A0A5K4F584_SCHMA Loading...

Flocculation protein FLO11-like

AlphaFold DB , UniProt , Accession A0A5K4F584, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 444 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	42	Very low	68.4	Low	222 Å²	222	99.4 Å²	99.4	100%	1.094	55%	0.553	S	S	*	*				0	103.1	0	-69.7	172.2	-170.2	0	0	106.8	S3	M1-S3 PolarHBondContact O-N 3.13Å
2	N	39.8	Very low	69.9	Low	170 Å²	170	94.7 Å²	94.7	91%	0.909	53%	0.53	S	S	*	.			trans	-74.5	82.8	164	-78.7	-8.4	0	0	0	105.8	S4	N2-S4 PolarHBondContact O-N 3.48Å
3	S	47.5	Very low	71.4	Confident	66 Å²	66	93.7 Å²	93.7	46%	0.462	53%	0.528	S	S	.	.			trans	-70.9	92.3	165.7	56.1	0	0	0	0	106.9	M1 N5 N48	M1-S3 PolarHBondContact O-N 3.13Å; S3-N5 PolarHBondContact O-N 2.79Å; S3-N5 VanDerWaalsContact O-N 3.12Å; S3-N48 WeakPolarHBondContact CB-ND2 3.32Å
4	S	51.4	Low	72.5	Confident	65 Å²	65	90.8 Å²	90.8	46%	0.455	51%	0.513	S	S	.	.			trans	-65	109.8	160	19.8	0	0	0	0	106.4	N2 G6 F8	N2-S4 PolarHBondContact O-N 3.48Å; S4-G6 PolarHBondContact O-N 2.96Å; S4-F8 VanDerWaalsContact O-CE2 3.29Å; S4-F8 WeakPolarHBondContact O-CE2 3.33Å; S4-F8 WeakPolarHBondContact O-CZ 3.1Å; S4-F8 WeakPolarHBondContact OG-CZ 3.36Å
5	N	66	Low	73.5	Confident	139 Å²	139	90.3 Å²	90.3	74%	0.743	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	117.9	160.1	-70.1	-27.5	0	0	0	106	S3	S3-N5 PolarHBondContact O-N 2.79Å; S3-N5 VanDerWaalsContact O-N 3.12Å
6	G	78.3	Confident	74.2	Confident	33 Å²	33	88.7 Å²	88.7	34%	0.34	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179	-175.4	-176	0	0	0	0	0	113.6	S4 N48 I50	S4-G6 PolarHBondContact O-N 2.96Å; G6-N48 PolarHBondContact N-O 3.43Å; G6-I50 PolarHBondContact O-N 2.87Å; G6-I50 VanDerWaalsContact O-N 3.09Å
7	I	83.5	Confident	74.7	Confident	131 Å²	131	91.5 Å²	91.5	67%	0.672	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	121	170.3	-58.2	173.1	0	0	0	106.2	I50	I7-I50 CarbonylContact C-O 3.3Å; I7-I50 WeakPolarHBondContact CA-O 3.39Å; I7-I50 HydrophobicContact CG1-CB 4.31Å; I7-I50 HydrophobicContact CG1-CD1 4.47Å
8	F	84.8	Confident	75.1	Confident	48 Å²	48	88.7 Å²	88.7	21%	0.211	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.9	173.2	-65.7	-93.9	0	0	0	108.8	S4 L44 I50 L52	S4-F8 VanDerWaalsContact O-CE2 3.29Å; S4-F8 WeakPolarHBondContact O-CE2 3.33Å; S4-F8 WeakPolarHBondContact O-CZ 3.1Å; S4-F8 WeakPolarHBondContact OG-CZ 3.36Å; F8-L44 HydrophobicContact CB-CD2 4.39Å; F8-I50 PolarHBondContact N-O 2.93Å; F8-L52 PolarHBondContact O-N 3.25Å
9	L	84.9	Confident	75.3	Confident	114 Å²	114	90.2 Å²	90.2	60%	0.597	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.9	178.6	-176.7	63.9	0	0	0	109	T11 L52	L9-T11 HydrophobicContact CD1-CG2 3.41Å; L9-T11 VanDerWaalsContact CD1-CG2 3.41Å; L9-T11 HydrophobicContact CG-CG2 3.84Å; L9-L52 HydrophobicContact CD1-CB 3.9Å; L9-L52 HydrophobicContact CD1-CD2 3.48Å; L9-L52 VanDerWaalsContact CD1-CD2 3.48Å; L9-L52 HydrophobicContact CD1-CG 3.62Å
10	I	86.6	Confident	75.6	Confident	45 Å²	45	88.9 Å²	88.9	23%	0.231	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	102.5	177.6	-49.3	177.8	0	0	0	108.4	S42 L44 L52 I53 T54	I10-S42 WeakPolarHBondContact CG2-OG 3.23Å; I10-L44 HydrophobicContact CD1-CB 4.01Å; I10-L44 HydrophobicContact CD1-CD1 4.35Å; I10-L44 HydrophobicContact CD1-CD2 4.28Å; I10-L44 HydrophobicContact CD1-CG 4.45Å; I10-L52 PolarHBondContact N-O 2.71Å; I10-I53 HydrophobicContact CB-CG1 4.35Å; I10-I53 HydrophobicContact CD1-CG1 4.38Å; I10-I53 CarbonylContact O-C 3.58Å; I10-I53 VanDerWaalsContact O-CA 3.3Å; I10-I53 WeakPolarHBondContact O-CA 3.34Å; I10-T54 PolarHBondContact O-N 3.49Å
11	T	88	Confident	75.8	Confident	60 Å²	60	89 Å²	89	37%	0.368	51%	0.511	S	S	.	.			trans	-135.2	65.3	-170.4	62.8	0	0	0	0	110.8	L9 T13 T54	L9-T11 HydrophobicContact CD1-CG2 3.41Å; L9-T11 VanDerWaalsContact CD1-CG2 3.41Å; L9-T11 HydrophobicContact CG-CG2 3.84Å; T11-T13 PolarHBondContact O-N 3.03Å; T11-T13 PolarHBondContact O-OG1 2.95Å; T11-T54 WeakPolarHBondContact CA-O 3.3Å; T11-T54 WeakPolarHBondContact CB-OG1 3.26Å; T11-T54 HydrophobicContact CG2-CG2 4.5Å; T11-T54 WeakPolarHBondContact CG2-OG1 3.15Å
12	P	86.5	Confident	77.5	Confident	43 Å²	43	79.4 Å²	79.4	28%	0.279	47%	0.465	S	S	.	.			trans	-65.9	127.8	173.7	29.4	-32.7	0	0	0	108.6	P40 S42 P55 T56	P12-P40 HydrophobicContact CB-CB 4.12Å; P12-P40 HydrophobicContact CG-CB 4.12Å; P12-S42 WeakPolarHBondContact CD-OG 3.2Å; P12-S42 WeakPolarHBondContact CG-OG 3.11Å; P12-P55 HydrophobicContact CG-CB 3.85Å; P12-P55 CarbonylContact O-C 3.48Å; P12-P55 VanDerWaalsContact O-CA 3.27Å; P12-P55 WeakPolarHBondContact O-CA 3.34Å; P12-T56 PolarHBondContact O-N 3.01Å
13	T	89	Confident	79.2	Confident	82 Å²	82	75.6 Å²	75.6	50%	0.503	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.6	179.9	-53.7	0	0	0	0	108.3	T11 V15 T56	T11-T13 PolarHBondContact O-N 3.03Å; T11-T13 PolarHBondContact O-OG1 2.95Å; T13-V15 HydrophobicContact CG2-CG2 3.7Å; T13-T56 CarbonylContact C-O 3.59Å; T13-T56 WeakPolarHBondContact CA-O 3.27Å; T13-T56 HydrophobicContact CG2-CG2 4.47Å
14	V	87.2	Confident	80.4	Confident	53 Å²	53	72.5 Å²	72.5	32%	0.321	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126.3	165.6	-170.6	0	0	0	0	106.5	Q38 P40 T56 V57 V58	V14-Q38 VanDerWaalsContact CB-OE1 3.29Å; V14-Q38 HydrophobicContact CG1-CG 4.21Å; V14-P40 HydrophobicContact CG2-CB 4.08Å; V14-P40 HydrophobicContact CG2-CG 4.16Å; V14-T56 PolarHBondContact N-O 2.91Å; V14-V57 WeakPolarHBondContact O-CA 3.12Å; V14-V58 PolarHBondContact O-N 3.18Å
15	V	86.7	Confident	81.4	Confident	84 Å²	84	72.8 Å²	72.8	51%	0.509	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	119.5	174.8	-176.3	0	0	0	0	106.7	T13 Q17 V58	T13-V15 HydrophobicContact CG2-CG2 3.7Å; V15-Q17 HydrophobicContact CG1-CG 4.17Å; V15-V58 CarbonylContact C-O 3.42Å; V15-V58 WeakPolarHBondContact CA-O 3.29Å; V15-V58 HydrophobicContact CG1-CB 4.46Å; V15-V58 HydrophobicContact CG2-CB 4.43Å
16	E	85.1	Confident	81.6	Confident	64 Å²	64	73.4 Å²	73.4	30%	0.299	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.9	174	-172.8	150	-152.7	0	0	108.2	T36 Q38 V58 E59 Q60	E16-T36 WeakPolarHBondContact OE2-CG2 3.36Å; E16-Q38 PolarHBondContact OE2-NE2 3.04Å; E16-V58 PolarHBondContact N-O 2.9Å; E16-E59 HydrophobicContact CB-CG 4.42Å; E16-E59 WeakPolarHBondContact O-CA 3Å; E16-Q60 PolarHBondContact O-N 3.27Å
17	Q	83.1	Confident	81.2	Confident	136 Å²	136	75.7 Å²	75.7	64%	0.636	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	114.6	176.8	-66.4	-172.4	3.2	0	0	107.3	V15 Q60	V15-Q17 HydrophobicContact CG1-CG 4.17Å; Q17-Q60 WeakPolarHBondContact CA-O 3.34Å; Q17-Q60 HydrophobicContact CG-CB 4.32Å
18	A	82	Confident	80.6	Confident	42 Å²	42	72.4 Å²	72.4	35%	0.347	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.6	173.6	0	0	0	0	0	108.3	Q60 A61 T62	A18-Q60 PolarHBondContact N-O 3.07Å; A18-A61 WeakPolarHBondContact O-CA 3.45Å; A18-T62 PolarHBondContact O-N 3.22Å
19	T	79.2	Confident	79.8	Confident	116 Å²	116	76.9 Å²	76.9	71%	0.712	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	107.5	168.3	-55.5	0	0	0	0	107.2	T62	T19-T62 WeakPolarHBondContact CA-O 3.46Å
20	T	80.7	Confident	79.3	Confident	64 Å²	64	74.6 Å²	74.6	39%	0.393	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	111.8	179.6	-55.8	0	0	0	0	107.3	T62 T63 S64	T20-T62 PolarHBondContact N-O 2.99Å; T20-T63 WeakPolarHBondContact O-CA 3.39Å; T20-S64 PolarHBondContact O-N 3.19Å
21	S	78.9	Confident	78.9	Confident	93 Å²	93	78.2 Å²	78.2	65%	0.65	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	110.8	170	-175.2	0	0	0	0	107.8	S64	S21-S64 WeakPolarHBondContact CA-O 3.16Å
22	T	79.1	Confident	78.5	Confident	20 Å²	20	79.8 Å²	79.8	12%	0.123	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	114	-176.3	-67.1	0	0	0	0	108.3	I24 S64 T65 T66	T22-I24 HydrophobicContact CG2-CD1 4.03Å; T22-I24 HydrophobicContact CG2-CG1 3.69Å; T22-S64 PolarHBondContact N-O 3.38Å; T22-T65 WeakPolarHBondContact O-CA 3.22Å; T22-T66 PolarHBondContact O-N 2.81Å
23	T	75	Confident	78	Confident	89 Å²	89	82.6 Å²	82.6	55%	0.546	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.8	165.9	-52.1	0	0	0	0	107.8	T66	T23-T66 WeakPolarHBondContact CA-O 3.28Å
24	I	73.5	Confident	77.7	Confident	2 Å²	2	83.8 Å²	83.8	1%	0.01	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.3	171.8	-53.3	-162.7	0	0	0	108.8	T22 E26 D28 T66 S68 D71	T22-I24 HydrophobicContact CG2-CD1 4.03Å; T22-I24 HydrophobicContact CG2-CG1 3.69Å; I24-E26 WeakPolarHBondContact CG2-O 3.47Å; I24-D28 HydrophobicContact CD1-CB 4.14Å; I24-D28 HydrophobicContact CG2-CB 3.99Å; I24-T66 PolarHBondContact N-O 3.13Å; I24-S68 PolarHBondContact O-N 3Å; I24-D71 WeakPolarHBondContact CB-OD2 3.43Å; I24-D71 VanDerWaalsContact CD1-OD2 3.24Å; I24-D71 WeakPolarHBondContact CD1-OD2 3.22Å; I24-D71 WeakPolarHBondContact CG2-OD1 3.24Å; I24-D71 WeakPolarHBondContact CG2-OD2 3.44Å
25	S	71.2	Confident	77.5	Confident	70 Å²	70	88.1 Å²	88.1	49%	0.49	49%	0.487	S	S	.	.			trans	-128.2	2.1	-174.9	-51.9	0	0	0	0	112.7	E69	S25-E69 VanDerWaalsContact O-CD 3.23Å
26	E	69.9	Low	77.4	Confident	152 Å²	152	84.8 Å²	84.8	71%	0.71	47%	0.467	S	S	*	.	S	Bend	trans	-141.3	144	174.3	-67.2	-174.6	-179.9	0	0	107	I24 D28 E69	I24-E26 WeakPolarHBondContact CG2-O 3.47Å; E26-D28 PolarHBondContact O-N 3.22Å; E26-E69 VanDerWaalsContact CA-OE2 3.32Å; E26-E69 WeakPolarHBondContact CA-OE2 3.11Å
27	S	71.2	Confident	77.4	Confident	82 Å²	82	85.6 Å²	85.6	57%	0.573	48%	0.477	S	S	*	.			trans	-49.6	110.3	178.2	-59.5	0	0	0	0	112.5	E69 S70	S27-E69 PolarHBondContact N-OE2 3.03Å; S27-S70 VanDerWaalsContact CA-O 3.3Å; S27-S70 WeakPolarHBondContact CA-O 3.38Å; S27-S70 WeakPolarHBondContact CB-O 3.36Å; S27-S70 PolarHBondContact OG-O 2.95Å
28	D	69.4	Low	77.5	Confident	62 Å²	62	79.6 Å²	79.6	33%	0.332	45%	0.449	S	S	.	.			trans	-112.5	144.2	-179	-103.8	-15.9	0	0	0	110.7	I24 E26 R30 D71 L72	I24-D28 HydrophobicContact CD1-CB 4.14Å; I24-D28 HydrophobicContact CG2-CB 3.99Å; E26-D28 PolarHBondContact O-N 3.22Å; D28-R30 HydrophobicContact CB-CG 4.34Å; D28-R30 IonicContact OD2-CZ 2.99Å; D28-R30 IonicContact OD2-NE 3.64Å; D28-R30 PolarHBondContact OD2-NE 3.37Å; D28-R30 VanDerWaalsContact OD2-NE 3.13Å; D28-R30 IonicContact OD2-NH2 3.97Å; D28-R30 PolarHBondContact OD2-NH2 3.41Å; D28-D71 PolarHBondContact N-OD1 2.95Å; D28-L72 PolarHBondContact O-N 2.91Å
29	L	67.9	Low	77.8	Confident	141 Å²	141	80.7 Å²	80.7	74%	0.738	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	108.3	167.5	-63	-178.9	0	0	0	108	L72	L29-L72 HydrophobicContact CD2-CB 3.56Å; L29-L72 HydrophobicContact CD2-CD1 3.53Å; L29-L72 HydrophobicContact CD2-CG 3.62Å
30	R	75.9	Confident	78.1	Confident	66 Å²	66	75.7 Å²	75.7	25%	0.249	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.4	179.5	-65.5	-171.4	-173.4	-175.8	8.3	111.4	D28 L72 R73 N74	D28-R30 HydrophobicContact CB-CG 4.34Å; D28-R30 IonicContact OD2-CZ 2.99Å; D28-R30 IonicContact OD2-NE 3.64Å; D28-R30 PolarHBondContact OD2-NE 3.37Å; D28-R30 VanDerWaalsContact OD2-NE 3.13Å; D28-R30 IonicContact OD2-NH2 3.97Å; D28-R30 PolarHBondContact OD2-NH2 3.41Å; R30-L72 PolarHBondContact N-O 3.12Å; R30-L72 VanDerWaalsContact N-O 3.07Å; R30-R73 HydrophobicContact CB-CG 4.48Å; R30-N74 PolarHBondContact O-N 2.89Å
31	N	77.1	Confident	78.4	Confident	121 Å²	121	77.6 Å²	77.6	65%	0.647	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	99.9	171.4	-175.7	30.4	0	0	0	107.3	N74	N31-N74 VanDerWaalsContact CA-O 3.29Å; N31-N74 WeakPolarHBondContact CA-O 3.45Å; N31-N74 PolarHBondContact OD1-ND2 2.87Å; N31-N74 PolarHBondContact OD1-O 2.91Å
32	E	80.6	Confident	78.7	Confident	94 Å²	94	73.3 Å²	73.3	44%	0.439	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.1	-176.4	-63.5	-173.6	-168.1	0	0	108.5	N74 E75 S76	E32-N74 PolarHBondContact N-O 2.82Å; E32-E75 HydrophobicContact CB-CG 4.46Å; E32-E75 WeakPolarHBondContact O-CA 3.24Å; E32-S76 PolarHBondContact O-N 3.46Å
33	S	75.6	Confident	79	Confident	101 Å²	101	80.2 Å²	80.2	71%	0.706	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.4	119.8	172.7	-177.5	0	0	0	0	109	S76	S33-S76 VanDerWaalsContact CA-O 3.24Å; S33-S76 WeakPolarHBondContact CA-O 3.24Å; S33-S76 PolarHBondContact OG-O 3.07Å
34	E	83.7	Confident	79.5	Confident	107 Å²	107	77.5 Å²	77.5	50%	0.5	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	142.1	178.3	-172.4	149.1	-159.7	0	0	109.7	S76 K78	E34-S76 PolarHBondContact N-O 2.99Å; E34-S76 VanDerWaalsContact N-O 3.08Å; E34-K78 PolarHBondContact O-N 2.92Å
35	K	82	Confident	80	Confident	144 Å²	144	82.7 Å²	82.7	63%	0.626	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	109	176.1	-175.8	-168.2	170.8	-164.5	0	109.3	K78	K35-K78 WeakPolarHBondContact CA-O 3.4Å; K35-K78 HydrophobicContact CG-CB 4.37Å
36	T	84.8	Confident	80.5	Confident	14 Å²	14	82.3 Å²	82.3	9%	0.086	43%	0.426	C	S	.	.			trans	-105.7	142.1	179.6	-59.6	0	0	0	0	109.7	E16 Q38 K78 S80	E16-T36 WeakPolarHBondContact OE2-CG2 3.36Å; T36-Q38 HydrophobicContact CG2-CG 4.21Å; T36-K78 PolarHBondContact N-O 3.38Å; T36-S80 PolarHBondContact O-N 2.7Å
37	T	85.5	Confident	81.1	Confident	81 Å²	81	75.4 Å²	75.4	50%	0.497	39%	0.394	S	S	.	.			trans	-146.1	118	176.4	-58.7	0	0	0	0	109.9	S80	T37-S80 CarbonylContact C-O 3.44Å; T37-S80 VanDerWaalsContact CA-O 3.29Å; T37-S80 WeakPolarHBondContact CA-O 3.03Å
38	Q	83.8	Confident	81.7	Confident	10 Å²	10	73.4 Å²	73.4	5%	0.047	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-121.9	123.5	-178.1	-57.8	-175	34.9	0	0	110.7	V14 E16 T36 V57 E59 S80 Q81 T82	V14-Q38 VanDerWaalsContact CB-OE1 3.29Å; V14-Q38 HydrophobicContact CG1-CG 4.21Å; E16-Q38 PolarHBondContact OE2-NE2 3.04Å; T36-Q38 HydrophobicContact CG2-CG 4.21Å; Q38-V57 HydrophobicContact CB-CG1 4.23Å; Q38-V57 HydrophobicContact CB-CG2 3.95Å; Q38-E59 PolarHBondContact NE2-OE2 2.92Å; Q38-S80 PolarHBondContact N-O 2.96Å; Q38-Q81 WeakPolarHBondContact O-CA 3.44Å; Q38-T82 PolarHBondContact O-N 3.13Å
39	T	88.3	Confident	82.5	Confident	65 Å²	65	71.8 Å²	71.8	40%	0.399	38%	0.375	S	S	.	.			trans	-138.3	67.2	-175.6	-42.9	0	0	0	0	111.1	E41 T82	T39-E41 HydrophobicContact CG2-CG 4.4Å; T39-E41 PolarHBondContact O-N 2.93Å; T39-T82 WeakPolarHBondContact CA-O 3.2Å; T39-T82 HydrophobicContact CG2-CG2 4.5Å; T39-T82 VanDerWaalsContact CG2-O 3.25Å; T39-T82 WeakPolarHBondContact CG2-O 3.27Å
40	P	85.2	Confident	83.5	Confident	11 Å²	11	68.9 Å²	68.9	7%	0.071	36%	0.36	C	S	.	.			trans	-67.7	116.5	174.5	26.2	-30.5	0	0	0	110.3	P12 V14 P55 V57 P83 E84	P12-P40 HydrophobicContact CB-CB 4.12Å; P12-P40 HydrophobicContact CG-CB 4.12Å; V14-P40 HydrophobicContact CG2-CB 4.08Å; V14-P40 HydrophobicContact CG2-CG 4.16Å; P40-P55 HydrophobicContact CB-CB 4.21Å; P40-P55 HydrophobicContact CG-CB 4.22Å; P40-P55 WeakPolarHBondContact O-CB 3.18Å; P40-V57 HydrophobicContact CG-CG2 3.59Å; P40-P83 HydrophobicContact CG-CB 3.86Å; P40-E84 PolarHBondContact O-N 2.87Å
41	E	87.1	Confident	84.2	Confident	105 Å²	105	65.8 Å²	65.8	49%	0.491	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134.7	179.3	-68.1	-171.3	-161.3	0	0	112.2	T39 E84	T39-E41 HydrophobicContact CG2-CG 4.4Å; T39-E41 PolarHBondContact O-N 2.93Å; E41-E84 HydrophobicContact CG-CB 4.34Å
42	S	85.9	Confident	84.8	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.014	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	117.6	170	-66.3	0	0	0	0	110.8	I10 P12 E84 R86	I10-S42 WeakPolarHBondContact CG2-OG 3.23Å; P12-S42 WeakPolarHBondContact CD-OG 3.2Å; P12-S42 WeakPolarHBondContact CG-OG 3.11Å; S42-E84 PolarHBondContact N-O 2.9Å; S42-R86 PolarHBondContact O-N 3Å
43	R	85.8	Confident	85.2	Confident	165 Å²	165	57.8 Å²	57.8	62%	0.623	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	124	-177.1	-61	180	63.1	177.5	-2.2	110.8	R86	R43-R86 WeakPolarHBondContact CA-O 3.1Å; R43-R86 HydrophobicContact CG-CB 4.32Å
44	L	85.2	Confident	86	Confident	32 Å²	32	54.2 Å²	54.2	17%	0.168	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.7	174.3	-172.7	62.8	0	0	0	109.9	F8 I10 V51 I53 R86 L87 N88	F8-L44 HydrophobicContact CB-CD2 4.39Å; I10-L44 HydrophobicContact CD1-CB 4.01Å; I10-L44 HydrophobicContact CD1-CD1 4.35Å; I10-L44 HydrophobicContact CD1-CD2 4.28Å; I10-L44 HydrophobicContact CD1-CG 4.45Å; L44-V51 HydrophobicContact CD2-CG1 3.89Å; L44-V51 HydrophobicContact CD2-CG2 4.28Å; L44-I53 HydrophobicContact CB-CD1 4.41Å; L44-R86 PolarHBondContact N-O 3.35Å; L44-L87 HydrophobicContact CB-CD1 3.76Å; L44-L87 HydrophobicContact CD2-CD1 3.87Å; L44-L87 HydrophobicContact CG-CD1 3.87Å; L44-L87 WeakPolarHBondContact O-CA 3.38Å; L44-N88 PolarHBondContact O-N 2.87Å; L44-N88 VanDerWaalsContact O-N 3.14Å
45	N	83.4	Confident	86.2	Confident	112 Å²	112	49.1 Å²	49.1	60%	0.599	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	-44.2	-176.7	-174.5	43.1	0	0	0	112.2	N88 S89	N45-N88 WeakPolarHBondContact O-CB 3.35Å; N45-N88 PolarHBondContact OD1-ND2 2.93Å; N45-S89 PolarHBondContact O-N 3.05Å
46	S	82.2	Confident	86.7	Confident	62 Å²	62	43.3 Å²	43.3	43%	0.434	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	142.1	-176.9	59.9	0	0	0	0	110.9	S89	S46-S89 WeakPolarHBondContact CA-O 3.47Å
47	S	82.3	Confident	87	Confident	6 Å²	6	42.6 Å²	42.6	4%	0.042	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	147.8	-179.9	48.1	0	0	0	0	112	V51 S89 S90 N91	S47-V51 VanDerWaalsContact CB-CG2 3.44Å; S47-V51 WeakPolarHBondContact OG-CG2 3.46Å; S47-S89 PolarHBondContact N-O 3.18Å; S47-S90 WeakPolarHBondContact O-CA 3.1Å; S47-S90 PolarHBondContact OG-OG 2.96Å; S47-N91 PolarHBondContact O-N 2.95Å
48	N	83.4	Confident	87.2	Confident	41 Å²	41	40 Å²	40	22%	0.219	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.2	167.6	-72.1	-11	0	0	0	108.3	S3 G6 N91	S3-N48 WeakPolarHBondContact CB-ND2 3.32Å; G6-N48 PolarHBondContact N-O 3.43Å; N48-N91 WeakPolarHBondContact CA-O 3.5Å; N48-N91 PolarHBondContact OD1-ND2 3.49Å; N48-N91 VanDerWaalsContact OD1-ND2 3.1Å
49	G	87.2	Confident	87.4	Confident	27 Å²	27	39.9 Å²	39.9	28%	0.278	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	109.8	-144.7	-175.3	0	0	0	0	0	112.9	N91 G92 N93	G49-N91 PolarHBondContact N-O 2.93Å; G49-G92 CarbonylContact O-C 3.18Å; G49-G92 VanDerWaalsContact O-CA 3.26Å; G49-G92 WeakPolarHBondContact O-CA 3.4Å; G49-N93 PolarHBondContact O-N 2.97Å
50	I	88.9	Confident	87.3	Confident	81 Å²	81	40.1 Å²	40.1	42%	0.415	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.5	-175	-59.3	173.4	0	0	0	108.8	G6 I7 F8 N93	G6-I50 PolarHBondContact O-N 2.87Å; G6-I50 VanDerWaalsContact O-N 3.09Å; I7-I50 CarbonylContact C-O 3.3Å; I7-I50 WeakPolarHBondContact CA-O 3.39Å; I7-I50 HydrophobicContact CG1-CB 4.31Å; I7-I50 HydrophobicContact CG1-CD1 4.47Å; F8-I50 PolarHBondContact N-O 2.93Å; I50-N93 WeakPolarHBondContact CA-O 3.4Å
51	V	89.9	Confident	87.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.8	177.3	-178.4	0	0	0	0	109.2	L44 S47 I53 L87 N93 V94 L95	L44-V51 HydrophobicContact CD2-CG1 3.89Å; L44-V51 HydrophobicContact CD2-CG2 4.28Å; S47-V51 VanDerWaalsContact CB-CG2 3.44Å; S47-V51 WeakPolarHBondContact OG-CG2 3.46Å; V51-I53 HydrophobicContact CG1-CD1 3.77Å; V51-I53 HydrophobicContact CG1-CG1 3.73Å; V51-L87 HydrophobicContact CB-CD2 4.34Å; V51-L87 HydrophobicContact CG1-CD2 3.95Å; V51-L87 HydrophobicContact CG2-CD2 4.38Å; V51-N93 PolarHBondContact N-O 2.89Å; V51-V94 HydrophobicContact CB-CG2 4.43Å; V51-L95 PolarHBondContact O-N 2.77Å
52	L	89.8	Confident	87.1	Confident	48 Å²	48	38.8 Å²	38.8	25%	0.251	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	115.9	173.2	-179.9	51.5	0	0	0	109.3	F8 L9 I10 T54 L95	F8-L52 PolarHBondContact O-N 3.25Å; L9-L52 HydrophobicContact CD1-CB 3.9Å; L9-L52 HydrophobicContact CD1-CD2 3.48Å; L9-L52 VanDerWaalsContact CD1-CD2 3.48Å; L9-L52 HydrophobicContact CD1-CG 3.62Å; I10-L52 PolarHBondContact N-O 2.71Å; L52-T54 HydrophobicContact CD1-CG2 3.35Å; L52-T54 HydrophobicContact CG-CG2 3.91Å; L52-L95 WeakPolarHBondContact CA-O 2.98Å; L52-L95 HydrophobicContact CD1-CB 3.86Å; L52-L95 HydrophobicContact CD1-CD2 3.55Å; L52-L95 HydrophobicContact CD1-CG 3.5Å
53	I	90.1	Very high	87.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	112.4	178.6	-57.8	172.2	0	0	0	109.1	I10 L44 V51 S85 L87 L95 I96 T97	I10-I53 HydrophobicContact CB-CG1 4.35Å; I10-I53 HydrophobicContact CD1-CG1 4.38Å; I10-I53 CarbonylContact O-C 3.58Å; I10-I53 VanDerWaalsContact O-CA 3.3Å; I10-I53 WeakPolarHBondContact O-CA 3.34Å; L44-I53 HydrophobicContact CB-CD1 4.41Å; V51-I53 HydrophobicContact CG1-CD1 3.77Å; V51-I53 HydrophobicContact CG1-CG1 3.73Å; I53-S85 VanDerWaalsContact CG2-OG 3.24Å; I53-S85 WeakPolarHBondContact CG2-OG 3.48Å; I53-L87 HydrophobicContact CD1-CB 4.2Å; I53-L95 PolarHBondContact N-O 2.71Å; I53-I96 HydrophobicContact CB-CG1 4.38Å; I53-I96 HydrophobicContact CD1-CG1 4.49Å; I53-I96 CarbonylContact O-C 3.6Å; I53-I96 WeakPolarHBondContact O-CA 3.24Å; I53-T97 PolarHBondContact O-N 3.28Å
54	T	91.2	Very high	86.8	Confident	25 Å²	25	35.4 Å²	35.4	15%	0.153	21%	0.211	C	C	.	.			trans	-137.4	70.2	-175	75.1	0	0	0	0	111.2	I10 T11 L52 T56 T97	I10-T54 PolarHBondContact O-N 3.49Å; T11-T54 WeakPolarHBondContact CA-O 3.3Å; T11-T54 WeakPolarHBondContact CB-OG1 3.26Å; T11-T54 HydrophobicContact CG2-CG2 4.5Å; T11-T54 WeakPolarHBondContact CG2-OG1 3.15Å; L52-T54 HydrophobicContact CD1-CG2 3.35Å; L52-T54 HydrophobicContact CG-CG2 3.91Å; T54-T56 PolarHBondContact O-N 3.2Å; T54-T56 PolarHBondContact O-OG1 2.64Å; T54-T97 WeakPolarHBondContact CA-O 3.4Å; T54-T97 WeakPolarHBondContact CB-OG1 3.31Å; T54-T97 WeakPolarHBondContact CG2-OG1 3.09Å
55	P	88.9	Confident	86.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.208	C	C	.	.			trans	-63.4	130.2	169	28.2	-33.8	0	0	0	108.9	P12 P40 P83 S85 P98 I99	P12-P55 HydrophobicContact CG-CB 3.85Å; P12-P55 CarbonylContact O-C 3.48Å; P12-P55 VanDerWaalsContact O-CA 3.27Å; P12-P55 WeakPolarHBondContact O-CA 3.34Å; P40-P55 HydrophobicContact CB-CB 4.21Å; P40-P55 HydrophobicContact CG-CB 4.22Å; P40-P55 WeakPolarHBondContact O-CB 3.18Å; P55-P83 HydrophobicContact CB-CB 3.89Å; P55-P83 HydrophobicContact CG-CB 4.05Å; P55-S85 WeakPolarHBondContact CD-OG 3.04Å; P55-S85 WeakPolarHBondContact CG-OG 3.3Å; P55-P98 HydrophobicContact CG-CB 3.93Å; P55-P98 HydrophobicContact CG-CG 4.32Å; P55-P98 VanDerWaalsContact O-CA 3.3Å; P55-P98 WeakPolarHBondContact O-CA 3.34Å; P55-I99 PolarHBondContact O-N 3.3Å
56	T	91.3	Very high	86.3	Confident	22 Å²	22	32 Å²	32	14%	0.135	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.2	-175.6	-54.6	0	0	0	0	109.8	P12 T13 V14 T54 V58 I99	P12-T56 PolarHBondContact O-N 3.01Å; T13-T56 CarbonylContact C-O 3.59Å; T13-T56 WeakPolarHBondContact CA-O 3.27Å; T13-T56 HydrophobicContact CG2-CG2 4.47Å; V14-T56 PolarHBondContact N-O 2.91Å; T54-T56 PolarHBondContact O-N 3.2Å; T54-T56 PolarHBondContact O-OG1 2.64Å; T56-V58 HydrophobicContact CG2-CG2 3.77Å; T56-I99 WeakPolarHBondContact CA-O 3.37Å; T56-I99 HydrophobicContact CG2-CB 4.16Å; T56-I99 HydrophobicContact CG2-CG2 4.21Å
57	V	91.3	Very high	86	Confident	0 Å²	0	29 Å²	29	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.3	165.5	170.3	0	0	0	0	107.2	V14 Q38 P40 Q81 P83 I99 V100 V101	V14-V57 WeakPolarHBondContact O-CA 3.12Å; Q38-V57 HydrophobicContact CB-CG1 4.23Å; Q38-V57 HydrophobicContact CB-CG2 3.95Å; P40-V57 HydrophobicContact CG-CG2 3.59Å; V57-Q81 HydrophobicContact CB-CB 4.49Å; V57-Q81 HydrophobicContact CG1-CB 4.02Å; V57-Q81 HydrophobicContact CG1-CG 3.73Å; V57-P83 HydrophobicContact CG2-CB 4.43Å; V57-I99 PolarHBondContact N-O 2.94Å; V57-V100 WeakPolarHBondContact O-CA 3.45Å; V57-V101 PolarHBondContact O-N 2.88Å
58	V	89.7	Confident	85.5	Confident	26 Å²	26	30.9 Å²	30.9	16%	0.158	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	120.4	170.6	-176.3	0	0	0	0	107.6	V14 V15 E16 T56 Q60 V101	V14-V58 PolarHBondContact O-N 3.18Å; V15-V58 CarbonylContact C-O 3.42Å; V15-V58 WeakPolarHBondContact CA-O 3.29Å; V15-V58 HydrophobicContact CG1-CB 4.46Å; V15-V58 HydrophobicContact CG2-CB 4.43Å; E16-V58 PolarHBondContact N-O 2.9Å; T56-V58 HydrophobicContact CG2-CG2 3.77Å; V58-Q60 HydrophobicContact CG1-CG 4.11Å; V58-V101 CarbonylContact C-O 3.35Å; V58-V101 WeakPolarHBondContact CA-O 3.24Å; V58-V101 HydrophobicContact CG1-CB 4.45Å; V58-V101 HydrophobicContact CG2-CB 4.45Å
59	E	88.4	Confident	84.9	Confident	8 Å²	8	32.6 Å²	32.6	4%	0.037	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.8	173.8	-171.4	157.5	177.7	0	0	109.3	E16 Q38 N79 Q81 V101 E102 L103	E16-E59 HydrophobicContact CB-CG 4.42Å; E16-E59 WeakPolarHBondContact O-CA 3Å; Q38-E59 PolarHBondContact NE2-OE2 2.92Å; E59-N79 PolarHBondContact OE2-ND2 3.12Å; E59-N79 PolarHBondContact OE2-OD1 2.91Å; E59-Q81 VanDerWaalsContact CB-NE2 3.25Å; E59-Q81 PolarHBondContact OE2-NE2 3.37Å; E59-V101 PolarHBondContact N-O 2.89Å; E59-E102 WeakPolarHBondContact O-CA 3.45Å; E59-L103 PolarHBondContact O-N 3.09Å
60	Q	86.3	Confident	84.2	Confident	70 Å²	70	33.9 Å²	33.9	33%	0.327	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	114.2	177.2	-57.3	-173.6	1.3	0	0	108.1	E16 Q17 A18 V58 L103	E16-Q60 PolarHBondContact O-N 3.27Å; Q17-Q60 WeakPolarHBondContact CA-O 3.34Å; Q17-Q60 HydrophobicContact CG-CB 4.32Å; A18-Q60 PolarHBondContact N-O 3.07Å; V58-Q60 HydrophobicContact CG1-CG 4.11Å; Q60-L103 WeakPolarHBondContact CA-O 3.26Å; Q60-L103 HydrophobicContact CG-CB 4.25Å; Q60-L103 HydrophobicContact CG-CD1 4.13Å; Q60-L103 HydrophobicContact CG-CG 4.44Å
61	A	85.7	Confident	83.4	Confident	27 Å²	27	30.1 Å²	30.1	22%	0.223	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125	175.5	0	0	0	0	0	108.8	A18 L103 T105	A18-A61 WeakPolarHBondContact O-CA 3.45Å; A61-L103 PolarHBondContact N-O 3.01Å; A61-T105 PolarHBondContact O-N 2.96Å
62	T	82.9	Confident	82.6	Confident	61 Å²	61	34.2 Å²	34.2	37%	0.374	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	111.1	167.6	-56.3	0	0	0	0	108.2	A18 T19 T20 T105	A18-T62 PolarHBondContact O-N 3.22Å; T19-T62 WeakPolarHBondContact CA-O 3.46Å; T20-T62 PolarHBondContact N-O 2.99Å; T62-T105 WeakPolarHBondContact CA-O 3.25Å
63	T	84.7	Confident	82.1	Confident	56 Å²	56	32.4 Å²	32.4	34%	0.344	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.4	177.6	58.5	0	0	0	0	109.1	T20 T105 A106 T107	T20-T63 WeakPolarHBondContact O-CA 3.39Å; T63-T105 PolarHBondContact N-O 3.06Å; T63-A106 WeakPolarHBondContact OG1-CA 3.45Å; T63-T107 PolarHBondContact O-N 2.81Å; T63-T107 PolarHBondContact O-OG1 2.91Å
64	S	79.4	Confident	81.5	Confident	39 Å²	39	35 Å²	35	27%	0.273	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	112.2	171.5	-168.5	0	0	0	0	108	T20 S21 T22 T107	T20-S64 PolarHBondContact O-N 3.19Å; S21-S64 WeakPolarHBondContact CA-O 3.16Å; T22-S64 PolarHBondContact N-O 3.38Å; S64-T107 WeakPolarHBondContact CA-OG1 3.12Å; S64-T107 WeakPolarHBondContact CB-OG1 3.32Å; S64-T107 PolarHBondContact OG-OG1 3Å; S64-T107 VanDerWaalsContact OG-OG1 3.13Å
65	T	80.6	Confident	81.2	Confident	18 Å²	18	36.3 Å²	36.3	11%	0.11	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	118.8	-176.6	-71.9	0	0	0	0	107.7	T22 I67 R73 T107 P108 S109	T22-T65 WeakPolarHBondContact O-CA 3.22Å; T65-I67 HydrophobicContact CG2-CD1 3.92Å; T65-I67 HydrophobicContact CG2-CG1 3.67Å; T65-R73 VanDerWaalsContact CG2-NH1 3.26Å; T65-T107 PolarHBondContact N-O 2.87Å; T65-P108 WeakPolarHBondContact O-CA 3.32Å; T65-S109 PolarHBondContact O-N 3.23Å
66	T	78.7	Confident	80.8	Confident	54 Å²	54	38.2 Å²	38.2	33%	0.331	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.7	170.4	-52.4	0	0	0	0	108.4	T22 T23 I24 S109	T22-T66 PolarHBondContact O-N 2.81Å; T23-T66 WeakPolarHBondContact CA-O 3.28Å; I24-T66 PolarHBondContact N-O 3.13Å; T66-S109 WeakPolarHBondContact CA-O 2.92Å
