A0A077ZJ98_TRITR Loading...

Pleiotropic regulator 1

Involved in pre-mRNA splicing as component of the spliceosome. Component of the PRP19-CDC5L complex that forms an integral part of the spliceosome and is required for activating pre-mRNA splicing. As a component of the minor spliceosome, involved in the splicing of U12-type introns in pre-mRNAs.

AlphaFold DB , UniProt , Accession A0A077ZJ98, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 429 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	37.1	Very low	38.4	Very low	247 Å²	247	148 Å²	148	100%	1.217	78%	0.782	S	S	*	*				0	60.4	0	-67.3	-177.6	-171.7	0	0	110.5
2	S	34	Very low	38.2	Very low	119 Å²	119	142.4 Å²	142.4	83%	0.832	76%	0.763	S	S	*	*			trans	-153.9	51	-167.2	58.3	0	0	0	0	114.4
3	S	42.2	Very low	38.4	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	76%	0.76	S	S	*	*			trans	-140.4	8.8	177.4	55.5	0	0	0	0	116.2
4	F	40.9	Very low	38.7	Very low	186 Å²	186	138.6 Å²	138.6	82%	0.816	73%	0.726	S	S	*	*	S	Bend	trans	-96.8	0	-171.1	-94.7	-88.4	0	0	0	117.1
5	L	39.7	Very low	39.5	Very low	152 Å²	152	130.8 Å²	130.8	80%	0.796	69%	0.688	S	S	*	*	S	Bend	trans	-104.2	3.8	-169.1	-87.1	161.6	0	0	0	117.1
6	V	39.9	Very low	40.3	Very low	122 Å²	122	128 Å²	128	74%	0.739	67%	0.673	S	S	*	*	S	Bend	trans	-100.6	-10.8	-174.6	-178.6	0	0	0	0	113.9
7	T	39.6	Very low	41.3	Very low	111 Å²	111	123.7 Å²	123.7	68%	0.681	66%	0.66	S	S	*	*	S	Bend	trans	-87	-23.2	-174.7	24.8	0	0	0	0	115.2
8	E	34.8	Very low	42	Very low	158 Å²	158	117.6 Å²	117.6	74%	0.738	63%	0.627	S	S	*	*	H	α-helix	trans	-72.4	-32.2	-177.1	-80.9	-175.2	142	0	0	114.2	K10 G11	E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 3.31Å; E8-G11 PolarHBondContact O-N 3.16Å
9	R	34.5	Very low	42.8	Very low	206 Å²	206	116.3 Å²	116.3	78%	0.777	61%	0.613	S	S	*	*	H	α-helix	trans	-67.6	-28	-177.2	-76.7	-175.2	176	-178.5	-0.7	113.5	F13	R9-F13 WeakPolarHBondContact O-CD2 3.45Å
10	K	42	Very low	43.5	Very low	170 Å²	170	117.3 Å²	117.3	74%	0.739	61%	0.612	S	S	*	*	H	α-helix	trans	-72.9	-28.2	-179.9	-69.1	-175.2	179.4	177.5	0	113.1	E8	E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 3.31Å
11	G	37.3	Very low	44.2	Very low	51 Å²	51	113.2 Å²	113.2	53%	0.526	60%	0.595	S	S	.	*	H	α-helix	trans	-69.4	-36.9	177.8	0	0	0	0	0	113.5	E8 F14 S15	E8-G11 PolarHBondContact O-N 3.16Å; G11-F14 PolarHBondContact O-N 3.36Å; G11-S15 PolarHBondContact O-N 2.99Å
12	C	36.8	Very low	45.3	Very low	81 Å²	81	102.5 Å²	102.5	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-76.3	-33.3	-175.3	-153	0	0	0	0	113.5	F14 S15 L16	C12-F14 VanDerWaalsContact C-N 3.31Å; C12-S15 PolarHBondContact O-OG 2.83Å; C12-S15 VanDerWaalsContact O-OG 3.07Å; C12-L16 PolarHBondContact O-N 2.93Å
13	F	39.9	Very low	46.2	Very low	165 Å²	165	102.2 Å²	102.2	72%	0.724	53%	0.527	S	S	*	.	H	α-helix	trans	-68.8	-31.8	173.9	-85.8	-83.5	0	0	0	112.2	R9 L16 A17	R9-F13 WeakPolarHBondContact O-CD2 3.45Å; F13-L16 PolarHBondContact O-N 2.84Å; F13-A17 PolarHBondContact O-N 2.85Å
14	F	43.2	Very low	46.9	Very low	67 Å²	67	102.3 Å²	102.3	29%	0.294	52%	0.518	S	S	.	.	H	α-helix	trans	-76.2	-39.6	-178.6	-163.5	-99.2	0	0	0	112.5	G11 C12 L16 A17 L18 K167	G11-F14 PolarHBondContact O-N 3.36Å; C12-F14 VanDerWaalsContact C-N 3.31Å; F14-L16 PolarHBondContact O-N 2.63Å; F14-A17 PolarHBondContact O-N 2.93Å; F14-L18 HydrophobicContact CE1-CD1 3.76Å; F14-L18 HydrophobicContact CZ-CD1 4.18Å; F14-L18 WeakPolarHBondContact O-CB 3.35Å; F14-L18 PolarHBondContact O-N 2.74Å; F14-K167 HydrophobicContact CE1-CB 4.47Å; F14-K167 HydrophobicContact CE1-CD 4.36Å; F14-K167 HydrophobicContact CE2-CD 4.02Å; F14-K167 HydrophobicContact CE2-CG 4.47Å; F14-K167 HydrophobicContact CZ-CB 4.37Å; F14-K167 HydrophobicContact CZ-CD 3.52Å; F14-K167 HydrophobicContact CZ-CG 4.12Å
15	S	51.2	Low	47.7	Very low	21 Å²	21	97.6 Å²	97.6	15%	0.147	50%	0.498	C	S	.	.	H	α-helix	trans	-60.1	-35.9	170.7	70.8	0	0	0	0	111	G11 C12 R19	G11-S15 PolarHBondContact O-N 2.99Å; C12-S15 PolarHBondContact O-OG 2.83Å; C12-S15 VanDerWaalsContact O-OG 3.07Å; S15-R19 WeakPolarHBondContact O-CB 3.44Å; S15-R19 VanDerWaalsContact O-CD 3.28Å; S15-R19 WeakPolarHBondContact O-CD 3.12Å; S15-R19 WeakPolarHBondContact O-CG 2.98Å; S15-R19 PolarHBondContact O-N 3.03Å
16	L	51.4	Low	48.7	Very low	86 Å²	86	93.2 Å²	93.2	45%	0.45	48%	0.48	S	S	.	.	H	α-helix	trans	-69.2	-41.9	175.8	-109.4	139.3	0	0	0	113.3	C12 F13 F14 K20	C12-L16 PolarHBondContact O-N 2.93Å; F13-L16 PolarHBondContact O-N 2.84Å; F14-L16 PolarHBondContact O-N 2.63Å; L16-K20 WeakPolarHBondContact O-CB 3.45Å; L16-K20 WeakPolarHBondContact O-CG 3.26Å; L16-K20 PolarHBondContact O-N 3.39Å
17	A	57.7	Low	49.4	Very low	55 Å²	55	93 Å²	93	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-67.7	-41	177.3	0	0	0	0	0	111.9	F13 F14 K20 A21	F13-A17 PolarHBondContact O-N 2.85Å; F14-A17 PolarHBondContact O-N 2.93Å; A17-K20 PolarHBondContact O-N 3.25Å; A17-A21 WeakPolarHBondContact O-CB 3.18Å; A17-A21 PolarHBondContact O-N 3.2Å
18	L	54.6	Low	50.2	Low	14 Å²	14	94.5 Å²	94.5	7%	0.073	47%	0.465	C	S	.	.	H	α-helix	trans	-69.2	-41.8	176.9	-154.9	137.3	0	0	0	111.1	F14 K20 A21 V22 L203	F14-L18 HydrophobicContact CE1-CD1 3.76Å; F14-L18 HydrophobicContact CZ-CD1 4.18Å; F14-L18 WeakPolarHBondContact O-CB 3.35Å; F14-L18 PolarHBondContact O-N 2.74Å; L18-K20 PolarHBondContact O-N 3.45Å; L18-A21 PolarHBondContact O-N 3.47Å; L18-V22 HydrophobicContact CD2-CG2 4.14Å; L18-V22 VanDerWaalsContact O-CB 3.28Å; L18-V22 WeakPolarHBondContact O-CB 3.24Å; L18-V22 VanDerWaalsContact O-CG2 3.27Å; L18-V22 WeakPolarHBondContact O-CG2 3.22Å; L18-V22 PolarHBondContact O-N 3.39Å; L18-L203 HydrophobicContact CD2-CB 3.79Å; L18-L203 WeakPolarHBondContact CD2-O 3.47Å
19	R	56.4	Low	51.4	Low	93 Å²	93	89.7 Å²	89.7	35%	0.351	45%	0.449	S	S	.	.	H	α-helix	trans	-58.8	-43.5	169.7	-77.6	168.9	-170.4	-169.5	-0.9	112.4	S15 K23 E204	S15-R19 WeakPolarHBondContact O-CB 3.44Å; S15-R19 VanDerWaalsContact O-CD 3.28Å; S15-R19 WeakPolarHBondContact O-CD 3.12Å; S15-R19 WeakPolarHBondContact O-CG 2.98Å; S15-R19 PolarHBondContact O-N 3.03Å; R19-K23 WeakPolarHBondContact O-CB 3.33Å; R19-K23 PolarHBondContact O-N 3.17Å; R19-E204 HydrophobicContact CG-CB 3.88Å; R19-E204 HydrophobicContact CG-CG 3.95Å; R19-E204 PolarHBondContact NE-O 2.9Å; R19-E204 PolarHBondContact NH2-O 3.37Å
20	K	57.2	Low	53	Low	135 Å²	135	85.2 Å²	85.2	59%	0.587	44%	0.436	S	S	*	.	H	α-helix	trans	-63.2	-46.6	176.5	-81.2	-177.8	178.8	-174.7	0	111.4	L16 A17 L18 K23 I24	L16-K20 WeakPolarHBondContact O-CB 3.45Å; L16-K20 WeakPolarHBondContact O-CG 3.26Å; L16-K20 PolarHBondContact O-N 3.39Å; A17-K20 PolarHBondContact O-N 3.25Å; L18-K20 PolarHBondContact O-N 3.45Å; K20-K23 PolarHBondContact O-N 2.85Å; K20-I24 WeakPolarHBondContact O-CB 3.16Å; K20-I24 WeakPolarHBondContact O-CD1 3.46Å; K20-I24 WeakPolarHBondContact O-CG1 3.03Å; K20-I24 PolarHBondContact O-N 3.36Å
21	A	58.9	Low	53.8	Low	32 Å²	32	80.9 Å²	80.9	26%	0.264	43%	0.427	S	S	.	.	H	α-helix	trans	-65.1	-40.3	-179.8	0	0	0	0	0	112.4	A17 L18 K25	A17-A21 WeakPolarHBondContact O-CB 3.18Å; A17-A21 PolarHBondContact O-N 3.2Å; L18-A21 PolarHBondContact O-N 3.47Å; A21-K25 WeakPolarHBondContact O-CG 3.35Å; A21-K25 PolarHBondContact O-N 3.39Å
22	V	58.4	Low	55.2	Low	22 Å²	22	80.9 Å²	80.9	13%	0.133	42%	0.422	C	S	.	.	H	α-helix	trans	-63.6	-50.9	173.8	157.2	0	0	0	0	111.3	L18 I24 K25 S26 P187 E204	L18-V22 HydrophobicContact CD2-CG2 4.14Å; L18-V22 VanDerWaalsContact O-CB 3.28Å; L18-V22 WeakPolarHBondContact O-CB 3.24Å; L18-V22 VanDerWaalsContact O-CG2 3.27Å; L18-V22 WeakPolarHBondContact O-CG2 3.22Å; L18-V22 PolarHBondContact O-N 3.39Å; V22-I24 PolarHBondContact O-N 2.82Å; V22-K25 CarbonylContact O-C 3.6Å; V22-K25 WeakPolarHBondContact O-CA 3.41Å; V22-K25 WeakPolarHBondContact O-CB 3.4Å; V22-K25 PolarHBondContact O-N 2.93Å; V22-S26 PolarHBondContact O-N 2.83Å; V22-P187 HydrophobicContact CB-CB 4.05Å; V22-P187 HydrophobicContact CG1-CB 3.22Å; V22-P187 HydrophobicContact CG1-CG 3.56Å; V22-P187 HydrophobicContact CG2-CB 3.64Å; V22-E204 HydrophobicContact CG1-CG 4.23Å; V22-E204 WeakPolarHBondContact CG1-OE1 3.41Å
23	K	53.2	Low	56.8	Low	113 Å²	113	83.1 Å²	83.1	49%	0.491	42%	0.424	S	S	.	.	H	α-helix	trans	-65.6	-38.5	-175.3	-169.2	171.7	-176	175.8	0	112.4	R19 K20 K25 S26 E27	R19-K23 WeakPolarHBondContact O-CB 3.33Å; R19-K23 PolarHBondContact O-N 3.17Å; K20-K23 PolarHBondContact O-N 2.85Å; K23-K25 VanDerWaalsContact C-N 3.27Å; K23-K25 PolarHBondContact O-N 2.77Å; K23-S26 PolarHBondContact O-N 2.58Å; K23-S26 PolarHBondContact O-OG 3.11Å; K23-E27 WeakPolarHBondContact CE-OE1 3.48Å; K23-E27 WeakPolarHBondContact CE-OE2 3.29Å; K23-E27 HydrophobicContact CG-CG 4.48Å; K23-E27 IonicContact NZ-OE1 2.64Å; K23-E27 PolarHBondContact O-N 3.46Å; K23-E27 VanDerWaalsContact O-N 3.1Å
24	I	56.9	Low	58.3	Low	109 Å²	109	81 Å²	81	56%	0.559	41%	0.414	S	S	*	.	H	α-helix	trans	-61.6	-37.5	173.2	-68.2	165	0	0	0	110.6	K20 V22 Y28	K20-I24 WeakPolarHBondContact O-CB 3.16Å; K20-I24 WeakPolarHBondContact O-CD1 3.46Å; K20-I24 WeakPolarHBondContact O-CG1 3.03Å; K20-I24 PolarHBondContact O-N 3.36Å; V22-I24 PolarHBondContact O-N 2.82Å; I24-Y28 WeakPolarHBondContact O-CB 3.35Å; I24-Y28 PolarHBondContact O-N 3.35Å
25	K	58.5	Low	59.6	Low	87 Å²	87	80.7 Å²	80.7	38%	0.378	42%	0.424	S	S	.	.	H	α-helix	trans	-74.4	-40.6	177.1	-74.6	-179.1	-179.5	-174.9	0	112.7	A21 V22 K23 S29 E141	A21-K25 WeakPolarHBondContact O-CG 3.35Å; A21-K25 PolarHBondContact O-N 3.39Å; V22-K25 CarbonylContact O-C 3.6Å; V22-K25 WeakPolarHBondContact O-CA 3.41Å; V22-K25 WeakPolarHBondContact O-CB 3.4Å; V22-K25 PolarHBondContact O-N 2.93Å; K23-K25 VanDerWaalsContact C-N 3.27Å; K23-K25 PolarHBondContact O-N 2.77Å; K25-S29 WeakPolarHBondContact O-CA 3.48Å; K25-S29 WeakPolarHBondContact O-CB 3.48Å; K25-S29 PolarHBondContact O-N 3.45Å; K25-S29 PolarHBondContact O-OG 2.64Å; K25-S29 VanDerWaalsContact O-OG 3.09Å; K25-E141 IonicContact NZ-OE1 3.78Å; K25-E141 PolarHBondContact NZ-OE1 2.97Å
26	S	60	Low	60.8	Low	60 Å²	60	87 Å²	87	42%	0.42	45%	0.449	S	S	.	.	H	α-helix	trans	-71.3	-41.1	-177.1	62.2	0	0	0	0	113.2	V22 K23	V22-S26 PolarHBondContact O-N 2.83Å; K23-S26 PolarHBondContact O-N 2.58Å; K23-S26 PolarHBondContact O-OG 3.11Å
27	E	55.2	Low	61.8	Low	118 Å²	118	89 Å²	89	55%	0.551	46%	0.456	S	S	*	.	H	α-helix	trans	-84.9	-26.7	-175.4	-68.4	175.8	176	0	0	112.8	K23	K23-E27 WeakPolarHBondContact CE-OE1 3.48Å; K23-E27 WeakPolarHBondContact CE-OE2 3.29Å; K23-E27 HydrophobicContact CG-CG 4.48Å; K23-E27 IonicContact NZ-OE1 2.64Å; K23-E27 PolarHBondContact O-N 3.46Å; K23-E27 VanDerWaalsContact O-N 3.1Å
28	Y	56.2	Low	62.7	Low	141 Å²	141	93.5 Å²	93.5	55%	0.553	47%	0.465	S	S	*	.	H	α-helix	trans	-116.3	0.9	-175.5	-59.5	-85.8	0	0	0	115.3	I24 H30 C31 A32	I24-Y28 WeakPolarHBondContact O-CB 3.35Å; I24-Y28 PolarHBondContact O-N 3.35Å; Y28-H30 VanDerWaalsContact C-N 3.34Å; Y28-H30 PolarHBondContact O-N 3.25Å; Y28-C31 PolarHBondContact O-N 2.67Å; Y28-C31 VanDerWaalsContact O-N 3.07Å; Y28-A32 PolarHBondContact O-N 3.36Å
29	S	60.5	Low	63.7	Low	57 Å²	57	99.3 Å²	99.3	40%	0.399	49%	0.49	S	S	.	.	H	α-helix	trans	-52.4	-49	179.7	45.1	0	0	0	0	112.7	K25 C31 A32 E33	K25-S29 WeakPolarHBondContact O-CA 3.48Å; K25-S29 WeakPolarHBondContact O-CB 3.48Å; K25-S29 PolarHBondContact O-N 3.45Å; K25-S29 PolarHBondContact O-OG 2.64Å; K25-S29 VanDerWaalsContact O-OG 3.09Å; S29-C31 VanDerWaalsContact C-N 3.29Å; S29-C31 PolarHBondContact O-N 3.35Å; S29-A32 PolarHBondContact O-N 3.07Å; S29-A32 VanDerWaalsContact O-N 3.13Å; S29-E33 PolarHBondContact O-N 2.86Å
30	H	66.6	Low	64.6	Low	113 Å²	113	102.2 Å²	102.2	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-32.1	179.9	175.9	-93.4	0	0	0	112.8	Y28 K34	Y28-H30 VanDerWaalsContact C-N 3.34Å; Y28-H30 PolarHBondContact O-N 3.25Å; H30-K34 WeakPolarHBondContact CE1-CE 3.24Å; H30-K34 PolarHBondContact CE1-NZ 3.03Å; H30-K34 VanDerWaalsContact NE2-CE 3.3Å; H30-K34 WeakPolarHBondContact NE2-CE 3.5Å; H30-K34 PolarHBondContact NE2-NZ 3.04Å; H30-K34 WeakPolarHBondContact O-CG 3.44Å; H30-K34 PolarHBondContact O-N 3.5Å
31	C	59.2	Low	65.2	Low	79 Å²	79	101.1 Å²	101.1	53%	0.534	50%	0.504	S	S	.	.	H	α-helix	trans	-73	-37.9	173.2	-69.3	0	0	0	0	112	Y28 S29 A35	Y28-C31 PolarHBondContact O-N 2.67Å; Y28-C31 VanDerWaalsContact O-N 3.07Å; S29-C31 VanDerWaalsContact C-N 3.29Å; S29-C31 PolarHBondContact O-N 3.35Å; C31-A35 WeakPolarHBondContact O-CB 3.28Å; C31-A35 PolarHBondContact O-N 2.97Å
32	A	66.5	Low	65.8	Low	51 Å²	51	104.2 Å²	104.2	42%	0.421	52%	0.516	S	S	.	.	H	α-helix	trans	-70.8	-36.6	179	0	0	0	0	0	112.6	Y28 S29 A35 K36	Y28-A32 PolarHBondContact O-N 3.36Å; S29-A32 PolarHBondContact O-N 3.07Å; S29-A32 VanDerWaalsContact O-N 3.13Å; A32-A35 PolarHBondContact O-N 3.41Å; A32-K36 WeakPolarHBondContact O-CG 3.24Å; A32-K36 PolarHBondContact O-N 2.8Å
33	E	71.3	Confident	66.4	Low	127 Å²	127	108 Å²	108	59%	0.593	53%	0.532	S	S	*	.	H	α-helix	trans	-66	-48.3	173.5	-76.4	-177.6	163.6	0	0	111.4	S29 A35 K36 E37	S29-E33 PolarHBondContact O-N 2.86Å; E33-A35 VanDerWaalsContact C-N 3.26Å; E33-A35 PolarHBondContact O-N 3.38Å; E33-K36 PolarHBondContact O-N 2.77Å; E33-K36 VanDerWaalsContact O-N 3.1Å; E33-E37 PolarHBondContact O-N 2.64Å
34	K	70.5	Confident	67.1	Low	121 Å²	121	111.2 Å²	111.2	53%	0.526	54%	0.542	S	S	.	.	H	α-helix	trans	-58.5	-37	174.1	-76.7	-174	176.8	-174.9	0	112.7	H30 K38	H30-K34 WeakPolarHBondContact CE1-CE 3.24Å; H30-K34 PolarHBondContact CE1-NZ 3.03Å; H30-K34 VanDerWaalsContact NE2-CE 3.3Å; H30-K34 WeakPolarHBondContact NE2-CE 3.5Å; H30-K34 PolarHBondContact NE2-NZ 3.04Å; H30-K34 WeakPolarHBondContact O-CG 3.44Å; H30-K34 PolarHBondContact O-N 3.5Å; K34-K38 VanDerWaalsContact O-CB 3.31Å; K34-K38 WeakPolarHBondContact O-CB 3.35Å; K34-K38 PolarHBondContact O-N 3.17Å
35	A	71.2	Confident	67.5	Low	61 Å²	61	113.8 Å²	113.8	50%	0.504	55%	0.55	S	S	.	.	H	α-helix	trans	-68	-40.8	175.7	0	0	0	0	0	112.4	C31 A32 E33 K38 K39	C31-A35 WeakPolarHBondContact O-CB 3.28Å; C31-A35 PolarHBondContact O-N 2.97Å; A32-A35 PolarHBondContact O-N 3.41Å; E33-A35 VanDerWaalsContact C-N 3.26Å; E33-A35 PolarHBondContact O-N 3.38Å; A35-K38 PolarHBondContact O-N 2.58Å; A35-K39 WeakPolarHBondContact O-CB 3.25Å; A35-K39 PolarHBondContact O-N 3.26Å
36	K	75.7	Confident	67.8	Low	153 Å²	153	113.9 Å²	113.9	67%	0.665	56%	0.561	S	S	*	*	H	α-helix	trans	-65.6	-41.6	174.9	-77.8	179.5	-179.9	179	0	112	A32 E33 K39 K40	A32-K36 WeakPolarHBondContact O-CG 3.24Å; A32-K36 PolarHBondContact O-N 2.8Å; E33-K36 PolarHBondContact O-N 2.77Å; E33-K36 VanDerWaalsContact O-N 3.1Å; K36-K39 PolarHBondContact O-N 3.28Å; K36-K40 WeakPolarHBondContact O-CG 3.33Å; K36-K40 PolarHBondContact O-N 2.65Å
37	E	74.2	Confident	67.4	Low	128 Å²	128	116.8 Å²	116.8	60%	0.598	57%	0.57	S	S	*	*	H	α-helix	trans	-63.1	-44.5	174.6	-75	-179	163.9	0	0	111.7	E33 K39 K40 M41	E33-E37 PolarHBondContact O-N 2.64Å; E37-K39 VanDerWaalsContact C-N 3.31Å; E37-K39 PolarHBondContact O-N 2.8Å; E37-K40 PolarHBondContact O-N 3.11Å; E37-M41 WeakPolarHBondContact O-CB 3.47Å; E37-M41 WeakPolarHBondContact O-CG 3.44Å; E37-M41 PolarHBondContact O-N 3.19Å
38	K	74.5	Confident	67.1	Low	149 Å²	149	116.9 Å²	116.9	65%	0.648	58%	0.58	S	S	*	*	H	α-helix	trans	-64.6	-36.1	177.3	-158.7	173.8	-174.2	179.3	0	112	K34 A35 N42	K34-K38 VanDerWaalsContact O-CB 3.31Å; K34-K38 WeakPolarHBondContact O-CB 3.35Å; K34-K38 PolarHBondContact O-N 3.17Å; A35-K38 PolarHBondContact O-N 2.58Å; K38-N42 WeakPolarHBondContact O-CB 3.08Å; K38-N42 PolarHBondContact O-N 2.87Å
39	K	76.4	Confident	66.7	Low	136 Å²	136	117.9 Å²	117.9	59%	0.591	59%	0.594	S	S	*	*	H	α-helix	trans	-67	-46.1	174	-167.2	177.2	178.3	-177.5	0	111.7	A35 K36 E37 M41 N42 E43	A35-K39 WeakPolarHBondContact O-CB 3.25Å; A35-K39 PolarHBondContact O-N 3.26Å; K36-K39 PolarHBondContact O-N 3.28Å; E37-K39 VanDerWaalsContact C-N 3.31Å; E37-K39 PolarHBondContact O-N 2.8Å; K39-M41 VanDerWaalsContact C-N 3.34Å; K39-M41 PolarHBondContact O-N 3.49Å; K39-N42 PolarHBondContact O-N 3.18Å; K39-E43 WeakPolarHBondContact CE-OE1 3.49Å; K39-E43 PolarHBondContact O-N 2.87Å
40	K	75.5	Confident	65.7	Low	154 Å²	154	121 Å²	121	67%	0.67	61%	0.613	S	S	*	*	H	α-helix	trans	-60	-41.9	173.8	-77.1	-176	176.8	-176.4	0	112.2	K36 E37 E43 Y44	K36-K40 WeakPolarHBondContact O-CG 3.33Å; K36-K40 PolarHBondContact O-N 2.65Å; E37-K40 PolarHBondContact O-N 3.11Å; K40-E43 PolarHBondContact O-N 2.96Å; K40-Y44 WeakPolarHBondContact O-CB 3.28Å; K40-Y44 PolarHBondContact O-N 3.01Å
41	M	69.1	Low	64.5	Low	113 Å²	113	123 Å²	123	56%	0.557	63%	0.627	S	S	*	*	H	α-helix	trans	-65	-37	176.4	-77.7	-68.8	-72.9	0	0	112.6	E37 K39 K45	E37-M41 WeakPolarHBondContact O-CB 3.47Å; E37-M41 WeakPolarHBondContact O-CG 3.44Å; E37-M41 PolarHBondContact O-N 3.19Å; K39-M41 VanDerWaalsContact C-N 3.34Å; K39-M41 PolarHBondContact O-N 3.49Å; M41-K45 WeakPolarHBondContact O-CB 3.43Å; M41-K45 WeakPolarHBondContact O-CG 3.14Å; M41-K45 PolarHBondContact O-N 2.66Å
42	N	72.3	Confident	63.4	Low	96 Å²	96	125 Å²	125	51%	0.513	64%	0.639	S	S	.	*	H	α-helix	trans	-72	-37.5	174.8	-80.5	-0.6	0	0	0	112.4	K38 K39 K45 S46	K38-N42 WeakPolarHBondContact O-CB 3.08Å; K38-N42 PolarHBondContact O-N 2.87Å; K39-N42 PolarHBondContact O-N 3.18Å; N42-K45 PolarHBondContact O-N 3.06Å; N42-S46 WeakPolarHBondContact O-CB 3Å; N42-S46 PolarHBondContact O-N 2.82Å; N42-S46 VanDerWaalsContact O-N 3.12Å; N42-S46 PolarHBondContact O-OG 2.64Å
43	E	70.6	Confident	62.1	Low	102 Å²	102	131.7 Å²	131.7	48%	0.477	66%	0.662	S	S	.	*	H	α-helix	trans	-63.2	-42.8	171.5	-77.6	170	-173.6	0	0	110.6	K39 K40 K45 S46 M47	K39-E43 WeakPolarHBondContact CE-OE1 3.49Å; K39-E43 PolarHBondContact O-N 2.87Å; K40-E43 PolarHBondContact O-N 2.96Å; E43-K45 VanDerWaalsContact C-N 3.33Å; E43-K45 PolarHBondContact O-N 2.82Å; E43-S46 WeakPolarHBondContact CA-OG 3.11Å; E43-S46 PolarHBondContact O-N 2.83Å; E43-S46 VanDerWaalsContact O-N 3.17Å; E43-S46 PolarHBondContact O-OG 3.33Å; E43-S46 VanDerWaalsContact O-OG 3.06Å; E43-M47 WeakPolarHBondContact O-CG 3.11Å; E43-M47 PolarHBondContact O-N 3.05Å
44	Y	68.2	Low	60.4	Low	181 Å²	181	134.5 Å²	134.5	71%	0.71	67%	0.672	S	S	*	*	H	α-helix	trans	-64.4	-35.5	177	-139	-90.2	0	0	0	113	K40 S46 M47	K40-Y44 WeakPolarHBondContact O-CB 3.28Å; K40-Y44 PolarHBondContact O-N 3.01Å; Y44-S46 VanDerWaalsContact C-N 3.34Å; Y44-M47 HydrophobicContact CD2-CE 4.39Å; Y44-M47 HydrophobicContact CE2-CE 4.41Å
45	K	65.9	Low	58.7	Low	163 Å²	163	133.7 Å²	133.7	71%	0.709	68%	0.679	S	S	*	*	H	α-helix	trans	-74.9	-19.9	175.8	-76.7	179.2	179.1	-174.5	0	114	M41 N42 E43	M41-K45 WeakPolarHBondContact O-CB 3.43Å; M41-K45 WeakPolarHBondContact O-CG 3.14Å; M41-K45 PolarHBondContact O-N 2.66Å; N42-K45 PolarHBondContact O-N 3.06Å; E43-K45 VanDerWaalsContact C-N 3.33Å; E43-K45 PolarHBondContact O-N 2.82Å
46	S	63.8	Low	57.2	Low	89 Å²	89	136.8 Å²	136.8	62%	0.622	69%	0.694	S	S	*	*	H	α-helix	trans	-99.5	-4.6	-178	50.8	0	0	0	0	113.6	N42 E43 Y44	N42-S46 WeakPolarHBondContact O-CB 3Å; N42-S46 PolarHBondContact O-N 2.82Å; N42-S46 VanDerWaalsContact O-N 3.12Å; N42-S46 PolarHBondContact O-OG 2.64Å; E43-S46 WeakPolarHBondContact CA-OG 3.11Å; E43-S46 PolarHBondContact O-N 2.83Å; E43-S46 VanDerWaalsContact O-N 3.17Å; E43-S46 PolarHBondContact O-OG 3.33Å; E43-S46 VanDerWaalsContact O-OG 3.06Å; Y44-S46 VanDerWaalsContact C-N 3.34Å
47	M	52.3	Low	55.3	Low	121 Å²	121	137 Å²	137	60%	0.596	70%	0.7	S	S	*	*	S	Bend	trans	-73.4	128.8	171.7	-71.5	-156.8	-56.7	0	0	110.8	E43 Y44 L49	E43-M47 WeakPolarHBondContact O-CG 3.11Å; E43-M47 PolarHBondContact O-N 3.05Å; Y44-M47 HydrophobicContact CD2-CE 4.39Å; Y44-M47 HydrophobicContact CE2-CE 4.41Å; M47-L49 PolarHBondContact O-N 2.83Å
48	P	49.2	Very low	53.5	Low	119 Å²	119	138.4 Å²	138.4	77%	0.773	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-64.4	135.3	174.3	-9.9	23.8	0	0	0	109.5
49	L	46.6	Very low	51.8	Low	162 Å²	162	137.1 Å²	137.1	85%	0.848	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-56.6	130.9	169.1	-75.2	162.7	0	0	0	108.8	M47 L51	M47-L49 PolarHBondContact O-N 2.83Å; L49-L51 PolarHBondContact O-N 2.85Å; L49-L51 VanDerWaalsContact O-N 3.12Å
50	P	40.5	Very low	49.6	Very low	122 Å²	122	139.6 Å²	139.6	79%	0.792	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-62.6	118.2	175.5	-15.8	28.2	0	0	0	109
51	L	41.1	Very low	47.5	Very low	156 Å²	156	137.6 Å²	137.6	82%	0.817	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-59.7	139.2	167.6	-75.4	158.4	0	0	0	108.3	L49 E53	L49-L51 PolarHBondContact O-N 2.85Å; L49-L51 VanDerWaalsContact O-N 3.12Å; L51-E53 PolarHBondContact O-N 2.76Å; L51-E53 VanDerWaalsContact O-N 3.11Å
52	P	36.9	Very low	45.9	Very low	121 Å²	121	140.9 Å²	140.9	79%	0.786	75%	0.751	S	S	*	*			trans	-66.4	115.9	177.7	27.2	-30.8	0	0	0	108.6	K54	P52-K54 PolarHBondContact O-N 3.43Å
53	E	39	Very low	43.8	Very low	192 Å²	192	143.9 Å²	143.9	90%	0.897	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-61.2	120.6	173.5	-78.6	-176.2	159	0	0	109.5	L51	L51-E53 PolarHBondContact O-N 2.76Å; L51-E53 VanDerWaalsContact O-N 3.11Å
54	K	34.8	Very low	42.1	Very low	186 Å²	186	146.4 Å²	146.4	81%	0.809	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-54.8	137.8	170.6	-106.5	173	173.2	176.9	0	109.4	P52	P52-K54 PolarHBondContact O-N 3.43Å
55	P	35.5	Very low	40.5	Very low	104 Å²	104	143.1 Å²	143.1	68%	0.675	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-63.4	148.8	172.3	28.8	-32.8	0	0	0	109.7	I57	P55-I57 PolarHBondContact O-N 3.29Å
56	P	38.8	Very low	39.1	Very low	125 Å²	125	142.9 Å²	142.9	81%	0.812	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65.9	130.3	-174	27.1	-32.5	0	0	0	110.6	L58	P56-L58 PolarHBondContact O-N 3.13Å
57	I	35.7	Very low	37.8	Very low	157 Å²	157	142.2 Å²	142.2	81%	0.805	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70	117.4	172.7	-63.1	161.2	0	0	0	107.3	P55	P55-I57 PolarHBondContact O-N 3.29Å
58	L	35.9	Very low	37.1	Very low	158 Å²	158	145.9 Å²	145.9	83%	0.827	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.9	136.5	169.6	-74.2	162.9	0	0	0	109.3	P56 E60	P56-L58 PolarHBondContact O-N 3.13Å; L58-E60 PolarHBondContact O-N 2.95Å
59	P	40.3	Very low	36.2	Very low	123 Å²	123	146.9 Å²	146.9	80%	0.799	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.3	124.8	174.8	28.9	-29.5	0	0	0	110.6
60	E	29.8	Very low	35.8	Very low	188 Å²	188	147.8 Å²	147.8	88%	0.879	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-62.4	127	165.4	-69.4	176.9	152.9	0	0	110.4	L58	L58-E60 PolarHBondContact O-N 2.95Å
61	S	31.4	Very low	35.5	Very low	112 Å²	112	148.3 Å²	148.3	78%	0.783	81%	0.806	S	S	*	*			trans	171.5	148.2	133.2	45.3	0	0	0	0	111.7
62	Q	34.8	Very low	35.3	Very low	181 Å²	181	147.8 Å²	147.8	85%	0.846	81%	0.81	S	S	*	*			trans	97.3	72.2	174.3	-46.6	-142.3	-0.6	0	0	116.6
63	L	28.4	Very low	35.3	Very low	160 Å²	160	145.6 Å²	145.6	84%	0.838	81%	0.81	S	S	*	*				10.8	115.5	125.5	-70.8	143.7	0	0	0	116.4
64	N	34.9	Very low	35.2	Very low	155 Å²	155	142 Å²	142	83%	0.829	81%	0.805	S	S	*	*				-163.9	102.3	126.2	-105.8	-16.6	0	0	0	112.4
65	V	34	Very low	35.5	Very low	112 Å²	112	138.3 Å²	138.3	68%	0.679	80%	0.8	S	S	*	*				28.2	94.7	129.9	-167.3	0	0	0	0	117
66	N	37.1	Very low	35.5	Very low	158 Å²	158	139.7 Å²	139.7	85%	0.845	81%	0.807	S	S	*	*				151.4	121.5	127.4	-78.3	-29.8	0	0	0	113.1
67	G	36.2	Very low	35.1	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	80%	0.802	S	S	*	*			trans	106.4	75	139.4	0	0	0	0	0	119.1
68	Q	37.8	Very low	35.2	Very low	199 Å²	199	139.6 Å²	139.6	93%	0.93	81%	0.806	S	S	*	*			trans	77.8	99.4	131.2	-130.8	161.6	8.2	0	0	120.2
69	L	30.8	Very low	35.1	Very low	140 Å²	140	138 Å²	138	73%	0.733	80%	0.802	S	S	*	*			trans	-71.6	156.5	152.3	-80.6	140.8	0	0	0	111.1	L71	L69-L71 HydrophobicContact CD2-CD1 4.27Å
70	M	38	Very low	34.8	Very low	180 Å²	180	138.4 Å²	138.4	89%	0.887	80%	0.802	S	S	*	*				-172.5	139.6	114.9	-92.1	-68	-88	0	0	112.4
71	L	34.6	Very low	35	Very low	133 Å²	133	133.4 Å²	133.4	70%	0.696	79%	0.793	S	S	*	*			trans	-90.9	-175.4	-169.4	-83.5	130.8	0	0	0	114	L69	L69-L71 HydrophobicContact CD2-CD1 4.27Å
72	T	37.4	Very low	35.2	Very low	145 Å²	145	137 Å²	137	89%	0.89	80%	0.795	S	S	*	*			trans	98.8	136.7	160.6	76.9	0	0	0	0	114.4
73	G	35.3	Very low	35.3	Very low	76 Å²	76	134.9 Å²	134.9	78%	0.784	79%	0.794	S	S	*	*			cis	-176.3	159.6	2.9	0	0	0	0	0	107.7
74	S	36.9	Very low	35.9	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	79%	0.788	S	S	*	*			trans	-81.3	-161.8	-168.5	57.9	0	0	0	0	114.8
75	P	43	Very low	35.8	Very low	109 Å²	109	134 Å²	134	71%	0.708	79%	0.79	S	S	*	*				-134.2	-173.8	-73.7	36.2	-15.4	0	0	0	114.2
76	V	34.5	Very low	35.8	Very low	133 Å²	133	137.3 Å²	137.3	81%	0.806	80%	0.798	S	S	*	*			trans	77.7	116.7	157.3	-165.3	0	0	0	0	118.9
77	S	31.2	Very low	35.6	Very low	101 Å²	101	138.4 Å²	138.4	71%	0.706	80%	0.798	S	S	*	*				166.9	132	105.8	-154.3	0	0	0	0	110.6
78	M	36.3	Very low	35.9	Very low	180 Å²	180	140 Å²	140	89%	0.887	80%	0.795	S	S	*	*				161.8	130.8	123	-78.4	-147.2	-148.5	0	0	113.3
79	T	34	Very low	35.8	Very low	123 Å²	123	142.7 Å²	142.7	76%	0.755	80%	0.796	S	S	*	*			trans	-59.3	135	172	41.2	0	0	0	0	114
80	V	34.3	Very low	35.9	Very low	133 Å²	133	141.9 Å²	141.9	81%	0.806	80%	0.797	S	S	*	*				97.1	124.4	91.2	172.1	0	0	0	0	114.7
81	A	33.3	Very low	35.9	Very low	83 Å²	83	142.1 Å²	142.1	69%	0.686	80%	0.796	S	S	*	*			trans	67.7	148.4	149.8	0	0	0	0	0	118.5
82	K	35.9	Very low	35.8	Very low	188 Å²	188	140.5 Å²	140.5	82%	0.817	80%	0.802	S	S	*	*			cis	-166.8	127.5	19.3	-127.3	160.6	179.4	-175.7	0	106
83	V	38.1	Very low	35.7	Very low	135 Å²	135	138.3 Å²	138.3	82%	0.818	80%	0.798	S	S	*	*				88.8	142.3	100.4	170.5	0	0	0	0	115.1
84	P	39.2	Very low	35.4	Very low	112 Å²	112	143 Å²	143	73%	0.727	80%	0.804	S	S	*	*			trans	-122.9	178.9	-150.2	41.7	-24.5	0	0	0	114.6
85	E	34.7	Very low	35.4	Very low	184 Å²	184	142.3 Å²	142.3	86%	0.86	81%	0.806	S	S	*	*			trans	-174.7	149.8	166.3	-107.5	170.5	-165.5	0	0	106.6
86	E	33.9	Very low	34.7	Very low	182 Å²	182	149.2 Å²	149.2	85%	0.85	82%	0.818	S	S	*	*			cis	-168.3	156.2	-15.6	-139.7	179.1	179.8	0	0	105.5
87	Q	32.3	Very low	34.8	Very low	182 Å²	182	147.5 Å²	147.5	85%	0.85	82%	0.818	S	S	*	*			trans	-91.1	-157.9	-171.8	-61.7	-179	-18.3	0	0	113.2
88	P	41.5	Very low	34.7	Very low	106 Å²	106	150.2 Å²	150.2	69%	0.688	82%	0.824	S	S	*	*				-130.8	-178.3	-74.3	36.9	-19.3	0	0	0	112.7
89	R	36.4	Very low	34.4	Very low	256 Å²	256	146.3 Å²	146.3	97%	0.966	81%	0.814	S	S	*	*			trans	-145.6	140.1	158.2	-115.6	-179.7	-176.8	-179.6	1.4	112.9
90	V	33.8	Very low	34.4	Very low	124 Å²	124	151.1 Å²	151.1	75%	0.752	82%	0.821	S	S	*	*			trans	-104.7	143	-167.9	178.2	0	0	0	0	110.5
91	Q	37.3	Very low	34.3	Very low	185 Å²	185	149.9 Å²	149.9	86%	0.864	82%	0.818	S	S	*	*			trans	156.4	108.2	143.6	-87.6	165.9	5.7	0	0	109.1
92	A	32.3	Very low	34.4	Very low	98 Å²	98	151.8 Å²	151.8	81%	0.81	83%	0.826	S	S	*	*				96.8	114.6	82.4	0	0	0	0	0	112
93	A	34.7	Very low	34.6	Very low	99 Å²	99	151.5 Å²	151.5	82%	0.818	83%	0.825	S	S	*	*			trans	150.1	128.4	136.4	0	0	0	0	0	113.7
94	L	29.5	Very low	34.6	Very low	174 Å²	174	149.3 Å²	149.3	91%	0.911	82%	0.816	S	S	*	*			trans	-20.2	129.8	167.2	-74.4	76.7	0	0	0	118.3
95	A	37.2	Very low	34.7	Very low	101 Å²	101	151.8 Å²	151.8	84%	0.835	82%	0.822	S	S	*	*			trans	-166	135.3	132.4	0	0	0	0	0	110.8
96	R	28.5	Very low	34.9	Very low	254 Å²	254	149.9 Å²	149.9	96%	0.958	82%	0.817	S	S	*	*			trans	-67.8	128.6	175.4	-67.5	172.3	169.2	121.8	-3.8	110.2
97	A	35.9	Very low	35.4	Very low	97 Å²	97	146.7 Å²	146.7	80%	0.802	81%	0.812	S	S	*	*			trans	-163.8	130.9	152	0	0	0	0	0	109.2
98	D	30.2	Very low	36	Very low	159 Å²	159	147 Å²	147	85%	0.85	81%	0.813	S	S	*	*			trans	-52.9	148.3	176.6	-58.7	-60.4	0	0	0	112.4
99	S	30.1	Very low	36.1	Very low	97 Å²	97	151.8 Å²	151.8	68%	0.678	82%	0.823	S	S	*	*			trans	139.4	130.1	143.1	70.1	0	0	0	0	113.8
100	Y	33.2	Very low	36.4	Very low	225 Å²	225	143.7 Å²	143.7	88%	0.882	81%	0.811	S	S	*	*			trans	56.1	88.3	163.1	-51.9	-74.6	0	0	0	118.5
101	S	32.5	Very low	37.2	Very low	107 Å²	107	142.5 Å²	142.5	75%	0.748	81%	0.814	S	S	*	*			trans	-140.8	95.4	145.2	69.3	0	0	0	0	110.5	F103	S101-F103 PolarHBondContact O-N 3.08Å
102	S	34.3	Very low	38.1	Very low	122 Å²	122	140 Å²	140	85%	0.853	81%	0.811	S	S	*	*			trans	-58	84.1	162.8	38.2	0	0	0	0	110	S104	S102-S104 VanDerWaalsContact C-N 3.26Å; S102-S104 PolarHBondContact O-N 3.42Å
103	F	41.8	Very low	39.7	Very low	183 Å²	183	139.7 Å²	139.7	80%	0.803	81%	0.808	S	S	*	*			trans	-73.8	92.4	163.6	-126	-87.3	0	0	0	107.6	S101 L105	S101-F103 PolarHBondContact O-N 3.08Å; F103-L105 VanDerWaalsContact C-N 3.34Å; F103-L105 PolarHBondContact O-N 3.33Å
104	S	37.1	Very low	41.6	Very low	89 Å²	89	139 Å²	139	62%	0.622	79%	0.794	S	S	*	*			trans	-51.8	97.8	166.7	130.3	0	0	0	0	108.5	S102 L106	S102-S104 VanDerWaalsContact C-N 3.26Å; S102-S104 PolarHBondContact O-N 3.42Å; S104-L106 PolarHBondContact O-N 2.88Å
105	L	41.1	Very low	44	Very low	164 Å²	164	139.5 Å²	139.5	86%	0.859	79%	0.789	S	S	*	*			trans	-69.4	87.5	161.5	-74.4	171.6	0	0	0	106.7	F103	F103-L105 VanDerWaalsContact C-N 3.34Å; F103-L105 PolarHBondContact O-N 3.33Å
106	L	40.1	Very low	45.9	Very low	143 Å²	143	138 Å²	138	75%	0.749	77%	0.77	S	S	*	*			trans	-56.2	126.9	163	-74.9	167.3	0	0	0	107	S104 H108	S104-L106 PolarHBondContact O-N 2.88Å; L106-H108 PolarHBondContact O-N 2.94Å; L106-H108 VanDerWaalsContact O-N 3.13Å
