A0A077ZFG0_TRITR Loading...

Endoplasmic reticulum Golgi intermediate

AlphaFold DB , UniProt , Accession A0A077ZFG0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 369 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	58.9	Low	229 Å²	229	177.5 Å²	177.5	100%	1.128	82%	0.818	S	S	*	*				0	114.6	0	-91.6	164.3	62.7	0	0	108.4
2	N	45.7	Very low	60.8	Low	145 Å²	145	170.3 Å²	170.3	78%	0.775	80%	0.796	S	S	*	*			trans	173.6	81.2	134.2	-84.4	-4.7	0	0	0	106.4	L4	N2-L4 VanDerWaalsContact C-N 3.34Å; N2-L4 PolarHBondContact O-N 3.07Å
3	E	49	Very low	62.3	Low	197 Å²	197	164.8 Å²	164.8	92%	0.921	77%	0.774	S	S	*	*			trans	-56.3	101.9	160.2	-77.1	176.9	136.4	0	0	107.6	R5	E3-R5 PolarHBondContact O-N 2.67Å
4	L	60.6	Low	63.7	Low	161 Å²	161	158.8 Å²	158.8	84%	0.843	75%	0.75	S	S	*	*			trans	-69	93.2	164.6	-73.6	168.1	0	0	0	106.7	N2 R6	N2-L4 VanDerWaalsContact C-N 3.34Å; N2-L4 PolarHBondContact O-N 3.07Å; L4-R6 VanDerWaalsContact C-N 3.33Å; L4-R6 PolarHBondContact O-N 3.21Å
5	R	56.9	Low	65.1	Low	238 Å²	238	156.7 Å²	156.7	90%	0.898	74%	0.737	S	S	*	*			trans	-47.4	94.4	169	-171.7	178.4	-170.1	171.4	3.1	108.8	E3 R7	E3-R5 PolarHBondContact O-N 2.67Å; R5-R7 PolarHBondContact O-N 3.05Å
6	R	56.8	Low	66.2	Low	239 Å²	239	153.4 Å²	153.4	90%	0.902	72%	0.724	S	S	*	*			trans	-58.8	108.3	168.3	-75.5	-170	-171.3	-155.7	3	106.5	L4 K8	L4-R6 VanDerWaalsContact C-N 3.33Å; L4-R6 PolarHBondContact O-N 3.21Å; R6-K8 PolarHBondContact O-N 2.82Å; R6-K8 VanDerWaalsContact O-N 3.12Å
7	R	63.7	Low	66.9	Low	235 Å²	235	152.1 Å²	152.1	89%	0.887	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-57.1	118.7	161.8	-86.6	-175.5	174.7	-177.6	-1.4	105.7	R5	R5-R7 PolarHBondContact O-N 3.05Å
8	K	63	Low	67.7	Low	190 Å²	190	148.3 Å²	148.3	83%	0.826	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-58.1	125.4	172.6	-156.4	176.7	-175.2	-175	0	106.2	R6 E10	R6-K8 PolarHBondContact O-N 2.82Å; R6-K8 VanDerWaalsContact O-N 3.12Å; K8-E10 PolarHBondContact O-N 2.93Å
9	P	58.7	Low	68.5	Low	78 Å²	78	146.8 Å²	146.8	51%	0.506	71%	0.706	S	S	.	*	P	Polyproline II helix	trans	-55.9	136.3	178.6	22.4	-31.2	0	0	0	108.6	D14	P9-D14 WeakPolarHBondContact CG-OD2 3.48Å
10	E	73	Confident	68.9	Low	137 Å²	137	144 Å²	144	64%	0.64	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-65.3	122.5	177.8	-68.3	-171.5	167.9	0	0	107.4	K8 V12 L13	K8-E10 PolarHBondContact O-N 2.93Å; E10-V12 PolarHBondContact O-N 2.92Å; E10-L13 HydrophobicContact CB-CD1 4.42Å; E10-L13 PolarHBondContact O-N 3.41Å
11	P	79.3	Confident	69.4	Low	103 Å²	103	141.4 Å²	141.4	67%	0.669	70%	0.697	S	S	*	*	H	α-helix	trans	-58.6	-18	-169.9	22.1	-33.9	0	0	0	113.8	F15	P11-F15 WeakPolarHBondContact O-CB 3.41Å; P11-F15 PolarHBondContact O-N 3.3Å
12	V	81.6	Confident	71.3	Confident	91 Å²	91	138.4 Å²	138.4	55%	0.552	68%	0.678	S	S	*	*	H	α-helix	trans	-71	-39.6	177.6	-176.9	0	0	0	0	111.7	E10 F15 I16	E10-V12 PolarHBondContact O-N 2.92Å; V12-F15 PolarHBondContact O-N 3.14Å; V12-I16 HydrophobicContact CG1-CD1 3.91Å; V12-I16 WeakPolarHBondContact O-CD1 3.2Å; V12-I16 VanDerWaalsContact O-CG1 3.25Å; V12-I16 WeakPolarHBondContact O-CG1 3.45Å; V12-I16 PolarHBondContact O-N 3.25Å
13	L	81	Confident	72.8	Confident	99 Å²	99	137 Å²	137	52%	0.518	68%	0.677	S	S	.	*	H	α-helix	trans	-67.2	-47.4	-179.9	-82.3	157.2	0	0	0	110.9	E10 F15 I16 E17	E10-L13 HydrophobicContact CB-CD1 4.42Å; E10-L13 PolarHBondContact O-N 3.41Å; L13-F15 VanDerWaalsContact C-N 3.28Å; L13-F15 PolarHBondContact O-N 3.06Å; L13-I16 PolarHBondContact O-N 2.8Å; L13-I16 VanDerWaalsContact O-N 3.16Å; L13-E17 PolarHBondContact O-N 3.43Å
14	D	81.2	Confident	74.1	Confident	81 Å²	81	136.3 Å²	136.3	43%	0.433	67%	0.671	S	S	.	*	H	α-helix	trans	-62.4	-36.9	178.2	-65.6	-9.4	0	0	0	111.5	P9 S18	P9-D14 WeakPolarHBondContact CG-OD2 3.48Å; D14-S18 WeakPolarHBondContact O-CB 3.16Å; D14-S18 PolarHBondContact O-N 3.3Å
15	F	85.4	Confident	75	Confident	128 Å²	128	133.3 Å²	133.3	56%	0.561	66%	0.659	S	S	*	*	H	α-helix	trans	-65.4	-42.9	175.3	-178.6	-105.3	0	0	0	111.9	P11 V12 L13 S18 L19	P11-F15 WeakPolarHBondContact O-CB 3.41Å; P11-F15 PolarHBondContact O-N 3.3Å; V12-F15 PolarHBondContact O-N 3.14Å; L13-F15 VanDerWaalsContact C-N 3.28Å; L13-F15 PolarHBondContact O-N 3.06Å; F15-S18 PolarHBondContact O-N 3.28Å; F15-S18 PolarHBondContact O-OG 3.25Å; F15-L19 HydrophobicContact CD1-CD1 4.2Å; F15-L19 HydrophobicContact CE1-CD1 3.69Å; F15-L19 HydrophobicContact CE1-CG 4.44Å; F15-L19 HydrophobicContact CZ-CD1 4.07Å; F15-L19 HydrophobicContact CZ-CG 4.46Å; F15-L19 PolarHBondContact O-N 3.16Å
16	I	82.4	Confident	76	Confident	103 Å²	103	127.6 Å²	127.6	53%	0.528	65%	0.646	S	S	.	*	H	α-helix	trans	-65.1	-42.2	177.9	-68.3	166	0	0	0	110.9	V12 L13 S18 L19	V12-I16 HydrophobicContact CG1-CD1 3.91Å; V12-I16 WeakPolarHBondContact O-CD1 3.2Å; V12-I16 VanDerWaalsContact O-CG1 3.25Å; V12-I16 WeakPolarHBondContact O-CG1 3.45Å; V12-I16 PolarHBondContact O-N 3.25Å; L13-I16 PolarHBondContact O-N 2.8Å; L13-I16 VanDerWaalsContact O-N 3.16Å; I16-S18 VanDerWaalsContact C-N 3.29Å; I16-S18 PolarHBondContact O-N 2.97Å; I16-L19 PolarHBondContact O-N 3.16Å
17	E	78.5	Confident	76.6	Confident	132 Å²	132	123.4 Å²	123.4	62%	0.617	64%	0.637	S	S	*	*	H	α-helix	trans	-64.9	-33.8	175	-72.3	-171.1	173.8	0	0	112.1	L13 L19 D20	L13-E17 PolarHBondContact O-N 3.43Å; E17-L19 PolarHBondContact O-N 3.07Å; E17-D20 WeakPolarHBondContact O-CB 3.4Å; E17-D20 PolarHBondContact O-N 2.85Å; E17-D20 VanDerWaalsContact O-N 3.07Å
18	S	80	Confident	77.1	Confident	84 Å²	84	119.9 Å²	119.9	59%	0.587	64%	0.636	S	S	*	*	H	α-helix	trans	-68.8	-21.3	176.5	77.1	0	0	0	0	113.9	D14 F15 I16 D20	D14-S18 WeakPolarHBondContact O-CB 3.16Å; D14-S18 PolarHBondContact O-N 3.3Å; F15-S18 PolarHBondContact O-N 3.28Å; F15-S18 PolarHBondContact O-OG 3.25Å; I16-S18 VanDerWaalsContact C-N 3.29Å; I16-S18 PolarHBondContact O-N 2.97Å; S18-D20 VanDerWaalsContact C-N 3.3Å
19	L	83.1	Confident	77.5	Confident	119 Å²	119	115.9 Å²	115.9	62%	0.623	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-11.9	173	-68.9	172.3	0	0	0	112.3	F15 I16 E17 A21	F15-L19 HydrophobicContact CD1-CD1 4.2Å; F15-L19 HydrophobicContact CE1-CD1 3.69Å; F15-L19 HydrophobicContact CE1-CG 4.44Å; F15-L19 HydrophobicContact CZ-CD1 4.07Å; F15-L19 HydrophobicContact CZ-CG 4.46Å; F15-L19 PolarHBondContact O-N 3.16Å; I16-L19 PolarHBondContact O-N 3.16Å; E17-L19 PolarHBondContact O-N 3.07Å; L19-A21 PolarHBondContact O-N 3.35Å
20	D	76.3	Confident	77.9	Confident	91 Å²	91	117.7 Å²	117.7	49%	0.487	63%	0.627	S	S	.	*			trans	-78.9	86.5	174.7	-167.1	7.8	0	0	0	110.1	E17 S18 F22	E17-D20 WeakPolarHBondContact O-CB 3.4Å; E17-D20 PolarHBondContact O-N 2.85Å; E17-D20 VanDerWaalsContact O-N 3.07Å; S18-D20 VanDerWaalsContact C-N 3.3Å; D20-F22 PolarHBondContact O-N 3.1Å; D20-F22 PolarHBondContact OD1-N 3.25Å
21	A	80.6	Confident	77.6	Confident	89 Å²	89	120 Å²	120	74%	0.736	64%	0.637	S	S	*	*			trans	-77.2	-2.9	-179.2	0	0	0	0	0	113.8	L19	L19-A21 PolarHBondContact O-N 3.35Å
22	F	80	Confident	76.9	Confident	167 Å²	167	124.4 Å²	124.4	73%	0.732	65%	0.646	S	S	*	*	S	Bend	trans	-97.8	132.5	-171.1	-68	-73.6	0	0	0	112.9	D20 K24	D20-F22 PolarHBondContact O-N 3.1Å; D20-F22 PolarHBondContact OD1-N 3.25Å; F22-K24 PolarHBondContact O-N 2.97Å
23	P	77.9	Confident	76.1	Confident	116 Å²	116	125.3 Å²	125.3	75%	0.753	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-65.3	130.9	174.9	26.2	-32.2	0	0	0	110.5	V25	P23-V25 PolarHBondContact O-N 2.92Å
24	K	77	Confident	75.6	Confident	182 Å²	182	121.2 Å²	121.2	79%	0.791	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-66.7	126.4	178.1	-65	178.2	-179.1	175.6	0	110	F22	F22-K24 PolarHBondContact O-N 2.97Å
25	V	79.1	Confident	75.4	Confident	97 Å²	97	123 Å²	123	59%	0.588	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-77.6	138.5	-178.4	-176	0	0	0	0	111	P23 V29 K30	P23-V25 PolarHBondContact O-N 2.92Å; V25-V29 HydrophobicContact CG1-CB 4.09Å; V25-V29 HydrophobicContact CG1-CG1 4.43Å; V25-K30 WeakPolarHBondContact O-CE 3.48Å
26	N	76.9	Confident	75.2	Confident	119 Å²	119	121.1 Å²	121.1	64%	0.636	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-57.5	143	175.9	-71.2	-14.5	0	0	0	111.9	D28 V29	N26-D28 VanDerWaalsContact C-N 3.25Å; N26-D28 PolarHBondContact O-N 3.07Å; N26-V29 PolarHBondContact O-N 2.93Å
27	E	70.9	Confident	75.2	Confident	151 Å²	151	119.3 Å²	119.3	71%	0.706	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-64	-27.3	-174.8	-59.9	-169.8	160	0	0	113.9	V29 K30	E27-V29 PolarHBondContact O-N 3.47Å; E27-K30 WeakPolarHBondContact O-CB 3.42Å; E27-K30 PolarHBondContact O-N 3.33Å; E27-K30 VanDerWaalsContact O-N 3.1Å
28	D	73.7	Confident	75.6	Confident	161 Å²	161	115 Å²	115	86%	0.861	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-66.5	-21.5	179.9	-56.4	-36.5	0	0	0	113.6	N26	N26-D28 VanDerWaalsContact C-N 3.25Å; N26-D28 PolarHBondContact O-N 3.07Å
29	V	70.7	Confident	76	Confident	106 Å²	106	115.1 Å²	115.1	64%	0.642	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-92.9	-9	178.7	-171.7	0	0	0	0	111.3	V25 N26 E27 E31	V25-V29 HydrophobicContact CG1-CB 4.09Å; V25-V29 HydrophobicContact CG1-CG1 4.43Å; N26-V29 PolarHBondContact O-N 2.93Å; E27-V29 PolarHBondContact O-N 3.47Å; V29-E31 PolarHBondContact O-N 2.67Å
30	K	68.2	Low	76.3	Confident	116 Å²	116	110.5 Å²	110.5	50%	0.504	60%	0.596	S	S	.	*	S	Bend	trans	-76.5	115.7	179.1	-62.1	178.8	-173.9	170.7	0	109.1	V25 E27 K32	V25-K30 WeakPolarHBondContact O-CE 3.48Å; E27-K30 WeakPolarHBondContact O-CB 3.42Å; E27-K30 PolarHBondContact O-N 3.33Å; E27-K30 VanDerWaalsContact O-N 3.1Å; K30-K32 PolarHBondContact O-N 3.4Å; K30-K32 VanDerWaalsContact O-N 3.16Å
31	E	66.8	Low	76.9	Confident	184 Å²	184	112 Å²	112	86%	0.86	60%	0.598	S	S	*	*			trans	-57.9	121	164.7	-68.2	-176.8	178.1	0	0	108.1	V29 P33	V29-E31 PolarHBondContact O-N 2.67Å; E31-P33 WeakPolarHBondContact O-CD 3.17Å; E31-P33 VanDerWaalsContact O-N 3.09Å
32	K	63.1	Low	77.4	Confident	197 Å²	197	111.9 Å²	111.9	86%	0.857	59%	0.588	S	S	*	*			trans	-65.3	113.5	176.7	-68.4	-178	-177.7	178.3	0	106.8	K30 S34	K30-K32 PolarHBondContact O-N 3.4Å; K30-K32 VanDerWaalsContact O-N 3.16Å; K32-S34 PolarHBondContact O-N 3.4Å; K32-S34 VanDerWaalsContact O-N 3.16Å
33	P	65.8	Low	78	Confident	109 Å²	109	107.5 Å²	107.5	71%	0.708	58%	0.577	S	S	*	*			trans	-58.8	127.3	-179.1	24.1	-32.4	0	0	0	107.7	E31	E31-P33 WeakPolarHBondContact O-CD 3.17Å; E31-P33 VanDerWaalsContact O-N 3.09Å
34	S	70.9	Confident	78.7	Confident	14 Å²	14	102.5 Å²	102.5	10%	0.098	55%	0.545	C	S	.	.			trans	-64.5	145.2	177.3	93	0	0	0	0	108.7	K32 F36 H37	K32-S34 PolarHBondContact O-N 3.4Å; K32-S34 VanDerWaalsContact O-N 3.16Å; S34-F36 PolarHBondContact O-N 2.96Å; S34-H37 PolarHBondContact O-CD2 2.91Å; S34-H37 PolarHBondContact O-N 2.95Å; S34-H37 PolarHBondContact OG-CD2 2.95Å; S34-H37 PolarHBondContact OG-NE2 3.32Å
35	P	76.6	Confident	79.5	Confident	119 Å²	119	101.4 Å²	101.4	77%	0.773	54%	0.536	S	S	*	.	H	α-helix	trans	-56.7	-20.4	179.2	17.7	-29	0	0	0	112.9	G38 V39	P35-G38 PolarHBondContact O-N 3.39Å; P35-V39 PolarHBondContact O-N 3.35Å
36	F	80.8	Confident	80.3	Confident	88 Å²	88	100.3 Å²	100.3	39%	0.386	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-40	174.2	-175.9	-101.1	0	0	0	113.3	S34 G38 V39 V40 S350	S34-F36 PolarHBondContact O-N 2.96Å; F36-G38 VanDerWaalsContact C-N 3.26Å; F36-G38 PolarHBondContact O-N 2.99Å; F36-V39 PolarHBondContact O-N 3.46Å; F36-V39 VanDerWaalsContact O-N 3.13Å; F36-V40 HydrophobicContact CD1-CG2 3.92Å; F36-V40 HydrophobicContact CE1-CG2 3.44Å; F36-V40 VanDerWaalsContact CE1-CG2 3.44Å; F36-V40 HydrophobicContact CE2-CG2 4.23Å; F36-V40 HydrophobicContact CG-CG2 4.47Å; F36-V40 HydrophobicContact CZ-CG2 3.62Å; F36-V40 WeakPolarHBondContact O-CG2 3.27Å; F36-V40 PolarHBondContact O-N 2.96Å; F36-S350 WeakPolarHBondContact CE1-OG 3.29Å
37	H	82.9	Confident	81.2	Confident	64 Å²	64	98.4 Å²	98.4	30%	0.296	52%	0.522	S	S	.	.	H	α-helix	trans	-63	-36.3	179	-59.6	-108.3	0	0	0	111.4	S34 V40 F41 V347 D351	S34-H37 PolarHBondContact O-CD2 2.91Å; S34-H37 PolarHBondContact O-N 2.95Å; S34-H37 PolarHBondContact OG-CD2 2.95Å; S34-H37 PolarHBondContact OG-NE2 3.32Å; H37-V40 PolarHBondContact O-N 3.48Å; H37-F41 WeakPolarHBondContact O-CB 3.35Å; H37-F41 PolarHBondContact O-N 3.01Å; H37-V347 WeakPolarHBondContact CE1-CG1 3.34Å; H37-V347 WeakPolarHBondContact ND1-CG1 3.36Å; H37-D351 IonicContact CE1-OD2 2.83Å
38	G	86.4	Confident	82.4	Confident	43 Å²	43	92.2 Å²	92.2	44%	0.443	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-42.1	175.5	0	0	0	0	0	112.2	P35 F36 F41 V42	P35-G38 PolarHBondContact O-N 3.39Å; F36-G38 VanDerWaalsContact C-N 3.26Å; F36-G38 PolarHBondContact O-N 2.99Å; G38-F41 PolarHBondContact O-N 2.97Å; G38-V42 WeakPolarHBondContact O-CG2 3.37Å; G38-V42 PolarHBondContact O-N 3.4Å; G38-V42 VanDerWaalsContact O-N 3.09Å
39	V	88.8	Confident	83.4	Confident	86 Å²	86	88.3 Å²	88.3	52%	0.521	47%	0.471	S	S	.	.	H	α-helix	trans	-65.3	-46.9	176.7	177.9	0	0	0	0	111	P35 F36 F41 V42 C43	P35-V39 PolarHBondContact O-N 3.35Å; F36-V39 PolarHBondContact O-N 3.46Å; F36-V39 VanDerWaalsContact O-N 3.13Å; V39-F41 VanDerWaalsContact C-N 3.3Å; V39-F41 PolarHBondContact O-N 3.36Å; V39-V42 PolarHBondContact O-N 2.9Å; V39-C43 WeakPolarHBondContact O-CB 3.3Å; V39-C43 PolarHBondContact O-N 3.27Å; V39-C43 PolarHBondContact O-SG 3.39Å; V39-C43 VanDerWaalsContact O-SG 3.34Å
40	V	88.1	Confident	84.7	Confident	21 Å²	21	92.6 Å²	92.6	13%	0.127	48%	0.476	C	S	.	.	H	α-helix	trans	-60	-41.4	178.5	175.5	0	0	0	0	111.3	F36 H37 C43 S44 V347	F36-V40 HydrophobicContact CD1-CG2 3.92Å; F36-V40 HydrophobicContact CE1-CG2 3.44Å; F36-V40 VanDerWaalsContact CE1-CG2 3.44Å; F36-V40 HydrophobicContact CE2-CG2 4.23Å; F36-V40 HydrophobicContact CG-CG2 4.47Å; F36-V40 HydrophobicContact CZ-CG2 3.62Å; F36-V40 WeakPolarHBondContact O-CG2 3.27Å; F36-V40 PolarHBondContact O-N 2.96Å; H37-V40 PolarHBondContact O-N 3.48Å; V40-C43 PolarHBondContact O-N 3.38Å; V40-S44 WeakPolarHBondContact O-CB 3.09Å; V40-S44 PolarHBondContact O-N 3.34Å; V40-S44 PolarHBondContact O-OG 3.07Å; V40-V347 HydrophobicContact CB-CG2 4.44Å; V40-V347 HydrophobicContact CG1-CG2 4.06Å
41	F	89.6	Confident	86	Confident	122 Å²	122	90.4 Å²	90.4	54%	0.535	47%	0.469	S	S	.	.	H	α-helix	trans	-63.4	-44.5	177.2	-178.6	-98	0	0	0	112.8	H37 G38 V39 S44 W45	H37-F41 WeakPolarHBondContact O-CB 3.35Å; H37-F41 PolarHBondContact O-N 3.01Å; G38-F41 PolarHBondContact O-N 2.97Å; V39-F41 VanDerWaalsContact C-N 3.3Å; V39-F41 PolarHBondContact O-N 3.36Å; F41-S44 PolarHBondContact O-N 3.43Å; F41-S44 PolarHBondContact O-OG 3.03Å; F41-W45 WeakPolarHBondContact O-CB 3.34Å; F41-W45 PolarHBondContact O-N 2.99Å
42	V	91.9	Very high	87.5	Confident	87 Å²	87	83.9 Å²	83.9	53%	0.527	44%	0.442	S	S	.	.	H	α-helix	trans	-64	-44.9	176.6	173.3	0	0	0	0	110.5	G38 V39 S44 W45 C46	G38-V42 WeakPolarHBondContact O-CG2 3.37Å; G38-V42 PolarHBondContact O-N 3.4Å; G38-V42 VanDerWaalsContact O-N 3.09Å; V39-V42 PolarHBondContact O-N 2.9Å; V42-S44 PolarHBondContact O-N 3.05Å; V42-W45 PolarHBondContact O-N 3.41Å; V42-C46 PolarHBondContact O-N 3.24Å; V42-C46 PolarHBondContact O-SG 3.11Å
43	C	92.5	Very high	89	Confident	75 Å²	75	81.1 Å²	81.1	51%	0.507	43%	0.427	S	S	.	.	H	α-helix	trans	-62.3	-42.6	177.6	-71.2	0	0	0	0	112.6	V39 V40 C46 L47	V39-C43 WeakPolarHBondContact O-CB 3.3Å; V39-C43 PolarHBondContact O-N 3.27Å; V39-C43 PolarHBondContact O-SG 3.39Å; V39-C43 VanDerWaalsContact O-SG 3.34Å; V40-C43 PolarHBondContact O-N 3.38Å; C43-C46 PolarHBondContact O-N 3.25Å; C43-L47 WeakPolarHBondContact O-CB 3.27Å; C43-L47 PolarHBondContact O-N 2.91Å
44	S	92	Very high	90.4	Very high	12 Å²	12	78.8 Å²	78.8	8%	0.084	41%	0.413	C	S	.	.	H	α-helix	trans	-66.1	-39.6	178.9	69.4	0	0	0	0	111.6	V40 F41 V42 L47 I48	V40-S44 WeakPolarHBondContact O-CB 3.09Å; V40-S44 PolarHBondContact O-N 3.34Å; V40-S44 PolarHBondContact O-OG 3.07Å; F41-S44 PolarHBondContact O-N 3.43Å; F41-S44 PolarHBondContact O-OG 3.03Å; V42-S44 PolarHBondContact O-N 3.05Å; S44-L47 WeakPolarHBondContact O-CB 3.38Å; S44-L47 PolarHBondContact O-N 2.78Å; S44-I48 VanDerWaalsContact O-CG1 3.32Å; S44-I48 WeakPolarHBondContact O-CG1 3.44Å; S44-I48 PolarHBondContact O-N 3.43Å
45	W	94	Very high	91.6	Very high	158 Å²	158	80.2 Å²	80.2	60%	0.598	42%	0.419	S	S	*	.	H	α-helix	trans	-66.3	-43.3	176.8	-161.9	76.5	0	0	0	112.3	F41 V42 L47 I48 I49	F41-W45 WeakPolarHBondContact O-CB 3.34Å; F41-W45 PolarHBondContact O-N 2.99Å; V42-W45 PolarHBondContact O-N 3.41Å; W45-L47 VanDerWaalsContact C-N 3.29Å; W45-L47 PolarHBondContact O-N 3.46Å; W45-I48 PolarHBondContact O-N 3.13Å; W45-I49 HydrophobicContact CD2-CD1 3.66Å; W45-I49 HydrophobicContact CD2-CG1 4.41Å; W45-I49 HydrophobicContact CE3-CD1 3.33Å; W45-I49 HydrophobicContact CE3-CG1 4.44Å; W45-I49 HydrophobicContact CH2-CD1 3.34Å; W45-I49 HydrophobicContact CZ2-CD1 3.64Å; W45-I49 HydrophobicContact CZ3-CD1 3.16Å; W45-I49 WeakPolarHBondContact O-CG1 3.39Å; W45-I49 PolarHBondContact O-N 3.32Å
46	C	95.6	Very high	92.4	Very high	74 Å²	74	78.6 Å²	78.6	50%	0.5	40%	0.403	S	S	.	.	H	α-helix	trans	-58.4	-42.4	172.5	-71.4	0	0	0	0	111.9	V42 C43 I49 W50	V42-C46 PolarHBondContact O-N 3.24Å; V42-C46 PolarHBondContact O-SG 3.11Å; C43-C46 PolarHBondContact O-N 3.25Å; C46-I49 PolarHBondContact O-N 2.96Å; C46-W50 PolarHBondContact O-N 3.4Å
47	L	95.5	Very high	92.9	Very high	80 Å²	80	78 Å²	78	42%	0.419	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-46.8	177.4	-171	169.9	0	0	0	111	C43 S44 W45 I49 W50 L51 V339	C43-L47 WeakPolarHBondContact O-CB 3.27Å; C43-L47 PolarHBondContact O-N 2.91Å; S44-L47 WeakPolarHBondContact O-CB 3.38Å; S44-L47 PolarHBondContact O-N 2.78Å; W45-L47 VanDerWaalsContact C-N 3.29Å; W45-L47 PolarHBondContact O-N 3.46Å; L47-I49 PolarHBondContact O-N 2.85Å; L47-W50 PolarHBondContact O-N 3.28Å; L47-L51 HydrophobicContact CD2-CD1 3.3Å; L47-L51 HydrophobicContact CD2-CG 3.77Å; L47-L51 PolarHBondContact O-N 2.98Å; L47-V339 HydrophobicContact CD2-CG1 4.48Å; L47-V339 HydrophobicContact CD2-CG2 3.57Å
48	I	95.9	Very high	93.2	Very high	21 Å²	21	78.8 Å²	78.8	11%	0.108	40%	0.404	C	S	.	.	H	α-helix	trans	-57.2	-48.9	176.7	-70.4	164.5	0	0	0	110.5	S44 W45 W50 L51 V52 I336 V339	S44-I48 VanDerWaalsContact O-CG1 3.32Å; S44-I48 WeakPolarHBondContact O-CG1 3.44Å; S44-I48 PolarHBondContact O-N 3.43Å; W45-I48 PolarHBondContact O-N 3.13Å; I48-W50 VanDerWaalsContact C-N 3.32Å; I48-W50 PolarHBondContact O-N 2.95Å; I48-L51 PolarHBondContact O-N 2.95Å; I48-V52 HydrophobicContact CG2-CG2 4.06Å; I48-V52 WeakPolarHBondContact O-CB 3.38Å; I48-V52 VanDerWaalsContact O-CG2 3.22Å; I48-V52 WeakPolarHBondContact O-CG2 3.46Å; I48-V52 PolarHBondContact O-N 3.05Å; I48-I336 HydrophobicContact CG2-CG1 4.47Å; I48-V339 HydrophobicContact CD1-CB 4.02Å; I48-V339 HydrophobicContact CD1-CG1 3.85Å; I48-V339 HydrophobicContact CG1-CB 3.72Å; I48-V339 HydrophobicContact CG1-CG1 3.69Å; I48-V339 HydrophobicContact CG1-CG2 3.86Å
49	I	96.2	Very high	93.5	Very high	79 Å²	79	79.2 Å²	79.2	41%	0.405	39%	0.393	S	S	.	.	H	α-helix	trans	-59.6	-44.7	179.9	-71.7	174.4	0	0	0	111.2	W45 C46 L47 Y53	W45-I49 HydrophobicContact CD2-CD1 3.66Å; W45-I49 HydrophobicContact CD2-CG1 4.41Å; W45-I49 HydrophobicContact CE3-CD1 3.33Å; W45-I49 HydrophobicContact CE3-CG1 4.44Å; W45-I49 HydrophobicContact CH2-CD1 3.34Å; W45-I49 HydrophobicContact CZ2-CD1 3.64Å; W45-I49 HydrophobicContact CZ3-CD1 3.16Å; W45-I49 WeakPolarHBondContact O-CG1 3.39Å; W45-I49 PolarHBondContact O-N 3.32Å; C46-I49 PolarHBondContact O-N 2.96Å; L47-I49 PolarHBondContact O-N 2.85Å; I49-Y53 VanDerWaalsContact O-CB 3.3Å; I49-Y53 WeakPolarHBondContact O-CB 3.42Å; I49-Y53 PolarHBondContact O-N 3.21Å
50	W	97.3	Very high	93.5	Very high	196 Å²	196	83.7 Å²	83.7	74%	0.742	40%	0.4	S	S	*	.	H	α-helix	trans	-60.5	-52.9	176.1	-178	-7.6	0	0	0	110.8	C46 L47 I48 V52 Y53 S54	C46-W50 PolarHBondContact O-N 3.4Å; L47-W50 PolarHBondContact O-N 3.28Å; I48-W50 VanDerWaalsContact C-N 3.32Å; I48-W50 PolarHBondContact O-N 2.95Å; W50-V52 VanDerWaalsContact C-N 3.33Å; W50-V52 PolarHBondContact O-N 2.88Å; W50-Y53 WeakPolarHBondContact O-CB 3.3Å; W50-Y53 PolarHBondContact O-N 3.24Å; W50-Y53 VanDerWaalsContact O-N 3.13Å; W50-S54 PolarHBondContact O-N 2.68Å
51	L	96.2	Very high	93.5	Very high	69 Å²	69	88.7 Å²	88.7	36%	0.361	42%	0.422	S	S	.	.	H	α-helix	trans	-60.9	-41.2	-179	-72.3	-176.4	0	0	0	112.6	L47 I48 S54 E55 I335 V339	L47-L51 HydrophobicContact CD2-CD1 3.3Å; L47-L51 HydrophobicContact CD2-CG 3.77Å; L47-L51 PolarHBondContact O-N 2.98Å; I48-L51 PolarHBondContact O-N 2.95Å; L51-S54 WeakPolarHBondContact O-CB 3.36Å; L51-S54 PolarHBondContact O-N 2.96Å; L51-E55 PolarHBondContact O-N 3.27Å; L51-I335 HydrophobicContact CB-CD1 4.07Å; L51-I335 HydrophobicContact CB-CG1 4.43Å; L51-I335 HydrophobicContact CB-CG2 3.8Å; L51-I335 HydrophobicContact CD1-CG2 3.99Å; L51-V339 HydrophobicContact CD1-CG2 4.37Å
52	V	96.4	Very high	93.4	Very high	47 Å²	47	86 Å²	86	29%	0.285	41%	0.413	S	S	.	.	H	α-helix	trans	-61.9	-44.3	175	168.6	0	0	0	0	110.8	I48 W50 S54 E55 L56 L332 I335	I48-V52 HydrophobicContact CG2-CG2 4.06Å; I48-V52 WeakPolarHBondContact O-CB 3.38Å; I48-V52 VanDerWaalsContact O-CG2 3.22Å; I48-V52 WeakPolarHBondContact O-CG2 3.46Å; I48-V52 PolarHBondContact O-N 3.05Å; W50-V52 VanDerWaalsContact C-N 3.33Å; W50-V52 PolarHBondContact O-N 2.88Å; V52-S54 VanDerWaalsContact C-N 3.32Å; V52-S54 PolarHBondContact O-N 3.49Å; V52-E55 PolarHBondContact O-N 3.46Å; V52-L56 WeakPolarHBondContact O-CB 3.19Å; V52-L56 PolarHBondContact O-N 3.45Å; V52-L332 HydrophobicContact CB-CD2 4.31Å; V52-L332 HydrophobicContact CG1-CD2 3.92Å; V52-L332 HydrophobicContact CG2-CD2 3.99Å; V52-I335 HydrophobicContact CG2-CG2 4.42Å
53	Y	96.1	Very high	93.2	Very high	139 Å²	139	84.8 Å²	84.8	55%	0.545	40%	0.403	S	S	.	.	H	α-helix	trans	-60.8	-42.6	174.8	-179.5	-96.2	0	0	0	111.6	I49 W50 L56 Q57	I49-Y53 VanDerWaalsContact O-CB 3.3Å; I49-Y53 WeakPolarHBondContact O-CB 3.42Å; I49-Y53 PolarHBondContact O-N 3.21Å; W50-Y53 WeakPolarHBondContact O-CB 3.3Å; W50-Y53 PolarHBondContact O-N 3.24Å; W50-Y53 VanDerWaalsContact O-N 3.13Å; Y53-L56 PolarHBondContact O-N 3.44Å; Y53-Q57 HydrophobicContact CD1-CG 4.22Å; Y53-Q57 HydrophobicContact CE1-CG 3.83Å; Y53-Q57 WeakPolarHBondContact O-CG 3.44Å; Y53-Q57 PolarHBondContact O-N 3.24Å; Y53-Q57 PolarHBondContact OH-NE2 3.09Å
54	S	94.9	Very high	93.1	Very high	60 Å²	60	84.1 Å²	84.1	42%	0.42	39%	0.394	S	S	.	.	H	α-helix	trans	-61.9	-47	176.9	-172.6	0	0	0	0	112.2	W50 L51 V52 L56 Q57 F58	W50-S54 PolarHBondContact O-N 2.68Å; L51-S54 WeakPolarHBondContact O-CB 3.36Å; L51-S54 PolarHBondContact O-N 2.96Å; V52-S54 VanDerWaalsContact C-N 3.32Å; V52-S54 PolarHBondContact O-N 3.49Å; S54-L56 VanDerWaalsContact C-N 3.31Å; S54-L56 PolarHBondContact O-N 3.07Å; S54-Q57 PolarHBondContact O-N 2.96Å; S54-F58 PolarHBondContact O-N 3.47Å
55	E	94.9	Very high	93.1	Very high	45 Å²	45	85.4 Å²	85.4	21%	0.21	40%	0.4	C	S	.	.	H	α-helix	trans	-64.7	-36.4	175.6	-78.3	-60.7	152.8	0	0	112	L51 V52 Q57 F58 Y59 R331 I335	L51-E55 PolarHBondContact O-N 3.27Å; V52-E55 PolarHBondContact O-N 3.46Å; E55-Q57 VanDerWaalsContact C-N 3.33Å; E55-Q57 PolarHBondContact O-N 3.34Å; E55-F58 PolarHBondContact O-N 3.5Å; E55-Y59 WeakPolarHBondContact O-CB 3.35Å; E55-Y59 PolarHBondContact O-N 3.4Å; E55-R331 IonicContact OE1-NH1 2.78Å; E55-R331 WeakPolarHBondContact OE2-CD 3.49Å; E55-R331 IonicContact OE2-CZ 3.59Å; E55-R331 IonicContact OE2-NE 3.65Å; E55-R331 IonicContact OE2-NH1 2.7Å; E55-R331 PolarHBondContact OE2-NH1 2.86Å; E55-I335 HydrophobicContact CB-CD1 4.31Å; E55-I335 HydrophobicContact CG-CD1 3.4Å; E55-I335 VanDerWaalsContact CG-CD1 3.4Å
56	L	93.8	Very high	93.1	Very high	85 Å²	85	83.6 Å²	83.6	45%	0.445	39%	0.394	S	S	.	.	H	α-helix	trans	-65	-39.3	175.7	-174.5	62.8	0	0	0	111.2	V52 Y53 S54 Y59 R60	V52-L56 WeakPolarHBondContact O-CB 3.19Å; V52-L56 PolarHBondContact O-N 3.45Å; Y53-L56 PolarHBondContact O-N 3.44Å; S54-L56 VanDerWaalsContact C-N 3.31Å; S54-L56 PolarHBondContact O-N 3.07Å; L56-Y59 PolarHBondContact O-N 2.93Å; L56-R60 VanDerWaalsContact O-CG 3.29Å; L56-R60 WeakPolarHBondContact O-CG 3.45Å; L56-R60 PolarHBondContact O-N 3.44Å
