A0A077Z8H2_TRITR Loading...

DUF290 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z8H2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 158 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	60.1	Low	66.3	Low	208 Å²	208	115.1 Å²	115.1	100%	1.025	62%	0.623	S	S	*	*				0	-54.8	0	-62.9	-67.1	-149.4	0	0	111.9	L3 R4 V5	M1-L3 PolarHBondContact O-N 3.33Å; M1-R4 PolarHBondContact O-N 3.01Å; M1-V5 PolarHBondContact O-N 3.05Å
2	A	63.3	Low	65.8	Low	83 Å²	83	112.3 Å²	112.3	69%	0.686	61%	0.612	S	S	*	*	H	α-helix	trans	-56.2	-39.9	-177.2	0	0	0	0	0	115.2	R4 V5 A6	A2-R4 VanDerWaalsContact C-N 3.34Å; A2-R4 PolarHBondContact O-N 3.39Å; A2-V5 PolarHBondContact O-N 2.81Å; A2-A6 PolarHBondContact O-N 2.68Å
3	L	65.9	Low	65.3	Low	145 Å²	145	111.7 Å²	111.7	76%	0.759	61%	0.607	S	S	*	*	H	α-helix	trans	-65.3	-34.3	-179.2	-157.2	78.7	0	0	0	113.2	M1 L7	M1-L3 PolarHBondContact O-N 3.33Å; L3-L7 PolarHBondContact O-N 3.04Å; L3-L7 VanDerWaalsContact O-N 3.16Å
4	R	62.1	Low	64.8	Low	210 Å²	210	109.2 Å²	109.2	79%	0.792	60%	0.597	S	S	*	*	H	α-helix	trans	-73.4	-36.7	177.9	-72.6	-169.4	177	-172.2	-0.9	111.8	M1 A2 L7 V8	M1-R4 PolarHBondContact O-N 3.01Å; A2-R4 VanDerWaalsContact C-N 3.34Å; A2-R4 PolarHBondContact O-N 3.39Å; R4-L7 PolarHBondContact O-N 3.03Å; R4-V8 VanDerWaalsContact O-CG2 3.31Å; R4-V8 WeakPolarHBondContact O-CG2 3.22Å; R4-V8 PolarHBondContact O-N 3.16Å; R4-V8 VanDerWaalsContact O-N 3.16Å
5	V	69.4	Low	64.3	Low	89 Å²	89	108.6 Å²	108.6	54%	0.539	60%	0.597	S	S	.	*	H	α-helix	trans	-67.5	-42.1	176.8	179.5	0	0	0	0	110.8	M1 A2 L7 V8 L9	M1-V5 PolarHBondContact O-N 3.05Å; A2-V5 PolarHBondContact O-N 2.81Å; V5-L7 PolarHBondContact O-N 3.01Å; V5-V8 PolarHBondContact O-N 3.47Å; V5-L9 HydrophobicContact CG1-CD1 3.98Å; V5-L9 PolarHBondContact O-N 3.3Å
6	A	68.6	Low	63.6	Low	46 Å²	46	107.1 Å²	107.1	38%	0.38	60%	0.596	S	S	.	*	H	α-helix	trans	-61.9	-42.1	175.4	0	0	0	0	0	112.5	A2 V8 L9 I10	A2-A6 PolarHBondContact O-N 2.68Å; A6-V8 PolarHBondContact O-N 3.09Å; A6-L9 PolarHBondContact O-N 3.09Å; A6-I10 VanDerWaalsContact O-CG1 3.27Å; A6-I10 WeakPolarHBondContact O-CG1 3.26Å; A6-I10 PolarHBondContact O-N 3.07Å
7	L	69.3	Low	63	Low	115 Å²	115	107.1 Å²	107.1	60%	0.602	60%	0.599	S	S	*	*	H	α-helix	trans	-65.2	-40.6	179.4	-136	117	0	0	0	112.1	L3 R4 V5 I10 T11	L3-L7 PolarHBondContact O-N 3.04Å; L3-L7 VanDerWaalsContact O-N 3.16Å; R4-L7 PolarHBondContact O-N 3.03Å; V5-L7 PolarHBondContact O-N 3.01Å; L7-I10 PolarHBondContact O-N 2.81Å; L7-T11 PolarHBondContact O-N 2.9Å; L7-T11 PolarHBondContact O-OG1 2.87Å; L7-T11 VanDerWaalsContact O-OG1 3.08Å
8	V	70.3	Confident	62.1	Low	88 Å²	88	113 Å²	113	53%	0.533	61%	0.611	S	S	.	*	H	α-helix	trans	-64.3	-45.5	176.3	173.3	0	0	0	0	110.8	R4 V5 A6 I10 T11 V12	R4-V8 VanDerWaalsContact O-CG2 3.31Å; R4-V8 WeakPolarHBondContact O-CG2 3.22Å; R4-V8 PolarHBondContact O-N 3.16Å; R4-V8 VanDerWaalsContact O-N 3.16Å; V5-V8 PolarHBondContact O-N 3.47Å; A6-V8 PolarHBondContact O-N 3.09Å; V8-I10 VanDerWaalsContact C-N 3.34Å; V8-I10 PolarHBondContact O-N 2.98Å; V8-T11 WeakPolarHBondContact CA-OG1 3.3Å; V8-T11 PolarHBondContact O-N 3.25Å; V8-T11 PolarHBondContact O-OG1 3.44Å; V8-V12 HydrophobicContact CG1-CG2 4.33Å; V8-V12 VanDerWaalsContact O-CG2 3.29Å; V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 2.88Å
9	L	65.3	Low	61.5	Low	102 Å²	102	111.8 Å²	111.8	53%	0.534	61%	0.612	S	S	.	*	H	α-helix	trans	-60.6	-41.1	176.7	-104.4	132.9	0	0	0	112.5	V5 A6 V12 L13	V5-L9 HydrophobicContact CG1-CD1 3.98Å; V5-L9 PolarHBondContact O-N 3.3Å; A6-L9 PolarHBondContact O-N 3.09Å; L9-V12 PolarHBondContact O-N 2.79Å; L9-L13 WeakPolarHBondContact O-CB 3.19Å; L9-L13 PolarHBondContact O-N 3.17Å
10	I	72.4	Confident	61.1	Low	107 Å²	107	109.8 Å²	109.8	55%	0.549	61%	0.61	S	S	.	*	H	α-helix	trans	-65	-45.2	175.9	-67.9	164.5	0	0	0	110.5	A6 L7 V8 V12 L13 V14	A6-I10 VanDerWaalsContact O-CG1 3.27Å; A6-I10 WeakPolarHBondContact O-CG1 3.26Å; A6-I10 PolarHBondContact O-N 3.07Å; L7-I10 PolarHBondContact O-N 2.81Å; V8-I10 VanDerWaalsContact C-N 3.34Å; V8-I10 PolarHBondContact O-N 2.98Å; I10-V12 PolarHBondContact O-N 2.95Å; I10-L13 PolarHBondContact O-N 3.42Å; I10-V14 HydrophobicContact CG2-CG2 4.31Å; I10-V14 VanDerWaalsContact O-CG2 3.26Å; I10-V14 WeakPolarHBondContact O-CG2 3.38Å; I10-V14 PolarHBondContact O-N 3.14Å
11	T	62.2	Low	60.9	Low	73 Å²	73	109.9 Å²	109.9	45%	0.448	61%	0.606	S	S	.	*	H	α-helix	trans	-63.5	-39.3	177.3	46.5	0	0	0	0	112.7	L7 V8 V14 V15	L7-T11 PolarHBondContact O-N 2.9Å; L7-T11 PolarHBondContact O-OG1 2.87Å; L7-T11 VanDerWaalsContact O-OG1 3.08Å; V8-T11 WeakPolarHBondContact CA-OG1 3.3Å; V8-T11 PolarHBondContact O-N 3.25Å; V8-T11 PolarHBondContact O-OG1 3.44Å; T11-V14 PolarHBondContact O-N 2.01Å; T11-V15 VanDerWaalsContact O-CG2 3.23Å; T11-V15 WeakPolarHBondContact O-CG2 3.47Å; T11-V15 PolarHBondContact O-N 3.39Å
12	V	60.6	Low	61.3	Low	81 Å²	81	107.1 Å²	107.1	49%	0.491	59%	0.589	S	S	.	*	H	α-helix	trans	-66.4	-42	176.4	173.5	0	0	0	0	110.7	V8 L9 I10 V15 C16	V8-V12 HydrophobicContact CG1-CG2 4.33Å; V8-V12 VanDerWaalsContact O-CG2 3.29Å; V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 2.88Å; L9-V12 PolarHBondContact O-N 2.79Å; I10-V12 PolarHBondContact O-N 2.95Å; V12-V15 PolarHBondContact O-N 2.94Å; V12-C16 WeakPolarHBondContact O-CB 3.28Å; V12-C16 PolarHBondContact O-N 3.34Å; V12-C16 PolarHBondContact O-SG 3.2Å; V12-C16 VanDerWaalsContact O-SG 3.33Å
13	L	58.8	Low	62	Low	105 Å²	105	108.9 Å²	108.9	55%	0.55	58%	0.583	S	S	.	*	H	α-helix	trans	-63.2	-42.5	174.9	-85.6	157.7	0	0	0	112.3	L9 I10 V15 C16 V17	L9-L13 WeakPolarHBondContact O-CB 3.19Å; L9-L13 PolarHBondContact O-N 3.17Å; I10-L13 PolarHBondContact O-N 3.42Å; L13-V15 PolarHBondContact O-N 3.48Å; L13-C16 PolarHBondContact O-N 2.9Å; L13-V17 WeakPolarHBondContact O-CB 3.4Å; L13-V17 WeakPolarHBondContact O-CG2 3.45Å; L13-V17 PolarHBondContact O-N 3.18Å
14	V	59.4	Low	62.8	Low	77 Å²	77	102.7 Å²	102.7	47%	0.467	55%	0.551	S	S	.	*	H	α-helix	trans	-63.6	-41.9	177.3	171.9	0	0	0	0	111.1	I10 T11 W18	I10-V14 HydrophobicContact CG2-CG2 4.31Å; I10-V14 VanDerWaalsContact O-CG2 3.26Å; I10-V14 WeakPolarHBondContact O-CG2 3.38Å; I10-V14 PolarHBondContact O-N 3.14Å; T11-V14 PolarHBondContact O-N 2.01Å; V14-W18 WeakPolarHBondContact O-CB 3.17Å; V14-W18 PolarHBondContact O-N 2.85Å; V14-W18 VanDerWaalsContact O-N 3.11Å
15	V	57.2	Low	64	Low	100 Å²	100	94.4 Å²	94.4	61%	0.606	53%	0.525	S	S	*	.	H	α-helix	trans	-68.1	-41.7	177.3	174.4	0	0	0	0	111.6	T11 V12 L13 W18 S19	T11-V15 VanDerWaalsContact O-CG2 3.23Å; T11-V15 WeakPolarHBondContact O-CG2 3.47Å; T11-V15 PolarHBondContact O-N 3.39Å; V12-V15 PolarHBondContact O-N 2.94Å; L13-V15 PolarHBondContact O-N 3.48Å; V15-W18 PolarHBondContact O-N 3.37Å; V15-S19 PolarHBondContact O-N 3.23Å; V15-S19 VanDerWaalsContact O-N 3.16Å
16	C	53.2	Low	64.9	Low	85 Å²	85	91.9 Å²	91.9	57%	0.574	51%	0.506	S	S	*	.	H	α-helix	trans	-67.1	-36	177	-73.2	0	0	0	0	112.8	V12 L13 W18 S19	V12-C16 WeakPolarHBondContact O-CB 3.28Å; V12-C16 PolarHBondContact O-N 3.34Å; V12-C16 PolarHBondContact O-SG 3.2Å; V12-C16 VanDerWaalsContact O-SG 3.33Å; L13-C16 PolarHBondContact O-N 2.9Å; C16-W18 VanDerWaalsContact C-N 3.33Å; C16-S19 PolarHBondContact O-N 2.68Å
17	V	52.1	Low	66	Low	107 Å²	107	91.5 Å²	91.5	65%	0.648	50%	0.497	S	S	*	.	H	α-helix	trans	-70.7	-30.6	176.3	173.3	0	0	0	0	111.5	L13	L13-V17 WeakPolarHBondContact O-CB 3.4Å; L13-V17 WeakPolarHBondContact O-CG2 3.45Å; L13-V17 PolarHBondContact O-N 3.18Å
18	W	47.9	Very low	67.2	Low	213 Å²	213	86 Å²	86	81%	0.807	47%	0.469	S	S	*	.	H	α-helix	trans	-77.6	-20.2	176	-85.4	41.2	0	0	0	113.9	V14 V15 C16 A20	V14-W18 WeakPolarHBondContact O-CB 3.17Å; V14-W18 PolarHBondContact O-N 2.85Å; V14-W18 VanDerWaalsContact O-N 3.11Å; V15-W18 PolarHBondContact O-N 3.37Å; C16-W18 VanDerWaalsContact C-N 3.33Å; W18-A20 VanDerWaalsContact C-N 3.32Å; W18-A20 PolarHBondContact O-N 2.77Å
19	S	50.7	Low	68.3	Low	91 Å²	91	86.5 Å²	86.5	64%	0.636	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	15	-178	-160.9	0	0	0	0	114.5	V15 C16 E21	V15-S19 PolarHBondContact O-N 3.23Å; V15-S19 VanDerWaalsContact O-N 3.16Å; C16-S19 PolarHBondContact O-N 2.68Å; S19-E21 PolarHBondContact O-N 2.87Å
20	A	53.1	Low	69.7	Low	70 Å²	70	81.9 Å²	81.9	58%	0.579	44%	0.438	S	S	*	.			trans	-72.3	82.9	162.4	0	0	0	0	0	108.1	W18 K22	W18-A20 VanDerWaalsContact C-N 3.32Å; W18-A20 PolarHBondContact O-N 2.77Å; A20-K22 PolarHBondContact O-N 3.38Å
21	E	58	Low	70.8	Confident	112 Å²	112	79 Å²	79	52%	0.523	42%	0.421	S	S	.	.			trans	-51.4	102.6	169	-83.6	-173.6	136.9	0	0	107.9	S19 Q23 R97	S19-E21 PolarHBondContact O-N 2.87Å; E21-Q23 PolarHBondContact O-N 3.19Å; E21-R97 VanDerWaalsContact CD-NH1 3.29Å; E21-R97 WeakPolarHBondContact OE1-CD 3.5Å; E21-R97 IonicContact OE1-CZ 2.65Å; E21-R97 IonicContact OE1-NE 3.64Å; E21-R97 IonicContact OE1-NH1 3.6Å; E21-R97 PolarHBondContact OE1-NH1 3.2Å; E21-R97 IonicContact OE2-CZ 3.54Å; E21-R97 VanDerWaalsContact OE2-CZ 3.3Å; E21-R97 IonicContact OE2-NE 3.47Å; E21-R97 IonicContact OE2-NH1 2.76Å; E21-R97 PolarHBondContact OE2-NH1 3.48Å
22	K	67.5	Low	72.3	Confident	151 Å²	151	75.5 Å²	75.5	66%	0.657	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	128.2	174.9	-77.9	-179.4	179.1	176	0	106.9	A20 D98	A20-K22 PolarHBondContact O-N 3.38Å; K22-D98 HydrophobicContact CB-CB 4.21Å; K22-D98 WeakPolarHBondContact O-CA 3.31Å; K22-D98 WeakPolarHBondContact O-CB 3.05Å; K22-D98 PolarHBondContact O-N 3.07Å
23	Q	78.4	Confident	73.9	Confident	120 Å²	120	72 Å²	72	56%	0.561	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.1	168.7	178.4	174.9	-28.2	0	0	107.4	E21 C95 Q96	E21-Q23 PolarHBondContact O-N 3.19Å; Q23-C95 HydrophobicContact CG-CB 3.94Å; Q23-Q96 WeakPolarHBondContact CA-O 3.38Å