107	P	43.3	Very low	48.6	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	74%	0.742	S	S	*	*			trans	-62.5	122.9	177.1	25.8	-31	0	0	0	107.3	K109	P107-K109 PolarHBondContact O-N 3.37Å
108	H	46	Very low	51.1	Low	190 Å²	190	129.5 Å²	129.5	88%	0.88	72%	0.722	S	S	*	*			trans	-49.4	115.5	160.7	-104.7	-66.5	0	0	0	106.1	L106 A110	L106-H108 PolarHBondContact O-N 2.94Å; L106-H108 VanDerWaalsContact O-N 3.13Å; H108-A110 PolarHBondContact O-N 3.27Å
109	K	41.8	Very low	53.9	Low	205 Å²	205	122.8 Å²	122.8	89%	0.891	69%	0.686	S	S	*	*			trans	-45.2	109.3	171.3	-105.6	177.4	175	175.4	0	106.8	P107 A111	P107-K109 PolarHBondContact O-N 3.37Å; K109-A111 PolarHBondContact O-N 2.93Å; K109-A111 VanDerWaalsContact O-N 3.08Å
110	A	43.1	Very low	56.8	Low	87 Å²	87	119.2 Å²	119.2	72%	0.719	66%	0.66	S	S	*	*			trans	-53	122	171.8	0	0	0	0	0	106.3	H108 V112	H108-A110 PolarHBondContact O-N 3.27Å; A110-V112 PolarHBondContact O-N 2.85Å
111	A	51.9	Low	59.6	Low	99 Å²	99	110.5 Å²	110.5	82%	0.818	63%	0.631	S	S	*	*			trans	-52.4	116.7	175.7	0	0	0	0	0	107	K109 A113	K109-A111 PolarHBondContact O-N 2.93Å; K109-A111 VanDerWaalsContact O-N 3.08Å; A111-A113 PolarHBondContact O-N 3.1Å
112	V	55.7	Low	62.6	Low	133 Å²	133	105.5 Å²	105.5	81%	0.806	60%	0.596	S	S	*	*			trans	-60.6	102.9	179.9	176.8	0	0	0	0	106.2	A110 V114	A110-V112 PolarHBondContact O-N 2.85Å; V112-V114 PolarHBondContact O-N 3.4Å
113	A	64.9	Low	65.4	Low	90 Å²	90	104.7 Å²	104.7	74%	0.744	58%	0.577	S	S	*	*			trans	-61.8	105.9	178.2	0	0	0	0	0	107.8	A111 K115	A111-A113 PolarHBondContact O-N 3.1Å; A113-K115 PolarHBondContact O-N 3.39Å
114	V	74.9	Confident	67.9	Low	86 Å²	86	99 Å²	99	52%	0.521	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-66.1	120.6	177.4	179.6	0	0	0	0	107.1	V112	V112-V114 PolarHBondContact O-N 3.4Å
115	K	79.7	Confident	70.6	Confident	184 Å²	184	98.6 Å²	98.6	80%	0.8	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-58.8	123.5	176.6	-69.6	-175.7	179.6	-179.9	0	108.6	A113	A113-K115 PolarHBondContact O-N 3.39Å
116	P	78.7	Confident	73.2	Confident	69 Å²	69	94.5 Å²	94.5	45%	0.448	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-64.3	143.8	-178.1	26.3	-33.8	0	0	0	110.3	L373	P116-L373 HydrophobicContact CB-CD2 4.4Å; P116-L373 HydrophobicContact CG-CD2 4.47Å
117	I	84.6	Confident	75.8	Confident	72 Å²	72	91 Å²	91	37%	0.369	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-76.7	135	170.9	-63.4	173.5	0	0	0	107.2	H119 D368 K370	I117-H119 PolarHBondContact O-CD2 2.73Å; I117-H119 PolarHBondContact O-N 2.96Å; I117-D368 PolarHBondContact N-OD2 3.17Å; I117-K370 HydrophobicContact CD1-CD 3.85Å
118	W	87.6	Confident	78.3	Confident	100 Å²	100	86 Å²	86	38%	0.379	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-73.9	126.1	172.7	179.8	85.5	0	0	0	109	P120 A423 R425	W118-P120 HydrophobicContact CH2-CB 3.92Å; W118-P120 HydrophobicContact CZ3-CB 4.32Å; W118-A423 HydrophobicContact CH2-CB 4.41Å; W118-A423 VanDerWaalsContact CH2-O 3.24Å; W118-A423 WeakPolarHBondContact CH2-O 3.49Å; W118-A423 HydrophobicContact CZ2-CB 4.04Å; W118-R425 HydrophobicContact CB-CG 4.16Å; W118-R425 HydrophobicContact CD2-CB 4.2Å; W118-R425 HydrophobicContact CD2-CG 4.45Å; W118-R425 HydrophobicContact CG-CB 4.18Å; W118-R425 HydrophobicContact CG-CG 3.91Å
119	H	89.7	Confident	80.5	Confident	18 Å²	18	79.7 Å²	79.7	8%	0.083	44%	0.442	C	S	.	.			trans	-116.8	141.1	173.1	-65	-73.4	0	0	0	108.8	I117 D352 V354 D368 F375	I117-H119 PolarHBondContact O-CD2 2.73Å; I117-H119 PolarHBondContact O-N 2.96Å; H119-D352 PolarHBondContact CE1-O 2.87Å; H119-V354 HydrophobicContact CB-CG2 4.27Å; H119-V354 WeakPolarHBondContact ND1-CG2 3.43Å; H119-D368 IonicContact CD2-OD1 3.19Å; H119-D368 IonicContact CE1-OD1 3.99Å; H119-D368 IonicContact NE2-OD1 2.93Å; H119-D368 PolarHBondContact NE2-OD1 3.36Å; H119-F375 HydrophobicContact CB-CD1 4.4Å; H119-F375 HydrophobicContact CB-CD2 4.34Å; H119-F375 HydrophobicContact CB-CE1 3.96Å; H119-F375 HydrophobicContact CB-CE2 3.9Å; H119-F375 HydrophobicContact CB-CZ 3.68Å; H119-F375 AromaticContact CD2-CE1 3.96Å
120	P	90.8	Very high	82.8	Confident	22 Å²	22	71.5 Å²	71.5	14%	0.143	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-64.1	144.2	174.1	28	-34.3	0	0	0	110.5	W118 E419	W118-P120 HydrophobicContact CH2-CB 3.92Å; W118-P120 HydrophobicContact CZ3-CB 4.32Å; P120-E419 HydrophobicContact CB-CB 4.25Å; P120-E419 HydrophobicContact CG-CB 3.87Å; P120-E419 HydrophobicContact CG-CG 3.91Å; P120-E419 WeakPolarHBondContact CG-OE2 3.3Å
121	P	93	Very high	85.3	Confident	42 Å²	42	68 Å²	68	27%	0.273	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-70.3	146.9	176.5	29.8	-31.5	0	0	0	110.6	D420 A423	P121-D420 HydrophobicContact CG-CB 4.02Å; P121-D420 VanDerWaalsContact O-CB 3.25Å; P121-D420 WeakPolarHBondContact O-CB 3.37Å; P121-D420 PolarHBondContact O-N 2.96Å; P121-A423 HydrophobicContact CG-CB 3.78Å
122	W	94.4	Very high	87.3	Confident	2 Å²	2	68 Å²	68	1%	0.008	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.8	178.3	-71.3	74.2	0	0	0	110.6	F366 Q376 F398 G402 L405 F417 K418 E419	W122-F366 HydrophobicContact CB-CD1 4.29Å; W122-F366 HydrophobicContact CB-CE1 3.58Å; W122-F366 HydrophobicContact CB-CE2 4.18Å; W122-F366 HydrophobicContact CB-CZ 3.52Å; W122-F366 AromaticContact CD1-CD1 3.47Å; W122-F366 VanDerWaalsContact CD1-CD1 3.47Å; W122-F366 AromaticContact CD1-CE1 3.5Å; W122-F366 HydrophobicContact CD2-CD1 4.46Å; W122-F366 AromaticContact CD2-CE1 3.83Å; W122-F366 HydrophobicContact CD2-CE1 3.83Å; W122-F366 AromaticContact CG-CD1 3.8Å; W122-F366 HydrophobicContact CG-CD1 3.8Å; W122-F366 AromaticContact CG-CE1 3.3Å; W122-F366 HydrophobicContact CG-CE1 3.3Å; W122-F366 AromaticContact CG-CZ 3.83Å; W122-F366 HydrophobicContact CG-CZ 3.83Å; W122-F366 AromaticContact NE1-CD1 3.97Å; W122-Q376 PolarHBondContact O-NE2 2.66Å; W122-F398 HydrophobicContact CH2-CD1 4.11Å; W122-F398 AromaticContact CH2-CE1 3.54Å; W122-F398 HydrophobicContact CH2-CE1 3.54Å; W122-F398 AromaticContact CZ2-CE1 3.67Å; W122-F398 HydrophobicContact CZ2-CE1 3.67Å; W122-F398 HydrophobicContact CZ2-CZ 4.42Å; W122-F398 HydrophobicContact CZ3-CE1 4.19Å; W122-G402 WeakPolarHBondContact CH2-O 3.34Å; W122-L405 HydrophobicContact CE3-CB 3.97Å; W122-L405 HydrophobicContact CH2-CB 4.49Å; W122-L405 HydrophobicContact CZ3-CB 3.79Å; W122-F417 HydrophobicContact CB-CB 4.42Å; W122-F417 HydrophobicContact CE3-CB 3.85Å; W122-K418 WeakPolarHBondContact CA-O 3.44Å; W122-E419 HydrophobicContact CD2-CG 4.02Å; W122-E419 HydrophobicContact CE3-CG 4.34Å; W122-E419 HydrophobicContact CH2-CG 3.82Å; W122-E419 HydrophobicContact CZ2-CG 3.45Å; W122-E419 VanDerWaalsContact CZ2-CG 3.45Å; W122-E419 VanDerWaalsContact CZ2-OE1 3.29Å; W122-E419 WeakPolarHBondContact CZ2-OE1 3.39Å; W122-E419 HydrophobicContact CZ3-CG 4.25Å
123	K	93.8	Very high	89.1	Confident	105 Å²	105	62 Å²	62	46%	0.457	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.6	176.3	-70.8	-179.6	-179.2	167.8	0	110.8	Y125 F417 K418 D420	K123-Y125 PolarHBondContact O-N 3Å; K123-F417 CarbonylContact O-C 3.6Å; K123-F417 VanDerWaalsContact O-CA 3.24Å; K123-F417 WeakPolarHBondContact O-CA 3.38Å; K123-K418 PolarHBondContact N-O 2.84Å; K123-K418 PolarHBondContact O-N 3.31Å; K123-D420 HydrophobicContact CD-CB 3.89Å; K123-D420 WeakPolarHBondContact CE-OD2 3.35Å; K123-D420 HydrophobicContact CG-CB 4.16Å; K123-D420 IonicContact NZ-OD1 2.93Å; K123-D420 PolarHBondContact NZ-OD1 2.76Å; K123-D420 IonicContact NZ-OD2 2.63Å; K123-D420 PolarHBondContact NZ-OD2 2.81Å
124	L	94.8	Very high	90.5	Very high	63 Å²	63	63.3 Å²	63.3	33%	0.33	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	121.9	170.4	178.7	67.7	0	0	0	108.7	V127 K415 F417	L124-V127 HydrophobicContact CD1-CG2 4.12Å; L124-V127 HydrophobicContact CD2-CG2 3.85Å; L124-V127 HydrophobicContact CG-CG2 4.31Å; L124-K415 HydrophobicContact CD1-CB 3.66Å; L124-K415 HydrophobicContact CD1-CD 4.16Å; L124-K415 HydrophobicContact CD1-CG 4.28Å; L124-K415 HydrophobicContact CD2-CD 4.31Å; L124-F417 HydrophobicContact CB-CD1 4.04Å; L124-F417 HydrophobicContact CB-CE1 3.87Å; L124-F417 HydrophobicContact CD1-CD1 4.44Å; L124-F417 HydrophobicContact CD1-CE1 4.12Å; L124-F417 HydrophobicContact CD1-CE2 4.48Å; L124-F417 HydrophobicContact CD1-CZ 4.14Å
125	Y	93.8	Very high	91.5	Very high	81 Å²	81	59.2 Å²	59.2	32%	0.318	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-20.2	177.6	79.4	-88	0	0	0	113.2	K123 R404 M416 K418	K123-Y125 PolarHBondContact O-N 3Å; Y125-R404 PolarHBondContact OH-NH1 3.15Å; Y125-M416 HydrophobicContact CD1-CB 4.16Å; Y125-M416 WeakPolarHBondContact CD1-O 3.42Å; Y125-M416 HydrophobicContact CE1-CB 3.39Å; Y125-M416 WeakPolarHBondContact CE1-O 3.34Å; Y125-M416 HydrophobicContact CE2-CB 4.47Å; Y125-M416 PolarHBondContact N-O 3.45Å; Y125-M416 WeakPolarHBondContact OH-CE 3.36Å; Y125-M416 PolarHBondContact OH-SD 3.31Å; Y125-M416 VanDerWaalsContact OH-SD 3.33Å; Y125-K418 HydrophobicContact CD1-CB 3.72Å; Y125-K418 HydrophobicContact CE1-CB 4.12Å; Y125-K418 HydrophobicContact CG-CB 4.45Å
126	R	94.4	Very high	92.3	Very high	78 Å²	78	52.8 Å²	52.8	29%	0.294	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	139.3	-179.8	-173.7	174	-71.5	161.3	-4.2	111.7	I128 A162 S163 M416	R126-I128 HydrophobicContact CG-CG1 4.01Å; R126-A162 PolarHBondContact NH1-O 3.01Å; R126-S163 PolarHBondContact NH1-O 3.48Å; R126-M416 HydrophobicContact CB-CB 4.32Å; R126-M416 PolarHBondContact N-O 2.76Å; R126-M416 PolarHBondContact O-N 3.28Å
127	V	95.1	Very high	93.2	Very high	69 Å²	69	50.1 Å²	50.1	42%	0.418	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.6	168.8	-178.8	0	0	0	0	107.3	L124 T413 K415	L124-V127 HydrophobicContact CD1-CG2 4.12Å; L124-V127 HydrophobicContact CD2-CG2 3.85Å; L124-V127 HydrophobicContact CG-CG2 4.31Å; V127-T413 HydrophobicContact CG1-CG2 4Å; V127-K415 HydrophobicContact CG1-CG 4.34Å; V127-K415 HydrophobicContact CG2-CD 4.14Å; V127-K415 HydrophobicContact CG2-CG 4.17Å
128	I	95	Very high	93.8	Very high	11 Å²	11	47.2 Å²	47.2	6%	0.056	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117	177.2	-54.9	168.3	0	0	0	107.2	R126 F147 W159 T413 I414 M416	R126-I128 HydrophobicContact CG-CG1 4.01Å; I128-F147 HydrophobicContact CD1-CE1 4.5Å; I128-F147 HydrophobicContact CD1-CZ 3.94Å; I128-W159 HydrophobicContact CG2-CD2 4.32Å; I128-W159 HydrophobicContact CG2-CE3 3.71Å; I128-W159 HydrophobicContact CG2-CH2 3.89Å; I128-W159 HydrophobicContact CG2-CZ2 4.45Å; I128-W159 HydrophobicContact CG2-CZ3 3.47Å; I128-W159 VanDerWaalsContact CG2-CZ3 3.47Å; I128-T413 WeakPolarHBondContact O-CA 3.49Å; I128-I414 HydrophobicContact CB-CB 4.19Å; I128-I414 HydrophobicContact CG2-CD1 4.43Å; I128-I414 PolarHBondContact N-O 2.75Å; I128-I414 PolarHBondContact O-N 3.16Å; I128-M416 HydrophobicContact CD1-CG 4.5Å; I128-M416 HydrophobicContact CD1-SD 3.9Å
129	S	93.3	Very high	94.2	Very high	57 Å²	57	43.2 Å²	43.2	40%	0.399	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.8	172.8	-56.2	0	0	0	0	109.5	Q383	S129-Q383 PolarHBondContact OG-NE2 3.32Å; S129-Q383 PolarHBondContact OG-OE1 3.22Å
130	G	90.2	Very high	94.5	Very high	34 Å²	34	42.5 Å²	42.5	35%	0.351	22%	0.222	S	C	.	.			trans	169.3	-14.6	174.4	0	0	0	0	0	114.6	K157	G130-K157 PolarHBondContact O-NZ 3.15Å
131	H	94.3	Very high	94.7	Very high	12 Å²	12	42.3 Å²	42.3	6%	0.056	22%	0.22	C	C	.	.			trans	-75.9	149.5	164.5	-73.9	-72.7	0	0	0	110.2	I135 T149 A151 D153 K157 W159	H131-I135 HydrophobicContact CB-CD1 4.5Å; H131-I135 HydrophobicContact CB-CG1 4.19Å; H131-T149 PolarHBondContact NE2-OG1 3.36Å; H131-A151 HydrophobicContact CB-CB 4.14Å; H131-A151 VanDerWaalsContact ND1-CB 3.31Å; H131-A151 WeakPolarHBondContact ND1-CB 3.32Å; H131-D153 WeakPolarHBondContact CB-OD2 3.29Å; H131-D153 IonicContact ND1-OD2 3.91Å; H131-K157 VanDerWaalsContact CE1-CD 3.47Å; H131-K157 WeakPolarHBondContact CE1-CD 3.19Å; H131-K157 VanDerWaalsContact CE1-CG 3.44Å; H131-K157 WeakPolarHBondContact CE1-CG 2.87Å; H131-W159 AromaticContact NE2-NE1 3.91Å
132	T	93.6	Very high	94.7	Very high	100 Å²	100	42.6 Å²	42.6	61%	0.613	22%	0.221	S	C	*	.	S	Bend	trans	-94.5	-2.3	175.4	52.7	0	0	0	0	112.8	D153 K412	T132-D153 WeakPolarHBondContact CA-OD1 3.42Å; T132-D153 WeakPolarHBondContact CA-OD2 3.39Å; T132-D153 WeakPolarHBondContact CB-OD1 3.19Å; T132-D153 PolarHBondContact N-OD2 2.97Å; T132-D153 PolarHBondContact OG1-OD1 3.37Å; T132-D153 PolarHBondContact OG1-OD2 3.31Å; T132-D153 VanDerWaalsContact OG1-OD2 3.11Å; T132-K412 WeakPolarHBondContact O-CD 3.45Å; T132-K412 WeakPolarHBondContact O-CE 3.17Å; T132-K412 PolarHBondContact O-NZ 3.44Å
133	G	93.7	Very high	94.7	Very high	8 Å²	8	44 Å²	44	8%	0.082	24%	0.237	C	C	.	.	S	Bend	trans	-153.2	174.3	-173.2	0	0	0	0	0	112.3	I135 D153	G133-I135 PolarHBondContact O-N 3.11Å; G133-D153 WeakPolarHBondContact CA-OD1 3.23Å; G133-D153 PolarHBondContact N-OD1 3.18Å; G133-D153 PolarHBondContact N-OD2 3.09Å
134	W	95.3	Very high	94.6	Very high	116 Å²	116	41.2 Å²	41.2	44%	0.439	23%	0.227	S	C	.	.			trans	-59.6	128.6	-172.2	-57.2	-16	0	0	0	112	R136 A151 A152 F394	W134-R136 PolarHBondContact O-N 2.83Å; W134-A151 CarbonylContact O-C 3.6Å; W134-A151 VanDerWaalsContact O-CA 3.24Å; W134-A151 WeakPolarHBondContact O-CA 3.24Å; W134-A152 HydrophobicContact CB-CB 4.23Å; W134-A152 PolarHBondContact O-N 3.2Å; W134-F394 HydrophobicContact CB-CD2 4.16Å; W134-F394 HydrophobicContact CB-CE2 3.73Å; W134-F394 HydrophobicContact CD2-CE2 4.08Å; W134-F394 HydrophobicContact CD2-CZ 4.39Å; W134-F394 HydrophobicContact CE3-CE2 4.14Å; W134-F394 HydrophobicContact CE3-CZ 4.12Å; W134-F394 AromaticContact CG-CE2 3.93Å; W134-F394 HydrophobicContact CG-CE2 3.93Å
135	I	96.6	Very high	94.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	119.5	176.7	-65.4	149.4	0	0	0	107.8	H131 G133 I138 A151 F394 E409 T413 I414	H131-I135 HydrophobicContact CB-CD1 4.5Å; H131-I135 HydrophobicContact CB-CG1 4.19Å; G133-I135 PolarHBondContact O-N 3.11Å; I135-I138 HydrophobicContact CG2-CD1 4.26Å; I135-I138 HydrophobicContact CG2-CG1 4.02Å; I135-A151 HydrophobicContact CG1-CB 4.38Å; I135-F394 VanDerWaalsContact O-CB 3.27Å; I135-F394 WeakPolarHBondContact O-CB 3.24Å; I135-F394 WeakPolarHBondContact O-CD2 3.26Å; I135-E409 PolarHBondContact N-O 2.94Å; I135-T413 WeakPolarHBondContact CD1-O 3.21Å; I135-I414 HydrophobicContact CD1-CD1 4.49Å; I135-I414 HydrophobicContact CD1-CG1 3.55Å
136	R	96.7	Very high	94.7	Very high	50 Å²	50	39.7 Å²	39.7	19%	0.189	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-26.8	-172.6	-55	-56.3	-59.1	-76.5	3.4	113.3	W134 G150 V177 R178 E194	W134-R136 PolarHBondContact O-N 2.83Å; R136-G150 PolarHBondContact N-O 3.45Å; R136-V177 WeakPolarHBondContact CB-O 3.15Å; R136-R178 VanDerWaalsContact NH1-CD 3.29Å; R136-R178 VanDerWaalsContact NH1-NE 3.18Å; R136-R178 VanDerWaalsContact NH2-NH2 3.19Å; R136-E194 IonicContact NH1-OE1 3.76Å
137	C	96.5	Very high	94.9	Very high	12 Å²	12	36 Å²	36	8%	0.081	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	150	-177.5	52.8	0	0	0	0	111.4	T149 G150 R178 A179	C137-T149 WeakPolarHBondContact O-CA 3.5Å; C137-G150 PolarHBondContact N-O 2.71Å; C137-G150 PolarHBondContact O-N 2.87Å; C137-G150 VanDerWaalsContact SG-CA 3.53Å; C137-R178 WeakPolarHBondContact CB-O 3.09Å; C137-A179 VanDerWaalsContact SG-C 3.55Å
138	I	96.8	Very high	94.9	Very high	11 Å²	11	32.7 Å²	32.7	6%	0.056	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139.6	176	-54.4	-170.3	0	0	0	107.7	I135 F147 C148 T149 A395 T397 I406 S407 G408 I414	I135-I138 HydrophobicContact CG2-CD1 4.26Å; I135-I138 HydrophobicContact CG2-CG1 4.02Å; I138-F147 HydrophobicContact CG2-CD2 4.14Å; I138-C148 VanDerWaalsContact CA-O 3.32Å; I138-C148 WeakPolarHBondContact CA-O 3.41Å; I138-T149 HydrophobicContact CD1-CG2 4.27Å; I138-T149 HydrophobicContact CG1-CG2 3.97Å; I138-T149 HydrophobicContact CG2-CG2 4.26Å; I138-A395 HydrophobicContact CB-CB 4.45Å; I138-A395 HydrophobicContact CG1-CB 3.97Å; I138-T397 HydrophobicContact CB-CG2 4.01Å; I138-T397 HydrophobicContact CG2-CG2 3.51Å; I138-I406 HydrophobicContact CD1-CG2 3.85Å; I138-I406 HydrophobicContact CG2-CB 4.41Å; I138-I406 HydrophobicContact CG2-CG2 3.99Å; I138-S407 VanDerWaalsContact CD1-C 3.47Å; I138-G408 VanDerWaalsContact CD1-CA 3.47Å; I138-I414 HydrophobicContact CD1-CG2 4.29Å
139	D	96.9	Very high	95	Very high	16 Å²	16	32.2 Å²	32.2	9%	0.086	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	145.6	171.2	-156.4	52.1	0	0	0	110.8	F147 C148 V180 K181 V182	D139-F147 CarbonylContact O-C 3.49Å; D139-F147 WeakPolarHBondContact O-CA 3.44Å; D139-F147 WeakPolarHBondContact O-CB 3.42Å; D139-C148 PolarHBondContact N-O 2.92Å; D139-C148 PolarHBondContact O-N 2.8Å; D139-V180 WeakPolarHBondContact CB-O 3.31Å; D139-K181 HydrophobicContact CB-CD 4.5Å; D139-K181 WeakPolarHBondContact OD1-CD 3.46Å; D139-K181 IonicContact OD1-NZ 2.98Å; D139-K181 PolarHBondContact OD1-NZ 3.36Å; D139-K181 VanDerWaalsContact OD2-CA 3.31Å; D139-K181 WeakPolarHBondContact OD2-CA 3.29Å; D139-V182 PolarHBondContact OD2-N 3.41Å
140	V	96.3	Very high	95.2	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.018	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.2	-175.2	-178.8	0	0	0	0	109.6	F147 L161 T397 D399 Q400 I406	V140-F147 HydrophobicContact CB-CB 4.47Å; V140-F147 HydrophobicContact CG2-CB 4.05Å; V140-L161 HydrophobicContact CG1-CD1 3.81Å; V140-T397 HydrophobicContact CG2-CG2 3.78Å; V140-D399 HydrophobicContact CG1-CB 4.36Å; V140-Q400 HydrophobicContact CG1-CG 4.5Å; V140-Q400 PolarHBondContact O-NE2 2.79Å; V140-I406 HydrophobicContact CG2-CD1 3.85Å
141	E	95.3	Very high	95.5	Very high	19 Å²	19	27.9 Å²	27.9	9%	0.089	15%	0.148	C	C	.	.			trans	-62.1	140.2	176	-173.1	-84.8	140	0	0	110.5	K25 G143 N144 Q145 W146	K25-E141 IonicContact NZ-OE1 3.78Å; K25-E141 PolarHBondContact NZ-OE1 2.97Å; E141-G143 PolarHBondContact O-N 3.17Å; E141-G143 PolarHBondContact OE1-N 2.83Å; E141-G143 WeakPolarHBondContact OE2-CA 3.43Å; E141-G143 PolarHBondContact OE2-N 2.97Å; E141-N144 PolarHBondContact O-N 2.8Å; E141-N144 PolarHBondContact OE2-N 2.87Å; E141-Q145 PolarHBondContact OE2-N 2.87Å; E141-W146 HydrophobicContact CB-CD2 3.74Å; E141-W146 HydrophobicContact CB-CE3 3.85Å; E141-W146 HydrophobicContact CB-CG 4.3Å; E141-W146 HydrophobicContact CB-CH2 4.01Å; E141-W146 HydrophobicContact CB-CZ2 3.92Å; E141-W146 HydrophobicContact CB-CZ3 3.95Å; E141-W146 VanDerWaalsContact CB-O 3.22Å; E141-W146 WeakPolarHBondContact CB-O 3.42Å; E141-W146 HydrophobicContact CG-CD2 4.01Å; E141-W146 VanDerWaalsContact CG-CE2 3.46Å; E141-W146 HydrophobicContact CG-CE3 4.44Å; E141-W146 HydrophobicContact CG-CH2 3.94Å; E141-W146 HydrophobicContact CG-CZ2 3.45Å; E141-W146 VanDerWaalsContact CG-CZ2 3.45Å; E141-W146 HydrophobicContact CG-CZ3 4.38Å; E141-W146 PolarHBondContact N-O 3.02Å; E141-W146 VanDerWaalsContact N-O 3.09Å
142	P	92.4	Very high	95.6	Very high	48 Å²	48	28.7 Å²	28.7	31%	0.312	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-19.7	-176.9	22.1	-38.3	0	0	0	115.6	P184	P142-P184 HydrophobicContact CB-CB 4.46Å
143	G	93.2	Very high	95.7	Very high	32 Å²	32	25.1 Å²	25.1	33%	0.33	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	7.6	175.3	0	0	0	0	0	115.2	E141 Q145	E141-G143 PolarHBondContact O-N 3.17Å; E141-G143 PolarHBondContact OE1-N 2.83Å; E141-G143 WeakPolarHBondContact OE2-CA 3.43Å; E141-G143 PolarHBondContact OE2-N 2.97Å; G143-Q145 PolarHBondContact O-N 2.89Å; G143-Q145 VanDerWaalsContact O-N 3.08Å
144	N	93.4	Very high	95.8	Very high	45 Å²	45	31.4 Å²	31.4	24%	0.241	16%	0.156	C	C	.	.	S	Bend	trans	55.9	20.9	178.2	-70.9	-22.6	0	0	0	115.5	E141 L161 Q400 S401	E141-N144 PolarHBondContact O-N 2.8Å; E141-N144 PolarHBondContact OE2-N 2.87Å; N144-L161 HydrophobicContact CB-CD1 4.45Å; N144-Q400 WeakPolarHBondContact OD1-CB 3.43Å; N144-Q400 WeakPolarHBondContact OD1-CG 3.31Å; N144-Q400 PolarHBondContact OD1-N 2.78Å; N144-S401 PolarHBondContact ND2-N 3.43Å
145	Q	94.7	Very high	95.8	Very high	104 Å²	104	27.9 Å²	27.9	49%	0.486	15%	0.145	S	C	.	.	S	Bend	trans	-83.6	-34.8	178.8	-65.7	-169.5	-6.4	0	0	112.4	E141 G143 L161	E141-Q145 PolarHBondContact OE2-N 2.87Å; G143-Q145 PolarHBondContact O-N 2.89Å; G143-Q145 VanDerWaalsContact O-N 3.08Å; Q145-L161 PolarHBondContact O-N 3.02Å; Q145-L161 VanDerWaalsContact O-N 3.13Å
146	W	95.7	Very high	95.8	Very high	9 Å²	9	28 Å²	28	3%	0.034	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	164.4	-177.5	53.6	-93.2	0	0	0	110.3	E141 C148 I158 W159 K167 V182 L203	E141-W146 HydrophobicContact CB-CD2 3.74Å; E141-W146 HydrophobicContact CB-CE3 3.85Å; E141-W146 HydrophobicContact CB-CG 4.3Å; E141-W146 HydrophobicContact CB-CH2 4.01Å; E141-W146 HydrophobicContact CB-CZ2 3.92Å; E141-W146 HydrophobicContact CB-CZ3 3.95Å; E141-W146 VanDerWaalsContact CB-O 3.22Å; E141-W146 WeakPolarHBondContact CB-O 3.42Å; E141-W146 HydrophobicContact CG-CD2 4.01Å; E141-W146 VanDerWaalsContact CG-CE2 3.46Å; E141-W146 HydrophobicContact CG-CE3 4.44Å; E141-W146 HydrophobicContact CG-CH2 3.94Å; E141-W146 HydrophobicContact CG-CZ2 3.45Å; E141-W146 VanDerWaalsContact CG-CZ2 3.45Å; E141-W146 HydrophobicContact CG-CZ3 4.38Å; E141-W146 PolarHBondContact N-O 3.02Å; E141-W146 VanDerWaalsContact N-O 3.09Å; W146-C148 WeakPolarHBondContact CZ3-SG 3.37Å; W146-I158 HydrophobicContact CB-CG2 3.97Å; W146-I158 HydrophobicContact CD2-CG2 3.81Å; W146-I158 HydrophobicContact CE3-CG2 3.63Å; W146-I158 HydrophobicContact CG-CG2 4.01Å; W146-I158 HydrophobicContact CZ3-CG2 4.44Å; W146-W159 CarbonylContact C-O 3.57Å; W146-W159 WeakPolarHBondContact CA-O 3.21Å; W146-W159 WeakPolarHBondContact CB-O 3Å; W146-K167 HydrophobicContact CB-CD 4.32Å; W146-V182 HydrophobicContact CH2-CG1 4.01Å; W146-V182 HydrophobicContact CH2-CG2 3.79Å; W146-V182 HydrophobicContact CZ3-CG2 3.72Å; W146-L203 HydrophobicContact CH2-CD1 3.7Å; W146-L203 HydrophobicContact CH2-CD2 4.15Å; W146-L203 HydrophobicContact CZ2-CD1 3.8Å; W146-L203 HydrophobicContact CZ2-CD2 4.46Å
147	F	97.1	Very high	95.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	154.2	174	67.9	-85.9	0	0	0	109.5	I128 I138 D139 V140 T149 W159 L161 I406 I414 M416	I128-F147 HydrophobicContact CD1-CE1 4.5Å; I128-F147 HydrophobicContact CD1-CZ 3.94Å; I138-F147 HydrophobicContact CG2-CD2 4.14Å; D139-F147 CarbonylContact O-C 3.49Å; D139-F147 WeakPolarHBondContact O-CA 3.44Å; D139-F147 WeakPolarHBondContact O-CB 3.42Å; V140-F147 HydrophobicContact CB-CB 4.47Å; V140-F147 HydrophobicContact CG2-CB 4.05Å; F147-T149 HydrophobicContact CD2-CG2 3.89Å; F147-T149 HydrophobicContact CE2-CG2 3.73Å; F147-W159 HydrophobicContact CD1-CB 3.98Å; F147-W159 HydrophobicContact CD2-CB 4.3Å; F147-W159 HydrophobicContact CE1-CB 3.46Å; F147-W159 VanDerWaalsContact CE1-CB 3.46Å; F147-W159 HydrophobicContact CE1-CG 4.34Å; F147-W159 HydrophobicContact CE2-CB 3.82Å; F147-W159 AromaticContact CE2-CD1 3.6Å; F147-W159 AromaticContact CE2-CG 3.89Å; F147-W159 HydrophobicContact CE2-CG 3.89Å; F147-W159 HydrophobicContact CG-CB 4.38Å; F147-W159 HydrophobicContact CZ-CB 3.37Å; F147-W159 AromaticContact CZ-CD1 3.97Å; F147-W159 AromaticContact CZ-CG 3.76Å; F147-W159 HydrophobicContact CZ-CG 3.76Å; F147-W159 PolarHBondContact N-O 2.71Å; F147-W159 PolarHBondContact O-N 2.86Å; F147-L161 HydrophobicContact CD1-CB 4.07Å; F147-L161 HydrophobicContact CD1-CG 4.36Å; F147-I406 HydrophobicContact CB-CD1 4.27Å; F147-I406 HydrophobicContact CD1-CD1 4.09Å; F147-I406 HydrophobicContact CD2-CD1 4.25Å; F147-I406 HydrophobicContact CD2-CG2 4.42Å; F147-I406 HydrophobicContact CE1-CD1 4.49Å; F147-I406 HydrophobicContact CE2-CG2 4.17Å; F147-I406 HydrophobicContact CG-CD1 3.95Å; F147-I414 HydrophobicContact CE2-CD1 4.1Å; F147-I414 HydrophobicContact CE2-CG2 4.02Å; F147-I414 HydrophobicContact CZ-CG2 4.27Å; F147-M416 HydrophobicContact CE1-CE 4.39Å
148	C	96.5	Very high	95.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	150	-179.9	-75.3	0	0	0	0	110.8	I138 D139 W146 I156 K157 V180 L189	I138-C148 VanDerWaalsContact CA-O 3.32Å; I138-C148 WeakPolarHBondContact CA-O 3.41Å; D139-C148 PolarHBondContact N-O 2.92Å; D139-C148 PolarHBondContact O-N 2.8Å; W146-C148 WeakPolarHBondContact CZ3-SG 3.37Å; C148-I156 HydrophobicContact CB-CG2 4.44Å; C148-K157 CarbonylContact C-O 2.88Å; C148-K157 WeakPolarHBondContact CA-O 3.22Å; C148-V180 HydrophobicContact CB-CG1 3.84Å; C148-L189 HydrophobicContact CB-CD1 4.06Å; C148-L189 WeakPolarHBondContact SG-CD1 2.95Å
149	T	97.5	Very high	95.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	133.6	175.7	54.4	0	0	0	0	109.2	H131 C137 I138 F147 I156 K157 W159 I414	H131-T149 PolarHBondContact NE2-OG1 3.36Å; C137-T149 WeakPolarHBondContact O-CA 3.5Å; I138-T149 HydrophobicContact CD1-CG2 4.27Å; I138-T149 HydrophobicContact CG1-CG2 3.97Å; I138-T149 HydrophobicContact CG2-CG2 4.26Å; F147-T149 HydrophobicContact CD2-CG2 3.89Å; F147-T149 HydrophobicContact CE2-CG2 3.73Å; T149-I156 CarbonylContact O-C 3.55Å; T149-I156 VanDerWaalsContact O-CA 3.31Å; T149-I156 WeakPolarHBondContact O-CA 3.22Å; T149-K157 PolarHBondContact N-O 2.76Å; T149-K157 PolarHBondContact O-N 3.32Å; T149-K157 PolarHBondContact OG1-O 2.81Å; T149-W159 PolarHBondContact OG1-NE1 3.08Å; T149-I414 HydrophobicContact CG2-CD1 3.62Å; T149-I414 HydrophobicContact CG2-CG1 4.1Å
150	G	96.6	Very high	95.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.4	171.3	0	0	0	0	0	109.9	R136 C137	R136-G150 PolarHBondContact N-O 3.45Å; C137-G150 PolarHBondContact N-O 2.71Å; C137-G150 PolarHBondContact O-N 2.87Å; C137-G150 VanDerWaalsContact SG-CA 3.53Å
151	A	96.6	Very high	95.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	170.4	-177.2	0	0	0	0	0	112.8	H131 W134 I135 D153 R154 I155 V177	H131-A151 HydrophobicContact CB-CB 4.14Å; H131-A151 VanDerWaalsContact ND1-CB 3.31Å; H131-A151 WeakPolarHBondContact ND1-CB 3.32Å; W134-A151 CarbonylContact O-C 3.6Å; W134-A151 VanDerWaalsContact O-CA 3.24Å; W134-A151 WeakPolarHBondContact O-CA 3.24Å; I135-A151 HydrophobicContact CG1-CB 4.38Å; A151-D153 HydrophobicContact CB-CB 4.42Å; A151-D153 PolarHBondContact O-N 3.5Å; A151-D153 VanDerWaalsContact O-N 3.16Å; A151-R154 PolarHBondContact O-N 3.09Å; A151-I155 PolarHBondContact N-O 2.92Å; A151-V177 PolarHBondContact O-N 3.38Å
152	A	96.2	Very high	95.7	Very high	30 Å²	30	29.2 Å²	29.2	25%	0.248	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.2	171.6	0	0	0	0	0	113.1	W134 R154 T176	W134-A152 HydrophobicContact CB-CB 4.23Å; W134-A152 PolarHBondContact O-N 3.2Å; A152-R154 PolarHBondContact O-N 3.06Å; A152-R154 VanDerWaalsContact O-N 3.15Å; A152-T176 HydrophobicContact CB-CG2 3.84Å
153	D	95.1	Very high	95.7	Very high	24 Å²	24	29.1 Å²	29.1	13%	0.128	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-4.2	176.4	-54.5	-37.6	0	0	0	114.5	H131 T132 G133 A151 I155	H131-D153 WeakPolarHBondContact CB-OD2 3.29Å; H131-D153 IonicContact ND1-OD2 3.91Å; T132-D153 WeakPolarHBondContact CA-OD1 3.42Å; T132-D153 WeakPolarHBondContact CA-OD2 3.39Å; T132-D153 WeakPolarHBondContact CB-OD1 3.19Å; T132-D153 PolarHBondContact N-OD2 2.97Å; T132-D153 PolarHBondContact OG1-OD1 3.37Å; T132-D153 PolarHBondContact OG1-OD2 3.31Å; T132-D153 VanDerWaalsContact OG1-OD2 3.11Å; G133-D153 WeakPolarHBondContact CA-OD1 3.23Å; G133-D153 PolarHBondContact N-OD1 3.18Å; G133-D153 PolarHBondContact N-OD2 3.09Å; A151-D153 HydrophobicContact CB-CB 4.42Å; A151-D153 PolarHBondContact O-N 3.5Å; A151-D153 VanDerWaalsContact O-N 3.16Å; D153-I155 HydrophobicContact CB-CD1 4.48Å; D153-I155 HydrophobicContact CB-CG1 4.32Å; D153-I155 PolarHBondContact O-N 2.9Å
154	R	95.8	Very high	95.6	Very high	141 Å²	141	28 Å²	28	53%	0.532	15%	0.152	S	C	.	.	S	Bend	trans	71.9	10.2	-176.4	-37.8	168.6	-77.5	-177.2	-2	113.6	A151 A152 H173 V174 S175	A151-R154 PolarHBondContact O-N 3.09Å; A152-R154 PolarHBondContact O-N 3.06Å; A152-R154 VanDerWaalsContact O-N 3.15Å; R154-H173 WeakPolarHBondContact CB-O 3.36Å; R154-V174 WeakPolarHBondContact CD-O 2.97Å; R154-S175 WeakPolarHBondContact CA-O 3.48Å; R154-S175 WeakPolarHBondContact CB-O 3.47Å; R154-S175 WeakPolarHBondContact CG-O 3.2Å
155	I	96.7	Very high	95.7	Very high	42 Å²	42	33 Å²	33	22%	0.215	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	138.5	-177.5	-53.7	176.7	0	0	0	109.2	A151 D153 K157 T171	A151-I155 PolarHBondContact N-O 2.92Å; D153-I155 HydrophobicContact CB-CD1 4.48Å; D153-I155 HydrophobicContact CB-CG1 4.32Å; D153-I155 PolarHBondContact O-N 2.9Å; I155-K157 HydrophobicContact CG2-CG 3.92Å; I155-T171 HydrophobicContact CG1-CG2 4.29Å
156	I	97.2	Very high	95.8	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.8	167.2	-58.1	164.4	0	0	0	107.3	C148 T149 L170 V177 V180 L189 W201	C148-I156 HydrophobicContact CB-CG2 4.44Å; T149-I156 CarbonylContact O-C 3.55Å; T149-I156 VanDerWaalsContact O-CA 3.31Å; T149-I156 WeakPolarHBondContact O-CA 3.22Å; I156-L170 HydrophobicContact CB-CB 4.15Å; I156-L170 PolarHBondContact N-O 3.09Å; I156-L170 PolarHBondContact O-N 2.99Å; I156-V177 HydrophobicContact CD1-CG1 4.28Å; I156-V177 HydrophobicContact CG1-CB 4.49Å; I156-V177 HydrophobicContact CG1-CG1 4Å; I156-V177 HydrophobicContact CG1-CG2 4.05Å; I156-V180 HydrophobicContact CD1-CG2 4.16Å; I156-V180 HydrophobicContact CG1-CG2 4.12Å; I156-V180 HydrophobicContact CG2-CG2 4.23Å; I156-L189 HydrophobicContact CD1-CD2 4.24Å; I156-L189 HydrophobicContact CG2-CD1 4.46Å; I156-W201 HydrophobicContact CD1-CZ2 4.25Å