57	Q	92.2	Very high	93.2	Very high	74 Å²	74	86.2 Å²	86.2	35%	0.346	39%	0.394	S	S	.	.	H	α-helix	trans	-64.6	-44.7	173.3	-69	-64.7	0.2	0	0	111.4	Y53 S54 E55 Y59 R60 E61	Y53-Q57 HydrophobicContact CD1-CG 4.22Å; Y53-Q57 HydrophobicContact CE1-CG 3.83Å; Y53-Q57 WeakPolarHBondContact O-CG 3.44Å; Y53-Q57 PolarHBondContact O-N 3.24Å; Y53-Q57 PolarHBondContact OH-NE2 3.09Å; S54-Q57 PolarHBondContact O-N 2.96Å; E55-Q57 VanDerWaalsContact C-N 3.33Å; E55-Q57 PolarHBondContact O-N 3.34Å; Q57-Y59 VanDerWaalsContact C-N 3.32Å; Q57-Y59 PolarHBondContact O-N 2.93Å; Q57-R60 WeakPolarHBondContact O-CB 3.37Å; Q57-R60 PolarHBondContact O-N 3.38Å; Q57-R60 VanDerWaalsContact O-N 3.12Å; Q57-E61 PolarHBondContact O-N 3.27Å
58	F	89.3	Confident	93.2	Very high	82 Å²	82	89.2 Å²	89.2	36%	0.36	40%	0.403	S	S	.	.	H	α-helix	trans	-61.9	-37.9	176.5	-176.7	-108.3	0	0	0	112.8	S54 E55 R60 E61 Q323	S54-F58 PolarHBondContact O-N 3.47Å; E55-F58 PolarHBondContact O-N 3.5Å; F58-R60 VanDerWaalsContact C-N 3.28Å; F58-R60 PolarHBondContact O-N 3.46Å; F58-E61 WeakPolarHBondContact O-CB 3.49Å; F58-E61 PolarHBondContact O-N 3.46Å; F58-Q323 VanDerWaalsContact CD1-NE2 3.27Å
59	Y	91.9	Very high	93.2	Very high	51 Å²	51	93.1 Å²	93.1	20%	0.2	42%	0.42	C	S	.	.	H	α-helix	trans	-66.7	-29.2	175.7	177.2	-99	0	0	0	113.1	E55 L56 Q57 E61 Q323 I325 L328	E55-Y59 WeakPolarHBondContact O-CB 3.35Å; E55-Y59 PolarHBondContact O-N 3.4Å; L56-Y59 PolarHBondContact O-N 2.93Å; Q57-Y59 VanDerWaalsContact C-N 3.32Å; Q57-Y59 PolarHBondContact O-N 2.93Å; Y59-E61 VanDerWaalsContact C-N 3.27Å; Y59-Q323 HydrophobicContact CD2-CB 3.76Å; Y59-Q323 HydrophobicContact CE2-CB 4Å; Y59-Q323 VanDerWaalsContact CE2-O 3.32Å; Y59-Q323 WeakPolarHBondContact CE2-O 3.39Å; Y59-I325 WeakPolarHBondContact OH-CG1 3.49Å; Y59-L328 HydrophobicContact CD1-CD2 3.87Å; Y59-L328 HydrophobicContact CD2-CB 3.74Å; Y59-L328 HydrophobicContact CD2-CD1 4.33Å; Y59-L328 HydrophobicContact CD2-CD2 3.88Å; Y59-L328 HydrophobicContact CD2-CG 4.19Å; Y59-L328 HydrophobicContact CE1-CD2 4.08Å; Y59-L328 HydrophobicContact CE2-CB 3.99Å; Y59-L328 HydrophobicContact CE2-CD2 4.08Å; Y59-L328 HydrophobicContact CG-CB 4.38Å; Y59-L328 HydrophobicContact CG-CD1 4.19Å; Y59-L328 HydrophobicContact CG-CD2 3.78Å; Y59-L328 HydrophobicContact CG-CG 4.33Å
60	R	89.3	Confident	93.1	Very high	180 Å²	180	95.4 Å²	95.4	68%	0.679	43%	0.432	S	S	*	.	H	α-helix	trans	-74.1	-20.7	175	-69.7	174.7	82.7	-179.2	7.1	112.4	L56 Q57 F58	L56-R60 VanDerWaalsContact O-CG 3.29Å; L56-R60 WeakPolarHBondContact O-CG 3.45Å; L56-R60 PolarHBondContact O-N 3.44Å; Q57-R60 WeakPolarHBondContact O-CB 3.37Å; Q57-R60 PolarHBondContact O-N 3.38Å; Q57-R60 VanDerWaalsContact O-N 3.12Å; F58-R60 VanDerWaalsContact C-N 3.28Å; F58-R60 PolarHBondContact O-N 3.46Å
61	E	87.4	Confident	92.8	Very high	127 Å²	127	86.8 Å²	86.8	59%	0.593	40%	0.4	S	S	*	.	S	Bend	trans	-71	138.6	176.8	-164.2	170.2	-175.6	0	0	111.3	Q57 F58 Y59	Q57-E61 PolarHBondContact O-N 3.27Å; F58-E61 WeakPolarHBondContact O-CB 3.49Å; F58-E61 PolarHBondContact O-N 3.46Å; Y59-E61 VanDerWaalsContact C-N 3.27Å
62	L	87.6	Confident	92.5	Very high	66 Å²	66	89.7 Å²	89.7	35%	0.346	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-87.8	131.7	178.1	-72.9	165	0	0	0	109.7	A274 K322	L62-A274 HydrophobicContact CD2-CB 3.63Å; L62-K322 HydrophobicContact CD2-CG 3.68Å
63	I	87.3	Confident	92.1	Very high	61 Å²	61	90.1 Å²	90.1	31%	0.313	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.6	175.3	-57.9	173	0	0	0	108.7	Q320 R321 Q323	I63-Q320 WeakPolarHBondContact O-CA 3.12Å; I63-R321 HydrophobicContact CB-CG 4.35Å; I63-R321 PolarHBondContact N-O 2.98Å; I63-R321 PolarHBondContact O-N 3.2Å; I63-Q323 HydrophobicContact CD1-CG 3.5Å; I63-Q323 VanDerWaalsContact CD1-CG 3.5Å; I63-Q323 HydrophobicContact CG1-CG 4.31Å
64	N	90.6	Very high	91.4	Very high	60 Å²	60	92.2 Å²	92.2	32%	0.321	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	118.1	172.2	-61.2	-30.8	0	0	0	109.6	Y66 I318 Q320	N64-Y66 HydrophobicContact CB-CE2 3.74Å; N64-I318 HydrophobicContact CB-CG2 3.95Å; N64-Q320 WeakPolarHBondContact OD1-CG 3.36Å; N64-Q320 PolarHBondContact OD1-NE2 3.39Å
65	D	92.8	Very high	90.9	Very high	39 Å²	39	96.7 Å²	96.7	21%	0.209	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124	171.7	-175.3	24.4	0	0	0	109.4	R67 I318 T319 R321	D65-R67 IonicContact OD2-CZ 2.78Å; D65-R67 IonicContact OD2-NE 3.63Å; D65-R67 PolarHBondContact OD2-NE 3.32Å; D65-R67 IonicContact OD2-NH2 3.67Å; D65-R67 PolarHBondContact OD2-NH2 3.01Å; D65-R67 VanDerWaalsContact OD2-NH2 3.16Å; D65-I318 WeakPolarHBondContact O-CA 3.43Å; D65-T319 PolarHBondContact N-O 3.03Å; D65-T319 PolarHBondContact O-N 3.23Å; D65-R321 IonicContact OD2-NH1 3.89Å; D65-R321 PolarHBondContact OD2-NH1 3.03Å
66	Y	94.3	Very high	90.5	Very high	121 Å²	121	97.3 Å²	97.3	48%	0.475	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.6	-173.5	-63.7	-92.9	0	0	0	110.4	N64 V316 I318	N64-Y66 HydrophobicContact CB-CE2 3.74Å; Y66-V316 HydrophobicContact CD1-CG1 4.2Å; Y66-I318 HydrophobicContact CD1-CD1 4.14Å; Y66-I318 HydrophobicContact CD1-CG1 3.8Å; Y66-I318 HydrophobicContact CE1-CD1 3.71Å; Y66-I318 HydrophobicContact CE1-CG1 3.84Å; Y66-I318 HydrophobicContact CE1-CG2 4.33Å
67	R	96.5	Very high	90.2	Very high	129 Å²	129	99.2 Å²	99.2	49%	0.487	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.8	174.4	-62.3	-178.1	-174.9	179.1	2.3	110.1	D65 F69 D317	D65-R67 IonicContact OD2-CZ 2.78Å; D65-R67 IonicContact OD2-NE 3.63Å; D65-R67 PolarHBondContact OD2-NE 3.32Å; D65-R67 IonicContact OD2-NH2 3.67Å; D65-R67 PolarHBondContact OD2-NH2 3.01Å; D65-R67 VanDerWaalsContact OD2-NH2 3.16Å; R67-F69 HydrophobicContact CB-CD2 4.31Å; R67-F69 HydrophobicContact CB-CE2 3.55Å; R67-F69 HydrophobicContact CB-CZ 3.93Å; R67-D317 HydrophobicContact CB-CB 4.42Å; R67-D317 PolarHBondContact N-O 3.16Å; R67-D317 PolarHBondContact O-N 3.36Å
68	F	96.3	Very high	90	Very high	142 Å²	142	96.2 Å²	96.2	62%	0.623	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	125	-179.1	-58.6	-87.5	0	0	0	108.9	I314 L315 V316	F68-I314 HydrophobicContact CB-CG2 4.09Å; F68-I314 HydrophobicContact CD1-CG2 4.08Å; F68-L315 WeakPolarHBondContact CA-O 3.49Å; F68-V316 HydrophobicContact CD1-CG2 3.9Å; F68-V316 HydrophobicContact CE1-CG1 4.38Å; F68-V316 HydrophobicContact CE1-CG2 3.74Å
69	F	95.2	Very high	90	Very high	103 Å²	103	93.8 Å²	93.8	45%	0.452	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	168.2	178.7	-62	-74	0	0	0	109.8	R67 I314 L315 D317	R67-F69 HydrophobicContact CB-CD2 4.31Å; R67-F69 HydrophobicContact CB-CE2 3.55Å; R67-F69 HydrophobicContact CB-CZ 3.93Å; F69-I314 CarbonylContact O-C 3.54Å; F69-I314 WeakPolarHBondContact O-CA 3.26Å; F69-L315 PolarHBondContact N-O 2.96Å; F69-L315 PolarHBondContact O-N 2.79Å; F69-D317 HydrophobicContact CD2-CB 3.69Å; F69-D317 HydrophobicContact CE2-CB 3.67Å
70	I	95.1	Very high	90	Very high	127 Å²	127	91.6 Å²	91.6	65%	0.651	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	132.1	168	-60.7	169.7	0	0	0	107.2	I72	I70-I72 PolarHBondContact O-N 2.88Å
71	D	90.9	Very high	90.1	Very high	16 Å²	16	84.2 Å²	84.2	9%	0.086	40%	0.395	C	S	.	.			trans	-69.9	117.8	172.1	-166.8	-2.1	0	0	0	109.4	D73 K192 P313 L315	D71-D73 PolarHBondContact OD1-N 3.3Å; D71-K192 IonicContact OD1-NZ 3.88Å; D71-K192 PolarHBondContact OD1-NZ 3.28Å; D71-K192 IonicContact OD2-NZ 3.91Å; D71-K192 PolarHBondContact OD2-NZ 3.05Å; D71-P313 PolarHBondContact N-O 3.24Å; D71-L315 HydrophobicContact CB-CB 4.09Å
72	I	90.2	Very high	90.4	Very high	129 Å²	129	78.5 Å²	78.5	66%	0.662	37%	0.369	S	S	*	.			trans	-98.9	-10.2	178.9	58.3	171.5	0	0	0	112.4	I70 Y74	I70-I72 PolarHBondContact O-N 2.88Å; I72-Y74 VanDerWaalsContact O-CD2 3.27Å; I72-Y74 WeakPolarHBondContact O-CD2 3.32Å; I72-Y74 PolarHBondContact O-N 3.45Å
73	D	87.3	Confident	90.7	Very high	57 Å²	57	75.6 Å²	75.6	31%	0.305	35%	0.353	S	S	.	.			trans	-90.4	79.9	-173.1	-73.6	-15.4	0	0	0	110.3	D71 E76 K192 R280	D71-D73 PolarHBondContact OD1-N 3.3Å; D73-E76 HydrophobicContact CB-CB 4.27Å; D73-K192 WeakPolarHBondContact O-CD 3.45Å; D73-K192 WeakPolarHBondContact O-CE 3.39Å; D73-K192 PolarHBondContact O-NZ 3.19Å; D73-R280 IonicContact OD2-CZ 2.87Å; D73-R280 IonicContact OD2-NH1 2.83Å; D73-R280 PolarHBondContact OD2-NH1 3.2Å; D73-R280 IonicContact OD2-NH2 3.47Å; D73-R280 PolarHBondContact OD2-NH2 2.83Å
74	Y	82.8	Confident	91	Very high	182 Å²	182	72.7 Å²	72.7	71%	0.714	34%	0.339	S	S	*	.			trans	-72.1	-32.3	-177.1	-60.6	-80.6	0	0	0	114.9	I72 E76	I72-Y74 VanDerWaalsContact O-CD2 3.27Å; I72-Y74 WeakPolarHBondContact O-CD2 3.32Å; I72-Y74 PolarHBondContact O-N 3.45Å; Y74-E76 VanDerWaalsContact C-N 3.34Å
75	D	84.2	Confident	91.2	Very high	155 Å²	155	70 Å²	70	83%	0.829	32%	0.324	S	S	*	.	S	Bend	trans	-83.8	-11.9	-174.3	-66.1	-44.9	0	0	0	113.6	K77	D75-K77 PolarHBondContact O-N 3.36Å
76	E	85.8	Confident	91.3	Very high	58 Å²	58	68.1 Å²	68.1	27%	0.271	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-66	129.6	179.3	175.4	175.1	-137.7	0	0	110.5	D73 Y74 K192 R280	D73-E76 HydrophobicContact CB-CB 4.27Å; Y74-E76 VanDerWaalsContact C-N 3.34Å; E76-K192 HydrophobicContact CB-CD 4.5Å; E76-K192 VanDerWaalsContact O-CG 3.28Å; E76-K192 WeakPolarHBondContact O-CG 3.45Å; E76-K192 WeakPolarHBondContact OE2-CE 3.45Å; E76-K192 IonicContact OE2-NZ 3.46Å; E76-K192 PolarHBondContact OE2-NZ 3.37Å; E76-R280 WeakPolarHBondContact OE1-CD 3.41Å; E76-R280 IonicContact OE1-CZ 3.99Å; E76-R280 IonicContact OE1-NE 3.84Å; E76-R280 IonicContact OE1-NH1 3.16Å; E76-R280 PolarHBondContact OE1-NH1 2.89Å; E76-R280 IonicContact OE2-NH1 3.75Å; E76-R280 PolarHBondContact OE2-NH1 3.15Å
77	K	86.7	Confident	91.3	Very high	125 Å²	125	63.2 Å²	63.2	54%	0.543	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-90.2	139.8	175.3	-63.8	-175.1	-179.1	-177.2	0	111	D75 L189 V190	D75-K77 PolarHBondContact O-N 3.36Å; K77-L189 HydrophobicContact CB-CB 4.12Å; K77-L189 HydrophobicContact CD-CB 4.13Å; K77-V190 CarbonylContact C-O 3.6Å; K77-V190 WeakPolarHBondContact CA-O 3.43Å; K77-V190 WeakPolarHBondContact CB-O 3.35Å
78	V	88.2	Confident	91.1	Very high	10 Å²	10	57.3 Å²	57.3	6%	0.061	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.4	178.2	-178	0	0	0	0	109.4	I80 V190 K192 F235 L311	V78-I80 PolarHBondContact O-N 3.24Å; V78-V190 HydrophobicContact CB-CG2 4.22Å; V78-V190 PolarHBondContact N-O 2.96Å; V78-V190 WeakPolarHBondContact O-CG2 3.38Å; V78-V190 PolarHBondContact O-N 2.77Å; V78-K192 HydrophobicContact CG2-CG 3.9Å; V78-F235 HydrophobicContact CG1-CB 4.01Å; V78-F235 HydrophobicContact CG1-CD1 4.39Å; V78-L311 HydrophobicContact CG2-CD2 4.03Å
79	P	90	Very high	90.8	Very high	31 Å²	31	52.6 Å²	52.6	20%	0.201	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	118.7	173.4	2	11.6	0	0	0	110.4	F188 L189 F235 G236	P79-F188 CarbonylContact C-O 3.6Å; P79-F188 WeakPolarHBondContact CA-O 3.49Å; P79-L189 HydrophobicContact CB-CD2 3.81Å; P79-L189 HydrophobicContact CG-CD2 3.97Å; P79-F235 CarbonylContact O-C 3.33Å; P79-G236 PolarHBondContact O-N 3.36Å
80	I	91.6	Very high	90.5	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.3	168.9	-58.1	-172.3	0	0	0	108.7	V78 Q187 F188 V190 L233 F235 Y309	V78-I80 PolarHBondContact O-N 3.24Å; I80-Q187 VanDerWaalsContact O-CA 3.29Å; I80-Q187 WeakPolarHBondContact O-CA 3.43Å; I80-F188 HydrophobicContact CB-CD2 4.23Å; I80-F188 HydrophobicContact CB-CE2 3.81Å; I80-F188 HydrophobicContact CB-CZ 3.97Å; I80-F188 HydrophobicContact CD1-CE2 3.97Å; I80-F188 HydrophobicContact CD1-CZ 4.47Å; I80-F188 HydrophobicContact CG1-CE2 4.26Å; I80-F188 HydrophobicContact CG2-CE1 4.44Å; I80-F188 HydrophobicContact CG2-CE2 4.25Å; I80-F188 HydrophobicContact CG2-CZ 3.93Å; I80-F188 PolarHBondContact N-O 3.01Å; I80-F188 PolarHBondContact O-N 3.23Å; I80-V190 HydrophobicContact CD1-CB 4.29Å; I80-V190 HydrophobicContact CD1-CG1 3.62Å; I80-V190 HydrophobicContact CD1-CG2 3.68Å; I80-V190 HydrophobicContact CG1-CG1 3.96Å; I80-V190 HydrophobicContact CG1-CG2 3.81Å; I80-L233 HydrophobicContact CG2-CD1 4.26Å; I80-F235 HydrophobicContact CD1-CD1 3.93Å; I80-F235 HydrophobicContact CD1-CE1 3.47Å; I80-F235 VanDerWaalsContact CD1-CE1 3.47Å; I80-F235 HydrophobicContact CD1-CZ 4.39Å; I80-F235 HydrophobicContact CG1-CD1 3.7Å; I80-F235 HydrophobicContact CG1-CE1 3.77Å; I80-Y309 HydrophobicContact CD1-CD1 4.43Å; I80-Y309 HydrophobicContact CD1-CE1 4.14Å; I80-Y309 HydrophobicContact CD1-CE2 4.45Å
81	N	92.1	Very high	90.1	Very high	25 Å²	25	46.6 Å²	46.6	13%	0.134	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119	169.6	-67.1	-62.7	0	0	0	108.6	G186 Q187 L233 A234 G236	N81-G186 WeakPolarHBondContact CA-O 3.42Å; N81-Q187 WeakPolarHBondContact OD1-CB 3.25Å; N81-Q187 WeakPolarHBondContact OD1-CG 3.38Å; N81-Q187 PolarHBondContact OD1-NE2 2.91Å; N81-L233 WeakPolarHBondContact O-CA 3.35Å; N81-A234 HydrophobicContact CB-CB 4.31Å; N81-A234 PolarHBondContact N-O 3.22Å; N81-A234 PolarHBondContact O-N 2.9Å; N81-G236 PolarHBondContact ND2-O 3.02Å
82	I	92	Very high	89.9	Confident	7 Å²	7	46.3 Å²	46.3	4%	0.036	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.5	177.4	-168.6	163.8	0	0	0	110.1	L84 Y185 G186 F188 F197 K232 L233 I307	I82-L84 HydrophobicContact CG1-CB 4.35Å; I82-Y185 CarbonylContact O-C 3.6Å; I82-Y185 WeakPolarHBondContact O-CA 3.28Å; I82-G186 PolarHBondContact N-O 3.35Å; I82-G186 PolarHBondContact O-N 3.03Å; I82-F188 HydrophobicContact CG2-CE1 3.93Å; I82-F197 HydrophobicContact CD1-CD1 3.81Å; I82-F197 HydrophobicContact CD1-CD2 4.3Å; I82-F197 HydrophobicContact CD1-CE1 3.48Å; I82-F197 VanDerWaalsContact CD1-CE1 3.48Å; I82-F197 HydrophobicContact CD1-CE2 3.99Å; I82-F197 HydrophobicContact CD1-CG 4.21Å; I82-F197 HydrophobicContact CD1-CZ 3.58Å; I82-K232 CarbonylContact C-O 3.53Å; I82-K232 WeakPolarHBondContact CA-O 3.4Å; I82-L233 HydrophobicContact CB-CD1 4.33Å; I82-L233 HydrophobicContact CD1-CD1 4.36Å; I82-L233 HydrophobicContact CG1-CD1 4.23Å; I82-I307 HydrophobicContact CD1-CD1 4.19Å
83	D	93.9	Very high	89.9	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	110	168.3	-158.5	-16.1	0	0	0	106.2	R166 R183 I184 E231 K232	D83-R166 IonicContact OD2-CZ 2.87Å; D83-R166 IonicContact OD2-NH1 3.26Å; D83-R166 PolarHBondContact OD2-NH1 3.5Å; D83-R166 IonicContact OD2-NH2 2.64Å; D83-R183 IonicContact OD1-CZ 2.7Å; D83-R183 IonicContact OD1-NE 2.82Å; D83-R183 PolarHBondContact OD1-NE 3.43Å; D83-R183 IonicContact OD1-NH2 2.8Å; D83-R183 PolarHBondContact OD1-NH2 3.14Å; D83-R183 IonicContact OD2-CZ 3.07Å; D83-R183 IonicContact OD2-NE 3.94Å; D83-R183 IonicContact OD2-NH2 3.71Å; D83-R183 PolarHBondContact OD2-NH2 3.46Å; D83-I184 WeakPolarHBondContact CA-O 3.38Å; D83-E231 HydrophobicContact CB-CB 4.01Å; D83-E231 PolarHBondContact O-N 3.32Å; D83-K232 HydrophobicContact CB-CB 3.91Å; D83-K232 PolarHBondContact N-O 2.73Å; D83-K232 PolarHBondContact O-N 3.39Å
84	L	94.3	Very high	89.8	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	126.5	-172.2	166.1	62.7	0	0	0	108.6	I82 V86 R183 I184 F197 V199 H228 R229 I230 E231	I82-L84 HydrophobicContact CG1-CB 4.35Å; L84-V86 HydrophobicContact CD1-CG2 4.46Å; L84-V86 HydrophobicContact CD2-CG2 4.35Å; L84-V86 HydrophobicContact CG-CG2 4.13Å; L84-R183 CarbonylContact O-C 3.51Å; L84-I184 HydrophobicContact CD2-CD1 4.16Å; L84-I184 HydrophobicContact CG-CD1 4.48Å; L84-I184 PolarHBondContact N-O 3.39Å; L84-I184 PolarHBondContact O-N 3Å; L84-F197 HydrophobicContact CD2-CE1 4.06Å; L84-V199 HydrophobicContact CD2-CG2 4.04Å; L84-H228 HydrophobicContact CD1-CB 3.87Å; L84-R229 WeakPolarHBondContact CA-O 3.44Å; L84-R229 WeakPolarHBondContact CD1-O 3.28Å; L84-I230 HydrophobicContact CD1-CG1 3.73Å; L84-E231 WeakPolarHBondContact CA-OE2 3.43Å; L84-E231 PolarHBondContact N-OE2 3.25Å
85	T	94.3	Very high	90.1	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.018	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.2	170.8	-53.2	0	0	0	0	112.1	V116 F118 C182 H228 R229 E231	T85-V116 HydrophobicContact CG2-CG2 3.61Å; T85-F118 HydrophobicContact CG2-CD2 4.27Å; T85-C182 WeakPolarHBondContact CA-O 3.31Å; T85-H228 CarbonylContact O-C 3.45Å; T85-H228 WeakPolarHBondContact O-CA 3.22Å; T85-H228 WeakPolarHBondContact O-CB 3.28Å; T85-R229 PolarHBondContact N-O 3.32Å; T85-R229 PolarHBondContact O-N 3.38Å; T85-E231 VanDerWaalsContact CB-OE1 3.27Å; T85-E231 WeakPolarHBondContact CB-OE1 3.39Å; T85-E231 PolarHBondContact N-OE2 3.44Å; T85-E231 PolarHBondContact OG1-OE1 2.9Å
86	V	95.3	Very high	90.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.9	-179.9	-174.2	0	0	0	0	110.3	L84 M88 G181 C182 I184 V199 S227 H228 I305	L84-V86 HydrophobicContact CD1-CG2 4.46Å; L84-V86 HydrophobicContact CD2-CG2 4.35Å; L84-V86 HydrophobicContact CG-CG2 4.13Å; V86-M88 HydrophobicContact CG1-CB 4.43Å; V86-M88 HydrophobicContact CG1-CG 4.46Å; V86-M88 PolarHBondContact O-N 2.82Å; V86-G181 CarbonylContact O-C 3.58Å; V86-G181 WeakPolarHBondContact O-CA 3.4Å; V86-C182 PolarHBondContact N-O 3.43Å; V86-C182 PolarHBondContact O-N 2.97Å; V86-I184 HydrophobicContact CG2-CD1 4.15Å; V86-V199 HydrophobicContact CG2-CG1 4.36Å; V86-S227 CarbonylContact C-O 3.54Å; V86-H228 HydrophobicContact CG2-CB 4.19Å; V86-I305 HydrophobicContact CG1-CD1 4.13Å; V86-I305 HydrophobicContact CG2-CD1 3.73Å
87	A	94	Very high	90	Very high	17 Å²	17	20.4 Å²	20.4	14%	0.14	12%	0.119	C	C	.	.	S	Bend	trans	-77.5	45.8	178.6	0	0	0	0	0	113.3	F118 D180 S227	A87-F118 VanDerWaalsContact CA-CD2 3.49Å; A87-F118 HydrophobicContact CB-CB 4.25Å; A87-F118 HydrophobicContact CB-CD1 3.74Å; A87-F118 HydrophobicContact CB-CD2 3.56Å; A87-F118 HydrophobicContact CB-CE1 3.92Å; A87-F118 HydrophobicContact CB-CE2 3.76Å; A87-F118 HydrophobicContact CB-CG 3.55Å; A87-F118 HydrophobicContact CB-CZ 3.93Å; A87-D180 CarbonylContact C-O 2.97Å; A87-S227 WeakPolarHBondContact CB-O 3.33Å; A87-S227 PolarHBondContact N-O 3.26Å
88	M	92.1	Very high	89.5	Confident	5 Å²	5	19.1 Å²	19.1	3%	0.025	11%	0.113	C	C	.	.	S	Bend	trans	-141.8	152.2	174.9	-69.1	-141.9	85.4	0	0	110.6	V86 I93 D180 G181 C182 F224 N225	V86-M88 HydrophobicContact CG1-CB 4.43Å; V86-M88 HydrophobicContact CG1-CG 4.46Å; V86-M88 PolarHBondContact O-N 2.82Å; M88-I93 HydrophobicContact CB-CG2 3.52Å; M88-I93 HydrophobicContact CG-CG2 4.16Å; M88-I93 HydrophobicContact SD-CG2 4.1Å; M88-D180 CarbonylContact C-O 3.53Å; M88-D180 PolarHBondContact N-O 2.79Å; M88-G181 CarbonylContact O-C 3.58Å; M88-G181 WeakPolarHBondContact O-CA 3.5Å; M88-C182 WeakPolarHBondContact O-CB 3.43Å; M88-C182 PolarHBondContact O-N 3.12Å; M88-F224 HydrophobicContact CE-CB 4.36Å; M88-F224 HydrophobicContact CE-CD1 3.64Å; M88-F224 HydrophobicContact CE-CE1 4.34Å; M88-F224 HydrophobicContact CE-CG 4.36Å; M88-F224 HydrophobicContact SD-CB 4.33Å; M88-F224 HydrophobicContact SD-CD1 3.75Å; M88-N225 WeakPolarHBondContact CG-O 3.37Å
89	P	91	Very high	88.7	Confident	43 Å²	43	19.3 Å²	19.3	28%	0.279	11%	0.114	S	C	.	.			trans	-66.2	144	173.6	27.9	-34	0	0	0	111.3	S91 A92	P89-S91 PolarHBondContact O-N 3.39Å; P89-A92 HydrophobicContact CG-CB 3.91Å; P89-A92 PolarHBondContact O-N 2.88Å
90	C	89.5	Confident	87.3	Confident	26 Å²	26	22.6 Å²	22.6	18%	0.176	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.3	-179.1	-62.4	0	0	0	0	114.4	A92 L113 C182	C90-A92 VanDerWaalsContact C-N 3.34Å; C90-L113 HydrophobicContact CB-CB 4.4Å; C90-C182 WeakPolarHBondContact CA-SG 3.24Å; C90-C182 HydrophobicContact CB-CB 3.95Å; C90-C182 WeakPolarHBondContact CB-SG 3.46Å; C90-C182 WeakPolarHBondContact SG-CA 3.2Å; C90-C182 WeakPolarHBondContact SG-CB 3.46Å; C90-C182 CovalentContact SG-SG 2.04Å; C90-C182 PolarHBondContact SG-SG 2.75Å
91	S	86.2	Confident	85.7	Confident	78 Å²	78	29 Å²	29	55%	0.545	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.7	176.5	51.7	0	0	0	0	113.9	P89	P89-S91 PolarHBondContact O-N 3.39Å
92	A	87.4	Confident	84	Confident	11 Å²	11	35.5 Å²	35.5	9%	0.091	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-10.5	-176	0	0	0	0	0	113.8	P89 C90 G202	P89-A92 HydrophobicContact CG-CB 3.91Å; P89-A92 PolarHBondContact O-N 2.88Å; C90-A92 VanDerWaalsContact C-N 3.34Å; A92-G202 PolarHBondContact O-N 2.88Å
93	I	88.9	Confident	82.2	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	151.2	179.4	66.7	167	0	0	0	112	M88 L113 C182 I184 V199 T200 G202	M88-I93 HydrophobicContact CB-CG2 3.52Å; M88-I93 HydrophobicContact CG-CG2 4.16Å; M88-I93 HydrophobicContact SD-CG2 4.1Å; I93-L113 HydrophobicContact CD1-CD2 4.23Å; I93-C182 HydrophobicContact CD1-CB 3.6Å; I93-C182 HydrophobicContact CG1-CB 4.36Å; I93-I184 HydrophobicContact CD1-CD1 4.25Å; I93-I184 HydrophobicContact CD1-CG1 4.5Å; I93-V199 HydrophobicContact CB-CG1 4.34Å; I93-V199 HydrophobicContact CD1-CG1 4.16Å; I93-T200 CarbonylContact C-O 3.58Å; I93-T200 WeakPolarHBondContact CA-O 3.22Å; I93-G202 CarbonylContact C-O 3.45Å
94	S	86.1	Confident	80.2	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.3	172.7	-177.4	0	0	0	0	108.6	V199 T200 G202 Q204	S94-V199 WeakPolarHBondContact O-CA 3.49Å; S94-T200 PolarHBondContact N-O 3.49Å; S94-T200 PolarHBondContact O-N 3.08Å; S94-G202 WeakPolarHBondContact CB-O 3.28Å; S94-G202 PolarHBondContact N-O 3.23Å; S94-Q204 WeakPolarHBondContact OG-CB 3.29Å; S94-Q204 WeakPolarHBondContact OG-CG 3.33Å; S94-Q204 PolarHBondContact OG-OE1 3.26Å
95	V	88.2	Confident	78.3	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.5	174.8	179.6	0	0	0	0	108.1	F111 L113 I184 F197 H198 V199 Q204	V95-F111 HydrophobicContact CB-CE2 3.73Å; V95-F111 HydrophobicContact CB-CZ 3.85Å; V95-F111 HydrophobicContact CG1-CD2 4.37Å; V95-F111 HydrophobicContact CG1-CE1 4.26Å; V95-F111 HydrophobicContact CG1-CE2 3.87Å; V95-F111 HydrophobicContact CG1-CZ 3.79Å; V95-F111 HydrophobicContact CG2-CE2 4.27Å; V95-L113 HydrophobicContact CG2-CD2 4.06Å; V95-I184 HydrophobicContact CG2-CD1 3.63Å; V95-I184 HydrophobicContact CG2-CG1 3.95Å; V95-I184 HydrophobicContact CG2-CG2 4.19Å; V95-F197 HydrophobicContact CG1-CD2 4.05Å; V95-F197 HydrophobicContact CG1-CE1 4.45Å; V95-F197 HydrophobicContact CG1-CE2 3.17Å; V95-F197 HydrophobicContact CG1-CZ 3.41Å; V95-F197 VanDerWaalsContact CG1-CZ 3.41Å; V95-H198 WeakPolarHBondContact CA-O 3.25Å; V95-V199 HydrophobicContact CG2-CG2 4.41Å; V95-Q204 PolarHBondContact O-NE2 3.04Å; V95-Q204 PolarHBondContact O-OE1 3.4Å
96	D	83.8	Confident	76.2	Confident	19 Å²	19	48.3 Å²	48.3	10%	0.102	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	128	-178.2	-173.6	7.6	0	0	0	108.7	K98 H198 R214	D96-K98 WeakPolarHBondContact OD2-CE 3.43Å; D96-K98 IonicContact OD2-NZ 3.72Å; D96-H198 HydrophobicContact CB-CB 4.43Å; D96-H198 PolarHBondContact N-O 3.26Å; D96-H198 PolarHBondContact O-N 2.95Å; D96-R214 IonicContact OD2-NH2 2.83Å
97	F	83.5	Confident	74.2	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.9	175.2	178.6	-88.8	0	0	0	108.5	D99 L105 F188 V190 S196 F197 Y309	F97-D99 HydrophobicContact CE1-CB 4.05Å; F97-L105 HydrophobicContact CD1-CB 4.11Å; F97-L105 HydrophobicContact CD1-CD1 3.53Å; F97-L105 HydrophobicContact CD1-CG 3.74Å; F97-L105 HydrophobicContact CD2-CD1 4.4Å; F97-L105 HydrophobicContact CE1-CD1 3.52Å; F97-L105 HydrophobicContact CE1-CG 3.91Å; F97-L105 HydrophobicContact CE2-CD1 4.39Å; F97-L105 HydrophobicContact CG-CD1 3.97Å; F97-L105 HydrophobicContact CG-CG 4.49Å; F97-L105 HydrophobicContact CZ-CD1 3.95Å; F97-F188 AromaticContact CD2-CE2 3.87Å; F97-F188 HydrophobicContact CD2-CE2 3.87Å; F97-F188 HydrophobicContact CD2-CZ 4.1Å; F97-F188 HydrophobicContact CE2-CD2 4.47Å; F97-F188 AromaticContact CE2-CE2 3.5Å; F97-F188 HydrophobicContact CE2-CE2 3.5Å; F97-F188 HydrophobicContact CE2-CZ 4.09Å; F97-F188 HydrophobicContact CZ-CE2 4.02Å; F97-V190 HydrophobicContact CE1-CG1 4.25Å; F97-V190 HydrophobicContact CE2-CG1 3.95Å; F97-V190 HydrophobicContact CZ-CB 4.2Å; F97-V190 HydrophobicContact CZ-CG1 3.38Å; F97-S196 WeakPolarHBondContact CA-O 3.39Å; F97-F197 HydrophobicContact CD2-CB 4.41Å; F97-F197 HydrophobicContact CD2-CD2 4.46Å; F97-Y309 AromaticContact CE2-CE1 3.72Å; F97-Y309 HydrophobicContact CE2-CE1 3.72Å; F97-Y309 HydrophobicContact CZ-CE1 4.15Å; F97-Y309 WeakPolarHBondContact CZ-OH 3.43Å
98	K	77.3	Confident	72	Confident	99 Å²	99	57.1 Å²	57.1	43%	0.43	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.5	179.9	-59.6	-173.9	179.3	-163.3	0	109.8	D96 G195 S196	D96-K98 WeakPolarHBondContact OD2-CE 3.43Å; D96-K98 IonicContact OD2-NZ 3.72Å; K98-G195 CarbonylContact O-C 3.59Å; K98-G195 VanDerWaalsContact O-CA 3.23Å; K98-G195 WeakPolarHBondContact O-CA 3.45Å; K98-S196 PolarHBondContact N-O 3Å; K98-S196 PolarHBondContact O-N 3.18Å; K98-S196 PolarHBondContact O-OG 3.36Å
