5-R9 WeakPolarHBondContact O-CG 3.22Å; A5-R9 PolarHBondContact O-N 3.04Å; R9-A13 VanDerWaalsContact O-CB 3.3Å; R9-A13 WeakPolarHBondContact O-CB 3.49Å; R9-A13 PolarHBondContact O-N 3.09Å
10	L	51.6	Low	48.7	Very low	105 Å²	105	114.7 Å²	114.7	55%	0.55	62%	0.623	S	S	.	*	H	α-helix	trans	-71.4	-31.2	175.6	-74.9	169.4	0	0	0	112.5	D6 H8 H14	D6-L10 WeakPolarHBondContact O-CG 3.12Å; D6-L10 PolarHBondContact O-N 3.05Å; D6-L10 VanDerWaalsContact O-N 3.11Å; H8-L10 PolarHBondContact O-N 3.08Å; L10-H14 WeakPolarHBondContact O-CB 3.42Å; L10-H14 PolarHBondContact O-CD2 2.92Å; L10-H14 VanDerWaalsContact O-CD2 3.29Å; L10-H14 PolarHBondContact O-N 3.18Å; L10-H14 VanDerWaalsContact O-N 3.12Å
11	R	50.8	Low	48.6	Very low	194 Å²	194	119.3 Å²	119.3	73%	0.732	64%	0.637	S	S	*	*	H	α-helix	trans	-70.9	-42	174.8	-120.3	177.8	178.8	170.2	-0.5	111.9	L7 H8 H14 T15	L7-R11 PolarHBondContact O-N 3.34Å; L7-R11 VanDerWaalsContact O-N 3.15Å; H8-R11 PolarHBondContact O-N 3.48Å; R11-H14 PolarHBondContact O-N 3.42Å; R11-T15 WeakPolarHBondContact O-CG2 3.38Å; R11-T15 PolarHBondContact O-N 3.49Å; R11-T15 PolarHBondContact O-OG1 3.34Å; R11-T15 VanDerWaalsContact O-OG1 3.1Å
12	E	52.5	Low	48.7	Very low	108 Å²	108	114.4 Å²	114.4	51%	0.505	62%	0.615	S	S	.	*	H	α-helix	trans	-66.7	-38.8	176.3	-76.2	163.8	-160.8	0	0	111.8	H8 H14 T15 A16	H8-E12 IonicContact CE1-OE1 2.85Å; H8-E12 IonicContact ND1-OE1 3.59Å; H8-E12 PolarHBondContact ND1-OE1 3.33Å; H8-E12 PolarHBondContact O-N 3.31Å; E12-H14 PolarHBondContact O-N 2.96Å; E12-T15 WeakPolarHBondContact CA-OG1 3.47Å; E12-T15 PolarHBondContact O-N 2.9Å; E12-T15 PolarHBondContact O-OG1 2.89Å; E12-A16 WeakPolarHBondContact O-CB 3.27Å; E12-A16 PolarHBondContact O-N 2.99Å
13	A	52.7	Low	49	Very low	60 Å²	60	113.2 Å²	113.2	50%	0.496	63%	0.626	S	S	.	*	H	α-helix	trans	-65.2	-35.4	174.3	0	0	0	0	0	113	R9 A17	R9-A13 VanDerWaalsContact O-CB 3.3Å; R9-A13 WeakPolarHBondContact O-CB 3.49Å; R9-A13 PolarHBondContact O-N 3.09Å; A13-A17 PolarHBondContact O-N 3.44Å
14	H	49	Very low	49	Very low	141 Å²	141	114.2 Å²	114.2	65%	0.653	63%	0.632	S	S	*	*	H	α-helix	trans	-77.9	-27.2	176.8	-88.7	-62.8	0	0	0	113.8	L10 R11 E12	L10-H14 WeakPolarHBondContact O-CB 3.42Å; L10-H14 PolarHBondContact O-CD2 2.92Å; L10-H14 VanDerWaalsContact O-CD2 3.29Å; L10-H14 PolarHBondContact O-N 3.18Å; L10-H14 VanDerWaalsContact O-N 3.12Å; R11-H14 PolarHBondContact O-N 3.42Å; E12-H14 PolarHBondContact O-N 2.96Å
15	T	50.1	Low	49.4	Very low	97 Å²	97	113.7 Å²	113.7	60%	0.595	63%	0.629	S	S	*	*	H	α-helix	trans	-78.2	-32.3	173.2	48	0	0	0	0	112.5	R11 E12 A17	R11-T15 WeakPolarHBondContact O-CG2 3.38Å; R11-T15 PolarHBondContact O-N 3.49Å; R11-T15 PolarHBondContact O-OG1 3.34Å; R11-T15 VanDerWaalsContact O-OG1 3.1Å; E12-T15 WeakPolarHBondContact CA-OG1 3.47Å; E12-T15 PolarHBondContact O-N 2.9Å; E12-T15 PolarHBondContact O-OG1 2.89Å; T15-A17 VanDerWaalsContact C-N 3.31Å; T15-A17 PolarHBondContact O-N 3.32Å
16	A	49.5	Very low	49.4	Very low	71 Å²	71	114.3 Å²	114.3	59%	0.587	63%	0.629	S	S	*	*	H	α-helix	trans	-70.9	-24.3	176.4	0	0	0	0	0	113.3	E12 N18	E12-A16 WeakPolarHBondContact O-CB 3.27Å; E12-A16 PolarHBondContact O-N 2.99Å; A16-N18 VanDerWaalsContact C-N 3.33Å; A16-N18 PolarHBondContact O-N 3.06Å
17	A	48.9	Very low	49.5	Very low	77 Å²	77	118.4 Å²	118.4	64%	0.636	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-13.9	-178.9	0	0	0	0	0	114.6	A13 T15	A13-A17 PolarHBondContact O-N 3.44Å; T15-A17 VanDerWaalsContact C-N 3.31Å; T15-A17 PolarHBondContact O-N 3.32Å
18	N	49.3	Very low	49.9	Very low	157 Å²	157	119.2 Å²	119.2	84%	0.84	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	2.5	-175.2	-84.2	-19.8	0	0	0	114.8	A16	A16-N18 VanDerWaalsContact C-N 3.33Å; A16-N18 PolarHBondContact O-N 3.06Å
19	A	45.2	Very low	50.1	Low	58 Å²	58	119.6 Å²	119.6	48%	0.479	66%	0.657	S	S	.	*	S	Bend	trans	-120.7	110.5	173.1	0	0	0	0	0	107.8
20	N	45.3	Very low	50.3	Low	117 Å²	117	115.1 Å²	115.1	63%	0.626	65%	0.649	S	S	*	*			trans	140.3	81.7	156.8	-66.8	-16.8	0	0	0	111.9
21	K	47.3	Very low	51	Low	213 Å²	213	114.8 Å²	114.8	93%	0.926	65%	0.648	S	S	*	*	S	Bend	trans	-82.4	1.1	153.1	-96.6	-176	176.1	178.8	0	112.6
22	D	42	Very low	52	Low	131 Å²	131	112 Å²	112	70%	0.701	64%	0.641	S	S	*	*	S	Bend	trans	-121	121.7	177.9	-66.9	-47	0	0	0	109.5	T24	D22-T24 VanDerWaalsContact C-N 3.33Å; D22-T24 PolarHBondContact O-N 3.2Å
23	G	43.5	Very low	53.2	Low	90 Å²	90	111.9 Å²	111.9	93%	0.928	64%	0.644	S	S	*	*			trans	-78.1	62.2	-163.9	0	0	0	0	0	115.8
24	T	46	Very low	54.4	Low	112 Å²	112	111.3 Å²	111.3	69%	0.687	64%	0.639	S	S	*	*			trans	-134.6	101.1	169.6	46.8	0	0	0	0	110.1	D22	D22-T24 VanDerWaalsContact C-N 3.33Å; D22-T24 PolarHBondContact O-N 3.2Å
25	L	53.7	Low	55.7	Low	138 Å²	138	110 Å²	110	72%	0.723	63%	0.633	S	S	*	*			trans	-62.6	137.7	168.8	-73.3	164.4	0	0	0	109.3	L27	L25-L27 PolarHBondContact O-N 2.8Å
26	P	52.2	Low	57.1	Low	67 Å²	67	110.8 Å²	110.8	44%	0.435	63%	0.63	S	S	.	*			trans	-61.6	112	173.8	-15.3	28.1	0	0	0	109.3	D28 E29	P26-D28 PolarHBondContact O-N 3.47Å; P26-D28 VanDerWaalsContact O-N 3.09Å; P26-E29 PolarHBondContact O-N 2.81Å
27	L	55.1	Low	58.6	Low	148 Å²	148	110 Å²	110	78%	0.775	62%	0.624	S	S	*	*	H	α-helix	trans	-57.4	-24.7	-178.7	-70.6	164.6	0	0	0	112.4	L25 D31	L25-L27 PolarHBondContact O-N 2.8Å; L27-D31 PolarHBondContact O-N 3.39Å
28	D	56.5	Low	60.2	Low	127 Å²	127	111 Å²	111	68%	0.679	62%	0.618	S	S	*	*	H	α-helix	trans	-76.3	-27.3	-178.7	-68.2	-12.4	0	0	0	114.7	P26 K32	P26-D28 PolarHBondContact O-N 3.47Å; P26-D28 VanDerWaalsContact O-N 3.09Å; D28-K32 PolarHBondContact O-N 3.49Å
29	E	56.4	Low	61.7	Low	124 Å²	124	108.1 Å²	108.1	58%	0.579	60%	0.603	S	S	*	*	H	α-helix	trans	-79.3	-31	176.8	-74.9	-171	168.2	0	0	111.9	P26 D31 N33	P26-E29 PolarHBondContact O-N 2.81Å; E29-D31 VanDerWaalsContact C-N 3.28Å; E29-D31 PolarHBondContact O-N 3.34Å; E29-N33 PolarHBondContact O-N 2.87Å; E29-N33 PolarHBondContact O-ND2 3.12Å
30	V	57.8	Low	63.4	Low	83 Å²	83	110.6 Å²	110.6	50%	0.503	61%	0.605	S	S	.	*	H	α-helix	trans	-64.6	-38.1	174.1	-175.5	0	0	0	0	110	A34	V30-A34 WeakPolarHBondContact O-CB 3.33Å; V30-A34 PolarHBondContact O-N 3.23Å
31	D	66.5	Low	65.3	Low	98 Å²	98	109.4 Å²	109.4	52%	0.524	60%	0.597	S	S	.	*	H	α-helix	trans	-70	-38.8	179.5	-114	3.7	0	0	0	113.2	L27 E29 A34 Q35	L27-D31 PolarHBondContact O-N 3.39Å; E29-D31 VanDerWaalsContact C-N 3.28Å; E29-D31 PolarHBondContact O-N 3.34Å; D31-A34 PolarHBondContact O-N 3.42Å; D31-Q35 WeakPolarHBondContact O-CB 3.4Å; D31-Q35 WeakPolarHBondContact O-CG 3.41Å; D31-Q35 PolarHBondContact O-N 3.15Å
32	K	73	Confident	66.9	Low	135 Å²	135	103.6 Å²	103.6	59%	0.587	57%	0.574	S	S	*	*	H	α-helix	trans	-66.6	-46.7	175.8	-71.9	178.8	-176.2	173.3	0	112.4	D28 A34 Q35 E36	D28-K32 PolarHBondContact O-N 3.49Å; K32-A34 VanDerWaalsContact C-N 3.3Å; K32-A34 PolarHBondContact O-N 2.81Å; K32-Q35 PolarHBondContact O-N 2.83Å; K32-E36 WeakPolarHBondContact O-CG 3.17Å; K32-E36 PolarHBondContact O-N 3.04Å
33	N	76.8	Confident	68.7	Low	105 Å²	105	99.7 Å²	99.7	56%	0.561	55%	0.552	S	S	*	*	H	α-helix	trans	-64.3	-37.9	177.3	-72.9	-24.2	0	0	0	111.5	E29 A37	E29-N33 PolarHBondContact O-N 2.87Å; E29-N33 PolarHBondContact O-ND2 3.12Å; N33-A37 WeakPolarHBondContact O-CB 3.35Å; N33-A37 PolarHBondContact O-N 3.36Å
34	A	77.8	Confident	70.5	Confident	49 Å²	49	102.3 Å²	102.3	41%	0.405	53%	0.534	S	S	.	.	H	α-helix	trans	-64.4	-43.1	173.9	0	0	0	0	0	111.7	V30 D31 K32 A37 L38	V30-A34 WeakPolarHBondContact O-CB 3.33Å; V30-A34 PolarHBondContact O-N 3.23Å; D31-A34 PolarHBondContact O-N 3.42Å; K32-A34 VanDerWaalsContact C-N 3.3Å; K32-A34 PolarHBondContact O-N 2.81Å; A34-A37 PolarHBondContact O-N 3.11Å; A34-L38 WeakPolarHBondContact O-CB 3.38Å; A34-L38 PolarHBondContact O-N 2.87Å
35	Q	77.5	Confident	72.3	Confident	112 Å²	112	103 Å²	103	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-65.2	-41.5	176.4	-82.3	166.6	-10.7	0	0	112.8	D31 K32 L38 N39	D31-Q35 WeakPolarHBondContact O-CB 3.4Å; D31-Q35 WeakPolarHBondContact O-CG 3.41Å; D31-Q35 PolarHBondContact O-N 3.15Å; K32-Q35 PolarHBondContact O-N 2.83Å; Q35-L38 PolarHBondContact O-N 2.94Å; Q35-N39 WeakPolarHBondContact O-CB 3.25Å; Q35-N39 VanDerWaalsContact O-CG 3.22Å; Q35-N39 PolarHBondContact O-N 3.35Å; Q35-N39 PolarHBondContact O-ND2 3.49Å
36	E	79.1	Confident	73.5	Confident	114 Å²	114	102.1 Å²	102.1	53%	0.533	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-42.6	174.4	-74.3	-175.2	-174.2	0	0	112.1	K32 L38 N39 Q40	K32-E36 WeakPolarHBondContact O-CG 3.17Å; K32-E36 PolarHBondContact O-N 3.04Å; E36-L38 VanDerWaalsContact C-N 3.32Å; E36-L38 PolarHBondContact O-N 2.9Å; E36-N39 PolarHBondContact O-N 2.94Å; E36-Q40 WeakPolarHBondContact O-CG 3.49Å; E36-Q40 PolarHBondContact O-N 2.99Å
37	A	80.9	Confident	74.8	Confident	55 Å²	55	99 Å²	99	46%	0.455	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-39.9	175.4	0	0	0	0	0	111.7	N33 A34 Q40 L41	N33-A37 WeakPolarHBondContact O-CB 3.35Å; N33-A37 PolarHBondContact O-N 3.36Å; A34-A37 PolarHBondContact O-N 3.11Å; A37-Q40 PolarHBondContact O-N 3.37Å; A37-L41 WeakPolarHBondContact O-CB 3.23Å; A37-L41 PolarHBondContact O-N 3.09Å
38	L	82.6	Confident	76	Confident	98 Å²	98	101.5 Å²	101.5	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-46	176.2	-133.7	154.8	0	0	0	111	A34 Q35 E36 Q40 L41 E42	A34-L38 WeakPolarHBondContact O-CB 3.38Å; A34-L38 PolarHBondContact O-N 2.87Å; Q35-L38 PolarHBondContact O-N 2.94Å; E36-L38 VanDerWaalsContact C-N 3.32Å; E36-L38 PolarHBondContact O-N 2.9Å; L38-Q40 PolarHBondContact O-N 3.1Å; L38-L41 WeakPolarHBondContact O-CB 3.48Å; L38-L41 PolarHBondContact O-N 3Å; L38-L41 VanDerWaalsContact O-N 3.14Å; L38-E42 HydrophobicContact CD2-CG 4.34Å; L38-E42 WeakPolarHBondContact O-CG 3.23Å; L38-E42 PolarHBondContact O-N 2.91Å
39	N	80.8	Confident	77	Confident	97 Å²	97	102.3 Å²	102.3	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-60.6	-43.8	176.2	-72.8	-19.2	0	0	0	112.1	Q35 E36 L41 E42 L43	Q35-N39 WeakPolarHBondContact O-CB 3.25Å; Q35-N39 VanDerWaalsContact O-CG 3.22Å; Q35-N39 PolarHBondContact O-N 3.35Å; Q35-N39 PolarHBondContact O-ND2 3.49Å; E36-N39 PolarHBondContact O-N 2.94Å; N39-L41 VanDerWaalsContact C-N 3.3Å; N39-L41 PolarHBondContact O-N 3.43Å; N39-E42 PolarHBondContact O-N 3.13Å; N39-L43 WeakPolarHBondContact O-CB 2.95Å; N39-L43 PolarHBondContact O-N 2.68Å
40	Q	81.7	Confident	78	Confident	110 Å²	110	97.6 Å²	97.6	51%	0.514	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-36.7	175.4	-73.3	-178.5	22.6	0	0	112.4	E36 A37 L38 L43 R44	E36-Q40 WeakPolarHBondContact O-CG 3.49Å; E36-Q40 PolarHBondContact O-N 2.99Å; A37-Q40 PolarHBondContact O-N 3.37Å; L38-Q40 PolarHBondContact O-N 3.1Å; Q40-L43 PolarHBondContact O-N 3.19Å; Q40-R44 WeakPolarHBondContact O-CB 3.36Å; Q40-R44 WeakPolarHBondContact O-CG 3.13Å; Q40-R44 PolarHBondContact O-N 2.82Å
41	L	84	Confident	79	Confident	91 Å²	91	103 Å²	103	48%	0.476	50%	0.499	S	S	.	.	H	α-helix	trans	-68.4	-42.1	177.8	-153.6	164.5	0	0	0	110.6	A37 L38 N39 R44 K45	A37-L41 WeakPolarHBondContact O-CB 3.23Å; A37-L41 PolarHBondContact O-N 3.09Å; L38-L41 WeakPolarHBondContact O-CB 3.48Å; L38-L41 PolarHBondContact O-N 3Å; L38-L41 VanDerWaalsContact O-N 3.14Å; N39-L41 VanDerWaalsContact C-N 3.3Å; N39-L41 PolarHBondContact O-N 3.43Å; L41-R44 PolarHBondContact O-N 2.85Å; L41-K45 HydrophobicContact CD2-CD 3.81Å; L41-K45 HydrophobicContact CD2-CG 4.15Å; L41-K45 WeakPolarHBondContact O-CG 3.42Å; L41-K45 PolarHBondContact O-N 2.99Å
42	E	81.9	Confident	79.7	Confident	91 Å²	91	99.2 Å²	99.2	43%	0.425	48%	0.48	S	S	.	.	H	α-helix	trans	-62.2	-41.6	172.5	-72.2	-171.2	175.2	0	0	112.6	L38 N39 K45 K46	L38-E42 HydrophobicContact CD2-CG 4.34Å; L38-E42 WeakPolarHBondContact O-CG 3.23Å; L38-E42 PolarHBondContact O-N 2.91Å; N39-E42 PolarHBondContact O-N 3.13Å; E42-K45 WeakPolarHBondContact O-CB 2.97Å; E42-K45 PolarHBondContact O-N 3.39Å; E42-K46 WeakPolarHBondContact O-CG 3.25Å; E42-K46 PolarHBondContact O-N 2.97Å
43	L	79.6	Confident	80.1	Confident	49 Å²	49	94.7 Å²	94.7	26%	0.257	47%	0.465	S	S	.	.	H	α-helix	trans	-66.1	-41.8	178.9	-139.4	150.5	0	0	0	111.6	N39 Q40 K45 K46 A47 M86 A89 V90	N39-L43 WeakPolarHBondContact O-CB 2.95Å; N39-L43 PolarHBondContact O-N 2.68Å; Q40-L43 PolarHBondContact O-N 3.19Å; L43-K45 VanDerWaalsContact C-N 3.33Å; L43-K45 PolarHBondContact O-N 3.17Å; L43-K46 PolarHBondContact O-N 3.25Å; L43-A47 WeakPolarHBondContact O-CB 3.47Å; L43-A47 PolarHBondContact O-N 2.89Å; L43-M86 HydrophobicContact CD2-CE 3.74Å; L43-A89 HydrophobicContact CD2-CB 3.63Å; L43-V90 HydrophobicContact CD1-CG2 3.89Å; L43-V90 HydrophobicContact CD2-CG2 3.64Å; L43-V90 HydrophobicContact CG-CG2 4.34Å
44	R	80.9	Confident	80.5	Confident	146 Å²	146	95.1 Å²	95.1	55%	0.551	47%	0.472	S	S	*	.	H	α-helix	trans	-66.1	-32.4	172.4	-76.3	179.4	172.8	155.1	-0.5	113	Q40 L41 R48 M86	Q40-R44 WeakPolarHBondContact O-CB 3.36Å; Q40-R44 WeakPolarHBondContact O-CG 3.13Å; Q40-R44 PolarHBondContact O-N 2.82Å; L41-R44 PolarHBondContact O-N 2.85Å; R44-R48 WeakPolarHBondContact O-CG 3.06Å; R44-R48 PolarHBondContact O-N 3.39Å; R44-M86 HydrophobicContact CG-CE 4.5Å; R44-M86 HydrophobicContact CG-SD 4.47Å
45	K	83	Confident	80.9	Confident	126 Å²	126	97.7 Å²	97.7	55%	0.548	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-44.8	172.1	-79.8	172.8	172.4	173.7	0	110.7	L41 E42 L43 R48	L41-K45 HydrophobicContact CD2-CD 3.81Å; L41-K45 HydrophobicContact CD2-CG 4.15Å; L41-K45 WeakPolarHBondContact O-CG 3.42Å; L41-K45 PolarHBondContact O-N 2.99Å; E42-K45 WeakPolarHBondContact O-CB 2.97Å; E42-K45 PolarHBondContact O-N 3.39Å; L43-K45 VanDerWaalsContact C-N 3.33Å; L43-K45 PolarHBondContact O-N 3.17Å; K45-R48 PolarHBondContact O-N 3.31Å
46	K	79.2	Confident	81.4	Confident	119 Å²	119	94.8 Å²	94.8	52%	0.517	46%	0.463	S	S	.	.	H	α-helix	trans	-60.6	-45.1	173.8	-71.9	175.6	-179.3	175	0	111.6	E42 L43 R48 L49 I50 A89	E42-K46 WeakPolarHBondContact O-CG 3.25Å; E42-K46 PolarHBondContact O-N 2.97Å; L43-K46 PolarHBondContact O-N 3.25Å; K46-R48 VanDerWaalsContact C-N 3.32Å; K46-R48 PolarHBondContact O-N 3.41Å; K46-L49 WeakPolarHBondContact O-CB 3.46Å; K46-L49 PolarHBondContact O-N 2.98Å; K46-L49 VanDerWaalsContact O-N 3.13Å; K46-I50 WeakPolarHBondContact O-CG1 3.24Å; K46-A89 HydrophobicContact CB-CB 4.24Å
47	A	80.4	Confident	81.8	Confident	2 Å²	2	93.2 Å²	93.2	2%	0.017	47%	0.465	C	S	.	.	H	α-helix	trans	-60.9	-36.2	179.3	0	0	0	0	0	113.6	L43 L49 I50 M86 A89	L43-A47 WeakPolarHBondContact O-CB 3.47Å; L43-A47 PolarHBondContact O-N 2.89Å; A47-L49 VanDerWaalsContact C-N 3.29Å; A47-L49 PolarHBondContact O-N 3.04Å; A47-I50 PolarHBondContact O-N 3.13Å; A47-M86 HydrophobicContact CB-SD 3.78Å; A47-A89 HydrophobicContact CB-CB 3.73Å
48	R	79.4	Confident	82.1	Confident	200 Å²	200	93.5 Å²	93.5	76%	0.755	46%	0.457	S	S	*	.	H	α-helix	trans	-69.3	-24.4	176.7	-76.8	-175.4	-125.6	-166.6	-2.1	114.1	R44 K45 K46 I50	R44-R48 WeakPolarHBondContact O-CG 3.06Å; R44-R48 PolarHBondContact O-N 3.39Å; K45-R48 PolarHBondContact O-N 3.31Å; K46-R48 VanDerWaalsContact C-N 3.32Å; K46-R48 PolarHBondContact O-N 3.41Å; R48-I50 VanDerWaalsContact C-N 3.32Å
49	L	77.2	Confident	82.3	Confident	144 Å²	144	89 Å²	89	75%	0.754	43%	0.433	S	S	*	.	H	α-helix	trans	-78	-21.2	177.3	-69.4	160.9	0	0	0	111.9	K46 A47	K46-L49 WeakPolarHBondContact O-CB 3.46Å; K46-L49 PolarHBondContact O-N 2.98Å; K46-L49 VanDerWaalsContact O-N 3.13Å; A47-L49 VanDerWaalsContact C-N 3.29Å; A47-L49 PolarHBondContact O-N 3.04Å
50	I	78.9	Confident	82.7	Confident	25 Å²	25	89.1 Å²	89.1	13%	0.128	43%	0.426	C	S	.	.	S	Bend	trans	-84.9	115.7	-177.1	-59	169.3	0	0	0	109.6	K46 A47 R48 V52 L88 A89	K46-I50 WeakPolarHBondContact O-CG1 3.24Å; A47-I50 PolarHBondContact O-N 3.13Å; R48-I50 VanDerWaalsContact C-N 3.32Å; I50-V52 HydrophobicContact CG2-CG2 4.06Å; I50-L88 HydrophobicContact CD1-CB 3.87Å; I50-L88 HydrophobicContact CG2-CB 4.22Å; I50-L88 HydrophobicContact CG2-CD1 3.93Å; I50-A89 HydrophobicContact CD1-CB 4.03Å
51	Q	77.9	Confident	83	Confident	198 Å²	198	84.8 Å²	84.8	93%	0.925	41%	0.41	S	S	*	.			trans	-82.1	118.3	173.3	-67.5	-167.8	-19.4	0	0	110.4
52	V	80.4	Confident	83.1	Confident	18 Å²	18	84.4 Å²	84.4	11%	0.109	40%	0.402	C	S	.	.			trans	-116.1	139.3	175.7	177.6	0	0	0	0	108.6	I50 V59 R81 L84 R85 L88	I50-V52 HydrophobicContact CG2-CG2 4.06Å; V52-V59 HydrophobicContact CG1-CG2 4.18Å; V52-R81 HydrophobicContact CB-CG 4.48Å; V52-R81 HydrophobicContact CG1-CG 4.01Å; V52-R81 PolarHBondContact O-NE 3.09Å; V52-R81 PolarHBondContact O-NH2 3Å; V52-L84 HydrophobicContact CG1-CD2 3.61Å; V52-L84 HydrophobicContact CG1-CG 4.2Å; V52-R85 HydrophobicContact CB-CG 4.07Å; V52-R85 HydrophobicContact CG2-CB 4.47Å; V52-R85 HydrophobicContact CG2-CG 3.44Å; V52-R85 VanDerWaalsContact CG2-CG 3.44Å; V52-L88 HydrophobicContact CG2-CD1 3.84Å
53	S	82.8	Confident	83.4	Confident	39 Å²	39	80 Å²	80	27%	0.273	38%	0.382	S	S	.	.			trans	-59.3	159.3	-178.8	68.3	0	0	0	0	112.9	E58 R81	S53-E58 WeakPolarHBondContact CB-OE2 3.39Å; S53-E58 WeakPolarHBondContact OG-CB 3.24Å; S53-E58 PolarHBondContact OG-OE2 3.34Å; S53-R81 WeakPolarHBondContact O-CD 3.35Å; S53-R81 PolarHBondContact O-NE 2.89Å
54	T	84.4	Confident	83.8	Confident	115 Å²	115	85.5 Å²	85.5	71%	0.706	40%	0.399	S	S	*	.	S	Bend	trans	-91.8	-12.2	179.7	45.3	0	0	0	0	112.7
55	E	87.1	Confident	84	Confident	102 Å²	102	83.1 Å²	83.1	48%	0.477	39%	0.394	S	S	.	.			trans	-81.3	120.6	-179.4	-63	-166.8	-178	0	0	111	S57 E58 V59	E55-S57 VanDerWaalsContact C-N 3.26Å; E55-S57 PolarHBondContact O-N 2.89Å; E55-E58 HydrophobicContact CB-CB 4.34Å; E55-E58 HydrophobicContact CB-CG 4.06Å; E55-E58 PolarHBondContact O-N 2.74Å; E55-V59 WeakPolarHBondContact O-CG2 3.07Å; E55-V59 PolarHBondContact O-N 3.11Å; E55-V59 VanDerWaalsContact O-N 3.09Å
56	D	87.2	Confident	84.1	Confident	51 Å²	51	80.2 Å²	80.2	27%	0.273	38%	0.384	S	S	.	.	H	α-helix	trans	-64.1	-31.3	-178.5	-172.5	46.9	0	0	0	112.6	V59 R60 R80	D56-V59 PolarHBondContact O-N 2.97Å; D56-R60 WeakPolarHBondContact O-CB 3.49Å; D56-R60 WeakPolarHBondContact O-CG 3.44Å; D56-R60 PolarHBondContact O-N 3.06Å; D56-R60 IonicContact OD1-NE 3.55Å; D56-R60 IonicContact OD2-CZ 2.62Å; D56-R60 IonicContact OD2-NE 3.65Å; D56-R60 PolarHBondContact OD2-NE 2.95Å; D56-R60 IonicContact OD2-NH2 3.8Å; D56-R60 PolarHBondContact OD2-NH2 3.24Å; D56-R80 IonicContact OD1-CZ 2.76Å; D56-R80 IonicContact OD1-NE 3.49Å; D56-R80 IonicContact OD1-NH1 3.65Å; D56-R80 PolarHBondContact OD1-NH1 3.29Å; D56-R80 IonicContact OD2-NH1 3.26Å; D56-R80 PolarHBondContact OD2-NH1 2.95Å
57	S	87.4	Confident	84.4	Confident	81 Å²	81	78 Å²	78	57%	0.566	40%	0.395	S	S	*	.	H	α-helix	trans	-58.8	-47.8	174.6	44.6	0	0	0	0	112	E55 R60 A61	E55-S57 VanDerWaalsContact C-N 3.26Å; E55-S57 PolarHBondContact O-N 2.89Å; S57-R60 PolarHBondContact O-N 3.33Å; S57-A61 WeakPolarHBondContact O-CB 3.36Å; S57-A61 PolarHBondContact O-N 2.81Å
58	E	87.5	Confident	84.8	Confident	62 Å²	62	81.7 Å²	81.7	29%	0.29	41%	0.412	S	S	.	.	H	α-helix	trans	-67.9	-44.9	178.1	-64.4	-175.2	158.5	0	0	110.9	S53 E55 R60 A61 Y62	S53-E58 WeakPolarHBondContact CB-OE2 3.39Å; S53-E58 WeakPolarHBondContact OG-CB 3.24Å; S53-E58 PolarHBondContact OG-OE2 3.34Å; E55-E58 HydrophobicContact CB-CB 4.34Å; E55-E58 HydrophobicContact CB-CG 4.06Å; E55-E58 PolarHBondContact O-N 2.74Å; E58-R60 VanDerWaalsContact C-N 3.3Å; E58-R60 PolarHBondContact O-N 3.35Å; E58-A61 CarbonylContact O-C 3.59Å; E58-A61 WeakPolarHBondContact O-CB 3.38Å; E58-A61 PolarHBondContact O-N 3.43Å; E58-Y62 VanDerWaalsContact O-CD2 3.27Å; E58-Y62 WeakPolarHBondContact O-CD2 3.33Å; E58-Y62 PolarHBondContact O-N 3.36Å
59	V	87.1	Confident	85.2	Confident	2 Å²	2	75.1 Å²	75.1	1%	0.012	40%	0.395	C	S	.	.	H	α-helix	trans	-57.3	-44.5	176.7	172.9	0	0	0	0	110.9	V52 E55 D56 Y62 L63 R80 R81 L84	V52-V59 HydrophobicContact CG1-CG2 4.18Å; E55-V59 WeakPolarHBondContact O-CG2 3.07Å; E55-V59 PolarHBondContact O-N 3.11Å; E55-V59 VanDerWaalsContact O-N 3.09Å; D56-V59 PolarHBondContact O-N 2.97Å; V59-Y62 PolarHBondContact O-N 3.48Å; V59-L63 HydrophobicContact CG1-CD1 4.16Å; V59-L63 WeakPolarHBondContact O-CG 3.38Å; V59-L63 PolarHBondContact O-N 3.19Å; V59-R80 HydrophobicContact CG1-CG 3.83Å; V59-R81 HydrophobicContact CG2-CG 4.47Å; V59-L84 HydrophobicContact CB-CD2 4.28Å; V59-L84 HydrophobicContact CG1-CB 4.32Å; V59-L84 HydrophobicContact CG1-CD2 3.85Å; V59-L84 HydrophobicContact CG2-CD2 4.29Å
60	R	88.6	Confident	85.8	Confident	100 Å²	100	70.2 Å²	70.2	38%	0.377	37%	0.371	S	S	.	.	H	α-helix	trans	-63.8	-39.8	174.9	-72.3	176.8	-169.5	-165.1	4.2	112.4	D56 S57 E58 R64 V70	D56-R60 WeakPolarHBondContact O-CB 3.49Å; D56-R60 WeakPolarHBondContact O-CG 3.44Å; D56-R60 PolarHBondContact O-N 3.06Å; D56-R60 IonicContact OD1-NE 3.55Å; D56-R60 IonicContact OD2-CZ 2.62Å; D56-R60 IonicContact OD2-NE 3.65Å; D56-R60 PolarHBondContact OD2-NE 2.95Å; D56-R60 IonicContact OD2-NH2 3.8Å; D56-R60 PolarHBondContact OD2-NH2 3.24Å; S57-R60 PolarHBondContact O-N 3.33Å; E58-R60 VanDerWaalsContact C-N 3.3Å; E58-R60 PolarHBondContact O-N 3.35Å; R60-R64 WeakPolarHBondContact O-CB 3.48Å; R60-R64 PolarHBondContact O-N 3.16Å; R60-V70 HydrophobicContact CB-CG1 3.74Å; R60-V70 HydrophobicContact CG-CG1 3.67Å
61	A	87.5	Confident	86.3	Confident	20 Å²	20	72 Å²	72	17%	0.165	39%	0.385	C	S	.	.	H	α-helix	trans	-64.5	-43	176.2	0	0	0	0	0	111.4	S57 E58 R64 Q65 L100	S57-A61 WeakPolarHBondContact O-CB 3.36Å; S57-A61 PolarHBondContact O-N 2.81Å; E58-A61 CarbonylContact O-C 3.59Å; E58-A61 WeakPolarHBondContact O-CB 3.38Å; E58-A61 PolarHBondContact O-N 3.43Å; A61-R64 WeakPolarHBondContact O-CB 3.4Å; A61-R64 PolarHBondContact O-N 2.98Å; A61-Q65 WeakPolarHBondContact O-CG 3.09Å; A61-Q65 PolarHBondContact O-N 2.95Å; A61-L100 HydrophobicContact CB-CD1 4.48Å
62	Y	85.9	Confident	86.9	Confident	82 Å²	82	66.8 Å²	66.8	32%	0.322	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-45.3	175.3	-90.5	-76.4	0	0	0	112.3	E58 V59 R64 Q65 L66 L100	E58-Y62 VanDerWaalsContact O-CD2 3.27Å; E58-Y62 WeakPolarHBondContact O-CD2 3.33Å; E58-Y62 PolarHBondContact O-N 3.36Å; V59-Y62 PolarHBondContact O-N 3.48Å; Y62-R64 VanDerWaalsContact C-N 3.31Å; Y62-R64 PolarHBondContact O-N 3.13Å; Y62-Q65 WeakPolarHBondContact O-CB 3.03Å; Y62-Q65 PolarHBondContact O-N 2.96Å; Y62-Q65 VanDerWaalsContact O-N 3.16Å; Y62-L66 WeakPolarHBondContact O-CG 3.43Å; Y62-L66 PolarHBondContact O-N 3.36Å; Y62-L100 HydrophobicContact CD2-CD1 4.15Å; Y62-L100 HydrophobicContact CE2-CD1 3.72Å
63	L	88.4	Confident	87.3	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-60.5	-42.1	175.6	-74	170.4	0	0	0	111.8	V59 Q65 L66 G67 E68 R80 L84 I87	V59-L63 HydrophobicContact CG1-CD1 4.16Å; V59-L63 WeakPolarHBondContact O-CG 3.38Å; V59-L63 PolarHBondContact O-N 3.19Å; L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 3.49Å; L63-L66 PolarHBondContact O-N 3.13Å; L63-G67 PolarHBondContact O-N 3.31Å; L63-E68 HydrophobicContact CD2-CB 4.07Å; L63-E68 PolarHBondContact O-N 3Å; L63-R80 HydrophobicContact CD1-CG 3.42Å; L63-R80 VanDerWaalsContact CD1-CG 3.42Å; L63-L84 HydrophobicContact CD2-CB 4.16Å; L63-L84 HydrophobicContact CD2-CD1 3.88Å; L63-L84 HydrophobicContact CG-CB 4.46Å; L63-L84 HydrophobicContact CG-CD1 4.24Å; L63-I87 HydrophobicContact CD2-CD1 3.93Å
64	R	88.1	Confident	87.6	Confident	164 Å²	164	77.9 Å²	77.9	62%	0.619	43%	0.425	S	S	*	.	H	α-helix	trans	-61	-41.8	174.3	-172.2	-176.4	-65.5	117.6	-2.5	111.9	R60 A61 Y62 L66 G67 V70	R60-R64 WeakPolarHBondContact O-CB 3.48Å; R60-R64 PolarHBondContact O-N 3.16Å; A61-R64 WeakPolarHBondContact O-CB 3.4Å; A61-R64 PolarHBondContact O-N 2.98Å; Y62-R64 VanDerWaalsContact C-N 3.31Å; Y62-R64 PolarHBondContact O-N 3.13Å; R64-L66 VanDerWaalsContact C-N 3.28Å; R64-L66 PolarHBondContact O-N 3.4Å; R64-G67 PolarHBondContact O-N 3.44Å; R64-V70 HydrophobicContact CB-CG2 4.21Å
65	Q	86.4	Confident	88	Confident	95 Å²	95	73.7 Å²	73.7	44%	0.444	40%	0.397	S	S	.	.	H	α-helix	trans	-67.3	-27.9	176.8	-74.1	177.5	2.9	0	0	113.4	A61 Y62 L63 G67	A61-Q65 WeakPolarHBondContact O-CG 3.09Å; A61-Q65 PolarHBondContact O-N 2.95Å; Y62-Q65 WeakPolarHBondContact O-CB 3.03Å; Y62-Q65 PolarHBondContact O-N 2.96Å; Y62-Q65 VanDerWaalsContact O-N 3.16Å; L63-Q65 VanDerWaalsContact C-N 3.34Å; L63-Q65 PolarHBondContact O-N 3.49Å; Q65-G67 VanDerWaalsContact C-N 3.28Å
66	L	84.5	Confident	88.1	Confident	66 Å²	66	74.3 Å²	74.3	35%	0.346	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.6	175.2	-69.8	168.6	0	0	0	112.9	Y62 L63 R64 E68 L84 I87 L88	Y62-L66 WeakPolarHBondContact O-CG 3.43Å; Y62-L66 PolarHBondContact O-N 3.36Å; L63-L66 PolarHBondContact O-N 3.13Å; R64-L66 VanDerWaalsContact C-N 3.28Å; R64-L66 PolarHBondContact O-N 3.4Å; L66-E68 HydrophobicContact CB-CB 4.4Å; L66-E68 HydrophobicContact CB-CG 4.04Å; L66-E68 PolarHBondContact O-N 3.3Å; L66-L84 HydrophobicContact CD1-CD1 3.48Å; L66-L84 VanDerWaalsContact CD1-CD1 3.48Å; L66-I87 HydrophobicContact CD1-CG2 4.17Å; L66-L88 HydrophobicContact CD1-CD2 4.39Å
67	G	85.9	Confident	88.2	Confident	71 Å²	71	73.7 Å²	73.7	73%	0.732	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	14.1	-173.8	0	0	0	0	0	113.6	L63 R64 Q65	L63-G67 PolarHBondContact O-N 3.31Å; R64-G67 PolarHBondContact O-N 3.44Å; Q65-G67 VanDerWaalsContact C-N 3.28Å
68	E	87.3	Confident	88.3	Confident	81 Å²	81	73.1 Å²	73.1	38%	0.379	41%	0.41	S	S	.	.			trans	-91.5	152.9	-178.7	-71.6	-76.5	177	0	0	110.5	L63 L66 V70 I87	L63-E68 HydrophobicContact CD2-CB 4.07Å; L63-E68 PolarHBondContact O-N 3Å; L66-E68 HydrophobicContact CB-CB 4.4Å; L66-E68 HydrophobicContact CB-CG 4.04Å; L66-E68 PolarHBondContact O-N 3.3Å; E68-V70 PolarHBondContact O-N 3.3Å; E68-I87 HydrophobicContact CB-CD1 4.23Å; E68-I87 HydrophobicContact CG-CD1 3.92Å; E68-I87 HydrophobicContact CG-CG2 4.33Å
69	P	89.7	Confident	88.4	Confident	62 Å²	62	74.4 Å²	74.4	40%	0.403	42%	0.418	S	S	.	.			trans	-59.4	127.8	-179.4	23.6	-31.1	0	0	0	110.4	C71 L72 R83	P69-C71 VanDerWaalsContact C-N 3.35Å; P69-C71 PolarHBondContact O-N 3.26Å; P69-L72 HydrophobicContact CG-CD2 4.23Å; P69-R83 VanDerWaalsContact O-CZ 3.24Å; P69-R83 PolarHBondContact O-NH1 2.89Å; P69-R83 PolarHBondContact O-NH2 3.4Å
70	V	89.5	Confident	88.5	Confident	40 Å²	40	74.8 Å²	74.8	24%	0.242	42%	0.42	C	S	.	.	S	Bend	trans	-64.8	-39.9	-175	179.7	0	0	0	0	111.3	R60 R64 E68 R80 R83	R60-V70 HydrophobicContact CB-CG1 3.74Å; R60-V70 HydrophobicContact CG-CG1 3.67Å; R64-V70 HydrophobicContact CB-CG2 4.21Å; E68-V70 PolarHBondContact O-N 3.3Å; V70-R80 WeakPolarHBondContact O-CD 3.31Å; V70-R80 PolarHBondContact O-NE 3.09Å; V70-R80 VanDerWaalsContact O-NE 3.07Å; V70-R83 PolarHBondContact O-NH2 3.39Å
71	C	89.2	Confident	88.5	Confident	64 Å²	64	73.5 Å²	73.5	43%	0.432	42%	0.415	S	S	.	.			trans	-138.8	132.2	176.5	-61.3	0	0	0	0	110	P69	P69-C71 VanDerWaalsContact C-N 3.35Å; P69-C71 PolarHBondContact O-N 3.26Å
72	L	90.7	Very high	88.5	Confident	88 Å²	88	76.5 Å²	76.5	46%	0.461	43%	0.425	S	S	.	.			trans	-88.8	157	165.2	-68.8	165.3	0	0	0	110.5	P69 G74 E75	P69-L72 HydrophobicContact CG-CD2 4.23Å; L72-G74 PolarHBondContact O-N 2.99Å; L72-E75 HydrophobicContact CB-CB 3.98Å; L72-E75 PolarHBondContact N-OE2 3.25Å; L72-E75 WeakPolarHBondContact O-CB 3.43Å; L72-E75 PolarHBondContact O-N 2.91Å
73	F	89.1	Confident	88.6	Confident	222 Å²	222	74.4 Å²	74.4	97%	0.974	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	121.8	178.9	-179.4	-95.1	0	0	0	110.6	E75	F73-E75 VanDerWaalsContact C-N 3.35Å
74	G	89.3	Confident	88.6	Confident	68 Å²	68	74.5 Å²	74.5	70%	0.701	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	11.3	-179	0	0	0	0	0	115.2	L72	L72-G74 PolarHBondContact O-N 2.99Å
75	E	91.4	Very high	88.5	Confident	26 Å²	26	68.5 Å²	68.5	12%	0.121	40%	0.395	C	S	.	.			trans	-86	117.9	-177.9	-171.2	-177.7	-143.7	0	0	112.1	L72 F73 D79 R80 R83	L72-E75 HydrophobicContact CB-CB 3.98Å; L72-E75 PolarHBondContact N-OE2 3.25Å; L72-E75 WeakPolarHBondContact O-CB 3.43Å; L72-E75 PolarHBondContact O-N 2.91Å; F73-E75 VanDerWaalsContact C-N 3.35Å; E75-D79 HydrophobicContact CG-CB 3.64Å; E75-R80 HydrophobicContact CG-CB 4.11Å; E75-R80 PolarHBondContact O-NH2 3.39Å; E75-R80 WeakPolarHBondContact OE1-CA 3.28Å; E75-R80 PolarHBondContact OE1-N 3.14Å; E75-R83 IonicContact OE1-CZ 2.99Å; E75-R83 IonicContact OE1-NE 2.74Å; E75-R83 PolarHBondContact OE1-NE 2.85Å; E75-R83 IonicContact OE1-NH2 3.77Å; E75-R83 PolarHBondContact OE1-NH2 3.49Å; E75-R83 IonicContact OE2-CZ 3.4Å; E75-R83 IonicContact OE2-NE 2.7Å; E75-R83 IonicContact OE2-NH2 3.68Å; E75-R83 PolarHBondContact OE2-NH2 3.39Å
76	D	90	Very high	88.5	Confident	115 Å²	115	66.8 Å²	66.8	62%	0.615	39%	0.388	S	S	*	.			trans	-72.9	165.4	172.8	-77.1	-19	0	0	0	111.8	A78 D79 R80	D76-A78 PolarHBondContact O-N 3.4Å; D76-D79 PolarHBondContact O-N 2.84Å; D76-R80 PolarHBondContact O-N 3.06Å
77	G	89.3	Confident	88.5	Confident	38 Å²	38	64.8 Å²	64.8	39%	0.392	38%	0.377	S	S	.	.	H	α-helix	trans	-58.3	-31.4	176.8	0	0	0	0	0	113.8	R81	G77-R81 WeakPolarHBondContact O-CB 3.3Å; G77-R81 PolarHBondContact O-N 3.45Å
78	A	88.4	Confident	88.4	Confident	70 Å²	70	62.9 Å²	62.9	58%	0.579	35%	0.35	S	S	*	.	H	α-helix	trans	-70.4	-44.1	176	0	0	0	0	0	112.1	D76 R81 E82	D76-A78 PolarHBondContact O-N 3.4Å; A78-R81 WeakPolarHBondContact O-CB 3.49Å; A78-R81 PolarHBondContact O-N 2.89Å; A78-E82 PolarHBondContact O-N 3.37Å
79	D	90	Very high	88.2	Confident	88 Å²	88	59.4 Å²	59.4	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-65.4	-41.6	179.4	-65.6	-18.8	0	0	0	111	E75 D76 R81 E82 R83	E75-D79 HydrophobicContact CG-CB 3.64Å; D76-D79 PolarHBondContact O-N 2.84Å; D79-R81 VanDerWaalsContact C-N 3.3Å; D79-R81 PolarHBondContact O-N 2.83Å; D79-E82 PolarHBondContact O-N 3.19Å; D79-E82 VanDerWaalsContact O-N 3.15Å; D79-R83 WeakPolarHBondContact O-CB 3.4Å; D79-R83 PolarHBondContact O-N 3.48Å
80	R	89.9	Confident	87.9	Confident	11 Å²	11	61.2 Å²	61.2	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-58	-42.1	174.4	-172	-176.1	-62.2	94	24.8	112.7	D56 V59 L63 V70 E75 D76 R83 L84	D56-R80 IonicContact OD1-CZ 2.76Å; D56-R80 IonicContact OD1-NE 3.49Å; D56-R80 IonicContact OD1-NH1 3.65Å; D56-R80 PolarHBondContact OD1-NH1 3.29Å; D56-R80 IonicContact OD2-NH1 3.26Å; D56-R80 PolarHBondContact OD2-NH1 2.95Å; V59-R80 HydrophobicContact CG1-CG 3.83Å; L63-R80 HydrophobicContact CD1-CG 3.42Å; L63-R80 VanDerWaalsContact CD1-CG 3.42Å; V70-R80 WeakPolarHBondContact O-CD 3.31Å; V70-R80 PolarHBondContact O-NE 3.09Å; V70-R80 VanDerWaalsContact O-NE 3.07Å; E75-R80 HydrophobicContact CG-CB 4.11Å; E75-R80 PolarHBondContact O-NH2 3.39Å; E75-R80 WeakPolarHBondContact OE1-CA 3.28Å; E75-R80 PolarHBondContact OE1-N 3.14Å; D76-R80 PolarHBondContact O-N 3.06Å; R80-R83 PolarHBondContact O-N 3.35Å; R80-L84 PolarHBondContact O-N 2.93Å
81	R	88.3	Confident	87.1	Confident	73 Å²	73	63.8 Å²	63.8	28%	0.275	36%	0.364	S	S	.	.	H	α-helix	trans	-67.4	-39.9	176.9	-176.8	-177.5	174.9	-149.1	-1.9	111.7	V52 S53 V59 G77 A78 D79 L84 R85	V52-R81 HydrophobicContact CB-CG 4.48Å; V52-R81 HydrophobicContact CG1-CG 4.01Å; V52-R81 PolarHBondContact O-NE 3.09Å; V52-R81 PolarHBondContact O-NH2 3Å; S53-R81 WeakPolarHBondContact O-CD 3.35Å; S53-R81 PolarHBondContact O-NE 2.89Å; V59-R81 HydrophobicContact CG2-CG 4.47Å; G77-R81 WeakPolarHBondContact O-CB 3.3Å; G77-R81 PolarHBondContact O-N 3.45Å; A78-R81 WeakPolarHBondContact O-CB 3.49Å; A78-R81 PolarHBondContact O-N 2.89Å; D79-R81 VanDerWaalsContact C-N 3.3Å; D79-R81 PolarHBondContact O-N 2.83Å; R81-L84 PolarHBondContact O-N 3.23Å; R81-R85 VanDerWaalsContact CZ-NH1 3.34Å; R81-R85 VanDerWaalsContact NE-NH1 3.17Å; R81-R85 PolarHBondContact O-N 2.89Å
82	E	87.3	Confident	85.9	Confident	83 Å²	83	63.6 Å²	63.6	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-66.6	-39.5	176	-167.6	60	-159	0	0	111.5	A78 D79 R85 M86	A78-E82 PolarHBondContact O-N 3.37Å; D79-E82 PolarHBondContact O-N 3.19Å; D79-E82 VanDerWaalsContact O-N 3.15Å; E82-R85 WeakPolarHBondContact O-CB 3.48Å; E82-R85 PolarHBondContact O-N 2.82Å; E82-R85 IonicContact OE2-CZ 3.19Å; E82-R85 IonicContact OE2-NE 2.79Å; E82-R85 PolarHBondContact OE2-NE 2.1Å; E82-R85 IonicContact OE2-NH2 2.91Å; E82-R85 PolarHBondContact OE2-NH2 2.76Å; E82-M86 WeakPolarHBondContact O-CG 3.29Å; E82-M86 PolarHBondContact O-N 3.34Å
83	R	88.7	Confident	84.6	Confident	38 Å²	38	60.7 Å²	60.7	14%	0.143	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-46.5	172.7	179.5	171.1	58.1	94.2	-6.2	111.8	P69 V70 E75 D79 R80 R85 M86 I87	P69-R83 VanDerWaalsContact O-CZ 3.24Å; P69-R83 PolarHBondContact O-NH1 2.89Å; P69-R83 PolarHBondContact O-NH2 3.4Å; V70-R83 PolarHBondContact O-NH2 3.39Å; E75-R83 IonicContact OE1-CZ 2.99Å; E75-R83 IonicContact OE1-NE 2.74Å; E75-R83 PolarHBondContact OE1-NE 2.85Å; E75-R83 IonicContact OE1-NH2 3.77Å; E75-R83 PolarHBondContact OE1-NH2 3.49Å; E75-R83 IonicContact OE2-CZ 3.4Å; E75-R83 IonicContact OE2-NE 2.7Å; E75-R83 IonicContact OE2-NH2 3.68Å; E75-R83 PolarHBondContact OE2-NH2 3.39Å; D79-R83 WeakPolarHBondContact O-CB 3.4Å; D79-R83 PolarHBondContact O-N 3.48Å; R80-R83 PolarHBondContact O-N 3.35Å; R83-R85 VanDerWaalsContact C-N 3.28Å; R83-R85 PolarHBondContact O-N 2.78Å; R83-M86 PolarHBondContact O-N 3.4Å; R83-M86 VanDerWaalsContact O-N 3.14Å; R83-I87 HydrophobicContact CG-CD1 3.67Å; R83-I87 HydrophobicContact CG-CG1 4.3Å; R83-I87 VanDerWaalsContact O-CG1 3.28Å; R83-I87 WeakPolarHBondContact O-CG1 3.39Å; R83-I87 PolarHBondContact O-N 2.83Å
84	L	87.1	Confident	83	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-58	-42.7	175	178.7	60.3	0	0	0	111.2	V52 V59 L63 L66 R80 R81 M86 I87 L88	V52-L84 HydrophobicContact CG1-CD2 3.61Å; V52-L84 HydrophobicContact CG1-CG 4.2Å; V59-L84 HydrophobicContact CB-CD2 4.28Å; V59-L84 HydrophobicContact CG1-CB 4.32Å; V59-L84 HydrophobicContact CG1-CD2 3.85Å; V59-L84 HydrophobicContact CG2-CD2 4.29Å; L63-L84 HydrophobicContact CD2-CB 4.16Å; L63-L84 HydrophobicContact CD2-CD1 3.88Å; L63-L84 HydrophobicContact CG-CB 4.46Å; L63-L84 HydrophobicContact CG-CD1 4.24Å; L66-L84 HydrophobicContact CD1-CD1 3.48Å; L66-L84 VanDerWaalsContact CD1-CD1 3.48Å; R80-L84 PolarHBondContact O-N 2.93Å; R81-L84 PolarHBondContact O-N 3.23Å; L84-M86 PolarHBondContact O-N 2.97Å; L84-I87 PolarHBondContact O-N 2.77Å; L84-L88 HydrophobicContact CD1-CD1 4.14Å; L84-L88 HydrophobicContact CD1-CG 4.19Å; L84-L88 HydrophobicContact CG-CD1 4.05Å; L84-L88 WeakPolarHBondContact O-CB 3.45Å; L84-L88 VanDerWaalsContact O-CG 3.23Å; L84-L88 WeakPolarHBondContact O-CG 3.27Å; L84-L88 PolarHBondContact O-N 3.28Å
85	R	87.4	Confident	80.8	Confident	39 Å²	39	56.5 Å²	56.5	15%	0.147	35%	0.354	C	S	.	.	H	α-helix	trans	-58.3	-46.5	173.3	-91.3	-168.5	-74.9	-94.3	-1.6	112.6	V52 R81 E82 R83 L88 A89	V52-R85 HydrophobicContact CB-CG 4.07Å; V52-R85 HydrophobicContact CG2-CB 4.47Å; V52-R85 HydrophobicContact CG2-CG 3.44Å; V52-R85 VanDerWaalsContact CG2-CG 3.44Å; R81-R85 VanDerWaalsContact CZ-NH1 3.34Å; R81-R85 VanDerWaalsContact NE-NH1 3.17Å; R81-R85 PolarHBondContact O-N 2.89Å; E82-R85 WeakPolarHBondContact O-CB 3.48Å; E82-R85 PolarHBondContact O-N 2.82Å; E82-R85 IonicContact OE2-CZ 3.19Å; E82-R85 IonicContact OE2-NE 2.79Å; E82-R85 PolarHBondContact OE2-NE 2.1Å; E82-R85 IonicContact OE2-NH2 2.91Å; E82-R85 PolarHBondContact OE2-NH2 2.76Å; R83-R85 VanDerWaalsContact C-N 3.28Å; R83-R85 PolarHBondContact O-N 2.78Å; R85-L88 PolarHBondContact O-N 3.36Å; R85-A89 WeakPolarHBondContact O-CB 3.33Å; R85-A89 PolarHBondContact O-N 3.31Å