67	I	75.5	Confident	80.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.5	177.6	-52.6	-162.9	0	0	0	108.8	T65 E69 D71 R73 S109 S111 D114 R116	T65-I67 HydrophobicContact CG2-CD1 3.92Å; T65-I67 HydrophobicContact CG2-CG1 3.67Å; I67-E69 WeakPolarHBondContact CG2-O 3.46Å; I67-D71 HydrophobicContact CD1-CB 4.19Å; I67-D71 WeakPolarHBondContact CD1-OD2 3.24Å; I67-D71 HydrophobicContact CG2-CB 4.17Å; I67-D71 WeakPolarHBondContact CG2-OD2 3.08Å; I67-R73 VanDerWaalsContact CD1-NE 3.34Å; I67-R73 VanDerWaalsContact CG1-NH2 3.32Å; I67-S109 PolarHBondContact N-O 2.68Å; I67-S111 PolarHBondContact O-N 3.08Å; I67-S111 PolarHBondContact O-OG 3Å; I67-D114 WeakPolarHBondContact CB-OD2 3.45Å; I67-D114 VanDerWaalsContact CD1-OD2 3.24Å; I67-D114 WeakPolarHBondContact CD1-OD2 3.42Å; I67-D114 VanDerWaalsContact CG2-OD1 3.27Å; I67-D114 WeakPolarHBondContact CG2-OD1 3.44Å; I67-D114 WeakPolarHBondContact CG2-OD2 3.48Å; I67-R116 VanDerWaalsContact CG1-NH2 3.3Å
68	S	71.2	Confident	80.2	Confident	46 Å²	46	44.5 Å²	44.5	32%	0.322	25%	0.249	S	C	.	.			trans	-110.7	-9.1	-178.8	-62.1	0	0	0	0	114.4	I24 S111 E112	I24-S68 PolarHBondContact O-N 3Å; S68-S111 WeakPolarHBondContact CA-OG 3.48Å; S68-E112 VanDerWaalsContact O-CD 3.23Å; S68-E112 WeakPolarHBondContact O-CG 3.48Å
69	E	72.4	Confident	80.1	Confident	77 Å²	77	43.2 Å²	43.2	36%	0.36	24%	0.242	S	C	.	.	S	Bend	trans	-140.2	165.3	175.9	-68.7	-163.3	176.6	0	0	110.1	S25 E26 S27 I67 D71 E112	S25-E69 VanDerWaalsContact O-CD 3.23Å; E26-E69 VanDerWaalsContact CA-OE2 3.32Å; E26-E69 WeakPolarHBondContact CA-OE2 3.11Å; S27-E69 PolarHBondContact N-OE2 3.03Å; I67-E69 WeakPolarHBondContact CG2-O 3.46Å; E69-D71 PolarHBondContact O-N 2.83Å; E69-E112 WeakPolarHBondContact CA-OE2 3.1Å
70	S	71.6	Confident	80.2	Confident	53 Å²	53	44.2 Å²	44.2	37%	0.371	25%	0.249	S	C	.	.			trans	-59.2	119.4	-176.4	-49.5	0	0	0	0	114.1	S27 S113	S27-S70 VanDerWaalsContact CA-O 3.3Å; S27-S70 WeakPolarHBondContact CA-O 3.38Å; S27-S70 WeakPolarHBondContact CB-O 3.36Å; S27-S70 PolarHBondContact OG-O 2.95Å; S70-S113 WeakPolarHBondContact CA-O 3.43Å; S70-S113 VanDerWaalsContact CB-O 3.26Å; S70-S113 WeakPolarHBondContact CB-O 3.36Å; S70-S113 PolarHBondContact OG-O 2.97Å
71	D	72.3	Confident	80.4	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.011	23%	0.234	C	C	.	.			trans	-118.6	147.8	177.9	-75.4	-25.3	0	0	0	113.3	I24 D28 I67 E69 R73 D114 L115	I24-D71 WeakPolarHBondContact CB-OD2 3.43Å; I24-D71 VanDerWaalsContact CD1-OD2 3.24Å; I24-D71 WeakPolarHBondContact CD1-OD2 3.22Å; I24-D71 WeakPolarHBondContact CG2-OD1 3.24Å; I24-D71 WeakPolarHBondContact CG2-OD2 3.44Å; D28-D71 PolarHBondContact N-OD1 2.95Å; I67-D71 HydrophobicContact CD1-CB 4.19Å; I67-D71 WeakPolarHBondContact CD1-OD2 3.24Å; I67-D71 HydrophobicContact CG2-CB 4.17Å; I67-D71 WeakPolarHBondContact CG2-OD2 3.08Å; E69-D71 PolarHBondContact O-N 2.83Å; D71-R73 HydrophobicContact CB-CG 4.37Å; D71-R73 IonicContact OD2-NE 3.4Å; D71-R73 IonicContact OD2-NH2 3.13Å; D71-D114 PolarHBondContact N-OD1 3.38Å; D71-D114 VanDerWaalsContact N-OD1 3.13Å; D71-L115 PolarHBondContact O-N 2.93Å
72	L	72.6	Confident	80.6	Confident	86 Å²	86	40.6 Å²	40.6	45%	0.45	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.4	164.1	-49.7	-175.1	0	0	0	109	D28 L29 R30 L115	D28-L72 PolarHBondContact O-N 2.91Å; L29-L72 HydrophobicContact CD2-CB 3.56Å; L29-L72 HydrophobicContact CD2-CD1 3.53Å; L29-L72 HydrophobicContact CD2-CG 3.62Å; R30-L72 PolarHBondContact N-O 3.12Å; R30-L72 VanDerWaalsContact N-O 3.07Å; L72-L115 HydrophobicContact CD2-CB 3.53Å; L72-L115 HydrophobicContact CD2-CD1 3.45Å; L72-L115 VanDerWaalsContact CD2-CD1 3.45Å; L72-L115 HydrophobicContact CD2-CG 3.64Å
73	R	79.1	Confident	80.9	Confident	11 Å²	11	37.7 Å²	37.7	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.7	179.1	-62	-164.6	-175.2	-176.5	11.9	112	R30 T65 I67 D71 E75 L115 N117	R30-R73 HydrophobicContact CB-CG 4.48Å; T65-R73 VanDerWaalsContact CG2-NH1 3.26Å; I67-R73 VanDerWaalsContact CD1-NE 3.34Å; I67-R73 VanDerWaalsContact CG1-NH2 3.32Å; D71-R73 HydrophobicContact CB-CG 4.37Å; D71-R73 IonicContact OD2-NE 3.4Å; D71-R73 IonicContact OD2-NH2 3.13Å; R73-E75 WeakPolarHBondContact CD-OE1 3.34Å; R73-E75 IonicContact NH1-OE1 2.62Å; R73-E75 PolarHBondContact NH1-OE1 2.91Å; R73-L115 PolarHBondContact N-O 2.87Å; R73-N117 PolarHBondContact O-N 2.89Å
74	N	78.6	Confident	81.1	Confident	54 Å²	54	36.8 Å²	36.8	29%	0.289	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	109.3	166.2	-177.2	69.1	0	0	0	108.2	R30 N31 E32 N117	R30-N74 PolarHBondContact O-N 2.89Å; N31-N74 VanDerWaalsContact CA-O 3.29Å; N31-N74 WeakPolarHBondContact CA-O 3.45Å; N31-N74 PolarHBondContact OD1-ND2 2.87Å; N31-N74 PolarHBondContact OD1-O 2.91Å; E32-N74 PolarHBondContact N-O 2.82Å; N74-N117 WeakPolarHBondContact CA-O 3.45Å; N74-N117 PolarHBondContact OD1-ND2 3.41Å
75	E	83.6	Confident	81.6	Confident	52 Å²	52	35 Å²	35	24%	0.243	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.1	-179.1	-62	-177.4	-164.2	0	0	108.5	E32 R73 N117 E118 S119	E32-E75 HydrophobicContact CB-CG 4.46Å; E32-E75 WeakPolarHBondContact O-CA 3.24Å; R73-E75 WeakPolarHBondContact CD-OE1 3.34Å; R73-E75 IonicContact NH1-OE1 2.62Å; R73-E75 PolarHBondContact NH1-OE1 2.91Å; E75-N117 PolarHBondContact N-O 2.94Å; E75-E118 HydrophobicContact CB-CG 4.38Å; E75-S119 PolarHBondContact O-N 3.33Å
76	S	81	Confident	82	Confident	40 Å²	40	39 Å²	39	28%	0.28	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	108.7	179.2	-66.3	0	0	0	0	110.2	E32 S33 E34 S119	E32-S76 PolarHBondContact O-N 3.46Å; S33-S76 VanDerWaalsContact CA-O 3.24Å; S33-S76 WeakPolarHBondContact CA-O 3.24Å; S33-S76 PolarHBondContact OG-O 3.07Å; E34-S76 PolarHBondContact N-O 2.99Å; E34-S76 VanDerWaalsContact N-O 3.08Å; S76-S119 CarbonylContact C-O 3.37Å; S76-S119 VanDerWaalsContact CA-O 3.31Å; S76-S119 WeakPolarHBondContact CA-O 3.33Å
77	E	86.3	Confident	82.5	Confident	63 Å²	63	36.5 Å²	36.5	29%	0.294	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.6	179.9	-173.2	158.9	-170.8	0	0	110.8	S119 E120 K121	E77-S119 PolarHBondContact N-O 2.9Å; E77-E120 HydrophobicContact CB-CG 4.5Å; E77-K121 PolarHBondContact O-N 2.91Å
78	K	83.4	Confident	83.1	Confident	91 Å²	91	40 Å²	40	40%	0.396	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	106.8	173.3	-175.6	-179.5	176.8	-178.4	0	110.6	E34 K35 T36 K121	E34-K78 PolarHBondContact O-N 2.92Å; K35-K78 WeakPolarHBondContact CA-O 3.4Å; K35-K78 HydrophobicContact CG-CB 4.37Å; T36-K78 PolarHBondContact N-O 3.38Å; K78-K121 WeakPolarHBondContact CA-O 3.37Å; K78-K121 HydrophobicContact CG-CB 4.49Å
79	N	88.7	Confident	83.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	142.5	175.5	-163.5	8.6	0	0	0	112.1	E59 Q81 E102 K121 T123	E59-N79 PolarHBondContact OE2-ND2 3.12Å; E59-N79 PolarHBondContact OE2-OD1 2.91Å; N79-Q81 PolarHBondContact ND2-NE2 2.65Å; N79-E102 PolarHBondContact ND2-OE1 2.92Å; N79-K121 PolarHBondContact N-O 2.97Å; N79-T123 PolarHBondContact O-N 2.93Å; N79-T123 VanDerWaalsContact O-N 3.1Å
80	S	89.1	Confident	84.6	Confident	28 Å²	28	36.1 Å²	36.1	20%	0.196	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	116.8	176.5	-168.8	0	0	0	0	111.2	T36 T37 Q38 T123	T36-S80 PolarHBondContact O-N 2.7Å; T37-S80 CarbonylContact C-O 3.44Å; T37-S80 VanDerWaalsContact CA-O 3.29Å; T37-S80 WeakPolarHBondContact CA-O 3.03Å; Q38-S80 PolarHBondContact N-O 2.96Å; S80-T123 CarbonylContact C-O 3.29Å; S80-T123 VanDerWaalsContact CA-O 3.32Å; S80-T123 WeakPolarHBondContact CA-O 3.47Å
81	Q	90.2	Very high	85.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	115.9	-174.1	-59.1	171.4	-29.3	0	0	109.9	Q38 V57 E59 N79 V100 T123 Q124 T125	Q38-Q81 WeakPolarHBondContact O-CA 3.44Å; V57-Q81 HydrophobicContact CB-CB 4.49Å; V57-Q81 HydrophobicContact CG1-CB 4.02Å; V57-Q81 HydrophobicContact CG1-CG 3.73Å; E59-Q81 VanDerWaalsContact CB-NE2 3.25Å; E59-Q81 PolarHBondContact OE2-NE2 3.37Å; N79-Q81 PolarHBondContact ND2-NE2 2.65Å; Q81-V100 HydrophobicContact CB-CG1 3.95Å; Q81-V100 HydrophobicContact CB-CG2 4.32Å; Q81-V100 HydrophobicContact CG-CG1 4.48Å; Q81-T123 PolarHBondContact N-O 2.91Å; Q81-Q124 WeakPolarHBondContact O-CA 3.21Å; Q81-T125 PolarHBondContact O-N 3.42Å
82	T	91.1	Very high	86	Confident	22 Å²	22	38 Å²	38	14%	0.135	20%	0.199	C	C	.	.			trans	-134.5	70.9	-173.3	-53.2	0	0	0	0	110.4	Q38 T39 E84 T125	Q38-T82 PolarHBondContact O-N 3.13Å; T39-T82 WeakPolarHBondContact CA-O 3.2Å; T39-T82 HydrophobicContact CG2-CG2 4.5Å; T39-T82 VanDerWaalsContact CG2-O 3.25Å; T39-T82 WeakPolarHBondContact CG2-O 3.27Å; T82-E84 HydrophobicContact CG2-CG 4.06Å; T82-E84 PolarHBondContact O-N 2.7Å; T82-T125 WeakPolarHBondContact CB-OG1 3.4Å; T82-T125 VanDerWaalsContact CG2-OG1 3.23Å; T82-T125 WeakPolarHBondContact CG2-OG1 3.44Å; T82-T125 PolarHBondContact OG1-OG1 2.69Å
83	P	88.6	Confident	86.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.			trans	-67.8	125.2	171.9	28.5	-33.2	0	0	0	109.9	P40 P55 V57 P98 V100 P126 E127	P40-P83 HydrophobicContact CG-CB 3.86Å; P55-P83 HydrophobicContact CB-CB 3.89Å; P55-P83 HydrophobicContact CG-CB 4.05Å; V57-P83 HydrophobicContact CG2-CB 4.43Å; P83-P98 HydrophobicContact CB-CB 4.1Å; P83-P98 HydrophobicContact CG-CB 4.04Å; P83-V100 VanDerWaalsContact CD-CG2 3.47Å; P83-V100 HydrophobicContact CG-CG2 3.48Å; P83-V100 VanDerWaalsContact CG-CG2 3.48Å; P83-P126 HydrophobicContact CG-CB 3.85Å; P83-E127 PolarHBondContact O-N 3.25Å
84	E	90.1	Very high	87.5	Confident	37 Å²	37	37.3 Å²	37.3	17%	0.173	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	134.1	-176.6	-67.1	-162.8	-172.8	0	0	112.6	P40 E41 S42 T82 E127	P40-E84 PolarHBondContact O-N 2.87Å; E41-E84 HydrophobicContact CG-CB 4.34Å; S42-E84 PolarHBondContact N-O 2.9Å; T82-E84 HydrophobicContact CG2-CG 4.06Å; T82-E84 PolarHBondContact O-N 2.7Å; E84-E127 HydrophobicContact CG-CB 4.36Å
85	S	89.5	Confident	88.2	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.007	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	123.7	172.1	-65.3	0	0	0	0	111.9	I53 P55 E127 R129	I53-S85 VanDerWaalsContact CG2-OG 3.24Å; I53-S85 WeakPolarHBondContact CG2-OG 3.48Å; P55-S85 WeakPolarHBondContact CD-OG 3.04Å; P55-S85 WeakPolarHBondContact CG-OG 3.3Å; S85-E127 PolarHBondContact N-O 3.08Å; S85-R129 PolarHBondContact O-N 2.83Å
86	R	88.9	Confident	88.6	Confident	101 Å²	101	34.9 Å²	34.9	38%	0.381	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	118.1	-179.9	-57.6	-178.8	65.6	176.1	2.8	111	S42 R43 L44 R129	S42-R86 PolarHBondContact O-N 3Å; R43-R86 WeakPolarHBondContact CA-O 3.1Å; R43-R86 HydrophobicContact CG-CB 4.32Å; L44-R86 PolarHBondContact N-O 3.35Å; R86-R129 WeakPolarHBondContact CA-O 3.12Å; R86-R129 HydrophobicContact CG-CB 4.42Å
87	L	88	Confident	89.2	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.016	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.2	173.6	179.2	61.6	0	0	0	109.7	L44 V51 I53 V94 I96 R129 L130 N131	L44-L87 HydrophobicContact CB-CD1 3.76Å; L44-L87 HydrophobicContact CD2-CD1 3.87Å; L44-L87 HydrophobicContact CG-CD1 3.87Å; L44-L87 WeakPolarHBondContact O-CA 3.38Å; V51-L87 HydrophobicContact CB-CD2 4.34Å; V51-L87 HydrophobicContact CG1-CD2 3.95Å; V51-L87 HydrophobicContact CG2-CD2 4.38Å; I53-L87 HydrophobicContact CD1-CB 4.2Å; L87-V94 HydrophobicContact CD2-CB 4.32Å; L87-V94 HydrophobicContact CD2-CG1 3.59Å; L87-V94 HydrophobicContact CD2-CG2 3.69Å; L87-I96 HydrophobicContact CB-CD1 4.21Å; L87-R129 PolarHBondContact N-O 2.86Å; L87-L130 HydrophobicContact CB-CD1 3.79Å; L87-L130 HydrophobicContact CD2-CD1 3.74Å; L87-L130 HydrophobicContact CG-CD1 3.66Å; L87-L130 WeakPolarHBondContact O-CA 3.48Å; L87-L130 WeakPolarHBondContact O-CD1 3.43Å; L87-N131 PolarHBondContact O-N 2.9Å; L87-N131 VanDerWaalsContact O-N 3.11Å
88	N	87.9	Confident	89.4	Confident	74 Å²	74	30.8 Å²	30.8	40%	0.396	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-40	-177.2	-179	41.3	0	0	0	112.1	L44 N45 N131 S132	L44-N88 PolarHBondContact O-N 2.87Å; L44-N88 VanDerWaalsContact O-N 3.14Å; N45-N88 WeakPolarHBondContact O-CB 3.35Å; N45-N88 PolarHBondContact OD1-ND2 2.93Å; N88-N131 WeakPolarHBondContact O-CB 3.37Å; N88-N131 PolarHBondContact OD1-ND2 3.1Å; N88-S132 PolarHBondContact O-N 2.86Å
89	S	87.4	Confident	89.9	Confident	40 Å²	40	28.8 Å²	28.8	28%	0.28	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	143.1	175.6	-174.3	0	0	0	0	112.2	N45 S46 S47 S132	N45-S89 PolarHBondContact O-N 3.05Å; S46-S89 WeakPolarHBondContact CA-O 3.47Å; S47-S89 PolarHBondContact N-O 3.18Å; S89-S132 WeakPolarHBondContact CA-O 3.4Å
90	S	88.4	Confident	90.1	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.4	171	-166.1	0	0	0	0	112.3	S47 V94 S132 S133 N134	S47-S90 WeakPolarHBondContact O-CA 3.1Å; S47-S90 PolarHBondContact OG-OG 2.96Å; S90-V94 WeakPolarHBondContact OG-CG2 3.1Å; S90-S132 PolarHBondContact N-O 3.02Å; S90-S132 VanDerWaalsContact N-O 3.17Å; S90-S133 WeakPolarHBondContact O-CA 3.47Å; S90-N134 PolarHBondContact O-N 2.8Å
91	N	86.6	Confident	90.3	Very high	74 Å²	74	29 Å²	29	40%	0.396	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	96	163.1	-60.8	-54.7	0	0	0	108.8	S47 N48 G49 N134	S47-N91 PolarHBondContact O-N 2.95Å; N48-N91 WeakPolarHBondContact CA-O 3.5Å; N48-N91 PolarHBondContact OD1-ND2 3.49Å; N48-N91 VanDerWaalsContact OD1-ND2 3.1Å; G49-N91 PolarHBondContact N-O 2.93Å; N91-N134 PolarHBondContact OD1-ND2 3.44Å
92	G	87.6	Confident	90.4	Very high	19 Å²	19	29.6 Å²	29.6	20%	0.196	16%	0.159	C	C	.	.	S	Bend	trans	138.4	-167.5	-175.2	0	0	0	0	0	111.5	G49 N134	G49-G92 CarbonylContact O-C 3.18Å; G49-G92 VanDerWaalsContact O-CA 3.26Å; G49-G92 WeakPolarHBondContact O-CA 3.4Å; G92-N134 PolarHBondContact N-O 3.44Å
93	N	90.7	Very high	90.3	Very high	78 Å²	78	30.9 Å²	30.9	42%	0.417	16%	0.164	S	C	.	.			trans	-81.3	136.3	-174.3	-64.4	-20.2	0	0	0	111	G49 I50 V51 N136	G49-N93 PolarHBondContact O-N 2.97Å; I50-N93 WeakPolarHBondContact CA-O 3.4Å; V51-N93 PolarHBondContact N-O 2.89Å; N93-N136 WeakPolarHBondContact CA-O 2.94Å; N93-N136 PolarHBondContact OD1-N 3.23Å
94	V	92	Very high	90.3	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.03	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.4	-178.2	177.5	0	0	0	0	109.5	V51 L87 S90 I96 L130 N136 L138	V51-V94 HydrophobicContact CB-CG2 4.43Å; L87-V94 HydrophobicContact CD2-CB 4.32Å; L87-V94 HydrophobicContact CD2-CG1 3.59Å; L87-V94 HydrophobicContact CD2-CG2 3.69Å; S90-V94 WeakPolarHBondContact OG-CG2 3.1Å; V94-I96 HydrophobicContact CG1-CD1 3.67Å; V94-I96 HydrophobicContact CG1-CG1 3.66Å; V94-L130 HydrophobicContact CB-CD2 4.32Å; V94-L130 HydrophobicContact CG1-CD2 3.95Å; V94-N136 PolarHBondContact N-O 3.09Å; V94-L138 PolarHBondContact O-N 3Å
95	L	93.1	Very high	90.2	Very high	56 Å²	56	33.4 Å²	33.4	29%	0.293	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	116.8	171.1	177	52.7	0	0	0	108.9	V51 L52 I53 T97 L138	V51-L95 PolarHBondContact O-N 2.77Å; L52-L95 WeakPolarHBondContact CA-O 2.98Å; L52-L95 HydrophobicContact CD1-CB 3.86Å; L52-L95 HydrophobicContact CD1-CD2 3.55Å; L52-L95 HydrophobicContact CD1-CG 3.5Å; I53-L95 PolarHBondContact N-O 2.71Å; L95-T97 HydrophobicContact CD1-CG2 3.33Å; L95-T97 HydrophobicContact CG-CG2 3.88Å; L95-L138 WeakPolarHBondContact CA-O 3.36Å; L95-L138 HydrophobicContact CD1-CB 3.81Å; L95-L138 HydrophobicContact CD1-CD2 3.56Å; L95-L138 HydrophobicContact CD1-CG 3.47Å; L95-L138 VanDerWaalsContact CD1-CG 3.47Å
96	I	92.7	Very high	90.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	112.6	179.6	-61.5	170.4	0	0	0	108.8	I53 L87 V94 P98 S128 L130 L138 I139 T140	I53-I96 HydrophobicContact CB-CG1 4.38Å; I53-I96 HydrophobicContact CD1-CG1 4.49Å; I53-I96 CarbonylContact O-C 3.6Å; I53-I96 WeakPolarHBondContact O-CA 3.24Å; L87-I96 HydrophobicContact CB-CD1 4.21Å; V94-I96 HydrophobicContact CG1-CD1 3.67Å; V94-I96 HydrophobicContact CG1-CG1 3.66Å; I96-P98 HydrophobicContact CG2-CG 4.34Å; I96-S128 WeakPolarHBondContact CG2-OG 3.22Å; I96-L130 HydrophobicContact CD1-CB 4.19Å; I96-L138 PolarHBondContact N-O 3.03Å; I96-I139 HydrophobicContact CB-CG1 4.46Å; I96-I139 WeakPolarHBondContact O-CA 3.21Å; I96-T140 PolarHBondContact O-N 2.95Å
97	T	92.7	Very high	90	Very high	17 Å²	17	32 Å²	32	10%	0.104	19%	0.192	C	C	.	.			trans	-135.9	75.3	-174.6	71.7	0	0	0	0	111.2	I53 T54 L95 I99 T140	I53-T97 PolarHBondContact O-N 3.28Å; T54-T97 WeakPolarHBondContact CA-O 3.4Å; T54-T97 WeakPolarHBondContact CB-OG1 3.31Å; T54-T97 WeakPolarHBondContact CG2-OG1 3.09Å; L95-T97 HydrophobicContact CD1-CG2 3.33Å; L95-T97 HydrophobicContact CG-CG2 3.88Å; T97-I99 WeakPolarHBondContact O-CG1 3.35Å; T97-I99 PolarHBondContact O-N 2.99Å; T97-T140 WeakPolarHBondContact CG2-OG1 3.46Å
98	P	91.7	Very high	89.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.196	C	C	.	.			trans	-64.3	128.1	167.8	-11	25	0	0	0	108.9	P55 P83 I96 P126 E127 S128 P141 T142	P55-P98 HydrophobicContact CG-CB 3.93Å; P55-P98 HydrophobicContact CG-CG 4.32Å; P55-P98 VanDerWaalsContact O-CA 3.3Å; P55-P98 WeakPolarHBondContact O-CA 3.34Å; P83-P98 HydrophobicContact CB-CB 4.1Å; P83-P98 HydrophobicContact CG-CB 4.04Å; I96-P98 HydrophobicContact CG2-CG 4.34Å; P98-P126 HydrophobicContact CB-CB 3.77Å; P98-E127 WeakPolarHBondContact CG-O 3.42Å; P98-S128 WeakPolarHBondContact CD-OG 3.35Å; P98-S128 WeakPolarHBondContact CG-OG 3.08Å; P98-P141 HydrophobicContact CG-CB 4.46Å; P98-P141 VanDerWaalsContact O-CA 3.29Å; P98-P141 WeakPolarHBondContact O-CA 3.03Å; P98-T142 PolarHBondContact O-N 3.03Å
99	I	93.1	Very high	89.3	Confident	48 Å²	48	31.1 Å²	31.1	25%	0.246	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.3	-174.6	-65.8	162	0	0	0	108.7	P55 T56 V57 T97 V101 T142	P55-I99 PolarHBondContact O-N 3.3Å; T56-I99 WeakPolarHBondContact CA-O 3.37Å; T56-I99 HydrophobicContact CG2-CB 4.16Å; T56-I99 HydrophobicContact CG2-CG2 4.21Å; V57-I99 PolarHBondContact N-O 2.94Å; T97-I99 WeakPolarHBondContact O-CG1 3.35Å; T97-I99 PolarHBondContact O-N 2.99Å; I99-V101 HydrophobicContact CG2-CG2 3.71Å; I99-T142 WeakPolarHBondContact CA-O 3.39Å
100	V	93.7	Very high	88.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.5	167.1	-175.3	0	0	0	0	107.9	V57 Q81 P83 Q124 P126 T142 V143 V144	V57-V100 WeakPolarHBondContact O-CA 3.45Å; Q81-V100 HydrophobicContact CB-CG1 3.95Å; Q81-V100 HydrophobicContact CB-CG2 4.32Å; Q81-V100 HydrophobicContact CG-CG1 4.48Å; P83-V100 VanDerWaalsContact CD-CG2 3.47Å; P83-V100 HydrophobicContact CG-CG2 3.48Å; P83-V100 VanDerWaalsContact CG-CG2 3.48Å; V100-Q124 HydrophobicContact CG1-CB 4.15Å; V100-Q124 HydrophobicContact CG1-CG 3.87Å; V100-P126 HydrophobicContact CG2-CB 4.2Å; V100-P126 HydrophobicContact CG2-CG 4.18Å; V100-T142 PolarHBondContact N-O 2.95Å; V100-V143 HydrophobicContact CB-CG2 4.39Å; V100-V144 PolarHBondContact O-N 3.48Å
101	V	92.1	Very high	88.2	Confident	33 Å²	33	31.3 Å²	31.3	20%	0.2	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.3	173.5	-177.3	0	0	0	0	108.1	V57 V58 E59 I99 L103 V144	V57-V101 PolarHBondContact O-N 2.88Å; V58-V101 CarbonylContact C-O 3.35Å; V58-V101 WeakPolarHBondContact CA-O 3.24Å; V58-V101 HydrophobicContact CG1-CB 4.45Å; V58-V101 HydrophobicContact CG2-CB 4.45Å; E59-V101 PolarHBondContact N-O 2.89Å; I99-V101 HydrophobicContact CG2-CG2 3.71Å; V101-L103 HydrophobicContact CG1-CD1 4.49Å; V101-L103 HydrophobicContact CG1-CD2 3.93Å; V101-L103 HydrophobicContact CG1-CG 3.98Å; V101-V144 WeakPolarHBondContact CA-O 3.04Å; V101-V144 HydrophobicContact CG2-CB 4.47Å
102	E	91.9	Very high	87.5	Confident	13 Å²	13	31.1 Å²	31.1	6%	0.061	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	119.2	175.3	-174.6	155.8	-149.3	0	0	108.8	E59 N79 T122 Q124 V144 E145 Q146	E59-E102 WeakPolarHBondContact O-CA 3.45Å; N79-E102 PolarHBondContact ND2-OE1 2.92Å; E102-T122 WeakPolarHBondContact OE2-CG2 3.36Å; E102-Q124 PolarHBondContact OE2-NE2 2.98Å; E102-V144 PolarHBondContact N-O 2.84Å; E102-E145 WeakPolarHBondContact O-CA 3.33Å; E102-Q146 PolarHBondContact O-N 2.99Å
103	L	89.8	Confident	86.7	Confident	48 Å²	48	33 Å²	33	25%	0.251	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.2	178.2	-53.2	-179.7	0	0	0	108.4	E59 Q60 A61 V101 Q146	E59-L103 PolarHBondContact O-N 3.09Å; Q60-L103 WeakPolarHBondContact CA-O 3.26Å; Q60-L103 HydrophobicContact CG-CB 4.25Å; Q60-L103 HydrophobicContact CG-CD1 4.13Å; Q60-L103 HydrophobicContact CG-CG 4.44Å; A61-L103 PolarHBondContact N-O 3.01Å; V101-L103 HydrophobicContact CG1-CD1 4.49Å; V101-L103 HydrophobicContact CG1-CD2 3.93Å; V101-L103 HydrophobicContact CG1-CG 3.98Å; L103-Q146 WeakPolarHBondContact CA-O 3.48Å; L103-Q146 HydrophobicContact CD2-CB 3.75Å; L103-Q146 HydrophobicContact CD2-CG 3.95Å
104	A	89.4	Confident	86	Confident	35 Å²	35	29.3 Å²	29.3	29%	0.289	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.8	177.8	0	0	0	0	0	110.2	Q146 T148	A104-Q146 PolarHBondContact N-O 2.93Å; A104-T148 PolarHBondContact O-N 2.97Å
105	T	87.1	Confident	85.1	Confident	56 Å²	56	33 Å²	33	34%	0.344	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	114.9	169.5	-59.6	0	0	0	0	109.1	A61 T62 T63 T148	A61-T105 PolarHBondContact O-N 2.96Å; T62-T105 WeakPolarHBondContact CA-O 3.25Å; T63-T105 PolarHBondContact N-O 3.06Å; T105-T148 WeakPolarHBondContact CA-O 3.46Å
106	A	87.8	Confident	84.6	Confident	24 Å²	24	30.8 Å²	30.8	20%	0.198	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126	178.6	0	0	0	0	0	110.3	T63 T148 T149 S150	T63-A106 WeakPolarHBondContact OG1-CA 3.45Å; A106-T148 PolarHBondContact N-O 3.01Å; A106-T149 HydrophobicContact CB-CG2 4.41Å; A106-T149 WeakPolarHBondContact O-CA 2.89Å; A106-S150 PolarHBondContact O-N 2.98Å
107	T	85.5	Confident	84	Confident	49 Å²	49	33.5 Å²	33.5	30%	0.301	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	67.1	176.1	51.6	0	0	0	0	111.1	T63 S64 T65 S150	T63-T107 PolarHBondContact O-N 2.81Å; T63-T107 PolarHBondContact O-OG1 2.91Å; S64-T107 WeakPolarHBondContact CA-OG1 3.12Å; S64-T107 WeakPolarHBondContact CB-OG1 3.32Å; S64-T107 PolarHBondContact OG-OG1 3Å; S64-T107 VanDerWaalsContact OG-OG1 3.13Å; T65-T107 PolarHBondContact N-O 2.87Å; T107-S150 WeakPolarHBondContact CA-O 3Å
108	P	81.6	Confident	83.6	Confident	17 Å²	17	35.4 Å²	35.4	11%	0.11	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.1	175.6	30.5	-33.4	0	0	0	110.6	T65 T151 T152	T65-P108 WeakPolarHBondContact O-CA 3.32Å; P108-T151 HydrophobicContact CG-CG2 4.3Å; P108-T151 WeakPolarHBondContact CG-OG1 3.43Å; P108-T152 PolarHBondContact O-N 2.75Å; P108-T152 VanDerWaalsContact O-N 3.09Å
109	S	81.3	Confident	83.3	Confident	41 Å²	41	37.8 Å²	37.8	29%	0.287	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	125.2	170.6	-178.5	0	0	0	0	109.6	T65 T66 I67 T152	T65-S109 PolarHBondContact O-N 3.23Å; T66-S109 WeakPolarHBondContact CA-O 2.92Å; I67-S109 PolarHBondContact N-O 2.68Å; S109-T152 WeakPolarHBondContact CA-O 3.46Å
110	T	78.2	Confident	83.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.9	175.4	49.2	0	0	0	0	109.9	D114 T152 I153 S154 D157	T110-D114 HydrophobicContact CG2-CB 4.46Å; T110-D114 WeakPolarHBondContact CG2-OD2 3.46Å; T110-T152 PolarHBondContact N-O 2.72Å; T110-I153 WeakPolarHBondContact OG1-CG1 3.31Å; T110-S154 PolarHBondContact O-N 3.41Å; T110-D157 WeakPolarHBondContact CG2-OD2 3.37Å; T110-D157 PolarHBondContact OG1-OD2 3.16Å
111	S	73.9	Confident	82.8	Confident	44 Å²	44	42 Å²	42	31%	0.308	24%	0.242	S	C	.	.	S	Bend	trans	-116	-0.5	171.6	71.9	0	0	0	0	113.9	I67 S68 E155	I67-S111 PolarHBondContact O-N 3.08Å; I67-S111 PolarHBondContact O-OG 3Å; S68-S111 WeakPolarHBondContact CA-OG 3.48Å; S111-E155 VanDerWaalsContact O-CG 3.22Å; S111-E155 WeakPolarHBondContact O-CG 3.33Å
112	E	72.2	Confident	82.8	Confident	71 Å²	71	40.4 Å²	40.4	33%	0.332	23%	0.233	S	C	.	.	S	Bend	trans	-145.3	179.7	177.6	-78.5	-156	-174.6	0	0	111.1	S68 E69 D114 E155	S68-E112 VanDerWaalsContact O-CD 3.23Å; S68-E112 WeakPolarHBondContact O-CG 3.48Å; E69-E112 WeakPolarHBondContact CA-OE2 3.1Å; E112-D114 PolarHBondContact O-N 2.91Å; E112-E155 WeakPolarHBondContact CA-OE2 3.12Å
113	S	70.6	Confident	82.9	Confident	57 Å²	57	41.3 Å²	41.3	40%	0.399	24%	0.239	S	C	.	.			trans	-67	108.5	-174.2	-61.4	0	0	0	0	114.9	S70 S156	S70-S113 WeakPolarHBondContact CA-O 3.43Å; S70-S113 VanDerWaalsContact CB-O 3.26Å; S70-S113 WeakPolarHBondContact CB-O 3.36Å; S70-S113 PolarHBondContact OG-O 2.97Å; S113-S156 WeakPolarHBondContact CA-O 3.37Å
114	D	74.8	Confident	83.1	Confident	2 Å²	2	39 Å²	39	1%	0.011	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	145.1	-178.4	-79.6	-17.1	0	0	0	112.9	I67 D71 T110 E112 R116 S156 L158	I67-D114 WeakPolarHBondContact CB-OD2 3.45Å; I67-D114 VanDerWaalsContact CD1-OD2 3.24Å; I67-D114 WeakPolarHBondContact CD1-OD2 3.42Å; I67-D114 VanDerWaalsContact CG2-OD1 3.27Å; I67-D114 WeakPolarHBondContact CG2-OD1 3.44Å; I67-D114 WeakPolarHBondContact CG2-OD2 3.48Å; D71-D114 PolarHBondContact N-OD1 3.38Å; D71-D114 VanDerWaalsContact N-OD1 3.13Å; T110-D114 HydrophobicContact CG2-CB 4.46Å; T110-D114 WeakPolarHBondContact CG2-OD2 3.46Å; E112-D114 PolarHBondContact O-N 2.91Å; D114-R116 HydrophobicContact CB-CG 4.41Å; D114-R116 IonicContact OD2-CZ 3.92Å; D114-R116 IonicContact OD2-NE 3.69Å; D114-R116 IonicContact OD2-NH2 2.79Å; D114-R116 PolarHBondContact OD2-NH2 2.86Å; D114-S156 PolarHBondContact N-O 3.4Å; D114-L158 PolarHBondContact O-N 3.04Å
115	L	74.8	Confident	83.3	Confident	82 Å²	82	38.4 Å²	38.4	43%	0.429	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	113.2	165.1	-60.3	-173.9	0	0	0	109.2	D71 L72 R73 L158	D71-L115 PolarHBondContact O-N 2.93Å; L72-L115 HydrophobicContact CD2-CB 3.53Å; L72-L115 HydrophobicContact CD2-CD1 3.45Å; L72-L115 VanDerWaalsContact CD2-CD1 3.45Å; L72-L115 HydrophobicContact CD2-CG 3.64Å; R73-L115 PolarHBondContact N-O 2.87Å; L115-L158 HydrophobicContact CD2-CB 3.5Å; L115-L158 VanDerWaalsContact CD2-CB 3.5Å; L115-L158 HydrophobicContact CD2-CD1 3.22Å; L115-L158 HydrophobicContact CD2-CG 3.51Å
116	R	81	Confident	83.5	Confident	9 Å²	9	35.7 Å²	35.7	3%	0.034	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.2	-179.6	-59.4	-174.3	-174.7	-177	3.3	111.5	I67 D114 L158 R159 N160	I67-R116 VanDerWaalsContact CG1-NH2 3.3Å; D114-R116 HydrophobicContact CB-CG 4.41Å; D114-R116 IonicContact OD2-CZ 3.92Å; D114-R116 IonicContact OD2-NE 3.69Å; D114-R116 IonicContact OD2-NH2 2.79Å; D114-R116 PolarHBondContact OD2-NH2 2.86Å; R116-L158 PolarHBondContact N-O 2.94Å; R116-R159 HydrophobicContact CB-CG 4.36Å; R116-N160 PolarHBondContact O-N 2.91Å
117	N	80.3	Confident	83.8	Confident	58 Å²	58	36 Å²	36	31%	0.31	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	108.7	167.6	-175.9	53.2	0	0	0	108.5	R73 N74 E75 N160	R73-N117 PolarHBondContact O-N 2.89Å; N74-N117 WeakPolarHBondContact CA-O 3.45Å; N74-N117 PolarHBondContact OD1-ND2 3.41Å; E75-N117 PolarHBondContact N-O 2.94Å; N117-N160 WeakPolarHBondContact CA-O 3.46Å; N117-N160 PolarHBondContact OD1-ND2 2.95Å; N117-N160 PolarHBondContact OD1-O 2.88Å
118	E	85.4	Confident	84.1	Confident	56 Å²	56	33.7 Å²	33.7	26%	0.262	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.6	-176.9	-60.8	-178	-165	0	0	108.4	E75 N160 E161 S162	E75-E118 HydrophobicContact CB-CG 4.38Å; E118-N160 PolarHBondContact N-O 3.37Å; E118-E161 HydrophobicContact CB-CG 4.37Å; E118-E161 WeakPolarHBondContact O-CA 3.38Å; E118-S162 PolarHBondContact O-N 2.86Å