24	S	82.6	Confident	75.5	Confident	15 Å²	15	67 Å²	67	11%	0.105	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.8	172.1	62.8	0	0	0	0	110.7	C95 Q96 D98 W103	S24-C95 WeakPolarHBondContact O-CA 3.47Å; S24-Q96 PolarHBondContact N-O 2.75Å; S24-Q96 PolarHBondContact O-N 3.25Å; S24-D98 WeakPolarHBondContact CB-OD2 3.07Å; S24-D98 PolarHBondContact N-OD2 3.08Å; S24-D98 PolarHBondContact OG-OD1 2.99Å; S24-D98 PolarHBondContact OG-OD2 2.86Å; S24-W103 PolarHBondContact O-NE1 2.89Å; S24-W103 PolarHBondContact OG-NE1 3.01Å; S24-W103 VanDerWaalsContact OG-NE1 3.07Å
25	C	86.3	Confident	77	Confident	36 Å²	36	64 Å²	64	24%	0.243	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	150.1	175.7	-57.1	0	0	0	0	110.2	G94 C95 F130	C25-G94 CarbonylContact C-O 3.58Å; C25-G94 VanDerWaalsContact CA-O 3.31Å; C25-G94 WeakPolarHBondContact CA-O 3.44Å; C25-C95 HydrophobicContact CB-CB 4.03Å; C25-C95 WeakPolarHBondContact CB-SG 3.36Å; C25-C95 WeakPolarHBondContact SG-CB 3.28Å; C25-C95 CovalentContact SG-SG 2.03Å; C25-C95 PolarHBondContact SG-SG 3.19Å; C25-F130 HydrophobicContact CB-CD2 3.8Å; C25-F130 HydrophobicContact CB-CE2 3.62Å; C25-F130 WeakPolarHBondContact O-CD2 3.29Å
26	R	89.1	Confident	78.4	Confident	36 Å²	36	61.6 Å²	61.6	14%	0.136	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.3	174.7	-60.1	-65.6	178.5	-120.5	0.6	108.9	S93 G94 W103 P105 G129 F130	R26-S93 CarbonylContact O-C 3.4Å; R26-S93 WeakPolarHBondContact O-CA 3.37Å; R26-S93 WeakPolarHBondContact O-CB 3.48Å; R26-G94 PolarHBondContact N-O 3.2Å; R26-G94 PolarHBondContact O-N 3.34Å; R26-W103 HydrophobicContact CB-CH2 4.21Å; R26-W103 HydrophobicContact CB-CZ2 3.89Å; R26-W103 HydrophobicContact CG-CH2 4.01Å; R26-W103 HydrophobicContact CG-CZ2 3.44Å; R26-W103 VanDerWaalsContact CG-CZ2 3.44Å; R26-P105 HydrophobicContact CG-CB 4.39Å; R26-P105 HydrophobicContact CG-CG 4.25Å; R26-G129 WeakPolarHBondContact CD-O 3.47Å; R26-G129 VanDerWaalsContact CZ-O 3.3Å; R26-G129 PolarHBondContact NE-O 2.85Å; R26-G129 PolarHBondContact NH1-O 2.91Å; R26-F130 CarbonylContact C-O 3.46Å; R26-F130 WeakPolarHBondContact CA-O 3.39Å
27	L	92.1	Very high	80	Confident	38 Å²	38	62.5 Å²	62.5	20%	0.199	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.7	170	-179.8	140.6	0	0	0	106.8	R29 V91 F130 D131 H132	L27-R29 HydrophobicContact CD2-CG 4.31Å; L27-V91 HydrophobicContact CD1-CG1 4.06Å; L27-V91 HydrophobicContact CD2-CG1 4.19Å; L27-V91 HydrophobicContact CG-CG1 4Å; L27-F130 HydrophobicContact CB-CE1 4.01Å; L27-F130 HydrophobicContact CB-CZ 4.02Å; L27-F130 PolarHBondContact N-O 2.85Å; L27-D131 WeakPolarHBondContact CD2-OD1 3.05Å; L27-D131 WeakPolarHBondContact O-CA 3.43Å; L27-H132 PolarHBondContact O-N 3Å
28	I	93.2	Very high	81.7	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.3	-176.3	-52.2	-176.9	0	0	0	107.9	L52 V91 V92 P105 V107 L125 H132 I134	I28-L52 HydrophobicContact CD1-CD1 3.64Å; I28-V91 CarbonylContact O-C 3.52Å; I28-V91 WeakPolarHBondContact O-CA 3.32Å; I28-V92 HydrophobicContact CB-CG1 4.02Å; I28-V92 PolarHBondContact N-O 3.44Å; I28-V92 PolarHBondContact O-N 2.81Å; I28-P105 HydrophobicContact CD1-CB 4.36Å; I28-V107 HydrophobicContact CD1-CG2 3.61Å; I28-V107 HydrophobicContact CG2-CG2 4.27Å; I28-L125 HydrophobicContact CD1-CD1 3.46Å; I28-L125 VanDerWaalsContact CD1-CD1 3.46Å; I28-H132 WeakPolarHBondContact CA-O 3.34Å; I28-I134 HydrophobicContact CG2-CD1 3.96Å; I28-I134 HydrophobicContact CG2-CG1 4.35Å
29	R	94.5	Very high	83.7	Confident	97 Å²	97	59.3 Å²	59.3	37%	0.366	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.4	179.4	50	-177.3	166.1	157.8	4.3	110.2	L27 F90 V91 D131 H132 E133 I134	L27-R29 HydrophobicContact CD2-CG 4.31Å; R29-F90 WeakPolarHBondContact CA-O 3.48Å; R29-V91 HydrophobicContact CB-CG2 4.04Å; R29-D131 IonicContact CZ-OD1 3.74Å; R29-D131 IonicContact CZ-OD2 2.92Å; R29-D131 VanDerWaalsContact CZ-OD2 3.31Å; R29-D131 IonicContact NE-OD1 3.3Å; R29-D131 PolarHBondContact NE-OD1 3.45Å; R29-D131 IonicContact NE-OD2 3.97Å; R29-D131 PolarHBondContact NE-OD2 2.88Å; R29-D131 IonicContact NH2-OD1 3.48Å; R29-D131 IonicContact NH2-OD2 2.86Å; R29-D131 PolarHBondContact NH2-OD2 3.31Å; R29-H132 PolarHBondContact N-O 3.38Å; R29-E133 HydrophobicContact CG-CB 4.01Å; R29-E133 HydrophobicContact CG-CG 4.22Å; R29-E133 CarbonylContact O-C 3.56Å; R29-E133 WeakPolarHBondContact O-CA 3.07Å; R29-I134 PolarHBondContact O-N 3.49Å
30	G	94.5	Very high	85.3	Confident	6 Å²	6	58.2 Å²	58.2	6%	0.062	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176	-173.6	-178.6	0	0	0	0	0	111.7	Y89 F90	G30-Y89 WeakPolarHBondContact O-CA 2.81Å; G30-F90 VanDerWaalsContact C-CE1 3.5Å; G30-F90 PolarHBondContact N-O 2.97Å; G30-F90 VanDerWaalsContact N-O 3.13Å; G30-F90 WeakPolarHBondContact O-CD1 3.41Å; G30-F90 PolarHBondContact O-N 3.09Å
31	R	94.7	Very high	86.8	Confident	46 Å²	46	60.6 Å²	60.6	17%	0.174	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	121.7	177.9	-161.9	-179.4	178	-124.6	-2.1	110.1	I33 N41 N87 G88 Y89 T137 I138	R31-I33 HydrophobicContact CG-CG2 4.33Å; R31-N41 PolarHBondContact NH2-O 2.64Å; R31-N87 PolarHBondContact NE-O 3.05Å; R31-N87 PolarHBondContact NH2-O 3.34Å; R31-G88 CarbonylContact C-O 3.59Å; R31-G88 WeakPolarHBondContact CA-O 3.23Å; R31-G88 VanDerWaalsContact CG-O 3.25Å; R31-G88 WeakPolarHBondContact CG-O 3.44Å; R31-Y89 HydrophobicContact CB-CD1 4.06Å; R31-Y89 HydrophobicContact CB-CE1 4.11Å; R31-Y89 HydrophobicContact CG-CD1 4.06Å; R31-Y89 HydrophobicContact CG-CD2 4.37Å; R31-Y89 HydrophobicContact CG-CE1 4.05Å; R31-Y89 HydrophobicContact CG-CE2 4.39Å; R31-Y89 HydrophobicContact CG-CG 4.24Å; R31-T137 HydrophobicContact CB-CG2 4.37Å; R31-T137 HydrophobicContact CG-CG2 4.16Å; R31-T137 CarbonylContact O-C 3.59Å; R31-T137 WeakPolarHBondContact O-CA 2.88Å; R31-I138 PolarHBondContact O-N 3.41Å
32	A	94.1	Very high	88.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.5	173.1	0	0	0	0	0	109.1	V84 G88 F90 I109 I138 L140	A32-V84 WeakPolarHBondContact O-CG1 3.43Å; A32-G88 PolarHBondContact N-O 3.34Å; A32-G88 CarbonylContact O-C 3.57Å; A32-G88 VanDerWaalsContact O-CA 3.31Å; A32-G88 WeakPolarHBondContact O-CA 3.49Å; A32-F90 HydrophobicContact CB-CD1 4.2Å; A32-F90 HydrophobicContact CB-CE1 3.93Å; A32-I109 HydrophobicContact CB-CD1 3.88Å; A32-I138 WeakPolarHBondContact CA-O 3.5Å; A32-I138 HydrophobicContact CB-CB 4.18Å; A32-I138 HydrophobicContact CB-CD1 4.33Å; A32-L140 HydrophobicContact CB-CD1 4.32Å; A32-L140 HydrophobicContact CB-CG 4.49Å
33	I	93.9	Very high	89.3	Confident	8 Å²	8	55 Å²	55	4%	0.041	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.6	-177.9	63.1	175.1	0	0	0	111.5	R31 P35 H43 T137 I138 L140	R31-I33 HydrophobicContact CG-CG2 4.33Å; I33-P35 HydrophobicContact CD1-CG 4.44Å; I33-P35 HydrophobicContact CG1-CG 4.4Å; I33-P35 WeakPolarHBondContact O-CD 3.33Å; I33-H43 HydrophobicContact CB-CB 4.37Å; I33-H43 HydrophobicContact CG2-CB 4.13Å; I33-T137 HydrophobicContact CD1-CG2 3.73Å; I33-T137 HydrophobicContact CG1-CG2 3.68Å; I33-T137 HydrophobicContact CG2-CG2 4.19Å; I33-I138 PolarHBondContact N-O 3.32Å; I33-L140 WeakPolarHBondContact O-CB 3.23Å; I33-L140 PolarHBondContact O-N 3.41Å
34	C	92.1	Very high	89.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.267	C	S	.	.			trans	-90.1	104.7	151.5	-79.4	0	0	0	0	108.8	D36 H43 D44 C113	C34-D36 PolarHBondContact O-N 3.33Å; C34-H43 PolarHBondContact N-ND1 2.88Å; C34-H43 VanDerWaalsContact N-ND1 3.2Å; C34-H43 CarbonylContact O-C 3.54Å; C34-H43 VanDerWaalsContact O-CA 3.31Å; C34-H43 WeakPolarHBondContact O-CA 3.31Å; C34-H43 PolarHBondContact O-ND1 2.66Å; C34-D44 VanDerWaalsContact CB-CG 3.5Å; C34-D44 WeakPolarHBondContact CB-OD1 3.37Å; C34-D44 WeakPolarHBondContact CB-OD2 3.31Å; C34-D44 PolarHBondContact O-N 3.12Å; C34-C113 WeakPolarHBondContact CA-SG 3.49Å; C34-C113 HydrophobicContact CB-CB 4.27Å; C34-C113 WeakPolarHBondContact CB-SG 3.44Å; C34-C113 VanDerWaalsContact SG-CA 3.6Å; C34-C113 WeakPolarHBondContact SG-CB 3.34Å; C34-C113 CovalentContact SG-SG 2.01Å; C34-C113 PolarHBondContact SG-SG 3.47Å
35	P	90.8	Very high	89.7	Confident	12 Å²	12	53.3 Å²	53.3	8%	0.078	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	131.1	-177	-20.1	30.5	0	0	0	111.4	I33 K42 N139 R141	I33-P35 HydrophobicContact CD1-CG 4.44Å; I33-P35 HydrophobicContact CG1-CG 4.4Å; I33-P35 WeakPolarHBondContact O-CD 3.33Å; P35-K42 CarbonylContact C-O 3.59Å; P35-K42 WeakPolarHBondContact CA-O 3.08Å; P35-N139 WeakPolarHBondContact CD-OD1 3.26Å; P35-N139 WeakPolarHBondContact CG-OD1 3.46Å; P35-R141 PolarHBondContact O-NH2 3.16Å
36	D	88.4	Confident	89.7	Confident	50 Å²	50	53.1 Å²	53.1	27%	0.267	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	133.4	171.1	-169	-51.1	0	0	0	109.4	C34 K38 D39 K42 D44	C34-D36 PolarHBondContact O-N 3.33Å; D36-K38 PolarHBondContact O-N 3.18Å; D36-K38 VanDerWaalsContact O-N 3.07Å; D36-K38 WeakPolarHBondContact OD1-CB 3.34Å; D36-K38 PolarHBondContact OD1-N 3.08Å; D36-D39 WeakPolarHBondContact CB-O 2.82Å; D36-D39 PolarHBondContact N-O 2.77Å; D36-D39 CarbonylContact O-C 3.24Å; D36-D39 VanDerWaalsContact O-C 3.24Å; D36-D39 PolarHBondContact O-N 2.93Å; D36-D39 VanDerWaalsContact O-N 3.09Å; D36-K42 HydrophobicContact CB-CB 4.27Å; D36-K42 PolarHBondContact N-O 2.99Å; D36-D44 HydrophobicContact CB-CB 4.3Å
37	P	85.6	Confident	89.6	Confident	105 Å²	105	56 Å²	56	68%	0.682	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-27.1	174.8	-24.9	32.1	0	0	0	114.5
38	K	88.7	Confident	89.6	Confident	201 Å²	201	54.3 Å²	54.3	87%	0.874	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-23.4	-179.7	-59.5	179.6	-178.3	179.6	0	113.3	D36	D36-K38 PolarHBondContact O-N 3.18Å; D36-K38 VanDerWaalsContact O-N 3.07Å; D36-K38 WeakPolarHBondContact OD1-CB 3.34Å; D36-K38 PolarHBondContact OD1-N 3.08Å