99	D	70.4	Confident	70.6	Confident	13 Å²	13	63.9 Å²	63.9	7%	0.07	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	159.1	167.7	-166.5	-6.9	0	0	0	109.2	F97 K101 E102 V193 H194	F97-D99 HydrophobicContact CE1-CB 4.05Å; D99-K101 PolarHBondContact O-N 2.99Å; D99-E102 WeakPolarHBondContact O-CA 3.22Å; D99-E102 PolarHBondContact O-N 3.43Å; D99-V193 VanDerWaalsContact CG-CG2 3.4Å; D99-V193 WeakPolarHBondContact OD1-CG2 3.22Å; D99-V193 WeakPolarHBondContact OD2-CG2 3.34Å; D99-H194 VanDerWaalsContact OD1-O 3.05Å
100	V	62.2	Low	69.9	Low	100 Å²	100	62.6 Å²	62.6	61%	0.606	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-30.6	172.6	170.5	0	0	0	0	111.6	E102 H194	V100-E102 PolarHBondContact O-N 3.46Å; V100-H194 HydrophobicContact CG2-CB 4.01Å; V100-H194 VanDerWaalsContact CG2-O 3.22Å; V100-H194 WeakPolarHBondContact CG2-O 3.49Å; V100-H194 PolarHBondContact N-O 2.82Å
101	K	57.3	Low	69.7	Low	140 Å²	140	61.9 Å²	61.9	61%	0.609	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	2.6	174.8	-65.4	-173.3	179.5	-176.8	0	113.9	D99 H103	D99-K101 PolarHBondContact O-N 2.99Å; K101-H103 PolarHBondContact O-N 2.88Å
102	E	55.8	Low	69.8	Low	163 Å²	163	64.8 Å²	64.8	76%	0.762	32%	0.316	S	S	*	.			trans	48.4	25.8	-171.2	-61.1	-169.6	158.8	0	0	113.1	D99 V100 I104	D99-E102 WeakPolarHBondContact O-CA 3.22Å; D99-E102 PolarHBondContact O-N 3.43Å; V100-E102 PolarHBondContact O-N 3.46Å; E102-I104 WeakPolarHBondContact O-CG1 3.35Å; E102-I104 PolarHBondContact O-N 2.84Å
103	H	54.2	Low	69.9	Low	128 Å²	128	67 Å²	67	59%	0.593	33%	0.326	S	S	*	.			trans	-73.6	88.5	174.3	-143.3	69.1	0	0	0	106.8	K101 L105	K101-H103 PolarHBondContact O-N 2.88Å; H103-L105 PolarHBondContact O-N 3.41Å
104	I	51.4	Low	70	Confident	74 Å²	74	70.2 Å²	70.2	38%	0.379	34%	0.341	S	S	.	.			trans	-74.1	100.8	-179.8	-45.3	171	0	0	0	106.3	E102 D106 K212	E102-I104 WeakPolarHBondContact O-CG1 3.35Å; E102-I104 PolarHBondContact O-N 2.84Å; I104-D106 PolarHBondContact O-N 3.36Å; I104-K212 VanDerWaalsContact CB-NZ 3.29Å; I104-K212 HydrophobicContact CD1-CD 4.29Å
105	L	54.8	Low	70.3	Confident	28 Å²	28	73 Å²	73	15%	0.147	36%	0.359	C	S	.	.			trans	-53.2	131.3	170.9	-68.5	173.3	0	0	0	108.8	F97 H103 F188 V190	F97-L105 HydrophobicContact CD1-CB 4.11Å; F97-L105 HydrophobicContact CD1-CD1 3.53Å; F97-L105 HydrophobicContact CD1-CG 3.74Å; F97-L105 HydrophobicContact CD2-CD1 4.4Å; F97-L105 HydrophobicContact CE1-CD1 3.52Å; F97-L105 HydrophobicContact CE1-CG 3.91Å; F97-L105 HydrophobicContact CE2-CD1 4.39Å; F97-L105 HydrophobicContact CG-CD1 3.97Å; F97-L105 HydrophobicContact CG-CG 4.49Å; F97-L105 HydrophobicContact CZ-CD1 3.95Å; H103-L105 PolarHBondContact O-N 3.41Å; L105-F188 HydrophobicContact CD1-CB 3.97Å; L105-F188 HydrophobicContact CD1-CD2 3.17Å; L105-F188 HydrophobicContact CD1-CE2 3.72Å; L105-F188 HydrophobicContact CD1-CG 3.72Å; L105-V190 HydrophobicContact CD1-CG1 4.4Å
106	D	51.5	Low	70.4	Confident	53 Å²	53	73.5 Å²	73.5	28%	0.283	36%	0.362	S	S	.	.			trans	-69.6	147.6	-178.3	-77	-5.5	0	0	0	111.7	I104 H108 E109 R206	I104-D106 PolarHBondContact O-N 3.36Å; D106-H108 PolarHBondContact O-N 3.23Å; D106-E109 HydrophobicContact CB-CB 4.29Å; D106-E109 HydrophobicContact CB-CG 4.27Å; D106-E109 PolarHBondContact O-N 2.87Å; D106-R206 VanDerWaalsContact CG-CZ 3.45Å; D106-R206 VanDerWaalsContact CG-NH2 3.27Å; D106-R206 IonicContact OD1-CZ 3.39Å; D106-R206 IonicContact OD1-NH1 3.14Å; D106-R206 PolarHBondContact OD1-NH1 2.81Å; D106-R206 IonicContact OD1-NH2 2.64Å; D106-R206 PolarHBondContact OD1-NH2 2.81Å; D106-R206 IonicContact OD2-CZ 2.79Å; D106-R206 IonicContact OD2-NH1 2.89Å; D106-R206 PolarHBondContact OD2-NH1 2.89Å; D106-R206 IonicContact OD2-NH2 3.92Å
107	D	51.6	Low	70.7	Confident	45 Å²	45	78 Å²	78	24%	0.241	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-6.7	173.6	-163.2	62.5	0	0	0	112	F111 Q204	D107-F111 HydrophobicContact CB-CZ 4.32Å; D107-F111 WeakPolarHBondContact OD1-CE2 3.43Å; D107-F111 WeakPolarHBondContact OD1-CZ 3.39Å; D107-Q204 PolarHBondContact OD1-NE2 3.33Å
108	H	48.7	Very low	71.1	Confident	158 Å²	158	78.8 Å²	78.8	73%	0.731	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-11.4	-179.3	-61.3	-33.2	0	0	0	114.7	D106	D106-H108 PolarHBondContact O-N 3.23Å
109	E	63.3	Low	71.7	Confident	146 Å²	146	77.7 Å²	77.7	68%	0.682	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	4.5	-173	-79.4	-167.6	157.9	0	0	114.9	D106	D106-E109 HydrophobicContact CB-CB 4.29Å; D106-E109 HydrophobicContact CB-CG 4.27Å; D106-E109 PolarHBondContact O-N 2.87Å
110	G	75.9	Confident	72.5	Confident	17 Å²	17	78.3 Å²	78.3	18%	0.175	38%	0.381	C	S	.	.	S	Bend	trans	-173	-12	171.1	0	0	0	0	0	119.7	G186 Q187	G110-G186 CarbonylContact O-C 3.58Å; G110-G186 WeakPolarHBondContact O-CA 3.29Å; G110-Q187 CarbonylContact O-C 3.13Å; G110-Q187 PolarHBondContact O-N 3.26Å
111	F	84.4	Confident	73.6	Confident	10 Å²	10	76.3 Å²	76.3	4%	0.044	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	157.2	173	69.1	-89.6	0	0	0	112	V95 D107 I184 Y185	V95-F111 HydrophobicContact CB-CE2 3.73Å; V95-F111 HydrophobicContact CB-CZ 3.85Å; V95-F111 HydrophobicContact CG1-CD2 4.37Å; V95-F111 HydrophobicContact CG1-CE1 4.26Å; V95-F111 HydrophobicContact CG1-CE2 3.87Å; V95-F111 HydrophobicContact CG1-CZ 3.79Å; V95-F111 HydrophobicContact CG2-CE2 4.27Å; D107-F111 HydrophobicContact CB-CZ 4.32Å; D107-F111 WeakPolarHBondContact OD1-CE2 3.43Å; D107-F111 WeakPolarHBondContact OD1-CZ 3.39Å; F111-I184 HydrophobicContact CB-CG2 4.48Å; F111-I184 HydrophobicContact CD2-CG2 4.11Å; F111-Y185 CarbonylContact C-O 3.52Å; F111-Y185 WeakPolarHBondContact CA-O 3.47Å
112	K	88.1	Confident	74.9	Confident	140 Å²	140	74.7 Å²	74.7	61%	0.609	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	144.2	177.3	-66.7	-176.7	-179.8	-178.3	0	109.3	I184 Y185	K112-I184 WeakPolarHBondContact O-CA 3.27Å; K112-Y185 HydrophobicContact CB-CD1 4.49Å; K112-Y185 HydrophobicContact CB-CE1 3.89Å; K112-Y185 HydrophobicContact CB-CE2 4.32Å; K112-Y185 PolarHBondContact N-O 2.87Å; K112-Y185 PolarHBondContact O-N 3.03Å
113	L	90.3	Very high	76	Confident	57 Å²	57	74 Å²	74	30%	0.298	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121	174.1	-69.4	156.6	0	0	0	108.1	C90 I93 V95 C182 R183 I184	C90-L113 HydrophobicContact CB-CB 4.4Å; I93-L113 HydrophobicContact CD1-CD2 4.23Å; V95-L113 HydrophobicContact CG2-CD2 4.06Å; L113-C182 WeakPolarHBondContact CD2-SG 3.43Å; L113-R183 CarbonylContact C-O 3.47Å; L113-R183 WeakPolarHBondContact CA-O 3.37Å; L113-I184 HydrophobicContact CD2-CG1 3.62Å
114	E	90.5	Very high	77.3	Confident	73 Å²	73	68.3 Å²	68.3	34%	0.341	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125	177.6	179.1	-179.7	-157.2	0	0	110.3	V116 R183 Y185	E114-V116 HydrophobicContact CG-CG1 4.03Å; E114-V116 PolarHBondContact O-N 3.28Å; E114-R183 HydrophobicContact CB-CB 4.4Å; E114-R183 PolarHBondContact N-O 2.78Å; E114-R183 PolarHBondContact O-N 2.8Å; E114-R183 IonicContact OE2-NH1 2.76Å; E114-Y185 HydrophobicContact CB-CE1 3.81Å
115	P	92.5	Very high	79	Confident	60 Å²	60	68.5 Å²	68.5	39%	0.39	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	122.2	177	31.2	-34.2	0	0	0	109.5	K179	P115-K179 HydrophobicContact CB-CB 4.27Å; P115-K179 HydrophobicContact CB-CD 4.01Å; P115-K179 HydrophobicContact CG-CD 4.22Å; P115-K179 VanDerWaalsContact O-CD 3.29Å; P115-K179 WeakPolarHBondContact O-CD 3.4Å; P115-K179 WeakPolarHBondContact O-CE 3.47Å; P115-K179 PolarHBondContact O-NZ 2.95Å
116	V	91.1	Very high	80.3	Confident	13 Å²	13	74.8 Å²	74.8	8%	0.079	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	171.8	-175	-63.9	0	0	0	0	110.1	T85 E114 K179 D180 G181 R183	T85-V116 HydrophobicContact CG2-CG2 3.61Å; E114-V116 HydrophobicContact CG-CG1 4.03Å; E114-V116 PolarHBondContact O-N 3.28Å; V116-K179 CarbonylContact O-C 3.54Å; V116-K179 WeakPolarHBondContact O-CA 3.08Å; V116-D180 PolarHBondContact O-N 3.37Å; V116-G181 PolarHBondContact N-O 2.8Å; V116-G181 CarbonylContact O-C 3.57Å; V116-G181 WeakPolarHBondContact O-CA 3.36Å; V116-G181 PolarHBondContact O-N 2.82Å; V116-R183 HydrophobicContact CG1-CB 3.95Å; V116-R183 HydrophobicContact CG2-CB 3.9Å
117	R	90.2	Very high	81.7	Confident	113 Å²	113	74.2 Å²	74.2	43%	0.426	36%	0.358	S	S	.	.			trans	-80.7	132.7	166.5	-170.3	178.3	177.6	162.6	-2	109.4	E119 R229	R117-E119 WeakPolarHBondContact CD-O 3.37Å; R117-R229 PolarHBondContact O-NH2 2.78Å; R117-R229 VanDerWaalsContact O-NH2 3.15Å
118	F	91.4	Very high	83.3	Confident	24 Å²	24	72.1 Å²	72.1	11%	0.105	35%	0.347	C	S	.	.	S	Bend	trans	-70.5	-50.4	173.2	-175.7	-103.6	0	0	0	110	T85 A87 L120 D180 R229	T85-F118 HydrophobicContact CG2-CD2 4.27Å; A87-F118 VanDerWaalsContact CA-CD2 3.49Å; A87-F118 HydrophobicContact CB-CB 4.25Å; A87-F118 HydrophobicContact CB-CD1 3.74Å; A87-F118 HydrophobicContact CB-CD2 3.56Å; A87-F118 HydrophobicContact CB-CE1 3.92Å; A87-F118 HydrophobicContact CB-CE2 3.76Å; A87-F118 HydrophobicContact CB-CG 3.55Å; A87-F118 HydrophobicContact CB-CZ 3.93Å; F118-L120 PolarHBondContact O-N 2.87Å; F118-D180 PolarHBondContact N-OD1 2.9Å; F118-R229 PolarHBondContact O-NH1 2.96Å; F118-R229 PolarHBondContact O-NH2 3.49Å
119	E	89.1	Confident	85.1	Confident	77 Å²	77	68.6 Å²	68.6	36%	0.36	33%	0.333	S	S	.	.	S	Bend	trans	-66.6	124.4	-178.7	-170.6	66.7	175.5	0	0	112.3	R117 R125	R117-E119 WeakPolarHBondContact CD-O 3.37Å; E119-R125 IonicContact OE1-CZ 2.78Å; E119-R125 IonicContact OE1-NH1 3.51Å; E119-R125 PolarHBondContact OE1-NH1 3.46Å; E119-R125 IonicContact OE1-NH2 3.4Å; E119-R125 PolarHBondContact OE1-NH2 3.38Å; E119-R125 IonicContact OE2-CZ 3.76Å; E119-R125 IonicContact OE2-NH2 3.43Å; E119-R125 PolarHBondContact OE2-NH2 2.96Å
120	L	87.5	Confident	86	Confident	25 Å²	25	62.7 Å²	62.7	13%	0.131	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-70.5	143.3	179.6	-68.5	175	0	0	0	111.2	F118 R125 W128	F118-L120 PolarHBondContact O-N 2.87Å; L120-R125 HydrophobicContact CB-CB 4.17Å; L120-W128 HydrophobicContact CD1-CB 3.8Å; L120-W128 HydrophobicContact CD1-CD2 4.19Å; L120-W128 HydrophobicContact CD1-CG 3.8Å
121	L	86.5	Confident	86.2	Confident	59 Å²	59	63 Å²	63	31%	0.309	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-63.5	153.8	169.6	-75.7	77.4	0	0	0	110	E123 S124 R125 A172	L121-E123 PolarHBondContact O-N 3.17Å; L121-E123 VanDerWaalsContact O-N 3.15Å; L121-S124 PolarHBondContact O-N 3.23Å; L121-S124 VanDerWaalsContact O-N 3.08Å; L121-R125 WeakPolarHBondContact O-CB 3.43Å; L121-R125 PolarHBondContact O-N 3.48Å; L121-A172 HydrophobicContact CD1-CB 4.18Å; L121-A172 HydrophobicContact CD2-CB 4.37Å
122	P	83.3	Confident	86.2	Confident	105 Å²	105	68.6 Å²	68.6	68%	0.682	33%	0.326	S	S	*	.	H	α-helix	trans	-54.2	-37.1	-177.5	-27.3	34.9	0	0	0	114	K126	P122-K126 WeakPolarHBondContact O-CG 3.3Å; P122-K126 PolarHBondContact O-N 2.91Å; P122-K126 VanDerWaalsContact O-N 3.16Å
123	E	79.6	Confident	85.7	Confident	150 Å²	150	66.1 Å²	66.1	70%	0.701	32%	0.317	S	S	*	.	H	α-helix	trans	-67.4	-50.5	176.3	-64.8	174.9	-175.1	0	0	111.5	L121 R125 K126 F127	L121-E123 PolarHBondContact O-N 3.17Å; L121-E123 VanDerWaalsContact O-N 3.15Å; E123-R125 VanDerWaalsContact C-N 3.25Å; E123-R125 PolarHBondContact O-N 2.95Å; E123-K126 PolarHBondContact O-N 2.83Å; E123-F127 PolarHBondContact O-N 3.3Å
124	S	81.8	Confident	85	Confident	7 Å²	7	65.8 Å²	65.8	5%	0.049	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-32.9	176.9	-46.5	0	0	0	0	112.3	L121 F127 W128	L121-S124 PolarHBondContact O-N 3.23Å; L121-S124 VanDerWaalsContact O-N 3.08Å; S124-F127 PolarHBondContact O-N 3.13Å; S124-W128 WeakPolarHBondContact O-CB 3.32Å; S124-W128 PolarHBondContact O-N 2.9Å
125	R	86.3	Confident	84.3	Confident	79 Å²	79	62.9 Å²	62.9	30%	0.298	30%	0.301	S	S	.	.	H	α-helix	trans	-70	-41.6	177.3	177.6	161.1	-77.6	161.6	-0.6	112.7	E119 L120 L121 E123 F127 W128 N129	E119-R125 IonicContact OE1-CZ 2.78Å; E119-R125 IonicContact OE1-NH1 3.51Å; E119-R125 PolarHBondContact OE1-NH1 3.46Å; E119-R125 IonicContact OE1-NH2 3.4Å; E119-R125 PolarHBondContact OE1-NH2 3.38Å; E119-R125 IonicContact OE2-CZ 3.76Å; E119-R125 IonicContact OE2-NH2 3.43Å; E119-R125 PolarHBondContact OE2-NH2 2.96Å; L120-R125 HydrophobicContact CB-CB 4.17Å; L121-R125 WeakPolarHBondContact O-CB 3.43Å; L121-R125 PolarHBondContact O-N 3.48Å; E123-R125 VanDerWaalsContact C-N 3.25Å; E123-R125 PolarHBondContact O-N 2.95Å; R125-F127 PolarHBondContact O-N 3.32Å; R125-W128 PolarHBondContact O-N 3.11Å; R125-N129 VanDerWaalsContact O-CG 3.29Å; R125-N129 PolarHBondContact O-N 3.27Å; R125-N129 PolarHBondContact O-ND2 3.3Å
126	K	82.2	Confident	83.5	Confident	160 Å²	160	64.7 Å²	64.7	70%	0.696	31%	0.311	S	S	*	.	H	α-helix	trans	-55.9	-46.5	172.9	-73.8	176.8	-178.9	-179.2	0	110.3	P122 E123 N129 V130	P122-K126 WeakPolarHBondContact O-CG 3.3Å; P122-K126 PolarHBondContact O-N 2.91Å; P122-K126 VanDerWaalsContact O-N 3.16Å; E123-K126 PolarHBondContact O-N 2.83Å; K126-N129 PolarHBondContact O-N 3.47Å; K126-V130 PolarHBondContact O-N 2.93Å
127	F	80.8	Confident	82.4	Confident	40 Å²	40	66.8 Å²	66.8	18%	0.175	32%	0.322	C	S	.	.	H	α-helix	trans	-62.4	-46.6	178.1	-172.8	-76.9	0	0	0	112.2	E123 S124 R125 N129 V130 L131 M165 M169	E123-F127 PolarHBondContact O-N 3.3Å; S124-F127 PolarHBondContact O-N 3.13Å; R125-F127 PolarHBondContact O-N 3.32Å; F127-N129 VanDerWaalsContact C-N 3.28Å; F127-N129 PolarHBondContact O-N 2.94Å; F127-V130 WeakPolarHBondContact O-CB 3.36Å; F127-V130 PolarHBondContact O-N 3.25Å; F127-V130 VanDerWaalsContact O-N 3.08Å; F127-L131 HydrophobicContact CE1-CB 4.22Å; F127-L131 PolarHBondContact O-N 3.5Å; F127-M165 HydrophobicContact CD1-CE 4.38Å; F127-M165 HydrophobicContact CD1-CG 3.67Å; F127-M165 HydrophobicContact CD1-SD 4.03Å; F127-M165 HydrophobicContact CE1-CB 4.12Å; F127-M165 HydrophobicContact CE1-CE 3.12Å; F127-M165 HydrophobicContact CE1-CG 3.23Å; F127-M165 HydrophobicContact CE1-SD 3.2Å; F127-M165 WeakPolarHBondContact CE1-SD 3.33Å; F127-M165 HydrophobicContact CE2-CB 4.23Å; F127-M165 HydrophobicContact CE2-CE 4.27Å; F127-M165 HydrophobicContact CE2-CG 4.15Å; F127-M165 HydrophobicContact CG-CG 4.39Å; F127-M165 HydrophobicContact CZ-CB 3.86Å; F127-M165 HydrophobicContact CZ-CE 3.04Å; F127-M165 HydrophobicContact CZ-CG 3.51Å; F127-M165 HydrophobicContact CZ-SD 3.7Å; F127-M169 HydrophobicContact CD1-CE 3.89Å; F127-M169 HydrophobicContact CE1-CE 4.42Å
128	W	86	Confident	81	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.008	33%	0.331	C	S	.	.	H	α-helix	trans	-56	-42.3	177.6	-177	-104.2	0	0	0	112.6	L120 S124 R125 V130 L131 R132 M169 R229 E231 G248 E250	L120-W128 HydrophobicContact CD1-CB 3.8Å; L120-W128 HydrophobicContact CD1-CD2 4.19Å; L120-W128 HydrophobicContact CD1-CG 3.8Å; S124-W128 WeakPolarHBondContact O-CB 3.32Å; S124-W128 PolarHBondContact O-N 2.9Å; R125-W128 PolarHBondContact O-N 3.11Å; W128-V130 VanDerWaalsContact C-N 3.3Å; W128-V130 PolarHBondContact O-N 3.46Å; W128-L131 HydrophobicContact CE3-CD2 4.4Å; W128-L131 HydrophobicContact CZ3-CD2 4.36Å; W128-L131 PolarHBondContact O-N 2.89Å; W128-R132 WeakPolarHBondContact O-CB 3.11Å; W128-R132 PolarHBondContact O-N 2.82Å; W128-M169 HydrophobicContact CE3-CE 4.27Å; W128-R229 HydrophobicContact CH2-CB 3.74Å; W128-R229 HydrophobicContact CH2-CG 4.47Å; W128-R229 HydrophobicContact CZ2-CB 3.63Å; W128-E231 HydrophobicContact CH2-CG 4.5Å; W128-E231 HydrophobicContact CZ3-CG 4.08Å; W128-G248 VanDerWaalsContact CH2-CA 3.5Å; W128-G248 VanDerWaalsContact CZ2-C 3.49Å; W128-G248 WeakPolarHBondContact CZ2-O 3.41Å; W128-E250 HydrophobicContact CZ2-CB 4.08Å; W128-E250 PolarHBondContact NE1-OE2 3.1Å
129	N	86.5	Confident	79.1	Confident	83 Å²	83	75.8 Å²	75.8	44%	0.444	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-37.1	177.4	-68.8	-20.8	0	0	0	112.3	R125 K126 F127 E133	R125-N129 VanDerWaalsContact O-CG 3.29Å; R125-N129 PolarHBondContact O-N 3.27Å; R125-N129 PolarHBondContact O-ND2 3.3Å; K126-N129 PolarHBondContact O-N 3.47Å; F127-N129 VanDerWaalsContact C-N 3.28Å; F127-N129 PolarHBondContact O-N 2.94Å; N129-E133 WeakPolarHBondContact O-CB 3.45Å; N129-E133 PolarHBondContact O-N 3.18Å
130	V	81.3	Confident	77.3	Confident	22 Å²	22	75.3 Å²	75.3	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-65.5	-47.8	174.6	174.2	0	0	0	0	110.9	K126 F127 W128 R132 E133 I134 L148 V151 F152	K126-V130 PolarHBondContact O-N 2.93Å; F127-V130 WeakPolarHBondContact O-CB 3.36Å; F127-V130 PolarHBondContact O-N 3.25Å; F127-V130 VanDerWaalsContact O-N 3.08Å; W128-V130 VanDerWaalsContact C-N 3.3Å; W128-V130 PolarHBondContact O-N 3.46Å; V130-R132 VanDerWaalsContact C-N 3.28Å; V130-R132 PolarHBondContact O-N 3.41Å; V130-E133 PolarHBondContact O-N 3.42Å; V130-I134 HydrophobicContact CG1-CD1 3.96Å; V130-I134 WeakPolarHBondContact O-CG1 3.32Å; V130-I134 PolarHBondContact O-N 3.16Å; V130-L148 HydrophobicContact CG1-CD2 3.59Å; V130-V151 HydrophobicContact CG2-CG1 4.03Å; V130-F152 HydrophobicContact CG1-CE2 4.21Å; V130-F152 HydrophobicContact CG2-CE2 4.22Å; V130-F152 HydrophobicContact CG2-CZ 4.48Å
131	L	80.8	Confident	75.7	Confident	25 Å²	25	79.1 Å²	79.1	13%	0.131	40%	0.395	C	S	.	.	H	α-helix	trans	-57.3	-44.4	178.1	178.3	62.7	0	0	0	111.4	F127 W128 I134 N135 M165	F127-L131 HydrophobicContact CE1-CB 4.22Å; F127-L131 PolarHBondContact O-N 3.5Å; W128-L131 HydrophobicContact CE3-CD2 4.4Å; W128-L131 HydrophobicContact CZ3-CD2 4.36Å; W128-L131 PolarHBondContact O-N 2.89Å; L131-I134 PolarHBondContact O-N 2.94Å; L131-N135 PolarHBondContact O-N 3.12Å; L131-N135 VanDerWaalsContact O-N 3.11Å; L131-M165 HydrophobicContact CD1-CE 4.48Å; L131-M165 HydrophobicContact CD2-SD 4.45Å
132	R	83.8	Confident	74	Confident	126 Å²	126	81.5 Å²	81.5	48%	0.475	41%	0.412	S	S	.	.	H	α-helix	trans	-61.9	-44.8	176.6	178	177.5	162	175.5	-4.3	112.1	W128 V130 I134 N135 V136	W128-R132 WeakPolarHBondContact O-CB 3.11Å; W128-R132 PolarHBondContact O-N 2.82Å; V130-R132 VanDerWaalsContact C-N 3.28Å; V130-R132 PolarHBondContact O-N 3.41Å; R132-I134 VanDerWaalsContact C-N 3.32Å; R132-I134 PolarHBondContact O-N 3.32Å; R132-N135 PolarHBondContact O-N 3.4Å; R132-V136 HydrophobicContact CG-CG2 4.48Å; R132-V136 WeakPolarHBondContact O-CG2 3.47Å; R132-V136 PolarHBondContact O-N 3.47Å
133	E	78.4	Confident	72.4	Confident	89 Å²	89	81.6 Å²	81.6	42%	0.416	40%	0.404	S	S	.	.	H	α-helix	trans	-61.8	-39.5	178.3	-174.1	69.9	-174.2	0	0	111.8	N129 V130 N137 K147	N129-E133 WeakPolarHBondContact O-CB 3.45Å; N129-E133 PolarHBondContact O-N 3.18Å; V130-E133 PolarHBondContact O-N 3.42Å; E133-N137 WeakPolarHBondContact O-CB 3.42Å; E133-N137 PolarHBondContact O-N 3.47Å; E133-N137 PolarHBondContact O-ND2 2.9Å; E133-N137 PolarHBondContact OE1-ND2 3.46Å; E133-K147 IonicContact OE1-NZ 3.76Å
134	I	74.7	Confident	71.1	Confident	50 Å²	50	76.2 Å²	76.2	26%	0.256	38%	0.38	S	S	.	.	H	α-helix	trans	-62.6	-45.7	175.4	-67	166.8	0	0	0	110.8	V130 L131 R132 I144 L148	V130-I134 HydrophobicContact CG1-CD1 3.96Å; V130-I134 WeakPolarHBondContact O-CG1 3.32Å; V130-I134 PolarHBondContact O-N 3.16Å; L131-I134 PolarHBondContact O-N 2.94Å; R132-I134 VanDerWaalsContact C-N 3.32Å; R132-I134 PolarHBondContact O-N 3.32Å; I134-I144 HydrophobicContact CG1-CG2 4.3Å; I134-L148 HydrophobicContact CD1-CD1 4.21Å; I134-L148 HydrophobicContact CD1-CD2 4.31Å
135	N	77.1	Confident	69.7	Low	11 Å²	11	79.2 Å²	79.2	6%	0.059	39%	0.394	C	S	.	.	H	α-helix	trans	-69.5	-34.8	-178.6	-175.2	15.5	0	0	0	112.5	L131 R132 R138 N244 P245 D247	L131-N135 PolarHBondContact O-N 3.12Å; L131-N135 VanDerWaalsContact O-N 3.11Å; R132-N135 PolarHBondContact O-N 3.4Å; N135-R138 WeakPolarHBondContact O-CG 3.29Å; N135-N244 PolarHBondContact OD1-O 3.18Å; N135-P245 PolarHBondContact ND2-O 2.94Å; N135-P245 WeakPolarHBondContact OD1-CA 3.39Å; N135-D247 PolarHBondContact ND2-O 3.03Å
136	V	74.4	Confident	68.1	Low	99 Å²	99	82.5 Å²	82.5	60%	0.6	41%	0.411	S	S	*	.	H	α-helix	trans	-70.6	-43.8	176.5	173	0	0	0	0	111.3	R132 R138	R132-V136 HydrophobicContact CG-CG2 4.48Å; R132-V136 WeakPolarHBondContact O-CG2 3.47Å; R132-V136 PolarHBondContact O-N 3.47Å; V136-R138 PolarHBondContact O-N 2.97Å
137	N	68.1	Low	66.7	Low	57 Å²	57	79.7 Å²	79.7	31%	0.305	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	50.1	-176	-66.3	-30.7	0	0	0	113.3	E133 L139	E133-N137 WeakPolarHBondContact O-CB 3.42Å; E133-N137 PolarHBondContact O-N 3.47Å; E133-N137 PolarHBondContact O-ND2 2.9Å; E133-N137 PolarHBondContact OE1-ND2 3.46Å; N137-L139 PolarHBondContact O-N 2.92Å
138	R	61.6	Low	65.3	Low	163 Å²	163	78.6 Å²	78.6	62%	0.615	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-23	-175	-62.7	-173.1	-174.3	153.9	8.4	115.7	N135 V136	N135-R138 WeakPolarHBondContact O-CG 3.29Å; V136-R138 PolarHBondContact O-N 2.97Å
139	L	52.1	Low	63.6	Low	163 Å²	163	81.1 Å²	81.1	85%	0.853	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	2.4	-164.5	-84.5	164.7	0	0	0	116.3	N137	N137-L139 PolarHBondContact O-N 2.92Å
140	L	50.3	Low	62.1	Low	66 Å²	66	83 Å²	83	35%	0.346	42%	0.417	S	S	.	.			trans	-137.2	81.4	-178	-97.1	115.1	0	0	0	113.6	T142 M143 I144	L140-T142 PolarHBondContact O-N 2.87Å; L140-T142 VanDerWaalsContact O-N 3.1Å; L140-M143 HydrophobicContact CB-CB 3.99Å; L140-M143 HydrophobicContact CD2-CB 3.82Å; L140-M143 HydrophobicContact CD2-CE 3.71Å; L140-M143 HydrophobicContact CD2-CG 3.45Å; L140-M143 VanDerWaalsContact CD2-CG 3.45Å; L140-M143 HydrophobicContact CD2-SD 3.77Å; L140-M143 PolarHBondContact O-N 2.92Å; L140-I144 WeakPolarHBondContact O-CB 3.41Å; L140-I144 WeakPolarHBondContact O-CD1 3.27Å; L140-I144 VanDerWaalsContact O-CG1 3.25Å; L140-I144 WeakPolarHBondContact O-CG1 3.41Å; L140-I144 PolarHBondContact O-N 2.79Å
141	S	54.5	Low	60.9	Low	105 Å²	105	86.3 Å²	86.3	73%	0.734	44%	0.437	S	S	*	.	H	α-helix	trans	-50.3	-30.6	165.4	-61.6	0	0	0	0	112.7
142	T	50.9	Low	59.5	Low	110 Å²	110	87.5 Å²	87.5	68%	0.675	44%	0.442	S	S	*	.	H	α-helix	trans	-81.2	-39.1	-179.5	53.3	0	0	0	0	114	L140 F146	L140-T142 PolarHBondContact O-N 2.87Å; L140-T142 VanDerWaalsContact O-N 3.1Å; T142-F146 PolarHBondContact O-N 3.45Å
143	M	49.4	Very low	58.2	Low	106 Å²	106	89.3 Å²	89.3	52%	0.522	46%	0.461	S	S	.	.	H	α-helix	trans	-75.8	-27.8	174.6	-81.6	-177.4	-156.9	0	0	112.6	L140 F146 K147	L140-M143 HydrophobicContact CB-CB 3.99Å; L140-M143 HydrophobicContact CD2-CB 3.82Å; L140-M143 HydrophobicContact CD2-CE 3.71Å; L140-M143 HydrophobicContact CD2-CG 3.45Å; L140-M143 VanDerWaalsContact CD2-CG 3.45Å; L140-M143 HydrophobicContact CD2-SD 3.77Å; L140-M143 PolarHBondContact O-N 2.92Å; M143-F146 PolarHBondContact O-N 3.5Å; M143-K147 VanDerWaalsContact O-CB 3.27Å; M143-K147 WeakPolarHBondContact O-CB 3.36Å; M143-K147 WeakPolarHBondContact O-CG 3.48Å; M143-K147 PolarHBondContact O-N 2.9Å
144	I	52.2	Low	56.8	Low	37 Å²	37	87 Å²	87	19%	0.19	45%	0.454	C	S	.	.	H	α-helix	trans	-65.1	-46.9	179.4	-71.8	167.3	0	0	0	110.6	I134 L140 F146 K147 L148	I134-I144 HydrophobicContact CG1-CG2 4.3Å; L140-I144 WeakPolarHBondContact O-CB 3.41Å; L140-I144 WeakPolarHBondContact O-CD1 3.27Å; L140-I144 VanDerWaalsContact O-CG1 3.25Å; L140-I144 WeakPolarHBondContact O-CG1 3.41Å; L140-I144 PolarHBondContact O-N 2.79Å; I144-F146 PolarHBondContact O-N 3.48Å; I144-K147 PolarHBondContact O-N 3.03Å; I144-L148 HydrophobicContact CG2-CD1 3.33Å; I144-L148 HydrophobicContact CG2-CG 4.23Å; I144-L148 WeakPolarHBondContact O-CB 3.44Å; I144-L148 WeakPolarHBondContact O-CD1 3.25Å; I144-L148 WeakPolarHBondContact O-CG 3.46Å; I144-L148 PolarHBondContact O-N 3.27Å
145	M	53.4	Low	55.4	Low	71 Å²	71	89.1 Å²	89.1	35%	0.35	47%	0.466	S	S	.	.	H	α-helix	trans	-60.5	-45.7	175	-81.7	-61.4	-60.8	0	0	112	L148 L149 D155 I158	M145-L148 PolarHBondContact O-N 3.1Å; M145-L149 WeakPolarHBondContact O-CB 3.43Å; M145-L149 WeakPolarHBondContact O-CG 2.97Å; M145-L149 PolarHBondContact O-N 3.01Å; M145-D155 WeakPolarHBondContact CE-OD1 3.47Å; M145-I158 HydrophobicContact CE-CD1 4.44Å