119	S	84.2	Confident	84.6	Confident	51 Å²	51	37 Å²	37	36%	0.357	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	119.6	172.6	-174	0	0	0	0	109.9	E75 S76 E77 S162	E75-S119 PolarHBondContact O-N 3.33Å; S76-S119 CarbonylContact C-O 3.37Å; S76-S119 VanDerWaalsContact CA-O 3.31Å; S76-S119 WeakPolarHBondContact CA-O 3.33Å; E77-S119 PolarHBondContact N-O 2.9Å; S119-S162 WeakPolarHBondContact CA-O 3.16Å
120	E	89.2	Confident	85.1	Confident	60 Å²	60	35.2 Å²	35.2	28%	0.28	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.5	175.7	-172	171.2	164.9	0	0	110.1	E77 T122 S162 E163 K164	E77-E120 HydrophobicContact CB-CG 4.5Å; E120-T122 PolarHBondContact OE1-OG1 3.2Å; E120-S162 PolarHBondContact N-O 3.38Å; E120-E163 HydrophobicContact CB-CG 4.38Å; E120-K164 PolarHBondContact O-N 2.98Å
121	K	88.3	Confident	85.8	Confident	76 Å²	76	38.5 Å²	38.5	33%	0.33	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	111.3	171.7	-175.6	-177.4	175	-178.7	0	110.9	E77 K78 N79 K164	E77-K121 PolarHBondContact O-N 2.91Å; K78-K121 WeakPolarHBondContact CA-O 3.37Å; K78-K121 HydrophobicContact CG-CB 4.49Å; N79-K121 PolarHBondContact N-O 2.97Å; K121-K164 WeakPolarHBondContact CA-O 3.44Å
122	T	92.1	Very high	86.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.2	-179.1	-67.9	0	0	0	0	110.5	E102 E120 Q124 K164 T166	E102-T122 WeakPolarHBondContact OE2-CG2 3.36Å; E120-T122 PolarHBondContact OE1-OG1 3.2Å; T122-Q124 HydrophobicContact CG2-CG 4.02Å; T122-K164 PolarHBondContact N-O 2.91Å; T122-T166 PolarHBondContact O-N 2.91Å; T122-T166 VanDerWaalsContact O-N 3.07Å
123	T	92.9	Very high	87.5	Confident	31 Å²	31	34.8 Å²	34.8	19%	0.19	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	112	179.3	-61.8	0	0	0	0	110.3	N79 S80 Q81 T125 T166	N79-T123 PolarHBondContact O-N 2.93Å; N79-T123 VanDerWaalsContact O-N 3.1Å; S80-T123 CarbonylContact C-O 3.29Å; S80-T123 VanDerWaalsContact CA-O 3.32Å; S80-T123 WeakPolarHBondContact CA-O 3.47Å; Q81-T123 PolarHBondContact N-O 2.91Å; T123-T125 HydrophobicContact CG2-CG2 3.84Å; T123-T166 WeakPolarHBondContact CA-O 3.49Å
124	Q	93.6	Very high	88.4	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117	-176.4	-57.6	-178.6	27.1	0	0	110.3	Q81 V100 E102 T122 V143 E145 T166 Q167 T168	Q81-Q124 WeakPolarHBondContact O-CA 3.21Å; V100-Q124 HydrophobicContact CG1-CB 4.15Å; V100-Q124 HydrophobicContact CG1-CG 3.87Å; E102-Q124 PolarHBondContact OE2-NE2 2.98Å; T122-Q124 HydrophobicContact CG2-CG 4.02Å; Q124-V143 HydrophobicContact CB-CG1 4.45Å; Q124-V143 HydrophobicContact CB-CG2 3.9Å; Q124-E145 PolarHBondContact NE2-OE2 2.96Å; Q124-T166 PolarHBondContact N-O 3.37Å; Q124-Q167 HydrophobicContact CB-CG 4.49Å; Q124-Q167 WeakPolarHBondContact O-CA 3.36Å; Q124-T168 PolarHBondContact O-N 2.99Å
125	T	93.9	Very high	89.1	Confident	21 Å²	21	36.2 Å²	36.2	13%	0.129	19%	0.191	C	C	.	.			trans	-133.7	65.4	-171.9	69	0	0	0	0	111.8	Q81 T82 T123 E127 T168	Q81-T125 PolarHBondContact O-N 3.42Å; T82-T125 WeakPolarHBondContact CB-OG1 3.4Å; T82-T125 VanDerWaalsContact CG2-OG1 3.23Å; T82-T125 WeakPolarHBondContact CG2-OG1 3.44Å; T82-T125 PolarHBondContact OG1-OG1 2.69Å; T123-T125 HydrophobicContact CG2-CG2 3.84Å; T125-E127 PolarHBondContact O-N 2.99Å; T125-T168 WeakPolarHBondContact CG2-OG1 3.48Å
126	P	91.9	Very high	89.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.			trans	-63.2	122	174.7	21.9	-28	0	0	0	110.7	P83 P98 V100 P141 V143 P169 E170	P83-P126 HydrophobicContact CG-CB 3.85Å; P98-P126 HydrophobicContact CB-CB 3.77Å; V100-P126 HydrophobicContact CG2-CB 4.2Å; V100-P126 HydrophobicContact CG2-CG 4.18Å; P126-P141 HydrophobicContact CB-CB 3.89Å; P126-P141 HydrophobicContact CG-CB 4.13Å; P126-P141 WeakPolarHBondContact O-CB 3.23Å; P126-V143 HydrophobicContact CG-CG2 3.65Å; P126-P169 HydrophobicContact CG-CB 3.82Å; P126-P169 WeakPolarHBondContact O-CA 3.43Å; P126-E170 PolarHBondContact O-N 2.95Å
127	E	93.3	Very high	90.6	Very high	29 Å²	29	35.7 Å²	35.7	14%	0.136	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.7	-174.8	-72	-156.5	-165.8	0	0	113.2	P83 E84 S85 P98 T125 R129 E170	P83-E127 PolarHBondContact O-N 3.25Å; E84-E127 HydrophobicContact CG-CB 4.36Å; S85-E127 PolarHBondContact N-O 3.08Å; P98-E127 WeakPolarHBondContact CG-O 3.42Å; T125-E127 PolarHBondContact O-N 2.99Å; E127-R129 IonicContact OE1-NH2 3.06Å; E127-R129 IonicContact OE2-CZ 3.28Å; E127-R129 IonicContact OE2-NE 3.05Å; E127-R129 PolarHBondContact OE2-NE 3.38Å; E127-R129 IonicContact OE2-NH2 2.69Å; E127-R129 PolarHBondContact OE2-NH2 3.2Å; E127-E170 HydrophobicContact CG-CB 4.36Å
128	S	92.5	Very high	91.3	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.2	173.6	-61.2	0	0	0	0	111.8	I96 P98 I139 E170 R172	I96-S128 WeakPolarHBondContact CG2-OG 3.22Å; P98-S128 WeakPolarHBondContact CD-OG 3.35Å; P98-S128 WeakPolarHBondContact CG-OG 3.08Å; S128-I139 WeakPolarHBondContact OG-CG2 3.29Å; S128-E170 PolarHBondContact N-O 3.09Å; S128-R172 PolarHBondContact O-N 2.91Å
129	R	92.3	Very high	91.7	Very high	86 Å²	86	33 Å²	33	33%	0.325	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	116.4	178.1	-57.5	-176.3	-175.6	-166.3	2.8	110.9	S85 R86 L87 E127 R172	S85-R129 PolarHBondContact O-N 2.83Å; R86-R129 WeakPolarHBondContact CA-O 3.12Å; R86-R129 HydrophobicContact CG-CB 4.42Å; L87-R129 PolarHBondContact N-O 2.86Å; E127-R129 IonicContact OE1-NH2 3.06Å; E127-R129 IonicContact OE2-CZ 3.28Å; E127-R129 IonicContact OE2-NE 3.05Å; E127-R129 PolarHBondContact OE2-NE 3.38Å; E127-R129 IonicContact OE2-NH2 2.69Å; E127-R129 PolarHBondContact OE2-NH2 3.2Å; R129-R172 HydrophobicContact CG-CB 4.5Å
130	L	92.1	Very high	92.2	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	119.4	174.2	177.6	56	0	0	0	109.8	L87 V94 I96 V137 I139 R172 L173 N174	L87-L130 HydrophobicContact CB-CD1 3.79Å; L87-L130 HydrophobicContact CD2-CD1 3.74Å; L87-L130 HydrophobicContact CG-CD1 3.66Å; L87-L130 WeakPolarHBondContact O-CA 3.48Å; L87-L130 WeakPolarHBondContact O-CD1 3.43Å; V94-L130 HydrophobicContact CB-CD2 4.32Å; V94-L130 HydrophobicContact CG1-CD2 3.95Å; I96-L130 HydrophobicContact CD1-CB 4.19Å; L130-V137 HydrophobicContact CD2-CB 4.36Å; L130-V137 HydrophobicContact CD2-CG1 3.61Å; L130-V137 HydrophobicContact CD2-CG2 3.75Å; L130-I139 HydrophobicContact CB-CD1 4.16Å; L130-I139 HydrophobicContact CD2-CD1 4.43Å; L130-R172 PolarHBondContact N-O 3.31Å; L130-L173 HydrophobicContact CB-CD1 3.78Å; L130-L173 HydrophobicContact CD2-CD1 3.74Å; L130-L173 HydrophobicContact CG-CD1 3.55Å; L130-L173 WeakPolarHBondContact O-CA 3.5Å; L130-L173 WeakPolarHBondContact O-CD1 3.24Å; L130-N174 PolarHBondContact O-N 3.01Å; L130-N174 VanDerWaalsContact O-N 3.08Å
131	N	91.7	Very high	92.4	Very high	70 Å²	70	28.9 Å²	28.9	37%	0.374	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-43.9	-177.2	-177.4	36.4	0	0	0	112	L87 N88 N174 S175	L87-N131 PolarHBondContact O-N 2.9Å; L87-N131 VanDerWaalsContact O-N 3.11Å; N88-N131 WeakPolarHBondContact O-CB 3.37Å; N88-N131 PolarHBondContact OD1-ND2 3.1Å; N131-N174 WeakPolarHBondContact O-CB 3.29Å; N131-N174 PolarHBondContact OD1-ND2 2.95Å; N131-S175 PolarHBondContact O-N 2.98Å
132	S	90.8	Very high	92.8	Very high	37 Å²	37	26.6 Å²	26.6	26%	0.259	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	141.9	176.4	-175.6	0	0	0	0	112.5	N88 S89 S90 S175	N88-S132 PolarHBondContact O-N 2.86Å; S89-S132 WeakPolarHBondContact CA-O 3.4Å; S90-S132 PolarHBondContact N-O 3.02Å; S90-S132 VanDerWaalsContact N-O 3.17Å; S132-S175 WeakPolarHBondContact CA-O 3.38Å
133	S	90.9	Very high	93	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.4	172.6	-168.6	0	0	0	0	112.4	S90 V137 S175 S176 N177	S90-S133 WeakPolarHBondContact O-CA 3.47Å; S133-V137 WeakPolarHBondContact OG-CG2 3.12Å; S133-S175 PolarHBondContact N-O 3.01Å; S133-S176 WeakPolarHBondContact O-CA 3.31Å; S133-N177 PolarHBondContact O-N 3Å
134	N	89.7	Confident	93	Very high	71 Å²	71	26.9 Å²	26.9	38%	0.38	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	94.5	164.7	-65.1	-42.4	0	0	0	108.2	S90 N91 G92 N177	S90-N134 PolarHBondContact O-N 2.8Å; N91-N134 PolarHBondContact OD1-ND2 3.44Å; G92-N134 PolarHBondContact N-O 3.44Å; N134-N177 PolarHBondContact OD1-ND2 3.31Å
135	G	89.7	Confident	93	Very high	17 Å²	17	27.3 Å²	27.3	18%	0.175	15%	0.149	C	C	.	.	S	Bend	trans	146.4	-175.5	-170.6	0	0	0	0	0	111.4	N177	G135-N177 PolarHBondContact N-O 2.95Å
136	N	92.9	Very high	92.8	Very high	76 Å²	76	30.1 Å²	30.1	41%	0.406	16%	0.161	S	C	.	.			trans	-78.7	139.1	178.3	-65.3	-22.2	0	0	0	110.6	N93 V94 N179	N93-N136 WeakPolarHBondContact CA-O 2.94Å; N93-N136 PolarHBondContact OD1-N 3.23Å; V94-N136 PolarHBondContact N-O 3.09Å; N136-N179 WeakPolarHBondContact CA-O 3.17Å; N136-N179 PolarHBondContact OD1-N 2.9Å
137	V	94.2	Very high	92.7	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.024	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.8	-178.4	174.7	0	0	0	0	109.3	L130 S133 I139 L173 N179 V180 L181	L130-V137 HydrophobicContact CD2-CB 4.36Å; L130-V137 HydrophobicContact CD2-CG1 3.61Å; L130-V137 HydrophobicContact CD2-CG2 3.75Å; S133-V137 WeakPolarHBondContact OG-CG2 3.12Å; V137-I139 HydrophobicContact CG1-CD1 3.74Å; V137-I139 HydrophobicContact CG1-CG1 3.65Å; V137-L173 HydrophobicContact CB-CD2 4.37Å; V137-L173 HydrophobicContact CG1-CD2 3.92Å; V137-N179 PolarHBondContact N-O 2.97Å; V137-V180 HydrophobicContact CB-CG2 4.42Å; V137-V180 WeakPolarHBondContact O-CA 2.95Å; V137-L181 PolarHBondContact O-N 2.67Å
138	L	95	Very high	92.6	Very high	57 Å²	57	32.9 Å²	32.9	30%	0.298	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	118.9	170.7	177.4	53.2	0	0	0	108.9	V94 L95 I96 T140 L181	V94-L138 PolarHBondContact O-N 3Å; L95-L138 WeakPolarHBondContact CA-O 3.36Å; L95-L138 HydrophobicContact CD1-CB 3.81Å; L95-L138 HydrophobicContact CD1-CD2 3.56Å; L95-L138 HydrophobicContact CD1-CG 3.47Å; L95-L138 VanDerWaalsContact CD1-CG 3.47Å; I96-L138 PolarHBondContact N-O 3.03Å; L138-T140 HydrophobicContact CD1-CG2 3.35Å; L138-T140 HydrophobicContact CG-CG2 3.87Å; L138-L181 WeakPolarHBondContact CA-O 3.04Å; L138-L181 HydrophobicContact CD1-CB 3.77Å; L138-L181 HydrophobicContact CD1-CD2 3.55Å; L138-L181 HydrophobicContact CD1-CG 3.45Å; L138-L181 VanDerWaalsContact CD1-CG 3.45Å
139	I	95.2	Very high	92.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	113.7	179.7	-57.5	174.9	0	0	0	108.9	I96 S128 L130 V137 S171 L173 L181 I182 T183	I96-I139 HydrophobicContact CB-CG1 4.46Å; I96-I139 WeakPolarHBondContact O-CA 3.21Å; S128-I139 WeakPolarHBondContact OG-CG2 3.29Å; L130-I139 HydrophobicContact CB-CD1 4.16Å; L130-I139 HydrophobicContact CD2-CD1 4.43Å; V137-I139 HydrophobicContact CG1-CD1 3.74Å; V137-I139 HydrophobicContact CG1-CG1 3.65Å; I139-S171 VanDerWaalsContact CG2-OG 3.22Å; I139-S171 WeakPolarHBondContact CG2-OG 3.45Å; I139-L173 HydrophobicContact CD1-CB 4.25Å; I139-L181 PolarHBondContact N-O 2.69Å; I139-I182 HydrophobicContact CB-CG1 4.45Å; I139-I182 WeakPolarHBondContact O-CA 3.37Å; I139-T183 PolarHBondContact O-N 3.01Å
140	T	94.6	Very high	92.2	Very high	25 Å²	25	33.1 Å²	33.1	15%	0.153	20%	0.196	C	C	.	.			trans	-137	71.3	-173	70.8	0	0	0	0	111.3	I96 T97 L138 T142 T183	I96-T140 PolarHBondContact O-N 2.95Å; T97-T140 WeakPolarHBondContact CG2-OG1 3.46Å; L138-T140 HydrophobicContact CD1-CG2 3.35Å; L138-T140 HydrophobicContact CG-CG2 3.87Å; T140-T142 PolarHBondContact O-N 2.87Å; T140-T142 PolarHBondContact O-OG1 2.7Å; T140-T183 WeakPolarHBondContact CA-O 3.42Å; T140-T183 WeakPolarHBondContact CG2-OG1 3.05Å
141	P	93.7	Very high	91.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.196	C	C	.	.			trans	-64.5	130.5	168.7	27.5	-32.9	0	0	0	109.2	P98 P126 P169 S171 P184 T185	P98-P141 HydrophobicContact CG-CB 4.46Å; P98-P141 VanDerWaalsContact O-CA 3.29Å; P98-P141 WeakPolarHBondContact O-CA 3.03Å; P126-P141 HydrophobicContact CB-CB 3.89Å; P126-P141 HydrophobicContact CG-CB 4.13Å; P126-P141 WeakPolarHBondContact O-CB 3.23Å; P141-P169 HydrophobicContact CB-CB 3.89Å; P141-P169 HydrophobicContact CG-CB 4.04Å; P141-S171 WeakPolarHBondContact CD-OG 3.06Å; P141-S171 WeakPolarHBondContact CG-OG 3.1Å; P141-P184 HydrophobicContact CG-CB 3.92Å; P141-P184 HydrophobicContact CG-CG 4.31Å; P141-P184 WeakPolarHBondContact O-CA 3.45Å; P141-T185 PolarHBondContact O-N 2.79Å
142	T	95.1	Very high	91.4	Very high	29 Å²	29	32.8 Å²	32.8	18%	0.178	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	133.2	-173.2	-55.1	0	0	0	0	110.2	P98 I99 V100 T140 V144 T185	P98-T142 PolarHBondContact O-N 3.03Å; I99-T142 WeakPolarHBondContact CA-O 3.39Å; V100-T142 PolarHBondContact N-O 2.95Å; T140-T142 PolarHBondContact O-N 2.87Å; T140-T142 PolarHBondContact O-OG1 2.7Å; T142-V144 HydrophobicContact CG2-CG2 3.87Å; T142-T185 WeakPolarHBondContact CA-O 3.25Å
143	V	96	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.8	165.2	166.9	0	0	0	0	107.8	V100 Q124 P126 Q167 T185 V186 V187	V100-V143 HydrophobicContact CB-CG2 4.39Å; Q124-V143 HydrophobicContact CB-CG1 4.45Å; Q124-V143 HydrophobicContact CB-CG2 3.9Å; P126-V143 HydrophobicContact CG-CG2 3.65Å; V143-Q167 HydrophobicContact CG1-CB 4.13Å; V143-Q167 VanDerWaalsContact CG1-CD 3.4Å; V143-Q167 HydrophobicContact CG1-CG 3.77Å; V143-Q167 HydrophobicContact CG2-CB 4.38Å; V143-T185 PolarHBondContact N-O 3.49Å; V143-V186 HydrophobicContact CB-CG2 4.37Å; V143-V187 PolarHBondContact O-N 3.34Å
144	V	93.3	Very high	90.3	Very high	36 Å²	36	33.3 Å²	33.3	22%	0.218	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	119.1	169	-177	0	0	0	0	108	V100 V101 E102 T142 Q146 V187	V100-V144 PolarHBondContact O-N 3.48Å; V101-V144 WeakPolarHBondContact CA-O 3.04Å; V101-V144 HydrophobicContact CG2-CB 4.47Å; E102-V144 PolarHBondContact N-O 2.84Å; T142-V144 HydrophobicContact CG2-CG2 3.87Å; V144-Q146 HydrophobicContact CG1-CG 4.29Å; V144-V187 WeakPolarHBondContact CA-O 3.04Å
145	E	93.3	Very high	89.6	Confident	11 Å²	11	33.3 Å²	33.3	5%	0.051	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.5	176.7	-169.2	167.2	160	0	0	109	E102 Q124 T165 Q167 V187 E188 Q189	E102-E145 WeakPolarHBondContact O-CA 3.33Å; Q124-E145 PolarHBondContact NE2-OE2 2.96Å; E145-T165 VanDerWaalsContact OE2-CG2 3.24Å; E145-T165 WeakPolarHBondContact OE2-CG2 3.5Å; E145-Q167 PolarHBondContact OE2-NE2 2.92Å; E145-V187 PolarHBondContact N-O 2.88Å; E145-E188 HydrophobicContact CB-CG 4.47Å; E145-E188 WeakPolarHBondContact O-CA 3.37Å; E145-Q189 PolarHBondContact O-N 3.03Å
146	Q	91.2	Very high	88.8	Confident	80 Å²	80	35 Å²	35	37%	0.374	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.1	174.9	-59.2	-169.5	-41.9	0	0	109.3	E102 L103 A104 V144 Q189	E102-Q146 PolarHBondContact O-N 2.99Å; L103-Q146 WeakPolarHBondContact CA-O 3.48Å; L103-Q146 HydrophobicContact CD2-CB 3.75Å; L103-Q146 HydrophobicContact CD2-CG 3.95Å; A104-Q146 PolarHBondContact N-O 2.93Å; V144-Q146 HydrophobicContact CG1-CG 4.29Å; Q146-Q189 WeakPolarHBondContact CA-O 3.46Å; Q146-Q189 HydrophobicContact CG-CB 4.37Å
147	A	90.2	Very high	88	Confident	27 Å²	27	31.4 Å²	31.4	22%	0.223	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.2	175.8	0	0	0	0	0	109.8	Q189 T191	A147-Q189 PolarHBondContact N-O 2.91Å; A147-T191 PolarHBondContact O-N 2.93Å
148	T	89.7	Confident	87.2	Confident	59 Å²	59	35.1 Å²	35.1	36%	0.362	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	116.1	169.8	-60	0	0	0	0	109.3	A104 T105 A106 T191	A104-T148 PolarHBondContact O-N 2.97Å; T105-T148 WeakPolarHBondContact CA-O 3.46Å; A106-T148 PolarHBondContact N-O 3.01Å; T148-T191 WeakPolarHBondContact CA-O 3.36Å
149	T	89.6	Confident	86.6	Confident	41 Å²	41	32.8 Å²	32.8	25%	0.252	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.3	179.2	-59.5	0	0	0	0	109.2	A106 T191 S193	A106-T149 HydrophobicContact CB-CG2 4.41Å; A106-T149 WeakPolarHBondContact O-CA 2.89Å; T149-T191 PolarHBondContact N-O 2.78Å; T149-S193 PolarHBondContact O-N 3.12Å
150	S	86.9	Confident	86	Confident	51 Å²	51	35.7 Å²	35.7	36%	0.357	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	97.6	174.8	-68.4	0	0	0	0	109.1	A106 T107 S193	A106-S150 PolarHBondContact O-N 2.98Å; T107-S150 WeakPolarHBondContact CA-O 3Å; S150-S193 WeakPolarHBondContact CA-O 2.94Å
151	T	84.8	Confident	85.7	Confident	6 Å²	6	37 Å²	37	4%	0.037	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.2	-175.8	-66.4	0	0	0	0	109.8	P108 I153 R159 S193 T195	P108-T151 HydrophobicContact CG-CG2 4.3Å; P108-T151 WeakPolarHBondContact CG-OG1 3.43Å; T151-I153 HydrophobicContact CG2-CD1 3.94Å; T151-I153 HydrophobicContact CG2-CG1 3.71Å; T151-R159 VanDerWaalsContact CG2-NH1 3.26Å; T151-S193 PolarHBondContact N-O 2.82Å; T151-T195 PolarHBondContact O-N 3.49Å
152	T	83.1	Confident	85.4	Confident	61 Å²	61	39.4 Å²	39.4	37%	0.374	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.2	169.7	-57.1	0	0	0	0	109.5	P108 S109 T110 T195	P108-T152 PolarHBondContact O-N 2.75Å; P108-T152 VanDerWaalsContact O-N 3.09Å; S109-T152 WeakPolarHBondContact CA-O 3.46Å; T110-T152 PolarHBondContact N-O 2.72Å; T152-T195 WeakPolarHBondContact CA-O 3.5Å
153	I	80.3	Confident	85.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.7	179.1	-58.8	-170.4	0	0	0	108.5	T110 T151 E155 D157 R159 T195 I196 S197 D200	T110-I153 WeakPolarHBondContact OG1-CG1 3.31Å; T151-I153 HydrophobicContact CG2-CD1 3.94Å; T151-I153 HydrophobicContact CG2-CG1 3.71Å; I153-E155 WeakPolarHBondContact CG2-O 3.4Å; I153-D157 HydrophobicContact CD1-CB 3.91Å; I153-D157 HydrophobicContact CG2-CB 4.03Å; I153-R159 VanDerWaalsContact CD1-NH2 3.28Å; I153-T195 PolarHBondContact N-O 2.93Å; I153-I196 HydrophobicContact CB-CG1 4.27Å; I153-I196 HydrophobicContact CD1-CG1 4.47Å; I153-S197 PolarHBondContact O-N 2.79Å; I153-D200 WeakPolarHBondContact CD1-OD2 3.38Å
154	S	76.9	Confident	84.9	Confident	48 Å²	48	44.3 Å²	44.3	34%	0.336	25%	0.251	S	S	.	.			trans	-101.9	-18.8	177.7	-61.1	0	0	0	0	113.8	T110 E198	T110-S154 PolarHBondContact O-N 3.41Å; S154-E198 WeakPolarHBondContact O-CB 3.41Å; S154-E198 WeakPolarHBondContact O-CG 3.48Å
155	E	76.1	Confident	85	Confident	72 Å²	72	42.6 Å²	42.6	34%	0.336	24%	0.24	S	C	.	.	S	Bend	trans	-141.9	-178	-179.1	-69.4	-162.5	-176.1	0	0	111.9	S111 E112 I153 D157 E198	S111-E155 VanDerWaalsContact O-CG 3.22Å; S111-E155 WeakPolarHBondContact O-CG 3.33Å; E112-E155 WeakPolarHBondContact CA-OE2 3.12Å; I153-E155 WeakPolarHBondContact CG2-O 3.4Å; E155-D157 PolarHBondContact O-N 2.98Å; E155-D157 VanDerWaalsContact O-N 3.12Å; E155-E198 WeakPolarHBondContact CA-OE2 3.31Å
156	S	72	Confident	85	Confident	52 Å²	52	43.5 Å²	43.5	36%	0.364	25%	0.247	S	C	.	.			trans	-54.2	105.5	-175.2	-65.5	0	0	0	0	115.2	S113 D114 S199	S113-S156 WeakPolarHBondContact CA-O 3.37Å; D114-S156 PolarHBondContact N-O 3.4Å; S156-S199 VanDerWaalsContact CA-O 3.23Å; S156-S199 WeakPolarHBondContact CA-O 2.98Å
157	D	76.6	Confident	85.3	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	138	176.5	-154.5	-24.6	0	0	0	110.4	T110 I153 E155 R159 S199 D200 L201	T110-D157 WeakPolarHBondContact CG2-OD2 3.37Å; T110-D157 PolarHBondContact OG1-OD2 3.16Å; I153-D157 HydrophobicContact CD1-CB 3.91Å; I153-D157 HydrophobicContact CG2-CB 4.03Å; E155-D157 PolarHBondContact O-N 2.98Å; E155-D157 VanDerWaalsContact O-N 3.12Å; D157-R159 VanDerWaalsContact CG-NE 3.28Å; D157-R159 VanDerWaalsContact OD1-CG 3.26Å; D157-R159 WeakPolarHBondContact OD1-CG 2.95Å; D157-R159 IonicContact OD1-NE 2.79Å; D157-R159 PolarHBondContact OD1-NE 2.98Å; D157-R159 IonicContact OD2-CZ 3.89Å; D157-R159 IonicContact OD2-NE 3.52Å; D157-R159 PolarHBondContact OD2-NE 2.62Å; D157-R159 IonicContact OD2-NH2 3Å; D157-R159 PolarHBondContact OD2-NH2 3.43Å; D157-S199 PolarHBondContact N-O 2.96Å; D157-D200 VanDerWaalsContact O-OD1 3.06Å; D157-L201 PolarHBondContact O-N 2.71Å
158	L	78.3	Confident	85.5	Confident	82 Å²	82	39.6 Å²	39.6	43%	0.429	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	111.7	166.8	-43.7	178	0	0	0	108.4	D114 L115 R116 L201	D114-L158 PolarHBondContact O-N 3.04Å; L115-L158 HydrophobicContact CD2-CB 3.5Å; L115-L158 VanDerWaalsContact CD2-CB 3.5Å; L115-L158 HydrophobicContact CD2-CD1 3.22Å; L115-L158 HydrophobicContact CD2-CG 3.51Å; R116-L158 PolarHBondContact N-O 2.94Å; L158-L201 WeakPolarHBondContact CA-O 3.04Å; L158-L201 HydrophobicContact CD2-CB 3.46Å; L158-L201 VanDerWaalsContact CD2-CB 3.46Å; L158-L201 HydrophobicContact CD2-CD2 3.93Å; L158-L201 HydrophobicContact CD2-CG 4.31Å
159	R	82.4	Confident	85.7	Confident	7 Å²	7	36.8 Å²	36.8	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.3	-178.2	-58.7	-163.4	-177.4	169.1	7.6	112	R116 T151 I153 D157 E161 L201 R202 N203	R116-R159 HydrophobicContact CB-CG 4.36Å; T151-R159 VanDerWaalsContact CG2-NH1 3.26Å; I153-R159 VanDerWaalsContact CD1-NH2 3.28Å; D157-R159 VanDerWaalsContact CG-NE 3.28Å; D157-R159 VanDerWaalsContact OD1-CG 3.26Å; D157-R159 WeakPolarHBondContact OD1-CG 2.95Å; D157-R159 IonicContact OD1-NE 2.79Å; D157-R159 PolarHBondContact OD1-NE 2.98Å; D157-R159 IonicContact OD2-CZ 3.89Å; D157-R159 IonicContact OD2-NE 3.52Å; D157-R159 PolarHBondContact OD2-NE 2.62Å; D157-R159 IonicContact OD2-NH2 3Å; D157-R159 PolarHBondContact OD2-NH2 3.43Å; R159-E161 HydrophobicContact CB-CG 4.48Å; R159-E161 VanDerWaalsContact CD-OE1 3.3Å; R159-E161 WeakPolarHBondContact CD-OE1 3.25Å; R159-E161 IonicContact NH1-OE1 3.68Å; R159-L201 PolarHBondContact N-O 2.99Å; R159-R202 HydrophobicContact CB-CG 4.42Å; R159-N203 PolarHBondContact O-N 2.83Å
160	N	82.9	Confident	85.9	Confident	61 Å²	61	36.3 Å²	36.3	33%	0.326	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	107.8	166.3	-176.6	59.2	0	0	0	108.4	R116 N117 E118 N203	R116-N160 PolarHBondContact O-N 2.91Å; N117-N160 WeakPolarHBondContact CA-O 3.46Å; N117-N160 PolarHBondContact OD1-ND2 2.95Å; N117-N160 PolarHBondContact OD1-O 2.88Å; E118-N160 PolarHBondContact N-O 3.37Å; N160-N203 WeakPolarHBondContact CA-O 2.8Å; N160-N203 PolarHBondContact OD1-ND2 2.86Å; N160-N203 PolarHBondContact OD1-O 3.19Å
161	E	87.3	Confident	86.2	Confident	52 Å²	52	33.9 Å²	33.9	24%	0.243	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.3	-176.6	-61.2	-179.6	-166.8	0	0	108.6	E118 R159 N203 E204 S205	E118-E161 HydrophobicContact CB-CG 4.37Å; E118-E161 WeakPolarHBondContact O-CA 3.38Å; R159-E161 HydrophobicContact CB-CG 4.48Å; R159-E161 VanDerWaalsContact CD-OE1 3.3Å; R159-E161 WeakPolarHBondContact CD-OE1 3.25Å; R159-E161 IonicContact NH1-OE1 3.68Å; E161-N203 PolarHBondContact N-O 2.89Å; E161-E204 HydrophobicContact CB-CG 4.32Å; E161-E204 WeakPolarHBondContact O-CA 3.15Å; E161-S205 PolarHBondContact O-N 2.91Å
162	S	86.5	Confident	86.7	Confident	51 Å²	51	37.8 Å²	37.8	36%	0.357	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	114.3	173.4	-173.4	0	0	0	0	110.7	E118 S119 E120 S205	E118-S162 PolarHBondContact O-N 2.86Å; S119-S162 WeakPolarHBondContact CA-O 3.16Å; E120-S162 PolarHBondContact N-O 3.38Å; S162-S205 WeakPolarHBondContact CA-O 3.47Å
163	E	91.8	Very high	87.2	Confident	55 Å²	55	35 Å²	35	26%	0.257	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	136	176.3	-165.4	-179.6	146.6	0	0	110.5	E120 T165 S205 E206 K207	E120-E163 HydrophobicContact CB-CG 4.38Å; E163-T165 PolarHBondContact OE1-OG1 2.92Å; E163-S205 PolarHBondContact N-O 3.07Å; E163-E206 HydrophobicContact CB-CG 4.34Å; E163-K207 PolarHBondContact O-N 3.06Å
164	K	90.7	Very high	87.8	Confident	77 Å²	77	38.4 Å²	38.4	34%	0.335	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	109.4	170.9	-175.2	-177.1	174.8	180	0	111.3	E120 K121 T122	E120-K164 PolarHBondContact O-N 2.98Å; K121-K164 WeakPolarHBondContact CA-O 3.44Å; T122-K164 PolarHBondContact N-O 2.91Å
165	T	93.8	Very high	88.5	Confident	1 Å²	1	38 Å²	38	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.7	-179.7	-65	0	0	0	0	110.5	E145 E163 Q167 K207 T209	E145-T165 VanDerWaalsContact OE2-CG2 3.24Å; E145-T165 WeakPolarHBondContact OE2-CG2 3.5Å; E163-T165 PolarHBondContact OE1-OG1 2.92Å; T165-Q167 HydrophobicContact CG2-CG 3.95Å; T165-K207 PolarHBondContact N-O 3Å; T165-T209 PolarHBondContact O-N 2.85Å
166	T	94.4	Very high	89.3	Confident	29 Å²	29	34.5 Å²	34.5	18%	0.178	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	114.3	179.1	-61.8	0	0	0	0	109.8	T122 T123 Q124 T168 T209	T122-T166 PolarHBondContact O-N 2.91Å; T122-T166 VanDerWaalsContact O-N 3.07Å; T123-T166 WeakPolarHBondContact CA-O 3.49Å; Q124-T166 PolarHBondContact N-O 3.37Å; T166-T168 HydrophobicContact CG2-CG2 3.87Å; T166-T209 WeakPolarHBondContact CA-O 3.32Å
167	Q	96	Very high	90.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	115.1	-175.1	-58.3	172.2	20	0	0	109.7	Q124 V143 E145 T165 V186 E188 T209 Q210 T211	Q124-Q167 HydrophobicContact CB-CG 4.49Å; Q124-Q167 WeakPolarHBondContact O-CA 3.36Å; V143-Q167 HydrophobicContact CG1-CB 4.13Å; V143-Q167 VanDerWaalsContact CG1-CD 3.4Å; V143-Q167 HydrophobicContact CG1-CG 3.77Å; V143-Q167 HydrophobicContact CG2-CB 4.38Å; E145-Q167 PolarHBondContact OE2-NE2 2.92Å; T165-Q167 HydrophobicContact CG2-CG 3.95Å; Q167-V186 HydrophobicContact CB-CG2 3.94Å; Q167-E188 PolarHBondContact NE2-OE2 2.9Å; Q167-E188 VanDerWaalsContact NE2-OE2 3.08Å; Q167-T209 PolarHBondContact N-O 3.06Å; Q167-Q210 WeakPolarHBondContact O-CA 3.47Å; Q167-T211 PolarHBondContact O-N 3.11Å
168	T	94.9	Very high	90.8	Very high	25 Å²	25	36.2 Å²	36.2	15%	0.153	19%	0.191	C	C	.	.			trans	-132	70	-173.2	73.2	0	0	0	0	111.3	Q124 T125 T166 E170 T211	Q124-T168 PolarHBondContact O-N 2.99Å; T125-T168 WeakPolarHBondContact CG2-OG1 3.48Å; T166-T168 HydrophobicContact CG2-CG2 3.87Å; T168-E170 PolarHBondContact O-N 3.02Å; T168-T211 WeakPolarHBondContact CG2-OG1 3.43Å
169	P	93.5	Very high	91.5	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.			trans	-65.8	121.2	173.7	28.2	-33.3	0	0	0	109.6	P126 P141 P184 V186 P212 E213	P126-P169 HydrophobicContact CG-CB 3.82Å; P126-P169 WeakPolarHBondContact O-CA 3.43Å; P141-P169 HydrophobicContact CB-CB 3.89Å; P141-P169 HydrophobicContact CG-CB 4.04Å; P169-P184 HydrophobicContact CB-CB 3.92Å; P169-P184 HydrophobicContact CG-CB 3.96Å; P169-P184 WeakPolarHBondContact O-CB 3.27Å; P169-V186 HydrophobicContact CG-CG2 3.77Å; P169-P212 HydrophobicContact CG-CB 3.79Å; P169-E213 PolarHBondContact O-N 2.94Å
170	E	94.8	Very high	92.1	Very high	30 Å²	30	35.8 Å²	35.8	14%	0.14	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.9	-174.6	-73.2	-157.3	-164.3	0	0	112.7	P126 E127 S128 T168 R172 E213	P126-E170 PolarHBondContact O-N 2.95Å; E127-E170 HydrophobicContact CG-CB 4.36Å; S128-E170 PolarHBondContact N-O 3.09Å; T168-E170 PolarHBondContact O-N 3.02Å; E170-R172 IonicContact OE1-NH2 2.74Å; E170-R172 IonicContact OE2-CZ 2.7Å; E170-R172 IonicContact OE2-NE 2.78Å; E170-R172 PolarHBondContact OE2-NE 2.71Å; E170-R172 IonicContact OE2-NH2 3.08Å; E170-R172 PolarHBondContact OE2-NH2 2.7Å; E170-E213 HydrophobicContact CG-CB 4.34Å
171	S	94.1	Very high	92.7	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	124.8	172.7	-66.1	0	0	0	0	112.3	I139 P141 E213 R215	I139-S171 VanDerWaalsContact CG2-OG 3.22Å; I139-S171 WeakPolarHBondContact CG2-OG 3.45Å; P141-S171 WeakPolarHBondContact CD-OG 3.06Å; P141-S171 WeakPolarHBondContact CG-OG 3.1Å; S171-E213 PolarHBondContact N-O 2.97Å; S171-R215 PolarHBondContact O-N 2.76Å
172	R	93.4	Very high	93.1	Very high	87 Å²	87	33.1 Å²	33.1	33%	0.328	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.2	177.5	-58.4	-176.9	-174.3	-166.9	2.5	110.7	S128 R129 L130 E170	S128-R172 PolarHBondContact O-N 2.91Å; R129-R172 HydrophobicContact CG-CB 4.5Å; L130-R172 PolarHBondContact N-O 3.31Å; E170-R172 IonicContact OE1-NH2 2.74Å; E170-R172 IonicContact OE2-CZ 2.7Å; E170-R172 IonicContact OE2-NE 2.78Å; E170-R172 PolarHBondContact OE2-NE 2.71Å; E170-R172 IonicContact OE2-NH2 3.08Å; E170-R172 PolarHBondContact OE2-NH2 2.7Å