39	D	88.5	Confident	89.5	Confident	52 Å²	52	55.6 Å²	55.6	28%	0.278	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	102.5	-177.7	-176.2	-11.1	0	0	0	110.2	D36 N41 K42	D36-D39 WeakPolarHBondContact CB-O 2.82Å; D36-D39 PolarHBondContact N-O 2.77Å; D36-D39 CarbonylContact O-C 3.24Å; D36-D39 VanDerWaalsContact O-C 3.24Å; D36-D39 PolarHBondContact O-N 2.93Å; D36-D39 VanDerWaalsContact O-N 3.09Å; D39-N41 PolarHBondContact O-N 3.04Å; D39-N41 WeakPolarHBondContact OD1-CB 3.43Å; D39-N41 PolarHBondContact OD1-N 2.96Å; D39-K42 HydrophobicContact CB-CB 4.26Å; D39-K42 HydrophobicContact CB-CD 4.15Å; D39-K42 HydrophobicContact CB-CG 4.26Å; D39-K42 PolarHBondContact O-N 2.87Å; D39-K42 VanDerWaalsContact OD2-CD 3.29Å; D39-K42 WeakPolarHBondContact OD2-CD 3.33Å; D39-K42 WeakPolarHBondContact OD2-CE 3.4Å; D39-K42 WeakPolarHBondContact OD2-CG 3.03Å; D39-K42 IonicContact OD2-NZ 2.74Å
40	A	85.1	Confident	89.4	Confident	67 Å²	67	51 Å²	51	55%	0.554	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	-15.3	-175.7	0	0	0	0	0	114.1
41	N	85.4	Confident	89.3	Confident	120 Å²	120	51 Å²	51	64%	0.642	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	-13.8	178.4	-64.8	-40.5	0	0	0	113	R31 D39	R31-N41 PolarHBondContact NH2-O 2.64Å; D39-N41 PolarHBondContact O-N 3.04Å; D39-N41 WeakPolarHBondContact OD1-CB 3.43Å; D39-N41 PolarHBondContact OD1-N 2.96Å
42	K	88.3	Confident	89	Confident	125 Å²	125	48.8 Å²	48.8	54%	0.543	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.7	178.9	-73.4	-177.9	-175.5	171.7	0	111.5	P35 D36 D39	P35-K42 CarbonylContact C-O 3.59Å; P35-K42 WeakPolarHBondContact CA-O 3.08Å; D36-K42 HydrophobicContact CB-CB 4.27Å; D36-K42 PolarHBondContact N-O 2.99Å; D39-K42 HydrophobicContact CB-CB 4.26Å; D39-K42 HydrophobicContact CB-CD 4.15Å; D39-K42 HydrophobicContact CB-CG 4.26Å; D39-K42 PolarHBondContact O-N 2.87Å; D39-K42 VanDerWaalsContact OD2-CD 3.29Å; D39-K42 WeakPolarHBondContact OD2-CD 3.33Å; D39-K42 WeakPolarHBondContact OD2-CE 3.4Å; D39-K42 WeakPolarHBondContact OD2-CG 3.03Å; D39-K42 IonicContact OD2-NZ 2.74Å
43	H	88.2	Confident	88.7	Confident	20 Å²	20	49.9 Å²	49.9	9%	0.093	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	128.4	168.6	-178.6	32.2	0	0	0	109.1	I33 C34 G45 S46 K86	I33-H43 HydrophobicContact CB-CB 4.37Å; I33-H43 HydrophobicContact CG2-CB 4.13Å; C34-H43 PolarHBondContact N-ND1 2.88Å; C34-H43 VanDerWaalsContact N-ND1 3.2Å; C34-H43 CarbonylContact O-C 3.54Å; C34-H43 VanDerWaalsContact O-CA 3.31Å; C34-H43 WeakPolarHBondContact O-CA 3.31Å; C34-H43 PolarHBondContact O-ND1 2.66Å; H43-G45 PolarHBondContact O-N 3.34Å; H43-G45 VanDerWaalsContact O-N 3.08Å; H43-S46 PolarHBondContact CE1-O 3.25Å; H43-S46 PolarHBondContact NE2-O 2.65Å; H43-K86 WeakPolarHBondContact CB-O 3.43Å
44	D	87.6	Confident	88.1	Confident	49 Å²	49	49.8 Å²	49.8	26%	0.262	28%	0.283	S	S	.	.			trans	-67.8	-1.2	-179.6	67.5	6.5	0	0	0	114.9	C34 D36 S46 R141	C34-D44 VanDerWaalsContact CB-CG 3.5Å; C34-D44 WeakPolarHBondContact CB-OD1 3.37Å; C34-D44 WeakPolarHBondContact CB-OD2 3.31Å; C34-D44 PolarHBondContact O-N 3.12Å; D36-D44 HydrophobicContact CB-CB 4.3Å; D44-S46 VanDerWaalsContact CG-OG 3.26Å; D44-S46 WeakPolarHBondContact OD1-CB 3.32Å; D44-S46 PolarHBondContact OD1-N 3.42Å; D44-S46 PolarHBondContact OD1-OG 2.75Å; D44-S46 PolarHBondContact OD2-OG 2.91Å; D44-R141 IonicContact OD2-NH2 3.75Å; D44-R141 PolarHBondContact OD2-NH2 3.08Å; D44-R141 VanDerWaalsContact OD2-NH2 3.14Å
45	G	83.5	Confident	87.4	Confident	52 Å²	52	55.5 Å²	55.5	54%	0.536	31%	0.308	S	S	.	.			trans	84.2	7.3	-179.6	0	0	0	0	0	114.5	H43	H43-G45 PolarHBondContact O-N 3.34Å; H43-G45 VanDerWaalsContact O-N 3.08Å
46	S	86.3	Confident	86.3	Confident	32 Å²	32	57.8 Å²	57.8	22%	0.224	32%	0.319	C	S	.	.			trans	-58	141.4	172.2	-62.3	0	0	0	0	111.5	H43 D44 V48	H43-S46 PolarHBondContact CE1-O 3.25Å; H43-S46 PolarHBondContact NE2-O 2.65Å; D44-S46 VanDerWaalsContact CG-OG 3.26Å; D44-S46 WeakPolarHBondContact OD1-CB 3.32Å; D44-S46 PolarHBondContact OD1-N 3.42Å; D44-S46 PolarHBondContact OD1-OG 2.75Å; D44-S46 PolarHBondContact OD2-OG 2.91Å; S46-V48 PolarHBondContact O-N 2.79Å
47	V	86.3	Confident	84.6	Confident	95 Å²	95	56 Å²	56	58%	0.576	31%	0.312	S	S	*	.			trans	-67.4	123.1	174.9	-179.1	0	0	0	0	109.6	I49 F83	V47-I49 HydrophobicContact CG1-CG1 4.2Å; V47-F83 HydrophobicContact CG1-CD1 4.34Å; V47-F83 HydrophobicContact CG1-CE1 4.36Å
48	V	91.4	Very high	82.6	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.018	32%	0.316	C	S	.	.			trans	-125.9	129.8	173.7	-178.1	0	0	0	0	108.2	S46 V84 I109 L110 H111 L140	S46-V48 PolarHBondContact O-N 2.79Å; V48-V84 HydrophobicContact CB-CB 3.87Å; V48-V84 HydrophobicContact CB-CG2 3.53Å; V48-V84 HydrophobicContact CG1-CB 4.31Å; V48-V84 HydrophobicContact CG1-CG2 3.42Å; V48-V84 VanDerWaalsContact CG1-CG2 3.42Å; V48-V84 PolarHBondContact O-N 2.78Å; V48-I109 HydrophobicContact CG1-CG2 3.34Å; V48-L110 WeakPolarHBondContact CA-O 3.34Å; V48-H111 HydrophobicContact CG1-CB 4.38Å; V48-H111 HydrophobicContact CG2-CB 4.12Å; V48-L140 HydrophobicContact CB-CD1 4.36Å; V48-L140 HydrophobicContact CG1-CD1 3.76Å; V48-L140 HydrophobicContact CG2-CD1 3.61Å
49	I	91.3	Very high	80.4	Confident	28 Å²	28	53.1 Å²	53.1	14%	0.144	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	131.7	-179.1	-55	176.1	0	0	0	107.6	V47 Q51 E81 F83 L110 F150	V47-I49 HydrophobicContact CG1-CG1 4.2Å; I49-Q51 HydrophobicContact CG2-CG 4.49Å; I49-E81 HydrophobicContact CG2-CB 4.46Å; I49-F83 HydrophobicContact CD1-CE1 3.92Å; I49-F83 HydrophobicContact CG1-CD1 3.93Å; I49-F83 HydrophobicContact CG1-CE1 3.71Å; I49-L110 HydrophobicContact CB-CB 4.36Å; I49-L110 PolarHBondContact N-O 3.34Å; I49-L110 PolarHBondContact O-N 2.97Å; I49-F150 HydrophobicContact CD1-CE1 3.92Å; I49-F150 HydrophobicContact CD1-CZ 4.25Å
50	V	93.1	Very high	78.1	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.2	176.8	-175.8	0	0	0	0	107.7	E81 A82 V84 F90 V92 V107 I109	V50-E81 CarbonylContact O-C 3.58Å; V50-E81 WeakPolarHBondContact O-CA 3.25Å; V50-A82 PolarHBondContact N-O 2.92Å; V50-A82 PolarHBondContact O-N 2.63Å; V50-V84 HydrophobicContact CG2-CG2 3.75Å; V50-F90 HydrophobicContact CB-CD2 4.2Å; V50-F90 HydrophobicContact CB-CG 4.43Å; V50-F90 HydrophobicContact CG1-CD2 3.86Å; V50-F90 HydrophobicContact CG1-CE2 3.84Å; V50-F90 HydrophobicContact CG1-CZ 4.47Å; V50-F90 HydrophobicContact CG2-CB 4.02Å; V50-F90 HydrophobicContact CG2-CD1 3.97Å; V50-F90 HydrophobicContact CG2-CD2 3.91Å; V50-F90 HydrophobicContact CG2-CE1 4.38Å; V50-F90 HydrophobicContact CG2-CE2 4.33Å; V50-F90 HydrophobicContact CG2-CG 3.7Å; V50-V92 HydrophobicContact CG1-CG1 4.08Å; V50-V107 HydrophobicContact CG1-CG1 3.6Å; V50-I109 HydrophobicContact CG1-CG1 4.43Å; V50-I109 HydrophobicContact CG2-CG1 4.27Å
51	Q	91	Very high	76.1	Confident	5 Å²	5	53.2 Å²	53.2	2%	0.023	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.6	174.9	-54.6	-176	-35.3	0	0	109.5	I49 K53 E81 V107 H108 L110	I49-Q51 HydrophobicContact CG2-CG 4.49Å; Q51-K53 HydrophobicContact CB-CG 4.46Å; Q51-E81 HydrophobicContact CB-CG 4.47Å; Q51-E81 HydrophobicContact CG-CG 4Å; Q51-E81 PolarHBondContact NE2-OE1 2.84Å; Q51-V107 WeakPolarHBondContact O-CA 3.37Å; Q51-H108 HydrophobicContact CB-CB 4.23Å; Q51-H108 PolarHBondContact N-O 3.29Å; Q51-H108 PolarHBondContact O-N 3.3Å; Q51-L110 HydrophobicContact CG-CD1 3.87Å; Q51-L110 HydrophobicContact CG-CG 4.48Å
52	L	89.3	Confident	74.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.6	167.3	-179.5	57.5	0	0	0	108.7	I28 I79 D80 V92 W103 P105 V107	I28-L52 HydrophobicContact CD1-CD1 3.64Å; L52-I79 HydrophobicContact CG-CB 4.37Å; L52-I79 PolarHBondContact O-N 2.87Å; L52-D80 PolarHBondContact N-O 3Å; L52-D80 PolarHBondContact O-N 3.25Å; L52-V92 HydrophobicContact CB-CG1 4.15Å; L52-V92 HydrophobicContact CB-CG2 3.64Å; L52-V92 HydrophobicContact CD2-CG2 4.46Å; L52-W103 HydrophobicContact CD1-CH2 4.03Å; L52-W103 HydrophobicContact CD1-CZ3 4.35Å; L52-W103 HydrophobicContact CD2-CH2 4.07Å; L52-W103 HydrophobicContact CG-CH2 4.03Å; L52-P105 HydrophobicContact CD1-CB 4Å; L52-V107 HydrophobicContact CD1-CG2 4.1Å
53	K	87.3	Confident	72	Confident	24 Å²	24	50.2 Å²	50.2	10%	0.104	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	153.6	-178.8	-64.7	-161.3	170	-157.2	0	112.6	Q51 D77 W103 P105 E106	Q51-K53 HydrophobicContact CB-CG 4.46Å; K53-D77 CarbonylContact C-O 3.48Å; K53-D77 WeakPolarHBondContact CA-O 3.46Å; K53-D77 VanDerWaalsContact CB-O 3.31Å; K53-D77 WeakPolarHBondContact CB-O 3.16Å; K53-D77 IonicContact NZ-OD2 2.71Å; K53-D77 PolarHBondContact NZ-OD2 2.92Å; K53-W103 WeakPolarHBondContact O-CZ3 3.38Å; K53-P105 CarbonylContact O-C 3.53Å; K53-E106 PolarHBondContact N-O 2.93Å; K53-E106 PolarHBondContact O-N 2.83Å
54	S	81.4	Confident	70.1	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	124.1	166.6	-161.2	0	0	0	0	109.8	D56 G57 D77 Q96	S54-D56 PolarHBondContact O-N 3.01Å; S54-G57 PolarHBondContact O-N 3Å; S54-D77 PolarHBondContact N-O 3.13Å; S54-Q96 PolarHBondContact OG-NE2 3.42Å; S54-Q96 PolarHBondContact OG-OE1 2.87Å
55	K	78.5	Confident	68.1	Low	120 Å²	120	56.6 Å²	56.6	52%	0.522	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.7	173.3	-170.4	178.2	173.6	-171	0	111.9	G57 Q104	K55-G57 VanDerWaalsContact C-N 3.31Å; K55-G57 PolarHBondContact O-N 2.97Å; K55-Q104 HydrophobicContact CB-CB 3.96Å; K55-Q104 WeakPolarHBondContact CB-O 3.32Å; K55-Q104 HydrophobicContact CD-CB 4.14Å; K55-Q104 PolarHBondContact N-O 3.24Å
56	D	66.7	Low	66.5	Low	59 Å²	59	59.4 Å²	59.4	32%	0.316	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	11.2	-173.4	-54	-42.9	0	0	0	113.2	S54 N58 Q104	S54-D56 PolarHBondContact O-N 3.01Å; D56-N58 PolarHBondContact O-N 2.84Å; D56-Q104 PolarHBondContact OD2-N 3.35Å; D56-Q104 VanDerWaalsContact OD2-N 3.14Å
57	G	53.9	Low	64.6	Low	12 Å²	12	66.9 Å²	66.9	12%	0.124	37%	0.365	C	S	.	.			trans	-59.8	-8.6	179	0	0	0	0	0	115.3	S54 K55	S54-G57 PolarHBondContact O-N 3Å; K55-G57 VanDerWaalsContact C-N 3.31Å; K55-G57 PolarHBondContact O-N 2.97Å
58	N	43.1	Very low	62.3	Low	144 Å²	144	67.6 Å²	67.6	77%	0.77	36%	0.364	S	S	*	.	S	Bend	trans	-94.9	98.5	173.1	-79.8	-16.2	0	0	0	110.7	D56	D56-N58 PolarHBondContact O-N 2.84Å