157	K	97.1	Very high	95.7	Very high	24 Å²	24	34.4 Å²	34.4	10%	0.104	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.7	178.7	-68	-171.1	-175.7	-167.8	0	110.3	G130 H131 C148 T149 I155 W159 L166	G130-K157 PolarHBondContact O-NZ 3.15Å; H131-K157 VanDerWaalsContact CE1-CD 3.47Å; H131-K157 WeakPolarHBondContact CE1-CD 3.19Å; H131-K157 VanDerWaalsContact CE1-CG 3.44Å; H131-K157 WeakPolarHBondContact CE1-CG 2.87Å; C148-K157 CarbonylContact C-O 2.88Å; C148-K157 WeakPolarHBondContact CA-O 3.22Å; T149-K157 PolarHBondContact N-O 2.76Å; T149-K157 PolarHBondContact O-N 3.32Å; T149-K157 PolarHBondContact OG1-O 2.81Å; I155-K157 HydrophobicContact CG2-CG 3.92Å; K157-W159 HydrophobicContact CB-CZ2 3.91Å; K157-W159 HydrophobicContact CD-CH2 4.25Å; K157-W159 HydrophobicContact CD-CZ2 3.63Å; K157-W159 HydrophobicContact CG-CZ2 4.4Å; K157-L166 HydrophobicContact CB-CD1 3.69Å; K157-L166 HydrophobicContact CD-CD1 3.8Å; K157-L166 HydrophobicContact CG-CD1 3.92Å
158	I	96.8	Very high	95.6	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.015	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.6	173.2	-49	-166.9	0	0	0	108	W146 K167 L168 L170 L203	W146-I158 HydrophobicContact CB-CG2 3.97Å; W146-I158 HydrophobicContact CD2-CG2 3.81Å; W146-I158 HydrophobicContact CE3-CG2 3.63Å; W146-I158 HydrophobicContact CG-CG2 4.01Å; W146-I158 HydrophobicContact CZ3-CG2 4.44Å; I158-K167 HydrophobicContact CG2-CB 4.48Å; I158-K167 PolarHBondContact O-N 3.43Å; I158-L168 HydrophobicContact CB-CB 4.09Å; I158-L168 HydrophobicContact CD1-CB 4.21Å; I158-L168 HydrophobicContact CD1-CD2 3.97Å; I158-L168 HydrophobicContact CG1-CB 4.15Å; I158-L168 PolarHBondContact N-O 3.26Å; I158-L168 PolarHBondContact O-N 3.34Å; I158-L170 HydrophobicContact CD1-CD1 4.19Å; I158-L203 HydrophobicContact CD1-CD2 4.35Å
159	W	96.9	Very high	95.5	Very high	8 Å²	8	39.2 Å²	39.2	3%	0.03	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	144.7	-177.7	-55.8	92.7	0	0	0	110.2	I128 H131 W146 F147 T149 K157 K165 L166 I414	I128-W159 HydrophobicContact CG2-CD2 4.32Å; I128-W159 HydrophobicContact CG2-CE3 3.71Å; I128-W159 HydrophobicContact CG2-CH2 3.89Å; I128-W159 HydrophobicContact CG2-CZ2 4.45Å; I128-W159 HydrophobicContact CG2-CZ3 3.47Å; I128-W159 VanDerWaalsContact CG2-CZ3 3.47Å; H131-W159 AromaticContact NE2-NE1 3.91Å; W146-W159 CarbonylContact C-O 3.57Å; W146-W159 WeakPolarHBondContact CA-O 3.21Å; W146-W159 WeakPolarHBondContact CB-O 3Å; F147-W159 HydrophobicContact CD1-CB 3.98Å; F147-W159 HydrophobicContact CD2-CB 4.3Å; F147-W159 HydrophobicContact CE1-CB 3.46Å; F147-W159 VanDerWaalsContact CE1-CB 3.46Å; F147-W159 HydrophobicContact CE1-CG 4.34Å; F147-W159 HydrophobicContact CE2-CB 3.82Å; F147-W159 AromaticContact CE2-CD1 3.6Å; F147-W159 AromaticContact CE2-CG 3.89Å; F147-W159 HydrophobicContact CE2-CG 3.89Å; F147-W159 HydrophobicContact CG-CB 4.38Å; F147-W159 HydrophobicContact CZ-CB 3.37Å; F147-W159 AromaticContact CZ-CD1 3.97Å; F147-W159 AromaticContact CZ-CG 3.76Å; F147-W159 HydrophobicContact CZ-CG 3.76Å; F147-W159 PolarHBondContact N-O 2.71Å; F147-W159 PolarHBondContact O-N 2.86Å; T149-W159 PolarHBondContact OG1-NE1 3.08Å; K157-W159 HydrophobicContact CB-CZ2 3.91Å; K157-W159 HydrophobicContact CD-CH2 4.25Å; K157-W159 HydrophobicContact CD-CZ2 3.63Å; K157-W159 HydrophobicContact CG-CZ2 4.4Å; W159-K165 WeakPolarHBondContact CA-O 3.28Å; W159-L166 HydrophobicContact CD2-CD1 4.07Å; W159-L166 HydrophobicContact CE3-CB 3.86Å; W159-L166 HydrophobicContact CE3-CD1 4.04Å; W159-L166 HydrophobicContact CH2-CB 4.25Å; W159-L166 HydrophobicContact CH2-CD1 3.94Å; W159-L166 HydrophobicContact CZ2-CD1 3.97Å; W159-L166 HydrophobicContact CZ3-CB 3.61Å; W159-L166 HydrophobicContact CZ3-CD1 3.97Å; W159-L166 HydrophobicContact CZ3-CG 4.36Å; W159-I414 HydrophobicContact CD2-CD1 4.24Å; W159-I414 HydrophobicContact CG-CD1 4.4Å; W159-I414 HydrophobicContact CZ2-CD1 3.98Å
160	D	96.3	Very high	95.4	Very high	31 Å²	31	39.6 Å²	39.6	17%	0.166	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	125.9	169.6	-170.8	46	0	0	0	110.5	S163 G164 K165 K167	D160-S163 WeakPolarHBondContact CB-OG 3.4Å; D160-S163 VanDerWaalsContact OD2-CB 3.24Å; D160-S163 WeakPolarHBondContact OD2-CB 3.41Å; D160-S163 PolarHBondContact OD2-N 2.9Å; D160-S163 VanDerWaalsContact OD2-N 3.11Å; D160-S163 PolarHBondContact OD2-OG 3.33Å; D160-G164 WeakPolarHBondContact O-CA 3.27Å; D160-G164 PolarHBondContact O-N 2.89Å; D160-K165 PolarHBondContact N-O 2.99Å; D160-K167 HydrophobicContact CB-CD 3.81Å; D160-K167 HydrophobicContact CB-CG 4.14Å; D160-K167 VanDerWaalsContact OD1-CE 3.26Å; D160-K167 WeakPolarHBondContact OD1-CE 3.45Å; D160-K167 IonicContact OD1-NZ 2.71Å; D160-K167 PolarHBondContact OD1-NZ 2.93Å
161	L	94.2	Very high	95.3	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.042	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-37.8	-174.1	-171.7	152.2	0	0	0	111.6	V140 N144 Q145 F147 D399 M416	V140-L161 HydrophobicContact CG1-CD1 3.81Å; N144-L161 HydrophobicContact CB-CD1 4.45Å; Q145-L161 PolarHBondContact O-N 3.02Å; Q145-L161 VanDerWaalsContact O-N 3.13Å; F147-L161 HydrophobicContact CD1-CB 4.07Å; F147-L161 HydrophobicContact CD1-CG 4.36Å; L161-D399 HydrophobicContact CD1-CB 4.11Å; L161-M416 HydrophobicContact CG-CE 4.5Å
162	A	93.4	Very high	95.1	Very high	63 Å²	63	46.1 Å²	46.1	52%	0.521	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-51.5	-179.3	0	0	0	0	0	112.5	R126	R126-A162 PolarHBondContact NH1-O 3.01Å
163	S	93.1	Very high	95.1	Very high	46 Å²	46	45.3 Å²	45.3	32%	0.322	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-20.9	-176.4	69.2	0	0	0	0	114.7	R126 D160 K165	R126-S163 PolarHBondContact NH1-O 3.48Å; D160-S163 WeakPolarHBondContact CB-OG 3.4Å; D160-S163 VanDerWaalsContact OD2-CB 3.24Å; D160-S163 WeakPolarHBondContact OD2-CB 3.41Å; D160-S163 PolarHBondContact OD2-N 2.9Å; D160-S163 VanDerWaalsContact OD2-N 3.11Å; D160-S163 PolarHBondContact OD2-OG 3.33Å; S163-K165 PolarHBondContact O-N 3.31Å; S163-K165 PolarHBondContact OG-N 2.85Å
164	G	91.9	Very high	95.1	Very high	9 Å²	9	48.9 Å²	48.9	9%	0.093	27%	0.271	C	S	.	.			trans	73.4	10.6	-173	0	0	0	0	0	114	D160	D160-G164 WeakPolarHBondContact O-CA 3.27Å; D160-G164 PolarHBondContact O-N 2.89Å
165	K	95	Very high	95.1	Very high	149 Å²	149	43.5 Å²	43.5	65%	0.648	26%	0.255	S	S	*	.			trans	-83.5	145.7	-178.9	-67.1	-178.4	178.6	179.4	0	111.8	W159 D160 S163 K167	W159-K165 WeakPolarHBondContact CA-O 3.28Å; D160-K165 PolarHBondContact N-O 2.99Å; S163-K165 PolarHBondContact O-N 3.31Å; S163-K165 PolarHBondContact OG-N 2.85Å; K165-K167 PolarHBondContact O-N 3.44Å
166	L	96	Very high	95.1	Very high	79 Å²	79	42.7 Å²	42.7	41%	0.414	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	124.4	172.5	-175.1	67.1	0	0	0	109.8	K157 W159	K157-L166 HydrophobicContact CB-CD1 3.69Å; K157-L166 HydrophobicContact CD-CD1 3.8Å; K157-L166 HydrophobicContact CG-CD1 3.92Å; W159-L166 HydrophobicContact CD2-CD1 4.07Å; W159-L166 HydrophobicContact CE3-CB 3.86Å; W159-L166 HydrophobicContact CE3-CD1 4.04Å; W159-L166 HydrophobicContact CH2-CB 4.25Å; W159-L166 HydrophobicContact CH2-CD1 3.94Å; W159-L166 HydrophobicContact CZ2-CD1 3.97Å; W159-L166 HydrophobicContact CZ3-CB 3.61Å; W159-L166 HydrophobicContact CZ3-CD1 3.97Å; W159-L166 HydrophobicContact CZ3-CG 4.36Å
167	K	93.8	Very high	95.1	Very high	65 Å²	65	42.6 Å²	42.6	28%	0.283	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-47.5	176.5	-79.1	172.9	153.1	171.6	0	111.8	F14 W146 I158 D160 K165	F14-K167 HydrophobicContact CE1-CB 4.47Å; F14-K167 HydrophobicContact CE1-CD 4.36Å; F14-K167 HydrophobicContact CE2-CD 4.02Å; F14-K167 HydrophobicContact CE2-CG 4.47Å; F14-K167 HydrophobicContact CZ-CB 4.37Å; F14-K167 HydrophobicContact CZ-CD 3.52Å; F14-K167 HydrophobicContact CZ-CG 4.12Å; W146-K167 HydrophobicContact CB-CD 4.32Å; I158-K167 HydrophobicContact CG2-CB 4.48Å; I158-K167 PolarHBondContact O-N 3.43Å; D160-K167 HydrophobicContact CB-CD 3.81Å; D160-K167 HydrophobicContact CB-CG 4.14Å; D160-K167 VanDerWaalsContact OD1-CE 3.26Å; D160-K167 WeakPolarHBondContact OD1-CE 3.45Å; D160-K167 IonicContact OD1-NZ 2.71Å; D160-K167 PolarHBondContact OD1-NZ 2.93Å; K165-K167 PolarHBondContact O-N 3.44Å
168	L	94.5	Very high	95.1	Very high	47 Å²	47	42.9 Å²	42.9	25%	0.246	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	147.8	-174.4	-164.4	74.5	0	0	0	110.5	I158 L170 N206	I158-L168 HydrophobicContact CB-CB 4.09Å; I158-L168 HydrophobicContact CD1-CB 4.21Å; I158-L168 HydrophobicContact CD1-CD2 3.97Å; I158-L168 HydrophobicContact CG1-CB 4.15Å; I158-L168 PolarHBondContact N-O 3.26Å; I158-L168 PolarHBondContact O-N 3.34Å; L168-L170 HydrophobicContact CD2-CD2 3.48Å; L168-L170 VanDerWaalsContact CD2-CD2 3.48Å; L168-L170 HydrophobicContact CD2-CG 3.94Å; L168-L170 HydrophobicContact CG-CD2 4.24Å; L168-N206 HydrophobicContact CD2-CB 3.88Å; L168-N206 VanDerWaalsContact CD2-CG 3.44Å; L168-N206 WeakPolarHBondContact CD2-OD1 3.12Å
169	S	95.6	Very high	95.1	Very high	54 Å²	54	42.8 Å²	42.8	38%	0.378	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	118.5	167.7	-63.8	0	0	0	0	108.6
170	L	95	Very high	95.1	Very high	8 Å²	8	42.5 Å²	42.5	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	115.9	177.4	-63.7	174.5	0	0	0	108.7	I156 I158 L168 W201 N206	I156-L170 HydrophobicContact CB-CB 4.15Å; I156-L170 PolarHBondContact N-O 3.09Å; I156-L170 PolarHBondContact O-N 2.99Å; I158-L170 HydrophobicContact CD1-CD1 4.19Å; L168-L170 HydrophobicContact CD2-CD2 3.48Å; L168-L170 VanDerWaalsContact CD2-CD2 3.48Å; L168-L170 HydrophobicContact CD2-CG 3.94Å; L168-L170 HydrophobicContact CG-CD2 4.24Å; L170-W201 HydrophobicContact CB-CE3 4.25Å; L170-W201 HydrophobicContact CB-CH2 4.13Å; L170-W201 HydrophobicContact CB-CZ3 3.92Å; L170-W201 HydrophobicContact CD1-CD2 4.21Å; L170-W201 HydrophobicContact CD1-CE3 4.07Å; L170-W201 HydrophobicContact CD2-CE3 4.06Å; L170-W201 HydrophobicContact CD2-CZ3 4.13Å; L170-W201 HydrophobicContact CG-CE3 4.37Å; L170-W201 HydrophobicContact CG-CZ3 4.44Å; L170-N206 HydrophobicContact CD2-CB 4.09Å
171	T	95.1	Very high	95.1	Very high	103 Å²	103	44.1 Å²	44.1	63%	0.632	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.4	135.8	176.7	54.3	0	0	0	0	109.7	I155 W201	I155-T171 HydrophobicContact CG1-CG2 4.29Å; T171-W201 WeakPolarHBondContact O-CH2 3.15Å
172	G	92.1	Very high	95.2	Very high	34 Å²	34	44.4 Å²	44.4	35%	0.351	26%	0.259	S	S	.	.			trans	172.7	-23.3	172.8	0	0	0	0	0	115	K199	G172-K199 PolarHBondContact O-NZ 3.26Å
173	H	95.2	Very high	95.3	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.056	24%	0.235	C	C	.	.			trans	-71.6	147.6	172.6	-82.4	-79.2	0	0	0	111.3	R154 V177 S191 D195	R154-H173 WeakPolarHBondContact CB-O 3.36Å; H173-V177 HydrophobicContact CB-CG2 3.87Å; H173-S191 WeakPolarHBondContact NE2-CB 3.4Å; H173-S191 PolarHBondContact NE2-OG 2.81Å; H173-D195 WeakPolarHBondContact CA-OD2 3.39Å; H173-D195 IonicContact CE1-OD1 3.88Å; H173-D195 IonicContact CE1-OD2 3.96Å; H173-D195 IonicContact CG-OD2 3.58Å; H173-D195 IonicContact ND1-OD1 3.27Å; H173-D195 PolarHBondContact ND1-OD1 3.33Å; H173-D195 IonicContact ND1-OD2 2.86Å; H173-D195 PolarHBondContact ND1-OD2 2.86Å
174	V	95.7	Very high	95.2	Very high	99 Å²	99	43 Å²	43	60%	0.6	24%	0.243	S	C	*	.	S	Bend	trans	-89.2	-24.5	-179.2	-177.2	0	0	0	0	111.2	R154 D195	R154-V174 WeakPolarHBondContact CD-O 2.97Å; V174-D195 HydrophobicContact CB-CB 4.08Å; V174-D195 PolarHBondContact N-OD2 2.7Å
175	S	96.3	Very high	95.1	Very high	28 Å²	28	49 Å²	49	20%	0.196	26%	0.263	C	S	.	.	S	Bend	trans	-131.4	-170.9	179.8	76.9	0	0	0	0	111.5	R154 V177 E194 D195	R154-S175 WeakPolarHBondContact CA-O 3.48Å; R154-S175 WeakPolarHBondContact CB-O 3.47Å; R154-S175 WeakPolarHBondContact CG-O 3.2Å; S175-V177 PolarHBondContact O-N 2.96Å; S175-E194 VanDerWaalsContact OG-CA 3.31Å; S175-E194 WeakPolarHBondContact OG-CA 3.43Å; S175-E194 VanDerWaalsContact OG-CB 3.28Å; S175-E194 WeakPolarHBondContact OG-CB 3.32Å; S175-E194 PolarHBondContact OG-N 2.82Å; S175-D195 WeakPolarHBondContact OG-CB 3.37Å; S175-D195 PolarHBondContact OG-N 3.1Å
176	T	96.8	Very high	95	Very high	25 Å²	25	44 Å²	44	15%	0.153	24%	0.242	C	C	.	.			trans	-53.8	134.9	179.2	75.3	0	0	0	0	111.6	A152 R178 G193 E194	A152-T176 HydrophobicContact CB-CG2 3.84Å; T176-R178 WeakPolarHBondContact OG1-CD 3.43Å; T176-G193 WeakPolarHBondContact O-CA 3.27Å; T176-E194 PolarHBondContact O-N 2.77Å; T176-E194 VanDerWaalsContact O-N 3.08Å; T176-E194 WeakPolarHBondContact OG1-CG 2.99Å; T176-E194 PolarHBondContact OG1-OE1 3.38Å; T176-E194 PolarHBondContact OG1-OE2 3.42Å
177	V	97.3	Very high	94.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	117.7	174.2	-176.6	0	0	0	0	107.5	R136 A151 I156 H173 S175 V180	R136-V177 WeakPolarHBondContact CB-O 3.15Å; A151-V177 PolarHBondContact O-N 3.38Å; I156-V177 HydrophobicContact CD1-CG1 4.28Å; I156-V177 HydrophobicContact CG1-CB 4.49Å; I156-V177 HydrophobicContact CG1-CG1 4Å; I156-V177 HydrophobicContact CG1-CG2 4.05Å; H173-V177 HydrophobicContact CB-CG2 3.87Å; S175-V177 PolarHBondContact O-N 2.96Å; V177-V180 HydrophobicContact CG1-CG2 3.76Å
178	R	97.1	Very high	94.9	Very high	29 Å²	29	40.5 Å²	40.5	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-35.6	-172.4	-66.3	-55.6	-55.2	-81	-15.3	113.2	R136 C137 T176 A192 E194 V219 Y220	R136-R178 VanDerWaalsContact NH1-CD 3.29Å; R136-R178 VanDerWaalsContact NH1-NE 3.18Å; R136-R178 VanDerWaalsContact NH2-NH2 3.19Å; C137-R178 WeakPolarHBondContact CB-O 3.09Å; T176-R178 WeakPolarHBondContact OG1-CD 3.43Å; R178-A192 PolarHBondContact N-O 3.43Å; R178-E194 WeakPolarHBondContact CD-OE1 3.36Å; R178-E194 HydrophobicContact CG-CG 3.8Å; R178-E194 IonicContact CZ-OE1 3.8Å; R178-E194 IonicContact NE-OE1 3.96Å; R178-E194 IonicContact NH1-OE1 2.87Å; R178-E194 PolarHBondContact NH1-OE1 3.25Å; R178-V219 WeakPolarHBondContact CB-O 3.34Å; R178-V219 WeakPolarHBondContact CG-O 3.44Å; R178-Y220 VanDerWaalsContact NH2-CE1 3.33Å
179	A	96.5	Very high	95	Very high	2 Å²	2	38.3 Å²	38.3	2%	0.017	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	145	179.8	0	0	0	0	0	111	C137 S191 A192 L222	C137-A179 VanDerWaalsContact SG-C 3.55Å; A179-S191 CarbonylContact O-C 3.54Å; A179-S191 VanDerWaalsContact O-CA 3.29Å; A179-S191 WeakPolarHBondContact O-CA 3.22Å; A179-A192 HydrophobicContact CB-CB 4.25Å; A179-A192 PolarHBondContact N-O 2.85Å; A179-A192 VanDerWaalsContact N-O 3.15Å; A179-A192 PolarHBondContact O-N 2.8Å; A179-L222 HydrophobicContact CB-CB 3.91Å
180	V	96.8	Very high	95.1	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	133.8	172.4	172	0	0	0	0	107.2	D139 C148 I156 V177 L189 F190	D139-V180 WeakPolarHBondContact CB-O 3.31Å; C148-V180 HydrophobicContact CB-CG1 3.84Å; I156-V180 HydrophobicContact CD1-CG2 4.16Å; I156-V180 HydrophobicContact CG1-CG2 4.12Å; I156-V180 HydrophobicContact CG2-CG2 4.23Å; V177-V180 HydrophobicContact CG1-CG2 3.76Å; V180-L189 HydrophobicContact CG1-CD1 3.95Å; V180-L189 HydrophobicContact CG1-CD2 3.96Å; V180-L189 HydrophobicContact CG1-CG 3.91Å; V180-F190 CarbonylContact C-O 3.58Å; V180-F190 VanDerWaalsContact CA-O 3.3Å; V180-F190 WeakPolarHBondContact CA-O 3.38Å
181	K	96.8	Very high	95.2	Very high	64 Å²	64	35.3 Å²	35.3	28%	0.278	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	135.1	171.5	-69.2	-64.7	174.3	-175.9	0	111.7	D139 F190 L222 V224	D139-K181 HydrophobicContact CB-CD 4.5Å; D139-K181 WeakPolarHBondContact OD1-CD 3.46Å; D139-K181 IonicContact OD1-NZ 2.98Å; D139-K181 PolarHBondContact OD1-NZ 3.36Å; D139-K181 VanDerWaalsContact OD2-CA 3.31Å; D139-K181 WeakPolarHBondContact OD2-CA 3.29Å; K181-F190 PolarHBondContact N-O 3.16Å; K181-F190 PolarHBondContact O-N 3.01Å; K181-L222 HydrophobicContact CB-CD2 3.58Å; K181-L222 HydrophobicContact CG-CD2 3.64Å; K181-L222 WeakPolarHBondContact CG-O 3.44Å; K181-V224 HydrophobicContact CB-CG2 4.03Å
182	V	95.8	Very high	95.3	Very high	14 Å²	14	30.4 Å²	30.4	9%	0.085	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.2	172.7	-177.6	0	0	0	0	108.1	D139 W146 L189 L203	D139-V182 PolarHBondContact OD2-N 3.41Å; W146-V182 HydrophobicContact CH2-CG1 4.01Å; W146-V182 HydrophobicContact CH2-CG2 3.79Å; W146-V182 HydrophobicContact CZ3-CG2 3.72Å; V182-L189 HydrophobicContact CG2-CD1 4.38Å; V182-L203 HydrophobicContact CG1-CD1 4.47Å
183	S	94.2	Very high	95.4	Very high	4 Å²	4	28.8 Å²	28.8	3%	0.028	15%	0.147	C	C	.	.			trans	-73.2	133.8	174.6	50.2	0	0	0	0	110.7	Q186 Y188	S183-Q186 PolarHBondContact OG-O 3Å; S183-Y188 PolarHBondContact N-O 2.98Å; S183-Y188 PolarHBondContact OG-N 2.95Å; S183-Y188 PolarHBondContact OG-O 3.4Å
184	P	91.3	Very high	95.5	Very high	75 Å²	75	31.6 Å²	31.6	49%	0.487	16%	0.161	S	C	.	.	S	Bend	trans	-74.6	-25.7	178.8	27.6	-33.6	0	0	0	113.6	P142	P142-P184 HydrophobicContact CB-CB 4.46Å
185	R	91	Very high	95.5	Very high	135 Å²	135	28.1 Å²	28.1	51%	0.509	14%	0.139	S	C	.	.	S	Bend	trans	-92.5	-38	-174.4	-68.1	166.2	60.5	107.7	-3.1	113.6	P226 T227 D229	R185-P226 WeakPolarHBondContact CD-O 3.45Å; R185-T227 PolarHBondContact NE-O 2.83Å; R185-T227 PolarHBondContact NH1-O 3.47Å; R185-T227 PolarHBondContact NH2-O 3.03Å; R185-D229 IonicContact CZ-OD1 4Å; R185-D229 IonicContact NE-OD1 3.39Å; R185-D229 PolarHBondContact NE-OD1 3.22Å; R185-D229 IonicContact NH2-OD1 3.85Å
186	Q	91.4	Very high	95.4	Very high	46 Å²	46	31.7 Å²	31.7	22%	0.215	15%	0.151	C	C	.	.	S	Bend	trans	-115.4	153.3	-173.8	-59.8	178.4	-2.4	0	0	109.1	S183 Y188 D229	S183-Q186 PolarHBondContact OG-O 3Å; Q186-Y188 HydrophobicContact CB-CD2 3.66Å; Q186-Y188 HydrophobicContact CB-CE2 4.01Å; Q186-Y188 HydrophobicContact CB-CG 4.32Å; Q186-Y188 HydrophobicContact CG-CD2 4.46Å; Q186-Y188 PolarHBondContact O-N 3.25Å; Q186-D229 PolarHBondContact NE2-OD1 3.44Å; Q186-D229 PolarHBondContact NE2-OD2 3.06Å
187	P	93.4	Very high	95.4	Very high	30 Å²	30	33.7 Å²	33.7	20%	0.195	16%	0.158	C	C	.	.	S	Bend	trans	-80.9	46.2	177.8	33.8	-35.8	0	0	0	113.5	V22 L203	V22-P187 HydrophobicContact CB-CB 4.05Å; V22-P187 HydrophobicContact CG1-CB 3.22Å; V22-P187 HydrophobicContact CG1-CG 3.56Å; V22-P187 HydrophobicContact CG2-CB 3.64Å; P187-L203 WeakPolarHBondContact O-CB 3.5Å; P187-L203 WeakPolarHBondContact O-CG 3.41Å; P187-L203 PolarHBondContact O-N 2.75Å; P187-L203 VanDerWaalsContact O-N 3.11Å
188	Y	95.5	Very high	95.4	Very high	40 Å²	40	33.8 Å²	33.8	16%	0.157	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	146.8	-179.7	-58.4	-40	0	0	0	111.7	S183 Q186 F190 W201 D202 I209 R210	S183-Y188 PolarHBondContact N-O 2.98Å; S183-Y188 PolarHBondContact OG-N 2.95Å; S183-Y188 PolarHBondContact OG-O 3.4Å; Q186-Y188 HydrophobicContact CB-CD2 3.66Å; Q186-Y188 HydrophobicContact CB-CE2 4.01Å; Q186-Y188 HydrophobicContact CB-CG 4.32Å; Q186-Y188 HydrophobicContact CG-CD2 4.46Å; Q186-Y188 PolarHBondContact O-N 3.25Å; Y188-F190 HydrophobicContact CD2-CZ 4.38Å; Y188-W201 VanDerWaalsContact CA-O 3.31Å; Y188-W201 WeakPolarHBondContact CA-O 3.44Å; Y188-D202 HydrophobicContact CD1-CB 4.42Å; Y188-D202 HydrophobicContact CE1-CB 4.36Å; Y188-I209 HydrophobicContact CD1-CD1 3.85Å; Y188-I209 HydrophobicContact CE1-CD1 3.37Å; Y188-R210 PolarHBondContact OH-NH1 2.89Å
189	L	96.5	Very high	95.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.9	164.9	176.8	158.5	0	0	0	107.8	C148 I156 V180 V182 W201 L203	C148-L189 HydrophobicContact CB-CD1 4.06Å; C148-L189 WeakPolarHBondContact SG-CD1 2.95Å; I156-L189 HydrophobicContact CD1-CD2 4.24Å; I156-L189 HydrophobicContact CG2-CD1 4.46Å; V180-L189 HydrophobicContact CG1-CD1 3.95Å; V180-L189 HydrophobicContact CG1-CD2 3.96Å; V180-L189 HydrophobicContact CG1-CG 3.91Å; V182-L189 HydrophobicContact CG2-CD1 4.38Å; L189-W201 HydrophobicContact CB-CB 4.17Å; L189-W201 HydrophobicContact CD2-CB 4.27Å; L189-W201 VanDerWaalsContact CD2-CD1 3.44Å; L189-W201 HydrophobicContact CD2-CG 3.98Å; L189-W201 PolarHBondContact N-O 2.98Å; L189-W201 WeakPolarHBondContact O-CB 3.32Å; L189-W201 VanDerWaalsContact O-CD1 3.32Å; L189-W201 PolarHBondContact O-N 3.49Å; L189-L203 HydrophobicContact CB-CD1 4.37Å; L189-L203 HydrophobicContact CB-CD2 3.86Å; L189-L203 HydrophobicContact CB-CG 4.18Å; L189-L203 HydrophobicContact CD1-CD2 4.3Å
190	F	97.1	Very high	95.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	138.7	174.1	-64.1	-79.7	0	0	0	109.4	V180 K181 Y188 K199 C200 Y212 L222 V224 L231 M245	V180-F190 CarbonylContact C-O 3.58Å; V180-F190 VanDerWaalsContact CA-O 3.3Å; V180-F190 WeakPolarHBondContact CA-O 3.38Å; K181-F190 PolarHBondContact N-O 3.16Å; K181-F190 PolarHBondContact O-N 3.01Å; Y188-F190 HydrophobicContact CD2-CZ 4.38Å; F190-K199 CarbonylContact C-O 3.47Å; F190-K199 VanDerWaalsContact CA-O 3.32Å; F190-K199 WeakPolarHBondContact CA-O 3.32Å; F190-C200 HydrophobicContact CD1-CB 3.98Å; F190-C200 HydrophobicContact CE1-CB 3.7Å; F190-C200 WeakPolarHBondContact CE1-SG 3.32Å; F190-Y212 HydrophobicContact CD1-CE2 4.01Å; F190-Y212 AromaticContact CE1-CE2 3.86Å; F190-Y212 HydrophobicContact CE1-CE2 3.86Å; F190-Y212 WeakPolarHBondContact CE1-OH 3.39Å; F190-L222 HydrophobicContact CB-CD1 3.92Å; F190-L222 HydrophobicContact CB-CD2 3.77Å; F190-V224 HydrophobicContact CD2-CG2 3.61Å; F190-V224 HydrophobicContact CE2-CG2 4.08Å; F190-V224 HydrophobicContact CG-CG2 4.44Å; F190-L231 HydrophobicContact CB-CD1 4.18Å; F190-L231 HydrophobicContact CD1-CD1 4.13Å; F190-L231 HydrophobicContact CD1-CD2 3.8Å; F190-L231 HydrophobicContact CD2-CD1 4.25Å; F190-L231 HydrophobicContact CE1-CD2 4.21Å; F190-L231 HydrophobicContact CG-CD1 3.91Å; F190-L231 HydrophobicContact CG-CD2 4.38Å; F190-M245 HydrophobicContact CE1-SD 4.35Å; F190-M245 HydrophobicContact CE2-SD 3.69Å; F190-M245 HydrophobicContact CZ-CG 4.1Å; F190-M245 HydrophobicContact CZ-SD 3.39Å; F190-M245 WeakPolarHBondContact CZ-SD 3.21Å
191	S	97.3	Very high	95.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	147.8	175.3	64.6	0	0	0	0	111.3	H173 A179 V198 K199 W201	H173-S191 WeakPolarHBondContact NE2-CB 3.4Å; H173-S191 PolarHBondContact NE2-OG 2.81Å; A179-S191 CarbonylContact O-C 3.54Å; A179-S191 VanDerWaalsContact O-CA 3.29Å; A179-S191 WeakPolarHBondContact O-CA 3.22Å; S191-V198 CarbonylContact O-C 3.59Å; S191-V198 VanDerWaalsContact O-CA 3.3Å; S191-V198 WeakPolarHBondContact O-CA 3.24Å; S191-K199 PolarHBondContact N-O 2.98Å; S191-K199 PolarHBondContact O-N 3.27Å; S191-W201 PolarHBondContact OG-NE1 3.15Å
192	A	96.7	Very high	95.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	145.5	179.1	0	0	0	0	0	110.4	R178 A179 V198 V219 L222	R178-A192 PolarHBondContact N-O 3.43Å; A179-A192 HydrophobicContact CB-CB 4.25Å; A179-A192 PolarHBondContact N-O 2.85Å; A179-A192 VanDerWaalsContact N-O 3.15Å; A179-A192 PolarHBondContact O-N 2.8Å; A192-V198 HydrophobicContact CB-CG2 4.13Å; A192-V219 HydrophobicContact CB-CB 3.9Å; A192-V219 HydrophobicContact CB-CG1 3.53Å; A192-L222 HydrophobicContact CB-CB 4.38Å; A192-L222 HydrophobicContact CB-CD1 4.08Å
193	G	95.7	Very high	95.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	174.1	-176.2	0	0	0	0	0	114.5	T176 D195 K196 Q197 V219	T176-G193 WeakPolarHBondContact O-CA 3.27Å; G193-D195 PolarHBondContact O-N 3.29Å; G193-K196 PolarHBondContact O-N 3.34Å; G193-Q197 PolarHBondContact N-O 3.31Å; G193-V219 PolarHBondContact O-N 2.95Å; G193-V219 VanDerWaalsContact O-N 3.09Å
194	E	96.4	Very high	95	Very high	71 Å²	71	32.2 Å²	32.2	33%	0.332	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-8.1	170.7	-77.5	167.4	-175.3	0	0	113.1	R136 S175 T176 R178 K196 A218	R136-E194 IonicContact NH1-OE1 3.76Å; S175-E194 VanDerWaalsContact OG-CA 3.31Å; S175-E194 WeakPolarHBondContact OG-CA 3.43Å; S175-E194 VanDerWaalsContact OG-CB 3.28Å; S175-E194 WeakPolarHBondContact OG-CB 3.32Å; S175-E194 PolarHBondContact OG-N 2.82Å; T176-E194 PolarHBondContact O-N 2.77Å; T176-E194 VanDerWaalsContact O-N 3.08Å; T176-E194 WeakPolarHBondContact OG1-CG 2.99Å; T176-E194 PolarHBondContact OG1-OE1 3.38Å; T176-E194 PolarHBondContact OG1-OE2 3.42Å; R178-E194 WeakPolarHBondContact CD-OE1 3.36Å; R178-E194 HydrophobicContact CG-CG 3.8Å; R178-E194 IonicContact CZ-OE1 3.8Å; R178-E194 IonicContact NE-OE1 3.96Å; R178-E194 IonicContact NH1-OE1 2.87Å; R178-E194 PolarHBondContact NH1-OE1 3.25Å; E194-K196 PolarHBondContact O-N 2.67Å; E194-A218 HydrophobicContact CB-CB 4.06Å; E194-A218 HydrophobicContact CG-CB 3.78Å
195	D	94.8	Very high	95.1	Very high	26 Å²	26	35.1 Å²	35.1	14%	0.139	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	6.2	177.8	60.3	0.2	0	0	0	112.4	H173 V174 S175 G193 Q197	H173-D195 WeakPolarHBondContact CA-OD2 3.39Å; H173-D195 IonicContact CE1-OD1 3.88Å; H173-D195 IonicContact CE1-OD2 3.96Å; H173-D195 IonicContact CG-OD2 3.58Å; H173-D195 IonicContact ND1-OD1 3.27Å; H173-D195 PolarHBondContact ND1-OD1 3.33Å; H173-D195 IonicContact ND1-OD2 2.86Å; H173-D195 PolarHBondContact ND1-OD2 2.86Å; V174-D195 HydrophobicContact CB-CB 4.08Å; V174-D195 PolarHBondContact N-OD2 2.7Å; S175-D195 WeakPolarHBondContact OG-CB 3.37Å; S175-D195 PolarHBondContact OG-N 3.1Å; G193-D195 PolarHBondContact O-N 3.29Å; D195-Q197 HydrophobicContact CB-CG 4.45Å; D195-Q197 WeakPolarHBondContact O-CG 3.46Å; D195-Q197 PolarHBondContact O-N 3.18Å; D195-Q197 VanDerWaalsContact O-N 3.15Å; D195-Q197 WeakPolarHBondContact OD1-CB 3.47Å; D195-Q197 PolarHBondContact OD1-N 3Å; D195-Q197 VanDerWaalsContact OD1-N 3.1Å
196	K	95.7	Very high	95.2	Very high	103 Å²	103	31 Å²	31	45%	0.448	14%	0.142	S	C	.	.	S	Bend	trans	65	6.9	-176.5	-37.7	-178.3	-177.8	-170.7	0	113.1	G193 E194 L216 S217	G193-K196 PolarHBondContact O-N 3.34Å; E194-K196 PolarHBondContact O-N 2.67Å; K196-L216 WeakPolarHBondContact CD-O 3.26Å; K196-L216 WeakPolarHBondContact CE-O 3.21Å; K196-L216 PolarHBondContact NZ-O 3.09Å; K196-S217 WeakPolarHBondContact CG-O 3.35Å
197	Q	95.7	Very high	95.3	Very high	67 Å²	67	35.7 Å²	35.7	31%	0.313	16%	0.162	S	C	.	.			trans	-98	136.9	-177	-58.8	-174.2	6	0	0	110.1	G193 D195	G193-Q197 PolarHBondContact N-O 3.31Å; D195-Q197 HydrophobicContact CB-CG 4.45Å; D195-Q197 WeakPolarHBondContact O-CG 3.46Å; D195-Q197 PolarHBondContact O-N 3.18Å; D195-Q197 VanDerWaalsContact O-N 3.15Å; D195-Q197 WeakPolarHBondContact OD1-CB 3.47Å; D195-Q197 PolarHBondContact OD1-N 3Å; D195-Q197 VanDerWaalsContact OD1-N 3.1Å
198	V	97.2	Very high	95.4	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.1	166.1	-176.9	0	0	0	0	107.3	S191 A192 H211 Y212 V219 L222 L231 T233	S191-V198 CarbonylContact O-C 3.59Å; S191-V198 VanDerWaalsContact O-CA 3.3Å; S191-V198 WeakPolarHBondContact O-CA 3.24Å; A192-V198 HydrophobicContact CB-CG2 4.13Å; V198-H211 WeakPolarHBondContact O-CA 3.49Å; V198-Y212 HydrophobicContact CB-CD2 4.16Å; V198-Y212 HydrophobicContact CG1-CD2 3.81Å; V198-Y212 PolarHBondContact O-N 3.39Å; V198-V219 HydrophobicContact CG2-CB 4.48Å; V198-V219 HydrophobicContact CG2-CG1 4.14Å; V198-V219 HydrophobicContact CG2-CG2 4.01Å; V198-L222 HydrophobicContact CG1-CD1 3.55Å; V198-L231 HydrophobicContact CG1-CD2 3.84Å; V198-T233 HydrophobicContact CG1-CG2 4.11Å; V198-T233 HydrophobicContact CG2-CG2 4.04Å
199	K	96.8	Very high	95.4	Very high	11 Å²	11	37.7 Å²	37.7	5%	0.048	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.2	-173.8	-58.4	-171	-172.8	-153.1	0	110.2	G172 F190 S191 W201 V208	G172-K199 PolarHBondContact O-NZ 3.26Å; F190-K199 CarbonylContact C-O 3.47Å; F190-K199 VanDerWaalsContact CA-O 3.32Å; F190-K199 WeakPolarHBondContact CA-O 3.32Å; S191-K199 PolarHBondContact N-O 2.98Å; S191-K199 PolarHBondContact O-N 3.27Å; K199-W201 HydrophobicContact CD-CZ2 4.22Å; K199-V208 HydrophobicContact CB-CG1 4.01Å; K199-V208 HydrophobicContact CD-CG1 4.28Å; K199-V208 HydrophobicContact CD-CG2 4.03Å; K199-V208 HydrophobicContact CG-CG1 4.31Å
200	C	97.1	Very high	95.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	120.2	166	-174.5	0	0	0	0	108.2	F190 V208 I209 R210 Y212	F190-C200 HydrophobicContact CD1-CB 3.98Å; F190-C200 HydrophobicContact CE1-CB 3.7Å; F190-C200 WeakPolarHBondContact CE1-SG 3.32Å; C200-V208 WeakPolarHBondContact O-CA 3.42Å; C200-I209 HydrophobicContact CB-CG1 4.13Å; C200-I209 WeakPolarHBondContact O-CG1 3.44Å; C200-I209 PolarHBondContact O-N 2.91Å; C200-R210 HydrophobicContact CB-CB 3.82Å; C200-R210 HydrophobicContact CB-CG 4.46Å; C200-R210 PolarHBondContact N-O 3.07Å; C200-R210 PolarHBondContact O-N 3.23Å; C200-Y212 HydrophobicContact CB-CE2 4Å
201	W	96.6	Very high	95.3	Very high	7 Å²	7	45.3 Å²	45.3	3%	0.027	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.8	176.2	-58.6	80.9	0	0	0	108.7	I156 L170 T171 Y188 L189 S191 K199 K207 V208	I156-W201 HydrophobicContact CD1-CZ2 4.25Å; L170-W201 HydrophobicContact CB-CE3 4.25Å; L170-W201 HydrophobicContact CB-CH2 4.13Å; L170-W201 HydrophobicContact CB-CZ3 3.92Å; L170-W201 HydrophobicContact CD1-CD2 4.21Å; L170-W201 HydrophobicContact CD1-CE3 4.07Å; L170-W201 HydrophobicContact CD2-CE3 4.06Å; L170-W201 HydrophobicContact CD2-CZ3 4.13Å; L170-W201 HydrophobicContact CG-CE3 4.37Å; L170-W201 HydrophobicContact CG-CZ3 4.44Å; T171-W201 WeakPolarHBondContact O-CH2 3.15Å; Y188-W201 VanDerWaalsContact CA-O 3.31Å; Y188-W201 WeakPolarHBondContact CA-O 3.44Å; L189-W201 HydrophobicContact CB-CB 4.17Å; L189-W201 HydrophobicContact CD2-CB 4.27Å; L189-W201 VanDerWaalsContact CD2-CD1 3.44Å; L189-W201 HydrophobicContact CD2-CG 3.98Å; L189-W201 PolarHBondContact N-O 2.98Å; L189-W201 WeakPolarHBondContact O-CB 3.32Å; L189-W201 VanDerWaalsContact O-CD1 3.32Å; L189-W201 PolarHBondContact O-N 3.49Å; S191-W201 PolarHBondContact OG-NE1 3.15Å; K199-W201 HydrophobicContact CD-CZ2 4.22Å; W201-K207 WeakPolarHBondContact CA-O 3.31Å; W201-V208 HydrophobicContact CD2-CG2 3.71Å; W201-V208 HydrophobicContact CE3-CG2 3.56Å; W201-V208 HydrophobicContact CH2-CG2 3.44Å; W201-V208 VanDerWaalsContact CH2-CG2 3.44Å; W201-V208 HydrophobicContact CZ2-CG2 3.59Å; W201-V208 HydrophobicContact CZ3-CG2 3.43Å; W201-V208 VanDerWaalsContact CZ3-CG2 3.43Å