173	L	94	Very high	93.5	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	118.2	173.7	178.3	56.2	0	0	0	110	L130 V137 I139 V180 I182 R215 L216 N217	L130-L173 HydrophobicContact CB-CD1 3.78Å; L130-L173 HydrophobicContact CD2-CD1 3.74Å; L130-L173 HydrophobicContact CG-CD1 3.55Å; L130-L173 WeakPolarHBondContact O-CA 3.5Å; L130-L173 WeakPolarHBondContact O-CD1 3.24Å; V137-L173 HydrophobicContact CB-CD2 4.37Å; V137-L173 HydrophobicContact CG1-CD2 3.92Å; I139-L173 HydrophobicContact CD1-CB 4.25Å; L173-V180 HydrophobicContact CD2-CB 4.33Å; L173-V180 HydrophobicContact CD2-CG1 3.58Å; L173-V180 HydrophobicContact CD2-CG2 3.73Å; L173-I182 HydrophobicContact CB-CD1 4.15Å; L173-I182 HydrophobicContact CD2-CD1 4.43Å; L173-R215 PolarHBondContact N-O 3.06Å; L173-L216 HydrophobicContact CB-CD1 3.8Å; L173-L216 HydrophobicContact CD2-CD1 3.72Å; L173-L216 HydrophobicContact CG-CD1 3.57Å; L173-L216 WeakPolarHBondContact O-CA 3.39Å; L173-L216 WeakPolarHBondContact O-CD1 3.24Å; L173-N217 PolarHBondContact O-N 3.38Å; L173-N217 VanDerWaalsContact O-N 3.09Å
174	N	92.8	Very high	93.6	Very high	71 Å²	71	29.2 Å²	29.2	38%	0.38	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-44.3	-178.1	-178	34.8	0	0	0	112	L130 N131 N217 S218	L130-N174 PolarHBondContact O-N 3.01Å; L130-N174 VanDerWaalsContact O-N 3.08Å; N131-N174 WeakPolarHBondContact O-CB 3.29Å; N131-N174 PolarHBondContact OD1-ND2 2.95Å; N174-N217 WeakPolarHBondContact O-CB 3.08Å; N174-N217 PolarHBondContact OD1-ND2 2.99Å; N174-S218 PolarHBondContact O-N 2.77Å
175	S	92.5	Very high	93.8	Very high	38 Å²	38	26.6 Å²	26.6	27%	0.266	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	142.9	175.9	-175	0	0	0	0	112.8	N131 S132 S133 S218	N131-S175 PolarHBondContact O-N 2.98Å; S132-S175 WeakPolarHBondContact CA-O 3.38Å; S133-S175 PolarHBondContact N-O 3.01Å; S175-S218 WeakPolarHBondContact CA-O 3.45Å
176	S	92.2	Very high	93.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	142.7	172.5	-168.1	0	0	0	0	112.4	S133 V180 S218 S219 N220	S133-S176 WeakPolarHBondContact O-CA 3.31Å; S176-V180 VanDerWaalsContact CB-CG2 3.42Å; S176-V180 WeakPolarHBondContact OG-CG2 3.11Å; S176-S218 PolarHBondContact N-O 2.92Å; S176-S219 WeakPolarHBondContact O-CA 3.37Å; S176-N220 PolarHBondContact O-N 3.34Å
177	N	90.6	Very high	93.9	Very high	70 Å²	70	26.8 Å²	26.8	37%	0.374	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	99.5	163.4	-64.3	-47.1	0	0	0	108.2	S133 N134 G135 N220	S133-N177 PolarHBondContact O-N 3Å; N134-N177 PolarHBondContact OD1-ND2 3.31Å; G135-N177 PolarHBondContact N-O 2.95Å; N177-N220 PolarHBondContact OD1-ND2 2.93Å
178	G	90	Very high	93.7	Very high	18 Å²	18	27.6 Å²	27.6	19%	0.186	15%	0.151	C	C	.	.	S	Bend	trans	142.5	-177.1	-169.8	0	0	0	0	0	111.3	N220	G178-N220 PolarHBondContact N-O 2.77Å
179	N	93.2	Very high	93.5	Very high	77 Å²	77	29.8 Å²	29.8	41%	0.412	16%	0.159	S	C	.	.			trans	-77.9	139.7	178.1	-65.5	-24.7	0	0	0	110.6	N136 V137 N222	N136-N179 WeakPolarHBondContact CA-O 3.17Å; N136-N179 PolarHBondContact OD1-N 2.9Å; V137-N179 PolarHBondContact N-O 2.97Å; N179-N222 WeakPolarHBondContact CA-O 3.14Å; N179-N222 PolarHBondContact OD1-N 3.31Å
180	V	94.5	Very high	93.3	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.024	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125.9	-179.2	176.4	0	0	0	0	109.5	V137 L173 S176 I182 L216 N222 V223 L224	V137-V180 HydrophobicContact CB-CG2 4.42Å; V137-V180 WeakPolarHBondContact O-CA 2.95Å; L173-V180 HydrophobicContact CD2-CB 4.33Å; L173-V180 HydrophobicContact CD2-CG1 3.58Å; L173-V180 HydrophobicContact CD2-CG2 3.73Å; S176-V180 VanDerWaalsContact CB-CG2 3.42Å; S176-V180 WeakPolarHBondContact OG-CG2 3.11Å; V180-I182 HydrophobicContact CG1-CD1 3.74Å; V180-I182 HydrophobicContact CG1-CG1 3.65Å; V180-L216 HydrophobicContact CB-CD2 4.44Å; V180-L216 HydrophobicContact CG1-CD2 4.03Å; V180-N222 PolarHBondContact N-O 2.94Å; V180-V223 HydrophobicContact CB-CG2 4.45Å; V180-V223 WeakPolarHBondContact O-CA 3.24Å; V180-L224 PolarHBondContact O-N 2.88Å
181	L	95.5	Very high	93.1	Very high	56 Å²	56	32.5 Å²	32.5	29%	0.293	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	119.5	170.1	176.3	53.7	0	0	0	108.8	V137 L138 I139 T183 L224	V137-L181 PolarHBondContact O-N 2.67Å; L138-L181 WeakPolarHBondContact CA-O 3.04Å; L138-L181 HydrophobicContact CD1-CB 3.77Å; L138-L181 HydrophobicContact CD1-CD2 3.55Å; L138-L181 HydrophobicContact CD1-CG 3.45Å; L138-L181 VanDerWaalsContact CD1-CG 3.45Å; I139-L181 PolarHBondContact N-O 2.69Å; L181-T183 HydrophobicContact CD1-CG2 3.35Å; L181-T183 HydrophobicContact CG-CG2 3.86Å; L181-L224 WeakPolarHBondContact CA-O 3.43Å; L181-L224 HydrophobicContact CD1-CB 3.77Å; L181-L224 HydrophobicContact CD1-CD2 3.55Å; L181-L224 HydrophobicContact CD1-CG 3.47Å; L181-L224 VanDerWaalsContact CD1-CG 3.47Å
182	I	96	Very high	92.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	114.3	179.2	-57.5	172.5	0	0	0	108.5	I139 L173 V180 P184 S214 L216 L224 I225 T226	I139-I182 HydrophobicContact CB-CG1 4.45Å; I139-I182 WeakPolarHBondContact O-CA 3.37Å; L173-I182 HydrophobicContact CB-CD1 4.15Å; L173-I182 HydrophobicContact CD2-CD1 4.43Å; V180-I182 HydrophobicContact CG1-CD1 3.74Å; V180-I182 HydrophobicContact CG1-CG1 3.65Å; I182-P184 HydrophobicContact CG2-CG 4.34Å; I182-S214 VanDerWaalsContact CG2-OG 3.26Å; I182-S214 WeakPolarHBondContact CG2-OG 3.3Å; I182-L216 HydrophobicContact CD1-CB 4.23Å; I182-L224 PolarHBondContact N-O 3.08Å; I182-I225 WeakPolarHBondContact O-CA 3.14Å; I182-T226 PolarHBondContact O-N 2.73Å
183	T	95	Very high	92.5	Very high	24 Å²	24	32.6 Å²	32.6	15%	0.147	19%	0.193	C	C	.	.			trans	-135.7	76.7	-174.4	70.5	0	0	0	0	111.2	I139 T140 L181 T185 T226	I139-T183 PolarHBondContact O-N 3.01Å; T140-T183 WeakPolarHBondContact CA-O 3.42Å; T140-T183 WeakPolarHBondContact CG2-OG1 3.05Å; L181-T183 HydrophobicContact CD1-CG2 3.35Å; L181-T183 HydrophobicContact CG-CG2 3.86Å; T183-T185 PolarHBondContact O-N 3.48Å; T183-T185 PolarHBondContact O-OG1 3.45Å; T183-T226 WeakPolarHBondContact CG2-OG1 3.49Å
184	P	94.6	Very high	92	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.194	C	C	.	.			trans	-66.8	129.2	168.5	-10.9	27.7	0	0	0	108.5	P141 P169 I182 P212 E213 S214 P227 I228	P141-P184 HydrophobicContact CG-CB 3.92Å; P141-P184 HydrophobicContact CG-CG 4.31Å; P141-P184 WeakPolarHBondContact O-CA 3.45Å; P169-P184 HydrophobicContact CB-CB 3.92Å; P169-P184 HydrophobicContact CG-CB 3.96Å; P169-P184 WeakPolarHBondContact O-CB 3.27Å; I182-P184 HydrophobicContact CG2-CG 4.34Å; P184-P212 HydrophobicContact CB-CB 3.82Å; P184-E213 WeakPolarHBondContact CG-O 3.46Å; P184-S214 WeakPolarHBondContact CD-OG 3.01Å; P184-S214 WeakPolarHBondContact CG-OG 3.3Å; P184-P227 WeakPolarHBondContact O-CA 3.34Å; P184-I228 PolarHBondContact O-N 3.02Å
185	T	95.2	Very high	91.5	Very high	23 Å²	23	32.6 Å²	32.6	14%	0.141	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.7	-173.6	-57.8	0	0	0	0	110.3	P141 T142 V143 T183 V187 I228	P141-T185 PolarHBondContact O-N 2.79Å; T142-T185 WeakPolarHBondContact CA-O 3.25Å; V143-T185 PolarHBondContact N-O 3.49Å; T183-T185 PolarHBondContact O-N 3.48Å; T183-T185 PolarHBondContact O-OG1 3.45Å; T185-V187 HydrophobicContact CG2-CG2 3.85Å; T185-I228 WeakPolarHBondContact CA-O 3.16Å; T185-I228 HydrophobicContact CG2-CB 4.31Å; T185-I228 HydrophobicContact CG2-CG2 4.33Å
186	V	95.8	Very high	90.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.3	165.8	163.5	0	0	0	0	107.8	V143 Q167 P169 Q210 I228 V229 V230	V143-V186 HydrophobicContact CB-CG2 4.37Å; Q167-V186 HydrophobicContact CB-CG2 3.94Å; P169-V186 HydrophobicContact CG-CG2 3.77Å; V186-Q210 HydrophobicContact CG1-CB 4.15Å; V186-Q210 HydrophobicContact CG1-CG 3.76Å; V186-Q210 HydrophobicContact CG2-CB 4.39Å; V186-I228 PolarHBondContact N-O 2.76Å; V186-V229 HydrophobicContact CB-CG2 4.43Å; V186-V230 PolarHBondContact O-N 2.96Å
187	V	93.1	Very high	90.1	Very high	33 Å²	33	33 Å²	33	20%	0.2	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.3	168.5	-177.4	0	0	0	0	108.2	V143 V144 E145 T185 Q189 V230	V143-V187 PolarHBondContact O-N 3.34Å; V144-V187 WeakPolarHBondContact CA-O 3.04Å; E145-V187 PolarHBondContact N-O 2.88Å; T185-V187 HydrophobicContact CG2-CG2 3.85Å; V187-Q189 HydrophobicContact CG1-CG 4.32Å; V187-V230 WeakPolarHBondContact CA-O 3.05Å
188	E	92.8	Very high	89.4	Confident	19 Å²	19	33 Å²	33	9%	0.089	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128	177.8	-168.3	169	146.4	0	0	109.1	E145 Q167 T208 Q210 V230 L232	E145-E188 HydrophobicContact CB-CG 4.47Å; E145-E188 WeakPolarHBondContact O-CA 3.37Å; Q167-E188 PolarHBondContact NE2-OE2 2.9Å; Q167-E188 VanDerWaalsContact NE2-OE2 3.08Å; E188-T208 VanDerWaalsContact OE2-CG2 3.29Å; E188-T208 WeakPolarHBondContact OE2-CG2 3.42Å; E188-Q210 PolarHBondContact OE2-NE2 2.98Å; E188-V230 PolarHBondContact N-O 2.9Å; E188-L232 PolarHBondContact O-N 2.99Å
189	Q	90.4	Very high	88.6	Confident	70 Å²	70	34.6 Å²	34.6	33%	0.327	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.3	177.7	-63.4	-174.7	-13	0	0	109.5	E145 Q146 A147 V187 L232	E145-Q189 PolarHBondContact O-N 3.03Å; Q146-Q189 WeakPolarHBondContact CA-O 3.46Å; Q146-Q189 HydrophobicContact CG-CB 4.37Å; A147-Q189 PolarHBondContact N-O 2.91Å; V187-Q189 HydrophobicContact CG1-CG 4.32Å; Q189-L232 WeakPolarHBondContact CA-O 3.46Å; Q189-L232 HydrophobicContact CG-CB 4.34Å; Q189-L232 HydrophobicContact CG-CD1 4.29Å
190	A	89.9	Confident	87.8	Confident	31 Å²	31	31.2 Å²	31.2	26%	0.256	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.7	177	0	0	0	0	0	110	L232 T234	A190-L232 PolarHBondContact N-O 2.67Å; A190-T234 PolarHBondContact O-N 2.79Å
191	T	89.5	Confident	87.1	Confident	56 Å²	56	34.7 Å²	34.7	34%	0.344	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.8	170	-60.4	0	0	0	0	109.3	A147 T148 T149	A147-T191 PolarHBondContact O-N 2.93Å; T148-T191 WeakPolarHBondContact CA-O 3.36Å; T149-T191 PolarHBondContact N-O 2.78Å
192	T	88.8	Confident	86.4	Confident	48 Å²	48	32.3 Å²	32.3	29%	0.294	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	120.5	179.7	-57.8	0	0	0	0	109.8	T234 A235 T236	T192-T234 PolarHBondContact N-O 2.66Å; T192-A235 WeakPolarHBondContact O-CA 3.04Å; T192-T236 PolarHBondContact O-N 2.88Å; T192-T236 PolarHBondContact O-OG1 2.67Å
193	S	85.7	Confident	85.8	Confident	43 Å²	43	35.3 Å²	35.3	30%	0.301	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	117.3	171.6	-68.7	0	0	0	0	108.5	T149 S150 T151 T236	T149-S193 PolarHBondContact O-N 3.12Å; S150-S193 WeakPolarHBondContact CA-O 2.94Å; T151-S193 PolarHBondContact N-O 2.82Å; S193-T236 PolarHBondContact OG-OG1 3.2Å
194	T	83.6	Confident	85.4	Confident	6 Å²	6	35.5 Å²	35.5	4%	0.037	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.3	-178.8	-72.6	0	0	0	0	108.2	I196 R202 S238	T194-I196 HydrophobicContact CG2-CD1 3.7Å; T194-I196 HydrophobicContact CG2-CG1 3.66Å; T194-R202 VanDerWaalsContact CG2-NH2 3.27Å; T194-R202 PolarHBondContact OG1-NH1 3.23Å; T194-S238 PolarHBondContact O-N 3.23Å
195	T	83	Confident	85	Confident	68 Å²	68	37.9 Å²	37.9	42%	0.417	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.3	167.9	-57.9	0	0	0	0	108.9	T151 T152 I153 S238	T151-T195 PolarHBondContact O-N 3.49Å; T152-T195 WeakPolarHBondContact CA-O 3.5Å; I153-T195 PolarHBondContact N-O 2.93Å; T195-S238 WeakPolarHBondContact CA-O 3.39Å
196	I	79.1	Confident	84.8	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.8	177.6	-64.9	164.3	0	0	0	107.9	I153 T194 E198 D200 R202 S238 T239 S240 D243	I153-I196 HydrophobicContact CB-CG1 4.27Å; I153-I196 HydrophobicContact CD1-CG1 4.47Å; T194-I196 HydrophobicContact CG2-CD1 3.7Å; T194-I196 HydrophobicContact CG2-CG1 3.66Å; I196-E198 WeakPolarHBondContact CG2-O 3.15Å; I196-D200 HydrophobicContact CD1-CB 4Å; I196-D200 WeakPolarHBondContact CD1-OD2 3.44Å; I196-D200 HydrophobicContact CG2-CB 4.02Å; I196-R202 VanDerWaalsContact CD1-NH2 3.3Å; I196-S238 PolarHBondContact N-O 2.97Å; I196-T239 HydrophobicContact CB-CG2 4.17Å; I196-T239 HydrophobicContact CD1-CG2 4.07Å; I196-S240 PolarHBondContact O-N 2.86Å; I196-S240 VanDerWaalsContact O-N 3.12Å; I196-S240 PolarHBondContact O-OG 2.79Å; I196-D243 WeakPolarHBondContact CD1-OD2 3.41Å
197	S	76.7	Confident	84.6	Confident	46 Å²	46	43.9 Å²	43.9	32%	0.322	25%	0.249	S	C	.	.			trans	-91.9	-30.9	177.2	-53.8	0	0	0	0	112.9	I153 S240 E241	I153-S197 PolarHBondContact O-N 2.79Å; S197-S240 VanDerWaalsContact CA-OG 3.27Å; S197-S240 WeakPolarHBondContact CA-OG 3.43Å; S197-S240 PolarHBondContact O-OG 3.38Å; S197-E241 WeakPolarHBondContact O-CB 3.25Å; S197-E241 WeakPolarHBondContact O-CG 3.03Å
198	E	76.2	Confident	84.6	Confident	69 Å²	69	42.6 Å²	42.6	32%	0.322	24%	0.241	S	C	.	.	S	Bend	trans	-130.2	-162.7	-173.5	-73.5	-165.2	-175.1	0	0	112.6	S154 E155 I196 E241	S154-E198 WeakPolarHBondContact O-CB 3.41Å; S154-E198 WeakPolarHBondContact O-CG 3.48Å; E155-E198 WeakPolarHBondContact CA-OE2 3.31Å; I196-E198 WeakPolarHBondContact CG2-O 3.15Å; E198-E241 WeakPolarHBondContact CA-OE2 3.05Å
199	S	72.5	Confident	84.6	Confident	52 Å²	52	43 Å²	43	36%	0.364	25%	0.245	S	C	.	.			trans	-63.1	134.2	-178.7	-61.8	0	0	0	0	113	S156 D157 S242	S156-S199 VanDerWaalsContact CA-O 3.23Å; S156-S199 WeakPolarHBondContact CA-O 2.98Å; D157-S199 PolarHBondContact N-O 2.96Å; S199-S242 VanDerWaalsContact CA-O 3.24Å; S199-S242 WeakPolarHBondContact CA-O 3.2Å
200	D	77	Confident	84.9	Confident	6 Å²	6	39.7 Å²	39.7	3%	0.032	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	139.9	175.7	-165.3	-5	0	0	0	110.1	I153 D157 I196 R202 S242 L244	I153-D200 WeakPolarHBondContact CD1-OD2 3.38Å; D157-D200 VanDerWaalsContact O-OD1 3.06Å; I196-D200 HydrophobicContact CD1-CB 4Å; I196-D200 WeakPolarHBondContact CD1-OD2 3.44Å; I196-D200 HydrophobicContact CG2-CB 4.02Å; D200-R202 WeakPolarHBondContact OD1-CG 3.23Å; D200-R202 IonicContact OD1-NE 3.34Å; D200-R202 IonicContact OD2-CZ 2.66Å; D200-R202 IonicContact OD2-NE 2.67Å; D200-R202 PolarHBondContact OD2-NE 2.78Å; D200-R202 IonicContact OD2-NH2 3.8Å; D200-R202 PolarHBondContact OD2-NH2 3.36Å; D200-S242 PolarHBondContact N-O 2.99Å; D200-L244 PolarHBondContact O-N 2.92Å
201	L	78.3	Confident	85.1	Confident	78 Å²	78	39.3 Å²	39.3	41%	0.408	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	109.7	170.3	-179.6	70.6	0	0	0	108.5	D157 L158 R159 L244	D157-L201 PolarHBondContact O-N 2.71Å; L158-L201 WeakPolarHBondContact CA-O 3.04Å; L158-L201 HydrophobicContact CD2-CB 3.46Å; L158-L201 VanDerWaalsContact CD2-CB 3.46Å; L158-L201 HydrophobicContact CD2-CD2 3.93Å; L158-L201 HydrophobicContact CD2-CG 4.31Å; R159-L201 PolarHBondContact N-O 2.99Å; L201-L244 WeakPolarHBondContact CA-O 3.21Å; L201-L244 HydrophobicContact CD1-CB 3.41Å; L201-L244 VanDerWaalsContact CD1-CB 3.41Å; L201-L244 HydrophobicContact CD1-CD1 3.85Å; L201-L244 HydrophobicContact CD1-CG 4.27Å
202	R	82.4	Confident	85.3	Confident	6 Å²	6	36.6 Å²	36.6	2%	0.023	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.6	178.3	-59	-156	-170.9	158.9	12.1	112.4	R159 T194 I196 D200 E204 L244 R245 N246	R159-R202 HydrophobicContact CB-CG 4.42Å; T194-R202 VanDerWaalsContact CG2-NH2 3.27Å; T194-R202 PolarHBondContact OG1-NH1 3.23Å; I196-R202 VanDerWaalsContact CD1-NH2 3.3Å; D200-R202 WeakPolarHBondContact OD1-CG 3.23Å; D200-R202 IonicContact OD1-NE 3.34Å; D200-R202 IonicContact OD2-CZ 2.66Å; D200-R202 IonicContact OD2-NE 2.67Å; D200-R202 PolarHBondContact OD2-NE 2.78Å; D200-R202 IonicContact OD2-NH2 3.8Å; D200-R202 PolarHBondContact OD2-NH2 3.36Å; R202-E204 HydrophobicContact CB-CG 4.42Å; R202-E204 WeakPolarHBondContact CD-OE1 3.45Å; R202-E204 IonicContact NH1-OE1 3.2Å; R202-L244 PolarHBondContact N-O 2.84Å; R202-R245 HydrophobicContact CB-CG 4.47Å; R202-N246 PolarHBondContact O-N 2.97Å
203	N	82.3	Confident	85.5	Confident	62 Å²	62	35.8 Å²	35.8	33%	0.332	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	104.7	164.7	-176.4	49.6	0	0	0	108.4	R159 N160 E161 N246	R159-N203 PolarHBondContact O-N 2.83Å; N160-N203 WeakPolarHBondContact CA-O 2.8Å; N160-N203 PolarHBondContact OD1-ND2 2.86Å; N160-N203 PolarHBondContact OD1-O 3.19Å; E161-N203 PolarHBondContact N-O 2.89Å; N203-N246 WeakPolarHBondContact CA-O 3.45Å; N203-N246 PolarHBondContact OD1-ND2 2.93Å
204	E	87	Confident	85.9	Confident	28 Å²	28	33.8 Å²	33.8	13%	0.131	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.4	-177.2	-64.2	176.3	-166.2	0	0	108.3	E161 R202 N246 E247 S248	E161-E204 HydrophobicContact CB-CG 4.32Å; E161-E204 WeakPolarHBondContact O-CA 3.15Å; R202-E204 HydrophobicContact CB-CG 4.42Å; R202-E204 WeakPolarHBondContact CD-OE1 3.45Å; R202-E204 IonicContact NH1-OE1 3.2Å; E204-N246 PolarHBondContact N-O 2.95Å; E204-E247 HydrophobicContact CB-CG 4.36Å; E204-S248 PolarHBondContact O-N 2.98Å
205	S	86.7	Confident	86.3	Confident	50 Å²	50	37.9 Å²	37.9	35%	0.35	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	115.5	173.7	-173.6	0	0	0	0	110.9	E161 S162 E163 S248	E161-S205 PolarHBondContact O-N 2.91Å; S162-S205 WeakPolarHBondContact CA-O 3.47Å; E163-S205 PolarHBondContact N-O 3.07Å; S205-S248 WeakPolarHBondContact CA-O 3.41Å
206	E	90.9	Very high	86.8	Confident	71 Å²	71	34.8 Å²	34.8	33%	0.332	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	134.5	179.5	-66.6	-177.5	-167	0	0	110.1	E163 S248 E249 K250	E163-E206 HydrophobicContact CB-CG 4.34Å; E206-S248 PolarHBondContact N-O 2.93Å; E206-E249 HydrophobicContact CB-CG 4.47Å; E206-K250 PolarHBondContact O-N 2.92Å
207	K	90	Very high	87.4	Confident	79 Å²	79	38.1 Å²	38.1	34%	0.343	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	105.9	174.6	-174.9	-175.8	173.6	179.7	0	111	E163 T165	E163-K207 PolarHBondContact O-N 3.06Å; T165-K207 PolarHBondContact N-O 3Å
208	T	93.3	Very high	88.1	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.037	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	133.1	177.3	-65.2	0	0	0	0	110.9	E188 Q210 K250 T252	E188-T208 VanDerWaalsContact OE2-CG2 3.29Å; E188-T208 WeakPolarHBondContact OE2-CG2 3.42Å; T208-Q210 HydrophobicContact CG2-CG 3.8Å; T208-Q210 VanDerWaalsContact CG2-NE2 3.32Å; T208-K250 PolarHBondContact N-O 3.06Å; T208-K250 VanDerWaalsContact N-O 3.11Å; T208-T252 PolarHBondContact O-N 2.98Å
209	T	94	Very high	88.8	Confident	28 Å²	28	34.2 Å²	34.2	17%	0.172	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	113.5	175.9	-62	0	0	0	0	109.7	T165 T166 Q167 T211 T252	T165-T209 PolarHBondContact O-N 2.85Å; T166-T209 WeakPolarHBondContact CA-O 3.32Å; Q167-T209 PolarHBondContact N-O 3.06Å; T209-T211 HydrophobicContact CG2-CG2 3.81Å; T209-T252 WeakPolarHBondContact CA-O 3.49Å
210	Q	95.7	Very high	89.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	114.5	-176	-59.6	172.1	17	0	0	109.5	Q167 V186 E188 T208 V229 E231 T252 Q253 T254	Q167-Q210 WeakPolarHBondContact O-CA 3.47Å; V186-Q210 HydrophobicContact CG1-CB 4.15Å; V186-Q210 HydrophobicContact CG1-CG 3.76Å; V186-Q210 HydrophobicContact CG2-CB 4.39Å; E188-Q210 PolarHBondContact OE2-NE2 2.98Å; T208-Q210 HydrophobicContact CG2-CG 3.8Å; T208-Q210 VanDerWaalsContact CG2-NE2 3.32Å; Q210-V229 HydrophobicContact CB-CG2 3.99Å; Q210-E231 PolarHBondContact NE2-OE2 2.59Å; Q210-E231 VanDerWaalsContact NE2-OE2 3.13Å; Q210-T252 PolarHBondContact N-O 3.09Å; Q210-Q253 WeakPolarHBondContact O-CA 3.32Å; Q210-T254 PolarHBondContact O-N 3.01Å
211	T	94.3	Very high	90.2	Very high	22 Å²	22	35.7 Å²	35.7	14%	0.135	19%	0.188	C	C	.	.			trans	-130.2	69.2	-173.7	73.4	0	0	0	0	111.3	Q167 T168 T209 E213 T254	Q167-T211 PolarHBondContact O-N 3.11Å; T168-T211 WeakPolarHBondContact CG2-OG1 3.43Å; T209-T211 HydrophobicContact CG2-CG2 3.81Å; T211-E213 PolarHBondContact O-N 2.91Å; T211-T254 WeakPolarHBondContact CB-OG1 3.45Å; T211-T254 WeakPolarHBondContact CG2-OG1 3.15Å
212	P	92.8	Very high	90.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.188	C	C	.	.			trans	-65.3	118.9	173.8	26.1	-31.3	0	0	0	109.9	P169 P184 P227 V229 P255 E256	P169-P212 HydrophobicContact CG-CB 3.79Å; P184-P212 HydrophobicContact CB-CB 3.82Å; P212-P227 HydrophobicContact CB-CB 3.84Å; P212-P227 HydrophobicContact CG-CB 3.96Å; P212-P227 WeakPolarHBondContact O-CB 3.36Å; P212-V229 HydrophobicContact CG-CG2 3.66Å; P212-P255 HydrophobicContact CG-CB 3.92Å; P212-E256 PolarHBondContact O-N 3.4Å
213	E	94	Very high	91.4	Very high	30 Å²	30	35.5 Å²	35.5	14%	0.14	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.2	-174.4	-73.8	-158	-162.2	0	0	112.6	P169 E170 S171 P184 T211 R215 E256	P169-E213 PolarHBondContact O-N 2.94Å; E170-E213 HydrophobicContact CG-CB 4.34Å; S171-E213 PolarHBondContact N-O 2.97Å; P184-E213 WeakPolarHBondContact CG-O 3.46Å; T211-E213 PolarHBondContact O-N 2.91Å; E213-R215 IonicContact OE1-NH2 3.01Å; E213-R215 IonicContact OE2-CZ 3.85Å; E213-R215 VanDerWaalsContact OE2-CZ 3.26Å; E213-R215 IonicContact OE2-NE 3.77Å; E213-R215 PolarHBondContact OE2-NE 2.89Å; E213-R215 IonicContact OE2-NH2 3.6Å; E213-R215 PolarHBondContact OE2-NH2 3.43Å; E213-E256 HydrophobicContact CG-CB 4.35Å
214	S	93.3	Very high	91.9	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.9	172.3	-66.6	0	0	0	0	112.3	I182 P184 I225 E256 R258	I182-S214 VanDerWaalsContact CG2-OG 3.26Å; I182-S214 WeakPolarHBondContact CG2-OG 3.3Å; P184-S214 WeakPolarHBondContact CD-OG 3.01Å; P184-S214 WeakPolarHBondContact CG-OG 3.3Å; S214-I225 WeakPolarHBondContact OG-CG2 3.13Å; S214-E256 PolarHBondContact N-O 2.69Å; S214-R258 PolarHBondContact O-N 2.73Å
215	R	92.7	Very high	92.2	Very high	92 Å²	92	34 Å²	34	35%	0.347	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	118	176.4	-58.3	-176.4	-172.9	-167.8	2.8	110.7	S171 L173 E213	S171-R215 PolarHBondContact O-N 2.76Å; L173-R215 PolarHBondContact N-O 3.06Å; E213-R215 IonicContact OE1-NH2 3.01Å; E213-R215 IonicContact OE2-CZ 3.85Å; E213-R215 VanDerWaalsContact OE2-CZ 3.26Å; E213-R215 IonicContact OE2-NE 3.77Å; E213-R215 PolarHBondContact OE2-NE 2.89Å; E213-R215 IonicContact OE2-NH2 3.6Å; E213-R215 PolarHBondContact OE2-NH2 3.43Å
216	L	93.4	Very high	92.5	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	119.6	174	175.8	57.2	0	0	0	109.9	L173 V180 I182 V223 I225 R258 L259 N260	L173-L216 HydrophobicContact CB-CD1 3.8Å; L173-L216 HydrophobicContact CD2-CD1 3.72Å; L173-L216 HydrophobicContact CG-CD1 3.57Å; L173-L216 WeakPolarHBondContact O-CA 3.39Å; L173-L216 WeakPolarHBondContact O-CD1 3.24Å; V180-L216 HydrophobicContact CB-CD2 4.44Å; V180-L216 HydrophobicContact CG1-CD2 4.03Å; I182-L216 HydrophobicContact CD1-CB 4.23Å; L216-V223 HydrophobicContact CD2-CB 4.35Å; L216-V223 HydrophobicContact CD2-CG1 3.58Å; L216-V223 HydrophobicContact CD2-CG2 3.77Å; L216-I225 HydrophobicContact CB-CD1 4.2Å; L216-I225 HydrophobicContact CD2-CD1 4.47Å; L216-R258 PolarHBondContact N-O 3.1Å; L216-L259 HydrophobicContact CB-CD1 3.8Å; L216-L259 HydrophobicContact CD2-CD1 3.65Å; L216-L259 HydrophobicContact CG-CD1 3.52Å; L216-L259 WeakPolarHBondContact O-CA 3.5Å; L216-L259 WeakPolarHBondContact O-CD1 3.22Å; L216-N260 PolarHBondContact O-N 2.88Å
217	N	91.9	Very high	92.6	Very high	71 Å²	71	29 Å²	29	38%	0.38	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-45.4	-177.6	-177.4	32.2	0	0	0	112	L173 N174 N260 S261	L173-N217 PolarHBondContact O-N 3.38Å; L173-N217 VanDerWaalsContact O-N 3.09Å; N174-N217 WeakPolarHBondContact O-CB 3.08Å; N174-N217 PolarHBondContact OD1-ND2 2.99Å; N217-N260 WeakPolarHBondContact O-CB 3.41Å; N217-N260 PolarHBondContact OD1-ND2 2.73Å; N217-S261 PolarHBondContact O-N 3.13Å; N217-S261 PolarHBondContact O-OG 2.72Å; N217-S261 VanDerWaalsContact O-OG 3.08Å
218	S	91.4	Very high	92.7	Very high	33 Å²	33	27.5 Å²	27.5	23%	0.231	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	142.9	176.3	-164.4	0	0	0	0	112.9	N174 S175 S176 S261	N174-S218 PolarHBondContact O-N 2.77Å; S175-S218 WeakPolarHBondContact CA-O 3.45Å; S176-S218 PolarHBondContact N-O 2.92Å; S218-S261 WeakPolarHBondContact CA-O 3.12Å; S218-S261 WeakPolarHBondContact CB-OG 3.18Å; S218-S261 PolarHBondContact OG-OG 2.81Å
219	S	91.4	Very high	92.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	142.8	172.7	-172.2	0	0	0	0	112.2	S176 S261 S262 N263	S176-S219 WeakPolarHBondContact O-CA 3.37Å; S219-S261 PolarHBondContact N-O 3.21Å; S219-S262 WeakPolarHBondContact O-CA 3.29Å; S219-N263 PolarHBondContact O-N 2.71Å
220	N	89.8	Confident	92.6	Very high	71 Å²	71	27.7 Å²	27.7	38%	0.38	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	99.5	164.4	-62.9	-50.3	0	0	0	108.2	S176 N177 G178 N263	S176-N220 PolarHBondContact O-N 3.34Å; N177-N220 PolarHBondContact OD1-ND2 2.93Å; G178-N220 PolarHBondContact N-O 2.77Å; N220-N263 PolarHBondContact OD1-ND2 2.89Å
221	G	88.9	Confident	92.4	Very high	18 Å²	18	28.2 Å²	28.2	19%	0.186	15%	0.151	C	C	.	.	S	Bend	trans	143.8	-177	-170.1	0	0	0	0	0	111.5	N263	G221-N263 PolarHBondContact N-O 2.89Å
222	N	91.9	Very high	92	Very high	76 Å²	76	29.7 Å²	29.7	41%	0.406	16%	0.158	S	C	.	.			trans	-77.5	139.6	177.6	-65.3	-25.2	0	0	0	110.5	N179 V180 N265	N179-N222 WeakPolarHBondContact CA-O 3.14Å; N179-N222 PolarHBondContact OD1-N 3.31Å; V180-N222 PolarHBondContact N-O 2.94Å; N222-N265 WeakPolarHBondContact CA-O 3.25Å; N222-N265 PolarHBondContact OD1-N 3.14Å
223	V	92.8	Very high	91.8	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.024	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	124	-178.4	175.1	0	0	0	0	109.3	V180 L216 I225 L259 N265 V266 L267	V180-V223 HydrophobicContact CB-CG2 4.45Å; V180-V223 WeakPolarHBondContact O-CA 3.24Å; L216-V223 HydrophobicContact CD2-CB 4.35Å; L216-V223 HydrophobicContact CD2-CG1 3.58Å; L216-V223 HydrophobicContact CD2-CG2 3.77Å; V223-I225 HydrophobicContact CG1-CD1 3.84Å; V223-I225 HydrophobicContact CG1-CG1 3.69Å; V223-L259 HydrophobicContact CB-CD2 4.33Å; V223-L259 HydrophobicContact CG1-CD2 3.88Å; V223-N265 PolarHBondContact N-O 3.11Å; V223-V266 HydrophobicContact CB-CG2 4.43Å; V223-V266 WeakPolarHBondContact O-CA 3.08Å; V223-L267 PolarHBondContact O-N 2.98Å
224	L	93.7	Very high	91.4	Very high	58 Å²	58	32.4 Å²	32.4	30%	0.304	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.4	170.4	175.9	55.2	0	0	0	108.8	V180 L181 I182 T226 L267	V180-L224 PolarHBondContact O-N 2.88Å; L181-L224 WeakPolarHBondContact CA-O 3.43Å; L181-L224 HydrophobicContact CD1-CB 3.77Å; L181-L224 HydrophobicContact CD1-CD2 3.55Å; L181-L224 HydrophobicContact CD1-CG 3.47Å; L181-L224 VanDerWaalsContact CD1-CG 3.47Å; I182-L224 PolarHBondContact N-O 3.08Å; L224-T226 HydrophobicContact CD1-CG2 3.33Å; L224-T226 HydrophobicContact CD2-CG2 4.48Å; L224-T226 HydrophobicContact CG-CG2 3.79Å; L224-L267 WeakPolarHBondContact CA-O 3.47Å; L224-L267 HydrophobicContact CD1-CB 3.77Å; L224-L267 HydrophobicContact CD1-CD2 3.6Å; L224-L267 HydrophobicContact CD1-CG 3.5Å
225	I	93.7	Very high	91	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	114.4	178.5	-55.1	175.9	0	0	0	108.4	I182 S214 L216 V223 P227 S257 L259 L267 I268 T269	I182-I225 WeakPolarHBondContact O-CA 3.14Å; S214-I225 WeakPolarHBondContact OG-CG2 3.13Å; L216-I225 HydrophobicContact CB-CD1 4.2Å; L216-I225 HydrophobicContact CD2-CD1 4.47Å; V223-I225 HydrophobicContact CG1-CD1 3.84Å; V223-I225 HydrophobicContact CG1-CG1 3.69Å; I225-P227 HydrophobicContact CG2-CG 4.4Å; I225-S257 VanDerWaalsContact CG2-OG 3.24Å; I225-S257 WeakPolarHBondContact CG2-OG 3.33Å; I225-L259 HydrophobicContact CD1-CB 4.24Å; I225-L267 PolarHBondContact N-O 2.91Å; I225-I268 HydrophobicContact CB-CG1 4.49Å; I225-I268 WeakPolarHBondContact O-CA 3.2Å; I225-T269 PolarHBondContact O-N 3.02Å