86	M	85.1	Confident	78.6	Confident	59 Å²	59	64 Å²	64	29%	0.291	39%	0.389	S	S	.	.	H	α-helix	trans	-65	-42.5	179.6	-71	-60.7	-64.4	0	0	111.7	L43 R44 A47 E82 R83 L84 L88 A89 V90	L43-M86 HydrophobicContact CD2-CE 3.74Å; R44-M86 HydrophobicContact CG-CE 4.5Å; R44-M86 HydrophobicContact CG-SD 4.47Å; A47-M86 HydrophobicContact CB-SD 3.78Å; E82-M86 WeakPolarHBondContact O-CG 3.29Å; E82-M86 PolarHBondContact O-N 3.34Å; R83-M86 PolarHBondContact O-N 3.4Å; R83-M86 VanDerWaalsContact O-N 3.14Å; L84-M86 PolarHBondContact O-N 2.97Å; M86-L88 PolarHBondContact O-N 2.89Å; M86-A89 WeakPolarHBondContact O-CB 3.39Å; M86-A89 PolarHBondContact O-N 2.83Å; M86-A89 VanDerWaalsContact O-N 3.16Å; M86-V90 WeakPolarHBondContact O-CG2 3.46Å; M86-V90 PolarHBondContact O-N 3.34Å
87	I	84.9	Confident	76.4	Confident	23 Å²	23	67.5 Å²	67.5	12%	0.118	39%	0.394	C	S	.	.	H	α-helix	trans	-60.6	-46.4	175.9	-68.4	162.1	0	0	0	110.5	L63 L66 E68 R83 L84 A89 V90 S91	L63-I87 HydrophobicContact CD2-CD1 3.93Å; L66-I87 HydrophobicContact CD1-CG2 4.17Å; E68-I87 HydrophobicContact CB-CD1 4.23Å; E68-I87 HydrophobicContact CG-CD1 3.92Å; E68-I87 HydrophobicContact CG-CG2 4.33Å; R83-I87 HydrophobicContact CG-CD1 3.67Å; R83-I87 HydrophobicContact CG-CG1 4.3Å; R83-I87 VanDerWaalsContact O-CG1 3.28Å; R83-I87 WeakPolarHBondContact O-CG1 3.39Å; R83-I87 PolarHBondContact O-N 2.83Å; L84-I87 PolarHBondContact O-N 2.77Å; I87-A89 VanDerWaalsContact C-N 3.25Å; I87-A89 PolarHBondContact O-N 2.92Å; I87-V90 PolarHBondContact O-N 3.43Å; I87-S91 WeakPolarHBondContact O-CB 3.26Å; I87-S91 PolarHBondContact O-N 2.68Å
88	L	83.8	Confident	74.1	Confident	32 Å²	32	70.6 Å²	70.6	17%	0.168	41%	0.407	C	S	.	.	H	α-helix	trans	-63.7	-32.4	177	-69.3	170.7	0	0	0	112.3	I50 V52 L66 L84 R85 M86 G92 G93	I50-L88 HydrophobicContact CD1-CB 3.87Å; I50-L88 HydrophobicContact CG2-CB 4.22Å; I50-L88 HydrophobicContact CG2-CD1 3.93Å; V52-L88 HydrophobicContact CG2-CD1 3.84Å; L66-L88 HydrophobicContact CD1-CD2 4.39Å; L84-L88 HydrophobicContact CD1-CD1 4.14Å; L84-L88 HydrophobicContact CD1-CG 4.19Å; L84-L88 HydrophobicContact CG-CD1 4.05Å; L84-L88 WeakPolarHBondContact O-CB 3.45Å; L84-L88 VanDerWaalsContact O-CG 3.23Å; L84-L88 WeakPolarHBondContact O-CG 3.27Å; L84-L88 PolarHBondContact O-N 3.28Å; R85-L88 PolarHBondContact O-N 3.36Å; M86-L88 PolarHBondContact O-N 2.89Å; L88-G92 PolarHBondContact O-N 3.11Å; L88-G93 PolarHBondContact O-N 3.33Å
89	A	83.5	Confident	72	Confident	7 Å²	7	71.7 Å²	71.7	6%	0.058	41%	0.408	C	S	.	.	H	α-helix	trans	-72	-36.6	176	0	0	0	0	0	112.8	L43 K46 A47 I50 R85 M86 I87	L43-A89 HydrophobicContact CD2-CB 3.63Å; K46-A89 HydrophobicContact CB-CB 4.24Å; A47-A89 HydrophobicContact CB-CB 3.73Å; I50-A89 HydrophobicContact CD1-CB 4.03Å; R85-A89 WeakPolarHBondContact O-CB 3.33Å; R85-A89 PolarHBondContact O-N 3.31Å; M86-A89 WeakPolarHBondContact O-CB 3.39Å; M86-A89 PolarHBondContact O-N 2.83Å; M86-A89 VanDerWaalsContact O-N 3.16Å; I87-A89 VanDerWaalsContact C-N 3.25Å; I87-A89 PolarHBondContact O-N 2.92Å
90	V	82.5	Confident	69.9	Low	100 Å²	100	70.5 Å²	70.5	61%	0.606	40%	0.401	S	S	*	.	H	α-helix	trans	-70	-45.4	174.6	176.8	0	0	0	0	110.6	L43 M86 I87 G92	L43-V90 HydrophobicContact CD1-CG2 3.89Å; L43-V90 HydrophobicContact CD2-CG2 3.64Å; L43-V90 HydrophobicContact CG-CG2 4.34Å; M86-V90 WeakPolarHBondContact O-CG2 3.46Å; M86-V90 PolarHBondContact O-N 3.34Å; I87-V90 PolarHBondContact O-N 3.43Å; V90-G92 VanDerWaalsContact C-N 3.25Å; V90-G92 PolarHBondContact O-N 3.21Å
91	S	74	Confident	67.3	Low	95 Å²	95	74.5 Å²	74.5	66%	0.664	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-3.6	-177.6	-82.2	0	0	0	0	115	I87	I87-S91 WeakPolarHBondContact O-CB 3.26Å; I87-S91 PolarHBondContact O-N 2.68Å
92	G	64.2	Low	64.9	Low	60 Å²	60	77.3 Å²	77.3	62%	0.619	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	36	170.6	0	0	0	0	0	116.7	L88 V90	L88-G92 PolarHBondContact O-N 3.11Å; V90-G92 VanDerWaalsContact C-N 3.25Å; V90-G92 PolarHBondContact O-N 3.21Å
93	G	63	Low	62.4	Low	26 Å²	26	79.1 Å²	79.1	27%	0.268	46%	0.464	S	S	.	.	S	Bend	trans	78	171.8	171.8	0	0	0	0	0	114.2	L88 A95	L88-G93 PolarHBondContact O-N 3.33Å; G93-A95 PolarHBondContact O-N 3.48Å
94	P	55.9	Low	59.9	Low	119 Å²	119	82.9 Å²	82.9	77%	0.773	49%	0.491	S	S	*	.			trans	-79.1	68.2	-168.1	34.3	-34.6	0	0	0	110.8	Q96	P94-Q96 PolarHBondContact O-N 2.91Å; P94-Q96 VanDerWaalsContact O-N 3.11Å
95	A	42.5	Very low	57.2	Low	84 Å²	84	90.8 Å²	90.8	69%	0.694	53%	0.526	S	S	*	.			trans	-77.8	97.1	171.8	0	0	0	0	0	109.2	G93	G93-A95 PolarHBondContact O-N 3.48Å
96	Q	45	Very low	54.6	Low	183 Å²	183	93.9 Å²	93.9	86%	0.855	55%	0.554	S	S	*	*	S	Bend	trans	67.5	71.5	152.4	-57	177.5	-8.8	0	0	117.6	P94	P94-Q96 PolarHBondContact O-N 2.91Å; P94-Q96 VanDerWaalsContact O-N 3.11Å
97	R	43.6	Very low	52.1	Low	188 Å²	188	96.4 Å²	96.4	71%	0.709	58%	0.577	S	S	*	*			trans	-137.5	144.4	148.7	-68.3	-170.8	-172.6	155.4	3.4	110.2
98	P	42.1	Very low	49.4	Very low	104 Å²	104	101.1 Å²	101.1	68%	0.675	61%	0.607	S	S	*	*			trans	-59.1	149.4	-173.2	-14.5	28.1	0	0	0	110.2
99	P	43.8	Very low	46.8	Very low	92 Å²	92	102.9 Å²	102.9	60%	0.597	63%	0.632	S	S	*	*			trans	-52.8	147.4	165.7	24.9	-31.8	0	0	0	108.9	T101	P99-T101 HydrophobicContact CG-CG2 4.26Å; P99-T101 PolarHBondContact O-N 2.83Å
100	L	44.5	Very low	44.1	Very low	64 Å²	64	109.5 Å²	109.5	34%	0.335	67%	0.672	S	S	.	*			trans	-56	84.2	171.1	-89.6	147.9	0	0	0	109.4	A61 Y62 D102	A61-L100 HydrophobicContact CB-CD1 4.48Å; Y62-L100 HydrophobicContact CD2-CD1 4.15Å; Y62-L100 HydrophobicContact CE2-CD1 3.72Å; L100-D102 PolarHBondContact O-N 2.8Å
101	T	35.3	Very low	41.6	Very low	94 Å²	94	108.1 Å²	108.1	58%	0.577	68%	0.679	S	S	*	*			trans	-87.8	106.5	170.5	47.4	0	0	0	0	108.1	P99 T103	P99-T101 HydrophobicContact CG-CG2 4.26Å; P99-T101 PolarHBondContact O-N 2.83Å; T101-T103 PolarHBondContact O-N 2.91Å
102	D	37.9	Very low	39.5	Very low	133 Å²	133	110.3 Å²	110.3	71%	0.711	69%	0.688	S	S	*	*	S	Bend	trans	64.8	4.7	145.4	-60.9	-24	0	0	0	122.4	L100	L100-D102 PolarHBondContact O-N 2.8Å
103	T	35.5	Very low	38	Very low	120 Å²	120	112.1 Å²	112.1	74%	0.736	69%	0.691	S	S	*	*	S	Bend	trans	-87.5	-6.2	176.7	47.5	0	0	0	0	115.8	T101	T101-T103 PolarHBondContact O-N 2.91Å
104	V	36.1	Very low	36.8	Very low	117 Å²	117	118.8 Å²	118.8	71%	0.709	72%	0.719	S	S	*	*	S	Bend	trans	-113.1	-1.3	-177.1	-173.5	0	0	0	0	113.8
105	K	31.9	Very low	35.7	Very low	167 Å²	167	120 Å²	120	73%	0.726	72%	0.719	S	S	*	*	S	Bend	trans	-98.7	5.8	179.3	-75	-175.4	178.2	174	0	115.4
106	S	31.6	Very low	35.2	Very low	105 Å²	105	127 Å²	127	73%	0.734	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	37.7	-174.9	59.6	0	0	0	0	115.5
107	S	31.7	Very low	34.5	Very low	112 Å²	112	126.7 Å²	126.7	78%	0.783	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	6.9	162.8	66.5	0	0	0	0	113.8
108	T	29.4	Very low	33.7	Very low	122 Å²	122	121.2 Å²	121.2	75%	0.748	73%	0.733	S	S	*	*	S	Bend	trans	-146.7	103.7	175.4	48.1	0	0	0	0	111.6
109	G	28.1	Very low	33.2	Very low	68 Å²	68	125 Å²	125	70%	0.701	74%	0.742	S	S	*	*			trans	100.2	103.9	153.1	0	0	0	0	0	118.4
110	T	28.3	Very low	32.5	Very low	146 Å²	146	128.9 Å²	128.9	90%	0.896	76%	0.757	S	S	*	*			trans	47.1	105	134.6	51	0	0	0	0	120.5
111	G	28.4	Very low	32	Very low	72 Å²	72	132.3 Å²	132.3	74%	0.742	78%	0.775	S	S	*	*				77.7	125.6	120.7	0	0	0	0	0	120.2
112	T	31.4	Very low	31.8	Very low	141 Å²	141	132.9 Å²	132.9	87%	0.865	78%	0.782	S	S	*	*			trans	114.1	122	142.6	-26.9	0	0	0	0	116.9
113	S	32.2	Very low	31.3	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	78%	0.784	S	S	*	*			trans	-43.2	155.4	176.7	53.5	0	0	0	0	118.5
114	I	37.5	Very low	31.3	Very low	167 Å²	167	133.6 Å²	133.6	86%	0.856	79%	0.786	S	S	*	*				-169.2	138	126.1	-90.2	145	0	0	0	112
115	N	32.6	Very low	31.3	Very low	145 Å²	145	133.9 Å²	133.9	78%	0.775	79%	0.788	S	S	*	*			trans	-65.7	151.8	176.3	-64.6	-38.7	0	0	0	114.8
116	R	32.7	Very low	31.7	Very low	231 Å²	231	132.8 Å²	132.8	87%	0.872	80%	0.795	S	S	*	*				165.1	118.5	113.7	-90.1	173.1	-172.8	176.4	3.8	113.6
117	L	29.1	Very low	32	Very low	176 Å²	176	129.5 Å²	129.5	92%	0.921	78%	0.778	S	S	*	*			trans	36.7	111.3	133.4	-64.7	157.5	0	0	0	119
118	G	28.4	Very low	32.2	Very low	73 Å²	73	130.3 Å²	130.3	75%	0.753	77%	0.774	S	S	*	*			trans	160	122.5	155.8	0	0	0	0	0	113.4
119	E	31.8	Very low	33.3	Very low	184 Å²	184	132.2 Å²	132.2	86%	0.86	78%	0.779	S	S	*	*			trans	87.4	93.5	156.4	-59.7	-175.7	157.5	0	0	119.3	I121	E119-I121 VanDerWaalsContact C-N 3.32Å; E119-I121 PolarHBondContact O-N 2.87Å
120	N	28.6	Very low	34.8	Very low	173 Å²	173	134.7 Å²	134.7	93%	0.925	78%	0.781	S	S	*	*			trans	-23.1	73.5	146.6	-61.1	-20.5	0	0	0	116.8
121	I	34.4	Very low	37	Very low	136 Å²	136	133 Å²	133	70%	0.697	77%	0.771	S	S	*	*			trans	-108.6	118.5	153.4	-63.1	171	0	0	0	105.1	E119 T123	E119-I121 VanDerWaalsContact C-N 3.32Å; E119-I121 PolarHBondContact O-N 2.87Å; I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 3.44Å
122	S	30.1	Very low	39.4	Very low	105 Å²	105	134.9 Å²	134.9	73%	0.734	77%	0.768	S	S	*	*			trans	-46.5	97.2	168.1	46.7	0	0	0	0	109.2	D124	S122-D124 PolarHBondContact O-N 2.89Å
123	T	28.6	Very low	41.9	Very low	123 Å²	123	138 Å²	138	76%	0.755	76%	0.763	S	S	*	*			trans	-66.4	87.8	158.2	51.2	0	0	0	0	104.5	I121 T125	I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 3.44Å; T123-T125 PolarHBondContact O-N 3.19Å
124	D	34.5	Very low	44.6	Very low	145 Å²	145	140.4 Å²	140.4	78%	0.775	76%	0.759	S	S	*	*			trans	-51.5	110	153.2	-89.6	-16.3	0	0	0	105	S122 V126	S122-D124 PolarHBondContact O-N 2.89Å; D124-V126 PolarHBondContact O-N 3.33Å
125	T	36.7	Very low	47	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	75%	0.749	S	S	*	*			trans	-46.6	103.8	176	46.9	0	0	0	0	107.7	T123 G127	T123-T125 PolarHBondContact O-N 3.19Å; T125-G127 PolarHBondContact O-N 2.97Å
126	V	39	Very low	49.7	Very low	144 Å²	144	141 Å²	141	87%	0.873	75%	0.753	S	S	*	*			trans	-66	76.1	147	-176.6	0	0	0	0	103.7	D124	D124-V126 PolarHBondContact O-N 3.33Å
127	G	38.5	Very low	52.3	Low	36 Å²	36	131.6 Å²	131.6	37%	0.371	73%	0.728	S	S	.	*			trans	-62.9	149.4	179.8	0	0	0	0	0	107.6	T125 D129	T125-G127 PolarHBondContact O-N 2.97Å; G127-D129 VanDerWaalsContact C-N 3.31Å; G127-D129 PolarHBondContact O-N 3.33Å
128	D	36.6	Very low	55.1	Low	130 Å²	130	125.8 Å²	125.8	70%	0.695	70%	0.701	S	S	*	*			trans	-53	93.6	173.6	-76.3	-44.5	0	0	0	110.6	T130 T131	D128-T130 PolarHBondContact O-N 2.78Å; D128-T131 PolarHBondContact O-N 2.84Å
129	D	51.8	Low	58.1	Low	161 Å²	161	128.9 Å²	128.9	86%	0.861	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	11.7	172	-84.1	-15.1	0	0	0	112.5	G127	G127-D129 VanDerWaalsContact C-N 3.31Å; G127-D129 PolarHBondContact O-N 3.33Å
130	T	60.2	Low	61	Low	120 Å²	120	122.1 Å²	122.1	74%	0.736	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	2.8	175.4	60.7	0	0	0	0	112.8	D128 V132	D128-T130 PolarHBondContact O-N 2.78Å; T130-V132 PolarHBondContact O-N 3.19Å
131	T	73.2	Confident	64	Low	112 Å²	112	114.8 Å²	114.8	69%	0.687	63%	0.632	S	S	*	*			trans	-73.7	121.7	179.1	54.7	0	0	0	0	111.5	D128 W133	D128-T131 PolarHBondContact O-N 2.84Å; T131-W133 PolarHBondContact O-N 2.9Å
132	V	79.7	Confident	66.7	Low	111 Å²	111	111 Å²	111	67%	0.673	62%	0.621	S	S	*	*			trans	-68.6	113	172.2	177.8	0	0	0	0	108.7	T130 Y134	T130-V132 PolarHBondContact O-N 3.19Å; V132-Y134 HydrophobicContact CB-CE2 4.49Å; V132-Y134 HydrophobicContact CG1-CE2 3.98Å
133	W	84.8	Confident	69.7	Low	205 Å²	205	112.5 Å²	112.5	78%	0.777	62%	0.617	S	S	*	*			trans	-86.1	138.5	175.6	-177.8	79.4	0	0	0	111.2	T131 H135	T131-W133 PolarHBondContact O-N 2.9Å; W133-H135 HydrophobicContact CE3-CB 4.32Å; W133-H135 HydrophobicContact CH2-CB 3.66Å; W133-H135 AromaticContact CH2-CG 3.98Å; W133-H135 AromaticContact CH2-ND1 3.72Å; W133-H135 HydrophobicContact CZ2-CB 4.46Å; W133-H135 HydrophobicContact CZ3-CB 3.58Å
134	Y	87.7	Confident	72.7	Confident	148 Å²	148	106.7 Å²	106.7	58%	0.58	58%	0.581	S	S	*	*			trans	-112.1	133.6	178.8	-70.2	-88.1	0	0	0	110.5	V132	V132-Y134 HydrophobicContact CB-CE2 4.49Å; V132-Y134 HydrophobicContact CG1-CE2 3.98Å
135	H	88.5	Confident	75.6	Confident	140 Å²	140	102.9 Å²	102.9	65%	0.648	56%	0.556	S	S	*	*			trans	-107.7	143	175.7	178.9	61.2	0	0	0	111.3	W133 G137	W133-H135 HydrophobicContact CE3-CB 4.32Å; W133-H135 HydrophobicContact CH2-CB 3.66Å; W133-H135 AromaticContact CH2-CG 3.98Å; W133-H135 AromaticContact CH2-ND1 3.72Å; W133-H135 HydrophobicContact CZ2-CB 4.46Å; W133-H135 HydrophobicContact CZ3-CB 3.58Å; H135-G137 PolarHBondContact O-N 2.83Å
136	Q	89.2	Confident	78.3	Confident	185 Å²	185	102 Å²	102	86%	0.864	55%	0.546	S	S	*	.			trans	-82	104.5	169.7	-68	-176.8	0	0	0	109.3
137	G	86.1	Confident	80.9	Confident	33 Å²	33	99 Å²	99	34%	0.34	52%	0.519	S	S	.	.			trans	-77.3	169.9	176.6	0	0	0	0	0	113.7	H135	H135-G137 PolarHBondContact O-N 2.83Å
138	P	89.8	Confident	83.6	Confident	55 Å²	55	97.5 Å²	97.5	36%	0.357	50%	0.502	S	S	.	.			trans	-67.9	160.1	178.8	29.6	-35.4	0	0	0	112.3	T140 L141	P138-T140 PolarHBondContact O-N 2.82Å; P138-L141 HydrophobicContact CG-CB 4.07Å; P138-L141 WeakPolarHBondContact O-CB 3.48Å; P138-L141 PolarHBondContact O-N 3.26Å; P138-L141 VanDerWaalsContact O-N 3.13Å
139	N	90.9	Very high	86.3	Confident	137 Å²	137	92.7 Å²	92.7	73%	0.733	48%	0.479	S	S	*	.	H	α-helix	trans	-62.4	-30.9	177.1	-70.2	-20.2	0	0	0	112.3	L141 A142 E143	N139-L141 PolarHBondContact O-N 3.29Å; N139-A142 WeakPolarHBondContact O-CB 3.39Å; N139-A142 PolarHBondContact O-N 3.46Å; N139-E143 PolarHBondContact O-N 3.45Å; N139-E143 VanDerWaalsContact O-N 3.11Å
140	T	91.5	Very high	88.4	Confident	43 Å²	43	90.8 Å²	90.8	26%	0.264	47%	0.465	S	S	.	.	H	α-helix	trans	-59	-36.4	175.3	50.3	0	0	0	0	111.8	P138 E143 A144 E324	P138-T140 PolarHBondContact O-N 2.82Å; T140-E143 PolarHBondContact O-N 3.17Å; T140-A144 WeakPolarHBondContact O-CB 3.23Å; T140-A144 PolarHBondContact O-N 3.28Å; T140-E324 PolarHBondContact OG1-OE2 3.37Å
141	L	91.5	Very high	90	Very high	19 Å²	19	87 Å²	87	10%	0.099	44%	0.438	C	S	.	.	H	α-helix	trans	-67.3	-35.1	173.3	164.5	157.7	0	0	0	112.3	P138 N139 R145 I326 L327	P138-L141 HydrophobicContact CG-CB 4.07Å; P138-L141 WeakPolarHBondContact O-CB 3.48Å; P138-L141 PolarHBondContact O-N 3.26Å; P138-L141 VanDerWaalsContact O-N 3.13Å; N139-L141 PolarHBondContact O-N 3.29Å; L141-R145 HydrophobicContact CD2-CG 4.46Å; L141-R145 VanDerWaalsContact O-CB 3.32Å; L141-R145 WeakPolarHBondContact O-CB 3.45Å; L141-R145 WeakPolarHBondContact O-CG 3.49Å; L141-R145 PolarHBondContact O-N 2.92Å; L141-I326 HydrophobicContact CB-CB 4.46Å; L141-I326 WeakPolarHBondContact CB-O 3.37Å; L141-I326 WeakPolarHBondContact CD1-O 3.41Å; L141-L327 HydrophobicContact CD1-CB 4.1Å; L141-L327 HydrophobicContact CD1-CD1 4.38Å
142	A	91.8	Very high	91	Very high	57 Å²	57	81.8 Å²	81.8	47%	0.471	41%	0.406	S	S	.	.	H	α-helix	trans	-67.3	-42.6	177.3	0	0	0	0	0	111.4	N139 R145 L146	N139-A142 WeakPolarHBondContact O-CB 3.39Å; N139-A142 PolarHBondContact O-N 3.46Å; A142-R145 PolarHBondContact O-N 2.92Å; A142-L146 PolarHBondContact O-N 3Å
143	E	92.9	Very high	91.7	Very high	136 Å²	136	81.5 Å²	81.5	64%	0.636	40%	0.401	S	S	*	.	H	α-helix	trans	-63.5	-46.3	174.2	-67.3	179.4	-178.9	0	0	111.5	N139 T140 R145 L146 W147	N139-E143 PolarHBondContact O-N 3.45Å; N139-E143 VanDerWaalsContact O-N 3.11Å; T140-E143 PolarHBondContact O-N 3.17Å; E143-R145 VanDerWaalsContact C-N 3.31Å; E143-R145 PolarHBondContact O-N 3.45Å; E143-L146 PolarHBondContact O-N 3.5Å; E143-W147 WeakPolarHBondContact O-CB 3.36Å; E143-W147 PolarHBondContact O-N 3.44Å
144	A	92.9	Very high	92.2	Very high	1 Å²	1	76 Å²	76	1%	0.008	39%	0.39	C	S	.	.	H	α-helix	trans	-59.6	-40.8	175.7	0	0	0	0	0	111.9	T140 W147 I148 F305 I326	T140-A144 WeakPolarHBondContact O-CB 3.23Å; T140-A144 PolarHBondContact O-N 3.28Å; A144-W147 PolarHBondContact O-N 3.43Å; A144-I148 WeakPolarHBondContact O-CB 3.25Å; A144-I148 WeakPolarHBondContact O-CD1 3.44Å; A144-I148 WeakPolarHBondContact O-CG1 3.3Å; A144-I148 PolarHBondContact O-N 2.84Å; A144-F305 HydrophobicContact CB-CE1 3.79Å; A144-F305 HydrophobicContact CB-CZ 3.84Å; A144-I326 HydrophobicContact CB-CD1 3.86Å
145	R	94	Very high	92.5	Very high	64 Å²	64	73.6 Å²	73.6	24%	0.242	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-42.4	176.6	-80.4	177.2	170	172.2	10.6	112.9	L141 A142 E143 W147 I148 S149 L362 R363 G365	L141-R145 HydrophobicContact CD2-CG 4.46Å; L141-R145 VanDerWaalsContact O-CB 3.32Å; L141-R145 WeakPolarHBondContact O-CB 3.45Å; L141-R145 WeakPolarHBondContact O-CG 3.49Å; L141-R145 PolarHBondContact O-N 2.92Å; A142-R145 PolarHBondContact O-N 2.92Å; E143-R145 VanDerWaalsContact C-N 3.31Å; E143-R145 PolarHBondContact O-N 3.45Å; R145-W147 VanDerWaalsContact C-N 3.33Å; R145-I148 PolarHBondContact O-N 3.39Å; R145-S149 WeakPolarHBondContact O-CB 3.48Å; R145-S149 PolarHBondContact O-N 2.82Å; R145-L362 VanDerWaalsContact CG-O 3.29Å; R145-L362 WeakPolarHBondContact CG-O 3.29Å; R145-L362 PolarHBondContact NE-O 2.89Å; R145-L362 VanDerWaalsContact NE-O 3.12Å; R145-R363 VanDerWaalsContact CD-O 3.25Å; R145-R363 WeakPolarHBondContact CD-O 3.27Å; R145-G365 VanDerWaalsContact NH2-CA 3.27Å
146	L	93.8	Very high	92.7	Very high	106 Å²	106	68 Å²	68	56%	0.555	36%	0.358	S	S	*	.	H	α-helix	trans	-62.2	-45.9	176.1	-172.5	130	0	0	0	110.1	A142 E143 I148 S149 E150	A142-L146 PolarHBondContact O-N 3Å; E143-L146 PolarHBondContact O-N 3.5Å; L146-I148 PolarHBondContact O-N 3.17Å; L146-S149 WeakPolarHBondContact O-CB 3.36Å; L146-S149 PolarHBondContact O-N 3.32Å; L146-S149 VanDerWaalsContact O-N 3.12Å; L146-S149 PolarHBondContact O-OG 3.19Å; L146-E150 PolarHBondContact O-N 2.92Å; L146-E150 VanDerWaalsContact O-N 3.09Å
147	W	94.3	Very high	93	Very high	81 Å²	81	65.9 Å²	65.9	31%	0.307	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-47.8	175.8	-170	95	0	0	0	112.7	E143 A144 R145 S149 E150 F151 F305	E143-W147 WeakPolarHBondContact O-CB 3.36Å; E143-W147 PolarHBondContact O-N 3.44Å; A144-W147 PolarHBondContact O-N 3.43Å; R145-W147 VanDerWaalsContact C-N 3.33Å; W147-S149 PolarHBondContact O-N 3Å; W147-E150 PolarHBondContact O-N 3.32Å; W147-F151 HydrophobicContact CE3-CB 4.24Å; W147-F151 HydrophobicContact CH2-CB 4.06Å; W147-F151 AromaticContact CH2-CD2 3.73Å; W147-F151 HydrophobicContact CH2-CD2 3.73Å; W147-F151 HydrophobicContact CH2-CE2 4.3Å; W147-F151 AromaticContact CH2-CG 3.91Å; W147-F151 HydrophobicContact CH2-CG 3.91Å; W147-F151 HydrophobicContact CZ2-CD2 4.44Å; W147-F151 HydrophobicContact CZ3-CB 3.84Å; W147-F151 HydrophobicContact CZ3-CD1 4.41Å; W147-F151 HydrophobicContact CZ3-CD2 4.23Å; W147-F151 AromaticContact CZ3-CG 3.92Å; W147-F151 HydrophobicContact CZ3-CG 3.92Å; W147-F151 WeakPolarHBondContact O-CB 3.26Å; W147-F151 PolarHBondContact O-N 3.3Å; W147-F305 AromaticContact CE3-CE2 3.65Å; W147-F305 HydrophobicContact CE3-CE2 3.65Å; W147-F305 HydrophobicContact CE3-CZ 4.2Å; W147-F305 AromaticContact CZ3-CE2 3.86Å; W147-F305 HydrophobicContact CZ3-CE2 3.86Å
148	I	94.7	Very high	93.4	Very high	3 Å²	3	68.3 Å²	68.3	2%	0.015	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-36.1	176	-69.1	164.8	0	0	0	110.3	A144 R145 L146 S152 F305 L362 R363	A144-I148 WeakPolarHBondContact O-CB 3.25Å; A144-I148 WeakPolarHBondContact O-CD1 3.44Å; A144-I148 WeakPolarHBondContact O-CG1 3.3Å; A144-I148 PolarHBondContact O-N 2.84Å; R145-I148 PolarHBondContact O-N 3.39Å; L146-I148 PolarHBondContact O-N 3.17Å; I148-S152 WeakPolarHBondContact O-CB 3.45Å; I148-S152 PolarHBondContact O-N 2.76Å; I148-S152 PolarHBondContact O-OG 2.9Å; I148-F305 HydrophobicContact CD1-CD2 4.09Å; I148-F305 HydrophobicContact CD1-CE2 3.72Å; I148-F305 HydrophobicContact CD1-CZ 4.05Å; I148-F305 HydrophobicContact CG1-CD2 4.08Å; I148-F305 HydrophobicContact CG1-CE2 3.43Å; I148-F305 VanDerWaalsContact CG1-CE2 3.43Å; I148-F305 HydrophobicContact CG1-CZ 4.01Å; I148-L362 HydrophobicContact CD1-CB 4.2Å; I148-L362 HydrophobicContact CD1-CD1 4.38Å; I148-L362 HydrophobicContact CG2-CB 4.19Å; I148-R363 HydrophobicContact CG2-CG 4.09Å
149	S	94.2	Very high	93.4	Very high	30 Å²	30	67.6 Å²	67.6	21%	0.21	34%	0.344	C	S	.	.	H	α-helix	trans	-65.4	-45.6	178.5	83.1	0	0	0	0	112	R145 L146 W147 S152 L153	R145-S149 WeakPolarHBondContact O-CB 3.48Å; R145-S149 PolarHBondContact O-N 2.82Å; L146-S149 WeakPolarHBondContact O-CB 3.36Å; L146-S149 PolarHBondContact O-N 3.32Å; L146-S149 VanDerWaalsContact O-N 3.12Å; L146-S149 PolarHBondContact O-OG 3.19Å; W147-S149 PolarHBondContact O-N 3Å; S149-S152 PolarHBondContact O-N 3.2Å; S149-S152 PolarHBondContact O-OG 2.8Å; S149-L153 VanDerWaalsContact O-CB 3.3Å; S149-L153 WeakPolarHBondContact O-CB 3.34Å; S149-L153 WeakPolarHBondContact O-CD1 3.22Å; S149-L153 WeakPolarHBondContact O-CG 3.43Å; S149-L153 PolarHBondContact O-N 2.86Å
150	E	95.4	Very high	93.5	Very high	120 Å²	120	63.9 Å²	63.9	56%	0.561	32%	0.323	S	S	*	.	H	α-helix	trans	-64.9	-44.5	177.7	-67.3	-177.9	171.4	0	0	111.4	L146 W147 T154	L146-E150 PolarHBondContact O-N 2.92Å; L146-E150 VanDerWaalsContact O-N 3.09Å; W147-E150 PolarHBondContact O-N 3.32Å; E150-T154 WeakPolarHBondContact O-CG2 3.28Å; E150-T154 PolarHBondContact O-N 2.92Å; E150-T154 PolarHBondContact O-OG1 3.26Å
151	F	94.3	Very high	93.7	Very high	40 Å²	40	64.3 Å²	64.3	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-47.2	177.6	-179.7	-96.7	0	0	0	112.3	W147 T154 R155 H300 P301	W147-F151 HydrophobicContact CE3-CB 4.24Å; W147-F151 HydrophobicContact CH2-CB 4.06Å; W147-F151 AromaticContact CH2-CD2 3.73Å; W147-F151 HydrophobicContact CH2-CD2 3.73Å; W147-F151 HydrophobicContact CH2-CE2 4.3Å; W147-F151 AromaticContact CH2-CG 3.91Å; W147-F151 HydrophobicContact CH2-CG 3.91Å; W147-F151 HydrophobicContact CZ2-CD2 4.44Å; W147-F151 HydrophobicContact CZ3-CB 3.84Å; W147-F151 HydrophobicContact CZ3-CD1 4.41Å; W147-F151 HydrophobicContact CZ3-CD2 4.23Å; W147-F151 AromaticContact CZ3-CG 3.92Å; W147-F151 HydrophobicContact CZ3-CG 3.92Å; W147-F151 WeakPolarHBondContact O-CB 3.26Å; W147-F151 PolarHBondContact O-N 3.3Å; F151-T154 PolarHBondContact O-OG1 3.23Å; F151-R155 PolarHBondContact O-N 3.33Å; F151-H300 AromaticContact CD1-CE1 3.7Å; F151-H300 AromaticContact CE1-CE1 3.68Å; F151-P301 HydrophobicContact CE1-CB 4.49Å
152	S	94.2	Very high	93.7	Very high	3 Å²	3	71.7 Å²	71.7	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-74	-35.8	-175	61.7	0	0	0	0	113.2	I148 S149 R155 A156 D344	I148-S152 WeakPolarHBondContact O-CB 3.45Å; I148-S152 PolarHBondContact O-N 2.76Å; I148-S152 PolarHBondContact O-OG 2.9Å; S149-S152 PolarHBondContact O-N 3.2Å; S149-S152 PolarHBondContact O-OG 2.8Å; S152-R155 PolarHBondContact O-N 2.74Å; S152-A156 WeakPolarHBondContact O-CB 3.14Å; S152-A156 PolarHBondContact O-N 2.71Å; S152-D344 VanDerWaalsContact CA-O 3.28Å; S152-D344 WeakPolarHBondContact CA-O 3.46Å; S152-D344 WeakPolarHBondContact CB-O 3.42Å
153	L	94.3	Very high	93.6	Very high	105 Å²	105	70.6 Å²	70.6	55%	0.55	34%	0.341	S	S	.	.	H	α-helix	trans	-65.1	-42	178.1	-73.4	171.8	0	0	0	111.8	S149 K157	S149-L153 VanDerWaalsContact O-CB 3.3Å; S149-L153 WeakPolarHBondContact O-CB 3.34Å; S149-L153 WeakPolarHBondContact O-CD1 3.22Å; S149-L153 WeakPolarHBondContact O-CG 3.43Å; S149-L153 PolarHBondContact O-N 2.86Å; L153-K157 WeakPolarHBondContact O-CB 3.38Å; L153-K157 PolarHBondContact O-N 3.15Å
154	T	95.4	Very high	93.5	Very high	89 Å²	89	71.2 Å²	71.2	55%	0.546	34%	0.338	S	S	.	.	H	α-helix	trans	-65.6	-45.4	177.8	55.4	0	0	0	0	111.4	E150 F151 K157 V158	E150-T154 WeakPolarHBondContact O-CG2 3.28Å; E150-T154 PolarHBondContact O-N 2.92Å; E150-T154 PolarHBondContact O-OG1 3.26Å; F151-T154 PolarHBondContact O-OG1 3.23Å; T154-K157 PolarHBondContact O-N 3.36Å; T154-V158 WeakPolarHBondContact O-CG2 3.32Å; T154-V158 PolarHBondContact O-N 3.07Å; T154-V158 VanDerWaalsContact O-N 3.09Å
155	R	93.1	Very high	93.6	Very high	99 Å²	99	75.5 Å²	75.5	37%	0.374	36%	0.361	S	S	.	.	H	α-helix	trans	-64.7	-43.1	175.8	-80.7	-167.7	163	-160.8	5.9	113.3	F151 S152 K157 V158 R159 P301 P343 D344	F151-R155 PolarHBondContact O-N 3.33Å; S152-R155 PolarHBondContact O-N 2.74Å; R155-K157 VanDerWaalsContact C-N 3.29Å; R155-K157 PolarHBondContact O-N 2.83Å; R155-V158 PolarHBondContact O-N 3.43Å; R155-R159 WeakPolarHBondContact O-CB 3.21Å; R155-R159 PolarHBondContact O-N 3.04Å; R155-P301 PolarHBondContact NH2-O 3.17Å; R155-P343 PolarHBondContact NH1-O 2.86Å; R155-P343 VanDerWaalsContact NH1-O 3.13Å; R155-D344 HydrophobicContact CB-CB 4.41Å
156	A	93.6	Very high	93.3	Very high	22 Å²	22	77 Å²	77	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-42.1	177.3	0	0	0	0	0	111.3	S152 R159 L160 D344	S152-A156 WeakPolarHBondContact O-CB 3.14Å; S152-A156 PolarHBondContact O-N 2.71Å; A156-R159 PolarHBondContact O-N 3.31Å; A156-L160 WeakPolarHBondContact O-CB 3.49Å; A156-L160 VanDerWaalsContact O-CG 3.28Å; A156-L160 WeakPolarHBondContact O-CG 3.25Å; A156-L160 PolarHBondContact O-N 3.46Å; A156-D344 WeakPolarHBondContact CA-OD2 3.44Å; A156-D344 HydrophobicContact CB-CB 4.4Å; A156-D344 WeakPolarHBondContact CB-OD2 3.12Å
157	K	95	Very high	93.1	Very high	141 Å²	141	77 Å²	77	61%	0.613	36%	0.363	S	S	*	.	H	α-helix	trans	-59.4	-51.6	173.6	-176.8	-179.8	177.3	-177.4	0	111.4	L153 T154 R155 R159 L160 D161	L153-K157 WeakPolarHBondContact O-CB 3.38Å; L153-K157 PolarHBondContact O-N 3.15Å; T154-K157 PolarHBondContact O-N 3.36Å; R155-K157 VanDerWaalsContact C-N 3.29Å; R155-K157 PolarHBondContact O-N 2.83Å; K157-R159 VanDerWaalsContact C-N 3.34Å; K157-R159 PolarHBondContact O-N 2.67Å; K157-L160 PolarHBondContact O-N 3.11Å; K157-D161 WeakPolarHBondContact O-CB 3.32Å; K157-D161 VanDerWaalsContact O-CG 3.3Å; K157-D161 PolarHBondContact O-N 3.5Å
158	V	93.3	Very high	93	Very high	83 Å²	83	79.3 Å²	79.3	50%	0.503	38%	0.381	S	S	.	.	H	α-helix	trans	-60.4	-41.8	179.7	173	0	0	0	0	111.9	T154 R155 D161 R162	T154-V158 WeakPolarHBondContact O-CG2 3.32Å; T154-V158 PolarHBondContact O-N 3.07Å; T154-V158 VanDerWaalsContact O-N 3.09Å; R155-V158 PolarHBondContact O-N 3.43Å; V158-D161 PolarHBondContact O-N 3.44Å; V158-R162 WeakPolarHBondContact O-CB 3.49Å; V158-R162 PolarHBondContact O-N 2.69Å
159	R	91.5	Very high	92.9	Very high	40 Å²	40	85 Å²	85	15%	0.151	41%	0.412	C	S	.	.	H	α-helix	trans	-63.5	-47.4	177.3	-179.4	-178.4	58.7	97	-2.1	111.5	R155 A156 K157 R162 A163 D344 N386 G387	R155-R159 WeakPolarHBondContact O-CB 3.21Å; R155-R159 PolarHBondContact O-N 3.04Å; A156-R159 PolarHBondContact O-N 3.31Å; K157-R159 VanDerWaalsContact C-N 3.34Å; K157-R159 PolarHBondContact O-N 2.67Å; R159-R162 PolarHBondContact O-N 2.92Å; R159-A163 WeakPolarHBondContact O-CB 3.46Å; R159-A163 PolarHBondContact O-N 3.38Å; R159-D344 VanDerWaalsContact CD-OD1 3.25Å; R159-D344 WeakPolarHBondContact CD-OD1 3.18Å; R159-D344 IonicContact CZ-OD1 3.95Å; R159-D344 IonicContact CZ-OD2 3.81Å; R159-D344 IonicContact NE-OD1 2.78Å; R159-D344 PolarHBondContact NE-OD1 3.39Å; R159-D344 IonicContact NE-OD2 3.92Å; R159-D344 PolarHBondContact NE-OD2 2.96Å; R159-D344 IonicContact NH2-OD2 2.89Å; R159-D344 PolarHBondContact NH2-OD2 3.41Å; R159-N386 PolarHBondContact NH1-O 3.34Å; R159-G387 PolarHBondContact NH1-O 3.25Å
160	L	92.4	Very high	92.8	Very high	59 Å²	59	85.3 Å²	85.3	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-64.6	-40.6	178.5	-72.1	176.4	0	0	0	111.8	A156 K157 A163 R164	A156-L160 WeakPolarHBondContact O-CB 3.49Å; A156-L160 VanDerWaalsContact O-CG 3.28Å; A156-L160 WeakPolarHBondContact O-CG 3.25Å; A156-L160 PolarHBondContact O-N 3.46Å; K157-L160 PolarHBondContact O-N 3.11Å; L160-A163 PolarHBondContact O-N 2.98Å; L160-R164 VanDerWaalsContact O-CG 3.31Å; L160-R164 WeakPolarHBondContact O-CG 3.24Å; L160-R164 PolarHBondContact O-N 2.69Å
161	D	94.3	Very high	92.6	Very high	53 Å²	53	82.9 Å²	82.9	28%	0.283	41%	0.407	S	S	.	.	H	α-helix	trans	-67.7	-40.2	177.3	-70.3	-19.9	0	0	0	111.4	K157 V158 A163 R164 N165	K157-D161 WeakPolarHBondContact O-CB 3.32Å; K157-D161 VanDerWaalsContact O-CG 3.3Å; K157-D161 PolarHBondContact O-N 3.5Å; V158-D161 PolarHBondContact O-N 3.44Å; D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 3.39Å; D161-R164 PolarHBondContact O-N 3.38Å; D161-R164 IonicContact OD1-NH1 3.63Å; D161-R164 PolarHBondContact OD1-NH1 2.65Å; D161-N165 WeakPolarHBondContact O-CB 3.4Å; D161-N165 PolarHBondContact O-N 3.04Å; D161-N165 PolarHBondContact O-ND2 3.4Å
162	R	91.6	Very high	92.5	Very high	174 Å²	174	83.1 Å²	83.1	66%	0.657	42%	0.416	S	S	*	.	H	α-helix	trans	-59.2	-44.2	171.6	-174.6	-175.5	-64.6	152.2	0.4	111.6	V158 R159 N165 Y166	V158-R162 WeakPolarHBondContact O-CB 3.49Å; V158-R162 PolarHBondContact O-N 2.69Å; R159-R162 PolarHBondContact O-N 2.92Å; R162-N165 PolarHBondContact O-N 3.12Å; R162-Y166 WeakPolarHBondContact O-CB 3.25Å; R162-Y166 PolarHBondContact O-N 2.9Å
163	A	89.7	Confident	92.4	Very high	33 Å²	33	87.5 Å²	87.5	27%	0.273	45%	0.445	S	S	.	.	H	α-helix	trans	-62.8	-49	177	0	0	0	0	0	111.3	R159 L160 D161 N165 Y166 F167	R159-A163 WeakPolarHBondContact O-CB 3.46Å; R159-A163 PolarHBondContact O-N 3.38Å; L160-A163 PolarHBondContact O-N 2.98Å; D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 3.39Å; A163-N165 VanDerWaalsContact C-N 3.34Å; A163-N165 PolarHBondContact O-N 2.7Å; A163-Y166 PolarHBondContact O-N 2.96Å; A163-F167 WeakPolarHBondContact O-CD2 3.2Å; A163-F167 PolarHBondContact O-N 2.97Å
164	R	92.6	Very high	92.3	Very high	149 Å²	149	88.2 Å²	88.2	56%	0.562	45%	0.445	S	S	*	.	H	α-helix	trans	-56	-47.5	176.5	-74	170.1	180	161	-4.7	111.7	L160 D161 Y166 F167 N168	L160-R164 VanDerWaalsContact O-CG 3.31Å; L160-R164 WeakPolarHBondContact O-CG 3.24Å; L160-R164 PolarHBondContact O-N 2.69Å; D161-R164 PolarHBondContact O-N 3.38Å; D161-R164 IonicContact OD1-NH1 3.63Å; D161-R164 PolarHBondContact OD1-NH1 2.65Å; R164-Y166 VanDerWaalsContact C-N 3.33Å; R164-Y166 PolarHBondContact O-N 2.92Å; R164-F167 PolarHBondContact O-N 3.28Å; R164-N168 WeakPolarHBondContact O-CB 3.45Å; R164-N168 PolarHBondContact O-N 2.86Å; R164-N168 PolarHBondContact O-ND2 2.89Å
165	N	93.2	Very high	92	Very high	91 Å²	91	87.4 Å²	87.4	49%	0.487	43%	0.432	S	S	.	.	H	α-helix	trans	-61.6	-41.1	178.4	-70.4	-18.6	0	0	0	111.9	D161 R162 A163 N169	D161-N165 WeakPolarHBondContact O-CB 3.4Å; D161-N165 PolarHBondContact O-N 3.04Å; D161-N165 PolarHBondContact O-ND2 3.4Å; R162-N165 PolarHBondContact O-N 3.12Å; A163-N165 VanDerWaalsContact C-N 3.34Å; A163-N165 PolarHBondContact O-N 2.7Å; N165-N169 WeakPolarHBondContact O-CB 3.25Å; N165-N169 PolarHBondContact O-N 2.81Å; N165-N169 PolarHBondContact O-ND2 2.95Å
166	Y	88.9	Confident	91.8	Very high	97 Å²	97	89.6 Å²	89.6	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-63	-46	176.2	178.6	-106.5	0	0	0	112.6	R162 A163 R164 V170 R175	R162-Y166 WeakPolarHBondContact O-CB 3.25Å; R162-Y166 PolarHBondContact O-N 2.9Å; A163-Y166 PolarHBondContact O-N 2.96Å; R164-Y166 VanDerWaalsContact C-N 3.33Å; R164-Y166 PolarHBondContact O-N 2.92Å; Y166-V170 HydrophobicContact CD2-CG2 3.96Å; Y166-V170 HydrophobicContact CE2-CB 4.42Å; Y166-V170 HydrophobicContact CE2-CG2 3.95Å; Y166-V170 WeakPolarHBondContact O-CB 3.22Å; Y166-V170 PolarHBondContact O-N 2.86Å; Y166-V170 VanDerWaalsContact O-N 3.09Å; Y166-R175 HydrophobicContact CE1-CG 4.26Å
167	F	88.5	Confident	91.7	Very high	104 Å²	104	90.6 Å²	90.6	46%	0.456	45%	0.453	S	S	.	.	H	α-helix	trans	-70.6	-30.9	-179.9	-74.1	-71.9	0	0	0	113.3	A163 R164	A163-F167 WeakPolarHBondContact O-CD2 3.2Å; A163-F167 PolarHBondContact O-N 2.97Å; R164-F167 PolarHBondContact O-N 3.28Å
168	N	92.6	Very high	91.3	Very high	130 Å²	130	88 Å²	88	70%	0.695	44%	0.441	S	S	*	.	H	α-helix	trans	-76.4	-39.9	176.6	-71.2	-12.4	0	0	0	112.4	R164	R164-N168 WeakPolarHBondContact O-CB 3.45Å; R164-N168 PolarHBondContact O-N 2.86Å; R164-N168 PolarHBondContact O-ND2 2.89Å
169	N	93.9	Very high	91	Very high	124 Å²	124	86.2 Å²	86.2	66%	0.663	43%	0.429	S	S	*	.	H	α-helix	trans	-85.6	-27.3	-173.4	-65.7	-14.6	0	0	0	113.6	N165 P171	N165-N169 WeakPolarHBondContact O-CB 3.25Å; N165-N169 PolarHBondContact O-N 2.81Å; N165-N169 PolarHBondContact O-ND2 2.95Å; N169-P171 WeakPolarHBondContact O-CD 3.11Å
170	V	90.6	Very high	90.8	Very high	35 Å²	35	90.8 Å²	90.8	21%	0.212	45%	0.452	C	S	.	.	S	Bend	trans	-110.5	107.1	-175	-166.7	0	0	0	0	111.2	Y166 Q174 R175	Y166-V170 HydrophobicContact CD2-CG2 3.96Å; Y166-V170 HydrophobicContact CE2-CB 4.42Å; Y166-V170 HydrophobicContact CE2-CG2 3.95Å; Y166-V170 WeakPolarHBondContact O-CB 3.22Å; Y166-V170 PolarHBondContact O-N 2.86Å; Y166-V170 VanDerWaalsContact O-N 3.09Å; V170-Q174 HydrophobicContact CG1-CB 3.89Å; V170-R175 HydrophobicContact CB-CG 3.91Å; V170-R175 HydrophobicContact CG1-CG 3.47Å; V170-R175 VanDerWaalsContact CG1-CG 3.47Å; V170-R175 PolarHBondContact O-NE 2.7Å
171	P	92.7	Very high	90.6	Very high	69 Å²	69	94.2 Å²	94.2	45%	0.448	47%	0.466	S	S	.	.			trans	-55	148.1	175	-27	35.2	0	0	0	112.9	N169 P173 Q174 R175	N169-P171 WeakPolarHBondContact O-CD 3.11Å; P171-P173 VanDerWaalsContact C-CD 3.41Å; P171-P173 VanDerWaalsContact C-N 3.34Å; P171-Q174 PolarHBondContact O-N 2.95Å; P171-Q174 VanDerWaalsContact O-N 3.13Å; P171-R175 PolarHBondContact O-N 2.85Å
172	A	91.1	Very high	90.1	Very high	46 Å²	46	95.5 Å²	95.5	38%	0.38	47%	0.468	S	S	.	.	H	α-helix	trans	-54	-38.2	-177.7	0	0	0	0	0	115	Q174 R175 K176	A172-Q174 PolarHBondContact O-N 2.86Å; A172-R175 PolarHBondContact O-N 2.86Å; A172-K176 WeakPolarHBondContact O-CG 3.25Å; A172-K176 PolarHBondContact O-N 2.9Å
173	P	92.7	Very high	89.9	Confident	95 Å²	95	88.5 Å²	88.5	62%	0.617	44%	0.442	S	S	*	.	H	α-helix	trans	-62	-42.4	177	-24.5	35.3	0	0	0	113.2	P171 K176 A177	P171-P173 VanDerWaalsContact C-CD 3.41Å; P171-P173 VanDerWaalsContact C-N 3.34Å; P173-K176 PolarHBondContact O-N 3.42Å; P173-A177 PolarHBondContact O-N 2.86Å
174	Q	92	Very high	89.8	Confident	120 Å²	120	94 Å²	94	56%	0.561	46%	0.46	S	S	*	.	H	α-helix	trans	-66.1	-39.5	178.2	-69.2	-179	-6.1	0	0	111.5	V170 P171 A172 K176 A177 K178	V170-Q174 HydrophobicContact CG1-CB 3.89Å; P171-Q174 PolarHBondContact O-N 2.95Å; P171-Q174 VanDerWaalsContact O-N 3.13Å; A172-Q174 PolarHBondContact O-N 2.86Å; Q174-K176 PolarHBondContact O-N 2.72Å; Q174-A177 PolarHBondContact O-N 3.45Å; Q174-K178 WeakPolarHBondContact O-CB 3.48Å; Q174-K178 PolarHBondContact O-N 2.66Å
175	R	89	Confident	89.6	Confident	71 Å²	71	90 Å²	90	27%	0.268	45%	0.452	S	S	.	.	H	α-helix	trans	-60.8	-44.2	175.1	-67.7	-170.1	-84.4	134.9	-7.2	111.9	Y166 V170 P171 A172 L179	Y166-R175 HydrophobicContact CE1-CG 4.26Å; V170-R175 HydrophobicContact CB-CG 3.91Å; V170-R175 HydrophobicContact CG1-CG 3.47Å; V170-R175 VanDerWaalsContact CG1-CG 3.47Å; V170-R175 PolarHBondContact O-NE 2.7Å; P171-R175 PolarHBondContact O-N 2.85Å; A172-R175 PolarHBondContact O-N 2.86Å; R175-L179 WeakPolarHBondContact O-CB 3.46Å; R175-L179 PolarHBondContact O-N 2.84Å; R175-L179 VanDerWaalsContact O-N 3.11Å
176	K	88.9	Confident	89.3	Confident	146 Å²	146	85.9 Å²	85.9	64%	0.635	43%	0.43	S	S	*	.	H	α-helix	trans	-65.6	-42.5	176.9	-72.4	-178	178.5	-176.8	0	112.1	A172 P173 Q174 L179 Q180	A172-K176 WeakPolarHBondContact O-CG 3.25Å; A172-K176 PolarHBondContact O-N 2.9Å; P173-K176 PolarHBondContact O-N 3.42Å; Q174-K176 PolarHBondContact O-N 2.72Å; K176-L179 PolarHBondContact O-N 3.42Å; K176-Q180 WeakPolarHBondContact O-CG 3.18Å; K176-Q180 PolarHBondContact O-N 2.62Å
177	A	91.4	Very high	89.3	Confident	43 Å²	43	88.3 Å²	88.3	36%	0.355	44%	0.439	S	S	.	.	H	α-helix	trans	-60.9	-48.6	177.3	0	0	0	0	0	111.6	P173 Q174 L179 Q180 E181	P173-A177 PolarHBondContact O-N 2.86Å; Q174-A177 PolarHBondContact O-N 3.45Å; A177-L179 VanDerWaalsContact C-N 3.28Å; A177-L179 PolarHBondContact O-N 2.85Å; A177-Q180 WeakPolarHBondContact O-CB 3.06Å; A177-Q180 PolarHBondContact O-N 2.84Å; A177-Q180 VanDerWaalsContact O-N 3.13Å; A177-E181 PolarHBondContact O-N 2.82Å