146	F	52.1	Low	54	Low	147 Å²	147	95 Å²	95	65%	0.645	49%	0.494	S	S	*	.	H	α-helix	trans	-65.9	-45.7	-179.9	-149.2	-90.8	0	0	0	111.9	T142 M143 I144 L149 L150	T142-F146 PolarHBondContact O-N 3.45Å; M143-F146 PolarHBondContact O-N 3.5Å; I144-F146 PolarHBondContact O-N 3.48Å; F146-L149 WeakPolarHBondContact O-CB 3.4Å; F146-L149 PolarHBondContact O-N 2.86Å; F146-L150 HydrophobicContact CD1-CD2 3.44Å; F146-L150 VanDerWaalsContact CD1-CD2 3.44Å; F146-L150 HydrophobicContact CE1-CD2 3.7Å; F146-L150 HydrophobicContact CG-CD2 4.43Å; F146-L150 WeakPolarHBondContact O-CD2 3.48Å; F146-L150 PolarHBondContact O-N 3.01Å
147	K	52.2	Low	52.6	Low	101 Å²	101	95.4 Å²	95.4	44%	0.439	49%	0.489	S	S	.	.	H	α-helix	trans	-65.5	-39.2	175.7	-77.4	-176.9	174.5	-176.9	0	112.2	E133 M143 I144 L149 L150 V151	E133-K147 IonicContact OE1-NZ 3.76Å; M143-K147 VanDerWaalsContact O-CB 3.27Å; M143-K147 WeakPolarHBondContact O-CB 3.36Å; M143-K147 WeakPolarHBondContact O-CG 3.48Å; M143-K147 PolarHBondContact O-N 2.9Å; I144-K147 PolarHBondContact O-N 3.03Å; K147-L149 VanDerWaalsContact C-N 3.32Å; K147-L150 PolarHBondContact O-N 2.88Å; K147-L150 VanDerWaalsContact O-N 3.14Å; K147-V151 WeakPolarHBondContact O-CG2 3.31Å; K147-V151 PolarHBondContact O-N 2.8Å
148	L	50.8	Low	51.4	Low	17 Å²	17	93.3 Å²	93.3	9%	0.089	48%	0.478	C	S	.	.	H	α-helix	trans	-65	-37.5	176	-79.6	162.2	0	0	0	111.5	V130 I134 I144 M145 L150 V151 F152 I158	V130-L148 HydrophobicContact CG1-CD2 3.59Å; I134-L148 HydrophobicContact CD1-CD1 4.21Å; I134-L148 HydrophobicContact CD1-CD2 4.31Å; I144-L148 HydrophobicContact CG2-CD1 3.33Å; I144-L148 HydrophobicContact CG2-CG 4.23Å; I144-L148 WeakPolarHBondContact O-CB 3.44Å; I144-L148 WeakPolarHBondContact O-CD1 3.25Å; I144-L148 WeakPolarHBondContact O-CG 3.46Å; I144-L148 PolarHBondContact O-N 3.27Å; M145-L148 PolarHBondContact O-N 3.1Å; L148-L150 VanDerWaalsContact C-N 3.31Å; L148-L150 PolarHBondContact O-N 3.12Å; L148-V151 PolarHBondContact O-N 2.96Å; L148-F152 HydrophobicContact CD2-CD2 4.05Å; L148-F152 HydrophobicContact CD2-CE2 4.02Å; L148-F152 WeakPolarHBondContact O-CB 3.42Å; L148-F152 PolarHBondContact O-N 2.82Å; L148-I158 HydrophobicContact CB-CD1 3.64Å; L148-I158 HydrophobicContact CB-CG1 4.2Å; L148-I158 HydrophobicContact CD1-CG2 3.85Å; L148-I158 HydrophobicContact CD2-CG2 4.43Å
149	L	52.1	Low	50.5	Low	56 Å²	56	93.8 Å²	93.8	29%	0.293	48%	0.479	S	S	.	.	H	α-helix	trans	-63	-32.4	170	-87.1	166.3	0	0	0	113.4	M145 F146 K147 F152 D155	M145-L149 WeakPolarHBondContact O-CB 3.43Å; M145-L149 WeakPolarHBondContact O-CG 2.97Å; M145-L149 PolarHBondContact O-N 3.01Å; F146-L149 WeakPolarHBondContact O-CB 3.4Å; F146-L149 PolarHBondContact O-N 2.86Å; K147-L149 VanDerWaalsContact C-N 3.32Å; L149-F152 CarbonylContact C-O 3.59Å; L149-F152 WeakPolarHBondContact CA-O 3.41Å; L149-F152 CarbonylContact O-C 3.59Å; L149-D155 WeakPolarHBondContact CD1-OD1 3.39Å; L149-D155 HydrophobicContact CD2-CB 4.46Å; L149-D155 VanDerWaalsContact CD2-OD1 3.25Å; L149-D155 WeakPolarHBondContact CD2-OD1 3.25Å; L149-D155 WeakPolarHBondContact CG-OD1 3.37Å
150	L	53.1	Low	49.9	Very low	121 Å²	121	94.1 Å²	94.1	63%	0.634	47%	0.469	S	S	*	.	H	α-helix	trans	-75.4	-26.5	172.8	-83.9	-29.8	0	0	0	113.3	F146 K147 L148	F146-L150 HydrophobicContact CD1-CD2 3.44Å; F146-L150 VanDerWaalsContact CD1-CD2 3.44Å; F146-L150 HydrophobicContact CE1-CD2 3.7Å; F146-L150 HydrophobicContact CG-CD2 4.43Å; F146-L150 WeakPolarHBondContact O-CD2 3.48Å; F146-L150 PolarHBondContact O-N 3.01Å; K147-L150 PolarHBondContact O-N 2.88Å; K147-L150 VanDerWaalsContact O-N 3.14Å; L148-L150 VanDerWaalsContact C-N 3.31Å; L148-L150 PolarHBondContact O-N 3.12Å
151	V	56.5	Low	49.8	Very low	92 Å²	92	92.3 Å²	92.3	56%	0.558	46%	0.462	S	S	*	.	H	α-helix	trans	-87.2	-36.6	179	174.7	0	0	0	0	111.4	V130 K147 L148	V130-V151 HydrophobicContact CG2-CG1 4.03Å; K147-V151 WeakPolarHBondContact O-CG2 3.31Å; K147-V151 PolarHBondContact O-N 2.8Å; L148-V151 PolarHBondContact O-N 2.96Å
152	F	51	Low	49.5	Very low	51 Å²	51	90.8 Å²	90.8	22%	0.224	44%	0.444	C	S	.	.	S	Bend	trans	-119.4	117.3	178.6	-62.4	-81.8	0	0	0	108.2	V130 L148 L149 S154	V130-F152 HydrophobicContact CG1-CE2 4.21Å; V130-F152 HydrophobicContact CG2-CE2 4.22Å; V130-F152 HydrophobicContact CG2-CZ 4.48Å; L148-F152 HydrophobicContact CD2-CD2 4.05Å; L148-F152 HydrophobicContact CD2-CE2 4.02Å; L148-F152 WeakPolarHBondContact O-CB 3.42Å; L148-F152 PolarHBondContact O-N 2.82Å; L149-F152 CarbonylContact C-O 3.59Å; L149-F152 WeakPolarHBondContact CA-O 3.41Å; L149-F152 CarbonylContact O-C 3.59Å; F152-S154 PolarHBondContact O-N 2.78Å
153	N	57.9	Low	49.4	Very low	164 Å²	164	92.8 Å²	92.8	88%	0.877	45%	0.446	S	S	*	.	S	Bend	trans	-62.1	6.7	-175.4	-82.3	-17.3	0	0	0	115.1
154	S	48.5	Very low	49.3	Very low	40 Å²	40	91.7 Å²	91.7	28%	0.28	44%	0.442	S	S	.	.			trans	-151.1	139.1	-179.6	78	0	0	0	0	115.2	F152 E156 E157	F152-S154 PolarHBondContact O-N 2.78Å; S154-E156 VanDerWaalsContact C-N 3.28Å; S154-E156 PolarHBondContact O-N 2.86Å; S154-E157 VanDerWaalsContact OG-CG 3.29Å; S154-E157 WeakPolarHBondContact OG-CG 3.42Å; S154-E157 PolarHBondContact OG-OE2 2.9Å
155	D	44.6	Very low	49.4	Very low	94 Å²	94	91.3 Å²	91.3	50%	0.503	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.4	178.2	-86.1	-44.2	0	0	0	113.7	M145 L149	M145-D155 WeakPolarHBondContact CE-OD1 3.47Å; L149-D155 WeakPolarHBondContact CD1-OD1 3.39Å; L149-D155 HydrophobicContact CD2-CB 4.46Å; L149-D155 VanDerWaalsContact CD2-OD1 3.25Å; L149-D155 WeakPolarHBondContact CD2-OD1 3.25Å; L149-D155 WeakPolarHBondContact CG-OD1 3.37Å
156	E	47.6	Very low	49.4	Very low	136 Å²	136	93.3 Å²	93.3	64%	0.636	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-17.7	-172.6	-133.3	-171.6	149	0	0	113.2	S154 R160	S154-E156 VanDerWaalsContact C-N 3.28Å; S154-E156 PolarHBondContact O-N 2.86Å; E156-R160 IonicContact OE1-CZ 3.57Å; E156-R160 IonicContact OE1-NH1 3.8Å; E156-R160 PolarHBondContact OE1-NH1 3.26Å; E156-R160 IonicContact OE1-NH2 3.44Å
157	E	46	Very low	49.5	Very low	106 Å²	106	91.8 Å²	91.8	50%	0.495	44%	0.441	S	S	.	.	H	α-helix	trans	-85.3	-22.4	-178.2	-78.6	171.8	157.9	0	0	113.1	S154 W159 S161	S154-E157 VanDerWaalsContact OG-CG 3.29Å; S154-E157 WeakPolarHBondContact OG-CG 3.42Å; S154-E157 PolarHBondContact OG-OE2 2.9Å; E157-W159 PolarHBondContact O-N 2.76Å; E157-S161 WeakPolarHBondContact O-CA 3.45Å; E157-S161 WeakPolarHBondContact O-CB 3.45Å; E157-S161 PolarHBondContact O-N 2.85Å; E157-S161 PolarHBondContact O-OG 3.14Å
158	I	43.4	Very low	49.7	Very low	14 Å²	14	90 Å²	90	7%	0.072	44%	0.438	C	S	.	.	H	α-helix	trans	-67.7	-45.5	-168.4	-64.9	163.8	0	0	0	112.9	M145 L148 S161 M162	M145-I158 HydrophobicContact CE-CD1 4.44Å; L148-I158 HydrophobicContact CB-CD1 3.64Å; L148-I158 HydrophobicContact CB-CG1 4.2Å; L148-I158 HydrophobicContact CD1-CG2 3.85Å; L148-I158 HydrophobicContact CD2-CG2 4.43Å; I158-S161 PolarHBondContact O-OG 3.06Å; I158-M162 PolarHBondContact O-N 2.89Å
159	W	42	Very low	49.9	Very low	172 Å²	172	91.2 Å²	91.2	65%	0.652	44%	0.444	S	S	*	.	H	α-helix	trans	-86	-33.5	-178.1	-67	103.3	0	0	0	113.1	E157 M162	E157-W159 PolarHBondContact O-N 2.76Å; W159-M162 HydrophobicContact CE3-CE 3.67Å; W159-M162 HydrophobicContact CZ3-CE 3.41Å; W159-M162 VanDerWaalsContact CZ3-CE 3.41Å; W159-M162 PolarHBondContact O-N 3.48Å
160	R	40.3	Very low	50.1	Low	171 Å²	171	91.8 Å²	91.8	65%	0.645	45%	0.448	S	S	*	.	H	α-helix	trans	-67.3	-39.6	171.6	-75.5	-174.3	176.5	141.5	2.7	110.9	E156 M162 H163 D164	E156-R160 IonicContact OE1-CZ 3.57Å; E156-R160 IonicContact OE1-NH1 3.8Å; E156-R160 PolarHBondContact OE1-NH1 3.26Å; E156-R160 IonicContact OE1-NH2 3.44Å; R160-M162 PolarHBondContact O-N 3.33Å; R160-H163 PolarHBondContact O-N 3.28Å; R160-D164 VanDerWaalsContact O-CB 3.28Å; R160-D164 WeakPolarHBondContact O-CB 3.34Å; R160-D164 PolarHBondContact O-N 2.92Å
161	S	47.7	Very low	50.1	Low	28 Å²	28	90 Å²	90	20%	0.196	45%	0.445	C	S	.	.	H	α-helix	trans	-64.7	-23.1	176	67.1	0	0	0	0	113.2	E157 I158 M165	E157-S161 WeakPolarHBondContact O-CA 3.45Å; E157-S161 WeakPolarHBondContact O-CB 3.45Å; E157-S161 PolarHBondContact O-N 2.85Å; E157-S161 PolarHBondContact O-OG 3.14Å; I158-S161 PolarHBondContact O-OG 3.06Å; S161-M165 WeakPolarHBondContact O-CA 3.21Å; S161-M165 VanDerWaalsContact O-CB 3.22Å; S161-M165 WeakPolarHBondContact O-CB 3.15Å; S161-M165 PolarHBondContact O-N 3.31Å
162	M	48.4	Very low	49.9	Very low	72 Å²	72	86.5 Å²	86.5	36%	0.355	43%	0.426	S	S	.	.	H	α-helix	trans	-78.9	-30.6	175.9	-179.8	153.4	75.2	0	0	113.6	I158 W159 R160 M165	I158-M162 PolarHBondContact O-N 2.89Å; W159-M162 HydrophobicContact CE3-CE 3.67Å; W159-M162 HydrophobicContact CZ3-CE 3.41Å; W159-M162 VanDerWaalsContact CZ3-CE 3.41Å; W159-M162 PolarHBondContact O-N 3.48Å; R160-M162 PolarHBondContact O-N 3.33Å; M162-M165 HydrophobicContact CB-CE 4.15Å; M162-M165 HydrophobicContact CG-CE 3.53Å; M162-M165 WeakPolarHBondContact O-CB 3.16Å; M162-M165 HydrophobicContact SD-CE 4.1Å
163	H	48	Very low	49.9	Very low	153 Å²	153	85.7 Å²	85.7	71%	0.708	43%	0.432	S	S	*	.	H	α-helix	trans	-78.4	-35.4	169.1	-87.2	-78	0	0	0	111.6	R160 M165	R160-H163 PolarHBondContact O-N 3.28Å; H163-M165 VanDerWaalsContact C-N 3.31Å
164	D	48.3	Very low	49.7	Very low	83 Å²	83	82 Å²	82	44%	0.444	42%	0.424	S	S	.	.	H	α-helix	trans	-72	-23.6	174.3	-158.7	24.2	0	0	0	112.7	R160 R166 L167 V168	R160-D164 VanDerWaalsContact O-CB 3.28Å; R160-D164 WeakPolarHBondContact O-CB 3.34Å; R160-D164 PolarHBondContact O-N 2.92Å; D164-R166 PolarHBondContact O-N 2.9Å; D164-R166 VanDerWaalsContact O-N 3.14Å; D164-L167 WeakPolarHBondContact O-CA 3.37Å; D164-L167 WeakPolarHBondContact O-CB 3.38Å; D164-L167 PolarHBondContact O-N 3.01Å; D164-V168 WeakPolarHBondContact O-CG2 3.34Å; D164-V168 PolarHBondContact O-N 2.71Å
165	M	53.8	Low	50	Low	28 Å²	28	82.4 Å²	82.4	14%	0.138	43%	0.427	C	S	.	.	H	α-helix	trans	-48.3	-44.5	175	177.8	-157.5	-45.5	0	0	112.1	F127 L131 S161 M162 H163 L167 V168 M169	F127-M165 HydrophobicContact CD1-CE 4.38Å; F127-M165 HydrophobicContact CD1-CG 3.67Å; F127-M165 HydrophobicContact CD1-SD 4.03Å; F127-M165 HydrophobicContact CE1-CB 4.12Å; F127-M165 HydrophobicContact CE1-CE 3.12Å; F127-M165 HydrophobicContact CE1-CG 3.23Å; F127-M165 HydrophobicContact CE1-SD 3.2Å; F127-M165 WeakPolarHBondContact CE1-SD 3.33Å; F127-M165 HydrophobicContact CE2-CB 4.23Å; F127-M165 HydrophobicContact CE2-CE 4.27Å; F127-M165 HydrophobicContact CE2-CG 4.15Å; F127-M165 HydrophobicContact CG-CG 4.39Å; F127-M165 HydrophobicContact CZ-CB 3.86Å; F127-M165 HydrophobicContact CZ-CE 3.04Å; F127-M165 HydrophobicContact CZ-CG 3.51Å; F127-M165 HydrophobicContact CZ-SD 3.7Å; L131-M165 HydrophobicContact CD1-CE 4.48Å; L131-M165 HydrophobicContact CD2-SD 4.45Å; S161-M165 WeakPolarHBondContact O-CA 3.21Å; S161-M165 VanDerWaalsContact O-CB 3.22Å; S161-M165 WeakPolarHBondContact O-CB 3.15Å; S161-M165 PolarHBondContact O-N 3.31Å; M162-M165 HydrophobicContact CB-CE 4.15Å; M162-M165 HydrophobicContact CG-CE 3.53Å; M162-M165 WeakPolarHBondContact O-CB 3.16Å; M162-M165 HydrophobicContact SD-CE 4.1Å; H163-M165 VanDerWaalsContact C-N 3.31Å; M165-L167 VanDerWaalsContact C-N 3.33Å; M165-V168 PolarHBondContact O-N 2.82Å; M165-M169 HydrophobicContact CG-CE 3.86Å; M165-M169 HydrophobicContact CG-SD 4.36Å; M165-M169 WeakPolarHBondContact O-CG 3.3Å; M165-M169 PolarHBondContact O-N 3.42Å; M165-M169 HydrophobicContact SD-CE 3.99Å
166	R	54.2	Low	50.8	Low	114 Å²	114	87.4 Å²	87.4	43%	0.43	45%	0.447	S	S	.	.	H	α-helix	trans	-69.5	-34.7	-178	-171.5	167.9	179.9	90.9	0	111.3	D83 D164 N170	D83-R166 IonicContact OD2-CZ 2.87Å; D83-R166 IonicContact OD2-NH1 3.26Å; D83-R166 PolarHBondContact OD2-NH1 3.5Å; D83-R166 IonicContact OD2-NH2 2.64Å; D164-R166 PolarHBondContact O-N 2.9Å; D164-R166 VanDerWaalsContact O-N 3.14Å; R166-N170 VanDerWaalsContact O-CB 3.26Å; R166-N170 WeakPolarHBondContact O-CB 3.49Å; R166-N170 PolarHBondContact O-N 3.01Å; R166-N170 PolarHBondContact O-ND2 2.98Å
167	L	54	Low	51.9	Low	114 Å²	114	82.9 Å²	82.9	60%	0.597	44%	0.437	S	S	*	.	H	α-helix	trans	-68.8	-42.2	175.1	-65.3	173.9	0	0	0	110.5	D164 M165 N170 S171	D164-L167 WeakPolarHBondContact O-CA 3.37Å; D164-L167 WeakPolarHBondContact O-CB 3.38Å; D164-L167 PolarHBondContact O-N 3.01Å; M165-L167 VanDerWaalsContact C-N 3.33Å; L167-N170 PolarHBondContact O-N 3.38Å; L167-S171 WeakPolarHBondContact O-CB 3.48Å; L167-S171 PolarHBondContact O-N 3.01Å; L167-S171 PolarHBondContact O-OG 3.41Å
168	V	54.5	Low	53.7	Low	63 Å²	63	87.8 Å²	87.8	38%	0.382	45%	0.451	S	S	.	.	H	α-helix	trans	-65.5	-43.1	177	177.5	0	0	0	0	112.3	D164 M165 S171 A172	D164-V168 WeakPolarHBondContact O-CG2 3.34Å; D164-V168 PolarHBondContact O-N 2.71Å; M165-V168 PolarHBondContact O-N 2.82Å; V168-S171 WeakPolarHBondContact CA-OG 3.04Å; V168-S171 PolarHBondContact O-N 3.38Å; V168-S171 PolarHBondContact O-OG 3.28Å; V168-A172 WeakPolarHBondContact O-CB 3.33Å; V168-A172 PolarHBondContact O-N 3.45Å
169	M	56.5	Low	55.8	Low	43 Å²	43	92.1 Å²	92.1	21%	0.212	47%	0.469	C	S	.	.	H	α-helix	trans	-65.7	-38.5	175.4	-72.8	-173.3	-177.6	0	0	112.1	F127 W128 M165 G173	F127-M169 HydrophobicContact CD1-CE 3.89Å; F127-M169 HydrophobicContact CE1-CE 4.42Å; W128-M169 HydrophobicContact CE3-CE 4.27Å; M165-M169 HydrophobicContact CG-CE 3.86Å; M165-M169 HydrophobicContact CG-SD 4.36Å; M165-M169 WeakPolarHBondContact O-CG 3.3Å; M165-M169 PolarHBondContact O-N 3.42Å; M165-M169 HydrophobicContact SD-CE 3.99Å; M169-G173 PolarHBondContact O-N 3.03Å
170	N	55.7	Low	58.1	Low	68 Å²	68	86.5 Å²	86.5	36%	0.364	45%	0.452	S	S	.	.	H	α-helix	trans	-70.6	-38.5	177.4	-71.3	-12.4	0	0	0	112.2	R166 L167 G173 R183	R166-N170 VanDerWaalsContact O-CB 3.26Å; R166-N170 WeakPolarHBondContact O-CB 3.49Å; R166-N170 PolarHBondContact O-N 3.01Å; R166-N170 PolarHBondContact O-ND2 2.98Å; L167-N170 PolarHBondContact O-N 3.38Å; N170-G173 PolarHBondContact O-N 3.14Å; N170-R183 PolarHBondContact OD1-NH1 3.11Å; N170-R183 PolarHBondContact OD1-NH2 3.26Å
171	S	53.6	Low	60.6	Low	83 Å²	83	78.4 Å²	78.4	58%	0.58	42%	0.422	S	S	*	.	H	α-helix	trans	-69.4	-35.7	177.4	64.9	0	0	0	0	111.9	L167 V168 G173 A174	L167-S171 WeakPolarHBondContact O-CB 3.48Å; L167-S171 PolarHBondContact O-N 3.01Å; L167-S171 PolarHBondContact O-OG 3.41Å; V168-S171 WeakPolarHBondContact CA-OG 3.04Å; V168-S171 PolarHBondContact O-N 3.38Å; V168-S171 PolarHBondContact O-OG 3.28Å; S171-G173 VanDerWaalsContact C-N 3.25Å; S171-G173 PolarHBondContact O-N 3.3Å; S171-A174 PolarHBondContact O-N 2.91Å
172	A	51.9	Low	62.8	Low	20 Å²	20	77 Å²	77	17%	0.165	41%	0.412	C	S	.	.	H	α-helix	trans	-66.7	-25	173.3	0	0	0	0	0	113.3	L121 V168 A174 S175	L121-A172 HydrophobicContact CD1-CB 4.18Å; L121-A172 HydrophobicContact CD2-CB 4.37Å; V168-A172 WeakPolarHBondContact O-CB 3.33Å; V168-A172 PolarHBondContact O-N 3.45Å; A172-A174 PolarHBondContact O-N 3.28Å; A172-S175 WeakPolarHBondContact O-CB 3.48Å; A172-S175 PolarHBondContact O-N 3.41Å
173	G	51.6	Low	64.9	Low	34 Å²	34	74.8 Å²	74.8	35%	0.351	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.3	175.7	0	0	0	0	0	114.9	M169 N170 S171 S175	M169-G173 PolarHBondContact O-N 3.03Å; N170-G173 PolarHBondContact O-N 3.14Å; S171-G173 VanDerWaalsContact C-N 3.25Å; S171-G173 PolarHBondContact O-N 3.3Å; G173-S175 PolarHBondContact O-N 2.92Å
174	A	54	Low	67.1	Low	86 Å²	86	67.5 Å²	67.5	71%	0.711	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	8.7	175.3	0	0	0	0	0	113.8	S171 A172	S171-A174 PolarHBondContact O-N 2.91Å; A172-A174 PolarHBondContact O-N 3.28Å
175	S	53.6	Low	69.2	Low	48 Å²	48	66.7 Å²	66.7	34%	0.336	36%	0.357	S	S	.	.			trans	-59.7	135.6	-178.3	178.7	0	0	0	0	113.8	A172 G173 G177	A172-S175 WeakPolarHBondContact O-CB 3.48Å; A172-S175 PolarHBondContact O-N 3.41Å; G173-S175 PolarHBondContact O-N 2.92Å; S175-G177 PolarHBondContact O-N 2.96Å
176	H	61.1	Low	70.9	Confident	200 Å²	200	66.3 Å²	66.3	93%	0.926	36%	0.36	S	S	*	.	S	Bend	trans	-63.9	92.5	164.6	-87.4	-87	0	0	0	110.2
177	G	71.8	Confident	72.5	Confident	41 Å²	41	66.5 Å²	66.5	42%	0.423	37%	0.366	S	S	.	.	S	Bend	trans	-165.5	165.6	176.1	0	0	0	0	0	112.4	S175 K179	S175-G177 PolarHBondContact O-N 2.96Å; G177-K179 PolarHBondContact O-N 2.75Å
178	R	83.8	Confident	74.1	Confident	208 Å²	208	61.6 Å²	61.6	79%	0.785	34%	0.34	S	S	*	.			trans	-64.8	120.4	174.8	-170	175	76.4	149.8	2.7	109	D180	R178-D180 PolarHBondContact O-N 3.25Å; R178-D180 VanDerWaalsContact O-N 3.1Å
179	K	87.1	Confident	75.6	Confident	105 Å²	105	63.3 Å²	63.3	46%	0.457	35%	0.347	S	S	.	.			trans	-78	90.3	175.9	-66.7	176	166.7	-144.6	0	109.4	P115 V116 G177	P115-K179 HydrophobicContact CB-CB 4.27Å; P115-K179 HydrophobicContact CB-CD 4.01Å; P115-K179 HydrophobicContact CG-CD 4.22Å; P115-K179 VanDerWaalsContact O-CD 3.29Å; P115-K179 WeakPolarHBondContact O-CD 3.4Å; P115-K179 WeakPolarHBondContact O-CE 3.47Å; P115-K179 PolarHBondContact O-NZ 2.95Å; V116-K179 CarbonylContact O-C 3.54Å; V116-K179 WeakPolarHBondContact O-CA 3.08Å; G177-K179 PolarHBondContact O-N 2.75Å
180	D	90.4	Very high	77	Confident	55 Å²	55	61.5 Å²	61.5	29%	0.294	34%	0.338	S	S	.	.			trans	-97.6	-0.8	-177.7	58.5	-5.5	0	0	0	113.8	A87 M88 V116 F118 R178	A87-D180 CarbonylContact C-O 2.97Å; M88-D180 CarbonylContact C-O 3.53Å; M88-D180 PolarHBondContact N-O 2.79Å; V116-D180 PolarHBondContact O-N 3.37Å; F118-D180 PolarHBondContact N-OD1 2.9Å; R178-D180 PolarHBondContact O-N 3.25Å; R178-D180 VanDerWaalsContact O-N 3.1Å
181	G	92.5	Very high	78.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	166.1	175.7	0	0	0	0	0	113.5	V86 M88 V116	V86-G181 CarbonylContact O-C 3.58Å; V86-G181 WeakPolarHBondContact O-CA 3.4Å; M88-G181 CarbonylContact O-C 3.58Å; M88-G181 WeakPolarHBondContact O-CA 3.5Å; V116-G181 PolarHBondContact N-O 2.8Å; V116-G181 CarbonylContact O-C 3.57Å; V116-G181 WeakPolarHBondContact O-CA 3.36Å; V116-G181 PolarHBondContact O-N 2.82Å
182	C	93.4	Very high	80.1	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.5	175	-168.3	0	0	0	0	110.3	T85 V86 M88 C90 I93 L113	T85-C182 WeakPolarHBondContact CA-O 3.31Å; V86-C182 PolarHBondContact N-O 3.43Å; V86-C182 PolarHBondContact O-N 2.97Å; M88-C182 WeakPolarHBondContact O-CB 3.43Å; M88-C182 PolarHBondContact O-N 3.12Å; C90-C182 WeakPolarHBondContact CA-SG 3.24Å; C90-C182 HydrophobicContact CB-CB 3.95Å; C90-C182 WeakPolarHBondContact CB-SG 3.46Å; C90-C182 WeakPolarHBondContact SG-CA 3.2Å; C90-C182 WeakPolarHBondContact SG-CB 3.46Å; C90-C182 CovalentContact SG-SG 2.04Å; C90-C182 PolarHBondContact SG-SG 2.75Å; I93-C182 HydrophobicContact CD1-CB 3.6Å; I93-C182 HydrophobicContact CG1-CB 4.36Å; L113-C182 WeakPolarHBondContact CD2-SG 3.43Å
183	R	94.1	Very high	81.7	Confident	25 Å²	25	58 Å²	58	9%	0.094	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.6	174.5	-174	-169.5	-174.6	171.8	7.6	109.1	D83 L84 L113 E114 V116 N170 Y185	D83-R183 IonicContact OD1-CZ 2.7Å; D83-R183 IonicContact OD1-NE 2.82Å; D83-R183 PolarHBondContact OD1-NE 3.43Å; D83-R183 IonicContact OD1-NH2 2.8Å; D83-R183 PolarHBondContact OD1-NH2 3.14Å; D83-R183 IonicContact OD2-CZ 3.07Å; D83-R183 IonicContact OD2-NE 3.94Å; D83-R183 IonicContact OD2-NH2 3.71Å; D83-R183 PolarHBondContact OD2-NH2 3.46Å; L84-R183 CarbonylContact O-C 3.51Å; L113-R183 CarbonylContact C-O 3.47Å; L113-R183 WeakPolarHBondContact CA-O 3.37Å; E114-R183 HydrophobicContact CB-CB 4.4Å; E114-R183 PolarHBondContact N-O 2.78Å; E114-R183 PolarHBondContact O-N 2.8Å; E114-R183 IonicContact OE2-NH1 2.76Å; V116-R183 HydrophobicContact CG1-CB 3.95Å; V116-R183 HydrophobicContact CG2-CB 3.9Å; N170-R183 PolarHBondContact OD1-NH1 3.11Å; N170-R183 PolarHBondContact OD1-NH2 3.26Å; R183-Y185 HydrophobicContact CG-CD1 4.04Å
184	I	93.1	Very high	83.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	111.2	174.2	-53	156.7	0	0	0	106.5	D83 L84 V86 I93 V95 F111 K112 L113 F197 V199	D83-I184 WeakPolarHBondContact CA-O 3.38Å; L84-I184 HydrophobicContact CD2-CD1 4.16Å; L84-I184 HydrophobicContact CG-CD1 4.48Å; L84-I184 PolarHBondContact N-O 3.39Å; L84-I184 PolarHBondContact O-N 3Å; V86-I184 HydrophobicContact CG2-CD1 4.15Å; I93-I184 HydrophobicContact CD1-CD1 4.25Å; I93-I184 HydrophobicContact CD1-CG1 4.5Å; V95-I184 HydrophobicContact CG2-CD1 3.63Å; V95-I184 HydrophobicContact CG2-CG1 3.95Å; V95-I184 HydrophobicContact CG2-CG2 4.19Å; F111-I184 HydrophobicContact CB-CG2 4.48Å; F111-I184 HydrophobicContact CD2-CG2 4.11Å; K112-I184 WeakPolarHBondContact O-CA 3.27Å; L113-I184 HydrophobicContact CD2-CG1 3.62Å; I184-F197 HydrophobicContact CG2-CZ 4Å; I184-V199 HydrophobicContact CD1-CG1 4.06Å; I184-V199 HydrophobicContact CD1-CG2 3.65Å
185	Y	92.2	Very high	85.3	Confident	65 Å²	65	56 Å²	56	26%	0.255	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.7	180	69.4	-78.9	0	0	0	111.4	I82 F111 K112 E114 R183	I82-Y185 CarbonylContact O-C 3.6Å; I82-Y185 WeakPolarHBondContact O-CA 3.28Å; F111-Y185 CarbonylContact C-O 3.52Å; F111-Y185 WeakPolarHBondContact CA-O 3.47Å; K112-Y185 HydrophobicContact CB-CD1 4.49Å; K112-Y185 HydrophobicContact CB-CE1 3.89Å; K112-Y185 HydrophobicContact CB-CE2 4.32Å; K112-Y185 PolarHBondContact N-O 2.87Å; K112-Y185 PolarHBondContact O-N 3.03Å; E114-Y185 HydrophobicContact CB-CE1 3.81Å; R183-Y185 HydrophobicContact CG-CD1 4.04Å
186	G	89.8	Confident	87.1	Confident	20 Å²	20	54.4 Å²	54.4	21%	0.206	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.1	164	-172.1	0	0	0	0	0	114.9	N81 I82 G110	N81-G186 WeakPolarHBondContact CA-O 3.42Å; I82-G186 PolarHBondContact N-O 3.35Å; I82-G186 PolarHBondContact O-N 3.03Å; G110-G186 CarbonylContact O-C 3.58Å; G110-G186 WeakPolarHBondContact O-CA 3.29Å
187	Q	88	Confident	88.5	Confident	118 Å²	118	45.2 Å²	45.2	55%	0.551	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.8	166.7	-176.7	175.5	24.4	0	0	108.6	I80 N81 G110	I80-Q187 VanDerWaalsContact O-CA 3.29Å; I80-Q187 WeakPolarHBondContact O-CA 3.43Å; N81-Q187 WeakPolarHBondContact OD1-CB 3.25Å; N81-Q187 WeakPolarHBondContact OD1-CG 3.38Å; N81-Q187 PolarHBondContact OD1-NE2 2.91Å; G110-Q187 CarbonylContact O-C 3.13Å; G110-Q187 PolarHBondContact O-N 3.26Å
188	F	87.4	Confident	89.5	Confident	11 Å²	11	45.8 Å²	45.8	5%	0.048	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	153.5	177.6	50.9	-90.1	0	0	0	111.4	P79 I80 I82 F97 L105 V190	P79-F188 CarbonylContact C-O 3.6Å; P79-F188 WeakPolarHBondContact CA-O 3.49Å; I80-F188 HydrophobicContact CB-CD2 4.23Å; I80-F188 HydrophobicContact CB-CE2 3.81Å; I80-F188 HydrophobicContact CB-CZ 3.97Å; I80-F188 HydrophobicContact CD1-CE2 3.97Å; I80-F188 HydrophobicContact CD1-CZ 4.47Å; I80-F188 HydrophobicContact CG1-CE2 4.26Å; I80-F188 HydrophobicContact CG2-CE1 4.44Å; I80-F188 HydrophobicContact CG2-CE2 4.25Å; I80-F188 HydrophobicContact CG2-CZ 3.93Å; I80-F188 PolarHBondContact N-O 3.01Å; I80-F188 PolarHBondContact O-N 3.23Å; I82-F188 HydrophobicContact CG2-CE1 3.93Å; F97-F188 AromaticContact CD2-CE2 3.87Å; F97-F188 HydrophobicContact CD2-CE2 3.87Å; F97-F188 HydrophobicContact CD2-CZ 4.1Å; F97-F188 HydrophobicContact CE2-CD2 4.47Å; F97-F188 AromaticContact CE2-CE2 3.5Å; F97-F188 HydrophobicContact CE2-CE2 3.5Å; F97-F188 HydrophobicContact CE2-CZ 4.09Å; F97-F188 HydrophobicContact CZ-CE2 4.02Å; L105-F188 HydrophobicContact CD1-CB 3.97Å; L105-F188 HydrophobicContact CD1-CD2 3.17Å; L105-F188 HydrophobicContact CD1-CE2 3.72Å; L105-F188 HydrophobicContact CD1-CG 3.72Å; F188-V190 HydrophobicContact CD2-CG1 3.45Å; F188-V190 VanDerWaalsContact CD2-CG1 3.45Å; F188-V190 HydrophobicContact CE2-CG1 3.48Å; F188-V190 VanDerWaalsContact CE2-CG1 3.48Å
189	L	86.9	Confident	89.9	Confident	100 Å²	100	36 Å²	36	52%	0.524	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.6	179.6	-65.9	172.7	0	0	0	109.5	K77 P79	K77-L189 HydrophobicContact CB-CB 4.12Å; K77-L189 HydrophobicContact CD-CB 4.13Å; P79-L189 HydrophobicContact CB-CD2 3.81Å; P79-L189 HydrophobicContact CG-CD2 3.97Å
190	V	86.1	Confident	90	Very high	5 Å²	5	31 Å²	31	3%	0.03	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.2	176.7	-53.2	0	0	0	0	110.8	K77 V78 I80 F97 L105 F188 Y309	K77-V190 CarbonylContact C-O 3.6Å; K77-V190 WeakPolarHBondContact CA-O 3.43Å; K77-V190 WeakPolarHBondContact CB-O 3.35Å; V78-V190 HydrophobicContact CB-CG2 4.22Å; V78-V190 PolarHBondContact N-O 2.96Å; V78-V190 WeakPolarHBondContact O-CG2 3.38Å; V78-V190 PolarHBondContact O-N 2.77Å; I80-V190 HydrophobicContact CD1-CB 4.29Å; I80-V190 HydrophobicContact CD1-CG1 3.62Å; I80-V190 HydrophobicContact CD1-CG2 3.68Å; I80-V190 HydrophobicContact CG1-CG1 3.96Å; I80-V190 HydrophobicContact CG1-CG2 3.81Å; F97-V190 HydrophobicContact CE1-CG1 4.25Å; F97-V190 HydrophobicContact CE2-CG1 3.95Å; F97-V190 HydrophobicContact CZ-CB 4.2Å; F97-V190 HydrophobicContact CZ-CG1 3.38Å; L105-V190 HydrophobicContact CD1-CG1 4.4Å; F188-V190 HydrophobicContact CD2-CG1 3.45Å; F188-V190 VanDerWaalsContact CD2-CG1 3.45Å; F188-V190 HydrophobicContact CE2-CG1 3.48Å; F188-V190 VanDerWaalsContact CE2-CG1 3.48Å; V190-Y309 HydrophobicContact CG2-CE2 4.36Å