59	L	42.2	Very low	60	Low	102 Å²	102	71 Å²	71	53%	0.534	39%	0.385	S	S	.	.			trans	40.9	94.6	158.2	-78.6	108.7	0	0	0	116.3	S61 H71	L59-S61 PolarHBondContact O-N 2.52Å; L59-H71 VanDerWaalsContact CD2-CE1 3.44Å; L59-H71 WeakPolarHBondContact CD2-CE1 3.31Å; L59-H71 WeakPolarHBondContact CD2-ND1 3.47Å
60	T	41.2	Very low	57.6	Low	71 Å²	71	72.1 Å²	72.1	44%	0.436	39%	0.393	S	S	.	.			trans	-75.7	85.5	146.6	38.4	0	0	0	0	107.9	L62	T60-L62 PolarHBondContact O-N 3.42Å
61	S	43.2	Very low	55	Low	50 Å²	50	77.9 Å²	77.9	35%	0.35	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	108.8	163.5	-175.5	0	0	0	0	107.3	L59 L63 T69	L59-S61 PolarHBondContact O-N 2.52Å; S61-L63 PolarHBondContact O-N 3.06Å; S61-T69 WeakPolarHBondContact OG-CG2 3.5Å
62	L	44.4	Very low	52.6	Low	46 Å²	46	79.8 Å²	79.8	24%	0.241	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	108.6	169.7	-79.4	155.4	0	0	0	108	T60 I64 T69 V70 V72 Y100	T60-L62 PolarHBondContact O-N 3.42Å; L62-I64 PolarHBondContact O-N 2.76Å; L62-T69 WeakPolarHBondContact O-CA 3.18Å; L62-V70 HydrophobicContact CB-CB 4.45Å; L62-V70 PolarHBondContact N-O 2.81Å; L62-V70 PolarHBondContact O-N 3.3Å; L62-V72 HydrophobicContact CD1-CG2 4.09Å; L62-Y100 HydrophobicContact CD1-CE2 3.66Å; L62-Y100 WeakPolarHBondContact CD1-OH 3.25Å; L62-Y100 HydrophobicContact CD2-CE1 4.43Å; L62-Y100 HydrophobicContact CD2-CE2 3.91Å; L62-Y100 HydrophobicContact CG-CE2 4.08Å
63	L	42.9	Very low	50.2	Low	136 Å²	136	84.9 Å²	84.9	71%	0.712	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	104.4	163	-80.8	157.1	0	0	0	107.9	S61 P65	S61-L63 PolarHBondContact O-N 3.06Å; L63-P65 WeakPolarHBondContact O-CD 3.25Å
64	I	48.1	Very low	48.1	Very low	93 Å²	93	87.2 Å²	87.2	48%	0.477	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	94.8	163.4	-51.7	176.7	0	0	0	106.8	L62 F67 L68 V70	L62-I64 PolarHBondContact O-N 2.76Å; I64-F67 PolarHBondContact O-N 2.91Å; I64-L68 PolarHBondContact N-O 2.94Å; I64-L68 PolarHBondContact O-N 3.49Å; I64-L68 VanDerWaalsContact O-N 3.14Å; I64-V70 HydrophobicContact CD1-CG2 4.34Å
65	P	45.6	Very low	46.5	Very low	110 Å²	110	92.4 Å²	92.4	71%	0.714	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	142	171.3	23.8	-30.2	0	0	0	110.3	L63	L63-P65 WeakPolarHBondContact O-CD 3.25Å
66	P	48.5	Very low	45.5	Very low	111 Å²	111	93.5 Å²	93.5	72%	0.721	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	cis	-100.6	-3.9	12.9	15.2	3.8	0	0	0	115.8
67	F	46.6	Very low	45.8	Very low	190 Å²	190	94.1 Å²	94.1	83%	0.833	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.4	-0.2	-163.8	-69	-73.5	0	0	0	117.7	I64	I64-F67 PolarHBondContact O-N 2.91Å
68	L	38.8	Very low	46.9	Very low	109 Å²	109	95.8 Å²	95.8	57%	0.571	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	106.4	-174.8	-145.9	76.8	0	0	0	112.5	I64 V70	I64-L68 PolarHBondContact N-O 2.94Å; I64-L68 PolarHBondContact O-N 3.49Å; I64-L68 VanDerWaalsContact O-N 3.14Å; L68-V70 HydrophobicContact CD2-CG2 3.58Å; L68-V70 HydrophobicContact CG-CG2 3.95Å; L68-V70 PolarHBondContact O-N 3.14Å
69	T	43.6	Very low	48.7	Very low	74 Å²	74	91 Å²	91	45%	0.454	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	100.6	162.7	-50.2	0	0	0	0	107.6	S61 L62 H71	S61-T69 WeakPolarHBondContact OG-CG2 3.5Å; L62-T69 WeakPolarHBondContact O-CA 3.18Å; T69-H71 PolarHBondContact O-N 2.8Å
70	V	40.6	Very low	50.9	Low	52 Å²	52	89.6 Å²	89.6	32%	0.315	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	107	175.3	-178.4	0	0	0	0	107.6	L62 I64 L68 V72	L62-V70 HydrophobicContact CB-CB 4.45Å; L62-V70 PolarHBondContact N-O 2.81Å; L62-V70 PolarHBondContact O-N 3.3Å; I64-V70 HydrophobicContact CD1-CG2 4.34Å; L68-V70 HydrophobicContact CD2-CG2 3.58Å; L68-V70 HydrophobicContact CG-CG2 3.95Å; L68-V70 PolarHBondContact O-N 3.14Å; V70-V72 HydrophobicContact CG1-CG2 4.31Å; V70-V72 PolarHBondContact O-N 2.78Å
71	H	37.4	Very low	53.2	Low	121 Å²	121	89.4 Å²	89.4	56%	0.56	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	101	168.4	-81.6	-91.4	0	0	0	108.5	L59 T69 S73	L59-H71 VanDerWaalsContact CD2-CE1 3.44Å; L59-H71 WeakPolarHBondContact CD2-CE1 3.31Å; L59-H71 WeakPolarHBondContact CD2-ND1 3.47Å; T69-H71 PolarHBondContact O-N 2.8Å; H71-S73 PolarHBondContact O-N 2.74Å
72	V	42	Very low	55.5	Low	45 Å²	45	87.7 Å²	87.7	27%	0.273	47%	0.468	S	S	.	.			trans	-74	113.8	168	-172.3	0	0	0	0	106.6	L62 V70 A74 I99	L62-V72 HydrophobicContact CD1-CG2 4.09Å; V70-V72 HydrophobicContact CG1-CG2 4.31Å; V70-V72 PolarHBondContact O-N 2.78Å; V72-A74 PolarHBondContact O-N 2.66Å; V72-I99 HydrophobicContact CG1-CD1 4.03Å
73	S	38.4	Very low	57.8	Low	107 Å²	107	92.5 Å²	92.5	75%	0.748	49%	0.487	S	S	*	.			trans	-47.6	127.9	-176.4	-65.1	0	0	0	0	111.2	H71 Y75	H71-S73 PolarHBondContact O-N 2.74Å; S73-Y75 PolarHBondContact O-N 2.87Å
74	A	42.5	Very low	60.2	Low	73 Å²	73	86.9 Å²	86.9	60%	0.603	46%	0.458	S	S	*	.			trans	-48.8	108.8	180	0	0	0	0	0	110.6	V72 R76	V72-A74 PolarHBondContact O-N 2.66Å; A74-R76 PolarHBondContact O-N 3.39Å
75	Y	48.2	Very low	62.3	Low	116 Å²	116	84.4 Å²	84.4	46%	0.455	45%	0.449	S	S	.	.			trans	-58.8	130.4	163.1	-97.8	-94.4	0	0	0	106.9	S73 D77	S73-Y75 PolarHBondContact O-N 2.87Å; Y75-D77 PolarHBondContact O-N 2.84Å; Y75-D77 VanDerWaalsContact O-N 3.09Å
76	R	57.7	Low	64.4	Low	142 Å²	142	88.4 Å²	88.4	54%	0.536	46%	0.455	S	S	.	.			trans	-45.8	124.3	174.9	-80.9	-170.9	179.9	175.1	4.4	108.2	A74 R78 C156	A74-R76 PolarHBondContact O-N 3.39Å; R76-R78 PolarHBondContact O-N 2.73Å; R76-C156 PolarHBondContact NH1-SG 3.33Å
77	D	73.5	Confident	66.4	Low	72 Å²	72	87.5 Å²	87.5	39%	0.385	44%	0.444	S	S	.	.	S	Bend	trans	-57	-32.1	178.2	63.3	-42.6	0	0	0	110.8	K53 S54 Y75	K53-D77 CarbonylContact C-O 3.48Å; K53-D77 WeakPolarHBondContact CA-O 3.46Å; K53-D77 VanDerWaalsContact CB-O 3.31Å; K53-D77 WeakPolarHBondContact CB-O 3.16Å; K53-D77 IonicContact NZ-OD2 2.71Å; K53-D77 PolarHBondContact NZ-OD2 2.92Å; S54-D77 PolarHBondContact N-O 3.13Å; Y75-D77 PolarHBondContact O-N 2.84Å; Y75-D77 VanDerWaalsContact O-N 3.09Å
78	R	75.6	Confident	68.5	Low	48 Å²	48	78.5 Å²	78.5	18%	0.181	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	116.2	173.5	-171.1	176.6	73.4	-177.5	-2	112	R76 E81	R76-R78 PolarHBondContact O-N 2.73Å; R78-E81 WeakPolarHBondContact CD-OE1 3.34Å; R78-E81 HydrophobicContact CG-CG 4.28Å; R78-E81 IonicContact CZ-OE1 3.76Å; R78-E81 IonicContact NE-OE1 2.83Å; R78-E81 VanDerWaalsContact NH1-CD 3.32Å; R78-E81 IonicContact NH1-OE1 3.04Å; R78-E81 PolarHBondContact NH1-OE1 2.91Å; R78-E81 IonicContact NH1-OE2 2.64Å; R78-E81 PolarHBondContact NH1-OE2 2.78Å
79	I	82.4	Confident	71.2	Confident	42 Å²	42	79.3 Å²	79.3	22%	0.215	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-54.5	178.4	-48.2	-137	0	0	0	110.5	L52 Q96 W103	L52-I79 HydrophobicContact CG-CB 4.37Å; L52-I79 PolarHBondContact O-N 2.87Å; I79-Q96 HydrophobicContact CD1-CB 3.8Å; I79-Q96 HydrophobicContact CD1-CG 4.32Å; I79-W103 HydrophobicContact CD1-CD2 4.24Å; I79-W103 HydrophobicContact CD1-CE3 3.87Å; I79-W103 HydrophobicContact CD1-CH2 3.6Å; I79-W103 HydrophobicContact CD1-CZ2 4Å; I79-W103 HydrophobicContact CD1-CZ3 3.5Å; I79-W103 HydrophobicContact CG1-CH2 4.4Å; I79-W103 HydrophobicContact CG1-CZ3 4.24Å
80	D	87.5	Confident	73.7	Confident	74 Å²	74	76 Å²	76	40%	0.396	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	167.4	-178.3	-159.5	12.6	0	0	0	111.8	L52 V92 S93	L52-D80 PolarHBondContact N-O 3Å; L52-D80 PolarHBondContact O-N 3.25Å; D80-V92 HydrophobicContact CB-CG2 4.23Å; D80-S93 WeakPolarHBondContact CB-O 3.48Å
81	E	90.1	Very high	76.3	Confident	67 Å²	67	77.7 Å²	77.7	31%	0.313	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	140.3	178.5	-55	-172.6	142.6	0	0	111.5	I49 V50 Q51 R78	I49-E81 HydrophobicContact CG2-CB 4.46Å; V50-E81 CarbonylContact O-C 3.58Å; V50-E81 WeakPolarHBondContact O-CA 3.25Å; Q51-E81 HydrophobicContact CB-CG 4.47Å; Q51-E81 HydrophobicContact CG-CG 4Å; Q51-E81 PolarHBondContact NE2-OE1 2.84Å; R78-E81 WeakPolarHBondContact CD-OE1 3.34Å; R78-E81 HydrophobicContact CG-CG 4.28Å; R78-E81 IonicContact CZ-OE1 3.76Å; R78-E81 IonicContact NE-OE1 2.83Å; R78-E81 VanDerWaalsContact NH1-CD 3.32Å; R78-E81 IonicContact NH1-OE1 3.04Å; R78-E81 PolarHBondContact NH1-OE1 2.91Å; R78-E81 IonicContact NH1-OE2 2.64Å; R78-E81 PolarHBondContact NH1-OE2 2.78Å
82	A	92.1	Very high	79	Confident	14 Å²	14	72 Å²	72	12%	0.116	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.5	174.6	0	0	0	0	0	111.2	V50 V91 V92	V50-A82 PolarHBondContact N-O 2.92Å; V50-A82 PolarHBondContact O-N 2.63Å; A82-V91 WeakPolarHBondContact CB-O 3.34Å; A82-V92 HydrophobicContact CB-CB 3.9Å; A82-V92 HydrophobicContact CB-CG2 4.18Å
83	F	92.1	Very high	81.3	Confident	146 Å²	146	72.3 Å²	72.3	64%	0.64	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	144.5	171.1	-67.4	-86.3	0	0	0	110.5	V47 I49	V47-F83 HydrophobicContact CG1-CD1 4.34Å; V47-F83 HydrophobicContact CG1-CE1 4.36Å; I49-F83 HydrophobicContact CD1-CE1 3.92Å; I49-F83 HydrophobicContact CG1-CD1 3.93Å; I49-F83 HydrophobicContact CG1-CE1 3.71Å
84	V	93.1	Very high	83.7	Confident	18 Å²	18	67.8 Å²	67.8	11%	0.109	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-75.3	135.5	169.5	-176.1	0	0	0	0	109.4	A32 V48 V50 G88 F90	A32-V84 WeakPolarHBondContact O-CG1 3.43Å; V48-V84 HydrophobicContact CB-CB 3.87Å; V48-V84 HydrophobicContact CB-CG2 3.53Å; V48-V84 HydrophobicContact CG1-CB 4.31Å; V48-V84 HydrophobicContact CG1-CG2 3.42Å; V48-V84 VanDerWaalsContact CG1-CG2 3.42Å; V48-V84 PolarHBondContact O-N 2.78Å; V50-V84 HydrophobicContact CG2-CG2 3.75Å; V84-G88 VanDerWaalsContact CG1-CA 3.42Å; V84-G88 WeakPolarHBondContact CG1-O 3.15Å; V84-F90 HydrophobicContact CG2-CB 4.14Å; V84-F90 HydrophobicContact CG2-CD1 4.28Å
85	S	92.2	Very high	85.7	Confident	42 Å²	42	67 Å²	67	29%	0.294	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-70.8	167.1	176.8	68.1	0	0	0	0	112.3	N87 G88 Y89	S85-N87 VanDerWaalsContact CB-OD1 3.28Å; S85-N87 WeakPolarHBondContact CB-OD1 3.44Å; S85-N87 PolarHBondContact O-N 3.31Å; S85-N87 PolarHBondContact OG-OD1 3.48Å; S85-G88 PolarHBondContact O-N 2.71Å; S85-Y89 WeakPolarHBondContact CB-O 3.43Å; S85-Y89 PolarHBondContact N-O 2.83Å; S85-Y89 PolarHBondContact OG-N 3.04Å; S85-Y89 PolarHBondContact OG-O 2.94Å