226	T	93	Very high	90.6	Very high	17 Å²	17	32.2 Å²	32.2	10%	0.104	19%	0.193	C	C	.	.			trans	-135.2	78.1	-174.3	70.2	0	0	0	0	110.9	I182 T183 L224 I228 T269	I182-T226 PolarHBondContact O-N 2.73Å; T183-T226 WeakPolarHBondContact CG2-OG1 3.49Å; L224-T226 HydrophobicContact CD1-CG2 3.33Å; L224-T226 HydrophobicContact CD2-CG2 4.48Å; L224-T226 HydrophobicContact CG-CG2 3.79Å; T226-I228 PolarHBondContact O-N 2.97Å; T226-T269 WeakPolarHBondContact CB-OG1 3.01Å; T226-T269 WeakPolarHBondContact CG2-OG1 3.17Å
227	P	92.8	Very high	89.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.195	C	C	.	.			trans	-67.9	125.8	168.1	-6.2	23.1	0	0	0	108.7	P184 P212 I225 P255 E256 S257 P270 T271	P184-P227 WeakPolarHBondContact O-CA 3.34Å; P212-P227 HydrophobicContact CB-CB 3.84Å; P212-P227 HydrophobicContact CG-CB 3.96Å; P212-P227 WeakPolarHBondContact O-CB 3.36Å; I225-P227 HydrophobicContact CG2-CG 4.4Å; P227-P255 HydrophobicContact CB-CB 3.82Å; P227-E256 WeakPolarHBondContact CG-O 3.43Å; P227-S257 WeakPolarHBondContact CD-OG 3.14Å; P227-S257 WeakPolarHBondContact CG-OG 3.22Å; P227-P270 WeakPolarHBondContact O-CA 3.38Å; P227-T271 PolarHBondContact O-N 3.27Å
228	I	92.9	Very high	89.4	Confident	47 Å²	47	31.5 Å²	31.5	24%	0.241	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.6	-172.4	-65.9	161.4	0	0	0	109	P184 T185 V186 T226 V230	P184-I228 PolarHBondContact O-N 3.02Å; T185-I228 WeakPolarHBondContact CA-O 3.16Å; T185-I228 HydrophobicContact CG2-CB 4.31Å; T185-I228 HydrophobicContact CG2-CG2 4.33Å; V186-I228 PolarHBondContact N-O 2.76Å; T226-I228 PolarHBondContact O-N 2.97Å; I228-V230 HydrophobicContact CG2-CG2 3.79Å
229	V	93	Very high	88.6	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.2	165.1	163.7	0	0	0	0	108	V186 Q210 P212 Q253 T271 V272 V273	V186-V229 HydrophobicContact CB-CG2 4.43Å; Q210-V229 HydrophobicContact CB-CG2 3.99Å; P212-V229 HydrophobicContact CG-CG2 3.66Å; V229-Q253 HydrophobicContact CG1-CB 4.19Å; V229-Q253 HydrophobicContact CG1-CG 3.78Å; V229-Q253 HydrophobicContact CG2-CB 4.47Å; V229-T271 PolarHBondContact N-O 2.94Å; V229-V272 HydrophobicContact CB-CG2 4.4Å; V229-V273 PolarHBondContact O-N 2.75Å
230	V	90.9	Very high	87.7	Confident	37 Å²	37	32.2 Å²	32.2	22%	0.224	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.6	169.5	179.4	0	0	0	0	108.4	V186 V187 E188 I228 L232 V273	V186-V230 PolarHBondContact O-N 2.96Å; V187-V230 WeakPolarHBondContact CA-O 3.05Å; E188-V230 PolarHBondContact N-O 2.9Å; I228-V230 HydrophobicContact CG2-CG2 3.79Å; V230-L232 HydrophobicContact CG1-CD2 4.41Å; V230-L232 HydrophobicContact CG1-CG 4.23Å; V230-V273 WeakPolarHBondContact CA-O 3.13Å
231	E	91.3	Very high	87	Confident	11 Å²	11	32.3 Å²	32.3	5%	0.051	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121.6	178.6	-168.9	170.4	146.3	0	0	109.3	Q210 T251 Q253 V273 Q275	Q210-E231 PolarHBondContact NE2-OE2 2.59Å; Q210-E231 VanDerWaalsContact NE2-OE2 3.13Å; E231-T251 PolarHBondContact OE1-OG1 3.39Å; E231-T251 VanDerWaalsContact OE2-CG2 3.25Å; E231-T251 WeakPolarHBondContact OE2-CG2 3.5Å; E231-Q253 PolarHBondContact OE2-NE2 3.47Å; E231-V273 PolarHBondContact N-O 2.91Å; E231-Q275 PolarHBondContact O-N 3.15Å
232	L	87.7	Confident	86.1	Confident	53 Å²	53	34 Å²	34	28%	0.277	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	114	178	-55.7	178.8	0	0	0	108.9	E188 Q189 A190 V230 Q275	E188-L232 PolarHBondContact O-N 2.99Å; Q189-L232 WeakPolarHBondContact CA-O 3.46Å; Q189-L232 HydrophobicContact CG-CB 4.34Å; Q189-L232 HydrophobicContact CG-CD1 4.29Å; A190-L232 PolarHBondContact N-O 2.67Å; V230-L232 HydrophobicContact CG1-CD2 4.41Å; V230-L232 HydrophobicContact CG1-CG 4.23Å; L232-Q275 HydrophobicContact CD2-CB 3.69Å
233	A	87.6	Confident	85.1	Confident	31 Å²	31	30.4 Å²	30.4	26%	0.256	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.3	177.6	0	0	0	0	0	110.5	Q275 T277	A233-Q275 PolarHBondContact N-O 2.86Å; A233-T277 PolarHBondContact O-N 2.94Å
234	T	85.9	Confident	84.3	Confident	57 Å²	57	33.8 Å²	33.8	35%	0.35	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	118.9	171.5	-62	0	0	0	0	110.2	A190 T192 T236 T277	A190-T234 PolarHBondContact O-N 2.79Å; T192-T234 PolarHBondContact N-O 2.66Å; T234-T236 HydrophobicContact CG2-CG2 4.44Å; T234-T277 WeakPolarHBondContact CA-O 3.08Å
235	A	85.5	Confident	83.7	Confident	32 Å²	32	31.6 Å²	31.6	26%	0.264	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.1	176.9	0	0	0	0	0	110.6	T192 P237 T277 T278 S279	T192-A235 WeakPolarHBondContact O-CA 3.04Å; A235-P237 VanDerWaalsContact C-CD 3.4Å; A235-T277 PolarHBondContact N-O 2.86Å; A235-T278 HydrophobicContact CB-CG2 4.28Å; A235-T278 WeakPolarHBondContact O-CA 3.45Å; A235-S279 PolarHBondContact O-N 2.87Å
236	T	84.1	Confident	83	Confident	56 Å²	56	34.1 Å²	34.1	34%	0.344	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	66.2	177.7	48.3	0	0	0	0	111.4	T192 S193 T234	T192-T236 PolarHBondContact O-N 2.88Å; T192-T236 PolarHBondContact O-OG1 2.67Å; S193-T236 PolarHBondContact OG-OG1 3.2Å; T234-T236 HydrophobicContact CG2-CG2 4.44Å
237	P	78.9	Confident	82.6	Confident	10 Å²	10	35.8 Å²	35.8	7%	0.065	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.7	174.7	30.6	-34.6	0	0	0	111.4	A235 S279 T280 T281	A235-P237 VanDerWaalsContact C-CD 3.4Å; P237-S279 WeakPolarHBondContact CD-O 3.36Å; P237-T280 HydrophobicContact CG-CG2 4.33Å; P237-T280 WeakPolarHBondContact CG-OG1 3.43Å; P237-T281 PolarHBondContact O-N 2.9Å
238	S	80.1	Confident	82.1	Confident	50 Å²	50	37.8 Å²	37.8	35%	0.35	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.9	168	-169.4	0	0	0	0	109.8	T194 T195 I196 T281	T194-S238 PolarHBondContact O-N 3.23Å; T195-S238 WeakPolarHBondContact CA-O 3.39Å; I196-S238 PolarHBondContact N-O 2.97Å; S238-T281 WeakPolarHBondContact CA-O 3.08Å
239	T	75.9	Confident	81.9	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.9	176.6	58.9	0	0	0	0	110	I196 D243 T281 V282 S283	I196-T239 HydrophobicContact CB-CG2 4.17Å; I196-T239 HydrophobicContact CD1-CG2 4.07Å; T239-D243 HydrophobicContact CG2-CB 4.01Å; T239-D243 WeakPolarHBondContact CG2-OD2 3.31Å; T239-T281 PolarHBondContact N-O 2.95Å; T239-V282 WeakPolarHBondContact O-CA 3.32Å; T239-V282 WeakPolarHBondContact OG1-CA 3.46Å; T239-V282 VanDerWaalsContact OG1-CB 3.31Å; T239-V282 WeakPolarHBondContact OG1-CB 3.47Å; T239-V282 WeakPolarHBondContact OG1-CG1 3.44Å; T239-V282 WeakPolarHBondContact OG1-CG2 3.49Å; T239-S283 PolarHBondContact O-N 3.18Å
240	S	72.6	Confident	81.6	Confident	46 Å²	46	42.5 Å²	42.5	32%	0.322	25%	0.245	S	C	.	.	S	Bend	trans	-98.1	-26.6	169	48.7	0	0	0	0	113.3	I196 S197 E284	I196-S240 PolarHBondContact O-N 2.86Å; I196-S240 VanDerWaalsContact O-N 3.12Å; I196-S240 PolarHBondContact O-OG 2.79Å; S197-S240 VanDerWaalsContact CA-OG 3.27Å; S197-S240 WeakPolarHBondContact CA-OG 3.43Å; S197-S240 PolarHBondContact O-OG 3.38Å; S240-E284 VanDerWaalsContact O-CG 3.24Å; S240-E284 WeakPolarHBondContact O-CG 3.4Å
241	E	73.2	Confident	81.5	Confident	73 Å²	73	40.7 Å²	40.7	34%	0.341	24%	0.235	S	C	.	.	S	Bend	trans	-129.4	-162.1	-172.7	-69.4	-168.8	-173.1	0	0	112.3	S197 E198 D243	S197-E241 WeakPolarHBondContact O-CB 3.25Å; S197-E241 WeakPolarHBondContact O-CG 3.03Å; E198-E241 WeakPolarHBondContact CA-OE2 3.05Å; E241-D243 PolarHBondContact O-N 2.93Å
242	S	70.2	Confident	81.5	Confident	53 Å²	53	41.5 Å²	41.5	37%	0.371	24%	0.24	S	C	.	.			trans	-64	112.4	-173.2	-66.1	0	0	0	0	113.5	S199 D200 S285	S199-S242 VanDerWaalsContact CA-O 3.24Å; S199-S242 WeakPolarHBondContact CA-O 3.2Å; D200-S242 PolarHBondContact N-O 2.99Å; S242-S285 VanDerWaalsContact CA-O 3.28Å; S242-S285 WeakPolarHBondContact CA-O 3.03Å
243	D	72.3	Confident	81.7	Confident	2 Å²	2	39 Å²	39	1%	0.011	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.2	176.8	-158.7	-14.4	0	0	0	110.8	I196 T239 E241 R245 S285 L287	I196-D243 WeakPolarHBondContact CD1-OD2 3.41Å; T239-D243 HydrophobicContact CG2-CB 4.01Å; T239-D243 WeakPolarHBondContact CG2-OD2 3.31Å; E241-D243 PolarHBondContact O-N 2.93Å; D243-R245 VanDerWaalsContact CG-NE 3.29Å; D243-R245 WeakPolarHBondContact OD1-CG 3.31Å; D243-R245 IonicContact OD1-NE 2.97Å; D243-R245 PolarHBondContact OD1-NE 2.8Å; D243-R245 IonicContact OD2-CZ 3.43Å; D243-R245 IonicContact OD2-NE 3.11Å; D243-R245 PolarHBondContact OD2-NE 2.74Å; D243-R245 IonicContact OD2-NH2 3.49Å; D243-R245 PolarHBondContact OD2-NH2 2.84Å; D243-S285 PolarHBondContact N-O 2.94Å; D243-L287 PolarHBondContact O-N 2.98Å
244	L	75.5	Confident	81.9	Confident	75 Å²	75	38.6 Å²	38.6	39%	0.393	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	100.8	175	-61.9	-174.6	0	0	0	108.2	D200 L201 R202 L287	D200-L244 PolarHBondContact O-N 2.92Å; L201-L244 WeakPolarHBondContact CA-O 3.21Å; L201-L244 HydrophobicContact CD1-CB 3.41Å; L201-L244 VanDerWaalsContact CD1-CB 3.41Å; L201-L244 HydrophobicContact CD1-CD1 3.85Å; L201-L244 HydrophobicContact CD1-CG 4.27Å; R202-L244 PolarHBondContact N-O 2.84Å; L244-L287 HydrophobicContact CD2-CB 3.52Å; L244-L287 HydrophobicContact CD2-CD1 3.5Å; L244-L287 VanDerWaalsContact CD2-CD1 3.5Å; L244-L287 HydrophobicContact CD2-CG 3.7Å
245	R	80.2	Confident	82.1	Confident	11 Å²	11	35.9 Å²	35.9	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.2	-178.4	-59.2	-156.1	-170	162.6	11	113	R202 D243 E247 L287 R288 N289	R202-R245 HydrophobicContact CB-CG 4.47Å; D243-R245 VanDerWaalsContact CG-NE 3.29Å; D243-R245 WeakPolarHBondContact OD1-CG 3.31Å; D243-R245 IonicContact OD1-NE 2.97Å; D243-R245 PolarHBondContact OD1-NE 2.8Å; D243-R245 IonicContact OD2-CZ 3.43Å; D243-R245 IonicContact OD2-NE 3.11Å; D243-R245 PolarHBondContact OD2-NE 2.74Å; D243-R245 IonicContact OD2-NH2 3.49Å; D243-R245 PolarHBondContact OD2-NH2 2.84Å; R245-E247 WeakPolarHBondContact CD-OE1 3.1Å; R245-E247 IonicContact NH1-OE1 2.77Å; R245-E247 PolarHBondContact NH1-OE1 2.85Å; R245-L287 PolarHBondContact N-O 3.11Å; R245-R288 HydrophobicContact CB-CG 4.43Å; R245-R288 WeakPolarHBondContact O-CA 3.08Å; R245-N289 PolarHBondContact O-N 2.73Å
246	N	80.3	Confident	82.3	Confident	53 Å²	53	35.9 Å²	35.9	28%	0.283	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	104.8	163.7	-176.4	55.1	0	0	0	108.7	R202 N203 E204 N289	R202-N246 PolarHBondContact O-N 2.97Å; N203-N246 WeakPolarHBondContact CA-O 3.45Å; N203-N246 PolarHBondContact OD1-ND2 2.93Å; E204-N246 PolarHBondContact N-O 2.95Å; N246-N289 WeakPolarHBondContact CA-O 3.44Å; N246-N289 PolarHBondContact OD1-ND2 3.28Å
247	E	83.9	Confident	82.6	Confident	52 Å²	52	33.3 Å²	33.3	24%	0.243	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	129	-179	-67.8	175.3	-161.2	0	0	108.3	E204 R245 N289 E290 S291	E204-E247 HydrophobicContact CB-CG 4.36Å; R245-E247 WeakPolarHBondContact CD-OE1 3.1Å; R245-E247 IonicContact NH1-OE1 2.77Å; R245-E247 PolarHBondContact NH1-OE1 2.85Å; E247-N289 PolarHBondContact N-O 2.85Å; E247-E290 HydrophobicContact CB-CG 4.48Å; E247-S291 PolarHBondContact O-N 2.92Å
248	S	82.8	Confident	83.1	Confident	43 Å²	43	37 Å²	37	30%	0.301	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	108.9	177.8	-71	0	0	0	0	110.2	E204 S205 E206 S291	E204-S248 PolarHBondContact O-N 2.98Å; S205-S248 WeakPolarHBondContact CA-O 3.41Å; E206-S248 PolarHBondContact N-O 2.93Å; S248-S291 WeakPolarHBondContact CA-O 3.35Å
249	E	87.5	Confident	83.6	Confident	63 Å²	63	34.8 Å²	34.8	29%	0.294	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.6	180	-167.3	-179.7	158.6	0	0	110.3	E206 T251 S291 K293	E206-E249 HydrophobicContact CB-CG 4.47Å; E249-T251 PolarHBondContact OE1-OG1 3.44Å; E249-S291 PolarHBondContact N-O 2.72Å; E249-K293 PolarHBondContact O-N 2.93Å
250	K	86.4	Confident	84.2	Confident	82 Å²	82	38 Å²	38	36%	0.357	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	106.8	173.3	-175	-173.5	172.6	-179.6	0	111.3	E206 T208	E206-K250 PolarHBondContact O-N 2.92Å; T208-K250 PolarHBondContact N-O 3.06Å; T208-K250 VanDerWaalsContact N-O 3.11Å
251	T	90.3	Very high	84.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.8	177	-66.1	0	0	0	0	110.8	E231 E249 Q253 K293 T295	E231-T251 PolarHBondContact OE1-OG1 3.39Å; E231-T251 VanDerWaalsContact OE2-CG2 3.25Å; E231-T251 WeakPolarHBondContact OE2-CG2 3.5Å; E249-T251 PolarHBondContact OE1-OG1 3.44Å; T251-Q253 HydrophobicContact CG2-CG 3.82Å; T251-K293 PolarHBondContact N-O 3.43Å; T251-K293 VanDerWaalsContact N-O 3.09Å; T251-T295 PolarHBondContact O-N 3.4Å
252	T	91.2	Very high	85.6	Confident	28 Å²	28	34.2 Å²	34.2	17%	0.172	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	114.8	176.2	-61.3	0	0	0	0	109.6	T208 T209 Q210 T254 T295	T208-T252 PolarHBondContact O-N 2.98Å; T209-T252 WeakPolarHBondContact CA-O 3.49Å; Q210-T252 PolarHBondContact N-O 3.09Å; T252-T254 HydrophobicContact CG2-CG2 3.83Å; T252-T295 WeakPolarHBondContact CA-O 3.44Å
253	Q	92.3	Very high	86.3	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.3	-175.9	-59.9	175.8	9.2	0	0	109.7	Q210 V229 E231 T251 P255 V272 T295 T297	Q210-Q253 WeakPolarHBondContact O-CA 3.32Å; V229-Q253 HydrophobicContact CG1-CB 4.19Å; V229-Q253 HydrophobicContact CG1-CG 3.78Å; V229-Q253 HydrophobicContact CG2-CB 4.47Å; E231-Q253 PolarHBondContact OE2-NE2 3.47Å; T251-Q253 HydrophobicContact CG2-CG 3.82Å; Q253-P255 VanDerWaalsContact C-CD 3.49Å; Q253-V272 HydrophobicContact CB-CG2 4.01Å; Q253-T295 PolarHBondContact N-O 3.41Å; Q253-T297 PolarHBondContact O-N 2.94Å
254	T	91.4	Very high	87	Confident	23 Å²	23	36.2 Å²	36.2	14%	0.141	19%	0.19	C	C	.	.			trans	-129.9	67.8	-173.7	74.7	0	0	0	0	111.7	Q210 T211 T252 E256 T297	Q210-T254 PolarHBondContact O-N 3.01Å; T211-T254 WeakPolarHBondContact CB-OG1 3.45Å; T211-T254 WeakPolarHBondContact CG2-OG1 3.15Å; T252-T254 HydrophobicContact CG2-CG2 3.83Å; T254-E256 PolarHBondContact O-N 2.77Å; T254-E256 VanDerWaalsContact O-N 3.15Å; T254-T297 WeakPolarHBondContact CB-OG1 3.13Å; T254-T297 WeakPolarHBondContact CG2-OG1 3.45Å
255	P	89.3	Confident	87.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.			trans	-64.2	117.9	172.9	22.3	-27.2	0	0	0	110.3	P212 P227 Q253 P270 V272 P298 E299	P212-P255 HydrophobicContact CG-CB 3.92Å; P227-P255 HydrophobicContact CB-CB 3.82Å; Q253-P255 VanDerWaalsContact C-CD 3.49Å; P255-P270 HydrophobicContact CB-CB 3.75Å; P255-P270 HydrophobicContact CG-CB 3.96Å; P255-P270 WeakPolarHBondContact O-CB 2.99Å; P255-V272 HydrophobicContact CG-CG2 3.66Å; P255-P298 HydrophobicContact CG-CB 4.07Å; P255-E299 PolarHBondContact O-N 3.12Å
256	E	91	Very high	88	Confident	32 Å²	32	35.9 Å²	35.9	15%	0.15	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.1	-176.4	-72.8	-157	-164.6	0	0	112.5	P212 E213 S214 P227 T254 R258 E299	P212-E256 PolarHBondContact O-N 3.4Å; E213-E256 HydrophobicContact CG-CB 4.35Å; S214-E256 PolarHBondContact N-O 2.69Å; P227-E256 WeakPolarHBondContact CG-O 3.43Å; T254-E256 PolarHBondContact O-N 2.77Å; T254-E256 VanDerWaalsContact O-N 3.15Å; E256-R258 IonicContact OE1-NH2 3.31Å; E256-R258 IonicContact OE2-CZ 3.88Å; E256-R258 VanDerWaalsContact OE2-CZ 3.28Å; E256-R258 IonicContact OE2-NE 2.65Å; E256-R258 PolarHBondContact OE2-NE 2.73Å; E256-R258 IonicContact OE2-NH2 3.38Å; E256-R258 PolarHBondContact OE2-NH2 2.6Å; E256-E299 HydrophobicContact CG-CB 4.33Å
257	S	89.4	Confident	88.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125	172	-67.7	0	0	0	0	112.2	I225 P227 E299 R301	I225-S257 VanDerWaalsContact CG2-OG 3.24Å; I225-S257 WeakPolarHBondContact CG2-OG 3.33Å; P227-S257 WeakPolarHBondContact CD-OG 3.14Å; P227-S257 WeakPolarHBondContact CG-OG 3.22Å; S257-E299 PolarHBondContact N-O 3.38Å; S257-R301 PolarHBondContact O-N 2.8Å
258	R	89.5	Confident	88.7	Confident	87 Å²	87	33.6 Å²	33.6	33%	0.328	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	116.8	176.3	-58	-175.9	-173.3	-166.6	2.5	110.8	S214 L216 E256 R301	S214-R258 PolarHBondContact O-N 2.73Å; L216-R258 PolarHBondContact N-O 3.1Å; E256-R258 IonicContact OE1-NH2 3.31Å; E256-R258 IonicContact OE2-CZ 3.88Å; E256-R258 VanDerWaalsContact OE2-CZ 3.28Å; E256-R258 IonicContact OE2-NE 2.65Å; E256-R258 PolarHBondContact OE2-NE 2.73Å; E256-R258 IonicContact OE2-NH2 3.38Å; E256-R258 PolarHBondContact OE2-NH2 2.6Å; R258-R301 HydrophobicContact CG-CB 4.5Å
259	L	89.7	Confident	88.9	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	117.7	172.4	-179.6	53.1	0	0	0	110.2	L216 V223 I225 S261 V266 I268 R301 L302 N303	L216-L259 HydrophobicContact CB-CD1 3.8Å; L216-L259 HydrophobicContact CD2-CD1 3.65Å; L216-L259 HydrophobicContact CG-CD1 3.52Å; L216-L259 WeakPolarHBondContact O-CA 3.5Å; L216-L259 WeakPolarHBondContact O-CD1 3.22Å; V223-L259 HydrophobicContact CB-CD2 4.33Å; V223-L259 HydrophobicContact CG1-CD2 3.88Å; I225-L259 HydrophobicContact CD1-CB 4.24Å; L259-S261 WeakPolarHBondContact CD1-O 3.09Å; L259-V266 HydrophobicContact CD2-CB 4.27Å; L259-V266 HydrophobicContact CD2-CG1 3.56Å; L259-V266 HydrophobicContact CD2-CG2 3.65Å; L259-I268 HydrophobicContact CB-CD1 4.18Å; L259-R301 PolarHBondContact N-O 2.9Å; L259-L302 HydrophobicContact CB-CD1 3.79Å; L259-L302 HydrophobicContact CD2-CD1 3.69Å; L259-L302 HydrophobicContact CG-CD1 3.6Å; L259-L302 WeakPolarHBondContact O-CA 2.99Å; L259-N303 PolarHBondContact O-N 3.09Å; L259-N303 VanDerWaalsContact O-N 3.09Å
260	N	88.7	Confident	88.9	Confident	71 Å²	71	29.7 Å²	29.7	38%	0.38	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-43.2	-179.1	-178.1	38.9	0	0	0	112.2	L216 N217 N303 S304	L216-N260 PolarHBondContact O-N 2.88Å; N217-N260 WeakPolarHBondContact O-CB 3.41Å; N217-N260 PolarHBondContact OD1-ND2 2.73Å; N260-N303 WeakPolarHBondContact O-CB 3.41Å; N260-N303 PolarHBondContact OD1-ND2 2.69Å; N260-S304 PolarHBondContact O-N 2.84Å
261	S	87.6	Confident	89.1	Confident	36 Å²	36	27.3 Å²	27.3	25%	0.252	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	144	177	61	0	0	0	0	112.8	N217 S218 S219 L259 S304	N217-S261 PolarHBondContact O-N 3.13Å; N217-S261 PolarHBondContact O-OG 2.72Å; N217-S261 VanDerWaalsContact O-OG 3.08Å; S218-S261 WeakPolarHBondContact CA-O 3.12Å; S218-S261 WeakPolarHBondContact CB-OG 3.18Å; S218-S261 PolarHBondContact OG-OG 2.81Å; S219-S261 PolarHBondContact N-O 3.21Å; L259-S261 WeakPolarHBondContact CD1-O 3.09Å; S261-S304 WeakPolarHBondContact CA-O 3.09Å
262	S	87.9	Confident	89	Confident	3 Å²	3	27.3 Å²	27.3	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	142.9	171.3	-171.8	0	0	0	0	112.3	S219 V266 S304 S305 N306	S219-S262 WeakPolarHBondContact O-CA 3.29Å; S262-V266 VanDerWaalsContact CB-CG2 3.48Å; S262-S304 PolarHBondContact N-O 2.87Å; S262-S305 WeakPolarHBondContact O-CA 2.99Å; S262-N306 PolarHBondContact O-N 2.69Å; S262-N306 VanDerWaalsContact O-N 3.08Å
263	N	86.2	Confident	88.7	Confident	81 Å²	81	28.9 Å²	28.9	43%	0.433	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	92.3	164.8	-63.8	-48.7	0	0	0	108.2	S219 N220 G221 N306	S219-N263 PolarHBondContact O-N 2.71Å; N220-N263 PolarHBondContact OD1-ND2 2.89Å; G221-N263 PolarHBondContact N-O 2.89Å; N263-N306 PolarHBondContact OD1-ND2 3.25Å
264	G	85.3	Confident	88.4	Confident	16 Å²	16	29.8 Å²	29.8	17%	0.165	16%	0.163	C	C	.	.	S	Bend	trans	151.1	-175	-172	0	0	0	0	0	111.4	N306	G264-N306 PolarHBondContact N-O 3.29Å
265	N	88.7	Confident	87.9	Confident	75 Å²	75	33.8 Å²	33.8	40%	0.401	18%	0.18	S	C	.	.			trans	-76.8	138	177.5	-65.2	-23.4	0	0	0	110.4	N222 V223 N308	N222-N265 WeakPolarHBondContact CA-O 3.25Å; N222-N265 PolarHBondContact OD1-N 3.14Å; V223-N265 PolarHBondContact N-O 3.11Å; N265-N308 WeakPolarHBondContact CA-O 3.48Å; N265-N308 PolarHBondContact OD1-N 2.97Å
266	V	88.2	Confident	87.5	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.024	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123.9	-179.9	174.7	0	0	0	0	109.1	V223 L259 S262 I268 L302 N308 V309 L310	V223-V266 HydrophobicContact CB-CG2 4.43Å; V223-V266 WeakPolarHBondContact O-CA 3.08Å; L259-V266 HydrophobicContact CD2-CB 4.27Å; L259-V266 HydrophobicContact CD2-CG1 3.56Å; L259-V266 HydrophobicContact CD2-CG2 3.65Å; S262-V266 VanDerWaalsContact CB-CG2 3.48Å; V266-I268 HydrophobicContact CG1-CD1 3.88Å; V266-I268 HydrophobicContact CG1-CG1 3.76Å; V266-L302 HydrophobicContact CG1-CD1 4.46Å; V266-L302 HydrophobicContact CG1-CD2 4.33Å; V266-N308 PolarHBondContact N-O 2.89Å; V266-V309 HydrophobicContact CB-CG2 4.41Å; V266-V309 WeakPolarHBondContact O-CA 3.04Å; V266-L310 PolarHBondContact O-N 2.95Å
267	L	90.6	Very high	86.9	Confident	57 Å²	57	36.6 Å²	36.6	30%	0.298	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.5	169.5	175.3	55.3	0	0	0	108.7	V223 L224 I225 T269 L310	V223-L267 PolarHBondContact O-N 2.98Å; L224-L267 WeakPolarHBondContact CA-O 3.47Å; L224-L267 HydrophobicContact CD1-CB 3.77Å; L224-L267 HydrophobicContact CD1-CD2 3.6Å; L224-L267 HydrophobicContact CD1-CG 3.5Å; I225-L267 PolarHBondContact N-O 2.91Å; L267-T269 HydrophobicContact CD1-CG2 3.35Å; L267-T269 HydrophobicContact CD2-CG2 4.36Å; L267-T269 HydrophobicContact CG-CG2 3.71Å; L267-L310 WeakPolarHBondContact CA-O 3.48Å; L267-L310 HydrophobicContact CD1-CB 3.79Å; L267-L310 HydrophobicContact CD1-CD2 3.66Å; L267-L310 HydrophobicContact CD1-CG 3.6Å
268	I	88.3	Confident	86.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	116.2	178.4	-60	174.2	0	0	0	108.4	I225 L259 V266 S300 L302 L310 I311 T312	I225-I268 HydrophobicContact CB-CG1 4.49Å; I225-I268 WeakPolarHBondContact O-CA 3.2Å; L259-I268 HydrophobicContact CB-CD1 4.18Å; V266-I268 HydrophobicContact CG1-CD1 3.88Å; V266-I268 HydrophobicContact CG1-CG1 3.76Å; I268-S300 WeakPolarHBondContact CG2-OG 3.4Å; I268-L302 HydrophobicContact CD1-CB 4.37Å; I268-L310 PolarHBondContact N-O 3.04Å; I268-I311 HydrophobicContact CB-CG1 4.39Å; I268-I311 WeakPolarHBondContact O-CA 3.09Å; I268-T312 PolarHBondContact O-N 2.93Å
269	T	88.6	Confident	85.7	Confident	23 Å²	23	38.3 Å²	38.3	14%	0.141	23%	0.225	C	C	.	.			trans	-134.6	73.8	-174.4	72.8	0	0	0	0	111.1	I225 T226 L267 T271 T312	I225-T269 PolarHBondContact O-N 3.02Å; T226-T269 WeakPolarHBondContact CB-OG1 3.01Å; T226-T269 WeakPolarHBondContact CG2-OG1 3.17Å; L267-T269 HydrophobicContact CD1-CG2 3.35Å; L267-T269 HydrophobicContact CD2-CG2 4.36Å; L267-T269 HydrophobicContact CG-CG2 3.71Å; T269-T271 PolarHBondContact O-N 3.19Å; T269-T271 PolarHBondContact O-OG1 2.98Å; T269-T312 WeakPolarHBondContact CG2-OG1 3.36Å
270	P	87.5	Confident	85	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.228	C	C	.	.			trans	-62.6	124	165	27.9	-33.7	0	0	0	108.6	P227 P255 P298 S300 P313 T314	P227-P270 WeakPolarHBondContact O-CA 3.38Å; P255-P270 HydrophobicContact CB-CB 3.75Å; P255-P270 HydrophobicContact CG-CB 3.96Å; P255-P270 WeakPolarHBondContact O-CB 2.99Å; P270-P298 HydrophobicContact CB-CB 3.87Å; P270-P298 HydrophobicContact CG-CB 3.96Å; P270-S300 WeakPolarHBondContact CD-OG 3.35Å; P270-S300 WeakPolarHBondContact CG-OG 3.29Å; P270-P313 HydrophobicContact CG-CB 4.2Å; P270-T314 PolarHBondContact O-N 3Å
271	T	89	Confident	84.3	Confident	32 Å²	32	38.7 Å²	38.7	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.9	-174.5	-60	0	0	0	0	109.6	P227 V229 T269 V273	P227-T271 PolarHBondContact O-N 3.27Å; V229-T271 PolarHBondContact N-O 2.94Å; T269-T271 PolarHBondContact O-N 3.19Å; T269-T271 PolarHBondContact O-OG1 2.98Å; T271-V273 HydrophobicContact CG2-CG2 3.97Å
272	V	88.2	Confident	83.4	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.7	167.1	162.9	0	0	0	0	107.5	V229 Q253 P255 Q296 T314	V229-V272 HydrophobicContact CB-CG2 4.4Å; Q253-V272 HydrophobicContact CB-CG2 4.01Å; P255-V272 HydrophobicContact CG-CG2 3.66Å; V272-Q296 HydrophobicContact CG1-CB 4.37Å; V272-Q296 HydrophobicContact CG1-CG 3.79Å; V272-Q296 VanDerWaalsContact CG1-OE1 3.23Å; V272-T314 PolarHBondContact N-O 2.93Å
273	V	86.4	Confident	82.4	Confident	61 Å²	61	40.5 Å²	40.5	37%	0.37	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	121	167.6	-178.8	0	0	0	0	107.8	V229 V230 E231 T271	V229-V273 PolarHBondContact O-N 2.75Å; V230-V273 WeakPolarHBondContact CA-O 3.13Å; E231-V273 PolarHBondContact N-O 2.91Å; T271-V273 HydrophobicContact CG2-CG2 3.97Å
274	E	84.3	Confident	81.6	Confident	19 Å²	19	41.6 Å²	41.6	9%	0.089	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127	179	-171.5	174.6	151	0	0	108.5	T294 Q296	E274-T294 WeakPolarHBondContact OE1-CG2 3.36Å; E274-T294 PolarHBondContact OE1-OG1 2.81Å; E274-T294 WeakPolarHBondContact OE2-CG2 3.36Å; E274-Q296 PolarHBondContact OE2-NE2 2.95Å
275	Q	81.8	Confident	80.8	Confident	106 Å²	106	43.3 Å²	43.3	50%	0.495	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	114.4	175.7	-176.1	-176	-7.8	0	0	108.9	E231 L232 A233	E231-Q275 PolarHBondContact O-N 3.15Å; L232-Q275 HydrophobicContact CD2-CB 3.69Å; A233-Q275 PolarHBondContact N-O 2.86Å
276	A	80.8	Confident	79.7	Confident	33 Å²	33	40.1 Å²	40.1	27%	0.273	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.3	172.3	0	0	0	0	0	109.9
277	T	79.2	Confident	78.8	Confident	58 Å²	58	44.2 Å²	44.2	36%	0.356	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	116.4	171.3	-62.4	0	0	0	0	109.5	A233 T234 A235	A233-T277 PolarHBondContact O-N 2.94Å; T234-T277 WeakPolarHBondContact CA-O 3.08Å; A235-T277 PolarHBondContact N-O 2.86Å
278	T	77.8	Confident	78	Confident	62 Å²	62	42.3 Å²	42.3	38%	0.38	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.6	178.9	-56.5	0	0	0	0	109.6	A235	A235-T278 HydrophobicContact CB-CG2 4.28Å; A235-T278 WeakPolarHBondContact O-CA 3.45Å
279	S	74.6	Confident	77.2	Confident	62 Å²	62	45.6 Å²	45.6	43%	0.434	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	108.1	172.5	-173.8	0	0	0	0	109.4	A235 P237	A235-S279 PolarHBondContact O-N 2.87Å; P237-S279 WeakPolarHBondContact CD-O 3.36Å
280	T	75.5	Confident	76.7	Confident	11 Å²	11	46.6 Å²	46.6	7%	0.067	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.2	-176.7	-65	0	0	0	0	110	P237 V282 R288 I325	P237-T280 HydrophobicContact CG-CG2 4.33Å; P237-T280 WeakPolarHBondContact CG-OG1 3.43Å; T280-V282 HydrophobicContact CG2-CG2 3.75Å; T280-R288 VanDerWaalsContact CG2-NH2 3.31Å; T280-R288 PolarHBondContact OG1-NH1 3.1Å; T280-I325 HydrophobicContact CG2-CD1 4.27Å
281	T	73.8	Confident	76.1	Confident	73 Å²	73	49.3 Å²	49.3	45%	0.448	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.5	166.6	-55	0	0	0	0	109.6	P237 S238 T239	P237-T281 PolarHBondContact O-N 2.9Å; S238-T281 WeakPolarHBondContact CA-O 3.08Å; T239-T281 PolarHBondContact N-O 2.95Å
282	V	69.4	Low	75.7	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.03	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	149.8	177	-176.4	0	0	0	0	107.7	T239 T280 D286 I325	T239-V282 WeakPolarHBondContact O-CA 3.32Å; T239-V282 WeakPolarHBondContact OG1-CA 3.46Å; T239-V282 VanDerWaalsContact OG1-CB 3.31Å; T239-V282 WeakPolarHBondContact OG1-CB 3.47Å; T239-V282 WeakPolarHBondContact OG1-CG1 3.44Å; T239-V282 WeakPolarHBondContact OG1-CG2 3.49Å; T280-V282 HydrophobicContact CG2-CG2 3.75Å; V282-D286 HydrophobicContact CG1-CB 4.02Å; V282-D286 HydrophobicContact CG2-CB 4.46Å; V282-D286 WeakPolarHBondContact CG2-OD2 3.41Å; V282-I325 HydrophobicContact CB-CB 4.17Å; V282-I325 HydrophobicContact CB-CD1 3.36Å; V282-I325 HydrophobicContact CB-CG1 3.51Å; V282-I325 HydrophobicContact CB-CG2 3.62Å; V282-I325 HydrophobicContact CG1-CD1 4.44Å; V282-I325 HydrophobicContact CG1-CG2 3.95Å; V282-I325 HydrophobicContact CG2-CD1 3.19Å; V282-I325 HydrophobicContact CG2-CG1 3.87Å; V282-I325 WeakPolarHBondContact O-CG2 2.95Å