191	A	85.7	Confident	89.8	Confident	21 Å²	21	30.6 Å²	30.6	17%	0.174	15%	0.154	C	C	.	.			trans	-74.3	159.3	170.1	0	0	0	0	0	110.6	V193	A191-V193 HydrophobicContact CB-CG2 3.57Å; A191-V193 PolarHBondContact O-N 2.8Å
192	K	87.1	Confident	89.2	Confident	35 Å²	35	30.9 Å²	30.9	15%	0.152	16%	0.157	C	C	.	.	S	Bend	trans	-75.2	61.5	176.2	-72	178.1	177.6	-176.4	0	112	D71 D73 E76 V78 L311	D71-K192 IonicContact OD1-NZ 3.88Å; D71-K192 PolarHBondContact OD1-NZ 3.28Å; D71-K192 IonicContact OD2-NZ 3.91Å; D71-K192 PolarHBondContact OD2-NZ 3.05Å; D73-K192 WeakPolarHBondContact O-CD 3.45Å; D73-K192 WeakPolarHBondContact O-CE 3.39Å; D73-K192 PolarHBondContact O-NZ 3.19Å; E76-K192 HydrophobicContact CB-CD 4.5Å; E76-K192 VanDerWaalsContact O-CG 3.28Å; E76-K192 WeakPolarHBondContact O-CG 3.45Å; E76-K192 WeakPolarHBondContact OE2-CE 3.45Å; E76-K192 IonicContact OE2-NZ 3.46Å; E76-K192 PolarHBondContact OE2-NZ 3.37Å; V78-K192 HydrophobicContact CG2-CG 3.9Å; K192-L311 HydrophobicContact CB-CD2 3.77Å; K192-L311 HydrophobicContact CG-CD2 3.58Å
193	V	87	Confident	88.4	Confident	40 Å²	40	37.4 Å²	37.4	24%	0.242	18%	0.182	C	C	.	.	S	Bend	trans	-137	162.3	-178.8	-83.7	0	0	0	0	109.2	D99 A191 G195 Y309 L311	D99-V193 VanDerWaalsContact CG-CG2 3.4Å; D99-V193 WeakPolarHBondContact OD1-CG2 3.22Å; D99-V193 WeakPolarHBondContact OD2-CG2 3.34Å; A191-V193 HydrophobicContact CB-CG2 3.57Å; A191-V193 PolarHBondContact O-N 2.8Å; V193-G195 PolarHBondContact O-N 2.84Å; V193-Y309 WeakPolarHBondContact O-CE2 3.48Å; V193-L311 WeakPolarHBondContact O-CD1 3.47Å
194	H	90.4	Very high	87.2	Confident	79 Å²	79	38.1 Å²	38.1	37%	0.366	19%	0.186	S	C	.	.			trans	-62.1	133.4	175.4	166.7	-79.7	0	0	0	110.2	D99 V100 I308 Y309	D99-H194 VanDerWaalsContact OD1-O 3.05Å; V100-H194 HydrophobicContact CG2-CB 4.01Å; V100-H194 VanDerWaalsContact CG2-O 3.22Å; V100-H194 WeakPolarHBondContact CG2-O 3.49Å; V100-H194 PolarHBondContact N-O 2.82Å; H194-I308 VanDerWaalsContact NE2-CG2 3.25Å; H194-I308 WeakPolarHBondContact NE2-CG2 3.07Å; H194-Y309 WeakPolarHBondContact CA-O 3.4Å
195	G	90.5	Very high	86	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	172.7	174.6	0	0	0	0	0	113	K98 V193 Y309	K98-G195 CarbonylContact O-C 3.59Å; K98-G195 VanDerWaalsContact O-CA 3.23Å; K98-G195 WeakPolarHBondContact O-CA 3.45Å; V193-G195 PolarHBondContact O-N 2.84Å; G195-Y309 VanDerWaalsContact CA-CZ 3.41Å; G195-Y309 PolarHBondContact N-O 3.31Å; G195-Y309 VanDerWaalsContact O-CD1 3.24Å; G195-Y309 WeakPolarHBondContact O-CD1 3.16Å; G195-Y309 WeakPolarHBondContact O-CE1 3.32Å; G195-Y309 PolarHBondContact O-N 3.47Å
196	S	90.4	Very high	84.5	Confident	15 Å²	15	41.9 Å²	41.9	11%	0.105	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	135	-174.8	60.7	0	0	0	0	110.9	F97 K98 H198 I307	F97-S196 WeakPolarHBondContact CA-O 3.39Å; K98-S196 PolarHBondContact N-O 3Å; K98-S196 PolarHBondContact O-N 3.18Å; K98-S196 PolarHBondContact O-OG 3.36Å; S196-H198 VanDerWaalsContact CB-NE2 3.35Å; S196-H198 WeakPolarHBondContact CB-NE2 3.29Å; S196-H198 PolarHBondContact OG-CD2 3.04Å; S196-H198 PolarHBondContact OG-NE2 3.4Å; S196-I307 CarbonylContact C-O 3.51Å; S196-I307 WeakPolarHBondContact CA-O 3.48Å
197	F	91.2	Very high	83.4	Confident	7 Å²	7	46.5 Å²	46.5	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.5	174.6	174.6	-90.4	0	0	0	107.9	I82 L84 V95 F97 I184 V199 S306 I307	I82-F197 HydrophobicContact CD1-CD1 3.81Å; I82-F197 HydrophobicContact CD1-CD2 4.3Å; I82-F197 HydrophobicContact CD1-CE1 3.48Å; I82-F197 VanDerWaalsContact CD1-CE1 3.48Å; I82-F197 HydrophobicContact CD1-CE2 3.99Å; I82-F197 HydrophobicContact CD1-CG 4.21Å; I82-F197 HydrophobicContact CD1-CZ 3.58Å; L84-F197 HydrophobicContact CD2-CE1 4.06Å; V95-F197 HydrophobicContact CG1-CD2 4.05Å; V95-F197 HydrophobicContact CG1-CE1 4.45Å; V95-F197 HydrophobicContact CG1-CE2 3.17Å; V95-F197 HydrophobicContact CG1-CZ 3.41Å; V95-F197 VanDerWaalsContact CG1-CZ 3.41Å; F97-F197 HydrophobicContact CD2-CB 4.41Å; F97-F197 HydrophobicContact CD2-CD2 4.46Å; I184-F197 HydrophobicContact CG2-CZ 4Å; F197-V199 HydrophobicContact CD1-CG2 4.37Å; F197-V199 HydrophobicContact CE1-CG2 3.53Å; F197-V199 HydrophobicContact CZ-CG2 4.03Å; F197-S306 CarbonylContact O-C 3.48Å; F197-S306 WeakPolarHBondContact O-CA 3.29Å; F197-I307 HydrophobicContact CB-CB 4.3Å; F197-I307 HydrophobicContact CD1-CB 4.46Å; F197-I307 HydrophobicContact CD1-CD1 4.07Å; F197-I307 HydrophobicContact CD1-CG1 4.39Å; F197-I307 PolarHBondContact N-O 3.04Å; F197-I307 PolarHBondContact O-N 3.43Å
198	H	91.5	Very high	82.4	Confident	53 Å²	53	43.1 Å²	43.1	25%	0.245	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125	-173.9	-70	-83.4	0	0	0	111.1	V95 D96 S196 I305 S306	V95-H198 WeakPolarHBondContact CA-O 3.25Å; D96-H198 HydrophobicContact CB-CB 4.43Å; D96-H198 PolarHBondContact N-O 3.26Å; D96-H198 PolarHBondContact O-N 2.95Å; S196-H198 VanDerWaalsContact CB-NE2 3.35Å; S196-H198 WeakPolarHBondContact CB-NE2 3.29Å; S196-H198 PolarHBondContact OG-CD2 3.04Å; S196-H198 PolarHBondContact OG-NE2 3.4Å; H198-I305 CarbonylContact C-O 3.48Å; H198-I305 WeakPolarHBondContact CA-O 3.48Å; H198-S306 PolarHBondContact CE1-OG 3Å; H198-S306 WeakPolarHBondContact ND1-CB 3.34Å; H198-S306 PolarHBondContact ND1-OG 2.91Å; H198-S306 VanDerWaalsContact ND1-OG 3.16Å
199	V	92.7	Very high	81.4	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.1	167.2	-168.7	0	0	0	0	108.5	L84 V86 I93 S94 V95 I184 F197 G304 I305	L84-V199 HydrophobicContact CD2-CG2 4.04Å; V86-V199 HydrophobicContact CG2-CG1 4.36Å; I93-V199 HydrophobicContact CB-CG1 4.34Å; I93-V199 HydrophobicContact CD1-CG1 4.16Å; S94-V199 WeakPolarHBondContact O-CA 3.49Å; V95-V199 HydrophobicContact CG2-CG2 4.41Å; I184-V199 HydrophobicContact CD1-CG1 4.06Å; I184-V199 HydrophobicContact CD1-CG2 3.65Å; F197-V199 HydrophobicContact CD1-CG2 4.37Å; F197-V199 HydrophobicContact CE1-CG2 3.53Å; F197-V199 HydrophobicContact CZ-CG2 4.03Å; V199-G304 CarbonylContact O-C 3.41Å; V199-G304 VanDerWaalsContact O-CA 3.29Å; V199-G304 WeakPolarHBondContact O-CA 3.38Å; V199-I305 HydrophobicContact CB-CB 4.17Å; V199-I305 HydrophobicContact CB-CD1 4.45Å; V199-I305 HydrophobicContact CG2-CB 4.48Å; V199-I305 PolarHBondContact N-O 3.05Å; V199-I305 PolarHBondContact O-N 2.82Å
200	T	89.7	Confident	80.4	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.012	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	163.1	-169.3	172.4	0	0	0	0	109.5	I93 S94 R214 R302	I93-T200 CarbonylContact C-O 3.58Å; I93-T200 WeakPolarHBondContact CA-O 3.22Å; S94-T200 PolarHBondContact N-O 3.49Å; S94-T200 PolarHBondContact O-N 3.08Å; T200-R214 PolarHBondContact OG1-NH1 2.73Å; T200-R302 WeakPolarHBondContact OG1-CD 2.96Å
201	F	86	Confident	79.5	Confident	46 Å²	46	56.6 Å²	56.6	20%	0.202	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	155.4	173.2	63.6	-92.7	0	0	0	112.8	I216 F224 F226 P303	F201-I216 HydrophobicContact CD2-CG1 4.38Å; F201-I216 HydrophobicContact CD2-CG2 3.96Å; F201-I216 HydrophobicContact CE2-CD1 4.01Å; F201-I216 HydrophobicContact CE2-CG1 4.05Å; F201-I216 HydrophobicContact CE2-CG2 3.93Å; F201-F224 HydrophobicContact CB-CD1 3.71Å; F201-F224 HydrophobicContact CB-CE1 3.46Å; F201-F224 VanDerWaalsContact CB-CE1 3.46Å; F201-F224 HydrophobicContact CB-CZ 4.05Å; F201-F224 HydrophobicContact CG-CE1 4.35Å; F201-F226 HydrophobicContact CB-CZ 4.33Å; F201-F226 HydrophobicContact CD1-CZ 4.27Å; F201-P303 HydrophobicContact CD1-CG 4.12Å; F201-P303 HydrophobicContact CE1-CG 3.7Å
202	G	80.4	Confident	78.4	Confident	5 Å²	5	58.6 Å²	58.6	5%	0.052	29%	0.291	C	S	.	.	S	Bend	trans	101	168.3	178.9	0	0	0	0	0	112.9	A92 I93 S94 L215	A92-G202 PolarHBondContact O-N 2.88Å; I93-G202 CarbonylContact C-O 3.45Å; S94-G202 WeakPolarHBondContact CB-O 3.28Å; S94-G202 PolarHBondContact N-O 3.23Å; G202-L215 CarbonylContact C-O 3.54Å; G202-L215 WeakPolarHBondContact CA-O 3.34Å
203	R	75.8	Confident	77.4	Confident	138 Å²	138	61.1 Å²	61.1	52%	0.521	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.3	172.8	-178.9	178.7	168	91	-0.1	109.1	I205 L215	R203-I205 HydrophobicContact CG-CG1 4.3Å; R203-L215 PolarHBondContact N-O 3.2Å; R203-L215 PolarHBondContact O-N 2.88Å
204	Q	69.9	Low	76.4	Confident	39 Å²	39	62.6 Å²	62.6	18%	0.182	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.8	169.4	60.8	-172.1	0.4	0	0	110	S94 V95 D107	S94-Q204 WeakPolarHBondContact OG-CB 3.29Å; S94-Q204 WeakPolarHBondContact OG-CG 3.33Å; S94-Q204 PolarHBondContact OG-OE1 3.26Å; V95-Q204 PolarHBondContact O-NE2 3.04Å; V95-Q204 PolarHBondContact O-OE1 3.4Å; D107-Q204 PolarHBondContact OD1-NE2 3.33Å
205	I	67.5	Low	75.4	Confident	63 Å²	63	62.6 Å²	62.6	32%	0.323	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.4	170.9	-56	-168.1	0	0	0	107.9	R203 L213 L215	R203-I205 HydrophobicContact CG-CG1 4.3Å; I205-L213 PolarHBondContact N-O 3.3Å; I205-L213 PolarHBondContact O-N 2.83Å; I205-L213 VanDerWaalsContact O-O 3.09Å; I205-L215 HydrophobicContact CD1-CD1 3.33Å; I205-L215 HydrophobicContact CD1-CG 3.98Å; I205-L215 HydrophobicContact CG1-CD1 4.16Å; I205-L215 HydrophobicContact CG1-CG 4.3Å
206	R	60	Low	74.2	Confident	82 Å²	82	65.5 Å²	65.5	31%	0.309	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	122.6	171.7	-68.2	163.3	176.6	-115.4	-10.2	108.3	D106 K212	D106-R206 VanDerWaalsContact CG-CZ 3.45Å; D106-R206 VanDerWaalsContact CG-NH2 3.27Å; D106-R206 IonicContact OD1-CZ 3.39Å; D106-R206 IonicContact OD1-NH1 3.14Å; D106-R206 PolarHBondContact OD1-NH1 2.81Å; D106-R206 IonicContact OD1-NH2 2.64Å; D106-R206 PolarHBondContact OD1-NH2 2.81Å; D106-R206 IonicContact OD2-CZ 2.79Å; D106-R206 IonicContact OD2-NH1 2.89Å; D106-R206 PolarHBondContact OD2-NH1 2.89Å; D106-R206 IonicContact OD2-NH2 3.92Å; R206-K212 HydrophobicContact CG-CG 4.11Å
207	L	66.2	Low	72.8	Confident	116 Å²	116	69.6 Å²	69.6	61%	0.607	35%	0.345	S	S	*	.	S	Bend	trans	-95.1	-31	168.8	-69.7	109.3	0	0	0	111.9	I211 L213	L207-I211 PolarHBondContact N-O 3.17Å; L207-L213 HydrophobicContact CD1-CB 3.59Å; L207-L213 HydrophobicContact CD1-CD1 3.23Å; L207-L213 HydrophobicContact CD1-CG 3.25Å; L207-L213 HydrophobicContact CG-CD1 4.5Å
208	S	68	Low	71.1	Confident	48 Å²	48	77.5 Å²	77.5	34%	0.336	38%	0.38	S	S	.	.	S	Bend	trans	-148.4	174.6	174.8	69.7	0	0	0	0	110.4	S210 I211	S208-S210 PolarHBondContact O-N 2.55Å; S208-S210 PolarHBondContact OG-N 2.76Å; S208-S210 PolarHBondContact OG-OG 3.41Å; S208-I211 PolarHBondContact N-O 2.75Å; S208-I211 PolarHBondContact O-N 2.86Å; S208-I211 WeakPolarHBondContact OG-CB 3.4Å; S208-I211 WeakPolarHBondContact OG-CG1 3.44Å; S208-I211 PolarHBondContact OG-N 2.79Å
209	E	66.2	Low	69.8	Low	199 Å²	199	78.7 Å²	78.7	93%	0.93	39%	0.388	S	S	*	.	S	Bend	trans	-54.7	-31.9	175	-68.6	-179.8	172.9	0	0	112.8
210	S	65.4	Low	68.2	Low	107 Å²	107	83.6 Å²	83.6	75%	0.748	43%	0.429	S	S	*	.	S	Bend	trans	-101.8	-22.7	-177.9	55	0	0	0	0	114.6	S208	S208-S210 PolarHBondContact O-N 2.55Å; S208-S210 PolarHBondContact OG-N 2.76Å; S208-S210 PolarHBondContact OG-OG 3.41Å
211	I	68.6	Low	67	Low	93 Å²	93	87.7 Å²	87.7	48%	0.477	46%	0.457	S	S	.	.			trans	-109.7	108.1	-172	-56.7	171.8	0	0	0	110.5	L207 S208 L213	L207-I211 PolarHBondContact N-O 3.17Å; S208-I211 PolarHBondContact N-O 2.75Å; S208-I211 PolarHBondContact O-N 2.86Å; S208-I211 WeakPolarHBondContact OG-CB 3.4Å; S208-I211 WeakPolarHBondContact OG-CG1 3.44Å; S208-I211 PolarHBondContact OG-N 2.79Å; I211-L213 HydrophobicContact CG2-CG 4.39Å
212	K	61.6	Low	66.3	Low	62 Å²	62	88.8 Å²	88.8	27%	0.27	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	114.2	169.3	-65.9	178.1	-176.3	173.3	0	108.8	I104 R206	I104-K212 VanDerWaalsContact CB-NZ 3.29Å; I104-K212 HydrophobicContact CD1-CD 4.29Å; R206-K212 HydrophobicContact CG-CG 4.11Å
213	L	67.3	Low	66.3	Low	88 Å²	88	94.3 Å²	94.3	46%	0.461	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.6	168.5	-70.2	-174.8	0	0	0	109.1	I205 L207 I211	I205-L213 PolarHBondContact N-O 3.3Å; I205-L213 PolarHBondContact O-N 2.83Å; I205-L213 VanDerWaalsContact O-O 3.09Å; L207-L213 HydrophobicContact CD1-CB 3.59Å; L207-L213 HydrophobicContact CD1-CD1 3.23Å; L207-L213 HydrophobicContact CD1-CG 3.25Å; L207-L213 HydrophobicContact CG-CD1 4.5Å; I211-L213 HydrophobicContact CG2-CG 4.39Å
214	R	65.7	Low	66.8	Low	71 Å²	71	90.1 Å²	90.1	27%	0.268	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.9	168.9	-175.7	176.8	-63.4	-153.6	-5.3	108.2	D96 T200 I216	D96-R214 IonicContact OD2-NH2 2.83Å; T200-R214 PolarHBondContact OG1-NH1 2.73Å; R214-I216 HydrophobicContact CG-CG1 4.43Å; R214-I216 PolarHBondContact O-N 3.31Å
215	L	67.9	Low	67.8	Low	79 Å²	79	91.1 Å²	91.1	41%	0.414	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	112.2	167.9	-62.3	-169.8	0	0	0	107.9	G202 R203 I205 N217	G202-L215 CarbonylContact C-O 3.54Å; G202-L215 WeakPolarHBondContact CA-O 3.34Å; R203-L215 PolarHBondContact N-O 3.2Å; R203-L215 PolarHBondContact O-N 2.88Å; I205-L215 HydrophobicContact CD1-CD1 3.33Å; I205-L215 HydrophobicContact CD1-CG 3.98Å; I205-L215 HydrophobicContact CG1-CD1 4.16Å; I205-L215 HydrophobicContact CG1-CG 4.3Å; L215-N217 PolarHBondContact O-N 3.34Å
216	I	65.3	Low	69	Low	62 Å²	62	88.1 Å²	88.1	32%	0.318	47%	0.47	S	S	.	.			trans	-83.8	99.8	165.8	-57.5	164.7	0	0	0	104.5	F201 R214 F218	F201-I216 HydrophobicContact CD2-CG1 4.38Å; F201-I216 HydrophobicContact CD2-CG2 3.96Å; F201-I216 HydrophobicContact CE2-CD1 4.01Å; F201-I216 HydrophobicContact CE2-CG1 4.05Å; F201-I216 HydrophobicContact CE2-CG2 3.93Å; R214-I216 HydrophobicContact CG-CG1 4.43Å; R214-I216 PolarHBondContact O-N 3.31Å; I216-F218 VanDerWaalsContact C-N 3.27Å; I216-F218 HydrophobicContact CB-CD2 4.11Å; I216-F218 HydrophobicContact CB-CE2 3.69Å; I216-F218 HydrophobicContact CB-CZ 4Å; I216-F218 HydrophobicContact CD1-CE2 4.42Å; I216-F218 HydrophobicContact CD1-CZ 4.17Å; I216-F218 HydrophobicContact CG2-CD1 3.97Å; I216-F218 HydrophobicContact CG2-CD2 3.83Å; I216-F218 HydrophobicContact CG2-CE1 3.73Å; I216-F218 HydrophobicContact CG2-CE2 3.58Å; I216-F218 HydrophobicContact CG2-CG 4.03Å; I216-F218 HydrophobicContact CG2-CZ 3.53Å; I216-F218 VanDerWaalsContact O-CD2 3.28Å; I216-F218 WeakPolarHBondContact O-CD2 3.21Å; I216-F218 PolarHBondContact O-N 2.94Å
217	N	61.2	Low	70.7	Confident	101 Å²	101	84.5 Å²	84.5	54%	0.54	46%	0.457	S	S	.	.			trans	-67.7	97.7	166.7	-76.5	8.9	0	0	0	106.4	L215 D219	L215-N217 PolarHBondContact O-N 3.34Å; N217-D219 PolarHBondContact O-N 3.04Å
218	F	55.7	Low	72.1	Confident	172 Å²	172	79 Å²	79	75%	0.754	43%	0.428	S	S	*	.			trans	-75.3	65	168.4	-67.3	-82.4	0	0	0	108.5	I216 A220	I216-F218 VanDerWaalsContact C-N 3.27Å; I216-F218 HydrophobicContact CB-CD2 4.11Å; I216-F218 HydrophobicContact CB-CE2 3.69Å; I216-F218 HydrophobicContact CB-CZ 4Å; I216-F218 HydrophobicContact CD1-CE2 4.42Å; I216-F218 HydrophobicContact CD1-CZ 4.17Å; I216-F218 HydrophobicContact CG2-CD1 3.97Å; I216-F218 HydrophobicContact CG2-CD2 3.83Å; I216-F218 HydrophobicContact CG2-CE1 3.73Å; I216-F218 HydrophobicContact CG2-CE2 3.58Å; I216-F218 HydrophobicContact CG2-CG 4.03Å; I216-F218 HydrophobicContact CG2-CZ 3.53Å; I216-F218 VanDerWaalsContact O-CD2 3.28Å; I216-F218 WeakPolarHBondContact O-CD2 3.21Å; I216-F218 PolarHBondContact O-N 2.94Å; F218-A220 PolarHBondContact O-N 2.85Å
219	D	64.5	Low	73.4	Confident	78 Å²	78	77.3 Å²	77.3	42%	0.417	42%	0.415	S	S	.	.			trans	-75.4	100.7	159.1	-169	-15	0	0	0	106.4	N217 S221 L222	N217-D219 PolarHBondContact O-N 3.04Å; D219-S221 VanDerWaalsContact CG-OG 3.24Å; D219-S221 PolarHBondContact O-N 3.44Å; D219-S221 WeakPolarHBondContact OD1-CB 3.46Å; D219-S221 PolarHBondContact OD1-N 2.85Å; D219-S221 VanDerWaalsContact OD1-N 3.16Å; D219-S221 PolarHBondContact OD1-OG 2.83Å; D219-S221 PolarHBondContact OD2-OG 2.79Å; D219-L222 HydrophobicContact CB-CB 4.49Å; D219-L222 HydrophobicContact CB-CD1 3.85Å; D219-L222 HydrophobicContact CB-CG 4.04Å; D219-L222 PolarHBondContact O-N 3.39Å
220	A	59.7	Low	74.7	Confident	104 Å²	104	68 Å²	68	86%	0.86	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-12.4	-178.6	0	0	0	0	0	113.1	F218	F218-A220 PolarHBondContact O-N 2.85Å
221	S	64.6	Low	75.9	Confident	88 Å²	88	64.1 Å²	64.1	62%	0.615	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-12.2	177	73.2	0	0	0	0	114.5	D219	D219-S221 VanDerWaalsContact CG-OG 3.24Å; D219-S221 PolarHBondContact O-N 3.44Å; D219-S221 WeakPolarHBondContact OD1-CB 3.46Å; D219-S221 PolarHBondContact OD1-N 2.85Å; D219-S221 VanDerWaalsContact OD1-N 3.16Å; D219-S221 PolarHBondContact OD1-OG 2.83Å; D219-S221 PolarHBondContact OD2-OG 2.79Å
222	L	71.3	Confident	77	Confident	70 Å²	70	62 Å²	62	37%	0.366	33%	0.329	S	S	.	.			trans	-92	103.6	-179.3	-70.7	175.5	0	0	0	111.1	D219 F224	D219-L222 HydrophobicContact CB-CB 4.49Å; D219-L222 HydrophobicContact CB-CD1 3.85Å; D219-L222 HydrophobicContact CB-CG 4.04Å; D219-L222 PolarHBondContact O-N 3.39Å; L222-F224 PolarHBondContact O-N 2.79Å
223	N	80.8	Confident	78.5	Confident	121 Å²	121	59.2 Å²	59.2	65%	0.647	32%	0.317	S	S	*	.			trans	-70.2	122	170.3	-62.6	-1.6	0	0	0	109.8	E256	N223-E256 WeakPolarHBondContact CA-OE1 3.42Å; N223-E256 VanDerWaalsContact CB-OE1 3.24Å; N223-E256 WeakPolarHBondContact CB-OE1 3.23Å
224	F	85.3	Confident	79.7	Confident	49 Å²	49	55.2 Å²	55.2	22%	0.215	30%	0.296	C	S	.	.			trans	-74.1	131.2	-179.6	-64.4	-75.8	0	0	0	111.4	M88 F201 L222 F226 E256	M88-F224 HydrophobicContact CE-CB 4.36Å; M88-F224 HydrophobicContact CE-CD1 3.64Å; M88-F224 HydrophobicContact CE-CE1 4.34Å; M88-F224 HydrophobicContact CE-CG 4.36Å; M88-F224 HydrophobicContact SD-CB 4.33Å; M88-F224 HydrophobicContact SD-CD1 3.75Å; F201-F224 HydrophobicContact CB-CD1 3.71Å; F201-F224 HydrophobicContact CB-CE1 3.46Å; F201-F224 VanDerWaalsContact CB-CE1 3.46Å; F201-F224 HydrophobicContact CB-CZ 4.05Å; F201-F224 HydrophobicContact CG-CE1 4.35Å; L222-F224 PolarHBondContact O-N 2.79Å; F224-F226 HydrophobicContact CB-CE2 4.38Å; F224-E256 HydrophobicContact CB-CB 4.26Å; F224-E256 WeakPolarHBondContact O-CA 2.91Å; F224-E256 WeakPolarHBondContact O-CG 3.44Å
225	N	90.4	Very high	81	Confident	60 Å²	60	52 Å²	52	32%	0.321	28%	0.284	S	S	.	.			trans	-135.7	104	-179.5	-172	-16.8	0	0	0	110.8	M88 S227 S253	M88-N225 WeakPolarHBondContact CG-O 3.37Å; N225-S227 PolarHBondContact O-N 3.27Å; N225-S227 WeakPolarHBondContact OD1-CB 3.2Å; N225-S227 PolarHBondContact OD1-N 3.39Å; N225-S227 PolarHBondContact OD1-OG 3.45Å; N225-S253 WeakPolarHBondContact OD1-CB 3.46Å
226	F	93.2	Very high	82.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.266	C	S	.	.			trans	-87.7	23.1	178.9	-64.7	-68.2	0	0	0	113.5	F201 F224 H228 F260 P303 I305	F201-F226 HydrophobicContact CB-CZ 4.33Å; F201-F226 HydrophobicContact CD1-CZ 4.27Å; F224-F226 HydrophobicContact CB-CE2 4.38Å; F226-H228 PolarHBondContact O-N 3.42Å; F226-H228 PolarHBondContact O-ND1 3.03Å; F226-F260 HydrophobicContact CB-CD2 4.25Å; F226-F260 HydrophobicContact CB-CE2 4.15Å; F226-P303 HydrophobicContact CE2-CB 4.02Å; F226-P303 HydrophobicContact CE2-CG 4.46Å; F226-I305 HydrophobicContact CB-CG1 4.29Å
227	S	95.4	Very high	83.3	Confident	6 Å²	6	48 Å²	48	4%	0.042	27%	0.267	C	S	.	.			trans	-58.7	133.3	168.5	-59.6	0	0	0	0	108.9	V86 A87 N225 R251 T252 S253	V86-S227 CarbonylContact C-O 3.54Å; A87-S227 WeakPolarHBondContact CB-O 3.33Å; A87-S227 PolarHBondContact N-O 3.26Å; N225-S227 PolarHBondContact O-N 3.27Å; N225-S227 WeakPolarHBondContact OD1-CB 3.2Å; N225-S227 PolarHBondContact OD1-N 3.39Å; N225-S227 PolarHBondContact OD1-OG 3.45Å; S227-R251 CarbonylContact C-O 3.57Å; S227-R251 VanDerWaalsContact CA-O 3.27Å; S227-R251 WeakPolarHBondContact CA-O 3.39Å; S227-T252 WeakPolarHBondContact OG-CA 3.35Å; S227-S253 PolarHBondContact OG-N 2.8Å
228	H	95.9	Very high	84.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	157.4	-173.2	62.5	-80.8	0	0	0	112	L84 T85 V86 F226 E250 R251 F260 Y262 I305	L84-H228 HydrophobicContact CD1-CB 3.87Å; T85-H228 CarbonylContact O-C 3.45Å; T85-H228 WeakPolarHBondContact O-CA 3.22Å; T85-H228 WeakPolarHBondContact O-CB 3.28Å; V86-H228 HydrophobicContact CG2-CB 4.19Å; F226-H228 PolarHBondContact O-N 3.42Å; F226-H228 PolarHBondContact O-ND1 3.03Å; H228-E250 WeakPolarHBondContact O-CA 3.37Å; H228-R251 PolarHBondContact N-O 2.8Å; H228-R251 PolarHBondContact O-N 2.77Å; H228-F260 AromaticContact CE1-CD1 3.86Å; H228-F260 AromaticContact CE1-CD2 3.81Å; H228-F260 AromaticContact CE1-CG 3.53Å; H228-Y262 PolarHBondContact CE1-OH 3.16Å; H228-Y262 AromaticContact NE2-CE2 3.35Å; H228-Y262 WeakPolarHBondContact NE2-CE2 3.34Å; H228-Y262 AromaticContact NE2-CZ 3.42Å; H228-Y262 PolarHBondContact NE2-OH 2.79Å; H228-I305 HydrophobicContact CB-CD1 3.57Å; H228-I305 VanDerWaalsContact CG-CD1 3.47Å; H228-I305 WeakPolarHBondContact ND1-CD1 3.5Å
229	R	94.5	Very high	86	Confident	14 Å²	14	42.3 Å²	42.3	5%	0.053	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.6	171.6	54.8	168.6	179.1	-88.5	10.9	109.2	L84 T85 R117 F118 W128 E231 V249 E250	L84-R229 WeakPolarHBondContact CA-O 3.44Å; L84-R229 WeakPolarHBondContact CD1-O 3.28Å; T85-R229 PolarHBondContact N-O 3.32Å; T85-R229 PolarHBondContact O-N 3.38Å; R117-R229 PolarHBondContact O-NH2 2.78Å; R117-R229 VanDerWaalsContact O-NH2 3.15Å; F118-R229 PolarHBondContact O-NH1 2.96Å; F118-R229 PolarHBondContact O-NH2 3.49Å; W128-R229 HydrophobicContact CH2-CB 3.74Å; W128-R229 HydrophobicContact CH2-CG 4.47Å; W128-R229 HydrophobicContact CZ2-CB 3.63Å; R229-E231 WeakPolarHBondContact CD-OE1 3.5Å; R229-E231 WeakPolarHBondContact CG-OE1 3.27Å; R229-E231 IonicContact CZ-OE1 3.88Å; R229-E231 IonicContact NE-OE1 3.65Å; R229-E231 PolarHBondContact NE-OE1 2.7Å; R229-E231 VanDerWaalsContact O-OE2 3.07Å; R229-V249 CarbonylContact C-O 3.55Å; R229-V249 VanDerWaalsContact CA-O 3.27Å; R229-V249 WeakPolarHBondContact CA-O 3.44Å; R229-E250 HydrophobicContact CB-CG 4.49Å
230	I	94.3	Very high	86.7	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	102.6	176.7	-60.3	162.8	0	0	0	106.7	L84 L233 L246 G248 V249 Y262	L84-I230 HydrophobicContact CD1-CG1 3.73Å; I230-L233 HydrophobicContact CG2-CB 4.26Å; I230-L246 WeakPolarHBondContact CB-O 3.46Å; I230-L246 HydrophobicContact CD1-CB 4.37Å; I230-L246 HydrophobicContact CD1-CD1 4.39Å; I230-L246 HydrophobicContact CD1-CD2 3.98Å; I230-L246 HydrophobicContact CD1-CG 4.48Å; I230-L246 HydrophobicContact CG2-CB 4.15Å; I230-L246 WeakPolarHBondContact CG2-O 3.38Å; I230-G248 PolarHBondContact O-N 3.45Å; I230-V249 PolarHBondContact N-O 3.42Å; I230-Y262 HydrophobicContact CD1-CE1 4.34Å; I230-Y262 HydrophobicContact CD1-CE2 4.11Å
231	E	90.8	Very high	87.5	Confident	27 Å²	27	41.8 Å²	41.8	13%	0.126	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-41.7	177.3	-67.5	82.2	174.3	0	0	111.1	D83 L84 T85 W128 R229	D83-E231 HydrophobicContact CB-CB 4.01Å; D83-E231 PolarHBondContact O-N 3.32Å; L84-E231 WeakPolarHBondContact CA-OE2 3.43Å; L84-E231 PolarHBondContact N-OE2 3.25Å; T85-E231 VanDerWaalsContact CB-OE1 3.27Å; T85-E231 WeakPolarHBondContact CB-OE1 3.39Å; T85-E231 PolarHBondContact N-OE2 3.44Å; T85-E231 PolarHBondContact OG1-OE1 2.9Å; W128-E231 HydrophobicContact CH2-CG 4.5Å; W128-E231 HydrophobicContact CZ3-CG 4.08Å; R229-E231 WeakPolarHBondContact CD-OE1 3.5Å; R229-E231 WeakPolarHBondContact CG-OE1 3.27Å; R229-E231 IonicContact CZ-OE1 3.88Å; R229-E231 IonicContact NE-OE1 3.65Å; R229-E231 PolarHBondContact NE-OE1 2.7Å; R229-E231 VanDerWaalsContact O-OE2 3.07Å
232	K	91.6	Very high	88.2	Confident	48 Å²	48	39.5 Å²	39.5	21%	0.209	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	129.7	-179.4	-171.2	179.8	177.2	-174.2	0	111.7	I82 D83 D247	I82-K232 CarbonylContact C-O 3.53Å; I82-K232 WeakPolarHBondContact CA-O 3.4Å; D83-K232 HydrophobicContact CB-CB 3.91Å; D83-K232 PolarHBondContact N-O 2.73Å; D83-K232 PolarHBondContact O-N 3.39Å; K232-D247 WeakPolarHBondContact CA-OD1 3.37Å