202	D	95.5	Very high	95.3	Very high	16 Å²	16	45.4 Å²	45.4	9%	0.086	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.8	167.6	-165.5	-31.9	0	0	0	109.1	Y188 E204 Y205 N206 K207 I209	Y188-D202 HydrophobicContact CD1-CB 4.42Å; Y188-D202 HydrophobicContact CE1-CB 4.36Å; D202-E204 PolarHBondContact O-N 3.24Å; D202-E204 WeakPolarHBondContact OD1-CB 3.37Å; D202-E204 PolarHBondContact OD1-N 3.46Å; D202-Y205 HydrophobicContact CB-CD2 4.15Å; D202-Y205 PolarHBondContact O-N 3.47Å; D202-Y205 VanDerWaalsContact OD2-CD2 3.26Å; D202-Y205 WeakPolarHBondContact OD2-CD2 3.41Å; D202-N206 WeakPolarHBondContact O-CA 3.44Å; D202-N206 PolarHBondContact O-N 3.42Å; D202-K207 PolarHBondContact N-O 2.93Å; D202-K207 PolarHBondContact O-N 3.47Å; D202-I209 HydrophobicContact CB-CD1 4.11Å; D202-I209 HydrophobicContact CB-CG1 4.26Å; D202-I209 HydrophobicContact CB-CG2 3.63Å
203	L	91.6	Very high	95.2	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.026	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-18.8	-178.6	-64.9	169.5	0	0	0	112.2	L18 W146 I158 V182 P187 L189 N206	L18-L203 HydrophobicContact CD2-CB 3.79Å; L18-L203 WeakPolarHBondContact CD2-O 3.47Å; W146-L203 HydrophobicContact CH2-CD1 3.7Å; W146-L203 HydrophobicContact CH2-CD2 4.15Å; W146-L203 HydrophobicContact CZ2-CD1 3.8Å; W146-L203 HydrophobicContact CZ2-CD2 4.46Å; I158-L203 HydrophobicContact CD1-CD2 4.35Å; V182-L203 HydrophobicContact CG1-CD1 4.47Å; P187-L203 WeakPolarHBondContact O-CB 3.5Å; P187-L203 WeakPolarHBondContact O-CG 3.41Å; P187-L203 PolarHBondContact O-N 2.75Å; P187-L203 VanDerWaalsContact O-N 3.11Å; L189-L203 HydrophobicContact CB-CD1 4.37Å; L189-L203 HydrophobicContact CB-CD2 3.86Å; L189-L203 HydrophobicContact CB-CG 4.18Å; L189-L203 HydrophobicContact CD1-CD2 4.3Å; L203-N206 PolarHBondContact O-OD1 3.11Å
204	E	91.8	Very high	95	Very high	43 Å²	43	54.2 Å²	54.2	20%	0.201	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-30.4	176.9	-62.3	-164.3	154.6	0	0	113.1	R19 V22 D202	R19-E204 HydrophobicContact CG-CB 3.88Å; R19-E204 HydrophobicContact CG-CG 3.95Å; R19-E204 PolarHBondContact NE-O 2.9Å; R19-E204 PolarHBondContact NH2-O 3.37Å; V22-E204 HydrophobicContact CG1-CG 4.23Å; V22-E204 WeakPolarHBondContact CG1-OE1 3.41Å; D202-E204 PolarHBondContact O-N 3.24Å; D202-E204 WeakPolarHBondContact OD1-CB 3.37Å; D202-E204 PolarHBondContact OD1-N 3.46Å
205	Y	93	Very high	95	Very high	137 Å²	137	51.1 Å²	51.1	54%	0.537	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-13.3	178.9	-58.8	-74.8	0	0	0	113.2	D202 K207	D202-Y205 HydrophobicContact CB-CD2 4.15Å; D202-Y205 PolarHBondContact O-N 3.47Å; D202-Y205 VanDerWaalsContact OD2-CD2 3.26Å; D202-Y205 WeakPolarHBondContact OD2-CD2 3.41Å; Y205-K207 PolarHBondContact O-N 3.42Å
206	N	93.1	Very high	95	Very high	48 Å²	48	55.7 Å²	55.7	26%	0.257	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	37	-173.9	-61.4	-48	0	0	0	113.2	L168 L170 D202 L203	L168-N206 HydrophobicContact CD2-CB 3.88Å; L168-N206 VanDerWaalsContact CD2-CG 3.44Å; L168-N206 WeakPolarHBondContact CD2-OD1 3.12Å; L170-N206 HydrophobicContact CD2-CB 4.09Å; D202-N206 WeakPolarHBondContact O-CA 3.44Å; D202-N206 PolarHBondContact O-N 3.42Å; L203-N206 PolarHBondContact O-OD1 3.11Å
207	K	94.5	Very high	95.1	Very high	145 Å²	145	52.4 Å²	52.4	63%	0.63	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	153.4	-177.7	-70.9	-179	-177.3	-176.8	0	110.8	W201 D202 Y205 I209	W201-K207 WeakPolarHBondContact CA-O 3.31Å; D202-K207 PolarHBondContact N-O 2.93Å; D202-K207 PolarHBondContact O-N 3.47Å; Y205-K207 PolarHBondContact O-N 3.42Å; K207-I209 PolarHBondContact O-N 3.37Å
208	V	95.6	Very high	95.1	Very high	43 Å²	43	49.7 Å²	49.7	26%	0.261	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	126.5	170.6	-174.9	0	0	0	0	108.6	K199 C200 W201	K199-V208 HydrophobicContact CB-CG1 4.01Å; K199-V208 HydrophobicContact CD-CG1 4.28Å; K199-V208 HydrophobicContact CD-CG2 4.03Å; K199-V208 HydrophobicContact CG-CG1 4.31Å; C200-V208 WeakPolarHBondContact O-CA 3.42Å; W201-V208 HydrophobicContact CD2-CG2 3.71Å; W201-V208 HydrophobicContact CE3-CG2 3.56Å; W201-V208 HydrophobicContact CH2-CG2 3.44Å; W201-V208 VanDerWaalsContact CH2-CG2 3.44Å; W201-V208 HydrophobicContact CZ2-CG2 3.59Å; W201-V208 HydrophobicContact CZ3-CG2 3.43Å; W201-V208 VanDerWaalsContact CZ3-CG2 3.43Å
209	I	95.4	Very high	95.1	Very high	68 Å²	68	49.6 Å²	49.6	35%	0.349	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-29.9	179.4	53.5	162.5	0	0	0	112.8	Y188 C200 D202 K207	Y188-I209 HydrophobicContact CD1-CD1 3.85Å; Y188-I209 HydrophobicContact CE1-CD1 3.37Å; C200-I209 HydrophobicContact CB-CG1 4.13Å; C200-I209 WeakPolarHBondContact O-CG1 3.44Å; C200-I209 PolarHBondContact O-N 2.91Å; D202-I209 HydrophobicContact CB-CD1 4.11Å; D202-I209 HydrophobicContact CB-CG1 4.26Å; D202-I209 HydrophobicContact CB-CG2 3.63Å; K207-I209 PolarHBondContact O-N 3.37Å
210	R	95.4	Very high	95.2	Very high	58 Å²	58	51.2 Å²	51.2	22%	0.219	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	144.4	-178.3	-55.5	178.7	177.9	95.2	6.5	110.6	Y188 C200 M245 K248	Y188-R210 PolarHBondContact OH-NH1 2.89Å; C200-R210 HydrophobicContact CB-CB 3.82Å; C200-R210 HydrophobicContact CB-CG 4.46Å; C200-R210 PolarHBondContact N-O 3.07Å; C200-R210 PolarHBondContact O-N 3.23Å; R210-M245 WeakPolarHBondContact CD-O 3.31Å; R210-K248 HydrophobicContact CB-CD 3.95Å; R210-K248 HydrophobicContact CB-CG 4.1Å; R210-K248 HydrophobicContact CG-CD 4.13Å; R210-K248 HydrophobicContact CG-CG 4.27Å
211	H	95.4	Very high	95.1	Very high	102 Å²	102	52.7 Å²	52.7	47%	0.472	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.3	169.2	-63.6	-88.1	0	0	0	108	V198	V198-H211 WeakPolarHBondContact O-CA 3.49Å
212	Y	96.2	Very high	95.1	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	113.6	170.9	-50.7	-88.5	0	0	0	108	F190 V198 C200 L231 W243 M245 K248	F190-Y212 HydrophobicContact CD1-CE2 4.01Å; F190-Y212 AromaticContact CE1-CE2 3.86Å; F190-Y212 HydrophobicContact CE1-CE2 3.86Å; F190-Y212 WeakPolarHBondContact CE1-OH 3.39Å; V198-Y212 HydrophobicContact CB-CD2 4.16Å; V198-Y212 HydrophobicContact CG1-CD2 3.81Å; V198-Y212 PolarHBondContact O-N 3.39Å; C200-Y212 HydrophobicContact CB-CE2 4Å; Y212-L231 HydrophobicContact CD2-CD2 3.9Å; Y212-L231 HydrophobicContact CE2-CD2 3.77Å; Y212-L231 HydrophobicContact CG-CD2 4.46Å; Y212-W243 HydrophobicContact CD1-CB 3.9Å; Y212-W243 HydrophobicContact CD1-CD2 4.29Å; Y212-W243 HydrophobicContact CD1-CE3 4.31Å; Y212-W243 HydrophobicContact CD1-CG 4.13Å; Y212-W243 HydrophobicContact CE1-CB 4.28Å; Y212-W243 HydrophobicContact CG-CD2 4.45Å; Y212-W243 HydrophobicContact CG-CG 4.4Å; Y212-M245 PolarHBondContact OH-O 2.89Å; Y212-K248 HydrophobicContact CD1-CB 3.86Å; Y212-K248 HydrophobicContact CD1-CG 4.29Å; Y212-K248 HydrophobicContact CE1-CB 3.99Å; Y212-K248 HydrophobicContact CE1-CG 4.02Å
213	H	94.7	Very high	95.2	Very high	164 Å²	164	52 Å²	52	76%	0.759	25%	0.253	S	S	*	.			trans	-110.6	138.8	-176	-177.3	75.4	0	0	0	110.4	W243	H213-W243 WeakPolarHBondContact O-CH2 3.48Å; H213-W243 WeakPolarHBondContact O-CZ3 3.36Å
214	G	93.5	Very high	95.4	Very high	21 Å²	21	52.9 Å²	52.9	22%	0.216	26%	0.259	C	S	.	.			trans	149.9	-13.2	175.5	0	0	0	0	0	113.6	L216 R241	G214-L216 PolarHBondContact O-N 3.1Å; G214-R241 PolarHBondContact O-NE 3.4Å; G214-R241 PolarHBondContact O-NH2 3.3Å
215	H	95.8	Very high	95.6	Very high	7 Å²	7	50.9 Å²	50.9	3%	0.032	25%	0.25	C	S	.	.			trans	-66.8	129.2	172.3	-75.9	-68.6	0	0	0	112.6	S217 V219 T233 S235 R241 W243	H215-S217 VanDerWaalsContact C-N 3.34Å; H215-V219 HydrophobicContact CB-CG2 3.86Å; H215-V219 VanDerWaalsContact CD2-CG2 3.46Å; H215-V219 WeakPolarHBondContact CD2-CG2 3.5Å; H215-T233 PolarHBondContact CE1-OG1 3.39Å; H215-T233 WeakPolarHBondContact NE2-CB 3.44Å; H215-T233 PolarHBondContact NE2-OG1 3.12Å; H215-S235 WeakPolarHBondContact ND1-CB 3.42Å; H215-R241 VanDerWaalsContact CA-NH1 3.33Å; H215-R241 PolarHBondContact ND1-NH1 3.05Å; H215-W243 AromaticContact CD2-CZ2 3.92Å; H215-W243 AromaticContact NE2-CZ2 3.92Å; H215-W243 AromaticContact NE2-NE1 3.84Å
216	L	95.5	Very high	95.5	Very high	122 Å²	122	46.7 Å²	46.7	64%	0.639	24%	0.24	S	C	*	.	S	Bend	trans	-83.1	-18.4	-177.9	-60.8	177.1	0	0	0	111.9	K196 G214 D237	K196-L216 WeakPolarHBondContact CD-O 3.26Å; K196-L216 WeakPolarHBondContact CE-O 3.21Å; K196-L216 PolarHBondContact NZ-O 3.09Å; G214-L216 PolarHBondContact O-N 3.1Å; L216-D237 HydrophobicContact CB-CB 4.02Å; L216-D237 PolarHBondContact N-OD2 3.04Å; L216-D237 VanDerWaalsContact N-OD2 3.14Å
217	S	96.6	Very high	95.6	Very high	33 Å²	33	47.6 Å²	47.6	23%	0.231	25%	0.247	C	C	.	.	S	Bend	trans	-146.6	-172.6	-177.2	-160.1	0	0	0	0	112	K196 H215 V219 R236	K196-S217 WeakPolarHBondContact CG-O 3.35Å; H215-S217 VanDerWaalsContact C-N 3.34Å; S217-V219 PolarHBondContact O-N 3.35Å; S217-R236 WeakPolarHBondContact OG-CB 3.49Å
218	A	96.7	Very high	95.5	Very high	10 Å²	10	44.4 Å²	44.4	8%	0.083	24%	0.236	C	C	.	.			trans	-56.7	134.6	-177.8	0	0	0	0	0	111.9	E194 Y220 S235 R236	E194-A218 HydrophobicContact CB-CB 4.06Å; E194-A218 HydrophobicContact CG-CB 3.78Å; A218-Y220 HydrophobicContact CB-CD2 4.47Å; A218-Y220 HydrophobicContact CB-CE2 3.98Å; A218-Y220 WeakPolarHBondContact O-CD2 3.43Å; A218-S235 CarbonylContact O-C 3.47Å; A218-S235 VanDerWaalsContact O-CA 3.27Å; A218-S235 WeakPolarHBondContact O-CA 3.46Å; A218-S235 PolarHBondContact O-OG 2.89Å; A218-R236 HydrophobicContact CB-CB 4.44Å; A218-R236 PolarHBondContact O-N 2.95Å
219	V	97.5	Very high	95.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	124	176	-172.5	0	0	0	0	108.2	R178 A192 G193 V198 H215 S217 T234	R178-V219 WeakPolarHBondContact CB-O 3.34Å; R178-V219 WeakPolarHBondContact CG-O 3.44Å; A192-V219 HydrophobicContact CB-CB 3.9Å; A192-V219 HydrophobicContact CB-CG1 3.53Å; G193-V219 PolarHBondContact O-N 2.95Å; G193-V219 VanDerWaalsContact O-N 3.09Å; V198-V219 HydrophobicContact CG2-CB 4.48Å; V198-V219 HydrophobicContact CG2-CG1 4.14Å; V198-V219 HydrophobicContact CG2-CG2 4.01Å; H215-V219 HydrophobicContact CB-CG2 3.86Å; H215-V219 VanDerWaalsContact CD2-CG2 3.46Å; H215-V219 WeakPolarHBondContact CD2-CG2 3.5Å; S217-V219 PolarHBondContact O-N 3.35Å; V219-T234 CarbonylContact C-O 3.52Å; V219-T234 VanDerWaalsContact CA-O 3.3Å; V219-T234 WeakPolarHBondContact CA-O 3.48Å; V219-T234 WeakPolarHBondContact CG1-O 3.26Å
220	Y	96.8	Very high	95.5	Very high	45 Å²	45	42.8 Å²	42.8	18%	0.176	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-43.3	-171.8	-83.9	-107.1	0	0	0	112.4	R178 A218 T234 R236	R178-Y220 VanDerWaalsContact NH2-CE1 3.33Å; A218-Y220 HydrophobicContact CB-CD2 4.47Å; A218-Y220 HydrophobicContact CB-CE2 3.98Å; A218-Y220 WeakPolarHBondContact O-CD2 3.43Å; Y220-T234 PolarHBondContact N-O 3Å; Y220-R236 HydrophobicContact CD2-CB 4.34Å; Y220-R236 HydrophobicContact CE2-CB 3.71Å; Y220-R236 HydrophobicContact CE2-CG 3.84Å
221	D	96.8	Very high	95.5	Very high	30 Å²	30	40 Å²	40	16%	0.16	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	162.3	-177.4	-161	12.8	0	0	0	111.5	T234 A262 T263 V264	D221-T234 WeakPolarHBondContact CA-OG1 2.99Å; D221-T234 VanDerWaalsContact CB-OG1 3.3Å; D221-T234 WeakPolarHBondContact CB-OG1 3.39Å; D221-T234 PolarHBondContact N-OG1 3.1Å; D221-T234 VanDerWaalsContact N-OG1 3.12Å; D221-T234 PolarHBondContact O-N 3.46Å; D221-T234 PolarHBondContact O-OG1 2.91Å; D221-A262 WeakPolarHBondContact CB-O 3.33Å; D221-T263 VanDerWaalsContact OD2-CA 3.22Å; D221-T263 WeakPolarHBondContact OD2-CA 3.46Å; D221-T263 PolarHBondContact OD2-OG1 3.42Å; D221-T263 VanDerWaalsContact OD2-OG1 3.09Å; D221-V264 HydrophobicContact CB-CG1 4.16Å; D221-V264 PolarHBondContact OD2-N 2.95Å
222	L	96.5	Very high	95.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	136.2	-176.6	177.7	156.1	0	0	0	109.3	A179 K181 F190 A192 V198 V224 L231 V232 T233	A179-L222 HydrophobicContact CB-CB 3.91Å; K181-L222 HydrophobicContact CB-CD2 3.58Å; K181-L222 HydrophobicContact CG-CD2 3.64Å; K181-L222 WeakPolarHBondContact CG-O 3.44Å; F190-L222 HydrophobicContact CB-CD1 3.92Å; F190-L222 HydrophobicContact CB-CD2 3.77Å; A192-L222 HydrophobicContact CB-CB 4.38Å; A192-L222 HydrophobicContact CB-CD1 4.08Å; V198-L222 HydrophobicContact CG1-CD1 3.55Å; L222-V224 HydrophobicContact CD2-CG2 4.36Å; L222-L231 HydrophobicContact CD1-CD1 3.9Å; L222-L231 HydrophobicContact CD1-CD2 4.16Å; L222-L231 HydrophobicContact CD1-CG 4.32Å; L222-L231 HydrophobicContact CD2-CD1 3.52Å; L222-L231 HydrophobicContact CG-CD1 3.63Å; L222-L231 HydrophobicContact CG-CG 4.3Å; L222-V232 CarbonylContact C-O 3.55Å; L222-V232 WeakPolarHBondContact CA-O 3.44Å; L222-T233 HydrophobicContact CB-CG2 4.33Å; L222-T233 HydrophobicContact CD1-CG2 3.83Å; L222-T233 HydrophobicContact CG-CG2 3.95Å
223	A	96.4	Very high	95.7	Very high	8 Å²	8	35.1 Å²	35.1	7%	0.066	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.7	175.5	0	0	0	0	0	110.6	V232 V264 C266	A223-V232 PolarHBondContact N-O 3.45Å; A223-V232 PolarHBondContact O-N 2.93Å; A223-V264 HydrophobicContact CB-CG1 3.94Å; A223-V264 HydrophobicContact CB-CG2 4.19Å; A223-C266 HydrophobicContact CB-CB 4.26Å; A223-C266 VanDerWaalsContact CB-SG 3.53Å
224	V	95.7	Very high	95.8	Very high	24 Å²	24	27.3 Å²	27.3	15%	0.145	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.7	172.3	-179.4	0	0	0	0	107.7	K181 F190 L222 L231 M245	K181-V224 HydrophobicContact CB-CG2 4.03Å; F190-V224 HydrophobicContact CD2-CG2 3.61Å; F190-V224 HydrophobicContact CE2-CG2 4.08Å; F190-V224 HydrophobicContact CG-CG2 4.44Å; L222-V224 HydrophobicContact CD2-CG2 4.36Å; V224-L231 HydrophobicContact CG2-CD1 3.9Å; V224-M245 HydrophobicContact CG1-SD 4.38Å
225	H	95.8	Very high	96	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	15%	0.147	C	C	.	.			trans	-71.6	136.8	175.5	-175.9	-86.2	0	0	0	110.4	T227 I228 V230 C266 Q267	H225-T227 PolarHBondContact CE1-OG1 3.22Å; H225-T227 PolarHBondContact ND1-N 3.37Å; H225-T227 PolarHBondContact O-N 3.38Å; H225-I228 WeakPolarHBondContact CB-O 3.46Å; H225-I228 VanDerWaalsContact CE1-CG1 3.48Å; H225-I228 WeakPolarHBondContact CE1-CG1 3.38Å; H225-I228 PolarHBondContact CE1-N 2.89Å; H225-I228 WeakPolarHBondContact ND1-CA 3.41Å; H225-I228 VanDerWaalsContact ND1-CB 3.32Å; H225-I228 WeakPolarHBondContact ND1-CB 3.38Å; H225-I228 PolarHBondContact ND1-N 3.42Å; H225-I228 PolarHBondContact ND1-O 3.45Å; H225-V230 HydrophobicContact CB-CB 4.39Å; H225-V230 WeakPolarHBondContact CB-O 3.44Å; H225-V230 PolarHBondContact N-O 3.3Å; H225-C266 HydrophobicContact CB-CB 4.48Å; H225-Q267 PolarHBondContact NE2-O 3.36Å
226	P	92.8	Very high	96.1	Very high	49 Å²	49	33 Å²	33	32%	0.318	17%	0.173	S	C	.	.	S	Bend	trans	-73.4	-25.6	-168.5	26.5	-35.8	0	0	0	114.9	R185	R185-P226 WeakPolarHBondContact CD-O 3.45Å
227	T	93.4	Very high	96.1	Very high	66 Å²	66	28.6 Å²	28.6	41%	0.405	15%	0.15	S	C	.	.	S	Bend	trans	-119.2	-47	-174.8	57.8	0	0	0	0	113.3	R185 H225	R185-T227 PolarHBondContact NE-O 2.83Å; R185-T227 PolarHBondContact NH1-O 3.47Å; R185-T227 PolarHBondContact NH2-O 3.03Å; H225-T227 PolarHBondContact CE1-OG1 3.22Å; H225-T227 PolarHBondContact ND1-N 3.37Å; H225-T227 PolarHBondContact O-N 3.38Å
228	I	94.1	Very high	96.1	Very high	78 Å²	78	28.9 Å²	28.9	40%	0.4	15%	0.151	S	C	.	.	S	Bend	trans	-80.7	139.7	172.7	-52.2	164.3	0	0	0	109.9	H225 V230 L287	H225-I228 WeakPolarHBondContact CB-O 3.46Å; H225-I228 VanDerWaalsContact CE1-CG1 3.48Å; H225-I228 WeakPolarHBondContact CE1-CG1 3.38Å; H225-I228 PolarHBondContact CE1-N 2.89Å; H225-I228 WeakPolarHBondContact ND1-CA 3.41Å; H225-I228 VanDerWaalsContact ND1-CB 3.32Å; H225-I228 WeakPolarHBondContact ND1-CB 3.38Å; H225-I228 PolarHBondContact ND1-N 3.42Å; H225-I228 PolarHBondContact ND1-O 3.45Å; I228-V230 HydrophobicContact CG2-CB 4.18Å; I228-V230 HydrophobicContact CG2-CG2 3.65Å; I228-V230 PolarHBondContact O-N 2.79Å; I228-L287 HydrophobicContact CD1-CD2 4.23Å
229	D	94.4	Very high	96.1	Very high	62 Å²	62	29 Å²	29	33%	0.332	15%	0.151	S	C	.	.	S	Bend	trans	-77.3	57	-179	-76.9	-10.2	0	0	0	112.7	R185 Q186 M245	R185-D229 IonicContact CZ-OD1 4Å; R185-D229 IonicContact NE-OD1 3.39Å; R185-D229 PolarHBondContact NE-OD1 3.22Å; R185-D229 IonicContact NH2-OD1 3.85Å; Q186-D229 PolarHBondContact NE2-OD1 3.44Å; Q186-D229 PolarHBondContact NE2-OD2 3.06Å; D229-M245 VanDerWaalsContact C-CE 3.41Å; D229-M245 HydrophobicContact CB-CE 3.47Å; D229-M245 VanDerWaalsContact CB-CE 3.47Å; D229-M245 WeakPolarHBondContact O-CB 3.48Å; D229-M245 WeakPolarHBondContact O-CG 3.44Å; D229-M245 PolarHBondContact O-N 3.27Å
230	V	95.6	Very high	96.1	Very high	16 Å²	16	29 Å²	29	10%	0.097	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.3	-174.6	164.1	0	0	0	0	110.9	H225 I228 V232 V242 W243	H225-V230 HydrophobicContact CB-CB 4.39Å; H225-V230 WeakPolarHBondContact CB-O 3.44Å; H225-V230 PolarHBondContact N-O 3.3Å; I228-V230 HydrophobicContact CG2-CB 4.18Å; I228-V230 HydrophobicContact CG2-CG2 3.65Å; I228-V230 PolarHBondContact O-N 2.79Å; V230-V232 HydrophobicContact CG1-CG2 4.4Å; V230-V242 HydrophobicContact CG1-CG1 3.24Å; V230-W243 WeakPolarHBondContact CA-O 3.34Å
231	L	96.7	Very high	96.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.6	178.5	-178.3	71.1	0	0	0	110	F190 V198 Y212 L222 V224 T233 V242 W243 M245	F190-L231 HydrophobicContact CB-CD1 4.18Å; F190-L231 HydrophobicContact CD1-CD1 4.13Å; F190-L231 HydrophobicContact CD1-CD2 3.8Å; F190-L231 HydrophobicContact CD2-CD1 4.25Å; F190-L231 HydrophobicContact CE1-CD2 4.21Å; F190-L231 HydrophobicContact CG-CD1 3.91Å; F190-L231 HydrophobicContact CG-CD2 4.38Å; V198-L231 HydrophobicContact CG1-CD2 3.84Å; Y212-L231 HydrophobicContact CD2-CD2 3.9Å; Y212-L231 HydrophobicContact CE2-CD2 3.77Å; Y212-L231 HydrophobicContact CG-CD2 4.46Å; L222-L231 HydrophobicContact CD1-CD1 3.9Å; L222-L231 HydrophobicContact CD1-CD2 4.16Å; L222-L231 HydrophobicContact CD1-CG 4.32Å; L222-L231 HydrophobicContact CD2-CD1 3.52Å; L222-L231 HydrophobicContact CG-CD1 3.63Å; L222-L231 HydrophobicContact CG-CG 4.3Å; V224-L231 HydrophobicContact CG2-CD1 3.9Å; L231-T233 HydrophobicContact CD2-CG2 4.23Å; L231-T233 HydrophobicContact CG-CG2 4.12Å; L231-V242 CarbonylContact O-C 3.52Å; L231-V242 WeakPolarHBondContact O-CA 3.37Å; L231-W243 HydrophobicContact CB-CB 4.25Å; L231-W243 PolarHBondContact N-O 2.67Å; L231-W243 PolarHBondContact O-N 2.93Å; L231-M245 HydrophobicContact CB-CG 4.12Å
232	V	97.2	Very high	96.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.8	176.1	-169.1	0	0	0	0	109.3	L222 A223 V230 R241 V242 V264 C266 I273	L222-V232 CarbonylContact C-O 3.55Å; L222-V232 WeakPolarHBondContact CA-O 3.44Å; A223-V232 PolarHBondContact N-O 3.45Å; A223-V232 PolarHBondContact O-N 2.93Å; V230-V232 HydrophobicContact CG1-CG2 4.4Å; V232-R241 WeakPolarHBondContact CA-O 3.4Å; V232-V242 HydrophobicContact CG1-CG2 4.45Å; V232-V242 HydrophobicContact CG2-CG2 4.33Å; V232-V264 HydrophobicContact CB-CG2 4.2Å; V232-V264 HydrophobicContact CG1-CG2 3.75Å; V232-C266 VanDerWaalsContact CG2-SG 3.56Å; V232-I273 HydrophobicContact CG1-CD1 4.15Å; V232-I273 HydrophobicContact CG1-CG2 4.1Å; V232-I273 HydrophobicContact CG2-CD1 3.59Å; V232-I273 HydrophobicContact CG2-CG1 4.05Å
233	T	97.7	Very high	96.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	141	-173.4	52.9	0	0	0	0	110.2	V198 H215 L222 L231 A240 R241 W243	V198-T233 HydrophobicContact CG1-CG2 4.11Å; V198-T233 HydrophobicContact CG2-CG2 4.04Å; H215-T233 PolarHBondContact CE1-OG1 3.39Å; H215-T233 WeakPolarHBondContact NE2-CB 3.44Å; H215-T233 PolarHBondContact NE2-OG1 3.12Å; L222-T233 HydrophobicContact CB-CG2 4.33Å; L222-T233 HydrophobicContact CD1-CG2 3.83Å; L222-T233 HydrophobicContact CG-CG2 3.95Å; L231-T233 HydrophobicContact CD2-CG2 4.23Å; L231-T233 HydrophobicContact CG-CG2 4.12Å; T233-A240 CarbonylContact O-C 3.6Å; T233-A240 WeakPolarHBondContact O-CA 3.35Å; T233-R241 PolarHBondContact N-O 2.85Å; T233-R241 PolarHBondContact O-N 3.17Å; T233-R241 PolarHBondContact OG1-O 3.41Å; T233-R241 VanDerWaalsContact OG1-O 3.1Å; T233-W243 PolarHBondContact OG1-NE1 3.07Å
234	T	97.3	Very high	96.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.2	-178.5	54	0	0	0	0	111	V219 Y220 D221 A240 V261 V264 T275	V219-T234 CarbonylContact C-O 3.52Å; V219-T234 VanDerWaalsContact CA-O 3.3Å; V219-T234 WeakPolarHBondContact CA-O 3.48Å; V219-T234 WeakPolarHBondContact CG1-O 3.26Å; Y220-T234 PolarHBondContact N-O 3Å; D221-T234 WeakPolarHBondContact CA-OG1 2.99Å; D221-T234 VanDerWaalsContact CB-OG1 3.3Å; D221-T234 WeakPolarHBondContact CB-OG1 3.39Å; D221-T234 PolarHBondContact N-OG1 3.1Å; D221-T234 VanDerWaalsContact N-OG1 3.12Å; D221-T234 PolarHBondContact O-N 3.46Å; D221-T234 PolarHBondContact O-OG1 2.91Å; T234-A240 HydrophobicContact CG2-CB 3.97Å; T234-V261 WeakPolarHBondContact CB-O 3.44Å; T234-V261 HydrophobicContact CG2-CB 4.07Å; T234-V261 HydrophobicContact CG2-CG1 3.38Å; T234-V264 HydrophobicContact CG2-CB 3.51Å; T234-V264 HydrophobicContact CG2-CG1 3.66Å; T234-V264 HydrophobicContact CG2-CG2 4.41Å; T234-T275 HydrophobicContact CG2-CG2 4.38Å
235	S	97.2	Very high	96.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	163.8	-172.3	153.7	0	0	0	0	112.8	H215 A218 D237 S238 T239 V261	H215-S235 WeakPolarHBondContact ND1-CB 3.42Å; A218-S235 CarbonylContact O-C 3.47Å; A218-S235 VanDerWaalsContact O-CA 3.27Å; A218-S235 WeakPolarHBondContact O-CA 3.46Å; A218-S235 PolarHBondContact O-OG 2.89Å; S235-D237 WeakPolarHBondContact CB-OD1 3.47Å; S235-D237 PolarHBondContact O-N 2.85Å; S235-D237 PolarHBondContact OG-N 2.94Å; S235-D237 VanDerWaalsContact OG-N 3.13Å; S235-D237 PolarHBondContact OG-OD1 3.46Å; S235-D237 PolarHBondContact OG-OD2 3.22Å; S235-S238 PolarHBondContact O-N 3.39Å; S235-T239 PolarHBondContact N-O 3.02Å; S235-T239 VanDerWaalsContact N-O 3.13Å; S235-V261 PolarHBondContact O-N 3.12Å; S235-V261 VanDerWaalsContact O-N 3.15Å
236	R	96.9	Very high	96	Very high	149 Å²	149	35.1 Å²	35.1	56%	0.562	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.3	172.4	-149.7	-177.4	162.3	172.6	-4.4	112.6	S217 A218 Y220 S238 T260	S217-R236 WeakPolarHBondContact OG-CB 3.49Å; A218-R236 HydrophobicContact CB-CB 4.44Å; A218-R236 PolarHBondContact O-N 2.95Å; Y220-R236 HydrophobicContact CD2-CB 4.34Å; Y220-R236 HydrophobicContact CE2-CB 3.71Å; Y220-R236 HydrophobicContact CE2-CG 3.84Å; R236-S238 PolarHBondContact O-N 3.37Å; R236-T260 HydrophobicContact CB-CG2 4.18Å; R236-T260 HydrophobicContact CG-CG2 3.28Å
237	D	96.1	Very high	96.1	Very high	29 Å²	29	35.6 Å²	35.6	16%	0.155	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	20.8	178.4	68.2	-2.7	0	0	0	113.9	L216 S235 T239 R241	L216-D237 HydrophobicContact CB-CB 4.02Å; L216-D237 PolarHBondContact N-OD2 3.04Å; L216-D237 VanDerWaalsContact N-OD2 3.14Å; S235-D237 WeakPolarHBondContact CB-OD1 3.47Å; S235-D237 PolarHBondContact O-N 2.85Å; S235-D237 PolarHBondContact OG-N 2.94Å; S235-D237 VanDerWaalsContact OG-N 3.13Å; S235-D237 PolarHBondContact OG-OD1 3.46Å; S235-D237 PolarHBondContact OG-OD2 3.22Å; D237-T239 VanDerWaalsContact CG-OG1 3.31Å; D237-T239 WeakPolarHBondContact O-CG2 3.47Å; D237-T239 PolarHBondContact O-N 3.39Å; D237-T239 VanDerWaalsContact O-N 3.09Å; D237-T239 PolarHBondContact OD1-N 2.67Å; D237-T239 PolarHBondContact OD1-OG1 3.3Å; D237-T239 PolarHBondContact OD2-OG1 2.9Å; D237-R241 IonicContact OD1-NH1 3.82Å; D237-R241 IonicContact OD2-CZ 3.58Å; D237-R241 IonicContact OD2-NH1 2.72Å; D237-R241 PolarHBondContact OD2-NH1 2.85Å; D237-R241 IonicContact OD2-NH2 3.49Å; D237-R241 PolarHBondContact OD2-NH2 2.96Å
238	S	96.4	Very high	96.1	Very high	38 Å²	38	37.4 Å²	37.4	27%	0.266	17%	0.174	S	C	.	.	S	Bend	trans	56.1	21.5	-179.9	67.1	0	0	0	0	115.3	S235 R236 H257 N259	S235-S238 PolarHBondContact O-N 3.39Å; R236-S238 PolarHBondContact O-N 3.37Å; S238-H257 WeakPolarHBondContact CB-O 3.43Å; S238-N259 VanDerWaalsContact CA-O 3.29Å; S238-N259 WeakPolarHBondContact CA-O 3.46Å; S238-N259 WeakPolarHBondContact CB-O 3.4Å
239	T	96.7	Very high	96.2	Very high	14 Å²	14	36.1 Å²	36.1	9%	0.086	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	151.6	176.9	70.1	0	0	0	0	112.1	S235 D237 R241 T255	S235-T239 PolarHBondContact N-O 3.02Å; S235-T239 VanDerWaalsContact N-O 3.13Å; D237-T239 VanDerWaalsContact CG-OG1 3.31Å; D237-T239 WeakPolarHBondContact O-CG2 3.47Å; D237-T239 PolarHBondContact O-N 3.39Å; D237-T239 VanDerWaalsContact O-N 3.09Å; D237-T239 PolarHBondContact OD1-N 2.67Å; D237-T239 PolarHBondContact OD1-OG1 3.3Å; D237-T239 PolarHBondContact OD2-OG1 2.9Å; T239-R241 PolarHBondContact OG1-NH1 2.87Å; T239-T255 HydrophobicContact CG2-CG2 4.08Å
240	A	97.1	Very high	96.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.6	158.5	0	0	0	0	0	108.9	T233 T234 L254 T275	T233-A240 CarbonylContact O-C 3.6Å; T233-A240 WeakPolarHBondContact O-CA 3.35Å; T234-A240 HydrophobicContact CG2-CB 3.97Å; A240-L254 HydrophobicContact CB-CB 4.08Å; A240-L254 HydrophobicContact CB-CD1 4.09Å; A240-L254 PolarHBondContact N-O 3.02Å; A240-L254 VanDerWaalsContact N-O 3.15Å; A240-L254 WeakPolarHBondContact O-CA 3.28Å; A240-L254 WeakPolarHBondContact O-CB 3.3Å; A240-L254 WeakPolarHBondContact O-CG 3.29Å; A240-L254 PolarHBondContact O-N 2.9Å; A240-T275 HydrophobicContact CB-CG2 3.97Å
241	R	97.3	Very high	96.3	Very high	17 Å²	17	39.7 Å²	39.7	6%	0.064	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.8	179.3	-65.7	-167.6	168	75.9	0.2	110.4	G214 H215 V232 T233 D237 T239 W243 Q250	G214-R241 PolarHBondContact O-NE 3.4Å; G214-R241 PolarHBondContact O-NH2 3.3Å; H215-R241 VanDerWaalsContact CA-NH1 3.33Å; H215-R241 PolarHBondContact ND1-NH1 3.05Å; V232-R241 WeakPolarHBondContact CA-O 3.4Å; T233-R241 PolarHBondContact N-O 2.85Å; T233-R241 PolarHBondContact O-N 3.17Å; T233-R241 PolarHBondContact OG1-O 3.41Å; T233-R241 VanDerWaalsContact OG1-O 3.1Å; D237-R241 IonicContact OD1-NH1 3.82Å; D237-R241 IonicContact OD2-CZ 3.58Å; D237-R241 IonicContact OD2-NH1 2.72Å; D237-R241 PolarHBondContact OD2-NH1 2.85Å; D237-R241 IonicContact OD2-NH2 3.49Å; D237-R241 PolarHBondContact OD2-NH2 2.96Å; T239-R241 PolarHBondContact OG1-NH1 2.87Å; R241-W243 HydrophobicContact CB-CZ2 3.78Å; R241-W243 HydrophobicContact CG-CZ2 4.23Å; R241-Q250 VanDerWaalsContact CG-NE2 3.33Å
242	V	97.6	Very high	96.2	Very high	1 Å²	1	42 Å²	42	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.7	175.2	-178	0	0	0	0	108.2	V230 L231 V232 Q250 V251 H252 L254 I273 L287	V230-V242 HydrophobicContact CG1-CG1 3.24Å; L231-V242 CarbonylContact O-C 3.52Å; L231-V242 WeakPolarHBondContact O-CA 3.37Å; V232-V242 HydrophobicContact CG1-CG2 4.45Å; V232-V242 HydrophobicContact CG2-CG2 4.33Å; V242-Q250 CarbonylContact O-C 3.57Å; V242-Q250 WeakPolarHBondContact O-CA 3.09Å; V242-V251 HydrophobicContact CG1-CB 4.31Å; V242-V251 PolarHBondContact O-N 2.87Å; V242-H252 HydrophobicContact CB-CB 4.08Å; V242-H252 HydrophobicContact CG2-CB 4.07Å; V242-H252 PolarHBondContact N-O 3.12Å; V242-L254 HydrophobicContact CG2-CD1 3.98Å; V242-L254 HydrophobicContact CG2-CG 4.14Å; V242-I273 HydrophobicContact CG2-CD1 3.96Å; V242-L287 HydrophobicContact CB-CD1 4.39Å; V242-L287 HydrophobicContact CG1-CD1 3.66Å; V242-L287 HydrophobicContact CG2-CD1 3.89Å
243	W	97.2	Very high	96.2	Very high	3 Å²	3	44.7 Å²	44.7	1%	0.011	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.5	-177.4	-50.3	92.4	0	0	0	110.7	Y212 H213 H215 V230 L231 T233 R241 M245 A249 Q250	Y212-W243 HydrophobicContact CD1-CB 3.9Å; Y212-W243 HydrophobicContact CD1-CD2 4.29Å; Y212-W243 HydrophobicContact CD1-CE3 4.31Å; Y212-W243 HydrophobicContact CD1-CG 4.13Å; Y212-W243 HydrophobicContact CE1-CB 4.28Å; Y212-W243 HydrophobicContact CG-CD2 4.45Å; Y212-W243 HydrophobicContact CG-CG 4.4Å; H213-W243 WeakPolarHBondContact O-CH2 3.48Å; H213-W243 WeakPolarHBondContact O-CZ3 3.36Å; H215-W243 AromaticContact CD2-CZ2 3.92Å; H215-W243 AromaticContact NE2-CZ2 3.92Å; H215-W243 AromaticContact NE2-NE1 3.84Å; V230-W243 WeakPolarHBondContact CA-O 3.34Å; L231-W243 HydrophobicContact CB-CB 4.25Å; L231-W243 PolarHBondContact N-O 2.67Å; L231-W243 PolarHBondContact O-N 2.93Å; T233-W243 PolarHBondContact OG1-NE1 3.07Å; R241-W243 HydrophobicContact CB-CZ2 3.78Å; R241-W243 HydrophobicContact CG-CZ2 4.23Å; W243-M245 PolarHBondContact O-N 3.08Å; W243-A249 WeakPolarHBondContact CA-O 3.44Å; W243-Q250 HydrophobicContact CE3-CB 3.91Å; W243-Q250 HydrophobicContact CH2-CB 4.23Å; W243-Q250 HydrophobicContact CZ3-CB 3.65Å; W243-Q250 HydrophobicContact CZ3-CG 4.42Å