86	K	88.7	Confident	87.2	Confident	194 Å²	194	62.6 Å²	62.6	84%	0.843	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.2	177.5	-69.1	-172.9	179.3	-178.5	0	114.4	H43	H43-K86 WeakPolarHBondContact CB-O 3.43Å
87	N	90.5	Very high	88.1	Confident	92 Å²	92	60.9 Å²	60.9	49%	0.492	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	3.9	177	51.4	-20.3	0	0	0	113.6	R31 S85 Y89	R31-N87 PolarHBondContact NE-O 3.05Å; R31-N87 PolarHBondContact NH2-O 3.34Å; S85-N87 VanDerWaalsContact CB-OD1 3.28Å; S85-N87 WeakPolarHBondContact CB-OD1 3.44Å; S85-N87 PolarHBondContact O-N 3.31Å; S85-N87 PolarHBondContact OG-OD1 3.48Å; N87-Y89 HydrophobicContact CB-CD2 4.04Å; N87-Y89 HydrophobicContact CB-CE2 4.28Å; N87-Y89 WeakPolarHBondContact ND2-CD2 3.36Å
88	G	92.8	Very high	88	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	91	4	175.4	0	0	0	0	0	114.9	R31 A32 V84 S85	R31-G88 CarbonylContact C-O 3.59Å; R31-G88 WeakPolarHBondContact CA-O 3.23Å; R31-G88 VanDerWaalsContact CG-O 3.25Å; R31-G88 WeakPolarHBondContact CG-O 3.44Å; A32-G88 PolarHBondContact N-O 3.34Å; A32-G88 CarbonylContact O-C 3.57Å; A32-G88 VanDerWaalsContact O-CA 3.31Å; A32-G88 WeakPolarHBondContact O-CA 3.49Å; V84-G88 VanDerWaalsContact CG1-CA 3.42Å; V84-G88 WeakPolarHBondContact CG1-O 3.15Å; S85-G88 PolarHBondContact O-N 2.71Å
89	Y	95	Very high	87.6	Confident	126 Å²	126	59.8 Å²	59.8	49%	0.494	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	147.3	-176.8	-68.4	-88.5	0	0	0	110.9	G30 R31 S85 N87	G30-Y89 WeakPolarHBondContact O-CA 2.81Å; R31-Y89 HydrophobicContact CB-CD1 4.06Å; R31-Y89 HydrophobicContact CB-CE1 4.11Å; R31-Y89 HydrophobicContact CG-CD1 4.06Å; R31-Y89 HydrophobicContact CG-CD2 4.37Å; R31-Y89 HydrophobicContact CG-CE1 4.05Å; R31-Y89 HydrophobicContact CG-CE2 4.39Å; R31-Y89 HydrophobicContact CG-CG 4.24Å; S85-Y89 WeakPolarHBondContact CB-O 3.43Å; S85-Y89 PolarHBondContact N-O 2.83Å; S85-Y89 PolarHBondContact OG-N 3.04Å; S85-Y89 PolarHBondContact OG-O 2.94Å; N87-Y89 HydrophobicContact CB-CD2 4.04Å; N87-Y89 HydrophobicContact CB-CE2 4.28Å; N87-Y89 WeakPolarHBondContact ND2-CD2 3.36Å
90	F	95.2	Very high	86.7	Confident	6 Å²	6	64.9 Å²	64.9	3%	0.026	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	153.9	172.8	64.7	-92	0	0	0	110.5	R29 G30 A32 V50 V84 I109 I134 I138	R29-F90 WeakPolarHBondContact CA-O 3.48Å; G30-F90 VanDerWaalsContact C-CE1 3.5Å; G30-F90 PolarHBondContact N-O 2.97Å; G30-F90 VanDerWaalsContact N-O 3.13Å; G30-F90 WeakPolarHBondContact O-CD1 3.41Å; G30-F90 PolarHBondContact O-N 3.09Å; A32-F90 HydrophobicContact CB-CD1 4.2Å; A32-F90 HydrophobicContact CB-CE1 3.93Å; V50-F90 HydrophobicContact CB-CD2 4.2Å; V50-F90 HydrophobicContact CB-CG 4.43Å; V50-F90 HydrophobicContact CG1-CD2 3.86Å; V50-F90 HydrophobicContact CG1-CE2 3.84Å; V50-F90 HydrophobicContact CG1-CZ 4.47Å; V50-F90 HydrophobicContact CG2-CB 4.02Å; V50-F90 HydrophobicContact CG2-CD1 3.97Å; V50-F90 HydrophobicContact CG2-CD2 3.91Å; V50-F90 HydrophobicContact CG2-CE1 4.38Å; V50-F90 HydrophobicContact CG2-CE2 4.33Å; V50-F90 HydrophobicContact CG2-CG 3.7Å; V84-F90 HydrophobicContact CG2-CB 4.14Å; V84-F90 HydrophobicContact CG2-CD1 4.28Å; F90-I109 HydrophobicContact CE1-CD1 4.39Å; F90-I109 HydrophobicContact CZ-CD1 4.47Å; F90-I134 HydrophobicContact CE2-CD1 4.37Å; F90-I134 HydrophobicContact CZ-CD1 3.86Å; F90-I138 HydrophobicContact CE1-CD1 4.29Å; F90-I138 HydrophobicContact CZ-CD1 4.43Å
91	V	95.1	Very high	85.9	Confident	87 Å²	87	66.1 Å²	66.1	53%	0.527	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	123.7	168.3	-175.3	0	0	0	0	106.2	L27 I28 R29 A82	L27-V91 HydrophobicContact CD1-CG1 4.06Å; L27-V91 HydrophobicContact CD2-CG1 4.19Å; L27-V91 HydrophobicContact CG-CG1 4Å; I28-V91 CarbonylContact O-C 3.52Å; I28-V91 WeakPolarHBondContact O-CA 3.32Å; R29-V91 HydrophobicContact CB-CG2 4.04Å; A82-V91 WeakPolarHBondContact CB-O 3.34Å
92	V	93.7	Very high	85.1	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.012	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.4	173.7	65.9	0	0	0	0	107.9	I28 V50 L52 D80 A82	I28-V92 HydrophobicContact CB-CG1 4.02Å; I28-V92 PolarHBondContact N-O 3.44Å; I28-V92 PolarHBondContact O-N 2.81Å; V50-V92 HydrophobicContact CG1-CG1 4.08Å; L52-V92 HydrophobicContact CB-CG1 4.15Å; L52-V92 HydrophobicContact CB-CG2 3.64Å; L52-V92 HydrophobicContact CD2-CG2 4.46Å; D80-V92 HydrophobicContact CB-CG2 4.23Å; A82-V92 HydrophobicContact CB-CB 3.9Å; A82-V92 HydrophobicContact CB-CG2 4.18Å
93	S	91.7	Very high	84.5	Confident	51 Å²	51	66.4 Å²	66.4	36%	0.357	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	158.2	177.8	63.9	0	0	0	0	110.4	R26 D80	R26-S93 CarbonylContact O-C 3.4Å; R26-S93 WeakPolarHBondContact O-CA 3.37Å; R26-S93 WeakPolarHBondContact O-CB 3.48Å; D80-S93 WeakPolarHBondContact CB-O 3.48Å
94	G	87.5	Confident	84	Confident	11 Å²	11	63.4 Å²	63.4	11%	0.113	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	153.6	-178.5	0	0	0	0	0	111.2	C25 R26	C25-G94 CarbonylContact C-O 3.58Å; C25-G94 VanDerWaalsContact CA-O 3.31Å; C25-G94 WeakPolarHBondContact CA-O 3.44Å; R26-G94 PolarHBondContact N-O 3.2Å; R26-G94 PolarHBondContact O-N 3.34Å
95	C	84.8	Confident	83.7	Confident	57 Å²	57	63.1 Å²	63.1	39%	0.385	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.5	178.2	-52.6	0	0	0	0	110.1	Q23 S24 C25	Q23-C95 HydrophobicContact CG-CB 3.94Å; S24-C95 WeakPolarHBondContact O-CA 3.47Å; C25-C95 HydrophobicContact CB-CB 4.03Å; C25-C95 WeakPolarHBondContact CB-SG 3.36Å; C25-C95 WeakPolarHBondContact SG-CB 3.28Å; C25-C95 CovalentContact SG-SG 2.03Å; C25-C95 PolarHBondContact SG-SG 3.19Å
96	Q	80.5	Confident	83.6	Confident	24 Å²	24	62 Å²	62	11%	0.112	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.8	172.4	-166	171.8	-11.1	0	0	109.6	Q23 S24 S54 I79 W103	Q23-Q96 WeakPolarHBondContact CA-O 3.38Å; S24-Q96 PolarHBondContact N-O 2.75Å; S24-Q96 PolarHBondContact O-N 3.25Å; S54-Q96 PolarHBondContact OG-NE2 3.42Å; S54-Q96 PolarHBondContact OG-OE1 2.87Å; I79-Q96 HydrophobicContact CD1-CB 3.8Å; I79-Q96 HydrophobicContact CD1-CG 4.32Å; Q96-W103 HydrophobicContact CB-CD2 4.06Å; Q96-W103 HydrophobicContact CB-CG 3.87Å; Q96-W103 HydrophobicContact CG-CG 4.46Å
97	R	76.1	Confident	83.7	Confident	106 Å²	106	52.7 Å²	52.7	40%	0.4	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	127.9	171.4	-68	-172.9	-174	177.4	3.3	109.8	E21 I99	E21-R97 VanDerWaalsContact CD-NH1 3.29Å; E21-R97 WeakPolarHBondContact OE1-CD 3.5Å; E21-R97 IonicContact OE1-CZ 2.65Å; E21-R97 IonicContact OE1-NE 3.64Å; E21-R97 IonicContact OE1-NH1 3.6Å; E21-R97 PolarHBondContact OE1-NH1 3.2Å; E21-R97 IonicContact OE2-CZ 3.54Å; E21-R97 VanDerWaalsContact OE2-CZ 3.3Å; E21-R97 IonicContact OE2-NE 3.47Å; E21-R97 IonicContact OE2-NH1 2.76Å; E21-R97 PolarHBondContact OE2-NH1 3.48Å; R97-I99 PolarHBondContact O-N 2.88Å
98	D	70.9	Confident	83.7	Confident	23 Å²	23	48.8 Å²	48.8	12%	0.123	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	96.5	170.5	-57.9	-38.1	0	0	0	107.9	K22 S24 P102 W103	K22-D98 HydrophobicContact CB-CB 4.21Å; K22-D98 WeakPolarHBondContact O-CA 3.31Å; K22-D98 WeakPolarHBondContact O-CB 3.05Å; K22-D98 PolarHBondContact O-N 3.07Å; S24-D98 WeakPolarHBondContact CB-OD2 3.07Å; S24-D98 PolarHBondContact N-OD2 3.08Å; S24-D98 PolarHBondContact OG-OD1 2.99Å; S24-D98 PolarHBondContact OG-OD2 2.86Å; D98-P102 WeakPolarHBondContact OD1-CA 3.41Å; D98-W103 VanDerWaalsContact OD1-CD1 3.28Å; D98-W103 PolarHBondContact OD1-N 2.85Å; D98-W103 VanDerWaalsContact OD1-N 3.08Å
99	I	67.1	Low	83.8	Confident	73 Å²	73	48.8 Å²	48.8	37%	0.374	24%	0.244	S	C	.	.	S	Bend	trans	-75.6	-39.4	-179.1	-49.4	179.3	0	0	0	110.4	V72 R97	V72-I99 HydrophobicContact CG1-CD1 4.03Å; R97-I99 PolarHBondContact O-N 2.88Å
100	Y	63.3	Low	83.6	Confident	149 Å²	149	42.9 Å²	42.9	58%	0.584	22%	0.221	S	C	*	.	S	Bend	trans	-138.9	-39.2	-178.3	-63.1	-71.8	0	0	0	113.7	L62	L62-Y100 HydrophobicContact CD1-CE2 3.66Å; L62-Y100 WeakPolarHBondContact CD1-OH 3.25Å; L62-Y100 HydrophobicContact CD2-CE1 4.43Å; L62-Y100 HydrophobicContact CD2-CE2 3.91Å; L62-Y100 HydrophobicContact CG-CE2 4.08Å
101	Q	70.8	Confident	83.5	Confident	101 Å²	101	42.6 Å²	42.6	47%	0.472	22%	0.219	S	C	.	.	S	Bend	trans	-127.8	146.2	179.3	143	174.5	-14.9	0	0	108.1	W103	Q101-W103 PolarHBondContact O-N 2.77Å
102	P	74.7	Confident	83.2	Confident	80 Å²	80	40.6 Å²	40.6	52%	0.519	21%	0.207	S	C	.	.			trans	-53.3	125.3	166.3	-22.3	32	0	0	0	110.3	D98	D98-P102 WeakPolarHBondContact OD1-CA 3.41Å
103	W	79.6	Confident	82.8	Confident	7 Å²	7	41.2 Å²	41.2	3%	0.027	21%	0.212	C	C	.	.			trans	-61.1	142.4	177.7	70.8	-80	0	0	0	111	S24 R26 L52 K53 I79 Q96 D98 Q101 P105	S24-W103 PolarHBondContact O-NE1 2.89Å; S24-W103 PolarHBondContact OG-NE1 3.01Å; S24-W103 VanDerWaalsContact OG-NE1 3.07Å; R26-W103 HydrophobicContact CB-CH2 4.21Å; R26-W103 HydrophobicContact CB-CZ2 3.89Å; R26-W103 HydrophobicContact CG-CH2 4.01Å; R26-W103 HydrophobicContact CG-CZ2 3.44Å; R26-W103 VanDerWaalsContact CG-CZ2 3.44Å; L52-W103 HydrophobicContact CD1-CH2 4.03Å; L52-W103 HydrophobicContact CD1-CZ3 4.35Å; L52-W103 HydrophobicContact CD2-CH2 4.07Å; L52-W103 HydrophobicContact CG-CH2 4.03Å; K53-W103 WeakPolarHBondContact O-CZ3 3.38Å; I79-W103 HydrophobicContact CD1-CD2 4.24Å; I79-W103 HydrophobicContact CD1-CE3 3.87Å; I79-W103 HydrophobicContact CD1-CH2 3.6Å; I79-W103 HydrophobicContact CD1-CZ2 4Å; I79-W103 HydrophobicContact CD1-CZ3 3.5Å; I79-W103 HydrophobicContact CG1-CH2 4.4Å; I79-W103 HydrophobicContact CG1-CZ3 4.24Å; Q96-W103 HydrophobicContact CB-CD2 4.06Å; Q96-W103 HydrophobicContact CB-CG 3.87Å; Q96-W103 HydrophobicContact CG-CG 4.46Å; D98-W103 VanDerWaalsContact OD1-CD1 3.28Å; D98-W103 PolarHBondContact OD1-N 2.85Å; D98-W103 VanDerWaalsContact OD1-N 3.08Å; Q101-W103 PolarHBondContact O-N 2.77Å; W103-P105 HydrophobicContact CE3-CB 4.13Å; W103-P105 HydrophobicContact CH2-CB 3.71Å; W103-P105 HydrophobicContact CZ3-CB 3.49Å; W103-P105 VanDerWaalsContact CZ3-CB 3.49Å; W103-P105 WeakPolarHBondContact O-CD 3.05Å