178	K	86.9	Confident	89.3	Confident	86 Å²	86	87.5 Å²	87.5	37%	0.374	44%	0.439	S	S	.	.	H	α-helix	trans	-57.9	-41.5	177	-163.1	-172.8	-172.3	-169.2	0	112	Q174 E181 Y182	Q174-K178 WeakPolarHBondContact O-CB 3.48Å; Q174-K178 PolarHBondContact O-N 2.66Å; K178-E181 PolarHBondContact O-N 2.89Å; K178-Y182 HydrophobicContact CD-CE2 3.82Å; K178-Y182 VanDerWaalsContact CE-CE2 3.5Å; K178-Y182 VanDerWaalsContact CE-OH 3.27Å; K178-Y182 WeakPolarHBondContact CE-OH 3.28Å; K178-Y182 HydrophobicContact CG-CD2 4.01Å; K178-Y182 HydrophobicContact CG-CE2 3.55Å; K178-Y182 WeakPolarHBondContact O-CD2 3.38Å; K178-Y182 PolarHBondContact O-N 2.79Å
179	L	86.9	Confident	89.2	Confident	45 Å²	45	81.3 Å²	81.3	24%	0.236	41%	0.406	C	S	.	.	H	α-helix	trans	-66.3	-39.2	178	-171.2	145	0	0	0	112.2	R175 K176 A177 Y182 H183 H447	R175-L179 WeakPolarHBondContact O-CB 3.46Å; R175-L179 PolarHBondContact O-N 2.84Å; R175-L179 VanDerWaalsContact O-N 3.11Å; K176-L179 PolarHBondContact O-N 3.42Å; A177-L179 VanDerWaalsContact C-N 3.28Å; A177-L179 PolarHBondContact O-N 2.85Å; L179-Y182 PolarHBondContact O-N 2.99Å; L179-H183 WeakPolarHBondContact CD2-CE1 3.17Å; L179-H183 PolarHBondContact O-CD2 2.78Å; L179-H183 VanDerWaalsContact O-CD2 3.29Å; L179-H183 VanDerWaalsContact O-CG 3.26Å; L179-H183 PolarHBondContact O-N 2.82Å; L179-H447 WeakPolarHBondContact CD1-O 3.5Å
180	Q	87.5	Confident	89.2	Confident	137 Å²	137	79.3 Å²	79.3	64%	0.64	40%	0.395	S	S	*	.	H	α-helix	trans	-65.6	-40.2	174.2	-72.8	177.4	-7.9	0	0	112.5	K176 A177 H183 K184	K176-Q180 WeakPolarHBondContact O-CG 3.18Å; K176-Q180 PolarHBondContact O-N 2.62Å; A177-Q180 WeakPolarHBondContact O-CB 3.06Å; A177-Q180 PolarHBondContact O-N 2.84Å; A177-Q180 VanDerWaalsContact O-N 3.13Å; Q180-H183 PolarHBondContact O-N 3.1Å; Q180-K184 PolarHBondContact O-N 2.81Å
181	E	87.2	Confident	89.2	Confident	130 Å²	130	81.2 Å²	81.2	61%	0.607	40%	0.404	S	S	*	.	H	α-helix	trans	-61.1	-46.1	173.5	-71.6	176.2	170.5	0	0	111.1	A177 K178 H183 K184 V185	A177-E181 PolarHBondContact O-N 2.82Å; K178-E181 PolarHBondContact O-N 2.89Å; E181-H183 VanDerWaalsContact C-N 3.34Å; E181-H183 PolarHBondContact O-N 2.83Å; E181-K184 WeakPolarHBondContact O-CB 3.42Å; E181-K184 PolarHBondContact O-N 3.05Å; E181-K184 VanDerWaalsContact O-N 3.1Å; E181-V185 WeakPolarHBondContact O-CG2 3.41Å; E181-V185 PolarHBondContact O-N 2.95Å
182	Y	84.7	Confident	89.2	Confident	80 Å²	80	80.9 Å²	80.9	31%	0.314	40%	0.398	S	S	.	.	H	α-helix	trans	-60.8	-42.9	175	-76.6	-55.9	0	0	0	112.3	K178 L179 K184 V185 L186	K178-Y182 HydrophobicContact CD-CE2 3.82Å; K178-Y182 VanDerWaalsContact CE-CE2 3.5Å; K178-Y182 VanDerWaalsContact CE-OH 3.27Å; K178-Y182 WeakPolarHBondContact CE-OH 3.28Å; K178-Y182 HydrophobicContact CG-CD2 4.01Å; K178-Y182 HydrophobicContact CG-CE2 3.55Å; K178-Y182 WeakPolarHBondContact O-CD2 3.38Å; K178-Y182 PolarHBondContact O-N 2.79Å; L179-Y182 PolarHBondContact O-N 2.99Å; Y182-K184 PolarHBondContact O-N 2.73Å; Y182-V185 PolarHBondContact O-N 2.92Å; Y182-L186 VanDerWaalsContact O-CG 3.26Å; Y182-L186 WeakPolarHBondContact O-CG 3.17Å; Y182-L186 PolarHBondContact O-N 2.85Å
183	H	87.3	Confident	89.1	Confident	27 Å²	27	79.9 Å²	79.9	13%	0.125	39%	0.388	C	S	.	.	H	α-helix	trans	-60.7	-35.8	175.1	-71.4	-173.2	0	0	0	112.2	L179 Q180 E181 L186 R187 I453	L179-H183 WeakPolarHBondContact CD2-CE1 3.17Å; L179-H183 PolarHBondContact O-CD2 2.78Å; L179-H183 VanDerWaalsContact O-CD2 3.29Å; L179-H183 VanDerWaalsContact O-CG 3.26Å; L179-H183 PolarHBondContact O-N 2.82Å; Q180-H183 PolarHBondContact O-N 3.1Å; E181-H183 VanDerWaalsContact C-N 3.34Å; E181-H183 PolarHBondContact O-N 2.83Å; H183-L186 PolarHBondContact O-N 2.82Å; H183-R187 WeakPolarHBondContact O-CG 3.42Å; H183-R187 PolarHBondContact O-N 3.5Å; H183-I453 HydrophobicContact CB-CD1 4.32Å
184	K	87.8	Confident	89.2	Confident	149 Å²	149	78.1 Å²	78.1	65%	0.648	38%	0.378	S	S	*	.	H	α-helix	trans	-65.5	-44.4	175	-172	-178.5	177.5	-175.8	0	111.5	Q180 E181 Y182 L186 R187	Q180-K184 PolarHBondContact O-N 2.81Å; E181-K184 WeakPolarHBondContact O-CB 3.42Å; E181-K184 PolarHBondContact O-N 3.05Å; E181-K184 VanDerWaalsContact O-N 3.1Å; Y182-K184 PolarHBondContact O-N 2.73Å; K184-L186 VanDerWaalsContact C-N 3.33Å; K184-L186 PolarHBondContact O-N 2.8Å; K184-R187 PolarHBondContact O-N 3.11Å
185	V	87.6	Confident	89.2	Confident	66 Å²	66	76.1 Å²	76.1	40%	0.4	37%	0.368	S	S	.	.	H	α-helix	trans	-61.8	-41.6	175.6	173.9	0	0	0	0	110.9	E181 Y182 R187 N188 K489	E181-V185 WeakPolarHBondContact O-CG2 3.41Å; E181-V185 PolarHBondContact O-N 2.95Å; Y182-V185 PolarHBondContact O-N 2.92Å; V185-R187 VanDerWaalsContact C-N 3.29Å; V185-R187 PolarHBondContact O-N 2.89Å; V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.11Å; V185-K489 HydrophobicContact CG1-CB 3.84Å; V185-K489 HydrophobicContact CG1-CD 4.2Å; V185-K489 HydrophobicContact CG1-CG 4.41Å
186	L	87.1	Confident	89.5	Confident	3 Å²	3	77 Å²	77	2%	0.016	38%	0.382	C	S	.	.	H	α-helix	trans	-64.5	-29.7	179.3	-71	170.5	0	0	0	113.6	Y182 H183 K184 N188 T189 Y432 I444 I453 K489	Y182-L186 VanDerWaalsContact O-CG 3.26Å; Y182-L186 WeakPolarHBondContact O-CG 3.17Å; Y182-L186 PolarHBondContact O-N 2.85Å; H183-L186 PolarHBondContact O-N 2.82Å; K184-L186 VanDerWaalsContact C-N 3.33Å; K184-L186 PolarHBondContact O-N 2.8Å; L186-N188 PolarHBondContact O-N 3.32Å; L186-T189 WeakPolarHBondContact O-CB 3.39Å; L186-T189 VanDerWaalsContact O-CG2 3.3Å; L186-T189 WeakPolarHBondContact O-CG2 3.45Å; L186-T189 PolarHBondContact O-N 2.86Å; L186-T189 PolarHBondContact O-OG1 3.02Å; L186-Y432 HydrophobicContact CD1-CD1 3.51Å; L186-Y432 HydrophobicContact CD1-CE1 4.18Å; L186-Y432 HydrophobicContact CD1-CG 3.74Å; L186-Y432 HydrophobicContact CD2-CD1 3.86Å; L186-Y432 HydrophobicContact CD2-CD2 4.37Å; L186-Y432 HydrophobicContact CD2-CE1 3.69Å; L186-Y432 HydrophobicContact CD2-CE2 4.18Å; L186-Y432 HydrophobicContact CD2-CG 4.21Å; L186-Y432 HydrophobicContact CG-CD1 4.31Å; L186-I444 HydrophobicContact CD1-CG2 4.36Å; L186-I444 HydrophobicContact CD2-CG2 4.42Å; L186-I453 HydrophobicContact CB-CD1 4.33Å; L186-I453 HydrophobicContact CB-CG2 3.93Å; L186-I453 HydrophobicContact CD1-CD1 3.77Å; L186-K489 HydrophobicContact CD2-CD 4.03Å; L186-K489 VanDerWaalsContact CD2-CE 3.42Å
187	R	88.9	Confident	89.5	Confident	149 Å²	149	70.2 Å²	70.2	56%	0.562	35%	0.353	S	S	*	.	H	α-helix	trans	-66.7	-25.1	175.1	-71.6	176.5	-170.5	163.8	2.7	113.2	H183 K184 V185 T189 I453	H183-R187 WeakPolarHBondContact O-CG 3.42Å; H183-R187 PolarHBondContact O-N 3.5Å; K184-R187 PolarHBondContact O-N 3.11Å; V185-R187 VanDerWaalsContact C-N 3.29Å; V185-R187 PolarHBondContact O-N 2.89Å; R187-T189 PolarHBondContact O-N 3.18Å; R187-I453 HydrophobicContact CB-CG2 4.44Å; R187-I453 HydrophobicContact CG-CG2 3.46Å; R187-I453 VanDerWaalsContact CG-CG2 3.46Å
188	N	89.4	Confident	89.5	Confident	86 Å²	86	68.8 Å²	68.8	46%	0.46	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	11.4	179.3	-66.1	-8.2	0	0	0	112.7	V185 L186 N190	V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.11Å; L186-N188 PolarHBondContact O-N 3.32Å; N188-N190 PolarHBondContact O-N 2.85Å; N188-N190 PolarHBondContact O-ND2 3.33Å
189	T	90.6	Very high	89.8	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.006	36%	0.357	C	S	.	.			trans	-64.5	118.6	174.3	44.5	0	0	0	0	111	L186 R187 I444 S488 K489	L186-T189 WeakPolarHBondContact O-CB 3.39Å; L186-T189 VanDerWaalsContact O-CG2 3.3Å; L186-T189 WeakPolarHBondContact O-CG2 3.45Å; L186-T189 PolarHBondContact O-N 2.86Å; L186-T189 PolarHBondContact O-OG1 3.02Å; R187-T189 PolarHBondContact O-N 3.18Å; T189-I444 HydrophobicContact CG2-CD1 3.97Å; T189-S488 CarbonylContact C-O 3.6Å; T189-S488 VanDerWaalsContact CA-O 3.25Å; T189-S488 WeakPolarHBondContact CA-O 3.36Å; T189-K489 HydrophobicContact CG2-CB 4.28Å; T189-K489 HydrophobicContact CG2-CG 3.48Å; T189-K489 VanDerWaalsContact CG2-CG 3.48Å
190	N	92.1	Very high	90.2	Very high	81 Å²	81	76.1 Å²	76.1	43%	0.433	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	159.2	-178.3	-68.9	-38.6	0	0	0	110.6	N188 L192 W487 S488	N188-N190 PolarHBondContact O-N 2.85Å; N188-N190 PolarHBondContact O-ND2 3.33Å; N190-L192 PolarHBondContact O-N 3.13Å; N190-W487 CarbonylContact O-C 3.58Å; N190-W487 VanDerWaalsContact O-CA 3.26Å; N190-W487 WeakPolarHBondContact O-CA 3.14Å; N190-S488 PolarHBondContact N-O 3.35Å; N190-S488 PolarHBondContact O-N 3.07Å
191	L	92.1	Very high	90.5	Very high	75 Å²	75	70.6 Å²	70.6	39%	0.393	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	123	177.4	-178.3	64.8	0	0	0	109.8	C193 K485 W487	L191-C193 WeakPolarHBondContact CD1-O 3.47Å; L191-K485 HydrophobicContact CD1-CB 3.6Å; L191-K485 HydrophobicContact CD1-CD 3.84Å; L191-K485 HydrophobicContact CD1-CG 3.85Å; L191-K485 HydrophobicContact CD2-CD 4.42Å; L191-W487 HydrophobicContact CB-CE3 3.9Å; L191-W487 HydrophobicContact CB-CH2 4.16Å; L191-W487 HydrophobicContact CB-CZ3 3.68Å; L191-W487 HydrophobicContact CD1-CD2 4.26Å; L191-W487 HydrophobicContact CD1-CE3 4.4Å; L191-W487 HydrophobicContact CD1-CH2 4.27Å; L191-W487 HydrophobicContact CD1-CZ2 4.13Å; L191-W487 HydrophobicContact CD1-CZ3 4.41Å; L191-W487 VanDerWaalsContact N-CE3 3.34Å
192	L	91.2	Very high	90.8	Very high	63 Å²	63	64.4 Å²	64.4	33%	0.33	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-59.4	175.8	-176.2	71.5	0	0	0	111.5	N190 Y474 L486	N190-L192 PolarHBondContact O-N 3.13Å; L192-Y474 HydrophobicContact CD2-CE1 3.98Å; L192-L486 HydrophobicContact CB-CD2 4.17Å; L192-L486 WeakPolarHBondContact CB-O 3.36Å; L192-L486 HydrophobicContact CD2-CD2 3.44Å; L192-L486 VanDerWaalsContact CD2-CD2 3.44Å; L192-L486 HydrophobicContact CG-CD2 4.34Å; L192-L486 PolarHBondContact N-O 2.95Å
193	C	90.7	Very high	91.3	Very high	24 Å²	24	60.9 Å²	60.9	16%	0.162	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148.3	-178.1	95.8	0	0	0	0	110	L191 C231 K485 L486	L191-C193 WeakPolarHBondContact CD1-O 3.47Å; C193-C231 HydrophobicContact CB-CB 4.33Å; C193-C231 WeakPolarHBondContact CB-SG 3.23Å; C193-C231 WeakPolarHBondContact SG-CB 3.08Å; C193-C231 CovalentContact SG-SG 2.1Å; C193-C231 PolarHBondContact SG-SG 2.9Å; C193-K485 WeakPolarHBondContact O-CA 3.19Å; C193-L486 PolarHBondContact N-O 3.31Å; C193-L486 PolarHBondContact O-N 2.89Å
194	S	93.3	Very high	91.6	Very high	58 Å²	58	59.8 Å²	59.8	41%	0.406	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	111.7	170.4	-176.6	0	0	0	0	107.1	K485	S194-K485 WeakPolarHBondContact OG-CE 3.34Å
195	Q	93.8	Very high	91.9	Very high	78 Å²	78	52.7 Å²	52.7	36%	0.364	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.9	-172.8	-173.3	68.5	9.9	0	0	109.9	G197 W226 T483 Y484	Q195-G197 PolarHBondContact O-N 2.9Å; Q195-W226 HydrophobicContact CG-CE3 4.22Å; Q195-W226 HydrophobicContact CG-CH2 4.28Å; Q195-W226 HydrophobicContact CG-CZ3 3.82Å; Q195-T483 CarbonylContact O-C 3.55Å; Q195-T483 WeakPolarHBondContact O-CA 3.2Å; Q195-T483 WeakPolarHBondContact O-CB 3.35Å; Q195-Y484 HydrophobicContact CB-CD1 4.2Å; Q195-Y484 HydrophobicContact CB-CE1 3.53Å; Q195-Y484 HydrophobicContact CB-CE2 4.21Å; Q195-Y484 HydrophobicContact CG-CE1 3.73Å; Q195-Y484 PolarHBondContact N-O 2.99Å; Q195-Y484 PolarHBondContact O-N 3.4Å
196	V	93.8	Very high	92.3	Very high	91 Å²	91	52.4 Å²	52.4	55%	0.552	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	120.6	174.7	-178.9	0	0	0	0	108.4	W226 T483	V196-W226 WeakPolarHBondContact O-CH2 3.28Å; V196-T483 HydrophobicContact CG2-CG2 4.26Å
197	G	89.7	Confident	92.6	Very high	3 Å²	3	52.7 Å²	52.7	3%	0.031	26%	0.262	C	S	.	.			trans	-81.8	-51	-179.1	0	0	0	0	0	112.5	Q195 R224 L482	Q195-G197 PolarHBondContact O-N 2.9Å; G197-R224 WeakPolarHBondContact O-CD 3.2Å; G197-R224 PolarHBondContact O-NH1 2.71Å; G197-L482 PolarHBondContact N-O 3.21Å
198	D	91.4	Very high	92.8	Very high	13 Å²	13	45.7 Å²	45.7	7%	0.07	24%	0.236	C	C	.	.			trans	-159.1	175.8	-176.9	-164	20.4	0	0	0	113.5	R200 L202 S218 S220 R224 L482	D198-R200 PolarHBondContact O-N 3.35Å; D198-L202 HydrophobicContact CB-CD2 4.38Å; D198-S218 WeakPolarHBondContact OD2-CB 3.2Å; D198-S218 PolarHBondContact OD2-OG 3.12Å; D198-S220 WeakPolarHBondContact OD2-CB 3.44Å; D198-S220 PolarHBondContact OD2-OG 2.76Å; D198-R224 VanDerWaalsContact CA-NH1 3.29Å; D198-R224 IonicContact OD1-CZ 3.12Å; D198-R224 IonicContact OD1-NH1 3.87Å; D198-R224 PolarHBondContact OD1-NH1 3.37Å; D198-R224 IonicContact OD1-NH2 3.16Å; D198-R224 PolarHBondContact OD1-NH2 2.71Å; D198-R224 IonicContact OD2-NH1 2.98Å; D198-L482 WeakPolarHBondContact O-CB 3.35Å
199	I	93	Very high	92.7	Very high	144 Å²	144	43.3 Å²	43.3	74%	0.738	23%	0.225	S	C	*	.	S	Bend	trans	-72.8	-16.1	170.7	60	166.9	0	0	0	113.5
200	R	94.4	Very high	92.6	Very high	140 Å²	140	45.2 Å²	45.2	53%	0.528	24%	0.235	S	C	.	.	S	Bend	trans	-116.1	153.2	-179.6	-74	-101.5	-176.6	-179.3	0.6	109.4	D198 W219 L482	D198-R200 PolarHBondContact O-N 3.35Å; R200-W219 HydrophobicContact CB-CB 4.09Å; R200-L482 WeakPolarHBondContact O-CD2 3.4Å
201	P	94.3	Very high	92.3	Very high	22 Å²	22	42 Å²	42	14%	0.143	22%	0.221	C	C	.	.			trans	-60.1	146.9	-177.8	26.6	-36.4	0	0	0	111.6	W219 H480	P201-W219 HydrophobicContact CG-CB 4.27Å; P201-W219 HydrophobicContact CG-CD2 3.47Å; P201-W219 VanDerWaalsContact CG-CD2 3.47Å; P201-W219 HydrophobicContact CG-CE3 3.31Å; P201-W219 HydrophobicContact CG-CG 3.93Å; P201-W219 HydrophobicContact CG-CH2 4.24Å; P201-W219 HydrophobicContact CG-CZ2 4.38Å; P201-W219 HydrophobicContact CG-CZ3 3.72Å; P201-W219 PolarHBondContact O-N 2.85Å; P201-H480 HydrophobicContact CB-CB 4.08Å
202	L	94.6	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135.4	178.6	-58.8	178.5	0	0	0	110	D198 S217 C478	D198-L202 HydrophobicContact CB-CD2 4.38Å; L202-S217 CarbonylContact C-O 3.49Å; L202-S217 WeakPolarHBondContact CA-O 3.17Å; L202-C478 HydrophobicContact CB-CB 3.89Å; L202-C478 HydrophobicContact CD1-CB 4.16Å
203	S	93.6	Very high	92.3	Very high	6 Å²	6	44 Å²	44	4%	0.042	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-31.2	-178.8	50	0	0	0	0	113.5	S217 T244 C245 V464	S203-S217 PolarHBondContact N-O 3.27Å; S203-S217 WeakPolarHBondContact OG-CB 3.16Å; S203-S217 PolarHBondContact OG-O 2.72Å; S203-S217 PolarHBondContact OG-OG 3.19Å; S203-T244 WeakPolarHBondContact CB-O 3.33Å; S203-T244 PolarHBondContact OG-O 3.26Å; S203-C245 WeakPolarHBondContact CB-O 3.47Å; S203-C245 PolarHBondContact OG-O 2.85Å; S203-V464 VanDerWaalsContact O-CG1 3.28Å; S203-V464 WeakPolarHBondContact O-CG1 3.41Å
204	M	94.8	Very high	92.4	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	150.1	-178	-164.3	168.7	149.1	0	0	111.1	T216 S217 A246 I247 V248 R296 Y465	M204-T216 WeakPolarHBondContact O-CA 3.24Å; M204-S217 VanDerWaalsContact CB-OG 3.24Å; M204-S217 WeakPolarHBondContact CB-OG 3.24Å; M204-S217 PolarHBondContact N-OG 2.85Å; M204-S217 VanDerWaalsContact N-OG 3.1Å; M204-S217 PolarHBondContact O-N 3.2Å; M204-S217 PolarHBondContact O-OG 3.01Å; M204-A246 HydrophobicContact CE-CB 4.47Å; M204-A246 WeakPolarHBondContact SD-CA 3.44Å; M204-A246 HydrophobicContact SD-CB 3.5Å; M204-A246 WeakPolarHBondContact SD-CB 3.47Å; M204-I247 HydrophobicContact CB-CG2 4.39Å; M204-I247 WeakPolarHBondContact CE-O 3.4Å; M204-I247 PolarHBondContact SD-N 2.96Å; M204-I247 VanDerWaalsContact SD-N 3.42Å; M204-V248 HydrophobicContact CE-CG2 3.97Å; M204-R296 PolarHBondContact SD-NH1 3.22Å; M204-Y465 HydrophobicContact CE-CE1 4.32Å; M204-Y465 HydrophobicContact CG-CD1 3.84Å; M204-Y465 HydrophobicContact CG-CD2 4.2Å; M204-Y465 HydrophobicContact CG-CE1 3.84Å; M204-Y465 HydrophobicContact CG-CE2 4.2Å; M204-Y465 HydrophobicContact CG-CG 3.97Å; M204-Y465 HydrophobicContact SD-CE2 4.47Å
205	C	94.1	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	139.9	167.2	55.7	0	0	0	0	109.4	L214 A215 T216 Y465 C478	C205-L214 HydrophobicContact CB-CD1 4.47Å; C205-L214 HydrophobicContact CB-CD2 4.46Å; C205-A215 CarbonylContact C-O 3.58Å; C205-A215 VanDerWaalsContact CA-O 3.23Å; C205-A215 WeakPolarHBondContact CA-O 3.23Å; C205-T216 HydrophobicContact CB-CG2 4.32Å; C205-Y465 WeakPolarHBondContact O-CD1 3.32Å; C205-Y465 WeakPolarHBondContact O-CE1 3.3Å; C205-C478 HydrophobicContact CB-CB 4.05Å
206	R	94.9	Very high	92.6	Very high	60 Å²	60	36.4 Å²	36.4	23%	0.226	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	132.3	176.8	-159	77.6	179.4	151.3	-7.5	111.1	A215 W249 R424 D467	R206-A215 PolarHBondContact N-O 2.73Å; R206-A215 PolarHBondContact O-N 3.06Å; R206-W249 PolarHBondContact O-NE1 2.72Å; R206-R424 VanDerWaalsContact NH1-CD 3.34Å; R206-D467 VanDerWaalsContact CA-OD2 3.24Å; R206-D467 WeakPolarHBondContact CA-OD2 3.44Å; R206-D467 VanDerWaalsContact CD-OD2 3.22Å; R206-D467 WeakPolarHBondContact CD-OD2 3.49Å; R206-D467 IonicContact CZ-OD1 3.71Å; R206-D467 IonicContact CZ-OD2 2.74Å; R206-D467 IonicContact NE-OD2 3.92Å; R206-D467 IonicContact NH1-OD1 3.76Å; R206-D467 PolarHBondContact NH1-OD1 3.23Å; R206-D467 IonicContact NH1-OD2 3.66Å; R206-D467 PolarHBondContact NH1-OD2 2.88Å
207	F	94.1	Very high	92.6	Very high	10 Å²	10	32.1 Å²	32.1	4%	0.044	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	145.3	172.2	-73.1	-82.9	0	0	0	111	L214 I228 W249 D467 I468 A476 L486	F207-L214 HydrophobicContact CD1-CD1 3.86Å; F207-L214 HydrophobicContact CD2-CD1 4.2Å; F207-L214 HydrophobicContact CE1-CD1 3.79Å; F207-L214 HydrophobicContact CE2-CD1 4.13Å; F207-L214 HydrophobicContact CG-CD1 4.08Å; F207-L214 HydrophobicContact CZ-CD1 3.93Å; F207-I228 HydrophobicContact CD1-CD1 3.3Å; F207-I228 HydrophobicContact CE1-CD1 3.27Å; F207-I228 HydrophobicContact CE1-CG1 4.28Å; F207-W249 VanDerWaalsContact C-CD1 3.44Å; F207-D467 HydrophobicContact CD2-CB 3.9Å; F207-D467 HydrophobicContact CE2-CB 4.23Å; F207-D467 WeakPolarHBondContact CE2-O 3.38Å; F207-D467 PolarHBondContact N-OD2 2.67Å; F207-I468 VanDerWaalsContact CD2-C 3.46Å; F207-A476 HydrophobicContact CD2-CB 4.42Å; F207-A476 HydrophobicContact CE1-CB 4.39Å; F207-A476 HydrophobicContact CE2-CB 3.43Å; F207-A476 VanDerWaalsContact CE2-CB 3.43Å; F207-A476 HydrophobicContact CZ-CB 3.41Å; F207-A476 VanDerWaalsContact CZ-CB 3.41Å; F207-L486 HydrophobicContact CE1-CD1 4.1Å; F207-L486 HydrophobicContact CZ-CD1 4.06Å
208	S	93	Very high	92.9	Very high	2 Å²	2	32 Å²	32	1%	0.014	15%	0.153	C	C	.	.			trans	-67.1	152.3	168.4	60.2	0	0	0	0	110.8	D210 G211 K212 Q213	S208-D210 WeakPolarHBondContact CB-OD1 3.41Å; S208-D210 PolarHBondContact O-N 2.52Å; S208-D210 PolarHBondContact OG-OD1 3.49Å; S208-G211 WeakPolarHBondContact O-CA 3.42Å; S208-G211 PolarHBondContact O-N 3.42Å; S208-G211 PolarHBondContact OG-N 3.25Å; S208-K212 PolarHBondContact OG-N 2.96Å; S208-Q213 PolarHBondContact N-O 2.91Å; S208-Q213 PolarHBondContact OG-N 3.46Å; S208-Q213 PolarHBondContact OG-O 3.46Å; S208-Q213 VanDerWaalsContact OG-O 3.11Å
209	P	88.5	Confident	93	Very high	36 Å²	36	36.4 Å²	36.4	23%	0.234	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-26	179.8	-24	32.5	0	0	0	114.7	W249 H250 A253 L255 P470	P209-W249 HydrophobicContact CG-CB 4.37Å; P209-H250 VanDerWaalsContact CG-O 3.25Å; P209-H250 WeakPolarHBondContact CG-O 3.46Å; P209-A253 WeakPolarHBondContact CD-O 3.43Å; P209-A253 HydrophobicContact CG-CB 4.37Å; P209-A253 WeakPolarHBondContact CG-O 3.39Å; P209-L255 HydrophobicContact CB-CD1 4.43Å; P209-P470 WeakPolarHBondContact O-CG 3.31Å
210	D	86.7	Confident	93	Very high	41 Å²	41	31.4 Å²	31.4	22%	0.219	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.9	174.4	68.1	-16.7	0	0	0	113.5	S208 K212	S208-D210 WeakPolarHBondContact CB-OD1 3.41Å; S208-D210 PolarHBondContact O-N 2.52Å; S208-D210 PolarHBondContact OG-OD1 3.49Å; D210-K212 VanDerWaalsContact C-N 3.26Å; D210-K212 PolarHBondContact O-N 3Å; D210-K212 PolarHBondContact OD1-N 2.63Å
211	G	87.4	Confident	92.8	Very high	12 Å²	12	24.8 Å²	24.8	12%	0.124	12%	0.122	C	C	.	.	S	Bend	trans	75.3	2.9	177.6	0	0	0	0	0	115.6	S208	S208-G211 WeakPolarHBondContact O-CA 3.42Å; S208-G211 PolarHBondContact O-N 3.42Å; S208-G211 PolarHBondContact OG-N 3.25Å
212	K	89.5	Confident	92.8	Very high	138 Å²	138	25.8 Å²	25.8	60%	0.6	13%	0.126	S	C	*	.	S	Bend	trans	-89.1	-20.7	-175.8	-64.9	-179.2	-175.9	169.6	0	114.1	S208 D210 I228	S208-K212 PolarHBondContact OG-N 2.96Å; D210-K212 VanDerWaalsContact C-N 3.26Å; D210-K212 PolarHBondContact O-N 3Å; D210-K212 PolarHBondContact OD1-N 2.63Å; K212-I228 PolarHBondContact O-N 2.69Å
213	Q	92.6	Very high	92.7	Very high	42 Å²	42	25.8 Å²	25.8	20%	0.196	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.2	-175.8	-60.4	-173.2	2.8	0	0	112	S208 W226 I228 W249	S208-Q213 PolarHBondContact N-O 2.91Å; S208-Q213 PolarHBondContact OG-N 3.46Å; S208-Q213 PolarHBondContact OG-O 3.46Å; S208-Q213 VanDerWaalsContact OG-O 3.11Å; Q213-W226 CarbonylContact C-O 3.49Å; Q213-W226 VanDerWaalsContact CA-O 3.23Å; Q213-W226 WeakPolarHBondContact CA-O 3.37Å; Q213-I228 VanDerWaalsContact C-CD1 3.49Å; Q213-W249 HydrophobicContact CB-CH2 4.01Å; Q213-W249 HydrophobicContact CB-CZ2 3.98Å
214	L	94.3	Very high	92.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.5	172.1	-168.7	87.8	0	0	0	108.6	C205 F207 T216 L225 W226 I228 A476 Y484	C205-L214 HydrophobicContact CB-CD1 4.47Å; C205-L214 HydrophobicContact CB-CD2 4.46Å; F207-L214 HydrophobicContact CD1-CD1 3.86Å; F207-L214 HydrophobicContact CD2-CD1 4.2Å; F207-L214 HydrophobicContact CE1-CD1 3.79Å; F207-L214 HydrophobicContact CE2-CD1 4.13Å; F207-L214 HydrophobicContact CG-CD1 4.08Å; F207-L214 HydrophobicContact CZ-CD1 3.93Å; L214-T216 HydrophobicContact CD2-CG2 3.63Å; L214-T216 HydrophobicContact CG-CG2 4.31Å; L214-L225 CarbonylContact O-C 3.57Å; L214-L225 WeakPolarHBondContact O-CA 3.49Å; L214-W226 HydrophobicContact CB-CB 4.23Å; L214-W226 PolarHBondContact N-O 2.93Å; L214-W226 PolarHBondContact O-N 3.11Å; L214-I228 HydrophobicContact CB-CD1 3.89Å; L214-I228 HydrophobicContact CB-CG1 4.28Å; L214-A476 HydrophobicContact CD1-CB 3.49Å; L214-A476 VanDerWaalsContact CD1-CB 3.49Å; L214-A476 HydrophobicContact CD2-CB 4.47Å; L214-Y484 HydrophobicContact CD2-CD2 3.49Å; L214-Y484 VanDerWaalsContact CD2-CD2 3.49Å; L214-Y484 HydrophobicContact CD2-CE2 3.66Å; L214-Y484 HydrophobicContact CD2-CG 4.01Å
215	A	94.7	Very high	92.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.9	168.7	0	0	0	0	0	110.3	C205 R206 R224 L225 I247 W249 L263	C205-A215 CarbonylContact C-O 3.58Å; C205-A215 VanDerWaalsContact CA-O 3.23Å; C205-A215 WeakPolarHBondContact CA-O 3.23Å; R206-A215 PolarHBondContact N-O 2.73Å; R206-A215 PolarHBondContact O-N 3.06Å; A215-R224 CarbonylContact C-O 3.52Å; A215-R224 WeakPolarHBondContact CA-O 2.85Å; A215-L225 HydrophobicContact CB-CD2 3.56Å; A215-I247 HydrophobicContact CB-CD1 3.68Å; A215-I247 HydrophobicContact CB-CG1 3.86Å; A215-I247 HydrophobicContact CB-CG2 4.17Å; A215-W249 HydrophobicContact CB-CZ2 3.84Å; A215-L263 HydrophobicContact CB-CD2 4.02Å
216	T	95.7	Very high	92.7	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.012	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.6	175.4	59.9	0	0	0	0	110.3	M204 C205 L214 C223 R224 W226 Y484	M204-T216 WeakPolarHBondContact O-CA 3.24Å; C205-T216 HydrophobicContact CB-CG2 4.32Å; L214-T216 HydrophobicContact CD2-CG2 3.63Å; L214-T216 HydrophobicContact CG-CG2 4.31Å; T216-C223 CarbonylContact O-C 3.46Å; T216-C223 VanDerWaalsContact O-CA 3.3Å; T216-C223 WeakPolarHBondContact O-CA 3.2Å; T216-R224 PolarHBondContact N-O 3.39Å; T216-R224 PolarHBondContact O-N 3.31Å; T216-R224 PolarHBondContact OG1-O 3.1Å; T216-W226 PolarHBondContact OG1-NE1 3.27Å; T216-Y484 HydrophobicContact CG2-CD1 4.23Å; T216-Y484 HydrophobicContact CG2-CG 4.37Å
217	S	94.6	Very high	92.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	143.6	173.9	63.5	0	0	0	0	110.4	L202 S203 M204 T244	L202-S217 CarbonylContact C-O 3.49Å; L202-S217 WeakPolarHBondContact CA-O 3.17Å; S203-S217 PolarHBondContact N-O 3.27Å; S203-S217 WeakPolarHBondContact OG-CB 3.16Å; S203-S217 PolarHBondContact OG-O 2.72Å; S203-S217 PolarHBondContact OG-OG 3.19Å; M204-S217 VanDerWaalsContact CB-OG 3.24Å; M204-S217 WeakPolarHBondContact CB-OG 3.24Å; M204-S217 PolarHBondContact N-OG 2.85Å; M204-S217 VanDerWaalsContact N-OG 3.1Å; M204-S217 PolarHBondContact O-N 3.2Å; M204-S217 PolarHBondContact O-OG 3.01Å; S217-T244 WeakPolarHBondContact CB-OG1 3.3Å
218	S	95	Very high	92.4	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.014	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	156.3	-174.5	69	0	0	0	0	112.6	D198 S220 G221 L222 T244	D198-S218 WeakPolarHBondContact OD2-CB 3.2Å; D198-S218 PolarHBondContact OD2-OG 3.12Å; S218-S220 PolarHBondContact O-N 3.2Å; S218-S220 VanDerWaalsContact O-N 3.14Å; S218-S220 PolarHBondContact OG-OG 3.25Å; S218-G221 PolarHBondContact O-N 2.89Å; S218-L222 PolarHBondContact N-O 3.15Å; S218-L222 PolarHBondContact OG-O 2.76Å; S218-T244 PolarHBondContact N-OG1 3.14Å; S218-T244 PolarHBondContact O-N 2.64Å; S218-T244 PolarHBondContact O-OG1 2.96Å
219	W	93.7	Very high	92	Very high	104 Å²	104	29.7 Å²	29.7	39%	0.394	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	0.7	176.4	-65.4	4.7	0	0	0	114.1	R200 P201 G221 P243 H480	R200-W219 HydrophobicContact CB-CB 4.09Å; P201-W219 HydrophobicContact CG-CB 4.27Å; P201-W219 HydrophobicContact CG-CD2 3.47Å; P201-W219 VanDerWaalsContact CG-CD2 3.47Å; P201-W219 HydrophobicContact CG-CE3 3.31Å; P201-W219 HydrophobicContact CG-CG 3.93Å; P201-W219 HydrophobicContact CG-CH2 4.24Å; P201-W219 HydrophobicContact CG-CZ2 4.38Å; P201-W219 HydrophobicContact CG-CZ3 3.72Å; P201-W219 PolarHBondContact O-N 2.85Å; W219-G221 VanDerWaalsContact C-N 3.27Å; W219-P243 HydrophobicContact CB-CB 3.83Å; W219-P243 HydrophobicContact CG-CB 4.14Å; W219-P243 WeakPolarHBondContact O-CB 3.45Å; W219-H480 AromaticContact CH2-CE1 3.87Å; W219-H480 AromaticContact CZ2-CE1 3.86Å; W219-H480 AromaticContact CZ2-NE2 3.59Å
220	S	92.5	Very high	92	Very high	39 Å²	39	33.6 Å²	33.6	27%	0.273	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.9	170.6	65.6	0	0	0	0	113.3	D198 S218 L222	D198-S220 WeakPolarHBondContact OD2-CB 3.44Å; D198-S220 PolarHBondContact OD2-OG 2.76Å; S218-S220 PolarHBondContact O-N 3.2Å; S218-S220 VanDerWaalsContact O-N 3.14Å; S218-S220 PolarHBondContact OG-OG 3.25Å; S220-L222 WeakPolarHBondContact OG-CB 3.27Å; S220-L222 WeakPolarHBondContact OG-CG 3.44Å; S220-L222 PolarHBondContact OG-N 2.91Å
221	G	90.7	Very high	92	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	16%	0.163	C	C	.	.	S	Bend	trans	99	-10.5	-168.4	0	0	0	0	0	113.2	S218 W219 A242 T244	S218-G221 PolarHBondContact O-N 2.89Å; W219-G221 VanDerWaalsContact C-N 3.27Å; G221-A242 WeakPolarHBondContact CA-O 3.28Å; G221-T244 WeakPolarHBondContact O-CG2 3.4Å
222	L	93.2	Very high	92.3	Very high	44 Å²	44	36 Å²	36	23%	0.23	18%	0.182	C	C	.	.			trans	-89.5	136.9	-177.3	-60.2	175.7	0	0	0	112	S218 S220 R238	S218-L222 PolarHBondContact N-O 3.15Å; S218-L222 PolarHBondContact OG-O 2.76Å; S220-L222 WeakPolarHBondContact OG-CB 3.27Å; S220-L222 WeakPolarHBondContact OG-CG 3.44Å; S220-L222 PolarHBondContact OG-N 2.91Å; L222-R238 HydrophobicContact CD2-CB 4.49Å; L222-R238 HydrophobicContact CD2-CG 3.84Å
223	C	93.4	Very high	92.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.7	165.7	-71	0	0	0	0	108.8	T216 L237 I247	T216-C223 CarbonylContact O-C 3.46Å; T216-C223 VanDerWaalsContact O-CA 3.3Å; T216-C223 WeakPolarHBondContact O-CA 3.2Å; C223-L237 HydrophobicContact CB-CB 3.95Å; C223-L237 HydrophobicContact CB-CD1 4.05Å; C223-L237 HydrophobicContact CB-CG 4.48Å; C223-L237 PolarHBondContact N-O 2.99Å; C223-L237 WeakPolarHBondContact O-CA 3.43Å; C223-L237 WeakPolarHBondContact O-CB 3.39Å; C223-L237 PolarHBondContact O-N 3.49Å; C223-I247 HydrophobicContact CB-CD1 3.65Å
224	R	94.4	Very high	92.4	Very high	40 Å²	40	34.2 Å²	34.2	15%	0.151	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144.2	-178.1	-67	-173.5	165.2	108.1	8.6	111.1	G197 D198 A215 T216 W226 L233 N236	G197-R224 WeakPolarHBondContact O-CD 3.2Å; G197-R224 PolarHBondContact O-NH1 2.71Å; D198-R224 VanDerWaalsContact CA-NH1 3.29Å; D198-R224 IonicContact OD1-CZ 3.12Å; D198-R224 IonicContact OD1-NH1 3.87Å; D198-R224 PolarHBondContact OD1-NH1 3.37Å; D198-R224 IonicContact OD1-NH2 3.16Å; D198-R224 PolarHBondContact OD1-NH2 2.71Å; D198-R224 IonicContact OD2-NH1 2.98Å; A215-R224 CarbonylContact C-O 3.52Å; A215-R224 WeakPolarHBondContact CA-O 2.85Å; T216-R224 PolarHBondContact N-O 3.39Å; T216-R224 PolarHBondContact O-N 3.31Å; T216-R224 PolarHBondContact OG1-O 3.1Å; R224-W226 HydrophobicContact CB-CZ2 4.05Å; R224-L233 HydrophobicContact CB-CD1 4.17Å; R224-L233 HydrophobicContact CG-CD1 4.05Å; R224-N236 WeakPolarHBondContact CD-OD1 3.29Å; R224-N236 VanDerWaalsContact CG-OD1 3.29Å; R224-N236 WeakPolarHBondContact CG-OD1 3.22Å; R224-N236 PolarHBondContact NE-OD1 3.35Å
225	L	94.3	Very high	92.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.7	174.5	-61.3	174.6	0	0	0	109.4	L214 A215 V234 M235 L237 W249 L263 L277	L214-L225 CarbonylContact O-C 3.57Å; L214-L225 WeakPolarHBondContact O-CA 3.49Å; A215-L225 HydrophobicContact CB-CD2 3.56Å; L225-V234 HydrophobicContact CB-CB 4.38Å; L225-V234 PolarHBondContact O-N 2.8Å; L225-M235 HydrophobicContact CB-CB 4.44Å; L225-M235 HydrophobicContact CD1-CB 4.27Å; L225-M235 HydrophobicContact CD1-CE 3.41Å; L225-M235 VanDerWaalsContact CD1-CE 3.41Å; L225-M235 PolarHBondContact N-O 2.92Å; L225-M235 PolarHBondContact O-N 3.39Å; L225-L237 HydrophobicContact CD1-CD1 4.31Å; L225-L237 HydrophobicContact CD1-CG 4.5Å; L225-L237 HydrophobicContact CG-CD1 4.38Å; L225-W249 HydrophobicContact CD2-CH2 3.81Å; L225-W249 HydrophobicContact CD2-CZ2 3.59Å; L225-L263 HydrophobicContact CD1-CD1 3.88Å; L225-L263 HydrophobicContact CD2-CD1 3.6Å; L225-L263 HydrophobicContact CG-CD1 4.29Å; L225-L277 HydrophobicContact CD1-CD2 3.75Å
226	W	94.6	Very high	92.2	Very high	12 Å²	12	36.7 Å²	36.7	5%	0.045	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.1	-178.3	-50.6	86.8	0	0	0	109.9	Q195 V196 Q213 L214 T216 R224 N232 L233 Y484	Q195-W226 HydrophobicContact CG-CE3 4.22Å; Q195-W226 HydrophobicContact CG-CH2 4.28Å; Q195-W226 HydrophobicContact CG-CZ3 3.82Å; V196-W226 WeakPolarHBondContact O-CH2 3.28Å; Q213-W226 CarbonylContact C-O 3.49Å; Q213-W226 VanDerWaalsContact CA-O 3.23Å; Q213-W226 WeakPolarHBondContact CA-O 3.37Å; L214-W226 HydrophobicContact CB-CB 4.23Å; L214-W226 PolarHBondContact N-O 2.93Å; L214-W226 PolarHBondContact O-N 3.11Å; T216-W226 PolarHBondContact OG1-NE1 3.27Å; R224-W226 HydrophobicContact CB-CZ2 4.05Å; W226-N232 CarbonylContact C-O 3.48Å; W226-N232 VanDerWaalsContact CA-O 3.25Å; W226-N232 WeakPolarHBondContact CA-O 3.23Å; W226-L233 HydrophobicContact CE3-CB 4.03Å; W226-L233 HydrophobicContact CE3-CD1 4.47Å; W226-L233 HydrophobicContact CH2-CB 4.43Å; W226-L233 HydrophobicContact CH2-CD1 3.79Å; W226-L233 HydrophobicContact CZ2-CD1 4.03Å; W226-L233 HydrophobicContact CZ3-CB 3.82Å; W226-L233 HydrophobicContact CZ3-CD1 4.03Å; W226-Y484 AromaticContact CD1-CE1 3.98Å; W226-Y484 AromaticContact CD2-CE1 3.56Å; W226-Y484 HydrophobicContact CD2-CE1 3.56Å; W226-Y484 AromaticContact CD2-CZ 3.74Å; W226-Y484 VanDerWaalsContact CD2-OH 3.28Å; W226-Y484 AromaticContact CE2-CE1 3.51Å; W226-Y484 HydrophobicContact CE3-CE1 4.03Å; W226-Y484 VanDerWaalsContact CE3-OH 3.31Å; W226-Y484 AromaticContact CG-CE1 3.89Å; W226-Y484 HydrophobicContact CG-CE1 3.89Å; W226-Y484 AromaticContact CG-CZ 3.75Å; W226-Y484 HydrophobicContact CH2-CE1 4.36Å; W226-Y484 AromaticContact CZ2-CE1 3.96Å; W226-Y484 HydrophobicContact CZ2-CE1 3.96Å; W226-Y484 HydrophobicContact CZ3-CE1 4.4Å; W226-Y484 AromaticContact NE1-CE1 3.74Å
227	S	93	Very high	92	Very high	27 Å²	27	36.6 Å²	36.6	19%	0.189	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	144.9	170.6	67.2	0	0	0	0	110.6	C231 N232	S227-C231 WeakPolarHBondContact O-CA 3.16Å; S227-C231 PolarHBondContact O-N 2.96Å; S227-N232 PolarHBondContact N-O 2.87Å; S227-N232 PolarHBondContact OG-N 3.44Å; S227-N232 PolarHBondContact OG-O 2.78Å
228	I	88.9	Confident	91.8	Very high	20 Å²	20	43.6 Å²	43.6	10%	0.103	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	133.3	172.2	-62.5	150.2	0	0	0	106.7	F207 K212 Q213 L214 Y474 L486	F207-I228 HydrophobicContact CD1-CD1 3.3Å; F207-I228 HydrophobicContact CE1-CD1 3.27Å; F207-I228 HydrophobicContact CE1-CG1 4.28Å; K212-I228 PolarHBondContact O-N 2.69Å; Q213-I228 VanDerWaalsContact C-CD1 3.49Å; L214-I228 HydrophobicContact CB-CD1 3.89Å; L214-I228 HydrophobicContact CB-CG1 4.28Å; I228-Y474 HydrophobicContact CG2-CD2 3.83Å; I228-Y474 HydrophobicContact CG2-CE2 3.86Å; I228-L486 HydrophobicContact CG1-CD1 4.32Å; I228-L486 HydrophobicContact CG2-CD1 4.38Å
229	P	84.3	Confident	91.3	Very high	64 Å²	64	45 Å²	45	42%	0.416	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.6	-9.3	10.2	34.8	-35.4	0	0	0	115.8	C231	P229-C231 PolarHBondContact O-N 3.47Å; P229-C231 VanDerWaalsContact O-N 3.12Å; P229-C231 PolarHBondContact O-SG 2.95Å; P229-C231 VanDerWaalsContact O-SG 3.42Å
230	D	87.6	Confident	91.1	Very high	117 Å²	117	40.6 Å²	40.6	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.9	-168.8	-59.6	-27.2	0	0	0	114.4	N232	D230-N232 PolarHBondContact O-N 2.9Å
231	C	88.4	Confident	91	Very high	6 Å²	6	45.1 Å²	45.1	4%	0.041	25%	0.245	C	C	.	.			trans	57.8	27.9	-179.4	-55.6	0	0	0	0	112.5	C193 S227 P229	C193-C231 HydrophobicContact CB-CB 4.33Å; C193-C231 WeakPolarHBondContact CB-SG 3.23Å; C193-C231 WeakPolarHBondContact SG-CB 3.08Å; C193-C231 CovalentContact SG-SG 2.1Å; C193-C231 PolarHBondContact SG-SG 2.9Å; S227-C231 WeakPolarHBondContact O-CA 3.16Å; S227-C231 PolarHBondContact O-N 2.96Å; P229-C231 PolarHBondContact O-N 3.47Å; P229-C231 VanDerWaalsContact O-N 3.12Å; P229-C231 PolarHBondContact O-SG 2.95Å; P229-C231 VanDerWaalsContact O-SG 3.42Å
232	N	93.2	Very high	91	Very high	98 Å²	98	45.8 Å²	45.8	52%	0.524	25%	0.251	S	S	.	.			trans	-84.5	144.3	177.8	-69.4	-32.8	0	0	0	111.1	W226 S227 D230 V234	W226-N232 CarbonylContact C-O 3.48Å; W226-N232 VanDerWaalsContact CA-O 3.25Å; W226-N232 WeakPolarHBondContact CA-O 3.23Å; S227-N232 PolarHBondContact N-O 2.87Å; S227-N232 PolarHBondContact OG-N 3.44Å; S227-N232 PolarHBondContact OG-O 2.78Å; D230-N232 PolarHBondContact O-N 2.9Å; N232-V234 PolarHBondContact O-N 3.27Å
233	L	92.8	Very high	91	Very high	76 Å²	76	45.5 Å²	45.5	40%	0.398	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.1	175.1	-174.9	122.3	0	0	0	110.4	R224 W226 N236	R224-L233 HydrophobicContact CB-CD1 4.17Å; R224-L233 HydrophobicContact CG-CD1 4.05Å; W226-L233 HydrophobicContact CE3-CB 4.03Å; W226-L233 HydrophobicContact CE3-CD1 4.47Å; W226-L233 HydrophobicContact CH2-CB 4.43Å; W226-L233 HydrophobicContact CH2-CD1 3.79Å; W226-L233 HydrophobicContact CZ2-CD1 4.03Å; W226-L233 HydrophobicContact CZ3-CB 3.82Å; W226-L233 HydrophobicContact CZ3-CD1 4.03Å; L233-N236 WeakPolarHBondContact CD1-OD1 3.12Å; L233-N236 WeakPolarHBondContact CD2-ND2 3.47Å
234	V	91.8	Very high	91	Very high	67 Å²	67	45.5 Å²	45.5	41%	0.406	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-52.8	177.7	-177.5	0	0	0	0	110.1	L225 N232	L225-V234 HydrophobicContact CB-CB 4.38Å; L225-V234 PolarHBondContact O-N 2.8Å; N232-V234 PolarHBondContact O-N 3.27Å