233	L	93.4	Very high	88.8	Confident	4 Å²	4	40 Å²	40	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	118.8	161.2	-174.8	72.9	0	0	0	109.2	I80 N81 I82 I230 F235 N244 L246 D247 V264 Y284 I307	I80-L233 HydrophobicContact CG2-CD1 4.26Å; N81-L233 WeakPolarHBondContact O-CA 3.35Å; I82-L233 HydrophobicContact CB-CD1 4.33Å; I82-L233 HydrophobicContact CD1-CD1 4.36Å; I82-L233 HydrophobicContact CG1-CD1 4.23Å; I230-L233 HydrophobicContact CG2-CB 4.26Å; L233-F235 HydrophobicContact CD2-CE2 4.09Å; L233-F235 HydrophobicContact CG-CE2 4.14Å; L233-N244 PolarHBondContact O-ND2 2.87Å; L233-L246 HydrophobicContact CB-CB 4.41Å; L233-L246 HydrophobicContact CD2-CD1 3.58Å; L233-D247 PolarHBondContact N-OD1 2.87Å; L233-V264 HydrophobicContact CD2-CG2 4.38Å; L233-Y284 HydrophobicContact CD2-CE2 4.32Å; L233-Y284 WeakPolarHBondContact O-CE1 3.37Å; L233-Y284 PolarHBondContact O-OH 3.35Å; L233-I307 HydrophobicContact CD2-CG2 4.15Å
234	A	92.7	Very high	89.2	Confident	3 Å²	3	35.3 Å²	35.3	3%	0.025	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	140.5	179.4	0	0	0	0	0	112	N81	N81-A234 HydrophobicContact CB-CB 4.31Å; N81-A234 PolarHBondContact N-O 3.22Å; N81-A234 PolarHBondContact O-N 2.9Å
235	F	93.3	Very high	89.4	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	92.5	175.4	-64.6	-97.3	0	0	0	108	V78 P79 I80 L233 V264 V266 S281 S282 Y284 Y309	V78-F235 HydrophobicContact CG1-CB 4.01Å; V78-F235 HydrophobicContact CG1-CD1 4.39Å; P79-F235 CarbonylContact O-C 3.33Å; I80-F235 HydrophobicContact CD1-CD1 3.93Å; I80-F235 HydrophobicContact CD1-CE1 3.47Å; I80-F235 VanDerWaalsContact CD1-CE1 3.47Å; I80-F235 HydrophobicContact CD1-CZ 4.39Å; I80-F235 HydrophobicContact CG1-CD1 3.7Å; I80-F235 HydrophobicContact CG1-CE1 3.77Å; L233-F235 HydrophobicContact CD2-CE2 4.09Å; L233-F235 HydrophobicContact CG-CE2 4.14Å; F235-V264 HydrophobicContact CE2-CG1 3.71Å; F235-V264 HydrophobicContact CZ-CG1 3.91Å; F235-V266 HydrophobicContact CB-CG1 3.98Å; F235-V266 HydrophobicContact CD1-CG1 3.97Å; F235-V266 HydrophobicContact CD1-CG2 3.78Å; F235-V266 HydrophobicContact CD2-CG1 4.37Å; F235-V266 HydrophobicContact CD2-CG2 3.96Å; F235-V266 HydrophobicContact CE1-CG2 3.56Å; F235-V266 HydrophobicContact CE2-CG2 3.78Å; F235-V266 HydrophobicContact CG-CG1 3.85Å; F235-V266 HydrophobicContact CG-CG2 3.98Å; F235-V266 HydrophobicContact CZ-CG2 3.57Å; F235-S281 PolarHBondContact O-OG 3.37Å; F235-S282 PolarHBondContact O-N 2.94Å; F235-Y284 AromaticContact CD2-CD1 3.72Å; F235-Y284 HydrophobicContact CD2-CD1 3.72Å; F235-Y284 HydrophobicContact CD2-CE1 4.28Å; F235-Y284 HydrophobicContact CD2-CG 4.13Å; F235-Y284 HydrophobicContact CE2-CD1 4.08Å; F235-Y284 HydrophobicContact CE2-CG 4.14Å; F235-Y309 HydrophobicContact CE1-CD2 4.21Å; F235-Y309 HydrophobicContact CE1-CG 4.08Å; F235-Y309 HydrophobicContact CZ-CG 4.33Å
236	G	91.6	Very high	89.5	Confident	2 Å²	2	30.7 Å²	30.7	2%	0.021	19%	0.187	C	C	.	.	S	Bend	trans	93	-169.4	-175.1	0	0	0	0	0	113.9	P79 N81	P79-G236 PolarHBondContact O-N 3.36Å; N81-G236 PolarHBondContact ND2-O 3.02Å
237	P	90	Very high	89.3	Confident	54 Å²	54	31.5 Å²	31.5	35%	0.351	19%	0.192	S	C	.	.	S	Bend	trans	-69	151.3	176.6	28.6	-33.3	0	0	0	111.2	L239 L279 R280 S281	P237-L239 PolarHBondContact O-N 2.85Å; P237-L279 HydrophobicContact CB-CD1 4.04Å; P237-L279 HydrophobicContact CG-CD1 3.44Å; P237-L279 VanDerWaalsContact CG-CD1 3.44Å; P237-L279 HydrophobicContact CG-CG 4.1Å; P237-R280 VanDerWaalsContact CD-O 3.29Å; P237-R280 WeakPolarHBondContact CD-O 3.44Å; P237-R280 WeakPolarHBondContact CG-O 3.49Å; P237-S281 VanDerWaalsContact O-CB 3.32Å; P237-S281 WeakPolarHBondContact O-CB 3.4Å; P237-S281 PolarHBondContact O-OG 2.97Å
238	R	86.9	Confident	88.9	Confident	138 Å²	138	31.3 Å²	31.3	52%	0.521	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-65	133.8	179.4	-72.2	-176.2	178.4	136.3	-6.6	111.3
239	L	85.1	Confident	88.7	Confident	16 Å²	16	32.3 Å²	32.3	8%	0.084	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-85.6	141.4	171.1	-69.7	165.6	0	0	0	110	P237 G241 A242 T269 M271 L279 Q283	P237-L239 PolarHBondContact O-N 2.85Å; L239-G241 PolarHBondContact O-N 2.82Å; L239-A242 HydrophobicContact CB-CB 3.75Å; L239-A242 PolarHBondContact O-N 3.27Å; L239-T269 HydrophobicContact CD1-CG2 3.7Å; L239-M271 HydrophobicContact CD2-CB 3.93Å; L239-M271 HydrophobicContact CD2-SD 3.94Å; L239-L279 HydrophobicContact CD2-CD2 4.06Å; L239-Q283 HydrophobicContact CD1-CG 3.65Å
240	P	80.3	Confident	88.6	Confident	87 Å²	87	34 Å²	34	57%	0.565	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	130.6	176.1	26.6	-31.5	0	0	0	110.6	A242 M271	P240-A242 PolarHBondContact O-N 3.32Å; P240-M271 VanDerWaalsContact CD-SD 3.53Å; P240-M271 HydrophobicContact CG-CE 3.47Å; P240-M271 VanDerWaalsContact CG-CE 3.47Å; P240-M271 HydrophobicContact CG-SD 3.7Å
241	G	75.8	Confident	88.6	Confident	85 Å²	85	38.7 Å²	38.7	88%	0.876	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.6	-9.9	-178.5	0	0	0	0	0	115.2	L239	L239-G241 PolarHBondContact O-N 2.82Å
242	A	79.9	Confident	88.7	Confident	39 Å²	39	41.7 Å²	41.7	32%	0.322	24%	0.243	S	C	.	.			trans	-81.3	130.9	175	0	0	0	0	0	110.7	L239 P240	L239-A242 HydrophobicContact CB-CB 3.75Å; L239-A242 PolarHBondContact O-N 3.27Å; P240-A242 PolarHBondContact O-N 3.32Å
243	V	83.3	Confident	88.7	Confident	81 Å²	81	40.1 Å²	40.1	49%	0.491	24%	0.238	S	C	.	.			trans	-109	129.7	174.3	-178.2	0	0	0	0	108.9
244	N	89.4	Confident	88.4	Confident	22 Å²	22	47.8 Å²	47.8	12%	0.118	28%	0.275	C	S	.	.			trans	-81.7	121.3	178.8	-77.6	-18.5	0	0	0	110.3	N135 L233 L246 D247 Y284	N135-N244 PolarHBondContact OD1-O 3.18Å; L233-N244 PolarHBondContact O-ND2 2.87Å; N244-L246 VanDerWaalsContact C-N 3.27Å; N244-L246 PolarHBondContact O-N 3Å; N244-D247 HydrophobicContact CB-CB 4.18Å; N244-D247 VanDerWaalsContact CB-CG 3.4Å; N244-D247 WeakPolarHBondContact CB-OD1 3.5Å; N244-D247 WeakPolarHBondContact CB-OD2 3.41Å; N244-D247 PolarHBondContact ND2-OD2 2.69Å; N244-D247 PolarHBondContact O-N 2.79Å; N244-Y284 HydrophobicContact CB-CE1 3.96Å; N244-Y284 WeakPolarHBondContact CB-OH 3.44Å; N244-Y284 WeakPolarHBondContact OD1-CE1 3.08Å
245	P	90.3	Very high	88.3	Confident	12 Å²	12	51.7 Å²	51.7	8%	0.078	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.6	-170.9	28.6	-39.3	0	0	0	114.7	N135 Y284 V286	N135-P245 PolarHBondContact ND2-O 2.94Å; N135-P245 WeakPolarHBondContact OD1-CA 3.39Å; P245-Y284 VanDerWaalsContact CD-CE2 3.49Å; P245-Y284 HydrophobicContact CG-CD2 3.64Å; P245-Y284 HydrophobicContact CG-CE2 3.32Å; P245-Y284 HydrophobicContact CG-CG 4.49Å; P245-Y284 WeakPolarHBondContact CG-O 3.19Å; P245-V286 HydrophobicContact CG-CB 4.48Å; P245-V286 HydrophobicContact CG-CG2 3.85Å
246	L	92.3	Very high	88	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-7.9	177.1	-74.5	175.1	0	0	0	114.7	I230 L233 N244 G248 V249 Y262 V264 Y284 V286	I230-L246 WeakPolarHBondContact CB-O 3.46Å; I230-L246 HydrophobicContact CD1-CB 4.37Å; I230-L246 HydrophobicContact CD1-CD1 4.39Å; I230-L246 HydrophobicContact CD1-CD2 3.98Å; I230-L246 HydrophobicContact CD1-CG 4.48Å; I230-L246 HydrophobicContact CG2-CB 4.15Å; I230-L246 WeakPolarHBondContact CG2-O 3.38Å; L233-L246 HydrophobicContact CB-CB 4.41Å; L233-L246 HydrophobicContact CD2-CD1 3.58Å; N244-L246 VanDerWaalsContact C-N 3.27Å; N244-L246 PolarHBondContact O-N 3Å; L246-G248 PolarHBondContact O-N 2.83Å; L246-V249 HydrophobicContact CD2-CB 4.44Å; L246-V249 HydrophobicContact CD2-CG2 4.06Å; L246-V249 WeakPolarHBondContact O-CB 3.5Å; L246-V249 PolarHBondContact O-N 2.95Å; L246-Y262 HydrophobicContact CD1-CD1 4.4Å; L246-Y262 HydrophobicContact CD2-CD1 3.69Å; L246-Y262 HydrophobicContact CD2-CE1 3.84Å; L246-V264 HydrophobicContact CD1-CG2 4.22Å; L246-Y284 HydrophobicContact CB-CE2 4.31Å; L246-Y284 HydrophobicContact CD1-CE2 4.2Å; L246-Y284 HydrophobicContact CG-CE2 4.19Å; L246-Y284 PolarHBondContact N-OH 2.61Å; L246-V286 HydrophobicContact CD1-CG1 4.08Å; L246-V286 HydrophobicContact CD1-CG2 3.79Å; L246-V286 HydrophobicContact CD2-CG1 4Å; L246-V286 HydrophobicContact CG-CB 4.31Å; L246-V286 HydrophobicContact CG-CG1 4.12Å; L246-V286 HydrophobicContact CG-CG2 3.8Å
247	D	88.5	Confident	87.9	Confident	18 Å²	18	59.3 Å²	59.3	10%	0.096	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	124.2	179.8	-70.9	8.7	0	0	0	109.5	N135 K232 L233 N244	N135-D247 PolarHBondContact ND2-O 3.03Å; K232-D247 WeakPolarHBondContact CA-OD1 3.37Å; L233-D247 PolarHBondContact N-OD1 2.87Å; N244-D247 HydrophobicContact CB-CB 4.18Å; N244-D247 VanDerWaalsContact CB-CG 3.4Å; N244-D247 WeakPolarHBondContact CB-OD1 3.5Å; N244-D247 WeakPolarHBondContact CB-OD2 3.41Å; N244-D247 PolarHBondContact ND2-OD2 2.69Å; N244-D247 PolarHBondContact O-N 2.79Å
248	G	87.2	Confident	88	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.01	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	11.5	-178.7	0	0	0	0	0	115	W128 I230 L246	W128-G248 VanDerWaalsContact CH2-CA 3.5Å; W128-G248 VanDerWaalsContact CZ2-C 3.49Å; W128-G248 WeakPolarHBondContact CZ2-O 3.41Å; I230-G248 PolarHBondContact O-N 3.45Å; L246-G248 PolarHBondContact O-N 2.83Å
249	V	90.8	Very high	88.3	Confident	22 Å²	22	51 Å²	51	13%	0.133	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	132.3	175.1	170.9	0	0	0	0	110	R229 I230 L246 R251	R229-V249 CarbonylContact C-O 3.55Å; R229-V249 VanDerWaalsContact CA-O 3.27Å; R229-V249 WeakPolarHBondContact CA-O 3.44Å; I230-V249 PolarHBondContact N-O 3.42Å; L246-V249 HydrophobicContact CD2-CB 4.44Å; L246-V249 HydrophobicContact CD2-CG2 4.06Å; L246-V249 WeakPolarHBondContact O-CB 3.5Å; L246-V249 PolarHBondContact O-N 2.95Å; V249-R251 HydrophobicContact CG1-CG 4.24Å
250	E	92.7	Very high	88.9	Confident	49 Å²	49	50.5 Å²	50.5	23%	0.229	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132	175.2	-176.1	176.2	-170.5	0	0	109.5	W128 H228 R229	W128-E250 HydrophobicContact CZ2-CB 4.08Å; W128-E250 PolarHBondContact NE1-OE2 3.1Å; H228-E250 WeakPolarHBondContact O-CA 3.37Å; R229-E250 HydrophobicContact CB-CG 4.49Å
251	R	94.2	Very high	89.6	Confident	101 Å²	101	47.4 Å²	47.4	38%	0.381	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.1	178.2	-66.8	-60.4	-173.9	172.3	-1.8	110.2	S227 H228 V249 F260 Y262	S227-R251 CarbonylContact C-O 3.57Å; S227-R251 VanDerWaalsContact CA-O 3.27Å; S227-R251 WeakPolarHBondContact CA-O 3.39Å; H228-R251 PolarHBondContact N-O 2.8Å; H228-R251 PolarHBondContact O-N 2.77Å; V249-R251 HydrophobicContact CG1-CG 4.24Å; R251-F260 HydrophobicContact CB-CD1 4.21Å; R251-F260 HydrophobicContact CB-CE1 3.91Å; R251-F260 HydrophobicContact CG-CD1 4.44Å; R251-F260 HydrophobicContact CG-CE1 4.45Å; R251-Y262 VanDerWaalsContact CG-OH 3.28Å; R251-Y262 WeakPolarHBondContact CG-OH 3.38Å
252	T	93.2	Very high	90.6	Very high	90 Å²	90	43.5 Å²	43.5	55%	0.552	23%	0.231	S	C	*	.			trans	-106.9	135.2	176.2	52.3	0	0	0	0	110.2	S227	S227-T252 WeakPolarHBondContact OG-CA 3.35Å
253	S	91	Very high	91.5	Very high	14 Å²	14	45.7 Å²	45.7	10%	0.098	23%	0.231	C	C	.	.			trans	-88.4	131.8	174.3	-155.1	0	0	0	0	108.8	N225 S227 N255 D258	N225-S253 WeakPolarHBondContact OD1-CB 3.46Å; S227-S253 PolarHBondContact OG-N 2.8Å; S253-N255 PolarHBondContact OG-O 2.79Å; S253-D258 WeakPolarHBondContact OG-CB 3.24Å; S253-D258 PolarHBondContact OG-OD2 3.14Å
254	M	88.5	Confident	92.1	Very high	165 Å²	165	41.9 Å²	41.9	81%	0.813	21%	0.208	S	C	*	.	S	Bend	trans	-99.4	-33.4	175.5	-65.9	-62.7	-157.7	0	0	111.1	D258	M254-D258 PolarHBondContact N-OD2 2.94Å
255	N	89.9	Confident	92.4	Very high	85 Å²	85	44.5 Å²	44.5	46%	0.455	22%	0.222	S	C	.	.	S	Bend	trans	-114	156	176.9	-49.2	-59.3	0	0	0	110.7	S253 N257 D258 T292	S253-N255 PolarHBondContact OG-O 2.79Å; N255-N257 PolarHBondContact O-N 3.41Å; N255-D258 WeakPolarHBondContact CB-OD1 3.34Å; N255-D258 PolarHBondContact N-OD2 3.41Å; N255-D258 PolarHBondContact ND2-OD1 3.48Å; N255-D258 PolarHBondContact O-N 2.68Å; N255-T292 HydrophobicContact CB-CG2 4.07Å; N255-T292 PolarHBondContact ND2-OG1 3.27Å
256	E	86.4	Confident	92.6	Very high	85 Å²	85	43.9 Å²	43.9	40%	0.397	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.9	177.3	-56.6	-176.7	165.3	0	0	112.8	N223 F224	N223-E256 WeakPolarHBondContact CA-OE1 3.42Å; N223-E256 VanDerWaalsContact CB-OE1 3.24Å; N223-E256 WeakPolarHBondContact CB-OE1 3.23Å; F224-E256 HydrophobicContact CB-CB 4.26Å; F224-E256 WeakPolarHBondContact O-CA 2.91Å; F224-E256 WeakPolarHBondContact O-CG 3.44Å
257	N	89.4	Confident	92.7	Very high	81 Å²	81	45.8 Å²	45.8	43%	0.433	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	17.1	-177	-66.4	-28.2	0	0	0	113.3	N255 T292 I293	N255-N257 PolarHBondContact O-N 3.41Å; N257-T292 HydrophobicContact CB-CG2 4.26Å; N257-I293 HydrophobicContact CB-CB 4.3Å; N257-I293 WeakPolarHBondContact CB-O 3.22Å; N257-I293 WeakPolarHBondContact O-CB 3.18Å; N257-I293 WeakPolarHBondContact O-CG1 2.9Å; N257-I293 PolarHBondContact O-N 3.48Å
258	D	92.9	Very high	93	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.043	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.1	177.5	-68	-24	0	0	0	111	S253 M254 N255 F260 T292 G304	S253-D258 WeakPolarHBondContact OG-CB 3.24Å; S253-D258 PolarHBondContact OG-OD2 3.14Å; M254-D258 PolarHBondContact N-OD2 2.94Å; N255-D258 WeakPolarHBondContact CB-OD1 3.34Å; N255-D258 PolarHBondContact N-OD2 3.41Å; N255-D258 PolarHBondContact ND2-OD1 3.48Å; N255-D258 PolarHBondContact O-N 2.68Å; D258-F260 HydrophobicContact CB-CE2 3.99Å; D258-F260 HydrophobicContact CB-CZ 4.35Å; D258-T292 WeakPolarHBondContact OD1-CB 3.49Å; D258-T292 WeakPolarHBondContact OD1-CG2 3.45Å; D258-T292 PolarHBondContact OD1-OG1 2.61Å; D258-G304 PolarHBondContact O-N 3.23Å
259	L	94	Very high	93.4	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.1	173.7	172.7	58.2	0	0	0	109	Q261 T290 R291 I293 R302 G304	L259-Q261 HydrophobicContact CD1-CG 4.02Å; L259-Q261 HydrophobicContact CD2-CG 3.98Å; L259-Q261 HydrophobicContact CG-CG 3.7Å; L259-T290 WeakPolarHBondContact O-CA 3.45Å; L259-R291 HydrophobicContact CB-CG 4.29Å; L259-R291 HydrophobicContact CD2-CG 4.48Å; L259-R291 PolarHBondContact N-O 2.86Å; L259-R291 PolarHBondContact O-N 2.89Å; L259-I293 HydrophobicContact CB-CD1 4.04Å; L259-I293 HydrophobicContact CB-CG1 4.05Å; L259-I293 HydrophobicContact CD2-CD1 3.95Å; L259-R302 WeakPolarHBondContact CD1-O 3.17Å; L259-G304 WeakPolarHBondContact CA-O 3.33Å; L259-G304 WeakPolarHBondContact CD1-O 3.46Å
260	F	96.3	Very high	93.5	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.022	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.8	173.3	-62.3	-87.2	0	0	0	109.6	F226 H228 R251 D258 Y262 T290 G304 I305 S306	F226-F260 HydrophobicContact CB-CD2 4.25Å; F226-F260 HydrophobicContact CB-CE2 4.15Å; H228-F260 AromaticContact CE1-CD1 3.86Å; H228-F260 AromaticContact CE1-CD2 3.81Å; H228-F260 AromaticContact CE1-CG 3.53Å; R251-F260 HydrophobicContact CB-CD1 4.21Å; R251-F260 HydrophobicContact CB-CE1 3.91Å; R251-F260 HydrophobicContact CG-CD1 4.44Å; R251-F260 HydrophobicContact CG-CE1 4.45Å; D258-F260 HydrophobicContact CB-CE2 3.99Å; D258-F260 HydrophobicContact CB-CZ 4.35Å; F260-Y262 HydrophobicContact CB-CE2 4.18Å; F260-T290 HydrophobicContact CD1-CG2 3.8Å; F260-T290 WeakPolarHBondContact CD1-OG1 3.33Å; F260-T290 HydrophobicContact CE1-CG2 3.57Å; F260-T290 HydrophobicContact CZ-CG2 4.19Å; F260-G304 PolarHBondContact N-O 3.39Å; F260-I305 HydrophobicContact CD2-CG1 4.48Å; F260-I305 CarbonylContact O-C 3.53Å; F260-I305 WeakPolarHBondContact O-CA 3.41Å; F260-S306 PolarHBondContact O-N 2.87Å
261	Q	95.9	Very high	93.5	Very high	22 Å²	22	45.4 Å²	45.4	10%	0.103	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.3	179.3	-52.4	-172.2	-103.9	0	0	110.1	L259 Y263 Q288 L289 S306	L259-Q261 HydrophobicContact CD1-CG 4.02Å; L259-Q261 HydrophobicContact CD2-CG 3.98Å; L259-Q261 HydrophobicContact CG-CG 3.7Å; Q261-Y263 HydrophobicContact CB-CE2 3.92Å; Q261-Y263 PolarHBondContact NE2-OH 2.76Å; Q261-Q288 WeakPolarHBondContact O-CA 3.27Å; Q261-L289 HydrophobicContact CB-CB 4.4Å; Q261-L289 PolarHBondContact N-O 3.35Å; Q261-L289 PolarHBondContact O-N 3.44Å; Q261-S306 CarbonylContact C-O 3.54Å; Q261-S306 WeakPolarHBondContact CA-O 3.29Å
262	Y	97.1	Very high	93.5	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	106.7	176	-61.8	-79.2	0	0	0	108.2	H228 I230 L246 R251 F260 V286 Q288 I305 S306 I307 I308	H228-Y262 PolarHBondContact CE1-OH 3.16Å; H228-Y262 AromaticContact NE2-CE2 3.35Å; H228-Y262 WeakPolarHBondContact NE2-CE2 3.34Å; H228-Y262 AromaticContact NE2-CZ 3.42Å; H228-Y262 PolarHBondContact NE2-OH 2.79Å; I230-Y262 HydrophobicContact CD1-CE1 4.34Å; I230-Y262 HydrophobicContact CD1-CE2 4.11Å; L246-Y262 HydrophobicContact CD1-CD1 4.4Å; L246-Y262 HydrophobicContact CD2-CD1 3.69Å; L246-Y262 HydrophobicContact CD2-CE1 3.84Å; R251-Y262 VanDerWaalsContact CG-OH 3.28Å; R251-Y262 WeakPolarHBondContact CG-OH 3.38Å; F260-Y262 HydrophobicContact CB-CE2 4.18Å; Y262-V286 HydrophobicContact CD1-CG1 4.15Å; Y262-Q288 HydrophobicContact CD1-CB 4.38Å; Y262-Q288 HydrophobicContact CD1-CG 3.76Å; Y262-Q288 HydrophobicContact CE1-CB 4.41Å; Y262-Q288 HydrophobicContact CE1-CG 3.88Å; Y262-I305 HydrophobicContact CD2-CG2 4.34Å; Y262-I305 HydrophobicContact CE2-CG2 4.07Å; Y262-S306 PolarHBondContact N-O 3.18Å; Y262-I307 HydrophobicContact CD2-CG1 4.04Å; Y262-I308 PolarHBondContact O-N 2.88Å
263	Y	97.3	Very high	93.4	Very high	85 Å²	85	41.3 Å²	41.3	33%	0.333	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	112.4	174.3	-61.4	-85.6	0	0	0	108.4	Q261 V286 T287 L289 I308	Q261-Y263 HydrophobicContact CB-CE2 3.92Å; Q261-Y263 PolarHBondContact NE2-OH 2.76Å; Y263-V286 VanDerWaalsContact O-CA 3.3Å; Y263-V286 WeakPolarHBondContact O-CA 3.16Å; Y263-T287 PolarHBondContact N-O 3.37Å; Y263-T287 PolarHBondContact O-N 3.03Å; Y263-L289 HydrophobicContact CE2-CB 4.21Å; Y263-L289 HydrophobicContact CE2-CD2 4.45Å; Y263-I308 CarbonylContact C-O 3.57Å; Y263-I308 HydrophobicContact CD1-CB 4.3Å; Y263-I308 HydrophobicContact CD1-CD1 4.08Å; Y263-I308 HydrophobicContact CE1-CD1 3.63Å
264	V	96.4	Very high	93.3	Very high	1 Å²	1	43 Å²	43	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109.8	-171.1	-178.2	0	0	0	0	109.5	L233 F235 L246 V266 Y284 S285 V286 I307 I308 Y309 E310	L233-V264 HydrophobicContact CD2-CG2 4.38Å; F235-V264 HydrophobicContact CE2-CG1 3.71Å; F235-V264 HydrophobicContact CZ-CG1 3.91Å; L246-V264 HydrophobicContact CD1-CG2 4.22Å; V264-V266 HydrophobicContact CG1-CG2 3.87Å; V264-Y284 HydrophobicContact CG1-CD2 3.55Å; V264-Y284 HydrophobicContact CG1-CE2 4.36Å; V264-Y284 HydrophobicContact CG1-CG 3.88Å; V264-S285 WeakPolarHBondContact CA-O 3.48Å; V264-V286 HydrophobicContact CB-CG2 4.48Å; V264-V286 HydrophobicContact CG1-CG2 4.35Å; V264-V286 HydrophobicContact CG2-CG1 4.48Å; V264-V286 HydrophobicContact CG2-CG2 3.94Å; V264-I307 HydrophobicContact CG2-CG2 3.72Å; V264-I308 PolarHBondContact N-O 2.91Å; V264-Y309 CarbonylContact O-C 3.45Å; V264-Y309 VanDerWaalsContact O-CA 3.22Å; V264-Y309 WeakPolarHBondContact O-CA 2.97Å; V264-E310 PolarHBondContact O-N 2.79Å
265	N	95.9	Very high	93.2	Very high	76 Å²	76	40.1 Å²	40.1	41%	0.406	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	110.4	174.9	-65.9	-5.3	0	0	0	108.4	Y284 S285	N265-Y284 CarbonylContact O-C 3.53Å; N265-Y284 WeakPolarHBondContact O-CA 3.48Å; N265-Y284 WeakPolarHBondContact O-CB 3.42Å; N265-S285 PolarHBondContact N-O 2.9Å; N265-S285 PolarHBondContact O-N 3.27Å
266	V	95.4	Very high	93.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.9	-174.5	-176.6	0	0	0	0	109.3	F235 V264 S282 Q283 E310 L311 S312	F235-V266 HydrophobicContact CB-CG1 3.98Å; F235-V266 HydrophobicContact CD1-CG1 3.97Å; F235-V266 HydrophobicContact CD1-CG2 3.78Å; F235-V266 HydrophobicContact CD2-CG1 4.37Å; F235-V266 HydrophobicContact CD2-CG2 3.96Å; F235-V266 HydrophobicContact CE1-CG2 3.56Å; F235-V266 HydrophobicContact CE2-CG2 3.78Å; F235-V266 HydrophobicContact CG-CG1 3.85Å; F235-V266 HydrophobicContact CG-CG2 3.98Å; F235-V266 HydrophobicContact CZ-CG2 3.57Å; V264-V266 HydrophobicContact CG1-CG2 3.87Å; V266-S282 VanDerWaalsContact CG1-CB 3.47Å; V266-Q283 CarbonylContact C-O 3.55Å; V266-Q283 WeakPolarHBondContact CA-O 3.27Å; V266-E310 PolarHBondContact N-O 2.88Å; V266-L311 HydrophobicContact CB-CG 4.21Å; V266-L311 HydrophobicContact CG1-CG 4.38Å; V266-L311 CarbonylContact O-C 3.59Å; V266-L311 WeakPolarHBondContact O-CA 3.33Å; V266-S312 WeakPolarHBondContact O-CB 3.39Å; V266-S312 PolarHBondContact O-N 3.06Å
267	V	94.5	Very high	93.5	Very high	39 Å²	39	39.3 Å²	39.3	24%	0.236	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	111	-178.9	-177.1	0	0	0	0	109.1	T269 S282 Q283 I314 V316	V267-T269 PolarHBondContact O-N 2.83Å; V267-T269 PolarHBondContact O-OG1 3.46Å; V267-S282 VanDerWaalsContact O-CA 3.31Å; V267-S282 WeakPolarHBondContact O-CA 3.2Å; V267-Q283 PolarHBondContact N-O 3.14Å; V267-Q283 PolarHBondContact O-N 2.94Å; V267-I314 WeakPolarHBondContact CG1-O 3.5Å; V267-V316 HydrophobicContact CG1-CG2 3.64Å
268	P	95.1	Very high	93.6	Very high	6 Å²	6	39.1 Å²	39.1	4%	0.039	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	132.7	174.6	-24.7	34.3	0	0	0	111.2	S312 L315 V316	P268-S312 WeakPolarHBondContact CD-O 3.46Å; P268-L315 HydrophobicContact CB-CD1 4.37Å; P268-L315 HydrophobicContact CB-CG 4.5Å; P268-L315 WeakPolarHBondContact O-CA 3.36Å; P268-V316 PolarHBondContact O-N 2.86Å
269	T	93.8	Very high	93.5	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	119	-178.3	-57.1	0	0	0	0	110.2	L239 V267 S281 Q283 V316 I318	L239-T269 HydrophobicContact CD1-CG2 3.7Å; V267-T269 PolarHBondContact O-N 2.83Å; V267-T269 PolarHBondContact O-OG1 3.46Å; T269-S281 CarbonylContact C-O 3.54Å; T269-S281 PolarHBondContact N-O 2.89Å; T269-S281 CarbonylContact O-C 3.39Å; T269-S281 PolarHBondContact O-N 3.25Å; T269-Q283 PolarHBondContact OG1-NE2 2.78Å; T269-V316 CarbonylContact C-O 3.42Å; T269-V316 VanDerWaalsContact CA-O 3.24Å; T269-V316 WeakPolarHBondContact CA-O 3.4Å; T269-V316 HydrophobicContact CG2-CB 4.24Å; T269-V316 HydrophobicContact CG2-CG1 4.45Å; T269-I318 HydrophobicContact CG2-CD1 3.53Å; T269-I318 HydrophobicContact CG2-CG1 3.97Å
270	K	94	Very high	93.4	Very high	68 Å²	68	45.9 Å²	45.9	30%	0.296	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.3	171.4	-178.5	-174.5	170.4	-166.3	0	108.1	V278 L315 V316 D317 I318	K270-V278 HydrophobicContact CD-CG1 4.24Å; K270-V278 HydrophobicContact CG-CG1 3.74Å; K270-L315 HydrophobicContact CB-CD1 4.44Å; K270-L315 HydrophobicContact CB-CD2 4.14Å; K270-V316 PolarHBondContact N-O 3Å; K270-D317 CarbonylContact O-C 3.51Å; K270-D317 WeakPolarHBondContact O-CA 3.46Å; K270-I318 PolarHBondContact O-N 2.86Å
271	M	93.1	Very high	93.3	Very high	6 Å²	6	46.2 Å²	46.2	3%	0.03	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	113.9	177.8	-178.1	-167.8	169.5	0	0	109.8	L239 P240 K273 V278 L279 I318 Q320	L239-M271 HydrophobicContact CD2-CB 3.93Å; L239-M271 HydrophobicContact CD2-SD 3.94Å; P240-M271 VanDerWaalsContact CD-SD 3.53Å; P240-M271 HydrophobicContact CG-CE 3.47Å; P240-M271 VanDerWaalsContact CG-CE 3.47Å; P240-M271 HydrophobicContact CG-SD 3.7Å; M271-K273 HydrophobicContact CE-CG 4.05Å; M271-V278 CarbonylContact O-C 3.58Å; M271-V278 WeakPolarHBondContact O-CA 3.47Å; M271-L279 HydrophobicContact CB-CB 4.36Å; M271-L279 PolarHBondContact N-O 3.15Å; M271-L279 PolarHBondContact O-N 3.08Å; M271-L279 HydrophobicContact SD-CD2 4.49Å; M271-I318 CarbonylContact C-O 3.52Å; M271-I318 VanDerWaalsContact CA-O 3.31Å; M271-I318 WeakPolarHBondContact CA-O 3.15Å; M271-I318 HydrophobicContact CB-CB 4.39Å; M271-I318 HydrophobicContact CG-CB 4.29Å; M271-I318 HydrophobicContact CG-CG2 4.4Å; M271-Q320 HydrophobicContact CE-CG 3.7Å; M271-Q320 VanDerWaalsContact CE-NE2 3.26Å; M271-Q320 VanDerWaalsContact CE-OE1 3.25Å
272	T	94.2	Very high	93.1	Very high	36 Å²	36	45.7 Å²	45.7	22%	0.221	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	109	171.4	-60.2	0	0	0	0	108.8	V278 I318 Q320	T272-V278 HydrophobicContact CG2-CG2 4.46Å; T272-I318 PolarHBondContact N-O 2.95Å; T272-Q320 PolarHBondContact O-N 3.01Å