283	S	66.6	Low	75.4	Confident	71 Å²	71	57.1 Å²	57.1	50%	0.497	32%	0.321	S	S	.	.	S	Bend	trans	-116.3	-21.3	-175.4	-54.8	0	0	0	0	115.2	T239	T239-S283 PolarHBondContact O-N 3.18Å
284	E	70.2	Confident	75.3	Confident	105 Å²	105	54.7 Å²	54.7	49%	0.491	31%	0.306	S	S	.	.	S	Bend	trans	-141.2	-59.6	-166.7	-66.9	-171	174.3	0	0	116.7	S240 E327 S328	S240-E284 VanDerWaalsContact O-CG 3.24Å; S240-E284 WeakPolarHBondContact O-CG 3.4Å; E284-E327 CarbonylContact C-O 3.54Å; E284-E327 CarbonylContact O-C 3.51Å; E284-S328 PolarHBondContact O-N 3Å
285	S	67.5	Low	75.4	Confident	52 Å²	52	55.6 Å²	55.6	36%	0.364	31%	0.313	S	S	.	.			trans	-152.4	120.2	-176.6	-69.6	0	0	0	0	111	S242 D243	S242-S285 VanDerWaalsContact CA-O 3.28Å; S242-S285 WeakPolarHBondContact CA-O 3.03Å; D243-S285 PolarHBondContact N-O 2.94Å
286	D	66.6	Low	75.5	Confident	8 Å²	8	50.6 Å²	50.6	4%	0.043	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	124.7	178.8	-144.4	-33.7	0	0	0	110.6	V282 R288	V282-D286 HydrophobicContact CG1-CB 4.02Å; V282-D286 HydrophobicContact CG2-CB 4.46Å; V282-D286 WeakPolarHBondContact CG2-OD2 3.41Å; D286-R288 HydrophobicContact CB-CG 4.48Å; D286-R288 WeakPolarHBondContact OD1-CG 3.46Å; D286-R288 IonicContact OD1-NE 2.79Å; D286-R288 PolarHBondContact OD1-NE 2.98Å; D286-R288 VanDerWaalsContact OD1-NE 3.08Å; D286-R288 IonicContact OD2-CZ 2.86Å; D286-R288 IonicContact OD2-NE 3.15Å; D286-R288 PolarHBondContact OD2-NE 3.16Å; D286-R288 IonicContact OD2-NH2 2.71Å; D286-R288 PolarHBondContact OD2-NH2 2.91Å
287	L	67.8	Low	75.7	Confident	89 Å²	89	50.6 Å²	50.6	47%	0.466	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	100.3	165.6	-59.8	-176.3	0	0	0	108	D243 L244 R245 L330	D243-L287 PolarHBondContact O-N 2.98Å; L244-L287 HydrophobicContact CD2-CB 3.52Å; L244-L287 HydrophobicContact CD2-CD1 3.5Å; L244-L287 VanDerWaalsContact CD2-CD1 3.5Å; L244-L287 HydrophobicContact CD2-CG 3.7Å; R245-L287 PolarHBondContact N-O 3.11Å; L287-L330 HydrophobicContact CD2-CB 3.75Å
288	R	73.3	Confident	75.9	Confident	17 Å²	17	47.8 Å²	47.8	6%	0.064	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.2	177.3	-57	-158.5	-175.9	174.4	6.2	112.6	R245 T280 D286 E290 N332	R245-R288 HydrophobicContact CB-CG 4.43Å; R245-R288 WeakPolarHBondContact O-CA 3.08Å; T280-R288 VanDerWaalsContact CG2-NH2 3.31Å; T280-R288 PolarHBondContact OG1-NH1 3.1Å; D286-R288 HydrophobicContact CB-CG 4.48Å; D286-R288 WeakPolarHBondContact OD1-CG 3.46Å; D286-R288 IonicContact OD1-NE 2.79Å; D286-R288 PolarHBondContact OD1-NE 2.98Å; D286-R288 VanDerWaalsContact OD1-NE 3.08Å; D286-R288 IonicContact OD2-CZ 2.86Å; D286-R288 IonicContact OD2-NE 3.15Å; D286-R288 PolarHBondContact OD2-NE 3.16Å; D286-R288 IonicContact OD2-NH2 2.71Å; D286-R288 PolarHBondContact OD2-NH2 2.91Å; R288-E290 HydrophobicContact CB-CG 4.49Å; R288-E290 WeakPolarHBondContact CD-OE1 3.49Å; R288-E290 IonicContact NH1-OE1 2.67Å; R288-N332 PolarHBondContact O-N 3.15Å
289	N	73	Confident	76.3	Confident	69 Å²	69	47.7 Å²	47.7	37%	0.369	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	104.6	161.6	-175.7	50.5	0	0	0	108.3	R245 N246 E247	R245-N289 PolarHBondContact O-N 2.73Å; N246-N289 WeakPolarHBondContact CA-O 3.44Å; N246-N289 PolarHBondContact OD1-ND2 3.28Å; E247-N289 PolarHBondContact N-O 2.85Å
290	E	76.6	Confident	76.7	Confident	44 Å²	44	44.9 Å²	44.9	21%	0.206	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.6	179.3	-70.6	165.8	-175.3	0	0	107.6	E247 R288 R331	E247-E290 HydrophobicContact CB-CG 4.48Å; R288-E290 HydrophobicContact CB-CG 4.49Å; R288-E290 WeakPolarHBondContact CD-OE1 3.49Å; R288-E290 IonicContact NH1-OE1 2.67Å; E290-R331 IonicContact OE2-CZ 3.56Å; E290-R331 IonicContact OE2-NE 3.14Å; E290-R331 IonicContact OE2-NH2 3.89Å; E290-R331 PolarHBondContact OE2-NH2 2.89Å
291	S	76	Confident	77.1	Confident	58 Å²	58	50.4 Å²	50.4	41%	0.406	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	115.9	171.7	-174.2	0	0	0	0	109.8	E247 S248 E249	E247-S291 PolarHBondContact O-N 2.92Å; S248-S291 WeakPolarHBondContact CA-O 3.35Å; E249-S291 PolarHBondContact N-O 2.72Å
292	E	80.7	Confident	77.4	Confident	93 Å²	93	47.3 Å²	47.3	44%	0.435	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.7	174.9	-167.5	-175.3	150.4	0	0	109.8
293	K	81.2	Confident	78.1	Confident	104 Å²	104	50.6 Å²	50.6	45%	0.452	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	101.6	171.4	-174.3	-174.3	174.5	174.5	0	111.3	E249 T251	E249-K293 PolarHBondContact O-N 2.93Å; T251-K293 PolarHBondContact N-O 3.43Å; T251-K293 VanDerWaalsContact N-O 3.09Å
294	T	84.5	Confident	78.8	Confident	10 Å²	10	49.6 Å²	49.6	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.1	169.6	-68.3	0	0	0	0	111.6	E274 Q296	E274-T294 WeakPolarHBondContact OE1-CG2 3.36Å; E274-T294 PolarHBondContact OE1-OG1 2.81Å; E274-T294 WeakPolarHBondContact OE2-CG2 3.36Å; T294-Q296 HydrophobicContact CG2-CG 3.82Å
295	T	85.8	Confident	79.3	Confident	38 Å²	38	44.7 Å²	44.7	23%	0.233	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	113.5	171.6	-62.8	0	0	0	0	109.4	T251 T252 Q253 T297	T251-T295 PolarHBondContact O-N 3.4Å; T252-T295 WeakPolarHBondContact CA-O 3.44Å; Q253-T295 PolarHBondContact N-O 3.41Å; T295-T297 HydrophobicContact CG2-CG2 3.96Å
296	Q	84.1	Confident	79.8	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	118.3	179.6	-57.6	178.8	8.8	0	0	110	V272 E274 T294 P298 V315	V272-Q296 HydrophobicContact CG1-CB 4.37Å; V272-Q296 HydrophobicContact CG1-CG 3.79Å; V272-Q296 VanDerWaalsContact CG1-OE1 3.23Å; E274-Q296 PolarHBondContact OE2-NE2 2.95Å; T294-Q296 HydrophobicContact CG2-CG 3.82Å; Q296-P298 VanDerWaalsContact C-CD 3.48Å; Q296-V315 HydrophobicContact CB-CG2 4.3Å
297	T	85.6	Confident	80.4	Confident	32 Å²	32	47.2 Å²	47.2	20%	0.196	25%	0.246	C	C	.	.			trans	-128.4	69.4	-179.8	68	0	0	0	0	111.6	Q253 T254 T295 E299	Q253-T297 PolarHBondContact O-N 2.94Å; T254-T297 WeakPolarHBondContact CB-OG1 3.13Å; T254-T297 WeakPolarHBondContact CG2-OG1 3.45Å; T295-T297 HydrophobicContact CG2-CG2 3.96Å; T297-E299 PolarHBondContact O-N 3.34Å; T297-E299 VanDerWaalsContact O-N 3.16Å
298	P	82.9	Confident	81.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.			trans	-64.8	115.2	171.7	26.1	-32.5	0	0	0	110.5	P255 P270 Q296 P313 V315	P255-P298 HydrophobicContact CG-CB 4.07Å; P270-P298 HydrophobicContact CB-CB 3.87Å; P270-P298 HydrophobicContact CG-CB 3.96Å; Q296-P298 VanDerWaalsContact C-CD 3.48Å; P298-P313 HydrophobicContact CB-CB 3.94Å; P298-P313 HydrophobicContact CG-CB 4.02Å; P298-V315 HydrophobicContact CG-CG2 3.87Å
299	E	85.9	Confident	81.5	Confident	60 Å²	60	47.2 Å²	47.2	28%	0.28	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.4	-178.8	-77	-158.3	-164.3	0	0	112.6	P255 E256 S257 T297 R301	P255-E299 PolarHBondContact O-N 3.12Å; E256-E299 HydrophobicContact CG-CB 4.33Å; S257-E299 PolarHBondContact N-O 3.38Å; T297-E299 PolarHBondContact O-N 3.34Å; T297-E299 VanDerWaalsContact O-N 3.16Å; E299-R301 IonicContact OE1-NH2 2.83Å; E299-R301 IonicContact OE2-CZ 3.06Å; E299-R301 VanDerWaalsContact OE2-CZ 3.31Å; E299-R301 IonicContact OE2-NE 2.73Å; E299-R301 PolarHBondContact OE2-NE 3.27Å; E299-R301 IonicContact OE2-NH2 3.12Å; E299-R301 PolarHBondContact OE2-NH2 2.99Å
300	S	83.3	Confident	82	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124	173.2	-66.3	0	0	0	0	111.4	I268 P270	I268-S300 WeakPolarHBondContact CG2-OG 3.4Å; P270-S300 WeakPolarHBondContact CD-OG 3.35Å; P270-S300 WeakPolarHBondContact CG-OG 3.29Å
301	R	83.8	Confident	82.1	Confident	127 Å²	127	45.3 Å²	45.3	48%	0.479	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.1	176.7	-58.9	-176	-172.2	-162.5	1.6	110.8	S257 R258 L259 E299	S257-R301 PolarHBondContact O-N 2.8Å; R258-R301 HydrophobicContact CG-CB 4.5Å; L259-R301 PolarHBondContact N-O 2.9Å; E299-R301 IonicContact OE1-NH2 2.83Å; E299-R301 IonicContact OE2-CZ 3.06Å; E299-R301 VanDerWaalsContact OE2-CZ 3.31Å; E299-R301 IonicContact OE2-NE 2.73Å; E299-R301 PolarHBondContact OE2-NE 3.27Å; E299-R301 IonicContact OE2-NH2 3.12Å; E299-R301 PolarHBondContact OE2-NH2 2.99Å
302	L	80.8	Confident	82.3	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.6	171.4	179.4	64.1	0	0	0	110.2	L259 V266 I268 V309 I311 N346	L259-L302 HydrophobicContact CB-CD1 3.79Å; L259-L302 HydrophobicContact CD2-CD1 3.69Å; L259-L302 HydrophobicContact CG-CD1 3.6Å; L259-L302 WeakPolarHBondContact O-CA 2.99Å; V266-L302 HydrophobicContact CG1-CD1 4.46Å; V266-L302 HydrophobicContact CG1-CD2 4.33Å; I268-L302 HydrophobicContact CD1-CB 4.37Å; L302-V309 HydrophobicContact CD2-CB 4.11Å; L302-V309 HydrophobicContact CD2-CG1 3.41Å; L302-V309 VanDerWaalsContact CD2-CG1 3.41Å; L302-V309 HydrophobicContact CD2-CG2 3.5Å; L302-V309 VanDerWaalsContact CD2-CG2 3.5Å; L302-I311 HydrophobicContact CB-CD1 4.18Å; L302-N346 PolarHBondContact O-N 3.1Å
303	N	83.6	Confident	82.1	Confident	74 Å²	74	39.5 Å²	39.5	40%	0.396	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-43.3	-179.2	-173.5	34.2	0	0	0	112.3	L259 N260 N346	L259-N303 PolarHBondContact O-N 3.09Å; L259-N303 VanDerWaalsContact O-N 3.09Å; N260-N303 WeakPolarHBondContact O-CB 3.41Å; N260-N303 PolarHBondContact OD1-ND2 2.69Å; N303-N346 PolarHBondContact OD1-ND2 2.89Å
304	S	81.2	Confident	81.8	Confident	50 Å²	50	36.7 Å²	36.7	35%	0.35	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	140.4	178	-174.2	0	0	0	0	112.5	N260 S261 S262	N260-S304 PolarHBondContact O-N 2.84Å; S261-S304 WeakPolarHBondContact CA-O 3.09Å; S262-S304 PolarHBondContact N-O 2.87Å
305	S	80.3	Confident	81.4	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.014	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	141.5	171.3	-177.3	0	0	0	0	111.8	S262	S262-S305 WeakPolarHBondContact O-CA 2.99Å
306	N	79.7	Confident	80.1	Confident	95 Å²	95	37.3 Å²	37.3	51%	0.508	20%	0.202	S	C	.	.	S	Bend	trans	-111.1	77.8	167.8	-65	-46.4	0	0	0	109.1	S262 N263 G264	S262-N306 PolarHBondContact O-N 2.69Å; S262-N306 VanDerWaalsContact O-N 3.08Å; N263-N306 PolarHBondContact OD1-ND2 3.25Å; G264-N306 PolarHBondContact N-O 3.29Å
307	G	79	Confident	79.5	Confident	18 Å²	18	38.4 Å²	38.4	19%	0.186	21%	0.208	C	C	.	.	S	Bend	trans	164.8	-175.4	-176	0	0	0	0	0	111.3
308	N	82.6	Confident	78	Confident	98 Å²	98	41.9 Å²	41.9	52%	0.524	22%	0.221	S	C	.	.			trans	-70.7	134.2	179	-64.3	-13.9	0	0	0	110	N265 V266	N265-N308 WeakPolarHBondContact CA-O 3.48Å; N265-N308 PolarHBondContact OD1-N 2.97Å; V266-N308 PolarHBondContact N-O 2.89Å
309	V	80.2	Confident	77.2	Confident	8 Å²	8	43.3 Å²	43.3	5%	0.048	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.5	178.3	177.5	0	0	0	0	109.5	V266 L302 I311 L345	V266-V309 HydrophobicContact CB-CG2 4.41Å; V266-V309 WeakPolarHBondContact O-CA 3.04Å; L302-V309 HydrophobicContact CD2-CB 4.11Å; L302-V309 HydrophobicContact CD2-CG1 3.41Å; L302-V309 VanDerWaalsContact CD2-CG1 3.41Å; L302-V309 HydrophobicContact CD2-CG2 3.5Å; L302-V309 VanDerWaalsContact CD2-CG2 3.5Å; V309-I311 HydrophobicContact CG1-CD1 4Å; V309-I311 HydrophobicContact CG1-CG1 3.92Å; V309-L345 HydrophobicContact CB-CD1 4.47Å; V309-L345 HydrophobicContact CG1-CD1 4.13Å
310	L	84.3	Confident	75.6	Confident	72 Å²	72	44 Å²	44	38%	0.377	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	121.5	169	178	58.2	0	0	0	108.9	V266 L267 I268 T312	V266-L310 PolarHBondContact O-N 2.95Å; L267-L310 WeakPolarHBondContact CA-O 3.48Å; L267-L310 HydrophobicContact CD1-CB 3.79Å; L267-L310 HydrophobicContact CD1-CD2 3.66Å; L267-L310 HydrophobicContact CD1-CG 3.6Å; I268-L310 PolarHBondContact N-O 3.04Å; L310-T312 HydrophobicContact CD1-CG2 3.58Å; L310-T312 HydrophobicContact CD2-CG2 4.39Å; L310-T312 HydrophobicContact CG-CG2 3.86Å
311	I	79.3	Confident	74.6	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.4	176.9	-66.8	169.7	0	0	0	106.8	I268 L302 V309	I268-I311 HydrophobicContact CB-CG1 4.39Å; I268-I311 WeakPolarHBondContact O-CA 3.09Å; L302-I311 HydrophobicContact CB-CD1 4.18Å; V309-I311 HydrophobicContact CG1-CD1 4Å; V309-I311 HydrophobicContact CG1-CG1 3.92Å
312	T	80.4	Confident	73.1	Confident	29 Å²	29	43.3 Å²	43.3	18%	0.178	26%	0.255	C	S	.	.			trans	-128.6	80.1	-178.4	59.8	0	0	0	0	109.8	I268 T269 L310 T314	I268-T312 PolarHBondContact O-N 2.93Å; T269-T312 WeakPolarHBondContact CG2-OG1 3.36Å; L310-T312 HydrophobicContact CD1-CG2 3.58Å; L310-T312 HydrophobicContact CD2-CG2 4.39Å; L310-T312 HydrophobicContact CG-CG2 3.86Å; T312-T314 PolarHBondContact O-N 2.95Å
313	P	76.5	Confident	72.4	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.259	C	S	.	.			trans	-65.5	126.6	159.7	29.3	-31.1	0	0	0	107.2	P270 P298 S343 P356 I357	P270-P313 HydrophobicContact CG-CB 4.2Å; P298-P313 HydrophobicContact CB-CB 3.94Å; P298-P313 HydrophobicContact CG-CB 4.02Å; P313-S343 WeakPolarHBondContact CG-OG 3Å; P313-P356 HydrophobicContact CG-CB 3.98Å; P313-I357 PolarHBondContact O-N 2.96Å
314	T	73.2	Confident	71.1	Confident	46 Å²	46	44.2 Å²	44.2	28%	0.282	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	130.5	-179.7	-57.7	0	0	0	0	108.4	P270 V272 T312 V316 I357	P270-T314 PolarHBondContact O-N 3Å; V272-T314 PolarHBondContact N-O 2.93Å; T312-T314 PolarHBondContact O-N 2.95Å; T314-V316 HydrophobicContact CG2-CG2 4.19Å; T314-I357 WeakPolarHBondContact CA-O 3.43Å
315	V	76.4	Confident	70	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.9	166.8	163.5	0	0	0	0	105.6	Q296 P298 Q339 I357 V358 V359	Q296-V315 HydrophobicContact CB-CG2 4.3Å; P298-V315 HydrophobicContact CG-CG2 3.87Å; V315-Q339 HydrophobicContact CG1-CG 3.94Å; V315-I357 PolarHBondContact N-O 3.29Å; V315-V358 HydrophobicContact CB-CB 4.27Å; V315-V358 HydrophobicContact CB-CG2 3.62Å; V315-V358 HydrophobicContact CG1-CB 4.4Å; V315-V358 HydrophobicContact CG1-CG2 3.91Å; V315-V358 HydrophobicContact CG2-CG2 4Å; V315-V358 CarbonylContact O-C 3.59Å; V315-V358 VanDerWaalsContact O-CA 3.22Å; V315-V358 WeakPolarHBondContact O-CA 3.45Å; V315-V359 PolarHBondContact O-N 2.96Å
316	V	59.1	Low	68.8	Low	60 Å²	60	45.5 Å²	45.5	36%	0.364	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	128	159.9	178.8	0	0	0	0	108.1	T314 V359	T314-V316 HydrophobicContact CG2-CG2 4.19Å; V316-V359 CarbonylContact C-O 3.31Å; V316-V359 WeakPolarHBondContact CA-O 3.17Å; V316-V359 HydrophobicContact CG2-CB 4.35Å
317	E	71.9	Confident	67.6	Low	25 Å²	25	45.2 Å²	45.2	12%	0.117	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130.1	-176.4	167.5	-175.2	172.7	0	0	105.4	N337 Q339 V359 E360 L361	E317-N337 PolarHBondContact OE1-ND2 3.37Å; E317-N337 PolarHBondContact OE2-ND2 2.73Å; E317-Q339 PolarHBondContact OE2-NE2 3.09Å; E317-V359 PolarHBondContact N-O 3.01Å; E317-E360 HydrophobicContact CB-CB 4.32Å; E317-E360 HydrophobicContact CG-CB 4.37Å; E317-E360 HydrophobicContact CG-CG 4.29Å; E317-E360 CarbonylContact O-C 3.53Å; E317-E360 WeakPolarHBondContact O-CA 3.37Å; E317-L361 PolarHBondContact O-N 3.32Å
318	Q	53.6	Low	66.5	Low	104 Å²	104	46.8 Å²	46.8	49%	0.486	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	129.1	162.1	-69.3	-161.7	-14.3	0	0	109.5	L361	Q318-L361 CarbonylContact C-O 3.35Å; Q318-L361 WeakPolarHBondContact CA-O 3.08Å; Q318-L361 VanDerWaalsContact CB-O 3.25Å; Q318-L361 WeakPolarHBondContact CB-O 3.37Å; Q318-L361 HydrophobicContact CG-CB 3.76Å; Q318-L361 HydrophobicContact CG-CD1 4.36Å
319	A	65.9	Low	65.4	Low	31 Å²	31	44 Å²	44	26%	0.256	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	146.1	175.6	0	0	0	0	0	108.7	L361 A362 T363	A319-L361 PolarHBondContact N-O 2.96Å; A319-A362 HydrophobicContact CB-CB 4.2Å; A319-A362 CarbonylContact O-C 3.23Å; A319-A362 VanDerWaalsContact O-CA 3.31Å; A319-A362 WeakPolarHBondContact O-CA 3.1Å; A319-T363 PolarHBondContact O-N 3.34Å
320	T	52.3	Low	64.1	Low	74 Å²	74	47.9 Å²	47.9	45%	0.454	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	126.5	160.8	-53.6	0	0	0	0	109.4	T363	T320-T363 CarbonylContact C-O 3.45Å; T320-T363 WeakPolarHBondContact CA-O 3.12Å; T320-T363 HydrophobicContact CG2-CG2 4.3Å
321	T	63.6	Low	63.1	Low	55 Å²	55	47.4 Å²	47.4	34%	0.337	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	148.8	-178.9	71.4	0	0	0	0	109.7	T363 A364 T365	T321-T363 PolarHBondContact N-O 3.21Å; T321-A364 WeakPolarHBondContact OG1-CA 3.36Å; T321-A364 WeakPolarHBondContact OG1-CB 3.42Å; T321-T365 PolarHBondContact O-N 3.41Å
322	S	51.3	Low	61.9	Low	61 Å²	61	50.5 Å²	50.5	43%	0.427	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	121.2	166.4	-75.2	0	0	0	0	109.4
323	T	65.5	Low	60.9	Low	20 Å²	20	51.2 Å²	51.2	12%	0.123	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.2	-175.7	-51.8	0	0	0	0	108	I325 T365 P366 S367	T323-I325 HydrophobicContact CG2-CD1 4Å; T323-I325 HydrophobicContact CG2-CG1 4.41Å; T323-T365 PolarHBondContact N-O 3.19Å; T323-P366 HydrophobicContact CG2-CB 4.43Å; T323-P366 CarbonylContact O-C 3.6Å; T323-P366 VanDerWaalsContact O-C 3.29Å; T323-P366 WeakPolarHBondContact O-CA 3.39Å; T323-S367 PolarHBondContact O-N 3.43Å; T323-S367 VanDerWaalsContact O-N 3.09Å
324	T	56.5	Low	59.5	Low	79 Å²	79	53.7 Å²	53.7	49%	0.485	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	115.8	163.5	-64.5	0	0	0	0	108.1	S367	T324-S367 VanDerWaalsContact CA-O 3.31Å; T324-S367 WeakPolarHBondContact CA-O 3.42Å; T324-S367 WeakPolarHBondContact CG2-O 3.33Å
325	I	59.4	Low	59	Low	16 Å²	16	54.6 Å²	54.6	8%	0.082	31%	0.309	C	S	.	.			trans	-146.5	110.3	-175.5	-57.9	162.3	0	0	0	110.5	T280 V282 T323 E327 T368	T280-I325 HydrophobicContact CG2-CD1 4.27Å; V282-I325 HydrophobicContact CB-CB 4.17Å; V282-I325 HydrophobicContact CB-CD1 3.36Å; V282-I325 HydrophobicContact CB-CG1 3.51Å; V282-I325 HydrophobicContact CB-CG2 3.62Å; V282-I325 HydrophobicContact CG1-CD1 4.44Å; V282-I325 HydrophobicContact CG1-CG2 3.95Å; V282-I325 HydrophobicContact CG2-CD1 3.19Å; V282-I325 HydrophobicContact CG2-CG1 3.87Å; V282-I325 WeakPolarHBondContact O-CG2 2.95Å; T323-I325 HydrophobicContact CG2-CD1 4Å; T323-I325 HydrophobicContact CG2-CG1 4.41Å; I325-E327 PolarHBondContact O-N 3.32Å; I325-T368 CarbonylContact C-O 3.34Å; I325-T368 CarbonylContact O-C 3.4Å
326	S	53.8	Low	58	Low	64 Å²	64	60.4 Å²	60.4	45%	0.448	33%	0.334	S	S	.	.			trans	-97.7	84.6	-170.6	-57	0	0	0	0	113.9	T368	S326-T368 VanDerWaalsContact CA-O 3.25Å; S326-T368 WeakPolarHBondContact CA-O 3.26Å; S326-T368 PolarHBondContact N-O 2.76Å; S326-T368 PolarHBondContact OG-O 3.28Å; S326-T368 VanDerWaalsContact OG-O 3.09Å
327	E	56.1	Low	58.3	Low	89 Å²	89	57.9 Å²	57.9	42%	0.416	32%	0.319	S	S	.	.	S	Bend	trans	86.7	124.6	169.1	-40.9	-166.9	-171.7	0	0	117.4	E284 I325 S369 E370	E284-E327 CarbonylContact C-O 3.54Å; E284-E327 CarbonylContact O-C 3.51Å; I325-E327 PolarHBondContact O-N 3.32Å; E327-S369 WeakPolarHBondContact CG-O 3.4Å; E327-E370 WeakPolarHBondContact CA-O 3.12Å; E327-E370 WeakPolarHBondContact CB-O 3.48Å; E327-E370 HydrophobicContact CG-CB 3.84Å; E327-E370 VanDerWaalsContact CG-O 3.24Å; E327-E370 WeakPolarHBondContact CG-O 3.38Å; E327-E370 PolarHBondContact N-O 3.24Å; E327-E370 WeakPolarHBondContact OE1-CB 3.42Å; E327-E370 WeakPolarHBondContact OE1-CG 3.33Å
328	S	56.1	Low	57.7	Low	51 Å²	51	58.4 Å²	58.4	36%	0.357	33%	0.325	S	S	.	.			cis	-137.7	135.2	-6	-73.3	0	0	0	0	112.5	E284 S371	E284-S328 PolarHBondContact O-N 3Å; S328-S371 CarbonylContact C-O 3.16Å; S328-S371 VanDerWaalsContact C-O 3.31Å; S328-S371 WeakPolarHBondContact CA-O 3.23Å; S328-S371 WeakPolarHBondContact CB-O 3.21Å; S328-S371 PolarHBondContact OG-N 3.06Å; S328-S371 PolarHBondContact OG-O 3.18Å
329	D	59.5	Low	58.3	Low	40 Å²	40	53.5 Å²	53.5	21%	0.214	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	149.6	-159	-77.2	-31.6	0	0	0	114.9	S371 D372 L373	D329-S371 PolarHBondContact N-O 2.88Å; D329-D372 CarbonylContact O-C 2.91Å; D329-D372 VanDerWaalsContact O-CA 3.23Å; D329-D372 WeakPolarHBondContact O-CA 3.35Å; D329-L373 PolarHBondContact O-N 2.87Å
330	L	52.6	Low	58.1	Low	89 Å²	89	54.8 Å²	54.8	47%	0.466	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	103.4	156.7	-69.5	171	0	0	0	110.8	L287 L373	L287-L330 HydrophobicContact CD2-CB 3.75Å; L330-L373 CarbonylContact C-O 3.31Å; L330-L373 WeakPolarHBondContact CA-O 3.15Å; L330-L373 VanDerWaalsContact CD2-CA 3.49Å; L330-L373 HydrophobicContact CD2-CB 3.12Å; L330-L373 HydrophobicContact CD2-CD1 3.62Å; L330-L373 HydrophobicContact CD2-CG 3.42Å; L330-L373 VanDerWaalsContact CD2-CG 3.42Å; L330-L373 VanDerWaalsContact CD2-N 3.29Å; L330-L373 WeakPolarHBondContact CD2-O 3.39Å
331	R	63.2	Low	58.5	Low	61 Å²	61	51.3 Å²	51.3	23%	0.23	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.1	-174.5	-171.7	175.3	-169.8	-163.6	-6.4	111	E290 E333 L373 R374 N375	E290-R331 IonicContact OE2-CZ 3.56Å; E290-R331 IonicContact OE2-NE 3.14Å; E290-R331 IonicContact OE2-NH2 3.89Å; E290-R331 PolarHBondContact OE2-NH2 2.89Å; R331-E333 HydrophobicContact CG-CG 4.1Å; R331-E333 IonicContact CZ-OE1 3.11Å; R331-E333 IonicContact NE-OE1 2.64Å; R331-E333 PolarHBondContact NE-OE1 2.96Å; R331-E333 VanDerWaalsContact NE-OE1 3.12Å; R331-E333 IonicContact NH1-OE1 2.86Å; R331-E333 PolarHBondContact NH1-OE1 3.21Å; R331-E333 IonicContact NH2-OE1 2.71Å; R331-E333 PolarHBondContact NH2-OE1 2.88Å; R331-L373 PolarHBondContact N-O 2.93Å; R331-R374 CarbonylContact O-C 3.45Å; R331-R374 VanDerWaalsContact O-C 3.23Å; R331-R374 WeakPolarHBondContact O-CA 3.06Å; R331-N375 PolarHBondContact O-N 3.39Å
332	N	52.6	Low	58.4	Low	67 Å²	67	53.1 Å²	53.1	36%	0.358	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	103.4	167.7	179	53.3	0	0	0	111	R288 N375	R288-N332 PolarHBondContact O-N 3.15Å; N332-N375 CarbonylContact C-O 3.5Å; N332-N375 VanDerWaalsContact C-O 3.26Å; N332-N375 WeakPolarHBondContact CA-O 3.01Å; N332-N375 HydrophobicContact CB-CB 4.5Å; N332-N375 WeakPolarHBondContact OD1-CB 3.09Å; N332-N375 PolarHBondContact OD1-ND2 3.04Å; N332-N375 PolarHBondContact OD1-O 3.49Å
333	E	61.1	Low	59.2	Low	44 Å²	44	50.3 Å²	50.3	21%	0.206	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	146.3	174.5	-51.7	176.1	169.8	0	0	110.3	R331 N375 E376 S377	R331-E333 HydrophobicContact CG-CG 4.1Å; R331-E333 IonicContact CZ-OE1 3.11Å; R331-E333 IonicContact NE-OE1 2.64Å; R331-E333 PolarHBondContact NE-OE1 2.96Å; R331-E333 VanDerWaalsContact NE-OE1 3.12Å; R331-E333 IonicContact NH1-OE1 2.86Å; R331-E333 PolarHBondContact NH1-OE1 3.21Å; R331-E333 IonicContact NH2-OE1 2.71Å; R331-E333 PolarHBondContact NH2-OE1 2.88Å; E333-N375 PolarHBondContact N-O 3.33Å; E333-E376 HydrophobicContact CB-CB 4.17Å; E333-E376 HydrophobicContact CB-CG 4.06Å; E333-E376 HydrophobicContact CG-CG 4.12Å; E333-E376 CarbonylContact O-C 3.59Å; E333-E376 WeakPolarHBondContact O-CA 3.46Å; E333-E376 WeakPolarHBondContact OE2-CG 3.43Å; E333-S377 PolarHBondContact O-N 2.96Å
334	S	46.9	Very low	58.9	Low	51 Å²	51	56.1 Å²	56.1	36%	0.357	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	122.3	158.6	-71.4	0	0	0	0	109.4	S377	S334-S377 CarbonylContact C-O 3.22Å; S334-S377 WeakPolarHBondContact CA-O 3.4Å; S334-S377 WeakPolarHBondContact CB-O 3.4Å; S334-S377 WeakPolarHBondContact OG-CB 3.39Å
335	E	62.1	Low	59.2	Low	66 Å²	66	52.7 Å²	52.7	31%	0.308	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.8	-178.9	161.1	-178.8	-163.6	0	0	107.6	S377 E378 K379	E335-S377 PolarHBondContact N-O 3.05Å; E335-E378 HydrophobicContact CB-CB 4.24Å; E335-E378 HydrophobicContact CG-CB 4.24Å; E335-E378 HydrophobicContact CG-CG 4.09Å; E335-E378 CarbonylContact O-C 3.59Å; E335-E378 WeakPolarHBondContact O-CA 3.14Å; E335-E378 WeakPolarHBondContact OE2-CG 3.08Å; E335-K379 PolarHBondContact O-N 2.74Å
336	K	55	Low	59.3	Low	121 Å²	121	55.9 Å²	55.9	53%	0.526	29%	0.286	S	S	.	.			trans	-145.3	93.7	170.7	-169.6	-170.1	174.1	-177	0	110.5	K379	K336-K379 CarbonylContact C-O 3.58Å; K336-K379 WeakPolarHBondContact CA-O 3.18Å; K336-K379 HydrophobicContact CB-CB 4.45Å; K336-K379 HydrophobicContact CD-CG 4.34Å; K336-K379 HydrophobicContact CG-CB 3.9Å; K336-K379 HydrophobicContact CG-CG 3.9Å; K336-K379 WeakPolarHBondContact CG-O 3.42Å
337	N	65.8	Low	59.3	Low	7 Å²	7	55.4 Å²	55.4	4%	0.037	28%	0.283	C	S	.	.			trans	-75.7	137.6	169.8	-176.5	5.6	0	0	0	111.9	E317 Q339 E360 K379 T380 T381	E317-N337 PolarHBondContact OE1-ND2 3.37Å; E317-N337 PolarHBondContact OE2-ND2 2.73Å; N337-Q339 PolarHBondContact ND2-NE2 2.94Å; N337-Q339 WeakPolarHBondContact OD1-CG 3.19Å; N337-E360 PolarHBondContact ND2-OE1 3.19Å; N337-E360 VanDerWaalsContact ND2-OE1 3.1Å; N337-E360 PolarHBondContact ND2-OE2 3.34Å; N337-K379 PolarHBondContact N-O 3.01Å; N337-K379 VanDerWaalsContact N-O 3.11Å; N337-T380 HydrophobicContact CB-CG2 4.12Å; N337-T380 CarbonylContact O-C 3.36Å; N337-T380 VanDerWaalsContact O-C 3.27Å; N337-T380 WeakPolarHBondContact O-CA 3.17Å; N337-T381 PolarHBondContact O-N 3.06Å
338	S	59.7	Low	59.2	Low	37 Å²	37	51.4 Å²	51.4	26%	0.259	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	126.7	161.3	-171.3	0	0	0	0	112	T381	S338-T381 CarbonylContact C-O 3.37Å; S338-T381 WeakPolarHBondContact CA-O 2.76Å; S338-T381 WeakPolarHBondContact CB-O 3.45Å; S338-T381 PolarHBondContact OG-O 3.22Å
339	Q	65.9	Low	58.9	Low	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.6	-179.5	-49.9	142.2	-26	0	0	108.8	V315 E317 N337 V358 T381 Q382 T383	V315-Q339 HydrophobicContact CG1-CG 3.94Å; E317-Q339 PolarHBondContact OE2-NE2 3.09Å; N337-Q339 PolarHBondContact ND2-NE2 2.94Å; N337-Q339 WeakPolarHBondContact OD1-CG 3.19Å; Q339-V358 HydrophobicContact CB-CG2 3.68Å; Q339-V358 VanDerWaalsContact CD-CG1 3.41Å; Q339-V358 HydrophobicContact CG-CG2 4.2Å; Q339-T381 PolarHBondContact N-O 3.04Å; Q339-Q382 HydrophobicContact CB-CB 4.48Å; Q339-Q382 CarbonylContact O-C 3.28Å; Q339-Q382 VanDerWaalsContact O-CA 3.23Å; Q339-Q382 WeakPolarHBondContact O-CA 3.19Å; Q339-T383 PolarHBondContact O-N 3.17Å; Q339-T383 PolarHBondContact O-OG1 3.08Å
340	T	60.5	Low	58.7	Low	59 Å²	59	52.6 Å²	52.6	36%	0.362	27%	0.272	S	S	.	.			trans	-134.7	65.2	-177	44	0	0	0	0	109.6	E342 T383	T340-E342 PolarHBondContact O-N 2.92Å; T340-T383 WeakPolarHBondContact CG2-OG1 3.41Å
341	P	60.7	Low	58.8	Low	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.273	C	S	.	.			trans	-76.8	96.6	-178.2	33.8	-35.9	0	0	0	108.9	P356 V358 T383 P384 E385	P341-P356 HydrophobicContact CB-CB 3.69Å; P341-P356 HydrophobicContact CG-CB 3.95Å; P341-P356 WeakPolarHBondContact O-CB 3.35Å; P341-V358 HydrophobicContact CB-CG2 4.43Å; P341-V358 HydrophobicContact CG-CG2 3.57Å; P341-T383 WeakPolarHBondContact CD-O 3.18Å; P341-P384 HydrophobicContact CG-CB 3.53Å; P341-P384 CarbonylContact O-C 3.43Å; P341-P384 VanDerWaalsContact O-CA 3.26Å; P341-P384 WeakPolarHBondContact O-CA 2.95Å; P341-E385 PolarHBondContact O-N 2.94Å
342	E	62.1	Low	58.8	Low	94 Å²	94	50 Å²	50	44%	0.439	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139.7	171.1	-96.3	-163.2	-164.7	0	0	113.3	T340 E385	T340-E342 PolarHBondContact O-N 2.92Å; E342-E385 CarbonylContact C-O 3.56Å; E342-E385 WeakPolarHBondContact CA-O 3.26Å; E342-E385 HydrophobicContact CG-CB 3.6Å
343	S	67.6	Low	59.1	Low	1 Å²	1	49.9 Å²	49.9	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.8	176.4	-67.4	0	0	0	0	109.7	P313 I354 E385 S386 R387	P313-S343 WeakPolarHBondContact CG-OG 3Å; S343-I354 WeakPolarHBondContact OG-CG2 3.46Å; S343-E385 PolarHBondContact N-O 2.9Å; S343-S386 CarbonylContact O-C 3.43Å; S343-S386 VanDerWaalsContact O-CA 3.27Å; S343-S386 WeakPolarHBondContact O-CA 3.36Å; S343-R387 PolarHBondContact O-N 2.98Å
344	R	59.9	Low	59.4	Low	143 Å²	143	47.8 Å²	47.8	54%	0.54	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.4	169.4	-62.7	-176	63.7	-175	-1.8	115.7	R387	R344-R387 CarbonylContact C-O 3.58Å; R344-R387 WeakPolarHBondContact CA-O 3.18Å; R344-R387 VanDerWaalsContact CB-O 3.29Å; R344-R387 WeakPolarHBondContact CB-O 3.44Å; R344-R387 HydrophobicContact CG-CB 3.94Å