235	M	90.7	Very high	90.8	Very high	23 Å²	23	43.9 Å²	43.9	11%	0.113	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	153.4	-176.9	-74.9	-175.7	-70.7	0	0	112.9	L225 L277	L225-M235 HydrophobicContact CB-CB 4.44Å; L225-M235 HydrophobicContact CD1-CB 4.27Å; L225-M235 HydrophobicContact CD1-CE 3.41Å; L225-M235 VanDerWaalsContact CD1-CE 3.41Å; L225-M235 PolarHBondContact N-O 2.92Å; L225-M235 PolarHBondContact O-N 3.39Å; M235-L277 HydrophobicContact CE-CB 4.12Å; M235-L277 HydrophobicContact CE-CD2 3.9Å; M235-L277 WeakPolarHBondContact CE-O 3.44Å
236	N	92.5	Very high	90.8	Very high	28 Å²	28	43.9 Å²	43.9	15%	0.15	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	105.9	170	-65.7	-64.7	0	0	0	109.6	R224 L233 R238	R224-N236 WeakPolarHBondContact CD-OD1 3.29Å; R224-N236 VanDerWaalsContact CG-OD1 3.29Å; R224-N236 WeakPolarHBondContact CG-OD1 3.22Å; R224-N236 PolarHBondContact NE-OD1 3.35Å; L233-N236 WeakPolarHBondContact CD1-OD1 3.12Å; L233-N236 WeakPolarHBondContact CD2-ND2 3.47Å; N236-R238 PolarHBondContact O-N 2.59Å
237	L	91.6	Very high	90.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	113.4	175.1	-56	174.9	0	0	0	109.1	C223 L225 I247 L263 W275	C223-L237 HydrophobicContact CB-CB 3.95Å; C223-L237 HydrophobicContact CB-CD1 4.05Å; C223-L237 HydrophobicContact CB-CG 4.48Å; C223-L237 PolarHBondContact N-O 2.99Å; C223-L237 WeakPolarHBondContact O-CA 3.43Å; C223-L237 WeakPolarHBondContact O-CB 3.39Å; C223-L237 PolarHBondContact O-N 3.49Å; L225-L237 HydrophobicContact CD1-CD1 4.31Å; L225-L237 HydrophobicContact CD1-CG 4.5Å; L225-L237 HydrophobicContact CG-CD1 4.38Å; L237-I247 HydrophobicContact CD1-CD1 4.49Å; L237-L263 HydrophobicContact CD1-CD1 3.86Å; L237-W275 HydrophobicContact CB-CD2 3.95Å; L237-W275 HydrophobicContact CB-CE3 3.69Å; L237-W275 HydrophobicContact CB-CH2 4.02Å; L237-W275 HydrophobicContact CB-CZ2 4.28Å; L237-W275 HydrophobicContact CB-CZ3 3.73Å; L237-W275 HydrophobicContact CD1-CB 4.14Å; L237-W275 HydrophobicContact CD1-CD2 3.98Å; L237-W275 HydrophobicContact CD1-CE3 4.37Å; L237-W275 HydrophobicContact CD1-CG 3.87Å; L237-W275 HydrophobicContact CD2-CB 4.31Å; L237-W275 HydrophobicContact CD2-CD2 4.2Å; L237-W275 HydrophobicContact CD2-CE3 3.81Å; L237-W275 HydrophobicContact CD2-CG 4.44Å; L237-W275 HydrophobicContact CD2-CZ3 4.49Å; L237-W275 HydrophobicContact CG-CD2 4.26Å; L237-W275 HydrophobicContact CG-CE3 4.15Å
238	R	91	Very high	90.8	Very high	148 Å²	148	42.8 Å²	42.8	56%	0.558	24%	0.24	S	C	*	.			trans	-112.3	120	-175.7	-63.8	179.1	-172.6	-175.5	4.5	109.2	L222 N236 E280	L222-R238 HydrophobicContact CD2-CB 4.49Å; L222-R238 HydrophobicContact CD2-CG 3.84Å; N236-R238 PolarHBondContact O-N 2.59Å; R238-E280 PolarHBondContact N-O 3.37Å
239	G	85.3	Confident	91.1	Very high	30 Å²	30	42.5 Å²	42.5	31%	0.309	24%	0.237	S	C	.	.			trans	-179.7	-30	176.6	0	0	0	0	0	115.2	K273	G239-K273 VanDerWaalsContact C-CE 3.4Å; G239-K273 WeakPolarHBondContact O-CE 3.38Å; G239-K273 PolarHBondContact O-NZ 3.26Å
240	H	89.7	Confident	91.5	Very high	13 Å²	13	40 Å²	40	6%	0.06	22%	0.22	C	C	.	.			trans	-78.6	132	174.5	-68.1	-74.8	0	0	0	111.4	T244 S265 A267 S271 K273	H240-T244 HydrophobicContact CB-CG2 3.83Å; H240-T244 WeakPolarHBondContact CD2-CG2 3.41Å; H240-S265 PolarHBondContact CD2-OG 2.99Å; H240-S265 PolarHBondContact NE2-OG 2.77Å; H240-A267 HydrophobicContact CB-CB 4.15Å; H240-A267 WeakPolarHBondContact ND1-CB 3.47Å; H240-S271 PolarHBondContact CE1-O 3.38Å; H240-S271 PolarHBondContact CE1-OG 3.29Å; H240-S271 PolarHBondContact ND1-OG 3.45Å; H240-K273 VanDerWaalsContact CE1-CG 3.4Å; H240-K273 WeakPolarHBondContact CE1-CG 3.49Å
241	T	88.5	Confident	91.4	Very high	133 Å²	133	36.4 Å²	36.4	82%	0.816	20%	0.203	S	C	*	.	S	Bend	trans	-85.9	-26.9	172.4	45.6	0	0	0	0	112.3	D269	T241-D269 PolarHBondContact OG1-OD2 3.38Å
242	A	91.3	Very high	91.2	Very high	16 Å²	16	38.9 Å²	38.9	13%	0.132	21%	0.214	C	C	.	.	S	Bend	trans	-99.1	163.5	179.3	0	0	0	0	0	111.6	G221 T244 A267 Q268 D269	G221-A242 WeakPolarHBondContact CA-O 3.28Å; A242-T244 PolarHBondContact O-N 3.09Å; A242-A267 HydrophobicContact CB-CB 4.31Å; A242-Q268 HydrophobicContact CB-CB 4.47Å; A242-D269 HydrophobicContact CB-CB 3.71Å; A242-D269 VanDerWaalsContact CB-CG 3.49Å; A242-D269 VanDerWaalsContact CB-OD2 3.27Å; A242-D269 WeakPolarHBondContact CB-OD2 3.27Å
243	P	93.1	Very high	90.3	Very high	38 Å²	38	34.4 Å²	34.4	25%	0.247	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-58.6	129.5	175.9	23.8	-35.2	0	0	0	111.6	W219 A267 Q268	W219-P243 HydrophobicContact CB-CB 3.83Å; W219-P243 HydrophobicContact CG-CB 4.14Å; W219-P243 WeakPolarHBondContact O-CB 3.45Å; P243-A267 WeakPolarHBondContact O-CA 3.29Å; P243-Q268 HydrophobicContact CG-CB 3.82Å; P243-Q268 PolarHBondContact O-N 2.67Å
244	T	93.2	Very high	89.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	138.5	178.1	61	0	0	0	0	111.3	S203 S217 S218 G221 H240 A242 S266	S203-T244 WeakPolarHBondContact CB-O 3.33Å; S203-T244 PolarHBondContact OG-O 3.26Å; S217-T244 WeakPolarHBondContact CB-OG1 3.3Å; S218-T244 PolarHBondContact N-OG1 3.14Å; S218-T244 PolarHBondContact O-N 2.64Å; S218-T244 PolarHBondContact O-OG1 2.96Å; G221-T244 WeakPolarHBondContact O-CG2 3.4Å; H240-T244 HydrophobicContact CB-CG2 3.83Å; H240-T244 WeakPolarHBondContact CD2-CG2 3.41Å; A242-T244 PolarHBondContact O-N 3.09Å; T244-S266 CarbonylContact C-O 3.54Å; T244-S266 WeakPolarHBondContact CA-O 3.5Å
245	C	92	Very high	88.5	Confident	6 Å²	6	35.3 Å²	35.3	4%	0.041	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-48	-178	-66.1	0	0	0	0	111.8	S203 S266 R293 V294 S295 R296	S203-C245 WeakPolarHBondContact CB-O 3.47Å; S203-C245 PolarHBondContact OG-O 2.85Å; C245-S266 PolarHBondContact N-O 2.92Å; C245-R293 PolarHBondContact SG-NE 3.04Å; C245-R293 PolarHBondContact SG-NH2 3.1Å; C245-V294 WeakPolarHBondContact CB-O 3.27Å; C245-S295 VanDerWaalsContact CB-O 3.3Å; C245-S295 WeakPolarHBondContact CB-O 3.04Å; C245-R296 PolarHBondContact O-NH1 3.42Å
246	A	92.9	Very high	87.6	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	154.9	-176.1	0	0	0	0	0	112.7	M204 S265 S266	M204-A246 HydrophobicContact CE-CB 4.47Å; M204-A246 WeakPolarHBondContact SD-CA 3.44Å; M204-A246 HydrophobicContact SD-CB 3.5Å; M204-A246 WeakPolarHBondContact SD-CB 3.47Å; A246-S265 CarbonylContact O-C 3.54Å; A246-S265 WeakPolarHBondContact O-CA 3.29Å; A246-S265 WeakPolarHBondContact O-CB 3.43Å; A246-S266 WeakPolarHBondContact CB-OG 3.02Å; A246-S266 PolarHBondContact N-OG 2.91Å; A246-S266 PolarHBondContact O-N 2.87Å
247	I	94.2	Very high	86.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	126.1	170.5	-176.1	153.1	0	0	0	110	M204 A215 C223 L237 L263 A264	M204-I247 HydrophobicContact CB-CG2 4.39Å; M204-I247 WeakPolarHBondContact CE-O 3.4Å; M204-I247 PolarHBondContact SD-N 2.96Å; M204-I247 VanDerWaalsContact SD-N 3.42Å; A215-I247 HydrophobicContact CB-CD1 3.68Å; A215-I247 HydrophobicContact CB-CG1 3.86Å; A215-I247 HydrophobicContact CB-CG2 4.17Å; C223-I247 HydrophobicContact CB-CD1 3.65Å; L237-I247 HydrophobicContact CD1-CD1 4.49Å; I247-L263 HydrophobicContact CD1-CD2 4.2Å; I247-L263 HydrophobicContact CG1-CD2 3.93Å; I247-A264 CarbonylContact C-O 3.59Å; I247-A264 WeakPolarHBondContact CA-O 3.25Å
248	V	94.4	Very high	84.8	Confident	16 Å²	16	52.7 Å²	52.7	10%	0.097	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	139.4	-176.5	-168.8	0	0	0	0	109.5	M204 L263 A264 L297 F299	M204-V248 HydrophobicContact CE-CG2 3.97Å; V248-L263 CarbonylContact O-C 3.57Å; V248-L263 WeakPolarHBondContact O-CA 3.32Å; V248-A264 PolarHBondContact N-O 3.29Å; V248-A264 PolarHBondContact O-N 2.84Å; V248-L297 HydrophobicContact CG2-CB 3.77Å; V248-L297 VanDerWaalsContact CG2-O 3.23Å; V248-L297 WeakPolarHBondContact CG2-O 3.32Å; V248-F299 HydrophobicContact CB-CD2 4.04Å; V248-F299 HydrophobicContact CB-CE2 4.22Å; V248-F299 HydrophobicContact CG1-CD2 3.7Å; V248-F299 HydrophobicContact CG1-CE2 4.36Å
249	W	94.1	Very high	83.7	Confident	14 Å²	14	48.6 Å²	48.6	5%	0.053	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	140.3	171.8	-69.8	92.2	0	0	0	111.7	R206 F207 P209 Q213 A215 L225 A253 A262 L263 L277 F299	R206-W249 PolarHBondContact O-NE1 2.72Å; F207-W249 VanDerWaalsContact C-CD1 3.44Å; P209-W249 HydrophobicContact CG-CB 4.37Å; Q213-W249 HydrophobicContact CB-CH2 4.01Å; Q213-W249 HydrophobicContact CB-CZ2 3.98Å; A215-W249 HydrophobicContact CB-CZ2 3.84Å; L225-W249 HydrophobicContact CD2-CH2 3.81Å; L225-W249 HydrophobicContact CD2-CZ2 3.59Å; W249-A253 HydrophobicContact CE3-CB 3.74Å; W249-A253 HydrophobicContact CZ3-CB 4.27Å; W249-A262 HydrophobicContact CZ3-CB 4.49Å; W249-L263 HydrophobicContact CB-CD2 4.37Å; W249-L263 HydrophobicContact CD2-CD2 3.3Å; W249-L263 HydrophobicContact CD2-CG 4.02Å; W249-L263 HydrophobicContact CE3-CD1 4.4Å; W249-L263 HydrophobicContact CE3-CD2 3.6Å; W249-L263 HydrophobicContact CE3-CG 3.77Å; W249-L263 HydrophobicContact CG-CD2 3.66Å; W249-L263 HydrophobicContact CH2-CD1 4.03Å; W249-L263 HydrophobicContact CH2-CD2 4.24Å; W249-L263 HydrophobicContact CH2-CG 4.29Å; W249-L263 HydrophobicContact CZ2-CD1 4.36Å; W249-L263 HydrophobicContact CZ2-CD2 4Å; W249-L263 HydrophobicContact CZ3-CD1 4.07Å; W249-L263 HydrophobicContact CZ3-CD2 4.07Å; W249-L263 HydrophobicContact CZ3-CG 3.92Å; W249-L277 HydrophobicContact CH2-CD2 3.94Å; W249-L277 HydrophobicContact CZ3-CD1 4.4Å; W249-L277 HydrophobicContact CZ3-CD2 3.86Å; W249-F299 VanDerWaalsContact O-CD2 3.32Å; W249-F299 WeakPolarHBondContact O-CD2 3.34Å
250	H	92.4	Very high	83.2	Confident	11 Å²	11	53.7 Å²	53.7	5%	0.051	30%	0.301	C	S	.	.			trans	-60.9	135.5	164.2	-174.7	-101	0	0	0	108.7	P209 Q252 A253 Q259 A262 F299 G303	P209-H250 VanDerWaalsContact CG-O 3.25Å; P209-H250 WeakPolarHBondContact CG-O 3.46Å; H250-Q252 PolarHBondContact ND1-N 2.91Å; H250-Q252 PolarHBondContact O-N 3.44Å; H250-A253 HydrophobicContact CB-CB 4.15Å; H250-A253 VanDerWaalsContact O-CB 3.24Å; H250-A253 WeakPolarHBondContact O-CB 3.2Å; H250-A253 PolarHBondContact O-N 3.26Å; H250-Q259 PolarHBondContact CE1-OE1 2.83Å; H250-Q259 PolarHBondContact ND1-OE1 2.78Å; H250-A262 WeakPolarHBondContact CB-O 3.19Å; H250-A262 PolarHBondContact N-O 2.9Å; H250-F299 HydrophobicContact CB-CZ 4.42Å; H250-F299 AromaticContact CD2-CD1 3.94Å; H250-F299 AromaticContact CD2-CE1 3.89Å; H250-G303 WeakPolarHBondContact NE2-CA 3.47Å; H250-G303 PolarHBondContact NE2-O 3.35Å
251	P	86.4	Confident	82.8	Confident	42 Å²	42	54.5 Å²	54.5	27%	0.273	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19	-172.6	24	-35.7	0	0	0	114.2
252	Q	83.5	Confident	82.7	Confident	58 Å²	58	48.3 Å²	48.3	27%	0.271	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	0.8	178.3	-67.9	170.3	-17.5	0	0	113.1	H250 G254 L255 Q256	H250-Q252 PolarHBondContact ND1-N 2.91Å; H250-Q252 PolarHBondContact O-N 3.44Å; Q252-G254 PolarHBondContact O-N 3.44Å; Q252-L255 PolarHBondContact O-N 3.31Å; Q252-L255 VanDerWaalsContact O-N 3.08Å; Q252-Q256 PolarHBondContact O-N 2.86Å
253	A	75.9	Confident	82.7	Confident	3 Å²	3	47.6 Å²	47.6	3%	0.025	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	128.9	176.5	0	0	0	0	0	110.9	P209 W249 H250 L255 A262	P209-A253 WeakPolarHBondContact CD-O 3.43Å; P209-A253 HydrophobicContact CG-CB 4.37Å; P209-A253 WeakPolarHBondContact CG-O 3.39Å; W249-A253 HydrophobicContact CE3-CB 3.74Å; W249-A253 HydrophobicContact CZ3-CB 4.27Å; H250-A253 HydrophobicContact CB-CB 4.15Å; H250-A253 VanDerWaalsContact O-CB 3.24Å; H250-A253 WeakPolarHBondContact O-CB 3.2Å; H250-A253 PolarHBondContact O-N 3.26Å; A253-L255 PolarHBondContact O-N 3.05Å; A253-A262 HydrophobicContact CB-CB 4.19Å
254	G	70	Confident	82.7	Confident	44 Å²	44	45.8 Å²	45.8	45%	0.454	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-14.7	-178.5	0	0	0	0	0	115.4	Q252	Q252-G254 PolarHBondContact O-N 3.44Å
255	L	75.8	Confident	82.8	Confident	119 Å²	119	45.8 Å²	45.8	62%	0.623	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-35.7	174.5	-65.5	173	0	0	0	111.9	P209 Q252 A253	P209-L255 HydrophobicContact CB-CD1 4.43Å; Q252-L255 PolarHBondContact O-N 3.31Å; Q252-L255 VanDerWaalsContact O-N 3.08Å; A253-L255 PolarHBondContact O-N 3.05Å
256	Q	72.8	Confident	82.9	Confident	99 Å²	99	45.5 Å²	45.5	46%	0.463	25%	0.248	S	C	.	.			trans	-115.9	116.6	176.2	-67.3	-177.4	-8.6	0	0	109.1	Q252 E258 Q259	Q252-Q256 PolarHBondContact O-N 2.86Å; Q256-E258 PolarHBondContact O-N 2.86Å; Q256-Q259 HydrophobicContact CB-CG 4.23Å; Q256-Q259 VanDerWaalsContact OE1-NE2 3.15Å
257	S	62.8	Low	82.9	Confident	129 Å²	129	45.5 Å²	45.5	90%	0.902	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.6	-178.7	-170.7	0	0	0	0	113.6
258	E	62	Low	82.8	Confident	187 Å²	187	50.2 Å²	50.2	87%	0.874	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-11.1	-173.6	-63.8	-176.9	170.5	0	0	113.4	Q256 Q260	Q256-E258 PolarHBondContact O-N 2.86Å; E258-Q260 PolarHBondContact O-N 2.77Å
259	Q	68	Low	82.6	Confident	63 Å²	63	51.8 Å²	51.8	29%	0.294	28%	0.278	S	S	.	.			trans	-83.2	113.1	-176.4	-69.8	-168.2	-19.7	0	0	111.6	H250 Q256 L261	H250-Q259 PolarHBondContact CE1-OE1 2.83Å; H250-Q259 PolarHBondContact ND1-OE1 2.78Å; Q256-Q259 HydrophobicContact CB-CG 4.23Å; Q256-Q259 VanDerWaalsContact OE1-NE2 3.15Å; Q259-L261 VanDerWaalsContact C-N 3.32Å
260	Q	74.3	Confident	82.4	Confident	137 Å²	137	51.3 Å²	51.3	64%	0.64	28%	0.277	S	S	*	.	S	Bend	trans	-67	-33.5	174.9	-66.8	-176.2	-20.1	0	0	112.2	E258 S276	E258-Q260 PolarHBondContact O-N 2.77Å; Q260-S276 WeakPolarHBondContact O-CA 3.49Å; Q260-S276 WeakPolarHBondContact O-CB 3.13Å
261	L	81.6	Confident	82.4	Confident	30 Å²	30	51.9 Å²	51.9	16%	0.157	28%	0.282	C	S	.	.			trans	-84.5	117.1	178.7	-177.9	66.1	0	0	0	110.9	Q259 L274 F299 L320	Q259-L261 VanDerWaalsContact C-N 3.32Å; L261-L274 HydrophobicContact CD1-CB 3.62Å; L261-L274 HydrophobicContact CD1-CD1 4.19Å; L261-L274 HydrophobicContact CD1-CD2 4.11Å; L261-L274 HydrophobicContact CD1-CG 4.18Å; L261-F299 HydrophobicContact CD2-CE1 4.17Å; L261-F299 HydrophobicContact CD2-CZ 4.47Å; L261-L320 HydrophobicContact CD2-CD1 3.73Å
262	A	85.8	Confident	82.7	Confident	3 Å²	3	49.9 Å²	49.9	3%	0.025	27%	0.269	C	S	.	.			trans	-116.3	-32.2	-179.4	0	0	0	0	0	113.7	W249 H250 A253 W275 L277	W249-A262 HydrophobicContact CZ3-CB 4.49Å; H250-A262 WeakPolarHBondContact CB-O 3.19Å; H250-A262 PolarHBondContact N-O 2.9Å; A253-A262 HydrophobicContact CB-CB 4.19Å; A262-W275 PolarHBondContact N-O 2.99Å; A262-L277 HydrophobicContact CB-CD1 3.97Å; A262-L277 HydrophobicContact CB-CD2 4.05Å; A262-L277 HydrophobicContact CB-CG 3.5Å; A262-L277 VanDerWaalsContact CB-CG 3.5Å
263	L	91.1	Very high	83.2	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154.1	-169.1	-73.3	157.3	0	0	0	111.3	A215 L225 L237 I247 V248 W249 W275 L277	A215-L263 HydrophobicContact CB-CD2 4.02Å; L225-L263 HydrophobicContact CD1-CD1 3.88Å; L225-L263 HydrophobicContact CD2-CD1 3.6Å; L225-L263 HydrophobicContact CG-CD1 4.29Å; L237-L263 HydrophobicContact CD1-CD1 3.86Å; I247-L263 HydrophobicContact CD1-CD2 4.2Å; I247-L263 HydrophobicContact CG1-CD2 3.93Å; V248-L263 CarbonylContact O-C 3.57Å; V248-L263 WeakPolarHBondContact O-CA 3.32Å; W249-L263 HydrophobicContact CB-CD2 4.37Å; W249-L263 HydrophobicContact CD2-CD2 3.3Å; W249-L263 HydrophobicContact CD2-CG 4.02Å; W249-L263 HydrophobicContact CE3-CD1 4.4Å; W249-L263 HydrophobicContact CE3-CD2 3.6Å; W249-L263 HydrophobicContact CE3-CG 3.77Å; W249-L263 HydrophobicContact CG-CD2 3.66Å; W249-L263 HydrophobicContact CH2-CD1 4.03Å; W249-L263 HydrophobicContact CH2-CD2 4.24Å; W249-L263 HydrophobicContact CH2-CG 4.29Å; W249-L263 HydrophobicContact CZ2-CD1 4.36Å; W249-L263 HydrophobicContact CZ2-CD2 4Å; W249-L263 HydrophobicContact CZ3-CD1 4.07Å; W249-L263 HydrophobicContact CZ3-CD2 4.07Å; W249-L263 HydrophobicContact CZ3-CG 3.92Å; L263-W275 HydrophobicContact CB-CB 4.06Å; L263-W275 HydrophobicContact CB-CG 4.48Å; L263-W275 PolarHBondContact N-O 3.34Å; L263-W275 PolarHBondContact O-N 2.91Å; L263-L277 HydrophobicContact CD1-CD2 4.38Å
264	A	93.4	Very high	84	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.9	163.9	0	0	0	0	0	110.1	I247 V248 K273 L274 L297 F299 L306	I247-A264 CarbonylContact C-O 3.59Å; I247-A264 WeakPolarHBondContact CA-O 3.25Å; V248-A264 PolarHBondContact N-O 3.29Å; V248-A264 PolarHBondContact O-N 2.84Å; A264-K273 CarbonylContact C-O 3.58Å; A264-K273 VanDerWaalsContact CA-O 3.27Å; A264-K273 WeakPolarHBondContact CA-O 3.27Å; A264-L274 HydrophobicContact CB-CD2 3.72Å; A264-L297 HydrophobicContact CB-CD1 4.01Å; A264-F299 HydrophobicContact CB-CE2 3.61Å; A264-F299 HydrophobicContact CB-CZ 3.54Å; A264-L306 HydrophobicContact CB-CD1 3.53Å
265	S	94.7	Very high	85.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.3	174	60.2	0	0	0	0	111.8	H240 A246 V272 K273 W275 L297	H240-S265 PolarHBondContact CD2-OG 2.99Å; H240-S265 PolarHBondContact NE2-OG 2.77Å; A246-S265 CarbonylContact O-C 3.54Å; A246-S265 WeakPolarHBondContact O-CA 3.29Å; A246-S265 WeakPolarHBondContact O-CB 3.43Å; S265-V272 CarbonylContact O-C 3.52Å; S265-V272 VanDerWaalsContact O-CA 3.28Å; S265-V272 WeakPolarHBondContact O-CA 3.33Å; S265-K273 PolarHBondContact N-O 3.22Å; S265-K273 PolarHBondContact O-N 3.24Å; S265-W275 PolarHBondContact OG-NE1 2.95Å; S265-L297 VanDerWaalsContact C-CD1 3.42Å
266	S	94.1	Very high	85.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	151.8	175.5	65	0	0	0	0	111.2	T244 C245 A246 V294	T244-S266 CarbonylContact C-O 3.54Å; T244-S266 WeakPolarHBondContact CA-O 3.5Å; C245-S266 PolarHBondContact N-O 2.92Å; A246-S266 WeakPolarHBondContact CB-OG 3.02Å; A246-S266 PolarHBondContact N-OG 2.91Å; A246-S266 PolarHBondContact O-N 2.87Å; S266-V294 PolarHBondContact OG-O 2.92Å
267	A	93.7	Very high	86.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	170.7	174.8	0	0	0	0	0	113.5	H240 A242 P243 D269 G270 S271 V294	H240-A267 HydrophobicContact CB-CB 4.15Å; H240-A267 WeakPolarHBondContact ND1-CB 3.47Å; A242-A267 HydrophobicContact CB-CB 4.31Å; P243-A267 WeakPolarHBondContact O-CA 3.29Å; A267-D269 VanDerWaalsContact C-N 3.26Å; A267-D269 VanDerWaalsContact CB-OD1 3.27Å; A267-D269 WeakPolarHBondContact CB-OD1 3.4Å; A267-D269 PolarHBondContact O-N 2.85Å; A267-G270 PolarHBondContact O-N 3.49Å; A267-S271 PolarHBondContact N-O 2.79Å; A267-V294 PolarHBondContact O-N 2.93Å
268	Q	92.3	Very high	87.5	Confident	99 Å²	99	39.1 Å²	39.1	46%	0.463	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-20.8	-177.8	-178.1	166.9	-1.3	0	0	114.1	A242 P243 G270 R293	A242-Q268 HydrophobicContact CB-CB 4.47Å; P243-Q268 HydrophobicContact CG-CB 3.82Å; P243-Q268 PolarHBondContact O-N 2.67Å; Q268-G270 PolarHBondContact O-N 3.3Å; Q268-R293 HydrophobicContact CB-CG 4.46Å; Q268-R293 HydrophobicContact CG-CB 4.29Å; Q268-R293 HydrophobicContact CG-CG 4.27Å; Q268-R293 WeakPolarHBondContact O-CA 3.38Å
269	D	90.7	Very high	88.6	Confident	50 Å²	50	34.8 Å²	34.8	27%	0.267	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5	174.7	52.8	12.8	0	0	0	113.6	T241 A242 A267 S271	T241-D269 PolarHBondContact OG1-OD2 3.38Å; A242-D269 HydrophobicContact CB-CB 3.71Å; A242-D269 VanDerWaalsContact CB-CG 3.49Å; A242-D269 VanDerWaalsContact CB-OD2 3.27Å; A242-D269 WeakPolarHBondContact CB-OD2 3.27Å; A267-D269 VanDerWaalsContact C-N 3.26Å; A267-D269 VanDerWaalsContact CB-OD1 3.27Å; A267-D269 WeakPolarHBondContact CB-OD1 3.4Å; A267-D269 PolarHBondContact O-N 2.85Å; D269-S271 VanDerWaalsContact C-N 3.33Å; D269-S271 VanDerWaalsContact CG-OG 3.28Å; D269-S271 VanDerWaalsContact OD1-CB 3.29Å; D269-S271 WeakPolarHBondContact OD1-CB 3.45Å; D269-S271 PolarHBondContact OD1-N 3.44Å; D269-S271 PolarHBondContact OD1-OG 3.45Å; D269-S271 PolarHBondContact OD2-OG 3.36Å
270	G	89.4	Confident	89.6	Confident	3 Å²	3	35.9 Å²	35.9	3%	0.031	18%	0.183	C	C	.	.	S	Bend	trans	88.3	-0.9	-174.9	0	0	0	0	0	113.5	A267 Q268 H289 H292	A267-G270 PolarHBondContact O-N 3.49Å; Q268-G270 PolarHBondContact O-N 3.3Å; G270-H289 WeakPolarHBondContact O-CB 3.34Å; G270-H289 PolarHBondContact O-CD2 2.91Å; G270-H292 WeakPolarHBondContact CA-O 3.41Å
271	S	91.8	Very high	90.3	Very high	24 Å²	24	36.5 Å²	36.5	17%	0.168	19%	0.186	C	C	.	.			trans	-71.9	133.8	174.9	65.3	0	0	0	0	110.8	H240 A267 D269	H240-S271 PolarHBondContact CE1-O 3.38Å; H240-S271 PolarHBondContact CE1-OG 3.29Å; H240-S271 PolarHBondContact ND1-OG 3.45Å; A267-S271 PolarHBondContact N-O 2.79Å; D269-S271 VanDerWaalsContact C-N 3.33Å; D269-S271 VanDerWaalsContact CG-OG 3.28Å; D269-S271 VanDerWaalsContact OD1-CB 3.29Å; D269-S271 WeakPolarHBondContact OD1-CB 3.45Å; D269-S271 PolarHBondContact OD1-N 3.44Å; D269-S271 PolarHBondContact OD1-OG 3.45Å; D269-S271 PolarHBondContact OD2-OG 3.36Å
272	V	93.7	Very high	90.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	120.5	168.2	175.6	0	0	0	0	107.3	S265 I286 V294 L297 L306 T308	S265-V272 CarbonylContact O-C 3.52Å; S265-V272 VanDerWaalsContact O-CA 3.28Å; S265-V272 WeakPolarHBondContact O-CA 3.33Å; V272-I286 HydrophobicContact CB-CB 4.13Å; V272-I286 HydrophobicContact CG1-CD1 4.11Å; V272-I286 PolarHBondContact O-N 3.49Å; V272-V294 HydrophobicContact CG2-CB 4.33Å; V272-V294 HydrophobicContact CG2-CG1 3.95Å; V272-V294 HydrophobicContact CG2-CG2 4.17Å; V272-L297 HydrophobicContact CG1-CD1 3.96Å; V272-L297 HydrophobicContact CG1-CD2 4.04Å; V272-L297 HydrophobicContact CG2-CD2 3.97Å; V272-L306 HydrophobicContact CG1-CD2 4.43Å; V272-T308 HydrophobicContact CG1-CG2 4.5Å; V272-T308 HydrophobicContact CG2-CG2 4.01Å
273	K	93.5	Very high	90.9	Very high	17 Å²	17	40.8 Å²	40.8	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.5	-175.7	-63.1	-172.7	171.3	-95.5	0	110.3	G239 H240 A264 S265 W275 P282 D285	G239-K273 VanDerWaalsContact C-CE 3.4Å; G239-K273 WeakPolarHBondContact O-CE 3.38Å; G239-K273 PolarHBondContact O-NZ 3.26Å; H240-K273 VanDerWaalsContact CE1-CG 3.4Å; H240-K273 WeakPolarHBondContact CE1-CG 3.49Å; A264-K273 CarbonylContact C-O 3.58Å; A264-K273 VanDerWaalsContact CA-O 3.27Å; A264-K273 WeakPolarHBondContact CA-O 3.27Å; S265-K273 PolarHBondContact N-O 3.22Å; S265-K273 PolarHBondContact O-N 3.24Å; K273-W275 HydrophobicContact CB-CZ2 3.8Å; K273-W275 HydrophobicContact CD-CH2 4.2Å; K273-W275 HydrophobicContact CD-CZ2 3.83Å; K273-W275 HydrophobicContact CG-CZ2 4.44Å; K273-W275 PolarHBondContact O-NE1 3.1Å; K273-P282 HydrophobicContact CB-CB 4.16Å; K273-P282 HydrophobicContact CD-CB 4.19Å; K273-P282 HydrophobicContact CD-CG 4.31Å; K273-P282 HydrophobicContact CG-CB 4.47Å; K273-D285 VanDerWaalsContact CG-OD1 3.28Å; K273-D285 WeakPolarHBondContact CG-OD1 3.47Å; K273-D285 IonicContact NZ-OD1 3.27Å; K273-D285 PolarHBondContact NZ-OD1 3.12Å; K273-D285 IonicContact NZ-OD2 3.89Å; K273-D285 PolarHBondContact NZ-OD2 3.36Å
274	L	93.3	Very high	90.8	Very high	16 Å²	16	42.8 Å²	42.8	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	138.2	174.1	-62.1	-173.1	0	0	0	109.3	L261 A264 P282 L283 A284 I286 L306 L320	L261-L274 HydrophobicContact CD1-CB 3.62Å; L261-L274 HydrophobicContact CD1-CD1 4.19Å; L261-L274 HydrophobicContact CD1-CD2 4.11Å; L261-L274 HydrophobicContact CD1-CG 4.18Å; A264-L274 HydrophobicContact CB-CD2 3.72Å; L274-P282 CarbonylContact O-C 3.55Å; L274-P282 WeakPolarHBondContact O-CA 3.49Å; L274-L283 PolarHBondContact O-N 2.98Å; L274-A284 HydrophobicContact CB-CB 4.49Å; L274-A284 HydrophobicContact CD1-CB 4.37Å; L274-A284 PolarHBondContact N-O 3.08Å; L274-I286 HydrophobicContact CD1-CD1 4.34Å; L274-I286 HydrophobicContact CD2-CD1 4.21Å; L274-I286 HydrophobicContact CG-CD1 4.29Å; L274-L306 HydrophobicContact CD2-CD1 3.77Å; L274-L320 HydrophobicContact CD1-CD2 3.83Å; L274-L320 HydrophobicContact CD2-CD2 4.38Å
275	W	92.4	Very high	90.7	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.8	-176.2	-46.8	83.8	0	0	0	112.6	L237 A262 L263 S265 K273 E280 P282	L237-W275 HydrophobicContact CB-CD2 3.95Å; L237-W275 HydrophobicContact CB-CE3 3.69Å; L237-W275 HydrophobicContact CB-CH2 4.02Å; L237-W275 HydrophobicContact CB-CZ2 4.28Å; L237-W275 HydrophobicContact CB-CZ3 3.73Å; L237-W275 HydrophobicContact CD1-CB 4.14Å; L237-W275 HydrophobicContact CD1-CD2 3.98Å; L237-W275 HydrophobicContact CD1-CE3 4.37Å; L237-W275 HydrophobicContact CD1-CG 3.87Å; L237-W275 HydrophobicContact CD2-CB 4.31Å; L237-W275 HydrophobicContact CD2-CD2 4.2Å; L237-W275 HydrophobicContact CD2-CE3 3.81Å; L237-W275 HydrophobicContact CD2-CG 4.44Å; L237-W275 HydrophobicContact CD2-CZ3 4.49Å; L237-W275 HydrophobicContact CG-CD2 4.26Å; L237-W275 HydrophobicContact CG-CE3 4.15Å; A262-W275 PolarHBondContact N-O 2.99Å; L263-W275 HydrophobicContact CB-CB 4.06Å; L263-W275 HydrophobicContact CB-CG 4.48Å; L263-W275 PolarHBondContact N-O 3.34Å; L263-W275 PolarHBondContact O-N 2.91Å; S265-W275 PolarHBondContact OG-NE1 2.95Å; K273-W275 HydrophobicContact CB-CZ2 3.8Å; K273-W275 HydrophobicContact CD-CH2 4.2Å; K273-W275 HydrophobicContact CD-CZ2 3.83Å; K273-W275 HydrophobicContact CG-CZ2 4.44Å; K273-W275 PolarHBondContact O-NE1 3.1Å; W275-E280 WeakPolarHBondContact CZ3-O 3.44Å; W275-P282 HydrophobicContact CD2-CB 4.37Å; W275-P282 HydrophobicContact CE3-CB 4.01Å; W275-P282 HydrophobicContact CH2-CB 4.04Å; W275-P282 HydrophobicContact CH2-CG 4.37Å; W275-P282 HydrophobicContact CZ2-CB 4.38Å; W275-P282 HydrophobicContact CZ3-CB 3.84Å; W275-P282 HydrophobicContact CZ3-CG 4.25Å; W275-P282 VanDerWaalsContact CZ3-N 3.29Å
276	S	90.3	Very high	90.4	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.028	25%	0.251	C	S	.	.			trans	-100.1	165.6	167.3	71.1	0	0	0	0	110.9	Q260 D278 N279	Q260-S276 WeakPolarHBondContact O-CA 3.49Å; Q260-S276 WeakPolarHBondContact O-CB 3.13Å; S276-D278 VanDerWaalsContact C-N 3.35Å; S276-N279 PolarHBondContact OG-N 3.02Å
277	L	86.3	Confident	89.9	Confident	49 Å²	49	55.2 Å²	55.2	26%	0.257	29%	0.288	S	S	.	.	S	Bend	trans	-87.1	-5.8	172.7	-67.8	173.4	0	0	0	113.4	L225 M235 W249 A262 L263	L225-L277 HydrophobicContact CD1-CD2 3.75Å; M235-L277 HydrophobicContact CE-CB 4.12Å; M235-L277 HydrophobicContact CE-CD2 3.9Å; M235-L277 WeakPolarHBondContact CE-O 3.44Å; W249-L277 HydrophobicContact CH2-CD2 3.94Å; W249-L277 HydrophobicContact CZ3-CD1 4.4Å; W249-L277 HydrophobicContact CZ3-CD2 3.86Å; A262-L277 HydrophobicContact CB-CD1 3.97Å; A262-L277 HydrophobicContact CB-CD2 4.05Å; A262-L277 HydrophobicContact CB-CG 3.5Å; A262-L277 VanDerWaalsContact CB-CG 3.5Å; L263-L277 HydrophobicContact CD1-CD2 4.38Å
278	D	84.8	Confident	89.3	Confident	138 Å²	138	57.4 Å²	57.4	74%	0.738	31%	0.311	S	S	*	.	S	Bend	trans	-99.4	-28.9	-176.3	-58.7	-36.1	0	0	0	111.8	S276	S276-D278 VanDerWaalsContact C-N 3.35Å
279	N	86.3	Confident	88.8	Confident	96 Å²	96	52.8 Å²	52.8	51%	0.513	29%	0.289	S	S	.	.			trans	-113.4	139.2	-176.4	-60.8	-31.5	0	0	0	111.7	S276 E281	S276-N279 PolarHBondContact OG-N 3.02Å; N279-E281 VanDerWaalsContact C-N 3.26Å
280	E	88.5	Confident	88.3	Confident	86 Å²	86	54.1 Å²	54.1	40%	0.402	31%	0.307	S	S	.	.	S	Bend	trans	-75.5	-16	171.3	-65.1	-163.8	150.8	0	0	113.1	R238 W275	R238-E280 PolarHBondContact N-O 3.37Å; W275-E280 WeakPolarHBondContact CZ3-O 3.44Å
281	E	89.7	Confident	88	Confident	150 Å²	150	59.2 Å²	59.2	70%	0.701	34%	0.34	S	S	*	.	S	Bend	trans	-89.9	150.6	177.6	-66.8	-175.6	171.4	0	0	111.2	N279	N279-E281 VanDerWaalsContact C-N 3.26Å
282	P	90.2	Very high	88	Confident	38 Å²	38	62 Å²	62	25%	0.247	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	141.7	177.8	29.5	-34.7	0	0	0	110.5	K273 L274 W275	K273-P282 HydrophobicContact CB-CB 4.16Å; K273-P282 HydrophobicContact CD-CB 4.19Å; K273-P282 HydrophobicContact CD-CG 4.31Å; K273-P282 HydrophobicContact CG-CB 4.47Å; L274-P282 CarbonylContact O-C 3.55Å; L274-P282 WeakPolarHBondContact O-CA 3.49Å; W275-P282 HydrophobicContact CD2-CB 4.37Å; W275-P282 HydrophobicContact CE3-CB 4.01Å; W275-P282 HydrophobicContact CH2-CB 4.04Å; W275-P282 HydrophobicContact CH2-CG 4.37Å; W275-P282 HydrophobicContact CZ2-CB 4.38Å; W275-P282 HydrophobicContact CZ3-CB 3.84Å; W275-P282 HydrophobicContact CZ3-CG 4.25Å; W275-P282 VanDerWaalsContact CZ3-N 3.29Å
283	L	89.2	Confident	87.9	Confident	85 Å²	85	65.6 Å²	65.6	45%	0.445	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	-44.3	175.5	-178.1	69.6	0	0	0	110.9	L274	L274-L283 PolarHBondContact O-N 2.98Å
284	A	89	Confident	87.9	Confident	43 Å²	43	64.8 Å²	64.8	36%	0.355	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	150.4	179.9	0	0	0	0	0	110.3	L274	L274-A284 HydrophobicContact CB-CB 4.49Å; L274-A284 HydrophobicContact CD1-CB 4.37Å; L274-A284 PolarHBondContact N-O 3.08Å
285	D	90.7	Very high	87.9	Confident	76 Å²	76	64.2 Å²	64.2	41%	0.406	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.8	172.7	-69.2	-5.3	0	0	0	108.1	K273	K273-D285 VanDerWaalsContact CG-OD1 3.28Å; K273-D285 WeakPolarHBondContact CG-OD1 3.47Å; K273-D285 IonicContact NZ-OD1 3.27Å; K273-D285 PolarHBondContact NZ-OD1 3.12Å; K273-D285 IonicContact NZ-OD2 3.89Å; K273-D285 PolarHBondContact NZ-OD2 3.36Å
286	I	89.6	Confident	88	Confident	19 Å²	19	64.4 Å²	64.4	10%	0.097	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	109.7	172.5	-60.3	174.1	0	0	0	107.1	V272 L274 L306 W318 L320	V272-I286 HydrophobicContact CB-CB 4.13Å; V272-I286 HydrophobicContact CG1-CD1 4.11Å; V272-I286 PolarHBondContact O-N 3.49Å; L274-I286 HydrophobicContact CD1-CD1 4.34Å; L274-I286 HydrophobicContact CD2-CD1 4.21Å; L274-I286 HydrophobicContact CG-CD1 4.29Å; I286-L306 HydrophobicContact CD1-CD1 4.49Å; I286-W318 HydrophobicContact CG2-CD2 3.57Å; I286-W318 VanDerWaalsContact CG2-CE2 3.43Å; I286-W318 HydrophobicContact CG2-CE3 3.66Å; I286-W318 HydrophobicContact CG2-CG 4.33Å; I286-W318 HydrophobicContact CG2-CH2 3.53Å; I286-W318 HydrophobicContact CG2-CZ2 3.43Å; I286-W318 VanDerWaalsContact CG2-CZ2 3.43Å; I286-W318 HydrophobicContact CG2-CZ3 3.64Å; I286-L320 HydrophobicContact CD1-CD2 4.44Å
287	E	82.9	Confident	88.2	Confident	166 Å²	166	64.6 Å²	64.6	78%	0.776	36%	0.358	S	S	*	.			trans	-95.4	143.3	176	-61.9	-175.6	176.8	0	0	110.3	W318	E287-W318 WeakPolarHBondContact O-CH2 3.47Å
288	G	80.4	Confident	88.6	Confident	46 Å²	46	62.8 Å²	62.8	47%	0.474	35%	0.351	S	S	.	.	S	Bend	trans	151.5	-16.7	177.7	0	0	0	0	0	115
289	H	82.2	Confident	89.1	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.009	32%	0.32	C	S	.	.			trans	-98.1	-10.2	-176	-53.2	-72.7	0	0	0	114.9	G270 H292 V294 T308 R316 W318	G270-H289 WeakPolarHBondContact O-CB 3.34Å; G270-H289 PolarHBondContact O-CD2 2.91Å; H289-H292 WeakPolarHBondContact O-CA 3.28Å; H289-H292 PolarHBondContact O-N 3.44Å; H289-V294 HydrophobicContact CB-CG2 3.66Å; H289-T308 PolarHBondContact CE1-OG1 3.41Å; H289-T308 PolarHBondContact NE2-OG1 3.34Å; H289-R316 VanDerWaalsContact CE1-CD 3.44Å; H289-R316 WeakPolarHBondContact CE1-CD 3.33Å; H289-R316 PolarHBondContact ND1-NH1 2.84Å; H289-W318 AromaticContact CE1-NE1 3.69Å; H289-W318 AromaticContact NE2-CE2 3.86Å; H289-W318 AromaticContact NE2-CZ2 3.74Å; H289-W318 AromaticContact NE2-NE1 3.44Å; H289-W318 PolarHBondContact NE2-NE1 2.91Å
290	A	79.5	Confident	89.5	Confident	78 Å²	78	52.6 Å²	52.6	65%	0.645	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	136.5	-177.9	0	0	0	0	0	110.7
291	P	84.6	Confident	89.6	Confident	110 Å²	110	49.5 Å²	49.5	71%	0.714	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95.8	11.8	9.4	38.4	-36.9	0	0	0	114.6
292	H	90.5	Very high	89.6	Confident	81 Å²	81	43 Å²	43	38%	0.375	25%	0.254	S	S	.	.	S	Bend	trans	-85.1	142.5	-171.6	-61.2	-74.1	0	0	0	111.9	G270 H289 C310 F311 D312	G270-H292 WeakPolarHBondContact CA-O 3.41Å; H289-H292 WeakPolarHBondContact O-CA 3.28Å; H289-H292 PolarHBondContact O-N 3.44Å; H292-C310 WeakPolarHBondContact CB-SG 3.31Å; H292-F311 HydrophobicContact CB-CB 4.49Å; H292-D312 HydrophobicContact CB-CB 4.43Å
293	R	92.7	Very high	89.6	Confident	77 Å²	77	41.3 Å²	41.3	29%	0.291	24%	0.243	S	C	.	.			trans	-63.4	138.4	175.8	168.9	173.6	-172.6	-167.5	1.7	110.5	C245 Q268 F311	C245-R293 PolarHBondContact SG-NE 3.04Å; C245-R293 PolarHBondContact SG-NH2 3.1Å; Q268-R293 HydrophobicContact CB-CG 4.46Å; Q268-R293 HydrophobicContact CG-CB 4.29Å; Q268-R293 HydrophobicContact CG-CG 4.27Å; Q268-R293 WeakPolarHBondContact O-CA 3.38Å; R293-F311 HydrophobicContact CB-CB 4.4Å; R293-F311 HydrophobicContact CB-CD2 3.68Å; R293-F311 HydrophobicContact CB-CE2 4.12Å; R293-F311 HydrophobicContact CB-CG 4.14Å; R293-F311 HydrophobicContact CG-CD2 3.67Å; R293-F311 HydrophobicContact CG-CE2 3.63Å; R293-F311 VanDerWaalsContact O-CD2 3.26Å; R293-F311 WeakPolarHBondContact O-CD2 3.46Å; R293-F311 PolarHBondContact O-N 3.31Å
294	V	93.6	Very high	89.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	115.3	167	175.9	0	0	0	0	108.8	C245 S266 A267 V272 H289 L297 T309	C245-V294 WeakPolarHBondContact CB-O 3.27Å; S266-V294 PolarHBondContact OG-O 2.92Å; A267-V294 PolarHBondContact O-N 2.93Å; V272-V294 HydrophobicContact CG2-CB 4.33Å; V272-V294 HydrophobicContact CG2-CG1 3.95Å; V272-V294 HydrophobicContact CG2-CG2 4.17Å; H289-V294 HydrophobicContact CB-CG2 3.66Å; V294-L297 HydrophobicContact CG1-CD2 3.86Å; V294-T309 CarbonylContact C-O 3.58Å; V294-T309 VanDerWaalsContact CA-O 3.31Å; V294-T309 WeakPolarHBondContact CA-O 3.44Å; V294-T309 WeakPolarHBondContact CG1-O 3.28Å
295	S	92.1	Very high	90	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-59.7	-172.7	40.4	0	0	0	0	112	C245 T309 V336 Y337	C245-S295 VanDerWaalsContact CB-O 3.3Å; C245-S295 WeakPolarHBondContact CB-O 3.04Å; S295-T309 PolarHBondContact N-O 3.18Å; S295-T309 WeakPolarHBondContact OG-CB 3.36Å; S295-T309 PolarHBondContact OG-O 3.35Å; S295-T309 VanDerWaalsContact OG-O 3.11Å; S295-T309 PolarHBondContact OG-OG1 3.49Å; S295-V336 PolarHBondContact OG-O 3.3Å; S295-Y337 WeakPolarHBondContact CB-O 3.14Å; S295-Y337 PolarHBondContact OG-O 3.33Å
296	R	94.3	Very high	90.2	Very high	6 Å²	6	33.8 Å²	33.8	2%	0.023	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.5	-175.8	-66.5	-68.5	-166.9	-159.5	-2.2	110.5	M204 C245 T309 Y337 D338	M204-R296 PolarHBondContact SD-NH1 3.22Å; C245-R296 PolarHBondContact O-NH1 3.42Å; R296-T309 PolarHBondContact N-OG1 2.95Å; R296-T309 VanDerWaalsContact N-OG1 3.09Å; R296-T309 PolarHBondContact O-N 3.21Å; R296-T309 VanDerWaalsContact O-N 3.1Å; R296-T309 PolarHBondContact O-OG1 2.61Å; R296-T309 VanDerWaalsContact O-OG1 3.04Å; R296-Y337 WeakPolarHBondContact CB-O 3.19Å; R296-Y337 WeakPolarHBondContact CG-O 3.46Å; R296-D338 WeakPolarHBondContact CB-OD1 3.42Å; R296-D338 HydrophobicContact CG-CB 4.25Å; R296-D338 WeakPolarHBondContact CG-OD1 3.35Å
297	L	94.9	Very high	90.4	Very high	7 Å²	7	32.9 Å²	32.9	4%	0.037	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.5	177.6	-60.1	177.8	0	0	0	108.1	V248 A264 S265 V272 V294 L306 A307 T308	V248-L297 HydrophobicContact CG2-CB 3.77Å; V248-L297 VanDerWaalsContact CG2-O 3.23Å; V248-L297 WeakPolarHBondContact CG2-O 3.32Å; A264-L297 HydrophobicContact CB-CD1 4.01Å; S265-L297 VanDerWaalsContact C-CD1 3.42Å; V272-L297 HydrophobicContact CG1-CD1 3.96Å; V272-L297 HydrophobicContact CG1-CD2 4.04Å; V272-L297 HydrophobicContact CG2-CD2 3.97Å; V294-L297 HydrophobicContact CG1-CD2 3.86Å; L297-L306 HydrophobicContact CD2-CD2 4.11Å; L297-A307 VanDerWaalsContact CA-O 3.32Å; L297-A307 WeakPolarHBondContact CA-O 3.1Å; L297-T308 HydrophobicContact CD2-CG2 3.56Å
298	A	95.2	Very high	91	Very high	12 Å²	12	25 Å²	25	10%	0.099	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	140.5	163	0	0	0	0	0	110.1	A307 V339 F341	A298-A307 PolarHBondContact N-O 3.19Å; A298-A307 PolarHBondContact O-N 2.9Å; A298-V339 HydrophobicContact CB-CG1 3.88Å; A298-V339 WeakPolarHBondContact CB-O 3.39Å; A298-F341 HydrophobicContact CB-CD2 3.79Å; A298-F341 HydrophobicContact CB-CE2 3.91Å; A298-F341 WeakPolarHBondContact O-CE2 3.45Å