273	K	91	Very high	93	Very high	68 Å²	68	48.8 Å²	48.8	30%	0.296	26%	0.261	S	S	.	.			trans	-69.9	160	176.1	-67	-173.7	-162.1	165.3	0	110.8	M271 N275 G276 E277	M271-K273 HydrophobicContact CE-CG 4.05Å; K273-N275 WeakPolarHBondContact CB-OD1 3.43Å; K273-N275 PolarHBondContact O-N 3.2Å; K273-N275 VanDerWaalsContact O-N 3.12Å; K273-G276 PolarHBondContact O-N 3.31Å; K273-E277 HydrophobicContact CB-CB 4.39Å; K273-E277 HydrophobicContact CD-CB 4.2Å; K273-E277 PolarHBondContact N-O 3.41Å; K273-E277 IonicContact NZ-OE2 3.71Å; K273-E277 PolarHBondContact NZ-OE2 3.28Å
274	A	87.6	Confident	92.8	Very high	51 Å²	51	45.6 Å²	45.6	42%	0.421	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-16.4	179.3	0	0	0	0	0	114.3	L62 G276 Q320	L62-A274 HydrophobicContact CD2-CB 3.63Å; A274-G276 VanDerWaalsContact C-N 3.3Å; A274-Q320 HydrophobicContact CB-CB 4.43Å
275	N	88	Confident	92.7	Very high	103 Å²	103	48.6 Å²	48.6	55%	0.551	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-2.1	171.9	63.9	-4.6	0	0	0	113.2	K273 E277	K273-N275 WeakPolarHBondContact CB-OD1 3.43Å; K273-N275 PolarHBondContact O-N 3.2Å; K273-N275 VanDerWaalsContact O-N 3.12Å; N275-E277 WeakPolarHBondContact ND2-CG 3.14Å; N275-E277 PolarHBondContact ND2-OE1 2.64Å; N275-E277 PolarHBondContact ND2-OE2 3.29Å; N275-E277 VanDerWaalsContact ND2-OE2 3.14Å; N275-E277 WeakPolarHBondContact OD1-CB 3.34Å; N275-E277 PolarHBondContact OD1-N 3.16Å
276	G	89.6	Confident	92.7	Very high	52 Å²	52	46.7 Å²	46.7	54%	0.536	26%	0.26	S	S	.	.	S	Bend	trans	88.9	-6.8	-176.9	0	0	0	0	0	114.7	K273 A274 V278	K273-G276 PolarHBondContact O-N 3.31Å; A274-G276 VanDerWaalsContact C-N 3.3Å; G276-V278 PolarHBondContact O-N 2.83Å
277	E	91.3	Very high	92.7	Very high	102 Å²	102	51.1 Å²	51.1	48%	0.477	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-64.8	132.8	173.9	-69.4	174.1	178.2	0	0	110.5	K273 N275	K273-E277 HydrophobicContact CB-CB 4.39Å; K273-E277 HydrophobicContact CD-CB 4.2Å; K273-E277 PolarHBondContact N-O 3.41Å; K273-E277 IonicContact NZ-OE2 3.71Å; K273-E277 PolarHBondContact NZ-OE2 3.28Å; N275-E277 WeakPolarHBondContact ND2-CG 3.14Å; N275-E277 PolarHBondContact ND2-OE1 2.64Å; N275-E277 PolarHBondContact ND2-OE2 3.29Å; N275-E277 VanDerWaalsContact ND2-OE2 3.14Å; N275-E277 WeakPolarHBondContact OD1-CB 3.34Å; N275-E277 PolarHBondContact OD1-N 3.16Å
278	V	92.4	Very high	92.7	Very high	76 Å²	76	52.7 Å²	52.7	46%	0.461	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.3	175.3	-177.5	0	0	0	0	108.9	K270 M271 T272 G276 R280	K270-V278 HydrophobicContact CD-CG1 4.24Å; K270-V278 HydrophobicContact CG-CG1 3.74Å; M271-V278 CarbonylContact O-C 3.58Å; M271-V278 WeakPolarHBondContact O-CA 3.47Å; T272-V278 HydrophobicContact CG2-CG2 4.46Å; G276-V278 PolarHBondContact O-N 2.83Å; V278-R280 HydrophobicContact CG1-CG 4.47Å
279	L	91.5	Very high	92.7	Very high	42 Å²	42	56.3 Å²	56.3	22%	0.22	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.1	174.4	-177.3	66.2	0	0	0	109	P237 L239 M271	P237-L279 HydrophobicContact CB-CD1 4.04Å; P237-L279 HydrophobicContact CG-CD1 3.44Å; P237-L279 VanDerWaalsContact CG-CD1 3.44Å; P237-L279 HydrophobicContact CG-CG 4.1Å; L239-L279 HydrophobicContact CD2-CD2 4.06Å; M271-L279 HydrophobicContact CB-CB 4.36Å; M271-L279 PolarHBondContact N-O 3.15Å; M271-L279 PolarHBondContact O-N 3.08Å; M271-L279 HydrophobicContact SD-CD2 4.49Å
280	R	91.8	Very high	92.7	Very high	118 Å²	118	59.6 Å²	59.6	45%	0.445	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	173.2	-63.5	-173.7	176.2	-167.3	-14.5	109.3	D73 E76 P237 V278	D73-R280 IonicContact OD2-CZ 2.87Å; D73-R280 IonicContact OD2-NH1 2.83Å; D73-R280 PolarHBondContact OD2-NH1 3.2Å; D73-R280 IonicContact OD2-NH2 3.47Å; D73-R280 PolarHBondContact OD2-NH2 2.83Å; E76-R280 WeakPolarHBondContact OE1-CD 3.41Å; E76-R280 IonicContact OE1-CZ 3.99Å; E76-R280 IonicContact OE1-NE 3.84Å; E76-R280 IonicContact OE1-NH1 3.16Å; E76-R280 PolarHBondContact OE1-NH1 2.89Å; E76-R280 IonicContact OE2-NH1 3.75Å; E76-R280 PolarHBondContact OE2-NH1 3.15Å; P237-R280 VanDerWaalsContact CD-O 3.29Å; P237-R280 WeakPolarHBondContact CD-O 3.44Å; P237-R280 WeakPolarHBondContact CG-O 3.49Å; V278-R280 HydrophobicContact CG1-CG 4.47Å
281	S	92.9	Very high	92.7	Very high	12 Å²	12	60.1 Å²	60.1	8%	0.084	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	-175.5	179.3	-172.2	0	0	0	0	109.7	F235 P237 T269	F235-S281 PolarHBondContact O-OG 3.37Å; P237-S281 VanDerWaalsContact O-CB 3.32Å; P237-S281 WeakPolarHBondContact O-CB 3.4Å; P237-S281 PolarHBondContact O-OG 2.97Å; T269-S281 CarbonylContact C-O 3.54Å; T269-S281 PolarHBondContact N-O 2.89Å; T269-S281 CarbonylContact O-C 3.39Å; T269-S281 PolarHBondContact O-N 3.25Å
282	S	93.3	Very high	92.6	Very high	11 Å²	11	63 Å²	63	8%	0.077	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	134.9	173.4	-56.7	0	0	0	0	110.4	F235 V266 V267	F235-S282 PolarHBondContact O-N 2.94Å; V266-S282 VanDerWaalsContact CG1-CB 3.47Å; V267-S282 VanDerWaalsContact O-CA 3.31Å; V267-S282 WeakPolarHBondContact O-CA 3.2Å
283	Q	93.2	Very high	92.5	Very high	69 Å²	69	61.4 Å²	61.4	32%	0.322	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	163.2	169.4	-65.2	175.9	85.4	0	0	108.4	L239 V266 V267 T269	L239-Q283 HydrophobicContact CD1-CG 3.65Å; V266-Q283 CarbonylContact C-O 3.55Å; V266-Q283 WeakPolarHBondContact CA-O 3.27Å; V267-Q283 PolarHBondContact N-O 3.14Å; V267-Q283 PolarHBondContact O-N 2.94Å; T269-Q283 PolarHBondContact OG1-NE2 2.78Å
284	Y	94.6	Very high	92.3	Very high	19 Å²	19	59.7 Å²	59.7	8%	0.075	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	154.6	174.1	69.6	-86.5	0	0	0	112.5	L233 F235 N244 P245 L246 V264 N265 V286	L233-Y284 HydrophobicContact CD2-CE2 4.32Å; L233-Y284 WeakPolarHBondContact O-CE1 3.37Å; L233-Y284 PolarHBondContact O-OH 3.35Å; F235-Y284 AromaticContact CD2-CD1 3.72Å; F235-Y284 HydrophobicContact CD2-CD1 3.72Å; F235-Y284 HydrophobicContact CD2-CE1 4.28Å; F235-Y284 HydrophobicContact CD2-CG 4.13Å; F235-Y284 HydrophobicContact CE2-CD1 4.08Å; F235-Y284 HydrophobicContact CE2-CG 4.14Å; N244-Y284 HydrophobicContact CB-CE1 3.96Å; N244-Y284 WeakPolarHBondContact CB-OH 3.44Å; N244-Y284 WeakPolarHBondContact OD1-CE1 3.08Å; P245-Y284 VanDerWaalsContact CD-CE2 3.49Å; P245-Y284 HydrophobicContact CG-CD2 3.64Å; P245-Y284 HydrophobicContact CG-CE2 3.32Å; P245-Y284 HydrophobicContact CG-CG 4.49Å; P245-Y284 WeakPolarHBondContact CG-O 3.19Å; L246-Y284 HydrophobicContact CB-CE2 4.31Å; L246-Y284 HydrophobicContact CD1-CE2 4.2Å; L246-Y284 HydrophobicContact CG-CE2 4.19Å; L246-Y284 PolarHBondContact N-OH 2.61Å; V264-Y284 HydrophobicContact CG1-CD2 3.55Å; V264-Y284 HydrophobicContact CG1-CE2 4.36Å; V264-Y284 HydrophobicContact CG1-CG 3.88Å; N265-Y284 CarbonylContact O-C 3.53Å; N265-Y284 WeakPolarHBondContact O-CA 3.48Å; N265-Y284 WeakPolarHBondContact O-CB 3.42Å; Y284-V286 HydrophobicContact CD2-CG2 3.39Å; Y284-V286 HydrophobicContact CE2-CG2 3.41Å; Y284-V286 VanDerWaalsContact CE2-CG2 3.41Å
285	S	94.1	Very high	92.3	Very high	64 Å²	64	63.1 Å²	63.1	45%	0.448	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	153.9	171.1	63.1	0	0	0	0	109.4	V264 N265	V264-S285 WeakPolarHBondContact CA-O 3.48Å; N265-S285 PolarHBondContact N-O 2.9Å; N265-S285 PolarHBondContact O-N 3.27Å
286	V	95	Very high	92.2	Very high	35 Å²	35	63.2 Å²	63.2	21%	0.212	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.9	-173.5	-176.4	0	0	0	0	112.2	P245 L246 Y262 Y263 V264 Y284 Q288	P245-V286 HydrophobicContact CG-CB 4.48Å; P245-V286 HydrophobicContact CG-CG2 3.85Å; L246-V286 HydrophobicContact CD1-CG1 4.08Å; L246-V286 HydrophobicContact CD1-CG2 3.79Å; L246-V286 HydrophobicContact CD2-CG1 4Å; L246-V286 HydrophobicContact CG-CB 4.31Å; L246-V286 HydrophobicContact CG-CG1 4.12Å; L246-V286 HydrophobicContact CG-CG2 3.8Å; Y262-V286 HydrophobicContact CD1-CG1 4.15Å; Y263-V286 VanDerWaalsContact O-CA 3.3Å; Y263-V286 WeakPolarHBondContact O-CA 3.16Å; V264-V286 HydrophobicContact CB-CG2 4.48Å; V264-V286 HydrophobicContact CG1-CG2 4.35Å; V264-V286 HydrophobicContact CG2-CG1 4.48Å; V264-V286 HydrophobicContact CG2-CG2 3.94Å; Y284-V286 HydrophobicContact CD2-CG2 3.39Å; Y284-V286 HydrophobicContact CE2-CG2 3.41Å; Y284-V286 VanDerWaalsContact CE2-CG2 3.41Å; V286-Q288 HydrophobicContact CG1-CG 3.96Å
287	T	95.7	Very high	92.1	Very high	94 Å²	94	67.1 Å²	67.1	58%	0.577	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.6	166.5	-54.3	0	0	0	0	108.9	Y263	Y263-T287 PolarHBondContact N-O 3.37Å; Y263-T287 PolarHBondContact O-N 3.03Å
288	Q	94.8	Very high	91.8	Very high	72 Å²	72	64.8 Å²	64.8	34%	0.336	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.7	-172.8	-53.1	-174.2	-21	0	0	110	Q261 Y262 V286	Q261-Q288 WeakPolarHBondContact O-CA 3.27Å; Y262-Q288 HydrophobicContact CD1-CB 4.38Å; Y262-Q288 HydrophobicContact CD1-CG 3.76Å; Y262-Q288 HydrophobicContact CE1-CB 4.41Å; Y262-Q288 HydrophobicContact CE1-CG 3.88Å; V286-Q288 HydrophobicContact CG1-CG 3.96Å
289	L	95.2	Very high	91.6	Very high	81 Å²	81	62.6 Å²	62.6	42%	0.424	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	128.1	175.3	178.9	64.9	0	0	0	109.4	Q261 Y263	Q261-L289 HydrophobicContact CB-CB 4.4Å; Q261-L289 PolarHBondContact N-O 3.35Å; Q261-L289 PolarHBondContact O-N 3.44Å; Y263-L289 HydrophobicContact CE2-CB 4.21Å; Y263-L289 HydrophobicContact CE2-CD2 4.45Å
290	T	94.4	Very high	91.4	Very high	73 Å²	73	66.5 Å²	66.5	45%	0.448	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.3	172.5	-57	0	0	0	0	108.5	L259 F260	L259-T290 WeakPolarHBondContact O-CA 3.45Å; F260-T290 HydrophobicContact CD1-CG2 3.8Å; F260-T290 WeakPolarHBondContact CD1-OG1 3.33Å; F260-T290 HydrophobicContact CE1-CG2 3.57Å; F260-T290 HydrophobicContact CZ-CG2 4.19Å
291	R	93.1	Very high	91.1	Very high	79 Å²	79	62.5 Å²	62.5	30%	0.298	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.2	175.8	65.7	-177.2	-176.3	100.6	-1.4	110.7	L259 I293 S299 H300	L259-R291 HydrophobicContact CB-CG 4.29Å; L259-R291 HydrophobicContact CD2-CG 4.48Å; L259-R291 PolarHBondContact N-O 2.86Å; L259-R291 PolarHBondContact O-N 2.89Å; R291-I293 VanDerWaalsContact CZ-CD1 3.49Å; R291-S299 PolarHBondContact NH1-OG 2.63Å; R291-S299 VanDerWaalsContact NH1-OG 3.1Å; R291-H300 PolarHBondContact NH1-O 2.7Å; R291-H300 PolarHBondContact NH2-O 2.78Å
292	T	92	Very high	90.9	Very high	65 Å²	65	67.8 Å²	67.8	40%	0.399	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129.4	174.6	-51	0	0	0	0	110	N255 N257 D258	N255-T292 HydrophobicContact CB-CG2 4.07Å; N255-T292 PolarHBondContact ND2-OG1 3.27Å; N257-T292 HydrophobicContact CB-CG2 4.26Å; D258-T292 WeakPolarHBondContact OD1-CB 3.49Å; D258-T292 WeakPolarHBondContact OD1-CG2 3.45Å; D258-T292 PolarHBondContact OD1-OG1 2.61Å
293	I	90.3	Very high	90.8	Very high	4 Å²	4	67.8 Å²	67.8	2%	0.021	38%	0.382	C	S	.	.			trans	-78.2	122.7	178.1	-56.7	-54.6	0	0	0	109.6	N257 L259 R291 S299 G301 P303	N257-I293 HydrophobicContact CB-CB 4.3Å; N257-I293 WeakPolarHBondContact CB-O 3.22Å; N257-I293 WeakPolarHBondContact O-CB 3.18Å; N257-I293 WeakPolarHBondContact O-CG1 2.9Å; N257-I293 PolarHBondContact O-N 3.48Å; L259-I293 HydrophobicContact CB-CD1 4.04Å; L259-I293 HydrophobicContact CB-CG1 4.05Å; L259-I293 HydrophobicContact CD2-CD1 3.95Å; R291-I293 VanDerWaalsContact CZ-CD1 3.49Å; I293-S299 WeakPolarHBondContact CG2-O 3.37Å; I293-G301 WeakPolarHBondContact CG2-O 3.21Å; I293-P303 HydrophobicContact CG1-CB 4.4Å
294	S	88.5	Confident	90.8	Very high	32 Å²	32	64.6 Å²	64.6	22%	0.224	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-138.5	107.9	174.4	173.4	0	0	0	0	109.1	S296 N297 S299	S294-S296 VanDerWaalsContact C-N 3.26Å; S294-S296 PolarHBondContact O-N 3.29Å; S294-S296 PolarHBondContact OG-OG 2.86Å; S294-S296 VanDerWaalsContact OG-OG 3.04Å; S294-N297 PolarHBondContact O-N 2.8Å; S294-N297 PolarHBondContact OG-N 2.83Å; S294-S299 CarbonylContact C-O 3.44Å; S294-S299 PolarHBondContact N-O 2.95Å; S294-S299 CarbonylContact O-C 3.53Å; S294-S299 WeakPolarHBondContact O-CA 3.14Å; S294-S299 WeakPolarHBondContact O-CB 3.36Å; S294-S299 PolarHBondContact O-N 3.33Å
295	H	86.1	Confident	90.9	Very high	123 Å²	123	63.8 Å²	63.8	57%	0.569	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-30.3	-179.6	-72.8	77.6	0	0	0	111.9	N297 G298 H300	H295-N297 VanDerWaalsContact C-N 3.3Å; H295-N297 PolarHBondContact O-N 2.91Å; H295-G298 PolarHBondContact O-N 3.03Å; H295-H300 AromaticContact CD2-CE1 3.99Å; H295-H300 AromaticContact CD2-ND1 3.38Å; H295-H300 PolarHBondContact CD2-ND1 3.38Å; H295-H300 AromaticContact NE2-ND1 3.99Å
296	S	87.6	Confident	90.9	Very high	105 Å²	105	60.9 Å²	60.9	73%	0.734	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-29.6	176.2	60.2	0	0	0	0	112.7	S294 G298	S294-S296 VanDerWaalsContact C-N 3.26Å; S294-S296 PolarHBondContact O-N 3.29Å; S294-S296 PolarHBondContact OG-OG 2.86Å; S294-S296 VanDerWaalsContact OG-OG 3.04Å; S296-G298 VanDerWaalsContact C-N 3.33Å
297	N	87.5	Confident	90.9	Very high	134 Å²	134	59.4 Å²	59.4	72%	0.717	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	15.3	-177.5	-61.9	1.7	0	0	0	112.4	S294 H295 S299	S294-N297 PolarHBondContact O-N 2.8Å; S294-N297 PolarHBondContact OG-N 2.83Å; H295-N297 VanDerWaalsContact C-N 3.3Å; H295-N297 PolarHBondContact O-N 2.91Å; N297-S299 PolarHBondContact O-N 2.87Å
298	G	84.8	Confident	90.9	Very high	53 Å²	53	56.3 Å²	56.3	55%	0.546	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	4	-177.5	0	0	0	0	0	114.9	H295 S296 H300	H295-G298 PolarHBondContact O-N 3.03Å; S296-G298 VanDerWaalsContact C-N 3.33Å; G298-H300 PolarHBondContact O-N 2.96Å; G298-H300 VanDerWaalsContact O-N 3.14Å
299	S	87.8	Confident	90.9	Very high	30 Å²	30	53.1 Å²	53.1	21%	0.21	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-86.2	85.2	176	175	0	0	0	0	110.2	R291 I293 S294 N297	R291-S299 PolarHBondContact NH1-OG 2.63Å; R291-S299 VanDerWaalsContact NH1-OG 3.1Å; I293-S299 WeakPolarHBondContact CG2-O 3.37Å; S294-S299 CarbonylContact C-O 3.44Å; S294-S299 PolarHBondContact N-O 2.95Å; S294-S299 CarbonylContact O-C 3.53Å; S294-S299 WeakPolarHBondContact O-CA 3.14Å; S294-S299 WeakPolarHBondContact O-CB 3.36Å; S294-S299 PolarHBondContact O-N 3.33Å; N297-S299 PolarHBondContact O-N 2.87Å
300	H	87.1	Confident	90.8	Very high	124 Å²	124	54.7 Å²	54.7	57%	0.574	30%	0.304	S	S	*	.			trans	-76.9	148.9	170.2	-59.7	-71	0	0	0	111.5	R291 H295 G298	R291-H300 PolarHBondContact NH1-O 2.7Å; R291-H300 PolarHBondContact NH2-O 2.78Å; H295-H300 AromaticContact CD2-CE1 3.99Å; H295-H300 AromaticContact CD2-ND1 3.38Å; H295-H300 PolarHBondContact CD2-ND1 3.38Å; H295-H300 AromaticContact NE2-ND1 3.99Å; G298-H300 PolarHBondContact O-N 2.96Å; G298-H300 VanDerWaalsContact O-N 3.14Å
301	G	86.2	Confident	90.7	Very high	33 Å²	33	52.5 Å²	52.5	34%	0.34	29%	0.29	S	S	.	.			trans	156.8	174.8	179.8	0	0	0	0	0	111.1	I293	I293-G301 WeakPolarHBondContact CG2-O 3.21Å
302	R	87.7	Confident	90.7	Very high	123 Å²	123	50.4 Å²	50.4	46%	0.464	29%	0.287	S	S	.	.			trans	-107.1	122.5	174.3	-174.3	176.7	-65.1	163.2	-3.7	107.9	T200 L259	T200-R302 WeakPolarHBondContact OG1-CD 2.96Å; L259-R302 WeakPolarHBondContact CD1-O 3.17Å
303	P	91.1	Very high	90.7	Very high	12 Å²	12	51.8 Å²	51.8	8%	0.078	30%	0.297	C	S	.	.			trans	-66.1	152.6	174.3	31.5	-36.7	0	0	0	110	F201 F226 I293	F201-P303 HydrophobicContact CD1-CG 4.12Å; F201-P303 HydrophobicContact CE1-CG 3.7Å; F226-P303 HydrophobicContact CE2-CB 4.02Å; F226-P303 HydrophobicContact CE2-CG 4.46Å; I293-P303 HydrophobicContact CG1-CB 4.4Å
304	G	93.5	Very high	90.8	Very high	2 Å²	2	55.5 Å²	55.5	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	140.4	-160.3	-173.8	0	0	0	0	0	113.8	V199 D258 L259 F260	V199-G304 CarbonylContact O-C 3.41Å; V199-G304 VanDerWaalsContact O-CA 3.29Å; V199-G304 WeakPolarHBondContact O-CA 3.38Å; D258-G304 PolarHBondContact O-N 3.23Å; L259-G304 WeakPolarHBondContact CA-O 3.33Å; L259-G304 WeakPolarHBondContact CD1-O 3.46Å; F260-G304 PolarHBondContact N-O 3.39Å
305	I	95.8	Very high	91.1	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.5	-179.7	-54.7	158.9	0	0	0	107.4	V86 H198 V199 F226 H228 F260 Y262	V86-I305 HydrophobicContact CG1-CD1 4.13Å; V86-I305 HydrophobicContact CG2-CD1 3.73Å; H198-I305 CarbonylContact C-O 3.48Å; H198-I305 WeakPolarHBondContact CA-O 3.48Å; V199-I305 HydrophobicContact CB-CB 4.17Å; V199-I305 HydrophobicContact CB-CD1 4.45Å; V199-I305 HydrophobicContact CG2-CB 4.48Å; V199-I305 PolarHBondContact N-O 3.05Å; V199-I305 PolarHBondContact O-N 2.82Å; F226-I305 HydrophobicContact CB-CG1 4.29Å; H228-I305 HydrophobicContact CB-CD1 3.57Å; H228-I305 VanDerWaalsContact CG-CD1 3.47Å; H228-I305 WeakPolarHBondContact ND1-CD1 3.5Å; F260-I305 HydrophobicContact CD2-CG1 4.48Å; F260-I305 CarbonylContact O-C 3.53Å; F260-I305 WeakPolarHBondContact O-CA 3.41Å; Y262-I305 HydrophobicContact CD2-CG2 4.34Å; Y262-I305 HydrophobicContact CE2-CG2 4.07Å
306	S	94.9	Very high	91.6	Very high	2 Å²	2	50 Å²	50	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	120.3	-178.5	179.2	0	0	0	0	109.4	F197 H198 F260 Q261 Y262 I308	F197-S306 CarbonylContact O-C 3.48Å; F197-S306 WeakPolarHBondContact O-CA 3.29Å; H198-S306 PolarHBondContact CE1-OG 3Å; H198-S306 WeakPolarHBondContact ND1-CB 3.34Å; H198-S306 PolarHBondContact ND1-OG 2.91Å; H198-S306 VanDerWaalsContact ND1-OG 3.16Å; F260-S306 PolarHBondContact O-N 2.87Å; Q261-S306 CarbonylContact C-O 3.54Å; Q261-S306 WeakPolarHBondContact CA-O 3.29Å; Y262-S306 PolarHBondContact N-O 3.18Å; S306-I308 WeakPolarHBondContact OG-CG1 3.48Å
307	I	95.6	Very high	91.9	Very high	5 Å²	5	46 Å²	46	3%	0.026	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	107.6	170.8	-56.1	174.1	0	0	0	106.4	I82 S196 F197 L233 Y262 V264	I82-I307 HydrophobicContact CD1-CD1 4.19Å; S196-I307 CarbonylContact C-O 3.51Å; S196-I307 WeakPolarHBondContact CA-O 3.48Å; F197-I307 HydrophobicContact CB-CB 4.3Å; F197-I307 HydrophobicContact CD1-CB 4.46Å; F197-I307 HydrophobicContact CD1-CD1 4.07Å; F197-I307 HydrophobicContact CD1-CG1 4.39Å; F197-I307 PolarHBondContact N-O 3.04Å; F197-I307 PolarHBondContact O-N 3.43Å; L233-I307 HydrophobicContact CD2-CG2 4.15Å; Y262-I307 HydrophobicContact CD2-CG1 4.04Å; V264-I307 HydrophobicContact CG2-CG2 3.72Å
308	I	95	Very high	92.3	Very high	29 Å²	29	40.2 Å²	40.2	15%	0.149	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.8	-178.6	-57	166.5	0	0	0	105.8	H194 Y262 Y263 V264 S306	H194-I308 VanDerWaalsContact NE2-CG2 3.25Å; H194-I308 WeakPolarHBondContact NE2-CG2 3.07Å; Y262-I308 PolarHBondContact O-N 2.88Å; Y263-I308 CarbonylContact C-O 3.57Å; Y263-I308 HydrophobicContact CD1-CB 4.3Å; Y263-I308 HydrophobicContact CD1-CD1 4.08Å; Y263-I308 HydrophobicContact CE1-CD1 3.63Å; V264-I308 PolarHBondContact N-O 2.91Å; S306-I308 WeakPolarHBondContact OG-CG1 3.48Å
309	Y	94.6	Very high	92.7	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.3	-179	69	-89	0	0	0	111.4	I80 F97 V190 V193 H194 G195 F235 V264 L311	I80-Y309 HydrophobicContact CD1-CD1 4.43Å; I80-Y309 HydrophobicContact CD1-CE1 4.14Å; I80-Y309 HydrophobicContact CD1-CE2 4.45Å; F97-Y309 AromaticContact CE2-CE1 3.72Å; F97-Y309 HydrophobicContact CE2-CE1 3.72Å; F97-Y309 HydrophobicContact CZ-CE1 4.15Å; F97-Y309 WeakPolarHBondContact CZ-OH 3.43Å; V190-Y309 HydrophobicContact CG2-CE2 4.36Å; V193-Y309 WeakPolarHBondContact O-CE2 3.48Å; H194-Y309 WeakPolarHBondContact CA-O 3.4Å; G195-Y309 VanDerWaalsContact CA-CZ 3.41Å; G195-Y309 PolarHBondContact N-O 3.31Å; G195-Y309 VanDerWaalsContact O-CD1 3.24Å; G195-Y309 WeakPolarHBondContact O-CD1 3.16Å; G195-Y309 WeakPolarHBondContact O-CE1 3.32Å; G195-Y309 PolarHBondContact O-N 3.47Å; F235-Y309 HydrophobicContact CE1-CD2 4.21Å; F235-Y309 HydrophobicContact CE1-CG 4.08Å; F235-Y309 HydrophobicContact CZ-CG 4.33Å; V264-Y309 CarbonylContact O-C 3.45Å; V264-Y309 VanDerWaalsContact O-CA 3.22Å; V264-Y309 WeakPolarHBondContact O-CA 2.97Å; Y309-L311 HydrophobicContact CD2-CD1 3.95Å; Y309-L311 HydrophobicContact CE2-CD1 4.01Å
310	E	93.2	Very high	92.9	Very high	114 Å²	114	39.8 Å²	39.8	53%	0.533	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132.7	177.1	-173.2	176.6	174.5	0	0	108.7	V264 V266	V264-E310 PolarHBondContact O-N 2.79Å; V266-E310 PolarHBondContact N-O 2.88Å
311	L	91.4	Very high	93.1	Very high	28 Å²	28	40.1 Å²	40.1	15%	0.147	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	129	178.1	-72.7	88.8	0	0	0	110.6	V78 K192 V193 V266 Y309	V78-L311 HydrophobicContact CG2-CD2 4.03Å; K192-L311 HydrophobicContact CB-CD2 3.77Å; K192-L311 HydrophobicContact CG-CD2 3.58Å; V193-L311 WeakPolarHBondContact O-CD1 3.47Å; V266-L311 HydrophobicContact CB-CG 4.21Å; V266-L311 HydrophobicContact CG1-CG 4.38Å; V266-L311 CarbonylContact O-C 3.59Å; V266-L311 WeakPolarHBondContact O-CA 3.33Å; Y309-L311 HydrophobicContact CD2-CD1 3.95Å; Y309-L311 HydrophobicContact CE2-CD1 4.01Å
312	S	93	Very high	93.2	Very high	34 Å²	34	45.6 Å²	45.6	24%	0.238	22%	0.222	C	C	.	.			trans	-69.7	138.2	172.4	178.6	0	0	0	0	110.5	V266 P268 I314	V266-S312 WeakPolarHBondContact O-CB 3.39Å; V266-S312 PolarHBondContact O-N 3.06Å; P268-S312 WeakPolarHBondContact CD-O 3.46Å; S312-I314 PolarHBondContact O-N 3.44Å; S312-I314 PolarHBondContact OG-N 3.38Å
313	P	92.4	Very high	93.3	Very high	94 Å²	94	40.6 Å²	40.6	61%	0.61	20%	0.204	S	C	*	.	S	Bend	trans	-72.9	-7.6	174	31.4	-35.9	0	0	0	113.2	D71	D71-P313 PolarHBondContact N-O 3.24Å
314	I	94	Very high	93.3	Very high	83 Å²	83	43 Å²	43	43%	0.426	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122	-179.4	-58.9	171	0	0	0	109.3	F68 F69 V267 S312	F68-I314 HydrophobicContact CB-CG2 4.09Å; F68-I314 HydrophobicContact CD1-CG2 4.08Å; F69-I314 CarbonylContact O-C 3.54Å; F69-I314 WeakPolarHBondContact O-CA 3.26Å; V267-I314 WeakPolarHBondContact CG1-O 3.5Å; S312-I314 PolarHBondContact O-N 3.44Å; S312-I314 PolarHBondContact OG-N 3.38Å
315	L	94.7	Very high	93.3	Very high	26 Å²	26	48 Å²	48	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.3	172.8	-179.8	142.9	0	0	0	110.7	F68 F69 D71 P268 K270 D317	F68-L315 WeakPolarHBondContact CA-O 3.49Å; F69-L315 PolarHBondContact N-O 2.96Å; F69-L315 PolarHBondContact O-N 2.79Å; D71-L315 HydrophobicContact CB-CB 4.09Å; P268-L315 HydrophobicContact CB-CD1 4.37Å; P268-L315 HydrophobicContact CB-CG 4.5Å; P268-L315 WeakPolarHBondContact O-CA 3.36Å; K270-L315 HydrophobicContact CB-CD1 4.44Å; K270-L315 HydrophobicContact CB-CD2 4.14Å; L315-D317 HydrophobicContact CD2-CB 3.97Å
316	V	95.2	Very high	93.3	Very high	12 Å²	12	53.7 Å²	53.7	7%	0.073	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.3	171	-176.1	0	0	0	0	108.7	Y66 F68 V267 P268 T269 K270 I318	Y66-V316 HydrophobicContact CD1-CG1 4.2Å; F68-V316 HydrophobicContact CD1-CG2 3.9Å; F68-V316 HydrophobicContact CE1-CG1 4.38Å; F68-V316 HydrophobicContact CE1-CG2 3.74Å; V267-V316 HydrophobicContact CG1-CG2 3.64Å; P268-V316 PolarHBondContact O-N 2.86Å; T269-V316 CarbonylContact C-O 3.42Å; T269-V316 VanDerWaalsContact CA-O 3.24Å; T269-V316 WeakPolarHBondContact CA-O 3.4Å; T269-V316 HydrophobicContact CG2-CB 4.24Å; T269-V316 HydrophobicContact CG2-CG1 4.45Å; K270-V316 PolarHBondContact N-O 3Å; V316-I318 HydrophobicContact CG1-CD1 4.41Å; V316-I318 HydrophobicContact CG1-CG1 3.93Å
317	D	95	Very high	93.2	Very high	22 Å²	22	56.3 Å²	56.3	12%	0.118	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115.2	174.5	-169.3	29.5	0	0	0	109.4	R67 F69 K270 L315	R67-D317 HydrophobicContact CB-CB 4.42Å; R67-D317 PolarHBondContact N-O 3.16Å; R67-D317 PolarHBondContact O-N 3.36Å; F69-D317 HydrophobicContact CD2-CB 3.69Å; F69-D317 HydrophobicContact CE2-CB 3.67Å; K270-D317 CarbonylContact O-C 3.51Å; K270-D317 WeakPolarHBondContact O-CA 3.46Å; L315-D317 HydrophobicContact CD2-CB 3.97Å
318	I	94.5	Very high	93.2	Very high	13 Å²	13	57 Å²	57	7%	0.067	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	111.3	-179	-53.8	178.6	0	0	0	107.6	N64 D65 Y66 T269 K270 M271 T272 V316	N64-I318 HydrophobicContact CB-CG2 3.95Å; D65-I318 WeakPolarHBondContact O-CA 3.43Å; Y66-I318 HydrophobicContact CD1-CD1 4.14Å; Y66-I318 HydrophobicContact CD1-CG1 3.8Å; Y66-I318 HydrophobicContact CE1-CD1 3.71Å; Y66-I318 HydrophobicContact CE1-CG1 3.84Å; Y66-I318 HydrophobicContact CE1-CG2 4.33Å; T269-I318 HydrophobicContact CG2-CD1 3.53Å; T269-I318 HydrophobicContact CG2-CG1 3.97Å; K270-I318 PolarHBondContact O-N 2.86Å; M271-I318 CarbonylContact C-O 3.52Å; M271-I318 VanDerWaalsContact CA-O 3.31Å; M271-I318 WeakPolarHBondContact CA-O 3.15Å; M271-I318 HydrophobicContact CB-CB 4.39Å; M271-I318 HydrophobicContact CG-CB 4.29Å; M271-I318 HydrophobicContact CG-CG2 4.4Å; T272-I318 PolarHBondContact N-O 2.95Å; V316-I318 HydrophobicContact CG1-CD1 4.41Å; V316-I318 HydrophobicContact CG1-CG1 3.93Å