244	D	96.3	Very high	96.1	Very high	34 Å²	34	44.7 Å²	44.7	18%	0.182	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.4	163.7	170.6	6.2	0	0	0	108.8	R246 T247 K248 A249 V251	D244-R246 PolarHBondContact O-N 3.01Å; D244-R246 PolarHBondContact OD1-N 3.25Å; D244-R246 IonicContact OD2-NH2 3.89Å; D244-T247 WeakPolarHBondContact CB-OG1 3.4Å; D244-T247 WeakPolarHBondContact OD2-CB 3.31Å; D244-T247 WeakPolarHBondContact OD2-CG2 3.42Å; D244-T247 PolarHBondContact OD2-OG1 3.1Å; D244-K248 WeakPolarHBondContact O-CA 3.21Å; D244-K248 PolarHBondContact O-N 2.76Å; D244-A249 PolarHBondContact N-O 3.44Å; D244-A249 VanDerWaalsContact N-O 3.07Å; D244-V251 HydrophobicContact CB-CG2 3.99Å
245	M	93.8	Very high	96	Very high	5 Å²	5	49 Å²	49	3%	0.025	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.6	-175.4	-68	-163.6	-59.6	0	0	112.6	F190 R210 Y212 V224 D229 L231 W243	F190-M245 HydrophobicContact CE1-SD 4.35Å; F190-M245 HydrophobicContact CE2-SD 3.69Å; F190-M245 HydrophobicContact CZ-CG 4.1Å; F190-M245 HydrophobicContact CZ-SD 3.39Å; F190-M245 WeakPolarHBondContact CZ-SD 3.21Å; R210-M245 WeakPolarHBondContact CD-O 3.31Å; Y212-M245 PolarHBondContact OH-O 2.89Å; V224-M245 HydrophobicContact CG1-SD 4.38Å; D229-M245 VanDerWaalsContact C-CE 3.41Å; D229-M245 HydrophobicContact CB-CE 3.47Å; D229-M245 VanDerWaalsContact CB-CE 3.47Å; D229-M245 WeakPolarHBondContact O-CB 3.48Å; D229-M245 WeakPolarHBondContact O-CG 3.44Å; D229-M245 PolarHBondContact O-N 3.27Å; L231-M245 HydrophobicContact CB-CG 4.12Å; W243-M245 PolarHBondContact O-N 3.08Å
246	R	93.7	Very high	95.9	Very high	177 Å²	177	50.3 Å²	50.3	67%	0.668	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-52.3	-175.2	-178.8	179.8	56.1	76.8	8.9	112.1	D244	D244-R246 PolarHBondContact O-N 3.01Å; D244-R246 PolarHBondContact OD1-N 3.25Å; D244-R246 IonicContact OD2-NH2 3.89Å
247	T	94.6	Very high	95.8	Very high	59 Å²	59	43.7 Å²	43.7	36%	0.362	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-19.8	-174.9	60.2	0	0	0	0	113	D244 A249	D244-T247 WeakPolarHBondContact CB-OG1 3.4Å; D244-T247 WeakPolarHBondContact OD2-CB 3.31Å; D244-T247 WeakPolarHBondContact OD2-CG2 3.42Å; D244-T247 PolarHBondContact OD2-OG1 3.1Å; T247-A249 PolarHBondContact O-N 3.31Å; T247-A249 PolarHBondContact OG1-N 2.8Å
248	K	94.3	Very high	95.9	Very high	103 Å²	103	48.1 Å²	48.1	45%	0.448	27%	0.267	S	S	.	.			trans	65.8	6.5	-171.5	-44.8	162.2	-71	177.5	0	113.7	R210 Y212 D244	R210-K248 HydrophobicContact CB-CD 3.95Å; R210-K248 HydrophobicContact CB-CG 4.1Å; R210-K248 HydrophobicContact CG-CD 4.13Å; R210-K248 HydrophobicContact CG-CG 4.27Å; Y212-K248 HydrophobicContact CD1-CB 3.86Å; Y212-K248 HydrophobicContact CD1-CG 4.29Å; Y212-K248 HydrophobicContact CE1-CB 3.99Å; Y212-K248 HydrophobicContact CE1-CG 4.02Å; D244-K248 WeakPolarHBondContact O-CA 3.21Å; D244-K248 PolarHBondContact O-N 2.76Å
249	A	96	Very high	95.9	Very high	52 Å²	52	49.7 Å²	49.7	43%	0.43	27%	0.272	S	S	.	.			trans	-74.8	145.8	178.3	0	0	0	0	0	110.1	W243 D244 T247 V251	W243-A249 WeakPolarHBondContact CA-O 3.44Å; D244-A249 PolarHBondContact N-O 3.44Å; D244-A249 VanDerWaalsContact N-O 3.07Å; T247-A249 PolarHBondContact O-N 3.31Å; T247-A249 PolarHBondContact OG1-N 2.8Å; A249-V251 PolarHBondContact O-N 3.15Å
250	Q	95.7	Very high	95.9	Very high	76 Å²	76	49.9 Å²	49.9	36%	0.355	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	121.3	167.9	-175.8	176.4	-0.4	0	0	108.5	R241 V242 W243 H252 C253	R241-Q250 VanDerWaalsContact CG-NE2 3.33Å; V242-Q250 CarbonylContact O-C 3.57Å; V242-Q250 WeakPolarHBondContact O-CA 3.09Å; W243-Q250 HydrophobicContact CE3-CB 3.91Å; W243-Q250 HydrophobicContact CH2-CB 4.23Å; W243-Q250 HydrophobicContact CZ3-CB 3.65Å; W243-Q250 HydrophobicContact CZ3-CG 4.42Å; Q250-H252 WeakPolarHBondContact CG-O 3.46Å; Q250-H252 PolarHBondContact NE2-O 2.86Å; Q250-C253 VanDerWaalsContact NE2-CA 3.32Å
251	V	95.7	Very high	95.9	Very high	76 Å²	76	49.9 Å²	49.9	46%	0.461	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-50.3	176.7	-174.8	0	0	0	0	110	V242 D244 A249	V242-V251 HydrophobicContact CG1-CB 4.31Å; V242-V251 PolarHBondContact O-N 2.87Å; D244-V251 HydrophobicContact CB-CG2 3.99Å; A249-V251 PolarHBondContact O-N 3.15Å
252	H	96.2	Very high	95.9	Very high	50 Å²	50	49.7 Å²	49.7	23%	0.231	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	149	178.6	-65.8	-68.8	0	0	0	111.9	V242 Q250 L254 L287	V242-H252 HydrophobicContact CB-CB 4.08Å; V242-H252 HydrophobicContact CG2-CB 4.07Å; V242-H252 PolarHBondContact N-O 3.12Å; Q250-H252 WeakPolarHBondContact CG-O 3.46Å; Q250-H252 PolarHBondContact NE2-O 2.86Å; H252-L254 HydrophobicContact CB-CD2 4.18Å; H252-L287 PolarHBondContact CD2-O 2.69Å; H252-L287 PolarHBondContact NE2-O 3.23Å
253	C	95.8	Very high	95.8	Very high	55 Å²	55	50 Å²	50	37%	0.372	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	101.1	164.1	-160.7	0	0	0	0	107.6	Q250 T255	Q250-C253 VanDerWaalsContact NE2-CA 3.32Å; C253-T255 HydrophobicContact CB-CG2 4.46Å; C253-T255 PolarHBondContact O-N 2.88Å
254	L	96.4	Very high	95.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	93	178.6	-52.5	177.1	0	0	0	108.2	A240 V242 H252 I273 W285 G290	A240-L254 HydrophobicContact CB-CB 4.08Å; A240-L254 HydrophobicContact CB-CD1 4.09Å; A240-L254 PolarHBondContact N-O 3.02Å; A240-L254 VanDerWaalsContact N-O 3.15Å; A240-L254 WeakPolarHBondContact O-CA 3.28Å; A240-L254 WeakPolarHBondContact O-CB 3.3Å; A240-L254 WeakPolarHBondContact O-CG 3.29Å; A240-L254 PolarHBondContact O-N 2.9Å; V242-L254 HydrophobicContact CG2-CD1 3.98Å; V242-L254 HydrophobicContact CG2-CG 4.14Å; H252-L254 HydrophobicContact CB-CD2 4.18Å; L254-I273 HydrophobicContact CD1-CD1 4Å; L254-I273 HydrophobicContact CD1-CG2 4.22Å; L254-W285 HydrophobicContact CB-CD2 4.05Å; L254-W285 HydrophobicContact CB-CE3 3.88Å; L254-W285 HydrophobicContact CB-CH2 3.98Å; L254-W285 HydrophobicContact CB-CZ2 4.12Å; L254-W285 HydrophobicContact CB-CZ3 3.85Å; L254-W285 HydrophobicContact CD1-CB 4.32Å; L254-W285 HydrophobicContact CD1-CD2 4.05Å; L254-W285 HydrophobicContact CD1-CE3 4.42Å; L254-W285 HydrophobicContact CD1-CG 3.98Å; L254-W285 HydrophobicContact CD2-CD2 4.24Å; L254-W285 HydrophobicContact CD2-CE3 3.8Å; L254-W285 HydrophobicContact CD2-CZ3 4.35Å; L254-W285 HydrophobicContact CG-CD2 4.34Å; L254-W285 HydrophobicContact CG-CE3 4.24Å; L254-G290 WeakPolarHBondContact CD2-O 3.3Å
255	T	95.3	Very high	95.8	Very high	92 Å²	92	49.5 Å²	49.5	56%	0.564	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	140.1	178.2	55	0	0	0	0	110.6	T239 C253 W285	T239-T255 HydrophobicContact CG2-CG2 4.08Å; C253-T255 HydrophobicContact CB-CG2 4.46Å; C253-T255 PolarHBondContact O-N 2.88Å; T255-W285 WeakPolarHBondContact O-CH2 3.14Å
256	G	93.8	Very high	95.9	Very high	27 Å²	27	50 Å²	50	28%	0.278	28%	0.28	S	S	.	.			trans	156.4	-25.8	174	0	0	0	0	0	113.6	R283	G256-R283 PolarHBondContact O-NH2 2.79Å
257	H	96.8	Very high	95.9	Very high	9 Å²	9	42.9 Å²	42.9	4%	0.042	25%	0.254	C	S	.	.			trans	-66.1	144.4	168.3	-76.8	-62.3	0	0	0	110.6	S238 V261 T275 S277 D279 T281	S238-H257 WeakPolarHBondContact CB-O 3.43Å; H257-V261 HydrophobicContact CB-CG2 3.84Å; H257-T275 PolarHBondContact NE2-OG1 2.64Å; H257-S277 VanDerWaalsContact CE1-CB 3.48Å; H257-S277 WeakPolarHBondContact CE1-CB 3.39Å; H257-S277 WeakPolarHBondContact ND1-CB 3.31Å; H257-D279 VanDerWaalsContact CA-OD2 3.26Å; H257-D279 WeakPolarHBondContact CA-OD2 3.24Å; H257-D279 WeakPolarHBondContact CB-OD2 3.32Å; H257-D279 IonicContact CE1-OD1 4Å; H257-D279 IonicContact CE1-OD2 3.94Å; H257-D279 IonicContact CG-OD2 3.41Å; H257-D279 IonicContact ND1-OD1 3.43Å; H257-D279 PolarHBondContact ND1-OD1 2.97Å; H257-D279 IonicContact ND1-OD2 2.78Å; H257-D279 PolarHBondContact ND1-OD2 2.86Å; H257-T281 PolarHBondContact CE1-OG1 2.87Å; H257-T281 PolarHBondContact ND1-OG1 2.83Å
258	T	96.4	Very high	95.8	Very high	122 Å²	122	43.6 Å²	43.6	75%	0.748	26%	0.261	S	S	*	.	S	Bend	trans	-97.7	-9.9	-179.4	58	0	0	0	0	112.6	D279	T258-D279 PolarHBondContact N-OD2 3Å; T258-D279 WeakPolarHBondContact OG1-CB 3.31Å
259	N	96.9	Very high	95.8	Very high	71 Å²	71	40.6 Å²	40.6	38%	0.38	26%	0.256	S	S	.	.	S	Bend	trans	-138.6	-180	-179.1	-153.9	-13.4	0	0	0	110.4	S238 V261 S277 H278 D279	S238-N259 VanDerWaalsContact CA-O 3.29Å; S238-N259 WeakPolarHBondContact CA-O 3.46Å; S238-N259 WeakPolarHBondContact CB-O 3.4Å; N259-V261 PolarHBondContact O-N 3.47Å; N259-S277 PolarHBondContact O-OG 3.33Å; N259-H278 HydrophobicContact CB-CB 4.27Å; N259-D279 HydrophobicContact CB-CB 3.88Å
260	T	96.9	Very high	95.5	Very high	18 Å²	18	42.3 Å²	42.3	11%	0.11	26%	0.258	C	S	.	.			trans	-55.4	127.7	-177.2	61.6	0	0	0	0	111.5	R236 A262 S277 H278	R236-T260 HydrophobicContact CB-CG2 4.18Å; R236-T260 HydrophobicContact CG-CG2 3.28Å; T260-A262 PolarHBondContact O-N 3.47Å; T260-S277 PolarHBondContact O-OG 3.16Å; T260-S277 VanDerWaalsContact O-OG 3.14Å; T260-H278 PolarHBondContact O-CD2 2.88Å; T260-H278 PolarHBondContact O-N 3.13Å; T260-H278 WeakPolarHBondContact OG1-CB 3.43Å; T260-H278 PolarHBondContact OG1-CD2 3.26Å; T260-H278 VanDerWaalsContact OG1-CG 3.23Å
261	V	97.5	Very high	95.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.7	177.6	-171.8	0	0	0	0	108.3	T234 S235 H257 N259 T275	T234-V261 WeakPolarHBondContact CB-O 3.44Å; T234-V261 HydrophobicContact CG2-CB 4.07Å; T234-V261 HydrophobicContact CG2-CG1 3.38Å; S235-V261 PolarHBondContact O-N 3.12Å; S235-V261 VanDerWaalsContact O-N 3.15Å; H257-V261 HydrophobicContact CB-CG2 3.84Å; N259-V261 PolarHBondContact O-N 3.47Å; V261-T275 HydrophobicContact CG1-CG2 4.32Å
262	A	96.6	Very high	95.3	Very high	13 Å²	13	36.6 Å²	36.6	11%	0.107	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-36.7	-169.4	0	0	0	0	0	112.9	D221 T260 G276 I303	D221-A262 WeakPolarHBondContact CB-O 3.33Å; T260-A262 PolarHBondContact O-N 3.47Å; A262-G276 PolarHBondContact N-O 2.88Å; A262-I303 VanDerWaalsContact CB-O 3.3Å; A262-I303 WeakPolarHBondContact CB-O 3.3Å
263	T	96.6	Very high	95.3	Very high	9 Å²	9	34.2 Å²	34.2	6%	0.055	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.7	-169.8	-177.1	0	0	0	0	112	D221 T275 G276 V306	D221-T263 VanDerWaalsContact OD2-CA 3.22Å; D221-T263 WeakPolarHBondContact OD2-CA 3.46Å; D221-T263 PolarHBondContact OD2-OG1 3.42Å; D221-T263 VanDerWaalsContact OD2-OG1 3.09Å; T263-T275 WeakPolarHBondContact O-CA 3.31Å; T263-G276 PolarHBondContact N-O 3.21Å; T263-G276 PolarHBondContact O-N 3.11Å; T263-V306 HydrophobicContact CG2-CB 3.99Å; T263-V306 HydrophobicContact CG2-CG2 3.7Å
264	V	96.9	Very high	95.4	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.024	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139.9	173.1	55.6	0	0	0	0	111.3	D221 A223 V232 T234 I273 I274 T275	D221-V264 HydrophobicContact CB-CG1 4.16Å; D221-V264 PolarHBondContact OD2-N 2.95Å; A223-V264 HydrophobicContact CB-CG1 3.94Å; A223-V264 HydrophobicContact CB-CG2 4.19Å; V232-V264 HydrophobicContact CB-CG2 4.2Å; V232-V264 HydrophobicContact CG1-CG2 3.75Å; T234-V264 HydrophobicContact CG2-CB 3.51Å; T234-V264 HydrophobicContact CG2-CG1 3.66Å; T234-V264 HydrophobicContact CG2-CG2 4.41Å; V264-I273 HydrophobicContact CG2-CG2 3.89Å; V264-I274 WeakPolarHBondContact CA-O 3.41Å; V264-T275 HydrophobicContact CB-CG2 4.41Å; V264-T275 HydrophobicContact CG2-CG2 4.2Å
265	T	96	Very high	95.4	Very high	21 Å²	21	31.6 Å²	31.6	13%	0.129	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	141.6	169.3	57.9	0	0	0	0	110	I274 V306	T265-I274 PolarHBondContact N-O 2.85Å; T265-I274 PolarHBondContact O-N 3.47Å; T265-V306 HydrophobicContact CG2-CB 4.37Å; T265-V306 HydrophobicContact CG2-CG1 4.19Å; T265-V306 VanDerWaalsContact CG2-O 3.24Å; T265-V306 WeakPolarHBondContact CG2-O 3.48Å
266	C	95.3	Very high	95.5	Very high	17 Å²	17	27.2 Å²	27.2	12%	0.115	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.5	177	-62.1	0	0	0	0	110.8	A223 H225 V232 Q272 L308	A223-C266 HydrophobicContact CB-CB 4.26Å; A223-C266 VanDerWaalsContact CB-SG 3.53Å; H225-C266 HydrophobicContact CB-CB 4.48Å; V232-C266 VanDerWaalsContact CG2-SG 3.56Å; C266-Q272 CarbonylContact C-O 3.6Å; C266-Q272 WeakPolarHBondContact CA-O 3.33Å; C266-L308 VanDerWaalsContact O-CD1 3.3Å; C266-L308 WeakPolarHBondContact O-CD1 3.39Å
267	Q	94.2	Very high	95.7	Very high	26 Å²	26	25.9 Å²	25.9	12%	0.121	16%	0.157	C	C	.	.			trans	-137	164	170.6	56.7	172.2	16.7	0	0	110.4	H225 A269 P271 Q272 I274 L308	H225-Q267 PolarHBondContact NE2-O 3.36Å; Q267-A269 VanDerWaalsContact CG-O 3.31Å; Q267-A269 WeakPolarHBondContact CG-O 3.35Å; Q267-A269 PolarHBondContact NE2-O 3.45Å; Q267-A269 VanDerWaalsContact NE2-O 3.09Å; Q267-P271 WeakPolarHBondContact CG-O 3.41Å; Q267-P271 PolarHBondContact NE2-O 2.89Å; Q267-Q272 PolarHBondContact N-O 2.77Å; Q267-Q272 WeakPolarHBondContact O-CA 3.47Å; Q267-I274 HydrophobicContact CG-CD1 4.42Å; Q267-L308 HydrophobicContact CB-CD1 3.89Å
268	S	92.7	Very high	95.7	Very high	74 Å²	74	27.5 Å²	27.5	52%	0.517	17%	0.165	S	C	.	.	S	Bend	trans	-81.9	-17.1	-179.4	55.8	0	0	0	0	114.5
269	A	93.5	Very high	95.7	Very high	40 Å²	40	22.9 Å²	22.9	33%	0.331	14%	0.136	S	C	.	.	S	Bend	trans	-102.9	153.9	180	0	0	0	0	0	110.4	Q267 P271 Q272 F313	Q267-A269 VanDerWaalsContact CG-O 3.31Å; Q267-A269 WeakPolarHBondContact CG-O 3.35Å; Q267-A269 PolarHBondContact NE2-O 3.45Å; Q267-A269 VanDerWaalsContact NE2-O 3.09Å; A269-P271 CarbonylContact O-C 3.54Å; A269-P271 VanDerWaalsContact O-O 3.09Å; A269-Q272 PolarHBondContact O-N 2.74Å; A269-F313 HydrophobicContact CB-CE2 3.73Å; A269-F313 HydrophobicContact CB-CZ 4.07Å
270	D	90.8	Very high	95.7	Very high	89 Å²	89	21.1 Å²	21.1	48%	0.476	13%	0.128	S	C	.	.	S	Bend	trans	-74.1	132.7	-179.8	-59.4	-34.1	0	0	0	111	Q272 F313	D270-Q272 WeakPolarHBondContact OD1-CG 3.49Å; D270-Q272 PolarHBondContact OD1-NE2 2.94Å; D270-F313 WeakPolarHBondContact O-CZ 3.4Å
271	P	93.4	Very high	95.7	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.006	13%	0.129	C	C	.	.	S	Bend	cis	-74.5	128.5	1.7	30.9	-37.9	0	0	0	113.9	Q267 A269 L284 M293 F328	Q267-P271 WeakPolarHBondContact CG-O 3.41Å; Q267-P271 PolarHBondContact NE2-O 2.89Å; A269-P271 CarbonylContact O-C 3.54Å; A269-P271 VanDerWaalsContact O-O 3.09Å; P271-L284 HydrophobicContact CB-CB 3.84Å; P271-L284 HydrophobicContact CB-CD2 4.32Å; P271-L284 HydrophobicContact CB-CG 4.48Å; P271-L284 HydrophobicContact CG-CB 4.13Å; P271-L284 HydrophobicContact CG-CD1 4.06Å; P271-L284 HydrophobicContact CG-CD2 3.88Å; P271-L284 HydrophobicContact CG-CG 4.24Å; P271-M293 HydrophobicContact CB-CE 3.42Å; P271-M293 VanDerWaalsContact CB-CE 3.42Å; P271-F328 VanDerWaalsContact CD-CD1 3.4Å; P271-F328 HydrophobicContact CG-CD1 3.34Å; P271-F328 HydrophobicContact CG-CE1 3.27Å; P271-F328 HydrophobicContact CG-CG 4.38Å; P271-F328 HydrophobicContact CG-CZ 4.28Å
272	Q	93.5	Very high	95.7	Very high	30 Å²	30	21.2 Å²	21.2	14%	0.14	13%	0.129	C	C	.	.			trans	-74.6	-30.6	-173.6	-71.5	172.6	26.6	0	0	113.6	C266 Q267 A269 D270 L287	C266-Q272 CarbonylContact C-O 3.6Å; C266-Q272 WeakPolarHBondContact CA-O 3.33Å; Q267-Q272 PolarHBondContact N-O 2.77Å; Q267-Q272 WeakPolarHBondContact O-CA 3.47Å; A269-Q272 PolarHBondContact O-N 2.74Å; D270-Q272 WeakPolarHBondContact OD1-CG 3.49Å; D270-Q272 PolarHBondContact OD1-NE2 2.94Å; Q272-L287 HydrophobicContact CB-CB 4.16Å
273	I	96.7	Very high	95.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.8	-179	-59.1	170.5	0	0	0	108.8	V232 V242 L254 V264 T275 W285 L287	V232-I273 HydrophobicContact CG1-CD1 4.15Å; V232-I273 HydrophobicContact CG1-CG2 4.1Å; V232-I273 HydrophobicContact CG2-CD1 3.59Å; V232-I273 HydrophobicContact CG2-CG1 4.05Å; V242-I273 HydrophobicContact CG2-CD1 3.96Å; L254-I273 HydrophobicContact CD1-CD1 4Å; L254-I273 HydrophobicContact CD1-CG2 4.22Å; V264-I273 HydrophobicContact CG2-CG2 3.89Å; I273-T275 HydrophobicContact CG2-CG2 4.03Å; I273-W285 HydrophobicContact CB-CB 4.14Å; I273-W285 PolarHBondContact O-N 2.77Å; I273-L287 HydrophobicContact CD1-CB 4.41Å; I273-L287 HydrophobicContact CD1-CD1 3.56Å; I273-L287 HydrophobicContact CD1-CG 4.42Å
274	I	96.9	Very high	95.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.3	171.3	-55.5	103.9	0	0	0	108.3	V264 T265 Q267 I282 L284 V306 L308 F315 F328	V264-I274 WeakPolarHBondContact CA-O 3.41Å; T265-I274 PolarHBondContact N-O 2.85Å; T265-I274 PolarHBondContact O-N 3.47Å; Q267-I274 HydrophobicContact CG-CD1 4.42Å; I274-I282 HydrophobicContact CG2-CG2 3.54Å; I274-L284 HydrophobicContact CB-CD2 4.05Å; I274-L284 HydrophobicContact CG1-CD2 3.35Å; I274-L284 HydrophobicContact CG2-CD2 3.8Å; I274-V306 HydrophobicContact CG2-CG1 3.94Å; I274-L308 HydrophobicContact CD1-CD2 3.77Å; I274-F315 HydrophobicContact CG2-CE2 4.38Å; I274-F328 HydrophobicContact CD1-CE1 4Å; I274-F328 HydrophobicContact CD1-CZ 3.54Å; I274-F328 HydrophobicContact CG1-CE1 3.99Å; I274-F328 HydrophobicContact CG1-CZ 3.98Å
275	T	97.5	Very high	95.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.9	175.9	60	0	0	0	0	111.1	T234 A240 H257 V261 T263 V264 I273 I282 R283 W285	T234-T275 HydrophobicContact CG2-CG2 4.38Å; A240-T275 HydrophobicContact CB-CG2 3.97Å; H257-T275 PolarHBondContact NE2-OG1 2.64Å; V261-T275 HydrophobicContact CG1-CG2 4.32Å; T263-T275 WeakPolarHBondContact O-CA 3.31Å; V264-T275 HydrophobicContact CB-CG2 4.41Å; V264-T275 HydrophobicContact CG2-CG2 4.2Å; I273-T275 HydrophobicContact CG2-CG2 4.03Å; T275-I282 CarbonylContact O-C 3.59Å; T275-I282 VanDerWaalsContact O-CA 3.29Å; T275-I282 WeakPolarHBondContact O-CA 3.49Å; T275-I282 WeakPolarHBondContact O-CG2 3.28Å; T275-R283 PolarHBondContact N-O 3.03Å; T275-R283 PolarHBondContact O-N 3.01Å; T275-W285 PolarHBondContact OG1-NE1 3.34Å
276	G	96.9	Very high	95.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.8	171.4	0	0	0	0	0	110.5	A262 T263	A262-G276 PolarHBondContact N-O 2.88Å; T263-G276 PolarHBondContact N-O 3.21Å; T263-G276 PolarHBondContact O-N 3.11Å
277	S	97.4	Very high	95.6	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	-127.1	161.9	-174.1	171.9	0	0	0	0	112.8	H257 N259 T260 D279 C280 T281 I303	H257-S277 VanDerWaalsContact CE1-CB 3.48Å; H257-S277 WeakPolarHBondContact CE1-CB 3.39Å; H257-S277 WeakPolarHBondContact ND1-CB 3.31Å; N259-S277 PolarHBondContact O-OG 3.33Å; T260-S277 PolarHBondContact O-OG 3.16Å; T260-S277 VanDerWaalsContact O-OG 3.14Å; S277-D279 WeakPolarHBondContact CB-OD1 3.42Å; S277-D279 PolarHBondContact O-N 3.48Å; S277-D279 PolarHBondContact OG-N 3.28Å; S277-D279 PolarHBondContact OG-OD1 2.9Å; S277-D279 PolarHBondContact OG-OD2 3.35Å; S277-C280 PolarHBondContact O-N 3.12Å; S277-T281 PolarHBondContact N-O 3.44Å; S277-I303 PolarHBondContact O-N 2.88Å
278	H	96.8	Very high	95.6	Very high	43 Å²	43	25.6 Å²	25.6	20%	0.199	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-5.7	171.2	-74.2	-89.5	0	0	0	113.4	N259 T260 C280 S302	N259-H278 HydrophobicContact CB-CB 4.27Å; T260-H278 PolarHBondContact O-CD2 2.88Å; T260-H278 PolarHBondContact O-N 3.13Å; T260-H278 WeakPolarHBondContact OG1-CB 3.43Å; T260-H278 PolarHBondContact OG1-CD2 3.26Å; T260-H278 VanDerWaalsContact OG1-CG 3.23Å; H278-C280 PolarHBondContact O-N 3.29Å; H278-S302 WeakPolarHBondContact ND1-CB 3.27Å
279	D	96.5	Very high	95.6	Very high	25 Å²	25	24.9 Å²	24.9	13%	0.134	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	7.9	169.9	63.8	17.9	0	0	0	113.9	H257 T258 N259 S277 T281	H257-D279 VanDerWaalsContact CA-OD2 3.26Å; H257-D279 WeakPolarHBondContact CA-OD2 3.24Å; H257-D279 WeakPolarHBondContact CB-OD2 3.32Å; H257-D279 IonicContact CE1-OD1 4Å; H257-D279 IonicContact CE1-OD2 3.94Å; H257-D279 IonicContact CG-OD2 3.41Å; H257-D279 IonicContact ND1-OD1 3.43Å; H257-D279 PolarHBondContact ND1-OD1 2.97Å; H257-D279 IonicContact ND1-OD2 2.78Å; H257-D279 PolarHBondContact ND1-OD2 2.86Å; T258-D279 PolarHBondContact N-OD2 3Å; T258-D279 WeakPolarHBondContact OG1-CB 3.31Å; N259-D279 HydrophobicContact CB-CB 3.88Å; S277-D279 WeakPolarHBondContact CB-OD1 3.42Å; S277-D279 PolarHBondContact O-N 3.48Å; S277-D279 PolarHBondContact OG-N 3.28Å; S277-D279 PolarHBondContact OG-OD1 2.9Å; S277-D279 PolarHBondContact OG-OD2 3.35Å; D279-T281 VanDerWaalsContact CG-OG1 3.23Å; D279-T281 PolarHBondContact O-N 3.11Å; D279-T281 WeakPolarHBondContact OD1-CA 3.45Å; D279-T281 WeakPolarHBondContact OD1-CB 3.5Å; D279-T281 PolarHBondContact OD1-N 3.13Å; D279-T281 PolarHBondContact OD1-OG1 2.85Å; D279-T281 PolarHBondContact OD2-OG1 3.05Å
280	C	96.4	Very high	95.6	Very high	33 Å²	33	23.6 Å²	23.6	22%	0.223	14%	0.143	C	C	.	.	S	Bend	trans	66.9	13.9	-178.9	-44.2	0	0	0	0	114.1	S277 H278 H299 K301 I303	S277-C280 PolarHBondContact O-N 3.12Å; H278-C280 PolarHBondContact O-N 3.29Å; C280-H299 WeakPolarHBondContact CB-O 3.4Å; C280-K301 VanDerWaalsContact SG-CA 3.52Å; C280-K301 PolarHBondContact SG-O 3.07Å; C280-I303 VanDerWaalsContact C-CD1 3.42Å
281	T	97.2	Very high	95.8	Very high	21 Å²	21	23.2 Å²	23.2	13%	0.129	14%	0.144	C	C	.	.			trans	-111.9	148.6	177	74.2	0	0	0	0	112.6	H257 S277 D279 T295 L296 T297 I303	H257-T281 PolarHBondContact CE1-OG1 2.87Å; H257-T281 PolarHBondContact ND1-OG1 2.83Å; S277-T281 PolarHBondContact N-O 3.44Å; D279-T281 VanDerWaalsContact CG-OG1 3.23Å; D279-T281 PolarHBondContact O-N 3.11Å; D279-T281 WeakPolarHBondContact OD1-CA 3.45Å; D279-T281 WeakPolarHBondContact OD1-CB 3.5Å; D279-T281 PolarHBondContact OD1-N 3.13Å; D279-T281 PolarHBondContact OD1-OG1 2.85Å; D279-T281 PolarHBondContact OD2-OG1 3.05Å; T281-T295 HydrophobicContact CG2-CG2 4.35Å; T281-L296 WeakPolarHBondContact CA-O 3.34Å; T281-T297 HydrophobicContact CG2-CG2 4.04Å; T281-I303 VanDerWaalsContact O-CD1 3.24Å; T281-I303 WeakPolarHBondContact O-CD1 3.49Å
282	I	97.3	Very high	95.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.9	166.3	-52.9	172.1	0	0	0	107	I274 T275 L296 I303 F315 S317 W326	I274-I282 HydrophobicContact CG2-CG2 3.54Å; T275-I282 CarbonylContact O-C 3.59Å; T275-I282 VanDerWaalsContact O-CA 3.29Å; T275-I282 WeakPolarHBondContact O-CA 3.49Å; T275-I282 WeakPolarHBondContact O-CG2 3.28Å; I282-L296 HydrophobicContact CB-CB 4.15Å; I282-L296 HydrophobicContact CB-CD1 4.26Å; I282-L296 HydrophobicContact CG2-CD1 4.37Å; I282-L296 PolarHBondContact N-O 2.83Å; I282-L296 PolarHBondContact O-N 3.36Å; I282-I303 HydrophobicContact CD1-CD1 4.29Å; I282-I303 HydrophobicContact CG1-CD1 3.45Å; I282-I303 VanDerWaalsContact CG1-CD1 3.45Å; I282-I303 HydrophobicContact CG1-CG1 4.17Å; I282-I303 HydrophobicContact CG1-CG2 4.44Å; I282-F315 HydrophobicContact CD1-CE2 4.17Å; I282-F315 HydrophobicContact CG2-CE2 4.3Å; I282-S317 WeakPolarHBondContact CD1-OG 3.46Å; I282-W326 HydrophobicContact CD1-CZ2 4.18Å
283	R	96.8	Very high	95.8	Very high	43 Å²	43	28.1 Å²	28.1	16%	0.162	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.6	174.4	-70.8	178.5	175.4	-114.7	-2.4	110	G256 T275 W285 S292 V294 T295	G256-R283 PolarHBondContact O-NH2 2.79Å; T275-R283 PolarHBondContact N-O 3.03Å; T275-R283 PolarHBondContact O-N 3.01Å; R283-W285 HydrophobicContact CB-CZ2 3.78Å; R283-W285 VanDerWaalsContact CD-CZ2 3.4Å; R283-W285 HydrophobicContact CG-CZ2 4.24Å; R283-S292 PolarHBondContact NH1-OG 3.13Å; R283-V294 WeakPolarHBondContact CA-O 3.3Å; R283-T295 HydrophobicContact CG-CG2 4.19Å
284	L	97.1	Very high	95.8	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.6	170.2	-59.4	-178.6	0	0	0	107.3	P271 I274 S292 M293 V294 F315 F328	P271-L284 HydrophobicContact CB-CB 3.84Å; P271-L284 HydrophobicContact CB-CD2 4.32Å; P271-L284 HydrophobicContact CB-CG 4.48Å; P271-L284 HydrophobicContact CG-CB 4.13Å; P271-L284 HydrophobicContact CG-CD1 4.06Å; P271-L284 HydrophobicContact CG-CD2 3.88Å; P271-L284 HydrophobicContact CG-CG 4.24Å; I274-L284 HydrophobicContact CB-CD2 4.05Å; I274-L284 HydrophobicContact CG1-CD2 3.35Å; I274-L284 HydrophobicContact CG2-CD2 3.8Å; L284-S292 CarbonylContact O-C 3.55Å; L284-M293 PolarHBondContact O-N 3.21Å; L284-V294 HydrophobicContact CB-CB 4.18Å; L284-V294 HydrophobicContact CD1-CB 4.02Å; L284-V294 HydrophobicContact CD1-CG1 4.49Å; L284-V294 HydrophobicContact CD1-CG2 4.43Å; L284-V294 HydrophobicContact CG-CB 4.32Å; L284-V294 PolarHBondContact N-O 3.41Å; L284-V294 PolarHBondContact O-N 3.09Å; L284-F315 HydrophobicContact CD2-CE1 4.29Å; L284-F315 HydrophobicContact CD2-CZ 4.24Å; L284-F328 HydrophobicContact CD2-CE1 3.99Å
285	W	96.6	Very high	95.8	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.008	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	142.5	-174.6	-55	85.3	0	0	0	111.1	L254 T255 I273 T275 R283 M293	L254-W285 HydrophobicContact CB-CD2 4.05Å; L254-W285 HydrophobicContact CB-CE3 3.88Å; L254-W285 HydrophobicContact CB-CH2 3.98Å; L254-W285 HydrophobicContact CB-CZ2 4.12Å; L254-W285 HydrophobicContact CB-CZ3 3.85Å; L254-W285 HydrophobicContact CD1-CB 4.32Å; L254-W285 HydrophobicContact CD1-CD2 4.05Å; L254-W285 HydrophobicContact CD1-CE3 4.42Å; L254-W285 HydrophobicContact CD1-CG 3.98Å; L254-W285 HydrophobicContact CD2-CD2 4.24Å; L254-W285 HydrophobicContact CD2-CE3 3.8Å; L254-W285 HydrophobicContact CD2-CZ3 4.35Å; L254-W285 HydrophobicContact CG-CD2 4.34Å; L254-W285 HydrophobicContact CG-CE3 4.24Å; T255-W285 WeakPolarHBondContact O-CH2 3.14Å; I273-W285 HydrophobicContact CB-CB 4.14Å; I273-W285 PolarHBondContact O-N 2.77Å; T275-W285 PolarHBondContact OG1-NE1 3.34Å; R283-W285 HydrophobicContact CB-CZ2 3.78Å; R283-W285 VanDerWaalsContact CD-CZ2 3.4Å; R283-W285 HydrophobicContact CG-CZ2 4.24Å; W285-M293 WeakPolarHBondContact O-CE 3.3Å
286	D	95	Very high	95.7	Very high	35 Å²	35	33.2 Å²	33.2	19%	0.187	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.7	161.6	170.9	28.4	0	0	0	108.6	A288 S289 G290 T291 M293	D286-A288 VanDerWaalsContact C-N 3.33Å; D286-A288 PolarHBondContact OD1-N 2.84Å; D286-S289 WeakPolarHBondContact CB-OG 3.44Å; D286-S289 WeakPolarHBondContact OD2-CB 3.22Å; D286-S289 PolarHBondContact OD2-N 2.83Å; D286-S289 PolarHBondContact OD2-OG 2.92Å; D286-G290 VanDerWaalsContact O-CA 3.3Å; D286-G290 WeakPolarHBondContact O-CA 3.24Å; D286-G290 PolarHBondContact O-N 2.84Å; D286-T291 PolarHBondContact N-O 3.24Å; D286-M293 HydrophobicContact CB-CE 4.03Å; D286-M293 HydrophobicContact CB-CG 3.79Å; D286-M293 HydrophobicContact CB-SD 3.92Å
287	L	94.4	Very high	95.6	Very high	16 Å²	16	37.8 Å²	37.8	8%	0.084	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-28.9	-179.3	-177.5	57.4	0	0	0	112	I228 V242 H252 Q272 I273	I228-L287 HydrophobicContact CD1-CD2 4.23Å; V242-L287 HydrophobicContact CB-CD1 4.39Å; V242-L287 HydrophobicContact CG1-CD1 3.66Å; V242-L287 HydrophobicContact CG2-CD1 3.89Å; H252-L287 PolarHBondContact CD2-O 2.69Å; H252-L287 PolarHBondContact NE2-O 3.23Å; Q272-L287 HydrophobicContact CB-CB 4.16Å; I273-L287 HydrophobicContact CD1-CB 4.41Å; I273-L287 HydrophobicContact CD1-CD1 3.56Å; I273-L287 HydrophobicContact CD1-CG 4.42Å
288	A	93.9	Very high	95.5	Very high	85 Å²	85	41.4 Å²	41.4	70%	0.702	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-45.2	-176.2	0	0	0	0	0	111.9	D286	D286-A288 VanDerWaalsContact C-N 3.33Å; D286-A288 PolarHBondContact OD1-N 2.84Å
289	S	93.3	Very high	95.4	Very high	58 Å²	58	39.7 Å²	39.7	41%	0.406	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-23.4	174.9	62.7	0	0	0	0	113.4	D286 T291	D286-S289 WeakPolarHBondContact CB-OG 3.44Å; D286-S289 WeakPolarHBondContact OD2-CB 3.22Å; D286-S289 PolarHBondContact OD2-N 2.83Å; D286-S289 PolarHBondContact OD2-OG 2.92Å; S289-T291 PolarHBondContact O-N 2.83Å; S289-T291 PolarHBondContact OG-N 3.15Å; S289-T291 PolarHBondContact OG-OG1 3.4Å
290	G	93.2	Very high	95.3	Very high	13 Å²	13	47.2 Å²	47.2	13%	0.134	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	19.3	-170.9	0	0	0	0	0	113.2	L254 D286	L254-G290 WeakPolarHBondContact CD2-O 3.3Å; D286-G290 VanDerWaalsContact O-CA 3.3Å; D286-G290 WeakPolarHBondContact O-CA 3.24Å; D286-G290 PolarHBondContact O-N 2.84Å
291	T	94.5	Very high	95.2	Very high	81 Å²	81	50.6 Å²	50.6	50%	0.497	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	154.9	-178.2	68.8	0	0	0	0	111.9	D286 S289	D286-T291 PolarHBondContact N-O 3.24Å; S289-T291 PolarHBondContact O-N 2.83Å; S289-T291 PolarHBondContact OG-N 3.15Å; S289-T291 PolarHBondContact OG-OG1 3.4Å
292	S	94.7	Very high	95.1	Very high	43 Å²	43	50.7 Å²	50.7	30%	0.301	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.4	175.7	58.4	0	0	0	0	110	R283 L284	R283-S292 PolarHBondContact NH1-OG 3.13Å; L284-S292 CarbonylContact O-C 3.55Å
293	M	93.8	Very high	95.1	Very high	91 Å²	91	50.7 Å²	50.7	45%	0.448	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-46.7	176	-66.8	-171.6	-80.8	0	0	111.9	P271 L284 W285 D286	P271-M293 HydrophobicContact CB-CE 3.42Å; P271-M293 VanDerWaalsContact CB-CE 3.42Å; L284-M293 PolarHBondContact O-N 3.21Å; W285-M293 WeakPolarHBondContact O-CE 3.3Å; D286-M293 HydrophobicContact CB-CE 4.03Å; D286-M293 HydrophobicContact CB-CG 3.79Å; D286-M293 HydrophobicContact CB-SD 3.92Å
294	V	95.6	Very high	95.1	Very high	37 Å²	37	52.5 Å²	52.5	22%	0.224	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	138.2	-176	-178.8	0	0	0	0	109.7	R283 L284 L296 N330	R283-V294 WeakPolarHBondContact CA-O 3.3Å; L284-V294 HydrophobicContact CB-CB 4.18Å; L284-V294 HydrophobicContact CD1-CB 4.02Å; L284-V294 HydrophobicContact CD1-CG1 4.49Å; L284-V294 HydrophobicContact CD1-CG2 4.43Å; L284-V294 HydrophobicContact CG-CB 4.32Å; L284-V294 PolarHBondContact N-O 3.41Å; L284-V294 PolarHBondContact O-N 3.09Å; V294-L296 HydrophobicContact CG1-CD2 3.61Å; V294-L296 HydrophobicContact CG1-CG 4.14Å; V294-N330 WeakPolarHBondContact CG1-O 3.47Å