104	Q	81.8	Confident	82.4	Confident	82 Å²	82	42.5 Å²	42.5	38%	0.383	21%	0.211	S	C	.	.			trans	-90.2	116	175.3	-69.9	-177.3	23.8	0	0	110.5	K55 D56	K55-Q104 HydrophobicContact CB-CB 3.96Å; K55-Q104 WeakPolarHBondContact CB-O 3.32Å; K55-Q104 HydrophobicContact CD-CB 4.14Å; K55-Q104 PolarHBondContact N-O 3.24Å; D56-Q104 PolarHBondContact OD2-N 3.35Å; D56-Q104 VanDerWaalsContact OD2-N 3.14Å
105	P	86.4	Confident	81.8	Confident	12 Å²	12	45.5 Å²	45.5	8%	0.078	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	142.2	176.8	30.6	-35.5	0	0	0	111.8	R26 I28 L52 K53 W103 V127	R26-P105 HydrophobicContact CG-CB 4.39Å; R26-P105 HydrophobicContact CG-CG 4.25Å; I28-P105 HydrophobicContact CD1-CB 4.36Å; L52-P105 HydrophobicContact CD1-CB 4Å; K53-P105 CarbonylContact O-C 3.53Å; W103-P105 HydrophobicContact CE3-CB 4.13Å; W103-P105 HydrophobicContact CH2-CB 3.71Å; W103-P105 HydrophobicContact CZ3-CB 3.49Å; W103-P105 VanDerWaalsContact CZ3-CB 3.49Å; W103-P105 WeakPolarHBondContact O-CD 3.05Å; P105-V127 HydrophobicContact CG-CB 3.93Å; P105-V127 HydrophobicContact CG-CG2 3.52Å
106	E	88.5	Confident	81.4	Confident	18 Å²	18	52.1 Å²	52.1	8%	0.084	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.7	175.7	-161.5	178.5	131	0	0	108.6	K53 H108 K122	K53-E106 PolarHBondContact N-O 2.93Å; K53-E106 PolarHBondContact O-N 2.83Å; E106-H108 IonicContact OE1-CD2 3.72Å; E106-H108 IonicContact OE1-CE1 3.28Å; E106-H108 IonicContact OE1-NE2 3.48Å; E106-H108 PolarHBondContact OE1-NE2 3.26Å; E106-K122 HydrophobicContact CG-CG 4.33Å; E106-K122 WeakPolarHBondContact OE1-CD 3.35Å; E106-K122 WeakPolarHBondContact OE1-CE 3.43Å; E106-K122 WeakPolarHBondContact OE1-CG 3.02Å; E106-K122 IonicContact OE1-NZ 3.5Å; E106-K122 PolarHBondContact OE1-NZ 3.28Å; E106-K122 IonicContact OE2-NZ 3.16Å; E106-K122 PolarHBondContact OE2-NZ 2.86Å
107	V	91.2	Very high	81.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.4	180	163.7	0	0	0	0	110.2	I28 V50 Q51 L52 I109 L123 L125	I28-V107 HydrophobicContact CD1-CG2 3.61Å; I28-V107 HydrophobicContact CG2-CG2 4.27Å; V50-V107 HydrophobicContact CG1-CG1 3.6Å; Q51-V107 WeakPolarHBondContact O-CA 3.37Å; L52-V107 HydrophobicContact CD1-CG2 4.1Å; V107-I109 HydrophobicContact CG1-CG1 4.06Å; V107-L123 HydrophobicContact CB-CB 4.38Å; V107-L123 HydrophobicContact CG1-CD1 4.1Å; V107-L123 PolarHBondContact O-N 2.92Å; V107-L125 HydrophobicContact CB-CD1 3.63Å; V107-L125 HydrophobicContact CB-CG 4.48Å; V107-L125 HydrophobicContact CG2-CD1 3.34Å
108	H	92	Very high	81.9	Confident	10 Å²	10	56 Å²	56	5%	0.046	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.7	178.6	-70.6	-146.3	0	0	0	107.7	Q51 E106 R120 V121	Q51-H108 HydrophobicContact CB-CB 4.23Å; Q51-H108 PolarHBondContact N-O 3.29Å; Q51-H108 PolarHBondContact O-N 3.3Å; E106-H108 IonicContact OE1-CD2 3.72Å; E106-H108 IonicContact OE1-CE1 3.28Å; E106-H108 IonicContact OE1-NE2 3.48Å; E106-H108 PolarHBondContact OE1-NE2 3.26Å; H108-R120 HydrophobicContact CB-CG 4.25Å; H108-R120 VanDerWaalsContact ND1-CD 3.34Å; H108-R120 WeakPolarHBondContact ND1-CD 3.1Å; H108-V121 CarbonylContact C-O 3.54Å; H108-V121 WeakPolarHBondContact CA-O 3.5Å
109	I	93.3	Very high	82.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.7	175.4	-55.1	-174.8	0	0	0	108.6	A32 V48 V50 F90 V107 R120 V121 L123 I138 L140	A32-I109 HydrophobicContact CB-CD1 3.88Å; V48-I109 HydrophobicContact CG1-CG2 3.34Å; V50-I109 HydrophobicContact CG1-CG1 4.43Å; V50-I109 HydrophobicContact CG2-CG1 4.27Å; F90-I109 HydrophobicContact CE1-CD1 4.39Å; F90-I109 HydrophobicContact CZ-CD1 4.47Å; V107-I109 HydrophobicContact CG1-CG1 4.06Å; I109-R120 CarbonylContact O-C 3.55Å; I109-R120 VanDerWaalsContact O-CA 3.31Å; I109-R120 WeakPolarHBondContact O-CA 3.14Å; I109-V121 HydrophobicContact CB-CB 4.32Å; I109-V121 PolarHBondContact N-O 3.06Å; I109-V121 PolarHBondContact O-N 3.38Å; I109-L123 HydrophobicContact CD1-CD1 3.52Å; I109-L123 HydrophobicContact CD1-CG 4.4Å; I109-L123 HydrophobicContact CG1-CD1 4.05Å; I109-I138 HydrophobicContact CD1-CD1 3.86Å; I109-L140 HydrophobicContact CB-CD2 4.46Å; I109-L140 HydrophobicContact CG2-CD1 4.3Å; I109-L140 HydrophobicContact CG2-CD2 3.84Å
110	L	92.1	Very high	84	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.2	179.2	-55.8	176.3	0	0	0	110.1	V48 I49 Q51 R119 R120 H148 F150	V48-L110 WeakPolarHBondContact CA-O 3.34Å; I49-L110 HydrophobicContact CB-CB 4.36Å; I49-L110 PolarHBondContact N-O 3.34Å; I49-L110 PolarHBondContact O-N 2.97Å; Q51-L110 HydrophobicContact CG-CD1 3.87Å; Q51-L110 HydrophobicContact CG-CG 4.48Å; L110-R119 WeakPolarHBondContact CA-O 3.4Å; L110-R120 HydrophobicContact CD2-CB 3.56Å; L110-R120 HydrophobicContact CD2-CG 3.56Å; L110-H148 HydrophobicContact CD2-CB 4.44Å; L110-H148 VanDerWaalsContact CD2-CD2 3.48Å; L110-H148 WeakPolarHBondContact CD2-CD2 3.29Å; L110-F150 HydrophobicContact CB-CD1 4.13Å; L110-F150 HydrophobicContact CB-CE1 3.15Å; L110-F150 HydrophobicContact CB-CZ 3.56Å; L110-F150 HydrophobicContact CD1-CD1 3.46Å; L110-F150 VanDerWaalsContact CD1-CD1 3.46Å; L110-F150 HydrophobicContact CD1-CE1 3.29Å; L110-F150 HydrophobicContact CD1-CZ 4.46Å; L110-F150 HydrophobicContact CD2-CE1 4.45Å; L110-F150 HydrophobicContact CG-CD1 4.31Å; L110-F150 HydrophobicContact CG-CE1 3.76Å
111	H	91.8	Very high	85.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	168.8	-172.9	67.3	96.7	0	0	0	112.7	V48 C113 R119 V121 L140 D145	V48-H111 HydrophobicContact CG1-CB 4.38Å; V48-H111 HydrophobicContact CG2-CB 4.12Å; H111-C113 VanDerWaalsContact ND1-CB 3.25Å; H111-C113 WeakPolarHBondContact ND1-CB 3.17Å; H111-C113 PolarHBondContact ND1-N 3Å; H111-R119 PolarHBondContact N-O 3.5Å; H111-R119 PolarHBondContact O-N 3.38Å; H111-V121 WeakPolarHBondContact NE2-CG2 3.11Å; H111-L140 HydrophobicContact CB-CD1 3.94Å; H111-L140 PolarHBondContact CE1-O 2.85Å; H111-D145 IonicContact CE1-OD2 3.59Å; H111-D145 PolarHBondContact CE1-OD2 3.46Å; H111-D145 IonicContact NE2-OD2 3.5Å
112	T	88.4	Confident	86.3	Confident	45 Å²	45	49 Å²	49	28%	0.276	24%	0.236	S	C	.	.			trans	-118.7	9.4	175.8	53.6	0	0	0	0	113.6	K114 K116 Q117	T112-K114 PolarHBondContact O-N 3.41Å; T112-K116 VanDerWaalsContact O-CA 3.32Å; T112-K116 WeakPolarHBondContact O-CA 3.44Å; T112-K116 PolarHBondContact O-N 2.03Å; T112-K116 VanDerWaalsContact O-N 3.09Å; T112-Q117 WeakPolarHBondContact CA-O 3.31Å
113	C	86.1	Confident	86.9	Confident	15 Å²	15	46.4 Å²	46.4	10%	0.101	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-50.4	-169.1	-140.8	0	0	0	0	117.5	C34 H111 L140 R141	C34-C113 WeakPolarHBondContact CA-SG 3.49Å; C34-C113 HydrophobicContact CB-CB 4.27Å; C34-C113 WeakPolarHBondContact CB-SG 3.44Å; C34-C113 VanDerWaalsContact SG-CA 3.6Å; C34-C113 WeakPolarHBondContact SG-CB 3.34Å; C34-C113 CovalentContact SG-SG 2.01Å; C34-C113 PolarHBondContact SG-SG 3.47Å; H111-C113 VanDerWaalsContact ND1-CB 3.25Å; H111-C113 WeakPolarHBondContact ND1-CB 3.17Å; H111-C113 PolarHBondContact ND1-N 3Å; C113-L140 HydrophobicContact CB-CB 4.08Å; C113-R141 HydrophobicContact CB-CG 4.32Å; C113-R141 VanDerWaalsContact SG-CG 3.51Å
114	K	82.7	Confident	86.7	Confident	78 Å²	78	51.8 Å²	51.8	34%	0.339	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-43.2	-168.3	-71	-172.4	-167.5	168.7	0	113.6	T112 L140 R141 V143 D145	T112-K114 PolarHBondContact O-N 3.41Å; K114-L140 WeakPolarHBondContact CE-O 3.19Å; K114-R141 WeakPolarHBondContact CE-O 3.25Å; K114-V143 VanDerWaalsContact CE-O 3.3Å; K114-V143 WeakPolarHBondContact CE-O 3.35Å; K114-V143 PolarHBondContact NZ-O 2.71Å; K114-D145 VanDerWaalsContact CD-OD2 3.28Å; K114-D145 WeakPolarHBondContact CD-OD2 3.23Å; K114-D145 VanDerWaalsContact CE-OD2 3.26Å; K114-D145 WeakPolarHBondContact CE-OD2 3.14Å; K114-D145 IonicContact NZ-OD1 2.81Å; K114-D145 PolarHBondContact NZ-OD1 2.99Å; K114-D145 IonicContact NZ-OD2 3.33Å; K114-D145 PolarHBondContact NZ-OD2 3.48Å
115	T	74.6	Confident	86.5	Confident	73 Å²	73	49.2 Å²	49.2	45%	0.448	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.5	11.2	-163.9	48.6	0	0	0	0	113.1	Q117	T115-Q117 PolarHBondContact O-N 3.05Å
116	K	77.5	Confident	85.8	Confident	197 Å²	197	55.2 Å²	55.2	86%	0.857	28%	0.278	S	S	*	.	S	Bend	trans	56.4	-2.3	-166.5	-59.9	-176.3	177.7	-179.1	0	114.4	T112	T112-K116 VanDerWaalsContact O-CA 3.32Å; T112-K116 WeakPolarHBondContact O-CA 3.44Å; T112-K116 PolarHBondContact O-N 2.03Å; T112-K116 VanDerWaalsContact O-N 3.09Å
117	Q	81.6	Confident	85	Confident	122 Å²	122	55.7 Å²	55.7	57%	0.57	28%	0.282	S	S	*	.	S	Bend	trans	-89.4	151.9	173.5	-64.5	-177.3	-4.3	0	0	110.3	T112 T115 R119	T112-Q117 WeakPolarHBondContact CA-O 3.31Å; T115-Q117 PolarHBondContact O-N 3.05Å; Q117-R119 WeakPolarHBondContact O-CG 3.14Å; Q117-R119 PolarHBondContact O-N 3.14Å
118	K	85.7	Confident	83.9	Confident	88 Å²	88	61.4 Å²	61.4	38%	0.383	32%	0.323	S	S	.	.			trans	-68.7	118.5	179.2	-57.8	170.3	170.6	-159.5	0	109.2	H148 F150	K118-H148 CarbonylContact C-O 3.42Å; K118-H148 WeakPolarHBondContact CB-O 3.33Å; K118-H148 PolarHBondContact O-N 2.78Å; K118-H148 VanDerWaalsContact O-O 3.14Å; K118-F150 HydrophobicContact CB-CD2 3.98Å; K118-F150 HydrophobicContact CB-CE2 4Å; K118-F150 HydrophobicContact CD-CB 4.2Å; K118-F150 HydrophobicContact CD-CD2 3.26Å; K118-F150 HydrophobicContact CD-CE2 3.96Å; K118-F150 HydrophobicContact CD-CG 4.07Å; K118-F150 VanDerWaalsContact CE-CD2 3.45Å; K118-F150 HydrophobicContact CG-CD2 3.49Å; K118-F150 VanDerWaalsContact CG-CD2 3.49Å; K118-F150 HydrophobicContact CG-CE2 3.62Å