299	F	94.6	Very high	91.7	Very high	19 Å²	19	22.8 Å²	22.8	8%	0.083	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	138.5	166.1	-78	-83.6	0	0	0	109.7	V248 W249 H250 L261 A264 L306 L320 F341	V248-F299 HydrophobicContact CB-CD2 4.04Å; V248-F299 HydrophobicContact CB-CE2 4.22Å; V248-F299 HydrophobicContact CG1-CD2 3.7Å; V248-F299 HydrophobicContact CG1-CE2 4.36Å; W249-F299 VanDerWaalsContact O-CD2 3.32Å; W249-F299 WeakPolarHBondContact O-CD2 3.34Å; H250-F299 HydrophobicContact CB-CZ 4.42Å; H250-F299 AromaticContact CD2-CD1 3.94Å; H250-F299 AromaticContact CD2-CE1 3.89Å; L261-F299 HydrophobicContact CD2-CE1 4.17Å; L261-F299 HydrophobicContact CD2-CZ 4.47Å; A264-F299 HydrophobicContact CB-CE2 3.61Å; A264-F299 HydrophobicContact CB-CZ 3.54Å; F299-L306 HydrophobicContact CD1-CB 4.38Å; F299-L306 HydrophobicContact CD1-CD1 4.47Å; F299-L306 HydrophobicContact CE1-CB 4.39Å; F299-L306 HydrophobicContact CE1-CD1 3.86Å; F299-L306 HydrophobicContact CE1-CG 4.43Å; F299-L306 HydrophobicContact CE2-CD1 4.48Å; F299-L306 HydrophobicContact CZ-CD1 3.87Å; F299-L320 HydrophobicContact CD1-CD1 4.16Å; F299-L320 HydrophobicContact CE1-CD1 3.69Å; F299-F341 VanDerWaalsContact C-CD2 3.49Å; F299-F341 VanDerWaalsContact O-CD2 3.24Å; F299-F341 WeakPolarHBondContact O-CD2 3.33Å
300	H	94.5	Very high	92.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.129	C	C	.	.			trans	-62.5	146.5	166.4	-179.3	-96	0	0	0	109.2	F151 S302 G303 F305 F341 G345	F151-H300 AromaticContact CD1-CE1 3.7Å; F151-H300 AromaticContact CE1-CE1 3.68Å; H300-S302 WeakPolarHBondContact ND1-CB 3.39Å; H300-S302 PolarHBondContact ND1-N 3.41Å; H300-S302 PolarHBondContact ND1-OG 2.8Å; H300-S302 PolarHBondContact O-N 3.24Å; H300-G303 PolarHBondContact O-N 3.05Å; H300-F305 HydrophobicContact CB-CB 3.76Å; H300-F305 HydrophobicContact CB-CD2 4.24Å; H300-F305 WeakPolarHBondContact CB-O 3.4Å; H300-F305 PolarHBondContact N-O 3.18Å; H300-F305 AromaticContact ND1-CD2 3.97Å; H300-F341 HydrophobicContact CB-CD2 4.34Å; H300-F341 HydrophobicContact CB-CE2 4.14Å; H300-F341 HydrophobicContact CB-CZ 4.23Å; H300-G345 WeakPolarHBondContact NE2-CA 3.24Å; H300-G345 PolarHBondContact NE2-O 3.23Å
301	P	91.7	Very high	93	Very high	22 Å²	22	21.5 Å²	21.5	14%	0.143	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-10.2	-176.2	-24.4	34.2	0	0	0	115.6	F151 R155 F341 H342	F151-P301 HydrophobicContact CE1-CB 4.49Å; R155-P301 PolarHBondContact NH2-O 3.17Å; P301-F341 HydrophobicContact CG-CB 4.27Å; P301-H342 WeakPolarHBondContact CG-O 3.48Å
302	S	89.7	Confident	93.4	Very high	14 Å²	14	17.6 Å²	17.6	10%	0.098	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-21.9	169.5	65.4	0	0	0	0	114.1	H300 R304	H300-S302 WeakPolarHBondContact ND1-CB 3.39Å; H300-S302 PolarHBondContact ND1-N 3.41Å; H300-S302 PolarHBondContact ND1-OG 2.8Å; H300-S302 PolarHBondContact O-N 3.24Å; S302-R304 VanDerWaalsContact C-N 3.26Å; S302-R304 PolarHBondContact O-N 3.31Å; S302-R304 PolarHBondContact OG-N 2.92Å
303	G	89.5	Confident	93.5	Very high	2 Å²	2	17.7 Å²	17.7	2%	0.021	8%	0.083	C	C	.	.	S	Bend	trans	88.5	-27.9	-171.5	0	0	0	0	0	114.7	H250 H300 F305 L320	H250-G303 WeakPolarHBondContact NE2-CA 3.47Å; H250-G303 PolarHBondContact NE2-O 3.35Å; H300-G303 PolarHBondContact O-N 3.05Å; G303-F305 PolarHBondContact O-N 2.98Å; G303-L320 VanDerWaalsContact O-CD1 3.32Å; G303-L320 WeakPolarHBondContact O-CD1 3.33Å
304	R	91.5	Very high	93.5	Very high	45 Å²	45	14 Å²	14	17%	0.17	7%	0.07	C	C	.	.	S	Bend	trans	-64.5	-36.7	-176.4	177	175	167.2	174.2	-10.4	114.7	S302 D319 L320 E321	S302-R304 VanDerWaalsContact C-N 3.26Å; S302-R304 PolarHBondContact O-N 3.31Å; S302-R304 PolarHBondContact OG-N 2.92Å; R304-D319 WeakPolarHBondContact CG-OD1 3.46Å; R304-D319 IonicContact CZ-OD1 3.57Å; R304-D319 IonicContact CZ-OD2 3.65Å; R304-D319 IonicContact NE-OD1 3.36Å; R304-D319 PolarHBondContact NE-OD1 3.02Å; R304-D319 IonicContact NE-OD2 3Å; R304-D319 PolarHBondContact NE-OD2 2.74Å; R304-D319 VanDerWaalsContact NE-OD2 3.15Å; R304-D319 IonicContact NH2-OD1 3.83Å; R304-D319 IonicContact NH2-OD2 3.41Å; R304-D319 PolarHBondContact NH2-OD2 3.13Å; R304-L320 VanDerWaalsContact O-CB 3.25Å; R304-L320 WeakPolarHBondContact O-CB 3.45Å; R304-L320 WeakPolarHBondContact O-CD1 3.45Å; R304-L320 VanDerWaalsContact O-CG 3.25Å; R304-L320 WeakPolarHBondContact O-CG 3.32Å; R304-L320 PolarHBondContact O-N 2.86Å; R304-E321 VanDerWaalsContact CD-CD 3.47Å; R304-E321 WeakPolarHBondContact CD-OE2 3.44Å; R304-E321 HydrophobicContact CG-CG 4.04Å; R304-E321 IonicContact CZ-OE2 3.21Å; R304-E321 IonicContact NE-OE2 3.2Å; R304-E321 PolarHBondContact NE-OE2 2.89Å; R304-E321 VanDerWaalsContact NE-OE2 3.16Å; R304-E321 IonicContact NH1-OE2 2.79Å; R304-E321 PolarHBondContact NH1-OE2 2.88Å; R304-E321 IonicContact NH2-OE2 3.83Å
305	F	94.3	Very high	93.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	146.5	-175.8	-51.1	-76.5	0	0	0	112.2	A144 W147 I148 H300 G303 L317 W318 D319 I326	A144-F305 HydrophobicContact CB-CE1 3.79Å; A144-F305 HydrophobicContact CB-CZ 3.84Å; W147-F305 AromaticContact CE3-CE2 3.65Å; W147-F305 HydrophobicContact CE3-CE2 3.65Å; W147-F305 HydrophobicContact CE3-CZ 4.2Å; W147-F305 AromaticContact CZ3-CE2 3.86Å; W147-F305 HydrophobicContact CZ3-CE2 3.86Å; I148-F305 HydrophobicContact CD1-CD2 4.09Å; I148-F305 HydrophobicContact CD1-CE2 3.72Å; I148-F305 HydrophobicContact CD1-CZ 4.05Å; I148-F305 HydrophobicContact CG1-CD2 4.08Å; I148-F305 HydrophobicContact CG1-CE2 3.43Å; I148-F305 VanDerWaalsContact CG1-CE2 3.43Å; I148-F305 HydrophobicContact CG1-CZ 4.01Å; H300-F305 HydrophobicContact CB-CB 3.76Å; H300-F305 HydrophobicContact CB-CD2 4.24Å; H300-F305 WeakPolarHBondContact CB-O 3.4Å; H300-F305 PolarHBondContact N-O 3.18Å; H300-F305 AromaticContact ND1-CD2 3.97Å; G303-F305 PolarHBondContact O-N 2.98Å; F305-L317 HydrophobicContact CB-CD1 3.89Å; F305-L317 HydrophobicContact CB-CG 4.26Å; F305-W318 CarbonylContact C-O 3.53Å; F305-W318 WeakPolarHBondContact CA-O 3.28Å; F305-D319 HydrophobicContact CD1-CB 3.92Å; F305-D319 HydrophobicContact CE1-CB 3.9Å; F305-I326 HydrophobicContact CD1-CD1 3.58Å; F305-I326 HydrophobicContact CE1-CD1 3.61Å
306	L	95.1	Very high	93.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.1	176.5	-176.6	158.8	0	0	0	109.3	A264 V272 L274 I286 L297 F299 T308 W318 L320	A264-L306 HydrophobicContact CB-CD1 3.53Å; V272-L306 HydrophobicContact CG1-CD2 4.43Å; L274-L306 HydrophobicContact CD2-CD1 3.77Å; I286-L306 HydrophobicContact CD1-CD1 4.49Å; L297-L306 HydrophobicContact CD2-CD2 4.11Å; F299-L306 HydrophobicContact CD1-CB 4.38Å; F299-L306 HydrophobicContact CD1-CD1 4.47Å; F299-L306 HydrophobicContact CE1-CB 4.39Å; F299-L306 HydrophobicContact CE1-CD1 3.86Å; F299-L306 HydrophobicContact CE1-CG 4.43Å; F299-L306 HydrophobicContact CE2-CD1 4.48Å; F299-L306 HydrophobicContact CZ-CD1 3.87Å; L306-T308 HydrophobicContact CD2-CG2 3.37Å; L306-W318 HydrophobicContact CB-CB 4.47Å; L306-W318 PolarHBondContact N-O 2.86Å; L306-W318 PolarHBondContact O-N 2.78Å; L306-L320 HydrophobicContact CB-CD1 4.29Å; L306-L320 HydrophobicContact CB-CD2 4.15Å; L306-L320 HydrophobicContact CB-CG 4.34Å; L306-L320 HydrophobicContact CD1-CD2 4.39Å
307	A	95.5	Very high	93.7	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	137.6	171.8	0	0	0	0	0	111.1	L297 A298 R316 L317 V339 F341	L297-A307 VanDerWaalsContact CA-O 3.32Å; L297-A307 WeakPolarHBondContact CA-O 3.1Å; A298-A307 PolarHBondContact N-O 3.19Å; A298-A307 PolarHBondContact O-N 2.9Å; A307-R316 CarbonylContact C-O 3.57Å; A307-R316 VanDerWaalsContact CA-O 3.3Å; A307-R316 WeakPolarHBondContact CA-O 3.4Å; A307-L317 HydrophobicContact CB-CD1 4.05Å; A307-V339 HydrophobicContact CB-CG1 3.99Å; A307-V339 HydrophobicContact CB-CG2 3.89Å; A307-F341 HydrophobicContact CB-CE2 3.64Å; A307-F341 HydrophobicContact CB-CZ 3.46Å; A307-F341 VanDerWaalsContact CB-CZ 3.46Å
308	T	95.4	Very high	93.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.8	177.7	54.5	0	0	0	0	109.1	V272 H289 L297 L306 W315 R316 W318	V272-T308 HydrophobicContact CG1-CG2 4.5Å; V272-T308 HydrophobicContact CG2-CG2 4.01Å; H289-T308 PolarHBondContact CE1-OG1 3.41Å; H289-T308 PolarHBondContact NE2-OG1 3.34Å; L297-T308 HydrophobicContact CD2-CG2 3.56Å; L306-T308 HydrophobicContact CD2-CG2 3.37Å; T308-W315 CarbonylContact O-C 3.5Å; T308-W315 VanDerWaalsContact O-CA 3.31Å; T308-W315 WeakPolarHBondContact O-CA 3.29Å; T308-R316 PolarHBondContact N-O 3.4Å; T308-R316 PolarHBondContact O-N 3.27Å; T308-R316 WeakPolarHBondContact OG1-CB 3.23Å; T308-R316 PolarHBondContact OG1-O 3.42Å; T308-W318 PolarHBondContact OG1-NE1 2.76Å
309	T	95.2	Very high	93.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.9	173.2	51.7	0	0	0	0	110.5	V294 S295 R296 W315 V336 Y337 V339	V294-T309 CarbonylContact C-O 3.58Å; V294-T309 VanDerWaalsContact CA-O 3.31Å; V294-T309 WeakPolarHBondContact CA-O 3.44Å; V294-T309 WeakPolarHBondContact CG1-O 3.28Å; S295-T309 PolarHBondContact N-O 3.18Å; S295-T309 WeakPolarHBondContact OG-CB 3.36Å; S295-T309 PolarHBondContact OG-O 3.35Å; S295-T309 VanDerWaalsContact OG-O 3.11Å; S295-T309 PolarHBondContact OG-OG1 3.49Å; R296-T309 PolarHBondContact N-OG1 2.95Å; R296-T309 VanDerWaalsContact N-OG1 3.09Å; R296-T309 PolarHBondContact O-N 3.21Å; R296-T309 VanDerWaalsContact O-N 3.1Å; R296-T309 PolarHBondContact O-OG1 2.61Å; R296-T309 VanDerWaalsContact O-OG1 3.04Å; T309-W315 HydrophobicContact CG2-CB 4.06Å; T309-V336 HydrophobicContact CG2-CB 4.23Å; T309-V336 HydrophobicContact CG2-CG1 3.51Å; T309-Y337 PolarHBondContact OG1-O 2.78Å; T309-V339 HydrophobicContact CG2-CB 3.47Å; T309-V339 VanDerWaalsContact CG2-CB 3.47Å; T309-V339 HydrophobicContact CG2-CG1 3.55Å
310	C	94.2	Very high	93.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	158.4	-171.6	-171.7	0	0	0	0	111.2	H292 D312 S314 V336	H292-C310 WeakPolarHBondContact CB-SG 3.31Å; C310-D312 WeakPolarHBondContact CB-OD1 3.5Å; C310-D312 PolarHBondContact O-N 2.93Å; C310-D312 PolarHBondContact SG-OD1 2.68Å; C310-D312 VanDerWaalsContact SG-OD1 3.39Å; C310-D312 PolarHBondContact SG-OD2 3.23Å; C310-S314 PolarHBondContact N-O 3.12Å; C310-S314 VanDerWaalsContact N-O 3.13Å; C310-V336 PolarHBondContact O-N 3.11Å
311	F	93.8	Very high	92.9	Very high	54 Å²	54	22.4 Å²	22.4	24%	0.237	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	7.9	177.2	-87.1	-107.7	0	0	0	114.1	H292 R293 H313 P335 L353	H292-F311 HydrophobicContact CB-CB 4.49Å; R293-F311 HydrophobicContact CB-CB 4.4Å; R293-F311 HydrophobicContact CB-CD2 3.68Å; R293-F311 HydrophobicContact CB-CE2 4.12Å; R293-F311 HydrophobicContact CB-CG 4.14Å; R293-F311 HydrophobicContact CG-CD2 3.67Å; R293-F311 HydrophobicContact CG-CE2 3.63Å; R293-F311 VanDerWaalsContact O-CD2 3.26Å; R293-F311 WeakPolarHBondContact O-CD2 3.46Å; R293-F311 PolarHBondContact O-N 3.31Å; F311-H313 VanDerWaalsContact C-N 3.28Å; F311-P335 HydrophobicContact CB-CB 4.22Å; F311-P335 HydrophobicContact CB-CG 4.33Å; F311-P335 HydrophobicContact CD1-CB 3.5Å; F311-P335 VanDerWaalsContact CD1-CB 3.5Å; F311-P335 HydrophobicContact CD1-CG 3.55Å; F311-P335 HydrophobicContact CE1-CB 3.96Å; F311-P335 HydrophobicContact CE1-CG 4.19Å; F311-P335 HydrophobicContact CG-CB 3.82Å; F311-P335 HydrophobicContact CG-CG 4.17Å; F311-L353 HydrophobicContact CE1-CD1 4.02Å
312	D	92.4	Very high	92.6	Very high	28 Å²	28	23.9 Å²	23.9	15%	0.15	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	18.7	173.4	60.2	2.8	0	0	0	113.1	H292 C310 S314 R316	H292-D312 HydrophobicContact CB-CB 4.43Å; C310-D312 WeakPolarHBondContact CB-OD1 3.5Å; C310-D312 PolarHBondContact O-N 2.93Å; C310-D312 PolarHBondContact SG-OD1 2.68Å; C310-D312 VanDerWaalsContact SG-OD1 3.39Å; C310-D312 PolarHBondContact SG-OD2 3.23Å; D312-S314 PolarHBondContact O-N 3.09Å; D312-S314 PolarHBondContact OD1-N 2.75Å; D312-S314 PolarHBondContact OD1-OG 3.1Å; D312-S314 PolarHBondContact OD2-OG 3.44Å; D312-R316 IonicContact OD1-NH1 3.15Å; D312-R316 IonicContact OD2-CZ 2.86Å; D312-R316 IonicContact OD2-NH1 3.34Å; D312-R316 PolarHBondContact OD2-NH1 3.49Å; D312-R316 IonicContact OD2-NH2 2.71Å; D312-R316 PolarHBondContact OD2-NH2 3.48Å
313	H	92.6	Very high	92.4	Very high	82 Å²	82	28.3 Å²	28.3	38%	0.38	15%	0.15	S	C	.	.	S	Bend	trans	69.9	1.8	-176	-47.1	-77.3	0	0	0	115.3	F311 S333 K334	F311-H313 VanDerWaalsContact C-N 3.28Å; H313-S333 PolarHBondContact CE1-O 2.8Å; H313-S333 PolarHBondContact ND1-O 3.44Å; H313-K334 WeakPolarHBondContact ND1-CA 3.13Å; H313-K334 PolarHBondContact ND1-N 3.4Å; H313-K334 PolarHBondContact ND1-O 3.4Å
314	S	93.3	Very high	92.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	164.6	179.2	86.1	0	0	0	0	112.4	C310 D312 H328 Q329	C310-S314 PolarHBondContact N-O 3.12Å; C310-S314 VanDerWaalsContact N-O 3.13Å; D312-S314 PolarHBondContact O-N 3.09Å; D312-S314 PolarHBondContact OD1-N 2.75Å; D312-S314 PolarHBondContact OD1-OG 3.1Å; D312-S314 PolarHBondContact OD2-OG 3.44Å; S314-H328 WeakPolarHBondContact CB-NE2 3.37Å; S314-H328 PolarHBondContact OG-CD2 2.82Å; S314-H328 PolarHBondContact OG-NE2 2.91Å; S314-Q329 VanDerWaalsContact CA-O 3.28Å; S314-Q329 WeakPolarHBondContact CA-O 3.22Å; S314-Q329 WeakPolarHBondContact CB-O 3.39Å
315	W	95.2	Very high	92.5	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.4	163.9	64.6	-79.9	0	0	0	108.2	T308 T309 L317 L327 Q329 V336 A348 T350 W360 L362	T308-W315 CarbonylContact O-C 3.5Å; T308-W315 VanDerWaalsContact O-CA 3.31Å; T308-W315 WeakPolarHBondContact O-CA 3.29Å; T309-W315 HydrophobicContact CG2-CB 4.06Å; W315-L317 HydrophobicContact CZ3-CB 4.34Å; W315-L327 HydrophobicContact CE3-CD2 4.25Å; W315-L327 HydrophobicContact CH2-CD2 3.59Å; W315-L327 HydrophobicContact CZ2-CD2 4.01Å; W315-L327 HydrophobicContact CZ3-CD2 3.73Å; W315-Q329 HydrophobicContact CD2-CB 4.13Å; W315-Q329 HydrophobicContact CG-CB 4.42Å; W315-Q329 HydrophobicContact CZ2-CB 3.78Å; W315-Q329 HydrophobicContact CZ2-CG 3.78Å; W315-Q329 PolarHBondContact N-O 3.21Å; W315-Q329 PolarHBondContact O-N 2.91Å; W315-V336 HydrophobicContact CB-CG1 4.45Å; W315-A348 HydrophobicContact CH2-CB 4.25Å; W315-T350 HydrophobicContact CD2-CG2 3.9Å; W315-T350 HydrophobicContact CG-CG2 3.83Å; W315-W360 AromaticContact CE2-CD1 3.82Å; W315-W360 AromaticContact CE2-NE1 3.87Å; W315-W360 HydrophobicContact CH2-CB 4.39Å; W315-W360 HydrophobicContact CH2-CG 4.48Å; W315-W360 HydrophobicContact CZ2-CB 3.84Å; W315-W360 AromaticContact CZ2-CD1 3.61Å; W315-W360 AromaticContact CZ2-CD2 3.97Å; W315-W360 HydrophobicContact CZ2-CD2 3.97Å; W315-W360 AromaticContact CZ2-CG 3.51Å; W315-W360 HydrophobicContact CZ2-CG 3.51Å; W315-W360 AromaticContact NE1-CD1 3.75Å; W315-W360 AromaticContact NE1-CE2 3.52Å; W315-W360 AromaticContact NE1-CZ2 3.97Å; W315-W360 AromaticContact NE1-NE1 3.3Å; W315-L362 HydrophobicContact CH2-CD2 3.8Å; W315-L362 HydrophobicContact CZ3-CD2 4.34Å
316	R	94.4	Very high	92.4	Very high	24 Å²	24	33.1 Å²	33.1	9%	0.091	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	149.7	-177.8	-54.6	179.3	173.7	80.1	-8.7	110.5	H289 A307 T308 D312 E325 L327	H289-R316 VanDerWaalsContact CE1-CD 3.44Å; H289-R316 WeakPolarHBondContact CE1-CD 3.33Å; H289-R316 PolarHBondContact ND1-NH1 2.84Å; A307-R316 CarbonylContact C-O 3.57Å; A307-R316 VanDerWaalsContact CA-O 3.3Å; A307-R316 WeakPolarHBondContact CA-O 3.4Å; T308-R316 PolarHBondContact N-O 3.4Å; T308-R316 PolarHBondContact O-N 3.27Å; T308-R316 WeakPolarHBondContact OG1-CB 3.23Å; T308-R316 PolarHBondContact OG1-O 3.42Å; D312-R316 IonicContact OD1-NH1 3.15Å; D312-R316 IonicContact OD2-CZ 2.86Å; D312-R316 IonicContact OD2-NH1 3.34Å; D312-R316 PolarHBondContact OD2-NH1 3.49Å; D312-R316 IonicContact OD2-NH2 2.71Å; D312-R316 PolarHBondContact OD2-NH2 3.48Å; R316-E325 HydrophobicContact CB-CG 4.25Å; R316-E325 WeakPolarHBondContact CD-OE1 3.18Å; R316-E325 WeakPolarHBondContact CD-OE2 3Å; R316-E325 WeakPolarHBondContact CG-OE1 3.44Å; R316-E325 IonicContact NE-OE1 2.79Å; R316-E325 PolarHBondContact NE-OE1 3.36Å; R316-E325 IonicContact NE-OE2 2.7Å; R316-L327 CarbonylContact C-O 3.49Å; R316-L327 WeakPolarHBondContact CA-O 3.3Å
317	L	94.6	Very high	92.3	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.5	170.5	-170.1	68.3	0	0	0	108.5	F305 A307 W315 I326 L327 F341 L362	F305-L317 HydrophobicContact CB-CD1 3.89Å; F305-L317 HydrophobicContact CB-CG 4.26Å; A307-L317 HydrophobicContact CB-CD1 4.05Å; W315-L317 HydrophobicContact CZ3-CB 4.34Å; L317-I326 HydrophobicContact CB-CD1 4.43Å; L317-I326 HydrophobicContact CB-CG1 4.06Å; L317-I326 HydrophobicContact CD2-CD1 3.57Å; L317-I326 HydrophobicContact CD2-CG1 4.11Å; L317-I326 HydrophobicContact CG-CD1 3.86Å; L317-I326 HydrophobicContact CG-CG1 4Å; L317-I326 WeakPolarHBondContact O-CG1 3.48Å; L317-I326 PolarHBondContact O-N 2.9Å; L317-L327 HydrophobicContact CB-CB 3.95Å; L317-L327 HydrophobicContact CB-CD2 4.22Å; L317-L327 PolarHBondContact N-O 3.01Å; L317-L327 PolarHBondContact O-N 2.91Å; L317-F341 HydrophobicContact CD1-CE1 4.26Å; L317-F341 HydrophobicContact CD1-CZ 3.65Å; L317-L362 HydrophobicContact CD2-CD2 4.22Å
318	W	94.1	Very high	92.1	Very high	22 Å²	22	37.8 Å²	37.8	8%	0.083	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.9	179.3	-62.7	87.4	0	0	0	109.5	I286 E287 H289 F305 L306 T308 E325	I286-W318 HydrophobicContact CG2-CD2 3.57Å; I286-W318 VanDerWaalsContact CG2-CE2 3.43Å; I286-W318 HydrophobicContact CG2-CE3 3.66Å; I286-W318 HydrophobicContact CG2-CG 4.33Å; I286-W318 HydrophobicContact CG2-CH2 3.53Å; I286-W318 HydrophobicContact CG2-CZ2 3.43Å; I286-W318 VanDerWaalsContact CG2-CZ2 3.43Å; I286-W318 HydrophobicContact CG2-CZ3 3.64Å; E287-W318 WeakPolarHBondContact O-CH2 3.47Å; H289-W318 AromaticContact CE1-NE1 3.69Å; H289-W318 AromaticContact NE2-CE2 3.86Å; H289-W318 AromaticContact NE2-CZ2 3.74Å; H289-W318 AromaticContact NE2-NE1 3.44Å; H289-W318 PolarHBondContact NE2-NE1 2.91Å; F305-W318 CarbonylContact C-O 3.53Å; F305-W318 WeakPolarHBondContact CA-O 3.28Å; L306-W318 HydrophobicContact CB-CB 4.47Å; L306-W318 PolarHBondContact N-O 2.86Å; L306-W318 PolarHBondContact O-N 2.78Å; T308-W318 PolarHBondContact OG1-NE1 2.76Å; W318-E325 HydrophobicContact CD2-CB 4.23Å; W318-E325 HydrophobicContact CE3-CB 3.89Å; W318-E325 HydrophobicContact CH2-CB 3.86Å; W318-E325 HydrophobicContact CZ2-CB 4.2Å; W318-E325 HydrophobicContact CZ3-CB 3.7Å
319	D	92.8	Very high	92	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	118.4	167.1	-170.4	-5	0	0	0	109	R304 F305 E321 A322 C323 E324 I326	R304-D319 WeakPolarHBondContact CG-OD1 3.46Å; R304-D319 IonicContact CZ-OD1 3.57Å; R304-D319 IonicContact CZ-OD2 3.65Å; R304-D319 IonicContact NE-OD1 3.36Å; R304-D319 PolarHBondContact NE-OD1 3.02Å; R304-D319 IonicContact NE-OD2 3Å; R304-D319 PolarHBondContact NE-OD2 2.74Å; R304-D319 VanDerWaalsContact NE-OD2 3.15Å; R304-D319 IonicContact NH2-OD1 3.83Å; R304-D319 IonicContact NH2-OD2 3.41Å; R304-D319 PolarHBondContact NH2-OD2 3.13Å; F305-D319 HydrophobicContact CD1-CB 3.92Å; F305-D319 HydrophobicContact CE1-CB 3.9Å; D319-E321 VanDerWaalsContact C-N 3.34Å; D319-E321 PolarHBondContact OD1-N 2.88Å; D319-A322 HydrophobicContact CB-CB 4.17Å; D319-C323 VanDerWaalsContact O-CA 3.25Å; D319-C323 WeakPolarHBondContact O-CA 3.45Å; D319-C323 PolarHBondContact O-N 3.47Å; D319-E324 PolarHBondContact N-O 2.82Å; D319-E324 PolarHBondContact O-N 2.79Å; D319-I326 HydrophobicContact CB-CD1 4.41Å; D319-I326 HydrophobicContact CB-CG2 3.71Å
320	L	88.9	Confident	91.8	Very high	32 Å²	32	45.5 Å²	45.5	17%	0.168	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-21.6	-175.9	-58.4	167.3	0	0	0	112.3	L261 L274 I286 F299 G303 R304 L306 C323	L261-L320 HydrophobicContact CD2-CD1 3.73Å; L274-L320 HydrophobicContact CD1-CD2 3.83Å; L274-L320 HydrophobicContact CD2-CD2 4.38Å; I286-L320 HydrophobicContact CD1-CD2 4.44Å; F299-L320 HydrophobicContact CD1-CD1 4.16Å; F299-L320 HydrophobicContact CE1-CD1 3.69Å; G303-L320 VanDerWaalsContact O-CD1 3.32Å; G303-L320 WeakPolarHBondContact O-CD1 3.33Å; R304-L320 VanDerWaalsContact O-CB 3.25Å; R304-L320 WeakPolarHBondContact O-CB 3.45Å; R304-L320 WeakPolarHBondContact O-CD1 3.45Å; R304-L320 VanDerWaalsContact O-CG 3.25Å; R304-L320 WeakPolarHBondContact O-CG 3.32Å; R304-L320 PolarHBondContact O-N 2.86Å; L306-L320 HydrophobicContact CB-CD1 4.29Å; L306-L320 HydrophobicContact CB-CD2 4.15Å; L306-L320 HydrophobicContact CB-CG 4.34Å; L306-L320 HydrophobicContact CD1-CD2 4.39Å; L320-C323 PolarHBondContact O-SG 2.88Å
321	E	86.7	Confident	91.5	Very high	136 Å²	136	47 Å²	47	64%	0.636	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-43	174.2	-73.2	176.6	-177.3	0	0	110.9	R304 D319	R304-E321 VanDerWaalsContact CD-CD 3.47Å; R304-E321 WeakPolarHBondContact CD-OE2 3.44Å; R304-E321 HydrophobicContact CG-CG 4.04Å; R304-E321 IonicContact CZ-OE2 3.21Å; R304-E321 IonicContact NE-OE2 3.2Å; R304-E321 PolarHBondContact NE-OE2 2.89Å; R304-E321 VanDerWaalsContact NE-OE2 3.16Å; R304-E321 IonicContact NH1-OE2 2.79Å; R304-E321 PolarHBondContact NH1-OE2 2.88Å; R304-E321 IonicContact NH2-OE2 3.83Å; D319-E321 VanDerWaalsContact C-N 3.34Å; D319-E321 PolarHBondContact OD1-N 2.88Å
322	A	85.2	Confident	91.4	Very high	53 Å²	53	45 Å²	45	44%	0.438	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-16.7	177.9	0	0	0	0	0	113.2	D319 E324	D319-A322 HydrophobicContact CB-CB 4.17Å; A322-E324 HydrophobicContact CB-CB 4.34Å; A322-E324 PolarHBondContact O-N 2.84Å
323	C	86.5	Confident	91.3	Very high	108 Å²	108	47.7 Å²	47.7	73%	0.73	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	36.9	-172	-65.8	0	0	0	0	112.7	D319 L320	D319-C323 VanDerWaalsContact O-CA 3.25Å; D319-C323 WeakPolarHBondContact O-CA 3.45Å; D319-C323 PolarHBondContact O-N 3.47Å; L320-C323 PolarHBondContact O-SG 2.88Å
324	E	90.1	Very high	91.4	Very high	85 Å²	85	48.3 Å²	48.3	40%	0.397	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	149.3	-176.8	-165.9	-174.3	-174.2	0	0	111	T140 D319 A322 I326	T140-E324 PolarHBondContact OG1-OE2 3.37Å; D319-E324 PolarHBondContact N-O 2.82Å; D319-E324 PolarHBondContact O-N 2.79Å; A322-E324 HydrophobicContact CB-CB 4.34Å; A322-E324 PolarHBondContact O-N 2.84Å; E324-I326 PolarHBondContact O-N 3.48Å
325	E	92.2	Very high	91.5	Very high	55 Å²	55	49.4 Å²	49.4	26%	0.257	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	110.9	164.8	-176.8	-178.8	173.4	0	0	109.2	R316 W318 H328	R316-E325 HydrophobicContact CB-CG 4.25Å; R316-E325 WeakPolarHBondContact CD-OE1 3.18Å; R316-E325 WeakPolarHBondContact CD-OE2 3Å; R316-E325 WeakPolarHBondContact CG-OE1 3.44Å; R316-E325 IonicContact NE-OE1 2.79Å; R316-E325 PolarHBondContact NE-OE1 3.36Å; R316-E325 IonicContact NE-OE2 2.7Å; W318-E325 HydrophobicContact CD2-CB 4.23Å; W318-E325 HydrophobicContact CE3-CB 3.89Å; W318-E325 HydrophobicContact CH2-CB 3.86Å; W318-E325 HydrophobicContact CZ2-CB 4.2Å; W318-E325 HydrophobicContact CZ3-CB 3.7Å; E325-H328 VanDerWaalsContact OE1-CB 3.27Å; E325-H328 WeakPolarHBondContact OE1-CB 3.31Å; E325-H328 IonicContact OE1-CD2 3.15Å; E325-H328 IonicContact OE1-CG 2.67Å
326	I	92	Very high	91.5	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-31.9	-179.6	54.3	166.1	0	0	0	112.3	L141 A144 F305 L317 D319 E324	L141-I326 HydrophobicContact CB-CB 4.46Å; L141-I326 WeakPolarHBondContact CB-O 3.37Å; L141-I326 WeakPolarHBondContact CD1-O 3.41Å; A144-I326 HydrophobicContact CB-CD1 3.86Å; F305-I326 HydrophobicContact CD1-CD1 3.58Å; F305-I326 HydrophobicContact CE1-CD1 3.61Å; L317-I326 HydrophobicContact CB-CD1 4.43Å; L317-I326 HydrophobicContact CB-CG1 4.06Å; L317-I326 HydrophobicContact CD2-CD1 3.57Å; L317-I326 HydrophobicContact CD2-CG1 4.11Å; L317-I326 HydrophobicContact CG-CD1 3.86Å; L317-I326 HydrophobicContact CG-CG1 4Å; L317-I326 WeakPolarHBondContact O-CG1 3.48Å; L317-I326 PolarHBondContact O-N 2.9Å; D319-I326 HydrophobicContact CB-CD1 4.41Å; D319-I326 HydrophobicContact CB-CG2 3.71Å; E324-I326 PolarHBondContact O-N 3.48Å
327	L	92.5	Very high	91.5	Very high	11 Å²	11	49.9 Å²	49.9	6%	0.058	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	120.1	-173.6	175.2	152.3	0	0	0	110.6	L141 W315 R316 L317 Q329	L141-L327 HydrophobicContact CD1-CB 4.1Å; L141-L327 HydrophobicContact CD1-CD1 4.38Å; W315-L327 HydrophobicContact CE3-CD2 4.25Å; W315-L327 HydrophobicContact CH2-CD2 3.59Å; W315-L327 HydrophobicContact CZ2-CD2 4.01Å; W315-L327 HydrophobicContact CZ3-CD2 3.73Å; R316-L327 CarbonylContact C-O 3.49Å; R316-L327 WeakPolarHBondContact CA-O 3.3Å; L317-L327 HydrophobicContact CB-CB 3.95Å; L317-L327 HydrophobicContact CB-CD2 4.22Å; L317-L327 PolarHBondContact N-O 3.01Å; L317-L327 PolarHBondContact O-N 2.91Å; L327-Q329 HydrophobicContact CD2-CB 3.5Å; L327-Q329 HydrophobicContact CG-CB 4.41Å
328	H	92.5	Very high	91.6	Very high	86 Å²	86	50 Å²	50	40%	0.398	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	113.3	166.5	-177.8	-114.2	0	0	0	108.3	S314 E325 E330	S314-H328 WeakPolarHBondContact CB-NE2 3.37Å; S314-H328 PolarHBondContact OG-CD2 2.82Å; S314-H328 PolarHBondContact OG-NE2 2.91Å; E325-H328 VanDerWaalsContact OE1-CB 3.27Å; E325-H328 WeakPolarHBondContact OE1-CB 3.31Å; E325-H328 IonicContact OE1-CD2 3.15Å; E325-H328 IonicContact OE1-CG 2.67Å; H328-E330 IonicContact CE1-OE1 3.39Å; H328-E330 PolarHBondContact CE1-OE1 2.84Å; H328-E330 VanDerWaalsContact CE1-OE1 3.27Å
329	Q	92.7	Very high	91.6	Very high	38 Å²	38	49 Å²	49	18%	0.178	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112.1	-176	-171.5	68.7	51.8	0	0	112.2	S314 W315 L327 W360	S314-Q329 VanDerWaalsContact CA-O 3.28Å; S314-Q329 WeakPolarHBondContact CA-O 3.22Å; S314-Q329 WeakPolarHBondContact CB-O 3.39Å; W315-Q329 HydrophobicContact CD2-CB 4.13Å; W315-Q329 HydrophobicContact CG-CB 4.42Å; W315-Q329 HydrophobicContact CZ2-CB 3.78Å; W315-Q329 HydrophobicContact CZ2-CG 3.78Å; W315-Q329 PolarHBondContact N-O 3.21Å; W315-Q329 PolarHBondContact O-N 2.91Å; L327-Q329 HydrophobicContact CD2-CB 3.5Å; L327-Q329 HydrophobicContact CG-CB 4.41Å; Q329-W360 HydrophobicContact CG-CD2 4.12Å; Q329-W360 HydrophobicContact CG-CE3 3.87Å; Q329-W360 HydrophobicContact CG-CH2 3.81Å; Q329-W360 HydrophobicContact CG-CZ2 4.06Å; Q329-W360 HydrophobicContact CG-CZ3 3.71Å
330	E	92.1	Very high	91.8	Very high	124 Å²	124	49.4 Å²	49.4	58%	0.579	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	151.2	166.9	-66	175.3	-172.4	0	0	110.1	H328	H328-E330 IonicContact CE1-OE1 3.39Å; H328-E330 PolarHBondContact CE1-OE1 2.84Å; H328-E330 VanDerWaalsContact CE1-OE1 3.27Å
331	G	86.7	Confident	92.1	Very high	31 Å²	31	48.7 Å²	48.7	32%	0.32	27%	0.266	S	S	.	.			trans	174.9	-24.5	175.7	0	0	0	0	0	114.1	R358	G331-R358 PolarHBondContact O-NE 3.49Å; G331-R358 VanDerWaalsContact O-NE 3.13Å; G331-R358 PolarHBondContact O-NH1 3.49Å; G331-R358 PolarHBondContact O-NH2 3.41Å
332	H	91.2	Very high	92.5	Very high	12 Å²	12	42.6 Å²	42.6	6%	0.056	24%	0.237	C	C	.	.			trans	-87.2	145.9	174.4	-68.8	-98.1	0	0	0	110.9	K334 V336 T350 G352 D354 Y356 R358	H332-K334 VanDerWaalsContact C-N 3.31Å; H332-K334 VanDerWaalsContact CB-O 3.22Å; H332-K334 WeakPolarHBondContact CB-O 3.42Å; H332-V336 HydrophobicContact CB-CG2 4.1Å; H332-T350 PolarHBondContact NE2-OG1 2.91Å; H332-G352 PolarHBondContact CE1-N 3.01Å; H332-D354 WeakPolarHBondContact CA-OD2 3.38Å; H332-D354 WeakPolarHBondContact CB-OD2 3.19Å; H332-D354 IonicContact CE1-OD1 3.48Å; H332-D354 IonicContact CG-OD1 2.75Å; H332-D354 IonicContact CG-OD2 2.9Å; H332-D354 IonicContact ND1-OD1 3.57Å; H332-D354 PolarHBondContact ND1-OD1 3.26Å; H332-D354 IonicContact ND1-OD2 2.7Å; H332-D354 PolarHBondContact ND1-OD2 3.41Å; H332-D354 VanDerWaalsContact ND1-OD2 3.12Å; H332-Y356 PolarHBondContact CE1-O 3.34Å; H332-Y356 VanDerWaalsContact CE1-O 3.25Å; H332-R358 PolarHBondContact CE1-NH1 3.39Å; H332-R358 PolarHBondContact ND1-NH1 3.31Å
333	S	91.9	Very high	92.8	Very high	86 Å²	86	41.3 Å²	41.3	60%	0.601	22%	0.224	S	C	*	.	S	Bend	trans	-82.9	-14	174.8	58.7	0	0	0	0	112.7	H313 D354	H313-S333 PolarHBondContact CE1-O 2.8Å; H313-S333 PolarHBondContact ND1-O 3.44Å; S333-D354 PolarHBondContact N-OD2 3Å; S333-D354 WeakPolarHBondContact OG-CB 3.26Å
334	K	94.1	Very high	93	Very high	95 Å²	95	36.4 Å²	36.4	41%	0.413	19%	0.191	S	C	.	.	S	Bend	trans	-129.5	168.4	177.2	-71.8	-170.7	-170.8	171.1	0	109.9	H313 H332 L353 D354	H313-K334 WeakPolarHBondContact ND1-CA 3.13Å; H313-K334 PolarHBondContact ND1-N 3.4Å; H313-K334 PolarHBondContact ND1-O 3.4Å; H332-K334 VanDerWaalsContact C-N 3.31Å; H332-K334 VanDerWaalsContact CB-O 3.22Å; H332-K334 WeakPolarHBondContact CB-O 3.42Å; K334-L353 HydrophobicContact CB-CB 4.08Å; K334-L353 HydrophobicContact CD-CB 4.36Å; K334-L353 VanDerWaalsContact CD-O 3.24Å; K334-L353 WeakPolarHBondContact CD-O 3.35Å; K334-L353 PolarHBondContact NZ-O 3.41Å; K334-D354 HydrophobicContact CB-CB 3.92Å; K334-D354 HydrophobicContact CD-CB 4.44Å; K334-D354 HydrophobicContact CG-CB 4.22Å
335	P	94.4	Very high	93.1	Very high	22 Å²	22	32.4 Å²	32.4	14%	0.143	17%	0.172	C	C	.	.			trans	-48	143.7	179.9	-36.1	41.2	0	0	0	114.1	F311 G352 L353	F311-P335 HydrophobicContact CB-CB 4.22Å; F311-P335 HydrophobicContact CB-CG 4.33Å; F311-P335 HydrophobicContact CD1-CB 3.5Å; F311-P335 VanDerWaalsContact CD1-CB 3.5Å; F311-P335 HydrophobicContact CD1-CG 3.55Å; F311-P335 HydrophobicContact CE1-CB 3.96Å; F311-P335 HydrophobicContact CE1-CG 4.19Å; F311-P335 HydrophobicContact CG-CB 3.82Å; F311-P335 HydrophobicContact CG-CG 4.17Å; P335-G352 WeakPolarHBondContact O-CA 3.4Å; P335-L353 HydrophobicContact CB-CD1 3.8Å; P335-L353 HydrophobicContact CB-CG 4.16Å; P335-L353 HydrophobicContact CG-CD1 4.12Å; P335-L353 PolarHBondContact O-N 3.2Å
336	V	95.5	Very high	93.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126.4	173.4	-170.2	0	0	0	0	108.5	S295 T309 C310 W315 H332 T350 T351	S295-V336 PolarHBondContact OG-O 3.3Å; T309-V336 HydrophobicContact CG2-CB 4.23Å; T309-V336 HydrophobicContact CG2-CG1 3.51Å; C310-V336 PolarHBondContact O-N 3.11Å; W315-V336 HydrophobicContact CB-CG1 4.45Å; H332-V336 HydrophobicContact CB-CG2 4.1Å; V336-T350 HydrophobicContact CG1-CG2 4.47Å; V336-T351 CarbonylContact C-O 3.6Å; V336-T351 VanDerWaalsContact CG1-O 3.3Å; V336-T351 WeakPolarHBondContact CG1-O 3.48Å
337	Y	95.4	Very high	93.3	Very high	37 Å²	37	31.4 Å²	31.4	15%	0.145	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-49.4	-174.9	-169	-89.4	0	0	0	113.4	S295 R296 T309 T351 L353 L378 L379	S295-Y337 WeakPolarHBondContact CB-O 3.14Å; S295-Y337 PolarHBondContact OG-O 3.33Å; R296-Y337 WeakPolarHBondContact CB-O 3.19Å; R296-Y337 WeakPolarHBondContact CG-O 3.46Å; T309-Y337 PolarHBondContact OG1-O 2.78Å; Y337-T351 PolarHBondContact N-O 2.83Å; Y337-L353 HydrophobicContact CD2-CD2 4.02Å; Y337-L353 HydrophobicContact CG-CD2 4.28Å; Y337-L378 WeakPolarHBondContact CB-O 3.05Å; Y337-L379 VanDerWaalsContact CD1-CA 3.48Å; Y337-L379 HydrophobicContact CD1-CB 4.3Å; Y337-L379 HydrophobicContact CD1-CD2 4.26Å; Y337-L379 WeakPolarHBondContact CD1-O 3.16Å; Y337-L379 HydrophobicContact CD2-CD2 4.03Å; Y337-L379 HydrophobicContact CE1-CB 4.09Å; Y337-L379 HydrophobicContact CE1-CD2 4.2Å; Y337-L379 WeakPolarHBondContact CE1-O 3.43Å; Y337-L379 HydrophobicContact CE2-CD2 3.94Å; Y337-L379 HydrophobicContact CG-CD2 4.16Å
338	D	95.3	Very high	93.4	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.6	-177.9	-157	10.3	0	0	0	111.6	R296 T350 T351 G380 A381	R296-D338 WeakPolarHBondContact CB-OD1 3.42Å; R296-D338 HydrophobicContact CG-CB 4.25Å; R296-D338 WeakPolarHBondContact CG-OD1 3.35Å; D338-T350 CarbonylContact O-C 3.57Å; D338-T350 WeakPolarHBondContact O-CA 3.49Å; D338-T351 WeakPolarHBondContact CA-OG1 3.18Å; D338-T351 WeakPolarHBondContact CB-OG1 3.49Å; D338-T351 PolarHBondContact N-O 3.12Å; D338-T351 PolarHBondContact N-OG1 2.86Å; D338-T351 VanDerWaalsContact N-OG1 3.1Å; D338-T351 PolarHBondContact O-N 3.19Å; D338-T351 PolarHBondContact O-OG1 2.85Å; D338-G380 WeakPolarHBondContact OD2-CA 3.39Å; D338-A381 PolarHBondContact OD2-N 2.81Å
339	V	95.5	Very high	93.6	Very high	2 Å²	2	27 Å²	27	1%	0.012	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.1	174.3	58.8	0	0	0	0	109.4	A298 A307 T309 L349 T350	A298-V339 HydrophobicContact CB-CG1 3.88Å; A298-V339 WeakPolarHBondContact CB-O 3.39Å; A307-V339 HydrophobicContact CB-CG1 3.99Å; A307-V339 HydrophobicContact CB-CG2 3.89Å; T309-V339 HydrophobicContact CG2-CB 3.47Å; T309-V339 VanDerWaalsContact CG2-CB 3.47Å; T309-V339 HydrophobicContact CG2-CG1 3.55Å; V339-L349 CarbonylContact C-O 3.57Å; V339-L349 WeakPolarHBondContact CA-O 3.34Å; V339-T350 HydrophobicContact CB-CG2 4.39Å; V339-T350 HydrophobicContact CG2-CG2 4.08Å
340	V	95.6	Very high	93.8	Very high	13 Å²	13	25.1 Å²	25.1	8%	0.079	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.5	176.3	177.9	0	0	0	0	109.9	L349 A381 V383	V340-L349 PolarHBondContact N-O 2.98Å; V340-L349 PolarHBondContact O-N 3.11Å; V340-A381 HydrophobicContact CG2-CB 4.11Å; V340-A381 WeakPolarHBondContact CG2-O 3.28Å; V340-V383 HydrophobicContact CG1-CB 4.25Å; V340-V383 HydrophobicContact CG1-CG2 3.99Å
341	F	95.4	Very high	93.9	Very high	17 Å²	17	19.2 Å²	19.2	8%	0.075	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	143.1	172.1	-68.7	-74.1	0	0	0	111.6	A298 F299 H300 P301 A307 L317 A348 L362	A298-F341 HydrophobicContact CB-CD2 3.79Å; A298-F341 HydrophobicContact CB-CE2 3.91Å; A298-F341 WeakPolarHBondContact O-CE2 3.45Å; F299-F341 VanDerWaalsContact C-CD2 3.49Å; F299-F341 VanDerWaalsContact O-CD2 3.24Å; F299-F341 WeakPolarHBondContact O-CD2 3.33Å; H300-F341 HydrophobicContact CB-CD2 4.34Å; H300-F341 HydrophobicContact CB-CE2 4.14Å; H300-F341 HydrophobicContact CB-CZ 4.23Å; P301-F341 HydrophobicContact CG-CB 4.27Å; A307-F341 HydrophobicContact CB-CE2 3.64Å; A307-F341 HydrophobicContact CB-CZ 3.46Å; A307-F341 VanDerWaalsContact CB-CZ 3.46Å; L317-F341 HydrophobicContact CD1-CE1 4.26Å; L317-F341 HydrophobicContact CD1-CZ 3.65Å; F341-A348 HydrophobicContact CD1-CB 3.84Å; F341-A348 HydrophobicContact CE1-CB 3.8Å; F341-L362 HydrophobicContact CD1-CD1 3.93Å; F341-L362 HydrophobicContact CE1-CD1 3.59Å; F341-L362 HydrophobicContact CE1-CD2 4.33Å; F341-L362 HydrophobicContact CE1-CG 4.49Å
342	H	94.7	Very high	94.3	Very high	7 Å²	7	17.8 Å²	17.8	3%	0.032	10%	0.098	C	C	.	.			trans	-63.1	144.9	166.7	-173.6	-86.4	0	0	0	109.8	P301 D344 G345 L347 G387	P301-H342 WeakPolarHBondContact CG-O 3.48Å; H342-D344 IonicContact CE1-OD2 3.06Å; H342-D344 PolarHBondContact CE1-OD2 2.89Å; H342-D344 VanDerWaalsContact CE1-OD2 3.23Å; H342-D344 WeakPolarHBondContact ND1-CB 3.34Å; H342-D344 PolarHBondContact ND1-N 3.21Å; H342-D344 IonicContact ND1-OD2 3.46Å; H342-D344 PolarHBondContact O-N 2.97Å; H342-D344 VanDerWaalsContact O-N 3.07Å; H342-G345 WeakPolarHBondContact O-CA 3.47Å; H342-G345 PolarHBondContact O-N 2.86Å; H342-L347 HydrophobicContact CB-CB 3.87Å; H342-L347 WeakPolarHBondContact CB-O 3.37Å; H342-L347 PolarHBondContact N-O 3.23Å; H342-G387 WeakPolarHBondContact NE2-CA 3.25Å; H342-G387 PolarHBondContact NE2-O 3.4Å
343	P	91.5	Very high	94.4	Very high	26 Å²	26	18 Å²	18	17%	0.169	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27	-176.3	21.6	-36.3	0	0	0	114.6	R155 G345	R155-P343 PolarHBondContact NH1-O 2.86Å; R155-P343 VanDerWaalsContact NH1-O 3.13Å; P343-G345 VanDerWaalsContact C-N 3.32Å