345	L	61.9	Low	60.1	Low	6 Å²	6	46.6 Å²	46.6	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.7	-178.4	-174.5	146.9	0	0	0	110.5	V309 V352 I354 R387 L388 N389	V309-L345 HydrophobicContact CB-CD1 4.47Å; V309-L345 HydrophobicContact CG1-CD1 4.13Å; L345-V352 HydrophobicContact CD1-CB 4.49Å; L345-V352 HydrophobicContact CD1-CG1 3.9Å; L345-V352 HydrophobicContact CD1-CG2 3.72Å; L345-I354 HydrophobicContact CB-CD1 4.49Å; L345-R387 PolarHBondContact N-O 3.24Å; L345-L388 HydrophobicContact CB-CB 4.36Å; L345-L388 HydrophobicContact CB-CD1 4.25Å; L345-L388 HydrophobicContact CB-CG 4.31Å; L345-L388 HydrophobicContact CD1-CD1 4.17Å; L345-L388 HydrophobicContact CD2-CD1 3.58Å; L345-L388 HydrophobicContact CD2-CG 3.7Å; L345-L388 HydrophobicContact CG-CD1 4.19Å; L345-L388 HydrophobicContact CG-CG 4.5Å; L345-L388 CarbonylContact O-C 3.27Å; L345-L388 VanDerWaalsContact O-CA 3.23Å; L345-L388 WeakPolarHBondContact O-CA 3.43Å; L345-N389 PolarHBondContact O-N 2.94Å
346	N	61.5	Low	60.3	Low	83 Å²	83	43.5 Å²	43.5	44%	0.444	23%	0.229	S	C	.	.	S	Bend	trans	-102.2	-18.6	-172.5	-161.7	26.2	0	0	0	116.7	L302 N303 N389	L302-N346 PolarHBondContact O-N 3.1Å; N303-N346 PolarHBondContact OD1-ND2 2.89Å; N346-N389 CarbonylContact O-C 3.55Å; N346-N389 PolarHBondContact OD1-ND2 2.85Å
347	S	53.9	Low	60.5	Low	54 Å²	54	40.5 Å²	40.5	38%	0.378	22%	0.218	S	C	.	.			trans	-177.6	145.3	158.5	-175	0	0	0	0	109.9	S390	S347-S390 CarbonylContact C-O 3.55Å; S347-S390 WeakPolarHBondContact CA-O 3.3Å; S347-S390 WeakPolarHBondContact OG-CB 3.5Å
348	S	54.1	Low	60.7	Low	6 Å²	6	40.1 Å²	40.1	4%	0.042	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-139.2	164	-179.9	69.9	0	0	0	0	112.6	V352 S390 S391 N392	S348-V352 VanDerWaalsContact OG-CG2 3.31Å; S348-V352 WeakPolarHBondContact OG-CG2 3.45Å; S348-S390 PolarHBondContact N-O 2.96Å; S348-S390 PolarHBondContact OG-O 2.99Å; S348-S391 CarbonylContact O-C 3.59Å; S348-S391 WeakPolarHBondContact O-CA 3.08Å; S348-S391 VanDerWaalsContact OG-CA 3.28Å; S348-S391 WeakPolarHBondContact OG-CA 3.21Å; S348-S391 WeakPolarHBondContact OG-CB 3.49Å; S348-N392 PolarHBondContact O-N 2.95Å
349	N	51	Low	60.5	Low	95 Å²	95	40 Å²	40	51%	0.508	21%	0.213	S	C	.	.	S	Bend	trans	-134	103.4	160.8	-81.8	-29.8	0	0	0	109	N392	N349-N392 WeakPolarHBondContact OD1-CB 3.07Å; N349-N392 PolarHBondContact OD1-ND2 2.95Å
350	G	55.5	Low	60.6	Low	21 Å²	21	40 Å²	40	22%	0.216	21%	0.213	C	C	.	.	S	Bend	trans	102.9	146.3	176.2	0	0	0	0	0	114.3	N392	G350-N392 WeakPolarHBondContact CA-O 3.12Å; G350-N392 PolarHBondContact N-O 2.98Å
351	N	54.5	Low	60.1	Low	91 Å²	91	39.3 Å²	39.3	49%	0.487	21%	0.207	S	C	.	.			trans	-45.4	131.3	-141.9	-61.3	2.9	0	0	0	117.2	I394	N351-I394 CarbonylContact C-O 3.38Å; N351-I394 WeakPolarHBondContact CA-O 3.22Å; N351-I394 WeakPolarHBondContact CB-O 2.92Å; N351-I394 VanDerWaalsContact CG-O 3.31Å; N351-I394 PolarHBondContact OD1-N 3.49Å
352	V	62.8	Low	60	Low	3 Å²	3	39.9 Å²	39.9	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.2	177.3	170.2	0	0	0	0	108.2	L345 S348 I354 L388 I394 V395 L396	L345-V352 HydrophobicContact CD1-CB 4.49Å; L345-V352 HydrophobicContact CD1-CG1 3.9Å; L345-V352 HydrophobicContact CD1-CG2 3.72Å; S348-V352 VanDerWaalsContact OG-CG2 3.31Å; S348-V352 WeakPolarHBondContact OG-CG2 3.45Å; V352-I354 HydrophobicContact CG1-CD1 4.1Å; V352-I354 HydrophobicContact CG1-CG1 3.85Å; V352-L388 HydrophobicContact CB-CD1 4.09Å; V352-L388 HydrophobicContact CG1-CD1 3.69Å; V352-L388 HydrophobicContact CG2-CD1 4.04Å; V352-I394 PolarHBondContact N-O 2.71Å; V352-I394 VanDerWaalsContact N-O 3.14Å; V352-V395 HydrophobicContact CB-CB 4.49Å; V352-V395 HydrophobicContact CB-CG1 4.26Å; V352-V395 HydrophobicContact CB-CG2 4.12Å; V352-V395 HydrophobicContact CG1-CG1 4.19Å; V352-V395 CarbonylContact O-C 3.44Å; V352-V395 WeakPolarHBondContact O-CA 3.42Å; V352-L396 PolarHBondContact O-N 2.73Å
353	L	57.8	Low	59.2	Low	65 Å²	65	38.5 Å²	38.5	34%	0.34	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	127	160	171.1	55.3	0	0	0	109.7	T355 L396	L353-T355 HydrophobicContact CD1-CG2 3.27Å; L353-T355 HydrophobicContact CD2-CG2 4.29Å; L353-T355 HydrophobicContact CG-CG2 3.7Å; L353-L396 WeakPolarHBondContact CA-O 3.23Å; L353-L396 HydrophobicContact CD1-CB 3.58Å; L353-L396 HydrophobicContact CD1-CD2 4.05Å; L353-L396 HydrophobicContact CD1-CG 3.57Å; L353-L396 WeakPolarHBondContact CD1-O 3.29Å; L353-L396 HydrophobicContact CD2-CD2 4.4Å
354	I	67.8	Low	58.8	Low	1 Å²	1	39.1 Å²	39.1	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.9	-178.4	-62.4	168	0	0	0	107.1	S343 L345 V352 S386 L388 L396 I397 T398	S343-I354 WeakPolarHBondContact OG-CG2 3.46Å; L345-I354 HydrophobicContact CB-CD1 4.49Å; V352-I354 HydrophobicContact CG1-CD1 4.1Å; V352-I354 HydrophobicContact CG1-CG1 3.85Å; I354-S386 VanDerWaalsContact CG2-CB 3.46Å; I354-S386 WeakPolarHBondContact CG2-OG 3.05Å; I354-L388 HydrophobicContact CD1-CB 4.31Å; I354-L396 PolarHBondContact N-O 2.92Å; I354-L396 VanDerWaalsContact N-O 3.07Å; I354-I397 HydrophobicContact CB-CG1 4.31Å; I354-I397 HydrophobicContact CB-CG2 4.14Å; I354-I397 HydrophobicContact CD1-CD1 4.3Å; I354-I397 HydrophobicContact CD1-CG1 4.39Å; I354-I397 HydrophobicContact CG2-CG2 4.26Å; I354-I397 CarbonylContact O-C 3.44Å; I354-I397 WeakPolarHBondContact O-CA 3.39Å; I354-I397 WeakPolarHBondContact O-CG2 3.22Å; I354-T398 PolarHBondContact O-N 2.88Å
355	T	61.4	Low	58.3	Low	26 Å²	26	35.9 Å²	35.9	16%	0.16	21%	0.211	C	C	.	.			trans	-138.9	82.1	179.8	59.1	0	0	0	0	109.6	L353 I357 T398	L353-T355 HydrophobicContact CD1-CG2 3.27Å; L353-T355 HydrophobicContact CD2-CG2 4.29Å; L353-T355 HydrophobicContact CG-CG2 3.7Å; T355-I357 PolarHBondContact O-N 3.21Å; T355-T398 WeakPolarHBondContact CA-O 3.08Å; T355-T398 VanDerWaalsContact CB-O 3.3Å; T355-T398 WeakPolarHBondContact CB-O 3.07Å; T355-T398 WeakPolarHBondContact CG2-OG1 3.38Å
356	P	66.5	Low	57.8	Low	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.215	C	C	.	.			trans	-60.1	122.9	167	21.3	-25	0	0	0	107.2	P313 P341 P384 S386 P399 T400	P313-P356 HydrophobicContact CG-CB 3.98Å; P341-P356 HydrophobicContact CB-CB 3.69Å; P341-P356 HydrophobicContact CG-CB 3.95Å; P341-P356 WeakPolarHBondContact O-CB 3.35Å; P356-P384 HydrophobicContact CB-CB 4Å; P356-P384 HydrophobicContact CG-CB 3.97Å; P356-S386 WeakPolarHBondContact CD-OG 3.02Å; P356-S386 WeakPolarHBondContact CG-OG 3Å; P356-P399 HydrophobicContact CG-CB 3.79Å; P356-P399 CarbonylContact O-C 3.59Å; P356-P399 VanDerWaalsContact O-CA 3.27Å; P356-P399 WeakPolarHBondContact O-CA 3.35Å; P356-T400 PolarHBondContact O-N 2.91Å
357	I	59.7	Low	57.2	Low	58 Å²	58	34.2 Å²	34.2	30%	0.297	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.1	172.1	-60.5	-175	0	0	0	108.2	P313 T314 V315 T355 V359 T400	P313-I357 PolarHBondContact O-N 2.96Å; T314-I357 WeakPolarHBondContact CA-O 3.43Å; V315-I357 PolarHBondContact N-O 3.29Å; T355-I357 PolarHBondContact O-N 3.21Å; I357-V359 HydrophobicContact CG2-CG2 3.84Å; I357-T400 CarbonylContact C-O 3.46Å; I357-T400 WeakPolarHBondContact CA-O 3.35Å
358	V	70.4	Confident	56.9	Low	0 Å²	0	34 Å²	34	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.7	165.2	147.7	0	0	0	0	106	V315 Q339 P341 Q382 T400 V401 V402	V315-V358 HydrophobicContact CB-CB 4.27Å; V315-V358 HydrophobicContact CB-CG2 3.62Å; V315-V358 HydrophobicContact CG1-CB 4.4Å; V315-V358 HydrophobicContact CG1-CG2 3.91Å; V315-V358 HydrophobicContact CG2-CG2 4Å; V315-V358 CarbonylContact O-C 3.59Å; V315-V358 VanDerWaalsContact O-CA 3.22Å; V315-V358 WeakPolarHBondContact O-CA 3.45Å; Q339-V358 HydrophobicContact CB-CG2 3.68Å; Q339-V358 VanDerWaalsContact CD-CG1 3.41Å; Q339-V358 HydrophobicContact CG-CG2 4.2Å; P341-V358 HydrophobicContact CB-CG2 4.43Å; P341-V358 HydrophobicContact CG-CG2 3.57Å; V358-Q382 HydrophobicContact CG1-CB 4.21Å; V358-Q382 HydrophobicContact CG1-CG 4.15Å; V358-Q382 VanDerWaalsContact CG1-OE1 3.24Å; V358-T400 PolarHBondContact N-O 2.87Å; V358-V401 HydrophobicContact CB-CB 4.33Å; V358-V401 HydrophobicContact CB-CG2 3.47Å; V358-V401 VanDerWaalsContact CB-CG2 3.47Å; V358-V401 HydrophobicContact CG1-CB 4.31Å; V358-V401 HydrophobicContact CG1-CG2 3.57Å; V358-V401 HydrophobicContact CG2-CG2 4.07Å; V358-V401 CarbonylContact O-C 3.37Å; V358-V401 WeakPolarHBondContact O-CA 3.43Å; V358-V401 PolarHBondContact O-N 2.92Å; V358-V402 PolarHBondContact O-N 3.09Å
359	V	55.2	Low	56.4	Low	33 Å²	33	35.6 Å²	35.6	20%	0.2	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	126	161.8	174.6	0	0	0	0	107.9	V315 V316 E317 I357 L361 V402	V315-V359 PolarHBondContact O-N 2.96Å; V316-V359 CarbonylContact C-O 3.31Å; V316-V359 WeakPolarHBondContact CA-O 3.17Å; V316-V359 HydrophobicContact CG2-CB 4.35Å; E317-V359 PolarHBondContact N-O 3.01Å; I357-V359 HydrophobicContact CG2-CG2 3.84Å; V359-L361 HydrophobicContact CG1-CD1 3.48Å; V359-L361 VanDerWaalsContact CG1-CD1 3.48Å; V359-V402 CarbonylContact C-O 3.44Å; V359-V402 WeakPolarHBondContact CA-O 3.18Å; V359-V402 HydrophobicContact CB-CB 4.5Å; V359-V402 WeakPolarHBondContact CB-O 3.43Å; V359-V402 HydrophobicContact CG1-CB 4.23Å; V359-V402 WeakPolarHBondContact CG1-O 3.38Å; V359-V402 HydrophobicContact CG2-CB 3.95Å
360	E	67	Low	56.6	Low	1 Å²	1	35.3 Å²	35.3	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.7	-179.9	161.3	-178.3	177.9	0	0	106.3	E317 N337 T380 Q382 V402 E403 Q404	E317-E360 HydrophobicContact CB-CB 4.32Å; E317-E360 HydrophobicContact CG-CB 4.37Å; E317-E360 HydrophobicContact CG-CG 4.29Å; E317-E360 CarbonylContact O-C 3.53Å; E317-E360 WeakPolarHBondContact O-CA 3.37Å; N337-E360 PolarHBondContact ND2-OE1 3.19Å; N337-E360 VanDerWaalsContact ND2-OE1 3.1Å; N337-E360 PolarHBondContact ND2-OE2 3.34Å; E360-T380 WeakPolarHBondContact OE1-CG2 3.43Å; E360-T380 PolarHBondContact OE1-OG1 2.95Å; E360-T380 WeakPolarHBondContact OE2-CG2 3.38Å; E360-Q382 PolarHBondContact OE2-NE2 2.83Å; E360-V402 PolarHBondContact N-O 2.98Å; E360-E403 HydrophobicContact CB-CG 4.03Å; E360-E403 HydrophobicContact CG-CG 3.95Å; E360-E403 CarbonylContact O-C 3.44Å; E360-E403 WeakPolarHBondContact O-CA 3.46Å; E360-E403 WeakPolarHBondContact OE2-CG 3.17Å; E360-Q404 PolarHBondContact O-N 3.21Å
361	L	49.7	Very low	56.5	Low	45 Å²	45	37 Å²	37	24%	0.236	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	113.3	160.5	-71.2	95.1	0	0	0	111.5	E317 Q318 A319 V359 Q404	E317-L361 PolarHBondContact O-N 3.32Å; Q318-L361 CarbonylContact C-O 3.35Å; Q318-L361 WeakPolarHBondContact CA-O 3.08Å; Q318-L361 VanDerWaalsContact CB-O 3.25Å; Q318-L361 WeakPolarHBondContact CB-O 3.37Å; Q318-L361 HydrophobicContact CG-CB 3.76Å; Q318-L361 HydrophobicContact CG-CD1 4.36Å; A319-L361 PolarHBondContact N-O 2.96Å; V359-L361 HydrophobicContact CG1-CD1 3.48Å; V359-L361 VanDerWaalsContact CG1-CD1 3.48Å; L361-Q404 CarbonylContact C-O 3.53Å; L361-Q404 WeakPolarHBondContact CA-O 3.43Å; L361-Q404 WeakPolarHBondContact CB-O 2.94Å; L361-Q404 HydrophobicContact CD2-CB 3.4Å; L361-Q404 VanDerWaalsContact CD2-CB 3.4Å; L361-Q404 HydrophobicContact CG-CB 3.61Å; L361-Q404 VanDerWaalsContact CG-O 3.31Å; L361-Q404 WeakPolarHBondContact CG-O 2.97Å
362	A	59.8	Low	56.4	Low	12 Å²	12	34.6 Å²	34.6	10%	0.099	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	154.4	164.8	0	0	0	0	0	110.9	A319 Q404 A405 T406	A319-A362 HydrophobicContact CB-CB 4.2Å; A319-A362 CarbonylContact O-C 3.23Å; A319-A362 VanDerWaalsContact O-CA 3.31Å; A319-A362 WeakPolarHBondContact O-CA 3.1Å; A362-Q404 PolarHBondContact N-O 3.04Å; A362-Q404 VanDerWaalsContact N-O 3.15Å; A362-A405 HydrophobicContact CB-CB 3.82Å; A362-A405 VanDerWaalsContact O-CA 3.31Å; A362-A405 WeakPolarHBondContact O-CA 3.24Å; A362-T406 PolarHBondContact O-N 2.99Å
363	T	45.9	Very low	55.8	Low	65 Å²	65	38.5 Å²	38.5	40%	0.399	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	126.3	159	-65.6	0	0	0	0	107	A319 T320 T321	A319-T363 PolarHBondContact O-N 3.34Å; T320-T363 CarbonylContact C-O 3.45Å; T320-T363 WeakPolarHBondContact CA-O 3.12Å; T320-T363 HydrophobicContact CG2-CG2 4.3Å; T321-T363 PolarHBondContact N-O 3.21Å
364	A	58.8	Low	55.9	Low	13 Å²	13	37 Å²	37	11%	0.107	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	144	177.5	0	0	0	0	0	108.7	T321 T407 S408	T321-A364 WeakPolarHBondContact OG1-CA 3.36Å; T321-A364 WeakPolarHBondContact OG1-CB 3.42Å; A364-T407 HydrophobicContact CB-CG2 3.6Å; A364-T407 CarbonylContact O-C 3.53Å; A364-T407 VanDerWaalsContact O-C 3.28Å; A364-T407 WeakPolarHBondContact O-CA 3.23Å; A364-S408 PolarHBondContact O-N 2.93Å
365	T	48.7	Very low	55	Low	75 Å²	75	39.5 Å²	39.5	46%	0.46	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	94.7	163.4	41.2	0	0	0	0	107.6	T321 T323	T321-T365 PolarHBondContact O-N 3.41Å; T323-T365 PolarHBondContact N-O 3.19Å
366	P	50.7	Low	54.8	Low	16 Å²	16	39.3 Å²	39.3	10%	0.104	23%	0.226	C	C	.	.			trans	-73.4	177	159	34.8	-24.5	0	0	0	109.9	T323 S408 T409	T323-P366 HydrophobicContact CG2-CB 4.43Å; T323-P366 CarbonylContact O-C 3.6Å; T323-P366 VanDerWaalsContact O-C 3.29Å; T323-P366 WeakPolarHBondContact O-CA 3.39Å; P366-S408 WeakPolarHBondContact CD-OG 3.45Å; P366-S408 WeakPolarHBondContact CG-OG 3.44Å; P366-T409 VanDerWaalsContact O-O 3.13Å
367	S	49.4	Very low	53.9	Low	39 Å²	39	41.2 Å²	41.2	27%	0.273	24%	0.239	S	C	.	.			trans	-176.4	146.7	142.4	61.7	0	0	0	0	110.3	T323 T324	T323-S367 PolarHBondContact O-N 3.43Å; T323-S367 VanDerWaalsContact O-N 3.09Å; T324-S367 VanDerWaalsContact CA-O 3.31Å; T324-S367 WeakPolarHBondContact CA-O 3.42Å; T324-S367 WeakPolarHBondContact CG2-O 3.33Å
368	T	47.5	Very low	53.8	Low	48 Å²	48	39.3 Å²	39.3	29%	0.294	23%	0.229	S	C	.	.			trans	84.6	146	136.2	66.8	0	0	0	0	123.2	I325 S326 I411	I325-T368 CarbonylContact C-O 3.34Å; I325-T368 CarbonylContact O-C 3.4Å; S326-T368 VanDerWaalsContact CA-O 3.25Å; S326-T368 WeakPolarHBondContact CA-O 3.26Å; S326-T368 PolarHBondContact N-O 2.76Å; S326-T368 PolarHBondContact OG-O 3.28Å; S326-T368 VanDerWaalsContact OG-O 3.09Å; T368-I411 WeakPolarHBondContact CA-O 3.47Å; T368-I411 WeakPolarHBondContact CB-O 3.21Å; T368-I411 WeakPolarHBondContact CG2-O 3.39Å
369	S	44.7	Very low	52.9	Low	40 Å²	40	43.3 Å²	43.3	28%	0.28	25%	0.247	S	C	.	.			cis	-158.5	106.6	-5.3	46.9	0	0	0	0	110.3	E327 I411	E327-S369 WeakPolarHBondContact CG-O 3.4Å; S369-I411 WeakPolarHBondContact CB-O 3.24Å
370	E	54.3	Low	53.2	Low	89 Å²	89	41.8 Å²	41.8	42%	0.416	24%	0.237	S	C	.	.	S	Bend	trans	88.9	164	-177.5	-23	-148	143.1	0	0	114.8	E327 E413	E327-E370 WeakPolarHBondContact CA-O 3.12Å; E327-E370 WeakPolarHBondContact CB-O 3.48Å; E327-E370 HydrophobicContact CG-CB 3.84Å; E327-E370 VanDerWaalsContact CG-O 3.24Å; E327-E370 WeakPolarHBondContact CG-O 3.38Å; E327-E370 PolarHBondContact N-O 3.24Å; E327-E370 WeakPolarHBondContact OE1-CB 3.42Å; E327-E370 WeakPolarHBondContact OE1-CG 3.33Å; E370-E413 WeakPolarHBondContact CA-O 3.11Å; E370-E413 WeakPolarHBondContact CB-O 3.35Å; E370-E413 VanDerWaalsContact CD-O 3.23Å; E370-E413 WeakPolarHBondContact CG-O 3.26Å
371	S	54.3	Low	52.7	Low	58 Å²	58	43.3 Å²	43.3	41%	0.406	25%	0.247	S	C	.	.	S	Bend		-79.7	150.8	-71.9	-64.9	0	0	0	0	113.5	S328 D329 S414	S328-S371 CarbonylContact C-O 3.16Å; S328-S371 VanDerWaalsContact C-O 3.31Å; S328-S371 WeakPolarHBondContact CA-O 3.23Å; S328-S371 WeakPolarHBondContact CB-O 3.21Å; S328-S371 PolarHBondContact OG-N 3.06Å; S328-S371 PolarHBondContact OG-O 3.18Å; D329-S371 PolarHBondContact N-O 2.88Å; S371-S414 WeakPolarHBondContact CA-O 3.46Å
372	D	52.5	Low	53.3	Low	39 Å²	39	41.2 Å²	41.2	21%	0.209	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.4	-154.7	157.9	59.6	0	0	0	111.5	D329 R374 S414 D415	D329-D372 CarbonylContact O-C 2.91Å; D329-D372 VanDerWaalsContact O-CA 3.23Å; D329-D372 WeakPolarHBondContact O-CA 3.35Å; D372-R374 WeakPolarHBondContact OD1-CB 3.32Å; D372-R374 PolarHBondContact OD1-N 3.08Å; D372-S414 PolarHBondContact N-O 3.22Å; D372-D415 WeakPolarHBondContact OD2-CA 3.18Å
373	L	50.7	Low	53.2	Low	86 Å²	86	42.7 Å²	42.7	45%	0.45	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	118.4	139.4	-44.4	162.5	0	0	0	110.8	D329 L330 R331 L416	D329-L373 PolarHBondContact O-N 2.87Å; L330-L373 CarbonylContact C-O 3.31Å; L330-L373 WeakPolarHBondContact CA-O 3.15Å; L330-L373 VanDerWaalsContact CD2-CA 3.49Å; L330-L373 HydrophobicContact CD2-CB 3.12Å; L330-L373 HydrophobicContact CD2-CD1 3.62Å; L330-L373 HydrophobicContact CD2-CG 3.42Å; L330-L373 VanDerWaalsContact CD2-CG 3.42Å; L330-L373 VanDerWaalsContact CD2-N 3.29Å; L330-L373 WeakPolarHBondContact CD2-O 3.39Å; R331-L373 PolarHBondContact N-O 2.93Å; L373-L416 HydrophobicContact CD2-CB 3.49Å; L373-L416 VanDerWaalsContact CD2-CB 3.49Å; L373-L416 VanDerWaalsContact CD2-O 3.25Å; L373-L416 WeakPolarHBondContact CD2-O 3.48Å
374	R	59	Low	53.8	Low	34 Å²	34	39.6 Å²	39.6	13%	0.128	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	148.2	-176.8	176.4	173.2	166.7	-154.7	-14	110	R331 D372 E376 S408 R417 N418 E419	R331-R374 CarbonylContact O-C 3.45Å; R331-R374 VanDerWaalsContact O-C 3.23Å; R331-R374 WeakPolarHBondContact O-CA 3.06Å; D372-R374 WeakPolarHBondContact OD1-CB 3.32Å; D372-R374 PolarHBondContact OD1-N 3.08Å; R374-E376 HydrophobicContact CG-CG 4.04Å; R374-E376 IonicContact CZ-OE1 3.33Å; R374-E376 IonicContact CZ-OE2 3.55Å; R374-E376 VanDerWaalsContact NE-CD 3.26Å; R374-E376 IonicContact NE-OE1 2.65Å; R374-E376 PolarHBondContact NE-OE1 2.97Å; R374-E376 IonicContact NE-OE2 3.42Å; R374-E376 IonicContact NH2-OE1 3.2Å; R374-E376 PolarHBondContact NH2-OE1 3.01Å; R374-E376 IonicContact NH2-OE2 3.66Å; R374-E376 PolarHBondContact NH2-OE2 3.26Å; R374-S408 PolarHBondContact NH2-OG 2.98Å; R374-R417 CarbonylContact O-C 3.39Å; R374-R417 WeakPolarHBondContact O-CA 3.43Å; R374-R417 PolarHBondContact O-N 3.09Å; R374-N418 PolarHBondContact O-N 2.74Å; R374-E419 IonicContact CZ-OE1 3.65Å; R374-E419 IonicContact NE-OE1 2.7Å; R374-E419 IonicContact NH1-OE1 3.06Å; R374-E419 IonicContact NH2-OE1 3.04Å; R374-E419 PolarHBondContact NH2-OE1 2.74Å
375	N	49.2	Very low	53.8	Low	53 Å²	53	40.7 Å²	40.7	28%	0.283	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	122.8	160.3	177.3	91.8	0	0	0	109.5	R331 N332 E333 N418	R331-N375 PolarHBondContact O-N 3.39Å; N332-N375 CarbonylContact C-O 3.5Å; N332-N375 VanDerWaalsContact C-O 3.26Å; N332-N375 WeakPolarHBondContact CA-O 3.01Å; N332-N375 HydrophobicContact CB-CB 4.5Å; N332-N375 WeakPolarHBondContact OD1-CB 3.09Å; N332-N375 PolarHBondContact OD1-ND2 3.04Å; N332-N375 PolarHBondContact OD1-O 3.49Å; E333-N375 PolarHBondContact N-O 3.33Å; N375-N418 CarbonylContact C-O 3.26Å; N375-N418 VanDerWaalsContact C-O 3.3Å; N375-N418 WeakPolarHBondContact CA-O 3.44Å; N375-N418 WeakPolarHBondContact CB-O 3.43Å; N375-N418 VanDerWaalsContact OD1-CB 3.24Å; N375-N418 WeakPolarHBondContact OD1-CB 3.45Å; N375-N418 PolarHBondContact OD1-ND2 2.96Å; N375-N418 PolarHBondContact OD1-O 2.97Å
376	E	57.2	Low	54.6	Low	21 Å²	21	37.1 Å²	37.1	10%	0.098	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145	-177.3	-49.7	-177.4	158.8	0	0	108.1	E333 R374 N418 E419 S420	E333-E376 HydrophobicContact CB-CB 4.17Å; E333-E376 HydrophobicContact CB-CG 4.06Å; E333-E376 HydrophobicContact CG-CG 4.12Å; E333-E376 CarbonylContact O-C 3.59Å; E333-E376 WeakPolarHBondContact O-CA 3.46Å; E333-E376 WeakPolarHBondContact OE2-CG 3.43Å; R374-E376 HydrophobicContact CG-CG 4.04Å; R374-E376 IonicContact CZ-OE1 3.33Å; R374-E376 IonicContact CZ-OE2 3.55Å; R374-E376 VanDerWaalsContact NE-CD 3.26Å; R374-E376 IonicContact NE-OE1 2.65Å; R374-E376 PolarHBondContact NE-OE1 2.97Å; R374-E376 IonicContact NE-OE2 3.42Å; R374-E376 IonicContact NH2-OE1 3.2Å; R374-E376 PolarHBondContact NH2-OE1 3.01Å; R374-E376 IonicContact NH2-OE2 3.66Å; R374-E376 PolarHBondContact NH2-OE2 3.26Å; E376-N418 PolarHBondContact N-O 3.05Å; E376-E419 HydrophobicContact CB-CG 3.64Å; E376-E419 HydrophobicContact CG-CG 3.92Å; E376-E419 CarbonylContact O-C 3.38Å; E376-E419 VanDerWaalsContact O-C 3.28Å; E376-E419 WeakPolarHBondContact O-CA 3.31Å; E376-E419 WeakPolarHBondContact OE2-CG 3.11Å; E376-S420 PolarHBondContact O-N 2.98Å
377	S	46.3	Very low	54.9	Low	40 Å²	40	39.9 Å²	39.9	28%	0.28	21%	0.214	S	C	.	.			trans	-152	101.7	169.4	-173.3	0	0	0	0	110.1	E333 S334 E335 S420	E333-S377 PolarHBondContact O-N 2.96Å; S334-S377 CarbonylContact C-O 3.22Å; S334-S377 WeakPolarHBondContact CA-O 3.4Å; S334-S377 WeakPolarHBondContact CB-O 3.4Å; S334-S377 WeakPolarHBondContact OG-CB 3.39Å; E335-S377 PolarHBondContact N-O 3.05Å; S377-S420 CarbonylContact C-O 3.13Å; S377-S420 WeakPolarHBondContact CA-O 3.14Å; S377-S420 VanDerWaalsContact CB-O 3.32Å; S377-S420 WeakPolarHBondContact CB-O 3.44Å; S377-S420 PolarHBondContact OG-O 3.2Å
378	E	59	Low	55.4	Low	18 Å²	18	38.1 Å²	38.1	8%	0.084	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-80	141.3	170.7	172.2	-178	-179.7	0	0	110.1	E335 S420 E421 K422	E335-E378 HydrophobicContact CB-CB 4.24Å; E335-E378 HydrophobicContact CG-CB 4.24Å; E335-E378 HydrophobicContact CG-CG 4.09Å; E335-E378 CarbonylContact O-C 3.59Å; E335-E378 WeakPolarHBondContact O-CA 3.14Å; E335-E378 WeakPolarHBondContact OE2-CG 3.08Å; E378-S420 PolarHBondContact N-O 3.43Å; E378-E421 HydrophobicContact CB-CB 4.17Å; E378-E421 HydrophobicContact CB-CG 4.32Å; E378-E421 HydrophobicContact CG-CB 4.42Å; E378-E421 HydrophobicContact CG-CG 4.02Å; E378-E421 CarbonylContact O-C 3.57Å; E378-E421 WeakPolarHBondContact O-CA 3.08Å; E378-E421 WeakPolarHBondContact OE2-CG 3.16Å; E378-K422 PolarHBondContact O-N 2.92Å
379	K	50.5	Low	55.7	Low	85 Å²	85	39.3 Å²	39.3	37%	0.37	21%	0.206	S	C	.	.			trans	-153.9	96.1	169.8	166.5	144.5	-172.4	-171.1	0	110.4	E335 K336 N337 K422	E335-K379 PolarHBondContact O-N 2.74Å; K336-K379 CarbonylContact C-O 3.58Å; K336-K379 WeakPolarHBondContact CA-O 3.18Å; K336-K379 HydrophobicContact CB-CB 4.45Å; K336-K379 HydrophobicContact CD-CG 4.34Å; K336-K379 HydrophobicContact CG-CB 3.9Å; K336-K379 HydrophobicContact CG-CG 3.9Å; K336-K379 WeakPolarHBondContact CG-O 3.42Å; N337-K379 PolarHBondContact N-O 3.01Å; N337-K379 VanDerWaalsContact N-O 3.11Å; K379-K422 WeakPolarHBondContact CA-O 3.27Å; K379-K422 WeakPolarHBondContact CD-O 3.35Å; K379-K422 WeakPolarHBondContact CG-O 3.36Å
380	T	62.1	Low	55.9	Low	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.			trans	-80	144.2	170.5	-56.6	0	0	0	0	112	N337 E360 Q382 E403 T423 T424	N337-T380 HydrophobicContact CB-CG2 4.12Å; N337-T380 CarbonylContact O-C 3.36Å; N337-T380 VanDerWaalsContact O-C 3.27Å; N337-T380 WeakPolarHBondContact O-CA 3.17Å; E360-T380 WeakPolarHBondContact OE1-CG2 3.43Å; E360-T380 PolarHBondContact OE1-OG1 2.95Å; E360-T380 WeakPolarHBondContact OE2-CG2 3.38Å; T380-Q382 HydrophobicContact CG2-CG 3.72Å; T380-E403 HydrophobicContact CG2-CG 3.91Å; T380-E403 WeakPolarHBondContact CG2-OE1 3.48Å; T380-T423 CarbonylContact O-C 3.57Å; T380-T423 VanDerWaalsContact O-C 3.22Å; T380-T423 WeakPolarHBondContact O-CA 3.37Å; T380-T424 PolarHBondContact O-N 3.35Å
381	T	56	Low	55.5	Low	34 Å²	34	35.2 Å²	35.2	21%	0.209	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	113.5	163.6	-72.5	0	0	0	0	111.3	N337 S338 Q339 T383 T424	N337-T381 PolarHBondContact O-N 3.06Å; S338-T381 CarbonylContact C-O 3.37Å; S338-T381 WeakPolarHBondContact CA-O 2.76Å; S338-T381 WeakPolarHBondContact CB-O 3.45Å; S338-T381 PolarHBondContact OG-O 3.22Å; Q339-T381 PolarHBondContact N-O 3.04Å; T381-T383 HydrophobicContact CG2-CG2 4.41Å; T381-T424 CarbonylContact C-O 3.55Å; T381-T424 WeakPolarHBondContact CA-O 3.07Å; T381-T424 WeakPolarHBondContact CB-O 3.18Å; T381-T424 WeakPolarHBondContact CG2-O 3.46Å; T381-T424 PolarHBondContact OG1-O 2.81Å
382	Q	63.1	Low	55.2	Low	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.3	-174.4	-32.7	-170.3	-41.1	0	0	108.7	Q339 V358 E360 T380 P384 V401 E403 T424 Q425 T426	Q339-Q382 HydrophobicContact CB-CB 4.48Å; Q339-Q382 CarbonylContact O-C 3.28Å; Q339-Q382 VanDerWaalsContact O-CA 3.23Å; Q339-Q382 WeakPolarHBondContact O-CA 3.19Å; V358-Q382 HydrophobicContact CG1-CB 4.21Å; V358-Q382 HydrophobicContact CG1-CG 4.15Å; V358-Q382 VanDerWaalsContact CG1-OE1 3.24Å; E360-Q382 PolarHBondContact OE2-NE2 2.83Å; T380-Q382 HydrophobicContact CG2-CG 3.72Å; Q382-P384 VanDerWaalsContact C-CD 3.5Å; Q382-V401 HydrophobicContact CB-CB 4.45Å; Q382-V401 HydrophobicContact CB-CG1 4.26Å; Q382-V401 HydrophobicContact CB-CG2 3.38Å; Q382-V401 HydrophobicContact CG-CG2 4.24Å; Q382-V401 VanDerWaalsContact OE1-CB 3.29Å; Q382-E403 WeakPolarHBondContact CG-OE1 3.44Å; Q382-E403 VanDerWaalsContact NE2-CG 3.27Å; Q382-E403 PolarHBondContact NE2-OE1 2.94Å; Q382-E403 PolarHBondContact OE1-OE1 2.91Å; Q382-T424 PolarHBondContact N-O 2.86Å; Q382-T424 VanDerWaalsContact N-O 3.1Å; Q382-Q425 HydrophobicContact CB-CG 4Å; Q382-Q425 HydrophobicContact CG-CG 3.71Å; Q382-Q425 CarbonylContact O-C 3.28Å; Q382-Q425 VanDerWaalsContact O-C 3.31Å; Q382-Q425 WeakPolarHBondContact O-CA 3.41Å; Q382-T426 PolarHBondContact O-N 2.85Å
383	T	57.1	Low	54.8	Low	44 Å²	44	35.6 Å²	35.6	27%	0.27	19%	0.191	S	C	.	.			trans	-134.9	76.3	-179.2	42.5	0	0	0	0	111.3	Q339 T340 P341 T381 E385 T426	Q339-T383 PolarHBondContact O-N 3.17Å; Q339-T383 PolarHBondContact O-OG1 3.08Å; T340-T383 WeakPolarHBondContact CG2-OG1 3.41Å; P341-T383 WeakPolarHBondContact CD-O 3.18Å; T381-T383 HydrophobicContact CG2-CG2 4.41Å; T383-E385 PolarHBondContact O-N 3.07Å; T383-T426 CarbonylContact C-O 3.47Å; T383-T426 WeakPolarHBondContact CA-O 3.27Å
384	P	58.8	Low	54.9	Low	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.194	C	C	.	.			trans	-75	108	175	30.6	-37	0	0	0	110.7	P341 P356 Q382 P399 V401 T426 P427 E428	P341-P384 HydrophobicContact CG-CB 3.53Å; P341-P384 CarbonylContact O-C 3.43Å; P341-P384 VanDerWaalsContact O-CA 3.26Å; P341-P384 WeakPolarHBondContact O-CA 2.95Å; P356-P384 HydrophobicContact CB-CB 4Å; P356-P384 HydrophobicContact CG-CB 3.97Å; Q382-P384 VanDerWaalsContact C-CD 3.5Å; P384-P399 HydrophobicContact CB-CB 3.49Å; P384-P399 VanDerWaalsContact CB-CB 3.49Å; P384-P399 HydrophobicContact CG-CB 3.81Å; P384-P399 WeakPolarHBondContact O-CB 2.95Å; P384-V401 HydrophobicContact CB-CG2 4.11Å; P384-V401 HydrophobicContact CG-CB 3.81Å; P384-V401 HydrophobicContact CG-CG2 3.22Å; P384-T426 VanDerWaalsContact CD-O 3.32Å; P384-T426 WeakPolarHBondContact CD-O 3.43Å; P384-P427 HydrophobicContact CG-CB 3.75Å; P384-P427 HydrophobicContact CG-CG 4.46Å; P384-P427 CarbonylContact O-C 3.45Å; P384-P427 WeakPolarHBondContact O-CA 3.48Å; P384-E428 PolarHBondContact O-N 2.82Å
385	E	58.4	Low	55	Low	36 Å²	36	35.3 Å²	35.3	17%	0.168	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	159.1	170.1	-79.1	-131.8	-169.3	0	0	114.3	P341 E342 S343 T383 E428	P341-E385 PolarHBondContact O-N 2.94Å; E342-E385 CarbonylContact C-O 3.56Å; E342-E385 WeakPolarHBondContact CA-O 3.26Å; E342-E385 HydrophobicContact CG-CB 3.6Å; S343-E385 PolarHBondContact N-O 2.9Å; T383-E385 PolarHBondContact O-N 3.07Å; E385-E428 WeakPolarHBondContact CA-O 3.42Å; E385-E428 WeakPolarHBondContact CB-O 3.46Å; E385-E428 VanDerWaalsContact CD-CB 3.45Å; E385-E428 HydrophobicContact CG-CB 4.03Å; E385-E428 WeakPolarHBondContact CG-O 3.08Å; E385-E428 WeakPolarHBondContact OE1-CB 3.07Å