119	R	90.1	Very high	83.3	Confident	38 Å²	38	62.4 Å²	62.4	14%	0.143	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	157.9	-177.9	-52.4	-130.1	81.5	103.5	-12.2	110.2	L110 H111 Q117 D145 E146 P147	L110-R119 WeakPolarHBondContact CA-O 3.4Å; H111-R119 PolarHBondContact N-O 3.5Å; H111-R119 PolarHBondContact O-N 3.38Å; Q117-R119 WeakPolarHBondContact O-CG 3.14Å; Q117-R119 PolarHBondContact O-N 3.14Å; R119-D145 HydrophobicContact CB-CB 4.17Å; R119-D145 WeakPolarHBondContact CD-OD2 3.33Å; R119-E146 CarbonylContact C-O 3.59Å; R119-E146 WeakPolarHBondContact CA-O 3.27Å; R119-P147 VanDerWaalsContact NH2-N 3.17Å
120	R	91	Very high	82.9	Confident	45 Å²	45	68.2 Å²	68.2	17%	0.17	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.9	180	-177	170.4	77.5	179.1	-2.7	111	H108 I109 L110 D145 E146 H148	H108-R120 HydrophobicContact CB-CG 4.25Å; H108-R120 VanDerWaalsContact ND1-CD 3.34Å; H108-R120 WeakPolarHBondContact ND1-CD 3.1Å; I109-R120 CarbonylContact O-C 3.55Å; I109-R120 VanDerWaalsContact O-CA 3.31Å; I109-R120 WeakPolarHBondContact O-CA 3.14Å; L110-R120 HydrophobicContact CD2-CB 3.56Å; L110-R120 HydrophobicContact CD2-CG 3.56Å; R120-D145 WeakPolarHBondContact O-CA 3.17Å; R120-D145 WeakPolarHBondContact O-CB 3.4Å; R120-E146 HydrophobicContact CB-CG 4.09Å; R120-E146 IonicContact CZ-OE1 2.91Å; R120-E146 PolarHBondContact N-O 2.99Å; R120-E146 IonicContact NE-OE1 3.31Å; R120-E146 PolarHBondContact NE-OE1 2.9Å; R120-E146 IonicContact NH2-OE1 2.63Å; R120-E146 PolarHBondContact NH2-OE1 3.45Å; R120-E146 IonicContact NH2-OE2 3.57Å; R120-E146 PolarHBondContact O-N 3.16Å; R120-H148 HydrophobicContact CB-CB 3.48Å; R120-H148 VanDerWaalsContact CB-CB 3.48Å; R120-H148 PolarHBondContact NH1-CE1 3.42Å; R120-H148 PolarHBondContact NH1-ND1 3.25Å
121	V	92.2	Very high	82.9	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.018	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.2	170.1	179.8	0	0	0	0	107.3	H108 I109 H111 L123 L140 V143 D145	H108-V121 CarbonylContact C-O 3.54Å; H108-V121 WeakPolarHBondContact CA-O 3.5Å; I109-V121 HydrophobicContact CB-CB 4.32Å; I109-V121 PolarHBondContact N-O 3.06Å; I109-V121 PolarHBondContact O-N 3.38Å; H111-V121 WeakPolarHBondContact NE2-CG2 3.11Å; V121-L123 HydrophobicContact CG1-CD2 4.02Å; V121-L123 HydrophobicContact CG1-CG 4.34Å; V121-L140 HydrophobicContact CG2-CD2 4.15Å; V121-V143 HydrophobicContact CB-CG1 4.4Å; V121-V143 HydrophobicContact CG1-CG1 4.01Å; V121-V143 HydrophobicContact CG1-CG2 3.81Å; V121-V143 HydrophobicContact CG2-CG1 3.48Å; V121-V143 VanDerWaalsContact CG2-CG1 3.48Å; V121-D145 HydrophobicContact CG2-CB 3.85Å
122	K	90.9	Very high	82.8	Confident	115 Å²	115	73.7 Å²	73.7	50%	0.5	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	116.9	172.8	176.4	171.9	166.6	139.7	0	108.5	E106	E106-K122 HydrophobicContact CG-CG 4.33Å; E106-K122 WeakPolarHBondContact OE1-CD 3.35Å; E106-K122 WeakPolarHBondContact OE1-CE 3.43Å; E106-K122 WeakPolarHBondContact OE1-CG 3.02Å; E106-K122 IonicContact OE1-NZ 3.5Å; E106-K122 PolarHBondContact OE1-NZ 3.28Å; E106-K122 IonicContact OE2-NZ 3.16Å; E106-K122 PolarHBondContact OE2-NZ 2.86Å
123	L	87.5	Confident	82.9	Confident	25 Å²	25	77.3 Å²	77.3	13%	0.131	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117.3	176.3	-67.5	177.8	0	0	0	109.6	V107 I109 V121 L125 I134 I138	V107-L123 HydrophobicContact CB-CB 4.38Å; V107-L123 HydrophobicContact CG1-CD1 4.1Å; V107-L123 PolarHBondContact O-N 2.92Å; I109-L123 HydrophobicContact CD1-CD1 3.52Å; I109-L123 HydrophobicContact CD1-CG 4.4Å; I109-L123 HydrophobicContact CG1-CD1 4.05Å; V121-L123 HydrophobicContact CG1-CD2 4.02Å; V121-L123 HydrophobicContact CG1-CG 4.34Å; L123-L125 PolarHBondContact O-N 3.44Å; L123-I134 HydrophobicContact CD1-CD1 4.2Å; L123-I138 HydrophobicContact CD1-CD1 3.58Å; L123-I138 HydrophobicContact CD1-CG1 4.29Å; L123-I138 HydrophobicContact CD2-CG1 4.49Å
124	P	74.9	Confident	83.2	Confident	119 Å²	119	77.7 Å²	77.7	77%	0.773	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-67.8	125.3	169.6	28.3	-31.1	0	0	0	108.4
125	L	78.9	Confident	83.3	Confident	29 Å²	29	79.6 Å²	79.6	15%	0.152	42%	0.423	C	S	.	.			trans	-116.7	122.6	177.6	-68.6	167.1	0	0	0	109.5	I28 V107 L123 V127 I134	I28-L125 HydrophobicContact CD1-CD1 3.46Å; I28-L125 VanDerWaalsContact CD1-CD1 3.46Å; V107-L125 HydrophobicContact CB-CD1 3.63Å; V107-L125 HydrophobicContact CB-CG 4.48Å; V107-L125 HydrophobicContact CG2-CD1 3.34Å; L123-L125 PolarHBondContact O-N 3.44Å; L125-V127 HydrophobicContact CB-CG2 3.62Å; L125-V127 HydrophobicContact CD1-CG2 4.49Å; L125-I134 HydrophobicContact CD2-CD1 4.17Å; L125-I134 HydrophobicContact CD2-CG1 4.14Å
126	T	71.7	Confident	84.1	Confident	137 Å²	137	86 Å²	86	84%	0.84	44%	0.439	S	S	*	.			trans	-100.8	88	167.5	2.7	0	0	0	0	107.1
127	V	70.6	Confident	84.7	Confident	28 Å²	28	79.6 Å²	79.6	17%	0.17	42%	0.417	C	S	.	.			trans	-101.5	118.5	-174.6	-162.3	0	0	0	0	110.3	P105 L125 H132	P105-V127 HydrophobicContact CG-CB 3.93Å; P105-V127 HydrophobicContact CG-CG2 3.52Å; L125-V127 HydrophobicContact CB-CG2 3.62Å; L125-V127 HydrophobicContact CD1-CG2 4.49Å; V127-H132 HydrophobicContact CG1-CB 3.65Å; V127-H132 HydrophobicContact CG2-CB 4.47Å
128	S	67.7	Low	85.3	Confident	121 Å²	121	74.6 Å²	74.6	85%	0.846	39%	0.394	S	S	*	.			trans	-115.3	85.4	168.9	60.4	0	0	0	0	109.3
129	G	80.2	Confident	85.7	Confident	31 Å²	31	73.4 Å²	73.4	32%	0.32	39%	0.392	S	S	.	.	S	Bend	trans	139.5	-179.4	176.6	0	0	0	0	0	114.2	R26	R26-G129 WeakPolarHBondContact CD-O 3.47Å; R26-G129 VanDerWaalsContact CZ-O 3.3Å; R26-G129 PolarHBondContact NE-O 2.85Å; R26-G129 PolarHBondContact NH1-O 2.91Å
130	F	85.6	Confident	85.8	Confident	121 Å²	121	71.6 Å²	71.6	53%	0.531	39%	0.385	S	S	.	.	S	Bend	trans	-71.5	-49.9	177.8	171.6	-101.9	0	0	0	111.9	C25 R26 L27	C25-F130 HydrophobicContact CB-CD2 3.8Å; C25-F130 HydrophobicContact CB-CE2 3.62Å; C25-F130 WeakPolarHBondContact O-CD2 3.29Å; R26-F130 CarbonylContact C-O 3.46Å; R26-F130 WeakPolarHBondContact CA-O 3.39Å; L27-F130 HydrophobicContact CB-CE1 4.01Å; L27-F130 HydrophobicContact CB-CZ 4.02Å; L27-F130 PolarHBondContact N-O 2.85Å
131	D	90.3	Very high	85.7	Confident	72 Å²	72	74.1 Å²	74.1	39%	0.385	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132	-175.3	-178.9	6.8	0	0	0	110.7	L27 R29	L27-D131 WeakPolarHBondContact CD2-OD1 3.05Å; L27-D131 WeakPolarHBondContact O-CA 3.43Å; R29-D131 IonicContact CZ-OD1 3.74Å; R29-D131 IonicContact CZ-OD2 2.92Å; R29-D131 VanDerWaalsContact CZ-OD2 3.31Å; R29-D131 IonicContact NE-OD1 3.3Å; R29-D131 PolarHBondContact NE-OD1 3.45Å; R29-D131 IonicContact NE-OD2 3.97Å; R29-D131 PolarHBondContact NE-OD2 2.88Å; R29-D131 IonicContact NH2-OD1 3.48Å; R29-D131 IonicContact NH2-OD2 2.86Å; R29-D131 PolarHBondContact NH2-OD2 3.31Å
132	H	90.5	Very high	85.5	Confident	46 Å²	46	77.7 Å²	77.7	21%	0.213	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	123.3	177.6	-169.3	69.1	0	0	0	111	L27 I28 R29 V127	L27-H132 PolarHBondContact O-N 3Å; I28-H132 WeakPolarHBondContact CA-O 3.34Å; R29-H132 PolarHBondContact N-O 3.38Å; V127-H132 HydrophobicContact CG1-CB 3.65Å; V127-H132 HydrophobicContact CG2-CB 4.47Å
133	E	91.8	Very high	85.4	Confident	120 Å²	120	74.2 Å²	74.2	56%	0.561	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.4	172.9	-175.4	170.9	-177.4	0	0	110.2	R29 P135	R29-E133 HydrophobicContact CG-CB 4.01Å; R29-E133 HydrophobicContact CG-CG 4.22Å; R29-E133 CarbonylContact O-C 3.56Å; R29-E133 WeakPolarHBondContact O-CA 3.07Å; E133-P135 VanDerWaalsContact O-CD 3.25Å; E133-P135 WeakPolarHBondContact O-CD 3.45Å
134	I	90.9	Very high	85.5	Confident	24 Å²	24	81.6 Å²	81.6	12%	0.123	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	108.4	171	-61.4	163.2	0	0	0	107	I28 R29 F90 L123 L125 R136 I138	I28-I134 HydrophobicContact CG2-CD1 3.96Å; I28-I134 HydrophobicContact CG2-CG1 4.35Å; R29-I134 PolarHBondContact O-N 3.49Å; F90-I134 HydrophobicContact CE2-CD1 4.37Å; F90-I134 HydrophobicContact CZ-CD1 3.86Å; L123-I134 HydrophobicContact CD1-CD1 4.2Å; L125-I134 HydrophobicContact CD2-CD1 4.17Å; L125-I134 HydrophobicContact CD2-CG1 4.14Å; I134-R136 VanDerWaalsContact C-N 3.25Å; I134-R136 PolarHBondContact O-N 3.11Å; I134-I138 HydrophobicContact CD1-CD1 4.48Å; I134-I138 HydrophobicContact CG2-CD1 4.19Å
135	P	86.2	Confident	86.2	Confident	117 Å²	117	77.7 Å²	77.7	76%	0.76	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	-18	-167.8	28.1	-35.1	0	0	0	113.3	E133	E133-P135 VanDerWaalsContact O-CD 3.25Å; E133-P135 WeakPolarHBondContact O-CD 3.45Å
136	R	89.4	Confident	86.7	Confident	207 Å²	207	79.9 Å²	79.9	78%	0.781	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.8	-176.6	-62.2	-175.7	-170.6	169.6	3.4	110.6	I134 I138	I134-R136 VanDerWaalsContact C-N 3.25Å; I134-R136 PolarHBondContact O-N 3.11Å; R136-I138 PolarHBondContact O-N 3.16Å
137	T	92	Very high	87.3	Confident	64 Å²	64	77.9 Å²	77.9	39%	0.393	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	123.3	167.7	-61.6	0	0	0	0	109.2	R31 I33 N139	R31-T137 HydrophobicContact CB-CG2 4.37Å; R31-T137 HydrophobicContact CG-CG2 4.16Å; R31-T137 CarbonylContact O-C 3.59Å; R31-T137 WeakPolarHBondContact O-CA 2.88Å; I33-T137 HydrophobicContact CD1-CG2 3.73Å; I33-T137 HydrophobicContact CG1-CG2 3.68Å; I33-T137 HydrophobicContact CG2-CG2 4.19Å; T137-N139 PolarHBondContact O-N 2.92Å
138	I	93.1	Very high	87.8	Confident	16 Å²	16	78.5 Å²	78.5	8%	0.082	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	112.5	177.4	-59.4	135.1	0	0	0	108.4	R31 A32 I33 F90 I109 L123 I134 R136 L140	R31-I138 PolarHBondContact O-N 3.41Å; A32-I138 WeakPolarHBondContact CA-O 3.5Å; A32-I138 HydrophobicContact CB-CB 4.18Å; A32-I138 HydrophobicContact CB-CD1 4.33Å; I33-I138 PolarHBondContact N-O 3.32Å; F90-I138 HydrophobicContact CE1-CD1 4.29Å; F90-I138 HydrophobicContact CZ-CD1 4.43Å; I109-I138 HydrophobicContact CD1-CD1 3.86Å; L123-I138 HydrophobicContact CD1-CD1 3.58Å; L123-I138 HydrophobicContact CD1-CG1 4.29Å; L123-I138 HydrophobicContact CD2-CG1 4.49Å; I134-I138 HydrophobicContact CD1-CD1 4.48Å; I134-I138 HydrophobicContact CG2-CD1 4.19Å; R136-I138 PolarHBondContact O-N 3.16Å; I138-L140 HydrophobicContact CG2-CD2 3.89Å; I138-L140 PolarHBondContact O-N 3.5Å