295	T	96.2	Very high	95	Very high	57 Å²	57	52.8 Å²	52.8	35%	0.35	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	116.1	170.6	-54.5	0	0	0	0	109.1	T281 R283 T297	T281-T295 HydrophobicContact CG2-CG2 4.35Å; R283-T295 HydrophobicContact CG-CG2 4.19Å; T295-T297 HydrophobicContact CG2-CG2 4.13Å
296	L	96.1	Very high	95	Very high	14 Å²	14	53.1 Å²	53.1	7%	0.073	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.7	178.9	-52.2	171.6	0	0	0	109.1	T281 I282 V294 F315 W326 G331	T281-L296 WeakPolarHBondContact CA-O 3.34Å; I282-L296 HydrophobicContact CB-CB 4.15Å; I282-L296 HydrophobicContact CB-CD1 4.26Å; I282-L296 HydrophobicContact CG2-CD1 4.37Å; I282-L296 PolarHBondContact N-O 2.83Å; I282-L296 PolarHBondContact O-N 3.36Å; V294-L296 HydrophobicContact CG1-CD2 3.61Å; V294-L296 HydrophobicContact CG1-CG 4.14Å; L296-F315 HydrophobicContact CD1-CZ 3.72Å; L296-W326 HydrophobicContact CB-CH2 3.81Å; L296-W326 HydrophobicContact CB-CZ2 4.41Å; L296-W326 HydrophobicContact CB-CZ3 4.12Å; L296-W326 HydrophobicContact CD1-CD2 3.98Å; L296-W326 HydrophobicContact CD1-CE3 3.81Å; L296-W326 HydrophobicContact CD1-CH2 4.09Å; L296-W326 HydrophobicContact CD1-CZ2 4.38Å; L296-W326 HydrophobicContact CD1-CZ3 3.86Å; L296-W326 HydrophobicContact CD2-CE3 4.35Å; L296-W326 HydrophobicContact CD2-CH2 4.44Å; L296-W326 HydrophobicContact CD2-CZ3 3.89Å; L296-W326 HydrophobicContact CG-CH2 4.34Å; L296-W326 HydrophobicContact CG-CZ3 4.18Å; L296-G331 VanDerWaalsContact CD2-O 3.31Å; L296-G331 WeakPolarHBondContact CD2-O 3.5Å
297	T	95.7	Very high	95	Very high	96 Å²	96	51.9 Å²	51.9	59%	0.589	29%	0.292	S	S	*	.			trans	-111.1	16.7	-173.2	54.9	0	0	0	0	113.1	T281 T295 H299	T281-T297 HydrophobicContact CG2-CG2 4.04Å; T295-T297 HydrophobicContact CG2-CG2 4.13Å; T297-H299 VanDerWaalsContact C-N 3.3Å; T297-H299 PolarHBondContact O-N 3.5Å
298	N	94.2	Very high	95.1	Very high	75 Å²	75	53.2 Å²	53.2	40%	0.401	30%	0.299	S	S	.	.			trans	-73.8	-19	-172	-62.7	-23	0	0	0	113.4	K324 W326	N298-K324 VanDerWaalsContact C-NZ 3.34Å; N298-K324 HydrophobicContact CB-CD 4.28Å; N298-K324 PolarHBondContact O-NZ 2.81Å; N298-W326 HydrophobicContact CB-CH2 3.63Å; N298-W326 HydrophobicContact CB-CZ2 4.25Å; N298-W326 WeakPolarHBondContact ND2-CH2 3.19Å; N298-W326 WeakPolarHBondContact ND2-CZ3 3.46Å
299	H	94.3	Very high	95.1	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.037	27%	0.268	C	S	.	.			trans	-80.2	141.4	177.9	-77.2	-72.8	0	0	0	111	C280 T297 I303 S317 S319 D321 N322	C280-H299 WeakPolarHBondContact CB-O 3.4Å; T297-H299 VanDerWaalsContact C-N 3.3Å; T297-H299 PolarHBondContact O-N 3.5Å; H299-I303 HydrophobicContact CB-CD1 4.16Å; H299-I303 HydrophobicContact CB-CG1 4.07Å; H299-S317 PolarHBondContact NE2-OG 3.12Å; H299-S319 PolarHBondContact ND1-OG 2.96Å; H299-D321 IonicContact CE1-OD1 3.69Å; H299-D321 IonicContact ND1-OD1 2.95Å; H299-D321 PolarHBondContact ND1-OD1 3.23Å; H299-D321 IonicContact ND1-OD2 3.75Å; H299-N322 PolarHBondContact CE1-O 3.48Å
300	K	94.3	Very high	95	Very high	182 Å²	182	50.3 Å²	50.3	79%	0.791	27%	0.271	S	S	*	.	S	Bend	trans	-95.5	-11.7	177.6	-62.4	-176.4	178.1	-177.2	0	112.7	D321	K300-D321 PolarHBondContact N-OD2 2.97Å
301	K	95.6	Very high	94.9	Very high	105 Å²	105	56.1 Å²	56.1	46%	0.457	29%	0.292	S	S	.	.	S	Bend	trans	-133.3	168.6	-177.7	-65.2	-176.3	-175	172.7	0	110.4	C280 I303 P320	C280-K301 VanDerWaalsContact SG-CA 3.52Å; C280-K301 PolarHBondContact SG-O 3.07Å; K301-I303 PolarHBondContact O-N 2.91Å; K301-P320 HydrophobicContact CB-CG 4.28Å; K301-P320 HydrophobicContact CD-CB 3.73Å; K301-P320 HydrophobicContact CD-CG 4.17Å; K301-P320 PolarHBondContact NZ-O 3.09Å
302	S	95.7	Very high	94.7	Very high	22 Å²	22	55.6 Å²	55.6	15%	0.154	29%	0.286	C	S	.	.			trans	-54.6	129.9	-178.5	60	0	0	0	0	112.8	H278 S319 P320	H278-S302 WeakPolarHBondContact ND1-CB 3.27Å; S302-S319 WeakPolarHBondContact O-CB 3.35Å; S302-P320 VanDerWaalsContact O-CD 3.28Å; S302-P320 WeakPolarHBondContact O-CD 3.3Å
303	I	96.5	Very high	94.7	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.			trans	-84.1	125	171.8	-62.4	133.4	0	0	0	108	A262 S277 C280 T281 I282 H299 K301 V306 A318	A262-I303 VanDerWaalsContact CB-O 3.3Å; A262-I303 WeakPolarHBondContact CB-O 3.3Å; S277-I303 PolarHBondContact O-N 2.88Å; C280-I303 VanDerWaalsContact C-CD1 3.42Å; T281-I303 VanDerWaalsContact O-CD1 3.24Å; T281-I303 WeakPolarHBondContact O-CD1 3.49Å; I282-I303 HydrophobicContact CD1-CD1 4.29Å; I282-I303 HydrophobicContact CG1-CD1 3.45Å; I282-I303 VanDerWaalsContact CG1-CD1 3.45Å; I282-I303 HydrophobicContact CG1-CG1 4.17Å; I282-I303 HydrophobicContact CG1-CG2 4.44Å; H299-I303 HydrophobicContact CB-CD1 4.16Å; H299-I303 HydrophobicContact CB-CG1 4.07Å; K301-I303 PolarHBondContact O-N 2.91Å; I303-V306 HydrophobicContact CG2-CG2 3.97Å; I303-A318 WeakPolarHBondContact CA-O 3.33Å
304	R	95.8	Very high	94.7	Very high	81 Å²	81	54.9 Å²	54.9	31%	0.306	28%	0.276	S	S	.	.			trans	-112.9	-27.3	-176.2	-70.3	-177.6	174.4	-131.9	-1.7	113.7	A318 V344 N345	R304-A318 PolarHBondContact N-O 2.87Å; R304-A318 VanDerWaalsContact N-O 3.13Å; R304-V344 WeakPolarHBondContact CB-O 3.45Å; R304-N345 WeakPolarHBondContact CD-OD1 3.42Å; R304-N345 PolarHBondContact NH1-OD1 3.25Å
305	A	95.8	Very high	94.8	Very high	7 Å²	7	53.1 Å²	53.1	6%	0.058	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	140.8	176.9	0	0	0	0	0	111	A318 L347	A305-A318 HydrophobicContact CB-CB 4.19Å; A305-A318 PolarHBondContact O-N 3.45Å; A305-L347 HydrophobicContact CB-CB 4.14Å; A305-L347 HydrophobicContact CB-CD1 4.42Å; A305-L347 HydrophobicContact CB-CG 4.03Å
306	V	96.1	Very high	94.8	Very high	9 Å²	9	50.4 Å²	50.4	6%	0.055	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.6	168.7	172.7	0	0	0	0	106.7	T263 T265 I274 I303 F315 A316	T263-V306 HydrophobicContact CG2-CB 3.99Å; T263-V306 HydrophobicContact CG2-CG2 3.7Å; T265-V306 HydrophobicContact CG2-CB 4.37Å; T265-V306 HydrophobicContact CG2-CG1 4.19Å; T265-V306 VanDerWaalsContact CG2-O 3.24Å; T265-V306 WeakPolarHBondContact CG2-O 3.48Å; I274-V306 HydrophobicContact CG2-CG1 3.94Å; I303-V306 HydrophobicContact CG2-CG2 3.97Å; V306-F315 HydrophobicContact CG1-CD2 4.01Å; V306-A316 CarbonylContact C-O 3.6Å; V306-A316 WeakPolarHBondContact CA-O 3.31Å
307	S	95.5	Very high	94.8	Very high	9 Å²	9	49.8 Å²	49.8	6%	0.063	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	130.4	178.9	59.1	0	0	0	0	110.2	F315 A316 I349	S307-F315 WeakPolarHBondContact O-CA 3.47Å; S307-A316 PolarHBondContact N-O 2.86Å; S307-A316 PolarHBondContact O-N 2.94Å; S307-I349 WeakPolarHBondContact O-CD1 3.24Å; S307-I349 WeakPolarHBondContact OG-CD1 3.2Å
308	L	95.4	Very high	94.7	Very high	45 Å²	45	45.2 Å²	45.2	24%	0.236	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	140.6	175.1	-69.3	172.4	0	0	0	110.6	C266 Q267 I274 F315 F328	C266-L308 VanDerWaalsContact O-CD1 3.3Å; C266-L308 WeakPolarHBondContact O-CD1 3.39Å; Q267-L308 HydrophobicContact CB-CD1 3.89Å; I274-L308 HydrophobicContact CD1-CD2 3.77Å; L308-F315 HydrophobicContact CD2-CB 3.92Å; L308-F328 HydrophobicContact CD2-CE2 3.77Å; L308-F328 HydrophobicContact CD2-CZ 3.78Å
309	H	94.8	Very high	94.7	Very high	12 Å²	12	41.7 Å²	41.7	6%	0.056	20%	0.198	C	C	.	.			trans	-78.3	133.6	170.2	-171.5	-69.4	0	0	0	109.6	K311 L312 M314 I349 N353 W369	H309-K311 PolarHBondContact ND1-N 2.85Å; H309-K311 VanDerWaalsContact ND1-N 3.13Å; H309-K311 PolarHBondContact O-N 2.98Å; H309-L312 HydrophobicContact CB-CB 4.41Å; H309-L312 PolarHBondContact CE1-N 2.93Å; H309-L312 WeakPolarHBondContact ND1-CB 3.45Å; H309-L312 PolarHBondContact ND1-N 3.13Å; H309-M314 HydrophobicContact CB-CB 4.46Å; H309-M314 VanDerWaalsContact CB-O 3.31Å; H309-M314 WeakPolarHBondContact CB-O 3.32Å; H309-M314 PolarHBondContact N-O 2.96Å; H309-I349 HydrophobicContact CB-CD1 4.37Å; H309-N353 PolarHBondContact CE1-OD1 3.48Å; H309-N353 PolarHBondContact NE2-OD1 2.9Å; H309-N353 VanDerWaalsContact NE2-OD1 3.16Å; H309-W369 HydrophobicContact CB-CH2 4.36Å; H309-W369 HydrophobicContact CB-CZ2 4.13Å; H309-W369 AromaticContact CD2-CD1 3.97Å; H309-W369 AromaticContact CD2-CD2 3.68Å; H309-W369 AromaticContact CD2-CE2 3.54Å; H309-W369 AromaticContact CD2-CG 3.97Å; H309-W369 AromaticContact CD2-CZ2 3.97Å; H309-W369 AromaticContact CD2-NE1 3.73Å
310	P	91.4	Very high	94.6	Very high	70 Å²	70	42.2 Å²	42.2	46%	0.455	20%	0.202	S	C	.	.	S	Bend	trans	-72.8	-28.5	-172.1	26.1	-35.4	0	0	0	114.9	Q351	P310-Q351 HydrophobicContact CB-CG 4.18Å; P310-Q351 HydrophobicContact CG-CB 4.38Å; P310-Q351 HydrophobicContact CG-CG 3.94Å
311	K	90.7	Very high	94.5	Very high	135 Å²	135	34.8 Å²	34.8	59%	0.587	17%	0.171	S	C	*	.	S	Bend	trans	-108.8	-52.9	-178.7	-64.6	173.9	179.7	160.2	0	113.8	H309 Q351	H309-K311 PolarHBondContact ND1-N 2.85Å; H309-K311 VanDerWaalsContact ND1-N 3.13Å; H309-K311 PolarHBondContact O-N 2.98Å; K311-Q351 PolarHBondContact NZ-O 2.77Å
312	L	91.3	Very high	94.4	Very high	70 Å²	70	32 Å²	32	37%	0.366	16%	0.161	S	C	.	.	S	Bend	trans	-73.6	142.4	177	-54.8	173.7	0	0	0	110.9	H309 M314	H309-L312 HydrophobicContact CB-CB 4.41Å; H309-L312 PolarHBondContact CE1-N 2.93Å; H309-L312 WeakPolarHBondContact ND1-CB 3.45Å; H309-L312 PolarHBondContact ND1-N 3.13Å; L312-M314 HydrophobicContact CB-CB 4.46Å; L312-M314 HydrophobicContact CB-CG 4.32Å; L312-M314 HydrophobicContact CB-SD 4.45Å; L312-M314 HydrophobicContact CD1-SD 4.47Å; L312-M314 PolarHBondContact O-N 3Å
313	F	93.4	Very high	94.4	Very high	93 Å²	93	31 Å²	31	41%	0.408	15%	0.154	S	C	.	.	S	Bend	trans	-78.8	63.4	177	-163.2	-129.4	0	0	0	111.2	A269 D270 F328	A269-F313 HydrophobicContact CB-CE2 3.73Å; A269-F313 HydrophobicContact CB-CZ 4.07Å; D270-F313 WeakPolarHBondContact O-CZ 3.4Å; F313-F328 HydrophobicContact CD1-CB 3.32Å; F313-F328 HydrophobicContact CD1-CD2 4.37Å; F313-F328 HydrophobicContact CD1-CG 4.33Å; F313-F328 HydrophobicContact CD2-CB 4.24Å; F313-F328 AromaticContact CD2-CD2 3.84Å; F313-F328 HydrophobicContact CD2-CD2 3.84Å; F313-F328 HydrophobicContact CD2-CG 4.46Å; F313-F328 HydrophobicContact CE1-CB 3.09Å; F313-F328 HydrophobicContact CE1-CD2 4.41Å; F313-F328 HydrophobicContact CE1-CG 4.1Å; F313-F328 HydrophobicContact CE2-CB 4.03Å; F313-F328 AromaticContact CE2-CD2 3.84Å; F313-F328 HydrophobicContact CE2-CD2 3.84Å; F313-F328 HydrophobicContact CE2-CG 4.2Å; F313-F328 HydrophobicContact CG-CB 3.9Å; F313-F328 HydrophobicContact CG-CD2 4.09Å; F313-F328 HydrophobicContact CG-CG 4.5Å; F313-F328 HydrophobicContact CZ-CB 3.48Å; F313-F328 VanDerWaalsContact CZ-CB 3.48Å; F313-F328 HydrophobicContact CZ-CD2 4.14Å; F313-F328 HydrophobicContact CZ-CG 4.02Å; F313-F328 PolarHBondContact O-N 2.86Å
314	M	95.1	Very high	94.3	Very high	26 Å²	26	32.1 Å²	32.1	13%	0.128	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	162.3	-173.4	-64.8	-178	66.4	0	0	110.8	H309 L312 Q325 W326 K327 V334 W369	H309-M314 HydrophobicContact CB-CB 4.46Å; H309-M314 VanDerWaalsContact CB-O 3.31Å; H309-M314 WeakPolarHBondContact CB-O 3.32Å; H309-M314 PolarHBondContact N-O 2.96Å; L312-M314 HydrophobicContact CB-CB 4.46Å; L312-M314 HydrophobicContact CB-CG 4.32Å; L312-M314 HydrophobicContact CB-SD 4.45Å; L312-M314 HydrophobicContact CD1-SD 4.47Å; L312-M314 PolarHBondContact O-N 3Å; M314-Q325 HydrophobicContact CE-CB 4.23Å; M314-W326 CarbonylContact C-O 3.45Å; M314-W326 WeakPolarHBondContact CA-O 3.37Å; M314-W326 VanDerWaalsContact CB-O 3.24Å; M314-W326 WeakPolarHBondContact CB-O 3.34Å; M314-K327 HydrophobicContact CG-CB 4.43Å; M314-V334 HydrophobicContact CE-CB 4.03Å; M314-V334 HydrophobicContact CE-CG1 4.05Å; M314-V334 HydrophobicContact CE-CG2 3.78Å; M314-W369 HydrophobicContact CB-CZ2 3.78Å; M314-W369 HydrophobicContact CE-CZ2 4.02Å; M314-W369 HydrophobicContact SD-CZ2 4.37Å
315	F	96	Very high	94.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	157.9	173.4	70.8	-85.2	0	0	0	111.2	I274 I282 L284 L296 V306 S307 L308 W326 F328	I274-F315 HydrophobicContact CG2-CE2 4.38Å; I282-F315 HydrophobicContact CD1-CE2 4.17Å; I282-F315 HydrophobicContact CG2-CE2 4.3Å; L284-F315 HydrophobicContact CD2-CE1 4.29Å; L284-F315 HydrophobicContact CD2-CZ 4.24Å; L296-F315 HydrophobicContact CD1-CZ 3.72Å; V306-F315 HydrophobicContact CG1-CD2 4.01Å; S307-F315 WeakPolarHBondContact O-CA 3.47Å; L308-F315 HydrophobicContact CD2-CB 3.92Å; F315-W326 HydrophobicContact CD1-CB 3.64Å; F315-W326 HydrophobicContact CD1-CG 4.49Å; F315-W326 HydrophobicContact CD2-CB 4.12Å; F315-W326 AromaticContact CD2-CD1 3.67Å; F315-W326 HydrophobicContact CD2-CG 4.17Å; F315-W326 HydrophobicContact CE1-CB 3.24Å; F315-W326 AromaticContact CE1-CG 3.95Å; F315-W326 HydrophobicContact CE1-CG 3.95Å; F315-W326 HydrophobicContact CE2-CB 3.74Å; F315-W326 AromaticContact CE2-CD1 3.23Å; F315-W326 HydrophobicContact CE2-CD2 4.42Å; F315-W326 AromaticContact CE2-CG 3.55Å; F315-W326 HydrophobicContact CE2-CG 3.55Å; F315-W326 AromaticContact CE2-NE1 3.92Å; F315-W326 HydrophobicContact CG-CB 4.09Å; F315-W326 HydrophobicContact CZ-CB 3.29Å; F315-W326 AromaticContact CZ-CD1 3.65Å; F315-W326 HydrophobicContact CZ-CD2 4.19Å; F315-W326 AromaticContact CZ-CG 3.43Å; F315-W326 HydrophobicContact CZ-CG 3.43Å; F315-W326 VanDerWaalsContact CZ-CG 3.43Å; F315-W326 PolarHBondContact N-O 2.94Å; F315-W326 PolarHBondContact O-N 3.39Å; F315-F328 HydrophobicContact CB-CE2 4.2Å; F315-F328 HydrophobicContact CB-CZ 4.03Å; F315-F328 AromaticContact CD1-CD1 3.98Å; F315-F328 HydrophobicContact CD1-CD1 3.98Å; F315-F328 HydrophobicContact CD1-CD2 4.33Å; F315-F328 AromaticContact CD1-CE1 3.31Å; F315-F328 HydrophobicContact CD1-CE1 3.31Å; F315-F328 AromaticContact CD1-CE2 3.73Å; F315-F328 HydrophobicContact CD1-CE2 3.73Å; F315-F328 HydrophobicContact CD1-CG 4.43Å; F315-F328 AromaticContact CD1-CZ 3.17Å; F315-F328 HydrophobicContact CD1-CZ 3.17Å; F315-F328 AromaticContact CE1-CD1 3.96Å; F315-F328 HydrophobicContact CE1-CD1 3.96Å; F315-F328 AromaticContact CE1-CE1 3.43Å; F315-F328 HydrophobicContact CE1-CE1 3.43Å; F315-F328 VanDerWaalsContact CE1-CE1 3.43Å; F315-F328 AromaticContact CE1-CZ 3.82Å; F315-F328 HydrophobicContact CE1-CZ 3.82Å; F315-F328 HydrophobicContact CG-CE1 4.35Å; F315-F328 HydrophobicContact CG-CE2 4.4Å; F315-F328 AromaticContact CG-CZ 3.88Å; F315-F328 HydrophobicContact CG-CZ 3.88Å
316	A	96.2	Very high	94.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	146.9	171.4	0	0	0	0	0	110.6	V306 S307 I323 K324 L347 I349 L355 W369	V306-A316 CarbonylContact C-O 3.6Å; V306-A316 WeakPolarHBondContact CA-O 3.31Å; S307-A316 PolarHBondContact N-O 2.86Å; S307-A316 PolarHBondContact O-N 2.94Å; A316-I323 HydrophobicContact CB-CG2 4.39Å; A316-K324 CarbonylContact C-O 3.58Å; A316-K324 VanDerWaalsContact CA-O 3.24Å; A316-K324 WeakPolarHBondContact CA-O 3.21Å; A316-L347 HydrophobicContact CB-CD1 4.23Å; A316-I349 HydrophobicContact CB-CD1 4.4Å; A316-L355 HydrophobicContact CB-CD1 4.41Å; A316-L355 HydrophobicContact CB-CD2 4.45Å; A316-W369 HydrophobicContact CB-CH2 3.77Å; A316-W369 HydrophobicContact CB-CZ3 3.6Å
317	S	96.4	Very high	94.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.5	172.9	59.2	0	0	0	0	110.4	I282 H299 I323 K324 W326	I282-S317 WeakPolarHBondContact CD1-OG 3.46Å; H299-S317 PolarHBondContact NE2-OG 3.12Å; S317-I323 CarbonylContact O-C 3.44Å; S317-I323 VanDerWaalsContact O-CA 3.27Å; S317-I323 WeakPolarHBondContact O-CA 2.95Å; S317-I323 WeakPolarHBondContact O-CG2 3.22Å; S317-K324 PolarHBondContact N-O 2.54Å; S317-K324 PolarHBondContact O-N 2.95Å; S317-W326 PolarHBondContact OG-NE1 3.35Å
318	A	94.9	Very high	94.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.4	178.9	0	0	0	0	0	110.6	I303 R304 A305 I323 V344 L347	I303-A318 WeakPolarHBondContact CA-O 3.33Å; R304-A318 PolarHBondContact N-O 2.87Å; R304-A318 VanDerWaalsContact N-O 3.13Å; A305-A318 HydrophobicContact CB-CB 4.19Å; A305-A318 PolarHBondContact O-N 3.45Å; A318-I323 HydrophobicContact CB-CG1 4.21Å; A318-V344 HydrophobicContact CB-CB 3.86Å; A318-V344 HydrophobicContact CB-CG1 3.51Å; A318-L347 HydrophobicContact CB-CD1 3.35Å; A318-L347 HydrophobicContact CB-CD2 3.92Å; A318-L347 HydrophobicContact CB-CG 3.49Å; A318-L347 VanDerWaalsContact CB-CG 3.49Å
319	S	94	Very high	94	Very high	1 Å²	1	34 Å²	34	1%	0.007	17%	0.173	C	C	.	.			trans	-135.8	169.3	161.2	98.9	0	0	0	0	109.6	H299 S302 D321 N322	H299-S319 PolarHBondContact ND1-OG 2.96Å; S302-S319 WeakPolarHBondContact O-CB 3.35Å; S319-D321 PolarHBondContact O-N 3.38Å; S319-D321 VanDerWaalsContact O-N 3.11Å; S319-D321 PolarHBondContact OG-N 3.39Å; S319-D321 VanDerWaalsContact OG-N 3.07Å; S319-D321 PolarHBondContact OG-OD1 3.5Å; S319-N322 PolarHBondContact N-O 3.33Å
320	P	92.6	Very high	93.7	Very high	19 Å²	19	38.3 Å²	38.3	12%	0.123	20%	0.196	C	C	.	.	S	Bend	trans	-69.4	2.5	174.5	-10.8	23.7	0	0	0	114.9	K301 S302 A342 I343	K301-P320 HydrophobicContact CB-CG 4.28Å; K301-P320 HydrophobicContact CD-CB 3.73Å; K301-P320 HydrophobicContact CD-CG 4.17Å; K301-P320 PolarHBondContact NZ-O 3.09Å; S302-P320 VanDerWaalsContact O-CD 3.28Å; S302-P320 WeakPolarHBondContact O-CD 3.3Å; P320-A342 WeakPolarHBondContact CA-O 3.24Å; P320-I343 HydrophobicContact CB-CB 4.48Å; P320-I343 HydrophobicContact CB-CG1 4.06Å; P320-I343 HydrophobicContact CG-CB 4.25Å; P320-I343 HydrophobicContact CG-CG1 4Å; P320-I343 HydrophobicContact CG-CG2 4.14Å
321	D	90.9	Very high	93.7	Very high	27 Å²	27	35.2 Å²	35.2	14%	0.144	18%	0.177	C	C	.	.	S	Bend	trans	-85.7	-65.7	169	62.2	20	0	0	0	110.9	H299 K300 S319	H299-D321 IonicContact CE1-OD1 3.69Å; H299-D321 IonicContact ND1-OD1 2.95Å; H299-D321 PolarHBondContact ND1-OD1 3.23Å; H299-D321 IonicContact ND1-OD2 3.75Å; K300-D321 PolarHBondContact N-OD2 2.97Å; S319-D321 PolarHBondContact O-N 3.38Å; S319-D321 VanDerWaalsContact O-N 3.11Å; S319-D321 PolarHBondContact OG-N 3.39Å; S319-D321 VanDerWaalsContact OG-N 3.07Å; S319-D321 PolarHBondContact OG-OD1 3.5Å
322	N	93.3	Very high	93.9	Very high	45 Å²	45	33.8 Å²	33.8	24%	0.241	17%	0.172	C	C	.	.			trans	-154.9	167.2	179.1	-61.7	-63.5	0	0	0	108.7	H299 S319 N336 S338	H299-N322 PolarHBondContact CE1-O 3.48Å; S319-N322 PolarHBondContact N-O 3.33Å; N322-N336 WeakPolarHBondContact CB-OD1 3.23Å; N322-N336 VanDerWaalsContact CG-ND2 3.31Å; N322-N336 PolarHBondContact ND2-ND2 3.17Å; N322-S338 VanDerWaalsContact OD1-CB 3.31Å; N322-S338 WeakPolarHBondContact OD1-CB 3.34Å
323	I	95.6	Very high	94	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.5	167.4	-62.1	159.5	0	0	0	107.5	A316 S317 A318 N336 L337 V344 L347 L355 S357	A316-I323 HydrophobicContact CB-CG2 4.39Å; S317-I323 CarbonylContact O-C 3.44Å; S317-I323 VanDerWaalsContact O-CA 3.27Å; S317-I323 WeakPolarHBondContact O-CA 2.95Å; S317-I323 WeakPolarHBondContact O-CG2 3.22Å; A318-I323 HydrophobicContact CB-CG1 4.21Å; I323-N336 PolarHBondContact O-OD1 2.77Å; I323-L337 HydrophobicContact CB-CB 4.05Å; I323-L337 HydrophobicContact CG2-CB 4.43Å; I323-L337 HydrophobicContact CG2-CD1 4.45Å; I323-L337 PolarHBondContact N-O 3.08Å; I323-L337 VanDerWaalsContact N-O 3.13Å; I323-L337 PolarHBondContact O-N 3.45Å; I323-V344 HydrophobicContact CD1-CG2 4.49Å; I323-L347 HydrophobicContact CD1-CD2 4.02Å; I323-L347 HydrophobicContact CG1-CD2 4.35Å; I323-L347 HydrophobicContact CG2-CD1 4.32Å; I323-L347 HydrophobicContact CG2-CD2 4.37Å; I323-L355 HydrophobicContact CG2-CD2 4.08Å; I323-S357 VanDerWaalsContact CD1-CB 3.47Å; I323-S357 WeakPolarHBondContact CD1-OG 3.15Å
324	K	95.7	Very high	94	Very high	24 Å²	24	34.3 Å²	34.3	10%	0.104	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.9	-177.8	-64.7	-174.2	-177.8	-162.4	0	110.7	N298 A316 S317 W326 F333	N298-K324 VanDerWaalsContact C-NZ 3.34Å; N298-K324 HydrophobicContact CB-CD 4.28Å; N298-K324 PolarHBondContact O-NZ 2.81Å; A316-K324 CarbonylContact C-O 3.58Å; A316-K324 VanDerWaalsContact CA-O 3.24Å; A316-K324 WeakPolarHBondContact CA-O 3.21Å; S317-K324 PolarHBondContact N-O 2.54Å; S317-K324 PolarHBondContact O-N 2.95Å; K324-W326 HydrophobicContact CB-CZ2 4.08Å; K324-W326 HydrophobicContact CD-CZ2 4Å; K324-F333 HydrophobicContact CB-CD2 4.47Å; K324-F333 HydrophobicContact CB-CE2 4.2Å; K324-F333 HydrophobicContact CD-CD2 4.33Å; K324-F333 HydrophobicContact CD-CE2 4.02Å; K324-F333 HydrophobicContact CG-CE2 4.05Å
325	Q	96.1	Very high	93.8	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.019	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	141.7	171.2	-76.4	176.7	4.9	0	0	110.9	M314 V334 Q335 L337 W369	M314-Q325 HydrophobicContact CE-CB 4.23Å; Q325-V334 HydrophobicContact CB-CB 4.38Å; Q325-V334 PolarHBondContact O-N 3.35Å; Q325-Q335 PolarHBondContact N-O 2.84Å; Q325-L337 HydrophobicContact CB-CD1 4.45Å; Q325-L337 HydrophobicContact CG-CD1 3.57Å; Q325-W369 HydrophobicContact CG-CE3 4.43Å; Q325-W369 HydrophobicContact CG-CH2 3.79Å; Q325-W369 HydrophobicContact CG-CZ2 3.95Å; Q325-W369 HydrophobicContact CG-CZ3 4.04Å; Q325-W369 VanDerWaalsContact NE2-CD2 3.35Å; Q325-W369 PolarHBondContact NE2-O 3.07Å
326	W	96.3	Very high	93.7	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.9	-174.1	-53.2	93.2	0	0	0	110.4	I282 L296 N298 M314 F315 S317 K324 G331 E332 F333	I282-W326 HydrophobicContact CD1-CZ2 4.18Å; L296-W326 HydrophobicContact CB-CH2 3.81Å; L296-W326 HydrophobicContact CB-CZ2 4.41Å; L296-W326 HydrophobicContact CB-CZ3 4.12Å; L296-W326 HydrophobicContact CD1-CD2 3.98Å; L296-W326 HydrophobicContact CD1-CE3 3.81Å; L296-W326 HydrophobicContact CD1-CH2 4.09Å; L296-W326 HydrophobicContact CD1-CZ2 4.38Å; L296-W326 HydrophobicContact CD1-CZ3 3.86Å; L296-W326 HydrophobicContact CD2-CE3 4.35Å; L296-W326 HydrophobicContact CD2-CH2 4.44Å; L296-W326 HydrophobicContact CD2-CZ3 3.89Å; L296-W326 HydrophobicContact CG-CH2 4.34Å; L296-W326 HydrophobicContact CG-CZ3 4.18Å; N298-W326 HydrophobicContact CB-CH2 3.63Å; N298-W326 HydrophobicContact CB-CZ2 4.25Å; N298-W326 WeakPolarHBondContact ND2-CH2 3.19Å; N298-W326 WeakPolarHBondContact ND2-CZ3 3.46Å; M314-W326 CarbonylContact C-O 3.45Å; M314-W326 WeakPolarHBondContact CA-O 3.37Å; M314-W326 VanDerWaalsContact CB-O 3.24Å; M314-W326 WeakPolarHBondContact CB-O 3.34Å; F315-W326 HydrophobicContact CD1-CB 3.64Å; F315-W326 HydrophobicContact CD1-CG 4.49Å; F315-W326 HydrophobicContact CD2-CB 4.12Å; F315-W326 AromaticContact CD2-CD1 3.67Å; F315-W326 HydrophobicContact CD2-CG 4.17Å; F315-W326 HydrophobicContact CE1-CB 3.24Å; F315-W326 AromaticContact CE1-CG 3.95Å; F315-W326 HydrophobicContact CE1-CG 3.95Å; F315-W326 HydrophobicContact CE2-CB 3.74Å; F315-W326 AromaticContact CE2-CD1 3.23Å; F315-W326 HydrophobicContact CE2-CD2 4.42Å; F315-W326 AromaticContact CE2-CG 3.55Å; F315-W326 HydrophobicContact CE2-CG 3.55Å; F315-W326 AromaticContact CE2-NE1 3.92Å; F315-W326 HydrophobicContact CG-CB 4.09Å; F315-W326 HydrophobicContact CZ-CB 3.29Å; F315-W326 AromaticContact CZ-CD1 3.65Å; F315-W326 HydrophobicContact CZ-CD2 4.19Å; F315-W326 AromaticContact CZ-CG 3.43Å; F315-W326 HydrophobicContact CZ-CG 3.43Å; F315-W326 VanDerWaalsContact CZ-CG 3.43Å; F315-W326 PolarHBondContact N-O 2.94Å; F315-W326 PolarHBondContact O-N 3.39Å; S317-W326 PolarHBondContact OG-NE1 3.35Å; K324-W326 HydrophobicContact CB-CZ2 4.08Å; K324-W326 HydrophobicContact CD-CZ2 4Å; W326-G331 VanDerWaalsContact CE3-O 3.23Å; W326-E332 CarbonylContact C-O 3.53Å; W326-E332 VanDerWaalsContact CA-O 3.28Å; W326-E332 WeakPolarHBondContact CA-O 3.3Å; W326-F333 HydrophobicContact CE3-CB 4.07Å; W326-F333 HydrophobicContact CZ3-CB 3.96Å
327	K	94.9	Very high	93.5	Very high	105 Å²	105	38.6 Å²	38.6	46%	0.457	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.5	177.1	-178.3	-176.9	173.6	-164	0	110.2	M314 G331 E332 V334	M314-K327 HydrophobicContact CG-CB 4.43Å; K327-G331 CarbonylContact O-C 3.14Å; K327-G331 WeakPolarHBondContact O-CA 3.36Å; K327-G331 PolarHBondContact O-N 3.29Å; K327-E332 HydrophobicContact CB-CB 4.39Å; K327-E332 PolarHBondContact N-O 2.7Å; K327-E332 PolarHBondContact O-N 2.88Å; K327-V334 HydrophobicContact CB-CG2 3.68Å
328	F	93.3	Very high	93.2	Very high	5 Å²	5	42.2 Å²	42.2	2%	0.022	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	157.4	171.6	-67.8	-56.2	0	0	0	111	P271 I274 L284 L308 F313 F315	P271-F328 VanDerWaalsContact CD-CD1 3.4Å; P271-F328 HydrophobicContact CG-CD1 3.34Å; P271-F328 HydrophobicContact CG-CE1 3.27Å; P271-F328 HydrophobicContact CG-CG 4.38Å; P271-F328 HydrophobicContact CG-CZ 4.28Å; I274-F328 HydrophobicContact CD1-CE1 4Å; I274-F328 HydrophobicContact CD1-CZ 3.54Å; I274-F328 HydrophobicContact CG1-CE1 3.99Å; I274-F328 HydrophobicContact CG1-CZ 3.98Å; L284-F328 HydrophobicContact CD2-CE1 3.99Å; L308-F328 HydrophobicContact CD2-CE2 3.77Å; L308-F328 HydrophobicContact CD2-CZ 3.78Å; F313-F328 HydrophobicContact CD1-CB 3.32Å; F313-F328 HydrophobicContact CD1-CD2 4.37Å; F313-F328 HydrophobicContact CD1-CG 4.33Å; F313-F328 HydrophobicContact CD2-CB 4.24Å; F313-F328 AromaticContact CD2-CD2 3.84Å; F313-F328 HydrophobicContact CD2-CD2 3.84Å; F313-F328 HydrophobicContact CD2-CG 4.46Å; F313-F328 HydrophobicContact CE1-CB 3.09Å; F313-F328 HydrophobicContact CE1-CD2 4.41Å; F313-F328 HydrophobicContact CE1-CG 4.1Å; F313-F328 HydrophobicContact CE2-CB 4.03Å; F313-F328 AromaticContact CE2-CD2 3.84Å; F313-F328 HydrophobicContact CE2-CD2 3.84Å; F313-F328 HydrophobicContact CE2-CG 4.2Å; F313-F328 HydrophobicContact CG-CB 3.9Å; F313-F328 HydrophobicContact CG-CD2 4.09Å; F313-F328 HydrophobicContact CG-CG 4.5Å; F313-F328 HydrophobicContact CZ-CB 3.48Å; F313-F328 VanDerWaalsContact CZ-CB 3.48Å; F313-F328 HydrophobicContact CZ-CD2 4.14Å; F313-F328 HydrophobicContact CZ-CG 4.02Å; F313-F328 PolarHBondContact O-N 2.86Å; F315-F328 HydrophobicContact CB-CE2 4.2Å; F315-F328 HydrophobicContact CB-CZ 4.03Å; F315-F328 AromaticContact CD1-CD1 3.98Å; F315-F328 HydrophobicContact CD1-CD1 3.98Å; F315-F328 HydrophobicContact CD1-CD2 4.33Å; F315-F328 AromaticContact CD1-CE1 3.31Å; F315-F328 HydrophobicContact CD1-CE1 3.31Å; F315-F328 AromaticContact CD1-CE2 3.73Å; F315-F328 HydrophobicContact CD1-CE2 3.73Å; F315-F328 HydrophobicContact CD1-CG 4.43Å; F315-F328 AromaticContact CD1-CZ 3.17Å; F315-F328 HydrophobicContact CD1-CZ 3.17Å; F315-F328 AromaticContact CE1-CD1 3.96Å; F315-F328 HydrophobicContact CE1-CD1 3.96Å; F315-F328 AromaticContact CE1-CE1 3.43Å; F315-F328 HydrophobicContact CE1-CE1 3.43Å; F315-F328 VanDerWaalsContact CE1-CE1 3.43Å; F315-F328 AromaticContact CE1-CZ 3.82Å; F315-F328 HydrophobicContact CE1-CZ 3.82Å; F315-F328 HydrophobicContact CG-CE1 4.35Å; F315-F328 HydrophobicContact CG-CE2 4.4Å; F315-F328 AromaticContact CG-CZ 3.88Å; F315-F328 HydrophobicContact CG-CZ 3.88Å
329	P	90.3	Very high	92.8	Very high	77 Å²	77	43.7 Å²	43.7	50%	0.5	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.1	-30.5	9.5	30.8	-34.2	0	0	0	114.8	G331	P329-G331 VanDerWaalsContact C-N 3.32Å; P329-G331 PolarHBondContact O-N 3.26Å
330	N	90	Very high	92.6	Very high	101 Å²	101	44 Å²	44	54%	0.54	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-2.7	-169.3	-63.2	-19	0	0	0	114.3	V294	V294-N330 WeakPolarHBondContact CG1-O 3.47Å
331	G	90.7	Very high	92.4	Very high	5 Å²	5	50 Å²	50	5%	0.052	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	44.8	-173.6	0	0	0	0	0	112.1	L296 W326 K327 P329 F333	L296-G331 VanDerWaalsContact CD2-O 3.31Å; L296-G331 WeakPolarHBondContact CD2-O 3.5Å; W326-G331 VanDerWaalsContact CE3-O 3.23Å; K327-G331 CarbonylContact O-C 3.14Å; K327-G331 WeakPolarHBondContact O-CA 3.36Å; K327-G331 PolarHBondContact O-N 3.29Å; P329-G331 VanDerWaalsContact C-N 3.32Å; P329-G331 PolarHBondContact O-N 3.26Å; G331-F333 PolarHBondContact O-N 2.92Å
332	E	94.1	Very high	92.4	Very high	106 Å²	106	49.3 Å²	49.3	50%	0.495	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132	174.9	-67.6	177.2	172.9	0	0	109.8	W326 K327 V334	W326-E332 CarbonylContact C-O 3.53Å; W326-E332 VanDerWaalsContact CA-O 3.28Å; W326-E332 WeakPolarHBondContact CA-O 3.3Å; K327-E332 HydrophobicContact CB-CB 4.39Å; K327-E332 PolarHBondContact N-O 2.7Å; K327-E332 PolarHBondContact O-N 2.88Å; E332-V334 PolarHBondContact O-N 2.97Å
333	F	94.1	Very high	92.5	Very high	101 Å²	101	50.3 Å²	50.3	44%	0.443	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.9	175.8	172.3	-103.2	0	0	0	110.1	K324 W326 G331 Q335 N336	K324-F333 HydrophobicContact CB-CD2 4.47Å; K324-F333 HydrophobicContact CB-CE2 4.2Å; K324-F333 HydrophobicContact CD-CD2 4.33Å; K324-F333 HydrophobicContact CD-CE2 4.02Å; K324-F333 HydrophobicContact CG-CE2 4.05Å; W326-F333 HydrophobicContact CE3-CB 4.07Å; W326-F333 HydrophobicContact CZ3-CB 3.96Å; G331-F333 PolarHBondContact O-N 2.92Å; F333-Q335 WeakPolarHBondContact CE2-O 3.38Å; F333-N336 HydrophobicContact CZ-CB 4.08Å
334	V	93	Very high	92.5	Very high	73 Å²	73	50.3 Å²	50.3	44%	0.442	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-59.5	-178.4	179	0	0	0	0	111.1	M314 Q325 K327 E332	M314-V334 HydrophobicContact CE-CB 4.03Å; M314-V334 HydrophobicContact CE-CG1 4.05Å; M314-V334 HydrophobicContact CE-CG2 3.78Å; Q325-V334 HydrophobicContact CB-CB 4.38Å; Q325-V334 PolarHBondContact O-N 3.35Å; K327-V334 HydrophobicContact CB-CG2 3.68Å; E332-V334 PolarHBondContact O-N 2.97Å