386	S	65.2	Low	55.3	Low	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	110.5	-163.5	-75.9	0	0	0	0	110	S343 I354 P356 E428 S429 R430	S343-S386 CarbonylContact O-C 3.43Å; S343-S386 VanDerWaalsContact O-CA 3.27Å; S343-S386 WeakPolarHBondContact O-CA 3.36Å; I354-S386 VanDerWaalsContact CG2-CB 3.46Å; I354-S386 WeakPolarHBondContact CG2-OG 3.05Å; P356-S386 WeakPolarHBondContact CD-OG 3.02Å; P356-S386 WeakPolarHBondContact CG-OG 3Å; S386-E428 PolarHBondContact N-O 2.99Å; S386-S429 CarbonylContact O-C 3.49Å; S386-S429 VanDerWaalsContact O-CA 3.31Å; S386-S429 WeakPolarHBondContact O-CA 3.33Å; S386-R430 PolarHBondContact O-N 3.34Å
387	R	58.4	Low	55.6	Low	73 Å²	73	37.1 Å²	37.1	28%	0.275	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	130.2	-175.2	-53.2	-168.5	56.2	175	4.9	116.2	S343 R344 L345 R430	S343-R387 PolarHBondContact O-N 2.98Å; R344-R387 CarbonylContact C-O 3.58Å; R344-R387 WeakPolarHBondContact CA-O 3.18Å; R344-R387 VanDerWaalsContact CB-O 3.29Å; R344-R387 WeakPolarHBondContact CB-O 3.44Å; R344-R387 HydrophobicContact CG-CB 3.94Å; L345-R387 PolarHBondContact N-O 3.24Å; R387-R430 CarbonylContact C-O 3.47Å; R387-R430 WeakPolarHBondContact CA-O 3.46Å; R387-R430 HydrophobicContact CB-CB 4.48Å; R387-R430 WeakPolarHBondContact CB-O 3.2Å; R387-R430 HydrophobicContact CG-CB 3.74Å
388	L	59	Low	56.2	Low	2 Å²	2	37.9 Å²	37.9	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.1	-174.8	175.2	140	0	0	0	110.3	L345 V352 I354 V395 R430 L431 L432	L345-L388 HydrophobicContact CB-CB 4.36Å; L345-L388 HydrophobicContact CB-CD1 4.25Å; L345-L388 HydrophobicContact CB-CG 4.31Å; L345-L388 HydrophobicContact CD1-CD1 4.17Å; L345-L388 HydrophobicContact CD2-CD1 3.58Å; L345-L388 HydrophobicContact CD2-CG 3.7Å; L345-L388 HydrophobicContact CG-CD1 4.19Å; L345-L388 HydrophobicContact CG-CG 4.5Å; L345-L388 CarbonylContact O-C 3.27Å; L345-L388 VanDerWaalsContact O-CA 3.23Å; L345-L388 WeakPolarHBondContact O-CA 3.43Å; V352-L388 HydrophobicContact CB-CD1 4.09Å; V352-L388 HydrophobicContact CG1-CD1 3.69Å; V352-L388 HydrophobicContact CG2-CD1 4.04Å; I354-L388 HydrophobicContact CD1-CB 4.31Å; L388-V395 HydrophobicContact CD1-CG1 4.05Å; L388-V395 HydrophobicContact CD1-CG2 3.87Å; L388-V395 HydrophobicContact CD2-CG2 4.36Å; L388-R430 PolarHBondContact N-O 3.22Å; L388-L431 HydrophobicContact CB-CD2 3.95Å; L388-L431 HydrophobicContact CD1-CD2 4.21Å; L388-L431 HydrophobicContact CD2-CD2 3.31Å; L388-L431 HydrophobicContact CG-CD2 4Å; L388-L431 CarbonylContact O-C 3.21Å; L388-L432 PolarHBondContact O-N 3.14Å
389	N	54.9	Low	56	Low	73 Å²	73	37.9 Å²	37.9	39%	0.39	21%	0.206	S	C	.	.	S	Bend	trans	-117.1	4.8	-176.2	-158.3	33.2	0	0	0	116.6	L345 N346 L432	L345-N389 PolarHBondContact O-N 2.94Å; N346-N389 CarbonylContact O-C 3.55Å; N346-N389 PolarHBondContact OD1-ND2 2.85Å; N389-L432 VanDerWaalsContact OD1-CB 3.23Å; N389-L432 WeakPolarHBondContact OD1-CB 3.47Å; N389-L432 VanDerWaalsContact OD1-CD2 3.24Å; N389-L432 WeakPolarHBondContact OD1-CD2 3.45Å
390	S	47.5	Very low	56.3	Low	42 Å²	42	36.5 Å²	36.5	29%	0.294	21%	0.205	S	C	.	.			trans	-174.3	160.1	137.8	-157.3	0	0	0	0	110.7	S347 S348	S347-S390 CarbonylContact C-O 3.55Å; S347-S390 WeakPolarHBondContact CA-O 3.3Å; S347-S390 WeakPolarHBondContact OG-CB 3.5Å; S348-S390 PolarHBondContact N-O 2.96Å; S348-S390 PolarHBondContact OG-O 2.99Å
391	S	47	Very low	56.4	Low	1 Å²	1	37 Å²	37	1%	0.007	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-153.4	154.6	-175.8	60.5	0	0	0	0	109.6	S348 V395 S433	S348-S391 CarbonylContact O-C 3.59Å; S348-S391 WeakPolarHBondContact O-CA 3.08Å; S348-S391 VanDerWaalsContact OG-CA 3.28Å; S348-S391 WeakPolarHBondContact OG-CA 3.21Å; S348-S391 WeakPolarHBondContact OG-CB 3.49Å; S391-V395 VanDerWaalsContact OG-CG2 3.31Å; S391-V395 WeakPolarHBondContact OG-CG2 3.39Å; S391-S433 PolarHBondContact OG-O 2.79Å; S391-S433 VanDerWaalsContact OG-O 3.14Å
392	N	47.1	Very low	56.4	Low	80 Å²	80	38.1 Å²	38.1	43%	0.428	22%	0.215	S	C	.	.	S	Bend	trans	-133.6	112.1	158	-72.6	-51.3	0	0	0	109.7	S348 N349 G350	S348-N392 PolarHBondContact O-N 2.95Å; N349-N392 WeakPolarHBondContact OD1-CB 3.07Å; N349-N392 PolarHBondContact OD1-ND2 2.95Å; G350-N392 WeakPolarHBondContact CA-O 3.12Å; G350-N392 PolarHBondContact N-O 2.98Å
393	G	44.2	Very low	56.4	Low	26 Å²	26	39.5 Å²	39.5	27%	0.268	22%	0.221	S	C	.	.	S	Bend	trans	92.3	145.2	-179.4	0	0	0	0	0	113.6	V395	G393-V395 PolarHBondContact O-N 3.3Å
394	I	53.4	Low	55.9	Low	98 Å²	98	43.3 Å²	43.3	50%	0.503	24%	0.236	S	C	.	.			trans	-37.8	115.4	-144.8	-60.6	174.8	0	0	0	114.6	N351 V352 Y434	N351-I394 CarbonylContact C-O 3.38Å; N351-I394 WeakPolarHBondContact CA-O 3.22Å; N351-I394 WeakPolarHBondContact CB-O 2.92Å; N351-I394 VanDerWaalsContact CG-O 3.31Å; N351-I394 PolarHBondContact OD1-N 3.49Å; V352-I394 PolarHBondContact N-O 2.71Å; V352-I394 VanDerWaalsContact N-O 3.14Å; I394-Y434 VanDerWaalsContact CA-CE2 3.49Å; I394-Y434 WeakPolarHBondContact CA-OH 2.87Å; I394-Y434 WeakPolarHBondContact CG1-OH 3.37Å
395	V	61.2	Low	56	Low	15 Å²	15	44 Å²	44	9%	0.091	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	139.5	159.8	-176.7	0	0	0	0	109.1	V352 L388 S391 G393 I397 L431 Y434	V352-V395 HydrophobicContact CB-CB 4.49Å; V352-V395 HydrophobicContact CB-CG1 4.26Å; V352-V395 HydrophobicContact CB-CG2 4.12Å; V352-V395 HydrophobicContact CG1-CG1 4.19Å; V352-V395 CarbonylContact O-C 3.44Å; V352-V395 WeakPolarHBondContact O-CA 3.42Å; L388-V395 HydrophobicContact CD1-CG1 4.05Å; L388-V395 HydrophobicContact CD1-CG2 3.87Å; L388-V395 HydrophobicContact CD2-CG2 4.36Å; S391-V395 VanDerWaalsContact OG-CG2 3.31Å; S391-V395 WeakPolarHBondContact OG-CG2 3.39Å; G393-V395 PolarHBondContact O-N 3.3Å; V395-I397 HydrophobicContact CG1-CD1 4.43Å; V395-I397 HydrophobicContact CG1-CG1 3.91Å; V395-L431 HydrophobicContact CB-CD1 4.48Å; V395-L431 HydrophobicContact CB-CD2 3.75Å; V395-L431 HydrophobicContact CG1-CD1 4.26Å; V395-L431 HydrophobicContact CG1-CD2 3.42Å; V395-L431 VanDerWaalsContact CG1-CD2 3.42Å; V395-L431 HydrophobicContact CG1-CG 4.2Å; V395-L431 HydrophobicContact CG2-CD2 3.84Å; V395-Y434 HydrophobicContact CB-CD2 4.47Å; V395-Y434 HydrophobicContact CG2-CD2 4.05Å
396	L	55.5	Low	55.3	Low	94 Å²	94	47.1 Å²	47.1	49%	0.492	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	153	153.7	171	67.7	0	0	0	109.2	V352 L353 I354 T398	V352-L396 PolarHBondContact O-N 2.73Å; L353-L396 WeakPolarHBondContact CA-O 3.23Å; L353-L396 HydrophobicContact CD1-CB 3.58Å; L353-L396 HydrophobicContact CD1-CD2 4.05Å; L353-L396 HydrophobicContact CD1-CG 3.57Å; L353-L396 WeakPolarHBondContact CD1-O 3.29Å; L353-L396 HydrophobicContact CD2-CD2 4.4Å; I354-L396 PolarHBondContact N-O 2.92Å; I354-L396 VanDerWaalsContact N-O 3.07Å; L396-T398 HydrophobicContact CD1-CG2 4.12Å; L396-T398 HydrophobicContact CD2-CG2 4.35Å; L396-T398 HydrophobicContact CG-CG2 4.18Å
397	I	63.4	Low	54.6	Low	19 Å²	19	49.7 Å²	49.7	10%	0.097	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.3	178.3	-53.4	-174.8	0	0	0	107.4	I354 V395 S429 L431	I354-I397 HydrophobicContact CB-CG1 4.31Å; I354-I397 HydrophobicContact CB-CG2 4.14Å; I354-I397 HydrophobicContact CD1-CD1 4.3Å; I354-I397 HydrophobicContact CD1-CG1 4.39Å; I354-I397 HydrophobicContact CG2-CG2 4.26Å; I354-I397 CarbonylContact O-C 3.44Å; I354-I397 WeakPolarHBondContact O-CA 3.39Å; I354-I397 WeakPolarHBondContact O-CG2 3.22Å; V395-I397 HydrophobicContact CG1-CD1 4.43Å; V395-I397 HydrophobicContact CG1-CG1 3.91Å; I397-S429 WeakPolarHBondContact CG2-OG 3.39Å; I397-L431 HydrophobicContact CD1-CD1 4.46Å; I397-L431 HydrophobicContact CD1-CD2 4.28Å; I397-L431 HydrophobicContact CD1-CG 3.77Å; I397-L431 HydrophobicContact CG1-CG 4.49Å
398	T	58.1	Low	53.6	Low	55 Å²	55	46.7 Å²	46.7	34%	0.337	27%	0.269	S	S	.	.			trans	-138.2	88.2	173.4	62.7	0	0	0	0	111.1	I354 T355 L396 T400	I354-T398 PolarHBondContact O-N 2.88Å; T355-T398 WeakPolarHBondContact CA-O 3.08Å; T355-T398 VanDerWaalsContact CB-O 3.3Å; T355-T398 WeakPolarHBondContact CB-O 3.07Å; T355-T398 WeakPolarHBondContact CG2-OG1 3.38Å; L396-T398 HydrophobicContact CD1-CG2 4.12Å; L396-T398 HydrophobicContact CD2-CG2 4.35Å; L396-T398 HydrophobicContact CG-CG2 4.18Å; T398-T400 PolarHBondContact O-N 2.9Å
399	P	54.9	Low	52.9	Low	18 Å²	18	50.8 Å²	50.8	12%	0.117	29%	0.294	C	S	.	.			trans	-62.1	115.7	159.8	29.1	-37.8	0	0	0	109.4	P356 P384 P427 S429	P356-P399 HydrophobicContact CG-CB 3.79Å; P356-P399 CarbonylContact O-C 3.59Å; P356-P399 VanDerWaalsContact O-CA 3.27Å; P356-P399 WeakPolarHBondContact O-CA 3.35Å; P384-P399 HydrophobicContact CB-CB 3.49Å; P384-P399 VanDerWaalsContact CB-CB 3.49Å; P384-P399 HydrophobicContact CG-CB 3.81Å; P384-P399 WeakPolarHBondContact O-CB 2.95Å; P399-P427 HydrophobicContact CB-CB 3.67Å; P399-P427 HydrophobicContact CG-CB 3.67Å; P399-P427 WeakPolarHBondContact O-CB 3.28Å; P399-S429 WeakPolarHBondContact CD-OG 3.1Å; P399-S429 VanDerWaalsContact CG-OG 3.22Å; P399-S429 WeakPolarHBondContact CG-OG 3.02Å
400	T	57.1	Low	52.4	Low	57 Å²	57	49.1 Å²	49.1	35%	0.35	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	152.8	169.9	-55.8	0	0	0	0	108.9	P356 I357 V358 T398 V402	P356-T400 PolarHBondContact O-N 2.91Å; I357-T400 CarbonylContact C-O 3.46Å; I357-T400 WeakPolarHBondContact CA-O 3.35Å; V358-T400 PolarHBondContact N-O 2.87Å; T398-T400 PolarHBondContact O-N 2.9Å; T400-V402 HydrophobicContact CG2-CG2 3.95Å
401	V	64.9	Low	52.2	Low	10 Å²	10	52 Å²	52	6%	0.061	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	114.5	-158.8	117.9	0	0	0	0	100	V358 Q382 P384 Q425	V358-V401 HydrophobicContact CB-CB 4.33Å; V358-V401 HydrophobicContact CB-CG2 3.47Å; V358-V401 VanDerWaalsContact CB-CG2 3.47Å; V358-V401 HydrophobicContact CG1-CB 4.31Å; V358-V401 HydrophobicContact CG1-CG2 3.57Å; V358-V401 HydrophobicContact CG2-CG2 4.07Å; V358-V401 CarbonylContact O-C 3.37Å; V358-V401 WeakPolarHBondContact O-CA 3.43Å; V358-V401 PolarHBondContact O-N 2.92Å; Q382-V401 HydrophobicContact CB-CB 4.45Å; Q382-V401 HydrophobicContact CB-CG1 4.26Å; Q382-V401 HydrophobicContact CB-CG2 3.38Å; Q382-V401 HydrophobicContact CG-CG2 4.24Å; Q382-V401 VanDerWaalsContact OE1-CB 3.29Å; P384-V401 HydrophobicContact CB-CG2 4.11Å; P384-V401 HydrophobicContact CG-CB 3.81Å; P384-V401 HydrophobicContact CG-CG2 3.22Å; V401-Q425 HydrophobicContact CG1-CB 3.43Å; V401-Q425 VanDerWaalsContact CG1-CB 3.43Å; V401-Q425 HydrophobicContact CG1-CG 3.23Å
402	V	55.1	Low	52.1	Low	58 Å²	58	54.9 Å²	54.9	35%	0.352	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	98.8	175.1	-178.5	0	0	0	0	109.5	V358 V359 E360 T400	V358-V402 PolarHBondContact O-N 3.09Å; V359-V402 CarbonylContact C-O 3.44Å; V359-V402 WeakPolarHBondContact CA-O 3.18Å; V359-V402 HydrophobicContact CB-CB 4.5Å; V359-V402 WeakPolarHBondContact CB-O 3.43Å; V359-V402 HydrophobicContact CG1-CB 4.23Å; V359-V402 WeakPolarHBondContact CG1-O 3.38Å; V359-V402 HydrophobicContact CG2-CB 3.95Å; E360-V402 PolarHBondContact N-O 2.98Å; T400-V402 HydrophobicContact CG2-CG2 3.95Å
403	E	62.9	Low	52.2	Low	29 Å²	29	57.5 Å²	57.5	14%	0.136	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	147.4	151.9	-79.7	151.6	-128.1	0	0	113.4	E360 T380 Q382 T423 Q425	E360-E403 HydrophobicContact CB-CG 4.03Å; E360-E403 HydrophobicContact CG-CG 3.95Å; E360-E403 CarbonylContact O-C 3.44Å; E360-E403 WeakPolarHBondContact O-CA 3.46Å; E360-E403 WeakPolarHBondContact OE2-CG 3.17Å; T380-E403 HydrophobicContact CG2-CG 3.91Å; T380-E403 WeakPolarHBondContact CG2-OE1 3.48Å; Q382-E403 WeakPolarHBondContact CG-OE1 3.44Å; Q382-E403 VanDerWaalsContact NE2-CG 3.27Å; Q382-E403 PolarHBondContact NE2-OE1 2.94Å; Q382-E403 PolarHBondContact OE1-OE1 2.91Å; E403-T423 VanDerWaalsContact CD-CG2 3.48Å; E403-T423 WeakPolarHBondContact OE1-CG2 3.31Å; E403-T423 WeakPolarHBondContact OE2-CB 3.31Å; E403-T423 WeakPolarHBondContact OE2-CG2 3.19Å; E403-T423 PolarHBondContact OE2-OG1 2.84Å; E403-Q425 WeakPolarHBondContact OE1-CG 3.37Å; E403-Q425 PolarHBondContact OE1-NE2 3.34Å; E403-Q425 PolarHBondContact OE2-NE2 2.93Å
404	Q	46.8	Very low	52.5	Low	124 Å²	124	60 Å²	60	58%	0.579	34%	0.341	S	S	*	.			trans	-159.4	91	146.4	-115.8	170.3	73.5	0	0	109.9	E360 L361 A362	E360-Q404 PolarHBondContact O-N 3.21Å; L361-Q404 CarbonylContact C-O 3.53Å; L361-Q404 WeakPolarHBondContact CA-O 3.43Å; L361-Q404 WeakPolarHBondContact CB-O 2.94Å; L361-Q404 HydrophobicContact CD2-CB 3.4Å; L361-Q404 VanDerWaalsContact CD2-CB 3.4Å; L361-Q404 HydrophobicContact CG-CB 3.61Å; L361-Q404 VanDerWaalsContact CG-O 3.31Å; L361-Q404 WeakPolarHBondContact CG-O 2.97Å; A362-Q404 PolarHBondContact N-O 3.04Å; A362-Q404 VanDerWaalsContact N-O 3.15Å
405	A	61.1	Low	52.1	Low	14 Å²	14	59 Å²	59	12%	0.116	34%	0.337	C	S	.	.			trans	-64.9	155.4	146	0	0	0	0	0	110.9	A362	A362-A405 HydrophobicContact CB-CB 3.82Å; A362-A405 VanDerWaalsContact O-CA 3.31Å; A362-A405 WeakPolarHBondContact O-CA 3.24Å
406	T	43.9	Very low	51.4	Low	102 Å²	102	64.6 Å²	64.6	63%	0.626	37%	0.366	S	S	*	.				-176	88.2	122.4	23.7	0	0	0	0	111.1	A362	A362-T406 PolarHBondContact O-N 2.99Å
407	T	50.3	Low	51.2	Low	53 Å²	53	64 Å²	64	33%	0.325	36%	0.357	S	S	.	.				21.6	120.5	114	55.6	0	0	0	0	121	A364	A364-T407 HydrophobicContact CB-CG2 3.6Å; A364-T407 CarbonylContact O-C 3.53Å; A364-T407 VanDerWaalsContact O-C 3.28Å; A364-T407 WeakPolarHBondContact O-CA 3.23Å
408	S	37.5	Very low	50.4	Low	10 Å²	10	67.7 Å²	67.7	7%	0.07	38%	0.377	C	S	.	.				77.5	115.7	99.5	-168.6	0	0	0	0	119.1	A364 P366 R374	A364-S408 PolarHBondContact O-N 2.93Å; P366-S408 WeakPolarHBondContact CD-OG 3.45Å; P366-S408 WeakPolarHBondContact CG-OG 3.44Å; R374-S408 PolarHBondContact NH2-OG 2.98Å
409	T	44.2	Very low	49.9	Very low	89 Å²	89	68.1 Å²	68.1	55%	0.546	38%	0.375	S	S	.	.			trans	-175.7	152.1	167.2	-81.4	0	0	0	0	109.8	P366	P366-T409 VanDerWaalsContact O-O 3.13Å
410	T	44.7	Very low	49.3	Very low	38 Å²	38	70.2 Å²	70.2	23%	0.233	39%	0.39	C	S	.	.			cis	-176.2	177.2	-23	-68.1	0	0	0	0	102.2	R417	T410-R417 PolarHBondContact OG1-NH1 3.08Å
411	I	43.2	Very low	48.9	Very low	101 Å²	101	72.6 Å²	72.6	52%	0.518	40%	0.397	S	S	.	.			trans	110.1	139.4	148.7	-47	149.2	0	0	0	112	T368 S369	T368-I411 WeakPolarHBondContact CA-O 3.47Å; T368-I411 WeakPolarHBondContact CB-O 3.21Å; T368-I411 WeakPolarHBondContact CG2-O 3.39Å; S369-I411 WeakPolarHBondContact CB-O 3.24Å
412	S	44.2	Very low	48	Very low	63 Å²	63	78 Å²	78	44%	0.441	42%	0.42	S	S	.	.	S	Bend	cis	-148.6	54.7	25.7	-33.2	0	0	0	0	116.4
413	E	49.7	Very low	47.9	Very low	135 Å²	135	76.9 Å²	76.9	63%	0.631	41%	0.414	S	S	*	.	S	Bend	trans	102.9	139.2	174.7	-58.6	172.4	177.4	0	0	113.2	E370	E370-E413 WeakPolarHBondContact CA-O 3.11Å; E370-E413 WeakPolarHBondContact CB-O 3.35Å; E370-E413 VanDerWaalsContact CD-O 3.23Å; E370-E413 WeakPolarHBondContact CG-O 3.26Å
414	S	50.8	Low	47.3	Very low	77 Å²	77	78.4 Å²	78.4	54%	0.538	43%	0.425	S	S	.	.			cis	-124.2	113.2	-14.7	-45.1	0	0	0	0	107.1	S371 D372	S371-S414 WeakPolarHBondContact CA-O 3.46Å; D372-S414 PolarHBondContact N-O 3.22Å
415	D	44.2	Very low	47.8	Very low	79 Å²	79	75.7 Å²	75.7	42%	0.422	41%	0.412	S	S	.	.			cis	84.5	107.2	40	-77.8	-40.5	0	0	0	115.9	D372	D372-D415 WeakPolarHBondContact OD2-CA 3.18Å
416	L	47.6	Very low	47.5	Very low	132 Å²	132	78.2 Å²	78.2	69%	0.691	43%	0.426	S	S	*	.			trans	179.2	70.3	135	-96.7	177.1	0	0	0	112.5	L373	L373-L416 HydrophobicContact CD2-CB 3.49Å; L373-L416 VanDerWaalsContact CD2-CB 3.49Å; L373-L416 VanDerWaalsContact CD2-O 3.25Å; L373-L416 WeakPolarHBondContact CD2-O 3.48Å
417	R	50.3	Low	48	Very low	80 Å²	80	76 Å²	76	30%	0.302	41%	0.414	S	S	.	.				-0.1	139.2	120.1	-166.2	174.8	-178.7	169.9	0.1	119.5	R374 T410 E419	R374-R417 CarbonylContact O-C 3.39Å; R374-R417 WeakPolarHBondContact O-CA 3.43Å; R374-R417 PolarHBondContact O-N 3.09Å; T410-R417 PolarHBondContact OG1-NH1 3.08Å; R417-E419 IonicContact CZ-OE1 3.76Å; R417-E419 IonicContact CZ-OE2 2.71Å; R417-E419 IonicContact NE-OE1 3.26Å; R417-E419 PolarHBondContact NE-OE1 3.23Å; R417-E419 IonicContact NE-OE2 3.75Å; R417-E419 PolarHBondContact NE-OE2 3.14Å; R417-E419 IonicContact NH2-OE1 2.95Å; R417-E419 PolarHBondContact NH2-OE1 3.37Å; R417-E419 IonicContact NH2-OE2 2.69Å; R417-E419 PolarHBondContact NH2-OE2 3.33Å
418	N	46.3	Very low	48.2	Very low	98 Å²	98	77.8 Å²	77.8	52%	0.524	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	122.4	139.9	175.4	60.5	0	0	0	113.2	R374 N375 E376	R374-N418 PolarHBondContact O-N 2.74Å; N375-N418 CarbonylContact C-O 3.26Å; N375-N418 VanDerWaalsContact C-O 3.3Å; N375-N418 WeakPolarHBondContact CA-O 3.44Å; N375-N418 WeakPolarHBondContact CB-O 3.43Å; N375-N418 VanDerWaalsContact OD1-CB 3.24Å; N375-N418 WeakPolarHBondContact OD1-CB 3.45Å; N375-N418 PolarHBondContact OD1-ND2 2.96Å; N375-N418 PolarHBondContact OD1-O 2.97Å; E376-N418 PolarHBondContact N-O 3.05Å
419	E	47.8	Very low	49.1	Very low	63 Å²	63	79.2 Å²	79.2	29%	0.294	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.4	-179.5	-90.8	156.8	-147.1	0	0	110.2	R374 E376 R417	R374-E419 IonicContact CZ-OE1 3.65Å; R374-E419 IonicContact NE-OE1 2.7Å; R374-E419 IonicContact NH1-OE1 3.06Å; R374-E419 IonicContact NH2-OE1 3.04Å; R374-E419 PolarHBondContact NH2-OE1 2.74Å; E376-E419 HydrophobicContact CB-CG 3.64Å; E376-E419 HydrophobicContact CG-CG 3.92Å; E376-E419 CarbonylContact O-C 3.38Å; E376-E419 VanDerWaalsContact O-C 3.28Å; E376-E419 WeakPolarHBondContact O-CA 3.31Å; E376-E419 WeakPolarHBondContact OE2-CG 3.11Å; R417-E419 IonicContact CZ-OE1 3.76Å; R417-E419 IonicContact CZ-OE2 2.71Å; R417-E419 IonicContact NE-OE1 3.26Å; R417-E419 PolarHBondContact NE-OE1 3.23Å; R417-E419 IonicContact NE-OE2 3.75Å; R417-E419 PolarHBondContact NE-OE2 3.14Å; R417-E419 IonicContact NH2-OE1 2.95Å; R417-E419 PolarHBondContact NH2-OE1 3.37Å; R417-E419 IonicContact NH2-OE2 2.69Å; R417-E419 PolarHBondContact NH2-OE2 3.33Å
420	S	42.7	Very low	49.5	Very low	63 Å²	63	81 Å²	81	44%	0.441	43%	0.425	S	S	.	.			trans	-150.3	96.8	166.1	176.1	0	0	0	0	112.7	E376 S377 E378	E376-S420 PolarHBondContact O-N 2.98Å; S377-S420 CarbonylContact C-O 3.13Å; S377-S420 WeakPolarHBondContact CA-O 3.14Å; S377-S420 VanDerWaalsContact CB-O 3.32Å; S377-S420 WeakPolarHBondContact CB-O 3.44Å; S377-S420 PolarHBondContact OG-O 3.2Å; E378-S420 PolarHBondContact N-O 3.43Å
421	E	48.9	Very low	49.8	Very low	106 Å²	106	82.7 Å²	82.7	50%	0.495	43%	0.432	S	S	.	.			trans	-67.4	133.4	158	-174.8	-176.7	165.8	0	0	112.6	E378	E378-E421 HydrophobicContact CB-CB 4.17Å; E378-E421 HydrophobicContact CB-CG 4.32Å; E378-E421 HydrophobicContact CG-CB 4.42Å; E378-E421 HydrophobicContact CG-CG 4.02Å; E378-E421 CarbonylContact O-C 3.57Å; E378-E421 WeakPolarHBondContact O-CA 3.08Å; E378-E421 WeakPolarHBondContact OE2-CG 3.16Å
422	K	45.4	Very low	50.3	Low	123 Å²	123	82.3 Å²	82.3	54%	0.535	43%	0.431	S	S	.	.			trans	-153.9	96.1	150.2	-172.9	173.1	176.1	173.5	0	113.7	E378 K379	E378-K422 PolarHBondContact O-N 2.92Å; K379-K422 WeakPolarHBondContact CA-O 3.27Å; K379-K422 WeakPolarHBondContact CD-O 3.35Å; K379-K422 WeakPolarHBondContact CG-O 3.36Å
423	T	54	Low	50.4	Low	36 Å²	36	82.9 Å²	82.9	22%	0.221	44%	0.435	C	S	.	.			trans	-41.8	135.9	141.5	-65.4	0	0	0	0	116.2	T380 E403 Q425	T380-T423 CarbonylContact O-C 3.57Å; T380-T423 VanDerWaalsContact O-C 3.22Å; T380-T423 WeakPolarHBondContact O-CA 3.37Å; E403-T423 VanDerWaalsContact CD-CG2 3.48Å; E403-T423 WeakPolarHBondContact OE1-CG2 3.31Å; E403-T423 WeakPolarHBondContact OE2-CB 3.31Å; E403-T423 WeakPolarHBondContact OE2-CG2 3.19Å; E403-T423 PolarHBondContact OE2-OG1 2.84Å; T423-Q425 HydrophobicContact CG2-CG 4.18Å
424	T	50.2	Low	50	Low	61 Å²	61	79.8 Å²	79.8	37%	0.374	42%	0.418	S	S	.	.			trans	-148.4	122.1	143	-65.3	0	0	0	0	112	T380 T381 Q382	T380-T424 PolarHBondContact O-N 3.35Å; T381-T424 CarbonylContact C-O 3.55Å; T381-T424 WeakPolarHBondContact CA-O 3.07Å; T381-T424 WeakPolarHBondContact CB-O 3.18Å; T381-T424 WeakPolarHBondContact CG2-O 3.46Å; T381-T424 PolarHBondContact OG1-O 2.81Å; Q382-T424 PolarHBondContact N-O 2.86Å; Q382-T424 VanDerWaalsContact N-O 3.1Å
425	Q	57.8	Low	49.5	Very low	66 Å²	66	80.5 Å²	80.5	31%	0.308	42%	0.419	S	S	.	.			trans	-92	138.2	174.8	-68.9	177.9	-1.2	0	0	111	Q382 V401 E403 T423	Q382-Q425 HydrophobicContact CB-CG 4Å; Q382-Q425 HydrophobicContact CG-CG 3.71Å; Q382-Q425 CarbonylContact O-C 3.28Å; Q382-Q425 VanDerWaalsContact O-C 3.31Å; Q382-Q425 WeakPolarHBondContact O-CA 3.41Å; V401-Q425 HydrophobicContact CG1-CB 3.43Å; V401-Q425 VanDerWaalsContact CG1-CB 3.43Å; V401-Q425 HydrophobicContact CG1-CG 3.23Å; E403-Q425 WeakPolarHBondContact OE1-CG 3.37Å; E403-Q425 PolarHBondContact OE1-NE2 3.34Å; E403-Q425 PolarHBondContact OE2-NE2 2.93Å; T423-Q425 HydrophobicContact CG2-CG 4.18Å
426	T	54.2	Low	49.2	Very low	67 Å²	67	82.2 Å²	82.2	41%	0.411	43%	0.426	S	S	.	.			trans	-140.5	91.9	162.7	-55.8	0	0	0	0	111.9	Q382 T383 P384	Q382-T426 PolarHBondContact O-N 2.85Å; T383-T426 CarbonylContact C-O 3.47Å; T383-T426 WeakPolarHBondContact CA-O 3.27Å; P384-T426 VanDerWaalsContact CD-O 3.32Å; P384-T426 WeakPolarHBondContact CD-O 3.43Å
427	P	54	Low	48.7	Very low	57 Å²	57	82.8 Å²	82.8	37%	0.37	43%	0.429	S	S	.	.			trans	-63.6	115.3	150.8	24.7	-33.1	0	0	0	115.1	P384 P399	P384-P427 HydrophobicContact CG-CB 3.75Å; P384-P427 HydrophobicContact CG-CG 4.46Å; P384-P427 CarbonylContact O-C 3.45Å; P384-P427 WeakPolarHBondContact O-CA 3.48Å; P399-P427 HydrophobicContact CB-CB 3.67Å; P399-P427 HydrophobicContact CG-CB 3.67Å; P399-P427 WeakPolarHBondContact O-CB 3.28Å
428	E	53.9	Low	48.4	Very low	90 Å²	90	85.6 Å²	85.6	42%	0.421	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	151.2	157.4	-118.5	-169.3	-141.6	0	0	115.4	P384 E385 S386 R430	P384-E428 PolarHBondContact O-N 2.82Å; E385-E428 WeakPolarHBondContact CA-O 3.42Å; E385-E428 WeakPolarHBondContact CB-O 3.46Å; E385-E428 VanDerWaalsContact CD-CB 3.45Å; E385-E428 HydrophobicContact CG-CB 4.03Å; E385-E428 WeakPolarHBondContact CG-O 3.08Å; E385-E428 WeakPolarHBondContact OE1-CB 3.07Å; S386-E428 PolarHBondContact N-O 2.99Å; E428-R430 IonicContact OE2-CZ 3.7Å; E428-R430 IonicContact OE2-NE 3.34Å; E428-R430 PolarHBondContact OE2-NE 2.83Å; E428-R430 IonicContact OE2-NH2 3.09Å; E428-R430 PolarHBondContact OE2-NH2 3.34Å; E428-R430 VanDerWaalsContact OE2-NH2 3.09Å
429	S	56.9	Low	47.8	Very low	40 Å²	40	84.7 Å²	84.7	28%	0.28	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.3	-168.2	-64.9	0	0	0	0	109.1	S386 I397 P399	S386-S429 CarbonylContact O-C 3.49Å; S386-S429 VanDerWaalsContact O-CA 3.31Å; S386-S429 WeakPolarHBondContact O-CA 3.33Å; I397-S429 WeakPolarHBondContact CG2-OG 3.39Å; P399-S429 WeakPolarHBondContact CD-OG 3.1Å; P399-S429 VanDerWaalsContact CG-OG 3.22Å; P399-S429 WeakPolarHBondContact CG-OG 3.02Å
430	R	52.8	Low	47.3	Very low	125 Å²	125	90.6 Å²	90.6	47%	0.472	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	97.6	176	-69.1	-179.1	-174.8	-139.5	-2.1	114.3	S386 R387 L388 E428	S386-R430 PolarHBondContact O-N 3.34Å; R387-R430 CarbonylContact C-O 3.47Å; R387-R430 WeakPolarHBondContact CA-O 3.46Å; R387-R430 HydrophobicContact CB-CB 4.48Å; R387-R430 WeakPolarHBondContact CB-O 3.2Å; R387-R430 HydrophobicContact CG-CB 3.74Å; L388-R430 PolarHBondContact N-O 3.22Å; E428-R430 IonicContact OE2-CZ 3.7Å; E428-R430 IonicContact OE2-NE 3.34Å; E428-R430 PolarHBondContact OE2-NE 2.83Å; E428-R430 IonicContact OE2-NH2 3.09Å; E428-R430 PolarHBondContact OE2-NH2 3.34Å; E428-R430 VanDerWaalsContact OE2-NH2 3.09Å
431	L	51.8	Low	46.7	Very low	75 Å²	75	93.6 Å²	93.6	39%	0.393	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	132.2	148.3	-75.1	163.8	0	0	0	111.8	L388 V395 I397	L388-L431 HydrophobicContact CB-CD2 3.95Å; L388-L431 HydrophobicContact CD1-CD2 4.21Å; L388-L431 HydrophobicContact CD2-CD2 3.31Å; L388-L431 HydrophobicContact CG-CD2 4Å; L388-L431 CarbonylContact O-C 3.21Å; V395-L431 HydrophobicContact CB-CD1 4.48Å; V395-L431 HydrophobicContact CB-CD2 3.75Å; V395-L431 HydrophobicContact CG1-CD1 4.26Å; V395-L431 HydrophobicContact CG1-CD2 3.42Å; V395-L431 VanDerWaalsContact CG1-CD2 3.42Å; V395-L431 HydrophobicContact CG1-CG 4.2Å; V395-L431 HydrophobicContact CG2-CD2 3.84Å; I397-L431 HydrophobicContact CD1-CD1 4.46Å; I397-L431 HydrophobicContact CD1-CD2 4.28Å; I397-L431 HydrophobicContact CD1-CG 3.77Å; I397-L431 HydrophobicContact CG1-CG 4.49Å
432	L	53	Low	46.1	Very low	93 Å²	93	96.7 Å²	96.7	49%	0.487	51%	0.511	S	S	.	.	S	Bend	trans	-100.9	-11.5	170.9	-111.5	82.8	0	0	0	115.3	L388 N389	L388-L432 PolarHBondContact O-N 3.14Å; N389-L432 VanDerWaalsContact OD1-CB 3.23Å; N389-L432 WeakPolarHBondContact OD1-CB 3.47Å; N389-L432 VanDerWaalsContact OD1-CD2 3.24Å; N389-L432 WeakPolarHBondContact OD1-CD2 3.45Å
433	S	46.7	Very low	45.4	Very low	74 Å²	74	98.9 Å²	98.9	52%	0.517	53%	0.527	S	S	.	.			trans	175	149.7	149.3	-97.5	0	0	0	0	112.1	S391	S391-S433 PolarHBondContact OG-O 2.79Å; S391-S433 VanDerWaalsContact OG-O 3.14Å
434	Y	40.2	Very low	44.7	Very low	71 Å²	71	108.2 Å²	108.2	28%	0.278	57%	0.573	S	S	.	*	B	Isolated β-bridge	trans	-138.2	119.3	-179.6	173.8	-103.5	0	0	0	104.5	I394 V395 M436	I394-Y434 VanDerWaalsContact CA-CE2 3.49Å; I394-Y434 WeakPolarHBondContact CA-OH 2.87Å; I394-Y434 WeakPolarHBondContact CG1-OH 3.37Å; V395-Y434 HydrophobicContact CB-CD2 4.47Å; V395-Y434 HydrophobicContact CG2-CD2 4.05Å; Y434-M436 HydrophobicContact CD1-CG 4.2Å; Y434-M436 HydrophobicContact CE1-CB 4.48Å; Y434-M436 HydrophobicContact CE1-CG 3.33Å; Y434-M436 HydrophobicContact CE1-SD 4.28Å; Y434-M436 PolarHBondContact OH-SD 3.06Å
435	T	41.2	Very low	44.5	Very low	91 Å²	91	110.6 Å²	110.6	56%	0.558	58%	0.583	S	S	*	*			trans	-114	100.4	178.5	29.1	0	0	0	0	111.1	L437	T435-L437 PolarHBondContact O-N 3.46Å
436	M	38.1	Very low	43.8	Very low	116 Å²	116	112.9 Å²	112.9	57%	0.571	60%	0.598	S	S	*	*			trans	-73.2	96.1	157.1	-74.4	-81.7	-80.8	0	0	108.1	Y434 N438	Y434-M436 HydrophobicContact CD1-CG 4.2Å; Y434-M436 HydrophobicContact CE1-CB 4.48Å; Y434-M436 HydrophobicContact CE1-CG 3.33Å; Y434-M436 HydrophobicContact CE1-SD 4.28Å; Y434-M436 PolarHBondContact OH-SD 3.06Å; M436-N438 PolarHBondContact O-N 3.23Å
437	L	37.3	Very low	43.2	Very low	144 Å²	144	115.4 Å²	115.4	75%	0.754	61%	0.608	S	S	*	*			trans	-75.5	83.9	151.7	-87	130.3	0	0	0	107.7	T435 S439	T435-L437 PolarHBondContact O-N 3.46Å; L437-S439 VanDerWaalsContact C-N 3.32Å; L437-S439 WeakPolarHBondContact CD2-OG 3.4Å; L437-S439 PolarHBondContact O-N 3.38Å
438	N	42.5	Very low	42.5	Very low	138 Å²	138	118.9 Å²	118.9	74%	0.738	62%	0.622	S	S	*	*			trans	-79.6	92.5	147	-97.3	-10.8	0	0	0	106.6	M436	M436-N438 PolarHBondContact O-N 3.23Å
439	S	34.9	Very low	41.8	Very low	79 Å²	79	120.7 Å²	120.7	55%	0.552	64%	0.635	S	S	*	*			trans	-143.5	98.1	158.2	25.6	0	0	0	0	108.8	L437 T441	L437-S439 VanDerWaalsContact C-N 3.32Å; L437-S439 WeakPolarHBondContact CD2-OG 3.4Å; L437-S439 PolarHBondContact O-N 3.38Å; S439-T441 PolarHBondContact O-N 3.3Å
440	H	36.9	Very low	40.8	Very low	188 Å²	188	126.1 Å²	126.1	87%	0.87	66%	0.658	S	S	*	*			trans	-33.5	123.7	139	-80.5	62.8	0	0	0	109.8
441	T	30.8	Very low	40	Very low	126 Å²	126	126.1 Å²	126.1	77%	0.773	67%	0.672	S	S	*	*			trans	-168.5	89.5	146.9	-63.8	0	0	0	0	105.7	S439	S439-T441 PolarHBondContact O-N 3.3Å
442	M	34.7	Very low	39.1	Very low	170 Å²	170	130.1 Å²	130.1	84%	0.837	69%	0.693	S	S	*	*				70.6	109.1	99.4	-168.4	-177.3	172.2	0	0	112.8
443	L	32	Very low	37.9	Very low	169 Å²	169	133.2 Å²	133.2	89%	0.885	71%	0.71	S	S	*	*			trans	-174.1	87.7	153.3	-102.5	159.9	0	0	0	108.3
444	I	39.6	Very low	37.1	Very low	232 Å²	232	138.5 Å²	138.5	100%	1.19	73%	0.728	S	S	*	*				-146.4	0	111.8	-54.8	-167.5	0	0	0	106.9

Retrieved 444 of 444 residues in 119.8 ms (Link to these results)

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