139	N	93.2	Very high	88.2	Confident	63 Å²	63	78.4 Å²	78.4	34%	0.337	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	104	172.9	-178.5	-16.1	0	0	0	109.7	P35 T137 R141 A142 V143	P35-N139 WeakPolarHBondContact CD-OD1 3.26Å; P35-N139 WeakPolarHBondContact CG-OD1 3.46Å; T137-N139 PolarHBondContact O-N 2.92Å; N139-R141 PolarHBondContact O-N 3.4Å; N139-R141 PolarHBondContact OD1-N 3.41Å; N139-A142 HydrophobicContact CB-CB 4.11Å; N139-A142 PolarHBondContact O-N 2.98Å; N139-A142 PolarHBondContact OD1-N 3.4Å; N139-V143 PolarHBondContact O-N 3.49Å
140	L	92.7	Very high	87.6	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.5	-176.1	-61.9	172.8	0	0	0	113.9	A32 I33 V48 I109 H111 C113 K114 V121 I138 V143	A32-L140 HydrophobicContact CB-CD1 4.32Å; A32-L140 HydrophobicContact CB-CG 4.49Å; I33-L140 WeakPolarHBondContact O-CB 3.23Å; I33-L140 PolarHBondContact O-N 3.41Å; V48-L140 HydrophobicContact CB-CD1 4.36Å; V48-L140 HydrophobicContact CG1-CD1 3.76Å; V48-L140 HydrophobicContact CG2-CD1 3.61Å; I109-L140 HydrophobicContact CB-CD2 4.46Å; I109-L140 HydrophobicContact CG2-CD1 4.3Å; I109-L140 HydrophobicContact CG2-CD2 3.84Å; H111-L140 HydrophobicContact CB-CD1 3.94Å; H111-L140 PolarHBondContact CE1-O 2.85Å; C113-L140 HydrophobicContact CB-CB 4.08Å; K114-L140 WeakPolarHBondContact CE-O 3.19Å; V121-L140 HydrophobicContact CG2-CD2 4.15Å; I138-L140 HydrophobicContact CG2-CD2 3.89Å; I138-L140 PolarHBondContact O-N 3.5Å; L140-V143 HydrophobicContact CD2-CG1 4.43Å
141	R	88.8	Confident	86.8	Confident	98 Å²	98	76.3 Å²	76.3	37%	0.37	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-22.4	171.2	-68.1	-172.8	-175.9	-172.2	6	113.2	P35 D44 C113 K114 N139	P35-R141 PolarHBondContact O-NH2 3.16Å; D44-R141 IonicContact OD2-NH2 3.75Å; D44-R141 PolarHBondContact OD2-NH2 3.08Å; D44-R141 VanDerWaalsContact OD2-NH2 3.14Å; C113-R141 HydrophobicContact CB-CG 4.32Å; C113-R141 VanDerWaalsContact SG-CG 3.51Å; K114-R141 WeakPolarHBondContact CE-O 3.25Å; N139-R141 PolarHBondContact O-N 3.4Å; N139-R141 PolarHBondContact OD1-N 3.41Å
142	A	88	Confident	85.6	Confident	78 Å²	78	79 Å²	79	65%	0.645	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-22.2	-175.7	0	0	0	0	0	113.7	N139	N139-A142 HydrophobicContact CB-CB 4.11Å; N139-A142 PolarHBondContact O-N 2.98Å; N139-A142 PolarHBondContact OD1-N 3.4Å
143	V	89.8	Confident	84.3	Confident	42 Å²	42	85.2 Å²	85.2	26%	0.255	43%	0.434	S	S	.	.	S	Bend	trans	-75.7	147	179.2	71.8	0	0	0	0	111.4	K114 V121 N139 L140	K114-V143 VanDerWaalsContact CE-O 3.3Å; K114-V143 WeakPolarHBondContact CE-O 3.35Å; K114-V143 PolarHBondContact NZ-O 2.71Å; V121-V143 HydrophobicContact CB-CG1 4.4Å; V121-V143 HydrophobicContact CG1-CG1 4.01Å; V121-V143 HydrophobicContact CG1-CG2 3.81Å; V121-V143 HydrophobicContact CG2-CG1 3.48Å; V121-V143 VanDerWaalsContact CG2-CG1 3.48Å; N139-V143 PolarHBondContact O-N 3.49Å; L140-V143 HydrophobicContact CD2-CG1 4.43Å
144	E	88.6	Confident	82.2	Confident	180 Å²	180	83.5 Å²	83.5	84%	0.841	43%	0.434	S	S	*	.			trans	-64.5	134.9	169.5	-70.9	-174.1	168.7	0	0	110.7
145	D	90.2	Very high	80.2	Confident	37 Å²	37	87.3 Å²	87.3	20%	0.198	46%	0.46	C	S	.	.			trans	-137.2	152.8	-178.1	56.3	4.4	0	0	0	110.5	H111 K114 R119 R120 V121	H111-D145 IonicContact CE1-OD2 3.59Å; H111-D145 PolarHBondContact CE1-OD2 3.46Å; H111-D145 IonicContact NE2-OD2 3.5Å; K114-D145 VanDerWaalsContact CD-OD2 3.28Å; K114-D145 WeakPolarHBondContact CD-OD2 3.23Å; K114-D145 VanDerWaalsContact CE-OD2 3.26Å; K114-D145 WeakPolarHBondContact CE-OD2 3.14Å; K114-D145 IonicContact NZ-OD1 2.81Å; K114-D145 PolarHBondContact NZ-OD1 2.99Å; K114-D145 IonicContact NZ-OD2 3.33Å; K114-D145 PolarHBondContact NZ-OD2 3.48Å; R119-D145 HydrophobicContact CB-CB 4.17Å; R119-D145 WeakPolarHBondContact CD-OD2 3.33Å; R120-D145 WeakPolarHBondContact O-CA 3.17Å; R120-D145 WeakPolarHBondContact O-CB 3.4Å; V121-D145 HydrophobicContact CG2-CB 3.85Å
146	E	88.9	Confident	78.4	Confident	76 Å²	76	85.4 Å²	85.4	36%	0.355	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	149.8	177.4	60.2	-175.6	169.6	0	0	110.2	R119 R120 H148	R119-E146 CarbonylContact C-O 3.59Å; R119-E146 WeakPolarHBondContact CA-O 3.27Å; R120-E146 HydrophobicContact CB-CG 4.09Å; R120-E146 IonicContact CZ-OE1 2.91Å; R120-E146 PolarHBondContact N-O 2.99Å; R120-E146 IonicContact NE-OE1 3.31Å; R120-E146 PolarHBondContact NE-OE1 2.9Å; R120-E146 IonicContact NH2-OE1 2.63Å; R120-E146 PolarHBondContact NH2-OE1 3.45Å; R120-E146 IonicContact NH2-OE2 3.57Å; R120-E146 PolarHBondContact O-N 3.16Å; E146-H148 PolarHBondContact O-N 3.38Å
147	P	85.6	Confident	76	Confident	94 Å²	94	81.2 Å²	81.2	61%	0.61	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.8	132.2	170.3	9.3	-4.7	0	0	0	109.6	R119	R119-P147 VanDerWaalsContact NH2-N 3.17Å
148	H	81.2	Confident	73.5	Confident	41 Å²	41	87.2 Å²	87.2	19%	0.19	49%	0.485	C	S	.	.			trans	-141.2	127.1	176.8	-169.1	65.8	0	0	0	111.1	L110 K118 R120 E146 F150	L110-H148 HydrophobicContact CD2-CB 4.44Å; L110-H148 VanDerWaalsContact CD2-CD2 3.48Å; L110-H148 WeakPolarHBondContact CD2-CD2 3.29Å; K118-H148 CarbonylContact C-O 3.42Å; K118-H148 WeakPolarHBondContact CB-O 3.33Å; K118-H148 PolarHBondContact O-N 2.78Å; K118-H148 VanDerWaalsContact O-O 3.14Å; R120-H148 HydrophobicContact CB-CB 3.48Å; R120-H148 VanDerWaalsContact CB-CB 3.48Å; R120-H148 PolarHBondContact NH1-CE1 3.42Å; R120-H148 PolarHBondContact NH1-ND1 3.25Å; E146-H148 PolarHBondContact O-N 3.38Å; H148-F150 PolarHBondContact O-N 2.88Å
149	V	75.2	Confident	72.5	Confident	119 Å²	119	90.8 Å²	90.8	72%	0.721	51%	0.505	S	S	*	.			trans	-79.9	116.4	171.4	-175	0	0	0	0	107.1	D151	V149-D151 PolarHBondContact O-N 3.04Å
150	F	68	Low	71.4	Confident	41 Å²	41	92.2 Å²	92.2	18%	0.18	51%	0.514	C	S	.	.			trans	-50.1	129.4	170.7	-80.8	-63.1	0	0	0	109.4	I49 L110 K118 H148 N152	I49-F150 HydrophobicContact CD1-CE1 3.92Å; I49-F150 HydrophobicContact CD1-CZ 4.25Å; L110-F150 HydrophobicContact CB-CD1 4.13Å; L110-F150 HydrophobicContact CB-CE1 3.15Å; L110-F150 HydrophobicContact CB-CZ 3.56Å; L110-F150 HydrophobicContact CD1-CD1 3.46Å; L110-F150 VanDerWaalsContact CD1-CD1 3.46Å; L110-F150 HydrophobicContact CD1-CE1 3.29Å; L110-F150 HydrophobicContact CD1-CZ 4.46Å; L110-F150 HydrophobicContact CD2-CE1 4.45Å; L110-F150 HydrophobicContact CG-CD1 4.31Å; L110-F150 HydrophobicContact CG-CE1 3.76Å; K118-F150 HydrophobicContact CB-CD2 3.98Å; K118-F150 HydrophobicContact CB-CE2 4Å; K118-F150 HydrophobicContact CD-CB 4.2Å; K118-F150 HydrophobicContact CD-CD2 3.26Å; K118-F150 HydrophobicContact CD-CE2 3.96Å; K118-F150 HydrophobicContact CD-CG 4.07Å; K118-F150 VanDerWaalsContact CE-CD2 3.45Å; K118-F150 HydrophobicContact CG-CD2 3.49Å; K118-F150 VanDerWaalsContact CG-CD2 3.49Å; K118-F150 HydrophobicContact CG-CE2 3.62Å; H148-F150 PolarHBondContact O-N 2.88Å; F150-N152 VanDerWaalsContact C-N 3.34Å; F150-N152 PolarHBondContact O-N 2.93Å; F150-N152 PolarHBondContact O-OD1 3.33Å
151	D	68.5	Low	70.2	Confident	67 Å²	67	97.3 Å²	97.3	36%	0.358	54%	0.543	S	S	.	.			trans	-70	96.8	171.3	-163	-11.5	0	0	0	108.1	V149 R153	V149-D151 PolarHBondContact O-N 3.04Å; D151-R153 VanDerWaalsContact CG-NE 3.33Å; D151-R153 PolarHBondContact O-N 3.39Å; D151-R153 VanDerWaalsContact OD1-CB 3.25Å; D151-R153 WeakPolarHBondContact OD1-CB 3.37Å; D151-R153 WeakPolarHBondContact OD1-CG 3.38Å; D151-R153 IonicContact OD1-CZ 3.79Å; D151-R153 PolarHBondContact OD1-N 3.21Å; D151-R153 IonicContact OD1-NE 2.96Å; D151-R153 PolarHBondContact OD1-NE 3.28Å; D151-R153 IonicContact OD1-NH2 2.68Å; D151-R153 IonicContact OD2-CZ 3.14Å; D151-R153 VanDerWaalsContact OD2-CZ 3.28Å; D151-R153 IonicContact OD2-NE 2.77Å; D151-R153 PolarHBondContact OD2-NE 3.04Å; D151-R153 IonicContact OD2-NH2 3.13Å; D151-R153 PolarHBondContact OD2-NH2 3.33Å
152	N	64.8	Low	69.1	Low	129 Å²	129	97.3 Å²	97.3	69%	0.69	55%	0.553	S	S	*	*			trans	-74.2	3.8	179.2	-68.7	-16.9	0	0	0	112	F150	F150-N152 VanDerWaalsContact C-N 3.34Å; F150-N152 PolarHBondContact O-N 2.93Å; F150-N152 PolarHBondContact O-OD1 3.33Å
153	R	64.1	Low	68	Low	176 Å²	176	98.5 Å²	98.5	66%	0.664	55%	0.547	S	S	*	.	S	Bend	trans	-62.1	127.6	175.6	-73.2	-178.8	-75.5	-169.2	-1.1	108.9	D151	D151-R153 VanDerWaalsContact CG-NE 3.33Å; D151-R153 PolarHBondContact O-N 3.39Å; D151-R153 VanDerWaalsContact OD1-CB 3.25Å; D151-R153 WeakPolarHBondContact OD1-CB 3.37Å; D151-R153 WeakPolarHBondContact OD1-CG 3.38Å; D151-R153 IonicContact OD1-CZ 3.79Å; D151-R153 PolarHBondContact OD1-N 3.21Å; D151-R153 IonicContact OD1-NE 2.96Å; D151-R153 PolarHBondContact OD1-NE 3.28Å; D151-R153 IonicContact OD1-NH2 2.68Å; D151-R153 IonicContact OD2-CZ 3.14Å; D151-R153 VanDerWaalsContact OD2-CZ 3.28Å; D151-R153 IonicContact OD2-NE 2.77Å; D151-R153 PolarHBondContact OD2-NE 3.04Å; D151-R153 IonicContact OD2-NH2 3.13Å; D151-R153 PolarHBondContact OD2-NH2 3.33Å
154	P	47.2	Very low	66.5	Low	85 Å²	85	102.3 Å²	102.3	55%	0.552	57%	0.567	S	S	*	*			trans	-57.7	142.9	-177.8	21.5	-30.8	0	0	0	110	C156 V157	P154-C156 PolarHBondContact O-N 3.38Å; P154-V157 HydrophobicContact CG-CG2 4.31Å
155	P	49.3	Very low	64.9	Low	103 Å²	103	96.7 Å²	96.7	67%	0.669	55%	0.547	S	S	*	.	S	Bend	trans	-62.9	101.2	176.8	25.2	-30.6	0	0	0	108.5
156	C	47.5	Very low	63	Low	77 Å²	77	101.3 Å²	101.3	52%	0.52	57%	0.574	S	S	.	*			trans	52.8	104	177.9	-54.3	0	0	0	0	114.1	R76 P154 P158	R76-C156 PolarHBondContact NH1-SG 3.33Å; P154-C156 PolarHBondContact O-N 3.38Å; C156-P158 WeakPolarHBondContact O-CD 3.31Å
157	V	39.6	Very low	60.8	Low	119 Å²	119	103.4 Å²	103.4	72%	0.721	59%	0.592	S	S	*	*			trans	-65.7	122.5	151.4	-171.3	0	0	0	0	105.4	P154	P154-V157 HydrophobicContact CG-CG2 4.31Å
158	P	39.2	Very low	58.6	Low	190 Å²	190	104.3 Å²	104.3	100%	1.234	59%	0.591	S	S	*	*			trans	-58.4	0	-178.4	20.7	-28.9	0	0	0	112.6	C156	C156-P158 WeakPolarHBondContact O-CD 3.31Å

Retrieved 158 of 158 residues in 44 ms (Link to these results)

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