344	D	91.5	Very high	94.5	Very high	6 Å²	6	14.9 Å²	14.9	3%	0.032	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.3	174.3	-60.3	-15.9	0	0	0	113.1	S152 R155 A156 R159 H342	S152-D344 VanDerWaalsContact CA-O 3.28Å; S152-D344 WeakPolarHBondContact CA-O 3.46Å; S152-D344 WeakPolarHBondContact CB-O 3.42Å; R155-D344 HydrophobicContact CB-CB 4.41Å; A156-D344 WeakPolarHBondContact CA-OD2 3.44Å; A156-D344 HydrophobicContact CB-CB 4.4Å; A156-D344 WeakPolarHBondContact CB-OD2 3.12Å; R159-D344 VanDerWaalsContact CD-OD1 3.25Å; R159-D344 WeakPolarHBondContact CD-OD1 3.18Å; R159-D344 IonicContact CZ-OD1 3.95Å; R159-D344 IonicContact CZ-OD2 3.81Å; R159-D344 IonicContact NE-OD1 2.78Å; R159-D344 PolarHBondContact NE-OD1 3.39Å; R159-D344 IonicContact NE-OD2 3.92Å; R159-D344 PolarHBondContact NE-OD2 2.96Å; R159-D344 IonicContact NH2-OD2 2.89Å; R159-D344 PolarHBondContact NH2-OD2 3.41Å; H342-D344 IonicContact CE1-OD2 3.06Å; H342-D344 PolarHBondContact CE1-OD2 2.89Å; H342-D344 VanDerWaalsContact CE1-OD2 3.23Å; H342-D344 WeakPolarHBondContact ND1-CB 3.34Å; H342-D344 PolarHBondContact ND1-N 3.21Å; H342-D344 IonicContact ND1-OD2 3.46Å; H342-D344 PolarHBondContact O-N 2.97Å; H342-D344 VanDerWaalsContact O-N 3.07Å
345	G	91.8	Very high	94.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.057	C	C	.	.	S	Bend	trans	84	-1.7	-176.4	0	0	0	0	0	115.6	H300 H342 P343 L362	H300-G345 WeakPolarHBondContact NE2-CA 3.24Å; H300-G345 PolarHBondContact NE2-O 3.23Å; H342-G345 WeakPolarHBondContact O-CA 3.47Å; H342-G345 PolarHBondContact O-N 2.86Å; P343-G345 VanDerWaalsContact C-N 3.32Å; G345-L362 WeakPolarHBondContact O-CD1 3.39Å
346	S	93.4	Very high	94.5	Very high	18 Å²	18	13.4 Å²	13.4	13%	0.126	7%	0.066	C	C	.	.	S	Bend	trans	-72.6	-39.8	179.5	46.5	0	0	0	0	113.6	L362	S346-L362 PolarHBondContact O-N 2.88Å
347	L	95.1	Very high	94.5	Very high	25 Å²	25	13.5 Å²	13.5	13%	0.131	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.9	-171.3	-53.5	173.9	0	0	0	111.4	H342 V359 W360 D361 I368	H342-L347 HydrophobicContact CB-CB 3.87Å; H342-L347 WeakPolarHBondContact CB-O 3.37Å; H342-L347 PolarHBondContact N-O 3.23Å; L347-V359 HydrophobicContact CB-CG1 3.94Å; L347-V359 HydrophobicContact CD1-CG1 3.97Å; L347-V359 HydrophobicContact CD2-CG1 4.35Å; L347-V359 HydrophobicContact CG-CG1 4.3Å; L347-W360 CarbonylContact C-O 3.38Å; L347-W360 WeakPolarHBondContact CA-O 3.37Å; L347-D361 HydrophobicContact CD2-CB 3.83Å; L347-I368 HydrophobicContact CD2-CD1 3.88Å
348	A	95.9	Very high	94.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.4	167.3	0	0	0	0	0	109	W315 F341 W360 L362	W315-A348 HydrophobicContact CH2-CB 4.25Å; F341-A348 HydrophobicContact CD1-CB 3.84Å; F341-A348 HydrophobicContact CE1-CB 3.8Å; A348-W360 PolarHBondContact N-O 2.93Å; A348-W360 PolarHBondContact O-N 3.41Å; A348-L362 HydrophobicContact CB-CD2 3.96Å; A348-L362 HydrophobicContact CB-CG 4.43Å
349	L	95.6	Very high	94.5	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.016	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.4	174	-173.6	162.2	0	0	0	108.1	V339 V340 T351 A357 R358 V359 L371 A381 V383 A390	V339-L349 CarbonylContact C-O 3.57Å; V339-L349 WeakPolarHBondContact CA-O 3.34Å; V340-L349 PolarHBondContact N-O 2.98Å; V340-L349 PolarHBondContact O-N 3.11Å; L349-T351 HydrophobicContact CD2-CG2 3.78Å; L349-A357 HydrophobicContact CD2-CB 4.36Å; L349-R358 CarbonylContact C-O 3.58Å; L349-R358 WeakPolarHBondContact CA-O 3.27Å; L349-V359 HydrophobicContact CB-CG2 4.47Å; L349-V359 HydrophobicContact CD1-CG2 4.24Å; L349-V359 HydrophobicContact CG-CG2 4.16Å; L349-L371 HydrophobicContact CD1-CD1 4.15Å; L349-A381 HydrophobicContact CD2-CB 3.35Å; L349-V383 HydrophobicContact CB-CG2 4.4Å; L349-V383 HydrophobicContact CD1-CG2 4.24Å; L349-A390 HydrophobicContact CD1-CB 3.66Å
350	T	96.2	Very high	94.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146.9	174.7	62.4	0	0	0	0	110.4	W315 H332 V336 D338 V339 A357 R358 W360	W315-T350 HydrophobicContact CD2-CG2 3.9Å; W315-T350 HydrophobicContact CG-CG2 3.83Å; H332-T350 PolarHBondContact NE2-OG1 2.91Å; V336-T350 HydrophobicContact CG1-CG2 4.47Å; D338-T350 CarbonylContact O-C 3.57Å; D338-T350 WeakPolarHBondContact O-CA 3.49Å; V339-T350 HydrophobicContact CB-CG2 4.39Å; V339-T350 HydrophobicContact CG2-CG2 4.08Å; T350-A357 CarbonylContact O-C 3.51Å; T350-A357 VanDerWaalsContact O-CA 3.25Å; T350-A357 WeakPolarHBondContact O-CA 3.45Å; T350-R358 PolarHBondContact N-O 3.42Å; T350-R358 PolarHBondContact O-N 3.22Å; T350-W360 PolarHBondContact OG1-NE1 3.24Å
351	T	95.3	Very high	94.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135.6	176	57.8	0	0	0	0	109.3	V336 Y337 D338 L349 A357 L378 A381 T392	V336-T351 CarbonylContact C-O 3.6Å; V336-T351 VanDerWaalsContact CG1-O 3.3Å; V336-T351 WeakPolarHBondContact CG1-O 3.48Å; Y337-T351 PolarHBondContact N-O 2.83Å; D338-T351 WeakPolarHBondContact CA-OG1 3.18Å; D338-T351 WeakPolarHBondContact CB-OG1 3.49Å; D338-T351 PolarHBondContact N-O 3.12Å; D338-T351 PolarHBondContact N-OG1 2.86Å; D338-T351 VanDerWaalsContact N-OG1 3.1Å; D338-T351 PolarHBondContact O-N 3.19Å; D338-T351 PolarHBondContact O-OG1 2.85Å; L349-T351 HydrophobicContact CD2-CG2 3.78Å; T351-A357 HydrophobicContact CG2-CB 4.1Å; T351-L378 HydrophobicContact CG2-CB 4.17Å; T351-L378 HydrophobicContact CG2-CD1 4.02Å; T351-A381 HydrophobicContact CG2-CB 3.48Å; T351-A381 VanDerWaalsContact CG2-CB 3.48Å; T351-T392 HydrophobicContact CG2-CG2 4.33Å
352	G	94.2	Very high	94.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	163.3	178.8	0	0	0	0	0	113.1	H332 P335 D354 G355 Y356 L378	H332-G352 PolarHBondContact CE1-N 3.01Å; P335-G352 WeakPolarHBondContact O-CA 3.4Å; G352-D354 VanDerWaalsContact CA-OD1 3.27Å; G352-D354 WeakPolarHBondContact CA-OD1 3.43Å; G352-D354 PolarHBondContact O-N 2.97Å; G352-G355 PolarHBondContact O-N 3.16Å; G352-Y356 PolarHBondContact N-O 2.78Å; G352-Y356 VanDerWaalsContact N-O 3.16Å; G352-L378 PolarHBondContact O-N 3.19Å; G352-L378 VanDerWaalsContact O-N 3.16Å
353	L	95	Very high	94.2	Very high	18 Å²	18	16.7 Å²	16.7	9%	0.094	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-3	168.8	-54.5	-176	0	0	0	111.9	F311 K334 P335 Y337 G355 E377 L379	F311-L353 HydrophobicContact CE1-CD1 4.02Å; K334-L353 HydrophobicContact CB-CB 4.08Å; K334-L353 HydrophobicContact CD-CB 4.36Å; K334-L353 VanDerWaalsContact CD-O 3.24Å; K334-L353 WeakPolarHBondContact CD-O 3.35Å; K334-L353 PolarHBondContact NZ-O 3.41Å; P335-L353 HydrophobicContact CB-CD1 3.8Å; P335-L353 HydrophobicContact CB-CG 4.16Å; P335-L353 HydrophobicContact CG-CD1 4.12Å; P335-L353 PolarHBondContact O-N 3.2Å; Y337-L353 HydrophobicContact CD2-CD2 4.02Å; Y337-L353 HydrophobicContact CG-CD2 4.28Å; L353-G355 PolarHBondContact O-N 3.23Å; L353-E377 HydrophobicContact CB-CB 4.22Å; L353-E377 HydrophobicContact CB-CG 4.09Å; L353-E377 HydrophobicContact CD2-CB 3.81Å; L353-E377 HydrophobicContact CD2-CG 4.33Å; L353-E377 WeakPolarHBondContact O-CG 3.31Å; L353-L379 HydrophobicContact CD2-CD2 4.13Å
354	D	93.6	Very high	94.2	Very high	20 Å²	20	18.7 Å²	18.7	11%	0.107	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.8	172.5	57.3	-10.6	0	0	0	112.9	H332 S333 K334 G352 Y356 R358	H332-D354 WeakPolarHBondContact CA-OD2 3.38Å; H332-D354 WeakPolarHBondContact CB-OD2 3.19Å; H332-D354 IonicContact CE1-OD1 3.48Å; H332-D354 IonicContact CG-OD1 2.75Å; H332-D354 IonicContact CG-OD2 2.9Å; H332-D354 IonicContact ND1-OD1 3.57Å; H332-D354 PolarHBondContact ND1-OD1 3.26Å; H332-D354 IonicContact ND1-OD2 2.7Å; H332-D354 PolarHBondContact ND1-OD2 3.41Å; H332-D354 VanDerWaalsContact ND1-OD2 3.12Å; S333-D354 PolarHBondContact N-OD2 3Å; S333-D354 WeakPolarHBondContact OG-CB 3.26Å; K334-D354 HydrophobicContact CB-CB 3.92Å; K334-D354 HydrophobicContact CD-CB 4.44Å; K334-D354 HydrophobicContact CG-CB 4.22Å; G352-D354 VanDerWaalsContact CA-OD1 3.27Å; G352-D354 WeakPolarHBondContact CA-OD1 3.43Å; G352-D354 PolarHBondContact O-N 2.97Å; D354-Y356 VanDerWaalsContact C-N 3.27Å; D354-Y356 HydrophobicContact CB-CD2 3.89Å; D354-Y356 WeakPolarHBondContact O-CD2 3.29Å; D354-Y356 PolarHBondContact OD1-N 2.56Å; D354-R358 IonicContact OD2-CZ 3.83Å; D354-R358 IonicContact OD2-NH1 2.7Å; D354-R358 PolarHBondContact OD2-NH1 3.01Å; D354-R358 IonicContact OD2-NH2 3.58Å
355	G	92.9	Very high	94.1	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.01	9%	0.094	C	C	.	.	S	Bend	trans	81.6	8.2	-177.5	0	0	0	0	0	113.3	G352 L353 E376	G352-G355 PolarHBondContact O-N 3.16Å; L353-G355 PolarHBondContact O-N 3.23Å; G355-E376 WeakPolarHBondContact CA-O 3.14Å
356	Y	94.5	Very high	94	Very high	85 Å²	85	26 Å²	26	33%	0.333	12%	0.12	S	C	.	.			trans	-111.9	140.5	179	-59	-67	0	0	0	110.8	H332 G352 D354 F370 E372 L378	H332-Y356 PolarHBondContact CE1-O 3.34Å; H332-Y356 VanDerWaalsContact CE1-O 3.25Å; G352-Y356 PolarHBondContact N-O 2.78Å; G352-Y356 VanDerWaalsContact N-O 3.16Å; D354-Y356 VanDerWaalsContact C-N 3.27Å; D354-Y356 HydrophobicContact CB-CD2 3.89Å; D354-Y356 WeakPolarHBondContact O-CD2 3.29Å; D354-Y356 PolarHBondContact OD1-N 2.56Å; Y356-F370 AromaticContact CD1-CE1 3.59Å; Y356-F370 HydrophobicContact CD1-CE1 3.59Å; Y356-F370 AromaticContact CD1-CE2 3.86Å; Y356-F370 HydrophobicContact CD1-CE2 3.86Å; Y356-F370 AromaticContact CD1-CZ 3.11Å; Y356-F370 HydrophobicContact CD1-CZ 3.11Å; Y356-F370 HydrophobicContact CD2-CE2 4.36Å; Y356-F370 AromaticContact CD2-CZ 3.98Å; Y356-F370 HydrophobicContact CD2-CZ 3.98Å; Y356-F370 AromaticContact CE1-CE1 3.72Å; Y356-F370 HydrophobicContact CE1-CE1 3.72Å; Y356-F370 AromaticContact CE1-CZ 3.43Å; Y356-F370 HydrophobicContact CE1-CZ 3.43Å; Y356-F370 VanDerWaalsContact CE1-CZ 3.43Å; Y356-F370 HydrophobicContact CE2-CZ 4.26Å; Y356-F370 HydrophobicContact CG-CE1 4.33Å; Y356-F370 AromaticContact CG-CE2 3.75Å; Y356-F370 HydrophobicContact CG-CE2 3.75Å; Y356-F370 AromaticContact CG-CZ 3.41Å; Y356-F370 HydrophobicContact CG-CZ 3.41Å; Y356-F370 VanDerWaalsContact CG-CZ 3.41Å; Y356-E372 HydrophobicContact CD1-CB 4.36Å; Y356-E372 HydrophobicContact CE1-CB 4.33Å; Y356-L378 WeakPolarHBondContact O-CD1 3.15Å
357	A	95.3	Very high	94	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.6	164.8	0	0	0	0	0	109.4	L349 T350 T351 L371 L378 T392	L349-A357 HydrophobicContact CD2-CB 4.36Å; T350-A357 CarbonylContact O-C 3.51Å; T350-A357 VanDerWaalsContact O-CA 3.25Å; T350-A357 WeakPolarHBondContact O-CA 3.45Å; T351-A357 HydrophobicContact CG2-CB 4.1Å; A357-L371 HydrophobicContact CB-CB 3.94Å; A357-L371 HydrophobicContact CB-CD1 3.95Å; A357-L371 HydrophobicContact CB-CG 4.41Å; A357-L371 PolarHBondContact N-O 3.45Å; A357-L371 WeakPolarHBondContact O-CB 2.95Å; A357-L371 PolarHBondContact O-N 3Å; A357-L378 HydrophobicContact CB-CD1 3.67Å; A357-T392 HydrophobicContact CB-CG2 3.85Å
358	R	94.9	Very high	93.8	Very high	34 Å²	34	30 Å²	30	13%	0.128	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.1	180	-70	-178.1	175.6	81.1	-2.4	109	G331 H332 L349 T350 D354 W360 F370	G331-R358 PolarHBondContact O-NE 3.49Å; G331-R358 VanDerWaalsContact O-NE 3.13Å; G331-R358 PolarHBondContact O-NH1 3.49Å; G331-R358 PolarHBondContact O-NH2 3.41Å; H332-R358 PolarHBondContact CE1-NH1 3.39Å; H332-R358 PolarHBondContact ND1-NH1 3.31Å; L349-R358 CarbonylContact C-O 3.58Å; L349-R358 WeakPolarHBondContact CA-O 3.27Å; T350-R358 PolarHBondContact N-O 3.42Å; T350-R358 PolarHBondContact O-N 3.22Å; D354-R358 IonicContact OD2-CZ 3.83Å; D354-R358 IonicContact OD2-NH1 2.7Å; D354-R358 PolarHBondContact OD2-NH1 3.01Å; D354-R358 IonicContact OD2-NH2 3.58Å; R358-W360 HydrophobicContact CB-CZ2 4.03Å; R358-W360 HydrophobicContact CG-CZ2 4.46Å; R358-F370 HydrophobicContact CG-CD2 4.11Å
359	V	95.7	Very high	93.5	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.2	174	-174.3	0	0	0	0	108.8	L347 L349 C367 I368 M369 L371 L404	L347-V359 HydrophobicContact CB-CG1 3.94Å; L347-V359 HydrophobicContact CD1-CG1 3.97Å; L347-V359 HydrophobicContact CD2-CG1 4.35Å; L347-V359 HydrophobicContact CG-CG1 4.3Å; L349-V359 HydrophobicContact CB-CG2 4.47Å; L349-V359 HydrophobicContact CD1-CG2 4.24Å; L349-V359 HydrophobicContact CG-CG2 4.16Å; V359-C367 CarbonylContact O-C 3.56Å; V359-I368 PolarHBondContact O-N 3.22Å; V359-M369 HydrophobicContact CB-CB 4.01Å; V359-M369 HydrophobicContact CB-CE 4.3Å; V359-M369 HydrophobicContact CG1-CE 4.1Å; V359-M369 HydrophobicContact CG2-CB 4.06Å; V359-M369 HydrophobicContact CG2-CE 4.38Å; V359-M369 PolarHBondContact N-O 3.06Å; V359-M369 PolarHBondContact O-N 3.35Å; V359-L371 HydrophobicContact CG2-CD1 3.97Å; V359-L371 HydrophobicContact CG2-CG 4.33Å; V359-L404 HydrophobicContact CG2-CD2 4.21Å
360	W	95.2	Very high	93.3	Very high	13 Å²	13	34.9 Å²	34.9	5%	0.049	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.5	-179.6	-54.1	94.3	0	0	0	110.5	W315 Q329 L347 A348 T350 R358 C367	W315-W360 AromaticContact CE2-CD1 3.82Å; W315-W360 AromaticContact CE2-NE1 3.87Å; W315-W360 HydrophobicContact CH2-CB 4.39Å; W315-W360 HydrophobicContact CH2-CG 4.48Å; W315-W360 HydrophobicContact CZ2-CB 3.84Å; W315-W360 AromaticContact CZ2-CD1 3.61Å; W315-W360 AromaticContact CZ2-CD2 3.97Å; W315-W360 HydrophobicContact CZ2-CD2 3.97Å; W315-W360 AromaticContact CZ2-CG 3.51Å; W315-W360 HydrophobicContact CZ2-CG 3.51Å; W315-W360 AromaticContact NE1-CD1 3.75Å; W315-W360 AromaticContact NE1-CE2 3.52Å; W315-W360 AromaticContact NE1-CZ2 3.97Å; W315-W360 AromaticContact NE1-NE1 3.3Å; Q329-W360 HydrophobicContact CG-CD2 4.12Å; Q329-W360 HydrophobicContact CG-CE3 3.87Å; Q329-W360 HydrophobicContact CG-CH2 3.81Å; Q329-W360 HydrophobicContact CG-CZ2 4.06Å; Q329-W360 HydrophobicContact CG-CZ3 3.71Å; L347-W360 CarbonylContact C-O 3.38Å; L347-W360 WeakPolarHBondContact CA-O 3.37Å; A348-W360 PolarHBondContact N-O 2.93Å; A348-W360 PolarHBondContact O-N 3.41Å; T350-W360 PolarHBondContact OG1-NE1 3.24Å; R358-W360 HydrophobicContact CB-CZ2 4.03Å; R358-W360 HydrophobicContact CG-CZ2 4.46Å; W360-C367 HydrophobicContact CD2-CB 4.37Å; W360-C367 HydrophobicContact CE3-CB 3.78Å; W360-C367 HydrophobicContact CH2-CB 4.16Å; W360-C367 HydrophobicContact CZ3-CB 3.66Å
361	D	95	Very high	93.1	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.027	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	114.2	167.2	177.4	19.7	0	0	0	109.8	L347 R363 T364 G365 R366 I368	L347-D361 HydrophobicContact CD2-CB 3.83Å; D361-R363 VanDerWaalsContact CG-NH2 3.35Å; D361-R363 PolarHBondContact O-N 3.4Å; D361-R363 IonicContact OD1-CZ 3.83Å; D361-R363 PolarHBondContact OD1-N 3.21Å; D361-R363 IonicContact OD1-NE 3.23Å; D361-R363 PolarHBondContact OD1-NE 3.33Å; D361-R363 IonicContact OD1-NH2 3.9Å; D361-R363 PolarHBondContact OD1-NH2 3.45Å; D361-R363 IonicContact OD2-CZ 3.92Å; D361-R363 IonicContact OD2-NE 2.86Å; D361-R363 IonicContact OD2-NH2 2.92Å; D361-R363 PolarHBondContact OD2-NH2 3.16Å; D361-T364 WeakPolarHBondContact CB-OG1 3.41Å; D361-T364 PolarHBondContact O-N 3.25Å; D361-T364 WeakPolarHBondContact OD2-CG2 3.33Å; D361-T364 PolarHBondContact OD2-OG1 3.28Å; D361-G365 WeakPolarHBondContact O-CA 3.3Å; D361-G365 PolarHBondContact O-N 3.28Å; D361-R366 PolarHBondContact N-O 3.4Å; D361-I368 HydrophobicContact CB-CD1 3.44Å; D361-I368 VanDerWaalsContact CB-CD1 3.44Å; D361-I368 HydrophobicContact CB-CG1 3.78Å
362	L	93.5	Very high	92.9	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-30.9	-174.1	-62	177.9	0	0	0	111.7	R145 I148 W315 L317 F341 G345 S346 A348	R145-L362 VanDerWaalsContact CG-O 3.29Å; R145-L362 WeakPolarHBondContact CG-O 3.29Å; R145-L362 PolarHBondContact NE-O 2.89Å; R145-L362 VanDerWaalsContact NE-O 3.12Å; I148-L362 HydrophobicContact CD1-CB 4.2Å; I148-L362 HydrophobicContact CD1-CD1 4.38Å; I148-L362 HydrophobicContact CG2-CB 4.19Å; W315-L362 HydrophobicContact CH2-CD2 3.8Å; W315-L362 HydrophobicContact CZ3-CD2 4.34Å; L317-L362 HydrophobicContact CD2-CD2 4.22Å; F341-L362 HydrophobicContact CD1-CD1 3.93Å; F341-L362 HydrophobicContact CE1-CD1 3.59Å; F341-L362 HydrophobicContact CE1-CD2 4.33Å; F341-L362 HydrophobicContact CE1-CG 4.49Å; G345-L362 WeakPolarHBondContact O-CD1 3.39Å; S346-L362 PolarHBondContact O-N 2.88Å; A348-L362 HydrophobicContact CB-CD2 3.96Å; A348-L362 HydrophobicContact CB-CG 4.43Å
363	R	92.7	Very high	92.7	Very high	90 Å²	90	42.6 Å²	42.6	34%	0.34	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-35.1	-176.6	-54.3	168.4	-59.6	137.7	9.7	112.6	R145 I148 D361	R145-R363 VanDerWaalsContact CD-O 3.25Å; R145-R363 WeakPolarHBondContact CD-O 3.27Å; I148-R363 HydrophobicContact CG2-CG 4.09Å; D361-R363 VanDerWaalsContact CG-NH2 3.35Å; D361-R363 PolarHBondContact O-N 3.4Å; D361-R363 IonicContact OD1-CZ 3.83Å; D361-R363 PolarHBondContact OD1-N 3.21Å; D361-R363 IonicContact OD1-NE 3.23Å; D361-R363 PolarHBondContact OD1-NE 3.33Å; D361-R363 IonicContact OD1-NH2 3.9Å; D361-R363 PolarHBondContact OD1-NH2 3.45Å; D361-R363 IonicContact OD2-CZ 3.92Å; D361-R363 IonicContact OD2-NE 2.86Å; D361-R363 IonicContact OD2-NH2 2.92Å; D361-R363 PolarHBondContact OD2-NH2 3.16Å
364	T	91.2	Very high	92.6	Very high	67 Å²	67	42.3 Å²	42.3	41%	0.411	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-21	-177.9	57.5	0	0	0	0	112.5	D361 R366	D361-T364 WeakPolarHBondContact CB-OG1 3.41Å; D361-T364 PolarHBondContact O-N 3.25Å; D361-T364 WeakPolarHBondContact OD2-CG2 3.33Å; D361-T364 PolarHBondContact OD2-OG1 3.28Å; T364-R366 PolarHBondContact O-N 3.08Å; T364-R366 PolarHBondContact OG1-N 2.91Å
365	G	88.5	Confident	92.5	Very high	16 Å²	16	48.9 Å²	48.9	17%	0.165	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	9.9	-171.4	0	0	0	0	0	113.9	R145 D361	R145-G365 VanDerWaalsContact NH2-CA 3.27Å; D361-G365 WeakPolarHBondContact O-CA 3.3Å; D361-G365 PolarHBondContact O-N 3.28Å
366	R	91.2	Very high	92.6	Very high	143 Å²	143	53.6 Å²	53.6	54%	0.54	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	145.4	-177.1	-64.9	-177.3	177.2	176.8	-1.7	110.6	D361 T364 I368	D361-R366 PolarHBondContact N-O 3.4Å; T364-R366 PolarHBondContact O-N 3.08Å; T364-R366 PolarHBondContact OG1-N 2.91Å; R366-I368 PolarHBondContact O-N 2.85Å
367	C	92.3	Very high	92.6	Very high	51 Å²	51	53.4 Å²	53.4	35%	0.345	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	117.5	162.8	-173.7	0	0	0	0	108.2	V359 W360 M369	V359-C367 CarbonylContact O-C 3.56Å; W360-C367 HydrophobicContact CD2-CB 4.37Å; W360-C367 HydrophobicContact CE3-CB 3.78Å; W360-C367 HydrophobicContact CH2-CB 4.16Å; W360-C367 HydrophobicContact CZ3-CB 3.66Å; C367-M369 PolarHBondContact SG-O 3.27Å; C367-M369 VanDerWaalsContact SG-O 3.41Å
368	I	90.9	Very high	92.6	Very high	78 Å²	78	53.3 Å²	53.3	40%	0.4	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-44.2	177.9	-61.8	-170.8	0	0	0	110.6	L347 V359 D361 R366	L347-I368 HydrophobicContact CD2-CD1 3.88Å; V359-I368 PolarHBondContact O-N 3.22Å; D361-I368 HydrophobicContact CB-CD1 3.44Å; D361-I368 VanDerWaalsContact CB-CD1 3.44Å; D361-I368 HydrophobicContact CB-CG1 3.78Å; R366-I368 PolarHBondContact O-N 2.85Å
369	M	90.3	Very high	92.6	Very high	12 Å²	12	52.5 Å²	52.5	6%	0.059	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.3	-175.2	-63.7	179	-100.5	0	0	111	V359 C367 L371 L404 Q407	V359-M369 HydrophobicContact CB-CB 4.01Å; V359-M369 HydrophobicContact CB-CE 4.3Å; V359-M369 HydrophobicContact CG1-CE 4.1Å; V359-M369 HydrophobicContact CG2-CB 4.06Å; V359-M369 HydrophobicContact CG2-CE 4.38Å; V359-M369 PolarHBondContact N-O 3.06Å; V359-M369 PolarHBondContact O-N 3.35Å; C367-M369 PolarHBondContact SG-O 3.27Å; C367-M369 VanDerWaalsContact SG-O 3.41Å; M369-L371 HydrophobicContact CB-CD2 4.21Å; M369-L404 HydrophobicContact CE-CB 4Å; M369-L404 HydrophobicContact CE-CD2 3.62Å; M369-L404 HydrophobicContact CE-CG 4.37Å; M369-L404 HydrophobicContact SD-CD2 4.13Å; M369-Q407 HydrophobicContact CG-CB 4.46Å; M369-Q407 HydrophobicContact CG-CG 4.12Å; M369-Q407 HydrophobicContact SD-CB 4.1Å; M369-Q407 HydrophobicContact SD-CG 3.73Å
370	F	91.4	Very high	92.5	Very high	93 Å²	93	52.5 Å²	52.5	41%	0.408	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	110.2	168.4	-173.3	-105.9	0	0	0	107.9	Y356 R358 E372	Y356-F370 AromaticContact CD1-CE1 3.59Å; Y356-F370 HydrophobicContact CD1-CE1 3.59Å; Y356-F370 AromaticContact CD1-CE2 3.86Å; Y356-F370 HydrophobicContact CD1-CE2 3.86Å; Y356-F370 AromaticContact CD1-CZ 3.11Å; Y356-F370 HydrophobicContact CD1-CZ 3.11Å; Y356-F370 HydrophobicContact CD2-CE2 4.36Å; Y356-F370 AromaticContact CD2-CZ 3.98Å; Y356-F370 HydrophobicContact CD2-CZ 3.98Å; Y356-F370 AromaticContact CE1-CE1 3.72Å; Y356-F370 HydrophobicContact CE1-CE1 3.72Å; Y356-F370 AromaticContact CE1-CZ 3.43Å; Y356-F370 HydrophobicContact CE1-CZ 3.43Å; Y356-F370 VanDerWaalsContact CE1-CZ 3.43Å; Y356-F370 HydrophobicContact CE2-CZ 4.26Å; Y356-F370 HydrophobicContact CG-CE1 4.33Å; Y356-F370 AromaticContact CG-CE2 3.75Å; Y356-F370 HydrophobicContact CG-CE2 3.75Å; Y356-F370 AromaticContact CG-CZ 3.41Å; Y356-F370 HydrophobicContact CG-CZ 3.41Å; Y356-F370 VanDerWaalsContact CG-CZ 3.41Å; R358-F370 HydrophobicContact CG-CD2 4.11Å; F370-E372 HydrophobicContact CD1-CB 3.99Å; F370-E372 HydrophobicContact CE1-CB 3.81Å; F370-E372 PolarHBondContact O-N 2.83Å
371	L	91.7	Very high	92.5	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	97.5	-176.5	-55.9	177.9	0	0	0	108.5	L349 A357 V359 M369 W402	L349-L371 HydrophobicContact CD1-CD1 4.15Å; A357-L371 HydrophobicContact CB-CB 3.94Å; A357-L371 HydrophobicContact CB-CD1 3.95Å; A357-L371 HydrophobicContact CB-CG 4.41Å; A357-L371 PolarHBondContact N-O 3.45Å; A357-L371 WeakPolarHBondContact O-CB 2.95Å; A357-L371 PolarHBondContact O-N 3Å; V359-L371 HydrophobicContact CG2-CD1 3.97Å; V359-L371 HydrophobicContact CG2-CG 4.33Å; M369-L371 HydrophobicContact CB-CD2 4.21Å; L371-W402 HydrophobicContact CB-CD2 4.16Å; L371-W402 HydrophobicContact CB-CE3 4.28Å; L371-W402 HydrophobicContact CB-CH2 3.99Å; L371-W402 HydrophobicContact CB-CZ2 3.88Å; L371-W402 HydrophobicContact CB-CZ3 4.18Å; L371-W402 HydrophobicContact CD1-CD2 4.15Å; L371-W402 HydrophobicContact CD1-CG 4.02Å; L371-W402 HydrophobicContact CD2-CD2 3.85Å; L371-W402 HydrophobicContact CD2-CE3 3.63Å; L371-W402 HydrophobicContact CD2-CG 4.23Å; L371-W402 HydrophobicContact CD2-CZ3 4.09Å; L371-W402 HydrophobicContact CG-CD2 4.27Å; L371-W402 HydrophobicContact CG-CE3 4.41Å
372	E	91.6	Very high	92.5	Very high	129 Å²	129	52.4 Å²	52.4	60%	0.603	26%	0.263	S	S	*	.			trans	-99.3	145.7	-173.7	67	173.1	179.9	0	0	114.9	Y356 F370 R400 W402	Y356-E372 HydrophobicContact CD1-CB 4.36Å; Y356-E372 HydrophobicContact CE1-CB 4.33Å; F370-E372 HydrophobicContact CD1-CB 3.99Å; F370-E372 HydrophobicContact CE1-CB 3.81Å; F370-E372 PolarHBondContact O-N 2.83Å; E372-R400 PolarHBondContact O-NH1 2.83Å; E372-W402 VanDerWaalsContact O-CH2 3.31Å; E372-W402 WeakPolarHBondContact O-CH2 3.39Å
373	G	89.1	Confident	92.5	Very high	29 Å²	29	52.6 Å²	52.6	30%	0.299	26%	0.264	S	S	.	.			trans	126.4	-1.4	153.9	0	0	0	0	0	115	R400	G373-R400 VanDerWaalsContact C-NH2 3.31Å; G373-R400 PolarHBondContact O-NH1 3.18Å; G373-R400 VanDerWaalsContact O-NH1 3.08Å; G373-R400 PolarHBondContact O-NH2 3.13Å
374	H	93	Very high	92.5	Very high	11 Å²	11	48.3 Å²	48.3	5%	0.051	25%	0.248	C	C	.	.			trans	-61	140.7	158.2	-77.7	-73.3	0	0	0	109	L378 T392 S394 D396 T398 R400	H374-L378 HydrophobicContact CB-CD2 3.75Å; H374-L378 WeakPolarHBondContact CD2-CD2 3.38Å; H374-L378 VanDerWaalsContact CG-CD2 3.49Å; H374-T392 PolarHBondContact CD2-OG1 2.79Å; H374-T392 PolarHBondContact NE2-O 3.44Å; H374-T392 PolarHBondContact NE2-OG1 3.43Å; H374-S394 WeakPolarHBondContact ND1-CB 3.28Å; H374-D396 IonicContact CG-OD2 3.91Å; H374-D396 IonicContact ND1-OD1 3.6Å; H374-D396 IonicContact ND1-OD2 3.52Å; H374-D396 PolarHBondContact ND1-OD2 3.12Å; H374-T398 PolarHBondContact CE1-OG1 2.83Å; H374-T398 PolarHBondContact ND1-OG1 2.87Å; H374-R400 VanDerWaalsContact CE1-CG 3.42Å; H374-R400 WeakPolarHBondContact CE1-CG 3.2Å; H374-R400 WeakPolarHBondContact NE2-CB 3.36Å; H374-R400 WeakPolarHBondContact NE2-CD 3.4Å; H374-R400 WeakPolarHBondContact NE2-CG 3.45Å
375	L	91.8	Very high	92.3	Very high	159 Å²	159	48.1 Å²	48.1	83%	0.832	25%	0.245	S	C	*	.	S	Bend	trans	-91.6	-27.4	-176.3	-65.2	171.9	0	0	0	111.8	D396	L375-D396 PolarHBondContact N-OD2 2.99Å
376	E	94.5	Very high	92.2	Very high	99 Å²	99	48.7 Å²	48.7	46%	0.463	24%	0.244	S	C	.	.	S	Bend	trans	-118.2	-178.1	-179.4	-59.5	-168.1	172.6	0	0	111.7	G355 S394 A395 D396	G355-E376 WeakPolarHBondContact CA-O 3.14Å; E376-S394 PolarHBondContact O-OG 3.42Å; E376-A395 HydrophobicContact CB-CB 3.87Å; E376-A395 WeakPolarHBondContact OE2-CB 3.48Å; E376-D396 HydrophobicContact CB-CB 4.13Å; E376-D396 HydrophobicContact CG-CB 4.07Å; E376-D396 PolarHBondContact OE2-N 3.32Å
377	E	95.2	Very high	92	Very high	81 Å²	81	42.1 Å²	42.1	38%	0.379	22%	0.22	S	C	.	.			trans	-60.5	138.5	-175.3	-49.8	-171	154.5	0	0	112.4	L353 S394 A395	L353-E377 HydrophobicContact CB-CB 4.22Å; L353-E377 HydrophobicContact CB-CG 4.09Å; L353-E377 HydrophobicContact CD2-CB 3.81Å; L353-E377 HydrophobicContact CD2-CG 4.33Å; L353-E377 WeakPolarHBondContact O-CG 3.31Å; E377-S394 CarbonylContact O-C 3.54Å; E377-S394 VanDerWaalsContact O-CA 3.31Å; E377-S394 WeakPolarHBondContact O-CA 3.41Å; E377-S394 PolarHBondContact O-OG 3.46Å; E377-A395 PolarHBondContact O-N 3Å
378	L	96	Very high	91.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	127.4	174.1	-61.2	-178.6	0	0	0	110.7	Y337 T351 G352 Y356 A357 H374 S393	Y337-L378 WeakPolarHBondContact CB-O 3.05Å; T351-L378 HydrophobicContact CG2-CB 4.17Å; T351-L378 HydrophobicContact CG2-CD1 4.02Å; G352-L378 PolarHBondContact O-N 3.19Å; G352-L378 VanDerWaalsContact O-N 3.16Å; Y356-L378 WeakPolarHBondContact O-CD1 3.15Å; A357-L378 HydrophobicContact CB-CD1 3.67Å; H374-L378 HydrophobicContact CB-CD2 3.75Å; H374-L378 WeakPolarHBondContact CD2-CD2 3.38Å; H374-L378 VanDerWaalsContact CG-CD2 3.49Å; L378-S393 WeakPolarHBondContact CA-O 3.38Å
379	L	94.6	Very high	92	Very high	17 Å²	17	39.2 Å²	39.2	9%	0.089	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-5	-176.2	-60.8	-179.3	0	0	0	113.6	Y337 L353 S393 V419 S421	Y337-L379 VanDerWaalsContact CD1-CA 3.48Å; Y337-L379 HydrophobicContact CD1-CB 4.3Å; Y337-L379 HydrophobicContact CD1-CD2 4.26Å; Y337-L379 WeakPolarHBondContact CD1-O 3.16Å; Y337-L379 HydrophobicContact CD2-CD2 4.03Å; Y337-L379 HydrophobicContact CE1-CB 4.09Å; Y337-L379 HydrophobicContact CE1-CD2 4.2Å; Y337-L379 WeakPolarHBondContact CE1-O 3.43Å; Y337-L379 HydrophobicContact CE2-CD2 3.94Å; Y337-L379 HydrophobicContact CG-CD2 4.16Å; L353-L379 HydrophobicContact CD2-CD2 4.13Å; L379-S393 PolarHBondContact N-O 3.06Å; L379-V419 HydrophobicContact CD1-CG1 3.21Å; L379-S421 VanDerWaalsContact O-O 3.12Å
380	G	92.9	Very high	92.1	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	147.3	177.2	0	0	0	0	0	111.8	D338 T392 S393	D338-G380 WeakPolarHBondContact OD2-CA 3.39Å; G380-T392 WeakPolarHBondContact O-CA 3.19Å; G380-S393 WeakPolarHBondContact CA-OG 3.49Å; G380-S393 PolarHBondContact N-O 3.17Å; G380-S393 PolarHBondContact N-OG 3.19Å; G380-S393 PolarHBondContact O-N 3.26Å; G380-S393 PolarHBondContact O-OG 3.24Å; G380-S393 VanDerWaalsContact O-OG 3.12Å
381	A	94.6	Very high	92.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155.5	168.4	0	0	0	0	0	110.1	D338 V340 L349 T351 A391 R424	D338-A381 PolarHBondContact OD2-N 2.81Å; V340-A381 HydrophobicContact CG2-CB 4.11Å; V340-A381 WeakPolarHBondContact CG2-O 3.28Å; L349-A381 HydrophobicContact CD2-CB 3.35Å; T351-A381 HydrophobicContact CG2-CB 3.48Å; T351-A381 VanDerWaalsContact CG2-CB 3.48Å; A381-A391 CarbonylContact C-O 3.54Å; A381-A391 VanDerWaalsContact CA-O 3.31Å; A381-A391 WeakPolarHBondContact CA-O 3.46Å; A381-R424 PolarHBondContact O-NH1 3.32Å
382	D	95.2	Very high	92.5	Very high	17 Å²	17	34 Å²	34	9%	0.091	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	156.1	161.5	-159.8	16.1	0	0	0	111.2	A390 A391 V423 R424 F425	D382-A390 CarbonylContact O-C 3.6Å; D382-A390 WeakPolarHBondContact O-CA 3.27Å; D382-A391 PolarHBondContact N-O 3.35Å; D382-A391 PolarHBondContact O-N 2.76Å; D382-V423 WeakPolarHBondContact CB-O 3.31Å; D382-R424 IonicContact OD1-NH1 2.83Å; D382-R424 VanDerWaalsContact OD2-CA 3.28Å; D382-R424 WeakPolarHBondContact OD2-CA 3.25Å; D382-R424 WeakPolarHBondContact OD2-CD 3.49Å; D382-F425 HydrophobicContact CB-CD2 3.77Å; D382-F425 HydrophobicContact CB-CE2 4.29Å; D382-F425 WeakPolarHBondContact O-CE2 3.42Å; D382-F425 PolarHBondContact OD2-N 3.12Å
383	V	93.8	Very high	92.7	Very high	8 Å²	8	27.9 Å²	27.9	5%	0.048	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.4	176.1	-179.4	0	0	0	0	107.7	V340 L349 A390 L404	V340-V383 HydrophobicContact CG1-CB 4.25Å; V340-V383 HydrophobicContact CG1-CG2 3.99Å; L349-V383 HydrophobicContact CB-CG2 4.4Å; L349-V383 HydrophobicContact CD1-CG2 4.24Å; V383-A390 HydrophobicContact CG2-CB 4.22Å; V383-L404 HydrophobicContact CG1-CD1 4.32Å
384	A	92.5	Very high	93.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.			trans	-66.7	143.8	177.8	0	0	0	0	0	110.7	N386 G387 H389 F425 C430	A384-N386 VanDerWaalsContact CB-OD1 3.27Å; A384-N386 WeakPolarHBondContact CB-OD1 3.44Å; A384-N386 PolarHBondContact O-N 3.42Å; A384-G387 WeakPolarHBondContact O-CA 3.12Å; A384-G387 PolarHBondContact O-N 3.42Å; A384-H389 HydrophobicContact CB-CB 3.85Å; A384-H389 WeakPolarHBondContact CB-O 3.46Å; A384-H389 PolarHBondContact N-O 2.85Å; A384-F425 HydrophobicContact CB-CB 4.41Å; A384-F425 HydrophobicContact CB-CD1 3.76Å; A384-F425 HydrophobicContact CB-CD2 4.07Å; A384-F425 HydrophobicContact CB-CE1 3.92Å; A384-F425 HydrophobicContact CB-CE2 4.25Å; A384-F425 HydrophobicContact CB-CG 3.84Å; A384-F425 HydrophobicContact CB-CZ 4.18Å; A384-C430 HydrophobicContact CB-CB 4.42Å
385	D	88.4	Confident	93.2	Very high	63 Å²	63	26.5 Å²	26.5	34%	0.337	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.6	178.3	-77.8	-14.5	0	0	0	113.5	G387 S427 R428 C430	D385-G387 PolarHBondContact O-N 3.29Å; D385-S427 WeakPolarHBondContact OD2-CA 3.43Å; D385-S427 PolarHBondContact OD2-OG 2.99Å; D385-R428 PolarHBondContact OD2-N 3.18Å; D385-C430 PolarHBondContact N-SG 3.42Å; D385-C430 VanDerWaalsContact N-SG 3.39Å
386	N	86.1	Confident	93.3	Very high	27 Å²	27	20.4 Å²	20.4	14%	0.144	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.6	172.1	70.3	19.4	0	0	0	113.1	R159 A384 Y388 H389 C430	R159-N386 PolarHBondContact NH1-O 3.34Å; A384-N386 VanDerWaalsContact CB-OD1 3.27Å; A384-N386 WeakPolarHBondContact CB-OD1 3.44Å; A384-N386 PolarHBondContact O-N 3.42Å; N386-Y388 VanDerWaalsContact C-N 3.3Å; N386-Y388 HydrophobicContact CB-CD1 3.49Å; N386-Y388 VanDerWaalsContact CB-CD1 3.49Å; N386-Y388 HydrophobicContact CB-CE1 3.24Å; N386-Y388 WeakPolarHBondContact ND2-CE1 3.31Å; N386-Y388 PolarHBondContact ND2-OH 2.73Å; N386-Y388 PolarHBondContact O-N 3.23Å; N386-Y388 VanDerWaalsContact OD1-CD1 3.3Å; N386-Y388 WeakPolarHBondContact OD1-CD1 3.3Å; N386-Y388 PolarHBondContact OD1-N 2.64Å; N386-H389 PolarHBondContact OD1-N 3.36Å; N386-H389 VanDerWaalsContact OD1-N 3.11Å; N386-C430 HydrophobicContact CB-CB 4.41Å; N386-C430 PolarHBondContact N-SG 3.4Å
387	G	86.6	Confident	93.4	Very high	5 Å²	5	18.2 Å²	18.2	5%	0.052	9%	0.094	C	C	.	.	S	Bend	trans	61.9	30.6	179.9	0	0	0	0	0	114.5	R159 H342 A384 D385	R159-G387 PolarHBondContact NH1-O 3.25Å; H342-G387 WeakPolarHBondContact NE2-CA 3.25Å; H342-G387 PolarHBondContact NE2-O 3.4Å; A384-G387 WeakPolarHBondContact O-CA 3.12Å; A384-G387 PolarHBondContact O-N 3.42Å; D385-G387 PolarHBondContact O-N 3.29Å
388	Y	89.5	Confident	93.4	Very high	56 Å²	56	15.7 Å²	15.7	22%	0.22	8%	0.084	C	C	.	.	S	Bend	trans	-128.6	-28.3	170.7	65.4	-95.9	0	0	0	112.4	N386 D403 L404	N386-Y388 VanDerWaalsContact C-N 3.3Å; N386-Y388 HydrophobicContact CB-CD1 3.49Å; N386-Y388 VanDerWaalsContact CB-CD1 3.49Å; N386-Y388 HydrophobicContact CB-CE1 3.24Å; N386-Y388 WeakPolarHBondContact ND2-CE1 3.31Å; N386-Y388 PolarHBondContact ND2-OH 2.73Å; N386-Y388 PolarHBondContact O-N 3.23Å; N386-Y388 VanDerWaalsContact OD1-CD1 3.3Å; N386-Y388 WeakPolarHBondContact OD1-CD1 3.3Å; N386-Y388 PolarHBondContact OD1-N 2.64Å; Y388-D403 CarbonylContact O-C 3.56Å; Y388-D403 WeakPolarHBondContact O-CA 3.39Å; Y388-L404 PolarHBondContact O-N 3.32Å
389	H	92.4	Very high	93.4	Very high	12 Å²	12	15.7 Å²	15.7	6%	0.056	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.2	173.6	-68.2	-35.2	0	0	0	112.2	A384 N386 W402 I410 F425 H447	A384-H389 HydrophobicContact CB-CB 3.85Å; A384-H389 WeakPolarHBondContact CB-O 3.46Å; A384-H389 PolarHBondContact N-O 2.85Å; N386-H389 PolarHBondContact OD1-N 3.36Å; N386-H389 VanDerWaalsContact OD1-N 3.11Å; H389-W402 WeakPolarHBondContact CA-O 3.44Å; H389-I410 WeakPolarHBondContact CE1-CD1 3.03Å; H389-I410 WeakPolarHBondContact ND1-CD1 3.42Å; H389-F425 HydrophobicContact CB-CE1 4.37Å; H389-F425 HydrophobicContact CB-CZ 4.18Å; H389-H447 AromaticContact CD2-CE1 3.5Å; H389-H447 PolarHBondContact CD2-CE1 2.76Å; H389-H447 VanDerWaalsContact CD2-CE1 3.5Å; H389-H447 AromaticContact CD2-ND1 3.97Å; H389-H447 AromaticContact NE2-CE1 3.02Å; H389-H447 PolarHBondContact NE2-CE1 2.88Å; H389-H447 AromaticContact NE2-ND1 3.82Å; H389-H447 AromaticContact NE2-NE2 3.78Å
390	A	94.2	Very high	93.4	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	151	162.1	0	0	0	0	0	108.9	L349 D382 V383 I401 W402 L404	L349-A390 HydrophobicContact CD1-CB 3.66Å; D382-A390 CarbonylContact O-C 3.6Å; D382-A390 WeakPolarHBondContact O-CA 3.27Å; V383-A390 HydrophobicContact CG2-CB 4.22Å; A390-I401 CarbonylContact O-C 3.56Å; A390-I401 WeakPolarHBondContact O-CA 3.14Å; A390-W402 HydrophobicContact CB-CB 4.27Å; A390-W402 PolarHBondContact N-O 2.93Å; A390-W402 PolarHBondContact O-N 2.89Å; A390-L404 HydrophobicContact CB-CD1 4.44Å; A390-L404 HydrophobicContact CB-CD2 4.09Å; A390-L404 HydrophobicContact CB-CG 4.26Å
391	A	95.1	Very high	93.5	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139.5	174.7	0	0	0	0	0	110.2	A381 D382 V399 R400 I401 V423 F425 I433	A381-A391 CarbonylContact C-O 3.54Å; A381-A391 VanDerWaalsContact CA-O 3.31Å; A381-A391 WeakPolarHBondContact CA-O 3.46Å; D382-A391 PolarHBondContact N-O 3.35Å; D382-A391 PolarHBondContact O-N 2.76Å; A391-V399 HydrophobicContact CB-CG1 4.25Å; A391-R400 CarbonylContact C-O 3.54Å; A391-R400 WeakPolarHBondContact CA-O 3.39Å; A391-I401 HydrophobicContact CB-CG1 4.33Å; A391-V423 HydrophobicContact CB-CG1 3.68Å; A391-F425 HydrophobicContact CB-CE2 3.44Å; A391-F425 VanDerWaalsContact CB-CE2 3.44Å; A391-F425 HydrophobicContact CB-CZ 3.53Å; A391-I433 HydrophobicContact CB-CD1 4.23Å
392	T	96.3	Very high	93.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.5	178	53.9	0	0	0	0	109.3	T351 A357 H374 G380 V399 R400 W402	T351-T392 HydrophobicContact CG2-CG2 4.33Å; A357-T392 HydrophobicContact CB-CG2 3.85Å; H374-T392 PolarHBondContact CD2-OG1 2.79Å; H374-T392 PolarHBondContact NE2-O 3.44Å; H374-T392 PolarHBondContact NE2-OG1 3.43Å; G380-T392 WeakPolarHBondContact O-CA 3.19Å; T392-V399 CarbonylContact O-C 3.55Å; T392-V399 VanDerWaalsContact O-CA 3.28Å; T392-V399 WeakPolarHBondContact O-CA 3.28Å; T392-R400 PolarHBondContact N-O 3.22Å; T392-R400 PolarHBondContact O-N 2.7Å; T392-W402 PolarHBondContact OG1-NE1 2.93Å
393	S	95.6	Very high	93.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.3	171.8	37.8	0	0	0	0	111.6	L378 L379 G380 V420 V423	L378-S393 WeakPolarHBondContact CA-O 3.38Å; L379-S393 PolarHBondContact N-O 3.06Å; G380-S393 WeakPolarHBondContact CA-OG 3.49Å; G380-S393 PolarHBondContact N-O 3.17Å; G380-S393 PolarHBondContact N-OG 3.19Å; G380-S393 PolarHBondContact O-N 3.26Å; G380-S393 PolarHBondContact O-OG 3.24Å; G380-S393 VanDerWaalsContact O-OG 3.12Å; S393-V420 VanDerWaalsContact CB-CG1 3.47Å; S393-V423 WeakPolarHBondContact OG-CG2 3.18Å