335	Q	92	Very high	92.4	Very high	59 Å²	59	50.1 Å²	50.1	28%	0.276	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	151.1	-171.5	-172.7	172	2.6	0	0	111.7	Q325 F333 S371	Q325-Q335 PolarHBondContact N-O 2.84Å; F333-Q335 WeakPolarHBondContact CE2-O 3.38Å; Q335-S371 PolarHBondContact NE2-O 3.23Å
336	N	93.6	Very high	92.4	Very high	56 Å²	56	50.3 Å²	50.3	30%	0.299	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.3	169.7	-155.3	24.8	0	0	0	110.2	N322 I323 F333	N322-N336 WeakPolarHBondContact CB-OD1 3.23Å; N322-N336 VanDerWaalsContact CG-ND2 3.31Å; N322-N336 PolarHBondContact ND2-ND2 3.17Å; I323-N336 PolarHBondContact O-OD1 2.77Å; F333-N336 HydrophobicContact CZ-CB 4.08Å
337	L	92.3	Very high	92.3	Very high	1 Å²	1	51 Å²	51	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	95.7	171.7	-66	88	0	0	0	107.2	I323 Q325 L355 W367	I323-L337 HydrophobicContact CB-CB 4.05Å; I323-L337 HydrophobicContact CG2-CB 4.43Å; I323-L337 HydrophobicContact CG2-CD1 4.45Å; I323-L337 PolarHBondContact N-O 3.08Å; I323-L337 VanDerWaalsContact N-O 3.13Å; I323-L337 PolarHBondContact O-N 3.45Å; Q325-L337 HydrophobicContact CB-CD1 4.45Å; Q325-L337 HydrophobicContact CG-CD1 3.57Å; L337-L355 HydrophobicContact CD2-CD2 3.84Å; L337-W367 HydrophobicContact CB-CD2 4.49Å; L337-W367 HydrophobicContact CB-CE3 4.02Å; L337-W367 HydrophobicContact CB-CZ3 4.18Å; L337-W367 HydrophobicContact CD2-CB 3.86Å; L337-W367 HydrophobicContact CD2-CD2 4.01Å; L337-W367 HydrophobicContact CD2-CE3 3.88Å; L337-W367 HydrophobicContact CD2-CG 4Å; L337-W367 HydrophobicContact CG-CE3 4.4Å
338	S	89.1	Confident	92.4	Very high	75 Å²	75	46.4 Å²	46.4	52%	0.524	26%	0.262	S	S	.	.			trans	-99.2	150.7	-179.7	57.2	0	0	0	0	111.1	N322 W367	N322-S338 VanDerWaalsContact OD1-CB 3.31Å; N322-S338 WeakPolarHBondContact OD1-CB 3.34Å; S338-W367 VanDerWaalsContact O-CH2 3.26Å; S338-W367 WeakPolarHBondContact O-CH2 3.47Å; S338-W367 WeakPolarHBondContact O-CZ3 3.11Å
339	G	86.6	Confident	92.5	Very high	31 Å²	31	47.2 Å²	47.2	32%	0.32	27%	0.266	S	S	.	.			trans	127	-15.8	175.7	0	0	0	0	0	114.6	N341	G339-N341 PolarHBondContact O-N 3.15Å
340	H	89.8	Confident	92.6	Very high	7 Å²	7	43.7 Å²	43.7	3%	0.032	24%	0.243	C	C	.	.			trans	-86.3	83.7	172.2	-157.1	158.1	0	0	0	110.3	A342 V344 S357 S363 H365 W367	H340-A342 PolarHBondContact O-N 3.42Å; H340-V344 HydrophobicContact CB-CG2 4.38Å; H340-S357 PolarHBondContact CE1-O 3.39Å; H340-S357 WeakPolarHBondContact ND1-CB 3.33Å; H340-S357 PolarHBondContact ND1-OG 2.69Å; H340-S363 PolarHBondContact CE1-O 2.88Å; H340-S363 PolarHBondContact NE2-O 3.29Å; H340-S363 PolarHBondContact NE2-OG 2.81Å; H340-H365 AromaticContact CD2-CE1 3.78Å; H340-H365 AromaticContact CD2-ND1 3.61Å; H340-H365 AromaticContact CE1-ND1 3.59Å; H340-H365 AromaticContact CG-ND1 3.66Å; H340-H365 AromaticContact ND1-CG 3.92Å; H340-H365 AromaticContact ND1-ND1 3.63Å; H340-H365 AromaticContact NE2-ND1 3.59Å; H340-W367 HydrophobicContact CB-CZ2 3.95Å
341	N	87.9	Confident	92.6	Very high	147 Å²	147	42.8 Å²	42.8	79%	0.786	24%	0.236	S	C	*	.			trans	-79.4	56.4	-178.2	-63.8	-15.5	0	0	0	112.2	G339	G339-N341 PolarHBondContact O-N 3.15Å
342	A	92	Very high	92.6	Very high	12 Å²	12	46.2 Å²	46.2	10%	0.099	25%	0.253	C	S	.	.	S	Bend	trans	-146.7	168.5	178.8	0	0	0	0	0	111.5	P320 H340 V344 N361	P320-A342 WeakPolarHBondContact CA-O 3.24Å; H340-A342 PolarHBondContact O-N 3.42Å; A342-V344 PolarHBondContact O-N 2.86Å; A342-V344 VanDerWaalsContact O-N 3.12Å; A342-N361 WeakPolarHBondContact CB-ND2 3.48Å; A342-N361 WeakPolarHBondContact CB-OD1 3.31Å
343	I	94.5	Very high	92.5	Very high	65 Å²	65	42.4 Å²	42.4	33%	0.333	24%	0.236	S	C	.	.			trans	-73.9	102.2	170.4	-61.3	170.9	0	0	0	107.7	P320 N345 G359 D360	P320-I343 HydrophobicContact CB-CB 4.48Å; P320-I343 HydrophobicContact CB-CG1 4.06Å; P320-I343 HydrophobicContact CG-CB 4.25Å; P320-I343 HydrophobicContact CG-CG1 4Å; P320-I343 HydrophobicContact CG-CG2 4.14Å; I343-N345 PolarHBondContact O-N 3.35Å; I343-G359 CarbonylContact O-C 3.56Å; I343-G359 WeakPolarHBondContact O-CA 3.27Å; I343-D360 HydrophobicContact CB-CB 3.99Å; I343-D360 HydrophobicContact CG2-CB 4.39Å; I343-D360 PolarHBondContact O-N 3.24Å
344	V	95.4	Very high	92.5	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	116.9	178.2	-177.9	0	0	0	0	109.3	R304 A318 I323 H340 A342 A346 L347 G358	R304-V344 WeakPolarHBondContact CB-O 3.45Å; A318-V344 HydrophobicContact CB-CB 3.86Å; A318-V344 HydrophobicContact CB-CG1 3.51Å; I323-V344 HydrophobicContact CD1-CG2 4.49Å; H340-V344 HydrophobicContact CB-CG2 4.38Å; A342-V344 PolarHBondContact O-N 2.86Å; A342-V344 VanDerWaalsContact O-N 3.12Å; V344-A346 WeakPolarHBondContact CG1-O 3.15Å; V344-L347 HydrophobicContact CG1-CD2 4.13Å; V344-L347 HydrophobicContact CG1-CG 4.48Å; V344-G358 WeakPolarHBondContact CA-O 3.45Å
345	N	95.1	Very high	92.7	Very high	21 Å²	21	34.1 Å²	34.1	11%	0.112	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-29.4	179.7	-69.3	-42.9	0	0	0	112.6	R304 I343 G358 D360 V393	R304-N345 WeakPolarHBondContact CD-OD1 3.42Å; R304-N345 PolarHBondContact NH1-OD1 3.25Å; I343-N345 PolarHBondContact O-N 3.35Å; N345-G358 PolarHBondContact N-O 3.14Å; N345-D360 PolarHBondContact ND2-OD1 3.03Å; N345-V393 WeakPolarHBondContact CB-O 3.32Å; N345-V393 PolarHBondContact ND2-O 3.43Å; N345-V393 VanDerWaalsContact ND2-O 3.16Å
346	A	94.5	Very high	92.9	Very high	8 Å²	8	31.3 Å²	31.3	7%	0.066	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	144.2	-174.3	0	0	0	0	0	112.2	V344 G358 L396	V344-A346 WeakPolarHBondContact CG1-O 3.15Å; A346-G358 PolarHBondContact O-N 3.13Å; A346-L396 HydrophobicContact CB-CB 3.98Å; A346-L396 HydrophobicContact CB-CD1 4.15Å; A346-L396 HydrophobicContact CB-CG 4.02Å
347	L	95.8	Very high	93	Very high	16 Å²	16	28.6 Å²	28.6	8%	0.084	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.6	170.6	-70.8	177.8	0	0	0	109.4	A305 A316 A318 I323 V344 L355 V356	A305-L347 HydrophobicContact CB-CB 4.14Å; A305-L347 HydrophobicContact CB-CD1 4.42Å; A305-L347 HydrophobicContact CB-CG 4.03Å; A316-L347 HydrophobicContact CB-CD1 4.23Å; A318-L347 HydrophobicContact CB-CD1 3.35Å; A318-L347 HydrophobicContact CB-CD2 3.92Å; A318-L347 HydrophobicContact CB-CG 3.49Å; A318-L347 VanDerWaalsContact CB-CG 3.49Å; I323-L347 HydrophobicContact CD1-CD2 4.02Å; I323-L347 HydrophobicContact CG1-CD2 4.35Å; I323-L347 HydrophobicContact CG2-CD1 4.32Å; I323-L347 HydrophobicContact CG2-CD2 4.37Å; V344-L347 HydrophobicContact CG1-CD2 4.13Å; V344-L347 HydrophobicContact CG1-CG 4.48Å; L347-L355 HydrophobicContact CB-CD1 4.41Å; L347-L355 HydrophobicContact CD2-CD1 4.15Å; L347-V356 WeakPolarHBondContact CA-O 3.35Å
348	A	95.7	Very high	93.2	Very high	8 Å²	8	28.6 Å²	28.6	7%	0.066	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	138	171.8	0	0	0	0	0	109.6	L355 V356 L396 F398 L405	A348-L355 CarbonylContact O-C 3.59Å; A348-L355 WeakPolarHBondContact O-CA 3.19Å; A348-V356 PolarHBondContact N-O 3.49Å; A348-V356 PolarHBondContact O-N 3.14Å; A348-L396 HydrophobicContact CB-CB 4.03Å; A348-F398 HydrophobicContact CB-CD2 3.77Å; A348-F398 HydrophobicContact CB-CE2 3.91Å; A348-L405 HydrophobicContact CB-CD1 4.46Å
349	I	95	Very high	93.5	Very high	22 Å²	22	25 Å²	25	11%	0.113	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.8	179.1	-61.9	165.8	0	0	0	108.7	S307 H309 A316 V354 L355 W369	S307-I349 WeakPolarHBondContact O-CD1 3.24Å; S307-I349 WeakPolarHBondContact OG-CD1 3.2Å; H309-I349 HydrophobicContact CB-CD1 4.37Å; A316-I349 HydrophobicContact CB-CD1 4.4Å; I349-V354 WeakPolarHBondContact CA-O 3.4Å; I349-L355 HydrophobicContact CD1-CD1 4.05Å; I349-L355 HydrophobicContact CG1-CB 4.41Å; I349-L355 HydrophobicContact CG1-CD1 3.3Å; I349-L355 HydrophobicContact CG1-CG 4.45Å; I349-W369 HydrophobicContact CD1-CE3 4.2Å; I349-W369 HydrophobicContact CD1-CH2 3.88Å; I349-W369 HydrophobicContact CD1-CZ3 3.44Å; I349-W369 VanDerWaalsContact CD1-CZ3 3.44Å; I349-W369 HydrophobicContact CG1-CE3 4.46Å; I349-W369 HydrophobicContact CG1-CZ3 4.08Å
350	N	93	Very high	93.8	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	14%	0.142	C	C	.	.			trans	-93	159.3	172.3	-170.4	15.7	0	0	0	111.5	D352 N353 V354 F398 G402	N350-D352 PolarHBondContact ND2-OD2 3.2Å; N350-D352 PolarHBondContact O-N 2.9Å; N350-N353 PolarHBondContact O-N 2.97Å; N350-N353 VanDerWaalsContact O-N 3.12Å; N350-V354 HydrophobicContact CB-CB 4.28Å; N350-V354 PolarHBondContact N-O 2.86Å; N350-F398 HydrophobicContact CB-CD1 4.22Å; N350-F398 HydrophobicContact CB-CD2 3.95Å; N350-F398 HydrophobicContact CB-CE1 4.07Å; N350-F398 HydrophobicContact CB-CE2 3.78Å; N350-F398 HydrophobicContact CB-CG 4.17Å; N350-F398 HydrophobicContact CB-CZ 3.82Å; N350-G402 PolarHBondContact ND2-O 3.49Å; N350-G402 VanDerWaalsContact ND2-O 3.09Å; N350-G402 WeakPolarHBondContact OD1-CA 3.18Å
351	Q	91.1	Very high	94	Very high	81 Å²	81	29.8 Å²	29.8	38%	0.379	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.9	174.5	-60.7	-175.6	18.9	0	0	114.1	P310 K311	P310-Q351 HydrophobicContact CB-CG 4.18Å; P310-Q351 HydrophobicContact CG-CB 4.38Å; P310-Q351 HydrophobicContact CG-CG 3.94Å; K311-Q351 PolarHBondContact NZ-O 2.77Å
352	D	90.4	Very high	94.2	Very high	77 Å²	77	22.8 Å²	22.8	41%	0.412	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	7.4	176	-55.6	-44.6	0	0	0	112.7	H119 N350 V354	H119-D352 PolarHBondContact CE1-O 2.87Å; N350-D352 PolarHBondContact ND2-OD2 3.2Å; N350-D352 PolarHBondContact O-N 2.9Å; D352-V354 VanDerWaalsContact C-N 3.34Å
353	N	92.3	Very high	94.3	Very high	26 Å²	26	22.7 Å²	22.7	14%	0.139	12%	0.121	C	C	.	.	S	Bend	trans	67.2	30.4	-178.1	-26.7	-77.3	0	0	0	113.6	H309 N350 W369	H309-N353 PolarHBondContact CE1-OD1 3.48Å; H309-N353 PolarHBondContact NE2-OD1 2.9Å; H309-N353 VanDerWaalsContact NE2-OD1 3.16Å; N350-N353 PolarHBondContact O-N 2.97Å; N350-N353 VanDerWaalsContact O-N 3.12Å; N353-W369 HydrophobicContact CB-CB 3.62Å; N353-W369 HydrophobicContact CB-CG 4.3Å; N353-W369 WeakPolarHBondContact O-CB 3.48Å; N353-W369 PolarHBondContact O-N 2.99Å
354	V	94.4	Very high	94.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.6	166	178.3	0	0	0	0	108.6	H119 I349 N350 D352 V356 F366 F375	H119-V354 HydrophobicContact CB-CG2 4.27Å; H119-V354 WeakPolarHBondContact ND1-CG2 3.43Å; I349-V354 WeakPolarHBondContact CA-O 3.4Å; N350-V354 HydrophobicContact CB-CB 4.28Å; N350-V354 PolarHBondContact N-O 2.86Å; D352-V354 VanDerWaalsContact C-N 3.34Å; V354-V356 HydrophobicContact CG1-CG2 4.21Å; V354-F366 HydrophobicContact CG1-CD1 4.25Å; V354-F375 HydrophobicContact CG1-CE1 4.05Å; V354-F375 HydrophobicContact CG1-CZ 3.91Å; V354-F375 HydrophobicContact CG2-CE1 4.42Å; V354-F375 HydrophobicContact CG2-CZ 4.35Å
355	L	95.5	Very high	94.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.2	171.2	170.4	76.8	0	0	0	109.1	A316 I323 L337 L347 A348 I349 W367 W369	A316-L355 HydrophobicContact CB-CD1 4.41Å; A316-L355 HydrophobicContact CB-CD2 4.45Å; I323-L355 HydrophobicContact CG2-CD2 4.08Å; L337-L355 HydrophobicContact CD2-CD2 3.84Å; L347-L355 HydrophobicContact CB-CD1 4.41Å; L347-L355 HydrophobicContact CD2-CD1 4.15Å; A348-L355 CarbonylContact O-C 3.59Å; A348-L355 WeakPolarHBondContact O-CA 3.19Å; I349-L355 HydrophobicContact CD1-CD1 4.05Å; I349-L355 HydrophobicContact CG1-CB 4.41Å; I349-L355 HydrophobicContact CG1-CD1 3.3Å; I349-L355 HydrophobicContact CG1-CG 4.45Å; L355-W367 HydrophobicContact CB-CB 4.16Å; L355-W367 HydrophobicContact CD2-CB 4.4Å; L355-W367 PolarHBondContact N-O 3.27Å; L355-W367 PolarHBondContact O-N 2.75Å; L355-W369 HydrophobicContact CB-CE3 4.17Å; L355-W369 HydrophobicContact CD1-CZ3 4.44Å; L355-W369 HydrophobicContact CD2-CE3 4.4Å; L355-W369 HydrophobicContact CD2-CZ3 4.38Å
356	V	96.4	Very high	94.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.5	176.7	-171.4	0	0	0	0	109.1	L347 A348 V354 I364 H365 F366 L396 F398 L405	L347-V356 WeakPolarHBondContact CA-O 3.35Å; A348-V356 PolarHBondContact N-O 3.49Å; A348-V356 PolarHBondContact O-N 3.14Å; V354-V356 HydrophobicContact CG1-CG2 4.21Å; V356-I364 HydrophobicContact CG1-CG2 3.47Å; V356-I364 VanDerWaalsContact CG1-CG2 3.47Å; V356-H365 WeakPolarHBondContact CA-O 3.41Å; V356-F366 HydrophobicContact CB-CD1 4.47Å; V356-F366 HydrophobicContact CG1-CD1 4.26Å; V356-F366 HydrophobicContact CG1-CE1 4.08Å; V356-F366 HydrophobicContact CG1-CZ 4.38Å; V356-F366 HydrophobicContact CG2-CD1 3.48Å; V356-F366 VanDerWaalsContact CG2-CD1 3.48Å; V356-F366 HydrophobicContact CG2-CE1 3.66Å; V356-F366 HydrophobicContact CG2-CG 4.39Å; V356-L396 HydrophobicContact CB-CD1 4.49Å; V356-L396 HydrophobicContact CG1-CD1 3.9Å; V356-F398 HydrophobicContact CG2-CE2 3.86Å; V356-F398 HydrophobicContact CG2-CZ 3.47Å; V356-F398 VanDerWaalsContact CG2-CZ 3.47Å; V356-L405 HydrophobicContact CB-CD1 4.42Å; V356-L405 HydrophobicContact CG1-CD1 4.49Å; V356-L405 HydrophobicContact CG1-CD2 3.9Å; V356-L405 HydrophobicContact CG2-CD1 4.29Å; V356-L405 HydrophobicContact CG2-CD2 4.26Å
357	S	96.6	Very high	94.4	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.2	171.8	45.2	0	0	0	0	111.1	I323 H340 I364 H365 W367	I323-S357 VanDerWaalsContact CD1-CB 3.47Å; I323-S357 WeakPolarHBondContact CD1-OG 3.15Å; H340-S357 PolarHBondContact CE1-O 3.39Å; H340-S357 WeakPolarHBondContact ND1-CB 3.33Å; H340-S357 PolarHBondContact ND1-OG 2.69Å; S357-I364 VanDerWaalsContact O-CA 3.32Å; S357-I364 WeakPolarHBondContact O-CA 3.33Å; S357-H365 PolarHBondContact N-O 2.77Å; S357-H365 PolarHBondContact O-N 3.25Å; S357-H365 PolarHBondContact OG-O 2.89Å; S357-W367 PolarHBondContact OG-NE1 3.43Å
358	G	96	Very high	94.3	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.2	177.5	0	0	0	0	0	111	V344 N345 A346 L396	V344-G358 WeakPolarHBondContact CA-O 3.45Å; N345-G358 PolarHBondContact N-O 3.14Å; A346-G358 PolarHBondContact O-N 3.13Å; G358-L396 VanDerWaalsContact N-CD1 3.26Å
359	G	95	Very high	94.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	154.2	177.2	0	0	0	0	0	113	I343 N361 G362 S363 V393	I343-G359 CarbonylContact O-C 3.56Å; I343-G359 WeakPolarHBondContact O-CA 3.27Å; G359-N361 PolarHBondContact O-N 2.98Å; G359-G362 PolarHBondContact O-N 2.75Å; G359-G362 VanDerWaalsContact O-N 3.09Å; G359-S363 PolarHBondContact N-O 2.91Å; G359-V393 PolarHBondContact O-N 3.05Å
360	D	93.6	Very high	93.9	Very high	62 Å²	62	22.2 Å²	22.2	33%	0.332	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.8	173	-150.5	35.4	0	0	0	112.7	I343 N345 G392 F394	I343-D360 HydrophobicContact CB-CB 3.99Å; I343-D360 HydrophobicContact CG2-CB 4.39Å; I343-D360 PolarHBondContact O-N 3.24Å; N345-D360 PolarHBondContact ND2-OD1 3.03Å; D360-G392 WeakPolarHBondContact O-CA 3.5Å; D360-F394 WeakPolarHBondContact OD1-CE1 3.22Å
361	N	92.9	Very high	93.7	Very high	77 Å²	77	23.1 Å²	23.1	41%	0.412	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	5.3	175.1	69.9	-17.3	0	0	0	113.8	A342 G359 S363 Q379 A391	A342-N361 WeakPolarHBondContact CB-ND2 3.48Å; A342-N361 WeakPolarHBondContact CB-OD1 3.31Å; G359-N361 PolarHBondContact O-N 2.98Å; N361-S363 VanDerWaalsContact C-N 3.27Å; N361-S363 PolarHBondContact ND2-OG 2.97Å; N361-S363 PolarHBondContact O-N 2.79Å; N361-S363 WeakPolarHBondContact OD1-CB 3.38Å; N361-S363 PolarHBondContact OD1-N 3.1Å; N361-S363 VanDerWaalsContact OD1-N 3.1Å; N361-S363 PolarHBondContact OD1-OG 2.95Å; N361-Q379 PolarHBondContact O-NE2 2.83Å; N361-A391 CarbonylContact C-O 3.49Å
362	G	92.2	Very high	93.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	S	Bend	trans	85.9	1.3	175.4	0	0	0	0	0	113.8	G359 T380 A391	G359-G362 PolarHBondContact O-N 2.75Å; G359-G362 VanDerWaalsContact O-N 3.09Å; G362-T380 WeakPolarHBondContact O-CG2 3.15Å; G362-T380 PolarHBondContact O-N 2.95Å; G362-T380 PolarHBondContact O-OG1 3.37Å; G362-A391 WeakPolarHBondContact CA-O 3.13Å; G362-A391 PolarHBondContact N-O 3.38Å
363	S	95	Very high	93.6	Very high	10 Å²	10	20.9 Å²	20.9	7%	0.07	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	129	172.9	68	0	0	0	0	110.3	H340 G359 N361	H340-S363 PolarHBondContact CE1-O 2.88Å; H340-S363 PolarHBondContact NE2-O 3.29Å; H340-S363 PolarHBondContact NE2-OG 2.81Å; G359-S363 PolarHBondContact N-O 2.91Å; N361-S363 VanDerWaalsContact C-N 3.27Å; N361-S363 PolarHBondContact ND2-OG 2.97Å; N361-S363 PolarHBondContact O-N 2.79Å; N361-S363 WeakPolarHBondContact OD1-CB 3.38Å; N361-S363 PolarHBondContact OD1-N 3.1Å; N361-S363 VanDerWaalsContact OD1-N 3.1Å; N361-S363 PolarHBondContact OD1-OG 2.95Å
364	I	95.7	Very high	93.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.3	174.4	-60.5	176.7	0	0	0	106.8	V356 S357 F366 Y378 T380 V393 F417	V356-I364 HydrophobicContact CG1-CG2 3.47Å; V356-I364 VanDerWaalsContact CG1-CG2 3.47Å; S357-I364 VanDerWaalsContact O-CA 3.32Å; S357-I364 WeakPolarHBondContact O-CA 3.33Å; I364-F366 HydrophobicContact CG2-CD2 4.31Å; I364-F366 HydrophobicContact CG2-CE2 3.69Å; I364-F366 HydrophobicContact CG2-CZ 3.94Å; I364-Y378 HydrophobicContact CD1-CD1 4.39Å; I364-Y378 PolarHBondContact N-O 3.08Å; I364-Y378 PolarHBondContact O-N 3.48Å; I364-T380 HydrophobicContact CD1-CG2 3.59Å; I364-T380 HydrophobicContact CG1-CG2 4.11Å; I364-V393 HydrophobicContact CD1-CG2 3.99Å; I364-V393 HydrophobicContact CG1-CG2 3.83Å; I364-F417 HydrophobicContact CD1-CE2 4.16Å; I364-F417 HydrophobicContact CD1-CZ 4.03Å
365	H	95.6	Very high	93.4	Very high	15 Å²	15	23.8 Å²	23.8	7%	0.069	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.2	177.1	-70.6	65.5	0	0	0	109.5	H340 V356 S357 W367 K377	H340-H365 AromaticContact CD2-CE1 3.78Å; H340-H365 AromaticContact CD2-ND1 3.61Å; H340-H365 AromaticContact CE1-ND1 3.59Å; H340-H365 AromaticContact CG-ND1 3.66Å; H340-H365 AromaticContact ND1-CG 3.92Å; H340-H365 AromaticContact ND1-ND1 3.63Å; H340-H365 AromaticContact NE2-ND1 3.59Å; V356-H365 WeakPolarHBondContact CA-O 3.41Å; S357-H365 PolarHBondContact N-O 2.77Å; S357-H365 PolarHBondContact O-N 3.25Å; S357-H365 PolarHBondContact OG-O 2.89Å; H365-W367 HydrophobicContact CB-CZ2 3.66Å; H365-W367 AromaticContact CD2-CZ2 3.93Å; H365-W367 PolarHBondContact O-NE1 3.25Å; H365-K377 WeakPolarHBondContact NE2-CD 3.4Å
366	F	95.3	Very high	93.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.4	173.9	-59.7	-101.1	0	0	0	109.2	W122 V354 V356 I364 A374 F375 Q376 L405	W122-F366 HydrophobicContact CB-CD1 4.29Å; W122-F366 HydrophobicContact CB-CE1 3.58Å; W122-F366 HydrophobicContact CB-CE2 4.18Å; W122-F366 HydrophobicContact CB-CZ 3.52Å; W122-F366 AromaticContact CD1-CD1 3.47Å; W122-F366 VanDerWaalsContact CD1-CD1 3.47Å; W122-F366 AromaticContact CD1-CE1 3.5Å; W122-F366 HydrophobicContact CD2-CD1 4.46Å; W122-F366 AromaticContact CD2-CE1 3.83Å; W122-F366 HydrophobicContact CD2-CE1 3.83Å; W122-F366 AromaticContact CG-CD1 3.8Å; W122-F366 HydrophobicContact CG-CD1 3.8Å; W122-F366 AromaticContact CG-CE1 3.3Å; W122-F366 HydrophobicContact CG-CE1 3.3Å; W122-F366 AromaticContact CG-CZ 3.83Å; W122-F366 HydrophobicContact CG-CZ 3.83Å; W122-F366 AromaticContact NE1-CD1 3.97Å; V354-F366 HydrophobicContact CG1-CD1 4.25Å; V356-F366 HydrophobicContact CB-CD1 4.47Å; V356-F366 HydrophobicContact CG1-CD1 4.26Å; V356-F366 HydrophobicContact CG1-CE1 4.08Å; V356-F366 HydrophobicContact CG1-CZ 4.38Å; V356-F366 HydrophobicContact CG2-CD1 3.48Å; V356-F366 VanDerWaalsContact CG2-CD1 3.48Å; V356-F366 HydrophobicContact CG2-CE1 3.66Å; V356-F366 HydrophobicContact CG2-CG 4.39Å; I364-F366 HydrophobicContact CG2-CD2 4.31Å; I364-F366 HydrophobicContact CG2-CE2 3.69Å; I364-F366 HydrophobicContact CG2-CZ 3.94Å; F366-A374 CarbonylContact O-C 3.54Å; F366-A374 VanDerWaalsContact O-CA 3.22Å; F366-A374 WeakPolarHBondContact O-CA 3.47Å; F366-F375 HydrophobicContact CB-CD1 4.35Å; F366-F375 HydrophobicContact CB-CD2 4.45Å; F366-F375 HydrophobicContact CB-CE1 3.74Å; F366-F375 HydrophobicContact CB-CE2 3.84Å; F366-F375 HydrophobicContact CB-CZ 3.45Å; F366-F375 VanDerWaalsContact CB-CZ 3.45Å; F366-F375 HydrophobicContact CG-CZ 4.31Å; F366-F375 PolarHBondContact O-N 3.09Å; F366-Q376 HydrophobicContact CB-CB 4.09Å; F366-Q376 HydrophobicContact CD2-CB 3.95Å; F366-Q376 HydrophobicContact CD2-CG 4.05Å; F366-Q376 HydrophobicContact CG-CB 4.32Å; F366-Q376 PolarHBondContact N-O 2.99Å; F366-Q376 PolarHBondContact O-N 2.9Å; F366-L405 HydrophobicContact CE1-CD2 3.76Å; F366-L405 HydrophobicContact CZ-CD2 3.86Å
367	W	94.6	Very high	93.1	Very high	3 Å²	3	32.1 Å²	32.1	1%	0.011	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.9	-171.8	-53.6	80.6	0	0	0	109.6	L337 S338 H340 L355 S357 H365 L373 A374	L337-W367 HydrophobicContact CB-CD2 4.49Å; L337-W367 HydrophobicContact CB-CE3 4.02Å; L337-W367 HydrophobicContact CB-CZ3 4.18Å; L337-W367 HydrophobicContact CD2-CB 3.86Å; L337-W367 HydrophobicContact CD2-CD2 4.01Å; L337-W367 HydrophobicContact CD2-CE3 3.88Å; L337-W367 HydrophobicContact CD2-CG 4Å; L337-W367 HydrophobicContact CG-CE3 4.4Å; S338-W367 VanDerWaalsContact O-CH2 3.26Å; S338-W367 WeakPolarHBondContact O-CH2 3.47Å; S338-W367 WeakPolarHBondContact O-CZ3 3.11Å; H340-W367 HydrophobicContact CB-CZ2 3.95Å; L355-W367 HydrophobicContact CB-CB 4.16Å; L355-W367 HydrophobicContact CD2-CB 4.4Å; L355-W367 PolarHBondContact N-O 3.27Å; L355-W367 PolarHBondContact O-N 2.75Å; S357-W367 PolarHBondContact OG-NE1 3.43Å; H365-W367 HydrophobicContact CB-CZ2 3.66Å; H365-W367 AromaticContact CD2-CZ2 3.93Å; H365-W367 PolarHBondContact O-NE1 3.25Å; W367-L373 WeakPolarHBondContact CA-O 3.4Å; W367-A374 HydrophobicContact CD2-CB 3.97Å; W367-A374 HydrophobicContact CE3-CB 3.69Å; W367-A374 HydrophobicContact CH2-CB 3.76Å; W367-A374 HydrophobicContact CZ2-CB 4Å; W367-A374 HydrophobicContact CZ3-CB 3.61Å
368	D	93.8	Very high	93	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121	163.5	175.2	35.2	0	0	0	108.4	I117 H119 K370 S371 G372 L373 F375	I117-D368 PolarHBondContact N-OD2 3.17Å; H119-D368 IonicContact CD2-OD1 3.19Å; H119-D368 IonicContact CE1-OD1 3.99Å; H119-D368 IonicContact NE2-OD1 2.93Å; H119-D368 PolarHBondContact NE2-OD1 3.36Å; D368-K370 VanDerWaalsContact C-N 3.29Å; D368-K370 PolarHBondContact O-N 3.48Å; D368-S371 WeakPolarHBondContact CB-OG 3.32Å; D368-S371 WeakPolarHBondContact OD2-CB 3.48Å; D368-S371 PolarHBondContact OD2-N 3.24Å; D368-S371 PolarHBondContact OD2-OG 3.07Å; D368-G372 VanDerWaalsContact O-CA 3.31Å; D368-G372 WeakPolarHBondContact O-CA 3.16Å; D368-G372 PolarHBondContact O-N 2.89Å; D368-L373 PolarHBondContact N-O 3.05Å; D368-F375 HydrophobicContact CB-CD1 4.44Å
369	W	92.4	Very high	92.9	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.015	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-39	-174.6	179.9	-96.3	0	0	0	112.9	H309 M314 A316 Q325 I349 N353 L355	H309-W369 HydrophobicContact CB-CH2 4.36Å; H309-W369 HydrophobicContact CB-CZ2 4.13Å; H309-W369 AromaticContact CD2-CD1 3.97Å; H309-W369 AromaticContact CD2-CD2 3.68Å; H309-W369 AromaticContact CD2-CE2 3.54Å; H309-W369 AromaticContact CD2-CG 3.97Å; H309-W369 AromaticContact CD2-CZ2 3.97Å; H309-W369 AromaticContact CD2-NE1 3.73Å; M314-W369 HydrophobicContact CB-CZ2 3.78Å; M314-W369 HydrophobicContact CE-CZ2 4.02Å; M314-W369 HydrophobicContact SD-CZ2 4.37Å; A316-W369 HydrophobicContact CB-CH2 3.77Å; A316-W369 HydrophobicContact CB-CZ3 3.6Å; Q325-W369 HydrophobicContact CG-CE3 4.43Å; Q325-W369 HydrophobicContact CG-CH2 3.79Å; Q325-W369 HydrophobicContact CG-CZ2 3.95Å; Q325-W369 HydrophobicContact CG-CZ3 4.04Å; Q325-W369 VanDerWaalsContact NE2-CD2 3.35Å; Q325-W369 PolarHBondContact NE2-O 3.07Å; I349-W369 HydrophobicContact CD1-CE3 4.2Å; I349-W369 HydrophobicContact CD1-CH2 3.88Å; I349-W369 HydrophobicContact CD1-CZ3 3.44Å; I349-W369 VanDerWaalsContact CD1-CZ3 3.44Å; I349-W369 HydrophobicContact CG1-CE3 4.46Å; I349-W369 HydrophobicContact CG1-CZ3 4.08Å; N353-W369 HydrophobicContact CB-CB 3.62Å; N353-W369 HydrophobicContact CB-CG 4.3Å; N353-W369 WeakPolarHBondContact O-CB 3.48Å; N353-W369 PolarHBondContact O-N 2.99Å; L355-W369 HydrophobicContact CB-CE3 4.17Å; L355-W369 HydrophobicContact CD1-CZ3 4.44Å; L355-W369 HydrophobicContact CD2-CE3 4.4Å; L355-W369 HydrophobicContact CD2-CZ3 4.38Å
370	K	90.3	Very high	92.7	Very high	107 Å²	107	39.6 Å²	39.6	47%	0.465	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-41.1	-173.1	-68.1	-171.4	-176.1	177.8	0	113.1	I117 D368	I117-K370 HydrophobicContact CD1-CD 3.85Å; D368-K370 VanDerWaalsContact C-N 3.29Å; D368-K370 PolarHBondContact O-N 3.48Å
371	S	87.9	Confident	92.5	Very high	23 Å²	23	44.5 Å²	44.5	16%	0.161	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-23.3	-179.9	60.2	0	0	0	0	112.4	Q335 D368 L373	Q335-S371 PolarHBondContact NE2-O 3.23Å; D368-S371 WeakPolarHBondContact CB-OG 3.32Å; D368-S371 WeakPolarHBondContact OD2-CB 3.48Å; D368-S371 PolarHBondContact OD2-N 3.24Å; D368-S371 PolarHBondContact OD2-OG 3.07Å; S371-L373 PolarHBondContact O-N 2.84Å; S371-L373 PolarHBondContact OG-N 3.33Å
372	G	89.2	Confident	92.3	Very high	11 Å²	11	42.7 Å²	42.7	11%	0.113	21%	0.207	C	C	.	.			trans	69.5	12.6	-171.8	0	0	0	0	0	113.4	D368	D368-G372 VanDerWaalsContact O-CA 3.31Å; D368-G372 WeakPolarHBondContact O-CA 3.16Å; D368-G372 PolarHBondContact O-N 2.89Å
373	L	90.2	Very high	92.1	Very high	99 Å²	99	45.9 Å²	45.9	52%	0.518	22%	0.222	S	C	.	.			trans	-84	132.6	178.8	-169.1	84	0	0	0	110.3	P116 W367 D368 S371 F375	P116-L373 HydrophobicContact CB-CD2 4.4Å; P116-L373 HydrophobicContact CG-CD2 4.47Å; W367-L373 WeakPolarHBondContact CA-O 3.4Å; D368-L373 PolarHBondContact N-O 3.05Å; S371-L373 PolarHBondContact O-N 2.84Å; S371-L373 PolarHBondContact OG-N 3.33Å; L373-F375 PolarHBondContact O-N 3.36Å
374	A	91.4	Very high	91.7	Very high	27 Å²	27	51.4 Å²	51.4	22%	0.223	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	106.1	166.4	0	0	0	0	0	109.9	F366 W367	F366-A374 CarbonylContact O-C 3.54Å; F366-A374 VanDerWaalsContact O-CA 3.22Å; F366-A374 WeakPolarHBondContact O-CA 3.47Å; W367-A374 HydrophobicContact CD2-CB 3.97Å; W367-A374 HydrophobicContact CE3-CB 3.69Å; W367-A374 HydrophobicContact CH2-CB 3.76Å; W367-A374 HydrophobicContact CZ2-CB 4Å; W367-A374 HydrophobicContact CZ3-CB 3.61Å
375	F	91.9	Very high	91.2	Very high	61 Å²	61	55.5 Å²	55.5	27%	0.268	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-21.1	178.9	66.2	-94.4	0	0	0	112.7	H119 V354 F366 D368 L373	H119-F375 HydrophobicContact CB-CD1 4.4Å; H119-F375 HydrophobicContact CB-CD2 4.34Å; H119-F375 HydrophobicContact CB-CE1 3.96Å; H119-F375 HydrophobicContact CB-CE2 3.9Å; H119-F375 HydrophobicContact CB-CZ 3.68Å; H119-F375 AromaticContact CD2-CE1 3.96Å; V354-F375 HydrophobicContact CG1-CE1 4.05Å; V354-F375 HydrophobicContact CG1-CZ 3.91Å; V354-F375 HydrophobicContact CG2-CE1 4.42Å; V354-F375 HydrophobicContact CG2-CZ 4.35Å; F366-F375 HydrophobicContact CB-CD1 4.35Å; F366-F375 HydrophobicContact CB-CD2 4.45Å; F366-F375 HydrophobicContact CB-CE1 3.74Å; F366-F375 HydrophobicContact CB-CE2 3.84Å; F366-F375 HydrophobicContact CB-CZ 3.45Å; F366-F375 VanDerWaalsContact CB-CZ 3.45Å; F366-F375 HydrophobicContact CG-CZ 4.31Å; F366-F375 PolarHBondContact O-N 3.09Å; D368-F375 HydrophobicContact CB-CD1 4.44Å; L373-F375 PolarHBondContact O-N 3.36Å
376	Q	92.2	Very high	90.9	Very high	32 Å²	32	56.1 Å²	56.1	15%	0.15	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	138.2	177.6	-174.3	-177.5	3.8	0	0	111.5	W122 F366	W122-Q376 PolarHBondContact O-NE2 2.66Å; F366-Q376 HydrophobicContact CB-CB 4.09Å; F366-Q376 HydrophobicContact CD2-CB 3.95Å; F366-Q376 HydrophobicContact CD2-CG 4.05Å; F366-Q376 HydrophobicContact CG-CB 4.32Å; F366-Q376 PolarHBondContact N-O 2.99Å; F366-Q376 PolarHBondContact O-N 2.9Å
377	K	94.1	Very high	90.6	Very high	142 Å²	142	61.5 Å²	61.5	62%	0.617	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	131.6	170.3	-56.3	-173.1	177.7	-177.3	0	108.4	H365	H365-K377 WeakPolarHBondContact NE2-CD 3.4Å
378	Y	93.9	Very high	90.2	Very high	52 Å²	52	67.9 Å²	67.9	20%	0.204	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.7	-179.5	-175.9	-93.8	0	0	0	109.2	I364 T380 F417	I364-Y378 HydrophobicContact CD1-CD1 4.39Å; I364-Y378 PolarHBondContact N-O 3.08Å; I364-Y378 PolarHBondContact O-N 3.48Å; Y378-T380 HydrophobicContact CD1-CG2 4.18Å; Y378-T380 HydrophobicContact CE1-CG2 4.01Å; Y378-F417 AromaticContact CD1-CE1 3.9Å; Y378-F417 HydrophobicContact CD1-CE1 3.9Å; Y378-F417 HydrophobicContact CD1-CZ 4.1Å; Y378-F417 AromaticContact CE1-CE1 3.56Å; Y378-F417 HydrophobicContact CE1-CE1 3.56Å; Y378-F417 AromaticContact CE1-CZ 3.74Å; Y378-F417 HydrophobicContact CE1-CZ 3.74Å; Y378-F417 HydrophobicContact CE2-CE1 4.32Å; Y378-F417 HydrophobicContact CG-CE1 4.4Å; Y378-F417 AromaticContact CZ-CE1 3.8Å
379	Q	93.2	Very high	89.9	Confident	102 Å²	102	72.6 Å²	72.6	48%	0.477	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.9	172.6	-176.2	62.9	33.2	0	0	108.1	N361 K381	N361-Q379 PolarHBondContact O-NE2 2.83Å; Q379-K381 PolarHBondContact O-N 3.28Å