319	T	94.5	Very high	93.2	Very high	37 Å²	37	60.7 Å²	60.7	23%	0.227	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.3	176.1	58.5	0	0	0	0	109.9	D65	D65-T319 PolarHBondContact N-O 3.03Å; D65-T319 PolarHBondContact O-N 3.23Å
320	Q	92.4	Very high	93.3	Very high	36 Å²	36	66 Å²	66	17%	0.168	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	118.6	176.5	-59.7	-158.9	-58.3	0	0	109.9	I63 N64 M271 T272 A274	I63-Q320 WeakPolarHBondContact O-CA 3.12Å; N64-Q320 WeakPolarHBondContact OD1-CG 3.36Å; N64-Q320 PolarHBondContact OD1-NE2 3.39Å; M271-Q320 HydrophobicContact CE-CG 3.7Å; M271-Q320 VanDerWaalsContact CE-NE2 3.26Å; M271-Q320 VanDerWaalsContact CE-OE1 3.25Å; T272-Q320 PolarHBondContact O-N 3.01Å; A274-Q320 HydrophobicContact CB-CB 4.43Å
321	R	90.3	Very high	93.4	Very high	131 Å²	131	64.7 Å²	64.7	49%	0.494	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.7	176.8	71.8	-177.8	-162.1	-130.3	1.7	111.5	I63 D65	I63-R321 HydrophobicContact CB-CG 4.35Å; I63-R321 PolarHBondContact N-O 2.98Å; I63-R321 PolarHBondContact O-N 3.2Å; D65-R321 IonicContact OD2-NH1 3.89Å; D65-R321 PolarHBondContact OD2-NH1 3.03Å
322	K	88.8	Confident	93.6	Very high	148 Å²	148	65.3 Å²	65.3	64%	0.643	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-78.4	154	166.5	-67.3	-177.8	179.3	-179.9	0	109.6	L62	L62-K322 HydrophobicContact CD2-CG 3.68Å
323	Q	88.7	Confident	93.8	Very high	19 Å²	19	68 Å²	68	9%	0.089	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-64.3	152.3	168.5	-69.7	178.9	16.5	0	0	110.4	F58 Y59 I63	F58-Q323 VanDerWaalsContact CD1-NE2 3.27Å; Y59-Q323 HydrophobicContact CD2-CB 3.76Å; Y59-Q323 HydrophobicContact CE2-CB 4Å; Y59-Q323 VanDerWaalsContact CE2-O 3.32Å; Y59-Q323 WeakPolarHBondContact CE2-O 3.39Å; I63-Q323 HydrophobicContact CD1-CG 3.5Å; I63-Q323 VanDerWaalsContact CD1-CG 3.5Å; I63-Q323 HydrophobicContact CG1-CG 4.31Å
324	S	92.5	Very high	94	Very high	61 Å²	61	66.7 Å²	66.7	43%	0.427	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-74.6	141	177.6	64.6	0	0	0	0	110.5	I326 V327 L328	S324-I326 PolarHBondContact O-N 3.49Å; S324-V327 PolarHBondContact O-N 2.84Å; S324-V327 VanDerWaalsContact O-N 3.11Å; S324-V327 WeakPolarHBondContact OG-CB 3.35Å; S324-V327 WeakPolarHBondContact OG-CG2 3.33Å; S324-V327 PolarHBondContact OG-N 3.36Å; S324-L328 PolarHBondContact O-N 3.15Å
325	I	93.3	Very high	94	Very high	108 Å²	108	63.8 Å²	63.8	55%	0.554	34%	0.335	S	S	*	.	H	α-helix	trans	-59.2	-35.4	177	-64	163.4	0	0	0	110.5	Y59 V327 L328 L329	Y59-I325 WeakPolarHBondContact OH-CG1 3.49Å; I325-V327 VanDerWaalsContact C-N 3.34Å; I325-V327 PolarHBondContact O-N 3.35Å; I325-L328 WeakPolarHBondContact O-CB 3.43Å; I325-L328 PolarHBondContact O-N 2.62Å; I325-L329 HydrophobicContact CG2-CD1 4.19Å; I325-L329 HydrophobicContact CG2-CG 4.35Å; I325-L329 WeakPolarHBondContact O-CG 3.46Å; I325-L329 PolarHBondContact O-N 2.82Å
326	I	95.7	Very high	94	Very high	122 Å²	122	66.2 Å²	66.2	63%	0.626	35%	0.347	S	S	*	.	H	α-helix	trans	-61.5	-43.6	177.7	-61.3	171.8	0	0	0	110.8	S324 L328 L329 L330	S324-I326 PolarHBondContact O-N 3.49Å; I326-L328 VanDerWaalsContact C-N 3.33Å; I326-L328 PolarHBondContact O-N 3.49Å; I326-L329 PolarHBondContact O-N 3.06Å; I326-L330 HydrophobicContact CG2-CD1 4.12Å; I326-L330 WeakPolarHBondContact O-CG 3.46Å; I326-L330 PolarHBondContact O-N 3.25Å
327	V	93	Very high	94	Very high	57 Å²	57	67.7 Å²	67.7	35%	0.345	37%	0.365	S	S	.	.	H	α-helix	trans	-65.3	-39.3	177.6	169.2	0	0	0	0	110.9	S324 I325 L330 R331	S324-V327 PolarHBondContact O-N 2.84Å; S324-V327 VanDerWaalsContact O-N 3.11Å; S324-V327 WeakPolarHBondContact OG-CB 3.35Å; S324-V327 WeakPolarHBondContact OG-CG2 3.33Å; S324-V327 PolarHBondContact OG-N 3.36Å; I325-V327 VanDerWaalsContact C-N 3.34Å; I325-V327 PolarHBondContact O-N 3.35Å; V327-L330 PolarHBondContact O-N 2.94Å; V327-R331 VanDerWaalsContact O-CG 3.29Å; V327-R331 WeakPolarHBondContact O-CG 3.16Å; V327-R331 PolarHBondContact O-N 2.86Å
328	L	94.6	Very high	94	Very high	18 Å²	18	68.4 Å²	68.4	9%	0.094	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-50.1	173.4	174.2	65.3	0	0	0	111.5	Y59 S324 I325 I326 L330 R331 L332	Y59-L328 HydrophobicContact CD1-CD2 3.87Å; Y59-L328 HydrophobicContact CD2-CB 3.74Å; Y59-L328 HydrophobicContact CD2-CD1 4.33Å; Y59-L328 HydrophobicContact CD2-CD2 3.88Å; Y59-L328 HydrophobicContact CD2-CG 4.19Å; Y59-L328 HydrophobicContact CE1-CD2 4.08Å; Y59-L328 HydrophobicContact CE2-CB 3.99Å; Y59-L328 HydrophobicContact CE2-CD2 4.08Å; Y59-L328 HydrophobicContact CG-CB 4.38Å; Y59-L328 HydrophobicContact CG-CD1 4.19Å; Y59-L328 HydrophobicContact CG-CD2 3.78Å; Y59-L328 HydrophobicContact CG-CG 4.33Å; S324-L328 PolarHBondContact O-N 3.15Å; I325-L328 WeakPolarHBondContact O-CB 3.43Å; I325-L328 PolarHBondContact O-N 2.62Å; I326-L328 VanDerWaalsContact C-N 3.33Å; I326-L328 PolarHBondContact O-N 3.49Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 2.86Å; L328-R331 PolarHBondContact O-N 2.83Å; L328-R331 VanDerWaalsContact O-N 3.14Å; L328-L332 HydrophobicContact CD1-CD1 4.16Å; L328-L332 HydrophobicContact CD1-CD2 4.47Å; L328-L332 HydrophobicContact CD1-CG 4.1Å; L328-L332 HydrophobicContact CG-CD1 4.03Å; L328-L332 HydrophobicContact CG-CG 4.36Å; L328-L332 WeakPolarHBondContact O-CG 2.96Å; L328-L332 PolarHBondContact O-N 2.74Å
329	L	96.1	Very high	94.1	Very high	107 Å²	107	68.3 Å²	68.3	56%	0.56	38%	0.378	S	S	*	.	H	α-helix	trans	-60.5	-42.2	-179.4	-69.3	174.3	0	0	0	112.1	I325 I326 R331 L332 C333	I325-L329 HydrophobicContact CG2-CD1 4.19Å; I325-L329 HydrophobicContact CG2-CG 4.35Å; I325-L329 WeakPolarHBondContact O-CG 3.46Å; I325-L329 PolarHBondContact O-N 2.82Å; I326-L329 PolarHBondContact O-N 3.06Å; L329-R331 VanDerWaalsContact C-N 3.32Å; L329-R331 PolarHBondContact O-N 3.44Å; L329-L332 PolarHBondContact O-N 3.06Å; L329-C333 PolarHBondContact O-N 2.8Å
330	L	96.3	Very high	93.9	Very high	116 Å²	116	71.8 Å²	71.8	61%	0.607	39%	0.39	S	S	*	.	H	α-helix	trans	-61.2	-41.1	175.5	-71.5	172.1	0	0	0	111.8	I326 V327 L328 A334	I326-L330 HydrophobicContact CG2-CD1 4.12Å; I326-L330 WeakPolarHBondContact O-CG 3.46Å; I326-L330 PolarHBondContact O-N 3.25Å; V327-L330 PolarHBondContact O-N 2.94Å; L328-L330 VanDerWaalsContact C-N 3.32Å; L328-L330 PolarHBondContact O-N 2.86Å; L330-A334 WeakPolarHBondContact O-CB 3.15Å; L330-A334 PolarHBondContact O-N 2.81Å
331	R	95.4	Very high	93.9	Very high	87 Å²	87	72.9 Å²	72.9	33%	0.328	41%	0.405	S	S	.	.	H	α-helix	trans	-67.7	-40.8	176.6	-71.3	178.1	178.7	-151	0.1	112.9	E55 V327 L328 L329 A334 I335	E55-R331 IonicContact OE1-NH1 2.78Å; E55-R331 WeakPolarHBondContact OE2-CD 3.49Å; E55-R331 IonicContact OE2-CZ 3.59Å; E55-R331 IonicContact OE2-NE 3.65Å; E55-R331 IonicContact OE2-NH1 2.7Å; E55-R331 PolarHBondContact OE2-NH1 2.86Å; V327-R331 VanDerWaalsContact O-CG 3.29Å; V327-R331 WeakPolarHBondContact O-CG 3.16Å; V327-R331 PolarHBondContact O-N 2.86Å; L328-R331 PolarHBondContact O-N 2.83Å; L328-R331 VanDerWaalsContact O-N 3.14Å; L329-R331 VanDerWaalsContact C-N 3.32Å; L329-R331 PolarHBondContact O-N 3.44Å; R331-A334 WeakPolarHBondContact O-CB 3.44Å; R331-A334 PolarHBondContact O-N 3.01Å; R331-I335 WeakPolarHBondContact O-CG1 3.36Å; R331-I335 PolarHBondContact O-N 2.83Å
332	L	96.1	Very high	93.9	Very high	41 Å²	41	70.5 Å²	70.5	22%	0.215	41%	0.405	C	S	.	.	H	α-helix	trans	-62.4	-43.4	176.4	-68.1	175.5	0	0	0	111.5	V52 L328 L329 A334 I335 I336	V52-L332 HydrophobicContact CB-CD2 4.31Å; V52-L332 HydrophobicContact CG1-CD2 3.92Å; V52-L332 HydrophobicContact CG2-CD2 3.99Å; L328-L332 HydrophobicContact CD1-CD1 4.16Å; L328-L332 HydrophobicContact CD1-CD2 4.47Å; L328-L332 HydrophobicContact CD1-CG 4.1Å; L328-L332 HydrophobicContact CG-CD1 4.03Å; L328-L332 HydrophobicContact CG-CG 4.36Å; L328-L332 WeakPolarHBondContact O-CG 2.96Å; L328-L332 PolarHBondContact O-N 2.74Å; L329-L332 PolarHBondContact O-N 3.06Å; L332-A334 VanDerWaalsContact C-N 3.35Å; L332-I335 PolarHBondContact O-N 2.89Å; L332-I336 WeakPolarHBondContact O-CG1 3.36Å; L332-I336 PolarHBondContact O-N 3.3Å; L332-I336 VanDerWaalsContact O-N 3.15Å
333	C	96	Very high	94	Very high	90 Å²	90	64.4 Å²	64.4	61%	0.608	38%	0.381	S	S	*	.	H	α-helix	trans	-61.1	-43.5	174	-173.6	0	0	0	0	111.6	L329 I335 I336 G337	L329-C333 PolarHBondContact O-N 2.8Å; C333-I335 PolarHBondContact O-N 3.23Å; C333-I336 PolarHBondContact O-N 2.86Å; C333-G337 PolarHBondContact O-N 3.3Å
334	A	96	Very high	93.9	Very high	66 Å²	66	68.5 Å²	68.5	55%	0.545	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-39	177.8	0	0	0	0	0	112.8	L330 R331 L332 G338	L330-A334 WeakPolarHBondContact O-CB 3.15Å; L330-A334 PolarHBondContact O-N 2.81Å; R331-A334 WeakPolarHBondContact O-CB 3.44Å; R331-A334 PolarHBondContact O-N 3.01Å; L332-A334 VanDerWaalsContact C-N 3.35Å; A334-G338 WeakPolarHBondContact O-CA 3.37Å; A334-G338 PolarHBondContact O-N 2.83Å
335	I	95.7	Very high	93.7	Very high	22 Å²	22	69.9 Å²	69.9	11%	0.113	41%	0.409	C	S	.	.	H	α-helix	trans	-63.9	-50.5	176.1	-71.8	165.5	0	0	0	110.6	L51 V52 E55 R331 L332 C333 G338 V339	L51-I335 HydrophobicContact CB-CD1 4.07Å; L51-I335 HydrophobicContact CB-CG1 4.43Å; L51-I335 HydrophobicContact CB-CG2 3.8Å; L51-I335 HydrophobicContact CD1-CG2 3.99Å; V52-I335 HydrophobicContact CG2-CG2 4.42Å; E55-I335 HydrophobicContact CB-CD1 4.31Å; E55-I335 HydrophobicContact CG-CD1 3.4Å; E55-I335 VanDerWaalsContact CG-CD1 3.4Å; R331-I335 WeakPolarHBondContact O-CG1 3.36Å; R331-I335 PolarHBondContact O-N 2.83Å; L332-I335 PolarHBondContact O-N 2.89Å; C333-I335 PolarHBondContact O-N 3.23Å; I335-G338 PolarHBondContact O-N 3.27Å; I335-V339 HydrophobicContact CG2-CG2 4.45Å; I335-V339 VanDerWaalsContact O-CG2 3.28Å; I335-V339 WeakPolarHBondContact O-CG2 3.24Å; I335-V339 PolarHBondContact O-N 3.37Å
336	I	94.1	Very high	93.5	Very high	77 Å²	77	69.6 Å²	69.6	40%	0.395	41%	0.409	S	S	.	.	H	α-helix	trans	-60.9	-51.8	-178.2	-64.9	167.8	0	0	0	109.7	I48 L332 C333 G338 V339 F340	I48-I336 HydrophobicContact CG2-CG1 4.47Å; L332-I336 WeakPolarHBondContact O-CG1 3.36Å; L332-I336 PolarHBondContact O-N 3.3Å; L332-I336 VanDerWaalsContact O-N 3.15Å; C333-I336 PolarHBondContact O-N 2.86Å; I336-G338 PolarHBondContact O-N 3.26Å; I336-V339 PolarHBondContact O-N 3.31Å; I336-F340 HydrophobicContact CG2-CD2 3.72Å; I336-F340 HydrophobicContact CG2-CE2 3.71Å; I336-F340 WeakPolarHBondContact O-CD2 3.41Å; I336-F340 PolarHBondContact O-N 3.29Å; I336-F340 VanDerWaalsContact O-N 3.07Å
337	G	95	Very high	93	Very high	43 Å²	43	64.9 Å²	64.9	44%	0.443	39%	0.385	S	S	.	.	H	α-helix	trans	-61.8	-41.9	179	0	0	0	0	0	113.3	C333 F340 A341	C333-G337 PolarHBondContact O-N 3.3Å; G337-F340 PolarHBondContact O-N 3.32Å; G337-A341 WeakPolarHBondContact O-CB 3.2Å; G337-A341 PolarHBondContact O-N 2.82Å
338	G	95.7	Very high	92.6	Very high	37 Å²	37	65.9 Å²	65.9	38%	0.381	39%	0.392	S	S	.	.	H	α-helix	trans	-66.2	-41.3	179.9	0	0	0	0	0	113.4	A334 I335 I336 T342	A334-G338 WeakPolarHBondContact O-CA 3.37Å; A334-G338 PolarHBondContact O-N 2.83Å; I335-G338 PolarHBondContact O-N 3.27Å; I336-G338 PolarHBondContact O-N 3.26Å; G338-T342 WeakPolarHBondContact O-CG2 3.44Å; G338-T342 PolarHBondContact O-N 3.1Å; G338-T342 PolarHBondContact O-OG1 2.97Å
339	V	94.9	Very high	92.2	Very high	12 Å²	12	71.1 Å²	71.1	7%	0.073	41%	0.414	C	S	.	.	H	α-helix	trans	-70.3	-40.1	177.5	179	0	0	0	0	111.2	L47 I48 L51 I335 I336 T342 S343	L47-V339 HydrophobicContact CD2-CG1 4.48Å; L47-V339 HydrophobicContact CD2-CG2 3.57Å; I48-V339 HydrophobicContact CD1-CB 4.02Å; I48-V339 HydrophobicContact CD1-CG1 3.85Å; I48-V339 HydrophobicContact CG1-CB 3.72Å; I48-V339 HydrophobicContact CG1-CG1 3.69Å; I48-V339 HydrophobicContact CG1-CG2 3.86Å; L51-V339 HydrophobicContact CD1-CG2 4.37Å; I335-V339 HydrophobicContact CG2-CG2 4.45Å; I335-V339 VanDerWaalsContact O-CG2 3.28Å; I335-V339 WeakPolarHBondContact O-CG2 3.24Å; I335-V339 PolarHBondContact O-N 3.37Å; I336-V339 PolarHBondContact O-N 3.31Å; V339-T342 WeakPolarHBondContact CA-OG1 3.49Å; V339-T342 PolarHBondContact O-N 3.36Å; V339-T342 PolarHBondContact O-OG1 2.86Å; V339-T342 VanDerWaalsContact O-OG1 3.05Å; V339-S343 VanDerWaalsContact O-CB 3.3Å; V339-S343 WeakPolarHBondContact O-CB 3.46Å; V339-S343 PolarHBondContact O-N 2.99Å; V339-S343 PolarHBondContact O-OG 3.39Å
340	F	91.3	Very high	91.6	Very high	110 Å²	110	66.7 Å²	66.7	48%	0.482	39%	0.392	S	S	.	.	H	α-helix	trans	-62	-48.3	175.3	-85.1	-65.4	0	0	0	111.9	I336 G337 T342 S343 D344	I336-F340 HydrophobicContact CG2-CD2 3.72Å; I336-F340 HydrophobicContact CG2-CE2 3.71Å; I336-F340 WeakPolarHBondContact O-CD2 3.41Å; I336-F340 PolarHBondContact O-N 3.29Å; I336-F340 VanDerWaalsContact O-N 3.07Å; G337-F340 PolarHBondContact O-N 3.32Å; F340-T342 VanDerWaalsContact C-N 3.34Å; F340-T342 PolarHBondContact O-N 3.33Å; F340-S343 PolarHBondContact O-N 3.35Å; F340-S343 PolarHBondContact O-OG 2.87Å; F340-D344 PolarHBondContact O-N 2.98Å; F340-D344 VanDerWaalsContact O-N 3.11Å
341	A	92.1	Very high	90.9	Very high	59 Å²	59	63.2 Å²	63.2	49%	0.488	37%	0.374	S	S	.	.	H	α-helix	trans	-59.2	-42.2	177.9	0	0	0	0	0	112.8	G337 V345	G337-A341 WeakPolarHBondContact O-CB 3.2Å; G337-A341 PolarHBondContact O-N 2.82Å; A341-V345 WeakPolarHBondContact O-CG2 3.34Å; A341-V345 PolarHBondContact O-N 2.86Å
342	T	91.1	Very high	90.2	Very high	80 Å²	80	62.4 Å²	62.4	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-72.7	-34.2	178.9	50.5	0	0	0	0	112.6	G338 V339 F340 V345 L346	G338-T342 WeakPolarHBondContact O-CG2 3.44Å; G338-T342 PolarHBondContact O-N 3.1Å; G338-T342 PolarHBondContact O-OG1 2.97Å; V339-T342 WeakPolarHBondContact CA-OG1 3.49Å; V339-T342 PolarHBondContact O-N 3.36Å; V339-T342 PolarHBondContact O-OG1 2.86Å; V339-T342 VanDerWaalsContact O-OG1 3.05Å; F340-T342 VanDerWaalsContact C-N 3.34Å; F340-T342 PolarHBondContact O-N 3.33Å; T342-V345 PolarHBondContact O-N 2.93Å; T342-L346 WeakPolarHBondContact O-CB 3.02Å; T342-L346 VanDerWaalsContact O-CG 3.27Å; T342-L346 WeakPolarHBondContact O-CG 3Å; T342-L346 PolarHBondContact O-N 3.43Å
343	S	89.8	Confident	89.4	Confident	21 Å²	21	66.3 Å²	66.3	15%	0.147	41%	0.406	C	S	.	.	H	α-helix	trans	-64.6	-40.7	176.6	71.5	0	0	0	0	112.2	V339 F340 L346 V347	V339-S343 VanDerWaalsContact O-CB 3.3Å; V339-S343 WeakPolarHBondContact O-CB 3.46Å; V339-S343 PolarHBondContact O-N 2.99Å; V339-S343 PolarHBondContact O-OG 3.39Å; F340-S343 PolarHBondContact O-N 3.35Å; F340-S343 PolarHBondContact O-OG 2.87Å; S343-L346 PolarHBondContact O-N 3.31Å; S343-V347 WeakPolarHBondContact O-CG2 3.39Å; S343-V347 PolarHBondContact O-N 2.98Å
344	D	87	Confident	88.5	Confident	104 Å²	104	67.5 Å²	67.5	56%	0.556	41%	0.406	S	S	*	.	H	α-helix	trans	-63.3	-45	174.7	-171.7	52.2	0	0	0	112.1	F340 L346 V347 T348	F340-D344 PolarHBondContact O-N 2.98Å; F340-D344 VanDerWaalsContact O-N 3.11Å; D344-L346 VanDerWaalsContact C-N 3.31Å; D344-L346 PolarHBondContact O-N 3.04Å; D344-V347 PolarHBondContact O-N 2.04Å; D344-T348 WeakPolarHBondContact O-CG2 3.32Å; D344-T348 PolarHBondContact O-N 2.7Å; D344-T348 PolarHBondContact O-OG1 2.8Å
345	V	89.4	Confident	87	Confident	90 Å²	90	67.1 Å²	67.1	55%	0.545	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-38.9	174.2	174.2	0	0	0	0	111.7	A341 T342 T348 F349	A341-V345 WeakPolarHBondContact O-CG2 3.34Å; A341-V345 PolarHBondContact O-N 2.86Å; T342-V345 PolarHBondContact O-N 2.93Å; V345-T348 WeakPolarHBondContact CA-OG1 3.17Å; V345-T348 PolarHBondContact O-OG1 3.02Å; V345-F349 WeakPolarHBondContact O-CB 3.46Å; V345-F349 PolarHBondContact O-N 3.25Å
346	L	88.1	Confident	85.1	Confident	103 Å²	103	73.4 Å²	73.4	54%	0.539	43%	0.431	S	S	.	.	H	α-helix	trans	-67.7	-41.4	178	-76.8	171.1	0	0	0	112.4	T342 S343 D344 S350	T342-L346 WeakPolarHBondContact O-CB 3.02Å; T342-L346 VanDerWaalsContact O-CG 3.27Å; T342-L346 WeakPolarHBondContact O-CG 3Å; T342-L346 PolarHBondContact O-N 3.43Å; S343-L346 PolarHBondContact O-N 3.31Å; D344-L346 VanDerWaalsContact C-N 3.31Å; D344-L346 PolarHBondContact O-N 3.04Å; L346-S350 VanDerWaalsContact O-CB 3.3Å; L346-S350 WeakPolarHBondContact O-CB 3.5Å; L346-S350 PolarHBondContact O-N 2.99Å; L346-S350 PolarHBondContact O-OG 2.93Å
347	V	85.8	Confident	82.8	Confident	22 Å²	22	76 Å²	76	13%	0.133	45%	0.445	C	S	.	.	H	α-helix	trans	-64	-52.2	177	169.8	0	0	0	0	110	H37 V40 S343 D344 F349 S350 D351	H37-V347 WeakPolarHBondContact CE1-CG1 3.34Å; H37-V347 WeakPolarHBondContact ND1-CG1 3.36Å; V40-V347 HydrophobicContact CB-CG2 4.44Å; V40-V347 HydrophobicContact CG1-CG2 4.06Å; S343-V347 WeakPolarHBondContact O-CG2 3.39Å; S343-V347 PolarHBondContact O-N 2.98Å; D344-V347 PolarHBondContact O-N 2.04Å; V347-F349 VanDerWaalsContact C-N 3.31Å; V347-F349 PolarHBondContact O-N 2.82Å; V347-S350 PolarHBondContact O-N 3.32Å; V347-S350 VanDerWaalsContact O-N 3.07Å; V347-S350 PolarHBondContact O-OG 2.64Å; V347-D351 PolarHBondContact O-N 3.07Å
348	T	84.6	Confident	80.7	Confident	78 Å²	78	77.1 Å²	77.1	48%	0.479	46%	0.458	S	S	.	.	H	α-helix	trans	-59.5	-40.8	179.2	51.8	0	0	0	0	112.5	D344 V345 D351 A352	D344-T348 WeakPolarHBondContact O-CG2 3.32Å; D344-T348 PolarHBondContact O-N 2.7Å; D344-T348 PolarHBondContact O-OG1 2.8Å; V345-T348 WeakPolarHBondContact CA-OG1 3.17Å; V345-T348 PolarHBondContact O-OG1 3.02Å; T348-D351 PolarHBondContact O-N 3.02Å; T348-A352 WeakPolarHBondContact O-CB 3.41Å; T348-A352 PolarHBondContact O-N 3.16Å
349	F	85.9	Confident	77.9	Confident	128 Å²	128	82.5 Å²	82.5	56%	0.561	48%	0.477	S	S	*	.	H	α-helix	trans	-66.1	-39.4	175	-174.7	-107.4	0	0	0	112.5	V345 V347 A352 L353	V345-F349 WeakPolarHBondContact O-CB 3.46Å; V345-F349 PolarHBondContact O-N 3.25Å; V347-F349 VanDerWaalsContact C-N 3.31Å; V347-F349 PolarHBondContact O-N 2.82Å; F349-A352 PolarHBondContact O-N 3.18Å; F349-L353 HydrophobicContact CD1-CD1 3.65Å; F349-L353 HydrophobicContact CE1-CD1 3.2Å; F349-L353 HydrophobicContact CE1-CG 4.15Å; F349-L353 HydrophobicContact CG-CD1 4.49Å; F349-L353 HydrophobicContact CZ-CD1 3.71Å; F349-L353 HydrophobicContact CZ-CG 4.23Å; F349-L353 WeakPolarHBondContact O-CB 3.42Å; F349-L353 PolarHBondContact O-N 2.92Å
350	S	82.7	Confident	75.5	Confident	14 Å²	14	88.8 Å²	88.8	10%	0.098	52%	0.516	C	S	.	.	H	α-helix	trans	-66.3	-38.5	176.8	74.7	0	0	0	0	112.6	F36 L346 V347 L353 L354	F36-S350 WeakPolarHBondContact CE1-OG 3.29Å; L346-S350 VanDerWaalsContact O-CB 3.3Å; L346-S350 WeakPolarHBondContact O-CB 3.5Å; L346-S350 PolarHBondContact O-N 2.99Å; L346-S350 PolarHBondContact O-OG 2.93Å; V347-S350 PolarHBondContact O-N 3.32Å; V347-S350 VanDerWaalsContact O-N 3.07Å; V347-S350 PolarHBondContact O-OG 2.64Å; S350-L353 PolarHBondContact O-N 2.92Å; S350-L354 WeakPolarHBondContact O-CB 3.28Å; S350-L354 WeakPolarHBondContact O-CG 3.34Å; S350-L354 PolarHBondContact O-N 3.31Å
351	D	81.8	Confident	73	Confident	43 Å²	43	86 Å²	86	23%	0.23	52%	0.518	C	S	.	.	H	α-helix	trans	-67.4	-39.8	176.8	-73.1	-31.4	0	0	0	111.2	H37 V347 T348 R356	H37-D351 IonicContact CE1-OD2 2.83Å; V347-D351 PolarHBondContact O-N 3.07Å; T348-D351 PolarHBondContact O-N 3.02Å; D351-R356 PolarHBondContact O-N 2.89Å
352	A	80.6	Confident	70.3	Confident	70 Å²	70	91.4 Å²	91.4	58%	0.579	53%	0.53	S	S	*	.	H	α-helix	trans	-62.8	-43	173.1	0	0	0	0	0	112.4	T348 F349 G355	T348-A352 WeakPolarHBondContact O-CB 3.41Å; T348-A352 PolarHBondContact O-N 3.16Å; F349-A352 PolarHBondContact O-N 3.18Å; A352-G355 PolarHBondContact O-N 3.4Å
353	L	80.1	Confident	67.8	Low	123 Å²	123	96.3 Å²	96.3	64%	0.644	55%	0.55	S	S	*	.	H	α-helix	trans	-67.2	-40.1	178.4	-91.5	168	0	0	0	113.4	F349 S350 G355	F349-L353 HydrophobicContact CD1-CD1 3.65Å; F349-L353 HydrophobicContact CE1-CD1 3.2Å; F349-L353 HydrophobicContact CE1-CG 4.15Å; F349-L353 HydrophobicContact CG-CD1 4.49Å; F349-L353 HydrophobicContact CZ-CD1 3.71Å; F349-L353 HydrophobicContact CZ-CG 4.23Å; F349-L353 WeakPolarHBondContact O-CB 3.42Å; F349-L353 PolarHBondContact O-N 2.92Å; S350-L353 PolarHBondContact O-N 2.92Å; L353-G355 PolarHBondContact O-N 2.87Å; L353-G355 VanDerWaalsContact O-N 3.14Å
354	L	76.8	Confident	65.1	Low	115 Å²	115	102.4 Å²	102.4	60%	0.602	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	4.1	-179.7	-73.3	171	0	0	0	113.1	S350 R356	S350-L354 WeakPolarHBondContact O-CB 3.28Å; S350-L354 WeakPolarHBondContact O-CG 3.34Å; S350-L354 PolarHBondContact O-N 3.31Å; L354-R356 PolarHBondContact O-N 2.82Å
355	G	65	Low	62.4	Low	58 Å²	58	103.5 Å²	103.5	60%	0.598	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	61	16.8	-178.7	0	0	0	0	0	112.9	A352 L353 N357	A352-G355 PolarHBondContact O-N 3.4Å; L353-G355 PolarHBondContact O-N 2.87Å; L353-G355 VanDerWaalsContact O-N 3.14Å; G355-N357 PolarHBondContact O-N 2.84Å
356	R	55.7	Low	59.9	Low	154 Å²	154	104.3 Å²	104.3	58%	0.581	59%	0.588	S	S	*	*			trans	-78.2	75	172.5	-90.8	-176.3	158.7	157.2	-2.9	107.8	D351 L354 G358	D351-R356 PolarHBondContact O-N 2.89Å; L354-R356 PolarHBondContact O-N 2.82Å; R356-G358 PolarHBondContact O-N 3.45Å
357	N	46.2	Very low	57.2	Low	131 Å²	131	105.3 Å²	105.3	70%	0.701	60%	0.599	S	S	*	*			trans	-67.5	69.5	158.7	-82	-11.5	0	0	0	108.7	G355 N359	G355-N357 PolarHBondContact O-N 2.84Å; N357-N359 VanDerWaalsContact C-N 3.25Å; N357-N359 PolarHBondContact O-N 3.02Å
358	G	50.3	Low	54.9	Low	68 Å²	68	110.4 Å²	110.4	70%	0.701	63%	0.63	S	S	*	*			trans	-65.9	99.1	150.2	0	0	0	0	0	105.3	R356 V360	R356-G358 PolarHBondContact O-N 3.45Å; G358-V360 PolarHBondContact O-N 3.41Å
359	N	37.5	Very low	52.7	Low	149 Å²	149	117.4 Å²	117.4	80%	0.797	66%	0.662	S	S	*	*			trans	0.4	102	178	-72.8	-28	0	0	0	114.7	N357 G361	N357-N359 VanDerWaalsContact C-N 3.25Å; N357-N359 PolarHBondContact O-N 3.02Å; N359-G361 PolarHBondContact O-N 3.03Å
360	V	44.2	Very low	51	Low	145 Å²	145	116.9 Å²	116.9	88%	0.879	67%	0.667	S	S	*	*	S	Bend	trans	-60.8	72.3	161.6	-179.7	0	0	0	0	108.3	G358	G358-V360 PolarHBondContact O-N 3.41Å
361	G	39.1	Very low	49.3	Very low	51 Å²	51	122.3 Å²	122.3	53%	0.526	70%	0.697	S	S	.	*			trans	-161.1	50.4	-160.2	0	0	0	0	0	109.8	N359	N359-G361 PolarHBondContact O-N 3.03Å
362	K	35.1	Very low	47.5	Very low	173 Å²	173	126.7 Å²	126.7	75%	0.752	72%	0.723	S	S	*	*			trans	174.1	71.4	145.1	-91.4	161.8	-171.3	-177	0	108.4	H364	K362-H364 PolarHBondContact O-N 3.46Å
363	M	38	Very low	45.6	Very low	183 Å²	183	130.1 Å²	130.1	90%	0.901	73%	0.731	S	S	*	*			trans	-68	67	151.7	-157.8	174.3	-172.4	0	0	107	L365	M363-L365 PolarHBondContact O-N 3.19Å
364	H	32.3	Very low	43.4	Very low	148 Å²	148	130.5 Å²	130.5	69%	0.685	74%	0.737	S	S	*	*			trans	-76.1	89	159.7	-80.8	-59.1	0	0	0	104.9	K362 P366	K362-H364 PolarHBondContact O-N 3.46Å; H364-P366 WeakPolarHBondContact O-CD 3.43Å
365	L	31.7	Very low	41.2	Very low	128 Å²	128	131.5 Å²	131.5	67%	0.67	75%	0.745	S	S	*	*			trans	-42.5	112	155.8	-144.3	85.4	0	0	0	106.4	M363 T367	M363-L365 PolarHBondContact O-N 3.19Å; L365-T367 VanDerWaalsContact C-N 3.3Å; L365-T367 PolarHBondContact O-N 3.36Å
366	P	35.7	Very low	39.5	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	76%	0.756	S	S	*	*			trans	-67.7	104.1	165.9	27.4	-27.7	0	0	0	105	H364 V368	H364-P366 WeakPolarHBondContact O-CD 3.43Å; P366-V368 HydrophobicContact CB-CG2 4.43Å; P366-V368 PolarHBondContact O-N 3.42Å
367	T	31.6	Very low	38.2	Very low	124 Å²	124	135.5 Å²	135.5	76%	0.761	77%	0.769	S	S	*	*			trans	-59.3	89.9	157.9	45.8	0	0	0	0	106.5	L365 I369	L365-T367 VanDerWaalsContact C-N 3.3Å; L365-T367 PolarHBondContact O-N 3.36Å; T367-I369 PolarHBondContact O-N 2.63Å
368	V	38.1	Very low	37.6	Very low	129 Å²	129	135.8 Å²	135.8	78%	0.782	78%	0.775	S	S	*	*			trans	-73.6	107.4	165.9	179.5	0	0	0	0	105.8	P366	P366-V368 HydrophobicContact CB-CG2 4.43Å; P366-V368 PolarHBondContact O-N 3.42Å
369	I	37.4	Very low	36.4	Very low	225 Å²	225	142 Å²	142	100%	1.154	78%	0.782	S	S	*	*			trans	-70.9	0	152.7	-68	173.8	0	0	0	107.3	T367	T367-I369 PolarHBondContact O-N 2.63Å

Retrieved 369 of 369 residues in 97 ms (Link to these results)

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