394	S	95.9	Very high	93.3	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	161.7	-178	176.7	0	0	0	0	112.1	H374 E376 E377 D396 T398 V420	H374-S394 WeakPolarHBondContact ND1-CB 3.28Å; E376-S394 PolarHBondContact O-OG 3.42Å; E377-S394 CarbonylContact O-C 3.54Å; E377-S394 VanDerWaalsContact O-CA 3.31Å; E377-S394 WeakPolarHBondContact O-CA 3.41Å; E377-S394 PolarHBondContact O-OG 3.46Å; S394-D396 VanDerWaalsContact CB-CG 3.43Å; S394-D396 WeakPolarHBondContact CB-OD1 3.26Å; S394-D396 WeakPolarHBondContact CB-OD2 3.47Å; S394-D396 PolarHBondContact O-N 3.45Å; S394-D396 PolarHBondContact OG-N 3.19Å; S394-D396 VanDerWaalsContact OG-N 3.12Å; S394-D396 PolarHBondContact OG-OD1 3.46Å; S394-D396 PolarHBondContact OG-OD2 3.32Å; S394-T398 PolarHBondContact N-O 3.21Å; S394-V420 PolarHBondContact O-N 3.37Å
395	A	95.5	Very high	93.3	Very high	12 Å²	12	25.1 Å²	25.1	10%	0.099	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.3	166.9	0	0	0	0	0	113.2	E376 E377 N397 V419	E376-A395 HydrophobicContact CB-CB 3.87Å; E376-A395 WeakPolarHBondContact OE2-CB 3.48Å; E377-A395 PolarHBondContact O-N 3Å; A395-N397 PolarHBondContact O-N 2.94Å; A395-N397 PolarHBondContact O-OD1 3.05Å; A395-V419 HydrophobicContact CB-CG1 4.18Å; A395-V419 HydrophobicContact CB-CG2 3.99Å
396	D	94.7	Very high	93.4	Very high	31 Å²	31	27.9 Å²	27.9	17%	0.166	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	11.6	175.1	67.7	23.9	0	0	0	114.7	H374 L375 E376 S394 T398	H374-D396 IonicContact CG-OD2 3.91Å; H374-D396 IonicContact ND1-OD1 3.6Å; H374-D396 IonicContact ND1-OD2 3.52Å; H374-D396 PolarHBondContact ND1-OD2 3.12Å; L375-D396 PolarHBondContact N-OD2 2.99Å; E376-D396 HydrophobicContact CB-CB 4.13Å; E376-D396 HydrophobicContact CG-CB 4.07Å; E376-D396 PolarHBondContact OE2-N 3.32Å; S394-D396 VanDerWaalsContact CB-CG 3.43Å; S394-D396 WeakPolarHBondContact CB-OD1 3.26Å; S394-D396 WeakPolarHBondContact CB-OD2 3.47Å; S394-D396 PolarHBondContact O-N 3.45Å; S394-D396 PolarHBondContact OG-N 3.19Å; S394-D396 VanDerWaalsContact OG-N 3.12Å; S394-D396 PolarHBondContact OG-OD1 3.46Å; S394-D396 PolarHBondContact OG-OD2 3.32Å; D396-T398 PolarHBondContact O-N 3.49Å; D396-T398 WeakPolarHBondContact OD1-CA 3.35Å; D396-T398 VanDerWaalsContact OD1-CB 3.25Å; D396-T398 WeakPolarHBondContact OD1-CB 3.31Å; D396-T398 PolarHBondContact OD1-N 2.84Å; D396-T398 PolarHBondContact OD1-OG1 3.07Å; D396-T398 PolarHBondContact OD2-OG1 3.49Å
397	N	95.3	Very high	93.5	Very high	52 Å²	52	32.2 Å²	32.2	28%	0.278	15%	0.149	S	C	.	.	S	Bend	trans	67	3.3	-177.4	-49.7	-23.7	0	0	0	115.4	A395 A415 H416 T417 S418 V419	A395-N397 PolarHBondContact O-N 2.94Å; A395-N397 PolarHBondContact O-OD1 3.05Å; N397-A415 PolarHBondContact O-N 2.7Å; N397-H416 WeakPolarHBondContact CB-O 3.4Å; N397-H416 PolarHBondContact O-N 3.16Å; N397-T417 PolarHBondContact ND2-O 2.93Å; N397-S418 WeakPolarHBondContact OD1-CA 3.37Å; N397-S418 PolarHBondContact OD1-O 3.35Å; N397-V419 PolarHBondContact OD1-N 2.9Å
398	T	96	Very high	93.8	Very high	28 Å²	28	37.8 Å²	37.8	17%	0.172	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	152.6	-179.4	76.3	0	0	0	0	112.5	H374 S394 D396 V412 I413	H374-T398 PolarHBondContact CE1-OG1 2.83Å; H374-T398 PolarHBondContact ND1-OG1 2.87Å; S394-T398 PolarHBondContact N-O 3.21Å; D396-T398 PolarHBondContact O-N 3.49Å; D396-T398 WeakPolarHBondContact OD1-CA 3.35Å; D396-T398 VanDerWaalsContact OD1-CB 3.25Å; D396-T398 WeakPolarHBondContact OD1-CB 3.31Å; D396-T398 PolarHBondContact OD1-N 2.84Å; D396-T398 PolarHBondContact OD1-OG1 3.07Å; D396-T398 PolarHBondContact OD2-OG1 3.49Å; T398-V412 HydrophobicContact CG2-CG1 4.16Å; T398-I413 WeakPolarHBondContact CA-O 3.43Å
399	V	95.9	Very high	93.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	122.8	166.5	176	0	0	0	0	107.9	A391 T392 I413 A415 V420 V423 T435	A391-V399 HydrophobicContact CB-CG1 4.25Å; T392-V399 CarbonylContact O-C 3.55Å; T392-V399 VanDerWaalsContact O-CA 3.28Å; T392-V399 WeakPolarHBondContact O-CA 3.28Å; V399-I413 HydrophobicContact CB-CB 4.26Å; V399-I413 PolarHBondContact N-O 3.4Å; V399-I413 PolarHBondContact O-N 2.86Å; V399-A415 HydrophobicContact CB-CB 4.43Å; V399-A415 HydrophobicContact CG2-CB 3.83Å; V399-V420 HydrophobicContact CG2-CB 4.34Å; V399-V420 HydrophobicContact CG2-CG1 3.77Å; V399-V420 HydrophobicContact CG2-CG2 4.23Å; V399-V423 HydrophobicContact CB-CG2 4.47Å; V399-V423 HydrophobicContact CG1-CG1 4.4Å; V399-V423 HydrophobicContact CG1-CG2 3.82Å; V399-V423 HydrophobicContact CG2-CG2 3.76Å; V399-T435 HydrophobicContact CG2-CG2 3.91Å
400	R	95.3	Very high	93.9	Very high	46 Å²	46	40.2 Å²	40.2	17%	0.174	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	138.1	176.3	-68.4	-175.1	179.3	-160	-3.4	110.4	E372 G373 H374 A391 T392 W402 V412	E372-R400 PolarHBondContact O-NH1 2.83Å; G373-R400 VanDerWaalsContact C-NH2 3.31Å; G373-R400 PolarHBondContact O-NH1 3.18Å; G373-R400 VanDerWaalsContact O-NH1 3.08Å; G373-R400 PolarHBondContact O-NH2 3.13Å; H374-R400 VanDerWaalsContact CE1-CG 3.42Å; H374-R400 WeakPolarHBondContact CE1-CG 3.2Å; H374-R400 WeakPolarHBondContact NE2-CB 3.36Å; H374-R400 WeakPolarHBondContact NE2-CD 3.4Å; H374-R400 WeakPolarHBondContact NE2-CG 3.45Å; A391-R400 CarbonylContact C-O 3.54Å; A391-R400 WeakPolarHBondContact CA-O 3.39Å; T392-R400 PolarHBondContact N-O 3.22Å; T392-R400 PolarHBondContact O-N 2.7Å; R400-W402 HydrophobicContact CB-CZ2 4.03Å; R400-V412 HydrophobicContact CG-CB 4.4Å; R400-V412 HydrophobicContact CG-CG1 4Å; R400-V412 HydrophobicContact CG-CG2 4.01Å
401	I	94.8	Very high	93.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.8	174.8	-66.4	146.6	0	0	0	108.4	A390 A391 A409 I410 Y411 I413 I433 W450	A390-I401 CarbonylContact O-C 3.56Å; A390-I401 WeakPolarHBondContact O-CA 3.14Å; A391-I401 HydrophobicContact CB-CG1 4.33Å; I401-A409 CarbonylContact O-C 3.59Å; I401-A409 WeakPolarHBondContact O-CA 3.13Å; I401-I410 HydrophobicContact CG2-CD1 4.29Å; I401-I410 PolarHBondContact O-N 3.23Å; I401-Y411 PolarHBondContact N-O 3.07Å; I401-Y411 PolarHBondContact O-N 3.28Å; I401-I413 HydrophobicContact CD1-CD1 3.5Å; I401-I413 HydrophobicContact CD1-CG1 3.84Å; I401-I413 HydrophobicContact CG1-CD1 4.47Å; I401-I433 HydrophobicContact CD1-CD1 4.24Å; I401-I433 HydrophobicContact CG1-CD1 4.17Å; I401-W450 HydrophobicContact CD1-CB 4.39Å; I401-W450 HydrophobicContact CD1-CD2 3.24Å; I401-W450 HydrophobicContact CD1-CE3 3.8Å; I401-W450 HydrophobicContact CD1-CG 3.51Å; I401-W450 HydrophobicContact CD1-CH2 4.19Å; I401-W450 HydrophobicContact CD1-CZ2 3.67Å; I401-W450 HydrophobicContact CD1-CZ3 4.27Å; I401-W450 HydrophobicContact CG1-CZ2 4.21Å; I401-W450 HydrophobicContact CG2-CZ2 3.89Å
402	W	94.5	Very high	93.8	Very high	11 Å²	11	48 Å²	48	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.6	-175.3	-57.1	96.4	0	0	0	109.6	L371 E372 H389 A390 T392 R400 Q408 A409	L371-W402 HydrophobicContact CB-CD2 4.16Å; L371-W402 HydrophobicContact CB-CE3 4.28Å; L371-W402 HydrophobicContact CB-CH2 3.99Å; L371-W402 HydrophobicContact CB-CZ2 3.88Å; L371-W402 HydrophobicContact CB-CZ3 4.18Å; L371-W402 HydrophobicContact CD1-CD2 4.15Å; L371-W402 HydrophobicContact CD1-CG 4.02Å; L371-W402 HydrophobicContact CD2-CD2 3.85Å; L371-W402 HydrophobicContact CD2-CE3 3.63Å; L371-W402 HydrophobicContact CD2-CG 4.23Å; L371-W402 HydrophobicContact CD2-CZ3 4.09Å; L371-W402 HydrophobicContact CG-CD2 4.27Å; L371-W402 HydrophobicContact CG-CE3 4.41Å; E372-W402 VanDerWaalsContact O-CH2 3.31Å; E372-W402 WeakPolarHBondContact O-CH2 3.39Å; H389-W402 WeakPolarHBondContact CA-O 3.44Å; A390-W402 HydrophobicContact CB-CB 4.27Å; A390-W402 PolarHBondContact N-O 2.93Å; A390-W402 PolarHBondContact O-N 2.89Å; T392-W402 PolarHBondContact OG1-NE1 2.93Å; R400-W402 HydrophobicContact CB-CZ2 4.03Å; W402-Q408 WeakPolarHBondContact CA-O 3.41Å; W402-A409 HydrophobicContact CD2-CB 4.35Å; W402-A409 HydrophobicContact CE3-CB 3.75Å; W402-A409 HydrophobicContact CH2-CB 3.96Å; W402-A409 HydrophobicContact CZ3-CB 3.55Å
403	D	93.5	Very high	93.7	Very high	16 Å²	16	48 Å²	48	9%	0.086	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	115	161.8	-161.3	-28.4	0	0	0	109	Y388 R405 Q406 Q407 Q408 I410	Y388-D403 CarbonylContact O-C 3.56Å; Y388-D403 WeakPolarHBondContact O-CA 3.39Å; D403-R405 PolarHBondContact O-N 2.75Å; D403-R405 WeakPolarHBondContact OD1-CB 3.41Å; D403-R405 PolarHBondContact OD1-N 3.48Å; D403-Q406 HydrophobicContact CB-CB 4.03Å; D403-Q406 HydrophobicContact CB-CG 4.25Å; D403-Q406 PolarHBondContact O-N 3.06Å; D403-Q407 WeakPolarHBondContact O-CA 3.32Å; D403-Q407 PolarHBondContact O-N 2.83Å; D403-Q408 PolarHBondContact N-O 2.95Å; D403-Q408 PolarHBondContact O-N 3.43Å; D403-I410 HydrophobicContact CB-CD1 3.56Å; D403-I410 HydrophobicContact CB-CG1 3.78Å
404	L	91.8	Very high	93.7	Very high	18 Å²	18	52.6 Å²	52.6	9%	0.094	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-20.5	177.4	-63.8	177.7	0	0	0	112.4	V359 M369 V383 Y388 A390	V359-L404 HydrophobicContact CG2-CD2 4.21Å; M369-L404 HydrophobicContact CE-CB 4Å; M369-L404 HydrophobicContact CE-CD2 3.62Å; M369-L404 HydrophobicContact CE-CG 4.37Å; M369-L404 HydrophobicContact SD-CD2 4.13Å; V383-L404 HydrophobicContact CG1-CD1 4.32Å; Y388-L404 PolarHBondContact O-N 3.32Å; A390-L404 HydrophobicContact CB-CD1 4.44Å; A390-L404 HydrophobicContact CB-CD2 4.09Å; A390-L404 HydrophobicContact CB-CG 4.26Å
405	R	91.5	Very high	93.5	Very high	150 Å²	150	52.6 Å²	52.6	57%	0.566	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-40.6	178.5	-60.9	-178.4	-178.4	-176.1	2.1	112.3	D403	D403-R405 PolarHBondContact O-N 2.75Å; D403-R405 WeakPolarHBondContact OD1-CB 3.41Å; D403-R405 PolarHBondContact OD1-N 3.48Å
406	Q	90.9	Very high	93.4	Very high	121 Å²	121	52.7 Å²	52.7	57%	0.565	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-14.1	178	-57.1	-178.5	3.1	0	0	112.3	D403 Q408	D403-Q406 HydrophobicContact CB-CB 4.03Å; D403-Q406 HydrophobicContact CB-CG 4.25Å; D403-Q406 PolarHBondContact O-N 3.06Å; Q406-Q408 VanDerWaalsContact C-N 3.25Å; Q406-Q408 WeakPolarHBondContact O-CG 3.33Å; Q406-Q408 PolarHBondContact O-N 2.85Å
407	Q	89.1	Confident	93.4	Very high	119 Å²	119	56.6 Å²	56.6	56%	0.556	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	36.1	-176.9	-49.2	-174.9	-18.8	0	0	112.6	M369 D403	M369-Q407 HydrophobicContact CG-CB 4.46Å; M369-Q407 HydrophobicContact CG-CG 4.12Å; M369-Q407 HydrophobicContact SD-CB 4.1Å; M369-Q407 HydrophobicContact SD-CG 3.73Å; D403-Q407 WeakPolarHBondContact O-CA 3.32Å; D403-Q407 PolarHBondContact O-N 2.83Å
408	Q	91.5	Very high	93.4	Very high	122 Å²	122	55.6 Å²	55.6	57%	0.57	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.2	154.3	-174	-72.4	179.5	-6	0	0	111.4	W402 D403 Q406 I410	W402-Q408 WeakPolarHBondContact CA-O 3.41Å; D403-Q408 PolarHBondContact N-O 2.95Å; D403-Q408 PolarHBondContact O-N 3.43Å; Q406-Q408 VanDerWaalsContact C-N 3.25Å; Q406-Q408 WeakPolarHBondContact O-CG 3.33Å; Q406-Q408 PolarHBondContact O-N 2.85Å; Q408-I410 PolarHBondContact O-N 3.44Å
409	A	91.7	Very high	93.4	Very high	44 Å²	44	55.9 Å²	55.9	36%	0.364	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	116.8	167.7	0	0	0	0	0	109.1	I401 W402	I401-A409 CarbonylContact O-C 3.59Å; I401-A409 WeakPolarHBondContact O-CA 3.13Å; W402-A409 HydrophobicContact CD2-CB 4.35Å; W402-A409 HydrophobicContact CE3-CB 3.75Å; W402-A409 HydrophobicContact CH2-CB 3.96Å; W402-A409 HydrophobicContact CZ3-CB 3.55Å
410	I	92	Very high	93.4	Very high	75 Å²	75	55.9 Å²	55.9	39%	0.385	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-45.6	176.4	-61.2	161	0	0	0	110	H389 I401 D403 Q408	H389-I410 WeakPolarHBondContact CE1-CD1 3.03Å; H389-I410 WeakPolarHBondContact ND1-CD1 3.42Å; I401-I410 HydrophobicContact CG2-CD1 4.29Å; I401-I410 PolarHBondContact O-N 3.23Å; D403-I410 HydrophobicContact CB-CD1 3.56Å; D403-I410 HydrophobicContact CB-CG1 3.78Å; Q408-I410 PolarHBondContact O-N 3.44Å
411	Y	93.4	Very high	93.3	Very high	102 Å²	102	53.8 Å²	53.8	40%	0.4	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	144.8	-170.2	-163.7	-103.8	0	0	0	111.4	I401 I413 W450	I401-Y411 PolarHBondContact N-O 3.07Å; I401-Y411 PolarHBondContact O-N 3.28Å; Y411-I413 HydrophobicContact CD1-CG1 3.64Å; Y411-I413 HydrophobicContact CE1-CB 4.47Å; Y411-I413 HydrophobicContact CE1-CG1 3.84Å; Y411-W450 HydrophobicContact CD1-CB 3.73Å; Y411-W450 AromaticContact CD1-CD1 3.76Å; Y411-W450 AromaticContact CD1-CG 3.99Å; Y411-W450 HydrophobicContact CD1-CG 3.99Å; Y411-W450 HydrophobicContact CE1-CB 3.81Å; Y411-W450 AromaticContact CG-CD1 3.84Å
412	V	94.7	Very high	93.3	Very high	61 Å²	61	53.9 Å²	53.9	37%	0.37	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	111.7	173.5	-173.7	0	0	0	0	107.4	T398 R400 P414	T398-V412 HydrophobicContact CG2-CG1 4.16Å; R400-V412 HydrophobicContact CG-CB 4.4Å; R400-V412 HydrophobicContact CG-CG1 4Å; R400-V412 HydrophobicContact CG-CG2 4.01Å; V412-P414 WeakPolarHBondContact O-CD 3.49Å
413	I	94.6	Very high	93.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	118.7	176.4	-54.7	176.6	0	0	0	108.3	T398 V399 I401 Y411 A415 W445 W450	T398-I413 WeakPolarHBondContact CA-O 3.43Å; V399-I413 HydrophobicContact CB-CB 4.26Å; V399-I413 PolarHBondContact N-O 3.4Å; V399-I413 PolarHBondContact O-N 2.86Å; I401-I413 HydrophobicContact CD1-CD1 3.5Å; I401-I413 HydrophobicContact CD1-CG1 3.84Å; I401-I413 HydrophobicContact CG1-CD1 4.47Å; Y411-I413 HydrophobicContact CD1-CG1 3.64Å; Y411-I413 HydrophobicContact CE1-CB 4.47Å; Y411-I413 HydrophobicContact CE1-CG1 3.84Å; I413-A415 VanDerWaalsContact C-N 3.28Å; I413-A415 HydrophobicContact CG2-CB 4.01Å; I413-A415 PolarHBondContact O-N 2.95Å; I413-W445 HydrophobicContact CD1-CB 4.43Å; I413-W445 HydrophobicContact CD1-CD2 4.38Å; I413-W445 HydrophobicContact CD1-CG 4.28Å; I413-W445 HydrophobicContact CG2-CD2 3.8Å; I413-W445 HydrophobicContact CG2-CE3 3.62Å; I413-W445 HydrophobicContact CG2-CH2 3.57Å; I413-W445 HydrophobicContact CG2-CZ2 3.77Å; I413-W445 HydrophobicContact CG2-CZ3 3.49Å; I413-W445 VanDerWaalsContact CG2-CZ3 3.49Å; I413-W450 HydrophobicContact CD1-CB 3.92Å; I413-W450 HydrophobicContact CD1-CD2 4.39Å; I413-W450 HydrophobicContact CD1-CE3 4.3Å; I413-W450 HydrophobicContact CD1-CG 4.26Å; I413-W450 HydrophobicContact CG1-CB 4Å
414	P	94.4	Very high	93.4	Very high	96 Å²	96	53.4 Å²	53.4	62%	0.623	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	87	162.3	30.6	-32.1	0	0	0	108.4	V412	V412-P414 WeakPolarHBondContact O-CD 3.49Å
415	A	91.7	Very high	93.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.273	C	S	.	.			trans	-80	-51.4	-162.3	0	0	0	0	0	112.3	N397 V399 I413 V420 K443 W445	N397-A415 PolarHBondContact O-N 2.7Å; V399-A415 HydrophobicContact CB-CB 4.43Å; V399-A415 HydrophobicContact CG2-CB 3.83Å; I413-A415 VanDerWaalsContact C-N 3.28Å; I413-A415 HydrophobicContact CG2-CB 4.01Å; I413-A415 PolarHBondContact O-N 2.95Å; A415-V420 HydrophobicContact CB-CG2 4.11Å; A415-K443 VanDerWaalsContact O-CD 3.29Å; A415-K443 WeakPolarHBondContact O-CD 3.33Å; A415-K443 PolarHBondContact O-NZ 3Å; A415-W445 VanDerWaalsContact CA-CZ2 3.48Å; A415-W445 HydrophobicContact CB-CZ2 3.93Å; A415-W445 WeakPolarHBondContact O-CZ2 3.26Å
416	H	94.4	Very high	93.4	Very high	14 Å²	14	46.3 Å²	46.3	7%	0.065	25%	0.247	C	C	.	.			trans	-134.5	170.9	-168.3	-75.3	-86.7	0	0	0	112.5	N397 S418 V420 T435 S437 D439 T441	N397-H416 WeakPolarHBondContact CB-O 3.4Å; N397-H416 PolarHBondContact O-N 3.16Å; H416-S418 WeakPolarHBondContact CB-O 3.3Å; H416-V420 HydrophobicContact CB-CG2 4.12Å; H416-T435 PolarHBondContact CD2-OG1 3.22Å; H416-T435 PolarHBondContact NE2-OG1 3Å; H416-S437 WeakPolarHBondContact CB-OG 3.24Å; H416-S437 VanDerWaalsContact ND1-CB 3.26Å; H416-S437 WeakPolarHBondContact ND1-CB 3.2Å; H416-D439 VanDerWaalsContact CB-OD2 3.31Å; H416-D439 WeakPolarHBondContact CB-OD2 3.42Å; H416-D439 IonicContact CE1-OD1 3.73Å; H416-D439 IonicContact CE1-OD2 3.68Å; H416-D439 IonicContact CG-OD2 3.71Å; H416-D439 VanDerWaalsContact ND1-CG 3.33Å; H416-D439 IonicContact ND1-OD1 3.04Å; H416-D439 PolarHBondContact ND1-OD1 3.23Å; H416-D439 IonicContact ND1-OD2 2.95Å; H416-D439 PolarHBondContact ND1-OD2 3.26Å; H416-T441 PolarHBondContact CE1-O 3.1Å; H416-T441 PolarHBondContact CE1-OG1 3.47Å; H416-T441 VanDerWaalsContact CE1-OG1 3.23Å; H416-T441 PolarHBondContact ND1-OG1 3.04Å; H416-T441 VanDerWaalsContact ND1-OG1 3.17Å
417	T	94.6	Very high	93	Very high	113 Å²	113	42.3 Å²	42.3	69%	0.693	23%	0.233	S	C	*	.	S	Bend	trans	-86.2	-14.2	175.2	57.5	0	0	0	0	112.6	N397 D439	N397-T417 PolarHBondContact ND2-O 2.93Å; T417-D439 PolarHBondContact N-OD2 3.06Å; T417-D439 VanDerWaalsContact OG1-CB 3.26Å; T417-D439 WeakPolarHBondContact OG1-CB 3.11Å
418	S	94.9	Very high	92.4	Very high	32 Å²	32	45.2 Å²	45.2	22%	0.224	24%	0.239	C	C	.	.	S	Bend	trans	-138.4	176.2	176.1	79.4	0	0	0	0	110.2	N397 H416 V420 S437 F438 D439	N397-S418 WeakPolarHBondContact OD1-CA 3.37Å; N397-S418 PolarHBondContact OD1-O 3.35Å; H416-S418 WeakPolarHBondContact CB-O 3.3Å; S418-V420 PolarHBondContact O-N 3.5Å; S418-S437 PolarHBondContact O-OG 3Å; S418-S437 PolarHBondContact OG-OG 3.28Å; S418-S437 VanDerWaalsContact OG-OG 3.11Å; S418-F438 WeakPolarHBondContact OG-CA 3.19Å; S418-F438 WeakPolarHBondContact OG-CB 3.22Å; S418-D439 PolarHBondContact OG-N 3.41Å
419	V	95.3	Very high	91.5	Very high	33 Å²	33	43.1 Å²	43.1	20%	0.2	23%	0.231	C	C	.	.			trans	-36	128.2	-179.5	173	0	0	0	0	112.6	L379 A395 N397 S437 F438	L379-V419 HydrophobicContact CD1-CG1 3.21Å; A395-V419 HydrophobicContact CB-CG1 4.18Å; A395-V419 HydrophobicContact CB-CG2 3.99Å; N397-V419 PolarHBondContact OD1-N 2.9Å; V419-S437 VanDerWaalsContact O-CA 3.29Å; V419-S437 WeakPolarHBondContact O-CA 3.31Å; V419-S437 WeakPolarHBondContact O-CB 3.48Å; V419-S437 PolarHBondContact O-OG 3.25Å; V419-F438 HydrophobicContact CB-CD2 3.67Å; V419-F438 HydrophobicContact CB-CE2 4.12Å; V419-F438 HydrophobicContact CB-CG 4.3Å; V419-F438 HydrophobicContact CG1-CD2 3.83Å; V419-F438 HydrophobicContact CG1-CE2 3.77Å; V419-F438 HydrophobicContact CG1-CZ 4.46Å; V419-F438 HydrophobicContact CG2-CD2 4.32Å; V419-F438 PolarHBondContact O-N 2.9Å; V419-F438 VanDerWaalsContact O-N 3.12Å
420	V	96.2	Very high	90.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	113.4	174.1	-173	0	0	0	0	108.2	S393 S394 V399 A415 H416 S418 V423 S436	S393-V420 VanDerWaalsContact CB-CG1 3.47Å; S394-V420 PolarHBondContact O-N 3.37Å; V399-V420 HydrophobicContact CG2-CB 4.34Å; V399-V420 HydrophobicContact CG2-CG1 3.77Å; V399-V420 HydrophobicContact CG2-CG2 4.23Å; A415-V420 HydrophobicContact CB-CG2 4.11Å; H416-V420 HydrophobicContact CB-CG2 4.12Å; S418-V420 PolarHBondContact O-N 3.5Å; V420-V423 HydrophobicContact CG1-CG2 4.32Å; V420-S436 CarbonylContact C-O 3.52Å; V420-S436 WeakPolarHBondContact CA-O 3.39Å; V420-S436 WeakPolarHBondContact CG1-O 3.46Å
421	S	94	Very high	90.5	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-28	-171.8	52.5	0	0	0	0	113.8	L379 S436 V463 V464	L379-S421 VanDerWaalsContact O-O 3.12Å; S421-S436 PolarHBondContact N-O 3.41Å; S421-S436 PolarHBondContact OG-O 3.44Å; S421-S436 PolarHBondContact OG-OG 2.97Å; S421-V463 PolarHBondContact OG-O 3.44Å; S421-V464 WeakPolarHBondContact CB-O 3.39Å; S421-V464 PolarHBondContact OG-O 3.47Å
422	S	94.4	Very high	90.4	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.014	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	154.4	176	86.4	0	0	0	0	112.7	T435 S436 A466	S422-T435 WeakPolarHBondContact O-CA 3.38Å; S422-S436 WeakPolarHBondContact CB-OG 3.45Å; S422-S436 PolarHBondContact N-OG 3.14Å; S422-S436 PolarHBondContact O-N 2.85Å; S422-S436 PolarHBondContact OG-OG 3.38Å; S422-A466 PolarHBondContact OG-N 3.44Å; S422-A466 VanDerWaalsContact OG-N 3.11Å
423	V	94.9	Very high	90.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134.7	173.5	174	0	0	0	0	108.1	D382 A391 S393 V399 V420 I433 V434 T435	D382-V423 WeakPolarHBondContact CB-O 3.31Å; A391-V423 HydrophobicContact CB-CG1 3.68Å; S393-V423 WeakPolarHBondContact OG-CG2 3.18Å; V399-V423 HydrophobicContact CB-CG2 4.47Å; V399-V423 HydrophobicContact CG1-CG1 4.4Å; V399-V423 HydrophobicContact CG1-CG2 3.82Å; V399-V423 HydrophobicContact CG2-CG2 3.76Å; V420-V423 HydrophobicContact CG1-CG2 4.32Å; V423-I433 HydrophobicContact CG1-CG2 3.59Å; V423-V434 WeakPolarHBondContact CA-O 3.45Å; V423-T435 HydrophobicContact CG2-CG2 4.19Å
424	R	95	Very high	90.4	Very high	16 Å²	16	30.7 Å²	30.7	6%	0.06	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	132.3	173.1	-72.7	-64.8	174.5	-124.1	23.1	112.1	R206 A381 D382 I433 V434 Y465 A466 I468	R206-R424 VanDerWaalsContact NH1-CD 3.34Å; A381-R424 PolarHBondContact O-NH1 3.32Å; D382-R424 IonicContact OD1-NH1 2.83Å; D382-R424 VanDerWaalsContact OD2-CA 3.28Å; D382-R424 WeakPolarHBondContact OD2-CA 3.25Å; D382-R424 WeakPolarHBondContact OD2-CD 3.49Å; R424-I433 CarbonylContact O-C 3.52Å; R424-I433 WeakPolarHBondContact O-CA 3.16Å; R424-V434 PolarHBondContact N-O 3.37Å; R424-V434 PolarHBondContact O-N 2.83Å; R424-Y465 PolarHBondContact NE-OH 3.09Å; R424-Y465 VanDerWaalsContact NE-OH 3.1Å; R424-Y465 PolarHBondContact NH2-OH 3.42Å; R424-A466 WeakPolarHBondContact CG-O 3.42Å; R424-I468 HydrophobicContact CB-CD1 4.27Å
425	F	93.1	Very high	90.5	Very high	14 Å²	14	26.1 Å²	26.1	6%	0.061	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	148.3	170.7	-77.2	-81.7	0	0	0	110.9	D382 A384 H389 A391 S427 I433 W450	D382-F425 HydrophobicContact CB-CD2 3.77Å; D382-F425 HydrophobicContact CB-CE2 4.29Å; D382-F425 WeakPolarHBondContact O-CE2 3.42Å; D382-F425 PolarHBondContact OD2-N 3.12Å; A384-F425 HydrophobicContact CB-CB 4.41Å; A384-F425 HydrophobicContact CB-CD1 3.76Å; A384-F425 HydrophobicContact CB-CD2 4.07Å; A384-F425 HydrophobicContact CB-CE1 3.92Å; A384-F425 HydrophobicContact CB-CE2 4.25Å; A384-F425 HydrophobicContact CB-CG 3.84Å; A384-F425 HydrophobicContact CB-CZ 4.18Å; H389-F425 HydrophobicContact CB-CE1 4.37Å; H389-F425 HydrophobicContact CB-CZ 4.18Å; A391-F425 HydrophobicContact CB-CE2 3.44Å; A391-F425 VanDerWaalsContact CB-CE2 3.44Å; A391-F425 HydrophobicContact CB-CZ 3.53Å; F425-S427 PolarHBondContact O-N 3.19Å; F425-I433 HydrophobicContact CD1-CD1 3.97Å; F425-I433 HydrophobicContact CD1-CG1 3.38Å; F425-I433 HydrophobicContact CE1-CD1 3.32Å; F425-I433 HydrophobicContact CE1-CG1 3.3Å; F425-I433 HydrophobicContact CE2-CD1 4.45Å; F425-I433 HydrophobicContact CG-CG1 4.11Å; F425-I433 HydrophobicContact CZ-CD1 3.6Å; F425-I433 HydrophobicContact CZ-CG1 3.95Å; F425-W450 AromaticContact CE1-CH2 3.96Å; F425-W450 HydrophobicContact CE1-CH2 3.96Å
426	E	90.9	Very high	90.6	Very high	5 Å²	5	26.1 Å²	26.1	2%	0.023	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-60.4	132	166.8	-173.5	-164.9	-162.5	0	0	111.2	S431 Y432 N472	E426-S431 WeakPolarHBondContact OE2-CA 3.36Å; E426-S431 WeakPolarHBondContact OE2-CB 3.27Å; E426-S431 PolarHBondContact OE2-N 2.81Å; E426-S431 PolarHBondContact OE2-OG 2.68Å; E426-Y432 HydrophobicContact CB-CD1 3.78Å; E426-Y432 HydrophobicContact CB-CE1 3.55Å; E426-Y432 HydrophobicContact CB-CE2 4.46Å; E426-Y432 HydrophobicContact CB-CG 4.31Å; E426-Y432 HydrophobicContact CG-CD1 3.97Å; E426-Y432 HydrophobicContact CG-CE1 3.34Å; E426-Y432 PolarHBondContact N-O 3.11Å; E426-N472 VanDerWaalsContact CD-ND2 3.34Å; E426-N472 HydrophobicContact CG-CB 4.3Å; E426-N472 VanDerWaalsContact CG-CG 3.41Å; E426-N472 WeakPolarHBondContact CG-ND2 3.45Å; E426-N472 WeakPolarHBondContact CG-OD1 3.36Å; E426-N472 PolarHBondContact OE1-ND2 2.91Å
427	S	82.6	Confident	90.7	Very high	37 Å²	37	25.4 Å²	25.4	26%	0.259	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	145.9	173	-169.7	0	0	0	0	111.7	D385 F425 N429 N472	D385-S427 WeakPolarHBondContact OD2-CA 3.43Å; D385-S427 PolarHBondContact OD2-OG 2.99Å; F425-S427 PolarHBondContact O-N 3.19Å; S427-N429 VanDerWaalsContact C-N 3.27Å; S427-N429 PolarHBondContact O-N 3.15Å; S427-N472 PolarHBondContact O-ND2 2.98Å
428	R	75.9	Confident	90.8	Very high	180 Å²	180	22.9 Å²	22.9	68%	0.679	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	-55.1	177	-51.6	-178.9	179.7	179.4	3	116.2	D385	D385-R428 PolarHBondContact OD2-N 3.18Å
429	N	72.3	Confident	90.8	Very high	78 Å²	78	22.8 Å²	22.8	42%	0.417	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-18	-170.7	-70.8	-19.8	0	0	0	113.9	S427 S431	S427-N429 VanDerWaalsContact C-N 3.27Å; S427-N429 PolarHBondContact O-N 3.15Å; N429-S431 PolarHBondContact O-N 3.48Å; N429-S431 VanDerWaalsContact O-N 3.17Å; N429-S431 PolarHBondContact O-OG 2.97Å
430	C	77.6	Confident	90.7	Very high	7 Å²	7	26.2 Å²	26.2	5%	0.047	12%	0.121	C	C	.	.			trans	50.6	35.9	179.9	-57.8	0	0	0	0	113.7	A384 D385 N386 H447	A384-C430 HydrophobicContact CB-CB 4.42Å; D385-C430 PolarHBondContact N-SG 3.42Å; D385-C430 VanDerWaalsContact N-SG 3.39Å; N386-C430 HydrophobicContact CB-CB 4.41Å; N386-C430 PolarHBondContact N-SG 3.4Å; C430-H447 PolarHBondContact O-CD2 3.44Å
431	S	84.8	Confident	90.7	Very high	12 Å²	12	27.2 Å²	27.2	8%	0.084	13%	0.128	C	C	.	.			trans	-87	-20.1	-173.8	-52.6	0	0	0	0	112.9	E426 N429 H447	E426-S431 WeakPolarHBondContact OE2-CA 3.36Å; E426-S431 WeakPolarHBondContact OE2-CB 3.27Å; E426-S431 PolarHBondContact OE2-N 2.81Å; E426-S431 PolarHBondContact OE2-OG 2.68Å; N429-S431 PolarHBondContact O-N 3.48Å; N429-S431 VanDerWaalsContact O-N 3.17Å; N429-S431 PolarHBondContact O-OG 2.97Å; S431-H447 VanDerWaalsContact O-CB 3.29Å; S431-H447 WeakPolarHBondContact O-CB 3.2Å; S431-H447 PolarHBondContact O-N 2.89Å
432	Y	91.5	Very high	90.8	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.008	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	163.2	178.5	66.8	-82.4	0	0	0	112.4	L186 E426 V434 I444 W445 I468 I475 K489	L186-Y432 HydrophobicContact CD1-CD1 3.51Å; L186-Y432 HydrophobicContact CD1-CE1 4.18Å; L186-Y432 HydrophobicContact CD1-CG 3.74Å; L186-Y432 HydrophobicContact CD2-CD1 3.86Å; L186-Y432 HydrophobicContact CD2-CD2 4.37Å; L186-Y432 HydrophobicContact CD2-CE1 3.69Å; L186-Y432 HydrophobicContact CD2-CE2 4.18Å; L186-Y432 HydrophobicContact CD2-CG 4.21Å; L186-Y432 HydrophobicContact CG-CD1 4.31Å; E426-Y432 HydrophobicContact CB-CD1 3.78Å; E426-Y432 HydrophobicContact CB-CE1 3.55Å; E426-Y432 HydrophobicContact CB-CE2 4.46Å; E426-Y432 HydrophobicContact CB-CG 4.31Å; E426-Y432 HydrophobicContact CG-CD1 3.97Å; E426-Y432 HydrophobicContact CG-CE1 3.34Å; E426-Y432 PolarHBondContact N-O 3.11Å; Y432-V434 HydrophobicContact CD2-CG2 3.89Å; Y432-V434 HydrophobicContact CE2-CG2 3.63Å; Y432-I444 HydrophobicContact CD2-CG2 3.64Å; Y432-I444 HydrophobicContact CE2-CG2 4.38Å; Y432-I444 HydrophobicContact CG-CG2 4.07Å; Y432-W445 CarbonylContact C-O 3.53Å; Y432-W445 WeakPolarHBondContact CA-O 3.34Å; Y432-W445 WeakPolarHBondContact CB-O 3.5Å; Y432-I468 HydrophobicContact CD2-CD1 4.49Å; Y432-I468 HydrophobicContact CE2-CD1 3.76Å; Y432-I468 HydrophobicContact CE2-CG1 4.47Å; Y432-I468 VanDerWaalsContact OH-CG2 3.28Å; Y432-I468 WeakPolarHBondContact OH-CG2 3.39Å; Y432-I475 HydrophobicContact CE2-CD1 4.37Å; Y432-K489 PolarHBondContact OH-NZ 3.05Å
433	I	94.3	Very high	90.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	143.1	170.2	-69.1	169.8	0	0	0	108.4	A391 I401 V423 R424 F425 T435 I444 W445 W450	A391-I433 HydrophobicContact CB-CD1 4.23Å; I401-I433 HydrophobicContact CD1-CD1 4.24Å; I401-I433 HydrophobicContact CG1-CD1 4.17Å; V423-I433 HydrophobicContact CG1-CG2 3.59Å; R424-I433 CarbonylContact O-C 3.52Å; R424-I433 WeakPolarHBondContact O-CA 3.16Å; F425-I433 HydrophobicContact CD1-CD1 3.97Å; F425-I433 HydrophobicContact CD1-CG1 3.38Å; F425-I433 HydrophobicContact CE1-CD1 3.32Å; F425-I433 HydrophobicContact CE1-CG1 3.3Å; F425-I433 HydrophobicContact CE2-CD1 4.45Å; F425-I433 HydrophobicContact CG-CG1 4.11Å; F425-I433 HydrophobicContact CZ-CD1 3.6Å; F425-I433 HydrophobicContact CZ-CG1 3.95Å; I433-T435 HydrophobicContact CG2-CG2 3.92Å; I433-I444 CarbonylContact O-C 3.53Å; I433-I444 WeakPolarHBondContact O-CA 3.34Å; I433-W445 HydrophobicContact CB-CB 4.45Å; I433-W445 PolarHBondContact N-O 2.94Å; I433-W445 PolarHBondContact O-N 3.15Å; I433-W450 HydrophobicContact CB-CZ3 4.28Å; I433-W450 HydrophobicContact CD1-CE3 3.82Å; I433-W450 HydrophobicContact CD1-CH2 3.5Å; I433-W450 VanDerWaalsContact CD1-CH2 3.5Å; I433-W450 HydrophobicContact CD1-CZ2 4.42Å; I433-W450 HydrophobicContact CD1-CZ3 3.15Å; I433-W450 HydrophobicContact CG1-CE3 4.42Å; I433-W450 HydrophobicContact CG1-CH2 4.04Å; I433-W450 HydrophobicContact CG1-CZ3 3.53Å
434	V	94.9	Very high	90.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.6	166.2	179.8	0	0	0	0	108.8	V423 R424 Y432 K443 I444 A466 I468 I475	V423-V434 WeakPolarHBondContact CA-O 3.45Å; R424-V434 PolarHBondContact N-O 3.37Å; R424-V434 PolarHBondContact O-N 2.83Å; Y432-V434 HydrophobicContact CD2-CG2 3.89Å; Y432-V434 HydrophobicContact CE2-CG2 3.63Å; V434-K443 WeakPolarHBondContact CA-O 3.22Å; V434-I444 HydrophobicContact CG2-CG1 4.37Å; V434-A466 HydrophobicContact CG1-CB 3.74Å; V434-I468 HydrophobicContact CB-CD1 4.15Å; V434-I468 HydrophobicContact CB-CG1 4.38Å; V434-I468 HydrophobicContact CG2-CD1 3.62Å; V434-I468 HydrophobicContact CG2-CG1 3.86Å; V434-I475 HydrophobicContact CG1-CG2 4.25Å; V434-I475 HydrophobicContact CG2-CD1 4.01Å; V434-I475 HydrophobicContact CG2-CG2 4.47Å
435	T	96.4	Very high	90.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.5	174.2	61.5	0	0	0	0	109.7	V399 H416 S422 V423 I433 T442 K443 W445	V399-T435 HydrophobicContact CG2-CG2 3.91Å; H416-T435 PolarHBondContact CD2-OG1 3.22Å; H416-T435 PolarHBondContact NE2-OG1 3Å; S422-T435 WeakPolarHBondContact O-CA 3.38Å; V423-T435 HydrophobicContact CG2-CG2 4.19Å; I433-T435 HydrophobicContact CG2-CG2 3.92Å; T435-T442 CarbonylContact O-C 3.53Å; T435-T442 WeakPolarHBondContact O-CA 3.38Å; T435-T442 WeakPolarHBondContact O-CB 3.35Å; T435-K443 PolarHBondContact N-O 3.12Å; T435-K443 PolarHBondContact O-N 3.18Å; T435-K443 PolarHBondContact OG1-O 3Å; T435-W445 PolarHBondContact OG1-NE1 3.39Å
436	S	95.4	Very high	90.7	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146	172.5	72.7	0	0	0	0	111.1	V420 S421 S422	V420-S436 CarbonylContact C-O 3.52Å; V420-S436 WeakPolarHBondContact CA-O 3.39Å; V420-S436 WeakPolarHBondContact CG1-O 3.46Å; S421-S436 PolarHBondContact N-O 3.41Å; S421-S436 PolarHBondContact OG-O 3.44Å; S421-S436 PolarHBondContact OG-OG 2.97Å; S422-S436 WeakPolarHBondContact CB-OG 3.45Å; S422-S436 PolarHBondContact N-OG 3.14Å; S422-S436 PolarHBondContact O-N 2.85Å; S422-S436 PolarHBondContact OG-OG 3.38Å
437	S	96.4	Very high	90.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	160.5	-176.1	175.9	0	0	0	0	113	H416 S418 V419 D439 K440 T441 V463	H416-S437 WeakPolarHBondContact CB-OG 3.24Å; H416-S437 VanDerWaalsContact ND1-CB 3.26Å; H416-S437 WeakPolarHBondContact ND1-CB 3.2Å; S418-S437 PolarHBondContact O-OG 3Å; S418-S437 PolarHBondContact OG-OG 3.28Å; S418-S437 VanDerWaalsContact OG-OG 3.11Å; V419-S437 VanDerWaalsContact O-CA 3.29Å; V419-S437 WeakPolarHBondContact O-CA 3.31Å; V419-S437 WeakPolarHBondContact O-CB 3.48Å; V419-S437 PolarHBondContact O-OG 3.25Å; S437-D439 WeakPolarHBondContact CB-OD1 3.35Å; S437-D439 PolarHBondContact O-N 3.45Å; S437-D439 PolarHBondContact OG-N 2.96Å; S437-K440 PolarHBondContact O-N 2.72Å; S437-T441 PolarHBondContact N-O 3.38Å; S437-V463 CarbonylContact C-O 3.56Å; S437-V463 PolarHBondContact O-N 2.79Å; S437-V463 VanDerWaalsContact O-N 3.12Å
438	F	95.4	Very high	90.5	Very high	59 Å²	59	30.7 Å²	30.7	26%	0.259	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-0.3	170.9	-63	-11.6	0	0	0	113.8	S418 V419 K440 K462 V463	S418-F438 WeakPolarHBondContact OG-CA 3.19Å; S418-F438 WeakPolarHBondContact OG-CB 3.22Å; V419-F438 HydrophobicContact CB-CD2 3.67Å; V419-F438 HydrophobicContact CB-CE2 4.12Å; V419-F438 HydrophobicContact CB-CG 4.3Å; V419-F438 HydrophobicContact CG1-CD2 3.83Å; V419-F438 HydrophobicContact CG1-CE2 3.77Å; V419-F438 HydrophobicContact CG1-CZ 4.46Å; V419-F438 HydrophobicContact CG2-CD2 4.32Å; V419-F438 PolarHBondContact O-N 2.9Å; V419-F438 VanDerWaalsContact O-N 3.12Å; F438-K440 PolarHBondContact O-N 3.11Å; F438-K462 HydrophobicContact CB-CB 4.12Å; F438-K462 HydrophobicContact CB-CD 3.93Å; F438-K462 HydrophobicContact CB-CG 3.85Å; F438-K462 HydrophobicContact CD1-CB 3.73Å; F438-K462 HydrophobicContact CD1-CD 4.13Å; F438-K462 HydrophobicContact CD1-CG 4.26Å; F438-K462 HydrophobicContact CD2-CD 4.17Å; F438-K462 HydrophobicContact CE1-CB 4.47Å; F438-K462 HydrophobicContact CG-CB 4.1Å; F438-K462 HydrophobicContact CG-CD 3.82Å; F438-K462 HydrophobicContact CG-CG 4.12Å; F438-V463 WeakPolarHBondContact CD1-O 3.45Å
439	D	94.6	Very high	90.9	Very high	30 Å²	30	28.1 Å²	28.1	16%	0.16	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	7.7	173.8	71.4	4.4	0	0	0	112.8	H416 T417 S418 S437 T441	H416-D439 VanDerWaalsContact CB-OD2 3.31Å; H416-D439 WeakPolarHBondContact CB-OD2 3.42Å; H416-D439 IonicContact CE1-OD1 3.73Å; H416-D439 IonicContact CE1-OD2 3.68Å; H416-D439 IonicContact CG-OD2 3.71Å; H416-D439 VanDerWaalsContact ND1-CG 3.33Å; H416-D439 IonicContact ND1-OD1 3.04Å; H416-D439 PolarHBondContact ND1-OD1 3.23Å; H416-D439 IonicContact ND1-OD2 2.95Å; H416-D439 PolarHBondContact ND1-OD2 3.26Å; T417-D439 PolarHBondContact N-OD2 3.06Å; T417-D439 VanDerWaalsContact OG1-CB 3.26Å; T417-D439 WeakPolarHBondContact OG1-CB 3.11Å; S418-D439 PolarHBondContact OG-N 3.41Å; S437-D439 WeakPolarHBondContact CB-OD1 3.35Å; S437-D439 PolarHBondContact O-N 3.45Å; S437-D439 PolarHBondContact OG-N 2.96Å; D439-T441 VanDerWaalsContact CG-OG1 3.23Å; D439-T441 PolarHBondContact O-N 3.29Å; D439-T441 WeakPolarHBondContact OD1-CA 3.49Å; D439-T441 WeakPolarHBondContact OD1-CB 3.4Å; D439-T441 PolarHBondContact OD1-N 2.99Å; D439-T441 PolarHBondContact OD1-OG1 3.34Å; D439-T441 PolarHBondContact OD2-OG1 3.34Å
440	K	94.8	Very high	91.6	Very high	105 Å²	105	24.9 Å²	24.9	46%	0.457	13%	0.126	S	C	.	.	S	Bend	trans	71.8	4.9	-178.9	-42.5	178.3	-178.3	-166.5	0	114.1	S437 F438 N460	S437-K440 PolarHBondContact O-N 2.72Å; F438-K440 PolarHBondContact O-N 3.11Å; K440-N460 WeakPolarHBondContact CD-O 3.5Å; K440-N460 WeakPolarHBondContact CE-O 3.47Å; K440-N460 PolarHBondContact NZ-O 3.02Å
441	T	95.7	Very high	92.2	Very high	22 Å²	22	27.4 Å²	27.4	14%	0.135	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	153.8	179.2	75.5	0	0	0	0	111	H416 S437 D439 E457	H416-T441 PolarHBondContact CE1-O 3.1Å; H416-T441 PolarHBondContact CE1-OG1 3.47Å; H416-T441 VanDerWaalsContact CE1-OG1 3.23Å; H416-T441 PolarHBondContact ND1-OG1 3.04Å; H416-T441 VanDerWaalsContact ND1-OG1 3.17Å; S437-T441 PolarHBondContact N-O 3.38Å; D439-T441 VanDerWaalsContact CG-OG1 3.23Å; D439-T441 PolarHBondContact O-N 3.29Å; D439-T441 WeakPolarHBondContact OD1-CA 3.49Å; D439-T441 WeakPolarHBondContact OD1-CB 3.4Å; D439-T441 PolarHBondContact OD1-N 2.99Å; D439-T441 PolarHBondContact OD1-OG1 3.34Å; D439-T441 PolarHBondContact OD2-OG1 3.34Å; T441-E457 HydrophobicContact CG2-CG 4.08Å
442	T	95.6	Very high	92.6	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.4	159.7	58	0	0	0	0	108.7	T435 L456 V463 A466 T477	T435-T442 CarbonylContact O-C 3.53Å; T435-T442 WeakPolarHBondContact O-CA 3.38Å; T435-T442 WeakPolarHBondContact O-CB 3.35Å; T442-L456 PolarHBondContact N-O 2.96Å; T442-L456 VanDerWaalsContact N-O 3.15Å; T442-L456 WeakPolarHBondContact O-CB 3.41Å; T442-L456 PolarHBondContact O-N 3.29Å; T442-L456 VanDerWaalsContact OG1-CB 3.27Å; T442-L456 WeakPolarHBondContact OG1-CB 3.44Å; T442-L456 WeakPolarHBondContact OG1-CD1 3.49Å; T442-V463 HydrophobicContact CG2-CB 4.02Å; T442-V463 HydrophobicContact CG2-CG1 3.55Å; T442-V463 HydrophobicContact CG2-CG2 4.09Å; T442-A466 HydrophobicContact CG2-CB 4.46Å; T442-T477 HydrophobicContact CG2-CG2 3.66Å