380	T	90.6	Very high	89.7	Confident	3 Å²	3	74.8 Å²	74.8	2%	0.018	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-67.7	136.4	177	66	0	0	0	0	109.7	G362 I364 Y378 V393 E409	G362-T380 WeakPolarHBondContact O-CG2 3.15Å; G362-T380 PolarHBondContact O-N 2.95Å; G362-T380 PolarHBondContact O-OG1 3.37Å; I364-T380 HydrophobicContact CD1-CG2 3.59Å; I364-T380 HydrophobicContact CG1-CG2 4.11Å; Y378-T380 HydrophobicContact CD1-CG2 4.18Å; Y378-T380 HydrophobicContact CE1-CG2 4.01Å; T380-V393 HydrophobicContact CG2-CG2 4.23Å; T380-E409 WeakPolarHBondContact CB-OE2 3.28Å; T380-E409 VanDerWaalsContact CG2-OE1 3.24Å; T380-E409 WeakPolarHBondContact CG2-OE1 3.35Å; T380-E409 PolarHBondContact OG1-OE2 3.03Å
381	K	89.4	Confident	89.7	Confident	166 Å²	166	70 Å²	70	72%	0.722	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-89.5	127.5	170.4	-65	-176.2	-179.7	-178.2	0	107.7	Q379 K415	Q379-K381 PolarHBondContact O-N 3.28Å; K381-K415 PolarHBondContact O-NZ 3.27Å
382	P	89.3	Confident	89.9	Confident	38 Å²	38	69 Å²	69	25%	0.247	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-63.8	151.7	177.7	27.3	-34	0	0	0	110.6	A391	P382-A391 HydrophobicContact CB-CB 4.46Å
383	Q	87.4	Confident	90.3	Very high	67 Å²	67	68.4 Å²	68.4	31%	0.313	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-63	145.6	172.4	-171.5	169.7	7	0	0	110.9	S129 G385 S386 D411 T413	S129-Q383 PolarHBondContact OG-NE2 3.32Å; S129-Q383 PolarHBondContact OG-OE1 3.22Å; Q383-G385 PolarHBondContact O-N 2.66Å; Q383-G385 VanDerWaalsContact O-N 3.16Å; Q383-S386 WeakPolarHBondContact O-CB 3.42Å; Q383-S386 PolarHBondContact O-N 2.9Å; Q383-D411 HydrophobicContact CB-CB 4.48Å; Q383-D411 PolarHBondContact N-OD2 2.89Å; Q383-D411 VanDerWaalsContact N-OD2 3.17Å; Q383-T413 HydrophobicContact CB-CG2 3.9Å; Q383-T413 HydrophobicContact CG-CG2 4.26Å
384	P	86.7	Confident	90.5	Very high	126 Å²	126	65.4 Å²	65.4	82%	0.818	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	123.5	169.9	-28	36.1	0	0	0	111.6
385	G	87	Confident	90.7	Very high	87 Å²	87	64.6 Å²	64.6	90%	0.897	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.8	-13.4	-176.3	0	0	0	0	0	114.6	Q383	Q383-G385 PolarHBondContact O-N 2.66Å; Q383-G385 VanDerWaalsContact O-N 3.16Å
386	S	87.6	Confident	90.9	Very high	28 Å²	28	62.4 Å²	62.4	20%	0.196	35%	0.347	C	S	.	.	S	Bend	trans	-90.4	155	171.3	-56	0	0	0	0	110.8	Q383 E390	Q383-S386 WeakPolarHBondContact O-CB 3.42Å; Q383-S386 PolarHBondContact O-N 2.9Å; S386-E390 WeakPolarHBondContact CB-OE2 3.2Å
387	I	89.5	Confident	91.1	Very high	112 Å²	112	62 Å²	62	57%	0.574	35%	0.347	S	S	*	.			trans	-82.1	151.1	176.4	-53.9	171.1	0	0	0	108.5	S389 E390	I387-S389 WeakPolarHBondContact CG2-OG 3.03Å; I387-S389 PolarHBondContact O-N 3.19Å; I387-S389 VanDerWaalsContact O-N 3.1Å; I387-E390 HydrophobicContact CB-CG 4.37Å; I387-E390 PolarHBondContact N-OE2 3.33Å; I387-E390 WeakPolarHBondContact O-CB 3.15Å; I387-E390 PolarHBondContact O-N 3.04Å
388	D	87	Confident	91.2	Very high	137 Å²	137	56 Å²	56	73%	0.733	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-56.1	-28.8	177.1	-67.3	-30.5	0	0	0	113.3	E390 A391	D388-E390 VanDerWaalsContact C-N 3.26Å; D388-E390 PolarHBondContact O-N 3.13Å; D388-A391 PolarHBondContact O-N 3.25Å
389	S	87.2	Confident	91.2	Very high	100 Å²	100	54 Å²	54	70%	0.699	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-73.1	-12.7	174.8	60.1	0	0	0	0	114.4	I387 A391	I387-S389 WeakPolarHBondContact CG2-OG 3.03Å; I387-S389 PolarHBondContact O-N 3.19Å; I387-S389 VanDerWaalsContact O-N 3.1Å; S389-A391 VanDerWaalsContact C-N 3.33Å
390	E	88.9	Confident	91.2	Very high	50 Å²	50	53.6 Å²	53.6	23%	0.234	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-91.8	7.8	175.5	-63.4	-172.9	137.6	0	0	112.6	S386 I387 D388 G392 A410 D411	S386-E390 WeakPolarHBondContact CB-OE2 3.2Å; I387-E390 HydrophobicContact CB-CG 4.37Å; I387-E390 PolarHBondContact N-OE2 3.33Å; I387-E390 WeakPolarHBondContact O-CB 3.15Å; I387-E390 PolarHBondContact O-N 3.04Å; D388-E390 VanDerWaalsContact C-N 3.26Å; D388-E390 PolarHBondContact O-N 3.13Å; E390-G392 PolarHBondContact O-N 3.22Å; E390-A410 CarbonylContact O-C 3.53Å; E390-A410 VanDerWaalsContact O-CB 3.29Å; E390-A410 WeakPolarHBondContact O-CB 3.39Å; E390-D411 PolarHBondContact O-N 2.78Å; E390-D411 VanDerWaalsContact O-N 3.17Å
391	A	88.9	Confident	91.3	Very high	6 Å²	6	56.4 Å²	56.4	5%	0.05	33%	0.331	C	S	.	.			trans	-76.8	73.8	167.6	0	0	0	0	0	108.9	N361 G362 P382 D388 S389	N361-A391 CarbonylContact C-O 3.49Å; G362-A391 WeakPolarHBondContact CA-O 3.13Å; G362-A391 PolarHBondContact N-O 3.38Å; P382-A391 HydrophobicContact CB-CB 4.46Å; D388-A391 PolarHBondContact O-N 3.25Å; S389-A391 VanDerWaalsContact C-N 3.33Å
392	G	93.2	Very high	91.4	Very high	2 Å²	2	48.6 Å²	48.6	2%	0.021	30%	0.298	C	S	.	.			trans	-123.2	142.9	178.4	0	0	0	0	0	111.7	D360 E390 E409 A410	D360-G392 WeakPolarHBondContact O-CA 3.5Å; E390-G392 PolarHBondContact O-N 3.22Å; G392-E409 CarbonylContact O-C 3.53Å; G392-E409 WeakPolarHBondContact O-CA 3.29Å; G392-A410 PolarHBondContact O-N 3.34Å
393	V	95.8	Very high	91.5	Very high	0 Å²	0	49 Å²	49	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.8	176.2	-176.4	0	0	0	0	109	N345 G359 I364 T380 L396 E409	N345-V393 WeakPolarHBondContact CB-O 3.32Å; N345-V393 PolarHBondContact ND2-O 3.43Å; N345-V393 VanDerWaalsContact ND2-O 3.16Å; G359-V393 PolarHBondContact O-N 3.05Å; I364-V393 HydrophobicContact CD1-CG2 3.99Å; I364-V393 HydrophobicContact CG1-CG2 3.83Å; T380-V393 HydrophobicContact CG2-CG2 4.23Å; V393-L396 HydrophobicContact CG1-CD1 4.22Å; V393-L396 HydrophobicContact CG1-CD2 3.88Å; V393-L396 HydrophobicContact CG1-CG 3.76Å; V393-E409 HydrophobicContact CG2-CG 4.35Å
394	F	95.8	Very high	91.9	Very high	35 Å²	35	48.8 Å²	48.8	15%	0.154	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-30.3	180	-69	-52.9	0	0	0	113.4	W134 I135 D360 G408 A410	W134-F394 HydrophobicContact CB-CD2 4.16Å; W134-F394 HydrophobicContact CB-CE2 3.73Å; W134-F394 HydrophobicContact CD2-CE2 4.08Å; W134-F394 HydrophobicContact CD2-CZ 4.39Å; W134-F394 HydrophobicContact CE3-CE2 4.14Å; W134-F394 HydrophobicContact CE3-CZ 4.12Å; W134-F394 AromaticContact CG-CE2 3.93Å; W134-F394 HydrophobicContact CG-CE2 3.93Å; I135-F394 VanDerWaalsContact O-CB 3.27Å; I135-F394 WeakPolarHBondContact O-CB 3.24Å; I135-F394 WeakPolarHBondContact O-CD2 3.26Å; D360-F394 WeakPolarHBondContact OD1-CE1 3.22Å; F394-G408 PolarHBondContact N-O 2.99Å; F394-A410 HydrophobicContact CD2-CB 4.06Å; F394-A410 HydrophobicContact CE2-CB 3.33Å; F394-A410 HydrophobicContact CZ-CB 3.89Å
395	A	95.4	Very high	92.3	Very high	10 Å²	10	42.8 Å²	42.8	8%	0.083	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.8	-178.4	0	0	0	0	0	111.1	I138 S407 G408	I138-A395 HydrophobicContact CB-CB 4.45Å; I138-A395 HydrophobicContact CG1-CB 3.97Å; A395-S407 WeakPolarHBondContact O-CA 3.21Å; A395-G408 PolarHBondContact N-O 2.93Å; A395-G408 PolarHBondContact O-N 2.96Å
396	L	95.9	Very high	92.8	Very high	16 Å²	16	38.7 Å²	38.7	8%	0.084	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.3	174.8	-72.3	170.1	0	0	0	108.4	A346 A348 V356 G358 V393 L405 I406 S407	A346-L396 HydrophobicContact CB-CB 3.98Å; A346-L396 HydrophobicContact CB-CD1 4.15Å; A346-L396 HydrophobicContact CB-CG 4.02Å; A348-L396 HydrophobicContact CB-CB 4.03Å; V356-L396 HydrophobicContact CB-CD1 4.49Å; V356-L396 HydrophobicContact CG1-CD1 3.9Å; G358-L396 VanDerWaalsContact N-CD1 3.26Å; V393-L396 HydrophobicContact CG1-CD1 4.22Å; V393-L396 HydrophobicContact CG1-CD2 3.88Å; V393-L396 HydrophobicContact CG1-CG 3.76Å; L396-L405 HydrophobicContact CD2-CD1 4.27Å; L396-L405 HydrophobicContact CD2-CD2 4.36Å; L396-L405 HydrophobicContact CD2-CG 4.44Å; L396-I406 WeakPolarHBondContact CA-O 3.48Å; L396-S407 VanDerWaalsContact CD2-CB 3.47Å
397	T	96	Very high	93.2	Very high	24 Å²	24	37.3 Å²	37.3	15%	0.147	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	147.3	171.2	-168.7	0	0	0	0	110.5	I138 V140 I406	I138-T397 HydrophobicContact CB-CG2 4.01Å; I138-T397 HydrophobicContact CG2-CG2 3.51Å; V140-T397 HydrophobicContact CG2-CG2 3.78Å; T397-I406 HydrophobicContact CG2-CB 4.18Å; T397-I406 PolarHBondContact N-O 2.79Å; T397-I406 PolarHBondContact O-N 2.79Å
398	F	96.2	Very high	93.5	Very high	15 Å²	15	32 Å²	32	7%	0.066	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	154	167.2	-75.3	-77.4	0	0	0	109.7	W122 A348 N350 V356 R404 L405	W122-F398 HydrophobicContact CH2-CD1 4.11Å; W122-F398 AromaticContact CH2-CE1 3.54Å; W122-F398 HydrophobicContact CH2-CE1 3.54Å; W122-F398 AromaticContact CZ2-CE1 3.67Å; W122-F398 HydrophobicContact CZ2-CE1 3.67Å; W122-F398 HydrophobicContact CZ2-CZ 4.42Å; W122-F398 HydrophobicContact CZ3-CE1 4.19Å; A348-F398 HydrophobicContact CB-CD2 3.77Å; A348-F398 HydrophobicContact CB-CE2 3.91Å; N350-F398 HydrophobicContact CB-CD1 4.22Å; N350-F398 HydrophobicContact CB-CD2 3.95Å; N350-F398 HydrophobicContact CB-CE1 4.07Å; N350-F398 HydrophobicContact CB-CE2 3.78Å; N350-F398 HydrophobicContact CB-CG 4.17Å; N350-F398 HydrophobicContact CB-CZ 3.82Å; V356-F398 HydrophobicContact CG2-CE2 3.86Å; V356-F398 HydrophobicContact CG2-CZ 3.47Å; V356-F398 VanDerWaalsContact CG2-CZ 3.47Å; F398-R404 CarbonylContact C-O 3.45Å; F398-R404 WeakPolarHBondContact CA-O 3.49Å; F398-L405 HydrophobicContact CD1-CB 4.12Å; F398-L405 HydrophobicContact CD1-CD1 4.15Å; F398-L405 HydrophobicContact CD2-CD1 4.33Å; F398-L405 HydrophobicContact CE1-CB 3.87Å; F398-L405 HydrophobicContact CE1-CD1 3.92Å; F398-L405 HydrophobicContact CE1-CG 4.46Å; F398-L405 HydrophobicContact CE2-CD1 4.11Å; F398-L405 HydrophobicContact CG-CD1 4.35Å; F398-L405 HydrophobicContact CZ-CD1 3.92Å
399	D	95	Very high	93.9	Very high	9 Å²	9	25.5 Å²	25.5	5%	0.048	15%	0.145	C	C	.	.			trans	-68.3	165.8	161.8	74.2	1.4	0	0	0	110.9	V140 L161 S401 G402 S403 R404	V140-D399 HydrophobicContact CG1-CB 4.36Å; L161-D399 HydrophobicContact CD1-CB 4.11Å; D399-S401 PolarHBondContact O-N 2.62Å; D399-S401 VanDerWaalsContact O-N 3.07Å; D399-S401 PolarHBondContact OD1-N 3.34Å; D399-S401 PolarHBondContact OD1-OG 3.26Å; D399-S401 PolarHBondContact OD2-OG 2.8Å; D399-G402 PolarHBondContact O-N 3.46Å; D399-G402 VanDerWaalsContact O-N 3.08Å; D399-G402 PolarHBondContact OD1-N 2.86Å; D399-S403 PolarHBondContact OD1-N 2.97Å; D399-S403 PolarHBondContact OD2-OG 2.71Å; D399-R404 HydrophobicContact CB-CB 4.29Å; D399-R404 PolarHBondContact N-O 3.09Å; D399-R404 PolarHBondContact OD1-N 3.32Å
400	Q	92.2	Very high	94.3	Very high	95 Å²	95	21 Å²	21	44%	0.444	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-13.3	-178.1	-53.2	-65.3	-26.3	0	0	112.7	V140 N144	V140-Q400 HydrophobicContact CG1-CG 4.5Å; V140-Q400 PolarHBondContact O-NE2 2.79Å; N144-Q400 WeakPolarHBondContact OD1-CB 3.43Å; N144-Q400 WeakPolarHBondContact OD1-CG 3.31Å; N144-Q400 PolarHBondContact OD1-N 2.78Å
401	S	92.3	Very high	94.5	Very high	61 Å²	61	18.7 Å²	18.7	43%	0.427	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-20.3	176.4	77.7	0	0	0	0	113.2	N144 D399 S403	N144-S401 PolarHBondContact ND2-N 3.43Å; D399-S401 PolarHBondContact O-N 2.62Å; D399-S401 VanDerWaalsContact O-N 3.07Å; D399-S401 PolarHBondContact OD1-N 3.34Å; D399-S401 PolarHBondContact OD1-OG 3.26Å; D399-S401 PolarHBondContact OD2-OG 2.8Å; S401-S403 VanDerWaalsContact C-N 3.27Å; S401-S403 PolarHBondContact O-N 2.72Å; S401-S403 WeakPolarHBondContact OG-CB 3.38Å; S401-S403 PolarHBondContact OG-N 3.49Å; S401-S403 PolarHBondContact OG-OG 3.2Å
402	G	91.9	Very high	94.8	Very high	2 Å²	2	22 Å²	22	2%	0.021	12%	0.116	C	C	.	.	S	Bend	trans	82.6	-8.7	-171.3	0	0	0	0	0	115.2	W122 N350 D399	W122-G402 WeakPolarHBondContact CH2-O 3.34Å; N350-G402 PolarHBondContact ND2-O 3.49Å; N350-G402 VanDerWaalsContact ND2-O 3.09Å; N350-G402 WeakPolarHBondContact OD1-CA 3.18Å; D399-G402 PolarHBondContact O-N 3.46Å; D399-G402 VanDerWaalsContact O-N 3.08Å; D399-G402 PolarHBondContact OD1-N 2.86Å
403	S	92.4	Very high	94.9	Very high	46 Å²	46	21.9 Å²	21.9	32%	0.322	12%	0.115	S	C	.	.	S	Bend	trans	-83.6	-17.1	-171.7	70	0	0	0	0	114.9	D399 S401	D399-S403 PolarHBondContact OD1-N 2.97Å; D399-S403 PolarHBondContact OD2-OG 2.71Å; S401-S403 VanDerWaalsContact C-N 3.27Å; S401-S403 PolarHBondContact O-N 2.72Å; S401-S403 WeakPolarHBondContact OG-CB 3.38Å; S401-S403 PolarHBondContact OG-N 3.49Å; S401-S403 PolarHBondContact OG-OG 3.2Å
404	R	94.4	Very high	94.9	Very high	64 Å²	64	21.9 Å²	21.9	24%	0.242	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132	-178.2	-59.9	173.6	-170.4	-125.1	3.3	110.3	Y125 F398 D399 F417	Y125-R404 PolarHBondContact OH-NH1 3.15Å; F398-R404 CarbonylContact C-O 3.45Å; F398-R404 WeakPolarHBondContact CA-O 3.49Å; D399-R404 HydrophobicContact CB-CB 4.29Å; D399-R404 PolarHBondContact N-O 3.09Å; D399-R404 PolarHBondContact OD1-N 3.32Å; R404-F417 WeakPolarHBondContact CA-O 3.38Å
405	L	96.3	Very high	94.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.8	168.8	175.8	76.4	0	0	0	108.5	W122 A348 V356 F366 L396 F398 M416 F417	W122-L405 HydrophobicContact CE3-CB 3.97Å; W122-L405 HydrophobicContact CH2-CB 4.49Å; W122-L405 HydrophobicContact CZ3-CB 3.79Å; A348-L405 HydrophobicContact CB-CD1 4.46Å; V356-L405 HydrophobicContact CB-CD1 4.42Å; V356-L405 HydrophobicContact CG1-CD1 4.49Å; V356-L405 HydrophobicContact CG1-CD2 3.9Å; V356-L405 HydrophobicContact CG2-CD1 4.29Å; V356-L405 HydrophobicContact CG2-CD2 4.26Å; F366-L405 HydrophobicContact CE1-CD2 3.76Å; F366-L405 HydrophobicContact CZ-CD2 3.86Å; L396-L405 HydrophobicContact CD2-CD1 4.27Å; L396-L405 HydrophobicContact CD2-CD2 4.36Å; L396-L405 HydrophobicContact CD2-CG 4.44Å; F398-L405 HydrophobicContact CD1-CB 4.12Å; F398-L405 HydrophobicContact CD1-CD1 4.15Å; F398-L405 HydrophobicContact CD2-CD1 4.33Å; F398-L405 HydrophobicContact CE1-CB 3.87Å; F398-L405 HydrophobicContact CE1-CD1 3.92Å; F398-L405 HydrophobicContact CE1-CG 4.46Å; F398-L405 HydrophobicContact CE2-CD1 4.11Å; F398-L405 HydrophobicContact CG-CD1 4.35Å; F398-L405 HydrophobicContact CZ-CD1 3.92Å; L405-M416 CarbonylContact O-C 3.6Å; L405-M416 WeakPolarHBondContact O-CA 3.48Å; L405-F417 HydrophobicContact CB-CB 4.2Å; L405-F417 HydrophobicContact CD2-CB 4.47Å; L405-F417 HydrophobicContact CD2-CD2 4.01Å; L405-F417 HydrophobicContact CD2-CG 4.42Å; L405-F417 HydrophobicContact CG-CD2 4.42Å; L405-F417 PolarHBondContact N-O 2.78Å; L405-F417 PolarHBondContact O-N 3.45Å
406	I	96.8	Very high	94.9	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.8	177.3	-48.5	179.2	0	0	0	107.7	I138 V140 F147 L396 T397 I414 M416	I138-I406 HydrophobicContact CD1-CG2 3.85Å; I138-I406 HydrophobicContact CG2-CB 4.41Å; I138-I406 HydrophobicContact CG2-CG2 3.99Å; V140-I406 HydrophobicContact CG2-CD1 3.85Å; F147-I406 HydrophobicContact CB-CD1 4.27Å; F147-I406 HydrophobicContact CD1-CD1 4.09Å; F147-I406 HydrophobicContact CD2-CD1 4.25Å; F147-I406 HydrophobicContact CD2-CG2 4.42Å; F147-I406 HydrophobicContact CE1-CD1 4.49Å; F147-I406 HydrophobicContact CE2-CG2 4.17Å; F147-I406 HydrophobicContact CG-CD1 3.95Å; L396-I406 WeakPolarHBondContact CA-O 3.48Å; T397-I406 HydrophobicContact CG2-CB 4.18Å; T397-I406 PolarHBondContact N-O 2.79Å; T397-I406 PolarHBondContact O-N 2.79Å; I406-I414 HydrophobicContact CG2-CG2 3.41Å; I406-I414 VanDerWaalsContact CG2-CG2 3.41Å; I406-M416 HydrophobicContact CD1-CE 3.88Å; I406-M416 HydrophobicContact CG1-CE 3.83Å; I406-M416 HydrophobicContact CG2-CG 4.44Å
407	S	96.6	Very high	94.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139.2	178.3	64.6	0	0	0	0	111.1	I138 A395 L396 I414 K415 F417	I138-S407 VanDerWaalsContact CD1-C 3.47Å; A395-S407 WeakPolarHBondContact O-CA 3.21Å; L396-S407 VanDerWaalsContact CD2-CB 3.47Å; S407-I414 VanDerWaalsContact O-CA 3.28Å; S407-I414 WeakPolarHBondContact O-CA 3.21Å; S407-K415 PolarHBondContact N-O 3.13Å; S407-K415 PolarHBondContact O-N 3.49Å; S407-K415 WeakPolarHBondContact OG-CB 3.43Å; S407-K415 PolarHBondContact OG-O 2.76Å; S407-F417 WeakPolarHBondContact OG-CE2 3.47Å
408	G	95.7	Very high	94.8	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	114.7	175	0	0	0	0	0	109.2	I138 F394 A395	I138-G408 VanDerWaalsContact CD1-CA 3.47Å; F394-G408 PolarHBondContact N-O 2.99Å; A395-G408 PolarHBondContact N-O 2.93Å; A395-G408 PolarHBondContact O-N 2.96Å
409	E	95.5	Very high	94.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	161	-171.2	-66	-166.3	-149.7	0	0	112.7	I135 T380 G392 V393 D411 K412 T413 K415	I135-E409 PolarHBondContact N-O 2.94Å; T380-E409 WeakPolarHBondContact CB-OE2 3.28Å; T380-E409 VanDerWaalsContact CG2-OE1 3.24Å; T380-E409 WeakPolarHBondContact CG2-OE1 3.35Å; T380-E409 PolarHBondContact OG1-OE2 3.03Å; G392-E409 CarbonylContact O-C 3.53Å; G392-E409 WeakPolarHBondContact O-CA 3.29Å; V393-E409 HydrophobicContact CG2-CG 4.35Å; E409-D411 VanDerWaalsContact C-N 3.27Å; E409-D411 WeakPolarHBondContact CB-OD1 3.31Å; E409-K412 PolarHBondContact O-N 3.05Å; E409-T413 PolarHBondContact N-O 2.86Å; E409-T413 VanDerWaalsContact N-O 3.11Å; E409-K415 WeakPolarHBondContact OE1-CD 3.49Å; E409-K415 WeakPolarHBondContact OE1-CG 3.29Å; E409-K415 IonicContact OE1-NZ 2.8Å; E409-K415 PolarHBondContact OE1-NZ 3.41Å; E409-K415 IonicContact OE2-NZ 2.67Å; E409-K415 PolarHBondContact OE2-NZ 3.02Å
410	A	94.6	Very high	94.5	Very high	6 Å²	6	24.6 Å²	24.6	5%	0.05	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.1	174.4	0	0	0	0	0	111.8	E390 G392 F394 K412	E390-A410 CarbonylContact O-C 3.53Å; E390-A410 VanDerWaalsContact O-CB 3.29Å; E390-A410 WeakPolarHBondContact O-CB 3.39Å; G392-A410 PolarHBondContact O-N 3.34Å; F394-A410 HydrophobicContact CD2-CB 4.06Å; F394-A410 HydrophobicContact CE2-CB 3.33Å; F394-A410 HydrophobicContact CZ-CB 3.89Å; A410-K412 PolarHBondContact O-N 2.82Å
411	D	93.6	Very high	94.3	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	12.1	173.3	74.3	-3.2	0	0	0	113.8	Q383 E390 E409 T413 K415	Q383-D411 HydrophobicContact CB-CB 4.48Å; Q383-D411 PolarHBondContact N-OD2 2.89Å; Q383-D411 VanDerWaalsContact N-OD2 3.17Å; E390-D411 PolarHBondContact O-N 2.78Å; E390-D411 VanDerWaalsContact O-N 3.17Å; E409-D411 VanDerWaalsContact C-N 3.27Å; E409-D411 WeakPolarHBondContact CB-OD1 3.31Å; D411-T413 VanDerWaalsContact CG-OG1 3.27Å; D411-T413 PolarHBondContact O-N 2.92Å; D411-T413 VanDerWaalsContact OD1-CB 3.29Å; D411-T413 WeakPolarHBondContact OD1-CB 3.44Å; D411-T413 WeakPolarHBondContact OD1-CG2 3.38Å; D411-T413 PolarHBondContact OD1-N 3.37Å; D411-T413 PolarHBondContact OD1-OG1 2.78Å; D411-T413 PolarHBondContact OD2-OG1 3.05Å; D411-K415 IonicContact OD2-NZ 2.64Å; D411-K415 PolarHBondContact OD2-NZ 2.99Å
412	K	94.5	Very high	94	Very high	76 Å²	76	30.1 Å²	30.1	33%	0.33	15%	0.151	S	C	.	.	S	Bend	trans	68.6	13.7	177.4	-42.3	165.9	-179.9	-170.4	0	113.1	T132 E409 A410	T132-K412 WeakPolarHBondContact O-CD 3.45Å; T132-K412 WeakPolarHBondContact O-CE 3.17Å; T132-K412 PolarHBondContact O-NZ 3.44Å; E409-K412 PolarHBondContact O-N 3.05Å; A410-K412 PolarHBondContact O-N 2.82Å
413	T	95.3	Very high	93.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	153.6	177.2	74.6	0	0	0	0	113.3	V127 I128 I135 Q383 E409 D411 K415	V127-T413 HydrophobicContact CG1-CG2 4Å; I128-T413 WeakPolarHBondContact O-CA 3.49Å; I135-T413 WeakPolarHBondContact CD1-O 3.21Å; Q383-T413 HydrophobicContact CB-CG2 3.9Å; Q383-T413 HydrophobicContact CG-CG2 4.26Å; E409-T413 PolarHBondContact N-O 2.86Å; E409-T413 VanDerWaalsContact N-O 3.11Å; D411-T413 VanDerWaalsContact CG-OG1 3.27Å; D411-T413 PolarHBondContact O-N 2.92Å; D411-T413 VanDerWaalsContact OD1-CB 3.29Å; D411-T413 WeakPolarHBondContact OD1-CB 3.44Å; D411-T413 WeakPolarHBondContact OD1-CG2 3.38Å; D411-T413 PolarHBondContact OD1-N 3.37Å; D411-T413 PolarHBondContact OD1-OG1 2.78Å; D411-T413 PolarHBondContact OD2-OG1 3.05Å; T413-K415 WeakPolarHBondContact OG1-CE 3.4Å
414	I	96.4	Very high	92.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	111.9	167.3	-52.9	154.7	0	0	0	106.3	I128 I135 I138 F147 T149 W159 I406 S407	I128-I414 HydrophobicContact CB-CB 4.19Å; I128-I414 HydrophobicContact CG2-CD1 4.43Å; I128-I414 PolarHBondContact N-O 2.75Å; I128-I414 PolarHBondContact O-N 3.16Å; I135-I414 HydrophobicContact CD1-CD1 4.49Å; I135-I414 HydrophobicContact CD1-CG1 3.55Å; I138-I414 HydrophobicContact CD1-CG2 4.29Å; F147-I414 HydrophobicContact CE2-CD1 4.1Å; F147-I414 HydrophobicContact CE2-CG2 4.02Å; F147-I414 HydrophobicContact CZ-CG2 4.27Å; T149-I414 HydrophobicContact CG2-CD1 3.62Å; T149-I414 HydrophobicContact CG2-CG1 4.1Å; W159-I414 HydrophobicContact CD2-CD1 4.24Å; W159-I414 HydrophobicContact CG-CD1 4.4Å; W159-I414 HydrophobicContact CZ2-CD1 3.98Å; I406-I414 HydrophobicContact CG2-CG2 3.41Å; I406-I414 VanDerWaalsContact CG2-CG2 3.41Å; S407-I414 VanDerWaalsContact O-CA 3.28Å; S407-I414 WeakPolarHBondContact O-CA 3.21Å
415	K	95.6	Very high	91.6	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.026	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	128	177	-59	-156.5	-174.1	114.7	0	109.7	L124 V127 K381 S407 E409 D411 T413 F417	L124-K415 HydrophobicContact CD1-CB 3.66Å; L124-K415 HydrophobicContact CD1-CD 4.16Å; L124-K415 HydrophobicContact CD1-CG 4.28Å; L124-K415 HydrophobicContact CD2-CD 4.31Å; V127-K415 HydrophobicContact CG1-CG 4.34Å; V127-K415 HydrophobicContact CG2-CD 4.14Å; V127-K415 HydrophobicContact CG2-CG 4.17Å; K381-K415 PolarHBondContact O-NZ 3.27Å; S407-K415 PolarHBondContact N-O 3.13Å; S407-K415 PolarHBondContact O-N 3.49Å; S407-K415 WeakPolarHBondContact OG-CB 3.43Å; S407-K415 PolarHBondContact OG-O 2.76Å; E409-K415 WeakPolarHBondContact OE1-CD 3.49Å; E409-K415 WeakPolarHBondContact OE1-CG 3.29Å; E409-K415 IonicContact OE1-NZ 2.8Å; E409-K415 PolarHBondContact OE1-NZ 3.41Å; E409-K415 IonicContact OE2-NZ 2.67Å; E409-K415 PolarHBondContact OE2-NZ 3.02Å; D411-K415 IonicContact OD2-NZ 2.64Å; D411-K415 PolarHBondContact OD2-NZ 2.99Å; T413-K415 WeakPolarHBondContact OG1-CE 3.4Å; K415-F417 HydrophobicContact CB-CE2 3.99Å; K415-F417 HydrophobicContact CB-CZ 4.29Å
416	M	95.9	Very high	89.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.1	179.5	-56.1	-176.8	83.8	0	0	110.4	Y125 R126 I128 F147 L161 L405 I406	Y125-M416 HydrophobicContact CD1-CB 4.16Å; Y125-M416 WeakPolarHBondContact CD1-O 3.42Å; Y125-M416 HydrophobicContact CE1-CB 3.39Å; Y125-M416 WeakPolarHBondContact CE1-O 3.34Å; Y125-M416 HydrophobicContact CE2-CB 4.47Å; Y125-M416 PolarHBondContact N-O 3.45Å; Y125-M416 WeakPolarHBondContact OH-CE 3.36Å; Y125-M416 PolarHBondContact OH-SD 3.31Å; Y125-M416 VanDerWaalsContact OH-SD 3.33Å; R126-M416 HydrophobicContact CB-CB 4.32Å; R126-M416 PolarHBondContact N-O 2.76Å; R126-M416 PolarHBondContact O-N 3.28Å; I128-M416 HydrophobicContact CD1-CG 4.5Å; I128-M416 HydrophobicContact CD1-SD 3.9Å; F147-M416 HydrophobicContact CE1-CE 4.39Å; L161-M416 HydrophobicContact CG-CE 4.5Å; L405-M416 CarbonylContact O-C 3.6Å; L405-M416 WeakPolarHBondContact O-CA 3.48Å; I406-M416 HydrophobicContact CD1-CE 3.88Å; I406-M416 HydrophobicContact CG1-CE 3.83Å; I406-M416 HydrophobicContact CG2-CG 4.44Å
417	F	96	Very high	87.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	149.7	179	-54.9	-100.6	0	0	0	110.4	W122 K123 L124 I364 Y378 R404 L405 S407 K415	W122-F417 HydrophobicContact CB-CB 4.42Å; W122-F417 HydrophobicContact CE3-CB 3.85Å; K123-F417 CarbonylContact O-C 3.6Å; K123-F417 VanDerWaalsContact O-CA 3.24Å; K123-F417 WeakPolarHBondContact O-CA 3.38Å; L124-F417 HydrophobicContact CB-CD1 4.04Å; L124-F417 HydrophobicContact CB-CE1 3.87Å; L124-F417 HydrophobicContact CD1-CD1 4.44Å; L124-F417 HydrophobicContact CD1-CE1 4.12Å; L124-F417 HydrophobicContact CD1-CE2 4.48Å; L124-F417 HydrophobicContact CD1-CZ 4.14Å; I364-F417 HydrophobicContact CD1-CE2 4.16Å; I364-F417 HydrophobicContact CD1-CZ 4.03Å; Y378-F417 AromaticContact CD1-CE1 3.9Å; Y378-F417 HydrophobicContact CD1-CE1 3.9Å; Y378-F417 HydrophobicContact CD1-CZ 4.1Å; Y378-F417 AromaticContact CE1-CE1 3.56Å; Y378-F417 HydrophobicContact CE1-CE1 3.56Å; Y378-F417 AromaticContact CE1-CZ 3.74Å; Y378-F417 HydrophobicContact CE1-CZ 3.74Å; Y378-F417 HydrophobicContact CE2-CE1 4.32Å; Y378-F417 HydrophobicContact CG-CE1 4.4Å; Y378-F417 AromaticContact CZ-CE1 3.8Å; R404-F417 WeakPolarHBondContact CA-O 3.38Å; L405-F417 HydrophobicContact CB-CB 4.2Å; L405-F417 HydrophobicContact CD2-CB 4.47Å; L405-F417 HydrophobicContact CD2-CD2 4.01Å; L405-F417 HydrophobicContact CD2-CG 4.42Å; L405-F417 HydrophobicContact CG-CD2 4.42Å; L405-F417 PolarHBondContact N-O 2.78Å; L405-F417 PolarHBondContact O-N 3.45Å; S407-F417 WeakPolarHBondContact OG-CE2 3.47Å; K415-F417 HydrophobicContact CB-CE2 3.99Å; K415-F417 HydrophobicContact CB-CZ 4.29Å
418	K	94.2	Very high	84.2	Confident	81 Å²	81	52.5 Å²	52.5	35%	0.352	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.9	173.2	-170.5	-174.9	172.4	-163.7	0	108.2	W122 K123 Y125 E421	W122-K418 WeakPolarHBondContact CA-O 3.44Å; K123-K418 PolarHBondContact N-O 2.84Å; K123-K418 PolarHBondContact O-N 3.31Å; Y125-K418 HydrophobicContact CD1-CB 3.72Å; Y125-K418 HydrophobicContact CE1-CB 4.12Å; Y125-K418 HydrophobicContact CG-CB 4.45Å; K418-E421 WeakPolarHBondContact CE-OE1 3.21Å; K418-E421 IonicContact NZ-OE1 3.68Å; K418-E421 PolarHBondContact NZ-OE1 3.06Å
419	E	93.3	Very high	81.2	Confident	55 Å²	55	66.2 Å²	66.2	26%	0.257	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	141.9	169.9	-62.7	-178.2	167.8	0	0	111.5	P120 W122 E421	P120-E419 HydrophobicContact CB-CB 4.25Å; P120-E419 HydrophobicContact CG-CB 3.87Å; P120-E419 HydrophobicContact CG-CG 3.91Å; P120-E419 WeakPolarHBondContact CG-OE2 3.3Å; W122-E419 HydrophobicContact CD2-CG 4.02Å; W122-E419 HydrophobicContact CE3-CG 4.34Å; W122-E419 HydrophobicContact CH2-CG 3.82Å; W122-E419 HydrophobicContact CZ2-CG 3.45Å; W122-E419 VanDerWaalsContact CZ2-CG 3.45Å; W122-E419 VanDerWaalsContact CZ2-OE1 3.29Å; W122-E419 WeakPolarHBondContact CZ2-OE1 3.39Å; W122-E419 HydrophobicContact CZ3-CG 4.25Å; E419-E421 PolarHBondContact O-N 2.95Å
420	D	91.5	Very high	80.5	Confident	24 Å²	24	69.5 Å²	69.5	13%	0.128	36%	0.364	C	S	.	.			trans	-82.7	103.4	176.3	-176.9	31.2	0	0	0	110.9	P121 K123 T422 A423	P121-D420 HydrophobicContact CG-CB 4.02Å; P121-D420 VanDerWaalsContact O-CB 3.25Å; P121-D420 WeakPolarHBondContact O-CB 3.37Å; P121-D420 PolarHBondContact O-N 2.96Å; K123-D420 HydrophobicContact CD-CB 3.89Å; K123-D420 WeakPolarHBondContact CE-OD2 3.35Å; K123-D420 HydrophobicContact CG-CB 4.16Å; K123-D420 IonicContact NZ-OD1 2.93Å; K123-D420 PolarHBondContact NZ-OD1 2.76Å; K123-D420 IonicContact NZ-OD2 2.63Å; K123-D420 PolarHBondContact NZ-OD2 2.81Å; D420-T422 VanDerWaalsContact CG-OG1 3.27Å; D420-T422 PolarHBondContact O-N 3.19Å; D420-T422 PolarHBondContact OD1-N 3.35Å; D420-T422 PolarHBondContact OD1-OG1 3.03Å; D420-T422 PolarHBondContact OD2-OG1 2.97Å; D420-A423 HydrophobicContact CB-CB 4.41Å; D420-A423 PolarHBondContact O-N 2.88Å
421	E	86.8	Confident	79.7	Confident	157 Å²	157	72.8 Å²	72.8	73%	0.734	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-16	179.8	-65.3	171.9	-166.8	0	0	113.1	K418 E419	K418-E421 WeakPolarHBondContact CE-OE1 3.21Å; K418-E421 IonicContact NZ-OE1 3.68Å; K418-E421 PolarHBondContact NZ-OE1 3.06Å; E419-E421 PolarHBondContact O-N 2.95Å
422	T	86.6	Confident	78.9	Confident	114 Å²	114	76.8 Å²	76.8	70%	0.699	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-14.3	178.9	64.7	0	0	0	0	114	D420 S424	D420-T422 VanDerWaalsContact CG-OG1 3.27Å; D420-T422 PolarHBondContact O-N 3.19Å; D420-T422 PolarHBondContact OD1-N 3.35Å; D420-T422 PolarHBondContact OD1-OG1 3.03Å; D420-T422 PolarHBondContact OD2-OG1 2.97Å; T422-S424 PolarHBondContact O-N 2.61Å
423	A	81.7	Confident	78	Confident	29 Å²	29	76.9 Å²	76.9	24%	0.24	41%	0.406	C	S	.	.			trans	-74.9	128.7	-178.5	0	0	0	0	0	110.3	W118 P121 D420	W118-A423 HydrophobicContact CH2-CB 4.41Å; W118-A423 VanDerWaalsContact CH2-O 3.24Å; W118-A423 WeakPolarHBondContact CH2-O 3.49Å; W118-A423 HydrophobicContact CZ2-CB 4.04Å; P121-A423 HydrophobicContact CG-CB 3.78Å; D420-A423 HydrophobicContact CB-CB 4.41Å; D420-A423 PolarHBondContact O-N 2.88Å
424	S	76.8	Confident	76.9	Confident	73 Å²	73	81.7 Å²	81.7	51%	0.51	43%	0.431	S	S	.	.			trans	-112.6	154.2	170.7	64.5	0	0	0	0	110.1	T422 C426 G427	T422-S424 PolarHBondContact O-N 2.61Å; S424-C426 PolarHBondContact O-N 2.96Å; S424-G427 PolarHBondContact O-N 2.79Å
425	R	69.5	Low	75.7	Confident	189 Å²	189	87.1 Å²	87.1	71%	0.713	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.4	179.1	-170.4	175.8	-178.2	-175.7	2.6	113.6	W118	W118-R425 HydrophobicContact CB-CG 4.16Å; W118-R425 HydrophobicContact CD2-CB 4.2Å; W118-R425 HydrophobicContact CD2-CG 4.45Å; W118-R425 HydrophobicContact CG-CB 4.18Å; W118-R425 HydrophobicContact CG-CG 3.91Å
426	C	53.1	Low	74.2	Confident	108 Å²	108	92.9 Å²	92.9	73%	0.73	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-4	-175.5	-64.3	0	0	0	0	114.6	S424 V428	S424-C426 PolarHBondContact O-N 2.96Å; C426-V428 PolarHBondContact O-N 2.88Å
427	G	45.2	Very low	72.6	Confident	64 Å²	64	100.1 Å²	100.1	66%	0.66	53%	0.529	S	S	*	.	S	Bend	trans	-87.8	8	-174.5	0	0	0	0	0	116.5	S424	S424-G427 PolarHBondContact O-N 2.79Å
428	V	37.1	Very low	70.6	Confident	119 Å²	119	108.4 Å²	108.4	72%	0.721	57%	0.573	S	S	*	*			trans	-130.4	90.3	-177.8	-169.6	0	0	0	0	109.1	C426	C426-V428 PolarHBondContact O-N 2.88Å
429	Y	31.4	Very low	68.5	Low	288 Å²	288	110.9 Å²	110.9	100%	1.129	59%	0.593	S	S	*	*			trans	-127.8	0	155.1	-77.8	-71.7	0	0	0	108.3

Retrieved 429 of 429 residues in 618.3 ms (Link to these results)

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