443	K	95.5	Very high	92.6	Very high	37 Å²	37	31.9 Å²	31.9	16%	0.161	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.5	-173.9	-67.7	-179.2	-173	174.6	0	110.4	A415 V434 T435 W445 T455	A415-K443 VanDerWaalsContact O-CD 3.29Å; A415-K443 WeakPolarHBondContact O-CD 3.33Å; A415-K443 PolarHBondContact O-NZ 3Å; V434-K443 WeakPolarHBondContact CA-O 3.22Å; T435-K443 PolarHBondContact N-O 3.12Å; T435-K443 PolarHBondContact O-N 3.18Å; T435-K443 PolarHBondContact OG1-O 3Å; K443-W445 HydrophobicContact CB-CZ2 4.03Å; K443-W445 HydrophobicContact CD-CH2 4.47Å; K443-W445 HydrophobicContact CD-CZ2 3.75Å; K443-T455 HydrophobicContact CD-CG2 4.31Å; K443-T455 HydrophobicContact CG-CG2 4.05Å
444	I	95	Very high	92.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.3	175.8	-54.8	-177.5	0	0	0	108.3	L186 T189 Y432 I433 V434 I453 K454 L456 I475	L186-I444 HydrophobicContact CD1-CG2 4.36Å; L186-I444 HydrophobicContact CD2-CG2 4.42Å; T189-I444 HydrophobicContact CG2-CD1 3.97Å; Y432-I444 HydrophobicContact CD2-CG2 3.64Å; Y432-I444 HydrophobicContact CE2-CG2 4.38Å; Y432-I444 HydrophobicContact CG-CG2 4.07Å; I433-I444 CarbonylContact O-C 3.53Å; I433-I444 WeakPolarHBondContact O-CA 3.34Å; V434-I444 HydrophobicContact CG2-CG1 4.37Å; I444-I453 HydrophobicContact CG2-CB 4.38Å; I444-I453 HydrophobicContact CG2-CD1 4.37Å; I444-I453 PolarHBondContact O-N 2.74Å; I444-K454 HydrophobicContact CD1-CB 4.47Å; I444-K454 PolarHBondContact N-O 2.99Å; I444-L456 HydrophobicContact CD1-CD1 4.19Å; I444-L456 HydrophobicContact CD1-CD2 4.39Å; I444-L456 HydrophobicContact CD1-CG 4.39Å; I444-L456 HydrophobicContact CG1-CD1 4.3Å; I444-L456 HydrophobicContact CG1-CG 4.46Å; I444-I475 HydrophobicContact CD1-CD1 3.71Å; I444-I475 HydrophobicContact CG1-CD1 4.39Å
445	W	93.8	Very high	92.6	Very high	13 Å²	13	38.1 Å²	38.1	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126	-178.6	-55.2	88.3	0	0	0	110.6	I413 A415 Y432 I433 T435 K443 W450 T451 P452	I413-W445 HydrophobicContact CD1-CB 4.43Å; I413-W445 HydrophobicContact CD1-CD2 4.38Å; I413-W445 HydrophobicContact CD1-CG 4.28Å; I413-W445 HydrophobicContact CG2-CD2 3.8Å; I413-W445 HydrophobicContact CG2-CE3 3.62Å; I413-W445 HydrophobicContact CG2-CH2 3.57Å; I413-W445 HydrophobicContact CG2-CZ2 3.77Å; I413-W445 HydrophobicContact CG2-CZ3 3.49Å; I413-W445 VanDerWaalsContact CG2-CZ3 3.49Å; A415-W445 VanDerWaalsContact CA-CZ2 3.48Å; A415-W445 HydrophobicContact CB-CZ2 3.93Å; A415-W445 WeakPolarHBondContact O-CZ2 3.26Å; Y432-W445 CarbonylContact C-O 3.53Å; Y432-W445 WeakPolarHBondContact CA-O 3.34Å; Y432-W445 WeakPolarHBondContact CB-O 3.5Å; I433-W445 HydrophobicContact CB-CB 4.45Å; I433-W445 PolarHBondContact N-O 2.94Å; I433-W445 PolarHBondContact O-N 3.15Å; T435-W445 PolarHBondContact OG1-NE1 3.39Å; K443-W445 HydrophobicContact CB-CZ2 4.03Å; K443-W445 HydrophobicContact CD-CH2 4.47Å; K443-W445 HydrophobicContact CD-CZ2 3.75Å; W445-W450 HydrophobicContact CB-CE3 4.46Å; W445-T451 WeakPolarHBondContact CA-O 3.48Å; W445-P452 HydrophobicContact CE3-CB 3.88Å; W445-P452 HydrophobicContact CE3-CG 4.44Å; W445-P452 HydrophobicContact CH2-CB 4.01Å; W445-P452 HydrophobicContact CH2-CG 4.48Å; W445-P452 HydrophobicContact CZ3-CB 3.59Å; W445-P452 HydrophobicContact CZ3-CG 3.89Å
446	G	90.4	Very high	92.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.6	-179.9	0	0	0	0	0	113.2	W450 T451	G446-W450 WeakPolarHBondContact O-CA 3.35Å; G446-W450 PolarHBondContact O-N 3.49Å; G446-T451 PolarHBondContact N-O 3.16Å
447	H	86.7	Confident	92.3	Very high	26 Å²	26	44.5 Å²	44.5	12%	0.12	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	142.6	166.4	-176.6	63.9	0	0	0	109.1	L179 H389 C430 S431 W450	L179-H447 WeakPolarHBondContact CD1-O 3.5Å; H389-H447 AromaticContact CD2-CE1 3.5Å; H389-H447 PolarHBondContact CD2-CE1 2.76Å; H389-H447 VanDerWaalsContact CD2-CE1 3.5Å; H389-H447 AromaticContact CD2-ND1 3.97Å; H389-H447 AromaticContact NE2-CE1 3.02Å; H389-H447 PolarHBondContact NE2-CE1 2.88Å; H389-H447 AromaticContact NE2-ND1 3.82Å; H389-H447 AromaticContact NE2-NE2 3.78Å; C430-H447 PolarHBondContact O-CD2 3.44Å; S431-H447 VanDerWaalsContact O-CB 3.29Å; S431-H447 WeakPolarHBondContact O-CB 3.2Å; S431-H447 PolarHBondContact O-N 2.89Å; H447-W450 HydrophobicContact CB-CE3 4.42Å; H447-W450 HydrophobicContact CB-CH2 3.72Å; H447-W450 HydrophobicContact CB-CZ2 4.31Å; H447-W450 HydrophobicContact CB-CZ3 3.76Å; H447-W450 AromaticContact CE1-CZ2 3.89Å; H447-W450 AromaticContact CG-CH2 3.76Å; H447-W450 AromaticContact CG-CZ2 3.98Å; H447-W450 AromaticContact ND1-CE2 3.68Å; H447-W450 AromaticContact ND1-CH2 3.22Å; H447-W450 WeakPolarHBondContact ND1-CH2 3.46Å; H447-W450 AromaticContact ND1-CZ2 3Å; H447-W450 WeakPolarHBondContact ND1-CZ2 3.27Å
448	P	82.5	Confident	92	Very high	73 Å²	73	46 Å²	46	47%	0.474	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	cis	-95.5	-8.8	5.3	37	-36.1	0	0	0	116.5	W450	P448-W450 VanDerWaalsContact C-N 3.33Å; P448-W450 PolarHBondContact O-NE1 3.48Å
449	I	84.7	Confident	91.9	Very high	125 Å²	125	43.7 Å²	43.7	64%	0.641	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-14.2	-173	-50.6	175.6	0	0	0	111.4	T451	I449-T451 VanDerWaalsContact C-N 3.28Å; I449-T451 HydrophobicContact CB-CG2 3.99Å; I449-T451 HydrophobicContact CG2-CG2 3.62Å; I449-T451 PolarHBondContact O-N 3.22Å
450	W	87.9	Confident	91.8	Very high	10 Å²	10	48.4 Å²	48.4	4%	0.038	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	39.1	-177	-51.7	113.1	0	0	0	113.1	I401 Y411 I413 F425 I433 W445 G446 H447 P448	I401-W450 HydrophobicContact CD1-CB 4.39Å; I401-W450 HydrophobicContact CD1-CD2 3.24Å; I401-W450 HydrophobicContact CD1-CE3 3.8Å; I401-W450 HydrophobicContact CD1-CG 3.51Å; I401-W450 HydrophobicContact CD1-CH2 4.19Å; I401-W450 HydrophobicContact CD1-CZ2 3.67Å; I401-W450 HydrophobicContact CD1-CZ3 4.27Å; I401-W450 HydrophobicContact CG1-CZ2 4.21Å; I401-W450 HydrophobicContact CG2-CZ2 3.89Å; Y411-W450 HydrophobicContact CD1-CB 3.73Å; Y411-W450 AromaticContact CD1-CD1 3.76Å; Y411-W450 AromaticContact CD1-CG 3.99Å; Y411-W450 HydrophobicContact CD1-CG 3.99Å; Y411-W450 HydrophobicContact CE1-CB 3.81Å; Y411-W450 AromaticContact CG-CD1 3.84Å; I413-W450 HydrophobicContact CD1-CB 3.92Å; I413-W450 HydrophobicContact CD1-CD2 4.39Å; I413-W450 HydrophobicContact CD1-CE3 4.3Å; I413-W450 HydrophobicContact CD1-CG 4.26Å; I413-W450 HydrophobicContact CG1-CB 4Å; F425-W450 AromaticContact CE1-CH2 3.96Å; F425-W450 HydrophobicContact CE1-CH2 3.96Å; I433-W450 HydrophobicContact CB-CZ3 4.28Å; I433-W450 HydrophobicContact CD1-CE3 3.82Å; I433-W450 HydrophobicContact CD1-CH2 3.5Å; I433-W450 VanDerWaalsContact CD1-CH2 3.5Å; I433-W450 HydrophobicContact CD1-CZ2 4.42Å; I433-W450 HydrophobicContact CD1-CZ3 3.15Å; I433-W450 HydrophobicContact CG1-CE3 4.42Å; I433-W450 HydrophobicContact CG1-CH2 4.04Å; I433-W450 HydrophobicContact CG1-CZ3 3.53Å; W445-W450 HydrophobicContact CB-CE3 4.46Å; G446-W450 WeakPolarHBondContact O-CA 3.35Å; G446-W450 PolarHBondContact O-N 3.49Å; H447-W450 HydrophobicContact CB-CE3 4.42Å; H447-W450 HydrophobicContact CB-CH2 3.72Å; H447-W450 HydrophobicContact CB-CZ2 4.31Å; H447-W450 HydrophobicContact CB-CZ3 3.76Å; H447-W450 AromaticContact CE1-CZ2 3.89Å; H447-W450 AromaticContact CG-CH2 3.76Å; H447-W450 AromaticContact CG-CZ2 3.98Å; H447-W450 AromaticContact ND1-CE2 3.68Å; H447-W450 AromaticContact ND1-CH2 3.22Å; H447-W450 WeakPolarHBondContact ND1-CH2 3.46Å; H447-W450 AromaticContact ND1-CZ2 3Å; H447-W450 WeakPolarHBondContact ND1-CZ2 3.27Å; P448-W450 VanDerWaalsContact C-N 3.33Å; P448-W450 PolarHBondContact O-NE1 3.48Å
451	T	90.9	Very high	91.8	Very high	61 Å²	61	45 Å²	45	37%	0.374	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	141.6	175.2	53.6	0	0	0	0	110.9	W445 G446 I449 I453	W445-T451 WeakPolarHBondContact CA-O 3.48Å; G446-T451 PolarHBondContact N-O 3.16Å; I449-T451 VanDerWaalsContact C-N 3.28Å; I449-T451 HydrophobicContact CB-CG2 3.99Å; I449-T451 HydrophobicContact CG2-CG2 3.62Å; I449-T451 PolarHBondContact O-N 3.22Å; T451-I453 PolarHBondContact O-N 2.79Å
452	P	92.6	Very high	91.8	Very high	84 Å²	84	48.6 Å²	48.6	55%	0.545	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	120.3	173.8	27.5	-30.2	0	0	0	109.3	W445	W445-P452 HydrophobicContact CE3-CB 3.88Å; W445-P452 HydrophobicContact CE3-CG 4.44Å; W445-P452 HydrophobicContact CH2-CB 4.01Å; W445-P452 HydrophobicContact CH2-CG 4.48Å; W445-P452 HydrophobicContact CZ3-CB 3.59Å; W445-P452 HydrophobicContact CZ3-CG 3.89Å
453	I	91.8	Very high	91.8	Very high	24 Å²	24	48.6 Å²	48.6	12%	0.123	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-49.8	179.1	-62.7	178.1	0	0	0	110.2	H183 L186 R187 I444 T451	H183-I453 HydrophobicContact CB-CD1 4.32Å; L186-I453 HydrophobicContact CB-CD1 4.33Å; L186-I453 HydrophobicContact CB-CG2 3.93Å; L186-I453 HydrophobicContact CD1-CD1 3.77Å; R187-I453 HydrophobicContact CB-CG2 4.44Å; R187-I453 HydrophobicContact CG-CG2 3.46Å; R187-I453 VanDerWaalsContact CG-CG2 3.46Å; I444-I453 HydrophobicContact CG2-CB 4.38Å; I444-I453 HydrophobicContact CG2-CD1 4.37Å; I444-I453 PolarHBondContact O-N 2.74Å; T451-I453 PolarHBondContact O-N 2.79Å
454	K	93.2	Very high	91.7	Very high	73 Å²	73	47.4 Å²	47.4	32%	0.317	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	137.9	-173.5	-174.8	67.6	174.2	-166.8	0	110.4	I444 L456	I444-K454 HydrophobicContact CD1-CB 4.47Å; I444-K454 PolarHBondContact N-O 2.99Å; K454-L456 HydrophobicContact CG-CD2 4.05Å
455	T	95	Very high	91.7	Very high	57 Å²	57	47.5 Å²	47.5	35%	0.35	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.7	164.4	57.8	0	0	0	0	107.9	K443 E457	K443-T455 HydrophobicContact CD-CG2 4.31Å; K443-T455 HydrophobicContact CG-CG2 4.05Å; T455-E457 PolarHBondContact OG1-OE1 2.96Å; T455-E457 VanDerWaalsContact OG1-OE1 3.1Å
456	L	93.7	Very high	91.8	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.016	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	102.3	174	-57	177.3	0	0	0	107.3	T442 I444 K454 I475 W487	T442-L456 PolarHBondContact N-O 2.96Å; T442-L456 VanDerWaalsContact N-O 3.15Å; T442-L456 WeakPolarHBondContact O-CB 3.41Å; T442-L456 PolarHBondContact O-N 3.29Å; T442-L456 VanDerWaalsContact OG1-CB 3.27Å; T442-L456 WeakPolarHBondContact OG1-CB 3.44Å; T442-L456 WeakPolarHBondContact OG1-CD1 3.49Å; I444-L456 HydrophobicContact CD1-CD1 4.19Å; I444-L456 HydrophobicContact CD1-CD2 4.39Å; I444-L456 HydrophobicContact CD1-CG 4.39Å; I444-L456 HydrophobicContact CG1-CD1 4.3Å; I444-L456 HydrophobicContact CG1-CG 4.46Å; K454-L456 HydrophobicContact CG-CD2 4.05Å; L456-I475 HydrophobicContact CD1-CD1 4.47Å; L456-W487 HydrophobicContact CB-CD2 4.21Å; L456-W487 HydrophobicContact CB-CE3 4.18Å; L456-W487 HydrophobicContact CB-CH2 4Å; L456-W487 HydrophobicContact CB-CZ2 4.01Å; L456-W487 HydrophobicContact CB-CZ3 4.07Å; L456-W487 HydrophobicContact CD1-CB 4.49Å; L456-W487 HydrophobicContact CD1-CD2 4.03Å; L456-W487 HydrophobicContact CD1-CE3 4.46Å; L456-W487 HydrophobicContact CD1-CG 4Å; L456-W487 HydrophobicContact CD2-CD2 4.11Å; L456-W487 HydrophobicContact CD2-CE3 3.7Å; L456-W487 HydrophobicContact CD2-CZ3 4.11Å; L456-W487 HydrophobicContact CG-CD2 4.34Å; L456-W487 HydrophobicContact CG-CE3 4.33Å
457	E	92.5	Very high	92	Very high	132 Å²	132	47.2 Å²	47.2	62%	0.617	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.6	-179.1	-70.8	168.7	-151.2	0	0	109.3	T441 T455 W487	T441-E457 HydrophobicContact CG2-CG 4.08Å; T455-E457 PolarHBondContact OG1-OE1 2.96Å; T455-E457 VanDerWaalsContact OG1-OE1 3.1Å; E457-W487 WeakPolarHBondContact O-CH2 3.46Å
458	G	89.1	Confident	92.3	Very high	30 Å²	30	46.6 Å²	46.6	31%	0.309	26%	0.257	S	S	.	.			trans	170.9	-18.1	178.3	0	0	0	0	0	114.5	K485	G458-K485 WeakPolarHBondContact O-CE 3.48Å; G458-K485 PolarHBondContact O-NZ 3.42Å
459	H	93.1	Very high	92.8	Very high	11 Å²	11	43.1 Å²	43.1	5%	0.051	24%	0.235	C	C	.	.			trans	-77.3	143.3	175.7	-79.2	-69.6	0	0	0	112	V463 T477 S479 D481	H459-V463 HydrophobicContact CB-CG2 3.87Å; H459-V463 VanDerWaalsContact CD2-CG2 3.49Å; H459-V463 WeakPolarHBondContact CD2-CG2 3.28Å; H459-T477 WeakPolarHBondContact NE2-CB 3.48Å; H459-T477 PolarHBondContact NE2-OG1 3.26Å; H459-S479 VanDerWaalsContact CE1-CB 3.49Å; H459-S479 WeakPolarHBondContact CE1-CB 3.42Å; H459-S479 WeakPolarHBondContact ND1-CB 3.47Å; H459-D481 WeakPolarHBondContact CA-OD2 3.49Å; H459-D481 IonicContact CG-OD2 3.71Å; H459-D481 IonicContact ND1-OD1 3.12Å; H459-D481 IonicContact ND1-OD2 3.6Å; H459-D481 PolarHBondContact ND1-OD2 2.89Å
460	N	93.5	Very high	93	Very high	129 Å²	129	38.2 Å²	38.2	69%	0.69	21%	0.211	S	C	*	.	S	Bend	trans	-86.9	-17.7	179.1	-70.3	-28.9	0	0	0	112.2	K440 D481	K440-N460 WeakPolarHBondContact CD-O 3.5Å; K440-N460 WeakPolarHBondContact CE-O 3.47Å; K440-N460 PolarHBondContact NZ-O 3.02Å; N460-D481 HydrophobicContact CB-CB 4.17Å; N460-D481 PolarHBondContact N-OD2 3.47Å
461	S	94.8	Very high	92.8	Very high	34 Å²	34	42.1 Å²	42.1	24%	0.238	23%	0.233	C	C	.	.	S	Bend	trans	-134.6	179.3	-175.7	-168.8	0	0	0	0	111.4	V463 S479 H480	S461-V463 PolarHBondContact O-N 3.35Å; S461-S479 PolarHBondContact O-OG 3.31Å; S461-S479 VanDerWaalsContact O-OG 3.08Å; S461-H480 VanDerWaalsContact OG-CB 3.28Å; S461-H480 WeakPolarHBondContact OG-CB 3.23Å
462	K	95.1	Very high	92.6	Very high	98 Å²	98	40.1 Å²	40.1	43%	0.426	22%	0.22	S	C	.	.			trans	-52.1	125.7	179.5	-60.9	-177.6	177.9	-175.5	0	110.7	F438 S479 H480	F438-K462 HydrophobicContact CB-CB 4.12Å; F438-K462 HydrophobicContact CB-CD 3.93Å; F438-K462 HydrophobicContact CB-CG 3.85Å; F438-K462 HydrophobicContact CD1-CB 3.73Å; F438-K462 HydrophobicContact CD1-CD 4.13Å; F438-K462 HydrophobicContact CD1-CG 4.26Å; F438-K462 HydrophobicContact CD2-CD 4.17Å; F438-K462 HydrophobicContact CE1-CB 4.47Å; F438-K462 HydrophobicContact CG-CB 4.1Å; F438-K462 HydrophobicContact CG-CD 3.82Å; F438-K462 HydrophobicContact CG-CG 4.12Å; K462-S479 VanDerWaalsContact O-CA 3.28Å; K462-S479 WeakPolarHBondContact O-CA 3.41Å; K462-S479 WeakPolarHBondContact O-CB 3.45Å; K462-S479 PolarHBondContact O-OG 3.09Å; K462-H480 PolarHBondContact O-N 3.5Å
463	V	95.6	Very high	92.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.5	170.8	-169	0	0	0	0	107.3	S421 S437 F438 T442 H459 S461 C478	S421-V463 PolarHBondContact OG-O 3.44Å; S437-V463 CarbonylContact C-O 3.56Å; S437-V463 PolarHBondContact O-N 2.79Å; S437-V463 VanDerWaalsContact O-N 3.12Å; F438-V463 WeakPolarHBondContact CD1-O 3.45Å; T442-V463 HydrophobicContact CG2-CB 4.02Å; T442-V463 HydrophobicContact CG2-CG1 3.55Å; T442-V463 HydrophobicContact CG2-CG2 4.09Å; H459-V463 HydrophobicContact CB-CG2 3.87Å; H459-V463 VanDerWaalsContact CD2-CG2 3.49Å; H459-V463 WeakPolarHBondContact CD2-CG2 3.28Å; S461-V463 PolarHBondContact O-N 3.35Å; V463-C478 VanDerWaalsContact CG1-O 3.31Å; V463-C478 WeakPolarHBondContact CG1-O 3.37Å
464	V	94.4	Very high	92.3	Very high	12 Å²	12	42.1 Å²	42.1	7%	0.073	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-37.6	-174.4	-176	0	0	0	0	111.1	S203 S421 C478 H480	S203-V464 VanDerWaalsContact O-CG1 3.28Å; S203-V464 WeakPolarHBondContact O-CG1 3.41Å; S421-V464 WeakPolarHBondContact CB-O 3.39Å; S421-V464 PolarHBondContact OG-O 3.47Å; V464-C478 PolarHBondContact N-O 3.41Å; V464-H480 WeakPolarHBondContact CG2-CD2 3.42Å; V464-H480 WeakPolarHBondContact CG2-NE2 3.41Å
465	Y	95.3	Very high	92.4	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	146.6	-174.9	-154.4	-100.8	0	0	0	110.6	M204 C205 R424 D467 T477 C478	M204-Y465 HydrophobicContact CE-CE1 4.32Å; M204-Y465 HydrophobicContact CG-CD1 3.84Å; M204-Y465 HydrophobicContact CG-CD2 4.2Å; M204-Y465 HydrophobicContact CG-CE1 3.84Å; M204-Y465 HydrophobicContact CG-CE2 4.2Å; M204-Y465 HydrophobicContact CG-CG 3.97Å; M204-Y465 HydrophobicContact SD-CE2 4.47Å; C205-Y465 WeakPolarHBondContact O-CD1 3.32Å; C205-Y465 WeakPolarHBondContact O-CE1 3.3Å; R424-Y465 PolarHBondContact NE-OH 3.09Å; R424-Y465 VanDerWaalsContact NE-OH 3.1Å; R424-Y465 PolarHBondContact NH2-OH 3.42Å; Y465-D467 HydrophobicContact CE1-CB 4.41Å; Y465-T477 WeakPolarHBondContact O-CA 3.47Å; Y465-C478 WeakPolarHBondContact CB-SG 3.42Å; Y465-C478 PolarHBondContact O-N 3.34Å
466	A	94.7	Very high	92.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.8	170.4	0	0	0	0	0	108.9	S422 R424 V434 T442 A476 T477	S422-A466 PolarHBondContact OG-N 3.44Å; S422-A466 VanDerWaalsContact OG-N 3.11Å; R424-A466 WeakPolarHBondContact CG-O 3.42Å; V434-A466 HydrophobicContact CG1-CB 3.74Å; T442-A466 HydrophobicContact CG2-CB 4.46Å; A466-A476 CarbonylContact C-O 3.54Å; A466-A476 VanDerWaalsContact CA-O 3.24Å; A466-A476 WeakPolarHBondContact CA-O 3.4Å; A466-T477 HydrophobicContact CB-CG2 3.95Å
467	D	94.9	Very high	92.5	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.043	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	158.5	173.6	-162.9	21.4	0	0	0	111.5	R206 F207 Y465 I475 A476	R206-D467 VanDerWaalsContact CA-OD2 3.24Å; R206-D467 WeakPolarHBondContact CA-OD2 3.44Å; R206-D467 VanDerWaalsContact CD-OD2 3.22Å; R206-D467 WeakPolarHBondContact CD-OD2 3.49Å; R206-D467 IonicContact CZ-OD1 3.71Å; R206-D467 IonicContact CZ-OD2 2.74Å; R206-D467 IonicContact NE-OD2 3.92Å; R206-D467 IonicContact NH1-OD1 3.76Å; R206-D467 PolarHBondContact NH1-OD1 3.23Å; R206-D467 IonicContact NH1-OD2 3.66Å; R206-D467 PolarHBondContact NH1-OD2 2.88Å; F207-D467 HydrophobicContact CD2-CB 3.9Å; F207-D467 HydrophobicContact CE2-CB 4.23Å; F207-D467 WeakPolarHBondContact CE2-O 3.38Å; F207-D467 PolarHBondContact N-OD2 2.67Å; Y465-D467 HydrophobicContact CE1-CB 4.41Å; D467-I475 CarbonylContact O-C 3.6Å; D467-I475 WeakPolarHBondContact O-CA 3.35Å; D467-I475 WeakPolarHBondContact O-CG2 2.99Å; D467-A476 PolarHBondContact N-O 3.43Å; D467-A476 PolarHBondContact O-N 2.89Å
468	I	93.8	Very high	92.6	Very high	12 Å²	12	29.6 Å²	29.6	6%	0.062	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.4	-178.6	-56.4	168.2	0	0	0	107.6	F207 R424 Y432 V434 I475	F207-I468 VanDerWaalsContact CD2-C 3.46Å; R424-I468 HydrophobicContact CB-CD1 4.27Å; Y432-I468 HydrophobicContact CD2-CD1 4.49Å; Y432-I468 HydrophobicContact CE2-CD1 3.76Å; Y432-I468 HydrophobicContact CE2-CG1 4.47Å; Y432-I468 VanDerWaalsContact OH-CG2 3.28Å; Y432-I468 WeakPolarHBondContact OH-CG2 3.39Å; V434-I468 HydrophobicContact CB-CD1 4.15Å; V434-I468 HydrophobicContact CB-CG1 4.38Å; V434-I468 HydrophobicContact CG2-CD1 3.62Å; V434-I468 HydrophobicContact CG2-CG1 3.86Å; I468-I475 HydrophobicContact CG1-CG1 4.46Å
469	S	92.4	Very high	92.9	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.007	14%	0.141	C	C	.	.			trans	-59.2	145.5	174.8	62.7	0	0	0	0	111	D471 N472 K473 Y474	S469-D471 PolarHBondContact O-N 3.35Å; S469-D471 VanDerWaalsContact O-N 3.17Å; S469-N472 WeakPolarHBondContact O-CA 3.3Å; S469-N472 PolarHBondContact O-N 3.47Å; S469-N472 PolarHBondContact O-OD1 3.47Å; S469-N472 PolarHBondContact OG-N 3.46Å; S469-K473 PolarHBondContact OG-N 3.47Å; S469-K473 VanDerWaalsContact OG-N 3.09Å; S469-Y474 WeakPolarHBondContact CB-O 3.5Å; S469-Y474 PolarHBondContact N-O 2.92Å; S469-Y474 PolarHBondContact OG-N 3.44Å; S469-Y474 PolarHBondContact OG-O 3.46Å
470	P	87.7	Confident	93	Very high	22 Å²	22	30 Å²	30	14%	0.143	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.6	179.6	24.3	-34.4	0	0	0	113.5	P209 N472	P209-P470 WeakPolarHBondContact O-CG 3.31Å; P470-N472 VanDerWaalsContact C-N 3.27Å
471	D	85.4	Confident	93	Very high	92 Å²	92	25.2 Å²	25.2	49%	0.492	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.8	174	-73.1	-8.9	0	0	0	113.3	S469 K473	S469-D471 PolarHBondContact O-N 3.35Å; S469-D471 VanDerWaalsContact O-N 3.17Å; D471-K473 HydrophobicContact CB-CG 4.4Å; D471-K473 PolarHBondContact O-N 3.27Å; D471-K473 VanDerWaalsContact O-N 3.13Å
472	N	85.4	Confident	93	Very high	19 Å²	19	26.3 Å²	26.3	10%	0.102	13%	0.127	C	C	.	.	S	Bend	trans	57.1	21.2	-177.9	-57.2	-30.7	0	0	0	114.3	E426 S427 S469 P470 K489	E426-N472 VanDerWaalsContact CD-ND2 3.34Å; E426-N472 HydrophobicContact CG-CB 4.3Å; E426-N472 VanDerWaalsContact CG-CG 3.41Å; E426-N472 WeakPolarHBondContact CG-ND2 3.45Å; E426-N472 WeakPolarHBondContact CG-OD1 3.36Å; E426-N472 PolarHBondContact OE1-ND2 2.91Å; S427-N472 PolarHBondContact O-ND2 2.98Å; S469-N472 WeakPolarHBondContact O-CA 3.3Å; S469-N472 PolarHBondContact O-N 3.47Å; S469-N472 PolarHBondContact O-OD1 3.47Å; S469-N472 PolarHBondContact OG-N 3.46Å; P470-N472 VanDerWaalsContact C-N 3.27Å; N472-K489 VanDerWaalsContact O-CD 3.23Å; N472-K489 WeakPolarHBondContact O-CD 3.37Å; N472-K489 WeakPolarHBondContact O-CE 3.35Å; N472-K489 PolarHBondContact O-NZ 3.34Å
473	K	87.4	Confident	93	Very high	103 Å²	103	22.7 Å²	22.7	45%	0.448	11%	0.113	S	C	.	.	S	Bend	trans	-85.7	-39.8	177.4	-69.5	-175	177.6	-175.9	0	112.5	S469 D471 K489	S469-K473 PolarHBondContact OG-N 3.47Å; S469-K473 VanDerWaalsContact OG-N 3.09Å; D471-K473 HydrophobicContact CB-CG 4.4Å; D471-K473 PolarHBondContact O-N 3.27Å; D471-K473 VanDerWaalsContact O-N 3.13Å; K473-K489 PolarHBondContact O-N 2.83Å
474	Y	92.1	Very high	93	Very high	47 Å²	47	22.8 Å²	22.8	18%	0.184	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	148.3	-174.8	-52.8	-66.2	0	0	0	112.1	L192 I228 S469 L486 W487	L192-Y474 HydrophobicContact CD2-CE1 3.98Å; I228-Y474 HydrophobicContact CG2-CD2 3.83Å; I228-Y474 HydrophobicContact CG2-CE2 3.86Å; S469-Y474 WeakPolarHBondContact CB-O 3.5Å; S469-Y474 PolarHBondContact N-O 2.92Å; S469-Y474 PolarHBondContact OG-N 3.44Å; S469-Y474 PolarHBondContact OG-O 3.46Å; Y474-L486 HydrophobicContact CD1-CD2 3.43Å; Y474-L486 VanDerWaalsContact CD1-CD2 3.43Å; Y474-L486 HydrophobicContact CD1-CG 4.19Å; Y474-L486 HydrophobicContact CE1-CD2 3.93Å; Y474-L486 HydrophobicContact CG-CD1 4.4Å; Y474-L486 HydrophobicContact CG-CD2 3.88Å; Y474-L486 HydrophobicContact CG-CG 4.31Å; Y474-W487 CarbonylContact C-O 3.57Å; Y474-W487 VanDerWaalsContact CA-O 3.23Å; Y474-W487 WeakPolarHBondContact CA-O 3.42Å
475	I	94.5	Very high	93	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.4	166.4	-58.7	169	0	0	0	106	Y432 V434 I444 L456 D467 I468 T477 L486 W487	Y432-I475 HydrophobicContact CE2-CD1 4.37Å; V434-I475 HydrophobicContact CG1-CG2 4.25Å; V434-I475 HydrophobicContact CG2-CD1 4.01Å; V434-I475 HydrophobicContact CG2-CG2 4.47Å; I444-I475 HydrophobicContact CD1-CD1 3.71Å; I444-I475 HydrophobicContact CG1-CD1 4.39Å; L456-I475 HydrophobicContact CD1-CD1 4.47Å; D467-I475 CarbonylContact O-C 3.6Å; D467-I475 WeakPolarHBondContact O-CA 3.35Å; D467-I475 WeakPolarHBondContact O-CG2 2.99Å; I468-I475 HydrophobicContact CG1-CG1 4.46Å; I475-T477 HydrophobicContact CG2-CG2 4.38Å; I475-L486 CarbonylContact O-C 3.57Å; I475-L486 WeakPolarHBondContact O-CA 3.4Å; I475-W487 HydrophobicContact CB-CB 4.2Å; I475-W487 PolarHBondContact N-O 3.2Å; I475-W487 PolarHBondContact O-N 3.2Å
476	A	95.1	Very high	93	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	140	174.3	0	0	0	0	0	109.5	F207 L214 A466 D467 K485	F207-A476 HydrophobicContact CD2-CB 4.42Å; F207-A476 HydrophobicContact CE1-CB 4.39Å; F207-A476 HydrophobicContact CE2-CB 3.43Å; F207-A476 VanDerWaalsContact CE2-CB 3.43Å; F207-A476 HydrophobicContact CZ-CB 3.41Å; F207-A476 VanDerWaalsContact CZ-CB 3.41Å; L214-A476 HydrophobicContact CD1-CB 3.49Å; L214-A476 VanDerWaalsContact CD1-CB 3.49Å; L214-A476 HydrophobicContact CD2-CB 4.47Å; A466-A476 CarbonylContact C-O 3.54Å; A466-A476 VanDerWaalsContact CA-O 3.24Å; A466-A476 WeakPolarHBondContact CA-O 3.4Å; D467-A476 PolarHBondContact N-O 3.43Å; D467-A476 PolarHBondContact O-N 2.89Å; A476-K485 CarbonylContact C-O 3.55Å; A476-K485 VanDerWaalsContact CA-O 3.31Å; A476-K485 WeakPolarHBondContact CA-O 3.42Å
477	T	96.1	Very high	92.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.9	176.9	56	0	0	0	0	109.5	T442 H459 Y465 A466 I475 Y484 K485 W487	T442-T477 HydrophobicContact CG2-CG2 3.66Å; H459-T477 WeakPolarHBondContact NE2-CB 3.48Å; H459-T477 PolarHBondContact NE2-OG1 3.26Å; Y465-T477 WeakPolarHBondContact O-CA 3.47Å; A466-T477 HydrophobicContact CB-CG2 3.95Å; I475-T477 HydrophobicContact CG2-CG2 4.38Å; T477-Y484 CarbonylContact O-C 3.55Å; T477-Y484 WeakPolarHBondContact O-CA 3.36Å; T477-K485 PolarHBondContact N-O 3.14Å; T477-K485 PolarHBondContact O-N 3.02Å; T477-W487 PolarHBondContact OG1-NE1 3.13Å
478	C	94.7	Very high	92.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.4	175.8	72	0	0	0	0	110.8	L202 C205 V463 V464 Y465	L202-C478 HydrophobicContact CB-CB 3.89Å; L202-C478 HydrophobicContact CD1-CB 4.16Å; C205-C478 HydrophobicContact CB-CB 4.05Å; V463-C478 VanDerWaalsContact CG1-O 3.31Å; V463-C478 WeakPolarHBondContact CG1-O 3.37Å; V464-C478 PolarHBondContact N-O 3.41Å; Y465-C478 WeakPolarHBondContact CB-SG 3.42Å; Y465-C478 PolarHBondContact O-N 3.34Å
479	S	95.5	Very high	92.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	162.9	-174.4	174.4	0	0	0	0	112.1	H459 S461 K462 D481 T483	H459-S479 VanDerWaalsContact CE1-CB 3.49Å; H459-S479 WeakPolarHBondContact CE1-CB 3.42Å; H459-S479 WeakPolarHBondContact ND1-CB 3.47Å; S461-S479 PolarHBondContact O-OG 3.31Å; S461-S479 VanDerWaalsContact O-OG 3.08Å; K462-S479 VanDerWaalsContact O-CA 3.28Å; K462-S479 WeakPolarHBondContact O-CA 3.41Å; K462-S479 WeakPolarHBondContact O-CB 3.45Å; K462-S479 PolarHBondContact O-OG 3.09Å; S479-D481 VanDerWaalsContact CB-OD1 3.27Å; S479-D481 WeakPolarHBondContact CB-OD1 3.47Å; S479-D481 PolarHBondContact O-N 3.17Å; S479-D481 VanDerWaalsContact OG-CG 3.31Å; S479-D481 PolarHBondContact OG-N 3.4Å; S479-D481 PolarHBondContact OG-OD1 3.39Å; S479-D481 PolarHBondContact OG-OD2 2.97Å; S479-T483 PolarHBondContact N-O 2.88Å
480	H	94.2	Very high	91.5	Very high	50 Å²	50	29.9 Å²	29.9	23%	0.231	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-0.2	168.1	-75.2	-172.6	0	0	0	113.4	P201 W219 S461 K462 V464 L482	P201-H480 HydrophobicContact CB-CB 4.08Å; W219-H480 AromaticContact CH2-CE1 3.87Å; W219-H480 AromaticContact CZ2-CE1 3.86Å; W219-H480 AromaticContact CZ2-NE2 3.59Å; S461-H480 VanDerWaalsContact OG-CB 3.28Å; S461-H480 WeakPolarHBondContact OG-CB 3.23Å; K462-H480 PolarHBondContact O-N 3.5Å; V464-H480 WeakPolarHBondContact CG2-CD2 3.42Å; V464-H480 WeakPolarHBondContact CG2-NE2 3.41Å; H480-L482 PolarHBondContact O-N 3.02Å
481	D	94	Very high	89.9	Confident	28 Å²	28	32.3 Å²	32.3	15%	0.15	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	12.4	172.6	65.2	14.4	0	0	0	113.5	H459 N460 S479 T483	H459-D481 WeakPolarHBondContact CA-OD2 3.49Å; H459-D481 IonicContact CG-OD2 3.71Å; H459-D481 IonicContact ND1-OD1 3.12Å; H459-D481 IonicContact ND1-OD2 3.6Å; H459-D481 PolarHBondContact ND1-OD2 2.89Å; N460-D481 HydrophobicContact CB-CB 4.17Å; N460-D481 PolarHBondContact N-OD2 3.47Å; S479-D481 VanDerWaalsContact CB-OD1 3.27Å; S479-D481 WeakPolarHBondContact CB-OD1 3.47Å; S479-D481 PolarHBondContact O-N 3.17Å; S479-D481 VanDerWaalsContact OG-CG 3.31Å; S479-D481 PolarHBondContact OG-N 3.4Å; S479-D481 PolarHBondContact OG-OD1 3.39Å; S479-D481 PolarHBondContact OG-OD2 2.97Å; D481-T483 VanDerWaalsContact CG-OG1 3.24Å; D481-T483 PolarHBondContact O-N 3.23Å; D481-T483 WeakPolarHBondContact OD1-CB 3.35Å; D481-T483 PolarHBondContact OD1-N 3.39Å; D481-T483 PolarHBondContact OD1-OG1 3.3Å; D481-T483 PolarHBondContact OD2-OG1 2.93Å
482	L	94.5	Very high	87.8	Confident	58 Å²	58	37.7 Å²	37.7	30%	0.304	20%	0.196	S	C	.	.	S	Bend	trans	71.1	-2.7	-177.6	-48	-178.7	0	0	0	114.5	G197 D198 R200 H480	G197-L482 PolarHBondContact N-O 3.21Å; D198-L482 WeakPolarHBondContact O-CB 3.35Å; R200-L482 WeakPolarHBondContact O-CD2 3.4Å; H480-L482 PolarHBondContact O-N 3.02Å
483	T	95.3	Very high	87.9	Confident	21 Å²	21	38.7 Å²	38.7	13%	0.129	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	149.9	-177.1	70.8	0	0	0	0	112.2	Q195 V196 S479 D481	Q195-T483 CarbonylContact O-C 3.55Å; Q195-T483 WeakPolarHBondContact O-CA 3.2Å; Q195-T483 WeakPolarHBondContact O-CB 3.35Å; V196-T483 HydrophobicContact CG2-CG2 4.26Å; S479-T483 PolarHBondContact N-O 2.88Å; D481-T483 VanDerWaalsContact CG-OG1 3.24Å; D481-T483 PolarHBondContact O-N 3.23Å; D481-T483 WeakPolarHBondContact OD1-CB 3.35Å; D481-T483 PolarHBondContact OD1-N 3.39Å; D481-T483 PolarHBondContact OD1-OG1 3.3Å; D481-T483 PolarHBondContact OD2-OG1 2.93Å
484	Y	95.1	Very high	88	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.9	157	73.9	-86.9	0	0	0	109	Q195 L214 T216 W226 T477	Q195-Y484 HydrophobicContact CB-CD1 4.2Å; Q195-Y484 HydrophobicContact CB-CE1 3.53Å; Q195-Y484 HydrophobicContact CB-CE2 4.21Å; Q195-Y484 HydrophobicContact CG-CE1 3.73Å; Q195-Y484 PolarHBondContact N-O 2.99Å; Q195-Y484 PolarHBondContact O-N 3.4Å; L214-Y484 HydrophobicContact CD2-CD2 3.49Å; L214-Y484 VanDerWaalsContact CD2-CD2 3.49Å; L214-Y484 HydrophobicContact CD2-CE2 3.66Å; L214-Y484 HydrophobicContact CD2-CG 4.01Å; T216-Y484 HydrophobicContact CG2-CD1 4.23Å; T216-Y484 HydrophobicContact CG2-CG 4.37Å; W226-Y484 AromaticContact CD1-CE1 3.98Å; W226-Y484 AromaticContact CD2-CE1 3.56Å; W226-Y484 HydrophobicContact CD2-CE1 3.56Å; W226-Y484 AromaticContact CD2-CZ 3.74Å; W226-Y484 VanDerWaalsContact CD2-OH 3.28Å; W226-Y484 AromaticContact CE2-CE1 3.51Å; W226-Y484 HydrophobicContact CE3-CE1 4.03Å; W226-Y484 VanDerWaalsContact CE3-OH 3.31Å; W226-Y484 AromaticContact CG-CE1 3.89Å; W226-Y484 HydrophobicContact CG-CE1 3.89Å; W226-Y484 AromaticContact CG-CZ 3.75Å; W226-Y484 HydrophobicContact CH2-CE1 4.36Å; W226-Y484 AromaticContact CZ2-CE1 3.96Å; W226-Y484 HydrophobicContact CZ2-CE1 3.96Å; W226-Y484 HydrophobicContact CZ3-CE1 4.4Å; W226-Y484 AromaticContact NE1-CE1 3.74Å; T477-Y484 CarbonylContact O-C 3.55Å; T477-Y484 WeakPolarHBondContact O-CA 3.36Å
485	K	95.1	Very high	87.7	Confident	19 Å²	19	34.6 Å²	34.6	8%	0.083	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	139.4	179.6	-70.3	-177	-172.8	-125.9	0	109.3	L191 C193 S194 G458 A476 T477 W487	L191-K485 HydrophobicContact CD1-CB 3.6Å; L191-K485 HydrophobicContact CD1-CD 3.84Å; L191-K485 HydrophobicContact CD1-CG 3.85Å; L191-K485 HydrophobicContact CD2-CD 4.42Å; C193-K485 WeakPolarHBondContact O-CA 3.19Å; S194-K485 WeakPolarHBondContact OG-CE 3.34Å; G458-K485 WeakPolarHBondContact O-CE 3.48Å; G458-K485 PolarHBondContact O-NZ 3.42Å; A476-K485 CarbonylContact C-O 3.55Å; A476-K485 VanDerWaalsContact CA-O 3.31Å; A476-K485 WeakPolarHBondContact CA-O 3.42Å; T477-K485 PolarHBondContact N-O 3.14Å; T477-K485 PolarHBondContact O-N 3.02Å; K485-W487 HydrophobicContact CB-CZ2 4.44Å; K485-W487 HydrophobicContact CD-CZ2 4.23Å
486	L	94.5	Very high	87.4	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.2	174.1	-164.8	108.2	0	0	0	108.6	L192 C193 F207 I228 Y474 I475	L192-L486 HydrophobicContact CB-CD2 4.17Å; L192-L486 WeakPolarHBondContact CB-O 3.36Å; L192-L486 HydrophobicContact CD2-CD2 3.44Å; L192-L486 VanDerWaalsContact CD2-CD2 3.44Å; L192-L486 HydrophobicContact CG-CD2 4.34Å; L192-L486 PolarHBondContact N-O 2.95Å; C193-L486 PolarHBondContact N-O 3.31Å; C193-L486 PolarHBondContact O-N 2.89Å; F207-L486 HydrophobicContact CE1-CD1 4.1Å; F207-L486 HydrophobicContact CZ-CD1 4.06Å; I228-L486 HydrophobicContact CG1-CD1 4.32Å; I228-L486 HydrophobicContact CG2-CD1 4.38Å; Y474-L486 HydrophobicContact CD1-CD2 3.43Å; Y474-L486 VanDerWaalsContact CD1-CD2 3.43Å; Y474-L486 HydrophobicContact CD1-CG 4.19Å; Y474-L486 HydrophobicContact CE1-CD2 3.93Å; Y474-L486 HydrophobicContact CG-CD1 4.4Å; Y474-L486 HydrophobicContact CG-CD2 3.88Å; Y474-L486 HydrophobicContact CG-CG 4.31Å; I475-L486 CarbonylContact O-C 3.57Å; I475-L486 WeakPolarHBondContact O-CA 3.4Å
487	W	93.9	Very high	86.9	Confident	10 Å²	10	38.9 Å²	38.9	4%	0.038	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.2	-180	-52.8	84.1	0	0	0	108.9	N190 L191 L456 E457 Y474 I475 T477 K485	N190-W487 CarbonylContact O-C 3.58Å; N190-W487 VanDerWaalsContact O-CA 3.26Å; N190-W487 WeakPolarHBondContact O-CA 3.14Å; L191-W487 HydrophobicContact CB-CE3 3.9Å; L191-W487 HydrophobicContact CB-CH2 4.16Å; L191-W487 HydrophobicContact CB-CZ3 3.68Å; L191-W487 HydrophobicContact CD1-CD2 4.26Å; L191-W487 HydrophobicContact CD1-CE3 4.4Å; L191-W487 HydrophobicContact CD1-CH2 4.27Å; L191-W487 HydrophobicContact CD1-CZ2 4.13Å; L191-W487 HydrophobicContact CD1-CZ3 4.41Å; L191-W487 VanDerWaalsContact N-CE3 3.34Å; L456-W487 HydrophobicContact CB-CD2 4.21Å; L456-W487 HydrophobicContact CB-CE3 4.18Å; L456-W487 HydrophobicContact CB-CH2 4Å; L456-W487 HydrophobicContact CB-CZ2 4.01Å; L456-W487 HydrophobicContact CB-CZ3 4.07Å; L456-W487 HydrophobicContact CD1-CB 4.49Å; L456-W487 HydrophobicContact CD1-CD2 4.03Å; L456-W487 HydrophobicContact CD1-CE3 4.46Å; L456-W487 HydrophobicContact CD1-CG 4Å; L456-W487 HydrophobicContact CD2-CD2 4.11Å; L456-W487 HydrophobicContact CD2-CE3 3.7Å; L456-W487 HydrophobicContact CD2-CZ3 4.11Å; L456-W487 HydrophobicContact CG-CD2 4.34Å; L456-W487 HydrophobicContact CG-CE3 4.33Å; E457-W487 WeakPolarHBondContact O-CH2 3.46Å; Y474-W487 CarbonylContact C-O 3.57Å; Y474-W487 VanDerWaalsContact CA-O 3.23Å; Y474-W487 WeakPolarHBondContact CA-O 3.42Å; I475-W487 HydrophobicContact CB-CB 4.2Å; I475-W487 PolarHBondContact N-O 3.2Å; I475-W487 PolarHBondContact O-N 3.2Å; T477-W487 PolarHBondContact OG1-NE1 3.13Å; K485-W487 HydrophobicContact CB-CZ2 4.44Å; K485-W487 HydrophobicContact CD-CZ2 4.23Å
488	S	92.1	Very high	86.3	Confident	7 Å²	7	41.5 Å²	41.5	5%	0.049	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	144.5	176.7	174.9	0	0	0	0	110	T189 N190 E490	T189-S488 CarbonylContact C-O 3.6Å; T189-S488 VanDerWaalsContact CA-O 3.25Å; T189-S488 WeakPolarHBondContact CA-O 3.36Å; N190-S488 PolarHBondContact N-O 3.35Å; N190-S488 PolarHBondContact O-N 3.07Å; S488-E490 PolarHBondContact OG-N 2.94Å; S488-E490 PolarHBondContact OG-O 3.43Å
489	K	85.4	Confident	85.7	Confident	25 Å²	25	44.4 Å²	44.4	11%	0.109	24%	0.241	C	C	.	.	S	Bend	trans	-79.8	-20.4	169.9	-66.8	174.5	-170.3	-176.4	0	113.1	V185 L186 T189 Y432 N472 K473	V185-K489 HydrophobicContact CG1-CB 3.84Å; V185-K489 HydrophobicContact CG1-CD 4.2Å; V185-K489 HydrophobicContact CG1-CG 4.41Å; L186-K489 HydrophobicContact CD2-CD 4.03Å; L186-K489 VanDerWaalsContact CD2-CE 3.42Å; T189-K489 HydrophobicContact CG2-CB 4.28Å; T189-K489 HydrophobicContact CG2-CG 3.48Å; T189-K489 VanDerWaalsContact CG2-CG 3.48Å; Y432-K489 PolarHBondContact OH-NZ 3.05Å; N472-K489 VanDerWaalsContact O-CD 3.23Å; N472-K489 WeakPolarHBondContact O-CD 3.37Å; N472-K489 WeakPolarHBondContact O-CE 3.35Å; N472-K489 PolarHBondContact O-NZ 3.34Å; K473-K489 PolarHBondContact O-N 2.83Å
490	E	73.3	Confident	84.9	Confident	123 Å²	123	47.8 Å²	47.8	58%	0.575	26%	0.26	S	S	*	.	S	Bend	trans	-87.8	126.1	178.6	-67.3	174.9	-175.6	0	0	108.4	S488	S488-E490 PolarHBondContact OG-N 2.94Å; S488-E490 PolarHBondContact OG-O 3.43Å
491	A	54.6	Low	84.1	Confident	72 Å²	72	47.7 Å²	47.7	60%	0.595	26%	0.262	S	S	*	.			trans	-71	127.6	162.1	0	0	0	0	0	106.7
492	N	41.8	Very low	83.2	Confident	206 Å²	206	49.5 Å²	49.5	100%	1.102	27%	0.272	S	S	*	.			trans	-50.3	0	170.3	-73.8	-9.7	0	0	0	112.1

Retrieved 492 of 492 residues in 1036.6 ms (Link to these results)

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